#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c29 h LEU 4 N 0.00 0.19 -9.70 3.22 3.38 -1.96 -3.47 115.31 106.97 1c29 h LEU 4 Ca 0.00 -0.25 -0.56 0.00 0.09 0.00 0.00 57.88 57.16 1c29 h LEU 4 Cb 0.00 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 40.60 1c29 h LEU 4 CO 0.00 1.21 -0.58 -0.76 0.09 0.00 0.00 178.44 178.39 1c29 s LEU 5 N -6.72 3.20 -0.14 1.67 1.43 -1.26 -5.09 118.68 111.77 1c29 s LEU 5 Ca -0.05 -0.77 -0.29 0.00 -1.03 0.00 0.00 54.13 51.99 1c29 s LEU 5 Cb 0.08 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.62 1c29 s LEU 5 CO 0.84 -0.20 1.19 0.21 0.23 0.00 0.00 176.35 178.62 1c29 s ASN 6 N -3.77 7.02 0.32 2.29 3.84 -1.26 -4.91 114.94 118.47 1c29 s ASN 6 Ca 0.35 1.67 0.25 0.00 0.21 0.00 0.00 52.86 55.34 1c29 s ASN 6 Cb -0.03 -2.55 1.10 0.00 -0.55 0.00 0.00 41.25 39.22 1c29 s ASN 6 CO 0.21 -0.67 1.76 -0.65 -2.79 0.00 0.00 177.10 174.96 1c29 h PRO 7 N 7.78 0.00 -6.25 0.43 0.11 -1.97 -3.45 132.00 128.65 1c29 h PRO 7 Ca -0.28 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.25 1c29 h PRO 7 Cb 1.12 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.11 1c29 h PRO 7 CO 0.94 0.00 -0.70 0.71 -0.21 0.00 0.00 178.00 178.74 1c29 s TYR 8 N -3.42 2.55 -0.42 0.65 1.51 -1.26 -1.50 117.35 115.45 1c29 s TYR 8 Ca 0.03 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 55.85 1c29 s TYR 8 Cb 0.09 -1.14 0.13 0.00 -0.11 0.00 0.00 41.96 40.93 1c29 s TYR 8 CO 0.38 0.64 0.20 -0.06 -1.11 0.00 0.00 175.55 175.61 1c29 s PHE 9 N -2.29 2.21 0.00 2.71 0.40 0.37 -4.99 117.98 116.39 1c29 s PHE 9 Ca 0.30 -2.45 0.00 0.00 -0.60 0.00 0.00 56.93 54.18 1c29 s PHE 9 Cb -0.06 -2.05 0.00 0.00 0.51 0.00 0.00 43.02 41.42 1c29 s PHE 9 CO 0.17 -0.80 0.00 0.41 0.70 0.00 0.00 175.22 175.70 1c29 n GLY 10 N 3.75 2.76 0.05 4.36 0.00 -1.26 -1.80 105.19 113.04 1c29 n GLY 10 Ca 0.06 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1c29 n GLY 10 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1c29 n GLU 11 N 9.06 0.30 -4.02 1.61 2.13 -1.26 -4.97 120.64 123.50 1c29 n GLU 11 Ca 0.00 0.03 -0.32 0.00 0.66 0.00 0.00 57.16 57.53 1c29 n GLU 11 Cb 0.00 -1.63 -0.06 0.00 0.27 0.00 0.00 31.44 30.02 1c29 n GLU 11 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1c29 s PHE 12 N -3.19 3.35 0.00 4.31 0.08 -0.74 -4.93 117.98 116.85 1c29 s PHE 12 Ca 0.04 0.20 0.00 0.00 0.12 0.00 0.00 56.93 57.30 1c29 s PHE 12 Cb 0.14 -1.72 0.00 0.00 -0.57 0.00 0.00 43.02 40.87 1c29 s PHE 12 CO 0.77 0.57 0.00 0.41 -0.10 0.00 0.00 175.22 176.87 1c29 n GLY 13 N 0.75 0.11 2.45 4.36 0.00 -0.66 -0.48 105.19 111.72 1c29 n GLY 13 Ca -0.10 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1c29 n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c29 n GLY 14 N 0.00 -1.97 2.26 -0.02 0.00 -0.56 -0.84 105.19 104.05 1c29 n GLY 14 Ca 0.00 -1.83 -0.23 0.00 0.00 0.00 0.00 46.02 43.96 1c29 n GLY 14 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1c29 n MET 15 N -0.03 0.62 -2.73 1.61 2.81 -1.26 -2.22 117.12 115.93 1c29 n MET 15 Ca 0.00 -3.12 -0.43 0.00 -1.81 0.00 0.00 57.70 52.34 1c29 n MET 15 Cb 0.00 -1.30 0.00 0.00 -0.71 0.00 0.00 33.22 31.21 1c29 n MET 15 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1c29 n TYR 16 N 1.68 3.43 -4.29 2.03 4.02 -0.99 -4.96 117.16 118.08 1c29 n TYR 16 Ca 0.22 -2.97 -0.19 0.00 -0.01 0.00 0.00 57.90 54.95 1c29 n TYR 16 Cb 0.53 -1.80 -0.11 0.00 -0.02 0.00 0.00 39.34 37.94 1c29 n TYR 16 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1c29 s VAL 17 N -0.35 1.54 0.60 -0.72 -7.23 -1.26 -2.94 120.40 110.04 1c29 s VAL 17 Ca 0.37 -1.93 -0.19 0.00 -1.81 0.00 0.00 61.98 58.43 1c29 s VAL 17 Cb 0.04 -1.77 -0.04 0.00 0.56 0.00 0.00 36.38 35.16 1c29 s VAL 17 CO 0.02 -0.47 1.02 -2.65 -0.31 0.00 0.00 175.10 172.71 1c29 n PRO 18 N 0.16 0.95 -0.36 4.82 -0.02 -1.26 -4.84 135.00 134.45 1c29 n PRO 18 Ca -0.12 0.37 0.26 0.00 -2.02 0.00 0.00 63.50 61.98 1c29 n PRO 18 Cb 0.58 -2.22 0.52 0.00 -0.02 0.00 0.00 33.50 32.36 1c29 n PRO 18 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1c29 h GLN 19 N 0.53 0.31 -0.64 -0.52 5.75 -1.99 -1.92 115.11 116.62 1c29 h GLN 19 Ca -0.49 -0.02 0.14 0.00 -0.15 0.00 0.00 58.65 58.14 1c29 h GLN 19 Cb 1.36 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 29.80 1c29 h GLN 19 CO 0.51 0.20 0.44 0.97 -2.65 0.00 0.00 178.83 178.31 1c29 h ILE 20 N 0.32 0.78 -0.00 2.39 6.09 -1.95 -2.36 117.51 122.78 1c29 h ILE 20 Ca 0.70 -0.08 0.00 0.00 -1.37 0.00 0.00 64.86 64.10 1c29 h ILE 20 Cb 1.79 0.52 0.00 0.00 0.47 0.00 0.00 36.82 39.59 1c29 h ILE 20 CO -0.44 0.04 -0.46 0.18 -3.07 0.00 0.00 178.15 174.40 1c29 n LEU 21 N -4.44 0.47 -0.11 2.19 7.99 -0.72 -4.32 117.00 118.07 1c29 n LEU 21 Ca 0.12 0.03 -0.06 0.00 -0.01 0.00 0.00 56.01 56.09 1c29 n LEU 21 Cb 0.54 -0.27 0.02 0.00 -0.11 0.00 0.00 43.42 43.60 1c29 n LEU 21 CO 0.35 0.12 0.94 0.24 -1.51 0.00 0.00 177.39 177.52 1c29 h MET 22 N 0.02 0.26 -0.49 3.23 2.86 -1.50 -1.81 114.93 117.50 1c29 h MET 22 Ca 0.00 -0.02 0.07 0.00 -2.06 0.00 0.00 59.70 57.69 1c29 h MET 22 Cb 0.50 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 1c29 h MET 22 CO 0.00 0.17 0.33 -1.35 1.06 0.00 0.00 176.91 177.12 1c29 h PRO 23 N 0.27 0.37 -0.54 -0.22 0.11 -1.77 -0.41 132.00 129.81 1c29 h PRO 23 Ca 0.16 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 66.13 1c29 h PRO 23 Cb 0.14 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.15 1c29 h PRO 23 CO -0.17 0.24 -0.13 0.00 -0.21 0.00 0.00 178.00 177.73 1c29 h ALA 24 N 1.74 0.74 -0.16 -0.75 0.00 -1.61 0.03 119.26 119.24 1c29 h ALA 24 Ca 0.22 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 1c29 h ALA 24 Cb 0.37 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1c29 h ALA 24 CO -0.05 0.67 -0.56 -0.07 0.00 0.00 0.00 179.25 179.24 1c29 h LEU 25 N 0.91 0.56 -0.38 0.00 3.38 -0.76 -0.59 115.31 118.43 1c29 h LEU 25 Ca 0.14 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 57.67 1c29 h LEU 25 Cb 0.70 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1c29 h LEU 25 CO 0.05 1.00 -0.26 0.78 0.09 0.00 0.00 178.44 180.10 1c29 h ASN 26 N 0.38 0.90 0.32 -0.43 -0.26 -0.93 -0.22 115.58 115.34 1c29 h ASN 26 Ca 0.01 -0.43 -0.02 0.00 -0.56 0.00 0.00 56.30 55.30 1c29 h ASN 26 Cb 1.09 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 38.11 1c29 h ASN 26 CO 0.10 1.14 -0.15 -0.61 -1.06 0.00 0.00 177.43 176.85 1c29 h GLN 27 N 0.66 -0.41 -0.26 0.81 4.15 -0.92 -2.09 115.11 117.06 1c29 h GLN 27 Ca 0.08 0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.57 1c29 h GLN 27 Cb 0.84 0.09 -0.04 0.00 0.21 0.00 0.00 27.48 28.58 1c29 h GLN 27 CO 0.07 -0.27 -0.01 1.25 -1.93 0.00 0.00 178.83 177.94 1c29 h LEU 28 N -0.44 -0.12 -0.50 -2.39 5.85 -1.04 -0.40 115.31 116.27 1c29 h LEU 28 Ca -0.04 0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.82 1c29 h LEU 28 Cb 0.33 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 1c29 h LEU 28 CO 0.07 -0.03 0.13 -0.08 -0.34 0.00 0.00 178.44 178.20 1c29 h GLU 29 N 0.07 0.28 -0.35 1.25 4.81 -0.93 -1.26 114.58 118.45 1c29 h GLU 29 Ca 0.12 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.23 1c29 h GLU 29 Cb 0.17 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1c29 h GLU 29 CO -0.22 0.18 -0.23 1.49 -0.73 0.00 0.00 179.01 179.50 1c29 h GLU 30 N 0.28 0.68 0.00 1.92 4.22 -0.92 -1.72 114.58 119.04 1c29 h GLU 30 Ca 0.25 -0.27 -0.10 0.00 0.08 0.00 0.00 59.36 59.32 1c29 h GLU 30 Cb 0.31 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1c29 h GLU 30 CO -0.29 0.85 -0.46 0.00 -2.18 0.00 0.00 179.01 176.93 1c29 h ALA 31 N 1.15 1.14 -0.02 2.92 0.00 -0.66 -2.20 119.26 121.59 1c29 h ALA 31 Ca 0.08 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1c29 h ALA 31 Cb 0.71 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1c29 h ALA 31 CO 0.05 0.57 -0.03 0.35 0.00 0.00 0.00 179.25 180.19 1c29 h PHE 32 N 0.00 0.07 -0.86 0.00 3.57 -0.90 -0.67 116.94 118.15 1c29 h PHE 32 Ca -0.00 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.51 1c29 h PHE 32 Cb 0.86 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.54 1c29 h PHE 32 CO 0.00 0.60 0.55 0.28 -2.23 0.00 0.00 178.31 177.51 1c29 h VAL 33 N -0.48 1.13 -0.11 1.41 2.07 -1.31 0.36 116.25 119.32 1c29 h VAL 33 Ca 0.00 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1c29 h VAL 33 Cb 0.59 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1c29 h VAL 33 CO 0.01 0.19 0.00 -0.09 0.02 0.00 0.00 177.57 177.70 1c29 h ARG 34 N 1.06 0.20 -1.00 1.57 2.43 -1.40 -2.98 114.38 114.25 1c29 h ARG 34 Ca 0.35 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.50 1c29 h ARG 34 Cb 0.03 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.50 1c29 h ARG 34 CO -0.12 0.44 0.65 0.00 -1.51 0.00 0.00 179.97 179.43 1c29 h ALA 35 N 0.75 1.37 0.00 2.80 0.00 -0.77 -1.48 119.26 121.93 1c29 h ALA 35 Ca 0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1c29 h ALA 35 Cb 0.35 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1c29 h ALA 35 CO 0.01 0.51 -0.08 0.37 0.00 0.00 0.00 179.25 180.05 1c29 h GLN 36 N 1.23 0.00 -0.10 0.00 5.75 -0.85 -0.87 115.11 120.27 1c29 h GLN 36 Ca 0.41 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.91 1c29 h GLN 36 Cb 0.07 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.62 1c29 h GLN 36 CO -0.14 0.08 0.00 1.63 -2.65 0.00 0.00 178.83 177.75 1c29 n LYS 37 N -4.16 2.20 -3.19 1.69 5.02 -0.72 -4.87 118.16 114.14 1c29 n LYS 37 Ca -0.03 -1.93 -0.43 0.00 -2.02 0.00 0.00 58.31 53.90 1c29 n LYS 37 Cb 0.17 -1.45 -0.07 0.00 -0.02 0.00 0.00 35.03 33.66 1c29 n LYS 37 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1c29 s ASP 38 N -1.79 6.27 0.48 4.39 3.68 -0.33 -4.94 116.67 124.43 1c29 s ASP 38 Ca 0.29 -0.48 0.15 0.00 2.13 0.00 0.00 52.55 54.64 1c29 s ASP 38 Cb 0.19 -2.28 1.12 0.00 -1.45 0.00 0.00 42.92 40.50 1c29 s ASP 38 CO 0.29 -0.71 2.07 1.55 0.13 0.00 0.00 175.17 178.49 1c29 h PRO 39 N 8.83 0.01 -0.46 4.34 0.13 -1.89 -0.85 132.00 142.11 1c29 h PRO 39 Ca -0.26 -0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.75 1c29 h PRO 39 Cb 1.10 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1c29 h PRO 39 CO 0.86 0.10 -0.18 0.93 -0.23 0.00 0.00 178.00 179.48 1c29 h GLU 40 N 0.01 0.93 0.13 0.86 4.39 -1.93 0.61 114.58 119.59 1c29 h GLU 40 Ca 0.00 -0.39 -0.01 0.00 0.34 0.00 0.00 59.36 59.31 1c29 h GLU 40 Cb 0.16 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1c29 h GLU 40 CO 0.01 1.05 -0.06 0.35 -1.16 0.00 0.00 179.01 179.20 1c29 h PHE 41 N 0.77 -0.16 -0.80 4.33 3.57 -1.65 -1.81 116.94 121.19 1c29 h PHE 41 Ca 0.11 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.74 1c29 h PHE 41 Cb 0.75 0.05 -0.09 0.00 2.79 0.00 0.00 35.95 39.45 1c29 h PHE 41 CO 0.05 0.15 0.39 0.37 -2.23 0.00 0.00 178.31 177.04 1c29 h GLN 42 N -0.49 0.57 0.00 1.11 5.75 -1.07 0.17 115.11 121.16 1c29 h GLN 42 Ca -0.02 -0.03 -0.09 0.00 -0.15 0.00 0.00 58.65 58.36 1c29 h GLN 42 Cb 0.39 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 1c29 h GLN 42 CO 0.03 0.38 -0.42 0.00 -2.65 0.00 0.00 178.83 176.17 1c29 h ALA 43 N 1.53 1.09 0.07 3.38 0.00 -0.81 -0.00 119.26 124.52 1c29 h ALA 43 Ca 0.43 -0.38 -0.23 0.00 0.00 0.00 0.00 54.91 54.73 1c29 h ALA 43 Cb 0.58 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.32 1c29 h ALA 43 CO -0.35 0.53 -0.93 1.96 0.00 0.00 0.00 179.25 180.46 1c29 h GLN 44 N 0.00 0.50 -0.38 0.00 4.20 -0.15 -1.98 115.11 117.30 1c29 h GLN 44 Ca -0.00 -0.64 -0.07 0.00 0.06 0.00 0.00 58.65 58.00 1c29 h GLN 44 Cb 0.86 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.83 1c29 h GLN 44 CO 0.05 1.26 -0.04 0.35 -0.67 0.00 0.00 178.83 179.79 1c29 h PHE 45 N 0.04 0.77 -0.60 2.96 3.57 -0.62 -2.02 116.94 121.04 1c29 h PHE 45 Ca -0.14 -0.15 -0.02 0.00 3.53 0.00 0.00 57.97 61.19 1c29 h PHE 45 Cb 1.65 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 40.16 1c29 h PHE 45 CO 0.14 0.81 0.28 0.00 -2.23 0.00 0.00 178.31 177.31 1c29 h ALA 46 N 0.86 1.37 -0.15 2.41 0.00 -1.04 -0.70 119.26 121.99 1c29 h ALA 46 Ca 0.10 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1c29 h ALA 46 Cb 0.53 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1c29 h ALA 46 CO 0.03 0.49 -0.04 0.22 0.00 0.00 0.00 179.25 179.95 1c29 h ASP 47 N 0.84 0.30 -0.63 0.00 1.82 -1.15 -1.39 116.42 116.21 1c29 h ASP 47 Ca 0.21 -0.37 -0.01 0.00 -0.39 0.00 0.00 57.03 56.47 1c29 h ASP 47 Cb 0.10 -0.08 -0.03 0.00 0.68 0.00 0.00 39.33 40.00 1c29 h ASP 47 CO -0.03 0.60 0.37 -0.07 -1.61 0.00 0.00 179.24 178.51 1c29 h LEU 48 N -0.00 0.77 -0.35 2.28 4.07 -1.10 -1.29 115.31 119.69 1c29 h LEU 48 Ca 0.04 -0.07 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 1c29 h LEU 48 Cb 0.47 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.00 1c29 h LEU 48 CO 0.02 0.61 0.20 -0.07 -1.08 0.00 0.00 178.44 178.12 1c29 h LEU 49 N 0.86 0.43 0.26 1.67 4.07 -1.07 -1.20 115.31 120.32 1c29 h LEU 49 Ca 0.23 -0.07 -0.01 0.00 0.08 0.00 0.00 57.88 58.10 1c29 h LEU 49 Cb -0.01 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.63 1c29 h LEU 49 CO -0.04 0.37 -0.12 0.50 -1.08 0.00 0.00 178.44 178.07 1c29 h LYS 50 N 0.45 -0.33 0.00 1.13 3.64 -1.06 -1.34 116.57 119.05 1c29 h LYS 50 Ca 0.12 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1c29 h LYS 50 Cb 0.03 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1c29 h LYS 50 