#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1j s ALA 2 N 0.00 3.09 0.00 3.04 0.00 -1.26 -5.06 121.76 121.57 3h1j s ALA 2 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3h1j s ALA 2 Cb 0.00 -2.00 0.00 0.00 0.00 0.00 0.00 23.12 21.12 3h1j s ALA 2 CO 0.00 -0.48 0.69 -0.35 0.00 0.00 0.00 175.76 175.62 3h1j n PRO 3 N 4.90 0.00 -2.24 0.00 -0.04 -1.26 -4.72 135.00 131.64 3h1j n PRO 3 Ca -0.17 0.37 -0.33 0.00 -0.04 0.00 0.00 63.50 63.33 3h1j n PRO 3 Cb 0.51 -1.19 -0.01 0.00 -0.04 0.00 0.00 33.50 32.78 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 -2.37 5.97 0.00 3.54 2.20 -1.26 -4.94 114.94 118.08 3h1j s ASN 4 Ca 0.00 1.89 0.11 0.00 -0.94 0.00 0.00 52.86 53.92 3h1j s ASN 4 Cb 0.00 -2.55 0.33 0.00 -2.00 0.00 0.00 41.25 37.03 3h1j s ASN 4 CO 0.00 -1.04 1.26 -0.38 -2.94 0.00 0.00 177.10 174.00 3h1j n ILE 5 N -1.59 0.41 -0.01 0.54 2.08 -1.26 -3.71 119.36 115.81 3h1j n ILE 5 Ca 0.09 -0.42 -0.08 0.00 0.56 0.00 0.00 62.75 62.90 3h1j n ILE 5 Cb 0.53 0.22 -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 1.88 0.00 0.00 0.38 2.43 -1.94 -3.28 114.38 113.84 3h1j h ARG 6 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3h1j h ARG 6 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 3h1j h ARG 6 CO 0.00 0.54 -1.04 1.63 -1.51 0.00 0.00 179.97 179.59 3h1j n LYS 7 N -3.07 1.05 -0.14 0.20 5.02 -1.25 -3.25 118.16 116.72 3h1j n LYS 7 Ca -0.15 -0.03 -0.29 0.00 -2.02 0.00 0.00 58.31 55.82 3h1j n LYS 7 Cb 1.04 -1.35 -0.10 0.00 -0.02 0.00 0.00 35.03 34.59 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 -1.57 1.96 -4.66 4.39 3.41 -1.24 -4.76 113.62 111.15 3h1j n SER 8 Ca 0.02 0.31 -0.57 0.00 -0.26 0.00 0.00 58.87 58.37 3h1j n SER 8 Cb 0.32 -0.80 -0.07 0.00 -0.26 0.00 0.00 64.21 63.39 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 -4.20 1.73 -0.35 7.33 -0.00 -1.24 -4.77 115.22 113.73 3h1j n HIS 9 Ca -0.53 0.68 0.36 0.00 -0.00 0.00 0.00 57.72 58.24 3h1j n HIS 9 Cb 0.88 -2.36 0.75 0.00 -0.00 0.00 0.00 29.99 29.26 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 5.78 0.01 0.00 1.57 0.11 -1.94 0.31 132.00 137.84 3h1j h PRO 10 Ca -0.47 -0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.35 3h1j h PRO 10 Cb 1.34 -0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.40 3h1j h PRO 10 CO 0.88 0.01 -1.82 1.28 -0.21 0.00 0.00 178.00 178.14 3h1j n LEU 11 N -4.17 1.92 -0.33 2.35 4.77 -1.26 -4.39 117.00 115.89 3h1j n LEU 11 Ca 0.27 0.38 -0.00 0.00 -0.03 0.00 0.00 56.01 56.62 3h1j n LEU 11 Cb 1.30 -0.83 0.13 0.00 -2.33 0.00 0.00 43.42 41.68 3h1j n LEU 11 CO 0.40 0.26 1.23 -0.07 -1.33 0.00 0.00 177.39 177.88 3h1j h LEU 12 N -1.00 0.96 -1.25 2.23 3.38 -1.84 0.20 115.31 118.00 3h1j h LEU 12 Ca -0.43 -0.00 0.13 0.00 0.09 0.00 0.00 57.88 57.66 3h1j h LEU 12 Cb 1.34 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 3h1j h LEU 12 CO -0.26 0.64 0.79 0.50 0.09 0.00 0.00 178.44 180.20 3h1j h LYS 13 N 1.11 0.00 0.05 1.13 3.64 -0.36 0.32 116.57 122.47 3h1j h LYS 13 Ca 0.37 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.48 3h1j h LYS 13 Cb 0.05 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3h1j h LYS 13 CO -0.13 0.00 -1.44 0.52 -2.27 0.00 0.00 179.45 176.13 3h1j h MET 14 N 0.00 0.12 -0.77 1.90 2.86 -0.80 -2.11 114.93 116.13 3h1j h MET 14 Ca 0.20 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 3h1j h MET 14 Cb 1.79 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 33.49 3h1j h MET 14 CO -0.00 1.09 0.31 0.82 1.06 0.00 0.00 176.91 180.19 3h1j h ILE 15 N -0.59 1.26 -0.17 -1.22 5.03 -0.56 -1.19 117.51 120.06 3h1j h ILE 15 Ca -0.35 -0.80 -0.15 0.00 -0.12 0.00 0.00 64.86 63.44 3h1j h ILE 15 Cb 1.57 0.33 -0.01 0.00 -3.03 0.00 0.00 36.82 35.68 3h1j h ILE 15 CO -0.08 0.33 -0.52 -1.13 -0.68 0.00 0.00 178.15 176.07 3h1j h ASN 16 N 1.12 0.52 1.01 1.72 -1.24 -0.67 0.10 115.58 118.15 3h1j h ASN 16 Ca 0.26 -0.27 0.00 0.00 0.71 0.00 0.00 56.30 57.00 3h1j h ASN 16 Cb 0.21 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.11 3h1j h ASN 16 CO -0.02 0.95 0.00 -1.13 -1.29 0.00 0.00 177.43 175.94 3h1j h ASN 17 N 0.37 0.00 0.00 1.15 -1.24 -0.65 0.12 115.58 115.33 3h1j h ASN 17 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.02 3h1j h ASN 17 Cb 1.04 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.09 3h1j h ASN 17 CO 0.09 0.00 0.00 -1.54 -1.29 0.00 0.00 177.43 174.69 3h1j n SER 18 N -2.40 0.04 -0.27 1.15 3.41 -0.52 -4.38 113.62 110.66 3h1j n SER 18 Ca 0.03 -0.29 0.01 0.00 -0.26 0.00 0.00 58.87 58.35 3h1j n SER 18 Cb 0.30 0.42 0.01 0.00 -0.26 0.00 0.00 64.21 64.68 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 -0.42 0.24 0.04 1.04 4.77 0.35 -4.79 117.00 118.24 3h1j n LEU 19 Ca 0.00 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 55.15 3h1j n LEU 19 Cb 0.01 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3h1j n LEU 19 CO 0.00 0.20 0.00 -0.38 -1.33 0.00 0.00 177.39 175.88 3h1j n ILE 20 N -0.12 0.00 0.33 -0.08 5.41 -1.16 -4.30 119.36 119.44 3h1j n ILE 20 Ca 0.01 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.87 3h1j n ILE 20 Cb 0.60 -0.37 0.18 0.00 -0.71 0.00 0.00 39.64 39.35 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 -2.73 3.24 -4.69 4.38 8.00 0.41 -2.52 116.55 122.64 3h1j n ASP 21 Ca 0.00 -1.94 -0.42 0.00 0.71 0.00 0.00 54.79 53.14 3h1j n ASP 21 Cb 0.00 -0.20 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 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 -1.43 4.40 0.11 0.64 2.96 -1.25 -4.71 118.68 119.40 3h1j s LEU 22 Ca 0.34 2.71 -0.31 0.00 -0.22 0.00 0.00 54.13 56.65 3h1j s LEU 22 Cb 0.20 -3.56 -0.07 0.00 0.50 0.00 0.00 46.19 43.26 3h1j s LEU 22 CO 0.28 -1.00 1.28 -2.84 -1.32 0.00 0.00 176.35 172.76 3h1j s PRO 23 N 2.94 4.39 0.02 0.98 0.02 -1.26 -0.71 135.00 141.38 3h1j s PRO 23 Ca 0.81 1.93 0.03 0.00 0.02 0.00 0.00 61.00 63.79 3h1j s PRO 23 Cb -0.45 -3.28 -0.02 0.00 0.02 0.00 0.00 34.50 30.78 3h1j s PRO 23 CO 0.36 -0.31 -0.09 0.00 -0.33 0.00 0.00 177.00 176.64 3h1j s ALA 24 N 0.85 0.71 0.46 -1.55 0.00 -0.18 -4.70 121.76 117.36 3h1j s ALA 24 Ca 0.60 -0.58 -0.23 0.00 0.00 0.00 0.00 51.96 51.75 3h1j s ALA 24 Cb -0.33 -0.09 -0.09 0.00 0.00 0.00 0.00 23.12 22.60 3h1j s ALA 24 CO 0.31 0.11 0.97 -2.30 0.00 0.00 0.00 175.76 174.85 3h1j n PRO 25 N 2.18 1.22 0.16 0.00 -0.02 -1.26 -0.43 135.00 136.85 3h1j n PRO 25 Ca -0.17 0.44 0.13 0.00 -2.02 0.00 0.00 63.50 61.88 3h1j n PRO 25 Cb 0.56 -2.04 0.43 0.00 -0.02 0.00 0.00 33.50 32.43 3h1j n PRO 25 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3h1j h SER 26 N 1.27 0.00 -0.28 2.55 4.64 -1.79 -3.33 113.55 116.60 3h1j h SER 26 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3h1j h SER 26 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 3h1j h SER 26 CO 0.55 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.05 3h1j n ASN 27 N -2.53 2.84 -4.74 4.97 6.94 -1.26 -5.02 115.26 116.46 3h1j n ASN 27 Ca 0.04 -1.85 -0.42 0.00 -0.02 0.00 0.00 54.58 52.33 3h1j n ASN 27 Cb 0.37 -0.18 -0.02 0.00 -2.36 0.00 0.00 39.78 37.59 3h1j n ASN 27 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 3h1j n ILE 28 N 0.86 1.06 -2.36 1.53 -5.35 -1.25 -4.64 119.36 109.20 3h1j n ILE 28 Ca 0.13 -0.26 -0.01 0.00 -0.27 0.00 0.00 62.75 62.34 3h1j n ILE 28 Cb 0.44 -1.93 0.00 0.00 -1.74 0.00 0.00 39.64 36.42 3h1j n ILE 28 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3h1j n SER 29 N 2.10 0.04 0.13 7.28 3.41 -1.26 -4.94 113.62 120.38 3h1j n SER 29 Ca 0.08 -1.03 0.14 0.00 -0.26 0.00 0.00 58.87 57.81 3h1j n SER 29 Cb 0.36 -0.02 0.67 0.00 -0.26 0.00 0.00 64.21 64.97 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 -0.32 2.26 0.00 7.33 0.00 -2.03 -0.64 119.26 125.86 3h1j h ALA 30 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h1j h ALA 30 Cb 0.03 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3h1j h ALA 30 CO 0.01 -0.34 0.00 0.91 0.00 0.00 0.00 179.25 179.83 3h1j n TRP 31 N -4.45 0.00 0.18 0.00 7.02 -1.26 -0.55 117.44 118.37 3h1j n TRP 31 Ca 0.04 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.57 3h1j n TRP 31 Cb 0.36 0.00 0.08 0.00 -2.42 0.00 0.00 31.31 29.33 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 -0.79 0.17 0.26 -5.99 8.01 -0.25 -4.52 117.44 114.33 3h1j n TRP 32 Ca 0.04 -0.21 0.12 0.00 -1.31 0.00 0.00 57.50 56.14 3h1j n TRP 32 Cb 0.02 -0.01 0.11 0.00 -2.01 0.00 0.00 31.31 29.42 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 1.89 0.00 0.42 -0.99 4.21 -0.98 -3.35 115.58 116.78 3h1j h ASN 33 Ca 0.00 -0.04 -0.08 0.00 1.21 0.00 0.00 56.30 57.39 3h1j h ASN 33 Cb 0.54 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.72 3h1j h ASN 33 CO 0.00 0.02 -0.38 -0.26 -1.29 0.00 0.00 177.43 175.52 3h1j h PHE 34 N 0.00 0.00 -0.28 1.19 0.04 -1.79 -2.52 116.94 113.57 3h1j h PHE 34 Ca 0.00 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.84 3h1j h PHE 34 Cb 0.94 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 39.02 3h1j h PHE 34 CO 0.00 0.38 -0.21 0.78 -0.60 0.00 0.00 178.31 178.66 3h1j h GLY 35 N 1.23 -0.05 1.37 -1.45 0.00 -1.90 0.86 103.07 103.13 3h1j h GLY 35 Ca -0.00 0.26 -0.18 0.00 0.00 0.00 0.00 47.33 47.41 3h1j h GLY 35 CO 0.05 -0.19 -0.58 1.48 0.00 0.00 0.00 176.54 177.30 3h1j h SER 36 N -0.19 0.74 -0.46 0.19 4.64 -1.79 -1.56 113.55 115.12 3h1j h SER 36 Ca 0.15 -0.41 0.02 0.00 -0.47 0.00 0.00 61.79 61.08 3h1j h SER 36 Cb 0.42 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.27 3h1j h SER 36 CO -0.40 1.16 0.28 -0.07 -0.87 0.00 0.00 176.83 176.93 3h1j h LEU 37 N 0.49 0.45 -0.53 5.97 3.38 -0.95 0.87 115.31 124.99 3h1j h LEU 37 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.07 3h1j h LEU 37 Cb 1.16 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.73 3h1j h LEU 37 CO 0.12 0.33 0.10 -0.07 0.09 0.00 0.00 178.44 179.01 3h1j h LEU 38 N 0.56 -0.01 -0.34 1.67 3.38 0.94 1.07 115.31 122.58 3h1j h LEU 38 Ca 0.18 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 3h1j h LEU 38 Cb -0.00 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3h1j h LEU 38 CO -0.07 0.02 0.18 0.00 0.09 0.00 0.00 178.44 178.66 3h1j h ALA 39 N 1.42 0.43 -0.74 1.53 0.00 -0.15 -0.13 119.26 121.62 3h1j h ALA 39 Ca 0.27 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3h1j h ALA 39 Cb 0.38 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3h1j h ALA 39 CO -0.35 -0.04 0.34 0.28 0.00 0.00 0.00 179.25 179.48 3h1j h VAL 40 N 0.42 1.24 -0.06 0.00 2.07 0.31 -0.89 116.25 119.33 3h1j h VAL 40 Ca 0.12 -0.69 0.02 0.00 0.82 0.00 0.00 66.70 66.97 3h1j h VAL 40 Cb 0.07 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 3h1j h VAL 40 CO -0.02 0.29 -0.04 0.00 0.02 0.00 0.00 177.57 177.82 3h1j h LEU 42 N -0.04 -0.44 -0.02 0.00 5.85 -0.33 0.29 115.31 120.62 3h1j h LEU 42 Ca 0.04 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3h1j h LEU 42 Cb 0.10 0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 3h1j h LEU 42 CO -0.09 -0.16 0.01 0.24 -0.34 0.00 0.00 178.44 178.11 3h1j h MET 43 N -0.03 0.03 -0.84 1.25 2.86 -0.76 -1.88 114.93 115.55 3h1j h MET 43 Ca 0.19 -0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.88 3h1j h MET 43 Cb 0.33 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.92 3h1j h MET 43 CO -0.42 0.04 0.53 1.15 1.06 0.00 0.00 176.91 179.27 3h1j h THR 44 N 0.00 1.07 0.37 2.22 2.02 0.06 -0.81 112.91 117.84 3h1j h THR 44 Ca 0.01 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 3h1j h THR 44 Cb 0.02 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.44 3h1j h THR 44 CO -0.00 0.18 -0.18 1.56 0.37 0.00 0.00 175.52 177.45 3h1j h GLN 45 N 0.98 -0.47 -0.54 6.66 1.08 -0.24 -0.60 115.11 121.97 3h1j h GLN 45 Ca 0.36 0.03 0.11 0.00 -1.45 0.00 0.00 58.65 57.70 3h1j h GLN 45 Cb 0.12 0.11 -0.09 0.00 -0.05 0.00 0.00 27.48 27.56 3h1j h GLN 45 CO -0.15 -0.23 -0.04 0.82 -0.95 0.00 0.00 178.83 178.28 3h1j h ILE 46 N -0.65 0.53 0.93 2.54 2.04 -1.10 0.63 117.51 122.43 3h1j h ILE 46 Ca -0.05 -0.03 -0.05 0.00 1.00 0.00 0.00 64.86 65.74 3h1j h ILE 46 Cb 0.47 0.45 0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3h1j h ILE 46 CO 0.08 0.01 -0.45 0.25 0.00 0.00 0.00 178.15 178.05 3h1j h LEU 47 N 0.07 -1.06 -1.61 1.44 5.85 -1.04 0.20 115.31 119.16 3h1j h LEU 47 Ca 0.27 0.04 0.04 0.00 0.84 0.00 0.00 57.88 59.07 3h1j h LEU 47 Cb 0.43 0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 3h1j h LEU 47 CO -0.49 -0.73 0.32 0.71 -0.34 0.00 0.00 178.44 177.91 3h1j h THR 48 N -1.32 1.03 0.37 1.05 1.35 -0.86 -1.71 112.91 112.82 3h1j h THR 48 Ca -0.13 -0.17 -0.02 0.00 -0.55 0.00 0.00 66.41 65.54 3h1j h THR 48 Cb 0.96 0.48 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 3h1j h THR 48 CO 0.21 0.09 -0.18 1.23 -0.25 0.00 0.00 175.52 176.63 3h1j h GLY 49 N 0.50 -0.51 0.37 5.82 0.00 0.56 0.31 103.07 110.11 3h1j h GLY 49 Ca 0.20 0.19 0.08 0.00 0.00 0.00 0.00 47.33 47.79 3h1j h GLY 49 CO -0.05 -0.19 0.05 1.41 0.00 0.00 0.00 176.54 177.76 3h1j h LEU 50 N -0.56 -0.07 -0.75 3.11 3.38 0.03 0.33 115.31 120.77 3h1j h LEU 50 Ca -0.05 0.09 0.14 0.00 0.09 0.00 0.00 