#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pa2 s GLN 1 N 0.00 3.81 0.54 0.03 -0.21 -1.26 -4.95 119.66 117.62 1pa2 s GLN 1 Ca 0.00 0.25 -0.20 0.00 0.02 0.00 0.00 55.36 55.43 1pa2 s GLN 1 Cb 0.00 -3.07 -0.06 0.00 1.00 0.00 0.00 33.01 30.88 1pa2 s GLN 1 CO 0.00 0.61 1.16 -0.51 -2.12 0.00 0.00 175.29 174.43 1pa2 s LEU 2 N -1.62 3.78 0.08 2.90 1.43 -1.26 -4.97 118.68 119.02 1pa2 s LEU 2 Ca 0.30 2.27 -0.08 0.00 -1.03 0.00 0.00 54.13 55.59 1pa2 s LEU 2 Cb -0.15 -4.51 -0.01 0.00 0.03 0.00 0.00 46.19 41.55 1pa2 s LEU 2 CO 0.16 -1.26 0.16 0.54 0.23 0.00 0.00 176.35 176.18 1pa2 s ASN 3 N -1.62 0.16 0.42 2.29 2.20 -0.12 -4.77 114.94 113.50 1pa2 s ASN 3 Ca 0.72 -0.66 0.21 0.00 -0.94 0.00 0.00 52.86 52.19 1pa2 s ASN 3 Cb -0.27 0.31 0.88 0.00 -2.00 0.00 0.00 41.25 40.18 1pa2 s ASN 3 CO 0.30 -0.69 1.82 0.00 -2.94 0.00 0.00 177.10 175.60 1pa2 h ALA 4 N 2.90 1.08 -0.44 3.54 0.00 -1.86 -0.27 119.26 124.23 1pa2 h ALA 4 Ca -0.34 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.25 1pa2 h ALA 4 Cb 1.19 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1pa2 h ALA 4 CO 0.57 0.36 0.04 0.25 0.00 0.00 0.00 179.25 180.47 1pa2 n THR 5 N -3.56 2.56 -0.33 0.00 -2.24 -1.26 -4.71 114.28 104.74 1pa2 n THR 5 Ca -0.01 -1.79 0.11 0.00 -2.27 0.00 0.00 64.05 60.09 1pa2 n THR 5 Cb 0.43 -0.29 0.31 0.00 -2.10 0.00 0.00 70.33 68.69 1pa2 n THR 5 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1pa2 h PHE 6 N 2.45 1.02 -0.59 4.78 3.57 -1.87 -0.96 116.94 125.34 1pa2 h PHE 6 Ca 0.07 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1pa2 h PHE 6 Cb 1.77 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 40.19 1pa2 h PHE 6 CO 0.84 0.33 0.00 0.66 -2.23 0.00 0.00 178.31 177.91 1pa2 n TYR 7 N -4.65 0.79 -0.30 0.41 4.01 -1.26 -4.69 117.16 111.48 1pa2 n TYR 7 Ca 0.20 -0.39 -0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1pa2 n TYR 7 Cb 0.47 0.00 0.13 0.00 -0.31 0.00 0.00 39.34 39.62 1pa2 n TYR 7 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1pa2 h SER 8 N 3.93 0.81 0.22 7.72 4.64 -1.45 0.25 113.55 129.68 1pa2 h SER 8 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1pa2 h SER 8 Cb 0.89 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1pa2 h SER 8 CO 0.00 0.53 -0.37 0.61 -0.87 0.00 0.00 176.83 176.73 1pa2 n GLY 9 N -1.32 -0.63 0.00 -0.77 0.00 -1.26 -3.93 105.19 97.28 1pa2 n GLY 9 Ca 0.11 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1pa2 n GLY 9 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pa2 n THR 10 N -0.73 0.00 -3.10 2.61 -2.24 -0.91 -4.88 114.28 105.02 1pa2 n THR 10 Ca 0.10 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.69 1pa2 n THR 10 Cb 0.36 -0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 67.88 1pa2 n THR 10 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pa2 h PRO 12 N 3.68 0.00 -0.62 0.00 0.13 -1.65 -1.92 132.00 131.62 1pa2 h PRO 12 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1pa2 h PRO 12 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1pa2 h PRO 12 CO 0.43 0.07 0.00 -1.71 -0.23 0.00 0.00 178.00 176.56 1pa2 n ASN 13 N -3.75 3.67 -0.25 1.44 4.05 -1.26 -4.59 115.26 114.57 1pa2 n ASN 13 Ca -0.02 -2.34 -0.02 0.00 0.45 0.00 0.00 54.58 52.65 1pa2 n ASN 13 Cb 0.18 -0.50 0.09 0.00 1.23 0.00 0.00 39.78 40.78 1pa2 n ASN 13 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1pa2 h ALA 14 N 3.73 0.93 -0.59 5.20 0.00 -1.71 -1.45 119.26 125.36 1pa2 h ALA 14 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1pa2 h ALA 14 Cb 1.15 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1pa2 h ALA 14 CO 0.18 0.15 0.31 1.03 0.00 0.00 0.00 179.25 180.91 1pa2 h SER 15 N 0.80 0.75 -0.28 0.00 0.87 -1.85 -0.82 113.55 113.03 1pa2 h SER 15 Ca 0.30 -0.11 -0.08 0.00 -1.23 0.00 0.00 61.79 60.66 1pa2 h SER 15 Cb 0.10 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 1pa2 h SER 15 CO -0.14 0.65 -0.10 0.00 -0.53 0.00 0.00 176.83 176.71 1pa2 h ALA 16 N 1.13 1.09 -0.18 6.23 0.00 -1.77 -1.42 119.26 124.34 1pa2 h ALA 16 Ca 0.21 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1pa2 h ALA 16 Cb 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1pa2 h ALA 16 CO -0.03 0.56 -0.01 0.82 0.00 0.00 0.00 179.25 180.59 1pa2 h ILE 17 N 0.63 1.26 -0.26 0.00 2.04 -0.85 -0.39 117.51 119.94 1pa2 h ILE 17 Ca 0.11 -0.91 0.03 0.00 1.00 0.00 0.00 64.86 65.09 1pa2 h ILE 17 Cb 0.54 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 1pa2 h ILE 17 CO 0.03 0.27 0.08 0.58 0.00 0.00 0.00 178.15 179.12 1pa2 h VAL 18 N 0.07 0.92 -0.62 1.67 2.07 -1.05 -1.64 116.25 117.67 1pa2 h VAL 18 Ca 0.05 -0.07 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1pa2 h VAL 18 Cb 0.42 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1pa2 h VAL 18 CO 0.01 0.04 0.25 -0.09 0.02 0.00 0.00 177.57 177.80 1pa2 h ARG 19 N 0.20 0.92 -0.72 1.57 2.43 -1.13 -1.79 114.38 115.87 1pa2 h ARG 19 Ca 0.12 -0.17 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1pa2 h ARG 19 Cb 0.09 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 1pa2 h ARG 19 CO -0.12 0.78 0.33 0.77 -1.51 0.00 0.00 179.97 180.22 1pa2 h SER 20 N 0.86 0.95 -0.59 -3.80 0.02 -0.91 0.75 113.55 110.83 1pa2 h SER 20 Ca 0.21 -0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1pa2 h SER 20 Cb 0.20 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.47 1pa2 h SER 20 CO -0.02 0.83 0.27 0.00 -1.14 0.00 0.00 176.83 176.77 1pa2 h THR 21 N 1.01 1.22 -0.12 -2.27 1.03 -1.00 -1.33 112.91 111.44 1pa2 h THR 21 Ca 0.24 -0.63 -0.20 0.00 -0.01 0.00 0.00 66.41 65.81 1pa2 h THR 21 Cb 0.14 0.53 0.00 0.00 -1.07 0.00 0.00 68.15 67.76 1pa2 h THR 21 CO -0.03 0.25 -0.75 0.40 -0.01 0.00 0.00 175.52 175.38 1pa2 h ILE 22 N 0.81 1.32 -0.75 0.00 2.04 -1.11 -1.70 117.51 118.12 1pa2 h ILE 22 Ca 0.20 -2.04 0.11 0.00 1.00 0.00 0.00 64.86 64.13 1pa2 h ILE 22 Cb 0.14 2.03 -0.08 0.00 -0.74 0.00 0.00 36.82 38.17 1pa2 h ILE 22 CO -0.02 0.63 0.37 -0.61 0.00 0.00 0.00 178.15 178.52 1pa2 h GLN 23 N 0.42 0.59 -0.49 2.37 -0.00 -0.64 0.19 115.11 117.54 1pa2 h GLN 23 Ca -0.04 -0.04 -0.07 0.00 -0.00 0.00 0.00 58.65 58.50 1pa2 h GLN 23 Cb 1.35 -0.13 -0.02 0.00 0.00 0.00 0.00 27.48 28.68 1pa2 h GLN 23 CO 0.14 0.39 0.03 1.96 0.00 0.00 0.00 178.83 181.35 1pa2 h GLN 24 N 0.61 0.85 -0.46 1.69 7.50 -1.04 -2.89 115.11 121.36 1pa2 h GLN 24 Ca 0.38 -0.26 -0.03 0.00 0.50 0.00 0.00 58.65 59.24 1pa2 h GLN 24 Cb 0.44 -0.08 -0.02 0.00 0.05 0.00 0.00 27.48 27.86 1pa2 h GLN 24 CO -0.30 0.88 0.15 0.00 -1.50 0.00 0.00 178.83 178.06 1pa2 h ALA 25 N 0.94 1.39 0.00 3.87 0.00 -0.57 -2.12 119.26 122.78 1pa2 h ALA 25 Ca 0.14 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1pa2 h ALA 25 Cb 0.48 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1pa2 h ALA 25 CO 0.02 0.45 -0.06 -0.07 0.00 0.00 0.00 179.25 179.58 1pa2 h LEU 26 N 0.66 0.00 -2.15 0.00 3.38 -0.77 -2.04 115.31 114.38 1pa2 h LEU 26 Ca 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1pa2 h LEU 26 Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1pa2 h LEU 26 CO -0.01 0.06 -0.05 1.56 0.09 0.00 0.00 178.44 180.09 1pa2 h GLN 27 N 0.00 0.00 -0.00 1.13 4.20 -1.31 -3.11 115.11 116.01 1pa2 h GLN 27 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1pa2 h GLN 27 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1pa2 h GLN 27 CO 0.01 0.05 -0.08 0.43 -0.67 0.00 0.00 178.83 178.57 1pa2 n SER 28 N -3.36 0.60 -3.38 1.46 7.64 -0.87 -4.90 113.62 110.82 1pa2 n SER 28 Ca -0.02 -0.80 -0.15 0.00 1.01 0.00 0.00 58.87 58.91 1pa2 n SER 28 Cb 0.20 0.60 -0.09 0.00 -1.01 0.00 0.00 64.21 63.91 1pa2 n SER 28 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1pa2 s ASP 29 N -0.88 1.35 0.02 6.43 2.15 -0.82 -5.01 116.67 119.90 1pa2 s ASP 29 Ca 0.02 -0.74 0.18 0.00 0.43 0.00 0.00 52.55 52.45 1pa2 s ASP 29 Cb 0.03 0.65 0.78 0.00 -0.30 0.00 0.00 42.92 44.08 1pa2 s ASP 29 CO 0.09 -0.37 1.59 0.35 -0.17 0.00 0.00 175.17 176.66 1pa2 n THR 30 N 5.24 0.76 0.72 1.71 -2.24 -1.25 -2.36 114.28 116.87 1pa2 n THR 30 Ca -0.00 0.18 0.13 0.00 -2.27 0.00 0.00 64.05 62.09 1pa2 n THR 30 Cb 0.47 -0.89 0.35 0.00 -2.10 0.00 0.00 70.33 68.16 1pa2 n THR 30 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1pa2 n ARG 31 N -1.55 0.19 0.14 -0.78 0.63 -1.26 -4.50 116.66 109.52 1pa2 n ARG 31 Ca 0.04 0.11 0.02 0.00 -0.92 0.00 0.00 57.85 57.10 1pa2 n ARG 31 Cb 0.22 -1.67 0.37 0.00 0.45 0.00 0.00 32.46 31.83 1pa2 n ARG 31 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 1pa2 h ILE 32 N 0.00 1.21 -0.39 5.15 6.09 -1.82 -1.95 117.51 125.79 1pa2 h ILE 32 Ca 0.00 -0.96 -0.01 0.00 -1.37 0.00 0.00 64.86 62.51 1pa2 h ILE 32 Cb 0.67 1.38 -0.02 0.00 0.47 0.00 0.00 36.82 39.32 1pa2 h ILE 32 CO 0.00 0.29 0.19 1.23 -3.07 0.00 0.00 178.15 176.79 1pa2 h GLY 33 N 0.86 0.60 0.76 8.18 0.00 -1.83 -0.55 103.07 111.08 1pa2 h GLY 33 Ca 0.03 -0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.10 1pa2 h GLY 33 CO 0.03 0.28 0.14 0.00 0.00 0.00 0.00 176.54 176.99 1pa2 h ALA 34 N 1.04 0.40 -0.87 3.60 0.00 -1.72 -2.36 119.26 119.36 1pa2 h ALA 34 Ca 0.13 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1pa2 h ALA 34 Cb 0.11 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1pa2 h ALA 34 CO -0.02 -0.25 0.52 1.03 0.00 0.00 0.00 179.25 180.54 1pa2 h SER 35 N 0.30 1.05 -0.23 0.00 0.87 -0.98 -2.30 113.55 112.25 1pa2 h SER 35 Ca 0.15 -0.06 -0.07 0.00 -1.23 0.00 0.00 61.79 60.58 1pa2 h SER 35 Cb 0.10 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.79 1pa2 h SER 35 CO -0.14 0.81 -0.11 -0.07 -0.53 0.00 0.00 176.83 176.79 1pa2 h LEU 36 N 1.21 0.50 -1.26 2.23 3.38 -0.87 -2.42 115.31 118.08 1pa2 h LEU 36 Ca 0.31 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1pa2 h LEU 36 Cb -0.05 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1pa2 h LEU 36 CO -0.06 0.80 0.03 -0.29 0.09 0.00 0.00 178.44 179.01 1pa2 h ILE 37 N 0.20 1.19 -0.26 1.22 2.10 -1.31 -1.61 117.51 119.03 1pa2 h ILE 37 Ca 0.05 -0.72 -0.04 0.00 1.08 0.00 0.00 64.86 65.22 1pa2 h ILE 37 Cb 0.61 0.89 -0.01 0.00 -1.09 0.00 0.00 36.82 37.21 1pa2 h ILE 37 CO 0.03 0.25 -0.03 -0.09 -1.08 0.00 0.00 178.15 177.24 1pa2 h ARG 38 N 0.52 0.40 -0.55 2.19 2.43 -1.25 -1.86 114.38 116.25 1pa2 h ARG 38 Ca 0.11 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1pa2 h ARG 38 Cb 0.29 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1pa2 h ARG 38 CO 0.01 0.46 0.19 -0.07 -1.51 0.00 0.00 179.97 179.04 1pa2 h LEU 39 N 0.39 0.75 -0.75 3.80 3.38 -0.79 -0.40 115.31 121.68 1pa2 h LEU 39 Ca 0.08 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1pa2 h LEU 39 Cb 0.31 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1pa2 h LEU 39 CO 0.01 0.70 -0.13 -0.74 0.09 0.00 0.00 178.44 178.37 1pa2 h HIS 40 N 0.80 0.91 0.33 1.13 2.76 -1.07 0.85 115.15 120.86 1pa2 h HIS 40 Ca 0.19 -0.17 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 1pa2 h HIS 40 Cb 0.21 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 28.94 1pa2 h HIS 40 CO 0.01 0.89 -0.16 0.35 -1.30 0.00 0.00 177.93 177.73 1pa2 h PHE 41 N 0.74 -0.41 0.00 5.26 3.57 -1.03 -0.05 116.94 125.00 1pa2 h PHE 41 Ca 0.12 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 1pa2 h PHE 41 Cb 0.62 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.50 1pa2 h PHE 41 CO 0.03 -0.20 -0.13 0.45 -2.23 0.00 0.00 178.31 176.23 1pa2 h HIS 42 N -0.53 0.00 0.21 0.41 3.86 -1.01 -1.78 115.15 116.30 1pa2 h HIS 42 Ca -0.05 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1pa2 h HIS 42 Cb 0.