#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1j n PRO 3 N 0.00 0.00 -2.56 0.00 -0.04 -1.26 -4.89 135.00 126.25 3h1j n PRO 3 Ca 0.00 0.49 -0.33 0.00 -0.04 0.00 0.00 63.50 63.62 3h1j n PRO 3 Cb 0.00 -1.40 -0.05 0.00 -0.04 0.00 0.00 33.50 32.02 3h1j n PRO 3 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3h1j s ASN 4 N -2.17 6.66 0.00 3.54 2.20 -1.26 -4.95 114.94 118.96 3h1j s ASN 4 Ca 0.00 1.68 0.11 0.00 -0.94 0.00 0.00 52.86 53.70 3h1j s ASN 4 Cb 0.00 -2.53 0.34 0.00 -2.00 0.00 0.00 41.25 37.06 3h1j s ASN 4 CO 0.00 -0.56 1.27 -0.38 -2.94 0.00 0.00 177.10 174.49 3h1j n ILE 5 N -1.16 0.38 -0.00 0.54 2.08 -1.26 -3.70 119.36 116.23 3h1j n ILE 5 Ca 0.07 -0.40 -0.09 0.00 0.56 0.00 0.00 62.75 62.90 3h1j n ILE 5 Cb 0.54 0.21 -0.14 0.00 -0.75 0.00 0.00 39.64 39.50 3h1j n ILE 5 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 3h1j h ARG 6 N 1.80 0.02 0.00 0.38 2.43 -1.94 -3.28 114.38 113.79 3h1j h ARG 6 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3h1j h ARG 6 Cb 0.41 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3h1j h ARG 6 CO 0.00 0.62 -1.20 1.63 -1.51 0.00 0.00 179.97 179.51 3h1j n LYS 7 N -3.12 0.74 -0.13 0.20 5.02 -1.24 -3.19 118.16 116.44 3h1j n LYS 7 Ca -0.15 -0.06 -0.25 0.00 -2.02 0.00 0.00 58.31 55.84 3h1j n LYS 7 Cb 1.03 -1.41 -0.11 0.00 -0.02 0.00 0.00 35.03 34.53 3h1j n LYS 7 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3h1j n SER 8 N -1.67 1.97 -4.67 4.39 3.41 -1.24 -4.74 113.62 111.06 3h1j n SER 8 Ca 0.01 0.17 -0.54 0.00 -0.26 0.00 0.00 58.87 58.25 3h1j n SER 8 Cb 0.36 -0.68 -0.06 0.00 -0.26 0.00 0.00 64.21 63.57 3h1j n SER 8 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3h1j n HIS 9 N -3.88 1.95 -0.42 7.33 -0.00 -1.24 -4.80 115.22 114.18 3h1j n HIS 9 Ca -0.50 0.48 0.39 0.00 -0.00 0.00 0.00 57.72 58.08 3h1j n HIS 9 Cb 0.92 -2.46 0.75 0.00 -0.00 0.00 0.00 29.99 29.21 3h1j n HIS 9 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3h1j h PRO 10 N 6.68 0.02 0.00 1.57 0.11 -1.94 0.26 132.00 138.70 3h1j h PRO 10 Ca -0.47 -0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.36 3h1j h PRO 10 Cb 1.31 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.38 3h1j h PRO 10 CO 0.91 0.02 -1.76 1.28 -0.21 0.00 0.00 178.00 178.23 3h1j n LEU 11 N -4.17 1.92 -0.34 2.35 4.77 -1.26 -4.38 117.00 115.90 3h1j n LEU 11 Ca 0.30 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.67 3h1j n LEU 11 Cb 1.41 -0.84 0.17 0.00 -2.33 0.00 0.00 43.42 41.83 3h1j n LEU 11 CO 0.40 0.23 1.28 -0.07 -1.33 0.00 0.00 177.39 177.90 3h1j h LEU 12 N -1.00 1.04 -1.55 2.23 3.38 -1.83 0.17 115.31 117.75 3h1j h LEU 12 Ca -0.42 -0.02 0.23 0.00 0.09 0.00 0.00 57.88 57.77 3h1j h LEU 12 Cb 1.32 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 3h1j h LEU 12 CO -0.25 0.73 0.87 0.50 0.09 0.00 0.00 178.44 180.37 3h1j h LYS 13 N 1.22 0.00 0.06 1.13 3.64 -0.45 0.29 116.57 122.45 3h1j h LYS 13 Ca 0.37 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.54 3h1j h LYS 13 Cb -0.03 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 3h1j h LYS 13 CO -0.10 0.00 -1.09 0.52 -2.27 0.00 0.00 179.45 176.50 3h1j h MET 14 N 0.00 0.12 -0.69 1.90 2.86 -0.87 -1.92 114.93 116.34 3h1j h MET 14 Ca 0.38 -0.21 -0.04 0.00 -2.06 0.00 0.00 59.70 57.77 3h1j h MET 14 Cb 2.11 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 33.82 3h1j h MET 14 CO -0.00 1.10 0.26 0.82 1.06 0.00 0.00 176.91 180.15 3h1j h ILE 15 N -0.65 1.24 -0.12 -1.22 5.03 -0.76 -1.18 117.51 119.85 3h1j h ILE 15 Ca -0.26 -0.77 -0.17 0.00 -0.12 0.00 0.00 64.86 63.54 3h1j h ILE 15 Cb 1.48 0.43 -0.01 0.00 -3.03 0.00 0.00 36.82 35.69 3h1j h ILE 15 CO -0.03 0.31 -0.64 -1.13 -0.68 0.00 0.00 178.15 175.98 3h1j h ASN 16 N 1.00 0.52 0.88 1.72 -1.24 -0.70 0.75 115.58 118.51 3h1j h ASN 16 Ca 0.23 -0.31 0.00 0.00 0.71 0.00 0.00 56.30 56.93 3h1j h ASN 16 Cb 0.22 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.11 3h1j h ASN 16 CO -0.02 1.02 0.00 -3.20 -1.29 0.00 0.00 177.43 173.95 3h1j n ASN 17 N -3.90 0.56 0.00 1.15 5.15 -0.72 -0.61 115.26 116.89 3h1j n ASN 17 Ca -0.04 0.61 0.00 0.00 -0.60 0.00 0.00 54.58 54.55 3h1j n ASN 17 Cb 0.65 -0.74 0.00 0.00 -0.53 0.00 0.00 39.78 39.16 3h1j n ASN 17 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3h1j n SER 18 N -2.09 0.04 -0.27 1.20 3.41 -0.52 -4.42 113.62 110.99 3h1j n SER 18 Ca 0.03 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 3h1j n SER 18 Cb 0.27 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 3h1j n SER 18 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h1j n LEU 19 N -0.33 0.02 0.05 1.04 4.77 0.25 -4.79 117.00 118.01 3h1j n LEU 19 Ca 0.00 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 3h1j n LEU 19 Cb 0.02 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3h1j n LEU 19 CO 0.00 0.14 0.00 -0.38 -1.33 0.00 0.00 177.39 175.82 3h1j n ILE 20 N -0.01 0.00 0.27 -0.08 5.41 -1.15 -4.34 119.36 119.47 3h1j n ILE 20 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.86 3h1j n ILE 20 Cb 0.61 -0.44 0.20 0.00 -0.71 0.00 0.00 39.64 39.30 3h1j n ILE 20 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 3h1j n ASP 21 N -2.81 3.37 -4.68 4.38 8.00 0.22 -2.63 116.55 122.40 3h1j n ASP 21 Ca 0.00 -1.97 -0.42 0.00 0.71 0.00 0.00 54.79 53.11 3h1j n ASP 21 Cb 0.00 -0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 40.83 3h1j n ASP 21 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3h1j s LEU 22 N -1.42 4.40 0.13 0.64 2.96 -1.25 -4.71 118.68 119.44 3h1j s LEU 22 Ca 0.37 2.69 -0.30 0.00 -0.22 0.00 0.00 54.13 56.66 3h1j s LEU 22 Cb 0.21 -3.56 -0.07 0.00 0.50 0.00 0.00 46.19 43.28 3h1j s LEU 22 CO 0.30 -1.00 1.21 -2.84 -1.32 0.00 0.00 176.35 172.70 3h1j s PRO 23 N 3.22 4.46 0.03 0.98 0.02 -1.26 -0.55 135.00 141.89 3h1j s PRO 23 Ca 0.82 1.85 0.02 0.00 0.02 0.00 0.00 61.00 63.71 3h1j s PRO 23 Cb -0.44 -3.28 -0.02 0.00 0.02 0.00 0.00 34.50 30.78 3h1j s PRO 23 CO 0.37 -0.18 -0.08 0.00 -0.33 0.00 0.00 177.00 176.78 3h1j s ALA 24 N 0.46 0.59 0.49 -1.55 0.00 -0.34 -4.69 121.76 116.73 3h1j s ALA 24 Ca 0.56 -0.68 -0.22 0.00 0.00 0.00 0.00 51.96 51.62 3h1j s ALA 24 Cb -0.32 0.00 -0.08 0.00 0.00 0.00 0.00 23.12 22.73 3h1j s ALA 24 CO 0.33 0.02 1.10 -2.30 0.00 0.00 0.00 175.76 174.91 3h1j n PRO 25 N 1.74 1.40 0.08 0.00 -0.02 -1.26 -0.33 135.00 136.61 3h1j n PRO 25 Ca -0.21 0.51 0.12 0.00 -2.02 0.00 0.00 63.50 61.91 3h1j n PRO 25 Cb 0.55 -2.24 0.46 0.00 -0.02 0.00 0.00 33.50 32.25 3h1j n PRO 25 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3h1j n SER 26 N -0.16 0.56 -0.61 2.55 3.41 -1.03 -3.94 113.62 114.40 3h1j n SER 26 Ca 0.10 0.58 0.06 0.00 -0.26 0.00 0.00 58.87 59.35 3h1j n SER 26 Cb 0.43 -0.72 0.13 0.00 -0.26 0.00 0.00 64.21 63.79 3h1j n SER 26 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3h1j n ASN 27 N -2.05 2.73 -4.76 4.04 6.94 -1.26 -5.02 115.26 115.88 3h1j n ASN 27 Ca 0.05 -1.89 -0.41 0.00 -0.02 0.00 0.00 54.58 52.31 3h1j n ASN 27 Cb 0.34 -0.19 -0.01 0.00 -2.36 0.00 0.00 39.78 37.56 3h1j n ASN 27 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3h1j s ILE 28 N -0.99 2.24 0.00 1.53 -4.36 -1.25 -4.59 121.20 113.77 3h1j s ILE 28 Ca 0.21 0.21 0.00 0.00 -0.26 0.00 0.00 60.65 60.81 3h1j s ILE 28 Cb 0.12 -3.13 0.00 0.00 1.25 0.00 0.00 42.46 40.69 3h1j s ILE 28 CO 0.16 0.04 0.00 -1.54 0.24 0.00 0.00 174.94 173.83 3h1j n SER 29 N 1.76 0.00 0.15 4.36 3.41 -1.26 -4.95 113.62 117.09 3h1j n SER 29 Ca 0.06 -0.74 0.05 0.00 -0.26 0.00 0.00 58.87 57.99 3h1j n SER 29 Cb 0.39 0.00 0.51 0.00 -0.26 0.00 0.00 64.21 64.85 3h1j n SER 29 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h1j h ALA 30 N -0.70 1.79 0.00 7.33 0.00 -2.03 -1.67 119.26 123.98 3h1j h ALA 30 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3h1j h ALA 30 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3h1j h ALA 30 CO 0.00 0.17 0.00 0.91 0.00 0.00 0.00 179.25 180.33 3h1j n TRP 31 N -4.45 0.00 0.31 0.00 7.02 -1.26 -0.20 117.44 118.85 3h1j n TRP 31 Ca -0.01 0.00 0.04 0.00 -1.02 0.00 0.00 57.50 56.52 3h1j n TRP 31 Cb 0.13 0.00 0.05 0.00 -2.42 0.00 0.00 31.31 29.06 3h1j n TRP 31 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 3h1j n TRP 32 N -0.71 0.05 0.47 -5.99 8.01 -0.63 -4.55 117.44 114.09 3h1j n TRP 32 Ca 0.02 -0.06 0.12 0.00 -1.31 0.00 0.00 57.50 56.27 3h1j n TRP 32 Cb 0.01 -0.00 0.25 0.00 -2.01 0.00 0.00 31.31 29.55 3h1j n TRP 32 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 3h1j h ASN 33 N 1.74 0.00 0.59 -0.99 4.21 -0.74 -3.34 115.58 117.05 3h1j h ASN 33 Ca 0.00 -0.06 -0.08 0.00 1.21 0.00 0.00 56.30 57.37 3h1j h ASN 33 Cb 0.41 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.60 3h1j h ASN 33 CO 0.00 0.03 -0.38 -0.26 -1.29 0.00 0.00 177.43 175.53 3h1j h PHE 34 N 0.00 0.00 -0.27 1.19 0.04 -1.80 -2.54 116.94 113.56 3h1j h PHE 34 Ca 0.00 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.83 3h1j h PHE 34 Cb 0.82 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.91 3h1j h PHE 34 CO 0.00 0.38 -0.17 0.78 -0.60 0.00 0.00 178.31 178.70 3h1j h GLY 35 N 1.56 0.02 1.57 -1.45 0.00 -1.90 0.86 103.07 103.72 3h1j h GLY 35 Ca -0.00 0.21 -0.20 0.00 0.00 0.00 0.00 47.33 47.34 3h1j h GLY 35 CO 0.05 -0.17 -0.79 1.48 0.00 0.00 0.00 176.54 177.10 3h1j h SER 36 N -0.15 0.50 -0.55 0.19 4.64 -1.80 -1.68 113.55 114.69 3h1j h SER 36 Ca 0.15 -0.35 -0.01 0.00 -0.47 0.00 0.00 61.79 61.11 3h1j h SER 36 Cb 0.37 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.28 3h1j h SER 36 CO -0.36 1.11 0.33 -0.07 -0.87 0.00 0.00 176.83 176.97 3h1j h LEU 37 N 0.26 0.67 -0.37 5.97 3.38 -0.92 0.78 115.31 125.08 3h1j h LEU 37 Ca -0.04 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 57.91 3h1j h LEU 37 Cb 1.39 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.92 3h1j h LEU 37 CO 0.14 0.54 0.08 -0.07 0.09 0.00 0.00 178.44 179.22 3h1j h LEU 38 N 0.74 0.03 0.09 1.67 3.38 0.83 0.57 115.31 122.63 3h1j h LEU 38 Ca 0.20 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.24 3h1j h LEU 38 Cb 0.00 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3h1j h LEU 38 CO -0.04 0.05 -0.16 0.00 0.09 0.00 0.00 178.44 178.39 3h1j h ALA 39 N 1.27 -0.26 -0.86 1.53 0.00 -0.24 -1.00 119.26 119.69 3h1j h ALA 39 Ca 0.18 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.14 3h1j h ALA 39 Cb 0.20 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 3h1j h ALA 39 CO -0.22 -0.68 0.56 0.28 0.00 0.00 0.00 179.25 179.18 3h1j h VAL 40 N -0.31 1.02 0.12 0.00 2.07 0.15 -1.03 116.25 118.27 3h1j h VAL 40 Ca 0.02 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.23 3h1j h VAL 40 Cb 0.33 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 3h1j h VAL 40 CO -0.09 0.17 -0.10 0.00 0.02 0.00 0.00 177.57 177.56 3h1j h LEU 42 N -0.24 -0.25 -0.03 0.00 5.85 -0.04 0.57 115.31 121.16 3h1j h LEU 42 Ca 0.00 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 3h1j h LEU 42 Cb 0.22 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 3h1j h LEU 42 CO -0.02 -0.09 0.01 0.24 -0.34 0.00 0.00 178.44 178.25 3h1j h MET 43 N 0.09 0.04 -0.52 1.25 2.86 -0.78 -1.57 114.93 116.29 3h1j h MET 43 Ca 0.24 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.93 3h1j h MET 43 Cb 0.37 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 3h1j h MET 43 CO -0.42 0.14 0.25 1.15 1.06 0.00 0.00 176.91 179.09 3h1j h THR 44 N -0.07 0.93 0.53 2.22 2.02 0.78 -0.83 112.91 118.48 3h1j h THR 44 Ca 0.01 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 3h1j h THR 44 Cb 0.11 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 3h1j h THR 44 CO -0.00 0.09 -0.33 1.56 0.37 0.00 0.00 175.52 177.20 3h1j h GLN 45 N 0.49 -0.79 -0.64 6.66 1.08 0.24 -0.30 115.11 121.85 3h1j h GLN 45 Ca 0.24 0.05 0.13 0.00 -1.45 0.00 0.00 58.65 57.62 3h1j h GLN 45 Cb 0.17 0.18 -0.11 0.00 -0.05 0.00 0.00 27.48 27.67 3h1j h GLN 45 CO -0.18 -0.53 -0.01 0.82 -0.95 0.00 0.00 178.83 177.98 3h1j h ILE 46 N -0.82 0.46 0.20 2.54 2.04 -1.03 0.56 117.51 121.46 3h1j h ILE 46 Ca -0.06 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 3h1j h ILE 46 Cb 0.67 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3h1j h ILE 46 CO 0.05 0.02 -0.10 0.25 0.00 0.00 0.00 178.15 178.38 3h1j h LEU 47 N 0.11 -0.23 -1.16 1.44 5.85 -0.97 0.76 115.31 121.11 3h1j h LEU 47 Ca 0.33 -0.17 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 3h1j h LEU 47 Cb 0.55 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 3h1j h LEU 47 CO -0.56 0.04 -0.20 0.71 -0.34 0.00 0.00 178.44 178.09 3h1j h THR 48 N -0.50 1.23 0.43 1.05 1.35 -0.71 -2.47 112.91 113.29 3h1j h THR 48 Ca -0.03 -1.06 -0.02 0.00 -0.55 0.00 0.00 66.41 64.75 3h1j h THR 48 Cb 0.38 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 3h1j h THR 48 CO 0.05 0.33 -0.21 1.23 -0.25 0.00 0.00 175.52 176.66 3h1j h GLY 49 N 0.93 -0.61 0.17 5.82 0.00 0.31 0.17 103.07 109.86 3h1j h GLY 49 Ca 0.05 0.23 0.09 0.00 0.00 0.00 0.00 47.33 47.71 3h1j h GLY 49 CO 0.04 -0.22 -0.04 1.41 0.00 0.00 0.00 176.54 177.73 3h1j h LEU 50 N -0.59 -0.27 -0.71 3.11 3.38 -0.69 0.63 115.31 120.17 3h1j h LEU 50 Ca -0.06 0.12 0.12 0.00 0.09 0.00 0.00 57.88 58.16 3h1j h LEU 50 Cb 0.46 0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.35 3h1j h LEU 50 CO 0.09 -0.10 0.29 -0.07 0.09 0.00 0.00 178.44 178.74 3h1j h LEU 51 N 0.08 0.29 -0.11 1.67 3.38 -0.96 -1.72 115.31 117.94 3h1j h LEU 51 Ca 0.24 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.23 3h1j h LEU 51 Cb 0.36 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3h1j h LEU 51 CO -0.42 0.13 -0.22 -0.07 0.09 0.00 0.00 178.44 177.95 3h1j h LEU 52 N 0.46 0.39 -1.89 1.67 3.38 0.15 -3.00 115.31 116.46 3h1j h LEU 52 Ca 0.38 -0.56 0.08 0.00 0.09 0.00 0.00 57.88 57.87 3h1j h LEU 52 Cb 0.53 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3h1j h LEU 52 CO -0.36 0.87 0.45 0.00 0.09 0.00 0.00 178.44 179.49 3h1j h ALA 53 N 0.53 1.88 0.00 1.53 0.00 0.90 0.30 119.26 124.40 3h1j h ALA 53 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3h1j h ALA 53 Cb 0.81 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3h1j h ALA 53 CO 0.05 -0.60 -0.06 0.52 0.00 0.00 0.00 179.25 179.16 3h1j h MET 54 N 0.00 0.00 -0.05 0.00 2.86 -1.19 -3.01 114.93 113.54 3h1j h MET 54 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3h1j h MET 54 Cb 1.