57.88 58.14 3h1j h LEU 50 Cb 0.42 0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.21 3h1j h LEU 50 CO 0.08 -0.00 0.31 -0.07 0.09 0.00 0.00 178.44 178.85 3h1j h LEU 51 N 0.17 0.31 -0.18 1.67 3.38 -0.99 -1.85 115.31 117.82 3h1j h LEU 51 Ca 0.22 0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.19 3h1j h LEU 51 Cb 0.30 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3h1j h LEU 51 CO -0.32 0.13 -0.28 -0.07 0.09 0.00 0.00 178.44 177.99 3h1j h LEU 52 N 0.47 0.55 -2.17 1.67 3.38 0.64 -3.03 115.31 116.81 3h1j h LEU 52 Ca 0.41 -0.53 0.04 0.00 0.09 0.00 0.00 57.88 57.89 3h1j h LEU 52 Cb 0.60 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3h1j h LEU 52 CO -0.39 0.97 0.29 0.00 0.09 0.00 0.00 178.44 179.40 3h1j h ALA 53 N 0.60 1.56 0.00 1.53 0.00 0.29 0.12 119.26 123.36 3h1j h ALA 53 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3h1j h ALA 53 Cb 0.85 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3h1j h ALA 53 CO 0.06 -0.35 0.00 0.52 0.00 0.00 0.00 179.25 179.48 3h1j h MET 54 N 0.00 0.00 0.00 0.00 2.86 -1.23 -3.11 114.93 113.45 3h1j h MET 54 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3h1j h MET 54 Cb 0.63 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.29 3h1j h MET 54 CO -0.00 0.00 0.00 0.72 1.06 0.00 0.00 176.91 178.69 3h1j n HIS 55 N -2.32 0.00 -2.52 -0.22 8.25 0.40 -5.06 115.22 113.74 3h1j n HIS 55 Ca 0.02 -0.31 -0.25 0.00 -0.26 0.00 0.00 57.72 56.93 3h1j n HIS 55 Cb 0.25 -0.03 0.04 0.00 1.12 0.00 0.00 29.99 31.37 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 -0.62 3.10 -0.27 4.41 5.04 -1.03 -4.68 117.35 123.30 3h1j s TYR 56 Ca 0.00 0.39 -0.02 0.00 -2.44 0.00 0.00 57.07 55.00 3h1j s TYR 56 Cb 0.00 -2.75 0.12 0.00 0.35 0.00 0.00 41.96 39.68 3h1j s TYR 56 CO 0.00 -0.86 0.27 0.99 -1.34 0.00 0.00 175.55 174.61 3h1j s THR 57 N -2.91 -0.37 -1.09 4.34 2.01 -1.26 -5.02 115.64 111.34 3h1j s THR 57 Ca 0.55 -0.43 -0.23 0.00 0.31 0.00 0.00 61.69 61.89 3h1j s THR 57 Cb -0.10 -0.92 -0.07 0.00 0.01 0.00 0.00 72.50 71.42 3h1j s THR 57 CO 0.42 -0.43 1.93 0.00 -0.69 0.00 0.00 174.62 175.85 3h1j s ALA 58 N 2.34 1.79 -0.28 7.40 0.00 -1.26 -3.07 121.76 128.68 3h1j s ALA 58 Ca 0.09 -1.94 -0.15 0.00 0.00 0.00 0.00 51.96 49.96 3h1j s ALA 58 Cb -0.14 -4.63 0.09 0.00 0.00 0.00 0.00 23.12 18.43 3h1j s ALA 58 CO -0.29 -5.03 0.68 0.34 0.00 0.00 0.00 175.76 171.46 3h1j s ASP 59 N 6.98 -0.99 0.29 0.00 2.15 -1.26 -4.55 116.67 119.29 3h1j s ASP 59 Ca 0.68 1.53 0.03 0.00 0.43 0.00 0.00 52.55 55.22 3h1j s ASP 59 Cb -0.03 1.58 0.72 0.00 -0.30 0.00 0.00 42.92 44.90 3h1j s ASP 59 CO 0.08 -0.23 1.65 0.71 -0.17 0.00 0.00 175.17 177.21 3h1j h THR 60 N 5.21 0.33 0.00 1.71 1.35 -1.90 0.95 112.91 120.57 3h1j h THR 60 Ca -0.27 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 3h1j h THR 60 Cb 1.20 0.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 3h1j h THR 60 CO 0.15 0.04 0.00 -1.54 -0.25 0.00 0.00 175.52 173.92 3h1j n SER 61 N -5.20 0.05 0.00 5.36 3.41 -1.26 -4.01 113.62 111.97 3h1j n SER 61 Ca 0.22 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.34 3h1j n SER 61 Cb 0.69 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 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 -1.55 0.00 -0.01 1.04 4.77 0.14 -4.85 117.00 116.54 3h1j n LEU 62 Ca 0.05 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.90 3h1j n LEU 62 Cb 0.24 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.25 3h1j n LEU 62 CO 0.19 0.00 0.50 0.00 -1.33 0.00 0.00 177.39 176.75 3h1j h ALA 63 N 0.00 -0.81 -0.31 -1.18 0.00 0.74 0.17 119.26 117.88 3h1j h ALA 63 Ca 0.00 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.93 3h1j h ALA 63 Cb 0.01 0.93 -0.07 0.00 0.00 0.00 0.00 17.79 18.66 3h1j h ALA 63 CO 0.00 -0.97 -0.19 0.35 0.00 0.00 0.00 179.25 178.44 3h1j h PHE 64 N -0.47 -0.50 -0.11 0.00 3.57 -1.78 -1.77 116.94 115.88 3h1j h PHE 64 Ca 0.03 0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.49 3h1j h PHE 64 Cb 0.55 0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 3h1j h PHE 64 CO -0.56 -0.27 -0.27 0.66 -2.23 0.00 0.00 178.31 175.63 3h1j h SER 65 N -0.16 0.19 -0.69 0.41 4.64 -1.81 -2.33 113.55 113.80 3h1j h SER 65 Ca 0.16 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 61.37 3h1j h SER 65 Cb 0.41 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.42 3h1j h SER 65 CO -0.41 0.47 0.21 0.77 -0.87 0.00 0.00 176.83 177.00 3h1j h SER 66 N 0.17 1.02 -0.44 4.97 4.64 0.20 0.46 113.55 124.58 3h1j h SER 66 Ca 0.03 -0.19 -0.04 0.00 -0.47 0.00 0.00 61.79 61.11 3h1j h SER 66 Cb 0.58 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 3h1j h SER 66 CO 0.04 0.96 0.11 0.58 -0.87 0.00 0.00 176.83 177.64 3h1j h VAL 67 N 1.05 1.23 -0.49 0.95 2.07 -1.22 0.26 116.25 120.10 3h1j h VAL 67 Ca 0.23 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.95 3h1j h VAL 67 Cb 0.31 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 3h1j h VAL 67 CO -0.01 0.28 0.31 0.00 0.02 0.00 0.00 177.57 178.18 3h1j h ALA 68 N 0.96 0.62 -0.66 1.67 0.00 -0.79 -1.23 119.26 119.84 3h1j h ALA 68 Ca 0.14 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3h1j h ALA 68 Cb 0.32 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3h1j h ALA 68 CO 0.00 0.04 0.40 1.25 0.00 0.00 0.00 179.25 180.95 3h1j h HIS 69 N 0.64 0.86 -0.53 0.00 -0.00 0.28 0.30 115.15 116.70 3h1j h HIS 69 Ca 0.18 0.00 0.10 0.00 -0.00 0.00 0.00 60.37 60.65 3h1j h HIS 69 Cb -0.05 -0.28 -0.08 0.00 -0.00 0.00 0.00 27.41 27.00 3h1j h HIS 69 CO -0.05 0.58 0.10 1.15 -0.00 0.00 0.00 177.93 179.71 3h1j h THR 70 N 0.90 0.68 -0.24 6.26 2.02 0.35 0.73 112.91 123.60 3h1j h THR 70 Ca 0.24 -0.08 -0.19 0.00 0.77 0.00 0.00 66.41 67.14 3h1j h THR 70 Cb -0.04 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 3h1j h THR 70 CO -0.05 0.04 -0.61 0.00 0.37 0.00 0.00 175.52 175.27 3h1j h ARG 72 N 0.61 0.00 0.00 0.00 3.08 0.08 -3.28 114.38 114.88 3h1j h ARG 72 Ca -0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.91 3h1j h ARG 72 Cb 1.22 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.25 3h1j h ARG 72 CO 0.13 0.49 -1.50 0.09 -1.07 0.00 0.00 179.97 178.12 3h1j n ASN 73 N -3.06 2.85 -4.69 7.04 3.02 0.25 -4.99 115.26 115.69 3h1j n ASN 73 Ca -0.09 -0.02 -0.42 0.00 -0.03 0.00 0.00 54.58 54.02 3h1j n ASN 73 Cb 0.91 -0.16 -0.03 0.00 -0.61 0.00 0.00 39.78 39.89 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 3.31 -0.21 2.41 1.01 -1.10 -4.91 120.40 118.74 3h1j s VAL 74 Ca -0.12 0.73 -0.39 0.00 0.00 0.00 0.00 61.98 62.20 3h1j s VAL 74 Cb 0.03 -3.47 -0.16 0.00 0.00 0.00 0.00 36.38 32.79 3h1j s VAL 74 CO 0.19 -0.00 1.68 0.00 0.00 0.00 0.00 175.10 176.97 3h1j n GLN 75 N 5.55 1.19 -0.96 2.72 1.13 -1.26 -0.15 117.38 125.59 3h1j n GLN 75 Ca 0.15 0.44 0.00 0.00 -1.94 0.00 0.00 57.00 55.64 3h1j n GLN 75 Cb 0.42 -2.12 0.00 0.00 0.11 0.00 0.00 30.24 28.65 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 4.94 0.00 -0.27 1.08 4.02 -1.26 -4.82 117.16 120.85 3h1j n TYR 76 Ca 0.25 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 58.19 3h1j n TYR 76 Cb 0.15 -1.71 0.27 0.00 -0.02 0.00 0.00 39.34 38.03 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 1.24 1.01 2.72 0.00 -0.67 -1.09 103.07 106.28 3h1j h GLY 77 Ca 0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 3h1j h GLY 77 CO 0.00 0.27 0.39 0.11 0.00 0.00 0.00 176.54 177.30 3h1j h TRP 78 N 0.95 0.97 -0.14 5.60 5.08 -1.70 -0.85 115.95 125.85 3h1j h TRP 78 Ca 0.38 -0.02 -0.01 0.00 1.08 0.00 0.00 58.89 60.31 3h1j h TRP 78 Cb 0.25 -0.31 -0.01 0.00 -3.00 0.00 0.00 29.16 26.10 3h1j h TRP 78 CO -0.00 0.68 0.04 1.25 -1.28 0.00 0.00 178.44 179.13 3h1j h LEU 79 N 0.97 0.22 -0.24 0.11 5.85 -1.63 -1.16 115.31 119.42 3h1j h LEU 79 Ca 0.25 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.75 3h1j h LEU 79 Cb 0.04 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3h1j h LEU 79 CO -0.04 0.39 0.12 0.40 -0.34 0.00 0.00 178.44 178.97 3h1j h ILE 80 N 0.03 1.00 -0.50 4.05 2.04 -1.11 0.14 117.51 123.16 3h1j h ILE 80 Ca 0.04 -0.09 0.02 0.00 1.00 0.00 0.00 64.86 65.84 3h1j h ILE 80 Cb 0.26 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 3h1j h ILE 80 CO 0.00 0.05 0.29 -0.09 0.00 0.00 0.00 178.15 178.40 3h1j h ARG 81 N 0.26 0.57 -0.04 2.37 1.12 -1.08 0.26 114.38 117.83 3h1j h ARG 81 Ca 0.10 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 58.94 3h1j h ARG 81 Cb 0.02 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 29.85 3h1j h ARG 81 CO -0.06 0.37 0.01 -0.91 -3.11 0.00 0.00 179.97 176.27 3h1j h ASN 82 N 0.58 0.00 -0.50 -3.80 -0.26 -0.49 0.18 115.58 111.29 3h1j h ASN 82 Ca 0.20 0.01 0.02 0.00 -0.56 0.00 0.00 56.30 55.97 3h1j h ASN 82 Cb 0.03 0.01 -0.03 0.00 -1.06 0.00 0.00 38.32 37.27 3h1j h ASN 82 CO -0.10 0.01 0.33 -0.07 -1.06 0.00 0.00 177.43 176.55 3h1j h LEU 83 N 0.03 0.52 -0.16 1.61 3.38 -0.45 0.24 115.31 120.48 3h1j h LEU 83 Ca 0.02 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 3h1j h LEU 83 Cb 0.01 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.64 3h1j h LEU 83 CO -0.02 0.37 -0.55 -0.74 0.09 0.00 0.00 178.44 177.59 3h1j h HIS 84 N 0.61 0.86 -0.12 1.13 2.76 -0.08 0.32 115.15 120.64 3h1j h HIS 84 Ca 0.20 -0.35 -0.02 0.00 -2.20 0.00 0.00 60.37 57.99 3h1j h HIS 84 Cb 0.03 -0.14 -0.00 0.00 1.55 0.00 0.00 27.41 28.85 3h1j h HIS 84 CO -0.00 1.15 -0.01 0.00 -1.30 0.00 0.00 177.93 177.77 3h1j h ALA 85 N 0.55 0.16 0.00 5.26 0.00 0.13 -2.67 119.26 122.69 3h1j h ALA 85 Ca -0.02 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 3h1j h ALA 85 Cb 1.17 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3h1j h ALA 85 CO 0.12 -0.14 -0.49 -0.91 0.00 0.00 0.00 179.25 177.83 3h1j h ASN 86 N -0.07 0.00 -0.46 0.00 4.21 -0.61 -3.04 115.58 115.60 3h1j h ASN 86 Ca 0.03 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.54 3h1j h ASN 86 Cb 0.38 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.56 3h1j h ASN 86 CO 0.01 0.49 0.29 1.23 -1.29 0.00 0.00 177.43 178.16 3h1j h GLY 87 N 2.60 0.66 -0.25 2.83 0.00 -0.29 -0.63 103.07 107.99 3h1j h GLY 87 Ca -0.00 -0.26 0.14 0.00 0.00 0.00 0.00 47.33 47.21 3h1j h GLY 87 CO 0.06 0.26 -0.05 0.00 0.00 0.00 0.00 176.54 176.81 3h1j h ALA 88 N 1.14 0.61 0.19 3.60 0.00 -1.36 0.32 119.26 123.78 3h1j h ALA 88 Ca 0.17 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 3h1j h ALA 88 Cb -0.03 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3h1j h ALA 88 CO -0.03 -0.41 -0.09 0.77 0.00 0.00 0.00 179.25 179.48 3h1j h SER 89 N 0.07 -0.22 0.17 0.00 0.02 -1.39 -1.95 113.55 110.25 3h1j h SER 89 Ca 0.35 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3h1j h SER 89 Cb 0.58 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.18 3h1j h SER 89 CO -0.62 0.01 0.00 -0.26 -1.14 0.00 0.00 176.83 174.82 3h1j h PHE 90 N -0.45 0.00 -0.12 3.45 -1.00 -0.32 0.53 116.94 119.03 3h1j h PHE 90 Ca -0.03 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.67 3h1j h PHE 90 Cb 0.35 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.91 3h1j h PHE 90 CO -0.01 0.00 -0.25 0.35 -1.61 0.00 0.00 178.31 176.79 3h1j h PHE 91 N 0.00 0.49 -0.16 -0.55 3.04 0.31 -1.38 116.94 118.69 3h1j h PHE 91 Ca 0.00 -0.18 -0.18 0.00 3.98 0.00 0.00 57.97 61.59 3h1j h PHE 91 Cb 0.08 -0.09 -0.00 0.00 2.56 0.00 0.00 35.95 38.50 3h1j h PHE 91 CO 0.00 0.87 -0.65 0.74 -2.02 0.00 0.00 178.31 177.25 3h1j h PHE 92 N -0.03 0.80 0.63 0.41 -1.00 -0.07 -0.19 116.94 117.49 3h1j h PHE 92 Ca 0.00 -0.32 -0.02 0.00 2.81 0.00 0.00 57.97 60.44 3h1j h PHE 92 Cb 0.85 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 40.25 3h1j h PHE 92 CO 0.10 1.09 -0.51 0.82 -1.61 0.00 0.00 178.31 178.21 3h1j h ILE 93 N 0.45 0.00 -0.58 -0.55 2.04 -0.06 0.12 117.51 118.93 3h1j h ILE 93 Ca -0.01 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.92 3h1j h ILE 93 Cb 1.23 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.24 3h1j h ILE 93 CO 0.12 0.00 0.23 0.00 0.00 0.00 0.00 178.15 178.51 3h1j h ILE 95 N 0.43 1.25 -0.16 0.00 2.10 -0.61 0.42 117.51 120.95 3h1j h ILE 95 Ca 0.28 -0.66 -0.00 0.00 1.08 0.00 0.00 64.86 65.56 3h1j h ILE 95 Cb 0.30 0.12 -0.01 0.00 -1.09 0.00 0.00 36.82 36.15 3h1j h ILE 95 CO -0.26 0.29 0.09 -0.26 -1.08 0.00 0.00 178.15 176.93 3h1j h PHE 96 N 1.20 0.21 -0.70 2.19 0.04 -0.14 0.24 116.94 119.98 3h1j h PHE 96 Ca 0.30 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 61.01 3h1j h PHE 96 Cb 0.06 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.11 3h1j h PHE 96 CO 0.01 0.19 0.23 -0.07 -0.60 0.00 0.00 178.31 178.07 3h1j h LEU 97 N 0.17 1.00 0.01 1.54 3.38 -0.99 -0.03 115.31 120.39 3h1j h LEU 97 Ca 0.06 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 57.88 3h1j h LEU 97 Cb 0.04 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 3h1j h LEU 97 CO -0.01 0.93 -0.22 -0.74 0.09 0.00 0.00 178.44 178.49 3h1j h HIS 98 N 1.03 -0.58 -0.60 1.13 2.76 -0.56 -0.29 115.15 118.05 3h1j h HIS 98 Ca 0.23 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.47 3h1j h HIS 98 Cb 0.28 0.26 -0.05 0.00 1.55 