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.87 1pa2 h HIS 42 CO -0.03 0.13 -0.10 0.22 0.86 0.00 0.00 177.93 179.01 1pa2 h ASP 43 N 0.00 -0.24 0.14 2.45 3.58 -0.51 -3.34 116.42 118.51 1pa2 h ASP 43 Ca -0.00 -0.29 -0.02 0.00 0.42 0.00 0.00 57.03 57.14 1pa2 h ASP 43 Cb 0.39 0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.50 1pa2 h ASP 43 CO 0.02 0.28 -0.08 0.00 -2.88 0.00 0.00 179.24 176.58 1pa2 n PHE 45 N -4.02 0.00 -3.67 0.00 3.01 -0.70 -3.57 117.46 108.50 1pa2 n PHE 45 Ca -0.03 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.18 1pa2 n PHE 45 Cb 0.17 -0.06 -0.17 0.00 -0.01 0.00 0.00 39.48 39.40 1pa2 n PHE 45 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1pa2 s VAL 46 N -2.13 0.10 -1.65 -4.37 1.01 -0.81 -4.73 120.40 107.83 1pa2 s VAL 46 Ca 0.43 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.28 1pa2 s VAL 46 Cb 0.22 -0.61 0.00 0.00 0.00 0.00 0.00 36.38 35.99 1pa2 s VAL 46 CO 0.39 -0.13 0.00 0.59 0.00 0.00 0.00 175.10 175.95 1pa2 n ASN 47 N 5.21 -5.22 -0.53 3.32 4.13 -1.26 -4.72 115.26 116.19 1pa2 n ASN 47 Ca -0.07 0.13 0.07 0.00 1.68 0.00 0.00 54.58 56.39 1pa2 n ASN 47 Cb 0.49 -4.43 -0.02 0.00 -1.54 0.00 0.00 39.78 34.28 1pa2 n ASN 47 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1pa2 n GLY 48 N -0.82 -2.12 3.50 7.41 0.00 -1.23 -4.50 105.19 107.42 1pa2 n GLY 48 Ca -0.21 -1.40 -0.43 0.00 0.00 0.00 0.00 46.02 43.98 1pa2 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pa2 n ASP 50 N 7.75 1.09 -1.84 0.00 5.75 -1.26 -4.66 116.55 123.39 1pa2 n ASP 50 Ca 0.47 -1.78 -0.18 0.00 -0.01 0.00 0.00 54.79 53.29 1pa2 n ASP 50 Cb 0.45 -0.08 -0.05 0.00 -1.03 0.00 0.00 41.12 40.41 1pa2 n ASP 50 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1pa2 n ALA 51 N -0.38 -0.42 -0.01 2.12 0.00 -1.26 -0.99 120.51 119.57 1pa2 n ALA 51 Ca 0.02 0.24 0.03 0.00 0.00 0.00 0.00 53.44 53.73 1pa2 n ALA 51 Cb 0.44 -1.86 0.38 0.00 0.00 0.00 0.00 19.45 18.42 1pa2 n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1pa2 h SER 52 N 0.00 0.50 0.30 0.00 4.64 -1.86 -2.29 113.55 114.83 1pa2 h SER 52 Ca -0.39 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 60.89 1pa2 h SER 52 Cb 1.22 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1pa2 h SER 52 CO 0.53 0.41 -0.04 -0.29 -0.87 0.00 0.00 176.83 176.56 1pa2 h ILE 53 N 0.57 0.30 0.00 0.95 2.10 -1.90 -2.95 117.51 116.57 1pa2 h ILE 53 Ca 0.15 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.81 1pa2 h ILE 53 Cb 0.03 1.21 0.00 0.00 -1.09 0.00 0.00 36.82 36.97 1pa2 h ILE 53 CO -0.02 0.04 -0.31 -0.07 -1.08 0.00 0.00 178.15 176.71 1pa2 h LEU 54 N 0.00 0.00 -9.69 2.19 3.38 -1.68 -3.41 115.31 106.10 1pa2 h LEU 54 Ca -0.00 -0.08 -0.52 0.00 0.09 0.00 0.00 57.88 57.37 1pa2 h LEU 54 Cb 0.21 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.99 1pa2 h LEU 54 CO 0.01 0.04 0.64 -0.76 0.09 0.00 0.00 178.44 178.45 1pa2 s LEU 55 N -4.74 4.42 0.40 1.67 1.43 -1.12 -4.06 118.68 116.68 1pa2 s LEU 55 Ca 0.08 2.40 -0.04 0.00 -1.03 0.00 0.00 54.13 55.54 1pa2 s LEU 55 Cb 0.11 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.68 1pa2 s LEU 55 CO 0.67 -0.51 0.68 -1.81 0.23 0.00 0.00 176.35 175.61 1pa2 s ASP 56 N 0.24 6.34 0.36 2.29 1.01 -0.39 -4.41 116.67 122.11 1pa2 s ASP 56 Ca 0.56 0.79 -0.28 0.00 0.71 0.00 0.00 52.55 54.32 1pa2 s ASP 56 Cb -0.36 -2.18 -0.11 0.00 1.01 0.00 0.00 42.92 41.27 1pa2 s ASP 56 CO 0.39 -0.41 1.51 0.47 0.21 0.00 0.00 175.17 177.34 1pa2 n ASP 57 N -1.76 3.80 -2.88 0.27 8.00 -1.26 -4.71 116.55 118.01 1pa2 n ASP 57 Ca -0.01 1.21 -0.16 0.00 0.71 0.00 0.00 54.79 56.54 1pa2 n ASP 57 Cb 0.55 -1.62 -0.06 0.00 -0.02 0.00 0.00 41.12 39.97 1pa2 n ASP 57 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1pa2 n THR 58 N 0.72 0.00 -0.07 -3.53 -2.24 -0.41 -4.95 114.28 103.80 1pa2 n THR 58 Ca 0.02 -2.02 0.17 0.00 -2.27 0.00 0.00 64.05 59.96 1pa2 n THR 58 Cb 0.38 1.00 0.60 0.00 -2.10 0.00 0.00 70.33 70.21 1pa2 n THR 58 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1pa2 h GLY 59 N 1.68 0.34 0.00 3.38 0.00 -2.06 -2.80 103.07 103.62 1pa2 h GLY 59 Ca -0.20 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1pa2 h GLY 59 CO 0.29 0.04 -0.94 -1.14 0.00 0.00 0.00 176.54 174.79 1pa2 n SER 60 N -4.43 0.89 -4.29 0.19 3.41 -1.26 -4.94 113.62 103.20 1pa2 n SER 60 Ca 0.12 -0.65 -0.34 0.00 -0.26 0.00 0.00 58.87 57.74 1pa2 n SER 60 Cb 0.55 1.17 -0.15 0.00 -0.26 0.00 0.00 64.21 65.52 1pa2 n SER 60 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1pa2 s ILE 61 N -2.56 3.00 -0.49 -1.33 1.01 -1.06 -5.01 121.20 114.77 1pa2 s ILE 61 Ca 0.03 -0.64 -0.16 0.00 0.00 0.00 0.00 60.65 59.88 1pa2 s ILE 61 Cb 0.11 -2.32 0.08 0.00 0.01 0.00 0.00 42.46 40.35 1pa2 s ILE 61 CO 0.62 0.48 0.43 -1.10 0.00 0.00 0.00 174.94 175.36 1pa2 s GLN 62 N 1.10 2.99 0.35 2.79 1.11 -1.26 -1.29 119.66 125.45 1pa2 s GLN 62 Ca 0.00 -1.41 -0.28 0.00 0.01 0.00 0.00 55.36 53.69 1pa2 s GLN 62 Cb -0.15 -4.17 -0.10 0.00 -1.01 0.00 0.00 33.01 27.59 1pa2 s GLN 62 CO -0.03 -1.10 1.33 0.45 0.01 0.00 0.00 175.29 175.96 1pa2 s SER 63 N 2.81 6.62 0.18 5.90 0.15 -1.26 -4.06 113.70 124.04 1pa2 s SER 63 Ca 0.04 2.74 0.19 0.00 0.70 0.00 0.00 55.95 59.62 1pa2 s SER 63 Cb -0.25 -2.65 0.83 0.00 -1.71 0.00 0.00 66.02 62.24 1pa2 s SER 63 CO 0.06 -0.65 1.57 -0.62 1.20 0.00 0.00 173.24 174.81 1pa2 n GLU 64 N 0.62 0.12 0.32 5.44 1.02 -1.26 -2.41 120.64 124.49 1pa2 n GLU 64 Ca 0.01 0.42 0.21 0.00 -0.02 0.00 0.00 57.16 57.78 1pa2 n GLU 64 Cb 0.42 -1.76 1.10 0.00 -0.02 0.00 0.00 31.44 31.18 1pa2 n GLU 64 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1pa2 h LYS 65 N 0.00 0.00 -0.19 3.49 1.57 -1.83 -0.51 116.57 119.10 1pa2 h LYS 65 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1pa2 h LYS 65 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1pa2 h LYS 65 CO 0.00 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.97 1pa2 n ASN 66 N -3.11 3.10 -4.75 0.86 3.02 -1.01 -3.00 115.26 110.37 1pa2 n ASN 66 Ca -0.02 -1.97 -0.36 0.00 -0.03 0.00 0.00 54.58 52.20 1pa2 n ASN 66 Cb 0.12 -0.11 0.04 0.00 -0.61 0.00 0.00 39.78 39.23 1pa2 n ASN 66 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pa2 s ALA 67 N -1.78 2.49 0.20 5.41 0.00 -0.20 -4.67 121.76 123.20 1pa2 s ALA 67 Ca 0.33 1.03 -0.19 0.00 0.00 0.00 0.00 51.96 53.14 1pa2 s ALA 67 Cb 0.21 -3.47 0.16 0.00 0.00 0.00 0.00 23.12 20.02 1pa2 s ALA 67 CO 0.31 -1.29 1.59 0.78 0.00 0.00 0.00 175.76 177.15 1pa2 h GLY 68 N 0.74 0.04 2.00 0.00 0.00 -1.90 -0.48 103.07 103.47 1pa2 h GLY 68 Ca -0.50 0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1pa2 h GLY 68 CO 0.54 -0.22 -0.04 -2.55 0.00 0.00 0.00 176.54 174.27 1pa2 h PRO 69 N -0.12 0.00 0.00 4.80 0.11 -1.91 -3.13 132.00 131.75 1pa2 h PRO 69 Ca 0.26 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 66.01 1pa2 h PRO 69 Cb 0.54 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.59 1pa2 h PRO 69 CO -0.68 0.04 -2.24 0.09 -0.21 0.00 0.00 178.00 174.99 1pa2 n ASN 70 N -3.45 0.45 -4.76 -2.05 3.02 -0.46 -4.44 115.26 103.58 1pa2 n ASN 70 Ca -0.02 0.08 -0.41 0.00 -0.03 0.00 0.00 54.58 54.20 1pa2 n ASN 70 Cb 0.16 0.57 -0.02 0.00 -0.61 0.00 0.00 39.78 39.88 1pa2 n ASN 70 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1pa2 s VAL 71 N -2.52 2.56 -1.34 2.41 0.11 -0.32 -0.84 120.40 120.47 1pa2 s VAL 71 Ca -0.12 0.52 -0.09 0.00 -2.93 0.00 0.00 61.98 59.36 1pa2 s VAL 71 Cb 0.07 -3.33 0.07 0.00 -1.53 0.00 0.00 36.38 31.65 1pa2 s VAL 71 CO 0.80 0.11 0.54 0.59 -3.33 0.00 0.00 175.10 173.81 1pa2 n ASN 72 N 1.38 -4.02 0.10 3.54 5.03 -1.26 -4.65 115.26 115.38 1pa2 n ASN 72 Ca 0.03 -0.43 0.00 0.00 0.87 0.00 0.00 54.58 55.05 1pa2 n ASN 72 Cb 0.41 -3.30 0.00 0.00 -1.02 0.00 0.00 39.78 35.86 1pa2 n ASN 72 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 1pa2 n SER 73 N -2.36 -1.32 -4.77 6.41 2.88 -0.87 -5.10 113.62 108.50 1pa2 n SER 73 Ca -0.02 0.37 -0.41 0.00 -1.33 0.00 0.00 58.87 57.48 1pa2 n SER 73 Cb 0.55 1.42 0.01 0.00 -0.75 0.00 0.00 64.21 65.44 1pa2 n SER 73 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pa2 n ALA 74 N -2.96 2.28 -3.26 -1.46 0.00 -0.02 -5.00 120.51 110.08 1pa2 n ALA 74 Ca 0.00 0.30 -0.11 0.00 0.00 0.00 0.00 53.44 53.63 1pa2 n ALA 74 Cb 0.00 -2.42 -0.03 0.00 0.00 0.00 0.00 19.45 17.01 1pa2 n ALA 74 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1pa2 s ARG 75 N -2.27 1.90 0.00 0.00 1.70 -1.26 -4.95 118.95 114.07 1pa2 s ARG 75 Ca 0.57 -1.50 0.00 0.00 -0.47 0.00 0.00 55.73 54.33 1pa2 s ARG 75 Cb -0.46 0.51 0.00 0.00 -0.57 0.00 0.00 34.95 34.43 1pa2 s ARG 75 CO 0.61 -0.82 0.00 0.41 -1.08 0.00 0.00 175.30 174.42 1pa2 n GLY 76 N -0.50 0.77 0.34 3.88 0.00 -1.26 -4.60 105.19 103.82 1pa2 n GLY 76 Ca -0.02 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.03 1pa2 n GLY 76 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1pa2 h PHE 77 N 0.00 0.74 -0.51 1.61 0.04 -1.97 -0.66 116.94 116.20 1pa2 h PHE 77 Ca 0.00 0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.69 1pa2 h PHE 77 Cb 0.00 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 37.88 1pa2 h PHE 77 CO 0.00 0.45 -0.06 -2.95 -0.60 0.00 0.00 178.31 175.15 1pa2 h ASN 78 N 0.79 0.88 -0.09 2.17 -1.07 -1.99 -1.15 115.58 115.12 1pa2 h ASN 78 Ca 0.24 -0.26 -0.15 0.00 0.07 0.00 0.00 56.30 56.20 1pa2 h ASN 78 Cb 0.00 -0.24 -0.01 0.00 -2.07 0.00 0.00 