#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d9b h PRO 2 N 0.00 -0.46 0.00 3.17 0.11 -1.97 -3.12 132.00 129.73 3d9b h PRO 2 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3d9b h PRO 2 Cb 0.00 0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.21 3d9b h PRO 2 CO 0.00 -0.31 0.00 0.27 -0.21 0.00 0.00 178.00 177.75 3d9b n ASN 3 N -5.06 0.00 -0.02 -2.05 0.23 -1.26 0.14 115.26 107.23 3d9b n ASN 3 Ca -0.06 -0.56 -0.22 0.00 -0.53 0.00 0.00 54.58 53.22 3d9b n ASN 3 Cb 0.19 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 37.75 3d9b n ASN 3 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 3d9b h PHE 4 N 0.00 0.37 0.00 -2.53 3.57 -1.96 -3.32 116.94 113.07 3d9b h PHE 4 Ca 0.00 -0.27 -0.05 0.00 3.53 0.00 0.00 57.97 61.18 3d9b h PHE 4 Cb 0.00 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 3d9b h PHE 4 CO 0.00 1.65 -0.24 0.74 -2.23 0.00 0.00 178.31 178.22 3d9b h PHE 5 N -0.29 0.00 0.00 0.41 -1.00 0.13 -1.85 116.94 114.34 3d9b h PHE 5 Ca -0.37 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.36 3d9b h PHE 5 Cb 1.79 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 41.34 3d9b h PHE 5 CO 0.10 0.24 -0.26 0.82 -1.61 0.00 0.00 178.31 177.61 3d9b h ILE 6 N 0.00 1.07 -0.01 -0.55 2.04 0.98 -2.61 117.51 118.44 3d9b h ILE 6 Ca -0.00 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.94 3d9b h ILE 6 Cb 1.10 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.69 3d9b h ILE 6 CO 0.03 0.25 -0.58 -0.67 0.00 0.00 0.00 178.15 177.18 3d9b n ASP 7 N -4.07 1.26 -3.72 1.72 2.03 -1.09 -4.56 116.55 108.12 3d9b n ASP 7 Ca -0.02 -1.02 -0.28 0.00 0.52 0.00 0.00 54.79 53.99 3d9b n ASP 7 Cb 0.32 0.52 -0.11 0.00 -0.72 0.00 0.00 41.12 41.13 3d9b n ASP 7 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3d9b n ARG 8 N -0.83 1.42 -0.18 -0.67 1.74 -0.72 -4.97 116.66 112.45 3d9b n ARG 8 Ca 0.08 -4.13 -0.01 0.00 -0.77 0.00 0.00 57.85 53.02 3d9b n ARG 8 Cb 0.38 -2.10 0.08 0.00 -1.02 0.00 0.00 32.46 29.80 3d9b n ARG 8 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3d9b h PRO 9 N 5.34 0.14 -0.02 5.56 0.11 -1.80 -2.70 132.00 138.62 3d9b h PRO 9 Ca 0.18 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 66.06 3d9b h PRO 9 Cb 0.79 -0.03 0.02 0.00 0.11 0.00 0.00 31.00 31.89 3d9b h PRO 9 CO 0.63 0.09 -0.88 0.82 -0.21 0.00 0.00 178.00 178.45 3d9b h ILE 10 N 0.14 1.32 -0.32 4.15 2.04 -1.93 -2.06 117.51 120.85 3d9b h ILE 10 Ca 0.29 -2.15 -0.01 0.00 1.00 0.00 0.00 64.86 63.98 3d9b h ILE 10 Cb 0.44 2.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.88 3d9b h ILE 10 CO -0.45 0.66 0.14 0.15 0.00 0.00 0.00 178.15 178.65 3d9b h PHE 11 N 0.28 0.44 0.29 1.37 3.57 -1.93 0.13 116.94 121.09 3d9b h PHE 11 Ca -0.10 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.38 3d9b h PHE 11 Cb 1.54 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 40.14 3d9b h PHE 11 CO 0.11 0.34 -0.18 0.00 -2.23 0.00 0.00 178.31 176.35 3d9b h ALA 12 N 1.71 -1.04 -0.79 2.41 0.00 -1.40 -3.11 119.26 117.05 3d9b h ALA 12 Ca 0.11 -0.09 0.21 0.00 0.00 0.00 0.00 54.91 55.14 3d9b h ALA 12 Cb 0.07 0.28 -0.15 0.00 0.00 0.00 0.00 17.79 18.00 3d9b h ALA 12 CO -0.01 -1.02 -0.01 0.91 0.00 0.00 0.00 179.25 179.12 3d9b n TRP 13 N -3.36 0.48 -0.16 0.00 7.02 -0.67 0.15 117.44 120.91 3d9b n TRP 13 Ca -0.05 0.95 -0.03 0.00 -1.02 0.00 0.00 57.50 57.35 3d9b n TRP 13 Cb 0.18 -1.08 0.06 0.00 -2.42 0.00 0.00 31.31 28.06 3d9b n TRP 13 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 3d9b h VAL 14 N 0.00 0.76 0.42 -0.99 2.07 -0.81 -1.64 116.25 116.07 3d9b h VAL 14 Ca 0.47 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.88 3d9b h VAL 14 Cb 0.94 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3d9b h VAL 14 CO -0.75 0.05 -0.31 0.40 0.02 0.00 0.00 177.57 176.98 3d9b h ILE 15 N 0.27 0.35 -0.17 4.57 2.04 0.15 -1.08 117.51 123.66 3d9b h ILE 15 Ca 0.24 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.14 3d9b h ILE 15 Cb 0.30 0.35 -0.07 0.00 -0.74 0.00 0.00 36.82 36.67 3d9b h ILE 15 CO -0.29 0.00 -0.50 0.00 0.00 0.00 0.00 178.15 177.36 3d9b h ALA 16 N -0.24 -0.75 0.00 1.87 0.00 -1.41 -1.06 119.26 117.66 3d9b h ALA 16 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d9b h ALA 16 Cb 0.62 0.94 0.00 0.00 0.00 0.00 0.00 17.79 19.35 3d9b h ALA 16 CO 0.01 -1.02 0.11 0.82 0.00 0.00 0.00 179.25 179.17 3d9b h ILE 17 N -0.53 0.00 0.07 0.00 2.04 -1.00 0.27 117.51 118.37 3d9b h ILE 17 Ca 0.06 0.00 -0.27 0.00 1.00 0.00 0.00 64.86 65.64 3d9b h ILE 17 Cb 0.66 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 3d9b h ILE 17 CO -0.44 0.00 -1.39 0.40 0.00 0.00 0.00 178.15 176.72 3d9b h ILE 18 N 0.00 1.29 -0.01 -0.67 2.04 0.04 -2.59 117.51 117.62 3d9b h ILE 18 Ca 0.00 -2.98 -0.16 0.00 1.00 0.00 0.00 64.86 62.72 3d9b h ILE 18 Cb 0.23 2.75 -0.02 0.00 -0.74 0.00 0.00 36.82 39.04 3d9b h ILE 18 CO 0.00 0.82 -0.73 0.40 0.00 0.00 0.00 178.15 178.63 3d9b h ILE 19 N 0.04 1.48 0.01 -0.67 2.04 0.24 -0.37 117.51 120.28 3d9b h ILE 19 Ca -0.18 -2.40 -0.00 0.00 1.00 0.00 0.00 64.86 63.28 3d9b h ILE 19 Cb 1.95 2.29 0.00 0.00 -0.74 0.00 0.00 36.82 40.32 3d9b h ILE 19 CO 0.15 0.69 -0.00 0.24 0.00 0.00 0.00 178.15 179.22 3d9b h MET 20 N 0.06 -0.01 -0.53 2.37 2.86 -0.91 -1.00 114.93 117.77 3d9b h MET 20 Ca -0.02 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 3d9b h MET 20 Cb 1.29 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.93 3d9b h MET 20 CO 0.10 0.31 0.21 -0.07 1.06 0.00 0.00 176.91 178.53 3d9b h LEU 21 N -0.33 0.73 0.08 1.22 3.38 -1.50 -0.42 115.31 118.47 3d9b h LEU 21 Ca -0.00 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 3d9b h LEU 21 Cb 0.33 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 3d9b h LEU 21 CO 0.00 0.70 -0.09 0.00 0.09 0.00 0.00 178.44 179.14 3d9b h ALA 22 N 1.06 -0.79 -0.96 1.53 0.00 -1.02 -2.57 119.26 116.51 3d9b h ALA 22 Ca 0.18 -0.03 0.20 0.00 0.00 0.00 0.00 54.91 55.25 3d9b h ALA 22 Cb 0.19 0.36 -0.08 0.00 0.00 0.00 0.00 17.79 18.26 3d9b h ALA 22 CO -0.02 -0.80 0.61 0.78 0.00 0.00 0.00 179.25 179.82 3d9b h GLY 23 N -0.17 1.29 0.93 0.00 0.00 -1.22 -1.96 103.07 101.94 3d9b h GLY 23 Ca -0.01 -0.27 0.02 0.00 0.00 0.00 0.00 47.33 47.07 3d9b h GLY 23 CO -0.02 -0.02 0.55 -1.33 0.00 0.00 0.00 176.54 175.72 3d9b h GLY 24 N 0.58 1.21 0.79 4.60 0.00 -0.92 0.34 103.07 109.67 3d9b h GLY 24 Ca 0.52 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 3d9b h GLY 24 CO -0.27 0.38 0.01 1.41 0.00 0.00 0.00 176.54 178.07 3d9b h LEU 25 N 1.09 0.04 -2.24 3.11 4.07 -1.03 -3.19 115.31 117.16 3d9b h LEU 25 Ca 0.33 -0.22 0.04 0.00 0.08 0.00 0.00 57.88 58.10 3d9b h LEU 25 Cb -0.05 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 3d9b h LEU 25 CO -0.10 0.25 0.13 0.00 -1.08 0.00 0.00 178.44 177.64 3d9b h ALA 26 N 0.79 1.82 -0.31 1.53 0.00 -0.51 0.15 119.26 122.74 3d9b h ALA 26 Ca 0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3d9b h ALA 26 Cb 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3d9b h ALA 26 CO -0.00 -0.20 -0.06 0.97 0.00 0.00 0.00 179.25 179.96 3d9b h ILE 27 N 0.00 1.28 0.29 0.00 2.10 -0.37 -3.02 117.51 117.79 3d9b h ILE 27 Ca 0.06 -1.09 -0.01 0.00 1.08 0.00 0.00 64.86 64.90 3d9b h ILE 27 Cb 0.32 1.35 0.00 0.00 -1.09 0.00 0.00 36.82 37.40 3d9b h ILE 27 CO -0.00 0.35 -0.14 -0.07 -1.08 0.00 0.00 178.15 177.21 3d9b h LEU 28 N 0.36 -0.33 0.00 2.19 3.38 -0.75 -3.29 115.31 116.87 3d9b h LEU 28 Ca 0.08 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3d9b h LEU 28 Cb 0.54 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.38 3d9b h LEU 28 CO 0.03 0.11 0.00 0.29 0.09 0.00 0.00 178.44 178.96 3d9b n LYS 29 N -5.07 0.70 -3.63 1.13 4.76 -0.45 -4.83 118.16 110.77 3d9b n LYS 29 Ca -0.09 0.01 -0.38 0.00 -2.87 0.00 0.00 58.31 54.99 3d9b n LYS 29 Cb 0.27 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.90 3d9b n LYS 29 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3d9b s LEU 30 N -2.13 4.45 0.39 -0.35 2.96 -1.14 -5.06 118.68 117.79 3d9b s LEU 30 Ca 0.35 0.80 -0.27 0.00 -0.22 0.00 0.00 54.13 54.79 3d9b s LEU 30 Cb 0.17 -2.41 -0.10 0.00 0.50 0.00 0.00 46.19 44.36 3d9b s LEU 30 CO 0.31 0.35 1.40 -2.84 -1.32 0.00 0.00 176.35 174.26 3d9b s PRO 31 N -1.05 4.03 -0.32 0.98 0.02 -1.26 -4.80 135.00 132.61 3d9b s PRO 31 Ca 0.21 2.38 -0.03 0.00 0.02 0.00 0.00 61.00 63.58 3d9b s PRO 31 Cb -0.15 -2.87 0.05 0.00 0.02 0.00 0.00 34.50 31.55 3d9b s PRO 31 CO 0.10 -0.52 0.04 0.08 -0.33 0.00 0.00 177.00 176.37 3d9b s VAL 32 N -1.17 3.22 0.33 3.83 1.01 -1.26 -0.58 120.40 125.77 3d9b s VAL 32 Ca 0.55 -1.35 0.05 0.00 0.00 0.00 0.00 61.98 61.23 3d9b s VAL 32 Cb -0.43 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 3d9b s VAL 32 CO 0.57 -0.16 0.21 0.00 0.00 0.00 0.00 175.10 175.73 3d9b s ALA 33 N 1.29 2.06 -0.10 5.51 0.00 -1.23 -3.12 121.76 126.16 3d9b s ALA 33 Ca -0.04 -1.80 -0.27 0.00 0.00 0.00 0.00 51.96 49.85 3d9b s ALA 33 Cb -0.20 1.26 -0.26 0.00 0.00 0.00 0.00 23.12 23.92 3d9b s ALA 33 CO -0.00 -0.56 0.86 0.37 0.00 0.00 0.00 175.76 176.43 3d9b h GLN 34 N 2.11 0.07 -4.61 0.00 4.15 -1.91 -3.30 115.11 111.63 3d9b h GLN 34 Ca -0.30 -0.11 -0.28 0.00 0.77 0.00 0.00 58.65 58.73 3d9b h GLN 34 Cb 1.25 0.04 -0.14 0.00 0.21 0.00 0.00 27.48 28.83 3d9b h GLN 34 CO 0.45 0.99 -0.57 0.71 -1.93 0.00 0.00 178.83 178.48 3d9b s TYR 35 N -2.52 1.25 0.50 3.99 2.02 -1.26 -1.21 117.35 120.12 3d9b s TYR 35 Ca -0.17 -1.41 -0.18 0.00 -0.37 0.00 0.00 57.07 54.93 3d9b s TYR 35 Cb -0.02 -0.56 -0.08 0.00 -0.40 0.00 0.00 41.96 40.91 3d9b s TYR 35 CO 0.72 -0.71 1.00 -1.25 -1.57 0.00 0.00 175.55 173.74 3d9b s PRO 36 N -3.99 3.90 -0.55 -1.71 0.04 -1.26 -4.93 135.00 126.50 3d9b s PRO 36 Ca 0.39 1.12 -0.26 0.00 0.04 0.00 0.00 61.00 62.29 3d9b s PRO 36 Cb 0.06 -2.12 -0.08 0.00 0.04 0.00 0.00 34.50 32.40 3d9b s PRO 36 CO 0.15 -0.32 2.37 0.95 0.04 0.00 0.00 177.00 180.19 3d9b s THR 37 N -2.35 3.03 -2.39 1.26 -4.23 -1.26 -4.72 115.64 104.99 3d9b s THR 37 Ca 0.62 0.01 0.20 0.00 -1.18 0.00 0.00 61.69 61.34 3d9b s THR 37 Cb -0.12 -3.09 0.13 0.00 1.34 0.00 0.00 72.50 70.76 3d9b s THR 37 CO 0.25 -0.08 1.11 -0.38 -0.54 0.00 0.00 174.62 174.98 3d9b n ILE 38 N 8.08 0.00 -2.26 2.99 5.41 -1.26 -4.95 119.36 127.36 3d9b n ILE 38 Ca 0.37 -0.46 -0.42 0.00 1.00 0.00 0.00 62.75 63.25 3d9b n ILE 38 Cb 0.53 1.38 -0.03 0.00 -0.71 0.00 0.00 39.64 40.81 3d9b n ILE 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3d9b s ALA 39 N -1.80 3.51 0.57 -1.39 0.00 -1.26 -4.77 121.76 116.63 3d9b s ALA 39 Ca 0.22 1.02 -0.18 0.00 0.00 0.00 0.00 51.96 53.02 3d9b s ALA 39 Cb 0.17 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.70 3d9b s ALA 39 CO 0.30 -0.54 0.47 -0.35 0.00 0.00 0.00 175.76 175.64 3d9b n PRO 40 N 3.87 0.46 -2.16 0.00 -0.04 -1.26 -4.88 135.00 130.98 3d9b n PRO 40 Ca 0.10 0.18 -0.39 0.00 -0.04 0.00 0.00 63.50 63.36 3d9b n PRO 40 Cb 0.44 -1.65 -0.01 0.00 -0.04 0.00 0.00 33.50 32.23 3d9b n PRO 40 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3d9b s PRO 41 N -2.04 3.96 -0.47 0.54 0.02 -1.24 -4.91 135.00 130.86 3d9b s PRO 41 Ca 0.68 1.99 0.09 0.00 0.02 0.00 0.00 61.00 63.78 3d9b s PRO 41 Cb -0.44 -2.69 0.33 0.00 0.02 0.00 0.00 34.50 31.72 3d9b s PRO 41 CO 0.55 -0.44 0.79 0.00 -0.33 0.00 0.00 177.00 177.57 3d9b n ALA 42 N 0.03 3.20 -1.57 -1.55 0.00 -1.26 -1.64 120.51 117.72 3d9b n ALA 42 Ca 0.04 -3.99 -0.36 0.00 0.00 0.00 0.00 53.44 49.12 3d9b n ALA 42 Cb 0.45 -0.84 0.08 0.00 0.00 0.00 0.00 19.45 19.14 3d9b n ALA 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3d9b n VAL 43 N 0.23 4.06 -3.76 0.00 0.31 -0.78 -3.29 118.33 115.11 3d9b n VAL 43 Ca 0.27 -0.45 -0.13 0.00 -0.01 0.00 0.00 64.34 64.03 3d9b n VAL 43 Cb 0.53 -1.33 -0.10 0.00 -0.91 0.00 0.00 33.84 32.03 3d9b n VAL 43 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3d9b s THR 44 N -1.57 0.02 -0.20 2.52 2.01 -0.62 -2.06 115.64 115.75 3d9b s THR 44 Ca 0.79 -0.18 0.00 0.00 0.31 0.00 0.00 61.69 62.61 3d9b s THR 44 Cb -0.37 -0.53 0.05 0.00 0.01 0.00 0.00 72.50 71.66 3d9b s THR 44 CO 0.44 -0.10 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.58 3d9b s ILE 45 N -0.40 1.35 -0.26 1.82 1.01 0.28 -1.63 121.20 123.38 3d9b s ILE 45 Ca -0.05 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 59.66 3d9b s ILE 45 Cb -0.03 -1.56 0.03 0.00 0.01 0.00 0.00 42.46 40.91 3d9b s ILE 45 CO 0.02 0.04 -0.06 -0.44 0.00 0.00 0.00 174.94 174.49 3d9b s SER 46 N 1.50 4.37 0.43 3.58 0.01 0.22 -1.87 113.70 121.95 3d9b s SER 46 Ca -0.02 -1.00 0.07 0.00 1.31 0.00 0.00 55.95 56.31 3d9b s SER 46 Cb -0.17 -1.65 -0.03 0.00 0.21 0.00 0.00 66.02 64.39 3d9b s SER 46 CO -0.07 -0.15 0.30 0.00 0.41 0.00 0.00 173.24 173.72 3d9b s ALA 47 N 1.28 3.92 -0.32 1.44 0.00 -1.21 -2.10 121.76 124.78 3d9b s ALA 47 Ca -0.02 -1.88 0.03 0.00 0.00 0.00 0.00 51.96 50.09 3d9b s ALA 47 Cb -0.17 -0.70 0.19 0.00 0.00 0.00 0.00 23.12 22.43 3d9b s ALA 47 CO -0.04 -0.23 0.71 -1.54 0.00 0.00 0.00 175.76 174.65 3d9b s SER 48 N -4.06 -1.32 -0.08 0.00 1.04 -1.26 -2.46 113.70 105.56 3d9b s SER 48 Ca 0.43 -0.09 -0.30 0.00 0.48 0.00 0.00 55.95 56.47 3d9b s SER 48 Cb -0.00 1.78 -0.05 0.00 0.10 0.00 0.00 66.02 67.85 3d9b s SER 48 CO 0.25 -0.21 1.69 -0.47 0.98 0.00 0.00 173.24 175.47 3d9b s TYR 49 N 2.56 1.91 -0.31 5.02 6.04 -1.10 -4.81 117.35 126.66 3d9b s TYR 49 Ca 0.15 0.21 -0.27 0.00 0.04 0.00 0.00 57.07 57.20 3d9b s TYR 49 Cb -0.06 -3.95 0.01 0.00 -1.04 0.00 0.00 41.96 36.92 3d9b s TYR 49 CO -0.20 -3.85 0.96 -1.25 -1.54 0.00 0.00 175.55 169.67 3d9b s PRO 50 N 4.25 4.03 0.00 4.97 0.04 -1.26 -3.46 135.00 143.57 3d9b s PRO 50 Ca 0.75 0.88 0.00 0.00 0.04 0.00 0.00 61.00 62.67 3d9b s PRO 50 Cb -0.33 -3.73 0.00 0.00 0.04 0.00 0.00 34.50 30.48 3d9b s PRO 50 CO 0.31 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.95 3d9b n GLY 51 N 3.99 0.89 3.93 0.56 0.00 -1.26 -4.77 105.19 108.52 3d9b n GLY 51 Ca 0.09 -0.52 -0.27 0.00 0.00 0.00 0.00 46.02 45.32 3d9b n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d9b s ALA 52 N -2.00 3.80 0.75 4.61 0.00 -1.22 -4.85 121.76 122.84 3d9b s ALA 52 Ca 0.00 -0.83 -0.09 0.00 0.00 0.00 0.00 51.96 51.03 3d9b s ALA 52 Cb 0.00 -2.03 0.07 0.00 0.00 0.00 0.00 23.12 21.16 3d9b s ALA 52 CO 0.00 0.34 1.09 0.16 0.00 0.00 0.00 175.76 177.35 3d9b s ASP 53 N -3.33 4.71 0.40 0.00 -4.77 -1.26 -3.73 116.67 108.69 3d9b s ASP 53 Ca 0.39 0.64 0.20 0.00 -3.30 0.00 0.00 52.55 50.48 3d9b s ASP 53 Cb -0.11 -1.23 0.80 0.00 -1.09 0.00 0.00 42.92 41.30 3d9b s ASP 53 CO 0.30 -1.72 1.79 0.00 0.70 0.00 0.00 175.17 176.24 3d9b h ALA 54 N -0.81 1.06 0.14 2.11 0.00 -1.78 -1.50 119.26 118.48 3d9b h ALA 54 Ca -0.45 -0.29 -0.19 0.00 0.00 0.00 0.00 54.91 53.97 3d9b h ALA 54 Cb 1.32 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 19.08 3d9b h ALA 54 CO 0.63 0.40 -0.85 -0.22 0.00 0.00 0.00 179.25 179.22 3d9b h LYS 55 N 0.00 0.30 0.00 0.00 3.64 -1.92 -2.78 116.57 115.81 3d9b h LYS 55 Ca -0.00 -0.51 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3d9b h LYS 55 Cb 0.79 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 3d9b h LYS 55 CO 0.04 1.24 0.00 1.15 -2.27 0.00 0.00 179.45 179.62 3d9b h THR 56 N -0.37 0.00 0.05 1.00 2.02 -1.91 0.69 112.91 114.39 3d9b h THR 56 Ca -0.15 -0.20 -0.36 0.00 0.77 0.00 0.00 66.41 66.47 3d9b h THR 56 Cb 1.65 0.90 -0.04 0.00 -1.74 0.00 0.00 68.15 68.92 3d9b h THR 56 CO 0.15 0.00 -2.13 0.52 0.37 0.00 0.00 175.52 174.43 3d9b n VAL 57 N -2.35 1.63 -0.00 3.16 0.31 -0.58 -3.61 118.33 116.89 3d9b n VAL 57 Ca 0.01 -0.68 -0.13 0.00 -0.01 0.00 0.00 64.34 63.53 3d9b n VAL 57 Cb 0.19 -1.38 -0.10 0.00 -0.91 0.00 0.00 33.84 31.64 3d9b n VAL 57 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 3d9b h GLN 58 N 0.03 -0.03 0.00 5.55 4.15 -1.17 -1.21 115.11 122.43 3d9b h GLN 58 Ca -0.46 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.96 3d9b h GLN 58 Cb 2.02 0.01 0.00 0.00 0.21 0.00 0.00 27.48 29.71 3d9b h GLN 58 CO 0.03 0.45 0.00 -0.25 -1.93 0.00 0.00 178.83 177.13 3d9b n ASP 59 N -4.87 0.00 0.00 -0.69 9.92 0.24 -1.16 116.55 119.99 3d9b n ASP 59 Ca -0.08 0.25 0.00 0.00 -0.53 0.00 0.00 54.79 54.43 3d9b n ASP 59 Cb 0.25 -0.41 0.00 0.00 -0.64 0.00 0.00 41.12 40.32 3d9b n ASP 59 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 3d9b n THR 60 N -1.41 0.00 0.07 -3.53 5.66 -1.24 -4.81 114.28 109.03 3d9b n THR 60 Ca 0.09 -0.21 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 3d9b n THR 60 Cb 0.26 0.71 0.00 0.00 -1.55 0.00 0.00 70.33 69.74 3d9b n THR 60 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 3d9b n VAL 61 N -1.21 0.57 -0.13 1.08 0.31 -0.56 -4.47 118.33 113.92 3d9b n VAL 61 Ca 0.00 0.19 -0.04 0.00 -0.01 0.00 0.00 64.34 64.48 3d9b n VAL 61 Cb 0.00 -1.03 0.04 0.00 -0.91 0.00 0.00 33.84 31.94 3d9b n VAL 61 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 3d9b h THR 62 N 0.00 0.81 0.17 2.52 2.02 -1.19 -1.27 112.91 115.97 3d9b h THR 62 Ca 0.00 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 3d9b h THR 62 Cb 0.00 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 3d9b h THR 62 CO 0.00 0.05 -0.08 1.56 0.37 0.00 0.00 175.52 177.42 3d9b h GLN 63 N 0.25 -0.22 0.00 6.66 4.20 -1.40 -1.15 115.11 123.46 3d9b h GLN 63 Ca 0.20 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.93 3d9b h GLN 63 Cb 0.23 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.06 3d9b h GLN 63 CO -0.24 0.05 0.00 1.55 -0.67 0.00 0.00 178.83 179.51 3d9b n VAL 64 N -5.08 1.51 -0.05 -0.54 3.14 -1.13 -1.66 118.33 114.52 3d9b n VAL 64 Ca -0.09 0.40 0.01 0.00 -2.96 0.00 0.00 64.34 61.71 3d9b n VAL 64 Cb 0.20 -1.30 -0.16 0.00 -1.06 0.00 0.00 33.84 31.52 3d9b n VAL 64 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 3d9b n ILE 65 N -1.57 0.64 0.04 1.55 5.41 -0.49 -3.94 119.36 121.00 3d9b n ILE 65 Ca 0.01 -0.66 -0.08 0.00 1.00 0.00 0.00 62.75 63.02 3d9b n ILE 65 Cb 0.08 -0.21 -0.13 0.00 -0.71 0.00 0.00 39.64 38.67 3d9b n ILE 65 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3d9b h GLU 66 N 0.00 0.02 -0.27 0.38 5.08 -0.81 -3.30 114.58 115.68 3d9b h GLU 66 Ca -0.25 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 57.89 3d9b h GLU 66 Cb 1.57 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.83 3d9b h GLU 66 CO 0.01 0.90 -0.53 1.96 -1.00 0.00 0.00 179.01 180.35 3d9b h GLN 67 N 0.01 0.80 0.00 2.33 4.20 -1.52 -3.07 115.11 117.86 3d9b h GLN 67 Ca -0.09 -0.50 0.00 0.00 0.06 0.00 0.00 58.65 58.12 3d9b h GLN 67 Cb 1.85 0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.68 3d9b h GLN 67 CO 0.12 1.13 0.00 0.09 -0.67 0.00 0.00 178.83 179.50 3d9b n ASN 68 N -4.00 0.00 -4.64 1.46 3.02 -1.25 -4.65 115.26 105.19 3d9b n ASN 68 Ca -0.04 -0.11 -0.42 0.00 -0.03 0.00 0.00 54.58 53.98 3d9b n ASN 68 Cb 0.61 -0.29 -0.03 0.00 -0.61 0.00 0.00 39.78 39.46 3d9b n ASN 68 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3d9b s MET 69 N -2.58 4.16 -0.18 3.52 -1.94 -1.16 -4.69 119.30 116.42 3d9b s MET 69 Ca 0.27 1.03 -0.35 0.00 -1.71 0.00 0.00 55.69 54.93 3d9b s MET 69 Cb 0.19 -3.67 0.14 0.00 2.01 0.00 0.00 34.83 33.51 3d9b s MET 69 CO 0.45 -0.62 1.30 0.54 -0.01 0.00 0.00 175.02 176.68 3d9b s ASN 70 N 1.38 -0.07 -1.47 3.03 2.20 -1.26 -4.97 114.94 113.77 3d9b s ASN 70 Ca 0.39 -0.02 -0.11 0.00 -0.94 0.00 0.00 52.86 52.17 3d9b s ASN 70 Cb -0.15 0.09 0.06 0.00 -2.00 0.00 0.00 41.25 39.25 3d9b s ASN 70 CO 0.09 -0.15 0.93 0.61 -2.94 0.00 0.00 177.10 175.64 3d9b n GLY 71 N -0.17 -0.51 3.38 0.45 0.00 -1.26 -4.96 105.19 102.11 3d9b n GLY 71 Ca -0.00 0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 3d9b n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d9b s ILE 72 N -3.25 3.25 0.79 -0.61 1.01 -1.26 -5.09 121.20 116.04 3d9b s ILE 72 Ca 0.58 -0.58 -0.11 0.00 0.00 0.00 0.00 60.65 60.54 3d9b s ILE 72 Cb -0.28 -2.40 0.07 0.00 0.01 0.00 0.00 42.46 39.86 3d9b s ILE 72 CO 0.71 0.50 1.09 -1.81 0.00 0.00 0.00 174.94 175.43 3d9b s ASP 73 N 0.57 4.39 0.00 3.58 1.11 -1.26 -3.96 116.67 121.10 3d9b s ASP 73 Ca -0.06 1.72 0.00 0.00 0.18 0.00 0.00 52.55 54.38 3d9b s ASP 73 Cb -0.15 -2.43 0.00 0.00 1.07 0.00 0.00 42.92 41.41 3d9b s ASP 73 CO 0.03 -2.09 0.00 0.59 1.18 0.00 0.00 175.17 174.88 3d9b n ASN 74 N -3.55 -0.69 -4.52 0.27 4.13 -1.26 -4.86 115.26 104.78 3d9b n ASN 74 Ca 0.08 0.00 -0.48 0.00 1.68 0.00 0.00 54.58 55.86 3d9b n ASN 74 Cb 0.54 -1.11 -0.06 0.00 -1.54 0.00 0.00 39.78 37.61 3d9b n ASN 74 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 3d9b n LEU 75 N 0.00 2.64 0.09 3.41 0.00 -1.25 -2.98 117.00 118.90 3d9b n LEU 75 Ca 0.00 0.41 -0.13 0.00 0.00 0.00 0.00 56.01 56.29 3d9b n LEU 75 Cb 0.06 -1.37 -0.08 0.00 0.00 0.00 0.00 43.42 42.03 3d9b n LEU 75 CO 0.00 -0.64 0.10 0.24 0.00 0.00 0.00 177.39 177.09 3d9b h MET 76 N 12.84 0.31 0.00 1.96 2.86 -1.41 -3.49 114.93 128.00 3d9b h MET 76 Ca -0.34 -0.41 0.00 0.00 -2.06 0.00 0.00 59.70 56.89 3d9b h MET 76 Cb 1.29 0.13 0.00 0.00 0.06 0.00 0.00 31.60 33.08 3d9b h MET 76 CO 0.99 1.12 0.00 2.48 1.06 0.00 0.00 176.91 182.56 3d9b n TYR 77 N -3.64 0.00 -4.53 -0.22 0.18 -1.25 -5.05 117.16 102.65 3d9b n TYR 77 Ca -0.07 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.38 3d9b n TYR 77 Cb 0.91 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.76 3d9b n TYR 77 CO 0.00 0.00 0.00 1.41 -2.08 0.00 0.00 176.86 176.19 3d9b s MET 78 N -1.37 2.71 -0.40 -3.48 -2.45 -1.26 -2.98 119.30 110.07 3d9b s MET 78 Ca 0.00 -0.59 0.08 0.00 -1.25 0.00 0.00 55.69 53.93 3d9b s MET 78 Cb 0.00 -2.59 0.26 0.00 1.25 0.00 0.00 34.83 33.75 3d9b s MET 78 CO 0.00 0.65 0.59 -1.13 1.05 0.00 0.00 175.02 176.18 3d9b n SER 79 N 1.96 -0.16 -4.73 1.11 3.41 -1.23 -0.34 113.62 113.65 3d9b n SER 79 Ca -0.17 -2.80 -0.41 0.00 -0.26 0.00 0.00 58.87 55.23 3d9b n SER 79 Cb 0.53 -0.32 -0.04 0.00 -0.26 0.00 0.00 64.21 64.11 3d9b n SER 79 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3d9b s SER 80 N -1.35 7.41 0.21 4.04 1.04 -0.77 -4.24 113.70 120.05 3d9b s SER 80 Ca 0.35 1.70 0.06 0.00 0.48 0.00 0.00 55.95 58.53 3d9b s SER 80 Cb 0.19 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.72 3d9b s SER 80 CO -0.12 -0.09 0.21 0.20 0.98 0.00 0.00 173.24 174.41 3d9b s ASN 81 N 0.22 5.73 -0.19 7.02 0.02 -0.97 -1.26 114.94 125.50 3d9b s ASN 81 Ca 0.46 -0.12 -0.08 0.00 -1.02 0.00 0.00 52.86 52.10 3d9b s ASN 81 Cb -0.22 -1.54 0.08 0.00 0.02 0.00 0.00 41.25 39.59 3d9b s ASN 81 CO 0.28 0.00 0.43 -0.44 0.02 0.00 0.00 177.10 177.40 3d9b s SER 82 N -3.54 -0.41 -0.04 -1.22 0.01 -0.83 -1.92 113.70 105.74 3d9b s SER 82 Ca 0.33 0.99 0.06 0.00 1.31 0.00 0.00 55.95 58.64 3d9b s SER 82 Cb -0.09 1.14 -0.02 0.00 0.21 0.00 0.00 66.02 67.26 3d9b s SER 82 CO 0.25 -0.22 -0.21 -1.81 0.41 0.00 0.00 173.24 171.66 3d9b s ASP 83 N 2.09 3.41 0.00 2.44 -0.00 -0.58 -2.37 116.67 121.66 3d9b s ASP 83 Ca -0.05 -0.39 0.00 0.00 -0.00 0.00 0.00 52.55 52.11 3d9b s ASP 83 Cb -0.10 -0.68 0.00 0.00 -0.00 0.00 0.00 42.92 42.14 3d9b s ASP 83 CO -0.13 0.30 0.40 -1.20 -0.00 0.00 0.00 175.17 174.54 3d9b n SER 84 N 2.57 1.18 -0.01 0.27 7.64 -1.02 0.06 113.62 124.31 3d9b n SER 84 Ca -0.17 -0.87 0.10 0.00 1.01 0.00 0.00 58.87 58.94 3d9b n SER 84 Cb 0.52 -0.22 -0.15 0.00 -1.01 0.00 0.00 64.21 63.35 3d9b n SER 84 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3d9b n THR 85 N 0.70 0.00 -1.59 0.44 5.66 -1.26 -4.81 114.28 113.43 3d9b n THR 85 Ca 0.00 -0.34 0.00 0.00 -3.05 0.00 0.00 64.05 60.66 3d9b n THR 85 Cb 0.20 0.32 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 3d9b n THR 85 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3d9b n GLY 86 N 1.38 0.73 3.06 1.09 0.00 0.11 -4.68 105.19 106.88 3d9b n GLY 86 Ca -0.01 -0.41 -0.18 0.00 0.00 0.00 0.00 46.02 45.41 3d9b n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d9b s THR 87 N -2.56 0.80 0.32 2.61 2.01 -1.19 -2.72 115.64 114.90 3d9b s THR 87 Ca 0.00 -0.69 0.09 0.00 0.31 0.00 0.00 61.69 61.41 3d9b s THR 87 Cb 0.00 -0.72 -0.05 0.00 0.01 0.00 0.00 72.50 71.74 3d9b s THR 87 CO 0.00 0.04 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.28 3d9b s VAL 88 N -0.60 2.83 -0.30 3.82 1.01 -1.03 -1.52 120.40 124.61 3d9b s VAL 88 Ca 0.01 -1.98 -0.05 0.00 0.00 0.00 0.00 61.98 59.96 3d9b s VAL 88 Cb -0.06 -2.77 0.19 0.00 0.00 0.00 0.00 36.38 33.74 3d9b s VAL 88 CO 0.00 -0.26 0.84 -1.58 0.00 0.00 0.00 175.10 174.10 3d9b s GLN 89 N -3.70 0.35 -0.14 2.72 0.74 -0.81 -3.29 119.66 115.53 3d9b s GLN 89 Ca 0.34 0.46 -0.05 0.00 0.05 0.00 0.00 55.36 56.16 3d9b s GLN 89 Cb -0.02 0.23 -0.03 0.00 1.10 0.00 0.00 33.01 34.29 3d9b s GLN 89 CO 0.19 -0.54 0.01 0.42 -0.55 0.00 0.00 175.29 174.82 3d9b s ILE 90 N 2.90 4.34 -0.47 -2.34 1.01 -0.78 -2.29 121.20 123.56 3d9b s ILE 90 Ca 0.15 -0.21 0.03 0.00 0.00 0.00 0.00 60.65 60.62 3d9b s ILE 90 Cb -0.08 -2.90 0.14 0.00 0.01 0.00 0.00 42.46 39.63 3d9b s ILE 90 CO -0.21 0.52 0.28 -0.89 0.00 0.00 0.00 174.94 174.64 3d9b s THR 91 N 0.00 1.53 0.00 2.92 2.01 -1.26 -0.56 115.64 120.29 3d9b s THR 91 Ca 0.03 -2.82 -0.30 0.00 0.31 0.00 0.00 61.69 58.91 3d9b s THR 91 Cb -0.13 -2.06 -0.04 0.00 0.01 0.00 0.00 72.50 70.29 3d9b s THR 91 CO 0.02 -0.94 1.07 -0.76 -0.69 0.00 0.00 174.62 173.32 3d9b s LEU 92 N 0.06 4.35 -0.18 4.42 1.02 -0.88 -3.51 118.68 123.95 3d9b s LEU 92 Ca 0.20 1.78 0.00 0.00 0.02 0.00 0.00 54.13 56.13 3d9b s LEU 92 Cb -0.19 -3.57 0.02 0.00 0.02 0.00 0.00 46.19 42.47 3d9b s LEU 92 CO -0.04 -0.38 -0.18 -0.89 0.02 0.00 0.00 176.35 174.88 3d9b s THR 93 N 1.24 2.22 0.25 5.49 2.01 -1.16 -1.86 115.64 123.83 3d9b s THR 93 Ca 0.54 -0.89 0.06 0.00 0.31 0.00 0.00 61.69 61.72 3d9b s THR 93 Cb -0.24 -1.94 -0.03 0.00 0.01 0.00 0.00 72.50 70.30 3d9b s THR 93 CO 0.27 0.53 0.28 -0.36 -0.69 0.00 0.00 174.62 174.65 3d9b s PHE 94 N 1.30 3.25 1.04 4.92 0.40 -0.65 -1.03 117.98 127.21 3d9b s PHE 94 Ca 0.05 -0.08 -0.17 0.00 -0.60 0.00 0.00 56.93 56.12 3d9b s PHE 94 Cb -0.13 -1.52 0.03 0.00 0.51 0.00 0.00 43.02 41.92 3d9b s PHE 94 CO -0.12 0.45 -0.04 0.39 0.70 0.00 0.00 175.22 176.60 3d9b n GLU 95 N -1.31 -0.85 -1.22 0.44 -0.58 -1.16 -3.70 120.64 112.26 3d9b n GLU 95 Ca -0.08 -0.23 -0.31 0.00 -0.42 0.00 0.00 57.16 56.13 3d9b n GLU 95 Cb 0.58 -1.64 0.10 0.00 -0.57 0.00 0.00 31.44 29.91 3d9b n GLU 95 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 3d9b s SER 96 N -1.77 4.24 0.00 1.62 0.01 -1.26 -3.34 113.70 113.20 3d9b s SER 96 Ca 0.53 1.78 0.00 0.00 1.31 0.00 0.00 55.95 59.58 3d9b s SER 96 Cb -0.14 -2.46 0.00 0.00 0.21 0.00 0.00 66.02 63.63 3d9b s SER 96 CO 0.68 -2.20 0.00 0.61 0.41 0.00 0.00 173.24 172.74 3d9b n GLY 97 N -1.12 1.31 3.48 3.44 0.00 -1.26 -4.94 105.19 106.10 3d9b n GLY 97 Ca 0.09 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.58 3d9b n GLY 97 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3d9b n THR 98 N -0.80 0.92 -1.65 2.61 -1.04 -1.21 -4.78 114.28 108.33 3d9b n THR 98 Ca 0.00 -0.23 -0.43 0.00 -2.04 0.00 0.00 64.05 61.35 3d9b n THR 98 Cb 0.00 -0.20 -0.03 0.00 -1.82 0.00 0.00 70.33 68.28 3d9b n THR 98 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3d9b s ASP 99 N -0.36 5.83 0.41 8.00 -1.08 -1.26 -4.81 116.67 123.41 3d9b s ASP 99 Ca 0.77 2.14 0.10 0.00 -0.52 0.00 0.00 52.55 55.05 3d9b s ASP 99 Cb -1.05 -2.52 0.86 0.00 -1.46 0.00 0.00 42.92 38.75 3d9b s ASP 99 CO 0.56 -1.62 1.97 0.00 0.52 0.00 0.00 175.17 176.59 3d9b h ALA 100 N 13.34 1.60 0.04 3.66 0.00 -1.91 -1.60 119.26 134.40 3d9b h ALA 100 Ca -0.44 -0.15 -0.24 0.00 0.00 0.00 0.00 54.91 54.08 3d9b h ALA 100 Cb 1.