CO -0.02 -0.22 -0.20 -0.91 -2.27 0.00 0.00 179.45 175.83 1c29 h ASN 51 N -0.95 0.00 0.00 4.20 4.21 -1.38 -2.88 115.58 118.78 1c29 h ASN 51 Ca -0.04 -0.06 -0.17 0.00 1.21 0.00 0.00 56.30 57.24 1c29 h ASN 51 Cb 0.26 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.43 1c29 h ASN 51 CO 0.06 0.03 -1.65 0.00 -1.29 0.00 0.00 177.43 174.58 1c29 n TYR 52 N -2.30 0.00 -0.01 1.19 9.36 -0.72 -4.80 117.16 119.88 1c29 n TYR 52 Ca 0.05 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.25 1c29 n TYR 52 Cb 0.44 -0.45 -0.12 0.00 -0.63 0.00 0.00 39.34 38.59 1c29 n TYR 52 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1c29 n ALA 53 N -2.71 1.94 0.00 2.98 0.00 -0.53 -4.81 120.51 117.38 1c29 n ALA 53 Ca -0.19 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.50 1c29 n ALA 53 Cb 0.74 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1c29 n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c29 n GLY 54 N 1.47 1.24 3.76 0.00 0.00 -0.96 -1.19 105.19 109.51 1c29 n GLY 54 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1c29 n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1c29 s ARG 55 N -0.51 4.40 0.41 1.61 6.06 -0.54 -4.10 118.95 126.28 1c29 s ARG 55 Ca 0.00 2.14 -0.14 0.00 -2.50 0.00 0.00 55.73 55.23 1c29 s ARG 55 Cb 0.00 -3.10 -0.08 0.00 0.06 0.00 0.00 34.95 31.83 1c29 s ARG 55 CO 0.00 -0.14 0.82 -1.25 -2.50 0.00 0.00 175.30 172.23 1c29 s PRO 56 N -1.53 3.91 0.42 5.12 0.04 -1.26 -4.40 135.00 137.30 1c29 s PRO 56 Ca 0.49 0.67 -0.12 0.00 0.04 0.00 0.00 61.00 62.08 1c29 s PRO 56 Cb -0.38 -2.33 -0.07 0.00 0.04 0.00 0.00 34.50 31.75 1c29 s PRO 56 CO 0.49 -0.03 0.81 0.95 0.04 0.00 0.00 177.00 179.26 1c29 s THR 57 N -2.30 4.72 0.84 1.26 -4.23 -1.26 -5.07 115.64 109.61 1c29 s THR 57 Ca 0.54 0.79 -0.11 0.00 -1.18 0.00 0.00 61.69 61.73 1c29 s THR 57 Cb -0.10 -3.71 0.10 0.00 1.34 0.00 0.00 72.50 70.12 1c29 s THR 57 CO 0.26 -0.51 1.09 0.00 -0.54 0.00 0.00 174.62 174.92 1c29 s ALA 58 N -2.37 1.88 -0.28 3.99 0.00 -1.26 -4.81 121.76 118.91 1c29 s ALA 58 Ca 0.53 -0.02 0.01 0.00 0.00 0.00 0.00 51.96 52.48 1c29 s ALA 58 Cb -0.10 -3.19 0.08 0.00 0.00 0.00 0.00 23.12 19.91 1c29 s ALA 58 CO 0.29 -2.06 0.01 -1.17 0.00 0.00 0.00 175.76 172.83 1c29 s LEU 59 N -6.04 3.02 -0.27 0.00 2.96 -1.26 -1.10 118.68 115.98 1c29 s LEU 59 Ca 0.62 -1.52 -0.13 0.00 -0.22 0.00 0.00 54.13 52.88 1c29 s LEU 59 Cb -0.17 -1.21 -0.04 0.00 0.50 0.00 0.00 46.19 45.27 1c29 s LEU 59 CO 0.56 -0.31 0.29 -0.89 -1.32 0.00 0.00 176.35 174.68 1c29 s THR 60 N 1.33 5.23 -0.32 3.68 2.01 0.07 -4.84 115.64 122.81 1c29 s THR 60 Ca 0.02 0.40 -0.29 0.00 0.31 0.00 0.00 61.69 62.13 1c29 s THR 60 Cb -0.19 -3.63 0.00 0.00 0.01 0.00 0.00 72.50 68.70 1c29 s THR 60 CO -0.11 0.20 1.34 -0.75 -0.69 0.00 0.00 174.62 174.61 1c29 s LYS 61 N 1.94 3.83 -0.77 4.92 2.20 -1.26 -0.76 119.74 129.84 1c29 s LYS 61 Ca 0.12 1.20 -0.23 0.00 -0.36 0.00 0.00 55.97 56.70 1c29 s LYS 61 Cb -0.16 -3.92 0.07 0.00 -1.51 0.00 0.00 37.83 32.32 1c29 s LYS 61 CO 0.10 -1.23 1.10 0.00 -0.36 0.00 0.00 175.35 174.97 1c29 h GLN 63 N 9.53 -0.04 -0.41 0.00 4.15 -1.93 -3.36 115.11 123.06 1c29 h GLN 63 Ca -0.15 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.35 1c29 h GLN 63 Cb 1.05 0.01 -0.07 0.00 0.21 0.00 0.00 27.48 28.68 1c29 h GLN 63 CO 1.21 0.47 0.00 -0.91 -1.93 0.00 0.00 178.83 177.67 1c29 h ASN 64 N -0.98 -0.16 -0.98 -0.69 -0.26 -1.91 -2.82 115.58 107.79 1c29 h ASN 64 Ca -0.00 0.09 0.14 0.00 -0.56 0.00 0.00 56.30 55.97 1c29 h ASN 64 Cb 0.53 0.17 -0.09 0.00 -1.06 0.00 0.00 38.32 37.87 1c29 h ASN 64 CO 0.01 -0.05 0.61 0.40 -1.06 0.00 0.00 177.43 177.35 1c29 h ILE 65 N 0.11 0.85 -0.14 2.81 2.04 -1.82 -2.04 117.51 119.32 1c29 h ILE 65 Ca 0.20 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1c29 h ILE 65 Cb 0.29 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 1c29 h ILE 65 CO -0.33 0.16 0.00 0.35 0.00 0.00 0.00 178.15 178.32 1c29 n THR 66 N -4.63 0.18 -1.61 -0.27 -2.24 -1.07 -4.97 114.28 99.67 1c29 n THR 66 Ca 0.20 -0.33 -0.46 0.00 -2.27 0.00 0.00 64.05 61.18 1c29 n THR 66 Cb 0.44 0.40 -0.03 0.00 -2.10 0.00 0.00 70.33 69.04 1c29 n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c29 n ALA 67 N 0.30 -0.07 -0.81 6.98 0.00 -0.77 -2.34 120.51 123.81 1c29 n ALA 67 Ca 0.17 0.42 0.00 0.00 0.00 0.00 0.00 53.44 54.02 1c29 n ALA 67 Cb 0.34 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.70 1c29 n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c29 n GLY 68 N 1.63 0.65 3.29 0.00 0.00 -1.26 -5.03 105.19 104.47 1c29 n GLY 68 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 1c29 n GLY 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1c29 s THR 69 N -2.28 0.41 -0.33 2.61 -4.23 -0.99 -4.96 115.64 105.88 1c29 s THR 69 Ca 0.00 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.61 1c29 s THR 69 Cb 0.00 -2.60 0.76 0.00 1.34 0.00 0.00 72.50 72.00 1c29 s THR 69 CO 0.00 0.00 1.82 -1.14 -0.54 0.00 0.00 174.62 174.76 1c29 n ARG 70 N -0.42 3.85 -4.02 3.99 0.63 -0.19 -4.93 116.66 115.57 1c29 n ARG 70 Ca 0.01 -3.10 -0.36 0.00 -0.92 0.00 0.00 57.85 53.48 1c29 n ARG 70 Cb 0.66 -2.23 -0.08 0.00 0.45 0.00 0.00 32.46 31.26 1c29 n ARG 70 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1c29 s THR 71 N -2.98 5.03 -0.21 5.15 2.01 -1.26 -2.37 115.64 121.02 1c29 s THR 71 Ca 0.56 0.04 -0.04 0.00 0.31 0.00 0.00 61.69 62.55 1c29 s THR 71 Cb 0.44 -3.20 -0.01 0.00 0.01 0.00 0.00 72.50 69.74 1c29 s THR 71 CO 0.14 0.57 -0.03 -0.89 -0.69 0.00 0.00 174.62 173.72 1c29 s THR 72 N -0.58 3.58 -0.13 -0.82 2.01 0.74 -4.81 115.64 115.63 1c29 s THR 72 Ca 0.11 -0.43 0.02 0.00 0.31 0.00 0.00 61.69 61.70 1c29 s THR 72 Cb -0.12 -2.62 0.01 0.00 0.01 0.00 0.00 72.50 69.79 1c29 s THR 72 CO 0.02 0.43 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.96 1c29 s LEU 73 N 1.25 1.99 0.26 4.42 2.96 -1.26 -0.35 118.68 127.95 1c29 s LEU 73 Ca 0.03 -0.55 0.09 0.00 -0.22 0.00 0.00 54.13 53.48 1c29 s LEU 73 Cb -0.14 -1.34 -0.04 0.00 0.50 0.00 0.00 46.19 45.17 1c29 s LEU 73 CO -0.01 0.06 0.03 -0.31 -1.32 0.00 0.00 176.35 174.81 1c29 s TYR 74 N 0.86 2.77 -0.07 5.38 2.02 -0.08 -0.17 117.35 128.06 1c29 s TYR 74 Ca -0.07 -0.20 0.01 0.00 -0.37 0.00 0.00 57.07 56.43 1c29 s TYR 74 Cb -0.15 -1.23 0.02 0.00 -0.40 0.00 0.00 41.96 40.19 1c29 s TYR 74 CO -0.02 0.60 -0.07 -0.51 -1.57 0.00 0.00 175.55 173.99 1c29 s LEU 75 N -3.68 1.28 -0.28 -1.29 1.43 0.06 -1.47 118.68 114.74 1c29 s LEU 75 Ca 0.31 -0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 52.91 1c29 s LEU 75 Cb -0.07 -0.65 -0.00 0.00 0.03 0.00 0.00 46.19 45.50 1c29 s LEU 75 CO 0.21 -0.06 1.32 -0.75 0.23 0.00 0.00 176.35 177.29 1c29 s LYS 76 N 1.18 3.94 -1.58 1.70 2.47 -0.29 -0.75 119.74 126.41 1c29 s LYS 76 Ca -0.06 1.32 -0.10 0.00 -1.56 0.00 0.00 55.97 55.57 1c29 s LYS 76 Cb -0.14 -3.88 -0.09 0.00 -1.46 0.00 0.00 37.83 32.26 1c29 s LYS 76 CO -0.02 -1.09 2.91 -2.13 0.16 0.00 0.00 175.35 175.18 1c29 n ARG 77 N 7.27 3.60 0.03 4.03 3.00 -0.26 -1.37 116.66 132.96 1c29 n ARG 77 Ca 0.15 -2.15 0.11 0.00 -0.00 0.00 0.00 57.85 55.95 1c29 n ARG 77 Cb 0.46 -2.78 0.44 0.00 0.00 0.00 0.00 32.46 30.59 1c29 n ARG 77 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1c29 n GLU 78 N 3.64 0.06 0.19 -0.14 -0.58 -0.76 -1.99 120.64 121.06 1c29 n GLU 78 Ca 0.77 0.20 0.14 0.00 -0.42 0.00 0.00 57.16 57.84 1c29 n GLU 78 Cb 0.22 -1.59 0.54 0.00 -0.57 0.00 0.00 31.44 30.04 1c29 n GLU 78 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 1c29 h ASP 79 N 0.00 0.00 -0.07 1.62 3.04 -1.67 -2.87 116.42 116.48 1c29 h ASP 79 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1c29 h ASP 79 Cb 0.40 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.69 1c29 h ASP 79 CO 0.00 0.00 0.00 0.18 -2.04 0.00 0.00 179.24 177.38 1c29 n LEU 80 N -2.60 1.88 -4.79 0.15 4.77 -0.84 -4.47 117.00 111.09 1c29 n LEU 80 Ca 0.02 -0.67 -0.31 0.00 -0.03 0.00 0.00 56.01 55.02 1c29 n LEU 80 Cb 0.29 -0.03 0.08 0.00 -2.33 0.00 0.00 43.42 41.43 1c29 n LEU 80 CO 0.24 0.34 0.70 -0.22 -1.33 0.00 0.00 177.39 177.12 1c29 s LEU 81 N -1.89 2.90 0.19 2.23 0.20 -1.08 -4.89 118.68 116.34 1c29 s LEU 81 Ca 0.35 1.61 -0.31 0.00 0.69 0.00 0.00 54.13 56.47 1c29 s LEU 81 Cb 0.20 -4.33 -0.09 0.00 -0.43 0.00 0.00 46.19 41.54 1c29 s LEU 81 CO 0.31 -1.87 1.45 -2.28 -0.29 0.00 0.00 176.35 173.68 1c29 s HIS 82 N -3.01 3.11 0.00 5.38 5.65 -0.34 -1.80 115.29 124.28 1c29 s HIS 82 Ca 0.60 0.92 0.00 0.00 0.25 0.00 0.00 55.06 56.83 1c29 s HIS 82 Cb -0.16 -3.80 0.00 0.00 -1.18 0.00 0.00 32.58 27.45 1c29 s HIS 82 CO 0.55 -2.73 0.00 0.41 -0.65 0.00 0.00 174.74 172.33 1c29 n GLY 83 N 2.92 1.78 2.07 1.59 0.00 -1.26 -4.42 105.19 107.87 1c29 n GLY 83 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1c29 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c29 n GLY 84 N -2.00 0.78 3.29 -0.02 0.00 -0.75 -5.00 105.19 101.49 1c29 n GLY 84 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1c29 n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c29 s ALA 85 N -2.95 -0.79 0.63 4.61 0.00 -1.25 -1.02 121.76 120.99 1c29 s ALA 85 Ca 0.00 -0.06 0.38 0.00 0.00 0.00 0.00 51.96 52.28 1c29 s ALA 85 Cb 0.00 0.53 2.17 0.00 0.00 0.00 0.00 23.12 25.82 1c29 s ALA 85 CO 0.00 -0.55 2.32 1.12 0.00 0.00 0.00 175.76 178.65 1c29 h HIS 86 N 2.69 0.00 -0.92 0.00 -0.00 -1.30 -2.96 115.15 112.65 1c29 h HIS 86 Ca -0.33 0.00 0.27 0.00 -0.00 0.00 0.00 60.37 60.31 1c29 h HIS 86 Cb 1.23 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 28.60 1c29 h HIS 86 CO 0.38 0.00 0.67 0.87 -0.00 0.00 0.00 177.93 179.85 1c29 h LYS 87 N 0.00 0.00 -0.06 5.12 1.57 -1.94 -1.88 116.57 119.37 1c29 h LYS 87 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1c29 h LYS 87 Cb 0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1c29 h LYS 87 CO -0.00 0.00 0.04 1.15 -0.57 0.00 0.00 179.45 180.07 1c29 h THR 88 N 0.00 1.02 0.53 -0.16 2.02 -1.80 -2.93 112.91 111.58 1c29 h THR 88 Ca 0.44 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.56 1c29 h THR 88 Cb 1.78 0.93 0.01 0.00 -1.74 0.00 0.00 68.15 69.12 1c29 h THR 88 CO -0.00 0.02 -0.26 0.78 0.37 0.00 0.00 175.52 176.43 1c29 h ASN 89 N 0.08 -0.61 -0.15 4.18 2.35 -1.61 -3.08 115.58 116.74 1c29 h ASN 89 Ca 0.02 -0.05 0.03 0.00 -0.55 0.00 0.00 56.30 55.76 1c29 h ASN 89 Cb -0.01 0.16 -0.07 0.00 0.05 0.00 0.00 38.32 38.45 1c29 h ASN 89 CO -0.00 -0.31 -0.53 -0.61 -1.65 0.00 0.00 177.43 174.33 1c29 h GLN 90 N -0.90 -0.54 -0.80 0.81 -0.00 -1.57 -2.96 115.11 109.14 1c29 h GLN 90 Ca -0.07 0.04 0.07 0.00 -0.00 0.00 0.00 58.65 58.69 1c29 h GLN 90 Cb 0.61 0.12 -0.05 0.00 0.00 0.00 0.00 27.48 28.17 1c29 h GLN 90 CO 0.12 -0.36 0.52 -0.39 0.00 0.00 0.00 178.83 178.72 1c29 h VAL 91 N -0.56 1.01 -0.31 2.39 -1.51 -1.60 -1.88 116.25 113.79 1c29 h VAL 91 Ca 0.04 -0.29 -0.01 0.00 -1.23 0.00 0.00 66.70 65.22 1c29 h VAL 91 Cb 0.67 0.11 -0.01 0.00 -2.13 0.00 0.00 31.29 29.93 1c29 h VAL 91 CO -0.44 0.15 0.17 -0.07 -1.23 0.00 0.00 177.57 176.15 1c29 h LEU 92 N 0.83 0.39 -0.46 4.19 3.38 -1.42 0.65 115.31 122.87 1c29 h LEU 92 Ca 0.35 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.17 1c29 h LEU 92 Cb 0.30 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1c29 h LEU 92 CO -0.13 0.36 0.01 1.23 0.09 0.00 0.00 178.44 180.00 1c29 h GLY 93 N 0.39 0.87 1.63 0.83 0.00 -1.40 -1.90 103.07 103.50 1c29 h GLY 93 Ca 0.11 -0.63 -0.07 0.00 0.00 0.00 0.00 47.33 46.74 1c29 h GLY 93 CO -0.02 0.58 -0.14 1.46 0.00 0.00 0.00 176.54 178.43 1c29 h GLN 94 N 0.66 0.44 -0.46 4.80 4.20 -1.16 -0.37 115.11 123.22 1c29 h GLN 94 Ca 0.13 -0.13 -0.14 0.00 0.06 0.00 0.00 58.65 58.58 1c29 h GLN 94 Cb 0.49 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 1c29 h GLN 94 CO 0.02 0.58 -0.25 0.00 -0.67 0.00 0.00 178.83 178.52 1c29 h ALA 95 N 1.45 0.69 -0.14 3.87 0.00 -0.61 0.20 119.26 124.71 1c29 h ALA 95 Ca 0.08 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 1c29 h ALA 95 Cb 0.49 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1c29 h ALA 95 CO 0.03 0.67 -0.34 -0.07 0.00 0.00 0.00 179.25 179.54 1c29 h LEU 96 N 0.83 0.30 -0.32 0.00 3.38 -0.90 -2.20 115.31 116.39 1c29 h LEU 96 Ca 0.10 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1c29 h LEU 96 Cb 0.82 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1c29 h LEU 96 CO 0.07 0.63 0.02 -0.07 0.09 0.00 0.00 178.44 179.18 1c29 h LEU 97 N 0.25 0.55 -0.88 1.67 3.38 -0.67 0.11 115.31 119.72 1c29 h LEU 97 Ca 0.03 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.74 1c29 h LEU 97 Cb 0.73 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 1c29 h LEU 97 CO 0.06 0.70 0.57 0.00 0.09 0.00 0.00 178.44 179.86 1c29 h ALA 98 N 0.86 1.16 -0.51 1.53 0.00 -0.72 -1.96 119.26 119.62 1c29 h ALA 98 Ca 0.09 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1c29 h ALA 98 Cb 0.41 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1c29 h ALA 98 CO 0.01 0.42 -0.14 -0.22 0.00 0.00 0.00 179.25 179.32 1c29 h LYS 99 N 1.11 0.99 -0.29 0.00 3.64 -1.14 -1.13 116.57 119.75 1c29 h LYS 99 Ca 0.35 -0.38 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1c29 h LYS 99 Cb 0.01 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 1c29 h LYS 99 CO -0.12 1.05 0.14 -0.09 -2.27 0.00 0.00 179.45 178.17 1c29 h ARG 100 N 0.87 0.40 -0.00 1.90 2.43 -0.47 -1.90 114.38 117.61 