0.00 0.00 27.41 29.45 3h1j h HIS 98 CO 0.02 -0.31 0.33 0.82 -1.30 0.00 0.00 177.93 177.49 3h1j h ILE 99 N -0.36 0.97 0.19 6.26 2.04 -0.49 -2.07 117.51 124.05 3h1j h ILE 99 Ca 0.06 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.70 3h1j h ILE 99 Cb 0.43 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 3h1j h ILE 99 CO -0.19 0.11 -0.36 1.23 0.00 0.00 0.00 178.15 178.95 3h1j h GLY 100 N 0.62 -1.15 -0.90 5.37 0.00 -0.06 -1.72 103.07 105.24 3h1j h GLY 100 Ca 0.27 0.56 0.16 0.00 0.00 0.00 0.00 47.33 48.32 3h1j h GLY 100 CO -0.17 -0.34 -0.34 -0.09 0.00 0.00 0.00 176.54 175.61 3h1j h ARG 101 N -0.59 -0.02 -0.63 4.80 1.12 -0.89 0.26 114.38 118.43 3h1j h ARG 101 Ca -0.02 0.00 0.13 0.00 -1.11 0.00 0.00 59.98 58.98 3h1j h ARG 101 Cb 0.55 0.00 -0.09 0.00 -0.01 0.00 0.00 29.97 30.42 3h1j h ARG 101 CO -0.13 -0.01 0.12 0.78 -3.11 0.00 0.00 179.97 177.61 3h1j h GLY 102 N -0.02 0.80 0.81 2.80 0.00 -0.80 0.13 103.07 106.80 3h1j h GLY 102 Ca 0.36 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.65 3h1j h GLY 102 CO -0.95 -0.15 -0.00 -2.00 0.00 0.00 0.00 176.54 173.44 3h1j h LEU 103 N 0.24 0.34 -0.65 3.11 5.85 0.32 0.28 115.31 124.79 3h1j h LEU 103 Ca 0.34 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 3h1j h LEU 103 Cb 0.53 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 3h1j h LEU 103 CO -0.45 0.57 0.28 0.22 -0.34 0.00 0.00 178.44 178.72 3h1j h TYR 104 N 0.10 0.97 -0.58 1.25 3.20 -0.59 -3.10 116.97 118.22 3h1j h TYR 104 Ca 0.05 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3h1j h TYR 104 Cb 0.40 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.38 3h1j h TYR 104 CO 0.04 0.75 0.00 0.66 -1.64 0.00 0.00 178.16 177.96 3h1j n TYR 105 N -4.44 1.53 -3.69 -3.82 4.02 -0.01 -2.09 117.16 108.66 3h1j n TYR 105 Ca 0.05 -0.58 -0.26 0.00 -0.01 0.00 0.00 57.90 57.09 3h1j n TYR 105 Cb 0.15 -0.30 0.05 0.00 -0.02 0.00 0.00 39.34 39.22 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 0.94 -0.53 0.22 2.72 0.00 -0.65 -4.38 105.19 103.52 3h1j n GLY 106 Ca 0.24 0.22 0.11 0.00 0.00 0.00 0.00 46.02 46.60 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 -2.33 0.00 0.06 1.61 0.02 -1.26 -2.91 113.55 108.74 3h1j h SER 107 Ca -0.57 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.38 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 0.16 0.00 0.00 -1.14 0.00 0.00 176.83 176.46 3h1j n TYR 108 N -3.23 0.41 0.38 3.45 0.18 -1.25 -0.71 117.16 116.39 3h1j n TYR 108 Ca 0.01 0.21 0.07 0.00 1.88 0.00 0.00 57.90 60.07 3h1j n TYR 108 Cb 0.46 -0.83 0.31 0.00 -0.38 0.00 0.00 39.34 38.89 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 -1.92 0.15 -4.20 -3.48 4.77 -1.10 -3.06 117.00 108.17 3h1j n LEU 109 Ca -0.00 0.54 -0.44 0.00 -0.03 0.00 0.00 56.01 56.08 3h1j n LEU 109 Cb 0.04 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 3h1j n LEU 109 CO 0.06 -0.38 1.30 -1.22 -1.33 0.00 0.00 177.39 175.82 3h1j n TYR 110 N -1.68 4.05 -0.32 -1.77 4.01 0.11 -4.92 117.16 116.64 3h1j n TYR 110 Ca 0.02 -3.23 -0.01 0.00 -0.16 0.00 0.00 57.90 54.53 3h1j n TYR 110 Cb 0.15 -1.81 0.05 0.00 -0.31 0.00 0.00 39.34 37.42 3h1j n TYR 110 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 3h1j h LYS 111 N 6.33 -0.04 -0.65 -0.72 1.57 -1.81 -1.05 116.57 120.20 3h1j h LYS 111 Ca 0.27 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.99 3h1j h LYS 111 Cb 0.76 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.06 3h1j h LYS 111 CO 1.29 -0.03 0.13 0.93 -0.57 0.00 0.00 179.45 181.20 3h1j h GLU 112 N -0.04 1.06 -0.21 3.15 3.07 -1.91 0.19 114.58 119.88 3h1j h GLU 112 Ca 0.34 -0.27 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 3h1j h GLU 112 Cb 0.60 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.37 3h1j h GLU 112 CO -0.90 0.96 0.10 1.15 -1.40 0.00 0.00 179.01 178.93 3h1j h THR 113 N 0.98 1.14 0.59 1.13 2.02 -1.75 -0.46 112.91 116.56 3h1j h THR 113 Ca 0.20 -0.41 -0.03 0.00 0.77 0.00 0.00 66.41 66.94 3h1j h THR 113 Cb 0.40 1.02 0.01 0.00 -1.74 0.00 0.00 68.15 67.83 3h1j h THR 113 CO 0.01 0.14 -0.28 -0.25 0.37 0.00 0.00 175.52 175.50 3h1j h TRP 114 N 0.21 -0.74 -0.63 3.16 2.91 -0.95 -1.13 115.95 118.80 3h1j h TRP 114 Ca 0.07 -0.02 0.13 0.00 1.13 0.00 0.00 58.89 60.20 3h1j h TRP 114 Cb 0.13 0.24 -0.10 0.00 -0.51 0.00 0.00 29.16 28.92 3h1j h TRP 114 CO -0.02 -0.42 0.09 -0.91 -1.03 0.00 0.00 178.44 176.15 3h1j h ASN 115 N -0.89 -0.09 0.32 2.65 2.35 -0.58 0.74 115.58 120.08 3h1j h ASN 115 Ca -0.08 0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.75 3h1j h ASN 115 Cb 0.64 0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.21 3h1j h ASN 115 CO 0.13 -0.04 -0.23 0.71 -1.65 0.00 0.00 177.43 176.35 3h1j h THR 116 N 0.21 1.02 -0.55 2.81 1.35 -1.01 -1.33 112.91 115.40 3h1j h THR 116 Ca 0.33 -0.85 -0.02 0.00 -0.55 0.00 0.00 66.41 65.33 3h1j h THR 116 Cb 0.53 1.48 -0.03 0.00 -1.73 0.00 0.00 68.15 68.40 3h1j h THR 116 CO -0.46 0.23 0.28 1.23 -0.25 0.00 0.00 175.52 176.54 3h1j h GLY 117 N 0.87 0.85 1.54 5.82 0.00 0.17 0.84 103.07 113.16 3h1j h GLY 117 Ca -0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 3h1j h GLY 117 CO 0.03 0.39 0.13 -2.08 0.00 0.00 0.00 176.54 175.01 3h1j h VAL 118 N 0.75 1.17 -0.55 4.60 2.07 0.22 -0.04 116.25 124.46 3h1j h VAL 118 Ca 0.19 -0.57 -0.12 0.00 0.82 0.00 0.00 66.70 67.02 3h1j h VAL 118 Cb 0.10 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 3h1j h VAL 118 CO -0.03 0.21 -0.11 0.40 0.02 0.00 0.00 177.57 178.07 3h1j h ILE 119 N 0.58 1.27 0.45 4.57 1.08 -0.61 -0.96 117.51 123.89 3h1j h ILE 119 Ca 0.14 -1.27 -0.02 0.00 -0.39 0.00 0.00 64.86 63.32 3h1j h ILE 119 Cb 0.17 0.96 -0.00 0.00 -3.07 0.00 0.00 36.82 34.88 3h1j h ILE 119 CO -0.01 0.45 -0.24 -0.07 -0.69 0.00 0.00 178.15 177.59 3h1j h LEU 120 N 0.92 -0.59 -0.29 1.44 3.38 0.40 0.31 115.31 120.88 3h1j h LEU 120 Ca 0.14 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.21 3h1j h LEU 120 Cb 0.68 0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.53 3h1j h LEU 120 CO 0.05 -0.40 -0.20 0.25 0.09 0.00 0.00 178.44 178.24 3h1j h LEU 121 N -0.64 -0.64 -0.75 1.67 5.85 -0.93 0.74 115.31 120.61 3h1j h LEU 121 Ca -0.06 0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.86 3h1j h LEU 121 Cb 0.51 0.33 -0.06 0.00 0.37 0.00 0.00 40.66 41.81 3h1j h LEU 121 CO 0.08 -0.23 0.44 -0.07 -0.34 0.00 0.00 178.44 178.32 3h1j h LEU 122 N -0.17 0.68 -0.36 2.25 3.38 -0.96 0.31 115.31 120.43 3h1j h LEU 122 Ca 0.15 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.03 3h1j h LEU 122 Cb 0.41 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3h1j h LEU 122 CO -0.39 0.44 -0.25 0.74 0.09 0.00 0.00 178.44 179.07 3h1j h THR 123 N 0.81 1.28 -0.59 0.22 2.02 0.91 -1.54 112.91 116.03 3h1j h THR 123 Ca 0.33 -1.40 0.07 0.00 0.77 0.00 0.00 66.41 66.19 3h1j h THR 123 Cb 0.18 1.39 -0.06 0.00 -1.74 0.00 0.00 68.15 67.92 3h1j h THR 123 CO -0.18 0.46 0.27 0.25 0.37 0.00 0.00 175.52 176.69 3h1j h LEU 124 N 0.60 0.34 0.42 2.58 5.85 0.10 0.10 115.31 125.31 3h1j h LEU 124 Ca 0.07 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3h1j h LEU 124 Cb 0.81 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 3h1j h LEU 124 CO 0.07 0.22 -0.39 0.24 -0.34 0.00 0.00 178.44 178.23 3h1j h MET 125 N 0.49 -0.79 -0.71 1.25 2.86 -0.62 0.12 114.93 117.52 3h1j h MET 125 Ca 0.28 0.05 0.07 0.00 -2.06 0.00 0.00 59.70 58.04 3h1j h MET 125 Cb 0.26 0.18 -0.06 0.00 0.06 0.00 0.00 31.60 32.04 3h1j h MET 125 CO -0.23 -0.53 0.39 0.00 1.06 0.00 0.00 176.91 177.60 3h1j h ALA 126 N -0.45 0.97 0.23 6.32 0.00 -0.84 -1.47 119.26 124.02 3h1j h ALA 126 Ca -0.04 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3h1j h ALA 126 Cb 0.73 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3h1j h ALA 126 CO -0.04 0.05 -0.28 1.15 0.00 0.00 0.00 179.25 180.12 3h1j h THR 127 N 0.70 0.40 -0.03 0.00 2.02 -0.37 -1.69 112.91 113.94 3h1j h THR 127 Ca 0.33 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.52 3h1j h THR 127 Cb 0.25 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 3h1j h THR 127 CO -0.21 0.00 0.03 0.00 0.37 0.00 0.00 175.52 175.71 3h1j h ALA 128 N 0.08 1.70 0.24 6.16 0.00 -0.42 -1.49 119.26 125.53 3h1j h ALA 128 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3h1j h ALA 128 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3h1j h ALA 128 CO -0.09 -0.05 -0.12 0.35 0.00 0.00 0.00 179.25 179.35 3h1j h PHE 129 N 0.00 -0.30 -0.84 0.00 3.57 -0.45 -2.66 116.94 116.27 3h1j h PHE 129 Ca 0.02 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.68 3h1j h PHE 129 Cb 0.08 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 38.86 3h1j h PHE 129 CO 0.00 -0.19 0.55 -0.39 -2.23 0.00 0.00 178.31 176.06 3h1j h VAL 130 N -0.67 0.75 -0.28 1.41 -1.51 -1.20 -0.59 116.25 114.17 3h1j h VAL 130 Ca -0.03 -0.16 0.01 0.00 -1.23 0.00 0.00 66.70 65.29 3h1j h VAL 130 Cb 0.25 0.25 -0.02 0.00 -2.13 0.00 0.00 31.29 29.64 3h1j h VAL 130 CO 0.05 0.08 0.17 1.23 -1.23 0.00 0.00 177.57 177.88 3h1j h GLY 131 N 0.46 0.39 2.00 5.19 0.00 -1.32 -2.03 103.07 107.76 3h1j h GLY 131 Ca 0.42 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.61 3h1j h GLY 131 CO -0.16 0.12 -0.06 -1.82 0.00 0.00 0.00 176.54 174.62 3h1j h TYR 132 N 0.35 0.00 0.00 5.60 3.20 -0.73 -1.66 116.97 123.73 3h1j h TYR 132 Ca 0.11 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.98 3h1j h TYR 132 Cb -0.01 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.26 3h1j h TYR 132 CO -0.07 0.06 0.00 0.28 -1.64 0.00 0.00 178.16 176.78 3h1j n VAL 133 N -3.74 0.51 0.11 1.81 0.31 -0.77 -3.87 118.33 112.68 3h1j n VAL 133 Ca -0.02 0.07 -0.03 0.00 -0.01 0.00 0.00 64.34 64.35 3h1j n VAL 133 Cb 0.15 -0.75 0.15 0.00 -0.91 0.00 0.00 33.84 32.48 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 0.16 -0.30 7.52 3.38 -1.29 -2.80 115.31 121.97 3h1j h LEU 134 Ca 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3h1j h LEU 134 Cb 0.43 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3h1j h LEU 134 CO 0.00 0.71 0.00 -2.65 0.09 0.00 0.00 178.44 176.59 3h1j n PRO 135 N -3.86 0.14 -3.51 1.13 -0.02 -1.25 -4.61 135.00 123.02 3h1j n PRO 135 Ca -0.02 0.29 -0.19 0.00 -2.02 0.00 0.00 63.50 61.56 3h1j n PRO 135 Cb 0.60 -1.73 0.07 0.00 -0.02 0.00 0.00 33.50 32.42 3h1j n PRO 135 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 3h1j n TRP 136 N -1.99 -2.12 -2.98 6.00 -0.00 -1.06 -3.09 117.44 112.21 3h1j n TRP 136 Ca 0.04 0.88 -0.09 0.00 -0.00 0.00 0.00 57.50 58.32 3h1j n TRP 136 Cb 0.27 -4.67 0.03 0.00 -0.00 0.00 0.00 31.31 26.95 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 -1.32 1.86 0.18 5.87 0.00 -1.26 -2.17 105.19 108.36 3h1j n GLY 137 Ca -0.26 -2.16 -0.04 0.00 0.00 0.00 0.00 46.02 43.55 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 0.25 -0.09 1.61 1.08 0.10 -1.38 115.11 116.69 3h1j h GLN 138 Ca -0.13 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.05 3h1j h GLN 138 Cb 0.59 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.96 3h1j h GLN 138 CO 0.18 0.17 0.05 0.52 -0.95 0.00 0.00 178.83 178.79 3h1j h MET 139 N 0.26 0.12 -0.32 1.46 2.86 -1.84 -1.91 114.93 115.56 3h1j h MET 139 Ca 0.20 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.88 3h1j h MET 139 Cb 0.23 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 31.79 3h1j h MET 139 CO -0.24 0.18 -0.48 0.77 1.06 0.00 0.00 176.91 178.20 3h1j h SER 140 N 0.04 -1.56 0.25 1.22 0.02 -1.69 0.62 113.55 112.44 3h1j h SER 140 Ca 0.03 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 3h1j h SER 140 Cb 0.09 0.65 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 3h1j h SER 140 CO -0.00 -0.41 -0.27 0.15 -1.14 0.00 0.00 176.83 175.16 3h1j h PHE 141 N -0.41 -0.71 0.00 3.45 3.57 -1.17 0.18 116.94 121.85 3h1j h PHE 141 Ca 0.10 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.52 3h1j h PHE 141 Cb 0.61 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 3h1j h PHE 141 CO -0.62 -0.39 -0.40 -1.49 -2.23 0.00 0.00 178.31 173.18 3h1j h TRP 142 N -0.55 0.00 0.11 0.41 4.06 -1.07 0.04 115.95 118.95 3h1j h TRP 142 Ca -0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 3h1j h TRP 142 Cb 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.68 3h1j h TRP 142 CO -0.18 0.40 -0.05 0.78 -3.56 0.00 0.00 178.44 175.83 3h1j h GLY 143 N 1.71 -0.16 0.06 1.49 0.00 0.58 -1.02 103.07 105.74 3h1j h GLY 143 Ca -0.00 0.06 0.08 0.00 0.00 0.00 0.00 47.33 47.46 3h1j h GLY 143 CO 0.05 -0.06 -0.21 0.00 0.00 0.00 0.00 176.54 176.33 3h1j h ALA 144 N 0.42 0.04 -0.54 3.60 0.00 -0.62 0.48 119.26 122.64 3h1j h ALA 144 Ca -0.02 0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.11 3h1j h ALA 144 Cb 0.35 0.48 -0.07 0.00 0.00 0.00 0.00 17.79 18.54 3h1j h ALA 144 CO 0.03 -0.59 0.13 1.15 0.00 0.00 0.00 179.25 179.97 3h1j h THR 145 N -0.15 0.71 0.04 0.00 2.02 -0.81 -2.52 112.91 112.19 3h1j h THR 145 Ca 0.18 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.26 3h1j h THR 145 Cb 0.43 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 3h1j h THR 145 CO -0.45 0.05 -0.02 0.58 0.37 0.00 0.00 175.52 176.05 3h1j h VAL 146 N 0.27 1.36 0.10 3.16 2.07 -0.20 -2.75 116.25 120.27 3h1j h VAL 146 Ca 0.28 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 3h1j h VAL 146 Cb 0.37 2.