38.32 36.01 1pa2 h ASN 78 CO -0.06 0.98 -0.46 0.58 0.07 0.00 0.00 177.43 178.54 1pa2 h VAL 79 N 0.82 1.30 -0.48 6.14 2.07 -1.72 -0.04 116.25 124.34 1pa2 h VAL 79 Ca 0.14 -1.66 0.04 0.00 0.82 0.00 0.00 66.70 66.04 1pa2 h VAL 79 Cb 0.57 1.61 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 1pa2 h VAL 79 CO 0.03 0.53 0.24 0.58 0.02 0.00 0.00 177.57 178.97 1pa2 h VAL 80 N 0.52 0.96 -0.88 2.57 2.07 -0.90 0.88 116.25 121.48 1pa2 h VAL 80 Ca 0.03 -0.16 0.06 0.00 0.82 0.00 0.00 66.70 67.44 1pa2 h VAL 80 Cb 1.00 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 31.15 1pa2 h VAL 80 CO 0.09 0.09 0.55 0.44 0.02 0.00 0.00 177.57 178.76 1pa2 h ASP 81 N 0.48 0.88 -0.20 0.57 3.32 -0.65 0.22 116.42 121.04 1pa2 h ASP 81 Ca 0.21 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.15 1pa2 h ASP 81 Cb 0.11 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1pa2 h ASP 81 CO -0.15 0.58 -0.29 0.78 -1.72 0.00 0.00 179.24 178.44 1pa2 h ASN 82 N 1.02 0.72 -0.46 6.45 2.35 -0.00 0.64 115.58 126.30 1pa2 h ASN 82 Ca 0.37 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 1pa2 h ASN 82 Cb 0.13 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1pa2 h ASN 82 CO -0.16 0.97 0.27 0.40 -1.65 0.00 0.00 177.43 177.25 1pa2 h ILE 83 N 0.59 1.15 -0.69 2.81 2.04 -0.40 -1.78 117.51 121.23 1pa2 h ILE 83 Ca 0.07 -0.37 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 1pa2 h ILE 83 Cb 0.80 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1pa2 h ILE 83 CO 0.07 0.16 0.16 0.50 0.00 0.00 0.00 178.15 179.04 1pa2 h LYS 84 N 0.61 1.10 -0.72 2.37 1.63 -0.55 -1.49 116.57 119.52 1pa2 h LYS 84 Ca 0.16 -0.26 -0.01 0.00 -0.85 0.00 0.00 60.65 59.70 1pa2 h LYS 84 Cb 0.02 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.47 1pa2 h LYS 84 CO -0.03 0.97 0.42 1.15 -3.45 0.00 0.00 179.45 178.52 1pa2 h THR 85 N 1.04 1.21 -0.67 1.00 2.02 -0.74 0.21 112.91 116.99 1pa2 h THR 85 Ca 0.22 -0.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.89 1pa2 h THR 85 Cb 0.37 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 1pa2 h THR 85 CO 0.00 0.22 0.34 0.00 0.37 0.00 0.00 175.52 176.45 1pa2 h ALA 86 N 1.22 0.86 -0.44 6.16 0.00 -0.89 0.71 119.26 126.88 1pa2 h ALA 86 Ca 0.26 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 1pa2 h ALA 86 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1pa2 h ALA 86 CO -0.05 0.40 -0.24 -0.07 0.00 0.00 0.00 179.25 179.30 1pa2 h LEU 87 N 0.92 0.94 -0.83 0.00 3.38 -0.89 -2.67 115.31 116.16 1pa2 h LEU 87 Ca 0.23 -0.36 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1pa2 h LEU 87 Cb 0.09 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1pa2 h LEU 87 CO -0.03 1.13 -0.25 -0.33 0.09 0.00 0.00 178.44 179.05 1pa2 h GLU 88 N 0.79 0.59 -0.92 1.13 4.39 -0.17 0.51 114.58 120.90 1pa2 h GLU 88 Ca 0.10 -0.23 0.02 0.00 0.34 0.00 0.00 59.36 59.58 1pa2 h GLU 88 Cb 0.80 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.37 1pa2 h GLU 88 CO 0.07 0.79 0.60 -0.91 -1.16 0.00 0.00 179.01 178.40 1pa2 h ASN 89 N 0.51 1.04 0.39 1.42 2.35 -0.75 -2.67 115.58 117.87 1pa2 h ASN 89 Ca 0.07 -0.02 -0.32 0.00 -0.55 0.00 0.00 56.30 55.48 1pa2 h ASN 89 Cb 0.71 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 1pa2 h ASN 89 CO 0.05 0.74 -1.63 0.00 -1.65 0.00 0.00 177.43 174.95 1pa2 h ALA 90 N 1.35 0.33 -1.72 -0.83 0.00 -1.19 -3.43 119.26 113.77 1pa2 h ALA 90 Ca 0.34 -1.18 -0.46 0.00 0.00 0.00 0.00 54.91 53.61 1pa2 h ALA 90 Cb -0.11 0.37 -0.32 0.00 0.00 0.00 0.00 17.79 17.74 1pa2 h ALA 90 CO -0.08 1.19 -0.88 0.00 0.00 0.00 0.00 179.25 179.48 1pa2 n PRO 92 N 2.26 2.19 -1.03 0.00 -0.02 -1.01 -2.57 135.00 134.82 1pa2 n PRO 92 Ca 0.23 0.79 -0.01 0.00 -2.02 0.00 0.00 63.50 62.49 1pa2 n PRO 92 Cb 0.53 -2.57 -0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1pa2 n PRO 92 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pa2 n GLY 93 N 3.52 0.48 0.17 -1.23 0.00 -1.26 -4.94 105.19 101.93 1pa2 n GLY 93 Ca 0.17 -0.28 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 1pa2 n GLY 93 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1pa2 n VAL 94 N -2.87 1.47 -3.45 1.61 0.31 -1.06 -4.98 118.33 109.36 1pa2 n VAL 94 Ca -0.01 -0.23 -0.37 0.00 -0.01 0.00 0.00 64.34 63.72 1pa2 n VAL 94 Cb 0.08 -1.99 -0.07 0.00 -0.91 0.00 0.00 33.84 30.95 1pa2 n VAL 94 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1pa2 s VAL 95 N -2.59 5.25 0.56 2.52 1.01 -1.26 -5.05 120.40 120.84 1pa2 s VAL 95 Ca -0.35 0.65 -0.18 0.00 0.00 0.00 0.00 61.98 62.11 1pa2 s VAL 95 Cb 0.11 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 1pa2 s VAL 95 CO 0.45 0.32 1.08 -0.44 0.00 0.00 0.00 175.10 176.51 1pa2 s SER 96 N 0.76 5.83 0.32 3.32 0.01 -1.26 -4.79 113.70 117.88 1pa2 s SER 96 Ca 0.18 1.95 0.03 0.00 1.31 0.00 0.00 55.95 59.42 1pa2 s SER 96 Cb -0.14 -2.55 0.53 0.00 0.21 0.00 0.00 66.02 64.07 1pa2 s SER 96 CO 0.06 -1.14 1.85 0.00 0.41 0.00 0.00 173.24 174.43 1pa2 h SER 98 N 0.59 0.82 0.23 0.00 4.64 -1.86 -1.96 113.55 116.00 1pa2 h SER 98 Ca 0.12 -0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.29 1pa2 h SER 98 Cb 0.34 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1pa2 h SER 98 CO 0.01 0.56 -0.60 0.44 -0.87 0.00 0.00 176.83 176.37 1pa2 h ASP 99 N 0.96 0.42 -0.51 4.97 3.32 -1.69 -2.91 116.42 120.99 1pa2 h ASP 99 Ca 0.31 -0.24 0.09 0.00 0.02 0.00 0.00 57.03 57.21 1pa2 h ASP 99 Cb 0.02 -0.12 -0.07 0.00 0.22 0.00 0.00 39.33 39.38 1pa2 h ASP 99 CO -0.12 0.93 0.11 0.58 -1.72 0.00 0.00 179.24 179.02 1pa2 h VAL 100 N 0.28 0.72 -0.43 -1.35 2.07 -0.60 0.11 116.25 117.04 1pa2 h VAL 100 Ca -0.01 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.35 1pa2 h VAL 100 Cb 1.13 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 1pa2 h VAL 100 CO 0.10 0.05 -0.06 -0.07 0.02 0.00 0.00 177.57 177.60 1pa2 h LEU 101 N 0.25 0.72 -0.36 2.57 3.38 -1.20 0.29 115.31 120.96 1pa2 h LEU 101 Ca 0.26 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 1pa2 h LEU 101 Cb 0.35 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1pa2 h LEU 101 CO -0.33 0.83 0.01 0.00 0.09 0.00 0.00 178.44 179.04 1pa2 h ALA 102 N 1.25 0.49 -0.41 1.53 0.00 -1.17 -1.78 119.26 119.17 1pa2 h ALA 102 Ca 0.12 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1pa2 h ALA 102 Cb 0.51 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1pa2 h ALA 102 CO 0.03 0.25 0.08 -0.07 0.00 0.00 0.00 179.25 179.54 1pa2 h LEU 103 N 0.45 0.64 -1.41 0.00 3.38 -0.53 -2.93 115.31 114.91 1pa2 h LEU 103 Ca 0.10 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1pa2 h LEU 103 Cb 0.44 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1pa2 h LEU 103 CO 0.02 0.72 0.12 0.00 0.09 0.00 0.00 178.44 179.38 1pa2 h ALA 104 N 0.94 1.53 0.00 1.53 0.00 -0.35 -2.07 119.26 120.84 1pa2 h ALA 104 Ca 0.13 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pa2 h ALA 104 Cb 0.34 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1pa2 h ALA 104 CO 0.00 0.36 -0.00 0.77 0.00 0.00 0.00 179.25 180.38 1pa2 h SER 105 N 0.51 -0.00 -0.64 0.00 0.02 -1.14 -0.57 113.55 111.73 1pa2 h SER 105 Ca 0.12 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 1pa2 h SER 105 Cb 0.15 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1pa2 h SER 105 CO -0.01 0.15 0.29 -0.08 -1.14 0.00 0.00 176.83 176.04 1pa2 h GLU 106 N -0.16 0.94 -0.36 3.45 4.22 -1.38 -2.01 114.58 119.29 1pa2 h GLU 106 Ca -0.00 -0.15 -0.00 0.00 0.08 0.00 0.00 59.36 59.28 1pa2 h GLU 106 Cb 0.16 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1pa2 h GLU 106 CO 0.00 0.77 0.21 0.00 -2.18 0.00 0.00 179.01 177.81 1pa2 h ALA 107 N 1.12 0.46 -0.66 2.92 0.00 -1.28 -1.11 119.26 120.70 1pa2 h ALA 107 Ca 0.22 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1pa2 h ALA 107 Cb 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1pa2 h ALA 107 CO -0.02 -0.04 0.29 0.77 0.00 0.00 0.00 179.25 180.25 1pa2 h SER 108 N 0.46 0.89 -0.20 0.00 0.02 -0.89 0.10 113.55 113.93 1pa2 h SER 108 Ca 0.13 -0.15 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 1pa2 h SER 108 Cb 0.03 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1pa2 h SER 108 CO -0.02 0.80 -0.03 0.58 -1.14 0.00 0.00 176.83 177.02 1pa2 h VAL 109 N 0.93 1.28 -0.44 2.27 2.07 -1.26 -2.54 116.25 118.55 1pa2 h VAL 109 Ca 0.22 -0.98 -0.13 0.00 0.82 0.00 0.00 66.70 66.63 1pa2 h VAL 109 Cb 0.17 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1pa2 h VAL 109 CO -0.02 0.30 -0.25 0.77 0.02 0.00 0.00 177.57 178.38 1pa2 h SER 110 N 0.11 0.98 -0.26 0.57 4.64 -0.98 0.43 113.55 119.04 1pa2 h SER 110 Ca 0.05 -0.42 0.02 0.00 -0.47 0.00 0.00 61.79 60.98 1pa2 h SER 110 Cb 0.46 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1pa2 h SER 110 CO 0.02 1.18 0.18 -0.07 -0.87 0.00 0.00 176.83 177.27 1pa2 h LEU 111 N 0.78 0.23 -0.45 5.97 3.38 -0.80 -1.33 115.31 123.09 1pa2 h LEU 111 Ca 0.09 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1pa2 h LEU 111 Cb 0.83 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1pa2 h LEU 111 CO 0.07 0.16 0.00 0.00 0.09 0.00 0.00 178.44 178.76 1pa2 n ALA 112 N -2.52 2.57 -0.04 1.53 0.00 -0.96 -4.88 120.51 116.21 1pa2 n ALA 112 Ca 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1pa2 n ALA 112 Cb 0.14 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1pa2 n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pa2 n GLY 113 N 0.92 0.80 2.89 0.00 0.00 -0.50 -0.90 105.19 108.40 1pa2 n GLY 113 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 1pa2 n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pa2 n GLY 114 N -2.03 -1.22 3.76 -0.02 0.00 0.11 -4.80 105.19 101.00 1pa2 n GLY 114 Ca 0.00 -1.73 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 1pa2 n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pa2 s PRO 115 N -5.10 2.50 0.31 1.61 0.04 -1.26 -4.35 135.00 128.74 1pa2 s PRO 115 Ca 0.56 1.32 0.02 0.00 0.04 0.00 0.00 61.00 62.94 1pa2 s PRO 115 Cb -0.02 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 1pa2 s PRO 115 CO 0.39 -1.48 0.49 -1.12 0.04 0.00 0.00 177.00 175.32 1pa2 s SER 116 N -2.88 6.31 0.21 6.66 0.01 -1.26 -3.70 113.70 119.04 1pa2 s SER 116 Ca 0.65 0.35 -0.19 0.00 1.31 0.00 0.00 55.95 58.06 1pa2 s SER 116 Cb -0.20 -1.98 0.03 0.00 0.21 0.00 0.00 66.02 64.08 1pa2 s SER 116 CO 0.48 -0.22 0.58 -1.66 0.41 0.00 0.00 173.24 172.83 1pa2 s TRP 117 N -2.21 -0.18 -0.52 2.43 -2.14 -1.26 -4.97 118.94 110.08 1pa2 s TRP 117 Ca 0.38 -0.17 -0.24 0.00 2.66 0.00 0.00 56.10 58.74 1pa2 s TRP 117 Cb -0.09 0.49 0.04 0.00 -3.10 0.00 0.00 33.47 30.80 1pa2 s TRP 117 CO 0.34 -0.99 0.91 0.99 -2.66 0.00 0.00 176.95 175.54 1pa2 s THR 118 N -3.87 4.45 0.13 0.66 2.01 -1.26 -5.01 115.64 112.75 1pa2 s THR 118 Ca 0.09 0.34 -0.30 0.00 0.31 0.00 0.00 61.69 62.13 1pa2 s THR 118 Cb -0.02 -4.49 -0.07 0.00 0.01 0.00 0.00 72.50 67.93 1pa2 s THR 118 CO -0.02 -1.01 1.17 -0.69 -0.69 0.00 0.00 174.62 173.38 1pa2 s VAL 119 N 3.79 3.86 0.06 3.82 1.01 -1.26 -5.00 120.40 126.69 1pa2 s VAL 119 Ca 0.31 1.47 -0.12 0.00 0.00 0.00 0.00 61.98 63.64 1pa2 s VAL 119 Cb -0.12 -3.94 -0.06 0.00 0.00 0.00 0.00 36.38 32.26 1pa2 s VAL 119 CO 0.20 0.19 0.42 -0.76 0.00 0.00 0.00 175.10 175.15 1pa2 s LEU 120 N 0.28 4.38 0.23 3.92 1.43 -1.26 -4.30 118.68 123.36 1pa2 s LEU 120 Ca 0.54 0.87 0.00 0.00 -1.03 0.00 0.00 54.13 54.51 1pa2 s LEU 120 Cb -0.30 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 42.97 1pa2 s LEU 120 CO 0.33 0.21 0.12 -0.76 0.23 0.00 0.00 176.35 176.48 1pa2 s LEU 121 N -1.69 1.35 0.00 1.79 1.43 -0.11 -4.84 118.68 116.62 1pa2 s LEU 121 Ca 0.31 -1.