1c29 h ARG 100 Ca 0.13 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1c29 h ARG 100 Cb 0.70 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1c29 h ARG 100 CO 0.05 0.31 -0.01 -1.33 -1.51 0.00 0.00 179.97 177.48 1c29 n MET 101 N -4.44 0.25 -0.61 0.20 2.81 -0.78 -4.89 117.12 109.65 1c29 n MET 101 Ca 0.01 -0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1c29 n MET 101 Cb 0.11 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 1c29 n MET 101 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1c29 n GLY 102 N 1.38 0.72 3.83 3.03 0.00 -0.71 -5.04 105.19 108.40 1c29 n GLY 102 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1c29 n GLY 102 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1c29 s LYS 103 N -0.39 4.15 -0.02 1.61 2.20 -0.47 -4.99 119.74 121.83 1c29 s LYS 103 Ca 0.00 0.82 0.03 0.00 -0.36 0.00 0.00 55.97 56.45 1c29 s LYS 103 Cb 0.00 -2.60 0.04 0.00 -1.51 0.00 0.00 37.83 33.77 1c29 s LYS 103 CO 0.00 0.23 0.89 -1.13 -0.36 0.00 0.00 175.35 174.98 1c29 n SER 104 N 0.06 0.47 -4.03 1.43 3.41 -1.14 -4.00 113.62 109.82 1c29 n SER 104 Ca 0.02 -1.88 -0.19 0.00 -0.26 0.00 0.00 58.87 56.55 1c29 n SER 104 Cb 0.52 -0.16 -0.15 0.00 -0.26 0.00 0.00 64.21 64.16 1c29 n SER 104 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1c29 s GLU 105 N -0.47 0.76 -0.01 4.33 2.02 -1.17 -1.37 118.70 122.78 1c29 s GLU 105 Ca 0.04 -0.35 0.06 0.00 0.02 0.00 0.00 54.97 54.74 1c29 s GLU 105 Cb 0.04 -0.73 -0.01 0.00 0.10 0.00 0.00 34.13 33.53 1c29 s GLU 105 CO 0.00 0.20 -0.19 0.42 0.02 0.00 0.00 175.26 175.72 1c29 s ILE 106 N -0.25 1.46 -0.06 -1.63 -1.09 0.18 -0.58 121.20 119.23 1c29 s ILE 106 Ca 0.03 -0.79 0.05 0.00 -2.23 0.00 0.00 60.65 57.72 1c29 s ILE 106 Cb -0.04 -1.22 -0.01 0.00 -1.58 0.00 0.00 42.46 39.62 1c29 s ILE 106 CO -0.00 0.41 -0.22 -0.63 -1.23 0.00 0.00 174.94 173.27 1c29 s ILE 107 N -0.42 1.87 -0.04 2.92 1.01 -0.03 -0.99 121.20 125.52 1c29 s ILE 107 Ca 0.07 -0.95 -0.03 0.00 0.00 0.00 0.00 60.65 59.74 1c29 s ILE 107 Cb -0.07 -1.59 0.02 0.00 0.01 0.00 0.00 42.46 40.82 1c29 s ILE 107 CO -0.01 0.52 0.10 0.00 0.00 0.00 0.00 174.94 175.56 1c29 s ALA 108 N -0.00 -0.21 -0.01 9.38 0.00 0.49 -0.42 121.76 130.99 1c29 s ALA 108 Ca -0.07 0.36 -0.11 0.00 0.00 0.00 0.00 51.96 52.15 1c29 s ALA 108 Cb -0.14 -0.23 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 1c29 s ALA 108 CO 0.04 -0.08 0.33 -2.00 0.00 0.00 0.00 175.76 174.06 1c29 s GLU 109 N 0.41 3.74 -0.09 0.00 -6.30 -1.26 -0.09 118.70 115.11 1c29 s GLU 109 Ca -0.03 0.18 -0.19 0.00 -2.50 0.00 0.00 54.97 52.43 1c29 s GLU 109 Cb -0.04 -3.15 0.04 0.00 0.00 0.00 0.00 34.13 30.98 1c29 s GLU 109 CO -0.02 0.68 0.46 -0.08 0.02 0.00 0.00 175.26 176.33 1c29 s THR 110 N -1.17 0.02 0.00 -1.70 -1.32 -1.01 -4.46 115.64 106.01 1c29 s THR 110 Ca 0.24 -0.18 0.00 0.00 -1.21 0.00 0.00 61.69 60.54 1c29 s THR 110 Cb -0.15 -0.73 0.00 0.00 -1.51 0.00 0.00 72.50 70.11 1c29 s THR 110 CO 0.13 -0.10 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 1c29 n GLY 111 N 1.79 -0.18 0.00 6.08 0.00 -1.26 -4.40 105.19 107.22 1c29 n GLY 111 Ca -0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.95 1c29 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c29 n ALA 112 N -2.19 2.06 -0.19 4.61 0.00 -1.26 -4.85 120.51 118.69 1c29 n ALA 112 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1c29 n ALA 112 Cb 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.08 1c29 n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c29 n GLY 113 N 0.79 0.73 0.22 0.00 0.00 -1.26 -4.91 105.19 100.76 1c29 n GLY 113 Ca 0.06 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 1c29 n GLY 113 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1c29 h GLN 114 N 4.05 0.78 -0.13 1.61 -0.00 -1.96 -1.55 115.11 117.90 1c29 h GLN 114 Ca 0.00 -0.65 -0.14 0.00 -0.00 0.00 0.00 58.65 57.86 1c29 h GLN 114 Cb 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.61 1c29 h GLN 114 CO 0.00 1.25 -0.52 1.25 0.00 0.00 0.00 178.83 180.81 1c29 h HIS 115 N 0.52 0.47 -0.42 3.99 2.76 -1.92 -2.34 115.15 118.22 1c29 h HIS 115 Ca -0.06 -0.16 -0.07 0.00 -2.20 0.00 0.00 60.37 57.89 1c29 h HIS 115 Cb 1.43 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 30.28 1c29 h HIS 115 CO 0.09 0.82 -0.01 0.78 -1.30 0.00 0.00 177.93 178.31 1c29 h GLY 116 N 1.24 0.80 0.96 5.26 0.00 -1.76 -0.41 103.07 109.16 1c29 h GLY 116 Ca 0.01 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 46.74 1c29 h GLY 116 CO 0.09 0.55 0.14 -2.08 0.00 0.00 0.00 176.54 175.24 1c29 h VAL 117 N 0.57 1.10 -0.06 4.60 2.07 -1.25 -0.15 116.25 123.13 1c29 h VAL 117 Ca 0.12 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.40 1c29 h VAL 117 Cb 0.50 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1c29 h VAL 117 CO 0.02 0.10 -0.06 0.00 0.02 0.00 0.00 177.57 177.65 1c29 h ALA 118 N 1.03 -0.01 -0.91 1.67 0.00 -1.30 -0.30 119.26 119.45 1c29 h ALA 118 Ca 0.09 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1c29 h ALA 118 Cb 0.04 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1c29 h ALA 118 CO -0.02 -0.54 0.59 0.77 0.00 0.00 0.00 179.25 180.06 1c29 h SER 119 N -0.08 1.00 -0.46 0.00 0.02 -0.92 -1.79 113.55 111.32 1c29 h SER 119 Ca 0.05 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 1c29 h SER 119 Cb 0.15 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 1c29 h SER 119 CO -0.11 0.70 0.15 0.00 -1.14 0.00 0.00 176.83 176.43 1c29 h ALA 120 N 1.36 0.61 -0.20 3.77 0.00 -0.52 -1.73 119.26 122.55 1c29 h ALA 120 Ca 0.35 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 1c29 h ALA 120 Cb -0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1c29 h ALA 120 CO -0.11 0.25 -0.49 1.37 0.00 0.00 0.00 179.25 180.27 1c29 h LEU 121 N 0.61 0.60 -0.52 0.00 8.10 -0.72 -1.64 115.31 121.75 1c29 h LEU 121 Ca 0.15 -0.30 -0.07 0.00 0.11 0.00 0.00 57.88 57.77 1c29 h LEU 121 Cb 0.26 -0.17 -0.02 0.00 -0.44 0.00 0.00 40.66 40.29 1c29 h LEU 121 CO -0.01 0.99 0.07 0.00 -4.11 0.00 0.00 178.44 175.39 1c29 h ALA 122 N 1.02 0.69 -0.18 0.17 0.00 -1.24 -1.72 119.26 118.00 1c29 h ALA 122 Ca 0.02 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 1c29 h ALA 122 Cb 1.02 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1c29 h ALA 122 CO 0.09 0.44 -0.46 0.77 0.00 0.00 0.00 179.25 180.09 1c29 h SER 123 N 0.74 0.50 0.00 0.00 0.02 -1.28 -1.33 113.55 112.20 1c29 h SER 123 Ca 0.15 -0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1c29 h SER 123 Cb 0.43 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1c29 h SER 123 CO 0.01 0.89 -0.00 0.00 -1.14 0.00 0.00 176.83 176.59 1c29 h ALA 124 N 1.13 -0.00 -0.90 3.77 0.00 -1.19 0.26 119.26 122.33 1c29 h ALA 124 Ca 0.02 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.81 1c29 h ALA 124 Cb 0.95 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 1c29 h ALA 124 CO 0.08 -0.34 0.59 1.25 0.00 0.00 0.00 179.25 180.84 1c29 h LEU 125 N -0.33 0.97 -3.41 0.00 5.85 -1.19 -2.88 115.31 114.31 1c29 h LEU 125 Ca -0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1c29 h LEU 125 Cb 0.33 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.13 1c29 h LEU 125 CO 0.00 0.66 0.00 0.18 -0.34 0.00 0.00 178.44 178.94 1c29 n LEU 126 N -4.44 5.09 -3.36 2.25 4.77 -0.51 -4.97 117.00 115.82 1c29 n LEU 126 Ca 0.12 -2.85 -0.23 0.00 -0.03 0.00 0.00 56.01 53.02 1c29 n LEU 126 Cb 0.11 -0.62 0.07 0.00 -2.33 0.00 0.00 43.42 40.64 1c29 n LEU 126 CO 0.35 0.68 0.17 0.61 -1.33 0.00 0.00 177.39 177.86 1c29 n GLY 127 N 0.45 -0.51 3.75 -0.72 0.00 -0.80 -5.01 105.19 102.34 1c29 n GLY 127 Ca 0.26 0.20 -0.31 0.00 0.00 0.00 0.00 46.02 46.17 1c29 n GLY 127 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c29 s LEU 128 N -6.99 3.73 -0.25 0.99 1.43 0.01 -4.99 118.68 112.61 1c29 s LEU 128 Ca 0.49 -0.04 -0.23 0.00 -1.03 0.00 0.00 54.13 53.33 1c29 s LEU 128 Cb -0.22 -2.40 -0.01 0.00 0.03 0.00 0.00 46.19 43.59 1c29 s LEU 128 CO 0.61 0.18 0.73 -0.54 0.23 0.00 0.00 176.35 177.57 1c29 s LYS 129 N -2.31 4.13 -0.16 1.70 1.02 -0.47 -4.50 119.74 119.15 1c29 s LYS 129 Ca 0.28 0.73 -0.05 0.00 0.02 0.00 0.00 55.97 56.95 1c29 s LYS 129 Cb -0.12 -3.65 -0.03 0.00 -0.52 0.00 0.00 37.83 33.51 1c29 s LYS 129 CO 0.20 -0.48 -0.01 0.00 -0.92 0.00 0.00 175.35 174.14 1c29 s ARG 131 N 0.40 3.05 -0.07 0.00 3.52 -0.16 -1.59 118.95 124.10 1c29 s ARG 131 Ca -0.02 -0.81 0.04 0.00 -0.13 0.00 0.00 55.73 54.81 1c29 s ARG 131 Cb -0.14 -2.59 0.00 0.00 -1.56 0.00 0.00 34.95 30.66 1c29 s ARG 131 CO 0.02 -0.15 -0.19 0.42 -0.81 0.00 0.00 175.30 174.59 1c29 s ILE 132 N 1.17 1.63 -0.16 4.11 1.01 0.59 -0.38 121.20 129.17 1c29 s ILE 132 Ca 0.02 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 59.81 1c29 s ILE 132 Cb -0.14 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.87 1c29 s ILE 132 CO -0.09 0.47 0.07 -0.31 0.00 0.00 0.00 174.94 175.07 1c29 s TYR 133 N 0.31 3.29 -0.03 3.97 1.51 0.88 0.40 117.35 127.68 1c29 s TYR 133 Ca -0.13 0.16 -0.01 0.00 -1.01 0.00 0.00 57.07 56.09 1c29 s TYR 133 Cb -0.15 -2.02 0.03 0.00 -0.11 0.00 0.00 41.96 39.71 1c29 s TYR 133 CO 0.05 0.28 0.06 1.41 -1.11 0.00 0.00 175.55 176.25 1c29 s MET 134 N 0.00 -0.03 0.16 -0.62 1.75 -0.43 -2.41 119.30 117.72 1c29 s MET 134 Ca 0.06 0.28 -0.34 0.00 -1.25 0.00 0.00 55.69 54.44 1c29 s MET 134 Cb -0.12 -0.30 -0.14 0.00 2.84 0.00 0.00 34.83 37.10 1c29 s MET 134 CO 0.01 -0.21 1.50 0.41 -0.65 0.00 0.00 175.02 176.07 1c29 n GLY 135 N 4.51 0.92 0.38 2.11 0.00 -1.26 0.10 105.19 111.95 1c29 n GLY 135 Ca -0.21 0.64 0.24 0.00 0.00 0.00 0.00 46.02 46.69 1c29 n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c29 h ALA 136 N 5.34 2.12 -0.01 4.61 0.00 -1.05 0.54 119.26 130.81 1c29 h ALA 136 Ca -0.45 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.51 1c29 h ALA 136 Cb 1.27 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1c29 h ALA 136 CO 0.84 -0.64 -0.34 -0.22 0.00 0.00 0.00 179.25 178.90 1c29 h LYS 137 N 0.37 0.02 0.02 0.00 3.64 -1.58 -1.70 116.57 117.33 1c29 h LYS 137 Ca 0.69 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 59.83 1c29 h LYS 137 Cb 1.65 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.45 1c29 h LYS 137 CO -0.46 0.36 -1.11 -0.44 -2.27 0.00 0.00 179.45 175.53 1c29 h ASP 138 N 0.02 0.07 -0.40 4.20 3.45 -0.08 -2.75 116.42 120.92 1c29 h ASP 138 Ca -0.00 -0.08 -0.10 0.00 0.43 0.00 0.00 57.03 57.28 1c29 h ASP 138 Cb 0.61 -0.02 -0.02 0.00 -0.56 0.00 0.00 39.33 39.34 1c29 h ASP 138 CO 0.04 1.06 -0.12 0.58 -1.57 0.00 0.00 179.24 179.24 1c29 h VAL 139 N 0.01 1.26 -0.08 -1.35 2.07 -0.72 0.43 116.25 117.88 1c29 h VAL 139 Ca -0.06 -1.22 -0.15 0.00 0.82 0.00 0.00 66.70 66.09 1c29 h VAL 139 Cb 1.83 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.62 1c29 h VAL 139 CO 0.14 0.42 -0.61 -0.08 0.02 0.00 0.00 177.57 177.46 1c29 h GLU 140 N 0.77 0.27 0.00 1.57 4.22 -1.40 -3.25 114.58 116.76 1c29 h GLU 140 Ca 0.12 -0.18 -0.19 0.00 0.08 0.00 0.00 59.36 59.18 1c29 h GLU 140 Cb 0.64 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 1c29 h GLU 140 CO 0.04 0.79 -1.12 -0.09 -2.18 0.00 0.00 179.01 176.45 1c29 h ARG 141 N 0.20 0.00 -2.06 1.92 2.43 -1.21 -3.39 114.38 112.27 1c29 h ARG 141 Ca -0.01 0.00 -0.61 0.00 -0.81 0.00 0.00 59.98 58.56 1c29 h ARG 141 Cb 1.12 0.00 -0.41 0.00 -0.42 0.00 0.00 29.97 30.26 1c29 h ARG 141 CO 0.10 0.62 -0.52 0.94 -1.51 0.00 0.00 179.97 179.60 1c29 n GLN 142 N -3.16 3.42 -0.12 0.20 -0.06 0.15 -4.91 117.38 112.90 1c29 n GLN 142 Ca -0.05 -4.72 -0.05 0.00 -2.00 0.00 0.00 57.00 50.18 1c29 n GLN 142 Cb 0.90 -2.26 0.03 0.00 -4.06 0.00 0.00 30.24 24.85 1c29 n GLN 142 CO 0.00 0.00 0.00 0.77 -0.20 0.00 0.00 177.06 177.63 1c29 h SER 143 N 2.94 0.12 -0.78 1.69 0.02 -1.77 -2.22 113.55 113.55 1c29 h SER 143 Ca 0.22 0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 61.19 1c29 h SER 143 Cb 0.60 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.14 1c29 h SER 143 CO 0.87 0.11 0.39 -0.65 -1.14 0.00 0.00 176.83 176.40 1c29 h PRO 144 N 0.29 1.13 -0.20 3.45 0.11 -1.94 -1.98 132.00 132.86 1c29 h PRO 144 Ca 0.19 -0.15 -0.15 0.00 0.11 0.00 0.00 66.00 66.00 1c29 h PRO 144 Cb 0.19 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 1c29 h PRO 144 CO -0.21 0.86 -0.49 -0.91 -0.21 0.00 0.00 178.00 177.04 1c29 h ASN 145 N 1.12 0.57 -0.49 -2.05 2.35 -1.87 -2.09 115.58 113.13 1c29 h ASN 145 Ca 0.27 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1c29 h ASN 145 Cb 0.10 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1c29 h ASN 145 CO -0.04 0.97 0.23 0.58 -1.65 0.00 0.00 177.43 177.53 1c29 h VAL 146 N 0.42 1.19 -0.17 2.81 2.07 -1.12 -0.73 116.25 120.71 1c29 h VAL 146 Ca 0.02 -0.54 -0.11 0.00 0.82 0.00 0.00 66.70 66.89 1c29 h VAL 146 Cb 1.01 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1c29 h VAL 146 CO 0.09 0.21 -0.37 0.15 0.02 0.00 0.00 177.57 177.67 1c29 h PHE 147 N 0.64 0.43 -0.07 1.57 3.04 -1.30 -1.36 116.94 119.89 1c29 h PHE 147 Ca 0.17 -0.11 -0.01 0.00 3.98 0.00 0.00 57.97 62.00 1c29 h PHE 147 Cb 0.12 -0.10 -0.00 0.00 2.56 0.00 0.00 35.95 38.53 1c29 h PHE 147 CO -0.01 0.70 0.01 0.00 -2.02 0.00 0.00 178.31 176.99 1c29 h ARG 148 N 0.32 0.11 -0.32 1.11 3.08 -1.02 0.16 114.38 117.82 1c29 h ARG 148 Ca 0.03 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.10 1c29 h ARG 148 Cb 0.80 