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3d9b h ALA 100 CO 0.96 0.29 -1.03 -0.44 0.00 0.00 0.00 179.25 179.02 3d9b h ASP 101 N 0.23 0.45 -0.12 0.00 3.32 -1.94 0.26 116.42 118.62 3d9b h ASP 101 Ca 0.05 -0.40 -0.17 0.00 0.02 0.00 0.00 57.03 56.54 3d9b h ASP 101 Cb 0.26 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 39.68 3d9b h ASP 101 CO 0.01 1.23 -0.58 0.40 -1.72 0.00 0.00 179.24 178.59 3d9b h ILE 102 N 0.16 1.34 -0.94 0.35 1.08 -1.93 -2.98 117.51 114.58 3d9b h ILE 102 Ca -0.09 -1.86 0.10 0.00 -0.39 0.00 0.00 64.86 62.62 3d9b h ILE 102 Cb 1.70 2.12 -0.07 0.00 -3.07 0.00 0.00 36.82 37.50 3d9b h ILE 102 CO 0.17 0.57 0.60 0.00 -0.69 0.00 0.00 178.15 178.80 3d9b h ALA 103 N 0.50 1.58 -0.48 1.87 0.00 -1.25 -1.82 119.26 119.65 3d9b h ALA 103 Ca -0.04 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3d9b h ALA 103 Cb 1.22 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 3d9b h ALA 103 CO 0.12 0.23 0.11 0.37 0.00 0.00 0.00 179.25 180.08 3d9b h GLN 104 N 0.95 0.78 0.15 0.00 4.15 -0.85 -3.14 115.11 117.16 3d9b h GLN 104 Ca 0.44 -0.19 -0.01 0.00 0.77 0.00 0.00 58.65 59.66 3d9b h GLN 104 Cb 0.39 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.98 3d9b h GLN 104 CO -0.20 0.76 -0.07 0.28 -1.93 0.00 0.00 178.83 177.67 3d9b h VAL 105 N 0.66 0.00 -0.79 2.39 2.07 -1.27 -3.24 116.25 116.07 3d9b h VAL 105 Ca 0.15 -0.06 0.28 0.00 0.82 0.00 0.00 66.70 67.89 3d9b h VAL 105 Cb 0.34 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.97 3d9b h VAL 105 CO 0.00 0.00 0.23 0.00 0.02 0.00 0.00 177.57 177.83 3d9b n GLN 106 N -2.73 -0.05 -0.20 1.57 6.02 -0.74 0.33 117.38 121.58 3d9b n GLN 106 Ca -0.03 1.14 0.00 0.00 -0.01 0.00 0.00 57.00 58.10 3d9b n GLN 106 Cb 0.08 -1.92 0.09 0.00 1.02 0.00 0.00 30.24 29.51 3d9b n GLN 106 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3d9b h VAL 107 N 0.00 0.47 0.06 5.09 2.07 -1.59 -2.99 116.25 119.36 3d9b h VAL 107 Ca 0.58 -0.03 -0.27 0.00 0.82 0.00 0.00 66.70 67.80 3d9b h VAL 107 Cb 1.41 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 3d9b h VAL 107 CO -0.67 0.02 -1.38 -0.61 0.02 0.00 0.00 177.57 174.94 3d9b h GLN 108 N 0.09 0.13 -0.93 1.57 4.15 0.54 -2.71 115.11 117.95 3d9b h GLN 108 Ca 0.31 -0.23 0.12 0.00 0.77 0.00 0.00 58.65 59.62 3d9b h GLN 108 Cb 0.50 0.08 -0.13 0.00 0.21 0.00 0.00 27.48 28.14 3d9b h GLN 108 CO -0.55 0.98 -0.44 -1.71 -1.93 0.00 0.00 178.83 175.19 3d9b n ASN 109 N -3.36 -0.76 0.00 -0.69 5.15 -0.67 0.53 115.26 115.47 3d9b n ASN 109 Ca -0.11 1.63 0.12 0.00 -0.60 0.00 0.00 54.58 55.63 3d9b n ASN 109 Cb 1.01 -0.31 0.58 0.00 -0.53 0.00 0.00 39.78 40.53 3d9b n ASN 109 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3d9b n LYS 110 N -5.28 0.11 0.01 1.20 4.76 -1.14 -3.19 118.16 114.62 3d9b n LYS 110 Ca 0.06 0.06 -0.15 0.00 -2.87 0.00 0.00 58.31 55.41 3d9b n LYS 110 Cb 0.32 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 31.97 3d9b n LYS 110 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3d9b h LEU 111 N 0.00 0.79 0.17 -0.35 6.46 0.42 -3.32 115.31 119.48 3d9b h LEU 111 Ca 0.00 -0.52 -0.29 0.00 -0.12 0.00 0.00 57.88 56.94 3d9b h LEU 111 Cb 0.38 -0.23 0.02 0.00 -0.73 0.00 0.00 40.66 40.09 3d9b h LEU 111 CO 0.00 1.31 -1.32 1.56 -0.62 0.00 0.00 178.44 179.37 3d9b h GLN 112 N 0.45 0.36 -0.55 1.25 4.20 -1.37 0.18 115.11 119.62 3d9b h GLN 112 Ca -0.05 -0.61 0.20 0.00 0.06 0.00 0.00 58.65 58.24 3d9b h GLN 112 Cb 1.39 0.23 -0.10 0.00 0.30 0.00 0.00 27.48 29.30 3d9b h GLN 112 CO 0.15 1.29 0.17 1.28 -0.67 0.00 0.00 178.83 181.05 3d9b n LEU 113 N -3.59 0.08 0.00 1.46 4.32 -1.21 -0.95 117.00 117.11 3d9b n LEU 113 Ca -0.11 0.93 0.11 0.00 -0.02 0.00 0.00 56.01 56.91 3d9b n LEU 113 Cb 1.05 -0.40 -0.05 0.00 -1.62 0.00 0.00 43.42 42.40 3d9b n LEU 113 CO 0.56 -0.99 -0.04 0.00 -1.22 0.00 0.00 177.39 175.69 3d9b n ALA 114 N -2.95 4.18 -0.14 -1.18 0.00 -0.09 -4.71 120.51 115.62 3d9b n ALA 114 Ca 0.17 -0.53 -0.11 0.00 0.00 0.00 0.00 53.44 52.98 3d9b n ALA 114 Cb 0.58 -0.85 0.02 0.00 0.00 0.00 0.00 19.45 19.20 3d9b n ALA 114 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3d9b h MET 115 N 0.00 0.94 -0.37 0.00 2.86 0.42 -1.94 114.93 116.83 3d9b h MET 115 Ca 0.00 -0.41 0.00 0.00 -2.06 0.00 0.00 59.70 57.23 3d9b h MET 115 Cb 0.59 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.22 3d9b h MET 115 CO 0.00 1.07 0.00 -0.35 1.06 0.00 0.00 176.91 178.69 3d9b n PRO 116 N -4.10 1.41 -0.00 -0.22 -0.05 -1.26 -3.15 135.00 127.62 3d9b n PRO 116 Ca -0.00 -0.48 0.08 0.00 -0.05 0.00 0.00 63.50 63.05 3d9b n PRO 116 Cb 0.47 -1.26 -0.11 0.00 -0.05 0.00 0.00 33.50 32.55 3d9b n PRO 116 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 175.50 176.73 3d9b n LEU 117 N -0.06 0.68 -4.88 1.53 4.77 -0.74 -4.98 117.00 113.33 3d9b n LEU 117 Ca 0.04 -0.41 -0.31 0.00 -0.03 0.00 0.00 56.01 55.31 3d9b n LEU 117 Cb 0.20 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.31 3d9b n LEU 117 CO 0.04 0.17 0.71 -0.76 -1.33 0.00 0.00 177.39 176.22 3d9b s LEU 118 N -3.08 3.18 0.91 2.23 1.43 -1.19 -5.00 118.68 117.16 3d9b s LEU 118 Ca 0.04 1.32 -0.10 0.00 -1.03 0.00 0.00 54.13 54.36 3d9b s LEU 118 Cb 0.13 -4.31 0.14 0.00 0.03 0.00 0.00 46.19 42.19 3d9b s LEU 118 CO 0.73 -0.96 1.16 -2.84 0.23 0.00 0.00 176.35 174.67 3d9b s PRO 119 N -5.19 1.02 0.08 1.29 0.02 -1.26 -4.84 135.00 126.12 3d9b s PRO 119 Ca 0.55 1.59 -0.25 0.00 0.02 0.00 0.00 61.00 62.91 3d9b s PRO 119 Cb -0.11 -1.72 -0.16 0.00 0.02 0.00 0.00 34.50 32.52 3d9b s PRO 119 CO 0.53 -2.64 1.69 0.37 -0.33 0.00 0.00 177.00 176.62 3d9b h GLN 120 N -1.82 -0.21 -0.15 5.54 5.75 -1.96 -2.66 115.11 119.59 3d9b h GLN 120 Ca -0.43 0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.13 3d9b h GLN 120 Cb 1.27 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.86 3d9b h GLN 120 CO 0.41 -0.12 0.24 0.93 -2.65 0.00 0.00 178.83 177.64 3d9b h GLU 121 N -0.24 0.00 0.16 1.69 3.07 -2.01 -2.03 114.58 115.22 3d9b h GLU 121 Ca -0.02 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.49 3d9b h GLU 121 Cb 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 3d9b h GLU 121 CO 0.04 0.00 -1.75 0.28 -1.40 0.00 0.00 179.01 176.18 3d9b h VAL 122 N 0.00 0.93 -0.54 3.13 2.07 -1.80 -3.25 116.25 116.79 3d9b h VAL 122 Ca 0.07 -2.55 -0.06 0.00 0.82 0.00 0.00 66.70 64.99 3d9b h VAL 122 Cb 0.54 2.72 -0.02 0.00 -1.52 0.00 0.00 31.29 33.00 3d9b h VAL 122 CO -0.00 0.85 0.11 1.56 0.02 0.00 0.00 177.57 180.11 3d9b h GLN 123 N 0.09 0.84 0.38 1.57 4.20 -1.06 -2.73 115.11 118.40 3d9b h GLN 123 Ca -0.34 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.19 3d9b h GLN 123 Cb 2.07 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 29.71 3d9b h GLN 123 CO 0.16 0.77 -0.48 1.96 -0.67 0.00 0.00 178.83 180.57 3d9b h GLN 124 N 0.81 -0.85 -0.82 1.46 4.20 -1.53 -2.92 115.11 115.47 3d9b h GLN 124 Ca 0.17 0.06 0.24 0.00 0.06 0.00 0.00 58.65 59.18 3d9b h GLN 124 Cb 0.33 0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 3d9b h GLN 124 CO 0.00 -0.57 0.64 1.96 -0.67 0.00 0.00 178.83 180.20 3d9b h GLN 125 N -0.88 0.00 -1.70 1.46 1.08 -1.55 -3.47 115.11 110.05 3d9b h GLN 125 Ca -0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 3d9b h GLN 125 Cb 0.79 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 3d9b h GLN 125 CO -0.11 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.18 3d9b n GLY 126 N -1.67 -1.58 3.72 3.46 0.00 -1.04 -5.02 105.19 103.06 3d9b n GLY 126 Ca 0.17 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 3d9b n GLY 126 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d9b s VAL 127 N 0.00 2.12 -0.02 1.61 -7.23 -1.26 -4.86 120.40 110.76 3d9b s VAL 127 Ca 0.00 0.06 0.01 0.00 -1.81 0.00 0.00 61.98 60.24 3d9b s VAL 127 Cb 0.00 -2.75 0.02 0.00 0.56 0.00 0.00 36.38 34.21 3d9b s VAL 127 CO 0.00 -0.03 -0.01 -0.94 -0.31 0.00 0.00 175.10 173.81 3d9b s SER 128 N -1.80 0.42 -0.29 4.85 1.04 -0.89 -5.00 113.70 112.03 3d9b s SER 128 Ca 0.77 -0.04 0.02 0.00 0.48 0.00 0.00 55.95 57.18 3d9b s SER 128 Cb -0.32 -0.18 0.08 0.00 0.10 0.00 0.00 66.02 65.70 3d9b s SER 128 CO 0.44 -0.05 0.00 -0.69 0.98 0.00 0.00 173.24 173.92 3d9b s VAL 129 N 0.67 1.79 0.56 5.02 1.01 -1.26 -0.61 120.40 127.59 3d9b s VAL 129 Ca -0.07 -1.73 0.08 0.00 0.00 0.00 0.00 61.98 60.27 3d9b s VAL 129 Cb -0.10 -2.17 0.07 0.00 0.00 0.00 0.00 36.38 34.18 3d9b s VAL 129 CO -0.01 -0.37 0.66 -1.61 0.00 0.00 0.00 175.10 173.77 3d9b s GLU 130 N 1.21 2.29 -0.30 2.72 2.02 -0.65 -4.93 118.70 121.06 3d9b s GLU 130 Ca 0.02 -1.77 -0.03 0.00 0.02 0.00 0.00 54.97 53.22 3d9b s GLU 130 Cb -0.19 -2.46 0.11 0.00 0.10 0.00 0.00 34.13 31.69 3d9b s GLU 130 CO -0.10 -0.78 0.17 -1.59 0.02 0.00 0.00 175.26 172.98 3d9b s LYS 131 N -4.54 0.28 -0.27 1.61 -2.85 -1.26 -1.58 119.74 111.13 3d9b s LYS 131 Ca 0.52 -0.64 -0.23 0.00 -1.00 0.00 0.00 55.97 54.63 3d9b s LYS 131 Cb -0.05 -1.12 0.07 0.00 -2.06 0.00 0.00 37.83 34.68 3d9b s LYS 131 CO 0.33 -1.06 0.71 -1.54 0.10 0.00 0.00 175.35 173.89 3d9b s SER 132 N 1.92 -0.80 0.95 0.03 1.04 -1.21 -1.83 113.70 113.80 3d9b s SER 132 Ca 0.11 1.46 -0.15 0.00 0.48 0.00 0.00 55.95 57.85 3d9b s SER 132 Cb -0.17 1.44 -0.07 0.00 0.10 0.00 0.00 66.02 67.33 3d9b s SER 132 CO -0.29 -0.25 -0.22 -1.54 0.98 0.00 0.00 173.24 171.93 3d9b n SER 133 N 3.13 -4.10 -0.09 7.02 3.41 -1.00 -4.70 113.62 117.30 3d9b n SER 133 Ca -0.16 0.28 -0.21 0.00 -0.26 0.00 0.00 58.87 58.52 3d9b n SER 133 Cb 0.56 -0.97 -0.12 0.00 -0.26 0.00 0.00 64.21 63.42 3d9b n SER 133 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3d9b h SER 134 N -1.17 0.04 -3.98 4.04 4.64 -1.92 -3.41 113.55 111.79 3d9b h SER 134 Ca -0.44 -0.63 -0.50 0.00 -0.47 0.00 0.00 61.79 59.75 3d9b h SER 134 Cb 1.30 -0.01 0.05 0.00 -0.31 0.00 0.00 62.40 63.42 3d9b h SER 134 CO 0.29 1.44 0.47 -0.94 -0.87 0.00 0.00 176.83 177.22 3d9b s SER 135 N -6.77 6.43 0.97 4.97 1.04 -1.26 -5.00 113.70 114.07 3d9b s SER 135 Ca -0.26 2.24 -0.12 0.00 0.48 0.00 0.00 55.95 58.28 3d9b s SER 135 Cb 0.04 -2.60 0.17 0.00 0.10 0.00 0.00 66.02 63.74 3d9b s SER 135 CO 0.63 -0.73 1.09 -0.36 0.98 0.00 0.00 173.24 174.84 3d9b s PHE 136 N -1.55 2.06 -0.00 5.02 0.40 -1.26 -4.58 117.98 118.07 3d9b s PHE 136 Ca 0.60 1.20 -0.00 0.00 -0.60 0.00 0.00 56.93 58.13 3d9b s PHE 136 Cb -0.27 -3.19 -0.00 0.00 0.51 0.00 0.00 43.02 40.07 3d9b s PHE 136 CO 0.33 -2.80 -0.00 -0.11 0.70 0.00 0.00 175.22 173.34 3d9b n LEU 137 N -4.16 0.01 -4.27 -0.37 0.00 0.18 -4.94 117.00 103.45 3d9b n LEU 137 Ca 0.06 0.02 -0.15 0.00 0.00 0.00 0.00 56.01 55.94 3d9b n LEU 137 Cb 0.55 -0.50 -0.10 0.00 0.00 0.00 0.00 43.42 43.37 3d9b n LEU 137 CO 0.56 -0.50 -0.42 0.00 0.00 0.00 0.00 177.39 177.03 3d9b s MET 138 N -1.01 1.13 -0.15 1.96 0.23 -1.26 -3.21 119.30 117.00 3d9b s MET 138 Ca -0.00 -1.49 0.02 0.00 -1.03 0.00 0.00 55.69 53.19 3d9b s MET 138 Cb 0.00 -0.74 0.01 0.00 -1.53 0.00 0.00 34.83 32.57 3d9b s MET 138 CO 0.00 0.10 -0.20 0.08 -2.03 0.00 0.00 175.02 172.97 3d9b s VAL 139 N -3.24 2.23 -0.27 5.16 1.01 -0.91 -2.75 120.40 121.63 3d9b s VAL 139 Ca 0.18 -0.92 -0.08 0.00 0.00 0.00 0.00 61.98 61.17 3d9b s VAL 139 Cb 0.02 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 3d9b s VAL 139 CO 0.02 0.54 0.08 -0.69 0.00 0.00 0.00 175.10 175.05 3d9b s VAL 140 N 0.83 4.27 0.61 2.92 1.01 -0.78 -3.94 120.40 125.33 3d9b s VAL 140 Ca -0.06 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 61.48 3d9b s VAL 140 Cb -0.15 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 3d9b s VAL 140 CO -0.02 0.25 1.03 -0.83 0.00 0.00 0.00 175.10 175.53 3d9b s GLY 141 N 1.59 1.76 -0.16 4.51 0.00 -0.11 0.44 107.32 115.35 3d9b s GLY 141 Ca 0.05 0.02 -0.04 0.00 0.00 0.00 0.00 44.72 44.75 3d9b s GLY 141 CO 0.04 0.30 0.25 0.14 0.00 0.00 0.00 173.10 173.82 3d9b s VAL 142 N -3.01 -0.39 0.25 1.40 1.01 0.33 -2.25 120.40 117.74 3d9b s VAL 142 Ca 0.57 0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.75 3d9b s VAL 142 Cb -0.12 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.67 3d9b s VAL 142 CO 0.49 -0.01 -0.12 0.27 0.00 0.00 0.00 175.10 175.73 3d9b s ILE 143 N 2.39 1.86 -0.20 2.22 -4.36 -1.08 -1.38 121.20 120.66 3d9b s ILE 143 Ca 0.04 -2.21 -0.06 0.00 -0.26 0.00 0.00 60.65 58.16 3d9b s ILE 143 Cb -0.14 -2.28 -0.03 0.00 1.25 0.00 0.00 42.46 41.27 3d9b s ILE 143 CO -0.10 -0.43 0.02 0.21 0.24 0.00 0.00 174.94 174.88 3d9b s ASN 144 N -3.42 5.02 -0.16 4.36 3.04 -1.26 -0.60 114.94 121.92 3d9b s ASN 144 Ca 0.27 -0.15 -0.23 0.00 0.04 0.00 0.00 52.86 52.79 3d9b s ASN 144 Cb 0.00 -1.86 -0.23 0.00 -1.54 0.00 0.00 41.25 37.62 3d9b s ASN 144 CO 0.11 0.08 0.47 0.71 -3.04 0.00 0.00 177.10 175.43 3d9b h THR 145 N 5.30 1.24 0.00 -5.21 1.35 -0.43 -3.35 112.91 111.82 3d9b h THR 145 Ca -0.36 -2.28 0.00 0.00 -0.55 0.00 0.00 66.41 63.22 3d9b h THR 145 Cb 1.18 2.72 0.00 0.00 -1.73 0.00 0.00 68.15 70.32 3d9b h THR 145 CO 0.62 0.49 0.00 0.47 -0.25 0.00 0.00 175.52 176.85 3d9b n ASP 146 N -4.39 0.00 0.00 5.36 9.92 -1.26 -4.82 116.55 121.36 3d9b n ASP 146 Ca -0.23 -0.89 0.00 0.00 -0.53 0.00 0.00 54.79 53.14 3d9b n ASP 146 Cb 0.66 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.14 3d9b n ASP 146 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3d9b n GLY 147 N -0.05 0.34 0.13 0.44 0.00 -1.26 -4.84 105.19 99.95 3d9b n GLY 147 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 3d9b n GLY 147 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3d9b h THR 148 N 0.00 1.22 -3.38 2.61 1.35 -1.88 -3.45 112.91 109.38 3d9b h THR 148 Ca 0.00 -2.35 -0.56 0.00 -0.55 0.00 0.00 66.41 62.94 3d9b h THR 148 Cb 0.13 2.36 -0.33 0.00 -1.73 0.00 0.00 68.15 68.57 3d9b h THR 148 CO 0.00 0.62 -0.83 0.00 -0.25 0.00 0.00 175.52 175.06 3d9b s MET 149 N -3.19 2.08 0.76 4.72 0.23 -1.26 -5.14 119.30 117.49 3d9b s MET 149 Ca 0.01 -0.54 -0.13 0.00 -1.03 0.00 0.00 55.69 54.00 3d9b s MET 149 Cb 0.10 -1.67 0.19 0.00 -1.53 0.00 0.00 34.83 31.92 3d9b s MET 149 CO 0.75 0.06 0.65 0.25 -2.03 0.00 0.00 175.02 174.70 3d9b n THR 150 N 3.78 0.00 0.20 3.16 -2.24 -1.26 -4.75 114.28 113.17 3d9b n THR 150 Ca -0.22 -0.26 0.09 0.00 -2.27 0.00 0.00 64.05 61.40 3d9b n THR 150 Cb 0.52 -1.08 0.25 0.00 -2.10 0.00 0.00 70.33 67.92 3d9b n THR 150 CO 0.00 0.00 0.00 0.06 -0.57 0.00 0.00 175.07 174.56 3d9b h GLN 151 N 0.00 0.00 0.08 -0.78 -0.00 -1.93 -2.44 115.11 110.04 3d9b h GLN 151 Ca -0.25 0.00 -0.25 0.00 -0.00 0.00 0.00 58.65 58.15 3d9b h GLN 151 Cb 0.77 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.24 3d9b h GLN 151 CO 0.16 0.20 -1.15 0.93 -0.00 0.00 0.00 178.83 178.98 3d9b h GLU 152 N 0.00 0.19 0.03 0.06 5.08 -1.95 -1.98 114.58 116.01 3d9b h GLU 152 Ca -0.00 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 3d9b h GLU 152 Cb 1.00 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.37 3d9b h GLU 152 CO 0.03 1.14 -0.01 -0.44 -1.00 0.00 0.00 179.01 178.72 3d9b h ASP 153 N 0.06 -0.03 0.14 1.42 3.32 -1.89 -2.71 116.42 116.72 3d9b h ASP 153 Ca -0.09 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.73 3d9b h ASP 153 Cb 1.88 0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.44 3d9b h ASP 153 CO 0.18 0.20 -0.07 0.40 -1.72 0.00 0.00 179.24 178.23 3d9b h ILE 154 N -0.27 0.93 -0.47 0.35 2.04 -1.41 0.44 117.51 119.13 3d9b h ILE 154 Ca -0.00 -0.28 0.04 0.00 1.00 0.00 0.00 64.86 65.62 3d9b h ILE 154 Cb 0.25 1.11 -0.06 0.00 -0.74 0.00 0.00 36.82 37.37 3d9b h ILE 154 CO 0.01 0.07 -0.35 0.28 0.00 0.00 0.00 178.15 178.15 3d9b h SER 155 N -0.32 -1.24 -0.29 1.72 0.02 -1.47 -1.66 113.55 110.32 3d9b h SER 155 Ca -0.02 0.18 0.05 0.00 -0.84 0.00 0.00 61.79 61.16 3d9b h SER 155 Cb 0.25 0.53 -0.04 0.00 0.14 0.00 0.00 62.40 63.29 3d9b h SER 155 CO 0.03 -0.18 0.02 -0.78 -1.14 0.00 0.00 176.83 174.78 3d9b h ASP 156 N -0.09 -0.07 -0.29 3.07 3.58 -1.07 0.51 116.42 122.06 3d9b h ASP 156 Ca 0.08 0.06 0.06 0.00 0.42 0.00 0.00 57.03 57.64 3d9b h ASP 156 Cb 0.29 0.09 -0.08 0.00 1.72 0.00 0.00 39.33 41.35 3d9b h ASP 156 CO -0.49 0.00 -0.43 0.22 -2.88 0.00 0.00 179.24 175.66 3d9b h TYR 157 N 0.11 -1.25 0.33 0.28 3.20 0.36 0.32 116.97 120.32 3d9b h TYR 157 Ca 0.14 0.06 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 3d9b h TYR 157 Cb 0.17 0.59 0.00 0.00 1.54 0.00 0.00 36.73 39.03 3d9b h TYR 157 CO -0.20 -0.46 -0.16 -0.39 -1.64 0.00 0.00 178.16 175.32 3d9b h VAL 158 N -0.40 0.70 -0.91 1.81 -1.51 -0.33 -0.88 116.25 114.73 3d9b h VAL 158 Ca 0.11 -0.23 0.26 0.00 -1.23 0.00 0.00 66.70 65.60 3d9b h VAL 158 Cb 0.60 0.82 -0.17 0.00 -2.13 0.00 0.00 31.29 30.42 3d9b h VAL 158 CO -0.50 0.05 0.05 0.00 -1.23 0.00 0.00 177.57 175.94 3d9b n ALA 159 N -2.35 0.49 0.99 5.19 0.00 0.17 0.11 120.51 125.11 3d9b n ALA 159 Ca -0.10 0.97 0.11 0.00 0.00 0.00 0.00 53.44 54.42 3d9b n ALA 159 Cb 0.23 -0.72 0.01 0.00 0.00 0.00 0.00 19.45 18.97 3d9b n ALA 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d9b n ALA 160 N -3.15 3.37 0.00 0.00 0.00 0.00 -4.17 120.51 116.57 3d9b n ALA 160 Ca 0.22 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 53.01 3d9b n ALA 160 Cb 0.73 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.39 3d9b n ALA 160 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3d9b n ASN 161 N 0.21 2.67 -0.06 0.00 3.02 0.27 -4.93 115.26 116.44 3d9b n ASN 161 Ca 0.10 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.55 3d9b n ASN 161 Cb 0.49 0.36 -0.06 0.00 -0.61 0.00 0.00 39.78 39.96 3d9b n ASN 161 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 3d9b n MET 162 N -1.12 0.31 0.01 3.52 2.81 0.31 -4.67 117.12 118.28 3d9b n MET 162 Ca 0.00 0.08 -0.18 0.00 -1.81 0.00 0.00 57.70 55.79 3d9b n MET 162 Cb 0.17 -1.20 -0.10 0.00 -0.71 0.00 0.00 33.22 31.38 3d9b n MET 162 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 3d9b h LYS 163 N -0.10 0.51 -0.67 0.03 3.64 -1.67 -2.79 116.57 115.53 3d9b h LYS 163 Ca -0.29 -0.52 0.11 0.00 -1.27 0.00 0.00 60.65 58.67 3d9b h LYS 163 Cb 1.41 0.14 -0.08 0.00 -0.41 0.00 0.00 32.23 33.29 3d9b h LYS 163 CO -0.08 1.16 0.27 0.22 -2.27 0.00 0.00 179.45 178.75 3d9b h ASP 164 N 0.07 0.29 -0.05 4.20 3.58 -1.83 0.24 116.42 122.91 3d9b h ASP 164 Ca -0.08 0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 3d9b h ASP 164 Cb 1.39 0.05 -0.00 0.00 1.72 0.00 0.00 39.33 42.49 3d9b h ASP 164 CO 0.14 0.15 0.02 0.00 -2.88 0.00 0.00 179.24 176.67 3d9b h ALA 165 N 1.45 0.07 -0.45 -0.78 0.00 -1.83 -3.23 119.26 114.48 3d9b h ALA 165 Ca 0.34 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 3d9b h ALA 165 Cb 0.44 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3d9b h ALA 165 CO -0.32 -0.34 0.15 0.82 0.00 0.00 0.00 179.25 179.55 3d9b h ILE 166 N -0.09 1.18 0.00 0.00 1.08 -0.96 -2.44 117.51 116.28 3d9b h ILE 166 Ca 0.02 -0.61 -0.03 0.00 -0.39 0.00 0.00 64.86 63.84 3d9b h ILE 166 Cb 0.18 0.68 -0.00 0.00 -3.07 0.00 0.00 36.82 34.60 3d9b h ILE 166 CO -0.00 0.23 -0.16 -1.28 -0.69 0.00 0.00 178.15 176.25 3d9b h SER 167 N 0.65 0.00 0.67 1.72 0.87 -0.59 -3.12 113.55 113.75 3d9b h SER 167 Ca 0.15 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.53 3d9b h SER 167 Cb 0.18 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.11 3d9b h SER 167 CO -0.01 0.16 -1.46 0.54 -0.53 0.00 0.00 176.83 175.54 3d9b n ARG 168 N -3.50 0.62 -1.59 2.24 1.74 -0.93 -4.82 116.66 110.42 3d9b n ARG 168 Ca -0.01 0.24 -0.52 0.00 -0.77 0.00 0.00 57.85 56.79 3d9b n ARG 168 Cb 0.32 -1.81 -0.06 0.00 -1.02 0.00 0.00 32.46 29.89 3d9b n ARG 168 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3d9b n THR 169 N -2.92 0.01 -1.26 0.55 -1.04 -1.18 -4.92 114.28 103.52 3d9b n THR 169 Ca -0.11 -0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.53 3d9b n THR 169 Cb 0.87 -0.83 0.06 0.00 -1.82 0.00 0.00 70.33 68.61 3d9b n THR 169 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 3d9b n SER 170 N 2.61 -1.83 0.00 8.00 2.88 -1.26 -3.11 113.62 120.91 3d9b n SER 170 Ca 0.19 0.59 0.00 0.00 -1.33 0.00 0.00 58.87 58.31 3d9b n SER 170 Cb 0.19 -1.13 0.00 0.00 -0.75 0.00 0.00 64.21 62.52 3d9b n SER 170 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3d9b n GLY 171 N 1.90 2.32 3.55 0.46 0.00 -1.26 -4.88 105.19 107.28 3d9b n GLY 171 Ca 0.09 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 3d9b n GLY 171 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d9b s VAL 172 N -0.89 3.47 -0.90 1.61 1.01 -1.18 -0.53 120.40 122.99 3d9b s VAL 172 Ca 0.00 0.29 0.26 0.00 0.00 0.00 0.00 61.98 62.53 3d9b s VAL 172 Cb 0.00 -4.17 0.24 0.00 0.00 0.00 0.00 36.38 32.45 3d9b s VAL 172 CO 0.00 -1.11 1.82 0.61 0.00 0.00 0.00 175.10 176.42 3d9b n GLY 173 N 5.59 -1.48 0.00 4.51 0.00 -1.26 -4.73 105.19 107.82 3d9b n GLY 173 Ca 0.16 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3d9b n GLY 173 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3d9b n ASP 174 N -1.74 0.00 -4.39 1.61 2.03 -1.26 -4.37 116.55 108.43 3d9b n ASP 174 Ca 0.06 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 55.00 3d9b n ASP 174 Cb 0.33 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.61 3d9b n ASP 174 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3d9b s VAL 175 N 0.00 4.03 -0.31 5.18 1.01 -1.26 -1.51 120.40 127.54 3d9b s VAL 175 Ca 0.00 -0.39 -0.18 0.00 0.00 0.00 0.00 61.98 61.42 3d9b s VAL 175 Cb 0.00 -2.94 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 3d9b s VAL 175 CO 0.00 0.28 0.49 -1.58 0.00 0.00 0.00 175.10 174.29 3d9b s GLN 176 N 1.56 3.80 -0.02 2.72 2.00 0.53 -4.99 119.66 125.27 3d9b s GLN 176 Ca 0.05 0.00 -0.30 0.00 -2.00 0.00 0.00 55.36 53.12 3d9b s GLN 176 Cb -0.16 -3.74 -0.03 0.00 0.80 0.00 0.00 33.01 29.88 3d9b s GLN 176 CO 0.02 -0.51 0.97 -1.17 -0.50 0.00 0.00 175.29 174.10 3d9b s LEU 177 N 2.32 4.35 -0.73 3.68 2.96 -1.26 -0.93 118.68 129.07 3d9b s LEU 177 Ca 0.19 1.62 -0.21 0.00 -0.22 0.00 0.00 54.13 55.51 3d9b s LEU 177 Cb -0.16 -3.54 0.09 0.00 0.50 0.00 0.00 46.19 43.09 3d9b s LEU 177 CO 0.12 -0.28 0.97 -0.36 -1.32 0.00 0.00 176.35 175.48 3d9b s PHE 178 N 1.15 2.86 0.00 5.38 0.08 -1.04 -4.72 117.98 121.69 3d9b s PHE 178 Ca 0.51 -0.88 0.00 0.00 0.12 0.00 0.00 56.93 56.68 3d9b s PHE 178 Cb -0.20 -4.25 0.00 0.00 -0.57 0.00 0.00 43.02 38.00 3d9b s PHE 178 CO 0.26 -1.55 0.00 0.41 -0.10 0.00 0.00 175.22 174.25 3d9b n GLY 179 N 5.37 -1.72 2.92 4.36 0.00 -1.26 -3.43 105.19 111.43 3d9b n GLY 179 Ca 0.04 -2.20 -0.12 0.00 0.00 0.00 0.00 46.02 43.74 3d9b n GLY 179 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3d9b s SER 180 N -1.30 -0.02 0.78 1.61 0.15 -1.26 -5.02 113.70 108.64 3d9b s SER 180 Ca 0.00 0.03 -0.16 0.00 0.70 0.00 0.00 55.95 56.52 3d9b s SER 180 Cb 0.00 0.08 -0.05 0.00 -1.71 0.00 0.00 66.02 64.34 3d9b s SER 180 CO 0.00 -0.04 0.26 1.67 1.20 0.00 0.00 173.24 176.33 3d9b n GLN 181 N 2.92 0.12 -1.03 5.44 7.27 -1.26 -3.81 117.38 127.03 3d9b n GLN 181 Ca -0.13 0.07 -0.30 0.00 0.07 0.00 0.00 57.00 56.71 3d9b n GLN 181 Cb 0.59 -1.63 0.25 0.00 2.41 0.00 0.00 30.24 31.86 3d9b n GLN 181 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 3d9b s TYR 182 N -2.02 0.21 -0.30 3.69 2.02 -1.26 -2.64 117.35 117.05 3d9b s TYR 182 Ca 0.60 0.44 -0.15 0.00 -0.37 0.00 0.00 57.07 57.58 3d9b s TYR 182 Cb -0.32 -3.45 0.16 0.00 -0.40 0.00 0.00 41.96 37.95 3d9b s TYR 182 CO 0.64 -4.06 0.98 0.00 -1.57 0.00 0.00 175.55 171.53 3d9b s ALA 183 N -2.97 -2.58 0.11 3.71 0.00 0.43 -4.33 121.76 116.14 3d9b s ALA 183 Ca 0.71 2.10 -0.36 0.00 0.00 0.00 0.00 51.96 54.42 3d9b s ALA 183 Cb -0.09 -1.96 -0.16 0.00 0.00 0.00 0.00 23.12 20.92 3d9b s ALA 183 CO 0.56 -0.79 1.44 -0.12 0.00 0.00 0.00 175.76 176.85 3d9b n MET 184 N 4.65 1.56 -3.85 0.00 1.56 -0.82 -2.13 117.12 118.09 3d9b n MET 184 Ca -0.12 0.56 -0.30 0.00 -0.27 0.00 0.00 57.70 57.57 3d9b n MET 184 Cb 0.54 -2.26 -0.15 0.00 2.15 0.00 0.00 33.22 33.50 3d9b n MET 184 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 3d9b s ARG 185 N 0.69 1.09 -0.47 2.12 1.81 0.05 -1.64 118.95 122.59 3d9b s ARG 185 Ca 0.82 -1.21 -0.20 0.00 -1.72 0.00 0.00 55.73 53.42 3d9b s ARG 185 Cb -0.84 -2.42 0.04 0.00 -0.45 0.00 0.00 34.95 31.27 3d9b s ARG 185 CO 0.43 -0.87 0.65 0.42 -0.68 0.00 0.00 175.30 175.26 3d9b s ILE 186 N 1.41 4.82 -0.33 1.52 -1.09 -0.96 -2.04 121.20 124.52 3d9b s ILE 186 Ca 0.06 -0.13 -0.16 0.00 -2.23 0.00 0.00 60.65 58.19 3d9b s ILE 186 Cb -0.18 -4.27 -0.01 0.00 -1.58 0.00 0.00 42.46 36.42 3d9b s ILE 186 CO -0.16 -0.72 0.38 0.26 -1.23 0.00 0.00 174.94 173.48 3d9b s TRP 187 N 2.82 3.21 -0.07 3.97 0.52 -0.37 -1.58 118.94 127.45 3d9b s TRP 187 Ca 0.20 0.06 -0.23 0.00 0.02 0.00 0.00 56.10 56.15 3d9b s TRP 187 Cb -0.16 -2.69 -0.04 0.00 -1.15 0.00 0.00 33.47 29.43 3d9b s TRP 187 CO 0.16 -0.42 0.68 -1.64 0.02 0.00 0.00 176.95 175.75 3d9b s MET 188 N 2.08 4.43 -0.50 4.98 -1.94 0.24 -1.32 119.30 127.27 3d9b s MET 188 Ca 0.13 0.84 -0.20 0.00 -1.71 0.00 0.00 55.69 54.75 3d9b s MET 188 Cb -0.16 -3.44 0.05 0.00 2.01 0.00 0.00 34.83 33.29 3d9b s MET 188 CO 0.12 0.09 0.64 1.21 -0.01 0.00 0.00 175.02 177.07 3d9b s ASN 189 N 0.73 6.25 0.23 3.03 3.84 -1.04 -1.47 114.94 126.51 3d9b s ASN 189 Ca 0.36 -0.77 -0.01 0.00 0.21 0.00 0.00 52.86 52.65 3d9b s ASN 189 Cb -0.18 -2.30 0.24 0.00 -0.55 0.00 0.00 41.25 38.46 3d9b s ASN 189 CO 0.17 -0.89 1.62 1.55 -2.79 0.00 0.00 177.10 176.77 3d9b h PRO 190 N 8.99 0.59 -0.75 0.43 0.13 -1.94 -1.80 132.00 137.65 3d9b h PRO 190 Ca -0.27 -0.27 0.01 0.00 -0.87 0.00 0.00 66.00 64.59 3d9b h PRO 190 Cb 1.09 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.18 3d9b h PRO 190 CO 0.96 0.85 0.49 -0.91 -0.23 0.00 0.00 178.00 179.16 3d9b h ASN 191 N 0.50 0.87 0.03 1.44 -0.26 -1.93 -2.06 115.58 114.17 3d9b h ASN 191 Ca 0.05 -0.03 -0.26 0.00 -0.56 0.00 0.00 56.30 55.51 3d9b h ASN 191 Cb 0.83 -0.22 0.02 0.00 -1.06 0.00 0.00 38.32 37.90 3d9b h ASN 191 CO 0.07 0.63 -1.04 -0.33 -1.06 0.00 0.00 177.43 175.70 3d9b h GLU 192 N 1.02 0.65 -0.88 0.81 5.08 -1.84 -2.51 114.58 116.91 3d9b h GLU 192 Ca 0.27 -0.74 0.12 0.00 -1.00 0.00 0.00 59.36 58.01 3d9b h GLU 192 Cb -0.11 0.22 -0.08 0.00 0.50 0.00 0.00 28.75 29.28 3d9b h GLU 192 CO -0.06 1.32 0.50 -0.07 -1.00 0.00 0.00 179.01 179.70 3d9b h LEU 193 N 0.30 0.69 -0.32 1.33 3.38 -0.99 -1.65 115.31 118.06 3d9b h LEU 193 Ca -0.14 0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.76 3d9b h LEU 193 Cb 1.70 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.38 3d9b h LEU 193 CO 0.20 0.36 -0.31 -1.13 0.09 0.00 0.00 178.44 177.66 3d9b h ASN 194 N 0.79 0.82 0.04 -0.43 -0.73 -1.38 0.83 115.58 115.52 3d9b h ASN 194 Ca 0.44 -0.47 0.02 0.00 1.87 0.00 0.00 56.30 58.17 3d9b h ASN 194 Cb 0.49 -0.23 -0.05 0.00 0.27 0.00 0.00 38.32 38.80 3d9b h ASN 194 CO -0.29 1.12 -0.47 0.50 -0.37 0.00 0.00 177.43 177.92 3d9b h LYS 195 N 0.54 -0.62 0.00 6.67 3.64 -1.02 -1.39 116.57 124.39 3d9b h LYS 195 Ca 0.05 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3d9b h LYS 195 Cb 0.88 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 3d9b h LYS 195 CO 0.08 -0.42 0.00 1.19 -2.27 0.00 0.00 179.45 178.03 3d9b n PHE 196 N -5.47 0.00 -3.25 1.91 3.01 -0.66 -4.92 117.46 108.09 3d9b n PHE 196 Ca -0.07 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.24 3d9b n PHE 196 Cb 0.39 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 39.93 3d9b n PHE 196 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3d9b n GLN 197 N -0.86 -3.59 -4.04 -1.08 6.02 0.12 -5.02 117.38 108.92 3d9b n GLN 197 Ca 0.17 0.83 -0.08 0.00 -0.01 0.00 0.00 57.00 57.91 3d9b n GLN 197 Cb 0.08 -5.70 -0.11 0.00 1.02 0.00 0.00 30.24 25.54 3d9b n GLN 197 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3d9b s LEU 198 N -5.60 2.37 0.26 1.08 1.43 0.25 -4.98 118.68 113.48 3d9b s LEU 198 Ca 0.29 -0.76 0.11 0.00 -1.03 0.00 0.00 54.13 52.75 3d9b s LEU 198 Cb -0.04 0.13 -0.05 0.00 0.03 0.00 0.00 46.19 46.26 3d9b s LEU 198 CO 0.71 -0.44 -0.19 0.42 0.23 0.00 0.00 176.35 177.07 3d9b s THR 199 N -2.69 2.33 0.49 5.49 -4.23 -1.26 -4.09 115.64 111.68 3d9b s THR 199 Ca -0.04 -2.33 0.33 0.00 -1.18 0.00 0.00 61.69 58.47 3d9b s THR 199 Cb -0.01 -2.23 0.52 0.00 1.34 0.00 0.00 72.50 72.13 3d9b s THR 199 CO -0.05 -0.40 1.74 -0.65 -0.54 0.00 0.00 174.62 174.72 3d9b h PRO 200 N 2.43 0.11 -0.49 3.99 0.11 -1.92 -0.54 132.00 135.69 3d9b h PRO 200 Ca -0.40 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.71 3d9b h PRO 200 Cb 1.25 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 3d9b h PRO 200 CO 0.59 0.07 0.32 0.28 -0.21 0.00 0.00 178.00 179.05 3d9b h VAL 201 N 0.11 1.12 -0.17 3.15 2.07 -1.90 0.88 116.25 121.51 3d9b h VAL 201 Ca 0.65 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.97 3d9b h VAL 201 Cb 2.29 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 32.44 3d9b h VAL 201 CO -0.14 0.12 -0.00 0.44 0.02 0.00 0.00 177.57 178.01 3d9b h ASP 202 N 0.66 -0.07 -0.65 0.57 3.32 -1.53 -0.74 116.42 117.99 3d9b h ASP 202 Ca 0.18 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.28 3d9b h ASP 202 Cb -0.07 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 3d9b h ASP 202 CO -0.04 -0.01 0.43 0.58 -1.72 0.00 0.00 179.24 178.47 3d9b h VAL 203 N 0.05 1.17 -0.72 -1.35 2.07 -0.32 0.13 116.25 117.29 3d9b h VAL 203 Ca 0.08 -0.31 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 3d9b h VAL 203 Cb 0.10 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 3d9b h VAL 203 CO -0.13 0.16 0.31 0.40 0.02 0.00 0.00 177.57 178.33 3d9b h ILE 204 N 0.88 1.24 -0.25 4.57 1.08 0.88 -1.80 117.51 124.11 3d9b h ILE 204 Ca 0.24 -0.73 -0.04 0.00 -0.39 0.00 0.00 64.86 63.94 3d9b h ILE 204 Cb -0.10 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 34.03 3d9b h ILE 204 CO -0.05 0.30 0.01 0.74 -0.69 0.00 0.00 178.15 178.46 3d9b h THR 205 N 1.02 1.25 -0.58 -0.27 2.02 -0.72 -2.33 112.91 113.30 3d9b h THR 205 Ca 0.24 -0.88 0.08 0.00 0.77 0.00 0.00 66.41 66.63 3d9b h THR 205 Cb 0.17 1.33 -0.07 0.00 -1.74 0.00 0.00 68.15 67.85 3d9b h THR 205 CO -0.02 0.28 0.22 0.00 0.37 0.00 0.00 175.52 176.36 3d9b h ALA 206 N 0.82 0.73 -0.70 6.16 0.00 -0.59 -0.24 119.26 125.45 3d9b h ALA 206 Ca 0.07 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3d9b h ALA 206 Cb 0.39 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3d9b h ALA 206 CO 0.01 -0.18 0.31 0.82 0.00 0.00 0.00 179.25 180.21 3d9b h ILE 207 N 0.41 1.24 -0.27 0.00 2.04 -1.26 -1.95 117.51 117.72 3d9b h ILE 207 Ca 0.28 -0.70 -0.12 0.00 1.00 0.00 0.00 64.86 65.32 3d9b h ILE 207 Cb 0.32 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 3d9b h ILE 207 CO -0.27 0.29 -0.32 0.11 0.00 0.00 0.00 178.15 177.95 3d9b h LYS 208 N 0.99 0.57 0.00 2.37 1.57 -0.69 0.17 116.57 121.55 3d9b h LYS 208 Ca 0.24 -0.25 -0.24 0.00 -1.87 0.00 0.00 60.65 58.52 3d9b h LYS 208 Cb 0.16 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.46 3d9b h LYS 208 CO -0.03 0.82 -0.98 0.00 -0.57 0.00 0.00 179.45 178.69 3d9b h ALA 209 N 1.16 0.28 0.00 3.86 0.00 -1.00 -3.38 119.26 120.18 3d9b h ALA 209 Ca 0.06 -0.71 -0.27 0.00 0.00 0.00 0.00 54.91 53.99 3d9b h ALA 209 Cb 0.79 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 3d9b h ALA 209 CO 0.06 0.77 -2.13 1.04 0.00 0.00 0.00 179.25 179.00 3d9b n GLN 210 N -3.78 0.67 -1.50 0.00 6.02 -0.74 -4.25 117.38 113.79 3d9b n GLN 210 Ca -0.08 0.02 -0.32 0.00 -0.01 0.00 0.00 57.00 56.60 3d9b n GLN 210 Cb 0.85 -1.58 0.03 0.00 1.02 0.00 0.00 30.24 30.56 3d9b n GLN 210 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3d9b n ASN 211 N -2.71 7.21 -4.53 1.08 5.15 0.58 -4.83 115.26 117.22 3d9b n ASN 211 Ca -0.23 -3.57 -0.30 0.00 -0.60 0.00 0.00 54.58 49.87 3d9b n ASN 211 Cb 1.00 -1.08 -0.11 0.00 -0.53 0.00 0.00 39.78 39.07 3d9b n ASN 211 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3d9b s ALA 212 N -3.16 2.81 -0.39 5.20 0.00 -1.26 -4.71 121.76 120.24 3d9b s ALA 212 Ca 0.54 -1.25 -0.11 0.00 0.00 0.00 0.00 51.96 51.14 3d9b s ALA 212 Cb 0.42 -0.80 0.04 0.00 0.00 0.00 0.00 23.12 22.78 3d9b s ALA 212 CO -0.20 0.61 0.22 -1.14 0.00 0.00 0.00 175.76 175.26 3d9b s GLN 213 N -1.99 2.77 -0.05 0.00 2.00 -1.26 -3.97 119.66 117.16 3d9b s GLN 213 Ca 0.19 -1.19 -0.05 0.00 -2.00 0.00 0.00 55.36 52.31 3d9b s GLN 213 Cb -0.11 -3.75 -0.04 0.00 0.80 0.00 0.00 33.01 29.91 3d9b s GLN 213 CO 0.11 -0.77 0.19 0.14 -0.50 0.00 0.00 175.29 174.45 3d9b s VAL 214 N 1.52 5.43 -0.14 1.34 -7.23 -1.05 -5.00 120.40 115.26 3d9b s VAL 214 Ca 0.02 0.06 -0.17 0.00 -1.81 0.00 0.00 61.98 60.08 3d9b s VAL 214 Cb -0.20 -3.49 -0.04 0.00 0.56 0.00 0.00 36.38 33.20 3d9b s VAL 214 CO 0.05 0.45 0.44 0.00 -0.31 0.00 0.00 175.10 175.74 3d9b s ALA 215 N -1.20 3.51 0.00 1.32 0.00 -1.26 -4.41 121.76 119.72 3d9b s ALA 215 Ca 0.22 -0.30 0.15 0.00 0.00 0.00 0.00 51.96 52.03 3d9b s ALA 215 Cb -0.13 -2.62 0.24 0.00 0.00 0.00 0.00 23.12 20.61 3d9b s ALA 215 CO 0.12 -0.07 1.08 0.00 0.00 0.00 0.00 175.76 176.88 3d9b n ALA 216 N 3.89 2.80 0.00 0.00 0.00 -1.26 -5.06 120.51 120.87 3d9b n ALA 216 Ca -0.08 -1.61 0.00 0.00 0.00 0.00 0.00 53.44 51.75 3d9b n ALA 216 Cb 0.51 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.41 3d9b n ALA 216 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d9b n GLY 217 N 0.28 0.24 3.29 0.00 0.00 -1.26 -4.69 105.19 103.05 3d9b n GLY 217 Ca -0.06 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.61 3d9b n GLY 217 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d9b s GLN 218 N 0.00 0.80 -0.17 1.61 -0.21 -1.26 -2.61 119.66 117.82 3d9b s GLN 218 Ca 0.00 -0.22 -0.27 0.00 0.02 0.00 0.00 55.36 54.88 3d9b s GLN 218 Cb 0.00 0.36 -0.01 0.00 1.00 0.00 0.00 33.01 34.36 3d9b s GLN 218 CO 0.00 -0.24 0.92 -0.51 -2.12 0.00 0.00 175.29 173.34 3d9b s LEU 219 N -1.58 4.18 -0.73 2.90 1.43 0.12 -3.84 118.68 121.15 3d9b s LEU 219 Ca -0.10 1.31 -0.04 0.00 -1.03 0.00 0.00 54.13 54.27 3d9b s LEU 219 Cb -0.03 -3.38 0.00 0.00 0.03 0.00 0.00 46.19 42.82 3d9b s LEU 219 CO 0.02 -0.47 0.52 0.61 0.23 0.00 0.00 176.35 177.26 3d9b n GLY 220 N 3.35 0.15 3.76 -3.19 0.00 -1.26 -2.15 105.19 105.85 3d9b n GLY 220 Ca 0.07 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 3d9b n GLY 220 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d9b s GLY 221 N -3.07 1.60 0.28 -0.02 0.00 -1.25 -4.78 107.32 100.08 3d9b s GLY 221 Ca 0.26 -0.27 -0.29 0.00 0.00 0.00 0.00 44.72 44.41 3d9b s GLY 221 CO 0.32 0.23 1.27 -0.51 0.00 0.00 0.00 173.10 174.41 3d9b s THR 222 N -3.10 3.03 0.37 0.90 -4.23 -1.26 -3.13 115.64 108.22 3d9b s THR 222 Ca 0.63 0.97 -0.24 0.00 -1.18 0.00 0.00 61.69 61.86 3d9b s THR 222 Cb -0.16 -3.62 -0.10 0.00 1.34 0.00 0.00 72.50 69.96 3d9b s THR 222 CO 0.55 0.20 0.99 -2.16 -0.54 0.00 0.00 174.62 173.66 3d9b s PRO 223 N -1.15 4.37 0.45 3.99 0.04 -1.26 -5.15 135.00 136.28 3d9b s PRO 223 Ca 0.51 1.37 0.04 0.00 0.04 0.00 0.00 61.00 62.95 3d9b s PRO 223 Cb -0.37 -2.60 0.01 0.00 0.04 0.00 0.00 34.50 31.57 3d9b s PRO 223 CO 0.45 0.07 0.63 -1.25 0.04 0.00 0.00 177.00 176.95 3d9b s PRO 224 N -2.40 2.88 0.30 0.56 0.04 -1.18 -5.07 135.00 130.13 3d9b s PRO 224 Ca 0.55 -0.84 -0.27 0.00 0.04 0.00 0.00 61.00 60.47 3d9b s PRO 224 Cb -0.18 -2.64 -0.10 0.00 0.04 0.00 0.00 34.50 31.62 3d9b s PRO 224 CO 0.24 -0.32 0.96 0.14 0.04 0.00 0.00 177.00 178.05 3d9b s VAL 225 N -2.49 4.09 0.18 -0.36 -7.23 -1.26 -4.96 120.40 108.38 3d9b s VAL 225 Ca 0.51 1.85 -0.33 0.00 -1.81 0.00 0.00 61.98 62.20 3d9b s VAL 225 Cb -0.10 -4.08 -0.13 0.00 0.56 0.00 0.00 36.38 32.64 3d9b s VAL 225 CO 0.35 0.25 1.68 0.29 -0.31 0.00 0.00 175.10 177.36 3d9b n LYS 226 N 0.82 2.53 -0.46 4.82 5.02 -1.26 -2.31 118.16 127.33 3d9b n LYS 226 Ca 0.01 0.91 0.00 0.00 -2.02 0.00 0.00 58.31 57.21 3d9b n LYS 226 Cb 0.49 -2.73 0.00 0.00 -0.02 0.00 0.00 35.03 32.77 3d9b n LYS 226 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d9b n GLY 227 N 3.78 0.72 3.77 0.72 0.00 -1.26 -5.06 105.19 107.86 3d9b n GLY 227 Ca 0.17 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 3d9b n GLY 227 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3d9b s GLN 228 N -0.87 3.89 -0.10 1.61 2.00 -0.98 -4.97 119.66 120.25 3d9b s GLN 228 Ca 0.00 1.89 -0.03 0.00 -2.00 0.00 0.00 55.36 55.22 3d9b s GLN 228 Cb 0.00 -2.58 -0.05 0.00 0.80 0.00 0.00 33.01 31.18 3d9b s GLN 228 CO 0.00 -0.47 -0.11 1.04 -0.50 0.00 0.00 175.29 175.24 3d9b n GLN 229 N -0.16 0.22 -3.29 1.67 1.13 -1.26 -5.03 117.38 110.67 3d9b n GLN 229 Ca 0.05 0.08 -0.39 0.00 -1.94 0.00 0.00 57.00 54.81 3d9b n GLN 229 Cb 0.46 -0.97 -0.06 0.00 0.11 0.00 0.00 30.24 29.78 3d9b n GLN 229 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 3d9b s LEU 230 N -6.20 4.49 -0.23 1.08 2.96 -1.26 -5.07 118.68 114.45 3d9b s LEU 230 Ca -0.14 1.20 -0.04 0.00 -0.22 0.00 0.00 54.13 54.93 3d9b s LEU 230 Cb 0.05 -2.86 0.08 0.00 0.50 0.00 0.00 46.19 43.95 3d9b s LEU 230 CO 0.19 0.24 0.10 0.21 -1.32 0.00 0.00 176.35 175.77 3d9b s ASN 231 N -0.87 2.97 0.09 3.68 3.04 -1.26 -4.30 114.94 118.29 3d9b s ASN 231 Ca 0.29 -0.96 0.06 0.00 0.04 0.00 0.00 52.86 52.28 3d9b s ASN 231 Cb -0.19 -0.36 -0.03 0.00 -1.54 0.00 0.00 41.25 39.13 3d9b s ASN 231 CO 0.18 -0.39 -0.15 0.00 -3.04 0.00 0.00 177.10 173.71 3d9b s ALA 232 N 2.07 1.33 0.27 1.71 0.00 -0.91 -4.97 121.76 121.24 3d9b s ALA 232 Ca 0.05 -1.11 -0.26 0.00 0.00 0.00 0.00 51.96 50.63 3d9b s ALA 232 Cb -0.16 -0.10 -0.09 0.00 0.00 0.00 0.00 23.12 22.76 3d9b s ALA 232 CO -0.21 0.16 0.90 -1.12 0.00 0.00 0.00 175.76 175.49 3d9b s SER 233 N -1.98 7.41 0.07 0.00 0.01 -1.26 0.12 113.70 118.07 3d9b s SER 233 Ca 0.02 1.80 -0.13 0.00 1.31 0.00 0.00 55.95 58.95 3d9b s SER 233 Cb -0.08 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.52 3d9b s SER 233 CO 0.03 0.05 0.46 -0.63 0.41 0.00 0.00 173.24 173.55 3d9b s ILE 234 N -1.41 4.98 -0.04 1.44 1.01 -1.07 -4.79 121.20 121.31 3d9b s ILE 234 Ca 0.45 0.74 0.07 0.00 0.00 0.00 0.00 60.65 61.90 3d9b s ILE 234 Cb -0.21 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 3d9b s ILE 234 CO 0.26 0.39 -0.24 -0.63 0.00 0.00 0.00 174.94 174.72 3d9b s ILE 235 N -1.29 1.96 0.00 2.92 -1.09 -1.26 -4.58 121.20 117.85 3d9b s ILE 235 Ca 0.31 -1.03 0.00 0.00 -2.23 0.00 0.00 60.65 57.70 3d9b s ILE 235 Cb -0.16 -1.64 0.00 0.00 -1.58 0.00 0.00 42.46 39.08 3d9b s ILE 235 CO 0.17 0.55 0.00 0.00 -1.23 0.00 0.00 174.94 174.43 3d9b n ALA 236 N 2.78 0.00 -1.68 9.38 0.00 -1.26 -5.07 120.51 124.67 3d9b n ALA 236 Ca -0.17 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.87 3d9b n ALA 236 Cb 0.52 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.00 3d9b n ALA 236 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3d9b n GLN 237 N 0.00 1.55 -4.20 0.00 6.02 -1.26 -4.91 117.38 114.58 3d9b n GLN 237 Ca 0.00 0.56 -0.17 0.00 -0.01 0.00 0.00 57.00 57.38 3d9b n GLN 237 Cb 0.00 -2.32 -0.12 0.00 1.02 0.00 0.00 30.24 28.82 3d9b n GLN 237 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3d9b s THR 238 N -1.30 0.91 0.55 5.09 -1.32 -1.25 -2.54 115.64 115.78 3d9b s THR 238 Ca 0.67 -1.07 -0.19 0.00 -1.21 0.00 0.00 61.69 59.89 3d9b s THR 238 Cb -0.48 -0.87 -0.08 0.00 -1.51 0.00 0.00 72.50 69.56 3d9b s THR 238 CO 0.53 -0.17 0.70 0.54 -2.21 0.00 0.00 174.62 174.02 3d9b n ARG 239 N 1.65 0.71 -2.51 7.08 5.12 -1.26 -4.81 116.66 122.64 3d9b n ARG 239 Ca -0.20 0.27 -0.33 0.00 -1.93 0.00 0.00 57.85 55.66 3d9b n ARG 239 Cb 0.55 -1.85 -0.04 0.00 -1.16 0.00 0.00 32.46 29.96 3d9b n ARG 239 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3d9b s LEU 240 N -0.09 3.77 0.00 0.55 1.02 -1.26 -4.83 118.68 117.84 3d9b s LEU 240 Ca 0.70 1.78 0.02 0.00 0.02 0.00 0.00 54.13 56.64 3d9b s LEU 240 Cb -0.46 -4.54 0.01 0.00 0.02 0.00 0.00 46.19 41.22 3d9b s LEU 240 CO 0.53 -0.69 0.45 0.35 0.02 0.00 0.00 176.35 177.01 3d9b n THR 241 N -1.17 0.00 -3.60 5.49 -2.24 -1.26 -2.91 114.28 108.59 3d9b n THR 241 Ca 0.08 -0.49 -0.15 0.00 -2.27 0.00 0.00 64.05 61.22 3d9b n THR 241 Cb 0.53 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.73 3d9b n THR 241 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3d9b s SER 242 N -0.41 -0.46 0.23 3.42 1.04 -1.26 -4.67 113.70 111.59 3d9b s SER 242 Ca 0.02 0.37 -0.13 0.00 0.48 0.00 0.00 55.95 56.68 3d9b s SER 242 Cb 0.02 0.46 0.28 0.00 0.10 0.00 0.00 66.02 66.88 3d9b s SER 242 CO 0.04 -0.60 1.60 0.71 0.98 0.00 0.00 173.24 175.96 3d9b h THR 243 N 3.15 0.23 -0.86 2.02 1.35 -1.97 -0.38 112.91 116.46 3d9b h THR 243 Ca -0.29 0.00 0.10 0.00 -0.55 0.00 0.00 66.41 65.67 3d9b h THR 243 Cb 1.17 0.23 -0.08 0.00 -1.73 0.00 0.00 68.15 67.75 3d9b h THR 243 CO 0.40 0.00 0.50 -0.08 -0.25 0.00 0.00 175.52 176.09 3d9b h GLU 244 N -0.02 0.79 -0.22 4.72 4.81 -1.96 0.18 114.58 122.88 3d9b h GLU 244 Ca 0.34 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.48 3d9b h GLU 244 Cb 0.55 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 3d9b h GLU 244 CO -0.76 0.52 -0.04 0.93 -0.73 0.00 0.00 179.01 178.92 3d9b h GLU 245 N 0.81 0.42 -0.23 1.92 5.08 -1.49 -2.21 114.58 118.88 3d9b h GLU 245 Ca 0.42 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 3d9b h GLU 245 Cb 0.40 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 3d9b h GLU 245 CO -0.26 0.65 0.15 0.74 -1.00 0.00 0.00 179.01 179.29 3d9b h PHE 246 N 0.16 0.28 -0.93 4.33 -1.00 -1.20 -3.17 116.94 115.41 3d9b h PHE 246 Ca 0.06 0.01 0.25 0.00 2.81 0.00 0.00 57.97 61.10 3d9b h PHE 246 Cb 0.49 -0.09 -0.17 0.00 3.61 0.00 0.00 35.95 39.79 3d9b h PHE 246 CO 0.05 0.17 0.07 0.78 -1.61 0.00 0.00 178.31 177.77 3d9b h GLY 247 N 0.30 1.22 -1.34 -1.45 0.00 -0.03 -0.54 103.07 101.22 3d9b h GLY 247 Ca 0.09 0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3d9b h GLY 247 CO -0.03 -0.46 0.00 0.58 0.00 0.00 0.00 176.54 176.64 3d9b n LYS 248 N -5.41 1.96 -1.25 4.80 2.85 -1.00 -0.74 118.16 119.37 3d9b n LYS 248 Ca 0.21 -1.47 -0.41 0.00 -1.05 0.00 0.00 58.31 55.60 3d9b n LYS 248 Cb 0.71 -1.40 -0.01 0.00 -0.65 0.00 0.00 35.03 33.68 3d9b n LYS 248 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 3d9b n ILE 249 N 0.69 0.96 -3.87 0.58 5.41 -0.21 -4.73 119.36 118.19 3d9b n ILE 249 Ca 0.16 -0.47 -0.35 0.00 1.00 0.00 0.00 62.75 63.09 3d9b n ILE 249 Cb 0.39 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 39.23 3d9b n ILE 249 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 3d9b s LEU 250 N 3.76 3.87 -0.22 1.39 2.96 -1.26 -1.53 118.68 127.65 3d9b s LEU 250 Ca 0.57 0.06 -0.14 0.00 -0.22 0.00 0.00 54.13 54.41 3d9b s LEU 250 Cb -0.68 -2.00 -0.18 0.00 0.50 0.00 0.00 46.19 43.83 3d9b s LEU 250 CO 0.57 0.12 -0.01 0.18 -1.32 0.00 0.00 176.35 175.90 3d9b n LEU 251 N 3.90 2.16 -3.55 -0.68 4.77 -0.92 -4.94 117.00 117.76 3d9b n LEU 251 Ca -0.16 0.29 -0.17 0.00 -0.03 0.00 0.00 56.01 55.94 3d9b n LEU 251 Cb 0.52 -0.94 -0.06 0.00 -2.33 0.00 0.00 43.42 40.61 3d9b n LEU 251 CO 0.35 0.56 0.47 -1.59 -1.33 0.00 0.00 177.39 175.84 3d9b s LYS 252 N -2.46 0.97 -0.11 3.23 -2.85 -1.24 -5.05 119.74 112.23 3d9b s LYS 252 Ca -0.32 0.38 -0.20 0.00 -1.00 0.00 0.00 55.97 54.83 3d9b s LYS 252 Cb 0.09 0.46 -0.04 0.00 -2.06 0.00 0.00 37.83 36.29 3d9b s LYS 252 CO 0.59 -0.27 0.56 0.08 0.10 0.00 0.00 175.35 176.40 3d9b s VAL 253 N -0.89 5.13 0.59 1.79 1.01 -1.26 -2.52 120.40 124.25 3d9b s VAL 253 Ca -0.08 1.12 -0.19 0.00 0.00 0.00 0.00 61.98 62.83 3d9b s VAL 253 Cb -0.01 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 3d9b s VAL 253 CO 0.07 0.28 1.20 0.20 0.00 0.00 0.00 175.10 176.85 3d9b s ASN 254 N 0.73 5.23 0.00 3.32 0.01 0.73 -4.89 114.94 120.07 3d9b s ASN 254 Ca 0.30 2.36 0.17 0.00 -0.71 0.00 0.00 52.86 54.98 3d9b s ASN 254 Cb -0.16 -2.60 1.04 0.00 0.41 0.00 0.00 41.25 39.94 3d9b s ASN 254 CO 0.13 -1.56 1.44 0.00 -1.51 0.00 0.00 177.10 175.60 3d9b n GLN 255 N -1.59 0.57 0.01 -0.60 10.64 -1.26 -1.97 117.38 123.17 3d9b n GLN 255 Ca 0.13 0.00 -0.08 0.00 -1.83 0.00 0.00 57.00 55.22 3d9b n GLN 255 Cb 0.50 -1.47 0.08 0.00 -0.86 0.00 0.00 30.24 28.48 3d9b n GLN 255 CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.06 175.45 3d9b h ASP 256 N 0.00 0.58 0.00 2.61 1.82 -2.03 -3.47 116.42 115.93 3d9b h ASP 256 Ca 0.00 -0.29 0.00 0.00 -0.39 0.00 0.00 57.03 56.35 3d9b h ASP 256 Cb 0.00 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 39.84 3d9b h ASP 256 CO 0.00 0.99 0.00 0.61 -1.61 0.00 0.00 179.24 179.23 3d9b n GLY 257 N 0.16 0.50 3.64 -0.78 0.00 -0.83 -5.11 105.19 102.76 3d9b n GLY 257 Ca -0.03 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 3d9b n GLY 257 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d9b n SER 258 N 0.00 0.80 -4.28 1.61 7.64 -1.26 -4.71 113.62 113.42 3d9b n SER 258 Ca 0.00 0.70 -0.30 0.00 1.01 0.00 0.00 58.87 60.29 3d9b n SER 258 Cb 0.00 -1.43 -0.16 0.00 -1.01 0.00 0.00 64.21 61.61 3d9b n SER 258 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 3d9b s ARG 259 N -3.32 1.97 -0.37 1.43 3.52 -1.26 -0.19 118.95 120.72 3d9b s ARG 259 Ca 0.75 -0.87 0.02 0.00 -0.13 0.00 0.00 55.73 55.50 3d9b s ARG 259 Cb -0.36 -1.91 0.11 0.00 -1.56 0.00 0.00 34.95 31.24 3d9b s ARG 259 CO 0.48 0.52 0.13 0.08 -0.81 0.00 0.00 175.30 175.71 3d9b s VAL 260 N -0.57 1.61 0.42 7.11 1.01 -1.05 -4.96 120.40 123.97 3d9b s VAL 260 Ca 0.09 -2.16 -0.03 0.00 0.00 0.00 0.00 61.98 59.88 3d9b s VAL 260 Cb -0.09 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 3d9b s VAL 260 CO -0.01 -0.72 0.69 -0.76 0.00 0.00 0.00 175.10 174.30 3d9b s LEU 261 N 0.90 3.79 0.27 3.92 1.43 -1.26 -2.15 118.68 125.58 3d9b s LEU 261 Ca 0.13 0.74 0.01 0.00 -1.03 0.00 0.00 54.13 53.97 3d9b s LEU 261 Cb -0.20 -3.65 0.59 0.00 0.03 0.00 0.00 46.19 42.96 3d9b s LEU 261 CO -0.11 -0.46 1.76 0.25 0.23 0.00 0.00 176.35 178.02 3d9b h LEU 262 N 0.47 0.58 -2.21 1.79 6.46 -1.17 0.29 115.31 121.52 3d9b h LEU 262 Ca -0.48 0.10 0.04 0.00 -0.12 0.00 0.00 57.88 57.42 3d9b h LEU 262 Cb 1.21 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.14 3d9b h LEU 262 CO 0.62 0.22 0.13 0.08 -0.62 0.00 0.00 178.44 178.87 3d9b h ARG 263 N 0.65 0.00 0.00 1.25 0.11 -1.12 -1.81 114.38 113.46 3d9b h ARG 263 Ca 0.50 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.58 3d9b h ARG 263 Cb 0.73 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.81 3d9b h ARG 263 CO -0.38 0.00 0.00 -0.44 0.10 0.00 0.00 179.97 179.25 3d9b h ASP 264 N 0.00 0.00 0.00 0.08 3.32 -0.69 -3.24 116.42 115.89 3d9b h ASP 264 Ca 0.07 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 3d9b h ASP 264 Cb 0.33 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 39.68 3d9b h ASP 264 CO -0.00 0.00 -0.72 1.33 -1.72 0.00 0.00 179.24 178.13 3d9b n VAL 265 N -2.61 0.57 -3.64 -1.35 0.24 -0.73 -4.95 118.33 105.86 3d9b n VAL 265 Ca 0.01 -1.29 -0.04 0.00 -2.04 0.00 0.00 64.34 60.98 3d9b n VAL 265 Cb 0.23 0.55 -0.07 0.00 -1.47 0.00 0.00 33.84 33.08 3d9b n VAL 265 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d9b s ALA 266 N -0.84 -2.16 -0.15 2.33 0.00 -0.90 -2.49 121.76 117.55 3d9b s ALA 266 Ca 0.27 1.74 -0.29 0.00 0.00 0.00 0.00 51.96 53.67 3d9b s ALA 266 Cb 0.29 -1.65 -0.01 0.00 0.00 0.00 0.00 23.12 21.75 3d9b s ALA 266 CO -0.09 -0.15 1.06 0.15 0.00 0.00 0.00 175.76 176.73 3d9b s LYS 267 N -0.12 4.34 -0.24 0.00 1.02 -0.43 -4.30 119.74 120.01 3d9b s LYS 267 Ca 0.06 1.43 -0.11 0.00 0.02 0.00 0.00 55.97 57.38 3d9b s LYS 267 Cb -0.04 -3.59 -0.05 0.00 -0.52 0.00 0.00 37.83 33.62 3d9b s LYS 267 CO -0.12 -0.47 0.19 0.42 -0.92 0.00 0.00 175.35 174.45 3d9b s ILE 268 N 2.56 5.34 -0.17 2.17 1.09 -1.26 -1.23 121.20 129.70 3d9b s ILE 268 Ca 0.48 0.25 -0.13 0.00 -1.10 0.00 0.00 60.65 60.16 3d9b s ILE 268 Cb -0.18 -3.53 0.05 0.00 -1.06 0.00 0.00 42.46 37.74 3d9b s ILE 268 CO 0.14 0.33 0.43 -0.70 -0.10 0.00 0.00 174.94 175.04 3d9b s GLU 269 N 1.11 0.46 -0.19 2.79 2.12 -0.87 -4.98 118.70 119.14 3d9b s GLU 269 Ca 0.09 0.69 -0.29 0.00 0.36 0.00 0.00 54.97 55.82 3d9b s GLU 269 Cb -0.14 0.13 -0.02 0.00 0.26 0.00 0.00 34.13 34.36 3d9b s GLU 269 CO 0.05 -0.10 1.47 -1.17 -0.54 0.00 0.00 175.26 174.97 3d9b s LEU 270 N 0.73 4.05 0.32 2.70 2.96 -1.26 -0.77 118.68 127.40 3d9b s LEU 270 Ca -0.04 1.67 0.02 0.00 -0.22 0.00 0.00 54.13 55.56 3d9b s LEU 270 Cb -0.05 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.09 3d9b s LEU 270 CO -0.05 -1.03 0.35 -0.83 -1.32 0.00 0.00 176.35 173.47 3d9b s GLY 271 N 3.19 1.85 0.62 7.98 0.00 -0.91 -4.91 107.32 115.15 3d9b s GLY 271 Ca 0.64 -1.78 -0.19 0.00 0.00 0.00 0.00 44.72 43.40 3d9b s GLY 271 CO 0.24 -1.25 1.27 -0.32 0.00 0.00 0.00 173.10 173.05 3d9b s GLY 272 N -3.29 2.83 0.02 0.20 0.00 -1.26 0.16 107.32 105.99 3d9b s GLY 272 Ca 0.36 1.17 -0.28 0.00 0.00 0.00 0.00 44.72 45.96 3d9b s GLY 272 CO 0.23 1.59 1.19 0.83 0.00 0.00 0.00 173.10 176.93 3d9b h GLU 273 N 0.75 -0.98 -5.87 2.90 5.08 -1.70 -3.41 114.58 111.35 3d9b h GLU 273 Ca -0.51 0.07 -0.58 0.00 -1.00 0.00 0.00 59.36 57.34 3d9b h GLU 273 Cb 1.32 0.22 -0.10 0.00 0.50 0.00 0.00 28.75 30.70 3d9b h GLU 273 CO 0.54 -0.66 -0.54 0.54 -1.00 0.00 0.00 179.01 177.90 3d9b s ASN 274 N -4.32 4.27 -0.04 1.42 2.20 -1.26 -5.02 114.94 112.20 3d9b s ASN 274 Ca -0.15 -1.12 0.10 0.00 -0.94 0.00 0.00 52.86 50.76 3d9b s ASN 274 Cb 0.01 -0.48 0.18 0.00 -2.00 0.00 0.00 41.25 38.97 3d9b s ASN 274 CO 0.45 -0.46 1.08 -1.22 -2.94 0.00 0.00 177.10 174.00 3d9b n TYR 275 N -1.13 0.00 -0.06 1.54 4.02 -1.26 -4.73 117.16 115.54 3d9b n TYR 275 Ca -0.02 -0.39 -0.09 0.00 -0.01 0.00 0.00 57.90 57.39 3d9b n TYR 275 Cb 0.65 -0.10 -0.15 0.00 -0.02 0.00 0.00 39.34 39.71 3d9b n TYR 275 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3d9b n ASP 276 N -0.18 0.47 -4.65 7.72 9.92 -1.26 -4.87 116.55 123.69 3d9b n ASP 276 Ca 0.05 0.22 -0.37 0.00 -0.53 0.00 0.00 54.79 54.16 3d9b n ASP 276 Cb 0.80 0.44 -0.09 0.00 -0.64 0.00 0.00 41.12 41.63 3d9b n ASP 276 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3d9b s ILE 277 N -2.57 5.29 -0.03 0.53 1.01 -1.26 -3.94 121.20 120.23 3d9b s ILE 277 Ca -0.07 0.37 -0.01 0.00 0.00 0.00 0.00 60.65 60.95 3d9b s ILE 277 Cb 0.07 -3.59 0.03 0.00 0.01 0.00 0.00 42.46 38.98 3d9b s ILE 277 CO 0.83 0.30 0.04 -0.63 0.00 0.00 0.00 174.94 175.47 3d9b s ILE 278 N 1.26 -0.05 0.26 2.92 1.01 -0.50 -4.27 121.20 121.83 3d9b s ILE 278 Ca 0.12 0.28 0.10 0.00 0.00 0.00 0.00 60.65 61.14 3d9b s ILE 278 Cb -0.14 -0.12 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 3d9b s ILE 278 CO 0.06 0.13 -0.03 0.00 0.00 0.00 0.00 174.94 175.10 3d9b s ALA 279 N 1.44 3.10 -0.16 9.38 0.00 -1.25 -0.39 121.76 133.89 3d9b s ALA 279 Ca -0.04 -1.65 -0.07 0.00 0.00 0.00 0.00 51.96 50.20 3d9b s ALA 279 Cb -0.13 -0.73 0.07 0.00 0.00 0.00 0.00 23.12 22.34 3d9b s ALA 279 CO -0.03 0.29 0.36 -1.21 0.00 0.00 0.00 175.76 175.17 3d9b s GLU 280 N -3.56 0.29 -0.26 0.00 2.02 0.59 -3.05 118.70 114.74 3d9b s GLU 280 Ca 0.31 0.84 -0.08 0.00 0.02 0.00 0.00 54.97 56.06 3d9b s GLU 280 Cb -0.07 0.09 -0.03 0.00 0.10 0.00 0.00 34.13 34.22 3d9b s GLU 280 CO 0.19 -0.22 0.08 0.12 0.02 0.00 0.00 175.26 175.45 