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.69 3h1j h MET 54 CO -0.00 0.06 0.00 0.72 1.06 0.00 0.00 176.91 178.75 3h1j n HIS 55 N -3.25 0.07 -2.73 -0.22 8.25 0.10 -5.05 115.22 112.39 3h1j n HIS 55 Ca -0.01 -0.44 -0.26 0.00 -0.26 0.00 0.00 57.72 56.75 3h1j n HIS 55 Cb 0.27 -0.04 0.01 0.00 1.12 0.00 0.00 29.99 31.34 3h1j n HIS 55 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3h1j s TYR 56 N -0.90 3.46 -0.24 4.41 5.04 -1.05 -4.68 117.35 123.38 3h1j s TYR 56 Ca 0.04 0.65 -0.04 0.00 -2.44 0.00 0.00 57.07 55.27 3h1j s TYR 56 Cb 0.02 -2.33 0.09 0.00 0.35 0.00 0.00 41.96 40.09 3h1j s TYR 56 CO 0.03 -0.33 0.13 0.99 -1.34 0.00 0.00 175.55 175.02 3h1j s THR 57 N -2.71 -0.11 -1.11 4.34 2.01 -1.26 -5.03 115.64 111.78 3h1j s THR 57 Ca 0.48 -0.51 -0.23 0.00 0.31 0.00 0.00 61.69 61.74 3h1j s THR 57 Cb -0.10 -0.82 -0.06 0.00 0.01 0.00 0.00 72.50 71.52 3h1j s THR 57 CO 0.43 -0.54 1.91 0.00 -0.69 0.00 0.00 174.62 175.74 3h1j s ALA 58 N 2.14 1.87 -0.29 7.40 0.00 -1.26 -2.91 121.76 128.71 3h1j s ALA 58 Ca 0.06 -2.02 -0.14 0.00 0.00 0.00 0.00 51.96 49.87 3h1j s ALA 58 Cb -0.16 -4.64 0.10 0.00 0.00 0.00 0.00 23.12 18.43 3h1j s ALA 58 CO -0.26 -4.96 0.70 0.34 0.00 0.00 0.00 175.76 171.58 3h1j s ASP 59 N 6.77 -0.98 0.28 0.00 2.15 -1.26 -4.58 116.67 119.05 3h1j s ASP 59 Ca 0.67 1.47 -0.02 0.00 0.43 0.00 0.00 52.55 55.11 3h1j s ASP 59 Cb -0.02 1.72 0.61 0.00 -0.30 0.00 0.00 42.92 44.93 3h1j s ASP 59 CO 0.08 -0.22 1.60 0.71 -0.17 0.00 0.00 175.17 177.17 3h1j h THR 60 N 5.37 0.17 0.00 1.71 1.35 -1.90 1.43 112.91 121.04 3h1j h THR 60 Ca -0.25 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 3h1j h THR 60 Cb 1.18 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 3h1j h THR 60 CO 0.14 0.01 0.00 -1.54 -0.25 0.00 0.00 175.52 173.88 3h1j n SER 61 N -5.42 0.00 0.00 5.36 3.41 -1.26 -3.93 113.62 111.78 3h1j n SER 61 Ca 0.19 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 3h1j n SER 61 Cb 0.63 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 3h1j n SER 61 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h1j n LEU 62 N -1.43 0.00 -0.06 1.04 4.77 0.18 -4.86 117.00 116.64 3h1j n LEU 62 Ca 0.06 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.98 3h1j n LEU 62 Cb 0.20 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 3h1j n LEU 62 CO 0.17 0.00 0.50 0.00 -1.33 0.00 0.00 177.39 176.73 3h1j h ALA 63 N 0.00 -0.48 -0.56 -1.18 0.00 0.18 0.79 119.26 118.01 3h1j h ALA 63 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.02 3h1j h ALA 63 Cb 0.10 0.90 -0.11 0.00 0.00 0.00 0.00 17.79 18.68 3h1j h ALA 63 CO 0.00 -0.60 -0.21 0.35 0.00 0.00 0.00 179.25 178.79 3h1j h PHE 64 N -0.16 -0.52 0.00 0.00 3.57 -1.77 -1.14 116.94 116.92 3h1j h PHE 64 Ca 0.03 0.06 -0.08 0.00 3.53 0.00 0.00 57.97 61.51 3h1j h PHE 64 Cb 0.24 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 3h1j h PHE 64 CO -0.67 -0.30 -0.37 0.66 -2.23 0.00 0.00 178.31 175.40 3h1j h SER 65 N -0.08 0.00 -0.28 0.41 4.64 -1.79 -2.38 113.55 114.07 3h1j h SER 65 Ca 0.26 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.46 3h1j h SER 65 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 3h1j h SER 65 CO -0.62 0.37 -0.24 0.77 -0.87 0.00 0.00 176.83 176.24 3h1j h SER 66 N 0.00 0.78 -0.41 4.97 4.64 0.40 0.36 113.55 124.29 3h1j h SER 66 Ca -0.00 -0.29 -0.07 0.00 -0.47 0.00 0.00 61.79 60.96 3h1j h SER 66 Cb 0.75 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 3h1j h SER 66 CO 0.05 0.99 -0.01 0.58 -0.87 0.00 0.00 176.83 177.57 3h1j h VAL 67 N 0.66 1.26 -0.01 0.95 2.07 -1.24 0.10 116.25 120.05 3h1j h VAL 67 Ca 0.09 -1.04 0.02 0.00 0.82 0.00 0.00 66.70 66.58 3h1j h VAL 67 Cb 0.75 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 3h1j h VAL 67 CO 0.06 0.35 -0.11 0.00 0.02 0.00 0.00 177.57 177.90 3h1j h ALA 68 N 0.89 -0.11 -0.97 1.67 0.00 -0.90 -1.54 119.26 118.29 3h1j h ALA 68 Ca 0.12 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.10 3h1j h ALA 68 Cb 0.50 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 3h1j h ALA 68 CO 0.02 -0.60 0.62 1.25 0.00 0.00 0.00 179.25 180.55 3h1j h HIS 69 N -0.18 1.14 -0.30 0.00 -0.00 0.02 0.21 115.15 116.04 3h1j h HIS 69 Ca 0.04 0.03 0.05 0.00 -0.00 0.00 0.00 60.37 60.50 3h1j h HIS 69 Cb 0.23 -0.37 -0.05 0.00 -0.00 0.00 0.00 27.41 27.22 3h1j h HIS 69 CO -0.17 0.58 -0.02 1.15 -0.00 0.00 0.00 177.93 179.47 3h1j h THR 70 N 1.11 0.76 -0.35 6.26 2.02 0.01 0.90 112.91 123.62 3h1j h THR 70 Ca 0.42 -0.02 -0.16 0.00 0.77 0.00 0.00 66.41 67.42 3h1j h THR 70 Cb 0.19 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 67.28 3h1j h THR 70 CO -0.18 0.01 -0.41 0.00 0.37 0.00 0.00 175.52 175.31 3h1j h ARG 72 N 0.70 0.00 0.00 0.00 3.08 -0.32 -3.26 114.38 114.58 3h1j h ARG 72 Ca 0.05 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.97 3h1j h ARG 72 Cb 1.01 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 3h1j h ARG 72 CO 0.10 0.53 -1.48 0.09 -1.07 0.00 0.00 179.97 178.14 3h1j n ASN 73 N -3.08 3.34 -4.68 7.04 3.02 0.31 -4.99 115.26 116.22 3h1j n ASN 73 Ca -0.08 -0.04 -0.42 0.00 -0.03 0.00 0.00 54.58 54.00 3h1j n ASN 73 Cb 0.92 -0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 40.03 3h1j n ASN 73 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3h1j s VAL 74 N -2.17 3.74 -0.29 2.41 1.01 -1.02 -4.92 120.40 119.16 3h1j s VAL 74 Ca -0.10 1.06 -0.41 0.00 0.00 0.00 0.00 61.98 62.53 3h1j s VAL 74 Cb 0.03 -3.69 -0.17 0.00 0.00 0.00 0.00 36.38 32.55 3h1j s VAL 74 CO 0.21 -0.03 1.65 0.00 0.00 0.00 0.00 175.10 176.93 3h1j n GLN 75 N 5.83 0.85 -1.19 2.72 1.13 -1.26 0.65 117.38 126.10 3h1j n GLN 75 Ca 0.14 0.31 -0.06 0.00 -1.94 0.00 0.00 57.00 55.44 3h1j n GLN 75 Cb 0.44 -1.94 -0.03 0.00 0.11 0.00 0.00 30.24 28.82 3h1j n GLN 75 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3h1j n TYR 76 N 4.67 0.00 -0.27 1.08 4.02 -1.26 -4.84 117.16 120.56 3h1j n TYR 76 Ca 0.27 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 58.14 3h1j n TYR 76 Cb 0.09 -2.32 0.10 0.00 -0.02 0.00 0.00 39.34 37.19 3h1j n TYR 76 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3h1j h GLY 77 N 0.00 1.12 0.78 2.72 0.00 0.10 -1.69 103.07 106.09 3h1j h GLY 77 Ca -0.13 -0.36 0.04 0.00 0.00 0.00 0.00 47.33 46.88 3h1j h GLY 77 CO 0.19 0.28 0.30 0.11 0.00 0.00 0.00 176.54 177.43 3h1j h TRP 78 N 0.92 0.55 0.08 5.60 5.08 -1.70 -0.60 115.95 125.88 3h1j h TRP 78 Ca 0.32 0.02 -0.00 0.00 1.08 0.00 0.00 58.89 60.30 3h1j h TRP 78 Cb 0.06 -0.17 -0.00 0.00 -3.00 0.00 0.00 29.16 26.05 3h1j h TRP 78 CO -0.04 0.29 -0.05 1.25 -1.28 0.00 0.00 178.44 178.61 3h1j h LEU 79 N 0.58 -0.12 -0.52 0.11 5.85 -1.76 -0.90 115.31 118.55 3h1j h LEU 79 Ca 0.23 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.99 3h1j h LEU 79 Cb 0.10 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 3h1j h LEU 79 CO -0.14 -0.08 0.31 0.40 -0.34 0.00 0.00 178.44 178.59 3h1j h ILE 80 N -0.12 1.04 -0.77 4.05 2.04 -1.07 0.20 117.51 122.89 3h1j h ILE 80 Ca -0.01 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 3h1j h ILE 80 Cb 0.10 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 3h1j h ILE 80 CO 0.01 0.11 0.36 -0.09 0.00 0.00 0.00 178.15 178.54 3h1j h ARG 81 N 0.61 1.12 0.09 2.37 1.12 -0.97 0.12 114.38 118.83 3h1j h ARG 81 Ca 0.21 -0.17 -0.00 0.00 -1.11 0.00 0.00 59.98 58.90 3h1j h ARG 81 Cb 0.04 -0.20 0.00 0.00 -0.01 0.00 0.00 29.97 29.80 3h1j h ARG 81 CO -0.10 0.88 -0.04 -0.91 -3.11 0.00 0.00 179.97 176.68 3h1j h ASN 82 N 1.09 -0.10 -0.60 -3.80 -0.26 -0.22 0.28 115.58 111.97 3h1j h ASN 82 Ca 0.26 -0.12 0.04 0.00 -0.56 0.00 0.00 56.30 55.92 3h1j h ASN 82 Cb 0.14 0.03 -0.03 0.00 -1.06 0.00 0.00 38.32 37.39 3h1j h ASN 82 CO -0.03 0.06 0.40 -0.07 -1.06 0.00 0.00 177.43 176.72 3h1j h LEU 83 N -0.25 0.58 -0.15 1.61 3.38 -0.45 0.31 115.31 120.34 3h1j h LEU 83 Ca -0.01 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 3h1j h LEU 83 Cb 0.21 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3h1j h LEU 83 CO 0.02 0.40 -0.38 -0.74 0.09 0.00 0.00 178.44 177.82 3h1j h HIS 84 N 0.67 0.68 -0.17 1.13 2.76 -0.43 0.26 115.15 120.05 3h1j h HIS 84 Ca 0.24 -0.26 -0.02 0.00 -2.20 0.00 0.00 60.37 58.14 3h1j h HIS 84 Cb 0.13 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 3h1j h HIS 84 CO -0.00 1.01 0.04 0.00 -1.30 0.00 0.00 177.93 177.68 3h1j h ALA 85 N 0.55 0.22 0.00 5.26 0.00 0.19 -2.70 119.26 122.78 3h1j h ALA 85 Ca -0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 3h1j h ALA 85 Cb 0.99 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 3h1j h ALA 85 CO 0.08 -0.14 -0.67 -0.91 0.00 0.00 0.00 179.25 177.62 3h1j h ASN 86 N 0.08 0.00 -0.78 0.00 4.21 -0.46 -3.08 115.58 115.55 3h1j h ASN 86 Ca 0.05 0.00 0.01 0.00 1.21 0.00 0.00 56.30 57.57 3h1j h ASN 86 Cb 0.26 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.42 3h1j h ASN 86 CO 0.00 0.67 0.51 1.23 -1.29 0.00 0.00 177.43 178.55 3h1j h GLY 87 N 2.48 1.10 0.09 2.83 0.00 -0.42 -1.07 103.07 108.08 3h1j h GLY 87 Ca -0.01 -0.42 0.16 0.00 0.00 0.00 0.00 47.33 47.06 3h1j h GLY 87 CO 0.09 0.41 0.33 0.00 0.00 0.00 0.00 176.54 177.36 3h1j h ALA 88 N 1.28 1.15 0.21 3.60 0.00 -1.38 0.22 119.26 124.34 3h1j h ALA 88 Ca 0.29 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 3h1j h ALA 88 Cb -0.11 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3h1j h ALA 88 CO -0.06 -0.22 -0.10 0.77 0.00 0.00 0.00 179.25 179.64 3h1j h SER 89 N 0.45 -0.24 0.09 0.00 0.02 -1.35 -2.11 113.55 110.41 3h1j h SER 89 Ca 0.45 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3h1j h SER 89 Cb 0.71 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.31 3h1j h SER 89 CO -0.42 0.12 0.00 -0.26 -1.14 0.00 0.00 176.83 175.13 3h1j h PHE 90 N -0.63 0.00 -0.04 3.45 -1.00 -0.56 0.59 116.94 118.75 3h1j h PHE 90 Ca -0.03 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.72 3h1j h PHE 90 Cb 0.45 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.01 3h1j h PHE 90 CO 0.03 0.00 -0.10 0.35 -1.61 0.00 0.00 178.31 176.98 3h1j h PHE 91 N 0.00 0.18 -0.42 -0.55 3.04 -0.12 -1.85 116.94 117.22 3h1j h PHE 91 Ca 0.00 -0.07 -0.14 0.00 3.98 0.00 0.00 57.97 61.74 3h1j h PHE 91 Cb 0.04 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.51 3h1j h PHE 91 CO 0.00 0.71 -0.27 0.74 -2.02 0.00 0.00 178.31 177.47 3h1j h PHE 92 N -0.40 1.08 0.30 0.41 -1.00 -0.10 0.14 116.94 117.38 3h1j h PHE 92 Ca -0.00 -0.29 -0.00 0.00 2.81 0.00 0.00 57.97 60.49 3h1j h PHE 92 Cb 0.71 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 40.00 3h1j h PHE 92 CO 0.13 1.10 -0.48 0.82 -1.61 0.00 0.00 178.31 178.27 3h1j h ILE 93 N 0.75 0.00 -0.41 -0.55 2.04 0.01 0.43 117.51 119.78 3h1j h ILE 93 Ca 0.09 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.02 3h1j h ILE 93 Cb 0.85 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 3h1j h ILE 93 CO 0.07 0.00 0.03 0.00 0.00 0.00 0.00 178.15 178.26 3h1j h ILE 95 N 0.15 1.17 -0.22 0.00 2.10 -0.32 0.24 117.51 120.63 3h1j h ILE 95 Ca 0.20 -0.38 -0.01 0.00 1.08 0.00 0.00 64.86 65.75 3h1j h ILE 95 Cb 0.27 -0.03 -0.01 0.00 -1.09 0.00 0.00 36.82 35.96 3h1j h ILE 95 CO -0.30 0.20 0.10 -0.26 -1.08 0.00 0.00 178.15 176.81 3h1j h PHE 96 N 1.10 0.33 -0.77 2.19 0.04 -0.25 0.45 116.94 120.02 3h1j h PHE 96 Ca 0.33 -0.02 -0.05 0.00 2.80 0.00 0.00 57.97 61.03 3h1j h PHE 96 Cb -0.03 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 37.99 3h1j h PHE 96 CO -0.00 0.34 0.27 -0.07 -0.60 0.00 0.00 178.31 178.25 3h1j h LEU 97 N 0.22 1.10 -0.08 1.54 3.38 -0.92 -0.10 115.31 120.44 3h1j h LEU 97 Ca 0.08 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.89 3h1j h LEU 97 Cb 0.14 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 3h1j h LEU 97 CO -0.01 0.99 -0.14 -0.74 0.09 0.00 0.00 178.44 178.63 3h1j h HIS 98 N 1.14 -0.35 -0.64 1.13 2.76 -0.60 0.09 115.15 118.68 3h1j h HIS 98 Ca 0.25 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.46 3h1j h HIS 98 Cb 0.26 0.17 -0.04 0.00 1.55 0.00 0.00 27.41 29.36 3h1j h HIS 98 CO 0.02 -0.21 0.41 0.82 -1.30 0.00 0.00 177.93 177.68 3h1j h ILE 99 N -0.19 1.11 0.39 6.26 2.04 -0.49 -2.29 117.51 124.34 3h1j h ILE 99 Ca 0.07 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 3h1j h ILE 99 Cb 0.30 