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 3h1j h VAL 146 CO -0.34 0.35 -0.05 0.40 0.02 0.00 0.00 177.57 177.95 3h1j h ILE 147 N -0.69 0.96 -0.90 4.57 2.04 -0.95 -1.85 117.51 120.68 3h1j h ILE 147 Ca -0.00 -0.21 0.04 0.00 1.00 0.00 0.00 64.86 65.68 3h1j h ILE 147 Cb 0.62 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.74 3h1j h ILE 147 CO 0.01 0.05 0.58 0.71 0.00 0.00 0.00 178.15 179.50 3h1j h THR 148 N -0.23 1.13 -0.03 -0.27 1.35 -1.60 0.17 112.91 113.43 3h1j h THR 148 Ca -0.01 -0.38 0.01 0.00 -0.55 0.00 0.00 66.41 65.47 3h1j h THR 148 Cb 0.19 -0.08 -0.00 0.00 -1.73 0.00 0.00 68.15 66.53 3h1j h THR 148 CO 0.02 0.20 0.07 0.78 -0.25 0.00 0.00 175.52 176.35 3h1j h ASN 149 N 1.11 0.00 -0.90 5.36 -0.26 -1.12 -1.79 115.58 117.98 3h1j h ASN 149 Ca 0.37 0.00 0.21 0.00 -0.56 0.00 0.00 56.30 56.32 3h1j h ASN 149 Cb 0.05 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 37.24 3h1j h ASN 149 CO -0.13 0.00 0.60 -0.07 -1.06 0.00 0.00 177.43 176.77 3h1j h LEU 150 N 0.00 0.34 -1.32 1.61 3.38 -0.14 0.58 115.31 119.76 3h1j h LEU 150 Ca 0.01 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3h1j h LEU 150 Cb 0.16 -0.02 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 -0.26 0.09 0.00 0.00 178.44 178.40 3h1j h PHE 151 N 0.34 0.00 0.00 1.13 -1.00 -1.48 -2.45 116.94 113.47 3h1j h PHE 151 Ca 0.47 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.25 3h1j h PHE 151 Cb 1.27 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.83 3h1j h PHE 151 CO -0.00 0.00 0.04 0.66 -1.61 0.00 0.00 178.31 177.40 3h1j h SER 152 N 0.00 0.00 0.82 2.17 4.64 -1.06 -0.19 113.55 119.93 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 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 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 1.92 1.00 -2.40 5.18 0.00 -1.59 -3.41 119.26 119.95 3h1j h ALA 153 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 3h1j h ALA 153 Cb 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3h1j h ALA 153 CO 0.00 0.00 0.39 0.42 0.00 0.00 0.00 179.25 180.06 3h1j s ILE 154 N -3.65 4.87 0.48 0.00 1.01 -0.08 -4.93 121.20 118.89 3h1j s ILE 154 Ca 0.01 1.97 -0.21 0.00 0.00 0.00 0.00 60.65 62.42 3h1j s ILE 154 Cb 0.09 -4.28 -0.08 0.00 0.01 0.00 0.00 42.46 38.21 3h1j s ILE 154 CO 0.49 0.12 1.08 -2.16 0.00 0.00 0.00 174.94 174.47 3h1j s PRO 155 N 1.30 3.77 1.31 2.79 0.04 -1.26 -1.85 135.00 141.10 3h1j s PRO 155 Ca 0.49 1.51 0.00 0.00 0.04 0.00 0.00 61.00 63.04 3h1j s PRO 155 Cb -0.20 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.13 3h1j s PRO 155 CO 0.24 -0.49 0.00 0.66 0.04 0.00 0.00 177.00 177.45 3h1j n TYR 156 N -0.79 0.00 0.29 0.56 0.53 -1.26 -3.99 117.16 112.50 3h1j n TYR 156 Ca 0.09 0.00 0.04 0.00 -1.02 0.00 0.00 57.90 57.00 3h1j n TYR 156 Cb 0.51 0.00 0.17 0.00 -1.03 0.00 0.00 39.34 38.99 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 1.31 0.04 -0.72 -5.35 -1.26 -4.07 119.36 109.31 3h1j n ILE 157 Ca 0.00 0.33 -0.02 0.00 -0.27 0.00 0.00 62.75 62.79 3h1j n ILE 157 Cb 0.00 -1.20 -0.01 0.00 -1.74 0.00 0.00 39.64 36.69 3h1j n ILE 157 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3h1j h GLY 158 N 1.29 -0.63 1.56 3.28 0.00 -1.50 0.52 103.07 107.59 3h1j h GLY 158 Ca 0.00 0.27 0.04 0.00 0.00 0.00 0.00 47.33 47.64 3h1j h GLY 158 CO 0.00 -0.23 0.21 0.45 0.00 0.00 0.00 176.54 176.97 3h1j h HIS 159 N -0.13 0.25 0.00 5.60 3.86 -1.77 -0.29 115.15 122.66 3h1j h HIS 159 Ca -0.01 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 3h1j h HIS 159 Cb 0.11 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 3h1j h HIS 159 CO -0.02 0.14 -0.23 1.15 0.86 0.00 0.00 177.93 179.83 3h1j h THR 160 N 0.26 0.48 0.06 2.45 2.02 -1.73 -2.46 112.91 113.98 3h1j h THR 160 Ca 0.13 -1.31 -0.24 0.00 0.77 0.00 0.00 66.41 65.76 3h1j h THR 160 Cb 0.20 1.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 3h1j h THR 160 CO -0.03 0.23 -1.14 -0.07 0.37 0.00 0.00 175.52 174.88 3h1j h LEU 161 N 0.00 0.19 -0.09 2.58 3.38 0.86 -3.20 115.31 119.02 3h1j h LEU 161 Ca -0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3h1j h LEU 161 Cb 0.92 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 3h1j h LEU 161 CO 0.03 1.16 0.03 0.58 0.09 0.00 0.00 178.44 180.33 3h1j h VAL 162 N 0.03 1.17 -0.68 1.22 2.07 -1.20 -1.65 116.25 117.22 3h1j h VAL 162 Ca -0.08 -0.53 0.11 0.00 0.82 0.00 0.00 66.70 67.03 3h1j h VAL 162 Cb 1.87 1.35 -0.12 0.00 -1.52 0.00 0.00 31.29 32.87 3h1j h VAL 162 CO 0.16 0.15 -0.36 -0.08 0.02 0.00 0.00 177.57 177.46 3h1j h GLU 163 N -0.04 -0.13 0.30 1.57 4.81 -1.49 0.52 114.58 120.12 3h1j h GLU 163 Ca 0.03 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3h1j h GLU 163 Cb 0.22 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 3h1j h GLU 163 CO -0.00 -0.08 -0.40 -1.49 -0.73 0.00 0.00 179.01 176.31 3h1j h TRP 164 N -0.13 -1.10 -1.14 0.92 6.55 -1.49 1.33 115.95 120.89 3h1j h TRP 164 Ca 0.25 0.01 0.38 0.00 0.95 0.00 0.00 58.89 60.49 3h1j h TRP 164 Cb 0.56 0.44 -0.14 0.00 -0.86 0.00 0.00 29.16 29.16 3h1j h TRP 164 CO -0.70 -0.53 0.70 0.00 -1.05 0.00 0.00 178.44 176.85 3h1j h ALA 165 N -0.33 2.36 0.00 1.49 0.00 0.01 -0.49 119.26 122.30 3h1j h ALA 165 Ca -0.01 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3h1j h ALA 165 Cb 0.70 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 3h1j h ALA 165 CO -0.12 -1.00 -1.92 0.91 0.00 0.00 0.00 179.25 177.12 3h1j n TRP 166 N -4.90 0.10 -1.50 0.00 8.01 -0.33 -4.77 117.44 114.05 3h1j n TRP 166 Ca 0.35 0.03 -0.13 0.00 -1.31 0.00 0.00 57.50 56.43 3h1j n TRP 166 Cb 1.23 -0.58 -0.05 0.00 -2.01 0.00 0.00 31.31 29.90 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 1.28 1.19 0.00 6.99 0.00 0.45 -2.80 105.19 112.30 3h1j n GLY 167 Ca -0.05 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.30 2.13 0.53 -0.02 0.00 -1.14 -4.88 105.19 100.52 3h1j n GLY 168 Ca -0.14 -0.56 0.08 0.00 0.00 0.00 0.00 46.02 45.40 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 0.50 -3.63 1.61 0.99 -1.26 -4.45 117.46 111.22 3h1j n PHE 169 Ca 0.00 -1.01 -0.03 0.00 -0.00 0.00 0.00 57.45 56.41 3h1j n PHE 169 Cb 0.00 -0.25 -0.03 0.00 -1.00 0.00 0.00 39.48 38.20 3h1j n PHE 169 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 3h1j s SER 170 N -2.45 -0.06 0.21 4.37 1.04 -1.26 -5.12 113.70 110.43 3h1j s SER 170 Ca 0.38 0.04 -0.32 0.00 0.48 0.00 0.00 55.95 56.53 3h1j s SER 170 Cb 0.32 0.06 -0.12 0.00 0.10 0.00 0.00 66.02 66.38 3h1j s SER 170 CO 0.05 -0.08 1.71 -0.69 0.98 0.00 0.00 173.24 175.21 3h1j s VAL 171 N -1.56 2.06 0.00 5.02 1.01 -1.26 -4.88 120.40 120.78 3h1j s VAL 171 Ca 0.09 0.04 -0.00 0.00 0.00 0.00 0.00 61.98 62.11 3h1j s VAL 171 Cb -0.01 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.34 3h1j s VAL 171 CO -0.05 0.00 0.01 -0.67 0.00 0.00 0.00 175.10 174.39 3h1j n ASP 172 N 3.84 -0.02 -0.22 3.32 -0.08 -1.26 -5.02 116.55 117.11 3h1j n ASP 172 Ca 0.15 -1.01 0.03 0.00 -1.51 0.00 0.00 54.79 52.45 3h1j n ASP 172 Cb 0.35 0.03 0.13 0.00 2.34 0.00 0.00 41.12 43.97 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 0.01 -0.15 -0.66 1.67 -1.24 -1.92 0.27 115.58 113.56 3h1j h ASN 173 Ca -0.00 0.15 0.19 0.00 0.71 0.00 0.00 56.30 57.35 3h1j h ASN 173 Cb 0.01 0.23 -0.03 0.00 0.73 0.00 0.00 38.32 39.27 3h1j h ASN 173 CO 0.00 -0.08 0.53 1.55 -1.29 0.00 0.00 177.43 178.15 3h1j h PRO 174 N 0.19 0.00 0.04 6.67 0.13 -1.90 0.37 132.00 137.49 3h1j h PRO 174 Ca 0.36 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.40 3h1j h PRO 174 Cb 0.59 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.73 3h1j h PRO 174 CO -0.51 0.00 -0.35 1.15 -0.23 0.00 0.00 178.00 178.06 3h1j h THR 175 N 0.00 1.61 -0.19 1.56 2.02 -0.33 -2.85 112.91 114.72 3h1j h THR 175 Ca 0.32 -2.23 0.04 0.00 0.77 0.00 0.00 66.41 65.30 3h1j h THR 175 Cb 1.37 3.07 -0.04 0.00 -1.74 0.00 0.00 68.15 70.80 3h1j h THR 175 CO -0.00 0.61 -0.09 0.25 0.37 0.00 0.00 175.52 176.66 3h1j h LEU 176 N -0.59 -0.29 -1.15 2.58 5.85 -0.26 0.14 115.31 121.58 3h1j h LEU 176 Ca -0.05 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 3h1j h LEU 176 Cb 1.20 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 3h1j h LEU 176 CO 0.07 -0.11 -0.18 0.71 -0.34 0.00 0.00 178.44 178.58 3h1j h THR 177 N -0.06 1.23 -0.00 1.05 1.35 -1.21 -0.58 112.91 114.69 3h1j h THR 177 Ca 0.10 -1.04 -0.16 0.00 -0.55 0.00 0.00 66.41 64.76 3h1j h THR 177 Cb 0.22 1.27 -0.02 0.00 -1.73 0.00 0.00 68.15 67.88 3h1j h THR 177 CO -0.23 0.33 -0.78 0.08 -0.25 0.00 0.00 175.52 174.66 3h1j h ARG 178 N 0.34 0.00 -0.46 4.72 0.11 -1.18 -2.85 114.38 115.07 3h1j h ARG 178 Ca 0.06 -0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.04 3h1j h ARG 178 Cb 0.52 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.59 3h1j h ARG 178 CO 0.03 0.79 -0.11 0.74 0.10 0.00 0.00 179.97 181.52 3h1j h PHE 179 N 0.00 1.00 -0.94 4.08 -1.00 -0.16 -0.48 116.94 119.44 3h1j h PHE 179 Ca -0.01 -0.21 -0.01 0.00 2.81 0.00 0.00 57.97 60.55 3h1j h PHE 179 Cb 1.39 -0.24 -0.04 0.00 3.61 0.00 0.00 35.95 40.66 3h1j h PHE 179 CO 0.00 0.98 0.55 0.35 -1.61 0.00 0.00 178.31 178.58 3h1j h PHE 180 N 0.73 1.25 0.35 -0.55 -0.00 -1.08 0.81 116.94 118.45 3h1j h PHE 180 Ca 0.12 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.97 58.06 3h1j h PHE 180 Cb 0.66 -0.41 0.00 0.00 -0.00 0.00 0.00 35.95 36.20 3h1j h PHE 180 CO 0.05 0.84 -0.17 0.00 -0.00 0.00 0.00 178.31 179.04 3h1j h ALA 181 N 1.30 -0.46 -0.79 2.41 0.00 -1.24 -0.90 119.26 119.58 3h1j h ALA 181 Ca 0.33 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 55.23 3h1j h ALA 181 Cb -0.03 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 17.86 3h1j h ALA 181 CO -0.06 -0.70 0.39 1.25 0.00 0.00 0.00 179.25 180.13 3h1j h LEU 182 N -0.58 0.47 -0.85 0.00 5.85 -0.79 -0.09 115.31 119.32 3h1j h LEU 182 Ca -0.05 0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 3h1j h LEU 182 Cb 0.43 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 3h1j h LEU 182 CO 0.08 0.22 -0.20 -0.74 -0.34 0.00 0.00 178.44 177.46 3h1j h HIS 183 N 0.60 0.70 -0.48 1.25 2.76 -0.67 -1.27 115.15 118.03 3h1j h HIS 183 Ca 0.42 -0.14 -0.11 0.00 -2.20 0.00 0.00 60.37 58.34 3h1j h HIS 183 Cb 0.54 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.31 3h1j h HIS 183 CO -0.11 0.78 -0.12 0.35 -1.30 0.00 0.00 177.93 177.54 3h1j h PHE 184 N 0.56 1.00 0.13 5.26 -0.00 0.19 -3.36 116.94 120.73 3h1j h PHE 184 Ca 0.09 -0.20 -0.01 0.00 -0.00 0.00 0.00 57.97 57.85 3h1j h PHE 184 Cb 0.66 -0.25 0.00 0.00 -0.00 0.00 0.00 35.95 36.36 3h1j h PHE 184 CO 0.03 0.96 -0.06 1.25 -0.00 0.00 0.00 178.31 180.48 3h1j h LEU 185 N 0.80 -0.15 -0.94 0.59 5.85 -0.70 -3.39 115.31 117.37 3h1j h LEU 185 Ca 0.13 -0.31 0.28 0.00 0.84 0.00 0.00 57.88 58.82 3h1j h LEU 185 Cb 0.65 0.04 -0.16 0.00 0.37 0.00 0.00 40.66 41.56 3h1j h LEU 185 CO 0.05 0.44 0.27 -0.07 -0.34 0.00 0.00 178.44 178.79 3h1j h LEU 186 N -0.96 -0.01 -0.82 2.25 3.38 -1.38 -1.35 115.31 116.42 3h1j h LEU 186 Ca -0.02 0.23 0.20 0.00 0.09 0.00 0.00 57.88 58.38 3h1j h LEU 186 Cb 0.45 0.31 -0.13 0.00 0.09 0.00 0.00 40.66 41.38 3h1j h LEU 186 CO 0.03 -0.25 0.22 -0.65 0.09 0.00 0.00 178.44 177.88 3h1j h PRO 187 N 0.14 0.25 -0.42 1.13 0.11 -1.75 0.57 132.00 132.02 3h1j h PRO 187 Ca 0.63 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.58 3h1j h PRO 187 Cb 1.38 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.43 3h1j h PRO 187 CO -0.73 0.16 -0.29 0.74 -0.21 0.00 0.00 178.00 177.67 3h1j h PHE 188 N 0.25 1.10 0.00 0.65 -1.00 -1.48 0.11 116.94 116.57 3h1j h PHE 188 Ca 0.49 -0.30 -0.01 0.00 2.81 0.00 0.00 57.97 60.96 3h1j h PHE 188 Cb 0.92 -0.24 -0.00 0.00 3.61 0.00 0.00 35.95 40.23 3h1j h PHE 188 CO -0.26 1.12 -0.06 0.00 -1.61 0.00 0.00 178.31 177.50 3h1j h ALA 189 N 0.81 1.84 0.21 2.45 0.00 -0.44 0.58 119.26 124.71 3h1j h ALA 189 Ca 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3h1j h ALA 189 Cb 0.87 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3h1j h ALA 189 CO 0.08 0.08 -0.10 0.82 0.00 0.00 0.00 179.25 180.12 3h1j h ILE 190 N 0.00 0.86 -0.80 0.00 2.04 0.10 -1.37 117.51 118.34 3h1j h ILE 190 Ca -0.00 -0.75 0.11 0.00 1.00 0.00 0.00 64.86 65.22 3h1j h ILE 190 Cb 0.11 1.28 -0.08 0.00 -0.74 0.00 0.00 36.82 37.39 3h1j h ILE 190 CO 0.01 0.16 0.42 0.00 0.00 0.00 0.00 178.15 178.74 3h1j h ALA 191 N -0.03 1.15 0.44 1.87 0.00 0.01 0.15 119.26 122.85 3h1j h ALA 191 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3h1j h ALA 191 Cb 0.48 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3h1j h ALA 191 CO 0.05 -0.01 -0.35 0.78 0.00 0.00 0.00 179.25 179.72 3h1j h GLY 192 N 0.68 -0.87 2.00 0.00 0.00 0.25 -2.36 103.07 102.77 3h1j h GLY 192 Ca 0.41 0.40 -0.01 0.00 0.00 0.00 0.00 47.33 48.13 3h1j h GLY 192 CO -0.29 -0.31 -0.02 -2.22 0.00 0.00 0.00 176.54 173.69 3h1j h ILE 193 N -0.79 0.94 -0.43 