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.79 1c29 h ARG 148 CO 0.06 0.32 0.07 0.52 -1.07 0.00 0.00 179.97 179.88 1c29 h MET 149 N -0.11 0.18 -0.18 0.04 2.86 -0.97 -1.52 114.93 115.22 1c29 h MET 149 Ca 0.02 -0.01 -0.10 0.00 -2.06 0.00 0.00 59.70 57.55 1c29 h MET 149 Cb 0.26 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 1c29 h MET 149 CO 0.00 0.12 -0.32 0.00 1.06 0.00 0.00 176.91 177.77 1c29 h ARG 150 N 0.19 0.35 0.00 1.72 3.08 -1.11 -1.91 114.38 116.70 1c29 h ARG 150 Ca 0.15 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1c29 h ARG 150 Cb 0.16 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1c29 h ARG 150 CO -0.19 0.64 -0.05 1.25 -1.07 0.00 0.00 179.97 180.54 1c29 h LEU 151 N 0.31 0.00 -3.61 3.04 5.85 -0.36 -2.61 115.31 117.93 1c29 h LEU 151 Ca 0.04 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1c29 h LEU 151 Cb 0.72 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 1c29 h LEU 151 CO 0.05 0.05 0.06 0.23 -0.34 0.00 0.00 178.44 178.49 1c29 n MET 152 N -3.15 4.69 0.00 1.25 2.81 -0.63 -4.92 117.12 117.17 1c29 n MET 152 Ca 0.01 -3.16 0.00 0.00 -1.81 0.00 0.00 57.70 52.74 1c29 n MET 152 Cb 0.38 -2.27 0.00 0.00 -0.71 0.00 0.00 33.22 30.62 1c29 n MET 152 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1c29 n GLY 153 N 0.46 2.46 3.77 3.03 0.00 -0.98 -4.56 105.19 109.37 1c29 n GLY 153 Ca 0.31 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.96 1c29 n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c29 s ALA 154 N -2.31 2.98 -0.26 4.61 0.00 -0.77 -4.81 121.76 121.19 1c29 s ALA 154 Ca 0.00 0.92 -0.22 0.00 0.00 0.00 0.00 51.96 52.66 1c29 s ALA 154 Cb 0.00 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 1c29 s ALA 154 CO 0.00 -0.63 0.70 -2.00 0.00 0.00 0.00 175.76 173.83 1c29 s GLU 155 N -2.69 4.10 -0.21 0.00 2.12 -0.62 -4.10 118.70 117.31 1c29 s GLU 155 Ca 0.63 0.65 -0.09 0.00 0.36 0.00 0.00 54.97 56.52 1c29 s GLU 155 Cb -0.28 -3.66 -0.04 0.00 0.26 0.00 0.00 34.13 30.40 1c29 s GLU 155 CO 0.34 -0.48 0.10 0.08 -0.54 0.00 0.00 175.26 174.77 1c29 s VAL 156 N 2.65 5.00 -0.23 3.70 1.01 -1.26 -0.30 120.40 130.97 1c29 s VAL 156 Ca 0.29 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.33 1c29 s VAL 156 Cb -0.15 -3.29 0.06 0.00 0.00 0.00 0.00 36.38 32.99 1c29 s VAL 156 CO 0.09 0.41 -0.07 -0.63 0.00 0.00 0.00 175.10 174.89 1c29 s ILE 157 N 0.73 1.64 0.19 2.22 1.01 0.16 -4.97 121.20 122.18 1c29 s ILE 157 Ca 0.05 -1.24 -0.31 0.00 0.00 0.00 0.00 60.65 59.16 1c29 s ILE 157 Cb -0.13 -1.85 -0.09 0.00 0.01 0.00 0.00 42.46 40.40 1c29 s ILE 157 CO 0.02 -0.04 1.43 -2.84 0.00 0.00 0.00 174.94 173.51 1c29 s PRO 158 N 1.35 4.29 -0.35 2.79 0.02 -1.25 -1.32 135.00 140.54 1c29 s PRO 158 Ca -0.05 2.21 -0.09 0.00 0.02 0.00 0.00 61.00 63.09 1c29 s PRO 158 Cb -0.19 -3.17 0.02 0.00 0.02 0.00 0.00 34.50 31.19 1c29 s PRO 158 CO -0.06 -0.43 0.16 0.08 -0.33 0.00 0.00 177.00 176.41 1c29 s VAL 159 N 0.52 4.33 -1.70 3.83 1.01 0.12 -4.78 120.40 123.72 1c29 s VAL 159 Ca 0.62 -0.82 0.25 0.00 0.00 0.00 0.00 61.98 62.03 1c29 s VAL 159 Cb -0.40 -3.36 0.12 0.00 0.00 0.00 0.00 36.38 32.73 1c29 s VAL 159 CO 0.37 -0.13 1.35 1.41 0.00 0.00 0.00 175.10 178.10 1c29 n HIS 160 N 4.94 0.00 -1.97 5.22 8.25 -1.26 -1.20 115.22 129.20 1c29 n HIS 160 Ca -0.13 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.01 1c29 n HIS 160 Cb 0.47 -0.09 0.02 0.00 1.12 0.00 0.00 29.99 31.50 1c29 n HIS 160 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1c29 s SER 161 N -2.59 5.75 1.88 0.41 1.04 -1.26 -4.48 113.70 114.45 1c29 s SER 161 Ca 0.20 1.76 0.00 0.00 0.48 0.00 0.00 55.95 58.39 1c29 s SER 161 Cb 0.18 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.78 1c29 s SER 161 CO 0.58 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 174.22 1c29 n GLY 162 N -1.22 3.49 0.89 7.32 0.00 -1.26 -1.37 105.19 113.04 1c29 n GLY 162 Ca 0.08 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.10 1c29 n GLY 162 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1c29 n SER 163 N 6.38 2.60 -3.96 1.61 3.41 -1.26 -4.95 113.62 117.45 1c29 n SER 163 Ca 0.00 -1.95 -0.28 0.00 -0.26 0.00 0.00 58.87 56.38 1c29 n SER 163 Cb 0.00 -0.29 -0.01 0.00 -0.26 0.00 0.00 64.21 63.66 1c29 n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c29 n ALA 164 N 0.92 -1.76 -3.02 7.33 0.00 -0.47 -4.81 120.51 118.70 1c29 n ALA 164 Ca 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1c29 n ALA 164 Cb 0.43 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.48 1c29 n ALA 164 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1c29 n THR 165 N -4.42 0.00 -0.24 0.00 -2.24 -1.26 -1.62 114.28 104.49 1c29 n THR 165 Ca -0.18 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.49 1c29 n THR 165 Cb 0.62 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.78 1c29 n THR 165 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1c29 h LEU 166 N 0.00 -1.82 -0.81 3.22 6.46 -1.90 -1.69 115.31 118.76 1c29 h LEU 166 Ca 0.00 0.27 0.12 0.00 -0.12 0.00 0.00 57.88 58.15 1c29 h LEU 166 Cb 0.00 0.79 -0.13 0.00 -0.73 0.00 0.00 40.66 40.59 1c29 h LEU 166 CO 0.00 -0.34 -0.33 1.17 -0.62 0.00 0.00 178.44 178.33 1c29 n LYS 167 N -5.36 -0.20 0.13 1.25 4.81 -1.26 -0.86 118.16 116.67 1c29 n LYS 167 Ca -0.00 1.25 -0.02 0.00 -0.87 0.00 0.00 58.31 58.67 1c29 n LYS 167 Cb 0.33 -1.86 0.18 0.00 0.02 0.00 0.00 35.03 33.70 1c29 n LYS 167 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1c29 h ASP 168 N 0.00 0.06 -0.34 3.14 3.32 -1.68 -2.52 116.42 118.41 1c29 h ASP 168 Ca 0.27 -0.04 -0.11 0.00 0.02 0.00 0.00 57.03 57.18 1c29 h ASP 168 Cb 0.48 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1c29 h ASP 168 CO -0.81 0.64 -0.22 0.00 -1.72 0.00 0.00 179.24 177.12 1c29 h ALA 169 N 1.37 0.49 -0.43 3.45 0.00 -0.13 -2.20 119.26 121.80 1c29 h ALA 169 Ca -0.01 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.54 1c29 h ALA 169 Cb 1.05 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1c29 h ALA 169 CO 0.08 0.46 0.26 0.00 0.00 0.00 0.00 179.25 180.05 1c29 h ASN 171 N 0.53 -1.15 -1.00 0.00 -0.26 -1.30 -2.42 115.58 109.98 1c29 h ASN 171 Ca 0.17 0.12 0.17 0.00 -0.56 0.00 0.00 56.30 56.20 1c29 h ASN 171 Cb -0.01 0.41 -0.10 0.00 -1.06 0.00 0.00 38.32 37.57 1c29 h ASN 171 CO -0.07 -0.51 0.62 -0.08 -1.06 0.00 0.00 177.43 176.33 1c29 h GLU 172 N -0.72 0.78 -0.61 0.81 4.57 -1.20 -0.96 114.58 117.25 1c29 h GLU 172 Ca -0.00 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 58.07 1c29 h GLU 172 Cb 0.70 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.09 1c29 h GLU 172 CO -0.16 0.51 0.13 0.00 -1.18 0.00 0.00 179.01 178.32 1c29 h ALA 173 N 1.62 0.80 0.00 2.92 0.00 -1.04 0.36 119.26 123.92 1c29 h ALA 173 Ca 0.55 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 1c29 h ALA 173 Cb 0.81 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1c29 h ALA 173 CO -0.33 0.53 -0.58 -0.07 0.00 0.00 0.00 179.25 178.79 1c29 h LEU 174 N 0.90 0.00 0.18 0.00 3.38 -0.89 0.10 115.31 118.99 1c29 h LEU 174 Ca 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 1c29 h LEU 174 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1c29 h LEU 174 CO 0.00 0.58 -0.09 0.03 0.09 0.00 0.00 178.44 179.06 1c29 h ARG 175 N 0.00 -0.24 0.02 1.13 3.08 -0.94 -1.14 114.38 116.29 1c29 h ARG 175 Ca -0.01 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.09 1c29 h ARG 175 Cb 1.05 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.11 1c29 h ARG 175 CO 0.08 0.13 -0.25 0.22 -1.07 0.00 0.00 179.97 179.07 1c29 h ASP 176 N -0.66 -0.74 -0.55 7.04 1.82 -0.85 -1.95 116.42 120.53 1c29 h ASP 176 Ca -0.03 0.10 0.12 0.00 -0.39 0.00 0.00 57.03 56.84 1c29 h ASP 176 Cb 0.48 0.30 -0.03 0.00 0.68 0.00 0.00 39.33 40.76 1c29 h ASP 176 CO 0.04 -0.32 0.38 -0.25 -1.61 0.00 0.00 179.24 177.48 1c29 h TRP 177 N -0.40 0.23 0.00 0.28 7.01 -0.93 -1.72 115.95 120.41 1c29 h TRP 177 Ca 0.06 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.06 1c29 h TRP 177 Cb 0.48 -0.07 0.00 0.00 -2.10 0.00 0.00 29.16 27.46 1c29 h TRP 177 CO -0.28 0.10 0.00 -1.13 -2.79 0.00 0.00 178.44 174.34 1c29 n SER 178 N -4.44 0.48 0.00 2.65 3.41 -0.44 -1.34 113.62 113.94 1c29 n SER 178 Ca 0.10 0.70 0.00 0.00 -0.26 0.00 0.00 58.87 59.41 1c29 n SER 178 Cb 0.48 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 1c29 n SER 178 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c29 n GLY 179 N -1.09 -0.20 0.00 5.00 0.00 -0.68 -4.81 105.19 103.41 1c29 n GLY 179 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1c29 n GLY 179 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1c29 n SER 180 N -0.07 0.36 -0.12 1.61 3.41 -0.95 -4.82 113.62 113.04 1c29 n SER 180 Ca 0.00 -0.68 0.27 0.00 -0.26 0.00 0.00 58.87 58.20 1c29 n SER 180 Cb 0.23 0.35 0.63 0.00 -0.26 0.00 0.00 64.21 65.16 1c29 n SER 180 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1c29 h TYR 181 N 0.00 0.00 0.00 7.33 -0.00 -1.39 -0.75 116.97 122.16 1c29 h TYR 181 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 58.73 58.67 1c29 h TYR 181 Cb 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.80 1c29 h TYR 181 CO 0.00 0.00 -0.27 0.93 -0.00 0.00 0.00 178.16 178.82 1c29 h GLU 182 N 0.00 0.00 0.00 0.10 5.08 -1.87 -3.31 114.58 114.57 1c29 h GLU 182 Ca 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 1c29 h GLU 182 Cb 2.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.34 1c29 h GLU 182 CO -0.00 0.27 -0.28 0.25 -1.00 0.00 0.00 179.01 178.25 1c29 n THR 183 N -3.79 0.00 -4.67 1.13 -2.24 -0.46 -4.94 114.28 99.31 1c29 n THR 183 Ca -0.01 -0.27 -0.28 0.00 -2.27 0.00 0.00 64.05 61.21 1c29 n THR 183 Cb 0.37 0.80 -0.14 0.00 -2.10 0.00 0.00 70.33 69.26 1c29 n THR 183 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c29 s ALA 184 N -1.09 2.14 -0.06 6.98 0.00 -0.41 -2.90 121.76 126.42 1c29 s ALA 184 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.69 1c29 s ALA 184 Cb 0.00 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.68 1c29 s ALA 184 CO 0.00 0.49 -0.03 -1.58 0.00 0.00 0.00 175.76 174.64 1c29 s HIS 185 N -0.90 3.04 -0.50 0.00 2.46 0.26 -4.24 115.29 115.41 1c29 s HIS 185 Ca 0.11 0.09 -0.20 0.00 0.47 0.00 0.00 55.06 55.53 1c29 s HIS 185 Cb -0.10 -1.72 0.05 0.00 -0.13 0.00 0.00 32.58 30.68 1c29 s HIS 185 CO 0.03 0.41 0.68 -0.47 -2.47 0.00 0.00 174.74 172.92 1c29 s TYR 186 N -0.90 3.01 -1.16 3.88 5.04 -1.26 -0.85 117.35 125.11 1c29 s TYR 186 Ca 0.14 -0.35 -0.17 0.00 -2.44 0.00 0.00 57.07 54.25 1c29 s TYR 186 Cb -0.11 -3.57 0.12 0.00 0.35 0.00 0.00 41.96 38.74 1c29 s TYR 186 CO 0.04 -1.05 1.48 1.41 -1.34 0.00 0.00 175.55 176.09 1c29 s MET 187 N 2.88 3.91 0.35 4.97 -2.45 0.44 -4.95 119.30 124.46 1c29 s MET 187 Ca 0.19 -2.08 -0.29 0.00 -1.25 0.00 0.00 55.69 52.27 1c29 s MET 187 Cb -0.17 -5.22 -0.11 0.00 1.25 0.00 0.00 34.83 30.58 1c29 s MET 187 CO 0.15 -1.98 1.48 -1.17 1.05 0.00 0.00 175.02 174.55 1c29 s LEU 188 N 3.01 4.34 0.00 4.11 0.20 -1.26 -4.41 118.68 124.68 1c29 s LEU 188 Ca 0.45 2.96 0.30 0.00 0.69 0.00 0.00 54.13 58.54 1c29 s LEU 188 Cb -0.01 -3.66 1.58 0.00 -0.43 0.00 0.00 46.19 43.67 1c29 s LEU 188 CO -0.00 -0.82 2.05 0.61 -0.29 0.00 0.00 176.35 177.89 1c29 n GLY 189 N 0.88 -0.78 3.67 7.98 0.00 -1.26 -4.97 105.19 110.70 1c29 n GLY 189 Ca 0.02 -0.26 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 1c29 n GLY 189 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1c29 s THR 190 N -2.12 0.00 -1.45 2.61 -1.32 -1.26 -4.95 115.64 107.16 1c29 s THR 190 Ca 0.41 -1.26 -0.08 0.00 -1.21 0.00 0.00 61.69 59.55 1c29 s THR 190 Cb 0.21 -2.83 0.04 0.00 -1.51 0.00 0.00 72.50 68.41 1c29 s THR 190 CO 0.39 0.00 2.58 0.00 -2.21 0.00 0.00 174.62 175.38 1c29 n ALA 191 N -0.56 6.99 -3.74 11.08 0.00 -1.26 -4.74 120.51 128.28 1c29 n ALA 191 Ca -0.04 -3.87 -0.08 0.00 0.00 0.00 0.00 53.44 49.44 1c29 n ALA 191 Cb 0.61 -3.05 -0.01 0.00 0.00 0.00 0.00 19.45 16.99 1c29 n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c29 n ALA 192 N 2.73 -0.51 0.00 0.00 0.00 -1.26 -4.08 120.51 117.38 1c29 n ALA 192 Ca 0.67 -1.16 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1c29 n ALA 192 Cb 0.25 0.93 0.00 0.00 0.00 0.00 0.00 19.45 20.63 1c29 n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c29 n GLY 193 N -0.43 -1.80 3.81 0.00 0.00 -1.26 -4.17 105.19 101.34 1c29 n GLY 193 Ca -0.01 -1.87 -0.33 0.00 0.00 0.00 0.00 46.02 43.80 1c29 n GLY 193 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1c29 s PRO 194 N 0.00 4.06 0.59 1.61 0.04 -1.19 -4.55 135.00 135.56 1c29 s PRO 194 Ca 0.00 1.23 -0.20 0.00 0.04 0.00 0.00 61.00 62.07 1c29 s PRO 194 Cb 0.00 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1c29 s PRO 194 CO 0.00 -0.19 1.15 1.58 0.04 0.00 0.00 177.00 179.58 1c29 n HIS 195 N -0.75 1.50 1.65 0.56 -0.00 -0.94 -1.40 115.22 115.84 1c29 n HIS 195 Ca 0.08 0.44 0.10 0.00 -0.00 0.00 0.00 57.72 58.33 1c29 n HIS 195 Cb 0.53 -2.23 0.46 0.00 -0.00 0.00 0.00 29.99 28.75 1c29 n HIS 195 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1c29 n PRO 196 N -1.17 1.33 -0.18 1.57 -0.04 -1.26 -4.90 135.00 130.34 1c29 n PRO 196 Ca 0.13 -0.49 -0.01 0.00 -0.04 0.00 0.00 63.50 63.09 1c29 n PRO 196 Cb 0.46 -1.33 0.08 0.00 -0.04 0.00 0.00 33.50 32.67 1c29 n PRO 196 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1c29 h TYR 197 N 1.00 -0.08 -0.26 0.54 0.05 -1.55 -1.35 116.97 115.30 1c29 h TYR 197 Ca 0.00 0.04 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 1c29 h TYR 197 Cb 0.22 0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.07 1c29 h TYR 197 CO 0.05 -0.16 0.07 -1.35 -1.05 0.00 0.00 178.16 175.72 1c29 h PRO 198 N 0.09 0.37 -0.08 4.88 0.11 -1.74 -0.86 132.00 134.77 1c29 h PRO 198 Ca 0.29 -0.05 -0.21 0.00 0.11 0.00 0.00 66.00 66.14 1c29 h PRO 198 Cb 0.45 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.50 1c29 h PRO 198 CO -0.50 0.34 -0.82 1.15 -0.21 0.00 0.00 178.00 177.96 1c29 h THR 199 N 0.37 1.34 0.02 -1.15 2.02 -1.81 -2.98 112.91 110.72 1c29 h THR 199 Ca 0.09 -2.15 -0.00 0.00 0.77 0.00 0.00 66.41 65.12 1c29 h THR 199 Cb 0.13 2.