3d9b s PHE 281 N 2.04 3.10 -1.54 1.61 5.36 -0.07 -0.82 117.98 127.66 3d9b s PHE 281 Ca -0.04 -0.40 -0.01 0.00 -0.96 0.00 0.00 56.93 55.51 3d9b s PHE 281 Cb -0.11 -2.25 0.01 0.00 -0.34 0.00 0.00 43.02 40.33 3d9b s PHE 281 CO -0.11 -0.35 0.10 0.09 -1.46 0.00 0.00 175.22 173.48 3d9b n ASN 282 N 4.94 0.60 0.00 6.13 3.02 -1.19 -0.75 115.26 128.00 3d9b n ASN 282 Ca -0.16 -1.23 0.00 0.00 -0.03 0.00 0.00 54.58 53.16 3d9b n ASN 282 Cb 0.51 -1.85 0.00 0.00 -0.61 0.00 0.00 39.78 37.83 3d9b n ASN 282 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d9b n GLY 283 N -2.42 1.23 3.78 7.41 0.00 -1.26 -4.96 105.19 108.97 3d9b n GLY 283 Ca -0.31 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.33 3d9b n GLY 283 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3d9b s GLN 284 N 0.00 4.60 0.30 1.61 0.74 0.07 -4.98 119.66 122.00 3d9b s GLN 284 Ca 0.00 1.24 -0.29 0.00 0.05 0.00 0.00 55.36 56.36 3d9b s GLN 284 Cb 0.00 -3.08 -0.13 0.00 1.10 0.00 0.00 33.01 30.90 3d9b s GLN 284 CO 0.00 0.45 1.32 -2.30 -0.55 0.00 0.00 175.29 174.21 3d9b n PRO 285 N 1.15 2.06 -3.53 1.67 -0.02 -1.26 -0.89 135.00 134.19 3d9b n PRO 285 Ca -0.02 0.73 -0.13 0.00 -2.02 0.00 0.00 63.50 62.05 3d9b n PRO 285 Cb 0.49 -2.33 -0.04 0.00 -0.02 0.00 0.00 33.50 31.60 3d9b n PRO 285 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d9b s ALA 286 N -0.70 -1.41 0.24 3.55 0.00 -1.17 -4.45 121.76 117.82 3d9b s ALA 286 Ca 0.60 0.56 0.03 0.00 0.00 0.00 0.00 51.96 53.15 3d9b s ALA 286 Cb -0.60 0.54 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 3d9b s ALA 286 CO 0.57 -0.59 0.11 0.45 0.00 0.00 0.00 175.76 176.30 3d9b n SER 287 N 0.13 0.76 0.00 0.00 2.88 -0.48 -3.79 113.62 113.13 3d9b n SER 287 Ca -0.18 -2.36 0.00 0.00 -1.33 0.00 0.00 58.87 55.01 3d9b n SER 287 Cb 0.62 0.74 0.00 0.00 -0.75 0.00 0.00 64.21 64.81 3d9b n SER 287 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3d9b n GLY 288 N 0.20 -1.22 2.90 0.46 0.00 -1.22 -0.51 105.19 105.80 3d9b n GLY 288 Ca -0.02 -0.91 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 3d9b n GLY 288 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d9b s LEU 289 N 0.00 3.12 -0.54 0.99 1.43 0.17 -2.49 118.68 121.36 3d9b s LEU 289 Ca 0.00 -1.60 -0.24 0.00 -1.03 0.00 0.00 54.13 51.26 3d9b s LEU 289 Cb 0.00 -1.22 0.04 0.00 0.03 0.00 0.00 46.19 45.04 3d9b s LEU 289 CO 0.00 -0.33 0.94 -0.83 0.23 0.00 0.00 176.35 176.35 3d9b s GLY 290 N 1.32 1.42 -0.10 -3.19 0.00 -0.11 -1.86 107.32 104.79 3d9b s GLY 290 Ca 0.04 -1.22 -0.01 0.00 0.00 0.00 0.00 44.72 43.53 3d9b s GLY 290 CO -0.12 2.04 -0.04 -0.42 0.00 0.00 0.00 173.10 174.56 3d9b s ILE 291 N 3.92 3.94 0.00 0.90 1.01 -1.11 -0.34 121.20 129.52 3d9b s ILE 291 Ca 0.31 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.58 3d9b s ILE 291 Cb -0.12 -2.66 0.00 0.00 0.01 0.00 0.00 42.46 39.68 3d9b s ILE 291 CO 0.20 0.57 0.00 0.29 0.00 0.00 0.00 174.94 175.99 3d9b n LYS 292 N 2.60 1.29 -3.66 2.79 4.76 -0.57 0.47 118.16 125.84 3d9b n LYS 292 Ca -0.18 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.03 3d9b n LYS 292 Cb 0.53 0.00 -0.17 0.00 -1.84 0.00 0.00 35.03 33.55 3d9b n LYS 292 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3d9b s LEU 293 N 0.00 0.35 0.16 -0.35 0.20 -1.26 -4.06 118.68 113.72 3d9b s LEU 293 Ca 0.00 -0.31 -0.33 0.00 0.69 0.00 0.00 54.13 54.18 3d9b s LEU 293 Cb 0.00 -0.25 -0.13 0.00 -0.43 0.00 0.00 46.19 45.38 3d9b s LEU 293 CO 0.00 -0.29 1.66 0.00 -0.29 0.00 0.00 176.35 177.42 3d9b n ALA 294 N 5.26 1.87 -1.50 5.97 0.00 0.31 -2.38 120.51 130.04 3d9b n ALA 294 Ca -0.06 0.42 -0.64 0.00 0.00 0.00 0.00 53.44 53.16 3d9b n ALA 294 Cb 0.49 -2.43 -0.11 0.00 0.00 0.00 0.00 19.45 17.41 3d9b n ALA 294 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3d9b n THR 295 N 3.76 0.00 -1.77 0.00 -1.04 -0.76 -2.21 114.28 112.26 3d9b n THR 295 Ca 0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 3d9b n THR 295 Cb 0.31 -0.49 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 3d9b n THR 295 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3d9b n GLY 296 N 5.53 0.55 3.66 3.41 0.00 -1.26 -4.91 105.19 112.16 3d9b n GLY 296 Ca 0.41 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 3d9b n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d9b n ALA 297 N -1.09 -0.84 -1.48 4.61 0.00 -0.94 -5.05 120.51 115.73 3d9b n ALA 297 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.90 3d9b n ALA 297 Cb 0.42 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.69 3d9b n ALA 297 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3d9b n ASN 298 N -4.02 -4.81 -2.98 0.00 5.03 -1.26 -4.80 115.26 102.42 3d9b n ASN 298 Ca 0.12 0.69 0.00 0.00 0.87 0.00 0.00 54.58 56.26 3d9b n ASN 298 Cb 0.52 -2.56 0.00 0.00 -1.02 0.00 0.00 39.78 36.71 3d9b n ASN 298 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3d9b n ALA 299 N 0.68 0.00 -0.24 5.41 0.00 -1.26 -4.42 120.51 120.68 3d9b n ALA 299 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.63 3d9b n ALA 299 Cb 0.00 0.00 0.30 0.00 0.00 0.00 0.00 19.45 19.75 3d9b n ALA 299 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3d9b n LEU 300 N 0.00 0.03 -0.08 0.00 0.00 -1.18 -0.38 117.00 115.40 3d9b n LEU 300 Ca 0.00 0.45 0.02 0.00 0.00 0.00 0.00 56.01 56.48 3d9b n LEU 300 Cb 0.00 -0.22 0.04 0.00 0.00 0.00 0.00 43.42 43.24 3d9b n LEU 300 CO 0.00 -0.47 0.15 0.47 0.00 0.00 0.00 177.39 177.55 3d9b n ASP 301 N -3.02 -0.06 -0.05 1.96 9.92 -1.26 0.29 116.55 124.32 3d9b n ASP 301 Ca 0.17 0.38 -0.13 0.00 -0.53 0.00 0.00 54.79 54.68 3d9b n ASP 301 Cb 0.71 -0.12 -0.07 0.00 -0.64 0.00 0.00 41.12 41.01 3d9b n ASP 301 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3d9b h THR 302 N 0.00 1.33 0.00 -3.53 2.02 -0.92 0.89 112.91 112.70 3d9b h THR 302 Ca 0.11 -1.20 -0.07 0.00 0.77 0.00 0.00 66.41 66.02 3d9b h THR 302 Cb 0.19 1.80 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 3d9b h THR 302 CO -0.22 0.35 -0.32 0.00 0.37 0.00 0.00 175.52 175.70 3d9b h ALA 303 N 0.64 1.12 -0.28 6.16 0.00 -0.08 -2.69 119.26 124.12 3d9b h ALA 303 Ca 0.03 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.48 3d9b h ALA 303 Cb 0.60 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3d9b h ALA 303 CO 0.03 0.41 -0.47 0.00 0.00 0.00 0.00 179.25 179.21 3d9b h ALA 304 N 1.68 0.44 -0.17 0.00 0.00 0.45 -3.14 119.26 118.51 3d9b h ALA 304 Ca -0.00 -0.48 0.05 0.00 0.00 0.00 0.00 54.91 54.47 3d9b h ALA 304 Cb 0.74 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3d9b h ALA 304 CO 0.04 0.59 0.22 0.00 0.00 0.00 0.00 179.25 180.11 3d9b h ALA 305 N 0.67 1.72 0.30 0.00 0.00 0.12 -3.32 119.26 118.75 3d9b h ALA 305 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3d9b h ALA 305 Cb 1.07 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3d9b h ALA 305 CO 0.11 -0.31 -0.14 0.82 0.00 0.00 0.00 179.25 179.73 3d9b h ILE 306 N 0.00 0.00 -0.25 0.00 1.08 -1.49 -2.85 117.51 114.01 3d9b h ILE 306 Ca 0.08 -0.10 0.05 0.00 -0.39 0.00 0.00 64.86 64.50 3d9b h ILE 306 Cb 0.52 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.26 3d9b h ILE 306 CO -0.00 0.00 0.17 -0.09 -0.69 0.00 0.00 178.15 177.54 3d9b h ARG 307 N -0.50 0.09 0.00 2.37 2.43 -1.72 2.44 114.38 119.49 3d9b h ARG 307 Ca -0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3d9b h ARG 307 Cb 0.31 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3d9b h ARG 307 CO 0.07 0.06 0.00 0.00 -1.51 0.00 0.00 179.97 178.59 3d9b n ALA 308 N -2.56 0.00 0.11 2.80 0.00 -1.25 0.53 120.51 120.14 3d9b n ALA 308 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.58 3d9b n ALA 308 Cb 0.26 0.38 0.61 0.00 0.00 0.00 0.00 19.45 20.69 3d9b n ALA 308 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3d9b h GLU 309 N 0.00 0.12 0.00 0.00 4.39 0.35 -2.57 114.58 116.87 3d9b h GLU 309 Ca 0.00 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 3d9b h GLU 309 Cb 0.00 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 3d9b h GLU 309 CO 0.00 0.08 -0.16 -0.07 -1.16 0.00 0.00 179.01 177.70 3d9b h LEU 310 N 0.13 0.00 -2.25 1.33 4.07 0.29 -3.38 115.31 115.48 3d9b h LEU 310 Ca 0.13 -0.55 -0.00 0.00 0.08 0.00 0.00 57.88 57.53 3d9b h LEU 310 Cb 0.35 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.09 3d9b h LEU 310 CO -0.02 0.87 -0.02 0.00 -1.08 0.00 0.00 178.44 178.20 3d9b h ALA 311 N -0.45 1.04 0.00 1.53 0.00 1.32 0.61 119.26 123.32 3d9b h ALA 311 Ca -0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3d9b h ALA 311 Cb 0.67 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 3d9b h ALA 311 CO -0.02 0.02 -0.03 0.87 0.00 0.00 0.00 179.25 180.09 3d9b h LYS 312 N 0.00 0.00 0.00 0.00 1.57 -1.56 -3.24 116.57 113.34 3d9b h LYS 312 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3d9b h LYS 312 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3d9b h LYS 312 CO 0.00 0.03 -1.15 -1.33 -0.57 0.00 0.00 179.45 176.43 3d9b n MET 313 N -3.17 0.50 0.29 3.15 2.81 0.21 -4.45 117.12 116.46 3d9b n MET 313 Ca -0.01 0.03 0.16 0.00 -1.81 0.00 0.00 57.70 56.07 3d9b n MET 313 Cb 0.24 -1.70 0.87 0.00 -0.71 0.00 0.00 33.22 31.92 3d9b n MET 313 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 3d9b h GLU 314 N 0.00 0.00 0.00 0.03 5.08 -1.54 -3.15 114.58 115.00 3d9b h GLU 314 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 3d9b h GLU 314 Cb 0.90 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 3d9b h GLU 314 CO 0.00 0.06 -0.87 -1.00 -1.00 0.00 0.00 179.01 176.19 3d9b h PRO 315 N 0.00 0.00 -0.40 2.33 0.14 -1.80 -3.37 132.00 128.90 3d9b h PRO 315 Ca -0.00 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.14 3d9b h PRO 315 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.36 3d9b h PRO 315 CO 0.01 0.40 0.00 1.19 0.14 0.00 0.00 178.00 179.73 3d9b n PHE 316 N -3.07 0.51 -1.45 1.56 3.01 -1.19 -4.96 117.46 111.87 3d9b n PHE 316 Ca -0.03 -0.26 -0.34 0.00 1.01 0.00 0.00 57.45 57.84 3d9b n PHE 316 Cb 0.77 0.00 0.09 0.00 -0.01 0.00 0.00 39.48 40.32 3d9b n PHE 316 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3d9b s PHE 317 N -1.49 2.15 0.63 1.38 0.08 -1.23 -5.06 117.98 114.45 3d9b s PHE 317 Ca 0.39 1.60 -0.11 0.00 0.12 0.00 0.00 56.93 58.94 3d9b s PHE 317 Cb 0.23 -3.39 0.15 0.00 -0.57 0.00 0.00 43.02 39.43 3d9b s PHE 317 CO 0.32 -2.42 0.82 -0.35 -0.10 0.00 0.00 175.22 173.49 3d9b n PRO 318 N -2.76 -0.97 -1.84 0.24 -0.05 -1.26 -4.96 135.00 123.39 3d9b n PRO 318 Ca 0.13 -1.27 -0.42 0.00 -0.05 0.00 0.00 63.50 61.88 3d9b n PRO 318 Cb 0.51 -0.88 -0.03 0.00 -0.05 0.00 0.00 33.50 33.05 3d9b n PRO 318 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 175.50 173.91 3d9b s SER 319 N -3.98 6.41 0.00 3.54 1.04 -1.26 -3.09 113.70 116.36 3d9b s SER 319 Ca 0.47 2.29 0.00 0.00 0.48 0.00 0.00 55.95 59.19 3d9b s SER 319 Cb -0.02 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.58 3d9b s SER 319 CO 0.33 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 174.03 3d9b n GLY 320 N 4.54 0.97 3.65 7.32 0.00 -1.26 -4.66 105.19 115.74 3d9b n GLY 320 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 3d9b n GLY 320 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3d9b s LEU 321 N 0.00 4.12 -0.19 0.99 1.98 -1.18 0.36 118.68 124.77 3d9b s LEU 321 Ca 0.00 1.81 -0.02 0.00 -2.89 0.00 0.00 54.13 53.03 3d9b s LEU 321 Cb 0.00 -3.53 0.05 0.00 0.66 0.00 0.00 46.19 43.37 3d9b s LEU 321 CO 0.00 -0.98 0.00 -0.75 -1.89 0.00 0.00 176.35 172.73 3d9b s LYS 322 N 4.06 0.97 0.50 1.98 2.20 0.23 -4.92 119.74 124.77 3d9b s LYS 322 Ca 0.66 -0.52 -0.22 0.00 -0.36 0.00 0.00 55.97 55.52 3d9b s LYS 322 Cb -0.26 -2.12 -0.06 0.00 -1.51 0.00 0.00 37.83 33.88 3d9b s LYS 322 CO 0.24 -0.58 1.27 0.42 -0.36 0.00 0.00 175.35 176.35 3d9b s ILE 323 N 1.74 2.56 0.12 5.43 1.01 -1.26 -2.62 121.20 128.18 3d9b s ILE 323 Ca -0.01 0.42 -0.05 0.00 0.00 0.00 0.00 60.65 61.02 3d9b s ILE 323 Cb -0.17 -3.22 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 3d9b s ILE 323 CO -0.07 -0.00 0.13 0.68 0.00 0.00 0.00 174.94 175.67 3d9b s VAL 324 N -1.41 0.12 -0.53 2.92 -7.23 -0.95 -4.96 120.40 108.36 3d9b s VAL 324 Ca 0.67 -1.63 0.04 0.00 -1.81 0.00 0.00 61.98 59.25 3d9b s VAL 324 Cb -0.35 -1.79 0.15 0.00 0.56 0.00 0.00 36.38 34.95 3d9b s VAL 324 CO 0.42 -0.54 0.34 -0.31 -0.31 0.00 0.00 175.10 174.70 3d9b s TYR 325 N -3.97 2.46 -1.28 2.82 1.51 -1.26 -0.94 117.35 116.69 3d9b s TYR 325 Ca 0.16 -2.78 0.26 0.00 -1.01 0.00 0.00 57.07 53.70 3d9b s TYR 325 Cb 0.06 -2.09 0.67 0.00 -0.11 0.00 0.00 41.96 40.50 3d9b s TYR 325 CO -0.03 -0.71 1.52 -0.35 -1.11 0.00 0.00 175.55 174.87 3d9b n PRO 326 N 2.89 0.31 -3.61 -1.71 -0.04 -1.25 -4.87 135.00 126.71 3d9b n PRO 326 Ca 0.15 -0.17 -0.03 0.00 -0.04 0.00 0.00 63.50 63.41 3d9b n PRO 326 Cb 0.37 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.28 3d9b n PRO 326 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 3d9b s TYR 327 N -2.81 -1.09 -0.32 0.54 5.04 -1.25 -4.00 117.35 113.46 3d9b s TYR 327 Ca 0.17 1.99 0.05 0.00 -2.44 0.00 0.00 57.07 56.84 3d9b s TYR 327 Cb 0.18 0.65 0.18 0.00 0.35 0.00 0.00 41.96 43.33 3d9b s TYR 327 CO 0.62 -0.54 0.53 0.34 -1.34 0.00 0.00 175.55 175.16 3d9b s ASP 328 N 2.28 -0.86 -0.16 4.32 2.15 -1.26 -2.14 116.67 121.00 3d9b s ASP 328 Ca -0.07 -0.28 -0.03 0.00 0.43 0.00 0.00 52.55 52.60 3d9b s ASP 328 Cb -0.08 1.66 -0.04 0.00 -0.30 0.00 0.00 42.92 44.16 3d9b s ASP 328 CO -0.19 -0.29 2.74 0.35 -0.17 0.00 0.00 175.17 177.62 3d9b n THR 329 N 5.13 2.78 0.08 1.71 -2.24 -1.20 -3.93 114.28 116.61 3d9b n THR 329 Ca 0.05 -1.60 0.00 0.00 -2.27 0.00 0.00 64.05 60.23 3d9b n THR 329 Cb 0.53 -1.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.09 3d9b n THR 329 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3d9b n THR 330 N 1.50 0.76 -0.39 4.28 -1.04 -1.26 -4.53 114.28 113.60 3d9b n THR 330 Ca 0.31 0.25 0.37 0.00 -2.04 0.00 0.00 64.05 62.94 3d9b n THR 330 Cb 0.67 -1.19 0.73 0.00 -1.82 0.00 0.00 70.33 68.72 3d9b n THR 330 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 3d9b h PRO 331 N 0.00 0.05 0.41 -2.82 0.11 -2.00 0.22 132.00 127.96 3d9b h PRO 331 Ca 0.00 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 3d9b h PRO 331 Cb 0.02 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.12 3d9b h PRO 331 CO 0.00 0.03 -0.19 0.35 -0.21 0.00 0.00 178.00 177.98 3d9b h PHE 332 N 0.05 -0.50 -0.12 0.65 3.57 -1.86 -1.05 116.94 117.67 3d9b h PHE 332 Ca 0.65 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 62.17 3d9b h PHE 332 Cb 2.46 0.17 -0.00 0.00 2.79 0.00 0.00 35.95 41.36 3d9b h PHE 332 CO -0.00 -0.19 0.11 0.28 -2.23 0.00 0.00 178.31 176.28 3d9b h VAL 333 N -0.81 0.70 0.08 1.41 2.07 -0.91 0.31 116.25 119.09 3d9b h VAL 333 Ca -0.06 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.33 3d9b h VAL 333 Cb 0.54 0.92 0.01 0.00 -1.52 0.00 0.00 31.29 31.24 3d9b h VAL 333 CO 0.09 0.00 -0.61 0.50 0.02 0.00 0.00 177.57 177.57 3d9b h LYS 334 N 0.00 0.18 0.00 1.57 3.64 -1.00 -3.19 116.57 117.77 3d9b h LYS 334 Ca 0.06 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 3d9b h LYS 334 Cb 0.27 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3d9b h LYS 334 CO -0.00 1.14 0.00 -0.89 -2.27 0.00 0.00 179.45 177.43 3d9b n ILE 335 N -4.29 0.00 -0.07 2.00 5.41 -0.40 -2.33 119.36 119.68 3d9b n ILE 335 Ca -0.14 0.00 -0.06 0.00 1.00 0.00 0.00 62.75 63.54 3d9b n ILE 335 Cb 0.71 -0.25 -0.02 0.00 -0.71 0.00 0.00 39.64 39.36 3d9b n ILE 335 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 3d9b n SER 336 N -0.75 1.65 -0.07 4.38 2.88 0.10 -3.93 113.62 117.89 3d9b n SER 336 Ca 0.12 0.43 0.01 0.00 -1.33 0.00 0.00 58.87 58.10 3d9b n SER 336 Cb 0.05 -0.77 0.31 0.00 -0.75 0.00 0.00 64.21 63.06 3d9b n SER 336 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 3d9b h ILE 337 N -0.88 1.17 -0.37 2.46 5.03 -1.64 -2.74 117.51 120.54 3d9b h ILE 337 Ca 0.00 -0.49 -0.12 0.00 -0.12 0.00 0.00 64.86 64.13 3d9b h ILE 337 Cb 0.68 0.57 -0.01 0.00 -3.03 0.00 0.00 36.82 35.02 3d9b h ILE 337 CO 0.00 0.20 -0.25 -0.74 -0.68 0.00 0.00 178.15 176.68 3d9b h HIS 338 N 0.68 0.87 0.00 1.37 2.76 -1.69 -2.11 115.15 117.01 3d9b h HIS 338 Ca 0.17 -0.21 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 3d9b h HIS 338 Cb 0.09 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 28.85 3d9b h HIS 338 CO 0.01 0.93 0.00 0.39 -1.30 0.00 0.00 177.93 177.95 3d9b n GLU 339 N -4.10 0.15 -0.01 5.26 -0.58 -1.07 -2.41 120.64 117.88 3d9b n GLU 339 Ca -0.00 0.30 -0.08 0.00 -0.42 0.00 0.00 57.16 56.96 3d9b n GLU 339 Cb 0.45 -1.75 -0.07 0.00 -0.57 0.00 0.00 31.44 29.51 3d9b n GLU 339 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3d9b h VAL 340 N 0.00 0.81 -0.73 2.62 2.07 -1.11 -3.20 116.25 116.71 3d9b h VAL 340 Ca 0.00 -1.42 0.14 0.00 0.82 0.00 0.00 66.70 66.24 3d9b h VAL 340 Cb 0.44 1.47 -0.14 0.00 -1.52 0.00 0.00 31.29 31.55 3d9b h VAL 340 CO 0.00 0.25 -0.24 0.58 0.02 0.00 0.00 177.57 178.18 3d9b h VAL 341 N -0.96 0.21 -0.87 2.57 2.07 -1.35 0.26 116.25 118.17 3d9b h VAL 341 Ca -0.01 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.65 3d9b h VAL 341 Cb 0.49 0.21 -0.15 0.00 -1.52 0.00 0.00 31.29 30.32 3d9b h VAL 341 CO 0.02 0.00 -0.36 0.50 0.02 0.00 0.00 177.57 177.75 3d9b h LYS 342 N -0.05 -0.05 0.00 1.57 3.64 -1.60 0.33 116.57 120.42 3d9b h LYS 342 Ca 0.33 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.65 3d9b h LYS 342 Cb 0.56 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 3d9b h LYS 342 CO -0.77 -0.03 -0.29 1.79 -2.27 0.00 0.00 179.45 177.89 3d9b h THR 343 N -0.05 1.19 -0.30 1.00 1.35 -0.55 -1.92 112.91 113.63 3d9b h THR 343 Ca 0.32 -0.99 0.04 0.00 -0.55 0.00 0.00 66.41 65.23 3d9b h THR 343 Cb 0.59 1.54 -0.04 0.00 -1.73 0.00 0.00 68.15 68.51 3d9b h THR 343 CO -0.90 0.28 0.06 -0.07 -0.25 0.00 0.00 175.52 174.65 3d9b h LEU 344 N 0.00 0.02 -0.06 3.87 3.38 0.12 0.18 115.31 122.82 3d9b h LEU 344 Ca -0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3d9b h LEU 344 Cb 0.52 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 3d9b h LEU 344 CO 0.04 0.05 0.04 0.58 0.09 0.00 0.00 178.44 179.23 3d9b h VAL 345 N 0.17 1.04 -0.29 1.22 2.07 -0.80 -0.13 116.25 119.53 3d9b h VAL 345 Ca 0.14 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.63 3d9b h VAL 345 Cb 0.15 0.99 -0.07 0.00 -1.52 0.00 0.00 31.29 30.84 3d9b h VAL 345 CO -0.18 0.03 -0.17 -0.33 0.02 0.00 0.00 177.57 176.94 3d9b h GLU 346 N 0.06 -0.13 -0.49 1.57 5.08 -1.19 0.37 114.58 119.84 3d9b h GLU 346 Ca 0.02 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.51 3d9b h GLU 346 Cb 0.02 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 3d9b h GLU 346 CO -0.00 -0.09 0.35 0.00 -1.00 0.00 0.00 179.01 178.26 3d9b h ALA 347 N 1.06 2.31 0.22 3.43 0.00 -0.23 0.64 119.26 126.69 3d9b h ALA 347 Ca 0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3d9b h ALA 347 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3d9b h ALA 347 CO -0.38 -0.45 -0.10 0.82 0.00 0.00 0.00 179.25 179.15 3d9b h ILE 348 N 0.11 0.81 -0.69 0.00 2.04 0.15 -2.91 117.51 117.02 3d9b h ILE 348 Ca 0.23 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 65.20 3d9b h ILE 348 Cb 0.78 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 3d9b h ILE 348 CO -0.03 0.18 0.43 0.40 0.00 0.00 0.00 178.15 179.13 3d9b h ILE 349 N -0.79 1.20 0.45 -0.67 2.04 0.03 -1.96 117.51 117.80 3d9b h ILE 349 Ca -0.03 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 3d9b h ILE 349 Cb 0.51 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 3d9b h ILE 349 CO 0.05 0.20 -0.48 -0.07 0.00 0.00 0.00 178.15 177.85 3d9b h LEU 350 N 0.94 -1.31 -0.64 1.44 4.07 -1.03 -2.14 115.31 116.65 3d9b h LEU 350 Ca 0.25 0.11 0.13 0.00 0.08 0.00 0.00 57.88 58.45 3d9b h LEU 350 Cb -0.04 0.44 -0.12 0.00 1.08 0.00 0.00 40.66 42.01 3d9b h LEU 350 CO -0.05 -0.63 -0.12 0.58 -1.08 0.00 0.00 178.44 177.14 3d9b h VAL 351 N -0.94 0.38 -0.83 1.22 2.07 -1.24 0.73 116.25 117.65 3d9b h VAL 351 Ca -0.05 -0.01 0.18 0.00 0.82 0.00 0.00 66.70 67.65 3d9b h VAL 351 Cb 0.83 0.36 -0.11 0.00 -1.52 0.00 0.00 31.29 30.85 3d9b h VAL 351 CO -0.08 0.00 0.32 0.15 0.02 0.00 0.00 177.57 177.99 3d9b h PHE 352 N 0.02 0.54 0.75 1.57 3.04 -1.14 1.03 116.94 122.74 3d9b h PHE 352 Ca 0.31 0.04 -0.04 0.00 3.98 0.00 0.00 57.97 62.27 3d9b h PHE 352 Cb 0.49 -0.11 0.01 0.00 2.56 0.00 0.00 35.95 38.90 3d9b h PHE 352 CO -0.49 -0.02 -0.36 -0.07 -2.02 0.00 0.00 178.31 175.36 3d9b h LEU 353 N 0.40 -0.85 -1.33 0.59 3.38 0.11 0.72 115.31 118.32 3d9b h LEU 353 Ca 0.49 0.01 0.17 0.00 0.09 0.00 0.00 57.88 58.63 3d9b h LEU 353 Cb 0.85 0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.75 3d9b h LEU 353 CO -0.49 -0.55 0.58 0.58 0.09 0.00 0.00 178.44 178.65 3d9b h VAL 354 N -1.10 0.77 -0.46 1.22 2.07 -0.40 0.58 116.25 118.94 3d9b h VAL 354 Ca -0.10 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.21 3d9b h VAL 354 Cb 0.79 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 3d9b h VAL 354 CO 0.17 0.11 0.29 0.24 0.02 0.00 0.00 177.57 178.40 3d9b h MET 355 N 0.61 0.62 -0.09 1.57 2.86 0.13 -3.19 114.93 117.43 3d9b h MET 355 Ca 0.46 -0.05 -0.21 0.00 -2.06 0.00 0.00 59.70 57.85 3d9b h MET 355 Cb 0.87 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.40 3d9b h MET 355 CO -0.21 0.43 -0.79 -0.92 1.06 0.00 0.00 176.91 176.47 3d9b h TYR 356 N 0.62 0.75 -0.11 -0.22 3.20 0.21 -1.86 116.97 119.56 3d9b h TYR 356 Ca 0.17 -0.35 0.04 0.00 3.14 0.00 0.00 58.73 61.73 3d9b h TYR 356 Cb -0.04 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.07 3d9b h TYR 356 CO -0.04 1.14 -0.21 1.25 -1.64 0.00 0.00 178.16 178.66 3d9b h LEU 357 N 0.36 -0.66 0.03 2.82 5.85 -0.13 -3.30 115.31 120.28 3d9b h LEU 357 Ca -0.05 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 3d9b h LEU 357 Cb 1.40 0.29 0.00 0.00 0.37 0.00 0.00 40.66 42.72 3d9b h LEU 357 CO 0.15 -0.27 -0.01 -0.26 -0.34 0.00 0.00 178.44 177.71 3d9b h PHE 358 N -0.28 -0.03 -3.32 1.25 -1.00 -1.51 -3.40 116.94 108.65 3d9b h PHE 358 Ca 0.09 -0.00 -0.58 0.00 2.81 0.00 0.00 57.97 60.29 3d9b h PHE 358 Cb 0.42 0.01 -0.08 0.00 3.61 0.00 0.00 35.95 39.91 3d9b h PHE 358 CO -0.31 -0.02 0.70 -0.51 -1.61 0.00 0.00 178.31 176.56 3d9b s LEU 359 N -4.52 4.00 -1.09 1.54 1.43 -0.71 -4.97 118.68 114.36 3d9b s LEU 359 Ca -0.01 0.97 -0.08 0.00 -1.03 0.00 0.00 54.13 53.99 3d9b s LEU 359 Cb 0.00 -3.40 0.28 0.00 0.03 0.00 0.00 46.19 43.10 3d9b s LEU 359 CO 0.02 -0.77 1.11 0.00 0.23 0.00 0.00 176.35 176.93 3d9b n GLN 360 N 6.59 3.51 -3.53 1.70 6.02 -1.24 -3.90 117.38 126.52 3d9b n GLN 360 Ca 0.09 -4.47 -0.04 0.00 -0.01 0.00 0.00 57.00 52.58 3d9b n GLN 360 Cb 0.47 -2.53 -0.06 0.00 1.02 0.00 0.00 30.24 29.14 3d9b n GLN 360 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 3d9b s ASN 361 N 0.92 -0.73 0.63 1.08 3.84 -1.26 -5.04 114.94 114.38 3d9b s ASN 361 Ca 0.31 1.10 0.41 0.00 0.21 0.00 0.00 52.86 54.88 3d9b s ASN 361 Cb -0.09 1.82 2.13 0.00 -0.55 0.00 0.00 41.25 44.57 3d9b s ASN 361 CO -0.07 -0.24 2.27 0.15 -2.79 0.00 0.00 177.10 176.42 3d9b h PHE 362 N 8.08 0.00 0.00 0.43 -0.00 -1.97 -0.27 116.94 123.20 3d9b h PHE 362 Ca -0.18 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 57.76 3d9b h PHE 362 Cb 1.12 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 37.07 3d9b h PHE 362 CO 0.19 0.00 -0.60 -2.13 -0.00 0.00 0.00 178.31 175.77 3d9b n ARG 363 N -3.13 0.46 -0.34 1.11 0.63 -1.26 -3.70 116.66 110.43 3d9b n ARG 363 Ca -0.02 0.54 0.12 0.00 -0.92 0.00 0.00 57.85 57.57 3d9b n ARG 363 Cb 0.13 -1.70 0.24 0.00 0.45 0.00 0.00 32.46 31.58 3d9b n ARG 363 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3d9b n ALA 364 N -3.60 0.42 0.28 5.13 0.00 -1.10 0.22 120.51 121.86 3d9b n ALA 364 Ca -0.10 1.05 0.14 0.00 0.00 0.00 0.00 53.44 54.54 3d9b n ALA 364 Cb 0.31 -0.73 0.83 0.00 0.00 0.00 0.00 19.45 19.87 3d9b n ALA 364 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d9b h THR 365 N 0.00 0.52 0.00 0.00 1.03 -1.24 -1.78 112.91 111.45 3d9b h THR 365 Ca 0.56 -0.27 -0.07 0.00 -0.01 0.00 0.00 66.41 66.62 3d9b h THR 365 Cb 1.07 1.17 -0.01 0.00 -1.07 0.00 0.00 68.15 69.31 3d9b h THR 365 CO -0.94 0.06 -0.34 0.25 -0.01 0.00 0.00 175.52 174.53 3d9b h LEU 366 N 0.00 0.00 0.00 0.00 5.85 0.25 -3.22 115.31 118.19 3d9b h LEU 366 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3d9b h LEU 366 Cb 0.