2.60 2.04 -0.64 0.13 117.51 121.35 3h1j h ILE 193 Ca -0.04 -0.09 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 3h1j h ILE 193 Cb 0.68 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 3h1j h ILE 193 CO -0.01 0.02 0.26 0.74 0.00 0.00 0.00 178.15 179.16 3h1j h THR 194 N 0.00 1.13 -0.36 -0.27 2.02 -0.21 0.23 112.91 115.45 3h1j h THR 194 Ca -0.00 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 3h1j h THR 194 Cb 0.05 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 3h1j h THR 194 CO 0.00 0.13 0.10 0.40 0.37 0.00 0.00 175.52 176.53 3h1j h ILE 195 N 0.59 1.22 -0.92 3.11 1.08 -0.63 -0.95 117.51 121.01 3h1j h ILE 195 Ca 0.16 -0.72 -0.00 0.00 -0.39 0.00 0.00 64.86 63.90 3h1j h ILE 195 Cb -0.01 1.01 -0.04 0.00 -3.07 0.00 0.00 36.82 34.70 3h1j h ILE 195 CO -0.03 0.25 0.56 0.40 -0.69 0.00 0.00 178.15 178.64 3h1j h ILE 196 N 0.43 1.25 0.16 -0.67 2.04 -1.11 -0.52 117.51 119.09 3h1j h ILE 196 Ca 0.11 -0.55 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 3h1j h ILE 196 Cb 0.27 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 3h1j h ILE 196 CO -0.00 0.26 -0.17 -0.74 0.00 0.00 0.00 178.15 177.50 3h1j h HIS 197 N 1.27 -0.47 -0.56 1.37 2.76 -0.18 -1.06 115.15 118.29 3h1j h HIS 197 Ca 0.33 0.00 0.16 0.00 -2.20 0.00 0.00 60.37 58.67 3h1j h HIS 197 Cb -0.06 0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.06 3h1j h HIS 197 CO 0.00 -0.22 0.41 -0.07 -1.30 0.00 0.00 177.93 176.75 3h1j h LEU 198 N -0.33 0.00 -0.19 0.26 3.38 -1.11 -0.28 115.31 117.04 3h1j h LEU 198 Ca -0.02 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 3h1j h LEU 198 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3h1j h LEU 198 CO -0.03 0.00 -0.07 0.74 0.09 0.00 0.00 178.44 179.17 3h1j h THR 199 N 0.00 1.30 -0.37 0.22 2.02 -0.55 0.10 112.91 115.64 3h1j h THR 199 Ca 0.26 -1.09 -0.07 0.00 0.77 0.00 0.00 66.41 66.28 3h1j h THR 199 Cb 1.09 1.62 -0.01 0.00 -1.74 0.00 0.00 68.15 69.10 3h1j h THR 199 CO -0.00 0.33 -0.04 -0.26 0.37 0.00 0.00 175.52 175.91 3h1j h PHE 200 N 0.09 0.75 -0.29 3.16 0.04 -0.39 -3.04 116.94 117.26 3h1j h PHE 200 Ca 0.05 -0.15 0.06 0.00 2.80 0.00 0.00 57.97 60.73 3h1j h PHE 200 Cb 0.54 -0.19 -0.06 0.00 2.20 0.00 0.00 35.95 38.44 3h1j h PHE 200 CO 0.06 0.80 -0.10 1.25 -0.60 0.00 0.00 178.31 179.72 3h1j h LEU 201 N 0.49 -0.36 -2.43 1.54 5.85 -0.93 -1.11 115.31 118.36 3h1j h LEU 201 Ca 0.10 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.94 3h1j h LEU 201 Cb 0.53 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.77 3h1j h LEU 201 CO 0.03 -0.13 0.16 0.45 -0.34 0.00 0.00 178.44 178.61 3h1j h HIS 202 N -0.05 0.00 -0.56 1.25 3.86 -0.71 0.26 115.15 119.21 3h1j h HIS 202 Ca 0.14 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.37 3h1j h HIS 202 Cb 0.26 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.70 3h1j h HIS 202 CO -0.30 0.00 0.37 0.93 0.86 0.00 0.00 177.93 179.79 3h1j h GLU 203 N 0.00 0.69 0.00 2.45 4.39 -1.09 -3.23 114.58 117.80 3h1j h GLU 203 Ca 0.03 -0.04 -0.16 0.00 0.34 0.00 0.00 59.36 59.53 3h1j h GLU 203 Cb 0.35 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 3h1j h GLU 203 CO -0.00 0.45 -1.72 -1.13 -1.16 0.00 0.00 179.01 175.45 3h1j n SER 204 N -4.46 2.25 0.00 1.42 3.41 -0.45 -5.14 113.62 110.65 3h1j n SER 204 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 3h1j n SER 204 Cb 0.09 0.93 0.00 0.00 -0.26 0.00 0.00 64.21 64.96 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 2.22 -1.32 3.64 5.00 0.00 0.80 -4.93 105.19 110.60 3h1j n GLY 205 Ca -0.15 -1.58 -0.36 0.00 0.00 0.00 0.00 46.02 43.93 3h1j n GLY 205 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h1j n SER 206 N -1.53 0.90 -4.66 1.61 7.64 -1.26 -4.89 113.62 111.42 3h1j n SER 206 Ca 0.00 0.71 -0.23 0.00 1.01 0.00 0.00 58.87 60.36 3h1j n SER 206 Cb 0.00 -1.44 0.12 0.00 -1.01 0.00 0.00 64.21 61.87 3h1j n SER 206 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3h1j s ASN 207 N -1.56 4.26 0.10 6.43 3.04 -1.26 -4.72 114.94 121.23 3h1j s ASN 207 Ca 0.76 -0.52 -0.11 0.00 0.04 0.00 0.00 52.86 53.03 3h1j s ASN 207 Cb -0.36 0.22 0.01 0.00 -1.54 0.00 0.00 41.25 39.58 3h1j s ASN 207 CO 0.47 -1.94 0.25 0.54 -3.04 0.00 0.00 177.10 173.39 3h1j s ASN 208 N -4.79 0.02 0.31 -4.21 2.20 -1.26 -4.85 114.94 102.36 3h1j s ASN 208 Ca 0.67 -0.57 0.03 0.00 -0.94 0.00 0.00 52.86 52.05 3h1j s ASN 208 Cb -0.04 0.38 0.78 0.00 -2.00 0.00 0.00 41.25 40.37 3h1j s ASN 208 CO 0.45 -0.77 1.55 -2.65 -2.94 0.00 0.00 177.10 172.74 3h1j n PRO 209 N -0.11 -0.08 0.25 3.55 -0.02 -1.26 -0.41 135.00 136.91 3h1j n PRO 209 Ca -0.15 1.48 0.16 0.00 -2.02 0.00 0.00 63.50 62.97 3h1j n PRO 209 Cb 0.63 -2.36 0.61 0.00 -0.02 0.00 0.00 33.50 32.35 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 1.42 2.45 3.38 -1.97 -3.42 115.31 117.16 3h1j h LEU 210 Ca 0.61 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 58.26 3h1j h LEU 210 Cb 1.27 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.04 3h1j h LEU 210 CO -0.93 0.00 -0.44 0.61 0.09 0.00 0.00 178.44 177.77 3h1j n GLY 211 N 0.15 -0.27 3.16 0.83 0.00 0.45 -4.73 105.19 104.77 3h1j n GLY 211 Ca 0.01 -0.14 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.93 0.88 0.19 -0.61 -4.36 -1.26 -4.40 121.20 108.71 3h1j s ILE 212 Ca 0.12 -1.53 -0.32 0.00 -0.26 0.00 0.00 60.65 58.67 3h1j s ILE 212 Cb -0.06 -1.22 -0.16 0.00 1.25 0.00 0.00 42.46 42.28 3h1j s ILE 212 CO 0.15 -0.51 1.05 -0.24 0.24 0.00 0.00 174.94 175.64 3h1j n SER 213 N 0.75 0.96 -0.72 4.36 2.88 -1.26 -4.84 113.62 115.75 3h1j n SER 213 Ca -0.18 1.15 0.06 0.00 -1.33 0.00 0.00 58.87 58.58 3h1j n SER 213 Cb 0.57 -1.18 0.18 0.00 -0.75 0.00 0.00 64.21 63.02 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 1.82 3.12 0.28 -3.46 3.41 -1.26 -4.62 113.62 112.92 3h1j n SER 214 Ca 0.14 -2.13 0.18 0.00 -0.26 0.00 0.00 58.87 56.81 3h1j n SER 214 Cb 0.25 -0.29 0.96 0.00 -0.26 0.00 0.00 64.21 64.87 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 2.15 0.00 0.00 4.04 3.45 -2.00 0.26 116.42 124.33 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 0.84 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.61 3h1j h ASP 215 CO 0.03 0.00 0.00 -1.54 -1.57 0.00 0.00 179.24 176.16 3h1j n SER 216 N -3.55 0.00 -2.72 6.45 3.41 -1.26 -4.40 113.62 111.54 3h1j n SER 216 Ca -0.01 -1.11 -0.04 0.00 -0.26 0.00 0.00 58.87 57.44 3h1j n SER 216 Cb 0.19 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.17 3h1j n SER 216 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3h1j n ASP 217 N -0.94 -2.57 -4.77 4.04 4.64 0.92 -5.15 116.55 112.73 3h1j n ASP 217 Ca 0.21 -2.27 -0.22 0.00 -1.38 0.00 0.00 54.79 51.13 3h1j n ASP 217 Cb 0.10 1.36 -0.05 0.00 -1.04 0.00 0.00 41.12 41.48 3h1j n ASP 217 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 3h1j s LYS 218 N 0.81 2.68 0.01 -0.67 -0.14 -1.22 -2.41 119.74 118.79 3h1j s LYS 218 Ca 0.28 -1.23 -0.03 0.00 -1.36 0.00 0.00 55.97 53.63 3h1j s LYS 218 Cb 0.09 -2.41 -0.01 0.00 -1.68 0.00 0.00 37.83 33.83 3h1j s LYS 218 CO -0.10 0.33 0.04 0.96 -0.76 0.00 0.00 175.35 175.83 3h1j s ILE 219 N -2.23 0.09 0.30 2.17 -4.36 0.43 -4.86 121.20 112.74 3h1j s ILE 219 Ca 0.34 -0.72 -0.30 0.00 -0.26 0.00 0.00 60.65 59.71 3h1j s ILE 219 Cb -0.07 -0.31 -0.11 0.00 1.25 0.00 0.00 42.46 43.23 3h1j s ILE 219 CO 0.23 -0.40 1.55 -2.16 0.24 0.00 0.00 174.94 174.41 3h1j s PRO 220 N -1.26 4.14 0.27 0.37 0.04 -1.26 -1.02 135.00 136.28 3h1j s PRO 220 Ca -0.14 2.53 -0.01 0.00 0.04 0.00 0.00 61.00 63.43 3h1j s PRO 220 Cb -0.08 -3.03 0.58 0.00 0.04 0.00 0.00 34.50 32.01 3h1j s PRO 220 CO 0.00 -0.58 1.70 0.35 0.04 0.00 0.00 177.00 178.50 3h1j h PHE 221 N 4.60 0.48 -2.99 0.56 3.57 -0.89 -3.33 116.94 118.96 3h1j h PHE 221 Ca -0.47 0.04 -0.63 0.00 3.53 0.00 0.00 57.97 60.44 3h1j h PHE 221 Cb 1.22 -0.09 -0.10 0.00 2.79 0.00 0.00 35.95 39.78 3h1j h PHE 221 CO 0.58 -0.04 -0.48 -1.58 -2.23 0.00 0.00 178.31 174.56 3h1j s HIS 222 N -5.97 3.50 -2.14 0.41 2.46 -1.05 0.81 115.29 113.32 3h1j s HIS 222 Ca -0.12 0.43 0.26 0.00 0.47 0.00 0.00 55.06 56.10 3h1j s HIS 222 Cb 0.23 -2.07 0.62 0.00 -0.13 0.00 0.00 32.58 31.23 3h1j s HIS 222 CO 0.77 0.49 1.48 -0.35 -2.47 0.00 0.00 174.74 174.66 3h1j n PRO 223 N 2.82 1.28 0.10 2.88 -0.04 -1.26 -4.89 135.00 135.90 3h1j n PRO 223 Ca -0.18 -0.87 -0.14 0.00 -0.04 0.00 0.00 63.50 62.28 3h1j n PRO 223 Cb 0.53 -1.48 -0.07 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 2.12 -1.08 0.00 0.54 0.99 -1.59 -2.00 116.97 115.95 3h1j h TYR 224 Ca 0.00 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.76 3h1j h TYR 224 Cb 0.61 0.46 0.00 0.00 1.00 0.00 0.00 36.73 38.80 3h1j h TYR 224 CO 0.00 -0.49 -1.23 0.66 -0.00 0.00 0.00 178.16 177.11 3h1j n TYR 225 N -5.45 0.53 -0.11 4.88 4.02 0.24 -2.19 117.16 119.08 3h1j n TYR 225 Ca -0.07 0.15 -0.11 0.00 -0.01 0.00 0.00 57.90 57.86 3h1j n TYR 225 Cb 0.36 -0.69 -0.03 0.00 -0.02 0.00 0.00 39.34 38.96 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 0.62 -0.43 7.72 4.64 -1.47 0.32 113.55 124.95 3h1j h SER 226 Ca 0.00 -0.35 -0.06 0.00 -0.47 0.00 0.00 61.79 60.91 3h1j h SER 226 Cb 0.91 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 3h1j h SER 226 CO 0.00 0.83 0.05 -0.26 -0.87 0.00 0.00 176.83 176.58 3h1j h PHE 227 N 0.40 0.79 -0.08 4.77 0.04 -1.46 -1.18 116.94 120.22 3h1j h PHE 227 Ca 0.09 -0.12 -0.00 0.00 2.80 0.00 0.00 57.97 60.73 3h1j h PHE 227 Cb 0.55 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.48 3h1j h PHE 227 CO 0.05 0.76 0.04 -0.22 -0.60 0.00 0.00 178.31 178.34 3h1j h LYS 228 N 0.59 0.12 -0.36 1.51 3.64 -1.27 -2.21 116.57 118.58 3h1j h LYS 228 Ca 0.13 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.54 3h1j h LYS 228 Cb 0.42 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.17 3h1j h LYS 228 CO 0.01 0.21 0.10 -0.44 -2.27 0.00 0.00 179.45 177.06 3h1j h ASP 229 N -0.00 0.07 -0.67 4.20 3.45 -0.25 0.23 116.42 123.45 3h1j h ASP 229 Ca 0.03 0.05 0.08 0.00 0.43 0.00 0.00 57.03 57.62 3h1j h ASP 229 Cb 0.14 0.05 -0.07 0.00 -0.56 0.00 0.00 39.33 38.89 3h1j h ASP 229 CO -0.00 0.08 0.33 0.40 -1.57 0.00 0.00 179.24 178.47 3h1j h ILE 230 N 0.23 0.86 -0.34 0.35 1.08 -1.09 0.24 117.51 118.85 3h1j h ILE 230 Ca 0.17 -0.20 0.02 0.00 -0.39 0.00 0.00 64.86 64.46 3h1j h ILE 230 Cb 0.17 0.24 -0.02 0.00 -3.07 0.00 0.00 36.82 34.14 3h1j h ILE 230 CO -0.20 0.10 0.18 0.25 -0.69 0.00 0.00 178.15 177.80 3h1j h LEU 231 N 0.57 0.28 -0.15 1.44 5.85 -0.70 -1.87 115.31 120.74 3h1j h LEU 231 Ca 0.32 0.01 0.03 0.00 0.84 0.00 0.00 57.88 59.08 3h1j h LEU 231 Cb 0.32 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 3h1j h LEU 231 CO -0.25 0.21 -0.05 1.23 -0.34 0.00 0.00 178.44 179.23 3h1j h GLY 232 N 0.37 0.09 0.10 3.75 0.00 0.68 -1.83 103.07 106.23 3h1j h GLY 232 Ca 0.14 0.07 0.08 0.00 0.00 0.00 0.00 47.33 47.61 3h1j h GLY 232 CO -0.08 -0.07 -0.19 -2.00 0.00 0.00 0.00 176.54 174.20 3h1j h LEU 233 N -0.03 -0.64 -2.24 3.11 5.85 -0.21 -0.27 115.31 120.89 3h1j h LEU 233 Ca 0.08 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 3h1j h LEU 233 Cb 0.15 0.34 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 3h1j h LEU 233 CO -0.17 -0.22 -0.00 0.71 -0.34 0.00 0.00 178.44 178.41 3h1j h THR 234 N -0.14 0.75 -0.02 1.05 1.35 -0.92 0.16 112.91 115.15 3h1j h THR 234 Ca 0.18 -0.02 -0.15 0.00 -0.55 0.00 0.00 66.41 65.87 3h1j h THR 234 Cb 0.41 1.01 0.01 0.00 -1.73 0.00 0.00 68.15 67.85 3h1j h THR 234 CO -0.43 0.00 -0.56 -0.07 -0.25 0.00 0.00 175.52 174.21 3h1j h LEU 235 N 0.00 0.53 -0.89 3.87 3.38 -0.25 -3.13 115.31 118.82 3h1j h LEU 235 Ca -0.00 -0.73 -0.07 0.00 0.09 0.00 0.00 57.88 57.16 3h1j h LEU 235 Cb 0.01 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3h1j h LEU 235 CO 0.00 1.19 0.02 -0.03 0.09 0.00 0.00 178.44 179.71 3h1j h MET 236 N -0.09 0.84 -0.92 1.13 4.05 -0.52 -3.10 114.93 116.33 3h1j h MET 236 Ca -0.06 -0.22 0.08 0.00 -0.28 0.00 0.00 59.70 59.21 3h1j h MET 236 Cb 1.26 -0.10 -0.06 0.00 -0.80 0.00 0.00 31.60 31.89 3h1j h MET 236 CO 0.11 0.83 0.59 1.25 0.23 0.00 0.00 176.91 179.92 3h1j h LEU 237 N 0.78 0.89 0.51 3.39 5.85 -0.72 -2.82 115.31 123.18 3h1j h LEU 237 Ca 0.15 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 3h1j h LEU 237 Cb 0.44 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 3h1j h LEU 237 CO 0.02 0.55 -0.33 0.74 -0.34 0.00 0.00 178.44 179.08 3h1j h THR 238 N 1.00 0.00 -0.64 1.05 2.02 -1.48 0.11 112.91 114.97 3h1j h THR 238 Ca 0.41 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.68 3h1j h THR 238 Cb 0.28 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.62 3h1j h THR 238 CO -0.17 0.00 0.26 1.55 0.37 0.00 0.00 175.52 177.53 3h1j h PRO 239 N -0.79 0.44 -0.60 6.66 0.13 -1.70 0.55 132.00 136.68 3h1j h PRO 239 Ca -0.07 -0.03 0.08 0.00 -0.87 0.00 0.00 66.00 65.11 3h1j h PRO 239 Cb 0.64 -0.10 -0.06 0.00 0.13 0.00 0.00 31.00 31.61 3h1j h PRO 239 CO 0.06 0.29 0.27 0.35 -0.23 0.00 0.00 178.00 178.73 3h1j h PHE 240 N 0.45 0.48 0.06 1.56 -0.00 -1.37 0.19 116.94 118.30 3h1j h PHE 240 Ca 0.32 0.03 -0.25 0.00 -0.00 