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 3h1j h ILE 99 CO -0.19 0.15 -0.41 1.23 0.00 0.00 0.00 178.15 178.93 3h1j h GLY 100 N 0.81 -1.16 -0.86 5.37 0.00 -0.20 -1.96 103.07 105.07 3h1j h GLY 100 Ca 0.25 0.54 0.22 0.00 0.00 0.00 0.00 47.33 48.34 3h1j h GLY 100 CO -0.08 -0.35 -0.11 -0.09 0.00 0.00 0.00 176.54 175.90 3h1j h ARG 101 N -0.79 0.01 -0.98 4.80 1.12 -0.87 0.30 114.38 117.98 3h1j h ARG 101 Ca -0.05 -0.00 0.05 0.00 -1.11 0.00 0.00 59.98 58.88 3h1j h ARG 101 Cb 0.69 -0.00 -0.06 0.00 -0.01 0.00 0.00 29.97 30.59 3h1j h ARG 101 CO -0.06 0.01 0.63 0.78 -3.11 0.00 0.00 179.97 178.22 3h1j h GLY 102 N 0.01 1.47 0.68 2.80 0.00 -0.86 -0.17 103.07 107.00 3h1j h GLY 102 Ca 0.51 -0.47 -0.07 0.00 0.00 0.00 0.00 47.33 47.30 3h1j h GLY 102 CO -0.92 0.36 -0.20 -2.00 0.00 0.00 0.00 176.54 173.77 3h1j h LEU 103 N 1.17 0.35 -0.48 3.11 5.85 0.26 0.33 115.31 125.90 3h1j h LEU 103 Ca 0.41 -0.57 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 3h1j h LEU 103 Cb 0.11 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3h1j h LEU 103 CO -0.16 0.85 0.27 0.22 -0.34 0.00 0.00 178.44 179.28 3h1j h TYR 104 N -0.14 0.65 -0.52 1.25 3.20 -0.86 -3.03 116.97 117.53 3h1j h TYR 104 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3h1j h TYR 104 Cb 0.79 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.85 3h1j h TYR 104 CO 0.11 0.48 0.00 0.66 -1.64 0.00 0.00 178.16 177.77 3h1j n TYR 105 N -4.68 1.26 -3.74 -3.82 4.02 -0.10 -2.19 117.16 107.91 3h1j n TYR 105 Ca 0.02 -0.49 -0.26 0.00 -0.01 0.00 0.00 57.90 57.15 3h1j n TYR 105 Cb 0.08 -0.23 0.05 0.00 -0.02 0.00 0.00 39.34 39.21 3h1j n TYR 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3h1j n GLY 106 N 0.93 -0.49 0.16 2.72 0.00 -0.87 -4.34 105.19 103.31 3h1j n GLY 106 Ca 0.21 0.21 0.03 0.00 0.00 0.00 0.00 46.02 46.47 3h1j n GLY 106 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3h1j h SER 107 N -2.29 0.00 0.00 1.61 0.02 -1.23 -3.00 113.55 108.66 3h1j h SER 107 Ca -0.58 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.37 3h1j h SER 107 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 3h1j h SER 107 CO 0.61 0.48 0.05 0.00 -1.14 0.00 0.00 176.83 176.83 3h1j n TYR 108 N -3.50 0.00 0.66 3.45 0.18 -1.24 -0.45 117.16 116.26 3h1j n TYR 108 Ca 0.00 0.00 0.09 0.00 1.88 0.00 0.00 57.90 59.87 3h1j n TYR 108 Cb 0.60 -0.43 0.40 0.00 -0.38 0.00 0.00 39.34 39.53 3h1j n TYR 108 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3h1j n LEU 109 N -1.43 0.00 -4.08 -3.48 4.77 -1.13 -3.14 117.00 108.51 3h1j n LEU 109 Ca 0.00 0.47 -0.43 0.00 -0.03 0.00 0.00 56.01 56.02 3h1j n LEU 109 Cb 0.05 -0.47 0.01 0.00 -2.33 0.00 0.00 43.42 40.67 3h1j n LEU 109 CO 0.00 -0.17 1.39 -1.22 -1.33 0.00 0.00 177.39 176.05 3h1j n TYR 110 N -1.47 3.34 -0.38 -1.77 4.01 0.40 -4.93 117.16 116.36 3h1j n TYR 110 Ca 0.05 -2.97 -0.06 0.00 -0.16 0.00 0.00 57.90 54.76 3h1j n TYR 110 Cb 0.21 -1.68 -0.04 0.00 -0.31 0.00 0.00 39.34 37.51 3h1j n TYR 110 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3h1j n LYS 111 N 2.97 -0.33 -0.22 -0.72 5.02 -1.19 -1.05 118.16 122.65 3h1j n LYS 111 Ca 0.32 1.43 -0.03 0.00 -2.02 0.00 0.00 58.31 58.01 3h1j n LYS 111 Cb 0.36 -2.11 0.16 0.00 -0.02 0.00 0.00 35.03 33.43 3h1j n LYS 111 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3h1j h GLU 112 N 0.00 1.01 -0.23 1.97 3.07 -1.91 0.38 114.58 118.88 3h1j h GLU 112 Ca 0.22 -0.15 -0.03 0.00 -0.50 0.00 0.00 59.36 58.91 3h1j h GLU 112 Cb 0.46 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 3h1j h GLU 112 CO -0.90 0.80 0.03 1.15 -1.40 0.00 0.00 179.01 178.68 3h1j h THR 113 N 1.00 1.23 0.25 1.13 2.02 -1.64 -1.50 112.91 115.41 3h1j h THR 113 Ca 0.24 -0.79 -0.01 0.00 0.77 0.00 0.00 66.41 66.62 3h1j h THR 113 Cb 0.14 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 3h1j h THR 113 CO -0.03 0.25 -0.12 -0.25 0.37 0.00 0.00 175.52 175.74 3h1j h TRP 114 N 0.17 -0.32 -0.41 3.16 2.91 -0.63 -0.94 115.95 119.90 3h1j h TRP 114 Ca 0.07 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.16 3h1j h TRP 114 Cb 0.34 0.10 -0.07 0.00 -0.51 0.00 0.00 29.16 29.02 3h1j h TRP 114 CO 0.02 -0.07 -0.06 -0.91 -1.03 0.00 0.00 178.44 176.39 3h1j h ASN 115 N -0.53 -0.31 -0.25 2.65 2.35 -0.24 0.72 115.58 119.97 3h1j h ASN 115 Ca -0.03 0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 3h1j h ASN 115 Cb 0.39 0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.97 3h1j h ASN 115 CO 0.06 -0.11 0.11 0.71 -1.65 0.00 0.00 177.43 176.56 3h1j h THR 116 N 0.04 1.12 -0.80 2.81 1.35 -1.24 -0.01 112.91 116.18 3h1j h THR 116 Ca 0.20 -0.39 0.05 0.00 -0.55 0.00 0.00 66.41 65.72 3h1j h THR 116 Cb 0.30 0.77 -0.05 0.00 -1.73 0.00 0.00 68.15 67.44 3h1j h THR 116 CO -0.39 0.15 0.49 1.23 -0.25 0.00 0.00 175.52 176.75 3h1j h GLY 117 N 0.58 1.18 1.03 5.82 0.00 0.18 0.11 103.07 111.97 3h1j h GLY 117 Ca 0.11 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 3h1j h GLY 117 CO -0.01 0.27 0.35 -2.08 0.00 0.00 0.00 176.54 175.07 3h1j h VAL 118 N 0.93 1.25 -0.84 4.60 2.07 0.10 -0.55 116.25 123.80 3h1j h VAL 118 Ca 0.34 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 3h1j h VAL 118 Cb 0.11 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 3h1j h VAL 118 CO -0.15 0.30 0.48 0.40 0.02 0.00 0.00 177.57 178.62 3h1j h ILE 119 N 1.09 1.24 0.34 4.57 1.08 -0.43 0.15 117.51 125.55 3h1j h ILE 119 Ca 0.26 -0.59 -0.01 0.00 -0.39 0.00 0.00 64.86 64.13 3h1j h ILE 119 Cb 0.15 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 34.00 3h1j h ILE 119 CO -0.03 0.27 -0.17 -0.07 -0.69 0.00 0.00 178.15 177.46 3h1j h LEU 120 N 1.17 -0.42 -0.09 1.44 3.38 0.09 0.13 115.31 121.01 3h1j h LEU 120 Ca 0.30 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.33 3h1j h LEU 120 Cb 0.01 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 3h1j h LEU 120 CO -0.05 -0.29 -0.32 0.25 0.09 0.00 0.00 178.44 178.12 3h1j h LEU 121 N -0.47 -0.99 -0.67 1.67 5.85 -0.62 0.35 115.31 120.43 3h1j h LEU 121 Ca -0.04 0.14 0.11 0.00 0.84 0.00 0.00 57.88 58.92 3h1j h LEU 121 Cb 0.37 0.41 -0.08 0.00 0.37 0.00 0.00 40.66 41.73 3h1j h LEU 121 CO 0.06 -0.37 0.27 -0.07 -0.34 0.00 0.00 178.44 178.00 3h1j h LEU 122 N -0.42 0.28 -0.40 2.25 3.38 -0.78 0.18 115.31 119.79 3h1j h LEU 122 Ca 0.08 0.08 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 3h1j h LEU 122 Cb 0.55 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3h1j h LEU 122 CO -0.33 0.15 -0.04 0.74 0.09 0.00 0.00 178.44 179.05 3h1j h THR 123 N 0.45 1.27 -0.86 0.22 2.02 -0.08 -1.56 112.91 114.36 3h1j h THR 123 Ca 0.34 -1.09 0.06 0.00 0.77 0.00 0.00 66.41 66.48 3h1j h THR 123 Cb 0.44 1.16 -0.06 0.00 -1.74 0.00 0.00 68.15 67.95 3h1j h THR 123 CO -0.33 0.37 0.54 0.25 0.37 0.00 0.00 175.52 176.72 3h1j h LEU 124 N 0.57 0.85 0.65 2.58 5.85 0.54 0.29 115.31 126.63 3h1j h LEU 124 Ca 0.11 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 3h1j h LEU 124 Cb 0.54 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 3h1j h LEU 124 CO 0.03 0.55 -0.40 0.24 -0.34 0.00 0.00 178.44 178.52 3h1j h MET 125 N 0.99 -0.94 -0.72 1.25 2.86 -0.29 -0.42 114.93 117.66 3h1j h MET 125 Ca 0.37 0.06 0.12 0.00 -2.06 0.00 0.00 59.70 58.19 3h1j h MET 125 Cb 0.14 0.21 -0.08 0.00 0.06 0.00 0.00 31.60 31.93 3h1j h MET 125 CO -0.16 -0.63 0.32 0.00 1.06 0.00 0.00 176.91 177.49 3h1j h ALA 126 N -1.32 1.00 0.08 6.32 0.00 -0.99 -1.12 119.26 123.24 3h1j h ALA 126 Ca -0.09 0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3h1j h ALA 126 Cb 0.79 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 3h1j h ALA 126 CO 0.08 -0.14 -0.30 1.15 0.00 0.00 0.00 179.25 180.04 3h1j h THR 127 N 0.51 0.34 0.00 0.00 2.02 -0.23 -1.66 112.91 113.89 3h1j h THR 127 Ca 0.38 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.55 3h1j h THR 127 Cb 0.49 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.24 3h1j h THR 127 CO -0.34 0.00 -0.01 0.00 0.37 0.00 0.00 175.52 175.55 3h1j h ALA 128 N 0.20 1.76 0.33 6.16 0.00 -0.41 -1.68 119.26 125.62 3h1j h ALA 128 Ca 0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3h1j h ALA 128 Cb 0.55 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3h1j h ALA 128 CO -0.20 0.01 -0.16 0.35 0.00 0.00 0.00 179.25 179.25 3h1j h PHE 129 N 0.00 -0.41 -0.98 0.00 3.57 -0.32 -2.24 116.94 116.57 3h1j h PHE 129 Ca -0.00 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.62 3h1j h PHE 129 Cb 0.02 0.14 -0.08 0.00 2.79 0.00 0.00 35.95 38.81 3h1j h PHE 129 CO 0.00 -0.25 0.62 -0.39 -2.23 0.00 0.00 178.31 176.05 3h1j h VAL 130 N -0.65 0.89 -0.58 1.41 -1.51 -1.31 -1.12 116.25 113.37 3h1j h VAL 130 Ca -0.05 -0.31 0.05 0.00 -1.23 0.00 0.00 66.70 65.16 3h1j h VAL 130 Cb 0.34 -0.11 -0.05 0.00 -2.13 0.00 0.00 31.29 29.34 3h1j h VAL 130 CO 0.07 0.17 0.31 1.23 -1.23 0.00 0.00 177.57 178.12 3h1j h GLY 131 N 0.91 0.82 2.00 5.19 0.00 -1.34 -1.29 103.07 109.37 3h1j h GLY 131 Ca 0.49 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.58 3h1j h GLY 131 CO -0.26 0.14 -0.12 -1.82 0.00 0.00 0.00 176.54 174.48 3h1j h TYR 132 N 0.59 0.00 0.00 5.60 3.20 -0.57 -1.85 116.97 123.94 3h1j h TYR 132 Ca 0.25 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.12 3h1j h TYR 132 Cb 0.14 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.41 3h1j h TYR 132 CO -0.09 0.12 0.00 0.28 -1.64 0.00 0.00 178.16 176.83 3h1j n VAL 133 N -3.99 0.77 0.02 1.81 0.31 -0.49 -3.82 118.33 112.93 3h1j n VAL 133 Ca -0.02 0.11 -0.05 0.00 -0.01 0.00 0.00 64.34 64.37 3h1j n VAL 133 Cb 0.21 -1.02 0.16 0.00 -0.91 0.00 0.00 33.84 32.29 3h1j n VAL 133 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3h1j h LEU 134 N 0.00 0.50 -1.00 7.52 3.38 -1.28 -2.65 115.31 121.78 3h1j h LEU 134 Ca 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3h1j h LEU 134 Cb 0.44 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3h1j h LEU 134 CO 0.00 0.80 0.00 -0.65 0.09 0.00 0.00 178.44 178.68 3h1j h PRO 135 N 0.41 0.00 -5.53 1.13 0.11 -1.77 -3.42 132.00 122.94 3h1j h PRO 135 Ca 0.05 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.86 3h1j h PRO 135 Cb 0.79 0.00 0.18 0.00 0.11 0.00 0.00 31.00 32.07 3h1j h PRO 135 CO 0.06 0.00 -0.78 1.87 -0.21 0.00 0.00 178.00 178.94 3h1j n TRP 136 N -2.59 -2.23 -3.18 0.65 -0.00 -1.00 -2.87 117.44 106.21 3h1j n TRP 136 Ca 0.02 0.90 -0.15 0.00 -0.00 0.00 0.00 57.50 58.27 3h1j n TRP 136 Cb 0.27 -4.75 0.04 0.00 -0.00 0.00 0.00 31.31 26.86 3h1j n TRP 136 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3h1j n GLY 137 N -1.16 2.13 0.23 5.87 0.00 -1.26 -2.26 105.19 108.74 3h1j n GLY 137 Ca -0.22 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.59 3h1j n GLY 137 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3h1j h GLN 138 N 0.00 0.19 -0.25 1.61 1.08 0.23 -1.27 115.11 116.69 3h1j h GLN 138 Ca -0.20 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 56.96 3h1j h GLN 138 Cb 0.89 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.27 3h1j h GLN 138 CO 0.30 0.13 0.08 0.52 -0.95 0.00 0.00 178.83 178.90 3h1j h MET 139 N 0.20 0.40 -0.31 1.46 2.86 -1.83 -1.80 114.93 115.90 3h1j h MET 139 Ca 0.31 -0.09 0.07 0.00 -2.06 0.00 0.00 59.70 57.93 3h1j h MET 139 Cb 0.48 -0.06 -0.08 0.00 0.06 0.00 0.00 31.60 32.00 3h1j h MET 139 CO -0.44 0.47 -0.31 0.77 1.06 0.00 0.00 176.91 178.46 3h1j h SER 140 N 0.24 -1.02 0.62 1.22 0.02 -1.61 0.43 113.55 113.45 3h1j h SER 140 Ca 0.08 0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 61.18 3h1j h SER 140 Cb 0.24 0.47 0.00 0.00 0.14 0.00 0.00 62.40 63.25 3h1j h SER 140 CO -0.00 -0.33 -0.32 0.15 -1.14 0.00 0.00 176.83 175.19 3h1j h PHE 141 N -0.29 -0.84 0.00 3.45 3.57 -1.14 -0.92 116.94 120.77 3h1j h PHE 141 Ca 0.15 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.56 3h1j h PHE 141 Cb 0.53 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 3h1j h PHE 141 CO -0.49 -0.51 -0.34 -1.49 -2.23 0.00 0.00 178.31 173.25 3h1j h TRP 142 N -0.87 0.00 -0.19 0.41 4.06 -1.15 -0.17 115.95 118.05 3h1j h TRP 142 Ca -0.08 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.83 3h1j h TRP 142 Cb 0.68 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.83 3h1j h TRP 142 CO -0.05 0.34 -0.03 0.78 -3.56 0.00 0.00 178.44 175.92 3h1j h GLY 143 N 1.49 0.38 0.40 1.49 0.00 -0.04 -1.07 103.07 105.73 3h1j h GLY 143 Ca -0.00 -0.31 0.06 0.00 0.00 0.00 0.00 47.33 47.08 3h1j h GLY 143 CO 0.04 0.28 -0.08 0.00 0.00 0.00 0.00 176.54 176.78 3h1j h ALA 144 N 0.74 0.17 -0.59 3.60 0.00 -0.72 0.42 119.26 122.88 3h1j h ALA 144 Ca 0.05 0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.15 3h1j h ALA 144 Cb 0.46 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 3h1j h ALA 144 CO 0.02 -0.48 0.24 1.15 0.00 0.00 0.00 179.25 180.18 3h1j h THR 145 N -0.02 0.81 0.22 0.00 2.02 -0.82 -2.30 112.91 112.82 3h1j h THR 145 Ca 0.14 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 3h1j h THR 145 Cb 0.23 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 3h1j h THR 145 CO -0.30 0.08 -0.11 0.58 0.37 0.00 0.00 175.52 176.14 3h1j h VAL 146 N 0.44 0.57 0.10 3.16 2.07 -0.52 -2.85 116.25 119.22 3h1j h VAL 146 Ca 0.29 -0.98 0.01 0.00 0.82 0.00 0.00 66.70 66.84 3h1j h VAL 146 Cb 0.32 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 3h1j h VAL 146 CO -0.27 