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1c29 h THR 199 CO -0.01 0.66 -0.01 0.40 0.37 0.00 0.00 175.52 176.93 1c29 h ILE 200 N 0.37 1.41 -0.95 3.11 2.04 -0.88 -2.11 117.51 120.49 1c29 h ILE 200 Ca -0.06 -1.42 0.04 0.00 1.00 0.00 0.00 64.86 64.43 1c29 h ILE 200 Cb 1.43 2.35 -0.06 0.00 -0.74 0.00 0.00 36.82 39.80 1c29 h ILE 200 CO 0.15 0.36 0.62 0.58 0.00 0.00 0.00 178.15 179.86 1c29 h VAL 201 N -0.65 1.13 0.43 1.67 2.07 -1.29 0.59 116.25 120.19 1c29 h VAL 201 Ca -0.00 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1c29 h VAL 201 Cb 0.61 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1c29 h VAL 201 CO 0.01 0.21 -0.21 -0.09 0.02 0.00 0.00 177.57 177.51 1c29 h ARG 202 N 1.17 -0.56 -0.25 1.57 2.43 -1.57 -1.08 114.38 116.10 1c29 h ARG 202 Ca 0.39 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.61 1c29 h ARG 202 Cb 0.06 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1c29 h ARG 202 CO -0.14 -0.33 0.17 0.93 -1.51 0.00 0.00 179.97 179.09 1c29 h GLU 203 N -0.65 0.30 -0.07 0.20 4.39 -1.08 0.85 114.58 118.52 1c29 h GLU 203 Ca -0.06 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1c29 h GLU 203 Cb 0.48 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1c29 h GLU 203 CO 0.10 0.20 0.00 1.19 -1.16 0.00 0.00 179.01 179.33 1c29 n PHE 204 N -4.50 0.08 -0.00 4.33 0.99 0.17 -3.49 117.46 115.04 1c29 n PHE 204 Ca 0.01 -0.04 0.00 0.00 -0.00 0.00 0.00 57.45 57.42 1c29 n PHE 204 Cb 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.58 1c29 n PHE 204 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.76 177.70 1c29 n GLN 205 N -0.02 2.76 -0.10 -1.08 -0.06 0.08 -3.49 117.38 115.46 1c29 n GLN 205 Ca 0.18 -0.26 0.22 0.00 -2.00 0.00 0.00 57.00 55.14 1c29 n GLN 205 Cb 0.28 -0.76 0.66 0.00 -4.06 0.00 0.00 30.24 26.36 1c29 n GLN 205 CO 0.00 0.00 0.00 -0.09 -0.20 0.00 0.00 177.06 176.77 1c29 h ARG 206 N 0.00 0.09 -0.70 3.69 2.43 -1.00 -2.86 114.38 116.03 1c29 h ARG 206 Ca 0.00 -0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.30 1c29 h ARG 206 Cb 0.00 -0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 29.40 1c29 h ARG 206 CO 0.00 0.06 -0.20 0.52 -1.51 0.00 0.00 179.97 178.84 1c29 h MET 207 N 0.09 -0.02 -0.47 0.20 2.86 -1.83 -0.73 114.93 115.03 1c29 h MET 207 Ca 0.34 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 58.03 1c29 h MET 207 Cb 1.24 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.83 1c29 h MET 207 CO -0.03 -0.01 -0.43 0.82 1.06 0.00 0.00 176.91 178.32 1c29 h ILE 208 N -0.02 0.00 -0.08 -1.22 2.04 -1.68 0.47 117.51 117.03 1c29 h ILE 208 Ca 0.33 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 66.06 1c29 h ILE 208 Cb 0.53 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1c29 h ILE 208 CO -0.73 0.00 -0.56 1.23 0.00 0.00 0.00 178.15 178.09 1c29 h GLY 209 N -0.19 0.25 1.22 5.37 0.00 -0.89 -1.11 103.07 107.72 1c29 h GLY 209 Ca 0.08 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 1c29 h GLY 209 CO -0.54 0.26 0.06 0.83 0.00 0.00 0.00 176.54 177.15 1c29 h GLU 210 N 0.18 0.96 -0.01 4.80 5.08 -0.65 -1.55 114.58 123.38 1c29 h GLU 210 Ca 0.00 -0.25 -0.24 0.00 -1.00 0.00 0.00 59.36 57.87 1c29 h GLU 210 Cb 1.03 -0.11 0.02 0.00 0.50 0.00 0.00 28.75 30.19 1c29 h GLU 210 CO 0.09 0.91 -0.92 0.93 -1.00 0.00 0.00 179.01 179.01 1c29 h GLU 211 N 0.90 0.63 -0.49 2.33 5.08 -0.01 -3.18 114.58 119.85 1c29 h GLU 211 Ca 0.18 -0.67 0.02 0.00 -1.00 0.00 0.00 59.36 57.88 1c29 h GLU 211 Cb 0.44 0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 1c29 h GLU 211 CO 0.02 1.27 0.32 1.15 -1.00 0.00 0.00 179.01 180.77 1c29 h THR 212 N 0.27 1.09 0.74 1.13 2.02 -1.01 -1.36 112.91 115.79 1c29 h THR 212 Ca -0.11 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 1c29 h THR 212 Cb 1.59 0.43 0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1c29 h THR 212 CO 0.18 0.11 -0.36 0.50 0.37 0.00 0.00 175.52 176.33 1c29 h LYS 213 N 0.61 -0.96 -0.86 6.66 3.64 -1.27 -0.83 116.57 123.56 1c29 h LYS 213 Ca 0.19 0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.68 1c29 h LYS 213 Cb 0.00 0.22 -0.05 0.00 -0.41 0.00 0.00 32.23 31.99 1c29 h LYS 213 CO -0.04 -0.62 0.57 0.00 -2.27 0.00 0.00 179.45 177.08 1c29 h ALA 214 N -1.11 1.50 -0.20 5.00 0.00 -1.52 -0.63 119.26 122.31 1c29 h ALA 214 Ca -0.10 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1c29 h ALA 214 Cb 0.78 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1c29 h ALA 214 CO 0.17 0.39 0.02 1.96 0.00 0.00 0.00 179.25 181.78 1c29 h GLN 215 N 1.03 0.34 -0.01 0.00 4.20 -1.23 -1.09 115.11 118.35 1c29 h GLN 215 Ca 0.36 -0.10 -0.15 0.00 0.06 0.00 0.00 58.65 58.81 1c29 h GLN 215 Cb 0.11 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 1c29 h GLN 215 CO -0.12 0.52 -0.72 0.97 -0.67 0.00 0.00 178.83 178.81 1c29 h ILE 216 N 0.11 1.49 -0.09 2.54 6.09 -0.91 -1.20 117.51 125.55 1c29 h ILE 216 Ca 0.06 -2.40 -0.09 0.00 -1.37 0.00 0.00 64.86 61.06 1c29 h ILE 216 Cb 0.35 2.29 -0.01 0.00 0.47 0.00 0.00 36.82 39.93 1c29 h ILE 216 CO 0.01 0.69 -0.35 -0.07 -3.07 0.00 0.00 178.15 175.36 1c29 h LEU 217 N 0.03 0.17 0.18 2.19 4.07 -1.00 0.29 115.31 121.24 1c29 h LEU 217 Ca -0.01 -0.06 -0.30 0.00 0.08 0.00 0.00 57.88 57.59 1c29 h LEU 217 Cb 1.27 -0.05 0.03 0.00 1.08 0.00 0.00 40.66 42.99 1c29 h LEU 217 CO 0.10 0.52 -1.26 -0.78 -1.08 0.00 0.00 178.44 175.93 1c29 h ASP 218 N 0.15 0.81 1.16 -0.43 3.58 -0.95 -0.93 116.42 119.81 1c29 h ASP 218 Ca 0.02 -0.88 -0.15 0.00 0.42 0.00 0.00 57.03 56.44 1c29 h ASP 218 Cb 0.69 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.46 1c29 h ASP 218 CO 0.05 1.61 -0.87 0.50 -2.88 0.00 0.00 179.24 177.65 1c29 h LYS 219 N 0.12 0.00 0.00 0.28 1.63 -1.03 -3.39 116.57 114.18 1c29 h LYS 219 Ca -0.21 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.59 1c29 h LYS 219 Cb 1.96 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.59 1c29 h LYS 219 CO 0.24 0.54 -0.06 -1.91 -3.45 0.00 0.00 179.45 174.81 1c29 n GLU 220 N -3.16 2.92 -3.05 1.90 4.07 0.10 -5.03 120.64 118.39 1c29 n GLU 220 Ca -0.02 0.00 -0.23 0.00 -0.06 0.00 0.00 57.16 56.85 1c29 n GLU 220 Cb 0.81 -0.27 0.04 0.00 -0.06 0.00 0.00 31.44 31.96 1c29 n GLU 220 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1c29 n GLY 221 N 0.49 -0.53 3.54 8.31 0.00 -0.35 -4.96 105.19 111.69 1c29 n GLY 221 Ca 0.00 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 1c29 n GLY 221 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1c29 s ARG 222 N -5.73 0.81 0.57 1.61 3.52 -1.26 -5.00 118.95 113.47 1c29 s ARG 222 Ca 0.32 0.14 -0.14 0.00 -0.13 0.00 0.00 55.73 55.91 1c29 s ARG 222 Cb -0.14 0.38 -0.06 0.00 -1.56 0.00 0.00 34.95 33.57 1c29 s ARG 222 CO 0.39 -0.27 1.01 -0.51 -0.81 0.00 0.00 175.30 175.12 1c29 s LEU 223 N -1.30 3.45 0.78 -0.88 1.43 -1.26 -4.20 118.68 116.71 1c29 s LEU 223 Ca -0.05 1.53 -0.11 0.00 -1.03 0.00 0.00 54.13 54.48 1c29 s LEU 223 Cb -0.00 -4.50 0.06 0.00 0.03 0.00 0.00 46.19 41.78 1c29 s LEU 223 CO 0.04 -0.77 1.10 -2.16 0.23 0.00 0.00 176.35 174.79 1c29 s PRO 224 N -4.52 2.17 0.22 1.29 0.04 -1.26 -4.93 135.00 128.01 1c29 s PRO 224 Ca 0.58 1.20 0.07 0.00 0.04 0.00 0.00 61.00 62.89 1c29 s PRO 224 Cb -0.11 -1.89 0.19 0.00 0.04 0.00 0.00 34.50 32.73 1c29 s PRO 224 CO 0.41 -1.71 1.51 -0.44 0.04 0.00 0.00 177.00 176.81 1c29 h ASP 225 N -1.16 0.10 -4.87 6.66 3.32 -0.87 -3.40 116.42 116.20 1c29 h ASP 225 Ca -0.44 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.53 1c29 h ASP 225 Cb 1.23 -0.03 -0.17 0.00 0.22 0.00 0.00 39.33 40.59 1c29 h ASP 225 CO 0.51 0.78 0.26 0.00 -1.72 0.00 0.00 179.24 179.07 1c29 s ALA 226 N -3.43 -1.74 -0.07 3.45 0.00 -1.21 -0.80 121.76 117.96 1c29 s ALA 226 Ca -0.02 1.05 0.04 0.00 0.00 0.00 0.00 51.96 53.04 1c29 s ALA 226 Cb 0.12 0.25 -0.00 0.00 0.00 0.00 0.00 23.12 23.49 1c29 s ALA 226 CO 0.79 -0.52 -0.20 0.14 0.00 0.00 0.00 175.76 175.97 1c29 s VAL 227 N -2.19 1.67 -0.01 0.00 -7.23 0.23 -2.52 120.40 110.36 1c29 s VAL 227 Ca -0.05 -0.82 0.08 0.00 -1.81 0.00 0.00 61.98 59.38 1c29 s VAL 227 Cb -0.00 -1.45 -0.02 0.00 0.56 0.00 0.00 36.38 35.46 1c29 s VAL 227 CO -0.00 0.47 -0.25 -0.63 -0.31 0.00 0.00 175.10 174.39 1c29 s ILE 228 N 0.23 2.20 -0.10 -0.62 1.09 -0.06 -0.58 121.20 123.36 1c29 s ILE 228 Ca -0.11 -1.13 -0.23 0.00 -1.10 0.00 0.00 60.65 58.09 1c29 s ILE 228 Cb -0.15 -1.80 0.05 0.00 -1.06 0.00 0.00 42.46 39.51 1c29 s ILE 228 CO 0.05 0.53 0.55 0.00 -0.10 0.00 0.00 174.94 175.97 1c29 s ALA 229 N -0.67 -1.40 0.61 9.38 0.00 -0.39 -1.00 121.76 128.29 1c29 s ALA 229 Ca 0.11 1.17 -0.14 0.00 0.00 0.00 0.00 51.96 53.09 1c29 s ALA 229 Cb -0.10 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.68 1c29 s ALA 229 CO -0.00 -0.31 1.04 0.00 0.00 0.00 0.00 175.76 176.50 1c29 s VAL 231 N -2.68 0.81 -0.20 0.00 1.01 0.24 -4.11 120.40 115.47 1c29 s VAL 231 Ca 0.61 -1.37 -0.15 0.00 0.00 0.00 0.00 61.98 61.07 1c29 s VAL 231 Cb -0.14 -1.62 -0.09 0.00 0.00 0.00 0.00 36.38 34.53 1c29 s VAL 231 CO 0.42 -0.69 -0.23 0.61 0.00 0.00 0.00 175.10 175.21 1c29 n GLY 232 N 4.86 -0.66 0.02 4.51 0.00 -1.26 -4.50 105.19 108.17 1c29 n GLY 232 Ca -0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 1c29 n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c29 n GLY 233 N 1.44 -0.15 0.00 -0.02 0.00 -1.26 -4.25 105.19 100.95 1c29 n GLY 233 Ca -0.25 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1c29 n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c29 n GLY 234 N 2.96 1.11 0.36 -0.02 0.00 -1.26 -1.23 105.19 107.10 1c29 n GLY 234 Ca -0.08 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.77 1c29 n GLY 234 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1c29 h SER 235 N 0.00 -0.73 -0.57 1.61 4.64 -1.90 -1.38 113.55 115.21 1c29 h SER 235 Ca 0.00 0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1c29 h SER 235 Cb 0.00 0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 1c29 h SER 235 CO 0.00 -0.48 0.28 -0.55 -0.87 0.00 0.00 176.83 175.20 1c29 h ASN 236 N -0.92 0.78 0.16 4.97 -1.07 -1.96 -1.36 115.58 116.18 1c29 h ASN 236 Ca -0.09 -0.08 -0.01 0.00 0.07 0.00 0.00 56.30 56.19 1c29 h ASN 236 Cb 0.68 -0.20 0.00 0.00 -2.07 0.00 0.00 38.32 36.73 1c29 h ASN 236 CO 0.14 0.67 -0.07 0.00 0.07 0.00 0.00 177.43 178.24 1c29 h ALA 237 N 1.45 -0.21 -0.23 4.14 0.00 -1.70 -2.56 119.26 120.16 1c29 h ALA 237 Ca 0.21 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1c29 h ALA 237 Cb 0.11 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1c29 h ALA 237 CO -0.03 -0.44 -0.08 0.97 0.00 0.00 0.00 179.25 179.68 1c29 h ILE 238 N -0.57 1.19 -0.60 0.00 6.09 -1.22 0.91 117.51 123.31 1c29 h ILE 238 Ca -0.02 -0.79 -0.00 0.00 -1.37 0.00 0.00 64.86 62.68 1c29 h ILE 238 Cb 0.43 1.10 -0.03 0.00 0.47 0.00 0.00 36.82 38.80 1c29 h ILE 238 CO 0.03 0.26 0.37 1.23 -3.07 0.00 0.00 178.15 176.97 1c29 h GLY 239 N 0.78 0.85 0.21 8.18 0.00 -1.16 0.17 103.07 112.10 1c29 h GLY 239 Ca 0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 1c29 h GLY 239 CO 0.02 0.33 -0.05 1.98 0.00 0.00 0.00 176.54 178.82 1c29 h MET 240 N 0.82 -0.13 -0.20 4.80 1.85 -0.95 -1.46 114.93 119.66 1c29 h MET 240 Ca 0.22 0.01 0.05 0.00 -0.61 0.00 0.00 59.70 59.36 1c29 h MET 240 Cb -0.05 0.03 -0.05 0.00 0.43 0.00 0.00 31.60 31.96 1c29 h MET 240 CO -0.04 0.32 -0.10 0.74 -0.40 0.00 0.00 176.91 177.42 1c29 h PHE 241 N -0.93 -0.24 -0.22 1.39 -1.00 -0.65 -3.35 116.94 111.93 1c29 h PHE 241 Ca -0.01 0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.81 1c29 h PHE 241 Cb 0.51 0.14 -0.03 0.00 3.61 0.00 0.00 35.95 40.18 1c29 h PHE 241 CO 0.10 -0.16 -0.13 0.00 -1.61 0.00 0.00 178.31 176.52 1c29 n ALA 242 N -2.52 -0.14 0.56 2.45 0.00 0.57 0.06 120.51 121.48 1c29 n ALA 242 Ca -0.02 0.19 0.10 0.00 0.00 0.00 0.00 53.44 53.71 1c29 n ALA 242 Cb 0.18 -0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.05 1c29 n ALA 242 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1c29 n ASP 243 N -3.91 0.28 -0.00 0.00 2.03 -1.26 -3.01 116.55 110.68 1c29 n ASP 243 Ca 0.00 0.56 0.10 0.00 0.52 0.00 0.00 54.79 55.97 1c29 n ASP 243 Cb 0.06 -0.62 -0.12 0.00 -0.72 0.00 0.00 41.12 39.72 1c29 n ASP 243 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1c29 n PHE 244 N -1.79 0.00 -0.27 -0.67 3.72 0.11 -4.58 117.46 113.98 1c29 n PHE 244 Ca 0.04 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.51 1c29 n PHE 244 Cb 0.24 -0.00 0.22 0.00 -0.94 0.00 0.00 39.48 38.99 1c29 n PHE 244 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1c29 h ILE 245 N 0.00 0.59 0.00 4.37 2.04 -1.38 0.31 117.51 123.44 1c29 h ILE 245 