0.00 0.00 57.97 58.07 3h1j h PHE 240 Cb 0.39 -0.12 0.00 0.00 -0.00 0.00 0.00 35.95 36.22 3h1j h PHE 240 CO -0.16 0.17 -1.07 -0.07 -0.00 0.00 0.00 178.31 177.18 3h1j h LEU 241 N 0.49 0.50 -0.07 0.59 3.38 0.21 -0.55 115.31 119.85 3h1j h LEU 241 Ca 0.29 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.83 3h1j h LEU 241 Cb 0.30 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3h1j h LEU 241 CO -0.25 1.29 -0.04 0.74 0.09 0.00 0.00 178.44 180.26 3h1j h THR 242 N 0.16 0.86 0.43 0.22 2.02 0.55 0.60 112.91 117.76 3h1j h THR 242 Ca -0.11 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 3h1j h THR 242 Cb 1.75 0.86 -0.00 0.00 -1.74 0.00 0.00 68.15 69.02 3h1j h THR 242 CO 0.18 0.00 -0.24 0.25 0.37 0.00 0.00 175.52 176.08 3h1j h LEU 243 N -0.04 -0.58 -0.37 2.58 5.85 -0.67 0.45 115.31 122.53 3h1j h LEU 243 Ca 0.05 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3h1j h LEU 243 Cb 0.11 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 3h1j h LEU 243 CO -0.10 -0.39 0.08 0.00 -0.34 0.00 0.00 178.44 177.69 3h1j h ALA 244 N -0.07 0.40 0.10 1.25 0.00 -0.70 -0.26 119.26 119.98 3h1j h ALA 244 Ca -0.05 0.07 -0.28 0.00 0.00 0.00 0.00 54.91 54.64 3h1j h ALA 244 Cb 0.50 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3h1j h ALA 244 CO 0.07 -0.32 -1.38 -0.07 0.00 0.00 0.00 179.25 177.55 3h1j h LEU 245 N 0.21 0.32 0.02 0.00 3.38 0.27 -3.34 115.31 116.17 3h1j h LEU 245 Ca 0.17 -0.40 -0.38 0.00 0.09 0.00 0.00 57.88 57.37 3h1j h LEU 245 Cb 0.19 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 3h1j h LEU 245 CO -0.22 1.32 -2.17 0.49 0.09 0.00 0.00 178.44 177.95 3h1j n PHE 246 N -3.43 0.44 -3.39 1.13 3.01 0.16 -4.72 117.46 110.65 3h1j n PHE 246 Ca -0.12 0.14 -0.26 0.00 1.01 0.00 0.00 57.45 58.22 3h1j n PHE 246 Cb 1.02 -1.05 -0.08 0.00 -0.01 0.00 0.00 39.48 39.36 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 -3.86 2.87 -0.20 4.37 2.88 -0.15 -4.98 113.62 114.54 3h1j n SER 247 Ca -0.44 -3.25 0.00 0.00 -1.33 0.00 0.00 58.87 53.86 3h1j n SER 247 Cb 0.91 -0.67 0.09 0.00 -0.75 0.00 0.00 64.21 63.79 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 4.22 0.07 -0.65 -1.46 0.11 -1.56 -2.50 132.00 130.22 3h1j h PRO 248 Ca 0.17 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 3h1j h PRO 248 Cb 0.72 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.81 3h1j h PRO 248 CO 0.74 0.04 0.00 0.09 -0.21 0.00 0.00 178.00 178.66 3h1j n ASN 249 N -5.34 4.78 -0.03 -2.05 3.02 -1.26 -4.58 115.26 109.80 3h1j n ASN 249 Ca 0.08 -2.48 -0.10 0.00 -0.03 0.00 0.00 54.58 52.05 3h1j n ASN 249 Cb 0.35 -0.59 -0.04 0.00 -0.61 0.00 0.00 39.78 38.89 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 4.02 -1.09 0.00 3.41 5.85 -1.79 -0.35 115.31 125.35 3h1j h LEU 250 Ca 0.00 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.88 3h1j h LEU 250 Cb 1.48 0.47 0.00 0.00 0.37 0.00 0.00 40.66 42.98 3h1j h LEU 250 CO 0.26 -0.36 0.00 0.18 -0.34 0.00 0.00 178.44 178.17 3h1j n LEU 251 N -5.42 0.00 -4.63 2.25 4.77 -1.26 -4.86 117.00 107.85 3h1j n LEU 251 Ca -0.02 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.68 3h1j n LEU 251 Cb 0.34 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.34 3h1j n LEU 251 CO 0.12 0.00 -0.37 -0.83 -1.33 0.00 0.00 177.39 174.99 3h1j s GLY 252 N -1.88 1.78 0.13 -0.72 0.00 -0.14 -4.72 107.32 101.77 3h1j s GLY 252 Ca 0.42 -1.30 -0.30 0.00 0.00 0.00 0.00 44.72 43.54 3h1j s GLY 252 CO 0.32 -1.29 1.06 -0.35 0.00 0.00 0.00 173.10 172.83 3h1j s ASP 253 N -2.59 7.33 0.05 1.64 -1.08 -1.26 -4.92 116.67 115.84 3h1j s ASP 253 Ca 0.25 1.95 0.28 0.00 -0.52 0.00 0.00 52.55 54.51 3h1j s ASP 253 Cb -0.10 -2.59 0.99 0.00 -1.46 0.00 0.00 42.92 39.75 3h1j s ASP 253 CO 0.17 -0.20 1.79 -0.81 0.52 0.00 0.00 175.17 176.63 3h1j n PRO 254 N 2.78 0.07 0.29 4.34 -0.04 -1.26 -3.25 135.00 137.94 3h1j n PRO 254 Ca 0.03 0.05 0.19 0.00 -0.04 0.00 0.00 63.50 63.73 3h1j n PRO 254 Cb 0.47 -1.58 0.85 0.00 -0.04 0.00 0.00 33.50 33.20 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 -0.86 0.54 4.57 -1.95 -2.84 114.58 114.04 3h1j h GLU 255 Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 3h1j h GLU 255 Cb 0.57 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.14 3h1j h GLU 255 CO 0.00 0.01 0.03 -1.71 -1.18 0.00 0.00 179.01 176.16 3h1j n ASN 256 N -3.12 2.89 -0.94 1.04 5.15 -1.20 -3.13 115.26 115.95 3h1j n ASN 256 Ca -0.01 -2.39 0.09 0.00 -0.60 0.00 0.00 54.58 51.68 3h1j n ASN 256 Cb 0.24 -0.58 0.19 0.00 -0.53 0.00 0.00 39.78 39.10 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 0.20 0.52 -3.88 1.20 3.01 -1.07 -4.57 117.46 112.86 3h1j n PHE 257 Ca 0.12 -0.34 -0.35 0.00 1.01 0.00 0.00 57.45 57.88 3h1j n PHE 257 Cb 0.65 -0.01 -0.14 0.00 -0.01 0.00 0.00 39.48 39.98 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 -1.16 3.30 0.26 4.37 2.01 -1.18 -5.01 115.64 118.22 3h1j s THR 258 Ca 0.33 -0.86 -0.30 0.00 0.31 0.00 0.00 61.69 61.17 3h1j s THR 258 Cb 0.18 -2.67 -0.14 0.00 0.01 0.00 0.00 72.50 69.88 3h1j s THR 258 CO 0.25 0.18 1.17 -2.65 -0.69 0.00 0.00 174.62 172.88 3h1j n PRO 259 N 4.75 1.56 -1.55 4.92 -0.02 -1.26 0.14 135.00 143.54 3h1j n PRO 259 Ca -0.16 0.55 -0.59 0.00 -2.02 0.00 0.00 63.50 61.29 3h1j n PRO 259 Cb 0.48 -2.05 -0.08 0.00 -0.02 0.00 0.00 33.50 31.83 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 0.93 -2.89 -3.99 3.55 0.00 -0.92 -4.36 120.51 112.83 3h1j n ALA 260 Ca 0.11 0.57 -0.31 0.00 0.00 0.00 0.00 53.44 53.81 3h1j n ALA 260 Cb 0.31 -1.84 -0.15 0.00 0.00 0.00 0.00 19.45 17.76 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 0.49 4.59 0.45 0.00 3.84 -1.26 -4.92 114.94 118.13 3h1j s ASN 261 Ca 0.92 -1.95 0.23 0.00 0.21 0.00 0.00 52.86 52.27 3h1j s ASN 261 Cb -1.24 -1.50 1.25 0.00 -0.55 0.00 0.00 41.25 39.21 3h1j s ASN 261 CO 0.58 -0.35 1.66 -0.65 -2.79 0.00 0.00 177.10 175.55 3h1j h PRO 262 N 7.71 0.00 -0.02 0.43 0.11 -2.00 -1.53 132.00 136.70 3h1j h PRO 262 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 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 0.50 0.00 -0.04 1.28 -0.21 0.00 0.00 178.00 179.53 3h1j n LEU 263 N -2.44 2.47 -3.62 2.35 4.77 -1.26 -4.92 117.00 114.36 3h1j n LEU 263 Ca -0.02 -0.97 -0.18 0.00 -0.03 0.00 0.00 56.01 54.81 3h1j n LEU 263 Cb 0.24 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.19 3h1j n LEU 263 CO 0.10 0.43 -0.23 -0.69 -1.33 0.00 0.00 177.39 175.67 3h1j s VAL 264 N -1.62 -0.27 -0.13 4.08 1.01 -0.57 -5.11 120.40 117.79 3h1j s VAL 264 Ca 0.21 0.18 -0.19 0.00 0.00 0.00 0.00 61.98 62.18 3h1j s VAL 264 Cb 0.15 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 36.07 3h1j s VAL 264 CO 0.26 0.02 0.51 -0.89 0.00 0.00 0.00 175.10 174.99 3h1j s THR 265 N 2.30 5.15 0.38 3.92 2.01 -1.26 -4.67 115.64 123.47 3h1j s THR 265 Ca 0.04 1.01 -0.26 0.00 0.31 0.00 0.00 61.69 62.78 3h1j s THR 265 Cb -0.13 -3.85 -0.11 0.00 0.01 0.00 0.00 72.50 68.42 3h1j s THR 265 CO -0.08 0.28 1.24 -2.65 -0.69 0.00 0.00 174.62 172.72 3h1j n PRO 266 N 3.96 1.92 0.04 4.92 -0.02 -1.26 -4.86 135.00 139.69 3h1j n PRO 266 Ca -0.06 0.68 0.04 0.00 -2.02 0.00 0.00 63.50 62.14 3h1j n PRO 266 Cb 0.51 -2.29 0.42 0.00 -0.02 0.00 0.00 33.50 32.12 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 2.21 0.46 -4.62 0.52 0.13 -2.05 -3.34 132.00 125.31 3h1j h PRO 267 Ca -0.46 -0.04 -0.69 0.00 -0.87 0.00 0.00 66.00 63.94 3h1j h PRO 267 Cb 1.30 -0.10 -0.34 0.00 0.13 0.00 0.00 31.00 31.99 3h1j h PRO 267 CO 0.61 0.35 -0.63 -1.01 -0.23 0.00 0.00 178.00 177.09 3h1j s HIS 268 N -5.31 3.49 -0.23 1.56 3.76 -1.26 -5.05 115.29 112.24 3h1j s HIS 268 Ca -0.08 -2.27 -0.00 0.00 -0.15 0.00 0.00 55.06 52.56 3h1j s HIS 268 Cb 0.17 -2.76 0.07 0.00 1.11 0.00 0.00 32.58 31.16 3h1j s HIS 268 CO 0.73 -0.90 -0.01 -1.50 -0.85 0.00 0.00 174.74 172.21 3h1j s ILE 269 N 1.16 1.16 0.09 0.60 2.07 -1.25 -5.02 121.20 120.00 3h1j s ILE 269 Ca 0.03 -1.06 0.10 0.00 -1.41 0.00 0.00 60.65 58.31 3h1j s ILE 269 Cb -0.21 -1.56 -0.03 0.00 0.13 0.00 0.00 42.46 40.78 3h1j s ILE 269 CO -0.03 -0.21 -0.25 -0.54 -1.91 0.00 0.00 174.94 172.00 3h1j s LYS 270 N 1.55 1.44 0.77 3.50 -0.14 -1.26 -5.13 119.74 120.47 3h1j s LYS 270 Ca -0.02 -1.20 -0.12 0.00 -1.36 0.00 0.00 55.97 53.27 3h1j s LYS 270 Cb -0.18 -1.76 0.06 0.00 -1.68 0.00 0.00 37.83 34.27 3h1j s LYS 270 CO -0.09 0.43 1.11 -2.14 -0.76 0.00 0.00 175.35 173.91 3h1j s PRO 271 N -1.71 2.15 0.36 -1.68 0.02 -1.26 -4.96 135.00 127.92 3h1j s PRO 271 Ca 0.11 1.32 -0.27 0.00 0.02 0.00 0.00 61.00 62.18 3h1j s PRO 271 Cb -0.10 -1.87 -0.12 0.00 0.02 0.00 0.00 34.50 32.43 3h1j s PRO 271 CO 0.04 -1.74 1.28 0.39 -0.33 0.00 0.00 177.00 176.63 3h1j n GLU 272 N -3.36 2.06 -0.32 5.54 4.71 -1.26 -4.66 120.64 123.34 3h1j n GLU 272 Ca 0.10 0.72 0.23 0.00 -0.01 0.00 0.00 57.16 58.20 3h1j n GLU 272 Cb 0.52 -2.33 0.45 0.00 -1.01 0.00 0.00 31.44 29.07 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 2.41 0.70 0.00 -0.32 5.08 -1.93 0.57 115.95 122.45 3h1j h TRP 273 Ca -0.46 0.04 0.00 0.00 1.08 0.00 0.00 58.89 59.55 3h1j h TRP 273 Cb 1.29 -0.14 0.00 0.00 -3.00 0.00 0.00 29.16 27.30 3h1j h TRP 273 CO 0.50 -0.28 0.00 2.48 -1.28 0.00 0.00 178.44 179.86 3h1j n TYR 274 N -5.18 0.00 0.26 0.12 0.18 -1.26 -2.05 117.16 109.23 3h1j n TYR 274 Ca 0.30 0.00 0.05 0.00 1.88 0.00 0.00 57.90 60.14 3h1j n TYR 274 Cb 0.98 -0.25 -0.07 0.00 -0.38 0.00 0.00 39.34 39.62 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 -1.25 0.00 -0.23 -3.48 3.72 0.20 -4.72 117.46 111.71 3h1j n PHE 275 Ca 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.46 3h1j n PHE 275 Cb 0.08 -0.12 0.07 0.00 -0.94 0.00 0.00 39.48 38.57 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 -0.61 -0.42 4.37 3.38 -1.23 -0.37 115.31 120.43 3h1j h LEU 276 Ca 0.00 0.20 0.06 0.00 0.09 0.00 0.00 57.88 58.23 3h1j h LEU 276 Cb 0.38 0.41 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 3h1j h LEU 276 CO 0.00 -0.22 0.11 2.19 0.09 0.00 0.00 178.44 180.61 3h1j h PHE 277 N 0.00 0.19 -0.06 1.13 -5.15 -1.78 0.31 116.94 111.58 3h1j h PHE 277 Ca 0.32 0.02 -0.01 0.00 -0.20 0.00 0.00 57.97 58.11 3h1j h PHE 277 Cb 0.49 -0.02 -0.00 0.00 0.22 0.00 0.00 35.95 36.64 3h1j h PHE 277 CO -0.54 0.05 0.01 0.00 -2.00 0.00 0.00 178.31 175.83 3h1j h ALA 278 N 1.30 0.07 -0.74 12.09 0.00 -1.73 -2.20 119.26 128.05 3h1j h ALA 278 Ca 0.20 -0.14 0.17 0.00 0.00 0.00 0.00 54.91 55.13 3h1j h ALA 278 Cb 0.22 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 17.87 3h1j h ALA 278 CO -0.24 -0.28 0.09 -0.92 0.00 0.00 0.00 179.25 177.90 3h1j h TYR 279 N -0.15 0.11 -0.28 0.00 3.20 -0.52 0.03 116.97 119.36 3h1j h TYR 279 Ca 0.02 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.94 3h1j h TYR 279 Cb 0.28 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 3h1j h TYR 279 CO 0.02 -0.17 0.18 0.00 -1.64 0.00 0.00 178.16 176.54 3h1j h ALA 280 N 1.66 0.35 -0.93 1.82 0.00 -0.09 -1.02 119.26 121.04 3h1j h ALA 280 Ca 0.42 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.34 3h1j h ALA 280 Cb 0.73 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 3h1j h ALA 280 CO -0.59 -0.18 0.61 0.82 0.00 0.00 0.00 179.25 179.92 3h1j h ILE 281 N 0.37 1.16 -0.06 0.00 2.04 -0.43 -2.12 117.51 118.47 3h1j h ILE 281 Ca 0.10 -0.40 -0.14 0.00 1.00 0.00 0.00 64.86 65.42 3h1j h ILE 281 Cb -0.03 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 35.92 3h1j h ILE 281 CO -0.02 0.21 -0.59 0.25 0.00 0.00 0.00 178.15 178.00 3h1j h LEU 282 N 1.17 0.22 -1.01 1.44 6.46 -0.71 -2.73 115.31 120.16 3h1j h LEU 282 Ca 0.37 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 58.00 3h1j h LEU 282 Cb 0.01 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 39.88 3h1j h LEU 282 CO -0.11 0.77 0.00 0.03 -0.62 0.00 0.00 178.44 178.50 3h1j h ARG 283 N 0.15 0.00 -0.03 1.25 3.08 -0.57 -3.26 114.38 115.00 3h1j h ARG 283 Ca -0.01 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 3h1j h ARG 283 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.14 3h1j h ARG 283 CO 0.09 0.00 -0.06 0.77 -1.07 0.00 0.00 179.97 179.70 3h1j h SER 284 N 0.00 0.10 -2.78 7.04 0.02 -1.09 -3.42 113.55 113.42 3h1j h SER 284 Ca 0.00 -0.58 -0.56 0.00 -0.84 0.00 0.00 61.79 59.81 3h1j h SER 284 Cb 0.52 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 3h1j h SER 284 CO 0.00 0.66 1.03 -0.63 -1.14 0.00 0.00 176.83 176.75 3h1j s ILE 285 N -3.88 3.88 -0.12 3.27 1.09 -1.23 -4.86 121.20 119.34 3h1j s ILE 285 Ca -0.16 1.05 -0.04 0.00 -1.10 0.00 0.00 60.65 60.39 3h1j s ILE 285 Cb 0.02 -3.75 -0.12 0.00 -1.06 0.00 0.00 42.46 37.56 3h1j s ILE 285 CO 0.70 -0.17 3.05 -0.81 -0.10 0.00 0.00 174.94 177.61 3h1j n PRO 286 N 7.10 1.90 -3.74 2.79 -0.04 -1.26 -4.42 135.00 137.33 3h1j n PRO 286 Ca 0.16 -1.17 -0.13 0.00 -0.04 0.00 0.00 63.50 62.32 3h1j n PRO 286 Cb 0.44 -1.83 -0.10 0.00 -0.04 0.00 0.00 33.50 31.97 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 1.50 -0.37 0.04 3.54 3.84 -1.26 -5.07 114.94 117.16 3h1j s ASN 287 Ca 0.51 0.65 -0.27 0.00 0.21 0.00 0.00 52.86 53.97 3h1j s ASN 287 Cb 0.27 0.70 -0.15 0.00 -0.55 