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.20 3d9b h LEU 366 CO 0.01 0.34 0.00 -0.38 -0.34 0.00 0.00 178.44 178.07 3d9b n ILE 367 N -3.29 0.00 0.31 4.05 5.41 -0.67 0.33 119.36 125.51 3d9b n ILE 367 Ca 0.01 1.31 0.17 0.00 1.00 0.00 0.00 62.75 65.25 3d9b n ILE 367 Cb 0.59 -2.22 1.01 0.00 -0.71 0.00 0.00 39.64 38.30 3d9b n ILE 367 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 3d9b h PRO 368 N 0.00 0.00 0.56 0.38 0.13 -1.74 0.24 132.00 131.58 3d9b h PRO 368 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 3d9b h PRO 368 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3d9b h PRO 368 CO 0.00 0.00 -0.29 1.15 -0.23 0.00 0.00 178.00 178.63 3d9b h THR 369 N 0.00 0.40 -0.83 1.56 2.02 -1.51 -2.93 112.91 111.62 3d9b h THR 369 Ca 0.00 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.26 3d9b h THR 369 Cb 0.01 0.40 -0.06 0.00 -1.74 0.00 0.00 68.15 66.77 3d9b h THR 369 CO -0.00 0.00 0.54 0.40 0.37 0.00 0.00 175.52 176.83 3d9b h ILE 370 N -0.79 1.02 -0.63 3.11 2.04 0.31 -3.05 117.51 119.53 3d9b h ILE 370 Ca -0.07 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.49 3d9b h ILE 370 Cb 0.61 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 3d9b h ILE 370 CO 0.11 0.16 0.40 0.00 0.00 0.00 0.00 178.15 178.82 3d9b h ALA 371 N 1.56 1.53 0.65 1.87 0.00 -0.98 -3.31 119.26 120.57 3d9b h ALA 371 Ca 0.37 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 3d9b h ALA 371 Cb 0.29 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.84 3d9b h ALA 371 CO -0.14 0.43 -0.31 0.28 0.00 0.00 0.00 179.25 179.51 3d9b h VAL 372 N 0.86 0.00 -0.28 0.00 2.07 -1.46 -2.97 116.25 114.46 3d9b h VAL 372 Ca 0.23 -0.31 0.06 0.00 0.82 0.00 0.00 66.70 67.50 3d9b h VAL 372 Cb -0.08 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.64 3d9b h VAL 372 CO -0.05 0.00 -0.07 1.55 0.02 0.00 0.00 177.57 179.02 3d9b h PRO 373 N -1.18 -0.00 -0.88 1.57 0.13 -1.74 0.11 132.00 130.00 3d9b h PRO 373 Ca -0.09 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.14 3d9b h PRO 373 Cb 0.67 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.68 3d9b h PRO 373 CO 0.15 -0.00 -0.47 0.28 -0.23 0.00 0.00 178.00 177.73 3d9b n VAL 374 N -5.24 -0.56 -0.07 1.56 0.31 -1.25 0.15 118.33 113.23 3d9b n VAL 374 Ca -0.01 2.12 -0.10 0.00 -0.01 0.00 0.00 64.34 66.34 3d9b n VAL 374 Cb 0.16 -2.67 -0.03 0.00 -0.91 0.00 0.00 33.84 30.39 3d9b n VAL 374 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3d9b h VAL 375 N 0.00 1.15 0.72 2.52 2.07 -0.78 -0.58 116.25 121.35 3d9b h VAL 375 Ca 0.19 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 3d9b h VAL 375 Cb 0.41 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 3d9b h VAL 375 CO -0.85 0.15 -0.50 -0.07 0.02 0.00 0.00 177.57 176.33 3d9b h LEU 376 N 0.26 -1.30 -0.88 2.57 4.07 0.16 -1.37 115.31 118.82 3d9b h LEU 376 Ca 0.08 0.08 0.10 0.00 0.08 0.00 0.00 57.88 58.23 3d9b h LEU 376 Cb 0.14 0.40 -0.12 0.00 1.08 0.00 0.00 40.66 42.15 3d9b h LEU 376 CO -0.01 -0.74 -0.45 0.18 -1.08 0.00 0.00 178.44 176.35 3d9b n LEU 377 N -5.61 -0.78 -0.29 1.67 4.77 0.40 0.17 117.00 117.34 3d9b n LEU 377 Ca -0.14 1.56 0.26 0.00 -0.03 0.00 0.00 56.01 57.65 3d9b n LEU 377 Cb 0.50 -0.27 0.59 0.00 -2.33 0.00 0.00 43.42 41.91 3d9b n LEU 377 CO 0.33 -1.32 1.25 1.23 -1.33 0.00 0.00 177.39 177.54 3d9b h GLY 378 N 0.00 0.72 0.63 -0.72 0.00 -0.23 -2.50 103.07 100.98 3d9b h GLY 378 Ca 0.21 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 3d9b h GLY 378 CO -0.85 -0.07 -0.20 -0.84 0.00 0.00 0.00 176.54 174.58 3d9b h THR 379 N 0.25 0.43 -1.42 4.70 2.02 0.77 -2.78 112.91 116.88 3d9b h THR 379 Ca 0.54 -0.55 0.42 0.00 0.77 0.00 0.00 66.41 67.60 3d9b h THR 379 Cb 1.65 0.63 -0.08 0.00 -1.74 0.00 0.00 68.15 68.61 3d9b h THR 379 CO -0.17 0.08 0.99 -0.26 0.37 0.00 0.00 175.52 176.52 3d9b h PHE 380 N -0.95 0.22 0.42 3.16 -1.00 -1.36 0.27 116.94 117.71 3d9b h PHE 380 Ca -0.06 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.71 3d9b h PHE 380 Cb 0.56 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 40.07 3d9b h PHE 380 CO 0.02 -0.05 -0.20 0.00 -1.61 0.00 0.00 178.31 176.47 3d9b h ALA 381 N 1.37 -1.08 -0.86 2.45 0.00 -1.49 0.22 119.26 119.87 3d9b h ALA 381 Ca 0.74 -0.12 0.21 0.00 0.00 0.00 0.00 54.91 55.73 3d9b h ALA 381 Cb 2.67 0.22 -0.12 0.00 0.00 0.00 0.00 17.79 20.56 3d9b h ALA 381 CO -0.15 -1.04 0.34 0.28 0.00 0.00 0.00 179.25 178.67 3d9b h VAL 382 N -0.60 0.48 0.32 0.00 2.07 -0.33 0.14 116.25 118.34 3d9b h VAL 382 Ca -0.06 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 3d9b h VAL 382 Cb 0.44 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 3d9b h VAL 382 CO 0.10 0.07 -0.33 -0.07 0.02 0.00 0.00 177.57 177.35 3d9b h LEU 383 N 0.37 -0.91 -0.48 2.57 3.38 -0.82 -2.34 115.31 117.07 3d9b h LEU 383 Ca 0.52 0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.65 3d9b h LEU 383 Cb 0.97 0.31 -0.10 0.00 0.09 0.00 0.00 40.66 41.93 3d9b h LEU 383 CO -0.53 -0.47 -0.42 0.00 0.09 0.00 0.00 178.44 177.11 3d9b h ALA 384 N -0.18 -0.35 0.00 1.53 0.00 0.14 -0.86 119.26 119.54 3d9b h ALA 384 Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3d9b h ALA 384 Cb 0.63 0.90 0.00 0.00 0.00 0.00 0.00 17.79 19.32 3d9b h ALA 384 CO -0.07 -0.83 0.00 0.00 0.00 0.00 0.00 179.25 178.35 3d9b n ALA 385 N -3.10 1.97 -0.05 0.00 0.00 0.30 -2.45 120.51 117.18 3d9b n ALA 385 Ca 0.01 -0.08 -0.06 0.00 0.00 0.00 0.00 53.44 53.31 3d9b n ALA 385 Cb 0.35 -1.20 -0.06 0.00 0.00 0.00 0.00 19.45 18.54 3d9b n ALA 385 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3d9b n PHE 386 N -0.99 0.00 0.00 0.00 0.99 -0.43 -5.06 117.46 111.97 3d9b n PHE 386 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.54 3d9b n PHE 386 Cb 0.04 -0.43 0.00 0.00 -1.00 0.00 0.00 39.48 38.10 3d9b n PHE 386 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3d9b n GLY 387 N 2.76 1.13 3.43 1.37 0.00 -0.58 -5.11 105.19 108.19 3d9b n GLY 387 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 3d9b n GLY 387 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d9b s PHE 388 N -2.00 2.77 0.42 1.61 0.40 -1.17 -5.07 117.98 114.94 3d9b s PHE 388 Ca 0.00 -0.38 -0.15 0.00 -0.60 0.00 0.00 56.93 55.80 3d9b s PHE 388 Cb 0.00 -1.74 -0.08 0.00 0.51 0.00 0.00 43.02 41.71 3d9b s PHE 388 CO 0.00 0.01 0.85 -1.54 0.70 0.00 0.00 175.22 175.24 3d9b s SER 389 N -0.22 6.67 -1.12 1.36 1.04 -1.26 -4.50 113.70 115.66 3d9b s SER 389 Ca 0.01 1.38 -0.23 0.00 0.48 0.00 0.00 55.95 57.59 3d9b s SER 389 Cb -0.13 -2.42 -0.06 0.00 0.10 0.00 0.00 66.02 63.50 3d9b s SER 389 CO 0.03 -0.40 1.91 -0.63 0.98 0.00 0.00 173.24 175.13 3d9b s ILE 390 N -2.33 3.57 0.33 -1.02 1.01 0.25 -4.82 121.20 118.20 3d9b s ILE 390 Ca 0.56 -0.86 0.10 0.00 0.00 0.00 0.00 60.65 60.45 3d9b s ILE 390 Cb -0.10 -4.50 -0.06 0.00 0.01 0.00 0.00 42.46 37.82 3d9b s ILE 390 CO 0.25 -1.07 -0.09 0.54 0.00 0.00 0.00 174.94 174.57 3d9b s ASN 391 N 6.66 3.82 0.27 3.58 2.20 -1.26 -3.58 114.94 126.62 3d9b s ASN 391 Ca 0.67 -1.12 -0.09 0.00 -0.94 0.00 0.00 52.86 51.38 3d9b s ASN 391 Cb -0.02 -0.39 0.42 0.00 -2.00 0.00 0.00 41.25 39.27 3d9b s ASN 391 CO 0.09 -0.17 1.52 0.41 -2.94 0.00 0.00 177.10 176.01 3d9b n THR 392 N -0.80 -0.42 0.05 0.54 -1.04 -0.35 -0.07 114.28 112.19 3d9b n THR 392 Ca -0.05 2.23 -0.13 0.00 -2.04 0.00 0.00 64.05 64.07 3d9b n THR 392 Cb 0.63 -3.07 -0.08 0.00 -1.82 0.00 0.00 70.33 65.98 3d9b n THR 392 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3d9b h LEU 393 N 0.00 -0.08 -0.90 -4.42 3.38 -1.94 -2.54 115.31 108.82 3d9b h LEU 393 Ca 0.45 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 58.28 3d9b h LEU 393 Cb 0.69 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.41 3d9b h LEU 393 CO -1.00 0.14 0.58 0.74 0.09 0.00 0.00 178.44 178.98 3d9b h THR 394 N -0.31 1.12 -0.54 0.22 2.02 -0.72 -1.23 112.91 113.46 3d9b h THR 394 Ca -0.01 -0.37 -0.04 0.00 0.77 0.00 0.00 66.41 66.76 3d9b h THR 394 Cb 0.26 -0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 3d9b h THR 394 CO 0.02 0.20 0.19 0.24 0.37 0.00 0.00 175.52 176.54 3d9b h MET 395 N 1.09 0.80 0.21 6.66 2.86 -0.47 -0.27 114.93 125.81 3d9b h MET 395 Ca 0.37 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.87 3d9b h MET 395 Cb 0.06 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.59 3d9b h MET 395 CO -0.14 0.67 -0.10 0.74 1.06 0.00 0.00 176.91 179.14 3d9b h PHE 396 N 0.78 -0.26 -0.80 -0.22 0.05 -0.99 -2.57 116.94 112.93 3d9b h PHE 396 Ca 0.18 -0.01 0.19 0.00 3.82 0.00 0.00 57.97 62.16 3d9b h PHE 396 Cb 0.19 0.09 -0.15 0.00 2.00 0.00 0.00 35.95 38.08 3d9b h PHE 396 CO 0.01 0.06 -0.10 0.41 -0.18 0.00 0.00 178.31 178.52 3d9b n GLY 397 N -0.31 -1.23 0.32 -1.45 0.00 -0.52 0.35 105.19 102.35 3d9b n GLY 397 Ca -0.09 0.83 -0.06 0.00 0.00 0.00 0.00 46.02 46.70 3d9b n GLY 397 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3d9b h MET 398 N 0.00 1.09 -0.13 1.61 2.86 -0.78 0.14 114.93 119.72 3d9b h MET 398 Ca 0.44 -0.16 -0.16 0.00 -2.06 0.00 0.00 59.70 57.75 3d9b h MET 398 Cb 0.79 -0.20 0.01 0.00 0.06 0.00 0.00 31.60 32.26 3d9b h MET 398 CO -0.79 0.85 -0.55 0.28 1.06 0.00 0.00 176.91 177.75 3d9b h VAL 399 N 1.07 1.34 -0.30 -2.22 2.07 0.29 -2.93 116.25 115.57 3d9b h VAL 399 Ca 0.26 -1.83 0.07 0.00 0.82 0.00 0.00 66.70 66.02 3d9b h VAL 399 Cb 0.12 2.08 -0.07 0.00 -1.52 0.00 0.00 31.29 31.90 3d9b h VAL 399 CO -0.03 0.56 -0.21 -0.07 0.02 0.00 0.00 177.57 177.84 3d9b h LEU 400 N 0.26 -0.69 -1.43 2.57 3.38 -0.72 -2.74 115.31 115.94 3d9b h LEU 400 Ca -0.03 0.14 0.29 0.00 0.09 0.00 0.00 57.88 58.37 3d9b h LEU 400 Cb 1.19 0.34 -0.09 0.00 0.09 0.00 0.00 40.66 42.19 3d9b h LEU 400 CO 0.12 -0.24 0.70 0.00 0.09 0.00 0.00 178.44 179.11 3d9b h ALA 401 N 0.96 2.37 -0.91 1.53 0.00 -0.78 -1.91 119.26 120.53 3d9b h ALA 401 Ca 0.16 0.06 0.17 0.00 0.00 0.00 0.00 54.91 55.29 3d9b h ALA 401 Cb 0.42 0.05 -0.16 0.00 0.00 0.00 0.00 17.79 18.11 3d9b h ALA 401 CO -0.41 -0.79 -0.29 0.82 0.00 0.00 0.00 179.25 178.57 3d9b h ILE 402 N 0.32 0.06 -0.23 0.00 2.04 -1.36 0.49 117.51 118.84 3d9b h ILE 402 Ca 0.61 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.51 3d9b h ILE 402 Cb 1.69 0.06 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 3d9b h ILE 402 CO -0.28 0.00 -0.41 1.23 0.00 0.00 0.00 178.15 178.69 3d9b h GLY 403 N -0.02 -1.24 1.51 5.37 0.00 -1.53 3.00 103.07 110.16 3d9b h GLY 403 Ca 0.39 0.73 0.00 0.00 0.00 0.00 0.00 47.33 48.44 3d9b h GLY 403 CO -0.93 -0.29 0.00 1.04 0.00 0.00 0.00 176.54 176.36 3d9b n LEU 404 N -4.69 0.00 -0.04 3.11 4.77 0.61 -1.47 117.00 119.28 3d9b n LEU 404 Ca -0.03 0.26 -0.04 0.00 -0.03 0.00 0.00 56.01 56.16 3d9b n LEU 404 Cb 0.26 -0.26 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 3d9b n LEU 404 CO 0.03 -0.11 -0.29 -0.11 -1.33 0.00 0.00 177.39 175.57 3d9b n LEU 405 N -1.26 0.92 -0.27 2.23 0.00 0.14 -4.47 117.00 114.30 3d9b n LEU 405 Ca 0.09 0.21 0.08 0.00 0.00 0.00 0.00 56.01 56.39 3d9b n LEU 405 Cb 0.13 -0.63 0.22 0.00 0.00 0.00 0.00 43.42 43.14 3d9b n LEU 405 CO 0.13 -0.41 0.93 -0.37 0.00 0.00 0.00 177.39 177.67 3d9b h VAL 406 N -0.48 0.43 -0.52 1.96 -1.51 0.55 0.20 116.25 116.89 3d9b h VAL 406 Ca 0.00 -0.08 0.05 0.00 -1.23 0.00 0.00 66.70 65.44 3d9b h VAL 406 Cb 0.43 0.17 -0.07 0.00 -2.13 0.00 0.00 31.29 29.69 3d9b h VAL 406 CO 0.00 0.04 -0.42 -0.78 -1.23 0.00 0.00 177.57 175.18 3d9b h ASP 407 N 0.24 -1.48 -0.77 4.19 1.82 -1.41 -1.74 116.42 117.26 3d9b h ASP 407 Ca 0.46 0.21 0.15 0.00 -0.39 0.00 0.00 57.03 57.47 3d9b h ASP 407 Cb 0.84 0.63 -0.15 0.00 0.68 0.00 0.00 39.33 41.34 3d9b h ASP 407 CO -0.57 -0.23 -0.21 0.44 -1.61 0.00 0.00 179.24 177.06 3d9b h ASP 408 N -0.15 -0.76 -0.28 2.28 3.32 -0.81 -0.38 116.42 119.64 3d9b h ASP 408 Ca 0.08 0.23 0.04 0.00 0.02 0.00 0.00 57.03 57.41 3d9b h ASP 408 Cb 0.37 0.49 -0.04 0.00 0.22 0.00 0.00 39.33 40.37 3d9b h ASP 408 CO -0.56 -0.26 0.03 0.00 -1.72 0.00 0.00 179.24 176.72 3d9b h ALA 409 N 1.73 0.27 0.53 3.45 0.00 -1.23 -2.93 119.26 121.08 3d9b h ALA 409 Ca 0.37 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 3d9b h ALA 409 Cb 0.57 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3d9b h ALA 409 CO -0.80 -0.39 -0.40 0.82 0.00 0.00 0.00 179.25 178.48 3d9b h ILE 410 N 0.12 0.19 -0.75 0.00 2.04 -0.62 -2.37 117.51 116.11 3d9b h ILE 410 Ca 0.13 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.14 3d9b h ILE 410 Cb 0.16 0.19 -0.14 0.00 -0.74 0.00 0.00 36.82 36.28 3d9b h ILE 410 CO -0.20 0.00 -0.20 0.58 0.00 0.00 0.00 178.15 178.33 3d9b h VAL 411 N -0.91 0.24 -0.15 1.67 2.07 -1.34 1.32 116.25 119.14 3d9b h VAL 411 Ca -0.06 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.49 3d9b h VAL 411 Cb 0.77 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3d9b h VAL 411 CO 0.01 0.00 -0.04 0.58 0.02 0.00 0.00 177.57 178.14 3d9b h VAL 412 N -0.01 0.84 0.28 2.57 2.07 -1.33 0.16 116.25 120.83 3d9b h VAL 412 Ca 0.36 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.86 3d9b h VAL 412 Cb 0.55 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 3d9b h VAL 412 CO -0.78 0.00 -0.14 0.58 0.02 0.00 0.00 177.57 177.26 3d9b h VAL 413 N -0.01 0.64 -0.16 2.57 2.07 -0.44 -3.18 116.25 117.74 3d9b h VAL 413 Ca 0.08 -0.79 0.05 0.00 0.82 0.00 0.00 66.70 66.86 3d9b h VAL 413 Cb 0.12 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.82 3d9b h VAL 413 CO -0.16 0.14 -0.30 -0.08 0.02 0.00 0.00 177.57 177.18 3d9b h GLU 414 N -0.87 -0.35 -0.37 1.57 4.57 0.17 0.12 114.58 119.41 3d9b h GLU 414 Ca -0.04 0.02 0.11 0.00 -1.18 0.00 0.00 59.36 58.27 3d9b h GLU 414 Cb 0.51 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 3d9b h GLU 414 CO 0.06 -0.23 0.27 -0.97 -1.18 0.00 0.00 179.01 176.96 3d9b h ASN 415 N -0.36 0.00 0.00 1.04 -1.24 -0.79 1.53 115.58 115.77 3d9b h ASN 415 Ca 0.11 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.09 3d9b h ASN 415 Cb 0.53 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.58 3d9b h ASN 415 CO -0.37 0.00 -0.09 0.58 -1.29 0.00 0.00 177.43 176.26 3d9b h VAL 416 N 0.00 1.61 -1.00 2.57 2.07 -1.31 0.55 116.25 120.74 3d9b h VAL 416 Ca 0.18 -1.93 0.22 0.00 0.82 0.00 0.00 66.70 65.99 3d9b h VAL 416 Cb 0.72 2.89 -0.10 0.00 -1.52 0.00 0.00 31.29 33.28 3d9b h VAL 416 CO -0.00 0.51 0.63 -0.33 0.02 0.00 0.00 177.57 178.39 3d9b h GLU 417 N -0.70 0.55 0.00 1.57 4.39 0.13 0.39 114.58 120.91 3d9b h GLU 417 Ca -0.01 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.65 3d9b h GLU 417 Cb 0.89 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 3d9b h GLU 417 CO 0.02 0.36 0.00 -2.13 -1.16 0.00 0.00 179.01 176.10 3d9b n ARG 418 N -4.70 0.00 -0.32 2.33 0.63 0.50 -2.35 116.66 112.75 3d9b n ARG 418 Ca 0.24 0.42 0.16 0.00 -0.92 0.00 0.00 57.85 57.75 3d9b n ARG 418 Cb 0.72 -1.38 0.32 0.00 0.45 0.00 0.00 32.46 32.57 3d9b n ARG 418 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3d9b h VAL 419 N 0.00 0.14 -0.66 5.15 2.07 0.14 0.68 116.25 123.77 3d9b h VAL 419 Ca 0.00 -0.03 -0.09 0.00 0.82 0.00 0.00 66.70 67.41 3d9b h VAL 419 Cb 0.00 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 29.79 3d9b h VAL 419 CO 0.00 0.01 0.07 0.24 0.02 0.00 0.00 177.57 177.92 3d9b h MET 420 N 0.08 1.11 0.00 1.57 2.86 -0.40 0.15 114.93 120.31 3d9b h MET 420 Ca 0.60 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 3d9b h MET 420 Cb 1.28 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.82 3d9b h MET 420 CO -0.80 1.04 0.00 0.00 1.06 0.00 0.00 176.91 178.21 3d9b h ALA 421 N 1.03 1.00 0.00 6.32 0.00 0.69 -2.60 119.26 125.71 3d9b h ALA 421 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.81 3d9b h ALA 421 Cb 0.49 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3d9b h ALA 421 CO 0.02 0.00 -2.10 0.39 0.00 0.00 0.00 179.25 177.56 3d9b n GLU 422 N -3.02 1.17 -0.04 0.00 1.02 -0.31 -1.55 120.64 117.92 3d9b n GLU 422 Ca 0.00 0.03 -0.05 0.00 -0.02 0.00 0.00 57.16 57.12 3d9b n GLU 422 Cb 0.26 -1.40 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 3d9b n GLU 422 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3d9b n GLU 423 N -2.72 2.21 0.00 3.49 1.02 0.43 -4.78 120.64 120.29 3d9b n GLU 423 Ca -0.28 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 56.86 3d9b n GLU 423 Cb 0.98 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 31.19 3d9b n GLU 423 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d9b n GLY 424 N 2.59 0.82 3.72 0.62 0.00 -0.98 -4.76 105.19 107.20 3d9b n GLY 424 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 3d9b n GLY 424 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d9b s LEU 425 N 0.00 4.38 0.59 0.99 1.02 -1.26 -4.59 118.68 119.81 3d9b s LEU 425 Ca 0.00 2.25 -0.19 0.00 0.02 0.00 0.00 54.13 56.21 3d9b s LEU 425 Cb 0.00 -3.59 -0.05 0.00 0.02 0.00 0.00 46.19 42.57 3d9b s LEU 425 CO 0.00 -0.58 0.97 -2.65 0.02 0.00 0.00 176.35 174.11 3d9b n PRO 426 N 3.71 0.94 -0.30 1.29 -0.02 -1.26 -4.11 135.00 135.25 3d9b n PRO 426 Ca 0.10 0.36 0.06 0.00 -2.02 0.00 0.00 63.50 62.00 3d9b n PRO 426 Cb 0.43 -2.16 0.14 0.00 -0.02 0.00 0.00 33.50 31.90 3d9b n PRO 426 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3d9b n PRO 427 N -0.91 -0.08 0.00 0.52 -0.02 -1.26 0.79 135.00 134.05 3d9b n PRO 427 Ca 0.13 1.32 -0.12 0.00 -2.02 0.00 0.00 63.50 62.81 3d9b n PRO 427 Cb 0.47 -1.99 -0.08 0.00 -0.02 0.00 0.00 33.50 31.88 3d9b n PRO 427 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3d9b h LYS 428 N 0.00 0.05 -0.21 -0.52 3.64 -1.87 -2.44 116.57 115.23 3d9b h LYS 428 Ca 0.43 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.69 3d9b h LYS 428 Cb 0.69 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.50 3d9b h LYS 428 CO -0.87 0.25 -0.29 1.49 -2.27 0.00 0.00 179.45 177.76 3d9b h GLU 429 N -0.16 0.57 -0.69 1.90 4.57 -1.24 -3.16 114.58 116.37 3d9b h GLU 429 Ca 0.01 -0.33 0.01 0.00 -1.18 0.00 0.00 59.36 57.87 3d9b h GLU 429 Cb 0.22 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.80 3d9b h GLU 429 CO -0.00 0.93 0.45 0.00 -1.18 0.00 0.00 179.01 179.21 3d9b h ALA 430 N 0.63 0.88 -0.01 2.92 0.00 0.34 -2.47 119.26 121.55 3d9b h ALA 430 Ca 0.02 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3d9b h ALA 430 Cb 0.87 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3d9b h ALA 430 CO 0.07 0.27 -0.44 0.00 0.00 0.00 0.00 179.25 179.15 3d9b h THR 431 N 0.91 1.32 0.71 0.00 1.03 -1.51 0.22 112.91 115.59 3d9b h THR 431 Ca 0.26 -1.52 -0.03 0.00 -0.01 0.00 0.00 66.41 65.11 3d9b h THR 431 Cb -0.07 1.81 -0.00 0.00 -1.07 0.00 0.00 68.15 68.81 3d9b h THR 431 CO -0.07 0.44 -0.42 0.03 -0.01 0.00 0.00 175.52 175.48 3d9b h ARG 432 N 0.02 -1.03 0.00 0.00 3.08 -1.41 0.61 114.38 115.65 3d9b h ARG 432 Ca -0.00 0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 3d9b h ARG 432 Cb 0.79 0.23 -0.00 0.00 0.08 0.00 0.00 29.97 31.07 3d9b h ARG 432 CO 0.06 -0.68 -0.11 0.87 -1.07 0.00 0.00 179.97 179.03 3d9b h LYS 433 N -1.07 0.00 0.00 0.04 1.79 -1.22 -2.08 116.57 114.03 3d9b h LYS 433 Ca -0.09 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.38 3d9b h LYS 433 Cb 0.85 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.50 3d9b h LYS 433 CO 0.10 0.11 -0.00 1.03 -1.08 0.00 0.00 179.45 179.61 3d9b h SER 434 N 0.00 -0.00 0.56 0.86 0.87 -0.34 -3.32 113.55 112.19 3d9b h SER 434 Ca -0.00 -0.52 -0.19 0.00 -1.23 0.00 0.00 61.79 59.85 3d9b h SER 434 Cb 0.20 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 3d9b h SER 434 CO 0.01 0.52 -0.85 0.24 -0.53 0.00 0.00 176.83 176.23 3d9b h MET 435 N -0.53 0.20 0.00 2.24 2.86 0.69 -1.83 114.93 118.56 3d9b h MET 435 Ca -0.00 -0.21 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 3d9b h MET 435 Cb 0.52 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.24 3d9b h MET 435 CO 0.00 0.93 0.00 0.41 1.06 0.00 0.00 176.91 179.31 3d9b n GLY 436 N 0.81 -0.81 0.03 8.32 0.00 -0.82 -1.43 105.19 111.27 3d9b n GLY 436 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 3d9b n GLY 436 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3d9b n GLN 437 N -0.50 1.96 0.00 1.61 0.00 -0.71 -4.69 117.38 115.05 3d9b n GLN 437 Ca 0.00 -0.03 0.04 0.00 -0.00 0.00 0.00 57.00 57.01 3d9b n GLN 437 Cb 0.00 -1.19 -0.01 0.00 0.00 0.00 0.00 30.24 29.03 3d9b n GLN 437 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.06 177.50 3d9b n ILE 438 N -2.12 0.00 0.00 1.69 -5.35 -1.09 -4.89 119.36 107.60 3d9b n ILE 438 Ca -0.09 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.00 3d9b n ILE 438 Cb 0.57 1.06 0.00 0.00 -1.74 0.00 0.00 39.64 39.53 3d9b n ILE 438 CO 0.00 0.00 0.00 1.67 -1.76 0.00 0.00 176.55 176.46 3d9b n GLN 439 N -0.60 0.00 0.28 6.28 7.27 -0.52 -2.18 117.38 127.91 3d9b n GLN 439 Ca 0.03 0.57 0.16 0.00 0.07 0.00 0.00 57.00 57.82 3d9b n GLN 439 Cb 0.14 -1.04 0.87 0.00 2.41 0.00 0.00 30.24 32.62 3d9b n GLN 439 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 3d9b h GLY 440 N 0.00 0.00 0.73 1.69 0.00 -1.90 -0.52 103.07 103.07 3d9b h GLY 440 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3d9b h GLY 440 CO 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 176.54 176.45 3d9b h ALA 441 N 1.74 0.19 -0.29 3.60 0.00 -1.79 -2.92 119.26 119.80 3d9b h ALA 441 Ca 0.00 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 3d9b h ALA 441 Cb 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3d9b h ALA 441 CO 0.00 0.01 -0.23 -0.07 0.00 0.00 0.00 179.25 178.96 3d9b h LEU 442 N -0.06 0.55 -0.02 0.00 3.38 -0.79 -0.31 115.31 118.06 3d9b h LEU 442 Ca 0.03 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3d9b h LEU 442 Cb 0.57 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 3d9b h LEU 442 CO 0.02 0.77 -0.01 0.58 0.09 0.00 0.00 178.44 179.90 3d9b h VAL 443 N 0.48 1.33 -0.68 1.22 2.07 -1.62 -2.70 116.25 116.35 3d9b h VAL 443 Ca 0.07 -0.99 0.08 0.00 0.82 0.00 0.00 66.70 66.69 3d9b h VAL 443 Cb 0.66 1.96 -0.07 0.00 -1.52 0.00 0.00 31.29 32.32 3d9b h VAL 443 CO 0.05 0.26 0.35 1.23 0.02 0.00 0.00 177.57 179.47 3d9b h GLY 444 N -0.36 1.01 0.14 2.17 0.00 -1.42 -2.34 103.07 102.27 3d9b h GLY 444 Ca 0.00 -0.22 0.17 0.00 0.00 0.00 0.00 47.33 47.28 3d9b h GLY 444 CO 0.00 0.08 0.49 -2.22 0.00 0.00 0.00 176.54 174.90 3d9b h ILE 445 N 0.61 0.69 0.00 2.60 5.03 -0.96 0.23 117.51 125.71 3d9b h ILE 445 Ca 0.33 -0.22 -0.02 0.00 -0.12 0.00 0.00 64.86 64.82 3d9b h ILE 445 Cb 0.31 -0.01 -0.00 0.00 -3.03 0.00 0.00 36.82 34.08 3d9b h ILE 445 CO -0.24 0.12 -0.10 0.00 -0.68 0.00 0.00 178.15 177.24 3d9b h ALA 446 N 1.61 1.12 0.08 1.87 0.00 -1.08 -2.76 119.26 120.09 3d9b h ALA 446 Ca 0.52 -0.10 -0.24 0.00 0.00 0.00 0.00 54.91 55.09 3d9b h ALA 446 Cb 0.79 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3d9b h ALA 446 CO -0.39 0.13 -1.27 0.52 0.00 0.00 0.00 179.25 178.24 3d9b h MET 447 N 0.00 0.17 0.00 0.00 2.86 -0.88 -2.66 114.93 114.42 3d9b h MET 447 Ca -0.00 -0.29 -0.03 0.00 -2.06 0.00 0.00 59.70 57.32 3d9b h MET 447 Cb 0.44 0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.21 3d9b h MET 447 CO 0.01 1.14 -0.13 -0.39 1.06 0.00 0.00 176.91 178.60 3d9b h VAL 448 N -0.50 0.44 0.13 -2.22 -1.51 -1.43 -1.05 116.25 110.11 3d9b h VAL 448 Ca -0.29 -0.71 -0.31 0.00 -1.23 0.00 0.00 66.70 64.16 3d9b h VAL 448 Cb 1.61 1.50 -0.00 0.00 -2.13 0.00 0.00 31.29 32.26 3d9b h VAL 448 CO -0.00 0.13 -1.58 -0.07 -1.23 0.00 0.00 177.57 174.82 3d9b h LEU 449 N 0.00 0.44 -1.67 4.19 4.07 -1.63 -3.27 115.31 117.44 3d9b h LEU 449 Ca -0.00 -0.88 0.00 0.00 0.08 0.00 0.00 57.88 57.08 3d9b h LEU 449 Cb 0.49 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.09 3d9b h LEU 449 CO 0.02 1.69 0.00 0.77 -1.08 0.00 0.00 178.44 179.84 3d9b h SER 450 N -0.16 0.00 0.11 -0.43 4.64 -1.47 -0.31 113.55 115.93 3d9b h SER 450 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3d9b h SER 450 Cb 1.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.97 3d9b h SER 450 CO 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.05 3d9b n ALA 451 N -2.02 2.28 -0.04 5.18 0.00 -0.40 -1.85 120.51 123.66 3d9b n ALA 451 Ca -0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 53.44 53.27 3d9b n ALA 451 Cb 0.23 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 18.26 3d9b n ALA 451 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3d9b n VAL 452 N -1.08 0.53 0.02 0.00 0.24 -0.19 -4.31 118.33 113.54 3d9b n VAL 452 Ca 0.15 -0.31 -0.21 0.00 -2.04 0.00 0.00 64.34 61.92 3d9b n VAL 452 Cb 0.10 -0.80 -0.14 0.00 -1.47 0.00 0.00 33.84 31.53 3d9b n VAL 452 CO 0.00 0.00 0.00 -0.26 -2.14 0.00 0.00 176.83 174.43 3d9b h PHE 453 N 0.00 0.48 0.03 6.34 -1.00 -1.37 -3.42 116.94 118.01 3d9b h PHE 453 Ca -0.21 -0.35 -0.00 0.00 2.81 0.00 0.00 57.97 60.22 3d9b h PHE 453 Cb 1.46 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 41.00 3d9b h PHE 453 CO 0.00 1.52 -0.02 0.28 -1.61 0.00 0.00 178.31 178.49 3d9b h VAL 454 N -0.29 1.13 0.00 -0.55 2.07 -1.64 -2.88 116.25 114.09 3d9b h VAL 454 Ca -0.28 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 66.71 3d9b h VAL 454 Cb 1.76 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 3d9b h VAL 454 CO 0.08 0.13 0.18 -0.65 0.02 0.00 0.00 177.57 177.33 3d9b h PRO 455 N -0.28 0.00 -0.02 1.57 0.11 -1.80 0.51 132.00 132.10 3d9b h PRO 455 Ca -0.00 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.98 3d9b h PRO 455 Cb 0.