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.01 1pa2 s LEU 121 Cb -0.15 0.25 0.00 0.00 0.03 0.00 0.00 46.19 46.32 1pa2 s LEU 121 CO 0.17 -0.81 0.00 0.61 0.23 0.00 0.00 176.35 176.55 1pa2 n GLY 122 N -0.36 1.02 3.77 -3.19 0.00 -1.26 -0.94 105.19 104.22 1pa2 n GLY 122 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1pa2 n GLY 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pa2 s ARG 123 N -0.55 3.55 0.25 1.61 0.52 -1.26 -4.67 118.95 118.39 1pa2 s ARG 123 Ca 0.00 1.77 0.10 0.00 -0.52 0.00 0.00 55.73 57.08 1pa2 s ARG 123 Cb 0.00 -2.25 -0.04 0.00 0.52 0.00 0.00 34.95 33.17 1pa2 s ARG 123 CO 0.00 -0.73 -0.08 1.03 0.02 0.00 0.00 175.30 175.54 1pa2 s ARG 124 N -2.91 2.06 -0.02 3.54 0.52 0.79 -4.56 118.95 118.37 1pa2 s ARG 124 Ca 0.68 -1.50 -0.16 0.00 -0.52 0.00 0.00 55.73 54.23 1pa2 s ARG 124 Cb -0.28 -2.04 -0.05 0.00 0.52 0.00 0.00 34.95 33.09 1pa2 s ARG 124 CO 0.33 0.37 0.45 -0.51 0.02 0.00 0.00 175.30 175.96 1pa2 s ASP 125 N -3.46 6.82 0.84 0.23 1.01 0.76 -4.35 116.67 118.51 1pa2 s ASP 125 Ca 0.30 0.97 -0.10 0.00 0.71 0.00 0.00 52.55 54.42 1pa2 s ASP 125 Cb -0.06 -2.27 0.10 0.00 1.01 0.00 0.00 42.92 41.69 1pa2 s ASP 125 CO 0.17 0.24 1.11 -0.94 0.21 0.00 0.00 175.17 175.96 1pa2 s SER 126 N -0.68 3.81 0.00 0.27 1.04 -0.16 -0.77 113.70 117.21 1pa2 s SER 126 Ca 0.25 1.92 0.23 0.00 0.48 0.00 0.00 55.95 58.83 1pa2 s SER 126 Cb -0.17 -2.51 0.11 0.00 0.10 0.00 0.00 66.02 63.56 1pa2 s SER 126 CO 0.13 -2.49 1.18 0.18 0.98 0.00 0.00 173.24 173.22 1pa2 n LEU 127 N -3.82 2.23 -4.09 2.42 7.99 -1.26 -4.80 117.00 115.67 1pa2 n LEU 127 Ca 0.10 -0.79 -0.08 0.00 -0.01 0.00 0.00 56.01 55.22 1pa2 n LEU 127 Cb 0.53 -0.01 -0.10 0.00 -0.11 0.00 0.00 43.42 43.74 1pa2 n LEU 127 CO 0.52 0.40 -0.30 0.42 -1.51 0.00 0.00 177.39 176.92 1pa2 s THR 128 N -2.34 0.17 0.26 -5.08 -4.23 -1.26 -4.96 115.64 98.19 1pa2 s THR 128 Ca 0.22 -1.77 0.11 0.00 -1.18 0.00 0.00 61.69 59.06 1pa2 s THR 128 Cb 0.19 -1.70 -0.05 0.00 1.34 0.00 0.00 72.50 72.28 1pa2 s THR 128 CO 0.49 -0.76 -0.12 0.00 -0.54 0.00 0.00 174.62 173.69 1pa2 s ALA 129 N -3.96 2.90 -0.53 3.99 0.00 -1.26 -4.67 121.76 118.23 1pa2 s ALA 129 Ca 0.13 -1.73 0.06 0.00 0.00 0.00 0.00 51.96 50.42 1pa2 s ALA 129 Cb 0.07 -0.51 0.21 0.00 0.00 0.00 0.00 23.12 22.89 1pa2 s ALA 129 CO -0.06 0.31 0.52 -1.71 0.00 0.00 0.00 175.76 174.82 1pa2 n ASN 130 N -0.57 1.50 -0.08 0.00 5.15 -1.26 -4.85 115.26 115.15 1pa2 n ASN 130 Ca -0.07 -2.90 -0.07 0.00 -0.60 0.00 0.00 54.58 50.94 1pa2 n ASN 130 Cb 0.59 -0.65 -0.00 0.00 -0.53 0.00 0.00 39.78 39.18 1pa2 n ASN 130 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1pa2 h LEU 131 N 4.82 0.08 -1.04 1.20 6.46 -1.85 -1.59 115.31 123.39 1pa2 h LEU 131 Ca 0.17 0.04 -0.00 0.00 -0.12 0.00 0.00 57.88 57.97 1pa2 h LEU 131 Cb 0.81 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.73 1pa2 h LEU 131 CO 0.58 0.08 0.54 0.00 -0.62 0.00 0.00 178.44 179.03 1pa2 h ALA 132 N 1.20 1.29 -0.22 1.25 0.00 -1.93 -1.31 119.26 119.54 1pa2 h ALA 132 Ca 0.13 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1pa2 h ALA 132 Cb 0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1pa2 h ALA 132 CO -0.15 0.62 -0.24 0.78 0.00 0.00 0.00 179.25 180.26 1pa2 h GLY 133 N 1.23 0.45 1.08 0.00 0.00 -1.89 -2.26 103.07 101.69 1pa2 h GLY 133 Ca 0.32 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 1pa2 h GLY 133 CO -0.06 0.33 0.50 0.00 0.00 0.00 0.00 176.54 177.30 1pa2 h ALA 134 N 1.37 1.22 0.00 3.60 0.00 -0.27 0.53 119.26 125.72 1pa2 h ALA 134 Ca 0.06 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1pa2 h ALA 134 Cb 0.63 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1pa2 h ALA 134 CO 0.05 0.64 -0.36 -0.91 0.00 0.00 0.00 179.25 178.66 1pa2 h ASN 135 N 1.22 0.00 0.05 0.00 2.35 -0.82 -3.04 115.58 115.34 1pa2 h ASN 135 Ca 0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.06 1pa2 h ASN 135 Cb -0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1pa2 h ASN 135 CO -0.05 0.36 -1.63 -1.54 -1.65 0.00 0.00 177.43 172.92 1pa2 n SER 136 N -3.94 0.34 -0.05 5.81 3.41 -0.95 -4.65 113.62 113.60 1pa2 n SER 136 Ca -0.02 -0.29 -0.01 0.00 -0.26 0.00 0.00 58.87 58.30 1pa2 n SER 136 Cb 0.42 1.61 -0.13 0.00 -0.26 0.00 0.00 64.21 65.85 1pa2 n SER 136 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1pa2 n SER 137 N -2.04 1.06 -4.68 4.04 7.64 0.13 -4.94 113.62 114.83 1pa2 n SER 137 Ca -0.01 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.47 1pa2 n SER 137 Cb 0.49 1.28 -0.06 0.00 -1.01 0.00 0.00 64.21 64.92 1pa2 n SER 137 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1pa2 s ILE 138 N -2.74 5.07 0.62 0.44 1.09 -1.15 -4.89 121.20 119.63 1pa2 s ILE 138 Ca -0.07 1.15 -0.17 0.00 -1.10 0.00 0.00 60.65 60.45 1pa2 s ILE 138 Cb 0.07 -3.92 -0.02 0.00 -1.06 0.00 0.00 42.46 37.53 1pa2 s ILE 138 CO 0.68 0.18 1.17 -2.16 -0.10 0.00 0.00 174.94 174.71 1pa2 s PRO 139 N 1.49 2.86 -0.00 2.79 0.04 -1.26 -4.96 135.00 135.96 1pa2 s PRO 139 Ca 0.29 1.67 -0.01 0.00 0.04 0.00 0.00 61.00 62.99 1pa2 s PRO 139 Cb -0.16 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 1pa2 s PRO 139 CO 0.11 -1.26 0.09 0.45 0.04 0.00 0.00 177.00 176.44 1pa2 s SER 140 N -1.93 5.73 0.26 6.66 0.15 -1.26 -5.01 113.70 118.30 1pa2 s SER 140 Ca 0.74 0.16 0.22 0.00 0.70 0.00 0.00 55.95 57.76 1pa2 s SER 140 Cb -0.27 -1.66 0.99 0.00 -1.71 0.00 0.00 66.02 63.38 1pa2 s SER 140 CO 0.36 0.27 1.65 -0.81 1.20 0.00 0.00 173.24 175.91 1pa2 n PRO 141 N 1.15 0.16 -0.18 5.44 -0.04 -1.26 -2.28 135.00 137.99 1pa2 n PRO 141 Ca -0.13 0.49 0.09 0.00 -0.04 0.00 0.00 63.50 63.92 1pa2 n PRO 141 Cb 0.53 -1.87 0.19 0.00 -0.04 0.00 0.00 33.50 32.30 1pa2 n PRO 141 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1pa2 n ILE 142 N -2.18 0.60 -2.25 0.52 -6.64 -1.26 -1.69 119.36 106.46 1pa2 n ILE 142 Ca 0.01 -0.80 -0.36 0.00 -1.77 0.00 0.00 62.75 59.83 1pa2 n ILE 142 Cb 0.15 0.86 -0.00 0.00 -1.44 0.00 0.00 39.64 39.21 1pa2 n ILE 142 CO 0.00 0.00 0.00 -1.61 -1.77 0.00 0.00 176.55 173.17 1pa2 s GLU 143 N -1.23 3.52 0.69 6.28 2.02 -0.96 -5.01 118.70 124.00 1pa2 s GLU 143 Ca 0.32 1.69 -0.15 0.00 0.02 0.00 0.00 54.97 56.85 1pa2 s GLU 143 Cb 0.19 -2.18 0.02 0.00 0.10 0.00 0.00 34.13 32.25 1pa2 s GLU 143 CO 0.26 -0.73 1.15 -1.54 0.02 0.00 0.00 175.26 174.42 1pa2 s SER 144 N -1.59 4.73 0.27 -0.19 1.04 -1.26 -4.74 113.70 111.96 1pa2 s SER 144 Ca 0.69 2.16 -0.00 0.00 0.48 0.00 0.00 55.95 59.27 1pa2 s SER 144 Cb -0.26 -2.57 0.57 0.00 0.10 0.00 0.00 66.02 63.86 1pa2 s SER 144 CO 0.30 -1.89 1.74 0.25 0.98 0.00 0.00 173.24 174.62 1pa2 h LEU 145 N -0.08 0.45 -1.00 2.42 5.85 -1.95 -0.76 115.31 120.24 1pa2 h LEU 145 Ca -0.47 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 1pa2 h LEU 145 Cb 1.27 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 1pa2 h LEU 145 CO 0.52 0.15 0.20 0.77 -0.34 0.00 0.00 178.44 179.75 1pa2 h SER 146 N 0.55 0.85 0.34 1.25 4.64 -1.99 -0.82 113.55 118.37 1pa2 h SER 146 Ca 0.48 -0.13 -0.21 0.00 -0.47 0.00 0.00 61.79 61.45 1pa2 h SER 146 Cb 0.75 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1pa2 h SER 146 CO -0.41 0.79 -0.89 0.78 -0.87 0.00 0.00 176.83 176.24 1pa2 h ASN 147 N 0.90 0.50 -0.59 4.97 4.21 -1.55 -1.13 115.58 122.89 1pa2 h ASN 147 Ca 0.20 -0.38 -0.02 0.00 1.21 0.00 0.00 56.30 57.32 1pa2 h ASN 147 Cb 0.24 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 37.26 1pa2 h ASN 147 CO -0.01 1.17 0.31 0.40 -1.29 0.00 0.00 177.43 178.00 1pa2 h ILE 148 N 0.23 1.20 -0.61 2.81 2.04 -1.03 -2.26 117.51 119.89 1pa2 h ILE 148 Ca -0.06 -0.53 0.09 0.00 1.00 0.00 0.00 64.86 65.35 1pa2 h ILE 148 Cb 1.51 0.47 -0.07 0.00 -0.74 0.00 0.00 36.82 37.99 1pa2 h ILE 148 CO 0.15 0.22 0.26 0.74 0.00 0.00 0.00 178.15 179.52 1pa2 h THR 149 N 0.80 0.81 -0.51 -0.27 2.02 -1.05 -1.00 112.91 113.72 1pa2 h THR 149 Ca 0.21 -0.16 0.03 0.00 0.77 0.00 0.00 66.41 67.25 1pa2 h THR 149 Cb 0.08 0.31 -0.04 0.00 -1.74 0.00 0.00 68.15 66.77 1pa2 h THR 149 CO -0.03 0.08 0.30 0.15 0.37 0.00 0.00 175.52 176.39 1pa2 h PHE 150 N 0.46 0.56 -0.55 3.16 3.57 -0.91 0.27 116.94 123.49 1pa2 h PHE 150 Ca 0.30 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.75 1pa2 h PHE 150 Cb 0.34 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.88 1pa2 h PHE 150 CO -0.15 0.31 0.05 0.87 -2.23 0.00 0.00 178.31 177.16 1pa2 h LYS 151 N 0.59 0.91 -0.45 1.11 1.57 -0.84 -0.49 116.57 118.97 1pa2 h LYS 151 Ca 0.21 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1pa2 h LYS 151 Cb 0.03 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1pa2 h LYS 151 CO -0.10 0.87 0.21 0.74 -0.57 0.00 0.00 179.45 180.60 1pa2 h PHE 152 N 0.85 0.66 -0.50 -1.35 -1.00 -0.78 -3.00 116.94 111.82 1pa2 h PHE 152 Ca 0.17 -0.04 -0.03 0.00 2.81 0.00 0.00 57.97 60.88 1pa2 h PHE 152 Cb 0.44 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.77 1pa2 h PHE 152 CO 0.03 0.54 0.20 0.66 -1.61 0.00 0.00 178.31 178.13 1pa2 h SER 153 N 0.58 0.66 0.41 2.17 4.64 -0.29 -1.41 113.55 120.31 1pa2 h SER 153 Ca 0.15 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 1pa2 h SER 153 Cb 0.14 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1pa2 h SER 153 CO -0.02 0.60 -0.09 0.00 -0.87 0.00 0.00 176.83 176.45 1pa2 h ALA 154 N 1.50 1.21 -0.01 5.18 0.00 -0.97 -1.71 119.26 124.47 1pa2 h ALA 154 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1pa2 h ALA 154 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1pa2 h ALA 154 CO -0.02 0.11 -0.57 1.33 0.00 0.00 0.00 179.25 180.10 1pa2 n VAL 155 N -3.50 0.00 0.00 0.00 0.24 -0.84 -5.00 118.33 109.23 1pa2 n VAL 155 Ca -0.02 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.07 1pa2 n VAL 155 Cb 0.23 1.18 0.00 0.00 -1.47 0.00 0.00 33.84 33.78 1pa2 n VAL 155 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pa2 n GLY 156 N 1.39 1.67 3.17 7.63 0.00 -0.64 -4.92 105.19 113.48 1pa2 n GLY 156 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 1pa2 n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pa2 s LEU 157 N 0.00 1.97 0.00 0.99 1.43 -0.59 -4.97 118.68 117.51 1pa2 s LEU 157 Ca 0.00 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 1pa2 s LEU 157 Cb 0.00 -1.04 0.00 0.00 0.03 0.00 0.00 46.19 45.18 1pa2 s LEU 157 CO 0.00 0.19 0.00 -0.46 0.23 0.00 0.00 176.35 176.31 1pa2 n ASN 158 N 2.95 0.00 -0.13 2.29 0.23 -1.26 -2.57 115.26 116.76 1pa2 n ASN 158 Ca -0.17 -0.94 -0.06 0.00 -0.53 0.00 0.00 54.58 52.89 1pa2 n ASN 158 Cb 0.53 0.00 0.13 0.00 -2.08 0.00 0.00 39.78 38.36 1pa2 n ASN 158 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1pa2 h THR 159 N -0.02 1.25 -0.61 5.53 2.02 -1.99 -0.27 112.91 118.83 1pa2 h THR 159 Ca 0.00 -1.05 -0.00 0.00 0.77 0.00 0.00 66.41 66.13 1pa2 h THR 159 Cb 0.00 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1pa2 h THR 159 CO 0.00 0.37 0.37 0.78 0.37 0.00 0.00 175.52 177.42 1pa2 h ASN 160 N 0.80 0.72 -0.44 4.18 2.35 -2.00 -1.49 115.58 119.70 1pa2 h ASN 160 Ca 0.15 -0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1pa2 h ASN 160 Cb 0.48 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1pa2 h ASN 160 CO 0.02 0.56 0.21 0.44 -1.65 0.00 0.00 177.43 177.01 1pa2 h ASP 161 N 0.82 0.57 -0.23 5.81 3.32 -1.80 -2.06 116.42 122.85 1pa2 h ASP 161 Ca 0.22 -0.13 0.05 0.00 0.02 0.00 0.00 57.03 57.19 1pa2 h ASP 161 Cb -0.04 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.32 1pa2 h ASP 161 CO -0.04 0.54 -0.08 0.25 -1.72 0.00 0.00 179.24 178.18 1pa2 h LEU 162 N 0.56 -0.29 -0.39 1.55 7.12 -0.72 0.95 115.31 124.09 1pa2 h LEU 162 Ca 0.15 0.08 -0.10 0.00 0.13 0.00 0.00 57.88 58.14 1pa2 h LEU 162 Cb 0.12 0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.41 1pa2 h LEU 162 CO -0.02 -0.11 -0.13 0.58 -0.13 0.00 0.00 178.44 178.63 1pa2 h VAL 163 N -0.04 1.28 0.06 1.05 2.07 -1.18 -0.94 116.25 118.55 1pa2 h VAL 163 Ca 0.12 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1pa2 h VAL 163 Cb 0.22 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1pa2 h VAL 163 CO -0.26 0.41 -0.05 0.00 0.02 0.00 0.00 177.57 177.69 1pa2 h ALA 164 N 0.83 -0.11 0.00 1.67 0.00 -1.28 -3.12 119.26 117.26 1pa2 h ALA 164 Ca 0.10 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1pa2 h ALA 164 Cb 0.66 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1pa2 h ALA 164 CO 0.05 -0.57 -0.37 -0.07 0.00 0.00 0.00 179.25 178.29 1pa2 h LEU 165 N -0.12 0.00 -2.53 0.00 3.38 -0.73 -1.08 115.31 114.23 1pa2 h LEU 165 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pa2 h LEU 165 Cb 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1pa2 h LEU 165 CO -0.01 0.37 0.01 0.28 0.09 0.00 0.00 178.44 179.19 1pa2 h SER 166 N 0.00 0.00 0.20 -0.43 0.02 -1.11 -1.34 113.55 110.89 1pa2 h SER 166 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1pa2 h SER 166 Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1pa2 h SER 166 CO 0.05 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 1pa2 n GLY 167 N -1.29 -0.68 0.21 -3.77 0.00 -0.41 -1.52 105.19 97.72 1pa2 n GLY 167 Ca -0.03 -0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.11 1pa2 n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pa2 h ALA 168 N 2.23 1.00 0.00 4.61 0.00 -1.40 -0.80 119.26 124.90 1pa2 h ALA 168 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pa2 h ALA 168 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1pa2 h ALA 168 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 1pa2 n HIS 169 N -2.50 0.00 0.54 0.00 8.25 -0.58 -2.83 115.22 118.10 1pa2 n HIS 169 Ca -0.01 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.53 1pa2 n HIS 169 Cb 0.10 -0.00 0.35 0.00 1.12 0.00 0.00 29.99 31.55 1pa2 n HIS 169 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1pa2 n THR 170 N -0.48 0.89 -4.17 1.59 5.66 -0.31 -3.58 114.28 113.89 1pa2 n THR 170 Ca 0.00 0.22 -0.14 0.00 -3.05 0.00 0.00 64.05 61.08 1pa2 n THR 170 Cb 0.01 -0.96 -0.08 0.00 -1.55 0.00 0.00 70.33 67.75 1pa2 n THR 170 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1pa2 s PHE 171 N -3.02 1.18 0.00 1.09 -0.12 -1.13 -4.44 117.98 111.54 1pa2 s PHE 171 Ca 0.08 -1.34 0.00 0.00 -0.05 0.00 0.00 56.93 55.62 1pa2 s PHE 171 Cb 0.10 -0.40 0.00 0.00 -0.63 0.00 0.00 43.02 42.09 1pa2 s PHE 171 CO 0.30 -0.84 0.00 0.41 -0.05 0.00 0.00 175.22 175.04 1pa2 n GLY 172 N -0.43 -2.64 3.34 1.99 0.00 -1.13 -4.70 105.19 101.63 1pa2 n GLY 172 Ca 0.03 -1.70 -0.18 0.00 0.00 0.00 0.00 46.02 44.16 1pa2 n GLY 172 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pa2 s ARG 173 N -0.66 1.33 -0.03 1.61 1.81 -1.26 -1.49 118.95 120.26 1pa2 s ARG 173 Ca 0.00 -1.61 -0.07 0.00 -1.72 0.00 0.00 55.73 52.34 1pa2 s ARG 173 Cb 0.00 -1.03 0.01 0.00 -0.45 0.00 0.00 34.95 33.47 1pa2 s ARG 173 CO 0.00 0.13 0.15 0.00 -0.68 0.00 0.00 175.30 174.91 1pa2 s ALA 174 N -3.05 -0.37 0.33 2.13 0.00 -0.51 -4.77 121.76 115.52 1pa2 s ALA 174 Ca 0.23 0.15 -0.07 0.00 0.00 0.00 0.00 51.96 52.27 1pa2 s ALA 174 Cb 0.01 -0.07 -0.06 0.00 0.00 0.00 0.00 23.12 23.00 1pa2 s ALA 174 CO 0.07 -0.15 0.63 -0.98 0.00 0.00 0.00 175.76 175.33 1pa2 s ARG 175 N -0.71 3.68 0.29 0.00 1.70 -1.26 -0.98 118.95 121.66 1pa2 s ARG 175 Ca -0.08 0.16 0.00 0.00 -0.47 0.00 0.00 55.73 55.34 1pa2 s ARG 175 Cb -0.05 -2.56 0.68 0.00 -0.57 0.00 0.00 34.95 32.45 1pa2 s ARG 175 CO 0.01 0.13 1.61 0.00 -1.08 0.00 0.00 175.30 175.97 1pa2 h GLY 177 N 0.10 0.00 -1.03 0.00 0.00 -1.39 0.83 103.07 101.58 1pa2 h GLY 177 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1pa2 h GLY 177 CO -0.76 0.00 -0.20 3.33 0.00 0.00 0.00 176.54 178.90 1pa2 n VAL 178 N -3.41 0.00 -0.63 4.60 0.24 -0.48 -4.25 118.33 114.39 1pa2 n VAL 178 Ca -0.01 -0.32 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 1pa2 n VAL 178 Cb 0.22 1.08 0.00 0.00 -1.47 0.00 0.00 33.84 33.67 1pa2 n VAL 178 CO 0.00 0.00 0.00 2.22 -2.14 0.00 0.00 176.83 176.91 1pa2 n PHE 179 N 0.38 0.00 0.28 6.34 1.16 -0.81 -4.78 117.46 120.03 1pa2 n PHE 179 Ca 0.13 -0.11 0.16 0.00 -1.87 0.00 0.00 57.45 55.76 1pa2 n PHE 179 Cb 0.48 -0.01 0.53 0.00 -1.61 0.00 0.00 39.48 38.87 1pa2 n PHE 179 CO 0.00 0.00 0.00 -2.95 -1.87 0.00 0.00 176.76 171.94 1pa2 h ASN 180 N 0.00 0.00 -0.21 5.98 7.08 -1.04 -2.30 115.58 125.09 1pa2 h ASN 180 Ca 0.00 0.00 0.06 0.00 -3.08 0.00 0.00 56.30 53.28 1pa2 h ASN 180 Cb 0.61 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.84 1pa2 h ASN 180 CO 0.00 0.00 0.20 -0.55 -2.08 0.00 0.00 177.43 175.00 1pa2 h ASN 181 N 0.00 0.00 1.27 6.14 7.08 -1.86 -1.60 115.58 126.60 1pa2 h ASN 181 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1pa2 h ASN 181 Cb 0.63 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.87 1pa2 h ASN 181 CO 0.00 0.00 0.00 0.03 -2.08 0.00 0.00 177.43 175.38 1pa2 h ARG 182 N 0.00 0.00 0.00 4.14 3.08 -1.75 -3.21 114.38 116.64 1pa2 h ARG 182 Ca 0.10 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.95 1pa2 h ARG 182 Cb 0.50 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 1pa2 h ARG 182 CO -0.00 0.00 -1.83 1.28 -1.07 0.00 0.00 179.97 178.35 1pa2 n LEU 183 N -2.79 0.44 0.08 3.04 4.77 -0.60 -0.96 117.00 120.97 1pa2 n LEU 183 Ca 0.02 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1pa2 n LEU 183 Cb 0.36 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 1pa2 n LEU 183 CO 0.28 0.23 -0.03 0.49 -1.33 0.00 0.00 177.39 177.03 1pa2 n PHE 184 N -2.73 -0.99 -3.56 -1.77 3.72 -1.26 -4.58 117.46 106.29 1pa2 n PHE 184 Ca -0.16 0.18 -0.28 0.00 -0.05 0.00 0.00 57.45 57.14 1pa2 n PHE 184 Cb 0.89 0.25 -0.11 0.00 -0.94 0.00 0.00 39.48 39.57 1pa2 n PHE 184 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1pa2 s ASN 185 N -5.51 2.69 -0.22 4.37 3.84 -1.26 -2.56 114.94 116.28 1pa2 s ASN 185 Ca 0.00 -3.09 -0.29 0.00 0.21 0.00 0.00 52.86 49.68 1pa2 s ASN 185 Cb 0.00 -0.79 -0.01 0.00 -0.55 0.00 0.00 41.25 39.89 1pa2 s ASN 185 CO 0.00 -0.18 1.35 0.12 -2.79 0.00 0.00 177.10 175.60 1pa2 s PHE 186 N -0.14 2.63 -1.18 0.43 5.36 -0.10 -3.95 117.98 121.03 1pa2 s PHE 186 Ca 0.27 0.84 -0.05 0.00 -0.96 0.00 0.00 56.93 57.04 1pa2 s PHE 186 Cb -0.05 -3.76 0.01 0.00 -0.34 0.00 0.00 43.02 38.88 1pa2 s PHE 186 CO -0.14 -1.99 0.09 0.45 -1.46 0.00 0.00 175.22 172.17 1pa2 n SER 187 N 7.32 0.10 -0.13 6.13 2.88 -1.26 -1.17 113.62 127.49 1pa2 n SER 187 Ca 0.15 -1.02 -0.02 0.00 -1.33 0.00 0.00 58.87 56.66 1pa2 n SER 187 Cb 0.45 -1.25 -0.01 0.00 -0.75 0.00 0.00 64.21 62.65 1pa2 n SER 187 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1pa2 n GLY 188 N -2.19 0.53 0.00 0.46 0.00 -1.25 -4.92 105.19 97.82 1pa2 n GLY 188 Ca -0.23 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.47 1pa2 n GLY 188 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pa2 n THR 189 N -2.86 0.02 -0.33 2.61 -2.24 -0.31 -4.96 114.28 106.20 1pa2 n THR 189 Ca -0.02 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1pa2 n THR 189 Cb 0.10 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 1pa2 n THR 189 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pa2 n GLY 190 N 1.49 1.98 3.23 3.38 0.00 -1.26 -4.95 105.19 109.07 1pa2 n GLY 190 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 1pa2 n GLY 190 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pa2 s ASN 191 N -3.47 1.78 1.12 1.61 0.02 -1.23 -4.70 114.94 110.07 1pa2 s ASN 191 Ca 0.00 -0.92 -0.12 0.00 -1.02 0.00 0.00 52.86 50.80 1pa2 s ASN 191 Cb 0.00 -0.02 0.26 0.00 0.02 0.00 0.00 41.25 41.51 1pa2 s ASN 191 CO 0.00 -0.27 1.05 -2.84 0.02 0.00 0.00 177.10 175.06 1pa2 s PRO 192 N -3.29 -0.57 -0.08 -0.60 0.02 -1.06 -0.92 135.00 128.50 1pa2 s PRO 192 Ca 0.13 1.04 -0.29 0.00 0.02 0.00 0.00 61.00 61.89 1pa2 s PRO 192 Cb -0.00 -1.58 -0.06 0.00 0.02 0.00 0.00 34.50 32.88 1pa2 s PRO 192 CO 0.01 -3.55 1.80 0.34 -0.33 0.00 