0.00 0.00 41.25 41.52 3h1j s ASN 287 CO -0.05 -0.19 1.40 0.50 -2.79 0.00 0.00 177.10 175.97 3h1j h LYS 288 N 5.23 -0.92 -0.38 0.43 3.64 -1.98 -2.42 116.57 120.17 3h1j h LYS 288 Ca -0.27 0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 3h1j h LYS 288 Cb 1.18 0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 3h1j h LYS 288 CO 0.29 -0.61 0.21 1.25 -2.27 0.00 0.00 179.45 178.32 3h1j h LEU 289 N -0.95 0.48 0.06 5.20 5.85 -1.97 -2.05 115.31 121.93 3h1j h LEU 289 Ca -0.10 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.56 3h1j h LEU 289 Cb 0.73 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 3h1j h LEU 289 CO 0.15 0.44 -0.24 1.23 -0.34 0.00 0.00 178.44 179.67 3h1j h GLY 290 N 0.49 -0.41 0.16 3.75 0.00 -1.94 0.27 103.07 105.39 3h1j h GLY 290 Ca 0.14 0.29 0.15 0.00 0.00 0.00 0.00 47.33 47.91 3h1j h GLY 290 CO -0.02 -0.21 0.38 -1.33 0.00 0.00 0.00 176.54 175.36 3h1j h GLY 291 N -0.41 1.30 0.74 4.60 0.00 -1.32 0.74 103.07 108.73 3h1j h GLY 291 Ca 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3h1j h GLY 291 CO -0.18 -0.08 0.00 -2.08 0.00 0.00 0.00 176.54 174.20 3h1j h VAL 292 N 0.53 1.24 -0.47 4.60 2.07 -0.65 0.58 116.25 124.15 3h1j h VAL 292 Ca 0.45 -0.74 0.06 0.00 0.82 0.00 0.00 66.70 67.29 3h1j h VAL 292 Cb 0.68 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 32.00 3h1j h VAL 292 CO -0.39 0.21 0.16 -0.07 0.02 0.00 0.00 177.57 177.49 3h1j h LEU 293 N -0.16 0.16 -0.49 2.57 3.38 0.85 0.30 115.31 121.92 3h1j h LEU 293 Ca 0.02 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.08 3h1j h LEU 293 Cb 0.32 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3h1j h LEU 293 CO 0.00 0.12 0.27 0.00 0.09 0.00 0.00 178.44 178.92 3h1j h ALA 294 N 1.32 0.63 0.38 1.53 0.00 0.61 0.36 119.26 124.07 3h1j h ALA 294 Ca 0.22 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3h1j h ALA 294 Cb 0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3h1j h ALA 294 CO -0.23 -0.05 -0.39 1.25 0.00 0.00 0.00 179.25 179.83 3h1j h LEU 295 N 0.54 -1.05 -0.35 0.00 5.85 0.39 0.29 115.31 120.97 3h1j h LEU 295 Ca 0.21 0.09 0.08 0.00 0.84 0.00 0.00 57.88 59.09 3h1j h LEU 295 Cb 0.07 0.35 -0.08 0.00 0.37 0.00 0.00 40.66 41.37 3h1j h LEU 295 CO -0.12 -0.53 -0.22 0.00 -0.34 0.00 0.00 178.44 177.23 3h1j h ALA 296 N -0.39 0.02 -0.84 1.25 0.00 0.03 -1.85 119.26 117.48 3h1j h ALA 296 Ca -0.03 0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.07 3h1j h ALA 296 Cb 0.71 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.93 3h1j h ALA 296 CO -0.07 -0.60 0.52 0.00 0.00 0.00 0.00 179.25 179.10 3h1j h ALA 297 N 1.03 1.16 -0.37 0.00 0.00 0.17 0.58 119.26 121.83 3h1j h ALA 297 Ca 0.18 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.19 3h1j h ALA 297 Cb 0.44 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3h1j h ALA 297 CO -0.45 0.24 0.46 0.66 0.00 0.00 0.00 179.25 180.16 3h1j h SER 298 N 0.93 0.00 0.00 0.00 4.64 0.46 0.16 113.55 119.74 3h1j h SER 298 Ca 0.37 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.44 3h1j h SER 298 Cb 0.19 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.25 3h1j h SER 298 CO -0.18 0.00 -1.85 0.52 -0.87 0.00 0.00 176.83 174.45 3h1j n VAL 299 N -3.58 0.84 -0.17 0.95 0.31 -0.84 -4.58 118.33 111.26 3h1j n VAL 299 Ca 0.07 -0.23 0.20 0.00 -0.01 0.00 0.00 64.34 64.37 3h1j n VAL 299 Cb 0.62 -1.62 0.58 0.00 -0.91 0.00 0.00 33.84 32.51 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 -0.48 0.25 -1.70 7.52 3.38 -0.74 -1.42 115.31 122.12 3h1j h LEU 300 Ca -0.38 0.02 0.05 0.00 0.09 0.00 0.00 57.88 57.66 3h1j h LEU 300 Cb 1.36 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 3h1j h LEU 300 CO -0.21 0.11 0.50 -0.29 0.09 0.00 0.00 178.44 178.64 3h1j h ILE 301 N 0.26 0.11 -0.32 1.22 2.10 -0.89 0.20 117.51 120.18 3h1j h ILE 301 Ca 0.40 0.00 0.08 0.00 1.08 0.00 0.00 64.86 66.42 3h1j h ILE 301 Cb 1.17 0.54 -0.01 0.00 -1.09 0.00 0.00 36.82 37.42 3h1j h ILE 301 CO -0.10 0.00 0.23 -0.07 -1.08 0.00 0.00 178.15 177.13 3h1j h LEU 302 N 0.00 0.05 -1.90 2.19 3.38 -1.52 0.93 115.31 118.44 3h1j h LEU 302 Ca 0.09 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 3h1j h LEU 302 Cb 1.08 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 3h1j h LEU 302 CO -0.00 0.03 -0.11 -0.26 0.09 0.00 0.00 178.44 178.19 3h1j h PHE 303 N 0.06 0.00 0.04 1.13 0.05 -0.83 -2.99 116.94 114.39 3h1j h PHE 303 Ca 0.15 0.00 -0.23 0.00 3.82 0.00 0.00 57.97 61.71 3h1j h PHE 303 Cb 0.53 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 38.46 3h1j h PHE 303 CO -0.00 0.11 -1.07 -0.07 -0.18 0.00 0.00 178.31 177.10 3h1j h LEU 304 N 0.00 0.13 -0.71 1.54 3.38 -0.98 -3.38 115.31 115.29 3h1j h LEU 304 Ca -0.00 -0.14 0.18 0.00 0.09 0.00 0.00 57.88 58.01 3h1j h LEU 304 Cb 0.22 -0.04 -0.13 0.00 0.09 0.00 0.00 40.66 40.79 3h1j h LEU 304 CO 0.01 1.10 -0.04 -0.38 0.09 0.00 0.00 178.44 179.23 3h1j n ILE 305 N -3.41 -0.30 -0.24 1.22 2.08 -1.13 0.29 119.36 117.87 3h1j n ILE 305 Ca -0.03 1.59 0.06 0.00 0.56 0.00 0.00 62.75 64.93 3h1j n ILE 305 Cb 0.96 -2.28 0.32 0.00 -0.75 0.00 0.00 39.64 37.89 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 0.81 -0.03 0.38 0.11 -1.79 -0.91 132.00 130.56 3h1j h PRO 306 Ca 0.41 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.47 3h1j h PRO 306 Cb 0.79 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.71 3h1j h PRO 306 CO -0.69 0.54 0.00 1.19 -0.21 0.00 0.00 178.00 178.83 3h1j n PHE 307 N -4.49 0.03 0.11 0.65 3.72 0.14 -3.45 117.46 114.17 3h1j n PHE 307 Ca 0.13 -0.01 0.08 0.00 -0.05 0.00 0.00 57.45 57.59 3h1j n PHE 307 Cb 0.25 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 38.95 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 -0.24 2.92 -4.62 4.37 4.77 -0.36 -4.92 117.00 118.93 3h1j n LEU 308 Ca 0.20 -1.60 -0.43 0.00 -0.03 0.00 0.00 56.01 54.14 3h1j n LEU 308 Cb 0.25 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 3h1j n LEU 308 CO 0.16 0.66 0.96 -2.28 -1.33 0.00 0.00 177.39 175.56 3h1j s HIS 309 N -1.13 3.01 -0.11 -1.77 2.46 -1.18 -4.14 115.29 112.42 3h1j s HIS 309 Ca 0.27 0.95 0.07 0.00 0.47 0.00 0.00 55.06 56.82 3h1j s HIS 309 Cb 0.16 -3.98 -0.10 0.00 -0.13 0.00 0.00 32.58 28.53 3h1j s HIS 309 CO 0.21 -0.98 0.20 1.63 -2.47 0.00 0.00 174.74 173.33 3h1j n LYS 310 N 7.24 1.79 -1.71 2.88 4.76 -1.26 -5.03 118.16 126.83 3h1j n LYS 310 Ca 0.11 -0.04 -0.37 0.00 -2.87 0.00 0.00 58.31 55.14 3h1j n LYS 310 Cb 0.48 -1.04 0.06 0.00 -1.84 0.00 0.00 35.03 32.69 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 -1.54 2.00 -0.09 4.39 2.88 -1.26 -4.59 113.62 115.42 3h1j n SER 311 Ca -0.00 0.86 0.12 0.00 -1.33 0.00 0.00 58.87 58.52 3h1j n SER 311 Cb 0.15 -1.54 0.32 0.00 -0.75 0.00 0.00 64.21 62.40 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 -1.58 0.30 -4.22 -1.46 4.76 -1.26 -4.81 118.16 109.90 3h1j n LYS 312 Ca 0.14 -0.17 -0.30 0.00 -2.87 0.00 0.00 58.31 55.11 3h1j n LYS 312 Cb 0.47 -1.50 -0.09 0.00 -1.84 0.00 0.00 35.03 32.07 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 -2.81 2.29 0.06 1.97 -0.21 -1.26 -5.07 119.66 114.62 3h1j s GLN 313 Ca 0.16 -0.94 -0.06 0.00 0.02 0.00 0.00 55.36 54.54 3h1j s GLN 313 Cb 0.18 -2.39 -0.30 0.00 1.00 0.00 0.00 33.01 31.50 3h1j s GLN 313 CO 0.63 0.53 1.07 -0.09 -2.12 0.00 0.00 175.29 175.30 3h1j h ARG 314 N 3.65 0.32 -5.76 2.91 2.43 -1.87 -3.48 114.38 112.58 3h1j h ARG 314 Ca -0.48 -0.54 -0.60 0.00 -0.81 0.00 0.00 59.98 57.55 3h1j h ARG 314 Cb 1.17 0.20 -0.09 0.00 -0.42 0.00 0.00 29.97 30.83 3h1j h ARG 314 CO 0.55 1.25 -0.46 0.95 -1.51 0.00 0.00 179.97 180.74 3h1j s THR 315 N -2.64 1.91 -2.36 0.20 -4.23 -1.26 -3.36 115.64 103.90 3h1j s THR 315 Ca -0.06 -1.72 0.22 0.00 -1.18 0.00 0.00 61.69 58.95 3h1j s THR 315 Cb 0.06 -2.62 0.44 0.00 1.34 0.00 0.00 72.50 71.72 3h1j s THR 315 CO 0.89 0.00 1.49 0.23 -0.54 0.00 0.00 174.62 176.69 3h1j n MET 316 N -1.36 1.98 -0.35 3.99 2.81 -0.89 -4.34 117.12 118.96 3h1j n MET 316 Ca -0.05 -1.48 0.10 0.00 -1.81 0.00 0.00 57.70 54.46 3h1j n MET 316 Cb 0.65 -1.43 0.28 0.00 -0.71 0.00 0.00 33.22 32.01 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 2.97 0.83 -0.33 2.03 2.02 -1.83 -1.90 112.91 116.70 3h1j h THR 317 Ca 0.00 -0.30 -0.07 0.00 0.77 0.00 0.00 66.41 66.81 3h1j h THR 317 Cb 0.65 -0.13 -0.04 0.00 -1.74 0.00 0.00 68.15 66.89 3h1j h THR 317 CO 0.00 0.16 0.02 0.49 0.37 0.00 0.00 175.52 176.56 3h1j n PHE 318 N -4.67 1.14 -3.76 3.16 0.99 -1.26 -4.79 117.46 108.26 3h1j n PHE 318 Ca 0.21 -1.08 -0.29 0.00 -0.00 0.00 0.00 57.45 56.29 3h1j n PHE 318 Cb 0.45 -0.40 -0.12 0.00 -1.00 0.00 0.00 39.48 38.41 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 -2.95 1.71 0.29 -1.08 0.52 -0.71 -4.98 118.95 111.75 3h1j s ARG 319 Ca 0.44 -2.54 0.02 0.00 -0.52 0.00 0.00 55.73 53.14 3h1j s ARG 319 Cb 0.37 -2.70 0.59 0.00 0.52 0.00 0.00 34.95 33.73 3h1j s ARG 319 CO 0.07 -1.22 1.85 -1.00 0.02 0.00 0.00 175.30 175.01 3h1j h PRO 320 N 6.12 0.93 0.08 3.54 0.13 -1.87 0.01 132.00 140.94 3h1j h PRO 320 Ca 0.07 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3h1j h PRO 320 Cb 0.87 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 31.79 3h1j h PRO 320 CO 0.57 0.61 -0.04 -0.07 -0.23 0.00 0.00 178.00 178.85 3h1j h LEU 321 N 0.96 -0.09 -1.39 1.56 3.38 -1.94 -2.44 115.31 115.35 3h1j h LEU 321 Ca 0.48 -0.31 0.11 0.00 0.09 0.00 0.00 57.88 58.26 3h1j h LEU 321 Cb 0.51 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 3h1j h LEU 321 CO -0.25 0.26 0.52 0.28 0.09 0.00 0.00 178.44 179.34 3h1j h SER 322 N -0.46 0.60 -0.77 -0.43 0.02 -1.77 -1.24 113.55 109.49 3h1j h SER 322 Ca -0.01 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3h1j h SER 322 Cb 0.39 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.80 3h1j h SER 322 CO 0.02 0.34 0.43 1.56 -1.14 0.00 0.00 176.83 178.04 3h1j h GLN 323 N 0.66 1.07 -0.15 3.45 4.20 -0.76 -0.07 115.11 123.50 3h1j h GLN 323 Ca 0.38 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.92 3h1j h GLN 323 Cb 0.56 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.13 3h1j h GLN 323 CO -0.15 0.79 -0.09 1.15 -0.67 0.00 0.00 178.83 179.86 3h1j h THR 324 N 1.07 1.32 -1.00 -0.54 2.02 -0.78 -1.84 112.91 113.16 3h1j h THR 324 Ca 0.27 -1.16 0.11 0.00 0.77 0.00 0.00 66.41 66.40 3h1j h THR 324 Cb 0.02 1.75 -0.08 0.00 -1.74 0.00 0.00 68.15 68.11 3h1j h THR 324 CO -0.04 0.34 0.64 0.25 0.37 0.00 0.00 175.52 177.07 3h1j h LEU 325 N -0.01 0.95 0.62 2.58 5.85 -1.18 0.06 115.31 124.19 3h1j h LEU 325 Ca 0.03 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 3h1j h LEU 325 Cb 0.57 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3h1j h LEU 325 CO 0.03 0.53 -0.33 0.15 -0.34 0.00 0.00 178.44 178.48 3h1j h PHE 326 N 1.04 -0.86 0.00 1.25 3.57 -0.67 -1.53 116.94 119.74 3h1j h PHE 326 Ca 0.48 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.95 3h1j h PHE 326 Cb 0.41 0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.44 3h1j h PHE 326 CO -0.00 -0.52 -0.06 -1.49 -2.23 0.00 0.00 178.31 174.01 3h1j h TRP 327 N -0.88 0.00 -0.10 0.41 4.06 -0.90 -0.76 115.95 117.79 3h1j h TRP 327 Ca -0.08 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.84 3h1j h TRP 327 Cb 0.69 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.84 3h1j h TRP 327 CO -0.06 0.06 -0.05 1.25 -3.56 0.00 0.00 178.44 176.08 3h1j h LEU 328 N 0.00 0.21 -0.72 -4.49 5.85 -0.61 -1.81 115.31 113.74 3h1j h LEU 328 Ca -0.00 -0.43 0.04 0.00 0.84 0.00 0.00 57.88 58.34 3h1j h LEU 328 Cb 0.23 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 3h1j h LEU 328 CO 0.01 0.59 0.44 0.25 -0.34 0.00 0.00 178.44 179.39 3h1j h LEU 329 N -0.17 0.69 -0.23 2.25 5.85 -0.17 0.42 115.31 123.96 3h1j h LEU 329 Ca 0.02 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.77 3h1j h LEU 329 Cb 0.52 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3h1j h LEU 329 CO 0.02 0.47 0.11 0.58 -0.34 0.00 0.00 178.44 179.27 3h1j h VAL 330 N 0.83 1.00 -0.28 1.05 2.07 -1.00 -0.98 116.25 118.94 3h1j h VAL 330 Ca 0.30 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.68 3h1j h VAL 330 Cb 0.09 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 3h1j h VAL 330 CO -0.14 0.04 -0.08 0.00 0.02 0.00 0.00 177.57 177.41 3h1j h ALA 331 N 1.11 1.34 -0.53 1.67 0.00 -0.77 -1.03 119.26 121.06 3h1j h ALA 331 Ca 0.09 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.83 3h1j h ALA 331 Cb 0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 3h1j h ALA 331 CO -0.06 0.45 0.22 -0.97 0.00 0.00 0.00 179.25 178.88 3h1j h ASN 332 N 0.42 0.26 -0.40 0.00 -0.73 0.80 0.28 115.58 116.21 3h1j h ASN 332 Ca 0.08 0.05 -0.12 0.00 1.87 0.00 0.00 56.30 58.19 3h1j h ASN 332 Cb 0.41 0.02 -0.01 0.00 0.27 0.00 0.00 38.32 39.01 3h1j h ASN 332 CO 0.02 0.17 -0.20 -0.07 -0.37 0.00 0.00 177.43 176.98 3h1j h LEU 333 N 0.42 0.87 -0.95 0.34 3.38 -0.60 0.19 115.31 118.97 3h1j h LEU 333 Ca 0.25 -0.41 0.11 0.00 0.09 0.00 0.00 57.88 57.92 3h1j h LEU 333 Cb 0.24 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.67 3h1j h LEU 333 CO -0.23 1.09 0.58 0.25 0.09 