0.15 -0.17 0.40 0.02 0.00 0.00 177.57 177.70 3h1j h ILE 147 N -0.95 0.62 -0.81 4.57 2.04 -0.96 -1.56 117.51 120.47 3h1j h ILE 147 Ca -0.03 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.88 3h1j h ILE 147 Cb 0.47 0.62 -0.05 0.00 -0.74 0.00 0.00 36.82 37.13 3h1j h ILE 147 CO 0.05 0.00 0.53 0.71 0.00 0.00 0.00 178.15 179.44 3h1j h THR 148 N -0.33 1.09 0.00 -0.27 1.35 -1.57 -0.15 112.91 113.03 3h1j h THR 148 Ca 0.02 -0.33 -0.01 0.00 -0.55 0.00 0.00 66.41 65.55 3h1j h THR 148 Cb 0.34 0.06 -0.00 0.00 -1.73 0.00 0.00 68.15 66.82 3h1j h THR 148 CO -0.09 0.17 -0.04 0.78 -0.25 0.00 0.00 175.52 176.10 3h1j h ASN 149 N 0.95 0.00 -1.01 5.36 -0.26 -1.07 -2.53 115.58 117.01 3h1j h ASN 149 Ca 0.33 0.00 0.24 0.00 -0.56 0.00 0.00 56.30 56.32 3h1j h ASN 149 Cb 0.13 0.00 -0.10 0.00 -1.06 0.00 0.00 38.32 37.29 3h1j h ASN 149 CO -0.11 0.04 0.64 -0.07 -1.06 0.00 0.00 177.43 176.87 3h1j h LEU 150 N 0.00 0.53 -0.61 1.61 3.38 -0.09 0.15 115.31 120.28 3h1j h LEU 150 Ca -0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3h1j h LEU 150 Cb 0.14 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3h1j h LEU 150 CO 0.00 0.13 0.00 0.49 0.09 0.00 0.00 178.44 179.16 3h1j n PHE 151 N -4.67 0.70 0.28 1.13 3.01 -0.95 -1.90 117.46 115.05 3h1j n PHE 151 Ca 0.24 0.28 0.15 0.00 1.01 0.00 0.00 57.45 59.13 3h1j n PHE 151 Cb 0.78 -0.94 0.76 0.00 -0.01 0.00 0.00 39.48 40.07 3h1j n PHE 151 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3h1j h SER 152 N 0.00 0.00 0.53 4.37 4.64 -0.89 -1.13 113.55 121.06 3h1j h SER 152 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h1j h SER 152 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3h1j h SER 152 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3h1j h ALA 153 N 2.06 1.00 -2.44 5.18 0.00 -1.53 -3.40 119.26 120.12 3h1j h ALA 153 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 3h1j h ALA 153 Cb 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3h1j h ALA 153 CO 0.00 0.00 0.62 0.42 0.00 0.00 0.00 179.25 180.29 3h1j s ILE 154 N -3.63 4.00 0.41 0.00 1.01 -0.43 -4.93 121.20 117.63 3h1j s ILE 154 Ca 0.00 1.42 -0.26 0.00 0.00 0.00 0.00 60.65 61.81 3h1j s ILE 154 Cb 0.09 -3.91 -0.10 0.00 0.01 0.00 0.00 42.46 38.55 3h1j s ILE 154 CO 0.40 0.08 1.25 -0.81 0.00 0.00 0.00 174.94 175.86 3h1j n PRO 155 N 4.30 1.90 0.00 2.79 -0.04 -1.26 -3.00 135.00 139.69 3h1j n PRO 155 Ca 0.10 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.23 3h1j n PRO 155 Cb 0.46 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 3h1j n PRO 155 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3h1j n TYR 156 N -0.13 0.00 0.00 0.54 0.53 -1.26 -4.15 117.16 112.69 3h1j n TYR 156 Ca 0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.95 3h1j n TYR 156 Cb 0.39 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.70 3h1j n TYR 156 CO 0.00 0.00 0.00 0.44 -1.02 0.00 0.00 176.86 176.28 3h1j n ILE 157 N 0.00 0.00 0.00 -0.72 -5.35 -1.26 -4.49 119.36 107.54 3h1j n ILE 157 Ca 0.00 0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.96 3h1j n ILE 157 Cb 0.00 -1.33 0.00 0.00 -1.74 0.00 0.00 39.64 36.57 3h1j n ILE 157 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h1j n GLY 158 N 0.00 0.47 0.31 3.28 0.00 -1.16 -1.72 105.19 106.37 3h1j n GLY 158 Ca 0.00 0.21 -0.03 0.00 0.00 0.00 0.00 46.02 46.19 3h1j n GLY 158 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3h1j n HIS 159 N 0.00 -0.10 -0.37 1.61 8.25 -1.26 0.28 115.22 123.62 3h1j n HIS 159 Ca 0.00 0.97 0.36 0.00 -0.26 0.00 0.00 57.72 58.79 3h1j n HIS 159 Cb 0.00 -0.71 0.72 0.00 1.12 0.00 0.00 29.99 31.12 3h1j n HIS 159 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3h1j h THR 160 N 0.00 0.36 -0.00 1.59 2.02 -1.62 1.34 112.91 116.60 3h1j h THR 160 Ca 0.22 -0.02 -0.20 0.00 0.77 0.00 0.00 66.41 67.18 3h1j h THR 160 Cb 0.42 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 3h1j h THR 160 CO -0.76 0.01 -0.87 -0.07 0.37 0.00 0.00 175.52 174.20 3h1j h LEU 161 N 0.06 0.30 -0.27 2.58 3.38 0.38 -3.15 115.31 118.58 3h1j h LEU 161 Ca 0.63 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.34 3h1j h LEU 161 Cb 2.36 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 43.01 3h1j h LEU 161 CO -0.07 1.03 0.09 0.58 0.09 0.00 0.00 178.44 180.16 3h1j h VAL 162 N 0.13 1.19 -0.55 1.22 2.07 0.23 -1.69 116.25 118.87 3h1j h VAL 162 Ca -0.05 -0.61 0.09 0.00 0.82 0.00 0.00 66.70 66.95 3h1j h VAL 162 Cb 1.49 1.09 -0.11 0.00 -1.52 0.00 0.00 31.29 32.24 3h1j h VAL 162 CO 0.14 0.20 -0.39 -0.08 0.02 0.00 0.00 177.57 177.46 3h1j h GLU 163 N 0.28 -0.21 0.17 1.57 4.81 -1.17 -0.35 114.58 119.67 3h1j h GLU 163 Ca 0.09 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 3h1j h GLU 163 Cb 0.23 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 3h1j h GLU 163 CO -0.00 -0.14 -0.47 -1.49 -0.73 0.00 0.00 179.01 176.18 3h1j h TRP 164 N -0.22 -1.35 -1.46 0.92 6.55 -1.45 1.70 115.95 120.64 3h1j h TRP 164 Ca 0.19 0.03 0.44 0.00 0.95 0.00 0.00 58.89 60.51 3h1j h TRP 164 Cb 0.56 0.57 -0.10 0.00 -0.86 0.00 0.00 29.16 29.33 3h1j h TRP 164 CO -0.66 -0.55 1.00 0.00 -1.05 0.00 0.00 178.44 177.18 3h1j h ALA 165 N -0.71 3.09 0.00 1.49 0.00 -0.24 0.17 119.26 123.06 3h1j h ALA 165 Ca -0.01 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 3h1j h ALA 165 Cb 0.70 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3h1j h ALA 165 CO -0.22 -1.62 -1.97 0.91 0.00 0.00 0.00 179.25 176.34 3h1j n TRP 166 N -4.37 0.00 -1.16 0.00 8.01 -0.28 -4.77 117.44 114.87 3h1j n TRP 166 Ca 0.36 0.00 -0.05 0.00 -1.31 0.00 0.00 57.50 56.50 3h1j n TRP 166 Cb 1.51 -0.57 -0.02 0.00 -2.01 0.00 0.00 31.31 30.22 3h1j n TRP 166 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3h1j n GLY 167 N 1.61 0.76 0.00 6.99 0.00 0.57 -2.57 105.19 112.55 3h1j n GLY 167 Ca -0.12 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.49 3h1j n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h1j n GLY 168 N -1.72 2.87 0.57 -0.02 0.00 -1.14 -4.90 105.19 100.85 3h1j n GLY 168 Ca -0.05 -0.62 0.07 0.00 0.00 0.00 0.00 46.02 45.42 3h1j n GLY 168 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h1j n PHE 169 N 0.00 0.48 0.00 1.61 0.99 -1.26 -4.43 117.46 114.85 3h1j n PHE 169 Ca 0.00 -1.10 0.00 0.00 -0.00 0.00 0.00 57.45 56.35 3h1j n PHE 169 Cb 0.00 -0.27 0.00 0.00 -1.00 0.00 0.00 39.48 38.21 3h1j n PHE 169 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 3h1j n SER 170 N -1.04 0.00 -4.75 4.37 3.41 -1.26 -5.12 113.62 109.23 3h1j n SER 170 Ca 0.21 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.40 3h1j n SER 170 Cb 0.79 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.72 3h1j n SER 170 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3h1j s VAL 171 N -2.00 2.01 0.03 -3.33 1.01 -1.26 -4.89 120.40 111.97 3h1j s VAL 171 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 3h1j s VAL 171 Cb 0.00 -3.01 0.01 0.00 0.00 0.00 0.00 36.38 33.38 3h1j s VAL 171 CO 0.00 0.00 0.14 -0.67 0.00 0.00 0.00 175.10 174.57 3h1j n ASP 172 N 2.49 -0.25 -0.22 3.32 -0.08 -1.26 -5.03 116.55 115.52 3h1j n ASP 172 Ca 0.10 -1.14 0.02 0.00 -1.51 0.00 0.00 54.79 52.26 3h1j n ASP 172 Cb 0.37 0.40 0.11 0.00 2.34 0.00 0.00 41.12 44.34 3h1j n ASP 172 CO 0.00 0.00 0.00 -1.13 0.12 0.00 0.00 177.20 176.19 3h1j h ASN 173 N 0.27 -0.38 -0.86 1.67 -1.24 -1.92 0.15 115.58 113.27 3h1j h ASN 173 Ca -0.04 0.18 0.25 0.00 0.71 0.00 0.00 56.30 57.40 3h1j h ASN 173 Cb 0.16 0.33 -0.03 0.00 0.73 0.00 0.00 38.32 39.51 3h1j h ASN 173 CO 0.05 -0.16 0.65 1.55 -1.29 0.00 0.00 177.43 178.24 3h1j h PRO 174 N 0.08 0.00 0.00 6.67 0.13 -1.91 0.30 132.00 137.28 3h1j h PRO 174 Ca 0.35 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.47 3h1j h PRO 174 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 3h1j h PRO 174 CO -0.60 0.00 -0.03 1.15 -0.23 0.00 0.00 178.00 178.28 3h1j h THR 175 N 0.00 1.68 -0.36 1.56 2.02 -0.45 -2.87 112.91 114.50 3h1j h THR 175 Ca 0.41 -2.05 0.07 0.00 0.77 0.00 0.00 66.41 65.60 3h1j h THR 175 Cb 1.71 3.07 -0.06 0.00 -1.74 0.00 0.00 68.15 71.13 3h1j h THR 175 CO -0.00 0.54 -0.05 0.25 0.37 0.00 0.00 175.52 176.62 3h1j h LEU 176 N -0.84 -0.25 -0.73 2.58 5.85 -0.42 0.87 115.31 122.38 3h1j h LEU 176 Ca -0.00 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.72 3h1j h LEU 176 Cb 0.90 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 3h1j h LEU 176 CO 0.01 -0.08 -0.08 0.71 -0.34 0.00 0.00 178.44 178.66 3h1j h THR 177 N 0.05 1.26 0.00 1.05 1.35 -1.23 -0.35 112.91 115.03 3h1j h THR 177 Ca 0.18 -1.17 -0.11 0.00 -0.55 0.00 0.00 66.41 64.75 3h1j h THR 177 Cb 0.26 0.96 -0.02 0.00 -1.73 0.00 0.00 68.15 67.62 3h1j h THR 177 CO -0.34 0.41 -0.51 0.08 -0.25 0.00 0.00 175.52 174.91 3h1j h ARG 178 N 0.81 0.00 -0.32 4.72 0.11 -1.20 -2.72 114.38 115.77 3h1j h ARG 178 Ca 0.14 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 60.06 3h1j h ARG 178 Cb 0.59 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.67 3h1j h ARG 178 CO 0.04 0.51 -0.40 0.74 0.10 0.00 0.00 179.97 180.96 3h1j h PHE 179 N 0.00 1.02 -0.99 4.08 -1.00 -0.41 0.16 116.94 119.82 3h1j h PHE 179 Ca -0.01 -0.33 0.02 0.00 2.81 0.00 0.00 57.97 60.47 3h1j h PHE 179 Cb 1.01 -0.21 -0.05 0.00 3.61 0.00 0.00 35.95 40.31 3h1j h PHE 179 CO 0.00 1.13 0.65 0.35 -1.61 0.00 0.00 178.31 178.83 3h1j h PHE 180 N 0.62 1.23 0.18 -0.55 -0.00 -0.94 0.25 116.94 117.73 3h1j h PHE 180 Ca 0.04 0.03 -0.01 0.00 -0.00 0.00 0.00 57.97 58.03 3h1j h PHE 180 Cb 0.99 -0.42 0.00 0.00 -0.00 0.00 0.00 35.95 36.53 3h1j h PHE 180 CO 0.07 0.76 -0.08 0.00 -0.00 0.00 0.00 178.31 179.05 3h1j h ALA 181 N 1.37 -0.24 -0.90 2.41 0.00 -1.24 -1.15 119.26 119.52 3h1j h ALA 181 Ca 0.37 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.24 3h1j h ALA 181 Cb -0.12 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 3h1j h ALA 181 CO -0.09 -0.54 0.54 1.25 0.00 0.00 0.00 179.25 180.42 3h1j h LEU 182 N -0.43 0.82 -0.74 0.00 5.85 -0.50 0.04 115.31 120.35 3h1j h LEU 182 Ca -0.02 0.03 -0.12 0.00 0.84 0.00 0.00 57.88 58.61 3h1j h LEU 182 Cb 0.34 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3h1j h LEU 182 CO 0.04 0.48 -0.28 -0.74 -0.34 0.00 0.00 178.44 177.60 3h1j h HIS 183 N 0.93 0.75 -0.48 1.25 2.76 -0.34 -2.03 115.15 117.99 3h1j h HIS 183 Ca 0.42 -0.18 -0.11 0.00 -2.20 0.00 0.00 60.37 58.30 3h1j h HIS 183 Cb 0.32 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.08 3h1j h HIS 183 CO -0.03 0.87 -0.13 0.35 -1.30 0.00 0.00 177.93 177.68 3h1j h PHE 184 N 0.57 1.01 0.27 5.26 -0.00 -0.13 -3.35 116.94 120.57 3h1j h PHE 184 Ca 0.07 -0.21 -0.01 0.00 -0.00 0.00 0.00 57.97 57.82 3h1j h PHE 184 Cb 0.77 -0.25 0.00 0.00 -0.00 0.00 0.00 35.95 36.47 3h1j h PHE 184 CO 0.03 0.97 -0.13 1.25 -0.00 0.00 0.00 178.31 180.44 3h1j h LEU 185 N 0.81 -0.31 -0.95 0.59 5.85 -0.83 -3.39 115.31 117.08 3h1j h LEU 185 Ca 0.13 -0.14 0.26 0.00 0.84 0.00 0.00 57.88 58.97 3h1j h LEU 185 Cb 0.66 0.08 -0.17 0.00 0.37 0.00 0.00 40.66 41.60 3h1j h LEU 185 CO 0.05 0.18 0.06 -0.07 -0.34 0.00 0.00 178.44 178.31 3h1j h LEU 186 N -1.02 -0.40 -0.86 2.25 3.38 -1.50 -1.66 115.31 115.49 3h1j h LEU 186 Ca -0.04 0.26 0.22 0.00 0.09 0.00 0.00 57.88 58.41 3h1j h LEU 186 Cb 0.43 0.44 -0.13 0.00 0.09 0.00 0.00 40.66 41.49 3h1j h LEU 186 CO 0.06 -0.31 0.28 -0.65 0.09 0.00 0.00 178.44 177.91 3h1j h PRO 187 N 0.04 0.27 -0.44 1.13 0.11 -1.76 0.34 132.00 131.69 3h1j h PRO 187 Ca 0.58 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.52 3h1j h PRO 187 Cb 1.18 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3h1j h PRO 187 CO -0.86 0.18 -0.29 0.74 -0.21 0.00 0.00 178.00 177.56 3h1j h PHE 188 N 0.28 1.15 0.00 0.65 -1.00 -1.54 0.10 116.94 116.57 3h1j h PHE 188 Ca 0.54 -0.31 -0.02 0.00 2.81 0.00 0.00 57.97 60.99 3h1j h PHE 188 Cb 1.05 -0.26 -0.00 0.00 3.61 0.00 0.00 35.95 40.35 3h1j h PHE 188 CO -0.22 1.14 -0.08 0.00 -1.61 0.00 0.00 178.31 177.54 3h1j h ALA 189 N 0.83 1.62 0.40 2.45 0.00 -0.52 0.33 119.26 124.37 3h1j h ALA 189 Ca 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3h1j h ALA 189 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3h1j h ALA 189 CO 0.08 0.10 -0.19 0.82 0.00 0.00 0.00 179.25 180.06 3h1j h ILE 190 N 0.00 0.32 -0.96 0.00 2.04 0.46 -1.34 117.51 118.03 3h1j h ILE 190 Ca -0.00 -0.65 0.21 0.00 1.00 0.00 0.00 64.86 65.42 3h1j h ILE 190 Cb 0.16 0.50 -0.12 0.00 -0.74 0.00 0.00 36.82 36.63 3h1j h ILE 190 CO 0.01 0.07 0.53 0.00 0.00 0.00 0.00 178.15 178.76 3h1j h ALA 191 N -0.80 1.61 0.44 1.87 0.00 -0.11 0.22 119.26 122.49 3h1j h ALA 191 Ca -0.05 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3h1j h ALA 191 Cb 0.52 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3h1j h ALA 191 CO 0.09 -0.20 -0.21 0.78 0.00 0.00 0.00 179.25 179.71 3h1j h GLY 192 N 0.60 -0.62 1.34 0.00 0.00 -0.30 -2.73 103.07 101.35 3h1j h GLY 192 Ca 0.58 0.23 0.04 0.00 0.00 0.00 0.00 47.33 48.18 3h1j h GLY 192 CO -0.45 -0.23 0.35 -2.22 0.00 0.00 0.00 176.54 174.00 3h1j h ILE 193 N -0.67 1.04 -0.37 2.60 2.04 0.00 0.48 117.51 122.63 3h1j h ILE 193 Ca -0.06 -0.20 0.06 0.00 1.00 0.00 0.00 64.86 65.66 3h1j h ILE 193 Cb 0.49 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 3h1j h ILE 193 CO 0.10 0.10 0.25 0.74 0.00 0.00 0.00 178.15 179.34 3h1j h