Ca 0.00 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1c29 h ILE 245 Cb 0.49 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1c29 h ILE 245 CO 0.00 0.07 0.00 0.59 0.00 0.00 0.00 178.15 178.81 1c29 n ASN 246 N -5.04 0.00 -4.37 1.72 3.02 -1.26 -4.36 115.26 104.97 1c29 n ASN 246 Ca 0.16 -0.19 -0.46 0.00 -0.03 0.00 0.00 54.58 54.07 1c29 n ASN 246 Cb 0.48 -0.27 -0.03 0.00 -0.61 0.00 0.00 39.78 39.36 1c29 n ASN 246 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1c29 s ASP 247 N -2.54 6.62 0.64 6.41 1.11 0.10 -4.91 116.67 124.09 1c29 s ASP 247 Ca 0.30 -2.28 0.41 0.00 0.18 0.00 0.00 52.55 51.16 1c29 s ASP 247 Cb 0.20 -2.28 2.17 0.00 1.07 0.00 0.00 42.92 44.08 1c29 s ASP 247 CO 0.45 -0.82 2.28 0.71 1.18 0.00 0.00 175.17 178.98 1c29 h THR 248 N 5.32 0.05 0.00 -1.27 1.35 -1.78 -2.62 112.91 113.95 1c29 h THR 248 Ca 0.05 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 1c29 h THR 248 Cb 1.04 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1c29 h THR 248 CO 0.92 0.00 0.00 0.77 -0.25 0.00 0.00 175.52 176.97 1c29 h SER 249 N 0.00 0.00 -3.45 5.36 4.64 -1.91 -3.43 113.55 114.76 1c29 h SER 249 Ca -0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 1c29 h SER 249 Cb 0.12 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.10 1c29 h SER 249 CO 0.00 0.00 0.09 -0.69 -0.87 0.00 0.00 176.83 175.36 1c29 s VAL 250 N -3.29 5.03 0.23 0.95 1.01 -0.99 -4.80 120.40 118.53 1c29 s VAL 250 Ca 0.06 1.12 -0.24 0.00 0.00 0.00 0.00 61.98 62.92 1c29 s VAL 250 Cb 0.07 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 1c29 s VAL 250 CO 0.62 0.10 0.82 -0.83 0.00 0.00 0.00 175.10 175.81 1c29 s GLY 251 N 1.27 2.82 -0.20 4.51 0.00 0.02 -4.93 107.32 110.81 1c29 s GLY 251 Ca 0.27 0.36 -0.03 0.00 0.00 0.00 0.00 44.72 45.32 1c29 s GLY 251 CO 0.10 0.82 -0.05 1.08 0.00 0.00 0.00 173.10 175.04 1c29 s LEU 252 N -1.62 2.92 -0.25 0.66 1.43 -1.26 -0.60 118.68 119.96 1c29 s LEU 252 Ca 0.42 -0.35 0.02 0.00 -1.03 0.00 0.00 54.13 53.19 1c29 s LEU 252 Cb -0.20 -1.73 0.06 0.00 0.03 0.00 0.00 46.19 44.35 1c29 s LEU 252 CO 0.25 0.03 -0.11 -0.63 0.23 0.00 0.00 176.35 176.12 1c29 s ILE 253 N 1.18 2.02 -0.11 -0.59 -1.09 0.26 -1.19 121.20 121.68 1c29 s ILE 253 Ca 0.02 -1.48 -0.15 0.00 -2.23 0.00 0.00 60.65 56.81 1c29 s ILE 253 Cb -0.14 -2.13 -0.05 0.00 -1.58 0.00 0.00 42.46 38.55 1c29 s ILE 253 CO -0.01 0.01 0.36 -0.83 -1.23 0.00 0.00 174.94 173.24 1c29 s GLY 254 N 1.18 2.31 -0.22 6.18 0.00 -0.10 -1.27 107.32 115.41 1c29 s GLY 254 Ca -0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 44.72 44.30 1c29 s GLY 254 CO -0.06 0.40 -0.11 0.14 0.00 0.00 0.00 173.10 173.46 1c29 s VAL 255 N 0.05 2.58 0.13 1.40 1.01 -0.09 -1.43 120.40 124.05 1c29 s VAL 255 Ca 0.20 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 61.16 1c29 s VAL 255 Cb -0.14 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.95 1c29 s VAL 255 CO 0.08 0.33 0.35 -1.61 0.00 0.00 0.00 175.10 174.25 1c29 s GLU 256 N 1.31 3.59 0.18 2.72 2.02 0.07 -0.59 118.70 128.00 1c29 s GLU 256 Ca 0.02 -0.14 -0.30 0.00 0.02 0.00 0.00 54.97 54.57 1c29 s GLU 256 Cb -0.15 -2.88 -0.08 0.00 0.10 0.00 0.00 34.13 31.11 1c29 s GLU 256 CO -0.07 0.49 1.27 -1.25 0.02 0.00 0.00 175.26 175.72 1c29 s PRO 257 N -2.61 4.42 0.00 0.39 0.04 -1.25 -1.66 135.00 134.34 1c29 s PRO 257 Ca 0.40 1.97 0.22 0.00 0.04 0.00 0.00 61.00 63.63 1c29 s PRO 257 Cb -0.12 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.15 1c29 s PRO 257 CO 0.25 -0.21 1.06 0.41 0.04 0.00 0.00 177.00 178.55 1c29 n GLY 258 N 2.45 -0.17 7.00 0.56 0.00 0.13 -1.80 105.19 113.36 1c29 n GLY 258 Ca 0.06 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1c29 n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c29 n GLY 259 N 1.44 3.67 0.14 -0.02 0.00 -1.26 -0.40 105.19 108.76 1c29 n GLY 259 Ca 0.08 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.31 1c29 n GLY 259 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1c29 n HIS 260 N 14.00 0.00 0.00 1.61 8.25 -0.83 -0.66 115.22 137.59 1c29 n HIS 260 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1c29 n HIS 260 Cb 0.00 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 30.92 1c29 n HIS 260 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1c29 n GLY 261 N 1.36 4.77 0.09 -1.41 0.00 0.47 -4.85 105.19 105.62 1c29 n GLY 261 Ca 0.11 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.00 1c29 n GLY 261 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1c29 h ILE 262 N 0.12 0.85 -0.70 -0.61 1.08 -1.89 -1.87 117.51 114.48 1c29 h ILE 262 Ca 0.00 -0.00 0.20 0.00 -0.39 0.00 0.00 64.86 64.67 1c29 h ILE 262 Cb 0.00 0.84 -0.03 0.00 -3.07 0.00 0.00 36.82 34.56 1c29 h ILE 262 CO 0.00 0.00 0.84 -0.08 -0.69 0.00 0.00 178.15 178.22 1c29 h GLU 263 N 0.00 0.00 0.00 2.37 4.22 -1.93 0.78 114.58 120.02 1c29 h GLU 263 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.52 1c29 h GLU 263 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1c29 h GLU 263 CO -0.16 0.00 -0.70 0.25 -2.18 0.00 0.00 179.01 176.22 1c29 n THR 264 N -3.43 0.31 -0.59 0.32 -2.24 -0.70 -4.94 114.28 103.01 1c29 n THR 264 Ca 0.15 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1c29 n THR 264 Cb 1.08 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 1c29 n THR 264 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c29 n GLY 265 N 1.35 1.77 3.04 3.38 0.00 0.27 -4.92 105.19 110.08 1c29 n GLY 265 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1c29 n GLY 265 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1c29 n GLU 266 N -2.00 4.11 -2.86 1.61 4.07 -1.26 -4.96 120.64 119.36 1c29 n GLU 266 Ca 0.00 -4.28 -0.08 0.00 -0.06 0.00 0.00 57.16 52.74 1c29 n GLU 266 Cb 0.00 -2.64 -0.03 0.00 -0.06 0.00 0.00 31.44 28.72 1c29 n GLU 266 CO 0.00 0.00 0.00 -2.39 -0.06 0.00 0.00 177.13 174.68 1c29 n HIS 267 N 2.29 -0.45 -2.70 4.31 1.44 -1.26 -1.97 115.22 116.88 1c29 n HIS 267 Ca 0.29 -1.14 -0.11 0.00 -2.01 0.00 0.00 57.72 54.75 1c29 n HIS 267 Cb 0.35 0.15 0.02 0.00 0.12 0.00 0.00 29.99 30.63 1c29 n HIS 267 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1c29 n GLY 268 N -0.26 1.97 2.48 -1.39 0.00 -0.75 -0.52 105.19 106.72 1c29 n GLY 268 Ca 0.03 -1.41 -0.27 0.00 0.00 0.00 0.00 46.02 44.36 1c29 n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c29 n ALA 269 N -0.05 3.94 0.03 4.61 0.00 -1.21 -3.77 120.51 124.06 1c29 n ALA 269 Ca 0.12 -4.70 -0.13 0.00 0.00 0.00 0.00 53.44 48.74 1c29 n ALA 269 Cb 0.79 -0.91 -0.01 0.00 0.00 0.00 0.00 19.45 19.32 1c29 n ALA 269 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1c29 h PRO 270 N 4.33 0.54 -0.27 0.00 0.13 -1.89 0.15 132.00 135.00 1c29 h PRO 270 Ca 0.19 -0.45 0.04 0.00 -0.87 0.00 0.00 66.00 64.92 1c29 h PRO 270 Cb 0.68 0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 1c29 h PRO 270 CO 0.81 1.07 0.18 1.25 -0.23 0.00 0.00 178.00 181.09 1c29 h LEU 271 N 0.36 0.16 0.00 1.56 6.46 -1.91 0.53 115.31 122.47 1c29 h LEU 271 Ca -0.04 -0.00 -0.16 0.00 -0.12 0.00 0.00 57.88 57.55 1c29 h LEU 271 Cb 1.36 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 41.22 1c29 h LEU 271 CO 0.14 0.11 -1.64 0.29 -0.62 0.00 0.00 178.44 176.72 1c29 n LYS 272 N -4.49 2.38 -0.60 1.25 4.01 -1.22 -4.68 118.16 114.82 1c29 n LYS 272 Ca 0.02 -0.01 0.05 0.00 -0.51 0.00 0.00 58.31 57.87 1c29 n LYS 272 Cb 0.21 -1.24 0.10 0.00 -0.51 0.00 0.00 35.03 33.59 1c29 n LYS 272 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 1c29 n HIS 273 N -2.33 0.00 -2.65 2.13 8.25 0.53 -5.05 115.22 116.11 1c29 n HIS 273 Ca -0.15 -0.76 0.00 0.00 -0.26 0.00 0.00 57.72 56.55 1c29 n HIS 273 Cb 0.78 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.74 1c29 n HIS 273 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1c29 n GLY 274 N -0.60 5.64 2.85 -1.41 0.00 0.19 -4.77 105.19 107.09 1c29 n GLY 274 Ca 0.11 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 43.96 1c29 n GLY 274 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1c29 s ARG 275 N 1.67 -0.00 0.25 1.61 3.52 -0.76 -4.79 118.95 120.45 1c29 s ARG 275 Ca 0.00 0.07 -0.31 0.00 -0.13 0.00 0.00 55.73 55.36 1c29 s ARG 275 Cb 0.00 -0.07 -0.12 0.00 -1.56 0.00 0.00 34.95 33.20 1c29 s ARG 275 CO 0.00 -0.05 1.63 0.28 -0.81 0.00 0.00 175.30 176.35 1c29 n VAL 276 N 3.41 0.56 -3.92 7.11 0.31 -1.26 -0.51 118.33 124.02 1c29 n VAL 276 Ca -0.17 -0.14 -0.12 0.00 -0.01 0.00 0.00 64.34 63.91 1c29 n VAL 276 Cb 0.57 -1.92 -0.02 0.00 -0.91 0.00 0.00 33.84 31.57 1c29 n VAL 276 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1c29 n GLY 277 N 2.93 1.98 3.01 2.92 0.00 -0.31 -4.88 105.19 110.85 1c29 n GLY 277 Ca 0.12 -1.50 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 1c29 n GLY 277 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c29 s ILE 278 N -2.65 1.88 0.04 -0.61 1.01 -1.26 -1.52 121.20 118.10 1c29 s ILE 278 Ca 0.23 -1.48 -0.27 0.00 0.00 0.00 0.00 60.65 59.12 1c29 s ILE 278 Cb -0.02 -2.08 0.08 0.00 0.01 0.00 0.00 42.46 40.45 1c29 s ILE 278 CO 0.16 -0.09 0.71 -0.47 0.00 0.00 0.00 174.94 175.25 1c29 s TYR 279 N 1.23 -0.53 -1.38 3.97 5.04 0.48 -4.93 117.35 121.22 1c29 s TYR 279 Ca -0.07 0.59 -0.09 0.00 -2.44 0.00 0.00 57.07 55.07 1c29 s TYR 279 Cb -0.19 0.50 0.02 0.00 0.35 0.00 0.00 41.96 42.64 1c29 s TYR 279 CO -0.06 -0.68 1.13 0.34 -1.34 0.00 0.00 175.55 174.94 1c29 n PHE 280 N 0.15 -2.72 -1.86 4.97 7.35 -1.26 -1.81 117.46 122.28 1c29 n PHE 280 Ca -0.16 0.99 -0.14 0.00 -0.76 0.00 0.00 57.45 57.38 1c29 n PHE 280 Cb 0.61 -4.85 -0.03 0.00 0.35 0.00 0.00 39.48 35.56 1c29 n PHE 280 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1c29 n GLY 281 N -1.88 0.57 3.11 7.13 0.00 -1.15 -3.53 105.19 109.44 1c29 n GLY 281 Ca -0.01 -0.34 -0.12 0.00 0.00 0.00 0.00 46.02 45.55 1c29 n GLY 281 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1c29 s MET 282 N -3.98 0.45 -0.32 1.61 0.00 -0.75 -2.34 119.30 113.98 1c29 s MET 282 Ca 0.00 -0.27 -0.08 0.00 0.00 0.00 0.00 55.69 55.34 1c29 s MET 282 Cb 0.00 0.19 0.02 0.00 0.00 0.00 0.00 34.83 35.04 1c29 s MET 282 CO 0.00 -0.11 0.12 0.21 0.00 0.00 0.00 175.02 175.24 1c29 s LYS 283 N -1.13 3.00 0.15 4.11 2.20 -0.02 -0.39 119.74 127.66 1c29 s LYS 283 Ca -0.12 -0.93 -0.25 0.00 -0.36 0.00 0.00 55.97 54.31 1c29 s LYS 283 Cb -0.06 -3.47 0.07 0.00 -1.51 0.00 0.00 37.83 32.85 1c29 s LYS 283 CO 0.02 -0.52 0.99 0.00 -0.36 0.00 0.00 175.35 175.47 1c29 s ALA 284 N 1.51 -1.67 0.47 3.13 0.00 -0.57 -1.65 121.76 122.97 1c29 s ALA 284 Ca 0.02 0.09 -0.25 0.00 0.00 0.00 0.00 51.96 51.83 1c29 s ALA 284 Cb -0.18 0.64 -0.08 0.00 0.00 0.00 0.00 23.12 23.50 1c29 s ALA 284 CO 0.04 -1.05 1.42 -2.14 0.00 0.00 0.00 175.76 174.03 1c29 s PRO 285 N -3.10 3.58 0.05 0.00 0.02 -1.26 -1.16 135.00 133.13 1c29 s PRO 285 Ca 0.13 2.39 -0.13 0.00 0.02 0.00 0.00 61.00 63.42 1c29 s PRO 285 Cb -0.01 -2.58 0.02 0.00 0.02 0.00 0.00 34.50 31.94 1c29 s PRO 285 CO 0.02 -0.89 0.28 -1.64 -0.33 0.00 0.00 177.00 174.44 1c29 s MET 286 N -2.53 0.79 -0.52 5.54 -1.94 0.33 -3.87 119.30 117.10 1c29 s MET 286 Ca 0.63 -0.55 -0.28 0.00 -1.71 0.00 0.00 55.69 53.77 1c29 s MET 286 Cb -0.43 0.34 0.03 0.00 2.01 0.00 0.00 34.83 36.78 1c29 s MET 286 CO 0.55 -0.25 1.13 -1.64 -0.01 0.00 0.00 175.02 174.79 1c29 s MET 287 N -2.64 3.60 0.04 2.03 -1.94 -0.50 -1.83 119.30 118.07 1c29 s MET 287 Ca -0.04 0.36 -0.01 0.00 -1.71 0.00 0.00 55.69 54.29 1c29 s MET 287 Cb -0.01 -3.96 -0.03 0.00 2.01 0.00 0.00 34.83 32.84 1c29 s MET 287 CO -0.04 -1.49 -0.03 -1.14 -0.01 0.00 0.00 175.02 172.31 1c29 s GLN 288 N 4.55 0.54 0.81 2.03 0.74 -1.26 -0.86 119.66 126.20 1c29 s GLN 288 Ca 0.44 -1.06 -0.05 0.00 0.05 0.00 0.00 55.36 54.74 1c29 s GLN 288 Cb -0.08 0.16 0.16 0.00 1.10 0.00 0.00 33.01 34.36 1c29 s GLN 288 CO 0.28 -0.09 1.11 0.95 -0.55 0.00 0.00 175.29 176.99 1c29 s THR 289 N -3.25 2.03 -0.29 -0.34 -4.23 -0.12 -4.83 115.64 104.61 1c29 s THR 289 Ca 0.01 -0.45 0.27 0.00 -1.18 0.00 0.00 61.69 60.34 1c29 s THR 289 Cb 0.03 -2.57 0.30 0.00 1.34 0.00 0.00 72.50 71.59 1c29 s THR 289 CO -0.07 0.00 1.80 0.00 -0.54 0.00 0.00 174.62 175.81 1c29 h ALA 290 N -0.90 1.00 -0.01 3.99 0.00 -2.02 -2.22 119.26 119.10 1c29 h ALA 290 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1c29 h ALA 290 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1c29 h ALA 290 CO 0.36 0.00 -0.30 -0.25 0.00 0.00 0.00 179.25 179.06 1c29 n ASP 291 N -2.51 1.50 -0.24 0.00 8.00 -1.26 -4.95 116.55 117.08 1c29 n ASP 291 Ca 0.02 -1.21 -0.00 0.00 0.71 0.00 0.00 54.79 54.31 1c29 n ASP 291 Cb 0.25 0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 1c29 n ASP 291 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1c29 n GLY 292 N 1.36 0.57 3.79 0.44 0.00 -0.83 -5.03 105.19 105.49 1c29 n GLY 292 Ca 0.12 -0.79 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 1c29 n GLY 292 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1c29 s GLN 293 N -4.40 3.89 0.13 1.61 -1.52 -1.26 -4.86 119.66 113.25 1c29 s GLN 293 Ca 0.00 -0.15 -0.31 0.00 -1.95 0.00 0.00 55.36 52.96 1c29 s GLN 293 Cb -0.00 -3.32 -0.08 0.00 -0.22 0.00 0.00 33.01 29.38 1c29 s GLN 293 CO 0.01 0.50 1.38 0.42 -0.25 0.00 0.00 175.29 177.34 1c29 s ILE 294 N -0.22 3.28 0.46 1.08 -1.09 -1.26 -0.94 121.20 122.51 1c29 s ILE 294 Ca 0.12 0.94 0.07 0.00 -2.23 0.00 0.00 60.65 59.55 1c29 s ILE 294 Cb -0.12 -3.60 0.01 0.00 -1.58 0.00 0.00 42.46 37.17 1c29 s ILE 294 CO 0.01 0.08 0.44 -0.70 -1.23 0.00 0.00 174.94 173.54 1c29 s GLU 295 N 0.90 2.45 0.25 2.79 2.12 -0.04 -4.90 118.70 122.27 1c29 s GLU 295 Ca 0.63 -1.65 -0.05 0.00 0.36 0.00 0.00 54.97 54.26 1c29 s GLU 295 Cb -0.37 -2.35 -0.05 0.00 0.26 0.00 0.00 34.13 31.62 1c29 s GLU 295 CO 0.32 -0.37 0.51 -2.00 -0.54 0.00 0.00 175.26 173.17 1c29 s GLU 296 N -4.23 3.63 -0.21 4.30 2.12 -1.26 -4.73 118.70 118.32 1c29 s GLU 296 Ca 0.47 -0.04 -0.09 0.00 0.36 0.00 0.00 54.97 55.67 1c29 s GLU 296 Cb -0.03 -2.70 -0.05 0.00 0.26 0.00 0.00 34.13 31.61 1c29 s GLU 296 CO 0.28 0.28 0.12 -1.12 -0.54 0.00 0.00 175.26 174.27 1c29 s SER 297 N -3.02 5.98 -0.01 -1.70 0.01 -1.26 -4.94 113.70 108.75 1c29 s SER 297 Ca 0.43 0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.83 1c29 s SER 297 Cb -0.11 -2.05 -0.04 0.00 0.21 0.00 0.00 66.02 64.03 1c29 s SER 297 CO 0.28 0.14 0.05 -0.47 0.41 0.00 0.00 173.24 173.65 1c29 s TYR 298 N 0.58 3.21 -0.18 2.43 6.14 0.32 -4.68 117.35 125.17 1c29 s TYR 298 Ca 0.06 0.17 -0.30 0.00 0.64 0.00 0.00 57.07 57.64 1c29 s TYR 298 Cb -0.12 -1.72 0.14 0.00 0.42 0.00 0.00 41.96 40.68 1c29 s TYR 298 CO 0.00 0.52 1.07 0.45 0.64 0.00 0.00 175.55 178.23 1c29 s SER 299 N -1.59 -0.30 0.50 4.32 0.15 -1.26 -2.19 113.70 113.33 1c29 s SER 299 Ca 0.21 0.33 0.21 0.00 0.70 0.00 0.00 55.95 57.40 1c29 s SER 299 Cb -0.12 0.25 1.32 0.00 -1.71 0.00 0.00 66.02 65.76 1c29 s SER 299 CO 0.11 -0.28 2.08 -0.29 1.20 0.00 0.00 173.24 176.06 1c29 h ILE 300 N 2.45 0.83 -3.70 6.45 2.10 -1.94 -3.39 117.51 120.31 1c29 h ILE 300 Ca -0.16 -0.43 -0.64 0.00 1.08 0.00 0.00 64.86 64.71 1c29 h ILE 300 Cb 1.17 1.25 -0.15 0.00 -1.09 0.00 0.00 36.82 38.00 1c29 h ILE 300 CO 0.29 0.11 -0.23 -0.94 -1.08 0.00 0.00 178.15 176.30 1c29 s SER 301 N -6.58 6.24 0.36 2.19 1.04 -1.26 -4.97 113.70 110.71 1c29 s SER 301 Ca -0.04 0.14 0.07 0.00 0.48 0.00 0.00 55.95 56.60 1c29 s SER 301 Cb 0.15 -2.21 0.77 0.00 0.10 0.00 0.00 66.02 64.83 1c29 s SER 301 CO 0.63 -0.24 1.92 0.00 0.98 0.00 0.00 173.24 176.53 1c29 h ALA 302 N 8.27 1.76 0.00 5.32 0.00 -1.98 -2.57 119.26 130.05 1c29 h ALA 302 Ca -0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1c29 h ALA 302 Cb 1.16 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1c29 h ALA 302 CO 0.66 0.07 0.00 0.41 0.00 0.00 0.00 179.25 180.40 1c29 n GLY 303 N -1.44 -1.23 2.17 0.00 0.00 -1.26 -2.69 105.19 100.73 1c29 n GLY 303 Ca 0.13 0.11 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 1c29 n GLY 303 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1c29 n LEU 304 N -2.27 6.78 -1.58 0.99 4.77 -0.97 -4.61 117.00 120.10 1c29 n LEU 304 Ca 0.02 -3.84 -0.13 0.00 -0.03 0.00 0.00 56.01 52.02 1c29 n LEU 304 Cb 0.21 -0.85 0.18 0.00 -2.33 0.00 0.00 43.42 40.62 1c29 n LEU 304 CO 0.19 1.21 0.88 0.47 -1.33 0.00 0.00 177.39 178.80 1c29 n ASP 305 N -1.07 3.27 -4.65 -1.43 10.43 -1.10 -4.79 116.55 117.20 1c29 n ASP 305 Ca 0.58 -3.75 -0.43 0.00 2.57 0.00 0.00 54.79 53.77 1c29 n ASP 305 Cb 1.32 -0.70 -0.02 0.00 1.84 0.00 0.00 41.12 43.56 1c29 n ASP 305 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 1c29 s PHE 306 N -3.33 3.30 -1.13 1.24 2.19 -1.26 -4.38 117.98 114.61 1c29 s PHE 306 Ca 0.50 1.36 0.00 0.00 0.33 0.00 0.00 56.93 59.12 1c29 s PHE 306 Cb 0.43 -3.30 0.00 0.00 -1.31 0.00 0.00 43.02 38.84 1c29 s PHE 306 CO 0.03 -0.52 0.55 -0.35 1.83 0.00 0.00 175.22 176.76 1c29 n PRO 307 N 6.36 0.00 0.00 10.12 -0.04 -1.26 -4.68 135.00 145.49 1c29 n PRO 307 Ca 0.11 0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 1c29 n PRO 307 Cb 0.46 -1.56 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 1c29 n PRO 307 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1c29 n SER 308 N -1.05 0.00 -3.85 3.54 2.88 -1.26 -1.41 113.62 112.48 1c29 n SER 308 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 1c29 n SER 308 Cb 0.06 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.47 1c29 n SER 308 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1c29 s VAL 309 N -0.05 0.04 0.48 2.46 0.11 -1.25 -4.66 120.40 117.52 1c29 s VAL 309 Ca 0.00 -1.07 -0.22 0.00 -2.93 0.00 0.00 61.98 57.76 1c29 s VAL 309 Cb 0.00 -1.73 -0.07 0.00 -1.53 0.00 0.00 36.38 33.05 1c29 s VAL 309 CO 0.00 -0.18 1.17 -0.83 -3.33 0.00 0.00 175.10 171.93 1c29 s GLY 310 N -2.92 2.77 0.27 6.54 0.00 -0.36 -4.77 107.32 108.84 1c29 s GLY 310 Ca 0.13 0.94 -0.02 0.00 0.00 0.00 0.00 44.72 45.77 1c29 s GLY 310 CO -0.01 1.39 1.80 -0.56 0.00 0.00 0.00 173.10 175.72 1c29 h PRO 311 N 1.89 0.87 -0.56 2.90 0.13 -1.89 -2.77 132.00 132.57 1c29 h PRO 311 Ca -0.50 -0.19 -0.04 0.00 -0.87 0.00 0.00 66.00 64.40 1c29 h PRO 311 Cb 1.25 -0.13 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 1c29 h PRO 311 CO 0.59 0.79 0.17 0.37 -0.23 0.00 0.00 178.00 179.70 1c29 h GLN 312 N 0.84 0.84 -0.44 0.86 4.15 -1.89 -1.31 115.11 118.16 1c29 h GLN 312 Ca 0.18 -0.16 -0.05 0.00 0.77 0.00 0.00 58.65 59.39 1c29 h GLN 312 Cb 0.32 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.86 1c29 h GLN 312 CO 0.00 0.73 0.07 0.45 -1.93 0.00 0.00 178.83 178.16 1c29 h HIS 313 N 0.82 0.78 0.00 3.99 3.86 -1.88 0.45 115.15 123.17 1c29 h HIS 313 Ca 0.19 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.26 1c29 h HIS 313 Cb 0.24 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 28.50 1c29 h HIS 313 CO 0.02 0.74 -0.13 0.00 0.86 0.00 0.00 177.93 179.41 1c29 h ALA 314 N 0.95 1.50 0.16 2.45 0.00 -1.24 -0.50 119.26 122.58 1c29 h ALA 314 Ca 0.13 -0.12 -0.27 0.00 0.00 0.00 0.00 54.91 54.66 1c29 h ALA 314 Cb 0.38 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1c29 h ALA 314 CO 0.01 0.16 -1.26 -0.92 0.00 0.00 0.00 179.25 177.24 1c29 h TYR 315 N 0.00 0.60 -0.16 0.00 3.20 -0.62 -2.67 116.97 117.32 1c29 h TYR 315 Ca -0.00 -0.44 -0.04 0.00 3.14 0.00 0.00 58.73 61.39 1c29 h TYR 315 Cb 0.28 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 1c29 h TYR 315 CO 0.00 1.49 -0.08 -0.07 -1.64 0.00 0.00 178.16 177.85 1c29 h LEU 316 N -0.20 0.22 -0.34 2.82 3.38 0.20 -1.93 115.31 119.45 1c29 h LEU 316 Ca -0.25 -0.04 -0.18 0.00 0.09 0.00 0.00 57.88 57.50 1c29 h LEU 316 Cb 1.83 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.52 1c29 h LEU 316 CO 0.14 0.34 -0.57 -1.13 0.09 0.00 0.00 178.44 177.31 1c29 h ASN 317 N 0.23 0.88 -0.75 -0.43 -1.24 -1.18 -0.20 115.58 112.89 1c29 h ASN 317 Ca 0.05 -0.48 -0.02 0.00 0.71 0.00 0.00 56.30 56.56 1c29 h ASN 317 Cb 0.30 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.06 1c29 h ASN 317 CO 0.02 1.26 0.39 -1.28 -1.29 0.00 0.00 177.43 176.53 1c29 h SER 318 N 0.60 0.94 0.29 1.15 0.87 -0.99 -2.68 113.55 113.73 1c29 h SER 318 Ca 0.01 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1c29 h SER 318 Cb 1.16 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 1c29 h SER 318 CO 0.12 0.78 -0.30 2.30 -0.53 0.00 0.00 176.83 179.21 1c29 n ILE 319 N -4.44 0.00 -0.53 2.23 -5.35 -0.97 -4.95 119.36 105.35 1c29 n ILE 319 Ca 0.07 -0.10 0.00 0.00 -0.27 0.00 0.00 62.75 62.44 1c29 n ILE 319 Cb 0.10 0.36 0.00 0.00 -1.74 0.00 0.00 39.64 38.36 1c29 n ILE 319 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1c29 n GLY 320 N 1.37 0.75 0.34 3.28 0.00 -1.00 -4.95 105.19 104.98 1c29 n GLY 320 Ca 0.11 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 1c29 n GLY 320 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1c29 h ARG 321 N 3.36 1.17 -5.67 1.61 9.65 -1.32 -3.44 114.38 119.74 1c29 h ARG 321 Ca 0.00 -0.17 -0.47 0.00 -1.10 0.00 0.00 59.98 58.25 1c29 h ARG 321 Cb 0.00 -0.21 -0.20 0.00 -1.39 0.00 0.00 29.97 28.17 1c29 h ARG 321 CO 0.00 0.89 -0.79 0.00 2.80 0.00 0.00 179.97 182.88 1c29 s ALA 322 N -5.73 1.55 -0.07 2.80 0.00 -0.93 -4.33 121.76 115.05 1c29 s ALA 322 Ca -0.13 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 50.64 1c29 s ALA 322 Cb 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 1c29 s ALA 322 CO 0.82 0.21 -0.12 -0.51 0.00 0.00 0.00 175.76 176.16 1c29 s ASP 323 N -2.12 4.20 -0.13 0.00 1.01 -0.34 -4.09 116.67 115.21 1c29 s ASP 323 Ca 0.06 -0.17 0.03 0.00 0.71 0.00 0.00 52.55 53.18 1c29 s ASP 323 Cb -0.08 -1.07 0.01 0.00 1.01 0.00 0.00 42.92 42.79 1c29 s ASP 323 CO 0.04 0.32 -0.21 -0.31 0.21 0.00 0.00 175.17 175.21 1c29 s TYR 324 N -0.56 2.57 0.47 4.23 1.51 -1.26 -0.92 117.35 123.39 1c29 s TYR 324 Ca 0.08 -1.27 0.02 0.00 -1.01 0.00 0.00 57.07 54.90 1c29 s TYR 324 Cb -0.12 -1.76 -0.01 0.00 -0.11 0.00 0.00 41.96 39.97 1c29 s TYR 324 CO 0.02 -0.58 0.07 0.14 -1.11 0.00 0.00 175.55 174.09 1c29 s VAL 325 N 0.78 0.79 0.26 0.71 -7.23 -0.52 -4.99 120.40 110.21 1c29 s VAL 325 Ca -0.08 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.13 1c29 s VAL 325 Cb -0.16 -2.19 -0.06 0.00 0.56 0.00 0.00 36.38 34.53 1c29 s VAL 325 CO -0.01 0.00 -0.01 -0.94 -0.31 0.00 0.00 175.10 173.83 1c29 s SER 326 N -3.75 2.20 -0.09 4.85 1.04 -1.26 -0.75 113.70 115.93 1c29 s SER 326 Ca 0.13 -1.23 -0.05 0.00 0.48 0.00 0.00 55.95 55.29 1c29 s SER 326 Cb 0.01 -0.06 0.04 0.00 0.10 0.00 0.00 66.02 66.12 1c29 s SER 326 CO 0.08 -0.47 0.22 -0.63 0.98 0.00 0.00 173.24 173.42 1c29 s ILE 327 N -3.27 -0.04 0.96 -1.02 -1.09 -0.66 -4.88 121.20 111.19 1c29 s ILE 327 Ca 0.30 0.16 -0.13 0.00 -2.23 0.00 0.00 60.65 58.75 1c29 s ILE 327 Cb 0.05 -0.34 0.17 0.00 -1.58 0.00 0.00 42.46 40.76 1c29 s ILE 327 CO 0.11 0.06 1.13 0.42 -1.23 0.00 0.00 174.94 175.43 1c29 s THR 328 N 1.24 1.97 0.11 2.92 -4.23 -1.26 0.20 115.64 116.59 1c29 s THR 328 Ca -0.09 0.00 -0.22 0.00 -1.18 0.00 0.00 61.69 60.19 1c29 s THR 328 Cb -0.11 -2.68 -0.08 0.00 1.34 0.00 0.00 72.50 70.98 1c29 s THR 328 CO -0.08 0.00 1.70 0.44 -0.54 0.00 0.00 174.62 176.15 1c29 h ASP 329 N -1.69 -0.22 -0.71 3.99 3.45 -1.20 -0.99 116.42 119.05 1c29 h ASP 329 Ca -0.51 0.04 -0.04 0.00 0.43 0.00 0.00 57.03 56.96 1c29 h ASP 329 Cb 1.33 0.11 -0.03 0.00 -0.56 0.00 0.00 39.33 40.17 1c29 h ASP 329 CO 0.58 -0.10 0.31 0.44 -1.57 0.00 0.00 179.24 178.90 1c29 h ASP 330 N -0.10 0.97 -0.37 6.45 3.32 -1.94 0.44 116.42 125.18 1c29 h ASP 330 Ca 0.05 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 1c29 h ASP 330 Cb 0.17 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1c29 h ASP 330 CO -0.12 0.85 0.14 -0.33 -1.72 0.00 0.00 179.24 178.06 1c29 h GLU 331 N 1.04 0.56 -0.42 3.56 5.08 -1.85 -1.05 114.58 121.50 1c29 h GLU 331 Ca 0.25 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 1c29 h GLU 331 Cb 0.17 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1c29 h GLU 331 CO -0.02 0.55 -0.13 0.00 -1.00 0.00 0.00 179.01 178.40 1c29 h ALA 332 N 0.99 0.98 -0.70 3.43 0.00 -0.79 -2.23 119.26 120.93 1c29 h ALA 332 Ca 0.12 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1c29 h ALA 332 Cb 0.20 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1c29 h ALA 332 CO -0.01 0.60 0.46 -0.07 0.00 0.00 0.00 179.25 180.24 1c29 h LEU 333 N 0.69 0.80 -0.52 0.00 -0.00 -0.59 -1.19 115.31 114.49 1c29 h LEU 333 Ca 0.11 -0.02 -0.12 0.00 -0.00 0.00 0.00 57.88 57.86 1c29 h LEU 333 Cb 0.61 -0.20 -0.02 0.00 -0.00 0.00 0.00 40.66 41.06 1c29 h LEU 333 CO 0.04 0.57 -0.13 -0.08 -0.00 0.00 0.00 178.44 178.84 1c29 h GLU 334 N 0.94 1.00 -0.52 1.13 4.22 -0.98 -1.13 114.58 119.25 1c29 h GLU 334 Ca 0.26 -0.39 -0.11 0.00 0.08 0.00 0.00 59.36 59.21 1c29 h GLU 334 Cb -0.09 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1c29 h GLU 334 CO -0.06 1.07 -0.09 0.00 -2.18 0.00 0.00 179.01 177.74 1c29 h ALA 335 N 0.90 0.85 0.08 2.92 0.00 -1.18 -1.73 119.26 121.10 1c29 h ALA 335 Ca 0.13 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1c29 h ALA 335 Cb 0.70 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1c29 h ALA 335 CO 0.05 0.65 -0.04 0.35 0.00 0.00 0.00 179.25 180.27 1c29 h PHE 336 N 0.86 -0.10 -0.08 0.00 3.57 -1.14 -1.72 116.94 118.33 1c29 h PHE 336 Ca 0.14 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.66 1c29 h PHE 336 Cb 0.64 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 1c29 h PHE 336 CO 0.04 -0.05 -0.07 -0.22 -2.23 0.00 0.00 178.31 175.79 1c29 h LYS 337 N -0.13 -0.07 -0.93 1.11 3.64 -1.12 -2.70 116.57 116.36 1c29 h LYS 337 Ca -0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1c29 h LYS 337 Cb 0.11 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.90 1c29 h LYS 337 CO 0.02 -0.05 0.60 1.15 -2.27 0.00 0.00 179.45 178.90 1c29 h THR 338 N -0.08 1.25 -0.27 1.00 2.02 -1.18 -2.26 112.91 113.39 1c29 h THR 338 Ca 0.06 -0.48 -0.14 0.00 0.77 0.00 0.00 66.41 66.62 1c29 h THR 338 Cb 0.16 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.45 1c29 h THR 338 CO -0.13 0.25 -0.40 0.25 0.37 0.00 0.00 175.52 175.86 1c29 h LEU 339 N 1.27 0.68 0.64 2.58 5.85 -1.20 -1.30 115.31 123.84 1c29 h LEU 339 Ca 0.34 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1c29 h LEU 339 Cb -0.11 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.73 1c29 h LEU 339 CO -0.07 1.00 -0.33 0.00 -0.34 0.00 0.00 178.44 178.71 1c29 h ARG 341 N -0.89 1.02 0.00 0.00 9.65 -1.40 -1.32 114.38 121.45 1c29 h ARG 341 Ca -0.09 -0.18 0.00 0.00 -1.10 0.00 0.00 59.98 58.62 1c29 h ARG 341 Cb 0.69 -0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.10 1c29 h ARG 341 CO 0.13 0.84 -1.82 0.72 2.80 0.00 0.00 179.97 182.64 1c29 n HIS 342 N -4.29 0.00 0.00 2.20 8.25 -0.49 -4.64 115.22 116.25 1c29 