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 3d9b h PRO 455 CO 0.01 0.00 -0.57 1.98 -0.21 0.00 0.00 178.00 179.21 3d9b h MET 456 N 0.00 0.07 -0.11 1.05 4.05 -1.74 -2.57 114.93 115.67 3d9b h MET 456 Ca 0.00 -0.04 0.03 0.00 -0.28 0.00 0.00 59.70 59.41 3d9b h MET 456 Cb 0.36 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.16 3d9b h MET 456 CO 0.00 0.62 0.13 0.00 0.23 0.00 0.00 176.91 177.88 3d9b h ALA 457 N 1.37 1.70 -2.76 0.39 0.00 -0.10 -3.33 119.26 116.53 3d9b h ALA 457 Ca -0.00 -0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.24 3d9b h ALA 457 Cb 1.02 0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.65 3d9b h ALA 457 CO 0.08 -0.18 -0.44 -0.06 0.00 0.00 0.00 179.25 178.65 3d9b s PHE 458 N -4.64 3.22 0.00 0.00 0.08 -0.97 -4.54 117.98 111.14 3d9b s PHE 458 Ca -0.05 -0.00 0.00 0.00 0.12 0.00 0.00 56.93 57.00 3d9b s PHE 458 Cb 0.15 -2.48 0.00 0.00 -0.57 0.00 0.00 43.02 40.12 3d9b s PHE 458 CO 0.55 -0.29 0.00 1.97 -0.10 0.00 0.00 175.22 177.35 3d9b n PHE 459 N 5.16 0.00 -1.55 0.36 -1.74 -1.25 -4.90 117.46 113.54 3d9b n PHE 459 Ca -0.12 0.00 -0.29 0.00 -0.56 0.00 0.00 57.45 56.48 3d9b n PHE 459 Cb 0.51 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.45 3d9b n PHE 459 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3d9b n GLY 460 N 0.00 0.03 7.00 4.97 0.00 -1.26 -4.11 105.19 111.81 3d9b n GLY 460 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3d9b n GLY 460 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d9b n GLY 461 N 6.26 1.72 0.18 -0.02 0.00 -1.26 -2.67 105.19 109.41 3d9b n GLY 461 Ca 0.42 -0.58 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 3d9b n GLY 461 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d9b h SER 462 N 6.71 0.51 0.31 1.61 4.64 -1.88 -2.64 113.55 122.82 3d9b h SER 462 Ca 0.00 -0.19 -0.06 0.00 -0.47 0.00 0.00 61.79 61.07 3d9b h SER 462 Cb 0.00 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 3d9b h SER 462 CO 0.00 0.56 -0.29 0.74 -0.87 0.00 0.00 176.83 176.97 3d9b h THR 463 N 0.44 1.17 -0.44 2.95 2.02 -1.92 -3.25 112.91 113.87 3d9b h THR 463 Ca 0.12 -1.01 -0.11 0.00 0.77 0.00 0.00 66.41 66.18 3d9b h THR 463 Cb 0.22 1.55 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 3d9b h THR 463 CO -0.01 0.28 -0.16 1.23 0.37 0.00 0.00 175.52 177.23 3d9b h GLY 464 N 0.92 0.92 0.62 2.16 0.00 -1.24 -2.42 103.07 104.02 3d9b h GLY 464 Ca -0.00 -0.75 0.16 0.00 0.00 0.00 0.00 47.33 46.74 3d9b h GLY 464 CO 0.04 0.68 0.52 0.00 0.00 0.00 0.00 176.54 177.78 3d9b h ALA 465 N 1.06 2.16 -0.09 3.60 0.00 -1.58 -2.44 119.26 121.98 3d9b h ALA 465 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 3d9b h ALA 465 Cb 0.68 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3d9b h ALA 465 CO 0.05 -0.37 -0.20 0.82 0.00 0.00 0.00 179.25 179.54 3d9b h ILE 466 N 0.39 1.40 -0.66 0.00 5.03 -1.59 -2.90 117.51 119.17 3d9b h ILE 466 Ca 0.38 -1.52 0.05 0.00 -0.12 0.00 0.00 64.86 63.65 3d9b h ILE 466 Cb 0.92 2.17 -0.05 0.00 -3.03 0.00 0.00 36.82 36.83 3d9b h ILE 466 CO -0.12 0.43 0.39 1.88 -0.68 0.00 0.00 178.15 180.05 3d9b h TYR 467 N -0.17 0.72 -0.20 1.37 0.05 -1.46 -2.95 116.97 114.33 3d9b h TYR 467 Ca -0.00 0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.86 3d9b h TYR 467 Cb 0.80 -0.23 -0.07 0.00 1.01 0.00 0.00 36.73 38.25 3d9b h TYR 467 CO 0.11 0.37 -0.27 -0.09 -1.05 0.00 0.00 178.16 177.23 3d9b h ARG 468 N 0.73 -0.29 -1.53 4.88 2.43 -1.37 0.46 114.38 119.68 3d9b h ARG 468 Ca 0.28 0.02 0.50 0.00 -0.81 0.00 0.00 59.98 59.97 3d9b h ARG 468 Cb 0.12 0.07 -0.12 0.00 -0.42 0.00 0.00 29.97 29.62 3d9b h ARG 468 CO -0.15 -0.20 1.03 1.04 -1.51 0.00 0.00 179.97 180.18 3d9b n GLN 469 N -5.39 -0.02 -0.07 0.20 1.13 -1.10 -1.75 117.38 110.38 3d9b n GLN 469 Ca -0.02 1.17 -0.08 0.00 -1.94 0.00 0.00 57.00 56.13 3d9b n GLN 469 Cb 0.31 -2.42 -0.05 0.00 0.11 0.00 0.00 30.24 28.19 3d9b n GLN 469 CO 0.00 0.00 0.00 0.74 -1.44 0.00 0.00 177.06 176.36 3d9b h PHE 470 N 0.00 0.00 -0.94 1.08 0.04 -0.19 -3.14 116.94 113.78 3d9b h PHE 470 Ca 0.88 0.00 0.12 0.00 2.80 0.00 0.00 57.97 61.77 3d9b h PHE 470 Cb 3.06 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 41.07 3d9b h PHE 470 CO -0.00 0.44 -0.44 0.43 -0.60 0.00 0.00 178.31 178.13 3d9b n SER 471 N -4.63 -0.77 0.11 2.17 7.64 -0.28 0.61 113.62 118.46 3d9b n SER 471 Ca -0.10 1.65 -0.02 0.00 1.01 0.00 0.00 58.87 61.41 3d9b n SER 471 Cb 0.30 -0.31 -0.03 0.00 -1.01 0.00 0.00 64.21 63.16 3d9b n SER 471 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 3d9b h ILE 472 N 0.00 1.23 0.00 0.44 1.08 -1.62 0.00 117.51 118.64 3d9b h ILE 472 Ca 0.25 -2.72 -0.11 0.00 -0.39 0.00 0.00 64.86 61.89 3d9b h ILE 472 Cb 0.49 2.60 -0.02 0.00 -3.07 0.00 0.00 36.82 36.82 3d9b h ILE 472 CO -0.91 0.70 -0.54 0.71 -0.69 0.00 0.00 178.15 177.41 3d9b h THR 473 N 0.00 1.38 0.06 -0.27 1.35 -1.14 -3.03 112.91 111.26 3d9b h THR 473 Ca -0.01 -1.87 -0.13 0.00 -0.55 0.00 0.00 66.41 63.85 3d9b h THR 473 Cb 1.54 2.01 -0.00 0.00 -1.73 0.00 0.00 68.15 69.97 3d9b h THR 473 CO 0.09 0.53 -0.66 0.40 -0.25 0.00 0.00 175.52 175.63 3d9b h ILE 474 N 0.00 1.45 -0.44 6.82 2.04 0.44 -3.22 117.51 124.60 3d9b h ILE 474 Ca -0.01 -2.38 -0.13 0.00 1.00 0.00 0.00 64.86 63.34 3d9b h ILE 474 Cb 0.97 3.04 -0.01 0.00 -0.74 0.00 0.00 36.82 40.07 3d9b h ILE 474 CO 0.07 0.60 -0.25 0.58 0.00 0.00 0.00 178.15 179.16 3d9b h VAL 475 N -0.72 1.27 -0.46 1.67 2.07 -1.13 -0.49 116.25 118.46 3d9b h VAL 475 Ca -0.15 -1.40 0.07 0.00 0.82 0.00 0.00 66.70 66.04 3d9b h VAL 475 Cb 1.35 1.19 -0.09 0.00 -1.52 0.00 0.00 31.29 32.21 3d9b h VAL 475 CO 0.01 0.48 -0.48 0.28 0.02 0.00 0.00 177.57 177.88 3d9b h SER 476 N 0.79 -1.63 -0.73 0.57 0.02 -1.70 0.18 113.55 111.05 3d9b h SER 476 Ca 0.10 0.24 0.17 0.00 -0.84 0.00 0.00 61.79 61.45 3d9b h SER 476 Cb 0.81 0.70 -0.12 0.00 0.14 0.00 0.00 62.40 63.93 3d9b h SER 476 CO 0.07 -0.37 0.09 0.00 -1.14 0.00 0.00 176.83 175.47 3d9b h ALA 477 N 0.30 0.85 0.48 3.77 0.00 -1.42 -2.54 119.26 120.71 3d9b h ALA 477 Ca 0.13 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.22 3d9b h ALA 477 Cb 0.58 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3d9b h ALA 477 CO -0.62 -0.39 -0.23 0.52 0.00 0.00 0.00 179.25 178.52 3d9b h MET 478 N 0.17 -0.63 -0.84 0.00 2.86 0.89 0.16 114.93 117.54 3d9b h MET 478 Ca 0.41 0.04 0.12 0.00 -2.06 0.00 0.00 59.70 58.21 3d9b h MET 478 Cb 0.72 0.14 -0.06 0.00 0.06 0.00 0.00 31.60 32.46 3d9b h MET 478 CO -0.59 -0.42 0.55 0.00 1.06 0.00 0.00 176.91 177.51 3d9b h ALA 479 N -1.70 1.81 -0.25 6.32 0.00 -0.88 0.32 119.26 124.88 3d9b h ALA 479 Ca -0.07 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 3d9b h ALA 479 Cb 0.50 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3d9b h ALA 479 CO 0.11 -0.02 -0.45 -0.07 0.00 0.00 0.00 179.25 178.82 3d9b h LEU 480 N 0.70 0.69 -1.80 0.00 3.38 -1.43 0.26 115.31 117.12 3d9b h LEU 480 Ca 0.41 -0.33 0.07 0.00 0.09 0.00 0.00 57.88 58.11 3d9b h LEU 480 Cb 0.60 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3d9b h LEU 480 CO -0.17 1.04 0.27 -1.28 0.09 0.00 0.00 178.44 178.40 3d9b h SER 481 N 0.52 0.21 0.12 -0.43 0.87 0.26 0.14 113.55 115.23 3d9b h SER 481 Ca 0.03 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.44 3d9b h SER 481 Cb 0.99 -0.04 0.02 0.00 -0.44 0.00 0.00 62.40 62.92 3d9b h SER 481 CO 0.09 0.14 -0.70 0.58 -0.53 0.00 0.00 176.83 176.41 3d9b h VAL 482 N 0.24 1.54 0.08 2.23 2.07 0.01 -0.67 116.25 121.76 3d9b h VAL 482 Ca 0.18 -2.50 0.01 0.00 0.82 0.00 0.00 66.70 65.21 3d9b h VAL 482 Cb 0.40 3.22 -0.02 0.00 -1.52 0.00 0.00 31.29 33.37 3d9b h VAL 482 CO -0.03 0.70 -0.14 -0.07 0.02 0.00 0.00 177.57 178.05 3d9b h LEU 483 N -0.48 -0.38 -0.62 2.57 3.38 -0.36 -1.64 115.31 117.79 3d9b h LEU 483 Ca -0.12 0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.00 3d9b h LEU 483 Cb 1.54 0.14 -0.08 0.00 0.09 0.00 0.00 40.66 42.35 3d9b h LEU 483 CO 0.12 -0.20 0.19 0.58 0.09 0.00 0.00 178.44 179.22 3d9b h VAL 484 N -0.27 0.70 -0.55 1.22 2.07 -1.09 -0.06 116.25 118.27 3d9b h VAL 484 Ca 0.02 -0.12 0.16 0.00 0.82 0.00 0.00 66.70 67.58 3d9b h VAL 484 Cb 0.29 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 3d9b h VAL 484 CO -0.08 0.06 0.51 0.00 0.02 0.00 0.00 177.57 178.09 3d9b h ALA 485 N 1.46 2.34 -0.10 1.67 0.00 -0.30 -1.50 119.26 122.81 3d9b h ALA 485 Ca 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3d9b h ALA 485 Cb 0.44 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3d9b h ALA 485 CO -0.36 -0.79 0.00 1.28 0.00 0.00 0.00 179.25 179.38 3d9b n LEU 486 N -3.87 2.07 0.06 0.00 4.32 -0.10 -4.22 117.00 115.27 3d9b n LEU 486 Ca 0.10 -1.35 0.00 0.00 -0.02 0.00 0.00 56.01 54.75 3d9b n LEU 486 Cb 0.73 -0.06 0.00 0.00 -1.62 0.00 0.00 43.42 42.46 3d9b n LEU 486 CO 0.30 0.46 -0.09 -0.38 -1.22 0.00 0.00 177.39 176.46 3d9b n ILE 487 N 0.42 0.25 -0.07 -0.08 5.41 -0.81 -3.62 119.36 120.87 3d9b n ILE 487 Ca 0.06 0.08 -0.08 0.00 1.00 0.00 0.00 62.75 63.81 3d9b n ILE 487 Cb 0.28 -0.90 -0.06 0.00 -0.71 0.00 0.00 39.64 38.24 3d9b n ILE 487 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 3d9b h LEU 488 N 0.00 0.00 -0.76 1.39 5.85 -1.53 -3.17 115.31 117.10 3d9b h LEU 488 Ca 0.00 -0.43 -0.00 0.00 0.84 0.00 0.00 57.88 58.29 3d9b h LEU 488 Cb 0.18 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 3d9b h LEU 488 CO 0.00 0.83 0.46 0.71 -0.34 0.00 0.00 178.44 180.10 3d9b h THR 489 N -1.00 1.21 -0.13 1.05 1.35 -1.56 0.52 112.91 114.35 3d9b h THR 489 Ca -0.04 -0.47 -0.07 0.00 -0.55 0.00 0.00 66.41 65.28 3d9b h THR 489 Cb 0.59 0.15 -0.00 0.00 -1.73 0.00 0.00 68.15 67.16 3d9b h THR 489 CO -0.02 0.22 -0.18 -0.65 -0.25 0.00 0.00 175.52 174.63 3d9b h PRO 490 N 1.04 0.36 -0.55 4.72 0.11 -1.77 0.49 132.00 136.39 3d9b h PRO 490 Ca 0.27 -0.21 0.09 0.00 0.11 0.00 0.00 66.00 66.27 3d9b h PRO 490 Cb -0.04 0.02 -0.11 0.00 0.11 0.00 0.00 31.00 30.98 3d9b h PRO 490 CO -0.05 0.78 -0.37 0.00 -0.21 0.00 0.00 178.00 178.15 3d9b h ALA 491 N 0.57 -0.18 -0.73 -0.75 0.00 -1.42 0.38 119.26 117.14 3d9b h ALA 491 Ca 0.01 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3d9b h ALA 491 Cb 0.74 0.84 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 3d9b h ALA 491 CO 0.04 -0.75 0.26 -0.07 0.00 0.00 0.00 179.25 178.74 3d9b h LEU 492 N -0.21 1.04 -0.61 0.00 4.07 0.08 -2.75 115.31 116.92 3d9b h LEU 492 Ca 0.20 -0.19 0.11 0.00 0.08 0.00 0.00 57.88 58.08 3d9b h LEU 492 Cb 0.56 -0.27 -0.08 0.00 1.08 0.00 0.00 40.66 41.95 3d9b h LEU 492 CO -0.66 0.95 0.18 0.00 -1.08 0.00 0.00 178.44 177.83 3d9b h ALA 494 N 1.46 0.32 0.17 0.00 0.00 -0.80 -3.04 119.26 117.36 3d9b h ALA 494 Ca 0.32 -0.57 -0.28 0.00 0.00 0.00 0.00 54.91 54.39 3d9b h ALA 494 Cb 0.44 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.22 3d9b h ALA 494 CO -0.36 0.63 -1.31 1.79 0.00 0.00 0.00 179.25 180.00 3d9b h THR 495 N 0.50 1.21 0.01 0.00 1.35 -1.35 -3.27 112.91 111.35 3d9b h THR 495 Ca -0.04 -2.53 -0.25 0.00 -0.55 0.00 0.00 66.41 63.04 3d9b h THR 495 Cb 1.31 2.95 -0.04 0.00 -1.73 0.00 0.00 68.15 70.64 3d9b h THR 495 CO 0.14 0.76 -1.35 0.24 -0.25 0.00 0.00 175.52 175.07 3d9b h MET 496 N -0.15 0.01 -6.51 4.72 2.86 -0.41 -3.47 114.93 111.99 3d9b h MET 496 Ca -0.25 -0.02 -0.53 0.00 -2.06 0.00 0.00 59.70 56.83 3d9b h MET 496 Cb 1.88 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.55 3d9b h MET 496 CO 0.16 0.78 0.54 -0.51 1.06 0.00 0.00 176.91 178.94 3d9b s LEU 497 N -6.45 4.39 0.31 1.22 1.43 -1.15 -4.68 118.68 113.75 3d9b s LEU 497 Ca -0.02 2.02 -0.28 0.00 -1.03 0.00 0.00 54.13 54.82 3d9b s LEU 497 Cb 0.09 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 42.63 3d9b s LEU 497 CO 0.82 -0.43 1.07 -0.75 0.23 0.00 0.00 176.35 177.30 3d9b s LYS 498 N 0.84 4.52 0.53 1.70 2.20 -1.26 -4.72 119.74 123.56 3d9b s LYS 498 Ca 0.57 1.70 -0.21 0.00 -0.36 0.00 0.00 55.97 57.67 3d9b s LYS 498 Cb -0.29 -3.01 -0.05 0.00 -1.51 0.00 0.00 37.83 32.96 3d9b s LYS 498 CO 0.30 0.14 1.28 -2.14 -0.36 0.00 0.00 175.35 174.57 3d9b s PRO 499 N -1.72 3.26 -0.24 4.03 0.02 -1.26 -4.91 135.00 134.18 3d9b s PRO 499 Ca 0.48 2.04 0.01 0.00 0.02 0.00 0.00 61.00 63.55 3d9b s PRO 499 Cb -0.29 -2.23 0.06 0.00 0.02 0.00 0.00 34.50 32.06 3d9b s PRO 499 CO 0.37 -1.04 -0.07 0.42 -0.33 0.00 0.00 177.00 176.35 3d9b s ILE 500 N -1.42 1.64 0.52 2.83 -1.09 -1.26 -5.07 121.20 117.35 3d9b s ILE 500 Ca 0.71 -1.27 -0.21 0.00 -2.23 0.00 0.00 60.65 57.65 3d9b s ILE 500 Cb -0.36 -1.86 -0.08 0.00 -1.58 0.00 0.00 42.46 38.58 3d9b s ILE 500 CO 0.42 -0.07 0.99 0.00 -1.23 0.00 0.00 174.94 175.05 3d9b n ALA 501 N 4.63 0.24 -1.55 9.38 0.00 -1.26 -4.37 120.51 127.58 3d9b n ALA 501 Ca -0.13 0.11 -0.47 0.00 0.00 0.00 0.00 53.44 52.95 3d9b n ALA 501 Cb 0.44 -2.10 -0.05 0.00 0.00 0.00 0.00 19.45 17.74 3d9b n ALA 501 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3d9b n LYS 502 N -0.44 1.64 -2.07 0.00 4.81 -1.26 -2.10 118.16 118.74 3d9b n LYS 502 Ca 0.11 0.49 0.00 0.00 -0.87 0.00 0.00 58.31 58.04 3d9b n LYS 502 Cb 0.44 -2.81 0.00 0.00 0.02 0.00 0.00 35.03 32.68 3d9b n LYS 502 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3d9b n GLY 503 N 5.84 0.74 3.44 3.14 0.00 -0.59 -4.95 105.19 112.81 3d9b n GLY 503 Ca 0.33 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 45.23 3d9b n GLY 503 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3d9b s ASP 504 N -2.92 5.78 -0.12 1.61 2.15 -0.89 -4.97 116.67 117.31 3d9b s ASP 504 Ca 0.00 -0.70 0.16 0.00 0.43 0.00 0.00 52.55 52.44 3d9b s ASP 504 Cb 0.00 -2.06 0.57 0.00 -0.30 0.00 0.00 42.92 41.13 3d9b s ASP 504 CO 0.00 -0.30 1.48 1.41 -0.17 0.00 0.00 175.17 177.60 3d9b n HIS 505 N 5.04 1.11 -2.26 -5.34 8.25 -1.26 -4.82 115.22 115.94 3d9b n HIS 505 Ca -0.13 -0.69 -0.20 0.00 -0.26 0.00 0.00 57.72 56.44 3d9b n HIS 505 Cb 0.48 -0.25 -0.02 0.00 1.12 0.00 0.00 29.99 31.32 3d9b n HIS 505 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3d9b n GLY 506 N 0.34 -0.10 0.09 -1.41 0.00 -1.26 -4.90 105.19 97.95 3d9b n GLY 506 Ca 0.21 -0.03 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 3d9b n GLY 506 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3d9b h GLU 507 N 0.00 0.15 -2.43 1.61 5.08 -1.87 -3.41 114.58 113.71 3d9b h GLU 507 Ca -0.47 -0.26 -0.60 0.00 -1.00 0.00 0.00 59.36 57.03 3d9b h GLU 507 Cb 1.35 0.10 -0.42 0.00 0.50 0.00 0.00 28.75 30.28 3d9b h GLU 507 CO 0.57 1.09 -0.62 0.41 -1.00 0.00 0.00 179.01 179.46 3d9b n GLY 508 N 1.48 4.46 3.64 -3.84 0.00 -1.26 -4.59 105.19 105.07 3d9b n GLY 508 Ca -0.07 -2.64 -0.04 0.00 0.00 0.00 0.00 46.02 43.27 3d9b n GLY 508 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d9b s LYS 509 N -2.09 0.40 0.57 1.61 -2.85 -1.26 -5.09 119.74 111.03 3d9b s LYS 509 Ca 0.35 0.62 0.00 0.00 -1.00 0.00 0.00 55.97 55.95 3d9b s LYS 509 Cb 0.10 0.12 0.00 0.00 -2.06 0.00 0.00 37.83 35.98 3d9b s LYS 509 CO -0.06 -0.07 0.00 0.36 0.10 0.00 0.00 175.35 175.67 3d9b n LYS 510 N 3.26 -0.23 0.00 1.78 2.85 -1.26 -2.15 118.16 122.40 3d9b n LYS 510 Ca -0.17 0.15 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 3d9b n LYS 510 Cb 0.57 -0.29 0.00 0.00 -0.65 0.00 0.00 35.03 34.67 3d9b n LYS 510 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3d9b n GLY 511 N -0.79 -0.12 0.10 2.58 0.00 -1.26 -4.28 105.19 101.42 3d9b n GLY 511 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3d9b n GLY 511 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3d9b h PHE 512 N 0.00 -0.10 -0.72 1.61 3.57 -1.99 -3.04 116.94 116.26 3d9b h PHE 512 Ca 0.00 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.57 3d9b h PHE 512 Cb 0.00 0.03 -0.06 0.00 2.79 0.00 0.00 35.95 38.71 3d9b h PHE 512 CO 0.00 0.32 0.40 0.74 -2.23 0.00 0.00 178.31 177.55 3d9b h PHE 513 N -0.96 0.73 -0.75 0.41 0.04 -1.87 0.22 116.94 114.76 3d9b h PHE 513 Ca -0.01 0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.84 3d9b h PHE 513 Cb 0.47 -0.22 -0.05 0.00 2.20 0.00 0.00 35.95 38.36 3d9b h PHE 513 CO 0.10 0.33 0.49 0.78 -0.60 0.00 0.00 178.31 179.42 3d9b h GLY 514 N 0.72 1.03 0.94 -1.45 0.00 -1.57 -1.77 103.07 100.97 3d9b h GLY 514 Ca 0.33 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 3d9b h GLY 514 CO -0.21 0.26 -0.26 -0.25 0.00 0.00 0.00 176.54 176.08 3d9b h TRP 515 N 0.84 0.79 0.23 5.60 2.91 -0.69 -2.93 115.95 122.69 3d9b h TRP 515 Ca 0.32 -0.23 -0.01 0.00 1.13 0.00 0.00 58.89 60.09 3d9b h TRP 515 Cb 0.19 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 28.67 3d9b h TRP 515 CO -0.00 0.96 -0.11 0.35 -1.03 0.00 0.00 178.44 178.61 3d9b h PHE 516 N 0.39 -0.28 0.00 2.65 3.57 -0.09 -1.29 116.94 121.89 3d9b h PHE 516 Ca 0.05 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 3d9b h PHE 516 Cb 0.82 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.65 3d9b h PHE 516 CO 0.07 -0.11 -0.06 -0.91 -2.23 0.00 0.00 178.31 175.08 3d9b h ASN 517 N -0.39 0.00 -0.31 0.41 4.21 -1.45 0.23 115.58 118.28 3d9b h ASN 517 Ca -0.03 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.35 3d9b h ASN 517 Cb 0.30 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.50 3d9b h ASN 517 CO 0.05 0.06 -0.32 0.03 -1.29 0.00 0.00 177.43 175.96 3d9b h ARG 518 N 0.00 0.75 0.01 0.81 3.08 -1.22 -2.31 114.38 115.50 3d9b h ARG 518 Ca -0.00 -0.40 -0.20 0.00 0.07 0.00 0.00 59.98 59.44 3d9b h ARG 518 Cb 0.15 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 3d9b h ARG 518 CO 0.01 1.03 -0.95 0.00 -1.07 0.00 0.00 179.97 178.98 3d9b h MET 519 N 0.51 0.06 0.08 0.04 -0.00 -0.23 -3.11 114.93 112.27 3d9b h MET 519 Ca 0.05 -0.08 -0.00 0.00 -0.00 0.00 0.00 59.70 59.66 3d9b h MET 519 Cb 0.89 0.03 0.00 0.00 -0.00 0.00 0.00 31.60 32.52 3d9b h MET 519 CO 0.08 0.96 -0.04 0.35 -0.00 0.00 0.00 176.91 178.26 3d9b h PHE 520 N 0.02 -0.09 -0.02 -0.10 3.57 -0.64 -0.68 116.94 119.00 3d9b h PHE 520 Ca -0.03 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 3d9b h PHE 520 Cb 1.65 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 40.42 3d9b h PHE 520 CO 0.01 0.45 -0.05 0.93 -2.23 0.00 0.00 178.31 177.42 3d9b h GLU 521 N -0.74 0.03 0.20 1.11 4.39 -1.55 0.51 114.58 118.53 3d9b h GLU 521 Ca -0.01 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 3d9b h GLU 521 Cb 0.58 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 3d9b h GLU 521 CO 0.02 0.08 -0.10 -0.22 -1.16 0.00 0.00 179.01 177.63 3d9b h LYS 522 N 0.03 -0.26 -0.71 2.33 3.64 -1.57 -3.10 116.57 116.92 3d9b h LYS 522 Ca 0.01 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.49 3d9b h LYS 522 Cb 0.11 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.92 3d9b h LYS 522 CO 0.01 0.04 0.37 0.77 -2.27 0.00 0.00 179.45 178.36 3d9b h SER 523 N -0.56 0.50 0.42 4.20 0.02 0.62 0.42 113.55 119.17 3d9b h SER 523 Ca -0.03 0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 60.92 3d9b h SER 523 Cb 0.42 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 3d9b h SER 523 CO 0.04 0.29 -0.25 0.71 -1.14 0.00 0.00 176.83 176.49 3d9b h THR 524 N 0.64 0.92 -0.01 -2.27 1.35 -1.08 0.49 112.91 112.94 3d9b h THR 524 Ca 0.34 -0.94 -0.26 0.00 -0.55 0.00 0.00 66.41 65.00 3d9b h THR 524 Cb 0.33 1.55 0.02 0.00 -1.73 0.00 0.00 68.15 68.32 3d9b h THR 524 CO -0.25 0.24 -1.00 -0.74 -0.25 0.00 0.00 175.52 173.52 3d9b h HIS 525 N 0.00 0.97 -0.55 4.73 6.17 -0.92 0.27 115.15 125.82 3d9b h HIS 525 Ca -0.00 -0.52 -0.06 0.00 0.71 0.00 0.00 60.37 60.50 3d9b h HIS 525 Cb 0.53 -0.11 -0.02 0.00 2.52 0.00 0.00 27.41 30.32 3d9b h HIS 525 CO 0.00 1.35 0.09 0.45 0.71 0.00 0.00 177.93 180.54 3d9b h HIS 526 N 0.38 0.92 -0.33 5.26 3.86 -0.51 -2.09 115.15 122.64 3d9b h HIS 526 Ca -0.11 -0.10 -0.02 0.00 -1.16 0.00 0.00 60.37 58.97 3d9b h HIS 526 Cb 1.65 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 29.84 3d9b h HIS 526 CO 0.09 0.79 0.14 -0.92 0.86 0.00 0.00 177.93 178.90 3d9b h TYR 527 N 0.84 0.49 0.07 2.45 5.03 0.17 -1.36 116.97 124.66 3d9b h TYR 527 Ca 0.17 -0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.45 3d9b h TYR 527 Cb 0.37 -0.15 0.00 0.00 1.55 0.00 0.00 36.73 38.50 3d9b h TYR 527 CO 0.02 0.45 -0.04 1.79 -1.32 0.00 0.00 178.16 179.07 3d9b h THR 528 N 0.39 1.09 -0.98 1.81 1.35 -0.36 -1.85 112.91 114.36 3d9b h THR 528 Ca 0.11 -0.56 0.11 0.00 -0.55 0.00 0.00 66.41 65.52 3d9b h THR 528 Cb 0.16 1.45 -0.08 0.00 -1.73 0.00 0.00 68.15 67.95 3d9b h THR 528 CO -0.01 0.14 0.62 0.44 -0.25 0.00 0.00 175.52 176.46 3d9b h ASP 529 N -0.35 0.90 -0.76 5.36 3.32 -1.39 0.45 116.42 123.95 3d9b h ASP 529 Ca -0.01 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 3d9b h ASP 529 Cb 0.31 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 3d9b h ASP 529 CO 0.02 0.51 0.26 0.28 -1.72 0.00 0.00 179.24 178.58 3d9b h SER 530 N 0.98 1.10 -0.13 6.45 0.02 -1.01 -0.40 113.55 120.57 3d9b h SER 530 Ca 0.47 -0.20 -0.14 0.00 -0.84 0.00 0.00 61.79 61.08 3d9b h SER 530 Cb 0.44 -0.29 0.01 0.00 0.14 0.00 0.00 62.40 62.70 3d9b h SER 530 CO -0.23 1.01 -0.47 0.58 -1.14 0.00 0.00 176.83 176.58 3d9b h VAL 531 N 1.13 1.36 -1.00 2.27 2.07 -0.45 -2.88 116.25 118.74 3d9b h VAL 531 Ca 0.25 -1.77 0.12 0.00 0.82 0.00 0.00 66.70 66.12 3d9b h VAL 531 Cb 0.29 2.11 -0.08 0.00 -1.52 0.00 0.00 31.29 32.08 3d9b h VAL 531 CO -0.01 0.53 0.63 1.23 0.02 0.00 0.00 177.57 179.98 3d9b h GLY 532 N 0.16 1.64 1.81 2.17 0.00 0.08 -0.90 103.07 108.04 3d9b h GLY 532 Ca -0.02 -0.43 -0.15 0.00 0.00 0.00 0.00 47.33 46.73 3d9b h GLY 532 CO 0.10 0.16 -0.63 -1.33 0.00 0.00 0.00 176.54 174.84 3d9b h GLY 533 N 1.00 0.21 1.35 4.60 0.00 -1.10 -3.10 103.07 106.02 3d9b h GLY 533 Ca 0.50 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 47.48 3d9b h GLY 533 CO -0.26 0.24 -0.90 0.16 0.00 0.00 0.00 176.54 175.78 3d9b h ILE 534 N 0.14 0.35 -0.52 2.60 3.07 -1.12 -3.11 117.51 118.93 3d9b h ILE 534 Ca -0.01 -1.60 0.05 0.00 1.55 0.00 0.00 64.86 64.85 3d9b h ILE 534 Cb 1.14 1.95 -0.05 0.00 -0.27 0.00 0.00 36.82 39.59 3d9b h ILE 534 CO 0.09 0.20 0.26 -0.07 -1.05 0.00 0.00 178.15 177.58 3d9b h LEU 535 N 0.00 0.36 -0.76 0.16 3.38 -1.26 -2.30 115.31 114.89 3d9b h LEU 535 Ca -0.06 0.03 0.19 0.00 0.09 0.00 0.00 57.88 58.13 3d9b h LEU 535 Cb 1.28 -0.03 -0.14 0.00 0.09 0.00 0.00 40.66 41.85 3d9b h LEU 535 CO 0.03 0.25 -0.06 0.54 0.09 0.00 0.00 178.44 179.28 3d9b n ARG 536 N -4.89 -0.06 -1.46 1.13 1.74 -1.17 -3.33 116.66 108.61 3d9b n ARG 536 Ca 0.05 1.16 -0.33 0.00 -0.77 0.00 0.00 57.85 57.95 3d9b n ARG 536 Cb 0.14 -1.80 0.07 0.00 -1.02 0.00 0.00 32.46 29.85 3d9b n ARG 536 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3d9b n SER 537 N -5.13 7.22 -1.40 0.55 3.41 -0.86 -4.98 113.62 112.43 3d9b n SER 537 Ca 0.16 -3.78 0.00 0.00 -0.26 0.00 0.00 58.87 54.98 3d9b n SER 537 Cb 0.51 -0.87 0.00 0.00 -0.26 0.00 0.00 64.21 63.59 3d9b n SER 537 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3d9b n THR 538 N -0.88 0.00 -3.95 6.66 -2.24 -1.21 -2.32 114.28 110.34 3d9b n THR 538 Ca 0.59 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 62.04 3d9b n THR 538 Cb 0.71 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.95 3d9b n THR 538 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d9b n GLY 539 N -0.25 -0.63 0.25 3.38 0.00 -1.26 -4.72 105.19 101.96 3d9b n GLY 539 Ca 0.00 0.26 0.25 0.00 0.00 0.00 0.00 46.02 46.52 3d9b n GLY 539 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3d9b n ARG 540 N -3.82 -0.05 -0.05 1.61 0.63 -0.98 -0.76 116.66 113.25 3d9b n ARG 540 Ca -0.09 1.09 -0.09 0.00 -0.92 0.00 0.00 57.85 57.84 3d9b n ARG 540 Cb 0.42 -1.95 -0.03 0.00 0.45 0.00 0.00 32.46 31.35 3d9b n ARG 540 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 3d9b h TYR 541 N 0.00 0.14 -0.39 -0.14 -1.99 -1.86 -2.52 116.97 110.21 3d9b h TYR 541 Ca 0.66 0.01 0.07 0.00 2.00 0.00 0.00 58.73 61.47 3d9b h TYR 541 Cb 1.73 -0.03 -0.07 0.00 2.00 0.00 0.00 36.73 40.36 3d9b h TYR 541 CO -0.03 0.07 -0.12 1.28 -0.00 0.00 0.00 178.16 179.37 3d9b n LEU 542 N -5.03 -0.18 0.35 3.88 4.32 0.06 0.44 117.00 120.84 3d9b n LEU 542 Ca -0.02 0.67 -0.18 0.00 -0.02 0.00 0.00 56.01 56.45 3d9b n LEU 542 Cb 0.07 -0.19 -0.09 0.00 -1.62 0.00 0.00 43.42 41.59 3d9b n LEU 542 CO 0.30 -0.63 0.57 0.58 -1.22 0.00 0.00 177.39 177.00 3d9b h VAL 543 N 0.00 0.11 -0.75 4.08 2.07 -1.43 -2.36 116.25 117.96 3d9b h VAL 543 Ca 0.17 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.88 3d9b h VAL 543 Cb 0.27 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.11 3d9b h VAL 543 CO -0.39 0.00 0.52 0.25 0.02 0.00 0.00 177.57 177.97 3d9b h LEU 544 N -1.03 0.18 -0.27 2.57 5.85 0.94 -0.26 115.31 123.29 3d9b h LEU 544 Ca -0.08 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.57 3d9b h LEU 544 Cb 0.85 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 3d9b h LEU 544 CO 0.04 0.08 -0.19 0.22 -0.34 0.00 0.00 178.44 178.25 3d9b h TYR 545 N 0.18 0.71 -0.46 1.25 5.03 0.32 -1.48 116.97 122.53 3d9b h TYR 545 Ca 0.37 -0.19 -0.08 0.00 2.58 0.00 0.00 58.73 61.41 3d9b h TYR 545 Cb 1.19 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 39.29 3d9b h TYR 545 CO -0.00 0.88 -0.05 -0.07 -1.32 0.00 0.00 178.16 177.60 3d9b h LEU 546 N 0.33 0.76 -0.61 2.82 3.38 -0.58 -0.79 115.31 120.61 3d9b h LEU 546 Ca 0.05 -0.20 0.07 0.00 0.09 0.00 0.00 57.88 57.90 3d9b h LEU 546 Cb 0.72 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 3d9b h LEU 546 CO 0.05 0.85 0.29 0.40 0.09 0.00 0.00 178.44 180.12 3d9b h ILE 547 N 0.72 0.87 -0.77 1.22 2.04 -1.02 0.35 117.51 120.92 3d9b h ILE 547 Ca 0.13 -0.18 0.01 0.00 1.00 0.00 0.00 64.86 65.82 3d9b h ILE 547 Cb 0.51 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 3d9b h ILE 547 CO 0.03 0.10 0.51 0.40 0.00 0.00 0.00 178.15 179.18 3d9b h ILE 548 N 0.53 1.18 0.54 -0.67 2.04 -0.52 0.27 117.51 120.88 3d9b h ILE 548 Ca 0.29 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 3d9b h ILE 548 Cb 0.27 0.06 0.01 0.00 -0.74 0.00 0.00 36.82 36.42 3d9b h ILE 548 CO -0.23 0.19 -0.26 0.58 0.00 0.00 0.00 178.15 178.42 3d9b h VAL 549 N 1.03 0.43 -0.59 1.67 2.07 -0.34 0.46 116.25 120.98 3d9b h VAL 549 Ca 0.29 -0.18 0.11 0.00 0.82 0.00 0.00 66.70 67.74 3d9b h VAL 549 Cb -0.09 0.51 -0.11 0.00 -1.52 0.00 0.00 31.29 30.07 3d9b h VAL 549 CO -0.07 0.03 -0.30 0.58 0.02 0.00 0.00 177.57 177.83 3d9b h VAL 550 N -0.85 0.21 -0.39 2.57 2.07 -0.04 0.18 116.25 120.00 3d9b h VAL 550 Ca -0.07 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.37 3d9b h VAL 550 Cb 0.61 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 3d9b h VAL 550 CO 0.12 0.00 -0.09 1.23 0.02 0.00 0.00 177.57 178.86 3d9b h GLY 551 N -0.14 0.72 0.38 2.17 0.00 -0.87 -2.44 103.07 102.89 3d9b h GLY 551 Ca 0.25 -0.51 0.05 0.00 0.00 0.00 0.00 47.33 47.12 3d9b h GLY 551 CO -0.67 0.47 -0.15 1.98 0.00 0.00 0.00 176.54 178.17 3d9b h MET 552 N 0.61 -0.15 -0.69 4.80 -1.53 0.18 -2.03 114.93 116.13 3d9b h MET 552 Ca 0.11 0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.38 3d9b h MET 552 Cb 0.51 0.03 -0.03 0.00 -0.55 0.00 0.00 31.60 31.56 3d9b h MET 552 CO 0.03 -0.10 0.44 0.00 0.14 0.00 0.00 176.91 177.42 3d9b h ALA 553 N 0.97 0.88 0.58 0.39 0.00 -0.83 -0.83 119.26 120.42 3d9b h ALA 553 Ca 0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3d9b h ALA 553 Cb 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3d9b h ALA 553 CO -0.29 0.32 -0.45 -0.92 0.00 0.00 0.00 179.25 177.92 3d9b h TYR 554 N 0.94 -1.22 -1.08 0.00 3.20 -1.23 -1.62 116.97 115.95 3d9b h TYR 554 Ca 0.25 -0.00 0.31 0.00 3.14 0.00 0.00 58.73 62.43 3d9b h TYR 554 Cb -0.07 0.45 -0.11 0.00 1.54 0.00 0.00 36.73 38.54 3d9b h TYR 554 CO -0.02 -0.64 0.68 -0.07 -1.64 0.00 0.00 178.16 176.47 3d9b h LEU 555 N -1.00 0.45 0.34 2.82 3.38 -1.08 0.31 115.31 120.53 3d9b h LEU 555 Ca -0.07 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3d9b h LEU 555 Cb 0.84 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3d9b h LEU 555 CO 0.01 -0.00 -0.16 0.15 0.09 0.00 0.00 178.44 178.52 3d9b h PHE 556 N 0.35 -0.42 0.00 1.13 3.57 -0.41 -2.08 116.94 119.08 3d9b h PHE 556 Ca 0.67 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 62.16 3d9b h PHE 556 Cb 1.70 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 40.58 3d9b h PHE 556 CO -0.00 -0.10 -0.00 -0.39 -2.23 0.00 0.00 178.31 175.58 3d9b h VAL 557 N -0.77 0.01 0.00 1.41 -1.51 -0.75 -2.68 116.25 111.96 3d9b h VAL 557 Ca -0.05 -0.73 -0.04 0.00 -1.23 0.00 0.00 66.70 64.65 3d9b h VAL 557 Cb 0.51 1.72 -0.01 0.00 -2.13 0.00 0.00 31.29 31.39 3d9b h VAL 557 CO 0.08 0.00 -0.20 -0.09 -1.23 0.00 0.00 177.57 176.13 3d9b h ARG 558 N 0.00 0.00 -6.05 5.19 9.65 -0.37 -3.45 114.38 119.35 3d9b h ARG 558 Ca -0.00 0.00 -0.56 0.00 -1.10 0.00 0.00 