0.00 177.00 175.27 1pa2 s ASP 193 N -2.49 6.41 0.00 2.53 -1.08 -0.14 -4.75 116.67 117.16 1pa2 s ASP 193 Ca 0.68 2.21 0.15 0.00 -0.52 0.00 0.00 52.55 55.07 1pa2 s ASP 193 Cb -0.25 -2.53 0.66 0.00 -1.46 0.00 0.00 42.92 39.35 1pa2 s ASP 193 CO 0.63 -1.14 1.49 -0.81 0.52 0.00 0.00 175.17 175.86 1pa2 n PRO 194 N 7.53 0.01 -0.03 4.34 -0.04 -1.26 -2.42 135.00 143.14 1pa2 n PRO 194 Ca 0.20 0.23 0.12 0.00 -0.04 0.00 0.00 63.50 64.01 1pa2 n PRO 194 Cb 0.43 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 32.90 1pa2 n PRO 194 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1pa2 n THR 195 N -1.49 0.08 -3.48 0.52 -2.24 -1.26 -4.73 114.28 101.68 1pa2 n THR 195 Ca 0.04 -0.24 -0.38 0.00 -2.27 0.00 0.00 64.05 61.20 1pa2 n THR 195 Cb 0.18 0.29 -0.09 0.00 -2.10 0.00 0.00 70.33 68.61 1pa2 n THR 195 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1pa2 s LEU 196 N -1.80 4.11 0.19 3.22 1.98 -1.01 -4.67 118.68 120.70 1pa2 s LEU 196 Ca 0.36 0.31 -0.32 0.00 -2.89 0.00 0.00 54.13 51.59 1pa2 s LEU 196 Cb 0.19 -2.35 -0.15 0.00 0.66 0.00 0.00 46.19 44.54 1pa2 s LEU 196 CO 0.30 -0.06 1.20 -3.20 -1.89 0.00 0.00 176.35 172.70 1pa2 n ASN 197 N 4.65 1.60 0.30 3.68 2.85 0.39 -4.75 115.26 123.97 1pa2 n ASN 197 Ca -0.11 1.14 0.17 0.00 -0.11 0.00 0.00 54.58 55.68 1pa2 n ASN 197 Cb 0.51 -1.26 0.93 0.00 1.24 0.00 0.00 39.78 41.21 1pa2 n ASN 197 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1pa2 h SER 198 N 3.45 0.00 0.00 1.20 0.02 -1.93 0.35 113.55 116.63 1pa2 h SER 198 Ca -0.43 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.49 1pa2 h SER 198 Cb 1.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.87 1pa2 h SER 198 CO 0.71 0.04 -0.11 0.74 -1.14 0.00 0.00 176.83 177.06 1pa2 h THR 199 N 0.00 1.60 -0.79 -2.27 2.02 -1.97 -2.45 112.91 109.05 1pa2 h THR 199 Ca -0.00 -1.92 -0.04 0.00 0.77 0.00 0.00 66.41 65.22 1pa2 h THR 199 Cb 0.15 2.86 -0.04 0.00 -1.74 0.00 0.00 68.15 69.38 1pa2 h THR 199 CO 0.00 0.51 0.34 0.25 0.37 0.00 0.00 175.52 177.00 1pa2 h LEU 200 N -0.67 1.06 -0.36 2.58 5.85 -1.87 -2.50 115.31 119.41 1pa2 h LEU 200 Ca -0.01 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.63 1pa2 h LEU 200 Cb 0.90 -0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.58 1pa2 h LEU 200 CO 0.02 0.92 -0.16 0.25 -0.34 0.00 0.00 178.44 179.13 1pa2 h LEU 201 N 1.14 -0.56 -0.69 2.25 5.85 -0.93 -1.21 115.31 121.16 1pa2 h LEU 201 Ca 0.27 0.13 -0.10 0.00 0.84 0.00 0.00 57.88 59.02 1pa2 h LEU 201 Cb 0.17 0.31 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1pa2 h LEU 201 CO -0.03 -0.20 -0.06 -1.28 -0.34 0.00 0.00 178.44 176.54 1pa2 h SER 202 N -0.10 0.94 -0.48 1.25 0.87 -1.01 0.42 113.55 115.45 1pa2 h SER 202 Ca 0.18 -0.28 0.09 0.00 -1.23 0.00 0.00 61.79 60.55 1pa2 h SER 202 Cb 0.37 -0.25 -0.08 0.00 -0.44 0.00 0.00 62.40 62.00 1pa2 h SER 202 CO -0.42 1.03 -0.01 0.74 -0.53 0.00 0.00 176.83 177.63 1pa2 h THR 203 N 0.87 0.62 -0.03 2.23 2.02 -1.16 -2.60 112.91 114.86 1pa2 h THR 203 Ca 0.15 -0.03 -0.17 0.00 0.77 0.00 0.00 66.41 67.12 1pa2 h THR 203 Cb 0.59 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1pa2 h THR 203 CO 0.04 0.02 -0.75 -0.07 0.37 0.00 0.00 175.52 175.12 1pa2 h LEU 204 N 0.10 0.27 -1.20 2.58 3.38 -0.79 -1.74 115.31 117.91 1pa2 h LEU 204 Ca 0.24 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1pa2 h LEU 204 Cb 0.36 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 1pa2 h LEU 204 CO -0.41 0.92 0.55 1.56 0.09 0.00 0.00 178.44 181.15 1pa2 h GLN 205 N 0.14 1.02 0.01 1.13 4.20 -0.74 0.27 115.11 121.15 1pa2 h GLN 205 Ca -0.03 -0.06 -0.23 0.00 0.06 0.00 0.00 58.65 58.39 1pa2 h GLN 205 Cb 1.32 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.88 1pa2 h GLN 205 CO 0.12 0.68 -0.96 1.96 -0.67 0.00 0.00 178.83 179.96 1pa2 h GLN 206 N 1.06 0.39 -0.31 1.46 4.20 -1.31 -2.86 115.11 117.74 1pa2 h GLN 206 Ca 0.32 -0.43 -0.10 0.00 0.06 0.00 0.00 58.65 58.50 1pa2 h GLN 206 Cb -0.01 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1pa2 h GLN 206 CO -0.09 1.11 -0.22 1.25 -0.67 0.00 0.00 178.83 180.20 1pa2 h LEU 207 N 0.22 0.59 -5.74 1.46 5.85 -0.86 -3.36 115.31 113.46 1pa2 h LEU 207 Ca -0.08 -0.20 -0.57 0.00 0.84 0.00 0.00 57.88 57.87 1pa2 h LEU 207 Cb 1.60 -0.16 -0.41 0.00 0.37 0.00 0.00 40.66 42.05 1pa2 h LEU 207 CO 0.16 0.81 -0.76 0.00 -0.34 0.00 0.00 178.44 178.32 1pa2 s PRO 209 N -2.78 2.62 0.27 0.00 0.02 -1.08 -4.74 135.00 129.30 1pa2 s PRO 209 Ca 0.43 1.91 0.00 0.00 0.02 0.00 0.00 61.00 63.36 1pa2 s PRO 209 Cb 0.24 -1.87 0.58 0.00 0.02 0.00 0.00 34.50 33.47 1pa2 s PRO 209 CO -0.09 -1.50 1.74 1.96 -0.33 0.00 0.00 177.00 178.78 1pa2 h GLN 210 N 0.49 0.54 -0.66 5.54 4.20 -1.99 -0.75 115.11 122.47 1pa2 h GLN 210 Ca -0.50 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.18 1pa2 h GLN 210 Cb 1.31 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1pa2 h GLN 210 CO 0.53 0.35 0.00 0.09 -0.67 0.00 0.00 178.83 179.14 1pa2 n ASN 211 N -4.92 4.03 -2.41 1.46 3.02 -1.26 -4.95 115.26 110.23 1pa2 n ASN 211 Ca 0.18 -2.21 -0.03 0.00 -0.03 0.00 0.00 54.58 52.49 1pa2 n ASN 211 Cb 0.49 -0.51 0.02 0.00 -0.61 0.00 0.00 39.78 39.17 1pa2 n ASN 211 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pa2 n GLY 212 N 1.33 1.21 3.71 7.41 0.00 -0.29 -5.06 105.19 113.50 1pa2 n GLY 212 Ca 0.23 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 1pa2 n GLY 212 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pa2 s SER 213 N -1.59 7.17 0.00 1.61 0.15 -1.26 -4.91 113.70 114.86 1pa2 s SER 213 Ca 0.10 1.87 0.27 0.00 0.70 0.00 0.00 55.95 58.88 1pa2 s SER 213 Cb -0.01 -2.57 1.18 0.00 -1.71 0.00 0.00 66.02 62.91 1pa2 s SER 213 CO 0.06 -0.42 1.87 0.00 1.20 0.00 0.00 173.24 175.96 1pa2 n ALA 214 N 4.12 2.25 0.66 5.45 0.00 -1.26 -3.63 120.51 128.10 1pa2 n ALA 214 Ca 0.08 -0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.54 1pa2 n ALA 214 Cb 0.48 -1.44 0.13 0.00 0.00 0.00 0.00 19.45 18.62 1pa2 n ALA 214 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1pa2 n SER 215 N -1.48 0.63 -4.65 0.00 3.41 -1.26 -1.08 113.62 109.19 1pa2 n SER 215 Ca 0.07 -0.09 -0.44 0.00 -0.26 0.00 0.00 58.87 58.15 1pa2 n SER 215 Cb 0.31 0.42 -0.01 0.00 -0.26 0.00 0.00 64.21 64.67 1pa2 n SER 215 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1pa2 n THR 216 N -1.92 1.80 -4.25 6.66 -1.04 -1.24 -4.69 114.28 109.60 1pa2 n THR 216 Ca 0.03 -0.45 -0.24 0.00 -2.04 0.00 0.00 64.05 61.35 1pa2 n THR 216 Cb 0.42 -1.33 -0.07 0.00 -1.82 0.00 0.00 70.33 67.52 1pa2 n THR 216 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 1pa2 s ILE 217 N -0.89 3.65 0.28 12.58 -4.36 -1.26 -0.79 121.20 130.41 1pa2 s ILE 217 Ca 0.59 -1.70 0.05 0.00 -0.26 0.00 0.00 60.65 59.33 1pa2 s ILE 217 Cb -0.64 -2.92 -0.02 0.00 1.25 0.00 0.00 42.46 40.13 1pa2 s ILE 217 CO 0.59 -0.29 0.17 1.07 0.24 0.00 0.00 174.94 176.72 1pa2 n THR 218 N -0.69 0.00 -3.06 8.37 5.66 -0.16 -4.95 114.28 119.45 1pa2 n THR 218 Ca -0.08 -1.83 -0.39 0.00 -3.05 0.00 0.00 64.05 58.70 1pa2 n THR 218 Cb 0.58 0.80 -0.06 0.00 -1.55 0.00 0.00 70.33 70.09 1pa2 n THR 218 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 1pa2 s ASN 219 N -2.83 7.28 0.32 1.09 0.01 -1.26 -1.43 114.94 118.12 1pa2 s ASN 219 Ca 0.24 1.52 0.06 0.00 -0.71 0.00 0.00 52.86 53.96 1pa2 s ASN 219 Cb 0.01 -2.46 0.56 0.00 0.41 0.00 0.00 41.25 39.77 1pa2 s ASN 219 CO 0.17 0.20 1.80 -0.07 -1.51 0.00 0.00 177.10 177.68 1pa2 h LEU 220 N 4.59 0.35 -7.86 0.60 3.38 -1.53 -3.39 115.31 111.45 1pa2 h LEU 220 Ca -0.47 -0.10 -0.68 0.00 0.09 0.00 0.00 57.88 56.72 1pa2 h LEU 220 Cb 1.21 -0.09 -0.36 0.00 0.09 0.00 0.00 40.66 41.51 1pa2 h LEU 220 CO 0.66 0.58 -0.67 -0.62 0.09 0.00 0.00 178.44 178.48 1pa2 s ASP 221 N -6.83 4.92 0.11 -0.43 2.15 -1.23 -4.38 116.67 110.97 1pa2 s ASP 221 Ca -0.06 -1.75 0.21 0.00 0.43 0.00 0.00 52.55 51.38 1pa2 s ASP 221 Cb 0.14 -1.71 0.85 0.00 -0.30 0.00 0.00 42.92 41.91 1pa2 s ASP 221 CO 0.76 -0.37 1.65 0.00 -0.17 0.00 0.00 175.17 177.05 1pa2 n LEU 222 N 4.49 0.33 -0.01 -1.34 -0.00 -1.26 -2.55 117.00 116.66 1pa2 n LEU 222 Ca -0.06 0.57 -0.01 0.00 -0.00 0.00 0.00 56.01 56.51 1pa2 n LEU 222 Cb 0.42 -0.51 -0.00 0.00 -0.00 0.00 0.00 43.42 43.33 1pa2 n LEU 222 CO 0.27 -0.32 0.03 -1.28 -0.00 0.00 0.00 177.39 176.09 1pa2 h SER 223 N 0.00 -0.04 -3.32 1.45 0.87 -1.93 -3.42 113.55 107.15 1pa2 h SER 223 Ca 0.00 0.00 -0.61 0.00 -1.23 0.00 0.00 61.79 59.95 1pa2 h SER 223 Cb 0.38 0.01 -0.40 0.00 -0.44 0.00 0.00 62.40 61.95 1pa2 h SER 223 CO 0.00 0.29 -0.73 0.42 -0.53 0.00 0.00 176.83 176.28 1pa2 s THR 224 N -1.56 1.66 0.49 2.23 -4.23 -1.25 -5.02 115.64 107.96 1pa2 s THR 224 Ca -0.01 -2.99 0.23 0.00 -1.18 0.00 0.00 61.69 57.74 1pa2 s THR 224 Cb 0.00 -2.14 0.40 0.00 1.34 0.00 0.00 72.50 72.11 1pa2 s THR 224 CO 0.02 -0.96 1.93 -0.65 -0.54 0.00 0.00 174.62 174.42 1pa2 h PRO 225 N 6.27 0.17 -0.00 3.99 0.11 -1.74 -3.07 132.00 137.72 1pa2 h PRO 225 Ca 0.06 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1pa2 h PRO 225 Cb 0.89 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1pa2 h PRO 225 CO 0.53 0.11 -0.12 -0.25 -0.21 0.00 0.00 178.00 178.06 1pa2 n ASP 226 N -4.40 0.57 -4.76 -2.05 8.00 -1.26 -2.82 116.55 109.82 1pa2 n ASP 226 Ca 0.14 -0.78 -0.38 0.00 0.71 0.00 0.00 54.79 54.48 1pa2 n ASP 226 Cb 0.68 0.67 -0.06 0.00 -0.02 0.00 0.00 41.12 42.39 1pa2 n ASP 226 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pa2 s ALA 227 N -1.03 3.53 -0.52 2.24 0.00 -1.16 -4.85 121.76 119.97 1pa2 s ALA 227 Ca 0.03 -0.09 -0.24 0.00 0.00 0.00 0.00 51.96 51.66 1pa2 s ALA 227 Cb 0.03 -2.64 0.04 0.00 0.00 0.00 0.00 23.12 20.55 1pa2 s ALA 227 CO 0.12 0.18 0.88 0.12 0.00 0.00 0.00 175.76 177.06 1pa2 s PHE 228 N -0.11 2.87 0.34 0.00 2.19 -0.08 -4.52 117.98 118.67 1pa2 s PHE 228 Ca 0.28 0.02 -0.14 0.00 0.33 0.00 0.00 56.93 57.42 1pa2 s PHE 228 Cb -0.17 -3.92 0.03 0.00 -1.31 0.00 0.00 43.02 37.65 1pa2 s PHE 228 CO 0.14 -1.22 0.68 0.16 1.83 0.00 0.00 175.22 176.81 1pa2 s ASP 229 N 2.61 0.14 0.00 6.13 1.47 -1.26 -3.54 116.67 122.22 1pa2 s ASP 229 Ca 0.30 -1.10 0.10 0.00 1.18 0.00 0.00 52.55 53.03 1pa2 s ASP 229 Cb -0.13 0.76 0.55 0.00 -0.34 0.00 0.00 42.92 43.77 1pa2 s ASP 229 CO 0.20 -1.49 1.36 -0.46 0.68 0.00 0.00 175.17 175.47 1pa2 n ASN 230 N -1.13 0.24 0.03 2.11 6.94 -1.26 -4.16 115.26 118.04 1pa2 n ASN 230 Ca -0.05 -1.73 0.10 0.00 -0.02 0.00 0.00 54.58 52.88 1pa2 n ASN 230 Cb 0.60 -0.02 0.54 0.00 -2.36 0.00 0.00 39.78 38.54 1pa2 n ASN 230 CO 0.00 0.00 0.00 0.78 -1.03 0.00 0.00 177.26 177.01 1pa2 h ASN 231 N 0.29 0.26 -0.79 0.53 -0.26 -1.94 -0.91 115.58 112.77 1pa2 h ASN 231 Ca 0.00 -0.00 0.18 0.00 -0.56 0.00 0.00 56.30 55.92 1pa2 h ASN 231 Cb 0.06 -0.06 -0.14 0.00 -1.06 0.00 0.00 38.32 37.13 1pa2 h ASN 231 CO 0.00 0.17 -0.01 0.22 -1.06 0.00 0.00 177.43 176.75 1pa2 h TYR 232 N 0.30 -0.09 -0.15 1.19 3.20 -1.90 0.03 116.97 119.55 1pa2 h TYR 232 Ca 0.17 0.06 -0.22 0.00 3.14 0.00 0.00 58.73 61.88 1pa2 h TYR 232 Cb 0.30 0.16 0.01 0.00 1.54 0.00 0.00 36.73 38.74 1pa2 h TYR 232 CO -0.00 -0.27 -0.77 0.74 -1.64 0.00 0.00 178.16 176.22 1pa2 h PHE 233 N 0.08 1.01 -0.84 -3.82 0.04 -1.50 -2.91 116.94 109.00 1pa2 h PHE 233 Ca 0.43 -0.45 0.05 0.00 2.80 0.00 0.00 57.97 60.80 1pa2 h PHE 233 Cb 0.76 -0.16 -0.06 0.00 2.20 0.00 0.00 35.95 38.70 1pa2 h PHE 233 CO -0.45 1.27 0.53 0.00 -0.60 0.00 0.00 178.31 179.06 1pa2 h ALA 234 N 0.61 1.13 -0.77 2.45 0.00 -1.28 -2.23 119.26 119.17 1pa2 h ALA 234 Ca -0.05 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.93 1pa2 h ALA 234 Cb 1.39 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.85 1pa2 h ALA 234 CO 0.16 0.33 0.42 -0.91 0.00 0.00 0.00 179.25 179.25 1pa2 h ASN 235 N 1.01 0.60 -0.55 0.00 2.35 -0.86 -0.69 115.58 117.44 1pa2 h ASN 235 Ca 0.35 0.05 0.03 0.00 -0.55 0.00 0.00 56.30 56.18 1pa2 h ASN 235 Cb 0.08 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 1pa2 h ASN 235 CO -0.14 0.35 0.36 -0.07 -1.65 0.00 0.00 177.43 176.28 1pa2 h LEU 236 N 0.72 0.54 -1.79 1.61 3.38 -1.21 0.41 115.31 118.97 1pa2 h LEU 236 Ca 0.37 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1pa2 h LEU 236 Cb 0.34 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1pa2 h LEU 236 CO -0.24 0.37 0.00 1.56 0.09 0.00 0.00 178.44 180.22 1pa2 h GLN 237 N 0.63 0.00 -0.17 1.13 4.20 -0.97 -2.36 115.11 117.57 1pa2 h GLN 237 Ca 0.22 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 1pa2 h GLN 237 Cb 0.10 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1pa2 h GLN 237 CO -0.06 0.00 -0.01 -1.13 -0.67 0.00 0.00 178.83 176.96 1pa2 n SER 238 N -3.08 3.25 -3.11 1.46 3.41 -0.62 -4.96 113.62 109.97 1pa2 n SER 238 Ca -0.00 -3.10 -0.23 0.00 -0.26 0.00 0.00 58.87 55.28 1pa2 n SER 238 Cb 0.25 -0.51 0.04 0.00 -0.26 0.00 0.00 64.21 63.74 1pa2 n SER 238 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1pa2 n ASN 239 N -0.87 -6.20 -0.82 4.04 4.13 -0.89 -4.65 115.26 110.00 1pa2 n ASN 239 Ca 0.20 -0.33 0.07 0.00 1.68 0.00 0.00 54.58 56.20 1pa2 n ASN 239 Cb 0.81 -4.97 0.21 0.00 -1.54 0.00 0.00 39.78 34.29 1pa2 n ASN 239 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1pa2 n ASP 240 N -2.59 3.42 -4.77 6.41 8.00 0.04 -0.46 116.55 126.59 1pa2 n ASP 240 Ca -0.09 -2.36 -0.37 0.00 0.71 0.00 0.00 54.79 52.68 1pa2 n ASP 240 Cb 0.61 -0.37 -0.02 0.00 -0.02 0.00 0.00 41.12 41.32 1pa2 n ASP 240 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1pa2 s GLY 241 N -1.28 2.79 -0.18 0.44 0.00 -1.24 -4.76 107.32 103.08 1pa2 s GLY 241 Ca 0.32 0.87 -0.23 0.00 0.00 0.00 0.00 44.72 45.68 1pa2 s GLY 241 CO 0.15 1.34 0.39 -2.00 0.00 0.00 0.00 173.10 172.98 1pa2 h LEU 242 N 2.31 0.00-10.09 0.66 5.85 -1.93 -3.44 115.31 108.68 1pa2 h LEU 242 Ca -0.49 -0.65 -0.48 0.00 0.84 0.00 0.00 57.88 57.10 1pa2 h LEU 242 Cb 1.23 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 1pa2 h LEU 242 CO 0.61 1.26 0.18 -0.76 -0.34 0.00 0.00 178.44 179.40 1pa2 s LEU 243 N -8.03 3.91 0.24 2.25 1.43 -1.26 -4.89 118.68 112.33 1pa2 s LEU 243 Ca -0.24 1.35 -0.05 0.00 -1.03 0.00 0.00 54.13 54.16 1pa2 s LEU 243 Cb 0.02 -4.20 0.41 0.00 0.03 0.00 0.00 46.19 42.46 1pa2 s LEU 243 CO 0.60 -0.34 1.76 -0.61 0.23 0.00 0.00 176.35 177.99 1pa2 h GLN 244 N 1.72 0.56 0.00 1.70 4.15 -1.87 -1.51 115.11 119.86 1pa2 h GLN 244 Ca -0.48 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 58.90 1pa2 h GLN 244 Cb 1.18 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.74 1pa2 h GLN 244 CO 0.64 0.37 -0.05 0.66 -1.93 0.00 0.00 178.83 178.51 1pa2 h SER 245 N 0.57 0.00 0.26 -0.69 4.64 -1.61 -0.26 113.55 116.46 1pa2 h SER 245 Ca 0.39 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.70 1pa2 h SER 245 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1pa2 h SER 245 CO -0.32 0.05 -0.12 0.44 -0.87 0.00 0.00 176.83 176.00 1pa2 h ASP 246 N 0.00 -0.29 -0.01 4.97 3.32 -1.62 -3.36 116.42 119.43 1pa2 h ASP 246 Ca -0.00 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1pa2 h ASP 246 Cb 0.30 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1pa2 h ASP 246 CO 0.01 0.07 -0.06 -0.61 -1.72 0.00 0.00 179.24 176.93 1pa2 h GLN 247 N -0.92 0.19 -0.06 3.56 5.75 -1.16 -1.72 115.11 120.74 1pa2 h GLN 247 Ca -0.04 -0.03 0.02 0.00 -0.15 0.00 0.00 58.65 58.45 1pa2 h GLN 247 Cb 0.27 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.78 1pa2 h GLN 247 CO 0.06 0.26 0.07 0.93 -2.65 0.00 0.00 178.83 177.50 1pa2 h GLU 248 N 0.18 0.00 -0.02 1.69 5.08 -1.20 -0.37 114.58 119.94 1pa2 h GLU 248 Ca 0.04 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1pa2 h GLU 248 Cb 0.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1pa2 h GLU 248 CO 0.01 0.00 -0.19 -0.07 -1.00 0.00 0.00 179.01 177.76 1pa2 h LEU 249 N 0.00 0.03 0.00 1.33 3.38 -1.45 -2.94 115.31 115.66 1pa2 h LEU 249 Ca 0.03 -0.01 -0.26 0.00 0.09 0.00 0.00 57.88 57.73 1pa2 h LEU 249 Cb 0.17 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 1pa2 h LEU 249 CO -0.00 0.22 -2.05 0.33 0.09 0.00 0.00 178.44 177.03 1pa2 n PHE 250 N -4.30 0.00 1.03 1.13 7.35 -0.60 -3.02 117.46 119.04 1pa2 n PHE 250 Ca -0.02 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.78 1pa2 n PHE 250 Cb 0.26 -0.74 0.03 0.00 0.35 0.00 0.00 39.48 39.37 1pa2 n PHE 250 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1pa2 n SER 251 N -2.54 1.16 -4.63 -2.13 7.64 -0.25 -4.82 113.62 108.05 1pa2 n SER 251 Ca -0.24 -0.97 -0.43 0.00 1.01 0.00 0.00 58.87 58.24 1pa2 n SER 251 Cb 0.96 0.65 -0.02 0.00 -1.01 0.00 0.00 64.21 64.78 1pa2 n SER 251 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1pa2 s THR 252 N -2.82 3.86 0.32 0.44 2.01 -1.11 -4.95 115.64 113.38 1pa2 s THR 252 Ca 0.13 0.96 -0.29 0.00 0.31 0.00 0.00 61.69 62.80 1pa2 s THR 252 Cb 0.17 -3.89 -0.12 0.00 0.01 0.00 0.00 72.50 68.67 1pa2 s THR 252 CO 0.73 -0.38 1.33 0.35 -0.69 0.00 0.00 174.62 175.95 1pa2 n THR 253 N 6.40 1.75 -1.62 -0.82 -2.24 -1.26 -2.72 114.28 113.77 1pa2 n THR 253 Ca 0.17 -0.44 -0.16 0.00 -2.27 0.00 0.00 64.05 61.36 1pa2 n THR 253 Cb 0.46 -1.57 -0.06 0.00 -2.10 0.00 0.00 70.33 67.06 1pa2 n THR 253 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pa2 n GLY 254 N 1.11 1.23 3.78 3.38 0.00 -1.26 -4.98 105.19 108.45 1pa2 n GLY 254 Ca 0.06 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 1pa2 n GLY 254 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pa2 s SER 255 N -2.73 6.70 0.64 1.61 0.15 -1.10 -4.97 113.70 114.00 1pa2 s SER 255 Ca 0.00 0.83 0.41 0.00 0.70 0.00 0.00 55.95 57.88 1pa2 s SER 255 Cb 0.00 -2.25 2.25 0.00 -1.71 0.00 0.00 66.02 64.31 1pa2 s SER 255 CO 0.00 0.18 2.33 0.77 1.20 0.00 0.00 173.24 177.72 1pa2 h SER 256 N 5.72 0.00 0.86 5.45 4.64 -1.93 -2.38 113.55 125.91 1pa2 h SER 256 Ca -0.46 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.83 1pa2 h SER 256 Cb 1.20 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1pa2 h SER 256 CO 0.69 0.00 -0.15 0.71 -0.87 0.00 0.00 176.83 177.21 1pa2 h THR 257 N 0.00 0.40 -0.30 2.95 1.35 -1.93 -3.11 112.91 112.27 1pa2 h THR 257 Ca -0.00 -0.87 0.01 0.00 -0.55 0.00 0.00 66.41 65.00 1pa2 h THR 257 Cb 0.02 1.63 -0.02 0.00 -1.73 0.00 0.00 68.15 68.06 1pa2 h THR 257 CO 0.00 0.15 0.17 0.40 -0.25 0.00 0.00 175.52 175.99 1pa2 h ILE 258 N 0.00 1.02 -0.15 6.82 2.04 -1.33 -0.47 117.51 125.45 1pa2 h ILE 258 Ca -0.00 -0.12 -0.10 0.00 1.00 0.00 0.00 64.86 65.64 1pa2 h ILE 258 Cb 0.62 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1pa2 h ILE 258 CO 0.02 0.06 -0.35 0.00 0.00 0.00 0.00 178.15 177.89 1pa2 h ALA 259 N 1.14 1.13 -0.29 1.87 0.00 -1.75 -0.60 119.26 120.75 1pa2 h ALA 259 Ca 0.12 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 1pa2 h ALA 259 Cb 0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1pa2 h ALA 259 CO -0.06 0.56 -0.12 0.82 0.00 0.00 0.00 179.25 180.45 1pa2 h ILE 260 N 0.27 1.29 -0.57 0.00 2.04 -1.48 0.30 117.51 119.35 1pa2 h ILE 260 Ca 0.03 -1.21 0.10 0.00 1.00 0.00 0.00 64.86 64.78 1pa2 h ILE 260 Cb 0.74 1.46 -0.08 0.00 -0.74 0.00 0.00 36.82 38.20 1pa2 h ILE 260 CO 0.06 0.38 0.15 0.58 0.00 0.00 0.00 178.15 179.33 1pa2 h VAL 261 N 0.35 0.71 -0.14 1.67 2.07 -0.74 -1.82 116.25 118.35 1pa2 h VAL 261 Ca 0.07 -0.10 -0.13 0.00 0.82 0.00 0.00 66.70 67.36 1pa2 h VAL 261 Cb 0.63 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1pa2 h VAL 261 CO 0.04 0.06 -0.47 0.74 0.02 0.00 0.00 177.57 177.96 1pa2 h THR 262 N 0.30 1.33 -0.50 2.57 2.02 -0.77 0.26 112.91 118.12 1pa2 h THR 262 Ca 0.29 -1.67 0.02 0.00 0.77 0.00 0.00 66.41 65.82 1pa2 h THR 262 Cb 0.40 1.73 -0.03 0.00 -1.74 0.00 0.00 68.15 68.51 1pa2 h THR 262 CO -0.35 0.51 0.31 0.77 0.37 0.00 0.00 175.52 177.13 1pa2 h SER 263 N 0.29 0.51 0.17 4.18 4.64 -0.45 -0.13 113.55 122.76 1pa2 h SER 263 Ca 0.02 -0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.18 1pa2 h SER 263 Cb 0.93 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.90 1pa2 h SER 263 CO 0.08 0.37 -0.58 -0.26 -0.87 0.00 0.00 176.83 175.57 1pa2 h PHE 264 N 0.62 0.53 -0.22 4.77 0.04 -0.92 -1.36 116.94 120.40 1pa2 h PHE 264 Ca 0.19 -0.19 -0.10 0.00 2.80 0.00 0.00 57.97 60.67 1pa2 h PHE 264 Cb -0.02 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.02 1pa2 h PHE 264 CO -0.06 0.89 -0.29 0.00 -0.60 0.00 0.00 178.31 178.26 1pa2 h ALA 265 N 1.06 1.08 0.00 2.45 0.00 -0.74 -3.19 119.26 119.92 1pa2 h ALA 265 Ca 0.00 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1pa2 h ALA 265 Cb 1.