n HIS 342 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1c29 n HIS 342 Cb 0.18 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 30.88 1c29 n HIS 342 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1c29 n GLU 343 N -2.12 4.19 -2.02 -0.41 4.07 -0.77 -4.62 120.64 118.96 1c29 n GLU 343 Ca -0.03 0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 56.99 1c29 n GLU 343 Cb 0.51 -0.53 -0.01 0.00 -0.06 0.00 0.00 31.44 31.36 1c29 n GLU 343 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1c29 n GLY 344 N 1.10 0.18 3.03 8.31 0.00 -0.50 -5.01 105.19 112.30 1c29 n GLY 344 Ca 0.00 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 45.17 1c29 n GLY 344 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c29 s ILE 345 N -2.39 1.44 -0.45 -0.61 1.01 -1.14 -4.98 121.20 114.08 1c29 s ILE 345 Ca 0.00 -0.60 -0.21 0.00 0.00 0.00 0.00 60.65 59.84 1c29 s ILE 345 Cb 0.00 -1.34 0.03 0.00 0.01 0.00 0.00 42.46 41.16 1c29 s ILE 345 CO 0.00 0.43 0.68 -0.63 0.00 0.00 0.00 174.94 175.42 1c29 s ILE 346 N 1.12 4.78 0.19 2.92 1.01 -1.26 -2.82 121.20 127.15 1c29 s ILE 346 Ca -0.04 0.09 -0.12 0.00 0.00 0.00 0.00 60.65 60.58 1c29 s ILE 346 Cb -0.14 -4.25 -0.07 0.00 0.01 0.00 0.00 42.46 38.00 1c29 s ILE 346 CO -0.03 -0.67 0.56 -2.16 0.00 0.00 0.00 174.94 172.63 1c29 s PRO 347 N 2.92 3.89 0.69 2.79 0.04 -1.26 -1.00 135.00 143.07 1c29 s PRO 347 Ca 0.23 0.39 -0.17 0.00 0.04 0.00 0.00 61.00 61.50 1c29 s PRO 347 Cb -0.14 -2.77 0.02 0.00 0.04 0.00 0.00 34.50 31.64 1c29 s PRO 347 CO 0.19 0.39 1.26 0.00 0.04 0.00 0.00 177.00 178.87 1c29 s ALA 348 N -1.66 2.22 -0.50 8.56 0.00 -0.74 -3.76 121.76 125.89 1c29 s ALA 348 Ca 0.43 1.07 0.22 0.00 0.00 0.00 0.00 51.96 53.68 1c29 s ALA 348 Cb -0.13 -3.52 0.96 0.00 0.00 0.00 0.00 23.12 20.43 1c29 s ALA 348 CO 0.20 -1.78 1.67 1.28 0.00 0.00 0.00 175.76 177.13 1c29 n LEU 349 N -2.33 0.59 0.13 0.00 4.77 -1.26 -1.14 117.00 117.75 1c29 n LEU 349 Ca 0.15 0.66 -0.08 0.00 -0.03 0.00 0.00 56.01 56.70 1c29 n LEU 349 Cb 0.49 -0.60 -0.05 0.00 -2.33 0.00 0.00 43.42 40.93 1c29 n LEU 349 CO 0.47 -0.58 0.26 -0.33 -1.33 0.00 0.00 177.39 175.88 1c29 h GLU 350 N 0.00 -0.39 -0.88 3.23 3.07 -1.94 -3.28 114.58 114.39 1c29 h GLU 350 Ca 0.00 0.03 0.03 0.00 -0.50 0.00 0.00 59.36 58.91 1c29 h GLU 350 Cb 0.30 0.09 -0.05 0.00 -0.84 0.00 0.00 28.75 28.25 1c29 h GLU 350 CO 0.00 -0.14 0.58 0.77 -1.40 0.00 0.00 179.01 178.81 1c29 h SER 351 N -1.05 0.97 -1.23 1.42 0.02 -1.82 -2.68 113.55 109.18 1c29 h SER 351 Ca -0.04 -0.01 0.35 0.00 -0.84 0.00 0.00 61.79 61.25 1c29 h SER 351 Cb 0.42 -0.23 -0.07 0.00 0.14 0.00 0.00 62.40 62.67 1c29 h SER 351 CO 0.07 0.68 0.86 0.28 -1.14 0.00 0.00 176.83 177.58 1c29 h SER 352 N 1.14 0.13 -0.47 3.07 0.02 -1.19 0.37 113.55 116.62 1c29 h SER 352 Ca 0.34 0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 61.25 1c29 h SER 352 Cb -0.04 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 1c29 h SER 352 CO -0.10 0.00 0.02 0.45 -1.14 0.00 0.00 176.83 176.06 1c29 h HIS 353 N 0.10 0.94 -0.25 3.45 3.86 -1.53 0.10 115.15 121.82 1c29 h HIS 353 Ca 0.63 -0.14 -0.10 0.00 -1.16 0.00 0.00 60.37 59.60 1c29 h HIS 353 Cb 2.25 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 30.46 1c29 h HIS 353 CO -0.00 0.85 -0.25 0.00 0.86 0.00 0.00 177.93 179.39 1c29 h ALA 354 N 1.19 0.36 -0.73 2.45 0.00 -0.43 -2.73 119.26 119.38 1c29 h ALA 354 Ca 0.16 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1c29 h ALA 354 Cb 0.46 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1c29 h ALA 354 CO 0.02 0.34 0.23 1.25 0.00 0.00 0.00 179.25 181.09 1c29 h LEU 355 N 0.32 1.06 -1.42 0.00 6.46 -1.20 -2.57 115.31 117.96 1c29 h LEU 355 Ca 0.04 -0.21 0.05 0.00 -0.12 0.00 0.00 57.88 57.64 1c29 h LEU 355 Cb 0.80 -0.28 -0.04 0.00 -0.73 0.00 0.00 40.66 40.42 1c29 h LEU 355 CO 0.06 0.99 0.44 0.00 -0.62 0.00 0.00 178.44 179.31 1c29 h ALA 356 N 1.12 1.69 -0.02 1.25 0.00 -0.73 -0.21 119.26 122.35 1c29 h ALA 356 Ca 0.24 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.90 1c29 h ALA 356 Cb 0.30 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1c29 h ALA 356 CO -0.01 0.22 -0.90 1.25 0.00 0.00 0.00 179.25 179.81 1c29 h HIS 357 N 0.74 0.68 -0.57 0.00 -0.00 -1.15 -1.95 115.15 112.90 1c29 h HIS 357 Ca 0.28 -0.35 -0.06 0.00 -0.00 0.00 0.00 60.37 60.23 1c29 h HIS 357 Cb 0.18 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 27.48 1c29 h HIS 357 CO -0.00 1.16 0.10 0.00 -0.00 0.00 0.00 177.93 179.19 1c29 h ALA 358 N 0.73 1.10 -0.67 5.26 0.00 -1.05 -1.05 119.26 123.58 1c29 h ALA 358 Ca -0.07 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 1c29 h ALA 358 Cb 1.53 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 1c29 h ALA 358 CO 0.16 0.59 0.13 -0.07 0.00 0.00 0.00 179.25 180.06 1c29 h LEU 359 N 0.86 1.04 -0.18 0.00 4.07 -1.02 -2.13 115.31 117.94 1c29 h LEU 359 Ca 0.18 -0.25 -0.00 0.00 0.08 0.00 0.00 57.88 57.89 1c29 h LEU 359 Cb 0.37 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.83 1c29 h LEU 359 CO 0.01 1.02 0.10 0.50 -1.08 0.00 0.00 178.44 178.99 1c29 h LYS 360 N 1.01 0.26 -0.55 1.13 3.64 -0.76 0.32 116.57 121.62 1c29 h LYS 360 Ca 0.21 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.62 1c29 h LYS 360 Cb 0.41 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.12 1c29 h LYS 360 CO 0.01 0.24 0.25 0.52 -2.27 0.00 0.00 179.45 178.19 1c29 h MET 361 N 0.20 0.45 0.70 1.90 2.86 -1.05 -0.69 114.93 119.31 1c29 h MET 361 Ca 0.07 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.64 1c29 h MET 361 Cb 0.06 -0.10 0.01 0.00 0.06 0.00 0.00 31.60 31.62 1c29 h MET 361 CO -0.01 0.30 -0.34 1.98 1.06 0.00 0.00 176.91 179.90 1c29 h MET 362 N 0.46 -0.90 -0.52 1.72 1.85 -1.22 -2.84 114.93 113.48 1c29 h MET 362 Ca 0.26 0.06 0.10 0.00 -0.61 0.00 0.00 59.70 59.51 1c29 h MET 362 Cb 0.24 0.21 -0.03 0.00 0.43 0.00 0.00 31.60 32.44 1c29 h MET 362 CO -0.22 -0.60 0.35 0.00 -0.40 0.00 0.00 176.91 176.04 1c29 h ARG 363 N -1.09 0.27 0.00 0.39 3.08 -0.87 -0.53 114.38 115.63 1c29 h ARG 363 Ca -0.10 -0.02 -0.22 0.00 0.07 0.00 0.00 59.98 59.71 1c29 h ARG 363 Cb 0.72 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.67 1c29 h ARG 363 CO 0.16 0.18 -1.12 0.93 -1.07 0.00 0.00 179.97 179.05 1c29 h GLU 364 N 0.28 0.00 -2.07 0.04 5.08 -1.18 -3.36 114.58 113.37 1c29 h GLU 364 Ca 0.24 -0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 58.06 1c29 h GLU 364 Cb 0.58 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.43 1c29 h GLU 364 CO -0.05 0.92 -1.00 0.94 -1.00 0.00 0.00 179.01 178.82 1c29 n GLN 365 N -3.30 1.49 0.27 2.33 -0.06 -0.98 -4.98 117.38 112.16 1c29 n GLN 365 Ca -0.03 -3.76 0.19 0.00 -2.00 0.00 0.00 57.00 51.40 1c29 n GLN 365 Cb 0.96 -1.73 0.95 0.00 -4.06 0.00 0.00 30.24 26.36 1c29 n GLN 365 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 1c29 h PRO 366 N 3.42 0.00 0.00 3.69 0.13 -1.27 -2.16 132.00 135.81 1c29 h PRO 366 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1c29 h PRO 366 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1c29 h PRO 366 CO 0.59 0.00 -0.72 -1.91 -0.23 0.00 0.00 178.00 175.73 1c29 n GLU 367 N -2.82 0.01 -2.32 0.86 4.07 -1.26 -1.03 120.64 118.15 1c29 n GLU 367 Ca -0.02 -0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.66 1c29 n GLU 367 Cb 0.10 -1.50 -0.03 0.00 -0.06 0.00 0.00 31.44 29.95 1c29 n GLU 367 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 1c29 s LYS 368 N -3.00 4.38 -0.19 5.31 2.20 -0.81 -4.74 119.74 122.88 1c29 s LYS 368 Ca 0.10 1.89 -0.29 0.00 -0.36 0.00 0.00 55.97 57.30 1c29 s LYS 368 Cb 0.17 -3.32 -0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1c29 s LYS 368 CO 0.77 -0.34 1.11 -2.00 -0.36 0.00 0.00 175.35 174.53 1c29 s GLU 369 N 1.16 4.27 -0.06 4.03 2.12 -1.26 -4.00 118.70 124.97 1c29 s GLU 369 Ca 0.61 1.46 -0.02 0.00 0.36 0.00 0.00 54.97 57.38 1c29 s GLU 369 Cb -0.32 -3.66 0.04 0.00 0.26 0.00 0.00 34.13 30.44 1c29 s GLU 369 CO 0.29 -0.62 0.13 -0.65 -0.54 0.00 0.00 175.26 173.87 1c29 s GLN 370 N 3.14 0.07 -0.41 4.30 -0.21 -1.00 -5.00 119.66 120.54 1c29 s GLN 370 Ca 0.48 0.35 -0.07 0.00 0.02 0.00 0.00 55.36 56.13 1c29 s GLN 370 Cb -0.18 -0.20 0.09 0.00 1.00 0.00 0.00 33.01 33.72 1c29 s GLN 370 CO 0.10 -0.17 0.24 -1.17 -2.12 0.00 0.00 175.29 172.17 1c29 s LEU 371 N 1.21 5.14 -0.02 2.90 2.96 -1.26 -0.18 118.68 129.42 1c29 s LEU 371 Ca -0.09 -1.63 0.02 0.00 -0.22 0.00 0.00 54.13 52.22 1c29 s LEU 371 Cb -0.12 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1c29 s LEU 371 CO -0.05 -0.54 -0.07 -0.76 -1.32 0.00 0.00 176.35 173.61 1c29 s LEU 372 N 1.35 3.14 -0.11 -0.68 1.02 0.53 -0.16 118.68 123.78 1c29 s LEU 372 Ca 0.04 -0.10 0.00 0.00 0.02 0.00 0.00 54.13 54.09 1c29 s LEU 372 Cb -0.23 -1.75 0.02 0.00 0.02 0.00 0.00 46.19 44.25 1c29 s LEU 372 CO 0.00 0.32 -0.10 -0.69 0.02 0.00 0.00 176.35 175.89 1c29 s VAL 373 N -0.91 1.19 -0.14 -1.59 1.01 -1.05 -0.90 120.40 118.01 1c29 s VAL 373 Ca 0.15 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.67 1c29 s VAL 373 Cb -0.11 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 1c29 s VAL 373 CO 0.05 0.39 -0.01 -0.69 0.00 0.00 0.00 175.10 174.84 1c29 s VAL 374 N 1.41 4.19 -0.40 2.92 1.01 -0.54 -0.88 120.40 128.11 1c29 s VAL 374 Ca 0.00 -0.26 -0.26 0.00 0.00 0.00 0.00 61.98 61.46 1c29 s VAL 374 Cb -0.13 -2.82 0.02 0.00 0.00 0.00 0.00 36.38 33.45 1c29 s VAL 374 CO -0.06 0.52 0.96 0.21 0.00 0.00 0.00 175.10 176.73 1c29 s ASN 375 N -0.05 6.65 -1.15 3.32 2.47 -0.17 -1.14 114.94 124.88 1c29 s ASN 375 Ca 0.03 0.49 -0.14 0.00 0.42 0.00 0.00 52.86 53.66 1c29 s ASN 375 Cb -0.13 -2.47 0.19 0.00 -1.45 0.00 0.00 41.25 37.38 1c29 s ASN 375 CO 0.02 -0.95 1.32 -0.22 -3.72 0.00 0.00 177.10 173.56 1c29 s LEU 376 N 3.65 5.33 0.59 3.21 2.96 -0.47 -4.68 118.68 129.27 1c29 s LEU 376 Ca 0.39 -2.98 0.28 0.00 -0.22 0.00 0.00 54.13 51.60 1c29 s LEU 376 Cb -0.11 -2.36 1.66 0.00 0.50 0.00 0.00 46.19 45.88 1c29 s LEU 376 CO 0.22 -0.70 2.12 0.77 -1.32 0.00 0.00 176.35 177.44 1c29 h SER 377 N 7.28 0.00 -5.00 3.68 4.64 -1.91 -1.95 113.55 120.29 1c29 h SER 377 Ca 0.27 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.64 1c29 h SER 377 Cb 0.90 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.94 1c29 h SER 377 CO 1.17 0.00 0.23 -0.83 -0.87 0.00 0.00 176.83 176.53 1c29 s GLY 378 N -4.02 -0.00 0.36 -0.77 0.00 -1.26 -1.24 107.32 100.40 1c29 s GLY 378 Ca -0.05 -0.39 -0.18 0.00 0.00 0.00 0.00 44.72 44.10 1c29 s GLY 378 CO 0.55 -0.14 0.83 -1.60 0.00 0.00 0.00 173.10 172.74 1c29 s ARG 379 N -3.66 4.11 0.00 2.90 3.52 -0.19 -1.79 118.95 123.84 1c29 s ARG 379 Ca 0.12 0.87 0.18 0.00 -0.13 0.00 0.00 55.73 56.76 1c29 s ARG 379 Cb -0.06 -2.35 0.46 0.00 -1.56 0.00 0.00 34.95 31.44 1c29 s ARG 379 CO 0.08 0.09 1.38 0.41 -0.81 0.00 0.00 175.30 176.44 1c29 n GLY 380 N -0.43 2.31 0.30 8.12 0.00 -0.17 -3.42 105.19 111.90 1c29 n GLY 380 Ca 0.05 -0.61 0.11 0.00 0.00 0.00 0.00 46.02 45.57 1c29 n GLY 380 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1c29 h ASP 381 N 3.40 0.08 -0.40 1.61 3.32 -1.88 -1.29 116.42 121.27 1c29 h ASP 381 Ca 0.00 -0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.11 1c29 h ASP 381 Cb 0.87 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.35 1c29 h ASP 381 CO 0.00 0.06 0.07 0.50 -1.72 0.00 0.00 179.24 178.14 1c29 h LYS 382 N 0.10 0.18 -0.11 3.56 3.64 -1.97 -3.07 116.57 118.89 1c29 h LYS 382 Ca 0.11 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1c29 h LYS 382 Cb 0.30 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1c29 h LYS 382 CO -0.01 0.12 0.00 -0.25 -2.27 0.00 0.00 179.45 177.04 1c29 n ASP 383 N -5.11 0.89 -0.27 4.20 8.00 -0.49 -4.49 116.55 119.28 1c29 n ASP 383 Ca 0.03 -1.69 -0.01 0.00 0.71 0.00 0.00 54.79 53.83 1c29 n ASP 383 Cb 0.19 -0.07 0.12 0.00 -0.02 0.00 0.00 41.12 41.33 1c29 n ASP 383 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1c29 h ILE 384 N 1.12 1.01 -0.21 0.53 1.08 -1.50 -2.17 117.51 117.36 1c29 h ILE 384 Ca 0.00 -0.28 -0.07 0.00 -0.39 0.00 0.00 64.86 64.12 1c29 h ILE 384 Cb 0.25 0.11 -0.00 0.00 -3.07 0.00 0.00 36.82 34.11 1c29 h ILE 384 CO 0.00 0.15 -0.15 -0.26 -0.69 0.00 0.00 178.15 177.19 1c29 h PHE 385 N 0.82 0.55 -0.24 1.37 -1.00 -1.85 -2.11 116.94 114.48 1c29 h PHE 385 Ca 0.33 -0.15 0.01 0.00 2.81 0.00 0.00 57.97 60.97 1c29 h PHE 385 Cb 0.17 -0.12 -0.02 0.00 3.61 0.00 0.00 35.95 39.60 1c29 h PHE 385 CO -0.06 0.79 0.14 1.15 -1.61 0.00 0.00 178.31 178.73 1c29 h THR 386 N 0.16 1.02 -0.22 -1.55 2.02 -1.82 -1.58 112.91 110.93 1c29 h THR 386 Ca 0.04 -0.10 -0.11 0.00 0.77 0.00 0.00 66.41 67.01 1c29 h THR 386 Cb 0.68 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1c29 h THR 386 CO 0.04 0.05 -0.35 0.58 0.37 0.00 0.00 175.52 176.22 1c29 h VAL 387 N 0.29 1.29 -0.60 3.16 2.07 -1.46 -3.10 116.25 117.90 1c29 h VAL 387 Ca 0.10 -1.46 0.00 0.00 0.82 0.00 0.00 66.70 66.16 1c29 h VAL 387 Cb 0.00 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 1c29 h VAL 387 CO -0.05 0.46 0.38 -0.74 0.02 0.00 0.00 177.57 177.63 1c29 h HIS 388 N 0.41 0.77 0.00 1.57 6.17 -0.87 -3.52 115.15 119.69 1c29 h HIS 388 Ca 0.05 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.13 1c29 h HIS 388 Cb 0.80 -0.26 0.00 0.00 2.52 0.00 0.00 27.41 30.48 1c29 h HIS 388 CO 0.03 0.51 0.00 -0.25 0.71 0.00 0.00 177.93 178.93