59.98 58.32 3d9b h ARG 558 Cb 0.72 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.25 3d9b h ARG 558 CO 0.00 0.20 0.23 -1.17 2.80 0.00 0.00 179.97 182.03 3d9b s LEU 559 N -6.49 4.27 1.17 3.80 2.96 -0.79 -5.05 118.68 118.56 3d9b s LEU 559 Ca 0.03 1.25 -0.16 0.00 -0.22 0.00 0.00 54.13 55.02 3d9b s LEU 559 Cb 0.08 -3.20 0.27 0.00 0.50 0.00 0.00 46.19 43.84 3d9b s LEU 559 CO 0.65 -0.23 1.06 -2.16 -1.32 0.00 0.00 176.35 174.35 3d9b s PRO 560 N 1.29 -0.91 0.15 0.98 0.04 -1.26 -4.84 135.00 130.44 3d9b s PRO 560 Ca 0.40 0.33 0.11 0.00 0.04 0.00 0.00 61.00 61.87 3d9b s PRO 560 Cb -0.18 -1.60 -0.04 0.00 0.04 0.00 0.00 34.50 32.72 3d9b s PRO 560 CO 0.18 -3.59 -0.25 -1.12 0.04 0.00 0.00 177.00 172.26 3d9b s SER 561 N -3.36 3.43 0.32 6.66 0.01 -1.26 -2.28 113.70 117.22 3d9b s SER 561 Ca 0.68 -0.76 -0.08 0.00 1.31 0.00 0.00 55.95 57.10 3d9b s SER 561 Cb -0.16 -0.27 0.01 0.00 0.21 0.00 0.00 66.02 65.81 3d9b s SER 561 CO 0.59 0.16 0.54 -0.55 0.41 0.00 0.00 173.24 174.39 3d9b s SER 562 N -2.26 0.43 0.00 2.44 0.15 -0.10 -4.84 113.70 109.51 3d9b s SER 562 Ca 0.17 -1.25 0.00 0.00 0.70 0.00 0.00 55.95 55.56 3d9b s SER 562 Cb -0.09 0.68 0.00 0.00 -1.71 0.00 0.00 66.02 64.90 3d9b s SER 562 CO 0.08 -1.34 0.00 0.33 1.20 0.00 0.00 173.24 173.51 3d9b n PHE 563 N -0.51 0.00 -4.65 3.44 -0.00 -1.26 -4.25 117.46 110.23 3d9b n PHE 563 Ca -0.02 0.00 -0.23 0.00 -0.00 0.00 0.00 57.45 57.20 3d9b n PHE 563 Cb 0.61 0.00 -0.15 0.00 -0.00 0.00 0.00 39.48 39.94 3d9b n PHE 563 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3d9b s LEU 564 N -2.52 1.96 0.08 -2.13 1.43 -1.26 -0.63 118.68 115.59 3d9b s LEU 564 Ca 0.00 -0.27 -0.30 0.00 -1.03 0.00 0.00 54.13 52.53 3d9b s LEU 564 Cb 0.00 -0.76 -0.05 0.00 0.03 0.00 0.00 46.19 45.41 3d9b s LEU 564 CO 0.00 0.15 0.97 -2.16 0.23 0.00 0.00 176.35 175.54 3d9b s PRO 565 N -0.16 4.65 0.13 1.29 0.04 -1.26 -4.98 135.00 134.72 3d9b s PRO 565 Ca 0.02 1.44 -0.35 0.00 0.04 0.00 0.00 61.00 62.15 3d9b s PRO 565 Cb -0.07 -3.40 -0.15 0.00 0.04 0.00 0.00 34.50 30.91 3d9b s PRO 565 CO 0.00 0.13 1.48 -0.25 0.04 0.00 0.00 177.00 178.40 3d9b n ASP 566 N 3.14 2.49 -4.72 6.66 9.92 -1.26 -4.78 116.55 128.00 3d9b n ASP 566 Ca 0.03 1.10 -0.29 0.00 -0.53 0.00 0.00 54.79 55.10 3d9b n ASP 566 Cb 0.50 -1.33 -0.07 0.00 -0.64 0.00 0.00 41.12 39.57 3d9b n ASP 566 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 3d9b s GLU 567 N 0.70 2.66 -0.07 -1.24 0.41 -1.26 -4.82 118.70 115.08 3d9b s GLU 567 Ca 0.81 -0.85 -0.30 0.00 -0.41 0.00 0.00 54.97 54.22 3d9b s GLU 567 Cb -0.79 -2.58 -0.05 0.00 -1.78 0.00 0.00 34.13 28.94 3d9b s GLU 567 CO 0.42 0.53 1.50 0.34 -0.49 0.00 0.00 175.26 177.56 3d9b s ASP 568 N -2.54 6.77 -0.28 -0.19 2.15 -1.26 -4.84 116.67 116.47 3d9b s ASP 568 Ca 0.28 2.08 0.10 0.00 0.43 0.00 0.00 52.55 55.44 3d9b s ASP 568 Cb -0.11 -2.54 0.54 0.00 -0.30 0.00 0.00 42.92 40.51 3d9b s ASP 568 CO 0.20 -0.84 1.52 0.00 -0.17 0.00 0.00 175.17 175.87 3d9b n GLN 569 N 6.62 2.23 -0.91 4.34 6.02 -1.26 -4.58 117.38 129.85 3d9b n GLN 569 Ca 0.16 -3.08 -0.02 0.00 -0.01 0.00 0.00 57.00 54.05 3d9b n GLN 569 Cb 0.43 -1.88 -0.01 0.00 1.02 0.00 0.00 30.24 29.81 3d9b n GLN 569 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3d9b n GLY 570 N -0.93 0.19 3.56 1.08 0.00 -1.26 -4.85 105.19 102.98 3d9b n GLY 570 Ca 0.33 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.34 3d9b n GLY 570 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d9b s VAL 571 N -1.02 -0.21 0.02 1.61 -7.23 -1.26 -2.01 120.40 110.29 3d9b s VAL 571 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.17 3d9b s VAL 571 Cb 0.00 -1.00 -0.00 0.00 0.56 0.00 0.00 36.38 35.94 3d9b s VAL 571 CO 0.00 0.00 0.01 2.22 -0.31 0.00 0.00 175.10 177.02 3d9b n PHE 572 N 4.23 -0.03 -4.03 2.82 1.16 -0.79 -4.63 117.46 116.19 3d9b n PHE 572 Ca -0.15 -0.13 -0.08 0.00 -1.87 0.00 0.00 57.45 55.22 3d9b n PHE 572 Cb 0.56 0.01 -0.10 0.00 -1.61 0.00 0.00 39.48 38.34 3d9b n PHE 572 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 3d9b s MET 573 N -2.07 0.56 -0.08 3.97 -1.94 -1.15 -1.62 119.30 116.97 3d9b s MET 573 Ca 0.02 -1.02 0.02 0.00 -1.71 0.00 0.00 55.69 52.99 3d9b s MET 573 Cb 0.00 0.20 0.02 0.00 2.01 0.00 0.00 34.83 37.06 3d9b s MET 573 CO 0.01 -0.11 -0.12 0.99 -0.01 0.00 0.00 175.02 175.78 3d9b s THR 574 N -3.24 1.17 0.36 2.05 2.01 -0.26 -1.72 115.64 116.01 3d9b s THR 574 Ca 0.01 -0.46 -0.22 0.00 0.31 0.00 0.00 61.69 61.32 3d9b s THR 574 Cb 0.03 -1.09 -0.10 0.00 0.01 0.00 0.00 72.50 71.34 3d9b s THR 574 CO -0.08 0.37 0.91 -0.04 -0.69 0.00 0.00 174.62 175.10 3d9b s MET 575 N 0.95 4.35 -0.13 4.92 -1.94 0.15 -1.37 119.30 126.23 3d9b s MET 575 Ca -0.09 1.14 -0.04 0.00 -1.71 0.00 0.00 55.69 54.99 3d9b s MET 575 Cb -0.15 -2.50 0.06 0.00 2.01 0.00 0.00 34.83 34.25 3d9b s MET 575 CO 0.00 0.14 0.14 0.08 -0.01 0.00 0.00 175.02 175.38 3d9b s VAL 576 N -1.89 -0.21 -0.08 -6.03 1.01 -0.53 -2.56 120.40 110.12 3d9b s VAL 576 Ca 0.55 0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.62 3d9b s VAL 576 Cb -0.13 -0.45 0.03 0.00 0.00 0.00 0.00 36.38 35.83 3d9b s VAL 576 CO 0.18 -0.05 0.03 -1.10 0.00 0.00 0.00 175.10 174.16 3d9b s GLN 577 N 2.24 0.32 0.45 2.72 -1.52 -0.08 0.35 119.66 124.15 3d9b s GLN 577 Ca 0.04 0.14 0.07 0.00 -1.95 0.00 0.00 55.36 53.66 3d9b s GLN 577 Cb -0.14 -1.00 0.02 0.00 -0.22 0.00 0.00 33.01 31.67 3d9b s GLN 577 CO -0.08 -0.38 0.62 -0.51 -0.25 0.00 0.00 175.29 174.70 3d9b s LEU 578 N 2.05 3.55 0.00 2.90 1.02 -0.39 -0.62 118.68 127.19 3d9b s LEU 578 Ca 0.04 -0.38 0.00 0.00 0.02 0.00 0.00 54.13 53.81 3d9b s LEU 578 Cb -0.13 -2.62 0.00 0.00 0.02 0.00 0.00 46.19 43.46 3d9b s LEU 578 CO -0.05 -0.87 0.00 -2.65 0.02 0.00 0.00 176.35 172.80 3d9b n PRO 579 N -1.97 2.81 -3.57 1.29 -0.02 -1.26 -4.92 135.00 127.37 3d9b n PRO 579 Ca 0.09 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.40 3d9b n PRO 579 Cb 0.59 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 34.01 3d9b n PRO 579 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d9b s ALA 580 N -2.28 -1.57 0.14 3.55 0.00 -1.26 -4.64 121.76 115.70 3d9b s ALA 580 Ca 0.00 1.13 -0.12 0.00 0.00 0.00 0.00 51.96 52.97 3d9b s ALA 580 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.10 3d9b s ALA 580 CO 0.00 -0.35 1.51 0.78 0.00 0.00 0.00 175.76 177.71 3d9b h GLY 581 N 3.20 0.96 -4.17 0.00 0.00 -1.99 -3.49 103.07 97.58 3d9b h GLY 581 Ca -0.28 -0.87 0.00 0.00 0.00 0.00 0.00 47.33 46.18 3d9b h GLY 581 CO 0.39 0.79 -0.44 0.00 0.00 0.00 0.00 176.54 177.28 3d9b n ALA 582 N -2.50 -3.17 -0.59 3.60 0.00 -1.26 -4.18 120.51 112.40 3d9b n ALA 582 Ca -0.01 0.40 -0.30 0.00 0.00 0.00 0.00 53.44 53.52 3d9b n ALA 582 Cb 0.45 -1.07 0.21 0.00 0.00 0.00 0.00 19.45 19.03 3d9b n ALA 582 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3d9b n THR 583 N 0.10 0.00 -0.32 0.00 -2.24 -1.26 -3.66 114.28 106.90 3d9b n THR 583 Ca 0.02 -0.32 0.09 0.00 -2.27 0.00 0.00 64.05 61.57 3d9b n THR 583 Cb 0.09 -0.83 0.26 0.00 -2.10 0.00 0.00 70.33 67.74 3d9b n THR 583 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3d9b h GLN 584 N -2.29 0.69 0.71 -0.78 4.15 -1.93 -2.59 115.11 113.07 3d9b h GLN 584 Ca -0.55 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 58.80 3d9b h GLN 584 Cb 1.33 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 28.86 3d9b h GLN 584 CO 0.43 0.46 -0.47 1.49 -1.93 0.00 0.00 178.83 178.81 3d9b h GLU 585 N 0.71 -1.07 -1.02 1.69 4.81 -1.90 -1.78 114.58 116.02 3d9b h GLU 585 Ca 0.50 0.07 0.26 0.00 -0.13 0.00 0.00 59.36 60.07 3d9b h GLU 585 Cb 0.71 0.24 -0.12 0.00 0.63 0.00 0.00 28.75 30.22 3d9b h GLU 585 CO -0.36 -0.72 0.61 0.00 -0.73 0.00 0.00 179.01 177.82 3d9b h ARG 586 N -1.11 0.50 -0.32 1.92 3.08 -1.79 0.93 114.38 117.60 3d9b h ARG 586 Ca -0.09 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.81 3d9b h ARG 586 Cb 0.90 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 3d9b h ARG 586 CO 0.07 0.33 -0.29 1.15 -1.07 0.00 0.00 179.97 180.16 3d9b h THR 587 N 0.52 1.28 -0.25 2.04 2.02 -1.32 -2.72 112.91 114.46 3d9b h THR 587 Ca 0.65 -1.41 -0.03 0.00 0.77 0.00 0.00 66.41 66.39 3d9b h THR 587 Cb 1.34 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 3d9b h THR 587 CO -0.46 0.46 0.05 -0.61 0.37 0.00 0.00 175.52 175.34 3d9b h GLN 588 N 0.57 0.41 -0.69 6.66 5.75 0.17 0.40 115.11 128.38 3d9b h GLN 588 Ca 0.07 -0.10 0.13 0.00 -0.15 0.00 0.00 58.65 58.60 3d9b h GLN 588 Cb 0.79 -0.05 -0.13 0.00 1.07 0.00 0.00 27.48 29.15 3d9b h GLN 588 CO 0.06 0.52 -0.24 -0.22 -2.65 0.00 0.00 178.83 176.30 3d9b h LYS 589 N 0.24 -0.05 -0.09 1.69 3.64 -1.05 0.17 116.57 121.12 3d9b h LYS 589 Ca 0.08 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3d9b h LYS 589 Cb 0.30 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3d9b h LYS 589 CO 0.00 -0.04 0.05 0.28 -2.27 0.00 0.00 179.45 177.47 3d9b h VAL 590 N -0.06 1.07 -0.40 2.00 2.07 -1.01 -2.15 116.25 117.79 3d9b h VAL 590 Ca 0.31 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.65 3d9b h VAL 590 Cb 0.54 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 3d9b h VAL 590 CO -0.74 0.07 0.26 -0.07 0.02 0.00 0.00 177.57 177.11 3d9b h LEU 591 N 0.06 0.38 0.73 2.57 3.38 0.13 -1.95 115.31 120.60 3d9b h LEU 591 Ca 0.03 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 3d9b h LEU 591 Cb 0.06 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.73 3d9b h LEU 591 CO -0.01 0.26 -0.35 0.78 0.09 0.00 0.00 178.44 179.22 3d9b h ASN 592 N 0.44 -0.83 -1.06 -0.43 2.35 -0.28 0.86 115.58 116.62 3d9b h ASN 592 Ca 0.16 0.01 0.31 0.00 -0.55 0.00 0.00 56.30 56.22 3d9b h ASN 592 Cb 0.09 0.21 -0.13 0.00 0.05 0.00 0.00 38.32 38.55 3d9b h ASN 592 CO -0.04 -0.50 0.64 -0.33 -1.65 0.00 0.00 177.43 175.55 3d9b h GLU 593 N -1.14 0.35 0.20 0.81 5.08 -0.79 1.60 114.58 120.69 3d9b h GLU 593 Ca -0.10 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 3d9b h GLU 593 Cb 0.78 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.95 3d9b h GLU 593 CO 0.16 0.23 -0.10 0.28 -1.00 0.00 0.00 179.01 178.59 3d9b h VAL 594 N 0.36 0.79 -0.59 3.13 2.07 -1.27 -2.91 116.25 117.84 3d9b h VAL 594 Ca 0.70 -0.98 0.15 0.00 0.82 0.00 0.00 66.70 67.39 3d9b h VAL 594 Cb 1.68 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 32.71 3d9b h VAL 594 CO -0.48 0.19 0.41 0.74 0.02 0.00 0.00 177.57 178.46 3d9b h THR 595 N -0.83 0.76 0.31 2.57 2.02 0.18 -1.88 112.91 116.04 3d9b h THR 595 Ca -0.03 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 3d9b h THR 595 Cb 0.52 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 3d9b h THR 595 CO 0.05 0.03 -0.15 -0.74 0.37 0.00 0.00 175.52 175.07 3d9b h HIS 596 N 0.14 -0.39 -0.01 3.16 6.17 0.22 -3.08 115.15 121.35 3d9b h HIS 596 Ca 0.28 -0.01 0.03 0.00 0.71 0.00 0.00 60.37 61.39 3d9b h HIS 596 Cb 0.94 0.13 -0.05 0.00 2.52 0.00 0.00 27.41 30.95 3d9b h HIS 596 CO -0.00 -0.16 -0.28 -0.92 0.71 0.00 0.00 177.93 177.29 3d9b h TYR 597 N -0.56 -0.74 -0.42 5.26 3.20 -1.13 0.62 116.97 123.20 3d9b h TYR 597 Ca -0.04 0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.95 3d9b h TYR 597 Cb 0.41 0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 3d9b h TYR 597 CO -0.02 -0.37 0.29 1.88 -1.64 0.00 0.00 178.16 178.31 3d9b h TYR 598 N -0.41 0.15 0.00 -3.82 0.05 -1.62 0.14 116.97 111.46 3d9b h TYR 598 Ca 0.07 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.67 3d9b h TYR 598 Cb 0.50 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 38.16 3d9b h TYR 598 CO -0.31 0.07 -1.59 1.28 -1.05 0.00 0.00 178.16 176.56 3d9b n LEU 599 N -4.45 0.68 -0.12 3.88 4.77 -0.60 -3.07 117.00 118.09 3d9b n LEU 599 Ca 0.06 0.30 -0.24 0.00 -0.03 0.00 0.00 56.01 56.11 3d9b n LEU 599 Cb 0.39 0.12 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 3d9b n LEU 599 CO 0.35 0.18 -1.13 0.35 -1.33 0.00 0.00 177.39 175.81 3d9b n THR 600 N -2.82 1.52 0.13 -5.08 -2.24 0.21 -4.28 114.28 101.71 3d9b n THR 600 Ca -0.12 -0.21 0.11 0.00 -2.27 0.00 0.00 64.05 61.56 3d9b n THR 600 Cb 0.86 -2.01 0.04 0.00 -2.10 0.00 0.00 70.33 67.12 3d9b n THR 600 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3d9b h LYS 601 N -1.00 0.00 0.00 -0.78 1.57 -0.92 -3.39 116.57 112.04 3d9b h LYS 601 Ca -0.50 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.22 3d9b h LYS 601 Cb 1.41 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.59 3d9b h LYS 601 CO -0.30 0.01 -0.63 -1.91 -0.57 0.00 0.00 179.45 176.05 3d9b n GLU 602 N -2.79 0.88 -0.06 3.15 4.07 -0.94 -4.86 120.64 120.10 3d9b n GLU 602 Ca 0.01 -2.60 -0.08 0.00 -0.06 0.00 0.00 57.16 54.43 3d9b n GLU 602 Cb 0.55 -0.96 -0.01 0.00 -0.06 0.00 0.00 31.44 30.96 3d9b n GLU 602 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 3d9b h LYS 603 N 0.81 -0.21 -1.00 5.31 1.57 -1.72 -2.49 116.57 118.85 3d9b h LYS 603 Ca -0.08 0.01 0.36 0.00 -1.87 0.00 0.00 60.65 59.07 3d9b h LYS 603 Cb 1.34 0.05 -0.18 0.00 0.08 0.00 0.00 32.23 33.52 3d9b h LYS 603 CO 0.03 -0.14 0.33 -0.91 -0.57 0.00 0.00 179.45 178.20 3d9b h ASN 604 N -0.21 -0.01 0.00 0.86 4.21 -1.89 -2.52 115.58 116.02 3d9b h ASN 604 Ca 0.14 0.27 -0.37 0.00 1.21 0.00 0.00 56.30 57.55 3d9b h ASN 604 Cb 0.44 0.36 -0.07 0.00 -1.12 0.00 0.00 38.32 37.93 3d9b h ASN 604 CO -0.39 -0.40 -2.40 0.59 -1.29 0.00 0.00 177.43 173.54 3d9b n ASN 605 N -5.35 1.19 -4.71 5.81 3.02 -1.05 -4.84 115.26 109.32 3d9b n ASN 605 Ca 0.32 -0.07 -0.42 0.00 -0.03 0.00 0.00 54.58 54.37 3d9b n ASN 605 Cb 1.07 0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 40.43 3d9b n ASN 605 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3d9b s VAL 606 N -2.49 4.81 -0.19 2.41 1.01 -0.95 0.40 120.40 125.40 3d9b s VAL 606 Ca -0.23 2.02 -0.16 0.00 0.00 0.00 0.00 61.98 63.61 3d9b s VAL 606 Cb 0.07 -4.29 -0.11 0.00 0.00 0.00 0.00 36.38 32.05 3d9b s VAL 606 CO 0.68 0.15 -0.07 1.21 0.00 0.00 0.00 175.10 177.07 3d9b n GLU 607 N 3.93 0.52 -3.72 2.72 4.07 0.70 -4.72 120.64 124.15 3d9b n GLU 607 Ca 0.06 0.48 -0.13 0.00 -0.06 0.00 0.00 57.16 57.51 3d9b n GLU 607 Cb 0.51 -1.66 -0.09 0.00 -0.06 0.00 0.00 31.44 30.13 3d9b n GLU 607 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 3d9b s SER 608 N -6.41 -0.46 -0.61 4.31 1.04 -0.22 -4.99 113.70 106.35 3d9b s SER 608 Ca -0.25 0.87 0.04 0.00 0.48 0.00 0.00 55.95 57.09 3d9b s SER 608 Cb 0.05 0.89 0.16 0.00 0.10 0.00 0.00 66.02 67.22 3d9b s SER 608 CO 0.42 -0.19 0.41 -0.69 0.98 0.00 0.00 173.24 174.17 3d9b s VAL 609 N 0.12 2.43 -0.30 5.02 1.01 -1.26 0.11 120.40 127.53 3d9b s VAL 609 Ca -0.01 -3.76 -0.28 0.00 0.00 0.00 0.00 61.98 57.93 3d9b s VAL 609 Cb -0.03 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 3d9b s VAL 609 CO 0.01 -0.98 1.85 0.12 0.00 0.00 0.00 175.10 176.10 3d9b s PHE 610 N -0.90 1.73 0.19 5.22 5.36 -0.43 -3.17 117.98 125.98 3d9b s PHE 610 Ca 0.23 0.60 0.11 0.00 -0.96 0.00 0.00 56.93 56.91 3d9b s PHE 610 Cb -0.10 -4.10 -0.04 0.00 -0.34 0.00 0.00 43.02 38.44 3d9b s PHE 610 CO -0.12 -3.14 -0.22 0.00 -1.46 0.00 0.00 175.22 170.28 3d9b s ALA 611 N 6.97 2.40 -0.21 11.12 0.00 0.00 0.00 121.76 142.04 3d9b s ALA 611 Ca 0.83 -1.62 -0.04 0.00 0.00 0.00 0.00 51.96 51.13 3d9b s ALA 611 Cb -0.24 -0.28 0.11 0.00 0.00 0.00 0.00 23.12 22.70 3d9b s ALA 611 CO 0.34 0.36 0.33 0.14 0.00 0.00 0.00 175.76 176.93 3d9b s VAL 612 N -1.85 -0.52 0.06 0.00 -7.23 -0.11 -0.30 120.40 110.44 3d9b s VAL 612 Ca 0.20 0.02 -0.26 0.00 -1.81 0.00 0.00 61.98 60.13 3d9b s VAL 612 Cb -0.07 -0.70 -0.05 0.00 0.56 0.00 0.00 36.38 36.11 3d9b s VAL 612 CO 0.09 -0.07 0.81 0.21 -0.31 0.00 0.00 175.10 175.84 3d9b s ASN 613 N 2.49 7.28 0.00 4.85 3.84 0.48 -2.42 114.94 131.45 3d9b s ASN 613 Ca 0.07 1.53 0.00 0.00 0.21 0.00 0.00 52.86 54.67 3d9b s ASN 613 Cb -0.14 -2.50 0.00 0.00 -0.55 0.00 0.00 41.25 38.06 3d9b s ASN 613 CO -0.13 -0.01 0.00 0.61 -2.79 0.00 0.00 177.10 174.78 3d9b n GLY 614 N 2.38 0.71 2.92 1.21 0.00 -0.46 -1.41 105.19 110.54 3d9b n GLY 614 Ca -0.01 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.47 3d9b n GLY 614 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3d9b s PHE 615 N -2.00 -0.06 -0.10 1.61 5.36 -1.25 -3.56 117.98 117.98 3d9b s PHE 615 Ca 0.00 0.15 -0.08 0.00 -0.96 0.00 0.00 56.93 56.05 3d9b s PHE 615 Cb 0.00 -0.00 0.03 0.00 -0.34 0.00 0.00 43.02 42.71 3d9b s PHE 615 CO 0.00 -0.04 0.25 0.20 -1.46 0.00 0.00 175.22 174.18 3d9b s GLY 616 N 0.14 -0.18 -0.28 13.12 0.00 -1.26 -3.59 107.32 115.27 3d9b s GLY 616 Ca -0.01 0.79 -0.29 0.00 0.00 0.00 0.00 44.72 45.22 3d9b s GLY 616 CO -0.00 0.78 1.63 -1.36 0.00 0.00 0.00 173.10 174.15 3d9b s PHE 617 N 0.42 2.08 0.00 1.90 0.08 -1.26 -0.09 117.98 121.11 3d9b s PHE 617 Ca -0.02 0.59 0.00 0.00 0.12 0.00 0.00 56.93 57.62 3d9b s PHE 617 Cb -0.04 -4.06 0.00 0.00 -0.57 0.00 0.00 43.02 38.35 3d9b s PHE 617 CO -0.02 -2.77 0.00 0.00 -0.10 0.00 0.00 175.22 172.33 3d9b n ALA 618 N 8.97 0.00 0.00 5.36 0.00 -1.26 -5.09 120.51 128.50 3d9b n ALA 618 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 3d9b n ALA 618 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 3d9b n ALA 618 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d9b n GLY 619 N 0.00 3.49 0.00 0.00 0.00 0.87 -5.14 105.19 104.41 3d9b n GLY 619 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.11 3d9b n GLY 619 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d9b n ARG 620 N -1.18 0.00 0.00 1.61 5.12 -1.26 -4.23 116.66 116.72 3d9b n ARG 620 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 3d9b n ARG 620 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 3d9b n ARG 620 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3d9b n GLY 621 N 0.00 4.53 0.37 -0.13 0.00 -1.23 -4.89 105.19 103.84 3d9b n GLY 621 Ca 0.00 -1.17 0.15 0.00 0.00 0.00 0.00 46.02 45.00 3d9b n GLY 621 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3d9b h GLN 622 N 0.00 0.36 0.00 1.61 4.20 -1.87 -2.54 115.11 116.87 3d9b h GLN 622 Ca 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3d9b h GLN 622 Cb 0.00 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.70 3d9b h GLN 622 CO 0.00 0.24 0.00 0.27 -0.67 0.00 0.00 178.83 178.67 3d9b n ASN 623 N -4.46 0.00 -4.55 1.46 0.23 -1.24 -4.29 115.26 102.41 3d9b n ASN 623 Ca 0.13 0.01 -0.26 0.00 -0.53 0.00 0.00 54.58 53.93 3d9b n ASN 623 Cb 0.49 -0.29 -0.09 0.00 -2.08 0.00 0.00 39.78 37.81 3d9b n ASN 623 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 3d9b s THR 624 N -2.57 3.07 0.17 5.53 -1.32 -0.96 -1.26 115.64 118.29 3d9b s THR 624 Ca 0.18 -1.79 -0.15 0.00 -1.21 0.00 0.00 61.69 58.73 3d9b s THR 624 Cb 0.13 -2.54 0.02 0.00 -1.51 0.00 0.00 72.50 68.60 3d9b s THR 624 CO 0.30 -0.17 0.43 -0.83 -2.21 0.00 0.00 174.62 172.14 3d9b s GLY 625 N -2.97 0.04 -0.26 6.08 0.00 0.16 -1.35 107.32 109.02 3d9b s GLY 625 Ca 0.26 -0.39 -0.21 0.00 0.00 0.00 0.00 44.72 44.38 3d9b s GLY 625 CO 0.15 -0.44 0.67 -1.50 0.00 0.00 0.00 173.10 171.97 3d9b s ILE 626 N -3.89 -0.00 -0.21 0.90 2.07 -1.02 -1.45 121.20 117.61 3d9b s ILE 626 Ca 0.10 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.35 3d9b s ILE 626 Cb 0.01 -0.94 0.05 0.00 0.13 0.00 0.00 42.46 41.71 3d9b s ILE 626 CO -0.04 0.00 -0.07 0.00 -1.91 0.00 0.00 174.94 172.92 3d9b s ALA 627 N 0.71 1.89 -0.34 1.50 0.00 -0.47 -0.93 121.76 124.12 3d9b s ALA 627 Ca -0.03 -1.21 -0.29 0.00 0.00 0.00 0.00 51.96 50.44 3d9b s ALA 627 Cb -0.05 -1.32 0.01 0.00 0.00 0.00 0.00 23.12 21.76 3d9b s ALA 627 CO -0.05 -0.98 1.26 -0.06 0.00 0.00 0.00 175.76 175.93 3d9b s PHE 628 N 1.44 2.74 -0.20 0.00 0.08 0.10 -1.10 117.98 121.03 3d9b s PHE 628 Ca -0.03 0.88 -0.04 0.00 0.12 0.00 0.00 56.93 57.85 3d9b s PHE 628 Cb -0.17 -4.00 -0.02 0.00 -0.57 0.00 0.00 43.02 38.26 3d9b s PHE 628 CO -0.07 -1.53 -0.02 0.08 -0.10 0.00 0.00 175.22 173.58 3d9b s VAL 629 N 4.42 3.74 -0.21 -0.44 1.01 -0.64 -1.32 120.40 126.96 3d9b s VAL 629 Ca 0.54 -0.38 -0.06 0.00 0.00 0.00 0.00 61.98 62.07 3d9b s VAL 629 Cb -0.14 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 3d9b s VAL 629 CO 0.24 0.43 0.04 -0.55 0.00 0.00 0.00 175.10 175.26 3d9b s SER 630 N 1.13 5.18 0.97 3.32 0.15 0.30 -1.88 113.70 122.87 3d9b s SER 630 Ca 0.02 -0.12 -0.16 0.00 0.70 0.00 0.00 55.95 56.40 3d9b s SER 630 Cb -0.14 -1.90 0.20 0.00 -1.71 0.00 0.00 66.02 62.46 3d9b s SER 630 CO 0.01 0.07 1.29 -0.76 1.20 0.00 0.00 173.24 175.05 3d9b s LEU 631 N 1.00 2.52 0.81 3.45 1.43 -0.85 -0.22 118.68 126.81 3d9b s LEU 631 Ca 0.03 0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 53.40 3d9b s LEU 631 Cb -0.14 -2.40 0.15 0.00 0.03 0.00 0.00 46.19 43.83 3d9b s LEU 631 CO 0.03 -2.79 1.12 -0.54 0.23 0.00 0.00 176.35 174.39 3d9b s LYS 632 N -5.82 1.36 0.07 1.70 1.02 0.16 -4.11 119.74 114.13 3d9b s LYS 632 Ca 0.73 -0.73 -0.31 0.00 0.02 0.00 0.00 55.97 55.68 3d9b s LYS 632 Cb -0.05 -2.13 -0.08 0.00 -0.52 0.00 0.00 37.83 35.05 3d9b s LYS 632 CO 0.53 -1.78 1.67 0.34 -0.92 0.00 0.00 175.35 175.19 3d9b s ASP 633 N -4.76 6.59 0.00 2.83 2.15 -1.26 -4.89 116.67 117.32 3d9b s ASP 633 Ca 0.68 2.51 0.00 0.00 0.43 0.00 0.00 52.55 56.17 3d9b s ASP 633 Cb -0.05 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.00 3d9b s ASP 633 CO 0.48 -0.90 0.00 0.79 -0.17 0.00 0.00 175.17 175.37 3d9b n TRP 634 N 5.62 0.00 0.22 -5.34 7.02 -1.26 0.12 117.44 123.81 3d9b n TRP 634 Ca 0.16 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.71 3d9b n TRP 634 Cb 0.40 -0.48 0.58 0.00 -2.42 0.00 0.00 31.31 29.39 3d9b n TRP 634 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3d9b h ALA 635 N 0.00 1.88 -0.30 6.99 0.00 -1.99 -0.39 119.26 125.46 3d9b h ALA 635 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3d9b h ALA 635 Cb 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3d9b h ALA 635 CO 0.00 0.09 0.03 -0.25 0.00 0.00 0.00 179.25 179.13 3d9b n ASP 636 N -4.48 3.33 -3.14 0.00 8.00 0.32 -4.18 116.55 116.40 3d9b n ASP 636 Ca -0.02 -2.49 -0.19 0.00 0.71 0.00 0.00 54.79 52.80 3d9b n ASP 636 Cb 0.13 -0.60 -0.03 0.00 -0.02 0.00 0.00 41.12 40.60 3d9b n ASP 636 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3d9b n ARG 637 N 0.25 0.89 -2.68 -1.24 1.74 -0.15 -4.87 116.66 110.60 3d9b n ARG 637 Ca 0.15 -3.18 -0.39 0.00 -0.77 0.00 0.00 57.85 53.66 3d9b n ARG 637 Cb 0.75 -1.51 -0.06 0.00 -1.02 0.00 0.00 32.46 30.63 3d9b n ARG 637 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3d9b s PRO 638 N -1.78 4.65 0.00 5.56 0.04 -1.26 -4.59 135.00 137.62 3d9b s PRO 638 Ca 0.37 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.92 3d9b s PRO 638 Cb 0.29 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.80 3d9b s PRO 638 CO -0.09 0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.67 3d9b n GLY 639 N 1.02 1.45 0.13 0.56 0.00 -1.26 -4.51 105.19 102.58 3d9b n GLY 639 Ca 0.00 -1.39 -0.03 0.00 0.00 0.00 0.00 46.02 44.61 3d9b n GLY 639 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3d9b n GLU 640 N 2.64 -0.13 -0.35 1.61 -0.58 -1.26 0.12 120.64 122.70 3d9b n GLU 640 Ca 0.00 0.48 0.13 0.00 -0.42 0.00 0.00 57.16 57.35 3d9b n GLU 640 Cb 0.00 -0.71 0.26 0.00 -0.57 0.00 0.00 31.44 30.42 3d9b n GLU 640 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3d9b h GLU 641 N 0.00 0.00 -0.01 3.49 5.08 -1.97 0.12 114.58 121.29 3d9b h GLU 641 Ca 0.06 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3d9b h GLU 641 Cb 0.14 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3d9b h GLU 641 CO -0.30 0.00 -0.05 0.09 -1.00 0.00 0.00 179.01 177.75 3d9b n ASN 642 N -5.52 0.92 -4.85 1.42 3.02 0.33 -4.17 115.26 106.41 3d9b n ASN 642 Ca 0.22 -1.13 -0.28 0.00 -0.03 0.00 0.00 54.58 53.36 3d9b n ASN 642 Cb 0.71 0.00 0.09 0.00 -0.61 0.00 0.00 39.78 39.97 3d9b n ASN 642 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3d9b s LYS 643 N -2.16 1.95 0.09 3.52 3.01 0.40 -4.89 119.74 121.67 3d9b s LYS 643 Ca 0.37 -0.10 -0.16 0.00 -1.01 0.00 0.00 55.97 55.07 3d9b s LYS 643 Cb 0.21 -2.04 -0.09 0.00 -1.01 0.00 0.00 37.83 34.90 3d9b s LYS 643 CO 0.39 -1.51 1.43 -0.39 0.51 0.00 0.00 175.35 175.78 3d9b h VAL 644 N -0.91 1.30 -0.95 3.17 -1.51 -1.89 -1.15 116.25 114.32 3d9b h VAL 644 Ca -0.45 -1.35 0.30 0.00 -1.23 0.00 0.00 66.70 63.97 3d9b h VAL 644 Cb 1.32 1.56 -0.16 0.00 -2.13 0.00 0.00 31.29 31.88 3d9b h VAL 644 CO 0.61 0.43 0.35 -0.08 -1.23 0.00 0.00 177.57 177.65 3d9b h GLU 645 N 0.37 0.17 0.02 5.19 4.81 -1.95 0.47 114.58 123.66 3d9b h GLU 645 Ca 0.05 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 3d9b h GLU 645 Cb 0.75 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.10 3d9b h GLU 645 CO 0.06 0.11 -0.33 0.00 -0.73 0.00 0.00 179.01 178.12 3d9b h ALA 646 N 1.87 0.01 -0.07 2.92 0.00 -1.74 -3.21 119.26 119.04 3d9b h ALA 646 Ca 0.66 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3d9b h ALA 646 Cb 1.49 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.30 3d9b h ALA 646 CO -0.70 0.14 0.04 0.82 0.00 0.00 0.00 179.25 179.55 3d9b h ILE 647 N -0.51 1.07 0.29 0.00 2.04 0.57 0.29 117.51 121.25 3d9b h ILE 647 Ca -0.05 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 3d9b h ILE 647 Cb 1.13 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 3d9b h ILE 647 CO 0.06 0.06 -0.20 0.71 0.00 0.00 0.00 178.15 178.78 3d9b h THR 648 N 0.03 0.57 -0.64 -0.27 1.35 -0.40 0.18 112.91 113.74 3d9b h THR 648 Ca 0.02 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.94 3d9b h THR 648 Cb 0.06 0.57 -0.08 0.00 -1.73 0.00 0.00 68.15 66.98 3d9b h THR 648 CO -0.00 0.00 -0.39 -0.03 -0.25 0.00 0.00 175.52 174.85 3d9b h MET 649 N -0.48 -0.02 -0.33 4.72 -1.53 -1.52 0.29 114.93 116.07 3d9b h MET 649 Ca -0.02 0.00 -0.03 0.00 -3.44 0.00 0.00 59.70 56.21 3d9b h MET 649 Cb 0.42 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.45 3d9b h MET 649 CO 0.01 -0.01 0.08 -0.09 0.14 0.00 0.00 176.91 177.04 3d9b h ARG 650 N -0.02 0.47 0.36 0.39 2.43 -0.13 -2.20 114.38 115.69 3d9b h ARG 650 Ca 0.10 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 3d9b h ARG 650 Cb 0.28 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 3d9b h ARG 650 CO -0.61 0.44 -0.17 0.00 -1.51 0.00 0.00 179.97 