THR 194 N 0.57 0.95 -0.31 -0.27 2.02 -0.35 0.21 112.91 115.73 3h1j h THR 194 Ca 0.22 -0.09 -0.11 0.00 0.77 0.00 0.00 66.41 67.21 3h1j h THR 194 Cb 0.15 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 3h1j h THR 194 CO -0.06 0.05 -0.22 0.40 0.37 0.00 0.00 175.52 176.06 3h1j h ILE 195 N 0.25 1.29 -0.76 3.11 1.08 -0.63 -1.33 117.51 120.52 3h1j h ILE 195 Ca 0.16 -1.36 -0.04 0.00 -0.39 0.00 0.00 64.86 63.23 3h1j h ILE 195 Cb 0.32 1.49 -0.03 0.00 -3.07 0.00 0.00 36.82 35.53 3h1j h ILE 195 CO -0.03 0.44 0.32 0.40 -0.69 0.00 0.00 178.15 178.59 3h1j h ILE 196 N 0.46 1.25 0.10 -0.67 2.04 -0.86 -0.68 117.51 119.16 3h1j h ILE 196 Ca 0.06 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.15 3h1j h ILE 196 Cb 0.77 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 3h1j h ILE 196 CO 0.06 0.32 -0.24 -0.74 0.00 0.00 0.00 178.15 177.55 3h1j h HIS 197 N 1.10 -0.68 -0.62 1.37 2.76 -0.34 -0.59 115.15 118.15 3h1j h HIS 197 Ca 0.26 0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.55 3h1j h HIS 197 Cb 0.19 0.28 -0.04 0.00 1.55 0.00 0.00 27.41 29.39 3h1j h HIS 197 CO 0.02 -0.28 0.42 -0.07 -1.30 0.00 0.00 177.93 176.72 3h1j h LEU 198 N -0.37 0.35 -0.19 0.26 3.38 -1.21 0.03 115.31 117.56 3h1j h LEU 198 Ca -0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3h1j h LEU 198 Cb 0.36 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3h1j h LEU 198 CO -0.10 0.20 0.07 0.74 0.09 0.00 0.00 178.44 179.44 3h1j h THR 199 N 0.39 1.17 -0.54 0.22 2.02 -0.45 0.20 112.91 115.92 3h1j h THR 199 Ca 0.29 -0.54 -0.07 0.00 0.77 0.00 0.00 66.41 66.87 3h1j h THR 199 Cb 0.63 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 3h1j h THR 199 CO -0.08 0.17 0.08 -0.26 0.37 0.00 0.00 175.52 175.80 3h1j h PHE 200 N 0.14 0.96 -0.31 3.16 0.04 -0.44 -3.00 116.94 117.49 3h1j h PHE 200 Ca 0.06 -0.14 0.04 0.00 2.80 0.00 0.00 57.97 60.74 3h1j h PHE 200 Cb 0.20 -0.26 -0.04 0.00 2.20 0.00 0.00 35.95 38.05 3h1j h PHE 200 CO -0.01 0.85 0.07 1.25 -0.60 0.00 0.00 178.31 179.88 3h1j h LEU 201 N 0.78 0.04 -2.13 1.54 5.85 -0.60 -1.85 115.31 118.94 3h1j h LEU 201 Ca 0.16 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.93 3h1j h LEU 201 Cb 0.42 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.51 3h1j h LEU 201 CO 0.01 0.06 0.01 0.45 -0.34 0.00 0.00 178.44 178.63 3h1j h HIS 202 N 0.19 0.00 -0.69 1.25 3.86 -0.49 0.33 115.15 119.61 3h1j h HIS 202 Ca 0.14 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.32 3h1j h HIS 202 Cb 0.15 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.58 3h1j h HIS 202 CO -0.16 0.00 0.29 0.93 0.86 0.00 0.00 177.93 179.84 3h1j h GLU 203 N 0.00 1.00 0.00 2.45 4.39 -1.24 -3.29 114.58 117.90 3h1j h GLU 203 Ca 0.00 -0.16 -0.28 0.00 0.34 0.00 0.00 59.36 59.27 3h1j h GLU 203 Cb 0.02 -0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 28.44 3h1j h GLU 203 CO 0.00 0.81 -2.04 -1.13 -1.16 0.00 0.00 179.01 175.49 3h1j n SER 204 N -4.31 1.61 0.00 1.42 3.41 -0.57 -5.13 113.62 110.05 3h1j n SER 204 Ca 0.06 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 3h1j n SER 204 Cb 0.16 0.58 0.00 0.00 -0.26 0.00 0.00 64.21 64.70 3h1j n SER 204 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h1j n GLY 205 N 2.20 -0.31 3.75 5.00 0.00 0.11 -4.95 105.19 110.99 3h1j n GLY 205 Ca -0.27 -1.70 -0.38 0.00 0.00 0.00 0.00 46.02 43.68 3h1j n GLY 205 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h1j s SER 206 N -2.28 5.12 0.79 1.61 0.01 -1.26 -4.89 113.70 112.79 3h1j s SER 206 Ca 0.00 2.72 -0.06 0.00 1.31 0.00 0.00 55.95 59.92 3h1j s SER 206 Cb 0.00 -2.63 0.14 0.00 0.21 0.00 0.00 66.02 63.74 3h1j s SER 206 CO 0.00 -1.67 1.09 0.21 0.41 0.00 0.00 173.24 173.28 3h1j s ASN 207 N -1.08 4.04 0.08 2.44 3.04 -1.26 -4.67 114.94 117.53 3h1j s ASN 207 Ca 0.74 -0.12 -0.08 0.00 0.04 0.00 0.00 52.86 53.44 3h1j s ASN 207 Cb -0.39 -0.19 -0.01 0.00 -1.54 0.00 0.00 41.25 39.12 3h1j s ASN 207 CO 0.45 -2.09 0.17 0.54 -3.04 0.00 0.00 177.10 173.13 3h1j s ASN 208 N -4.76 0.16 0.25 -4.21 2.20 -1.26 -4.85 114.94 102.47 3h1j s ASN 208 Ca 0.68 -0.68 -0.05 0.00 -0.94 0.00 0.00 52.86 51.87 3h1j s ASN 208 Cb -0.05 0.32 0.47 0.00 -2.00 0.00 0.00 41.25 39.99 3h1j s ASN 208 CO 0.47 -0.71 1.38 -2.65 -2.94 0.00 0.00 177.10 172.64 3h1j n PRO 209 N -0.02 -0.08 0.16 3.55 -0.02 -1.26 -0.25 135.00 137.08 3h1j n PRO 209 Ca -0.15 1.36 0.13 0.00 -2.02 0.00 0.00 63.50 62.82 3h1j n PRO 209 Cb 0.62 -2.07 0.54 0.00 -0.02 0.00 0.00 33.50 32.57 3h1j n PRO 209 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3h1j h LEU 210 N 0.00 0.00 2.00 2.45 3.38 -1.97 -3.43 115.31 117.75 3h1j h LEU 210 Ca 0.45 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 58.05 3h1j h LEU 210 Cb 0.76 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.52 3h1j h LEU 210 CO -0.89 0.00 -0.50 0.61 0.09 0.00 0.00 178.44 177.75 3h1j n GLY 211 N -0.08 -0.40 3.16 0.83 0.00 0.66 -4.74 105.19 104.63 3h1j n GLY 211 Ca 0.02 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 3h1j n GLY 211 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h1j s ILE 212 N -3.00 0.83 0.15 -0.61 -4.36 -1.26 -4.36 121.20 108.58 3h1j s ILE 212 Ca 0.10 -1.67 -0.34 0.00 -0.26 0.00 0.00 60.65 58.47 3h1j s ILE 212 Cb -0.04 -1.38 -0.16 0.00 1.25 0.00 0.00 42.46 42.13 3h1j s ILE 212 CO 0.12 -0.64 1.26 -0.24 0.24 0.00 0.00 174.94 175.69 3h1j n SER 213 N 0.46 1.63 -0.89 4.36 2.88 -1.26 -4.83 113.62 115.97 3h1j n SER 213 Ca -0.15 1.13 0.07 0.00 -1.33 0.00 0.00 58.87 58.59 3h1j n SER 213 Cb 0.58 -1.23 0.22 0.00 -0.75 0.00 0.00 64.21 63.04 3h1j n SER 213 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3h1j n SER 214 N 2.27 3.54 0.30 -3.46 3.41 -1.26 -4.59 113.62 113.83 3h1j n SER 214 Ca 0.16 -2.35 0.16 0.00 -0.26 0.00 0.00 58.87 56.58 3h1j n SER 214 Cb 0.23 -0.39 0.96 0.00 -0.26 0.00 0.00 64.21 64.76 3h1j n SER 214 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3h1j h ASP 215 N 2.40 0.00 0.29 4.04 3.45 -2.00 0.28 116.42 124.89 3h1j h ASP 215 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3h1j h ASP 215 Cb 1.06 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.83 3h1j h ASP 215 CO 0.10 0.00 0.00 -1.54 -1.57 0.00 0.00 179.24 176.23 3h1j n SER 216 N -3.74 0.00 -2.80 6.45 3.41 -1.26 -4.39 113.62 111.29 3h1j n SER 216 Ca -0.03 -0.41 -0.03 0.00 -0.26 0.00 0.00 58.87 58.14 3h1j n SER 216 Cb 0.09 -0.17 0.01 0.00 -0.26 0.00 0.00 64.21 63.88 3h1j n SER 216 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3h1j s ASP 217 N -2.33 -1.14 0.26 4.04 3.68 0.99 -5.15 116.67 117.02 3h1j s ASP 217 Ca 0.32 -1.21 0.09 0.00 2.13 0.00 0.00 52.55 53.88 3h1j s ASP 217 Cb 0.18 1.48 -0.04 0.00 -1.45 0.00 0.00 42.92 43.09 3h1j s ASP 217 CO 0.36 -0.06 0.02 -0.54 0.13 0.00 0.00 175.17 175.08 3h1j s LYS 218 N 1.08 2.36 0.00 4.34 -0.14 -1.21 -2.47 119.74 123.71 3h1j s LYS 218 Ca 0.26 -1.36 -0.02 0.00 -1.36 0.00 0.00 55.97 53.49 3h1j s LYS 218 Cb 0.03 -2.22 -0.01 0.00 -1.68 0.00 0.00 37.83 33.95 3h1j s LYS 218 CO -0.07 0.37 0.04 0.96 -0.76 0.00 0.00 175.35 175.89 3h1j s ILE 219 N -2.26 0.08 0.30 2.17 -4.36 0.55 -4.86 121.20 112.81 3h1j s ILE 219 Ca 0.31 -0.62 -0.30 0.00 -0.26 0.00 0.00 60.65 59.78 3h1j s ILE 219 Cb -0.07 -0.26 -0.12 0.00 1.25 0.00 0.00 42.46 43.26 3h1j s ILE 219 CO 0.20 -0.34 1.60 -0.81 0.24 0.00 0.00 174.94 175.83 3h1j n PRO 220 N 1.93 2.72 -0.27 0.37 -0.04 -1.26 -1.20 135.00 137.24 3h1j n PRO 220 Ca -0.21 0.97 0.09 0.00 -0.04 0.00 0.00 63.50 64.31 3h1j n PRO 220 Cb 0.56 -2.75 0.23 0.00 -0.04 0.00 0.00 33.50 31.50 3h1j n PRO 220 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 3h1j h PHE 221 N 4.76 0.35 -2.88 0.54 3.57 -0.81 -3.32 116.94 119.15 3h1j h PHE 221 Ca -0.47 0.05 -0.65 0.00 3.53 0.00 0.00 57.97 60.42 3h1j h PHE 221 Cb 1.22 -0.03 -0.09 0.00 2.79 0.00 0.00 35.95 39.84 3h1j h PHE 221 CO 0.58 -0.12 -0.49 -1.58 -2.23 0.00 0.00 178.31 174.47 3h1j s HIS 222 N -5.99 3.51 -2.59 0.41 2.46 -1.08 0.89 115.29 112.90 3h1j s HIS 222 Ca -0.12 0.44 0.26 0.00 0.47 0.00 0.00 55.06 56.10 3h1j s HIS 222 Cb 0.23 -2.00 0.67 0.00 -0.13 0.00 0.00 32.58 31.36 3h1j s HIS 222 CO 0.76 0.58 1.53 -0.35 -2.47 0.00 0.00 174.74 174.79 3h1j n PRO 223 N 2.47 1.81 0.22 2.88 -0.04 -1.26 -4.90 135.00 136.18 3h1j n PRO 223 Ca -0.19 -1.27 -0.16 0.00 -0.04 0.00 0.00 63.50 61.84 3h1j n PRO 223 Cb 0.54 -1.47 -0.09 0.00 -0.04 0.00 0.00 33.50 32.44 3h1j n PRO 223 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3h1j h TYR 224 N 3.09 -1.22 0.00 0.54 0.99 -1.58 -1.98 116.97 116.81 3h1j h TYR 224 Ca 0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 3h1j h TYR 224 Cb 0.69 0.49 0.00 0.00 1.00 0.00 0.00 36.73 38.91 3h1j h TYR 224 CO 0.00 -0.58 -0.94 0.66 -0.00 0.00 0.00 178.16 177.30 3h1j n TYR 225 N -5.51 0.34 -0.06 4.88 4.02 0.26 -1.94 117.16 119.16 3h1j n TYR 225 Ca -0.10 0.10 -0.13 0.00 -0.01 0.00 0.00 57.90 57.76 3h1j n TYR 225 Cb 0.41 -0.50 -0.07 0.00 -0.02 0.00 0.00 39.34 39.17 3h1j n TYR 225 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3h1j h SER 226 N 0.00 0.38 -0.57 7.72 4.64 -1.47 0.19 113.55 124.45 3h1j h SER 226 Ca 0.00 -0.45 -0.05 0.00 -0.47 0.00 0.00 61.79 60.82 3h1j h SER 226 Cb 0.74 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 3h1j h SER 226 CO 0.00 0.75 0.17 -0.26 -0.87 0.00 0.00 176.83 176.62 3h1j h PHE 227 N 0.01 0.92 -0.25 4.77 0.04 -1.43 -0.81 116.94 120.19 3h1j h PHE 227 Ca 0.03 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.68 3h1j h PHE 227 Cb 0.63 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 3h1j h PHE 227 CO 0.08 0.78 0.07 -0.22 -0.60 0.00 0.00 178.31 178.41 3h1j h LYS 228 N 0.80 0.39 -0.27 1.51 3.64 -1.31 -2.37 116.57 118.97 3h1j h LYS 228 Ca 0.18 -0.09 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 3h1j h LYS 228 Cb 0.29 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 3h1j h LYS 228 CO -0.00 0.48 0.11 -0.44 -2.27 0.00 0.00 179.45 177.33 3h1j h ASP 229 N 0.23 0.15 -0.64 4.20 3.45 -0.34 0.29 116.42 123.76 3h1j h ASP 229 Ca 0.08 0.02 0.09 0.00 0.43 0.00 0.00 57.03 57.65 3h1j h ASP 229 Cb 0.26 -0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 38.95 3h1j h ASP 229 CO -0.00 0.12 0.28 0.40 -1.57 0.00 0.00 179.24 178.46 3h1j h ILE 230 N 0.24 0.81 -0.31 0.35 1.08 -1.09 0.23 117.51 118.82 3h1j h ILE 230 Ca 0.11 -0.17 0.01 0.00 -0.39 0.00 0.00 64.86 64.43 3h1j h ILE 230 Cb 0.06 0.28 -0.02 0.00 -3.07 0.00 0.00 36.82 34.07 3h1j h ILE 230 CO -0.10 0.09 0.18 0.25 -0.69 0.00 0.00 178.15 177.88 3h1j h LEU 231 N 0.48 0.29 -0.45 1.44 5.85 -0.84 -2.11 115.31 119.98 3h1j h LEU 231 Ca 0.32 0.00 0.05 0.00 0.84 0.00 0.00 57.88 59.09 3h1j h LEU 231 Cb 0.36 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 3h1j h LEU 231 CO -0.28 0.21 0.19 1.23 -0.34 0.00 0.00 178.44 179.45 3h1j h GLY 232 N 0.37 0.61 0.42 3.75 0.00 0.69 -2.15 103.07 106.76 3h1j h GLY 232 Ca 0.12 -0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.37 3h1j h GLY 232 CO -0.06 0.06 -0.21 -2.00 0.00 0.00 0.00 176.54 174.34 3h1j h LEU 233 N 0.39 -0.62 -2.07 3.11 5.85 -0.28 -1.40 115.31 120.29 3h1j h LEU 233 Ca 0.20 0.10 0.07 0.00 0.84 0.00 0.00 57.88 59.09 3h1j h LEU 233 Cb 0.16 0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 3h1j h LEU 233 CO -0.18 -0.26 0.18 0.71 -0.34 0.00 0.00 178.44 178.55 3h1j h THR 234 N -0.29 0.78 -0.06 1.05 1.35 -0.94 0.27 112.91 115.07 3h1j h THR 234 Ca 0.08 0.00 -0.13 0.00 -0.55 0.00 0.00 66.41 65.81 3h1j h THR 234 Cb 0.41 0.87 0.01 0.00 -1.73 0.00 0.00 68.15 67.70 3h1j h THR 234 CO -0.24 0.00 -0.46 -0.07 -0.25 0.00 0.00 175.52 174.49 3h1j h LEU 235 N 0.00 0.51 -1.02 3.87 3.38 -0.66 -3.06 115.31 118.33 3h1j h LEU 235 Ca 0.11 -0.68 -0.08 0.00 0.09 0.00 0.00 57.88 57.31 3h1j h LEU 235 Cb 0.47 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3h1j h LEU 235 CO -0.00 1.11 -0.20 -0.03 0.09 0.00 0.00 178.44 179.42 3h1j h MET 236 N -0.06 0.47 -0.98 1.13 4.05 -0.38 -3.10 114.93 116.07 3h1j h MET 236 Ca -0.04 -0.16 0.04 0.00 -0.28 0.00 0.00 59.70 59.26 3h1j h MET 236 Cb 1.13 -0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 31.84 3h1j h MET 236 CO 0.09 0.65 0.64 1.25 0.23 0.00 0.00 176.91 179.78 3h1j h LEU 237 N 0.43 1.07 0.69 3.39 5.85 -0.49 -2.92 115.31 123.33 3h1j h LEU 237 Ca 0.07 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 3h1j h LEU 237 Cb 0.59 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 3h1j h LEU 237 CO 0.04 0.73 -0.43 0.74 -0.34 0.00 0.00 178.44 179.17 3h1j h THR 238 N 1.23 0.00 -0.42 1.05 2.02 -1.45 0.49 112.91 115.83 3h1j h THR 238 Ca 0.39 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.64 3h1j h THR 238 Cb 0.02 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.37 3h1j h THR 238 CO -0.12 0.00 0.09 1.55 0.37 0.00 0.00 175.52 177.41 3h1j h PRO 239 N -1.06 0.22 -0.46 6.66 0.13 -1.71 0.48 132.00 136.26 3h1j h PRO 239 Ca -0.09 -0.01 0.09 0.00 -0.87 0.00 0.00 66.00 65.12 3h1j h PRO 239 Cb 0.85 -0.05 -0.08 0.00 0.13 0.00 0.00 31.00 31.85 3h1j h PRO 239 CO 0.09 0.15 -0.04 0.35 -0.23 0.00 0.00 178.00 178.31 3h1j h PHE 240 N 0.23 -0.11 -0.10 1.56 -0.00 -1.39 0.35 116.94 117.48 3h1j h PHE 240 Ca 0.20 0.04 -0.21 0.00 -0.00 0.00 0.00 57.97 58.00 3h1j h PHE 240 Cb 0.24 0.12 0.00 0.00 -0.00 0.00 0.00 35.95 36.32 3h1j h PHE 240 