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1pa2 h ALA 265 CO 0.10 0.57 -0.53 0.66 0.00 0.00 0.00 179.25 180.05 1pa2 h SER 266 N 0.39 0.00 -2.28 0.00 4.64 -0.75 -3.44 113.55 112.10 1pa2 h SER 266 Ca 0.05 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.04 1pa2 h SER 266 Cb 0.71 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.46 1pa2 h SER 266 CO 0.05 0.32 -0.64 0.21 -0.87 0.00 0.00 176.83 175.91 1pa2 s ASN 267 N -6.20 1.72 0.36 4.97 3.84 -0.54 -5.01 114.94 114.09 1pa2 s ASN 267 Ca 0.04 -0.64 0.10 0.00 0.21 0.00 0.00 52.86 52.57 1pa2 s ASN 267 Cb 0.07 0.43 0.70 0.00 -0.55 0.00 0.00 41.25 41.90 1pa2 s ASN 267 CO 0.74 -0.38 1.84 -0.61 -2.79 0.00 0.00 177.10 175.90 1pa2 h GLN 268 N 8.28 0.12 -0.71 0.43 4.15 -1.85 -2.52 115.11 123.01 1pa2 h GLN 268 Ca -0.15 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.22 1pa2 h GLN 268 Cb 1.09 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.74 1pa2 h GLN 268 CO 0.33 0.41 0.42 1.15 -1.93 0.00 0.00 178.83 179.21 1pa2 h THR 269 N 0.11 1.21 -0.62 2.39 2.02 -1.95 0.99 112.91 117.07 1pa2 h THR 269 Ca 0.02 -0.49 -0.05 0.00 0.77 0.00 0.00 66.41 66.65 1pa2 h THR 269 Cb 0.58 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 1pa2 h THR 269 CO 0.04 0.22 0.19 -0.07 0.37 0.00 0.00 175.52 176.27 1pa2 h LEU 270 N 0.98 0.91 0.09 2.58 3.38 -1.81 -1.13 115.31 120.31 1pa2 h LEU 270 Ca 0.25 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1pa2 h LEU 270 Cb -0.00 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1pa2 h LEU 270 CO -0.05 0.88 -0.04 0.15 0.09 0.00 0.00 178.44 179.48 1pa2 h PHE 271 N 0.90 -0.11 -0.77 1.13 3.57 -1.10 -1.80 116.94 118.76 1pa2 h PHE 271 Ca 0.20 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 1pa2 h PHE 271 Cb 0.30 0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 1pa2 h PHE 271 CO 0.02 -0.03 0.39 0.74 -2.23 0.00 0.00 178.31 177.20 1pa2 h PHE 272 N -0.16 1.08 -0.54 0.41 -1.00 -0.61 0.62 116.94 116.74 1pa2 h PHE 272 Ca -0.01 -0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.73 1pa2 h PHE 272 Cb 0.13 -0.34 -0.03 0.00 3.61 0.00 0.00 35.95 39.32 1pa2 h PHE 272 CO -0.06 0.77 0.35 1.96 -1.61 0.00 0.00 178.31 179.72 1pa2 h GLN 273 N 1.07 0.72 -0.55 1.51 4.20 -1.14 -1.67 115.11 119.25 1pa2 h GLN 273 Ca 0.27 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.83 1pa2 h GLN 273 Cb 0.08 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1pa2 h GLN 273 CO -0.04 0.49 -0.02 0.00 -0.67 0.00 0.00 178.83 178.60 1pa2 h ALA 274 N 1.18 0.74 -0.31 3.87 0.00 -0.82 -2.35 119.26 121.58 1pa2 h ALA 274 Ca 0.20 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1pa2 h ALA 274 Cb -0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1pa2 h ALA 274 CO -0.04 0.58 0.16 0.35 0.00 0.00 0.00 179.25 180.30 1pa2 h PHE 275 N 0.85 0.43 -0.24 0.00 3.57 -0.76 0.45 116.94 121.25 1pa2 h PHE 275 Ca 0.15 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.64 1pa2 h PHE 275 Cb 0.56 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 1pa2 h PHE 275 CO 0.04 0.36 0.14 0.00 -2.23 0.00 0.00 178.31 176.62 1pa2 h ALA 276 N 1.03 0.30 -0.62 2.41 0.00 -1.23 0.01 119.26 121.15 1pa2 h ALA 276 Ca 0.11 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1pa2 h ALA 276 Cb 0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1pa2 h ALA 276 CO -0.02 -0.18 0.29 0.37 0.00 0.00 0.00 179.25 179.71 1pa2 h GLN 277 N 0.29 0.90 -0.13 0.00 5.75 -1.17 -1.78 115.11 118.97 1pa2 h GLN 277 Ca 0.08 -0.14 -0.10 0.00 -0.15 0.00 0.00 58.65 58.35 1pa2 h GLN 277 Cb 0.03 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.41 1pa2 h GLN 277 CO -0.02 0.73 -0.35 0.77 -2.65 0.00 0.00 178.83 177.32 1pa2 h SER 278 N 0.86 0.27 -0.52 -0.69 0.02 -0.63 -0.55 113.55 112.31 1pa2 h SER 278 Ca 0.21 -0.10 -0.08 0.00 -0.84 0.00 0.00 61.79 60.98 1pa2 h SER 278 Cb 0.14 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1pa2 h SER 278 CO -0.02 0.61 0.02 0.24 -1.14 0.00 0.00 176.83 176.54 1pa2 h MET 279 N 0.23 0.90 -0.68 3.45 2.86 -0.67 -0.42 114.93 120.59 1pa2 h MET 279 Ca 0.03 -0.27 -0.02 0.00 -2.06 0.00 0.00 59.70 57.37 1pa2 h MET 279 Cb 0.73 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 1pa2 h MET 279 CO 0.06 0.91 0.35 0.82 1.06 0.00 0.00 176.91 180.10 1pa2 h ILE 280 N 0.77 1.22 -0.09 -1.22 2.04 -0.96 -0.68 117.51 118.59 1pa2 h ILE 280 Ca 0.15 -0.60 0.02 0.00 1.00 0.00 0.00 64.86 65.43 1pa2 h ILE 280 Cb 0.49 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1pa2 h ILE 280 CO 0.02 0.25 -0.04 0.78 0.00 0.00 0.00 178.15 179.17 1pa2 h ASN 281 N 0.94 -0.12 -0.75 1.72 2.35 -0.81 -2.00 115.58 116.91 1pa2 h ASN 281 Ca 0.24 0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 56.00 1pa2 h ASN 281 Cb 0.09 0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 1pa2 h ASN 281 CO -0.03 -0.05 0.39 -0.03 -1.65 0.00 0.00 177.43 176.06 1pa2 h MET 282 N -0.02 1.07 0.00 0.81 4.05 -0.95 -2.14 114.93 117.74 1pa2 h MET 282 Ca 0.05 -0.14 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 1pa2 h MET 282 Cb 0.09 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 30.69 1pa2 h MET 282 CO -0.10 0.82 0.00 0.41 0.23 0.00 0.00 176.91 178.26 1pa2 n GLY 283 N -1.03 -1.04 0.95 1.39 0.00 -0.27 -2.22 105.19 102.96 1pa2 n GLY 283 Ca 0.07 0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.20 1pa2 n GLY 283 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pa2 n ASN 284 N -1.79 2.79 -4.67 1.61 5.03 -0.79 -4.89 115.26 112.56 1pa2 n ASN 284 Ca 0.02 -1.94 -0.43 0.00 0.87 0.00 0.00 54.58 53.11 1pa2 n ASN 284 Cb 0.17 -0.28 -0.02 0.00 -1.02 0.00 0.00 39.78 38.63 1pa2 n ASN 284 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1pa2 s ILE 285 N -1.44 4.67 -0.80 2.41 1.01 -0.94 -4.39 121.20 121.71 1pa2 s ILE 285 Ca 0.36 1.98 -0.21 0.00 0.00 0.00 0.00 60.65 62.78 1pa2 s ILE 285 Cb 0.20 -4.27 0.03 0.00 0.01 0.00 0.00 42.46 38.42 1pa2 s ILE 285 CO 0.27 -0.10 0.46 -0.24 0.00 0.00 0.00 174.94 175.33 1pa2 n SER 286 N 5.79 -2.88 -4.78 3.58 2.88 -1.26 -1.97 113.62 114.98 1pa2 n SER 286 Ca 0.11 -0.88 -0.35 0.00 -1.33 0.00 0.00 58.87 56.42 1pa2 n SER 286 Cb 0.47 -1.09 -0.01 0.00 -0.75 0.00 0.00 64.21 62.83 1pa2 n SER 286 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1pa2 s PRO 287 N -6.37 3.60 -0.10 -1.46 0.04 -1.26 -4.04 135.00 125.40 1pa2 s PRO 287 Ca 0.30 1.57 -0.24 0.00 0.04 0.00 0.00 61.00 62.67 1pa2 s PRO 287 Cb -0.17 -2.14 -0.03 0.00 0.04 0.00 0.00 34.50 32.21 1pa2 s PRO 287 CO 0.67 -0.64 0.76 -0.51 0.04 0.00 0.00 177.00 177.32 1pa2 s LEU 288 N -3.49 4.26 0.19 -3.56 1.43 -1.26 -4.98 118.68 111.27 1pa2 s LEU 288 Ca 0.69 1.20 0.03 0.00 -1.03 0.00 0.00 54.13 55.01 1pa2 s LEU 288 Cb -0.23 -3.16 -0.05 0.00 0.03 0.00 0.00 46.19 42.78 1pa2 s LEU 288 CO 0.27 -0.23 -0.01 0.42 0.23 0.00 0.00 176.35 177.02 1pa2 s THR 289 N 1.35 0.85 0.00 5.49 -4.23 -1.26 -0.15 115.64 117.69 1pa2 s THR 289 Ca 0.38 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 1pa2 s THR 289 Cb -0.17 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.49 1pa2 s THR 289 CO 0.17 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.41 1pa2 n GLY 290 N -0.30 2.64 0.10 3.99 0.00 -1.26 -1.53 105.19 108.84 1pa2 n GLY 290 Ca -0.06 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 45.93 1pa2 n GLY 290 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1pa2 h SER 291 N 0.00 0.00 -3.92 1.61 0.02 -2.02 -3.47 113.55 105.77 1pa2 h SER 291 Ca 0.00 -0.07 -0.47 0.00 -0.84 0.00 0.00 61.79 60.41 1pa2 h SER 291 Cb 0.00 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1pa2 h SER 291 CO 0.00 0.04 0.35 0.20 -1.14 0.00 0.00 176.83 176.28 1pa2 s ASN 292 N -4.62 7.22 0.18 3.07 0.01 -0.58 -4.84 114.94 115.38 1pa2 s ASN 292 Ca 0.08 1.84 0.00 0.00 -0.71 0.00 0.00 52.86 54.07 1pa2 s ASN 292 Cb 0.12 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 39.20 1pa2 s ASN 292 CO 0.65 -0.15 0.00 0.61 -1.51 0.00 0.00 177.10 176.70 1pa2 n GLY 293 N 0.36 -2.04 3.33 0.66 0.00 -1.26 -4.16 105.19 102.08 1pa2 n GLY 293 Ca 0.03 -1.36 -0.19 0.00 0.00 0.00 0.00 46.02 44.50 1pa2 n GLY 293 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1pa2 s GLU 294 N -1.26 1.66 -0.51 1.61 -1.05 0.05 -4.82 118.70 114.36 1pa2 s GLU 294 Ca 0.00 -1.96 -0.18 0.00 -0.15 0.00 0.00 54.97 52.68 1pa2 s GLU 294 Cb 0.00 -0.00 0.07 0.00 -0.44 0.00 0.00 34.13 33.76 1pa2 s GLU 294 CO 0.00 -0.51 0.58 0.42 0.95 0.00 0.00 175.26 176.70 1pa2 s ILE 295 N -3.55 4.97 0.22 1.83 1.01 -1.26 -0.17 121.20 124.24 1pa2 s ILE 295 Ca 0.36 -0.75 -0.30 0.00 0.00 0.00 0.00 60.65 59.95 1pa2 s ILE 295 Cb 0.04 -4.29 -0.10 0.00 0.01 0.00 0.00 42.46 38.12 1pa2 s ILE 295 CO 0.20 -0.81 1.46 -0.13 0.00 0.00 0.00 174.94 175.66 1pa2 s ARG 296 N 2.36 4.27 0.00 2.79 0.52 -1.26 -4.93 118.95 122.70 1pa2 s ARG 296 Ca 0.11 2.29 -0.21 0.00 -0.52 0.00 0.00 55.73 57.40 1pa2 s ARG 296 Cb -0.22 -3.13 -0.21 0.00 0.52 0.00 0.00 34.95 31.91 1pa2 s ARG 296 CO 0.09 -0.45 1.14 -0.07 0.02 0.00 0.00 175.30 176.03 1pa2 h LEU 297 N 5.52 0.46 -7.97 2.53 3.38 -1.93 -3.43 115.31 113.88 1pa2 h LEU 297 Ca -0.45 -0.71 -0.67 0.00 0.09 0.00 0.00 57.88 56.15 1pa2 h LEU 297 Cb 1.21 -0.14 -0.36 0.00 0.09 0.00 0.00 40.66 41.47 1pa2 h LEU 297 CO 0.81 1.10 -0.83 -0.62 0.09 0.00 0.00 178.44 178.99 1pa2 s ASP 298 N -6.56 3.66 0.43 -0.43 -1.08 -1.26 -4.93 116.67 106.50 1pa2 s ASP 298 Ca -0.14 -0.96 0.30 0.00 -0.52 0.00 0.00 52.55 51.23 1pa2 s ASP 298 Cb 0.03 -1.49 1.48 0.00 -1.46 0.00 0.00 42.92 41.48 1pa2 s ASP 298 CO 0.80 -0.09 1.90 0.00 0.52 0.00 0.00 175.17 178.30 1pa2 n LYS 300 N -2.58 0.10 -3.69 0.00 5.02 -1.26 -3.94 118.16 111.82 1pa2 n LYS 300 Ca -0.01 0.09 -0.11 0.00 -2.02 0.00 0.00 58.31 56.26 1pa2 n LYS 300 Cb 0.12 -1.62 -0.06 0.00 -0.02 0.00 0.00 35.03 33.46 1pa2 n LYS 300 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1pa2 s LYS 301 N -3.04 0.95 0.57 1.97 -2.85 -0.91 -1.26 119.74 115.17 1pa2 s LYS 301 Ca 0.13 -0.57 -0.17 0.00 -1.00 0.00 0.00 55.97 54.35 1pa2 s LYS 301 Cb 0.16 0.41 -0.05 0.00 -2.06 0.00 0.00 37.83 36.30 1pa2 s LYS 301 CO 0.55 -0.34 1.07 0.14 0.10 0.00 0.00 175.35 176.87 1pa2 s VAL 302 N -3.11 3.67 0.37 1.79 -7.23 -1.26 -4.57 120.40 110.06 1pa2 s VAL 302 Ca -0.01 0.87 -0.28 0.00 -1.81 0.00 0.00 61.98 60.75 1pa2 s VAL 302 Cb 0.01 -3.36 -0.10 0.00 0.56 0.00 0.00 36.38 33.49 1pa2 s VAL 302 CO -0.07 -0.39 1.39 0.20 -0.31 0.00 0.00 175.10 175.92 1pa2 s ASN 303 N -2.47 6.48 0.00 4.85 0.01 -1.26 -2.46 114.94 120.09 1pa2 s ASN 303 Ca 0.66 2.85 0.00 0.00 -0.71 0.00 0.00 52.86 55.66 1pa2 s ASN 303 Cb -0.17 -2.66 0.00 0.00 0.41 0.00 0.00 41.25 38.83 1pa2 s ASN 303 CO 0.32 -0.75 0.00 0.61 -1.51 0.00 0.00 177.10 175.77 1pa2 n GLY 304 N 0.62 1.17 0.85 0.66 0.00 -1.26 -5.15 105.19 102.08 1pa2 n GLY 304 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1pa2 n GLY 304 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76