0.00 0.00 178.44 180.22 3h1j h LEU 334 N 0.66 0.85 0.28 1.67 5.85 -0.50 0.33 115.31 124.46 3h1j h LEU 334 Ca 0.09 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3h1j h LEU 334 Cb 0.76 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.67 3h1j h LEU 334 CO 0.06 0.47 -0.14 0.40 -0.34 0.00 0.00 178.44 178.90 3h1j h ILE 335 N 0.95 0.75 -0.94 4.05 2.04 0.02 -1.55 117.51 122.81 3h1j h ILE 335 Ca 0.46 -0.50 0.15 0.00 1.00 0.00 0.00 64.86 65.97 3h1j h ILE 335 Cb 0.42 1.02 -0.10 0.00 -0.74 0.00 0.00 36.82 37.42 3h1j h ILE 335 CO -0.25 0.10 0.55 -0.07 0.00 0.00 0.00 178.15 178.48 3h1j h LEU 336 N -0.66 0.73 -0.11 1.44 3.38 -0.01 0.15 115.31 120.23 3h1j h LEU 336 Ca -0.04 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3h1j h LEU 336 Cb 0.46 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3h1j h LEU 336 CO 0.06 0.32 0.06 0.74 0.09 0.00 0.00 178.44 179.72 3h1j h THR 337 N 0.78 1.06 -0.09 0.22 2.02 -0.22 0.06 112.91 116.74 3h1j h THR 337 Ca 0.51 -0.16 0.04 0.00 0.77 0.00 0.00 66.41 67.57 3h1j h THR 337 Cb 0.69 0.98 -0.05 0.00 -1.74 0.00 0.00 68.15 68.02 3h1j h THR 337 CO -0.34 0.06 -0.26 -0.25 0.37 0.00 0.00 175.52 175.10 3h1j h TRP 338 N 0.11 -0.69 -0.53 3.16 7.01 -0.06 -2.25 115.95 122.70 3h1j h TRP 338 Ca 0.04 0.03 0.10 0.00 2.11 0.00 0.00 58.89 61.17 3h1j h TRP 338 Cb 0.04 0.32 -0.08 0.00 -2.10 0.00 0.00 29.16 27.33 3h1j h TRP 338 CO -0.06 -0.34 0.06 0.82 -2.79 0.00 0.00 178.44 176.13 3h1j h ILE 339 N -0.34 0.63 -0.96 2.65 1.08 -0.44 -1.65 117.51 118.48 3h1j h ILE 339 Ca 0.09 -0.06 0.25 0.00 -0.39 0.00 0.00 64.86 64.75 3h1j h ILE 339 Cb 0.47 0.44 -0.06 0.00 -3.07 0.00 0.00 36.82 34.60 3h1j h ILE 339 CO -0.29 0.03 0.66 1.23 -0.69 0.00 0.00 178.15 179.09 3h1j h GLY 340 N 0.18 0.50 1.97 5.37 0.00 -0.38 0.18 103.07 110.89 3h1j h GLY 340 Ca 0.27 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.51 3h1j h GLY 340 CO -0.40 -0.03 -0.02 -1.14 0.00 0.00 0.00 176.54 174.95 3h1j n SER 341 N -4.40 0.12 -4.94 0.19 3.41 -0.63 -4.86 113.62 102.52 3h1j n SER 341 Ca 0.21 0.49 -0.27 0.00 -0.26 0.00 0.00 58.87 59.04 3h1j n SER 341 Cb 0.90 -0.51 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 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 -3.01 3.47 0.65 4.33 -1.52 0.64 -5.07 119.66 119.14 3h1j s GLN 342 Ca 0.13 -0.50 -0.16 0.00 -1.95 0.00 0.00 55.36 52.88 3h1j s GLN 342 Cb 0.18 -2.92 -0.00 0.00 -0.22 0.00 0.00 33.01 30.05 3h1j s GLN 342 CO 0.54 0.48 1.15 -1.25 -0.25 0.00 0.00 175.29 175.97 3h1j s PRO 343 N -3.24 2.71 -1.03 2.91 0.04 -1.26 -4.89 135.00 130.24 3h1j s PRO 343 Ca 0.36 1.58 -0.23 0.00 0.04 0.00 0.00 61.00 62.74 3h1j s PRO 343 Cb -0.11 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 3h1j s PRO 343 CO 0.29 -1.35 1.77 0.08 0.04 0.00 0.00 177.00 177.82 3h1j s VAL 344 N -2.07 3.68 0.21 -0.36 1.01 -1.26 -4.71 120.40 116.90 3h1j s VAL 344 Ca 0.71 -0.74 -0.18 0.00 0.00 0.00 0.00 61.98 61.77 3h1j s VAL 344 Cb -0.25 -4.55 0.03 0.00 0.00 0.00 0.00 36.38 31.61 3h1j s VAL 344 CO 0.39 -1.38 0.54 -1.61 0.00 0.00 0.00 175.10 173.05 3h1j s GLU 345 N 6.00 1.43 0.43 2.72 2.02 -1.26 -4.97 118.70 125.07 3h1j s GLU 345 Ca 0.61 -0.90 -0.23 0.00 0.02 0.00 0.00 54.97 54.47 3h1j s GLU 345 Cb -0.03 0.53 -0.09 0.00 0.10 0.00 0.00 34.13 34.65 3h1j s GLU 345 CO -0.01 -0.61 1.06 -1.58 0.02 0.00 0.00 175.26 174.14 3h1j s HIS 346 N -3.89 3.14 -1.38 1.61 5.65 -1.26 -0.82 115.29 118.33 3h1j s HIS 346 Ca 0.10 1.61 0.28 0.00 0.25 0.00 0.00 55.06 57.30 3h1j s HIS 346 Cb -0.01 -3.14 1.03 0.00 -1.18 0.00 0.00 32.58 29.28 3h1j s HIS 346 CO -0.01 -0.79 1.75 -0.35 -0.65 0.00 0.00 174.74 174.69 3h1j n PRO 347 N -0.40 0.41 -0.20 2.88 -0.04 -1.26 -4.86 135.00 131.52 3h1j n PRO 347 Ca 0.07 -0.15 -0.07 0.00 -0.04 0.00 0.00 63.50 63.30 3h1j n PRO 347 Cb 0.50 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.45 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 0.38 -1.13 -0.31 0.54 0.05 -1.61 -1.58 116.94 113.28 3h1j h PHE 348 Ca 0.00 0.08 0.04 0.00 3.82 0.00 0.00 57.97 61.90 3h1j h PHE 348 Cb 0.43 0.58 -0.06 0.00 2.00 0.00 0.00 35.95 38.90 3h1j h PHE 348 CO 0.00 -0.41 -0.41 0.82 -0.18 0.00 0.00 178.31 178.13 3h1j h ILE 349 N -0.20 0.00 -0.20 -0.55 2.04 -1.26 0.18 117.51 117.51 3h1j h ILE 349 Ca 0.20 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.10 3h1j h ILE 349 Cb 0.56 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.60 3h1j h ILE 349 CO -0.68 0.00 -0.06 -0.29 0.00 0.00 0.00 178.15 177.12 3h1j h ILE 350 N -0.29 0.78 -0.50 -0.67 6.09 -1.77 -0.69 117.51 120.47 3h1j h ILE 350 Ca 0.05 0.00 0.10 0.00 -1.37 0.00 0.00 64.86 63.64 3h1j h ILE 350 Cb 0.44 0.78 -0.09 0.00 0.47 0.00 0.00 36.82 38.42 3h1j h ILE 350 CO -0.44 0.00 -0.06 0.40 -3.07 0.00 0.00 178.15 174.97 3h1j h ILE 351 N -0.01 0.55 -0.05 2.19 2.04 -0.71 0.34 117.51 121.86 3h1j h ILE 351 Ca 0.10 -0.02 0.04 0.00 1.00 0.00 0.00 64.86 65.98 3h1j h ILE 351 Cb 0.16 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 36.68 3h1j h ILE 351 CO -0.21 0.01 -0.26 1.23 0.00 0.00 0.00 178.15 178.92 3h1j h GLY 352 N 0.05 -0.35 0.44 5.37 0.00 0.08 0.13 103.07 108.79 3h1j h GLY 352 Ca 0.25 0.31 0.12 0.00 0.00 0.00 0.00 47.33 48.00 3h1j h GLY 352 CO -0.47 -0.21 0.56 1.46 0.00 0.00 0.00 176.54 177.88 3h1j h GLN 353 N -0.37 0.85 0.83 4.80 4.20 -0.11 0.12 115.11 125.43 3h1j h GLN 353 Ca 0.08 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.69 3h1j h GLN 353 Cb 0.48 -0.19 0.01 0.00 0.30 0.00 0.00 27.48 28.07 3h1j h GLN 353 CO -0.26 0.56 -0.40 0.52 -0.67 0.00 0.00 178.83 178.59 3h1j h MET 354 N 0.88 -1.07 -0.86 1.46 2.86 -0.21 -0.28 114.93 117.71 3h1j h MET 354 Ca 0.46 0.07 0.22 0.00 -2.06 0.00 0.00 59.70 58.40 3h1j h MET 354 Cb 0.48 0.24 -0.14 0.00 0.06 0.00 0.00 31.60 32.24 3h1j h MET 354 CO -0.28 -0.71 0.14 0.00 1.06 0.00 0.00 176.91 177.12 3h1j h ALA 355 N -1.36 1.12 0.85 6.32 0.00 -0.08 1.32 119.26 127.43 3h1j h ALA 355 Ca -0.11 0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3h1j h ALA 355 Cb 0.85 0.38 0.01 0.00 0.00 0.00 0.00 17.79 19.03 3h1j h ALA 355 CO 0.19 -0.47 -0.44 0.77 0.00 0.00 0.00 179.25 179.30 3h1j h SER 356 N 0.15 -1.05 -0.61 0.00 0.02 -0.69 0.78 113.55 112.16 3h1j h SER 356 Ca 0.52 0.04 0.11 0.00 -0.84 0.00 0.00 61.79 61.63 3h1j h SER 356 Cb 1.02 0.28 -0.09 0.00 0.14 0.00 0.00 62.40 63.75 3h1j h SER 356 CO -0.69 -0.72 0.13 0.25 -1.14 0.00 0.00 176.83 174.66 3h1j h LEU 357 N -1.18 0.00 -0.06 5.07 5.85 0.10 -1.45 115.31 123.65 3h1j h LEU 357 Ca -0.12 0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.76 3h1j h LEU 357 Cb 0.91 0.15 -0.06 0.00 0.37 0.00 0.00 40.66 42.04 3h1j h LEU 357 CO 0.17 0.01 -0.38 -1.28 -0.34 0.00 0.00 178.44 176.63 3h1j h SER 358 N 0.26 -1.15 -0.43 1.25 0.87 0.22 -2.43 113.55 112.13 3h1j h SER 358 Ca 0.32 0.15 0.05 0.00 -1.23 0.00 0.00 61.79 61.08 3h1j h SER 358 Cb 0.48 0.47 -0.08 0.00 -0.44 0.00 0.00 62.40 62.83 3h1j h SER 358 CO -0.41 -0.41 -0.52 0.22 -0.53 0.00 0.00 176.83 175.18 3h1j h TYR 359 N -0.49 -1.59 0.00 2.24 3.20 0.16 -0.89 116.97 119.60 3h1j h TYR 359 Ca 0.07 0.08 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 3h1j h TYR 359 Cb 0.61 0.75 -0.00 0.00 1.54 0.00 0.00 36.73 39.62 3h1j h TYR 359 CO -0.42 -0.44 -0.03 0.74 -1.64 0.00 0.00 178.16 176.37 3h1j h PHE 360 N -0.33 0.00 0.08 -3.82 -1.00 -1.37 -2.71 116.94 107.79 3h1j h PHE 360 Ca 0.07 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.71 3h1j h PHE 360 Cb 0.53 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.11 3h1j h PHE 360 CO -0.75 0.03 -0.62 1.15 -1.61 0.00 0.00 178.31 176.51 3h1j h THR 361 N 0.00 1.53 -0.76 -1.55 2.02 -0.71 -1.30 112.91 112.14 3h1j h THR 361 Ca -0.00 -2.37 0.04 0.00 0.77 0.00 0.00 66.41 64.85 3h1j h THR 361 Cb 0.16 3.06 -0.04 0.00 -1.74 0.00 0.00 68.15 69.59 3h1j h THR 361 CO 0.00 0.67 0.50 0.40 0.37 0.00 0.00 175.52 177.46 3h1j h ILE 362 N -0.40 1.11 0.17 3.11 2.04 -0.92 0.13 117.51 122.74 3h1j h ILE 362 Ca -0.10 -0.31 -0.31 0.00 1.00 0.00 0.00 64.86 65.13 3h1j h ILE 362 Cb 1.44 0.12 0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3h1j h ILE 362 CO 0.12 0.17 -1.32 -0.07 0.00 0.00 0.00 178.15 177.04 3h1j h LEU 363 N 0.91 0.87 0.00 1.44 3.38 -1.55 -1.99 115.31 118.36 3h1j h LEU 363 Ca 0.30 -0.86 -0.24 0.00 0.09 0.00 0.00 57.88 57.18 3h1j h LEU 363 Cb 0.08 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 3h1j h LEU 363 CO -0.09 1.65 -1.53 -0.07 0.09 0.00 0.00 178.44 178.49 3h1j h LEU 364 N 0.22 0.00 0.00 1.67 3.38 -1.11 -3.43 115.31 116.03 3h1j h LEU 364 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 3h1j h LEU 364 Cb 2.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.75 3h1j h LEU 364 CO 0.25 0.84 -0.77 -0.38 0.09 0.00 0.00 178.44 178.48 3h1j n ILE 365 N -3.02 0.29 0.21 1.22 5.41 0.37 -4.73 119.36 119.10 3h1j n ILE 365 Ca -0.13 0.09 -0.15 0.00 1.00 0.00 0.00 62.75 63.57 3h1j n ILE 365 Cb 0.96 -1.52 -0.08 0.00 -0.71 0.00 0.00 39.64 38.29 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 0.00 -0.41 -0.06 1.39 3.38 -1.41 -2.14 115.31 116.06 3h1j h LEU 366 Ca 0.00 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.98 3h1j h LEU 366 Cb 0.77 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.56 3h1j h LEU 366 CO 0.00 -0.24 -0.49 -0.26 0.09 0.00 0.00 178.44 177.54 3h1j h PHE 367 N -0.55 -1.41 -0.70 1.13 0.05 -1.60 0.71 116.94 114.56 3h1j h PHE 367 Ca -0.05 0.05 0.04 0.00 3.82 0.00 0.00 57.97 61.83 3h1j h PHE 367 Cb 0.41 0.63 -0.05 0.00 2.00 0.00 0.00 35.95 38.94 3h1j h PHE 367 CO -0.04 -0.53 0.43 -1.00 -0.18 0.00 0.00 178.31 176.99 3h1j h PRO 368 N -0.60 0.80 0.45 1.51 0.13 -1.72 -1.09 132.00 131.50 3h1j h PRO 368 Ca 0.04 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.11 3h1j h PRO 368 Cb 0.68 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 3h1j h PRO 368 CO -0.38 0.53 -0.33 1.15 -0.23 0.00 0.00 178.00 178.75 3h1j h THR 369 N 0.83 0.32 -0.44 1.56 2.02 -0.53 -1.78 112.91 114.89 3h1j h THR 369 Ca 0.29 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.54 3h1j h THR 369 Cb 0.06 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.77 3h1j h THR 369 CO -0.13 0.00 0.30 0.40 0.37 0.00 0.00 175.52 176.46 3h1j h ILE 370 N -0.77 0.92 -0.33 3.11 1.08 0.62 -0.75 117.51 121.39 3h1j h ILE 370 Ca -0.05 -0.09 -0.02 0.00 -0.39 0.00 0.00 64.86 64.31 3h1j h ILE 370 Cb 0.65 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 35.01 3h1j h ILE 370 CO 0.02 0.05 0.14 1.23 -0.69 0.00 0.00 178.15 178.90 3h1j h GLY 371 N 0.27 0.52 0.95 5.37 0.00 -0.57 0.18 103.07 109.79 3h1j h GLY 371 Ca 0.20 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 3h1j h GLY 371 CO -0.04 0.26 -0.00 -0.84 0.00 0.00 0.00 176.54 175.92 3h1j h THR 372 N 0.39 1.03 -0.30 4.70 2.02 -0.51 -1.33 112.91 118.91 3h1j h THR 372 Ca 0.11 -0.12 0.06 0.00 0.77 0.00 0.00 66.41 67.23 3h1j h THR 372 Cb 0.16 1.12 -0.06 0.00 -1.74 0.00 0.00 68.15 67.63 3h1j h THR 372 CO -0.01 0.03 -0.09 0.25 0.37 0.00 0.00 175.52 176.07 3h1j h LEU 373 N -0.06 -0.32 -1.24 2.58 5.85 -0.93 -1.26 115.31 119.92 3h1j h LEU 373 Ca -0.00 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.89 3h1j h LEU 373 Cb 0.06 0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.24 3h1j h LEU 373 CO 0.00 -0.12 0.55 -0.33 -0.34 0.00 0.00 178.44 178.20 3h1j h GLU 374 N -0.02 0.88 -0.74 1.25 5.08 -0.43 -0.81 114.58 119.78 3h1j h GLU 374 Ca 0.15 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 3h1j h GLU 374 Cb 0.25 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 3h1j h GLU 374 CO -0.32 0.58 0.32 -0.91 -1.00 0.00 0.00 179.01 177.68 3h1j h ASN 375 N 0.90 1.00 -0.20 1.42 2.35 -0.09 -1.60 115.58 119.36 3h1j h ASN 375 Ca 0.37 -0.16 -0.10 0.00 -0.55 0.00 0.00 56.30 55.86 3h1j h ASN 375 Cb 0.27 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3h1j h ASN 375 CO -0.14 0.89 -0.19 0.11 -1.65 0.00 0.00 177.43 176.45 3h1j h LYS 376 N 1.06 0.63 0.00 0.81 1.57 -0.57 -1.29 116.57 118.77 3h1j h LYS 376 Ca 0.25 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3h1j h LYS 376 Cb 0.18 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.44 3h1j h LYS 376 CO -0.02 0.78 0.00 0.52 -0.57 0.00 0.00 179.45 180.16 3h1j h MET 377 N 0.56 0.00 -0.01 3.15 2.86 -0.45 0.18 114.93 121.22 3h1j h MET 377 Ca 0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 3h1j h MET 377 Cb 0.64 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.30 3h1j h MET 377 CO 0.05 0.00 -0.14 1.28 1.06 0.00 0.00 176.91 179.15 3h1j n LEU 378 N -3.02 0.68 -0.97 1.22 4.77 -0.57 -4.90 117.00 114.21 3h1j n LEU 378 Ca 0.00 -0.10 -0.06 0.00 -0.03 0.00 0.00 56.01 55.82 3h1j n LEU 378 Cb 0.25 -0.15 0.01 0.00 -2.33 0.00 0.00 43.42 41.20 3h1j n LEU 378 CO 0.25 0.13 -0.02 -3.20 -1.33 0.00 0.00 177.39 173.22 3h1j n ASN 379 N -0.80 -2.76 -0.42 -1.43 5.15 0.05 -5.10 115.26 109.96 3h1j n ASN 379 Ca 0.14 -0.07 0.05 0.00 -0.60 0.00 0.00 54.58 54.11 3h1j n ASN 379 Cb 0.30 -1.78 0.04 0.00 -0.53 0.00 0.00 39.78 37.81 3h1j n ASN 379 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44