CO -0.20 -0.14 -0.78 -0.07 -0.00 0.00 0.00 178.31 177.13 3h1j h LEU 241 N 0.07 0.70 -0.25 0.59 3.38 -0.33 0.45 115.31 119.92 3h1j h LEU 241 Ca 0.23 -0.47 0.03 0.00 0.09 0.00 0.00 57.88 57.76 3h1j h LEU 241 Cb 0.35 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3h1j h LEU 241 CO -0.42 1.24 0.05 0.74 0.09 0.00 0.00 178.44 180.14 3h1j h THR 242 N 0.39 0.88 0.20 0.22 2.02 0.69 0.86 112.91 118.16 3h1j h THR 242 Ca -0.05 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 3h1j h THR 242 Cb 1.38 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 3h1j h THR 242 CO 0.15 0.03 -0.10 0.25 0.37 0.00 0.00 175.52 176.22 3h1j h LEU 243 N 0.14 -0.23 -0.39 2.58 5.85 -0.28 0.41 115.31 123.39 3h1j h LEU 243 Ca 0.11 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.80 3h1j h LEU 243 Cb 0.12 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3h1j h LEU 243 CO -0.15 -0.08 0.19 0.00 -0.34 0.00 0.00 178.44 178.06 3h1j h ALA 244 N 0.43 0.48 0.05 1.25 0.00 -0.29 0.59 119.26 121.76 3h1j h ALA 244 Ca -0.03 0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 3h1j h ALA 244 Cb 0.28 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3h1j h ALA 244 CO 0.04 -0.17 -1.30 -0.07 0.00 0.00 0.00 179.25 177.75 3h1j h LEU 245 N 0.39 0.15 0.00 0.00 3.38 0.76 -3.34 115.31 116.66 3h1j h LEU 245 Ca 0.16 -0.19 -0.42 0.00 0.09 0.00 0.00 57.88 57.52 3h1j h LEU 245 Cb 0.07 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 3h1j h LEU 245 CO -0.12 1.16 -2.36 0.49 0.09 0.00 0.00 178.44 177.70 3h1j n PHE 246 N -3.34 0.18 -3.35 1.13 3.01 0.14 -4.74 117.46 110.48 3h1j n PHE 246 Ca -0.08 0.07 -0.26 0.00 1.01 0.00 0.00 57.45 58.18 3h1j n PHE 246 Cb 1.00 -1.02 -0.08 0.00 -0.01 0.00 0.00 39.48 39.37 3h1j n PHE 246 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 3h1j n SER 247 N -4.06 3.16 -0.21 4.37 2.88 0.14 -4.97 113.62 114.93 3h1j n SER 247 Ca -0.50 -3.32 -0.02 0.00 -1.33 0.00 0.00 58.87 53.70 3h1j n SER 247 Cb 0.89 -0.66 0.04 0.00 -0.75 0.00 0.00 64.21 63.73 3h1j n SER 247 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3h1j h PRO 248 N 4.07 -0.08 -0.60 -1.46 0.11 -1.53 -2.18 132.00 130.34 3h1j h PRO 248 Ca 0.17 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.29 3h1j h PRO 248 Cb 0.69 0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.82 3h1j h PRO 248 CO 0.77 -0.05 0.00 0.09 -0.21 0.00 0.00 178.00 178.60 3h1j n ASN 249 N -5.45 3.42 0.04 -2.05 3.02 -1.26 -4.52 115.26 108.46 3h1j n ASN 249 Ca 0.06 -2.26 -0.12 0.00 -0.03 0.00 0.00 54.58 52.24 3h1j n ASN 249 Cb 0.35 -0.46 -0.06 0.00 -0.61 0.00 0.00 39.78 39.01 3h1j n ASN 249 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3h1j h LEU 250 N 2.99 -1.12 0.00 3.41 5.85 -1.74 -0.84 115.31 123.86 3h1j h LEU 250 Ca 0.00 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3h1j h LEU 250 Cb 1.03 0.45 0.00 0.00 0.37 0.00 0.00 40.66 42.51 3h1j h LEU 250 CO 0.14 -0.41 0.00 0.18 -0.34 0.00 0.00 178.44 178.00 3h1j n LEU 251 N -5.43 0.00 -4.57 2.25 4.77 -1.26 -4.84 117.00 107.91 3h1j n LEU 251 Ca -0.05 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.63 3h1j n LEU 251 Cb 0.35 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.33 3h1j n LEU 251 CO 0.16 0.00 -0.42 -0.83 -1.33 0.00 0.00 177.39 174.98 3h1j s GLY 252 N -1.83 1.76 0.17 -0.72 0.00 -0.32 -4.72 107.32 101.66 3h1j s GLY 252 Ca 0.37 -1.17 -0.30 0.00 0.00 0.00 0.00 44.72 43.62 3h1j s GLY 252 CO 0.29 -1.11 1.17 -0.35 0.00 0.00 0.00 173.10 173.10 3h1j s ASP 253 N -1.91 7.14 0.02 1.64 -1.08 -1.26 -4.93 116.67 116.30 3h1j s ASP 253 Ca 0.20 2.17 0.28 0.00 -0.52 0.00 0.00 52.55 54.67 3h1j s ASP 253 Cb -0.11 -2.60 0.98 0.00 -1.46 0.00 0.00 42.92 39.73 3h1j s ASP 253 CO 0.11 -0.33 1.76 -0.81 0.52 0.00 0.00 175.17 176.42 3h1j n PRO 254 N 2.58 0.03 0.29 4.34 -0.04 -1.26 -3.37 135.00 137.56 3h1j n PRO 254 Ca 0.04 0.02 0.18 0.00 -0.04 0.00 0.00 63.50 63.70 3h1j n PRO 254 Cb 0.45 -1.53 0.78 0.00 -0.04 0.00 0.00 33.50 33.16 3h1j n PRO 254 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3h1j h GLU 255 N 0.00 0.00 -0.87 0.54 4.57 -1.95 -2.80 114.58 114.07 3h1j h GLU 255 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 3h1j h GLU 255 Cb 0.53 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.10 3h1j h GLU 255 CO 0.00 0.02 0.03 -1.71 -1.18 0.00 0.00 179.01 176.18 3h1j n ASN 256 N -3.15 2.76 -0.98 1.04 5.15 -1.22 -3.08 115.26 115.79 3h1j n ASN 256 Ca -0.00 -2.36 0.10 0.00 -0.60 0.00 0.00 54.58 51.71 3h1j n ASN 256 Cb 0.26 -0.57 0.20 0.00 -0.53 0.00 0.00 39.78 39.14 3h1j n ASN 256 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 3h1j n PHE 257 N 0.18 0.51 -3.85 1.20 3.01 -1.06 -4.56 117.46 112.89 3h1j n PHE 257 Ca 0.11 -0.32 -0.36 0.00 1.01 0.00 0.00 57.45 57.89 3h1j n PHE 257 Cb 0.63 -0.01 -0.13 0.00 -0.01 0.00 0.00 39.48 39.96 3h1j n PHE 257 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 3h1j s THR 258 N -1.21 3.56 0.25 4.37 2.01 -1.18 -5.00 115.64 118.43 3h1j s THR 258 Ca 0.33 -0.66 -0.30 0.00 0.31 0.00 0.00 61.69 61.37 3h1j s THR 258 Cb 0.19 -2.75 -0.15 0.00 0.01 0.00 0.00 72.50 69.81 3h1j s THR 258 CO 0.26 0.24 1.06 -2.65 -0.69 0.00 0.00 174.62 172.84 3h1j n PRO 259 N 4.80 1.29 -1.56 4.92 -0.02 -1.26 0.21 135.00 143.39 3h1j n PRO 259 Ca -0.16 0.46 -0.54 0.00 -2.02 0.00 0.00 63.50 61.23 3h1j n PRO 259 Cb 0.49 -1.87 -0.06 0.00 -0.02 0.00 0.00 33.50 32.03 3h1j n PRO 259 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h1j n ALA 260 N 0.70 -1.89 -3.98 3.55 0.00 -0.96 -4.28 120.51 113.65 3h1j n ALA 260 Ca 0.12 0.54 -0.31 0.00 0.00 0.00 0.00 53.44 53.79 3h1j n ALA 260 Cb 0.29 -1.96 -0.15 0.00 0.00 0.00 0.00 19.45 17.64 3h1j n ALA 260 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3h1j s ASN 261 N 0.26 4.63 0.60 0.00 3.84 -1.26 -4.92 114.94 118.10 3h1j s ASN 261 Ca 0.85 -2.02 0.26 0.00 0.21 0.00 0.00 52.86 52.16 3h1j s ASN 261 Cb -1.05 -1.52 1.42 0.00 -0.55 0.00 0.00 41.25 39.55 3h1j s ASN 261 CO 0.51 -0.37 1.78 -0.65 -2.79 0.00 0.00 177.10 175.58 3h1j h PRO 262 N 7.69 0.00 -0.02 0.43 0.11 -2.00 -1.41 132.00 136.80 3h1j h PRO 262 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3h1j h PRO 262 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3h1j h PRO 262 CO 0.51 0.00 -0.11 1.28 -0.21 0.00 0.00 178.00 179.47 3h1j n LEU 263 N -2.73 2.34 -3.61 2.35 4.77 -1.26 -4.93 117.00 113.93 3h1j n LEU 263 Ca -0.02 -0.93 -0.20 0.00 -0.03 0.00 0.00 56.01 54.83 3h1j n LEU 263 Cb 0.39 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.32 3h1j n LEU 263 CO 0.12 0.41 -0.27 -0.69 -1.33 0.00 0.00 177.39 175.63 3h1j s VAL 264 N -1.73 -0.21 -0.19 4.08 1.01 -0.53 -5.11 120.40 117.72 3h1j s VAL 264 Ca 0.20 0.13 -0.19 0.00 0.00 0.00 0.00 61.98 62.12 3h1j s VAL 264 Cb 0.15 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 3h1j s VAL 264 CO 0.30 -0.03 0.56 -0.89 0.00 0.00 0.00 175.10 175.04 3h1j s THR 265 N 2.25 5.08 0.44 3.92 2.01 -1.26 -4.66 115.64 123.41 3h1j s THR 265 Ca 0.04 1.05 -0.24 0.00 0.31 0.00 0.00 61.69 62.85 3h1j s THR 265 Cb -0.14 -3.88 -0.10 0.00 0.01 0.00 0.00 72.50 68.39 3h1j s THR 265 CO -0.08 0.16 1.01 -2.65 -0.69 0.00 0.00 174.62 172.38 3h1j n PRO 266 N 4.78 1.33 -0.08 4.92 -0.02 -1.26 -4.86 135.00 139.81 3h1j n PRO 266 Ca -0.04 0.48 0.01 0.00 -2.02 0.00 0.00 63.50 61.93 3h1j n PRO 266 Cb 0.50 -2.06 0.30 0.00 -0.02 0.00 0.00 33.50 32.22 3h1j n PRO 266 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3h1j h PRO 267 N 1.47 0.71 -4.47 0.52 0.13 -2.05 -3.35 132.00 124.95 3h1j h PRO 267 Ca -0.45 -0.09 -0.70 0.00 -0.87 0.00 0.00 66.00 63.90 3h1j h PRO 267 Cb 1.34 -0.14 -0.34 0.00 0.13 0.00 0.00 31.00 31.99 3h1j h PRO 267 CO 0.56 0.56 -0.54 -1.01 -0.23 0.00 0.00 178.00 177.35 3h1j s HIS 268 N -5.40 3.57 -0.23 1.56 3.76 -1.26 -5.05 115.29 112.24 3h1j s HIS 268 Ca -0.09 -2.36 0.01 0.00 -0.15 0.00 0.00 55.06 52.47 3h1j s HIS 268 Cb 0.17 -3.23 0.06 0.00 1.11 0.00 0.00 32.58 30.69 3h1j s HIS 268 CO 0.77 -0.97 -0.05 -1.50 -0.85 0.00 0.00 174.74 172.13 3h1j s ILE 269 N 1.16 1.52 -0.02 0.60 2.07 -1.26 -5.02 121.20 120.26 3h1j s ILE 269 Ca 0.08 -1.22 0.06 0.00 -1.41 0.00 0.00 60.65 58.16 3h1j s ILE 269 Cb -0.23 -1.79 -0.01 0.00 0.13 0.00 0.00 42.46 40.55 3h1j s ILE 269 CO -0.04 -0.10 -0.22 -0.54 -1.91 0.00 0.00 174.94 172.13 3h1j s LYS 270 N 1.40 1.86 0.79 3.50 -0.14 -1.26 -5.13 119.74 120.76 3h1j s LYS 270 Ca -0.06 -0.78 -0.14 0.00 -1.36 0.00 0.00 55.97 53.64 3h1j s LYS 270 Cb -0.19 -1.75 0.08 0.00 -1.68 0.00 0.00 37.83 34.29 3h1j s LYS 270 CO -0.06 0.43 1.21 -2.14 -0.76 0.00 0.00 175.35 174.04 3h1j s PRO 271 N -0.41 1.71 0.37 -1.68 0.02 -1.26 -4.93 135.00 128.83 3h1j s PRO 271 Ca 0.06 1.78 -0.27 0.00 0.02 0.00 0.00 61.00 62.59 3h1j s PRO 271 Cb -0.09 -1.78 -0.11 0.00 0.02 0.00 0.00 34.50 32.53 3h1j s PRO 271 CO 0.00 -2.17 1.19 0.39 -0.33 0.00 0.00 177.00 176.09 3h1j n GLU 272 N -3.19 1.82 -0.32 5.54 4.71 -1.26 -4.65 120.64 123.28 3h1j n GLU 272 Ca 0.14 0.64 0.22 0.00 -0.01 0.00 0.00 57.16 58.15 3h1j n GLU 272 Cb 0.50 -2.22 0.43 0.00 -1.01 0.00 0.00 31.44 29.14 3h1j n GLU 272 CO 0.00 0.00 0.00 0.11 0.09 0.00 0.00 177.13 177.33 3h1j h TRP 273 N 2.14 0.69 0.00 -0.32 5.08 -1.92 0.43 115.95 122.06 3h1j h TRP 273 Ca -0.45 0.04 0.00 0.00 1.08 0.00 0.00 58.89 59.56 3h1j h TRP 273 Cb 1.30 -0.14 0.00 0.00 -3.00 0.00 0.00 29.16 27.32 3h1j h TRP 273 CO 0.48 -0.26 0.00 2.48 -1.28 0.00 0.00 178.44 179.86 3h1j n TYR 274 N -5.17 0.00 0.21 0.12 0.18 -1.26 -2.21 117.16 109.04 3h1j n TYR 274 Ca 0.30 0.00 0.04 0.00 1.88 0.00 0.00 57.90 60.12 3h1j n TYR 274 Cb 0.94 -0.10 -0.05 0.00 -0.38 0.00 0.00 39.34 39.75 3h1j n TYR 274 CO 0.00 0.00 0.00 1.19 -2.08 0.00 0.00 176.86 175.97 3h1j n PHE 275 N -1.10 0.00 -0.17 -3.48 3.72 0.15 -4.76 117.46 111.82 3h1j n PHE 275 Ca 0.08 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.43 3h1j n PHE 275 Cb 0.06 -0.08 0.02 0.00 -0.94 0.00 0.00 39.48 38.54 3h1j n PHE 275 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3h1j h LEU 276 N 0.00 -0.95 -0.54 4.37 3.38 -1.31 0.66 115.31 120.92 3h1j h LEU 276 Ca 0.00 0.20 0.11 0.00 0.09 0.00 0.00 57.88 58.28 3h1j h LEU 276 Cb 0.27 0.49 -0.09 0.00 0.09 0.00 0.00 40.66 41.42 3h1j h LEU 276 CO 0.00 -0.28 0.04 2.19 0.09 0.00 0.00 178.44 180.48 3h1j h PHE 277 N -0.15 0.04 -0.17 1.13 -5.15 -1.79 0.48 116.94 111.34 3h1j h PHE 277 Ca 0.23 0.04 -0.04 0.00 -0.20 0.00 0.00 57.97 58.00 3h1j h PHE 277 Cb 0.52 0.06 -0.01 0.00 0.22 0.00 0.00 35.95 36.74 3h1j h PHE 277 CO -0.56 -0.09 -0.04 0.00 -2.00 0.00 0.00 178.31 175.62 3h1j h ALA 278 N 1.47 0.24 -0.65 12.09 0.00 -1.74 -2.12 119.26 128.55 3h1j h ALA 278 Ca 0.28 -0.24 0.14 0.00 0.00 0.00 0.00 54.91 55.09 3h1j h ALA 278 Cb 0.42 -0.06 -0.12 0.00 0.00 0.00 0.00 17.79 18.04 3h1j h ALA 278 CO -0.42 -0.01 -0.08 -0.92 0.00 0.00 0.00 179.25 177.82 3h1j h TYR 279 N 0.04 -0.20 0.07 0.00 3.20 0.27 -0.62 116.97 119.72 3h1j h TYR 279 Ca 0.04 0.05 0.02 0.00 3.14 0.00 0.00 58.73 61.98 3h1j h TYR 279 Cb 0.47 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.90 3h1j h TYR 279 CO 0.05 -0.24 -0.17 0.00 -1.64 0.00 0.00 178.16 176.16 3h1j h ALA 280 N 1.63 -0.26 -0.90 1.82 0.00 0.14 -1.63 119.26 120.05 3h1j h ALA 280 Ca 0.33 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.34 3h1j h ALA 280 Cb 0.53 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.51 3h1j h ALA 280 CO -0.62 -0.68 0.53 0.82 0.00 0.00 0.00 179.25 179.30 3h1j h ILE 281 N -0.31 0.87 -0.23 0.00 2.04 -0.48 -2.05 117.51 117.35 3h1j h ILE 281 Ca 0.03 -0.29 -0.11 0.00 1.00 0.00 0.00 64.86 65.50 3h1j h ILE 281 Cb 0.35 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 3h1j h ILE 281 CO -0.11 0.15 -0.32 0.25 0.00 0.00 0.00 178.15 178.12 3h1j h LEU 282 N 0.84 0.48 -1.16 1.44 6.46 -0.66 -2.81 115.31 119.90 3h1j h LEU 282 Ca 0.45 -0.18 -0.09 0.00 -0.12 0.00 0.00 57.88 57.95 3h1j h LEU 282 Cb 0.48 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 3h1j h LEU 282 CO -0.28 0.78 -0.39 0.03 -0.62 0.00 0.00 178.44 177.96 3h1j h ARG 283 N 0.41 0.06 -0.00 1.25 3.08 -0.62 -3.24 114.38 115.31 3h1j h ARG 283 Ca 0.05 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.10 3h1j h ARG 283 Cb 0.76 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 3h1j h ARG 283 CO 0.06 0.44 -0.14 0.77 -1.07 0.00 0.00 179.97 180.03 3h1j h SER 284 N 0.05 -0.40 -2.81 7.04 0.02 -1.17 -3.38 113.55 112.89 3h1j h SER 284 Ca 0.00 0.06 -0.56 0.00 -0.84 0.00 0.00 61.79 60.45 3h1j h SER 284 Cb 0.71 0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.39 3h1j h SER 284 CO 0.05 -0.19 1.05 -0.63 -1.14 0.00 0.00 176.83 175.97 3h1j s ILE 285 N -6.14 3.85 -0.09 3.27 1.09 -1.22 -4.86 121.20 117.10 3h1j s ILE 285 Ca -0.14 0.99 -0.04 0.00 -1.10 0.00 0.00 60.65 60.36 3h1j s ILE 285 Cb 0.08 -3.77 -0.10 0.00 -1.06 0.00 0.00 42.46 37.60 3h1j s ILE 285 CO 0.66 -0.24 2.90 -0.81 -0.10 0.00 0.00 174.94 177.36 3h1j n PRO 286 N 7.28 1.75 -3.77 2.79 -0.04 -1.26 -4.38 135.00 137.37 3h1j n PRO 286 Ca 0.17 -0.94 -0.13 0.00 -0.04 0.00 0.00 63.50 62.56 3h1j n PRO 286 Cb 0.45 -1.70 -0.11 0.00 -0.04 0.00 0.00 33.50 32.10 3h1j n PRO 286 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3h1j s ASN 287 N 1.62 -0.30 0.03 3.54 3.84 -1.26 -5.07 114.94 117.33 3h1j s ASN 287 Ca 0.43 0.59 -0.17 0.00 0.21 0.00 0.00 52.86 53.92 3h1j s ASN 287 Cb 0.23 0.59 -0.09 0.00 -0.55 0.00 0.00 41.25 41.43 3h1j s ASN 287 CO -0.03 -0.10 1.26 0.50 -2.79 0.00 0.00 177.10 175.94 3h1j h LYS 288 N 5.70 -0.53 -0.92 0.43 3.64 -1.97 -2.03 116.57 120.88 3h1j h LYS 288 Ca -0.26 0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.18 3h1j h LYS 288 Cb 1.19 0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 33.08 3h1j h LYS 288 CO 0.32 -0.35 0.61 1.25 -2.27 0.00 0.00 179.45 179.01 3h1j h LEU 289 N -0.55 1.03 0.35 5.20 5.85 -1.97 -2.31 115.31 122.92 3h1j h LEU 289 Ca -0.05 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 3h1j h LEU 289 Cb 0.45 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.23 3h1j h LEU 289 CO 0.04 0.73 -0.17 1.23 -0.34 0.00 0.00 178.44 179.93 3h1j h GLY 290 N 1.21 -0.49 0.08 3.75 0.00 -1.93 -0.07 103.07 105.62 3h1j h GLY 290 Ca 0.35 0.18 0.18 0.00 0.00 0.00 0.00 47.33 48.04 3h1j h GLY 290 CO -0.09 -0.18 0.45 -1.33 0.00 0.00 0.00 176.54 175.39 3h1j h GLY 291 N -0.49 1.49 0.76 4.60 0.00 -1.15 0.57 103.07 108.86 3h1j h GLY 291 Ca -0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 3h1j h GLY 291 CO 0.08 -0.11 -0.18 -2.08 0.00 0.00 0.00 176.54 174.25 3h1j h VAL 292 N 0.58 0.61 -0.92 4.60 2.07 -1.07 0.48 116.25 122.59 3h1j h VAL 292 Ca 0.51 -0.41 0.15 0.00 0.82 0.00 0.00 66.70 67.77 3h1j h VAL 292 Cb 0.82 0.81 -0.10 0.00 -1.52 0.00 0.00 31.29 31.30 3h1j h VAL 292 CO -0.42 0.08 0.53 -0.07 0.02 0.00 0.00 177.57 177.71 3h1j h LEU 293 N -0.75 0.69 0.04 2.57 3.38 0.08 0.44 115.31 121.76 3h1j h LEU 293 Ca -0.05 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3h1j h LEU 293 Cb 0.51 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3h1j h LEU 293 CO 0.09 0.30 -0.02 0.00 0.09 0.00 0.00 178.44 178.90 3h1j h ALA 294 N 1.58 -0.05 0.05 1.53 0.00 0.27 0.29 119.26 122.92 3h1j h ALA 294 Ca 0.50 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.40 3h1j h ALA 294 Cb 0.68 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 3h1j h ALA 294 CO -0.34 -0.50 -0.32 1.25 0.00 0.00 0.00 179.25 179.33 3h1j h LEU 295 N -0.10 -0.96 -0.28 0.00 5.85 0.14 0.61 115.31 120.58 3h1j h LEU 295 Ca -0.01 0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.90 3h1j h LEU 295 Cb 0.09 0.37 -0.07 0.00 0.37 0.00 0.00 40.66 41.42 3h1j h LEU 295 CO 0.01 -0.40 -0.20 0.00 -0.34 0.00 0.00 178.44 177.51 3h1j h ALA 296 N 0.18 -0.02 -0.96 1.25 0.00 -0.03 -1.71 119.26 117.98 3h1j h ALA 296 Ca 0.05 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3h1j h ALA 296 Cb 0.57 0.44 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 3h1j h ALA 296 CO -0.24 -0.61 0.63 0.00 0.00 0.00 0.00 179.25 179.03 3h1j h ALA 297 N 0.96 1.38 -0.15 0.00 0.00 0.29 0.15 119.26 121.88 3h1j h ALA 297 Ca 0.15 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.06 3h1j h ALA 297 Cb 0.41 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3h1j h ALA 297 CO -0.39 0.53 0.28 0.66 0.00 0.00 0.00 179.25 180.33 3h1j h SER 298 N 1.21 0.00 0.00 0.00 4.64 0.12 -0.72 113.55 118.81 3h1j h SER 298 Ca 0.38 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.52 3h1j h SER 298 Cb -0.01 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 3h1j h SER 298 CO -0.11 0.00 -1.61 0.52 -0.87 0.00 0.00 176.83 174.76 3h1j n VAL 299 N -3.39 0.60 0.18 0.95 0.31 -0.84 -4.59 118.33 111.56 3h1j n VAL 299 Ca 0.01 -0.19 0.16 0.00 -0.01 0.00 0.00 64.34 64.32 3h1j n VAL 299 Cb 0.38 -1.31 0.79 0.00 -0.91 0.00 0.00 33.84 32.79 3h1j n VAL 299 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3h1j h LEU 300 N -0.22 0.00 -2.09 7.52 3.38 -0.63 -1.83 115.31 121.44 3h1j h LEU 300 Ca -0.26 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.78 3h1j h LEU 300 Cb 1.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 3h1j h LEU 300 CO -0.11 0.00 0.33 -0.29 0.09 0.00 0.00 178.44 178.46 3h1j h ILE 301 N 0.00 0.33 -0.52 1.22 2.10 -1.35 -0.43 117.51 118.86 3h1j h ILE 301 Ca 0.10 0.00 0.15 0.00 1.08 0.00 0.00 64.86 66.19 3h1j h ILE 301 Cb 0.50 0.72 -0.02 0.00 -1.09 0.00 0.00 36.82 36.93 3h1j h ILE 301 CO -0.00 0.00 0.40 -0.07 -1.08 0.00 0.00 178.15 177.40 3h1j h LEU 302 N 0.00 0.00 -1.56 2.19 3.38 -1.60 0.17 115.31 117.89 3h1j h LEU 302 Ca 0.12 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 3h1j h LEU 302 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 3h1j h LEU 302 CO -0.00 0.00 -0.23 -0.26 0.09 0.00 0.00 178.44 178.04 3h1j h PHE 303 N 0.00 0.00 0.09 1.13 0.05 -1.30 -3.12 116.94 113.79 3h1j h PHE 303 Ca 0.24 0.00 -0.26 0.00 3.82 0.00 0.00 57.97 61.78 3h1j h PHE 303 Cb 1.04 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.98 3h1j h PHE 303 CO 0.00 0.23 -1.18 -0.07 -0.18 0.00 0.00 178.31 177.11 3h1j h LEU 304 N 0.00 0.31 -0.56 1.54 3.38 -0.84 -3.37 115.31 115.76 3h1j h LEU 304 Ca -0.00 -0.33 0.11 0.00 0.09 0.00 0.00 57.88 57.74 3h1j h LEU 304 Cb 0.46 -0.10 -0.10 0.00 0.09 0.00 0.00 40.66 41.01 3h1j h LEU 304 CO 0.03 1.26 -0.15 -0.38 0.09 0.00 0.00 178.44 179.29 3h1j n ILE 305 N -3.48 -0.24 -0.24 1.22 2.08 -1.18 0.88 119.36 118.40 3h1j n ILE 305 Ca -0.06 1.29 0.09 0.00 0.56 0.00 0.00 62.75 64.63 3h1j n ILE 305 Cb 1.00 -1.78 0.35 0.00 -0.75 0.00 0.00 39.64 38.47 3h1j n ILE 305 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 3h1j h PRO 306 N 0.00 0.73 -0.08 0.38 0.11 -1.80 -0.61 132.00 130.73 3h1j h PRO 306 Ca 0.26 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.33 3h1j h PRO 306 Cb 0.40 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.35 3h1j h PRO 306 CO -0.58 0.48 0.00 1.19 -0.21 0.00 0.00 178.00 178.89 3h1j n PHE 307 N -4.52 0.09 -0.16 0.65 3.72 0.25 -3.43 117.46 114.07 3h1j n PHE 307 Ca 0.14 -0.05 0.07 0.00 -0.05 0.00 0.00 57.45 57.57 3h1j n PHE 307 Cb 0.34 0.00 0.18 0.00 -0.94 0.00 0.00 39.48 39.07 3h1j n PHE 307 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3h1j n LEU 308 N -0.07 3.09 -4.60 4.37 4.77 -0.24 -4.93 117.00 119.40 3h1j n LEU 308 Ca 0.17 -1.92 -0.42 0.00 -0.03 0.00 0.00 56.01 53.81 3h1j n LEU 308 Cb 0.26 -0.27 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 3h1j n LEU 308 CO 0.14 0.76 0.67 -2.28 -1.33 0.00 0.00 177.39 175.35 3h1j s HIS 309 N -1.01 3.12 -0.04 -1.77 2.46 -1.19 -4.14 115.29 112.72 3h1j s HIS 309 Ca 0.28 0.73 0.06 0.00 0.47 0.00 0.00 55.06 56.61 3h1j s HIS 309 Cb 0.15 -3.46 -0.10 0.00 -0.13 0.00 0.00 32.58 29.04 3h1j s HIS 309 CO 0.20 -0.73 0.15 1.63 -2.47 0.00 0.00 174.74 173.52 3h1j n LYS 310 N 6.52 0.65 -1.71 2.88 4.76 -1.26 -5.04 118.16 124.97 3h1j n LYS 310 Ca 0.05 -0.05 -0.38 0.00 -2.87 0.00 0.00 58.31 55.06 3h1j n LYS 310 Cb 0.48 -1.12 0.05 0.00 -1.84 0.00 0.00 35.03 32.60 3h1j n LYS 310 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3h1j n SER 311 N -1.67 2.05 -0.30 4.39 2.88 -1.26 -4.60 113.62 115.10 3h1j n SER 311 Ca -0.01 0.90 0.13 0.00 -1.33 0.00 0.00 58.87 58.56 3h1j n SER 311 Cb 0.16 -1.52 0.45 0.00 -0.75 0.00 0.00 64.21 62.54 3h1j n SER 311 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3h1j n LYS 312 N -1.25 1.08 -4.26 -1.46 4.76 -1.26 -4.79 118.16 110.97 3h1j n LYS 312 Ca 0.13 -0.61 -0.29 0.00 -2.87 0.00 0.00 58.31 54.67 3h1j n LYS 312 Cb 0.46 -1.49 -0.10 0.00 -1.84 0.00 0.00 35.03 32.06 3h1j n LYS 312 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3h1j s GLN 313 N -2.34 1.98 0.02 1.97 -0.21 -1.26 -5.07 119.66 114.75 3h1j s GLN 313 Ca 0.29 -1.12 -0.17 0.00 0.02 0.00 0.00 55.36 54.38 3h1j s GLN 313 Cb 0.20 -2.21 -0.30 0.00 1.00 0.00 0.00 33.01 31.70 3h1j s GLN 313 CO 0.46 0.49 1.04 -0.09 -2.12 0.00 0.00 175.29 175.06 3h1j h ARG 314 N 3.54 0.52 -5.94 2.91 2.43 -1.87 -3.48 114.38 112.49 3h1j h ARG 314 Ca -0.49 -0.74 -0.58 0.00 -0.81 0.00 0.00 59.98 57.35 3h1j h ARG 314 Cb 1.17 0.26 -0.05 0.00 -0.42 0.00 0.00 29.97 30.93 3h1j h ARG 314 CO 0.50 1.33 -0.30 0.95 -1.51 0.00 0.00 179.97 180.95 3h1j s THR 315 N -2.82 1.65 -2.29 0.20 -4.23 -1.26 -3.52 115.64 103.36 3h1j s THR 315 Ca -0.11 -1.48 0.23 0.00 -1.18 0.00 0.00 61.69 59.15 3h1j s THR 315 Cb 0.04 -2.13 0.50 0.00 1.34 0.00 0.00 72.50 72.25 3h1j s THR 315 CO 0.90 0.00 1.45 0.23 -0.54 0.00 0.00 174.62 176.67 3h1j n MET 316 N -1.78 2.51 -0.24 3.99 2.81 -0.93 -4.39 117.12 119.08 3h1j n MET 316 Ca -0.01 -2.31 0.10 0.00 -1.81 0.00 0.00 57.70 53.67 3h1j n MET 316 Cb 0.64 -1.52 0.37 0.00 -0.71 0.00 0.00 33.22 32.00 3h1j n MET 316 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 3h1j h THR 317 N 4.21 0.89 -0.24 2.03 2.02 -1.84 -1.94 112.91 118.03 3h1j h THR 317 Ca 0.00 -0.24 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 3h1j h THR 317 Cb 0.94 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 3h1j h THR 317 CO 0.00 0.13 -0.01 0.49 0.37 0.00 0.00 175.52 176.50 3h1j n PHE 318 N -4.53 0.85 -3.79 3.16 0.99 -1.26 -4.81 117.46 108.07 3h1j n PHE 318 Ca 0.15 -1.03 -0.29 0.00 -0.00 0.00 0.00 57.45 56.29 3h1j n PHE 318 Cb 0.40 -0.33 -0.13 0.00 -1.00 0.00 0.00 39.48 38.43 3h1j n PHE 318 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 3h1j s ARG 319 N -2.92 1.76 0.36 -1.08 0.52 -0.73 -4.98 118.95 111.89 3h1j s ARG 319 Ca 0.41 -2.57 0.07 0.00 -0.52 0.00 0.00 55.73 53.13 3h1j s ARG 319 Cb 0.35 -2.80 0.77 0.00 0.52 0.00 0.00 34.95 33.79 3h1j s ARG 319 CO 0.06 -1.21 1.92 -1.00 0.02 0.00 0.00 175.30 175.10 3h1j h PRO 320 N 6.16 0.71 -0.06 3.54 0.13 -1.87 0.45 132.00 141.05 3h1j h PRO 320 Ca 0.05 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 3h1j h PRO 320 Cb 0.87 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.84 3h1j h PRO 320 CO 0.59 0.47 -0.08 -0.07 -0.23 0.00 0.00 178.00 178.68 3h1j h LEU 321 N 0.73 0.18 -0.69 1.56 3.38 -1.94 -2.63 115.31 115.90 3h1j h LEU 321 Ca 0.37 -0.51 0.05 0.00 0.09 0.00 0.00 57.88 57.88 3h1j h LEU 321 Cb 0.46 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 3h1j h LEU 321 CO -0.14 0.65 0.40 0.28 0.09 0.00 0.00 178.44 179.72 3h1j h SER 322 N -0.29 0.61 -0.91 -0.43 0.02 -1.78 -1.73 113.55 109.05 3h1j h SER 322 Ca 0.01 0.02 0.12 0.00 -0.84 0.00 0.00 61.79 61.10 3h1j h SER 322 Cb 0.61 -0.10 -0.09 0.00 0.14 0.00 0.00 62.40 62.96 3h1j h SER 322 CO 0.02 0.40 0.53 1.56 -1.14 0.00 0.00 176.83 178.20 3h1j h GLN 323 N 0.75 0.79 -0.16 3.45 4.20 -0.81 0.87 115.11 124.20 3h1j h GLN 323 Ca 0.30 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.88 3h1j h GLN 323 Cb 0.15 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.75 3h1j h GLN 323 CO -0.17 0.52 -0.22 1.15 -0.67 0.00 0.00 178.83 179.44 3h1j h THR 324 N 0.82 1.35 -0.77 -0.54 2.02 -1.02 -2.28 112.91 112.49 3h1j h THR 324 Ca 0.46 -1.44 0.10 0.00 0.77 0.00 0.00 66.41 66.30 3h1j h THR 324 Cb 0.52 1.91 -0.05 0.00 -1.74 0.00 0.00 68.15 68.79 3h1j h THR 324 CO -0.29 0.43 0.51 0.25 0.37 0.00 0.00 175.52 176.78 3h1j h LEU 325 N 0.06 0.62 0.63 2.58 5.85 -0.60 0.22 115.31 124.66 3h1j h LEU 325 Ca 0.02 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 3h1j h LEU 325 Cb 0.79 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 41.72 3h1j h LEU 325 CO 0.05 0.37 -0.30 0.15 -0.34 0.00 0.00 178.44 178.37 3h1j h PHE 326 N 0.68 -0.78 0.00 1.25 3.57 -0.62 -1.71 116.94 119.34 3h1j h PHE 326 Ca 0.36 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.83 3h1j h PHE 326 Cb 0.48 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.47 3h1j h PHE 326 CO -0.00 -0.44 -0.03 -1.49 -2.23 0.00 0.00 178.31 174.12 3h1j h TRP 327 N -1.00 0.00 -0.11 0.41 4.06 -0.94 -0.24 115.95 118.13 3h1j h TRP 327 Ca -0.09 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.82 3h1j h TRP 327 Cb 0.69 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.85 3h1j h TRP 327 CO -0.01 0.03 -0.11 1.25 -3.56 0.00 0.00 178.44 176.05 3h1j h LEU 328 N 0.00 0.28 -0.56 -4.49 5.85 -0.73 -2.25 115.31 113.41 3h1j h LEU 328 Ca -0.00 -0.48 0.05 0.00 0.84 0.00 0.00 57.88 58.28 3h1j h LEU 328 Cb 0.21 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 3h1j h LEU 328 CO 0.00 0.70 0.30 0.25 -0.34 0.00 0.00 178.44 179.36 3h1j h LEU 329 N -0.14 0.44 -0.67 2.25 5.85 -0.15 0.41 115.31 123.31 3h1j h LEU 329 Ca 0.02 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.80 3h1j h LEU 329 Cb 0.62 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 3h1j h LEU 329 CO 0.03 0.30 0.41 0.58 -0.34 0.00 0.00 178.44 179.42 3h1j h VAL 330 N 0.58 1.07 -0.14 1.05 2.07 -1.16 -1.03 116.25 118.69 3h1j h VAL 330 Ca 0.25 -0.27 -0.14 0.00 0.82 0.00 0.00 66.70 67.35 3h1j h VAL 330 Cb 0.14 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 3h1j h VAL 330 CO -0.16 0.15 -0.52 0.00 0.02 0.00 0.00 177.57 177.06 3h1j h ALA 331 N 1.29 0.84 -0.51 1.67 0.00 -0.80 -1.52 119.26 120.24 3h1j h ALA 331 Ca 0.27 -0.49 0.07 0.00 0.00 0.00 0.00 54.91 54.76 3h1j h ALA 331 Cb 0.04 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 3h1j h ALA 331 CO -0.11 0.68 0.19 -0.97 0.00 0.00 0.00 179.25 179.03 3h1j h ASN 332 N 0.31 0.21 -0.15 0.00 -0.73 0.72 0.20 115.58 116.13 3h1j h ASN 332 Ca 0.01 0.06 -0.03 0.00 1.87 0.00 0.00 56.30 58.21 3h1j h ASN 332 Cb 1.02 0.03 -0.01 0.00 0.27 0.00 0.00 38.32 39.63 3h1j h ASN 332 CO 0.09 0.15 -0.03 -0.07 -0.37 0.00 0.00 177.43 177.20 3h1j h LEU 333 N 0.37 0.29 -1.37 0.34 3.38 -1.02 -0.53 115.31 116.78 3h1j h LEU 333 Ca 0.24 -0.35 0.20 0.00 0.09 0.00 0.00 57.88 58.06 3h1j h LEU 333 Cb 0.25 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.84 3h1j h LEU 333 CO -0.24 0.57 0.61 0.25 0.09 0.00 0.00 178.44 179.72 3h1j h LEU 334 N 0.00 0.52 0.06 1.67 5.85 -0.75 0.43 115.31 123.09 3h1j h LEU 334 Ca 0.04 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3h1j h LEU 334 Cb 0.44 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.43 3h1j h LEU 334 CO 0.01 0.20 -0.03 0.40 -0.34 0.00 0.00 178.44 178.68 3h1j h ILE 335 N 0.51 1.23 -0.95 4.05 2.04 -0.12 -2.00 117.51 122.27 3h1j h ILE 335 Ca 0.50 -1.10 0.12 0.00 1.00 0.00 0.00 64.86 65.38 3h1j h ILE 335 Cb 1.10 1.94 -0.08 0.00 -0.74 0.00 0.00 36.82 39.04 3h1j h ILE 335 CO -0.23 0.27 0.58 -0.07 0.00 0.00 0.00 178.15 178.70 3h1j h LEU 336 N -0.58 0.84 -0.15 1.44 3.38 0.69 0.15 115.31 121.06 3h1j h LEU 336 Ca -0.01 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3h1j h LEU 336 Cb 0.51 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3h1j h LEU 336 CO 0.01 0.44 0.09 0.74 0.09 0.00 0.00 178.44 179.81 3h1j h THR 337 N 0.91 1.07 -0.15 0.22 2.02 -0.21 0.80 112.91 117.57 3h1j h THR 337 Ca 0.48 -0.18 0.04 0.00 0.77 0.00 0.00 66.41 67.53 3h1j h THR 337 Cb 0.50 0.91 -0.05 0.00 -1.74 0.00 0.00 68.15 67.77 3h1j h THR 337 CO -0.28 0.07 -0.16 -0.25 0.37 0.00 0.00 175.52 175.27 3h1j h TRP 338 N 0.17 -0.42 -0.53 3.16 7.01 -0.39 -1.92 115.95 123.04 3h1j h TRP 338 Ca 0.05 0.02 0.08 0.00 2.11 0.00 0.00 58.89 61.16 3h1j h TRP 338 Cb 0.03 0.21 -0.06 0.00 -2.10 0.00 0.00 29.16 27.23 3h1j h TRP 338 CO -0.05 -0.24 0.17 0.82 -2.79 0.00 0.00 178.44 176.35 3h1j h ILE 339 N -0.20 0.79 -0.99 2.65 1.08 -0.36 -1.58 117.51 118.90 3h1j h ILE 339 Ca 0.10 -0.12 0.26 0.00 -0.39 0.00 0.00 64.86 64.72 3h1j h ILE 339 Cb 0.34 0.42 -0.07 0.00 -3.07 0.00 0.00 36.82 34.45 3h1j h ILE 339 CO -0.26 0.06 0.67 1.23 -0.69 0.00 0.00 178.15 179.16 3h1j h GLY 340 N 0.34 0.64 1.80 5.37 0.00 -0.03 0.35 103.07 111.54 3h1j h GLY 340 Ca 0.26 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.47 3h1j h GLY 340 CO -0.28 -0.05 -0.02 -1.14 0.00 0.00 0.00 176.54 175.06 3h1j n SER 341 N -4.44 0.03 -4.87 0.19 3.41 -0.60 -4.84 113.62 102.49 3h1j n SER 341 Ca 0.22 0.23 -0.31 0.00 -0.26 0.00 0.00 58.87 58.75 3h1j n SER 341 Cb 0.91 -0.39 -0.05 0.00 -0.26 0.00 0.00 64.21 64.42 3h1j n SER 341 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3h1j s GLN 342 N -2.84 3.27 0.71 4.33 -1.52 0.12 -5.06 119.66 118.66 3h1j s GLN 342 Ca 0.19 -0.50 -0.16 0.00 -1.95 0.00 0.00 55.36 52.94 3h1j s GLN 342 Cb 0.19 -2.95 0.03 0.00 -0.22 0.00 0.00 33.01 30.06 3h1j s GLN 342 CO 0.51 0.60 1.23 -1.25 -0.25 0.00 0.00 175.29 176.13 3h1j s PRO 343 N -2.40 2.24 -1.14 2.91 0.04 -1.26 -4.86 135.00 130.53 3h1j s PRO 343 Ca 0.32 1.84 -0.22 0.00 0.04 0.00 0.00 61.00 62.98 3h1j s PRO 343 Cb -0.13 -1.84 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 3h1j s PRO 343 CO 0.25 -1.78 1.85 0.08 0.04 0.00 0.00 177.00 177.44 3h1j s VAL 344 N -1.83 3.69 0.22 -0.36 1.01 -1.26 -4.72 120.40 117.14 3h1j s VAL 344 Ca 0.76 -1.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.60 3h1j s VAL 344 Cb -0.31 -4.64 0.00 0.00 0.00 0.00 0.00 36.38 31.43 3h1j s VAL 344 CO 0.44 -1.30 0.45 -1.61 0.00 0.00 0.00 175.10 173.07 3h1j s GLU 345 N 5.94 1.43 0.42 2.72 2.02 -1.26 -4.96 118.70 125.01 3h1j s GLU 345 Ca 0.63 -1.14 -0.22 0.00 0.02 0.00 0.00 54.97 54.26 3h1j s GLU 345 Cb -0.01 0.46 -0.10 0.00 0.10 0.00 0.00 34.13 34.59 3h1j s GLU 345 CO 0.07 -0.59 0.99 -1.58 0.02 0.00 0.00 175.26 174.17 3h1j s HIS 346 N -3.97 3.29 -1.57 1.61 5.65 -1.26 -0.27 115.29 118.76 3h1j s HIS 346 Ca 0.18 1.64 0.29 0.00 0.25 0.00 0.00 55.06 57.42 3h1j s HIS 346 Cb 0.00 -2.97 1.28 0.00 -1.18 0.00 0.00 32.58 29.71 3h1j s HIS 346 CO 0.04 -0.33 1.90 -0.35 -0.65 0.00 0.00 174.74 175.35 3h1j n PRO 347 N -0.41 0.60 -0.19 2.88 -0.04 -1.26 -4.86 135.00 131.72 3h1j n PRO 347 Ca 0.06 -0.17 -0.06 0.00 -0.04 0.00 0.00 63.50 63.30 3h1j n PRO 347 Cb 0.52 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.48 3h1j n PRO 347 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3h1j h PHE 348 N 0.40 -0.97 -0.16 0.54 0.05 -1.57 -1.69 116.94 113.55 3h1j h PHE 348 Ca 0.00 0.07 0.03 0.00 3.82 0.00 0.00 57.97 61.90 3h1j h PHE 348 Cb 0.34 0.51 -0.07 0.00 2.00 0.00 0.00 35.95 38.74 3h1j h PHE 348 CO 0.00 -0.39 -0.52 0.82 -0.18 0.00 0.00 178.31 178.04 3h1j h ILE 349 N -0.19 0.03 -0.50 -0.55 2.04 -0.92 0.14 117.51 117.55 3h1j h ILE 349 Ca 0.21 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.09 3h1j h ILE 349 Cb 0.55 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 3h1j h ILE 349 CO -0.66 0.00 0.32 -0.29 0.00 0.00 0.00 178.15 177.52 3h1j h ILE 350 N -0.55 1.09 -0.38 -0.67 6.09 -1.80 -0.86 117.51 120.44 3h1j h ILE 350 Ca 0.05 -0.22 0.06 0.00 -1.37 0.00 0.00 64.86 63.38 3h1j h ILE 350 Cb 0.67 0.39 -0.05 0.00 0.47 0.00 0.00 36.82 38.30 3h1j h ILE 350 CO -0.44 0.12 0.05 0.40 -3.07 0.00 0.00 178.15 175.21 3h1j h ILE 351 N 0.64 0.78 0.12 2.19 2.04 -0.84 -0.40 117.51 122.04 3h1j h ILE 351 Ca 0.19 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 66.01 3h1j h ILE 351 Cb -0.03 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 3h1j h ILE 351 CO -0.07 0.03 -0.34 1.23 0.00 0.00 0.00 178.15 179.00 3h1j h GLY 352 N 0.17 -0.66 0.51 5.37 0.00 -0.22 0.41 103.07 108.65 3h1j h GLY 352 Ca 0.18 0.41 0.18 0.00 0.00 0.00 0.00 47.33 48.09 3h1j h GLY 352 CO -0.26 -0.25 0.55 1.46 0.00 0.00 0.00 176.54 178.04 3h1j h GLN 353 N -0.57 0.39 0.46 4.80 4.20 -0.61 0.15 115.11 123.93 3h1j h GLN 353 Ca 0.03 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 3h1j h GLN 353 Cb 0.60 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.30 3h1j h GLN 353 CO -0.20 0.26 -0.22 0.52 -0.67 0.00 0.00 178.83 178.52 3h1j h MET 354 N 0.40 -0.60 -0.84 1.46 2.86 -0.25 -0.71 114.93 117.25 3h1j h MET 354 Ca 0.41 0.04 0.21 0.00 -2.06 0.00 0.00 59.70 58.31 3h1j h MET 354 Cb 1.01 0.14 -0.15 0.00 0.06 0.00 0.00 31.60 32.66 3h1j h MET 354 CO -0.14 -0.40 0.07 0.00 1.06 0.00 0.00 176.91 177.50 3h1j h ALA 355 N -1.33 1.00 0.65 6.32 0.00 -0.17 1.64 119.26 127.37 3h1j h ALA 355 Ca -0.06 0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3h1j h ALA 355 Cb 0.48 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3h1j h ALA 355 CO 0.10 -0.46 -0.44 0.77 0.00 0.00 0.00 179.25 179.22 3h1j h SER 356 N 0.11 -1.12 -0.96 0.00 0.02 -0.74 0.81 113.55 111.68 3h1j h SER 356 Ca 0.49 0.07 0.16 0.00 -0.84 0.00 0.00 61.79 61.67 3h1j h SER 356 Cb 0.94 0.33 -0.10 0.00 0.14 0.00 0.00 62.40 63.71 3h1j h SER 356 CO -0.72 -0.65 0.57 0.25 -1.14 0.00 0.00 176.83 175.14 3h1j h LEU 357 N -1.03 0.76 0.44 5.07 5.85 0.68 -1.66 115.31 125.41 3h1j h LEU 357 Ca -0.09 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3h1j h LEU 357 Cb 0.84 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 3h1j h LEU 357 CO 0.07 0.32 -0.49 -1.28 -0.34 0.00 0.00 178.44 176.72 3h1j h SER 358 N 0.80 -1.37 -0.62 1.25 0.87 0.32 -2.75 113.55 112.06 3h1j h SER 358 Ca 0.53 0.12 0.06 0.00 -1.23 0.00 0.00 61.79 61.26 3h1j h SER 358 Cb 0.72 0.46 -0.09 0.00 -0.44 0.00 0.00 62.40 63.04 3h1j h SER 358 CO -0.34 -0.64 -0.55 0.22 -0.53 0.00 0.00 176.83 174.99 3h1j h TYR 359 N -0.95 -1.72 0.00 2.24 3.20 0.16 -0.71 116.97 119.19 3h1j h TYR 359 Ca -0.05 0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 3h1j h TYR 359 Cb 0.84 0.83 -0.00 0.00 1.54 0.00 0.00 36.73 39.94 3h1j h TYR 359 CO -0.28 -0.43 -0.05 0.74 -1.64 0.00 0.00 178.16 176.51 3h1j h PHE 360 N -0.23 0.00 0.02 -3.82 -1.00 -1.51 -2.80 116.94 107.61 3h1j h PHE 360 Ca 0.10 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.77 3h1j h PHE 360 Cb 0.50 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.07 3h1j h PHE 360 CO -0.84 0.05 -0.46 1.15 -1.61 0.00 0.00 178.31 176.59 3h1j h THR 361 N 0.00 1.51 -0.42 -1.55 2.02 -0.87 -0.27 112.91 113.34 3h1j h THR 361 Ca -0.00 -2.12 0.04 0.00 0.77 0.00 0.00 66.41 65.10 3h1j h THR 361 Cb 0.13 2.82 -0.02 0.00 -1.74 0.00 0.00 68.15 69.33 3h1j h THR 361 CO 0.01 0.60 0.28 0.40 0.37 0.00 0.00 175.52 177.17 3h1j h ILE 362 N -0.36 1.00 0.14 3.11 2.04 -0.98 0.76 117.51 123.23 3h1j h ILE 362 Ca -0.06 -0.14 -0.26 0.00 1.00 0.00 0.00 64.86 65.40 3h1j h ILE 362 Cb 1.23 0.57 0.01 0.00 -0.74 0.00 0.00 36.82 37.89 3h1j h ILE 362 CO 0.09 0.07 -1.28 -0.07 0.00 0.00 0.00 178.15 176.96 3h1j h LEU 363 N 0.40 0.45 0.00 1.44 3.38 -1.51 -2.26 115.31 117.21 3h1j h LEU 363 Ca 0.17 -0.89 -0.24 0.00 0.09 0.00 0.00 57.88 57.01 3h1j h LEU 363 Cb 0.19 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 3h1j h LEU 363 CO -0.04 1.58 -1.32 -0.07 0.09 0.00 0.00 178.44 178.68 3h1j h LEU 364 N -0.27 0.00 0.00 1.67 3.38 -0.95 -3.43 115.31 115.71 3h1j h LEU 364 Ca -0.26 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 3h1j h LEU 364 Cb 1.78 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.53 3h1j h LEU 364 CO 0.11 0.98 -0.40 -0.38 0.09 0.00 0.00 178.44 178.84 3h1j n ILE 365 N -3.20 1.05 0.19 1.22 5.41 0.17 -4.73 119.36 119.48 3h1j n ILE 365 Ca -0.08 0.27 -0.15 0.00 1.00 0.00 0.00 62.75 63.80 3h1j n ILE 365 Cb 0.98 -1.68 -0.07 0.00 -0.71 0.00 0.00 39.64 38.16 3h1j n ILE 365 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3h1j h LEU 366 N -0.16 -0.95 -0.14 1.39 3.38 -1.41 -2.30 115.31 115.12 3h1j h LEU 366 Ca -0.02 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.08 3h1j h LEU 366 Cb 0.37 0.33 -0.07 0.00 0.09 0.00 0.00 40.66 41.38 3h1j h LEU 366 CO -0.02 -0.47 -0.42 -0.26 0.09 0.00 0.00 178.44 177.37 3h1j h PHE 367 N -0.68 -1.20 -0.99 1.13 0.05 -1.65 0.42 116.94 114.01 3h1j h PHE 367 Ca -0.01 0.05 0.01 0.00 3.82 0.00 0.00 57.97 61.84 3h1j h PHE 367 Cb 0.63 0.55 -0.05 0.00 2.00 0.00 0.00 35.95 39.08 3h1j h PHE 367 CO -0.23 -0.47 0.66 -1.00 -0.18 0.00 0.00 178.31 177.09 3h1j h PRO 368 N -0.48 1.29 0.89 1.51 0.13 -1.71 -1.37 132.00 132.26 3h1j h PRO 368 Ca 0.08 -0.08 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 3h1j h PRO 368 Cb 0.62 -0.29 0.00 0.00 0.13 0.00 0.00 31.00 31.46 3h1j h PRO 368 CO -0.41 0.86 -0.47 1.15 -0.23 0.00 0.00 178.00 178.90 3h1j h THR 369 N 1.33 0.00 -0.63 1.56 2.02 -0.71 -1.76 112.91 114.73 3h1j h THR 369 Ca 0.37 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.71 3h1j h THR 369 Cb -0.13 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.24 3h1j h THR 369 CO -0.09 0.00 0.44 0.40 0.37 0.00 0.00 175.52 176.65 3h1j h ILE 370 N -1.25 0.74 -0.42 3.11 1.08 -0.10 0.60 117.51 121.28 3h1j h ILE 370 Ca -0.12 -0.05 -0.08 0.00 -0.39 0.00 0.00 64.86 64.22 3h1j h ILE 370 Cb 0.98 0.58 -0.01 0.00 -3.07 0.00 0.00 36.82 35.30 3h1j h ILE 370 CO 0.17 0.03 -0.04 1.23 -0.69 0.00 0.00 178.15 178.84 3h1j h GLY 371 N 0.15 0.83 0.81 5.37 0.00 -0.91 0.13 103.07 109.44 3h1j h GLY 371 Ca 0.31 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 3h1j h GLY 371 CO -0.04 0.59 0.02 -0.84 0.00 0.00 0.00 176.54 176.27 3h1j h THR 372 N 0.59 1.21 -0.25 4.70 2.02 -0.17 -1.78 112.91 119.22 3h1j h THR 372 Ca 0.11 -0.65 0.06 0.00 0.77 0.00 0.00 66.41 66.70 3h1j h THR 372 Cb 0.55 1.42 -0.05 0.00 -1.74 0.00 0.00 68.15 68.32 3h1j h THR 372 CO 0.03 0.19 -0.10 0.25 0.37 0.00 0.00 175.52 176.26 3h1j h LEU 373 N -0.02 -0.35 -1.54 2.58 5.85 -0.83 -1.39 115.31 119.60 3h1j h LEU 373 Ca 0.04 0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.89 3h1j h LEU 373 Cb 0.27 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 3h1j h LEU 373 CO 0.00 -0.13 0.36 -0.33 -0.34 0.00 0.00 178.44 178.00 3h1j h GLU 374 N -0.06 0.58 -0.46 1.25 5.08 -0.61 -1.59 114.58 118.77 3h1j h GLU 374 Ca 0.13 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 3h1j h GLU 374 Cb 0.26 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3h1j h GLU 374 CO -0.30 0.38 0.16 -0.91 -1.00 0.00 0.00 179.01 177.35 3h1j h ASN 375 N 0.60 0.65 -0.68 1.42 2.35 -0.36 -1.92 115.58 117.64 3h1j h ASN 375 Ca 0.22 -0.19 -0.04 0.00 -0.55 0.00 0.00 56.30 55.74 3h1j h ASN 375 Cb 0.15 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.31 3h1j h ASN 375 CO -0.06 0.67 0.27 0.11 -1.65 0.00 0.00 177.43 176.76 3h1j h LYS 376 N 0.60 1.05 0.00 0.81 1.57 -0.84 -0.78 116.57 118.99 3h1j h LYS 376 Ca 0.15 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3h1j h LYS 376 Cb 0.24 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3h1j h LYS 376 CO -0.01 0.86 0.00 0.52 -0.57 0.00 0.00 179.45 180.26 3h1j h MET 377 N 1.02 0.00 -0.01 3.15 2.86 -0.81 0.20 114.93 121.34 3h1j h MET 377 Ca 0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 3h1j h MET 377 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 3h1j h MET 377 CO -0.02 0.00 -0.22 1.28 1.06 0.00 0.00 176.91 179.01 3h1j n LEU 378 N -2.84 1.04 -0.98 1.22 4.77 -0.38 -4.91 117.00 114.92 3h1j n LEU 378 Ca -0.00 -0.27 -0.06 0.00 -0.03 0.00 0.00 56.01 55.64 3h1j n LEU 378 Cb 0.20 -0.11 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 3h1j n LEU 378 CO 0.22 0.19 -0.01 -3.20 -1.33 0.00 0.00 177.39 173.26 3h1j n ASN 379 N -0.58 -2.77 -0.46 -1.43 5.15 0.70 -5.10 115.26 110.77 3h1j n ASN 379 Ca 0.13 -0.07 0.06 0.00 -0.60 0.00 0.00 54.58 54.10 3h1j n ASN 379 Cb 0.35 -1.76 0.05 0.00 -0.53 0.00 0.00 39.78 37.89 3h1j n ASN 379 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44