178.12 3d9b h ALA 651 N 1.63 -0.48 -0.56 2.80 0.00 0.01 -2.90 119.26 119.75 3d9b h ALA 651 Ca 0.11 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 54.95 3d9b h ALA 651 Cb 0.18 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3d9b h ALA 651 CO -0.00 -0.52 0.38 0.00 0.00 0.00 0.00 179.25 179.11 3d9b h THR 652 N -0.99 0.86 -0.47 0.00 1.03 -0.15 0.80 112.91 113.98 3d9b h THR 652 Ca -0.05 -0.10 -0.06 0.00 -0.01 0.00 0.00 66.41 66.18 3d9b h THR 652 Cb 0.51 0.54 -0.02 0.00 -1.07 0.00 0.00 68.15 68.11 3d9b h THR 652 CO 0.08 0.05 0.02 -0.09 -0.01 0.00 0.00 175.52 175.58 3d9b h ARG 653 N 0.29 0.75 -0.03 0.00 2.43 -1.47 -2.80 114.38 113.55 3d9b h ARG 653 Ca 0.26 -0.18 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 3d9b h ARG 653 Cb 0.64 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 3d9b h ARG 653 CO -0.06 0.74 -0.13 0.00 -1.51 0.00 0.00 179.97 179.01 3d9b h ALA 654 N 1.32 0.06 0.00 2.80 0.00 0.69 -3.30 119.26 120.83 3d9b h ALA 654 Ca 0.14 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3d9b h ALA 654 Cb 0.40 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3d9b h ALA 654 CO 0.01 -0.02 0.00 0.74 0.00 0.00 0.00 179.25 179.98 3d9b h PHE 655 N -0.44 0.00 -0.04 0.00 0.04 -0.80 -2.05 116.94 113.64 3d9b h PHE 655 Ca -0.01 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.77 3d9b h PHE 655 Cb 0.78 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.93 3d9b h PHE 655 CO 0.14 0.00 0.19 0.66 -0.60 0.00 0.00 178.31 178.71 3d9b h SER 656 N 0.00 0.00 -0.77 2.17 4.64 -1.57 -1.31 113.55 116.71 3d9b h SER 656 Ca 0.00 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.43 3d9b h SER 656 Cb 0.10 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.11 3d9b h SER 656 CO 0.00 0.00 0.38 -0.61 -0.87 0.00 0.00 176.83 175.73 3d9b h GLN 657 N 0.00 0.60 -6.47 4.77 4.15 -1.60 -3.45 115.11 113.11 3d9b h GLN 657 Ca 0.02 -0.04 -0.59 0.00 0.77 0.00 0.00 58.65 58.81 3d9b h GLN 657 Cb 0.41 -0.14 0.05 0.00 0.21 0.00 0.00 27.48 28.01 3d9b h GLN 657 CO -0.00 0.40 0.82 -0.89 -1.93 0.00 0.00 178.83 177.23 3d9b n ILE 658 N -4.86 0.07 -2.70 2.39 5.41 -0.50 -4.91 119.36 114.26 3d9b n ILE 658 Ca 0.13 -0.01 -0.42 0.00 1.00 0.00 0.00 62.75 63.45 3d9b n ILE 658 Cb 0.33 -1.55 -0.03 0.00 -0.71 0.00 0.00 39.64 37.68 3d9b n ILE 658 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 3d9b s LYS 659 N 1.25 4.49 -0.93 0.38 2.20 -1.26 -4.14 119.74 121.73 3d9b s LYS 659 Ca 0.81 1.40 -0.06 0.00 -0.36 0.00 0.00 55.97 57.76 3d9b s LYS 659 Cb -0.69 -3.50 -0.03 0.00 -1.51 0.00 0.00 37.83 32.09 3d9b s LYS 659 CO 0.40 -0.19 0.80 -3.47 -0.36 0.00 0.00 175.35 172.53 3d9b n ASP 660 N 4.49 -6.79 -3.26 1.43 -0.08 -1.26 -5.02 116.55 106.06 3d9b n ASP 660 Ca 0.07 -0.53 0.03 0.00 -1.51 0.00 0.00 54.79 52.85 3d9b n ASP 660 Cb 0.50 -4.77 -0.04 0.00 2.34 0.00 0.00 41.12 39.15 3d9b n ASP 660 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3d9b s ALA 661 N -3.23 -3.10 -0.21 -1.67 0.00 -1.26 -4.52 121.76 107.78 3d9b s ALA 661 Ca 0.27 1.86 -0.29 0.00 0.00 0.00 0.00 51.96 53.80 3d9b s ALA 661 Cb -0.05 -2.22 -0.01 0.00 0.00 0.00 0.00 23.12 20.83 3d9b s ALA 661 CO 0.77 -0.99 1.35 1.41 0.00 0.00 0.00 175.76 178.30 3d9b s MET 662 N 2.24 4.07 -0.03 0.00 1.75 0.21 -4.86 119.30 122.68 3d9b s MET 662 Ca -0.01 1.57 0.00 0.00 -1.25 0.00 0.00 55.69 56.00 3d9b s MET 662 Cb -0.03 -3.85 0.03 0.00 2.84 0.00 0.00 34.83 33.81 3d9b s MET 662 CO -0.16 -0.93 0.00 0.08 -0.65 0.00 0.00 175.02 173.36 3d9b s VAL 663 N 4.04 0.18 -0.02 10.11 1.01 -1.26 -0.90 120.40 133.56 3d9b s VAL 663 Ca 0.59 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.70 3d9b s VAL 663 Cb -0.21 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 35.88 3d9b s VAL 663 CO 0.20 0.16 -0.06 -0.36 0.00 0.00 0.00 175.10 175.04 3d9b s PHE 664 N 1.19 0.72 -0.17 5.22 0.40 -1.06 -4.68 117.98 119.59 3d9b s PHE 664 Ca -0.07 -0.17 -0.07 0.00 -0.60 0.00 0.00 56.93 56.02 3d9b s PHE 664 Cb -0.13 -0.55 -0.04 0.00 0.51 0.00 0.00 43.02 42.81 3d9b s PHE 664 CO -0.02 -0.10 0.06 0.00 0.70 0.00 0.00 175.22 175.86 3d9b s ALA 665 N 0.35 3.40 -0.05 5.36 0.00 -1.26 0.32 121.76 129.87 3d9b s ALA 665 Ca -0.05 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.12 3d9b s ALA 665 Cb -0.09 -1.89 0.02 0.00 0.00 0.00 0.00 23.12 21.16 3d9b s ALA 665 CO 0.00 0.21 0.14 -0.59 0.00 0.00 0.00 175.76 175.52 3d9b s PHE 666 N 0.27 -0.15 0.77 0.00 -0.71 -0.70 -4.69 117.98 112.77 3d9b s PHE 666 Ca 0.03 0.37 -0.11 0.00 -1.04 0.00 0.00 56.93 56.19 3d9b s PHE 666 Cb -0.12 0.04 0.06 0.00 -1.21 0.00 0.00 43.02 41.78 3d9b s PHE 666 CO 0.00 -0.08 1.09 1.21 -1.34 0.00 0.00 175.22 176.10 3d9b s ASN 667 N 0.16 4.56 0.11 1.98 2.47 -1.26 -2.96 114.94 120.01 3d9b s ASN 667 Ca -0.01 1.74 -0.30 0.00 0.42 0.00 0.00 52.86 54.71 3d9b s ASN 667 Cb -0.02 -2.47 -0.06 0.00 -1.45 0.00 0.00 41.25 37.25 3d9b s ASN 667 CO -0.00 -1.99 1.16 -0.76 -3.72 0.00 0.00 177.10 171.79 3d9b s LEU 668 N -5.88 4.42 0.00 3.21 1.43 -1.26 -4.89 118.68 115.70 3d9b s LEU 668 Ca 0.61 2.04 0.00 0.00 -1.03 0.00 0.00 54.13 55.75 3d9b s LEU 668 Cb -0.17 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.47 3d9b s LEU 668 CO 0.56 -0.37 0.28 -2.65 0.23 0.00 0.00 176.35 174.40 3d9b n PRO 669 N 3.28 0.00 0.00 1.29 -0.02 -1.26 -4.62 135.00 133.68 3d9b n PRO 669 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 3d9b n PRO 669 Cb 0.46 -1.56 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 3d9b n PRO 669 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d9b n ALA 670 N -0.71 0.00 0.00 3.55 0.00 -1.26 -4.61 120.51 117.48 3d9b n ALA 670 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3d9b n ALA 670 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.73 3d9b n ALA 670 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 3d9b n ILE 671 N -2.00 0.00 -0.15 0.00 3.06 -1.26 -4.94 119.36 114.06 3d9b n ILE 671 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 3d9b n ILE 671 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 3d9b n ILE 671 CO 0.00 0.00 0.00 0.52 -2.50 0.00 0.00 176.55 174.57 3d9b n VAL 672 N -0.87 0.00 -2.46 9.51 0.31 -1.26 -0.70 118.33 122.86 3d9b n VAL 672 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.92 3d9b n VAL 672 Cb 0.00 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 32.94 3d9b n VAL 672 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3d9b n GLU 673 N 0.28 5.13 -1.21 5.55 0.28 -1.26 -4.46 120.64 124.95 3d9b n GLU 673 Ca 0.00 -4.29 -0.23 0.00 -0.16 0.00 0.00 57.16 52.48 3d9b n GLU 673 Cb 0.00 -2.53 0.16 0.00 1.43 0.00 0.00 31.44 30.50 3d9b n GLU 673 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 3d9b n LEU 674 N 0.59 6.44 -3.03 -1.84 7.94 0.12 -4.58 117.00 122.66 3d9b n LEU 674 Ca 0.50 -3.83 -0.39 0.00 -1.11 0.00 0.00 56.01 51.19 3d9b n LEU 674 Cb 0.26 -0.82 0.03 0.00 0.53 0.00 0.00 43.42 43.42 3d9b n LEU 674 CO 0.58 1.21 1.37 0.61 -1.11 0.00 0.00 177.39 180.06 3d9b n GLY 675 N -1.08 5.69 0.00 -3.96 0.00 -1.23 -4.63 105.19 99.98 3d9b n GLY 675 Ca 0.56 -2.53 0.05 0.00 0.00 0.00 0.00 46.02 44.09 3d9b n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d9b n THR 676 N -0.43 0.00 -1.18 2.61 -2.24 -1.26 -4.65 114.28 107.13 3d9b n THR 676 Ca 0.51 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.99 3d9b n THR 676 Cb 0.28 -0.77 0.13 0.00 -2.10 0.00 0.00 70.33 67.87 3d9b n THR 676 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d9b s ALA 677 N -2.00 1.66 -0.04 6.98 0.00 -1.26 -4.73 121.76 122.36 3d9b s ALA 677 Ca 0.14 0.04 -0.00 0.00 0.00 0.00 0.00 51.96 52.14 3d9b s ALA 677 Cb 0.06 -3.22 -0.00 0.00 0.00 0.00 0.00 23.12 19.96 3d9b s ALA 677 CO 0.11 -2.27 0.04 0.25 0.00 0.00 0.00 175.76 173.88 3d9b n THR 678 N -3.84 -1.35 0.00 0.00 -2.24 -1.26 -4.95 114.28 100.64 3d9b n THR 678 Ca 0.08 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 3d9b n THR 678 Cb 0.54 -3.20 0.00 0.00 -2.10 0.00 0.00 70.33 65.57 3d9b n THR 678 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d9b n GLY 679 N -1.44 0.94 1.74 3.38 0.00 -1.26 -4.92 105.19 103.63 3d9b n GLY 679 Ca -0.00 -1.03 -0.04 0.00 0.00 0.00 0.00 46.02 44.95 3d9b n GLY 679 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3d9b n PHE 680 N 0.16 -1.63 -3.02 1.61 1.16 -1.00 -4.85 117.46 109.89 3d9b n PHE 680 Ca 0.00 -0.86 -0.16 0.00 -1.87 0.00 0.00 57.45 54.56 3d9b n PHE 680 Cb 0.00 0.43 -0.03 0.00 -1.61 0.00 0.00 39.48 38.27 3d9b n PHE 680 CO 0.00 0.00 0.00 -3.47 -1.87 0.00 0.00 176.76 171.42 3d9b n ASP 681 N -1.25 -1.67 -4.67 5.98 2.03 -1.26 -4.20 116.55 111.51 3d9b n ASP 681 Ca -0.04 -2.83 -0.43 0.00 0.52 0.00 0.00 54.79 52.02 3d9b n ASP 681 Cb 0.28 0.60 -0.02 0.00 -0.72 0.00 0.00 41.12 41.25 3d9b n ASP 681 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3d9b s PHE 682 N 0.10 3.41 -0.09 -0.67 5.36 0.18 -2.78 117.98 123.49 3d9b s PHE 682 Ca 0.33 1.51 -0.01 0.00 -0.96 0.00 0.00 56.93 57.80 3d9b s PHE 682 Cb 0.11 -3.24 -0.03 0.00 -0.34 0.00 0.00 43.02 39.52 3d9b s PHE 682 CO -0.15 -0.41 -0.04 -2.00 -1.46 0.00 0.00 175.22 171.16 3d9b s GLU 683 N 2.64 3.01 0.13 10.12 2.56 0.31 0.08 118.70 137.55 3d9b s GLU 683 Ca 0.46 -0.49 0.04 0.00 0.00 0.00 0.00 54.97 54.99 3d9b s GLU 683 Cb -0.17 -2.73 -0.04 0.00 2.00 0.00 0.00 34.13 33.19 3d9b s GLU 683 CO 0.12 0.60 0.11 -1.17 -0.56 0.00 0.00 175.26 174.36 3d9b s LEU 684 N -0.62 3.77 -0.02 2.70 2.96 -0.64 -0.48 118.68 126.34 3d9b s LEU 684 Ca 0.10 -0.10 0.00 0.00 -0.22 0.00 0.00 54.13 53.90 3d9b s LEU 684 Cb -0.12 -2.41 0.03 0.00 0.50 0.00 0.00 46.19 44.19 3d9b s LEU 684 CO 0.02 0.11 0.02 -0.63 -1.32 0.00 0.00 176.35 174.54 3d9b s ILE 685 N -1.62 0.04 -1.28 6.68 -1.09 0.18 -2.55 121.20 121.57 3d9b s ILE 685 Ca 0.30 0.17 -0.19 0.00 -2.23 0.00 0.00 60.65 58.70 3d9b s ILE 685 Cb -0.11 -0.16 0.05 0.00 -1.58 0.00 0.00 42.46 40.66 3d9b s ILE 685 CO 0.23 0.11 1.76 -0.62 -1.23 0.00 0.00 174.94 175.19 3d9b s ASP 686 N 1.08 6.56 0.32 3.58 2.15 -0.13 -1.14 116.67 129.09 3d9b s ASP 686 Ca -0.09 -2.31 0.16 0.00 0.43 0.00 0.00 52.55 50.74 3d9b s ASP 686 Cb -0.13 -2.58 0.46 0.00 -0.30 0.00 0.00 42.92 40.37 3d9b s ASP 686 CO -0.02 -1.47 1.63 -0.61 -0.17 0.00 0.00 175.17 174.53 3d9b h GLN 687 N 7.95 0.00 0.00 4.34 5.75 -1.79 -3.42 115.11 127.94 3d9b h GLN 687 Ca 0.41 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.91 3d9b h GLN 687 Cb 0.88 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.43 3d9b h GLN 687 CO 1.42 0.49 0.00 0.00 -2.65 0.00 0.00 178.83 178.10 3d9b n ALA 688 N -2.32 0.00 -2.71 3.38 0.00 -1.21 -5.00 120.51 112.66 3d9b n ALA 688 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.04 3d9b n ALA 688 Cb 0.59 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.06 3d9b n ALA 688 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d9b n GLY 689 N 5.00 6.01 0.09 0.00 0.00 -1.26 -4.83 105.19 110.20 3d9b n GLY 689 Ca 0.00 -2.61 0.13 0.00 0.00 0.00 0.00 46.02 43.54 3d9b n GLY 689 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d9b n LEU 690 N 0.02 0.78 0.00 0.99 4.77 -1.26 -5.05 117.00 117.25 3d9b n LEU 690 Ca 0.44 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.89 3d9b n LEU 690 Cb 0.28 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3d9b n LEU 690 CO 0.51 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 3d9b n GLY 691 N 1.32 -1.77 0.07 -0.72 0.00 -1.26 -4.42 105.19 98.40 3d9b n GLY 691 Ca 0.05 -1.33 -0.09 0.00 0.00 0.00 0.00 46.02 44.65 3d9b n GLY 691 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3d9b h HIS 692 N 0.00 0.00 -0.99 1.61 2.76 -2.01 -3.36 115.15 113.16 3d9b h HIS 692 Ca 0.00 0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.26 3d9b h HIS 692 Cb 0.00 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 28.89 3d9b h HIS 692 CO 0.00 0.61 0.63 0.93 -1.30 0.00 0.00 177.93 178.80 3d9b h GLU 693 N -1.00 1.04 0.00 5.26 3.07 -2.00 -0.95 114.58 120.00 3d9b h GLU 693 Ca -0.05 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.36 58.69 3d9b h GLU 693 Cb 0.65 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 3d9b h GLU 693 CO -0.03 0.69 -0.27 0.87 -1.40 0.00 0.00 179.01 178.87 3d9b h LYS 694 N 1.07 0.00 0.04 2.33 1.57 -1.77 -1.48 116.57 118.33 3d9b h LYS 694 Ca 0.45 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.14 3d9b h LYS 694 Cb 0.32 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.64 3d9b h LYS 694 CO -0.21 0.27 -0.39 1.25 -0.57 0.00 0.00 179.45 179.80 3d9b h LEU 695 N 0.00 0.28 -0.59 2.94 6.46 -1.33 0.63 115.31 123.69 3d9b h LEU 695 Ca -0.00 -0.87 0.05 0.00 -0.12 0.00 0.00 57.88 56.94 3d9b h LEU 695 Cb 0.61 -0.09 -0.07 0.00 -0.73 0.00 0.00 40.66 40.38 3d9b h LEU 695 CO 0.03 1.12 -0.35 0.41 -0.62 0.00 0.00 178.44 179.03 3d9b n THR 696 N -4.39 -0.40 0.23 1.05 -1.04 -0.96 0.24 114.28 109.00 3d9b n THR 696 Ca -0.11 1.81 -0.15 0.00 -2.04 0.00 0.00 64.05 63.56 3d9b n THR 696 Cb 0.60 -2.27 -0.07 0.00 -1.82 0.00 0.00 70.33 66.77 3d9b n THR 696 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 3d9b h GLN 697 N 0.00 -0.63 -0.68 -2.82 4.20 -1.19 0.55 115.11 114.55 3d9b h GLN 697 Ca 0.09 0.04 0.14 0.00 0.06 0.00 0.00 58.65 58.98 3d9b h GLN 697 Cb 0.24 0.14 -0.13 0.00 0.30 0.00 0.00 27.48 28.04 3d9b h GLN 697 CO -0.56 -0.42 -0.15 0.00 -0.67 0.00 0.00 178.83 177.03 3d9b h ALA 698 N -0.10 0.47 -0.37 3.87 0.00 -0.49 0.12 119.26 122.76 3d9b h ALA 698 Ca -0.03 0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 3d9b h ALA 698 Cb 0.56 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3d9b h ALA 698 CO -0.00 -0.42 -0.00 -0.09 0.00 0.00 0.00 179.25 178.73 3d9b h ARG 699 N 0.01 0.66 -0.72 0.00 2.43 0.56 -0.82 114.38 116.50 3d9b h ARG 699 Ca 0.33 -0.21 0.15 0.00 -0.81 0.00 0.00 59.98 59.44 3d9b h ARG 699 Cb 0.51 -0.06 -0.11 0.00 -0.42 0.00 0.00 29.97 29.89 3d9b h ARG 699 CO -0.69 0.77 0.16 -0.91 -1.51 0.00 0.00 179.97 177.79 3d9b h ASN 700 N 0.48 -0.01 0.61 -3.80 2.35 0.15 0.20 115.58 115.55 3d9b h ASN 700 Ca 0.11 0.14 -0.10 0.00 -0.55 0.00 0.00 56.30 55.90 3d9b h ASN 700 Cb 0.47 0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 3d9b h ASN 700 CO 0.02 -0.04 -0.49 -0.61 -1.65 0.00 0.00 177.43 174.66 3d9b h GLN 701 N 0.26 0.00 0.10 0.81 4.15 -0.32 0.16 115.11 120.26 3d9b h GLN 701 Ca 0.40 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.81 3d9b h GLN 701 Cb 0.67 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.36 3d9b h GLN 701 CO -0.50 0.49 -0.05 1.25 -1.93 0.00 0.00 178.83 178.09 3d9b h LEU 702 N 0.00 -0.11 -0.75 -2.39 5.85 -0.22 -2.86 115.31 114.82 3d9b h LEU 702 Ca -0.00 -0.41 0.17 0.00 0.84 0.00 0.00 57.88 58.48 3d9b h LEU 702 Cb 0.93 0.03 -0.13 0.00 0.37 0.00 0.00 40.66 41.86 3d9b h LEU 702 CO 0.06 0.53 0.05 -0.07 -0.34 0.00 0.00 178.44 178.67 3d9b h LEU 703 N -0.93 -0.26 -1.35 2.25 3.38 -0.64 0.13 115.31 117.88 3d9b h LEU 703 Ca -0.01 0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3d9b h LEU 703 Cb 0.51 0.31 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 3d9b h LEU 703 CO 0.02 -0.15 0.18 0.00 0.09 0.00 0.00 178.44 178.58 3d9b h ALA 704 N 1.69 1.49 0.00 1.53 0.00 -0.77 -2.58 119.26 120.63 3d9b h ALA 704 Ca 0.42 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 3d9b h ALA 704 Cb 0.74 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3d9b h ALA 704 CO -0.63 0.39 -0.79 0.93 0.00 0.00 0.00 179.25 179.15 3d9b h GLU 705 N 0.62 0.00 0.03 0.00 4.39 -0.97 -3.33 114.58 115.32 3d9b h GLU 705 Ca 0.15 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.61 3d9b h GLU 705 Cb 0.12 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.77 3d9b h GLU 705 CO -0.02 0.09 -1.03 0.00 -1.16 0.00 0.00 179.01 176.89 3d9b h ALA 706 N 1.87 0.26 -0.13 3.43 0.00 -0.55 -3.09 119.26 121.04 3d9b h ALA 706 Ca -0.03 -0.74 0.04 0.00 0.00 0.00 0.00 54.91 54.18 3d9b h ALA 706 Cb 1.13 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3d9b h ALA 706 CO 0.01 0.81 0.11 0.00 0.00 0.00 0.00 179.25 180.18 3d9b h ALA 707 N 0.63 1.94 0.00 0.00 0.00 -1.58 -2.56 119.26 117.69 3d9b h ALA 707 Ca -0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3d9b h ALA 707 Cb 1.68 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.48 3d9b h ALA 707 CO 0.18 -0.18 0.00 1.63 0.00 0.00 0.00 179.25 180.89 3d9b n LYS 708 N -4.20 0.94 -3.23 0.00 5.02 -1.17 -3.93 118.16 111.60 3d9b n LYS 708 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 3d9b n LYS 708 Cb 0.23 -1.20 -0.06 0.00 -0.02 0.00 0.00 35.03 33.97 3d9b n LYS 708 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3d9b n HIS 709 N -0.27 0.95 0.30 2.13 8.25 -0.96 -4.97 115.22 120.65 3d9b n HIS 709 Ca 0.00 -3.77 0.03 0.00 -0.26 0.00 0.00 57.72 53.72 3d9b n HIS 709 Cb 0.10 -0.42 0.16 0.00 1.12 0.00 0.00 29.99 30.95 3d9b n HIS 709 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3d9b n PRO 710 N 1.00 0.11 -0.02 -0.41 -0.02 -1.25 -3.35 135.00 131.06 3d9b n PRO 710 Ca 0.24 0.18 0.11 0.00 -2.02 0.00 0.00 63.50 62.02 3d9b n PRO 710 Cb 0.51 -1.50 0.10 0.00 -0.02 0.00 0.00 33.50 32.59 3d9b n PRO 710 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3d9b n ASP 711 N -1.23 2.89 -2.13 2.55 5.68 -1.26 -4.56 116.55 118.49 3d9b n ASP 711 Ca 0.03 -1.92 -0.04 0.00 -0.50 0.00 0.00 54.79 52.36 3d9b n ASP 711 Cb 0.04 -0.02 0.06 0.00 -1.14 0.00 0.00 41.12 40.06 3d9b n ASP 711 CO 0.00 0.00 0.00 1.15 -1.33 0.00 0.00 177.20 177.02 3d9b n MET 712 N 1.25 0.92 0.00 0.11 0.00 -1.21 -4.92 117.12 113.28 3d9b n MET 712 Ca 0.13 -1.16 0.00 0.00 0.00 0.00 0.00 57.70 56.68 3d9b n MET 712 Cb 0.55 0.44 0.00 0.00 0.00 0.00 0.00 33.22 34.21 3d9b n MET 712 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 3d9b n LEU 713 N -1.04 0.00 -3.81 3.17 7.94 -1.24 -4.45 117.00 117.57 3d9b n LEU 713 Ca -0.21 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.57 3d9b n LEU 713 Cb 0.82 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.68 3d9b n LEU 713 CO -0.15 0.00 -0.06 0.28 -1.11 0.00 0.00 177.39 176.35 3d9b s THR 714 N 0.00 0.07 -1.39 1.96 -1.32 -1.23 -4.30 115.64 109.44 3d9b s THR 714 Ca 0.00 -0.61 -0.02 0.00 -1.21 0.00 0.00 61.69 59.85 3d9b s THR 714 Cb 0.00 -0.61 0.01 0.00 -1.51 0.00 0.00 72.50 70.39 3d9b s THR 714 CO 0.00 -0.34 0.58 -0.24 -2.21 0.00 0.00 174.62 172.41 3d9b n SER 715 N 1.21 -1.05 -4.65 8.08 2.88 -1.26 -2.76 113.62 116.08 3d9b n SER 715 Ca -0.21 -0.92 -0.42 0.00 -1.33 0.00 0.00 58.87 55.99 3d9b n SER 715 Cb 0.56 -3.49 -0.04 0.00 -0.75 0.00 0.00 64.21 60.49 3d9b n SER 715 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3d9b s VAL 716 N -3.78 4.83 0.07 2.46 -7.23 -1.26 -4.44 120.40 111.05 3d9b s VAL 716 Ca 0.08 1.60 -0.10 0.00 -1.81 0.00 0.00 61.98 61.75 3d9b s VAL 716 Cb -0.04 -4.13 0.00 0.00 0.56 0.00 0.00 36.38 32.78 3d9b s VAL 716 CO 0.86 -0.07 0.21 0.00 -0.31 0.00 0.00 175.10 175.79 3d9b s ARG 717 N 2.77 0.79 0.33 4.82 1.70 -1.02 -4.90 118.95 123.44 3d9b s ARG 717 Ca 0.36 -0.80 -0.21 0.00 -0.47 0.00 0.00 55.73 54.61 3d9b s ARG 717 Cb -0.15 0.33 -0.10 0.00 -0.57 0.00 0.00 34.95 34.46 3d9b s ARG 717 CO 0.08 -0.25 0.86 -1.25 -1.08 0.00 0.00 175.30 173.66 3d9b s PRO 718 N -3.28 4.29 0.10 3.89 0.04 -1.26 -1.63 135.00 137.15 3d9b s PRO 718 Ca 0.00 1.04 0.26 0.00 0.04 0.00 0.00 61.00 62.34 3d9b s PRO 718 Cb 0.02 -2.57 0.71 0.00 0.04 0.00 0.00 34.50 32.70 3d9b s PRO 718 CO -0.08 0.19 1.60 -1.71 0.04 0.00 0.00 177.00 177.05 3d9b n ASN 719 N 0.07 0.54 -1.17 6.66 5.15 -1.11 -4.84 115.26 120.56 3d9b n ASN 719 Ca 0.03 0.26 0.00 0.00 -0.60 0.00 0.00 54.58 54.27 3d9b n ASN 719 Cb 0.52 -0.24 0.00 0.00 -0.53 0.00 0.00 39.78 39.53 3d9b n ASN 719 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3d9b n GLY 720 N 1.40 1.27 3.11 8.20 0.00 -1.26 -5.10 105.19 112.81 3d9b n GLY 720 Ca 0.05 -1.58 -0.09 0.00 0.00 0.00 0.00 46.02 44.40 3d9b n GLY 720 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d9b s LEU 721 N 0.00 2.46 0.20 0.99 1.43 -1.26 -5.15 118.68 117.35 3d9b s LEU 721 Ca 0.00 -0.93 0.04 0.00 -1.03 0.00 0.00 54.13 52.22 3d9b s LEU 721 Cb 0.00 0.06 -0.03 0.00 0.03 0.00 0.00 46.19 46.25 3d9b s LEU 721 CO 0.00 -0.50 0.27 -1.61 0.23 0.00 0.00 176.35 174.75 3d9b s GLU 722 N -3.51 3.27 0.06 1.70 0.41 -1.26 -4.79 118.70 114.57 3d9b s GLU 722 Ca 0.06 -0.77 -0.34 0.00 -0.41 0.00 0.00 54.97 53.51 3d9b s GLU 722 Cb 0.04 -2.82 -0.13 0.00 -1.78 0.00 0.00 34.13 29.44 3d9b s GLU 722 CO -0.07 0.46 1.72 -0.25 -0.49 0.00 0.00 175.26 176.63 3d9b n ASP 723 N -0.91 3.29 -4.42 -0.19 9.92 -1.26 -4.65 116.55 118.33 3d9b n ASP 723 Ca -0.08 1.03 -0.29 0.00 -0.53 0.00 0.00 54.79 54.92 3d9b n ASP 723 Cb 0.56 -1.41 -0.13 0.00 -0.64 0.00 0.00 41.12 39.50 3d9b n ASP 723 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3d9b s THR 724 N 2.29 2.49 0.17 -3.53 -4.23 -0.66 -4.78 115.64 107.39 3d9b s THR 724 Ca 0.85 -1.56 -0.33 0.00 -1.18 0.00 0.00 61.69 59.47 3d9b s THR 724 Cb -0.67 -2.09 -0.16 0.00 1.34 0.00 0.00 72.50 70.92 3d9b s THR 724 CO 0.43 0.16 1.19 -2.65 -0.54 0.00 0.00 174.62 173.21 3d9b n PRO 725 N 1.07 1.20 -4.41 3.99 -0.02 -1.26 -3.79 135.00 131.77 3d9b n PRO 725 Ca -0.17 0.43 -0.26 0.00 -2.02 0.00 0.00 63.50 61.48 3d9b n PRO 725 Cb 0.53 -1.94 -0.11 0.00 -0.02 0.00 0.00 33.50 31.96 3d9b n PRO 725 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3d9b s GLN 726 N -0.32 1.68 -0.62 -0.52 -0.21 0.22 -4.96 119.66 114.94 3d9b s GLN 726 Ca 0.74 -1.56 -0.13 0.00 0.02 0.00 0.00 55.36 54.43 3d9b s GLN 726 Cb -0.85 -1.88 0.16 0.00 1.00 0.00 0.00 33.01 31.43 3d9b s GLN 726 CO 0.52 0.38 0.54 0.12 -2.12 0.00 0.00 175.29 174.73 3d9b s PHE 727 N -1.96 3.46 0.03 0.91 5.36 -1.26 -2.45 117.98 122.06 3d9b s PHE 727 Ca 0.25 -1.75 -0.30 0.00 -0.96 0.00 0.00 56.93 54.16 3d9b s PHE 727 Cb -0.07 -3.69 -0.04 0.00 -0.34 0.00 0.00 43.02 38.88 3d9b s PHE 727 CO 0.13 -0.99 1.03 0.21 -1.46 0.00 0.00 175.22 174.14 3d9b s LYS 728 N 0.99 4.54 -0.19 10.12 2.47 -0.78 -4.94 119.74 131.94 3d9b s LYS 728 Ca 0.09 1.52 0.01 0.00 -1.56 0.00 0.00 55.97 56.03 3d9b s LYS 728 Cb -0.22 -3.42 0.03 0.00 -1.46 0.00 0.00 37.83 32.75 3d9b s LYS 728 CO -0.02 -0.07 -0.18 0.42 0.16 0.00 0.00 175.35 175.66 3d9b s ILE 729 N 0.88 2.09 -0.36 5.43 1.01 -1.26 -1.56 121.20 127.44 3d9b s ILE 729 Ca 0.53 -1.04 -0.16 0.00 0.00 0.00 0.00 60.65 59.98 3d9b s ILE 729 Cb -0.24 -1.93 -0.00 0.00 0.01 0.00 0.00 42.46 40.29 3d9b s ILE 729 CO 0.29 0.45 0.40 -1.81 0.00 0.00 0.00 174.94 174.27 3d9b s ASP 730 N 1.26 6.21 -0.53 3.58 1.11 -0.37 -4.96 116.67 122.97 3d9b s ASP 730 Ca 0.03 -0.27 -0.28 0.00 0.18 0.00 0.00 52.55 52.21 3d9b s ASP 730 Cb -0.14 -2.21 0.03 0.00 1.07 0.00 0.00 42.92 41.67 3d9b s ASP 730 CO -0.12 -0.40 1.14 -0.63 1.18 0.00 0.00 175.17 176.34 3d9b s ILE 731 N 2.10 4.14 -0.60 0.77 -1.09 -1.26 -1.49 121.20 123.77 3d9b s ILE 731 Ca 0.13 0.98 -0.27 0.00 -2.23 0.00 0.00 60.65 59.27 3d9b s ILE 731 Cb -0.16 -4.65 -0.01 0.00 -1.58 0.00 0.00 42.46 36.05 3d9b s ILE 731 CO 0.12 -1.17 1.76 -0.62 -1.23 0.00 0.00 174.94 173.80 3d9b s ASP 732 N 2.72 5.47 0.08 3.58 2.15 0.52 -4.86 116.67 126.33 3d9b s ASP 732 Ca 0.44 0.34 -0.23 0.00 0.43 0.00 0.00 52.55 53.52 3d9b s ASP 732 Cb -0.08 -2.53 -0.16 0.00 -0.30 0.00 0.00 42.92 39.85 3d9b s ASP 732 CO 0.28 -2.22 1.69 1.56 -0.17 0.00 0.00 175.17 176.30 3d9b h GLN 733 N 14.01 -0.02 -0.09 4.34 1.08 -1.94 -2.29 115.11 130.20 3d9b h GLN 733 Ca -0.27 0.00 0.04 0.00 -1.45 0.00 0.00 58.65 56.97 3d9b h GLN 733 Cb 1.15 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.52 3d9b h GLN 733 CO 1.21 0.04 -0.43 1.49 -0.95 0.00 0.00 178.83 180.19 3d9b h GLU 734 N -0.07 -0.51 -0.59 1.46 4.81 -1.98 0.31 114.58 118.01 3d9b h GLU 734 Ca -0.00 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 3d9b h GLU 734 Cb 0.06 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 3d9b h GLU 734 CO 0.00 -0.34 0.39 -0.22 -0.73 0.00 0.00 179.01 178.12 3d9b h LYS 735 N -0.53 0.67 -0.17 1.92 1.63 -1.93 0.70 116.57 118.86 3d9b h LYS 735 Ca 0.06 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.81 3d9b h LYS 735 Cb 0.64 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 32.11 3d9b h LYS 735 CO -0.38 0.45 0.06 0.00 -3.45 0.00 0.00 179.45 176.13 3d9b h ALA 736 N 1.66 0.23 -0.47 5.00 0.00 -0.58 0.82 119.26 125.91 3d9b h ALA 736 Ca 0.24 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.04 3d9b h ALA 736 Cb 0.08 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3d9b h ALA 736 CO -0.06 -0.16 0.30 1.96 0.00 0.00 0.00 179.25 181.28 3d9b h GLN 737 N 0.11 0.58 -0.85 0.00 4.20 0.10 -0.58 115.11 118.67 3d9b h GLN 737 Ca 0.06 -0.03 0.10 0.00 0.06 0.00 0.00 58.65 58.83 3d9b h GLN 737 Cb 0.21 -0.13 -0.07 0.00 0.30 0.00 0.00 27.48 27.79 3d9b h GLN 737 CO -0.00 0.38 0.49 0.00 -0.67 0.00 0.00 178.83 179.03 3d9b h ALA 738 N 1.19 1.21 0.00 3.87 0.00 0.59 -1.82 119.26 124.30 3d9b h ALA 738 Ca 0.18 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 3d9b h ALA 738 Cb -0.03 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3d9b h ALA 738 CO -0.06 0.12 -0.01 -0.07 0.00 0.00 0.00 179.25 179.23 3d9b h LEU 739 N 0.82 0.00 0.00 0.00 3.38 -0.62 -3.48 115.31 115.41 3d9b h LEU 739 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3d9b h LEU 739 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3d9b h LEU 739 CO -0.25 0.01 0.00 0.61 0.09 0.00 0.00 178.44 178.91 3d9b n GLY 740 N 0.92 1.39 3.72 0.83 0.00 -0.31 -4.79 105.19 106.95 3d9b n GLY 740 Ca 0.03 -0.32 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 3d9b n GLY 740 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d9b s VAL 741 N -2.00 4.79 0.26 1.61 -7.23 -0.68 -0.78 120.40 116.37 3d9b s VAL 741 Ca 0.00 -0.06 -0.30 0.00 -1.81 0.00 0.00 61.98 59.82 3d9b s VAL 741 Cb 0.00 -3.08 -0.10 0.00 0.56 0.00 0.00 36.38 33.76 3d9b s VAL 741 CO 0.00 0.56 1.34 -0.55 -0.31 0.00 0.00 175.10 176.14 3d9b s SER 742 N -0.53 6.80 0.52 4.85 0.15 -1.26 -4.42 113.70 119.81 3d9b s SER 742 Ca 0.10 2.57 0.31 0.00 0.70 0.00 0.00 55.95 59.64 3d9b s SER 742 Cb -0.12 -2.63 1.14 0.00 -1.71 0.00 0.00 66.02 62.70 3d9b s SER 742 CO 0.02 -0.56 1.90 0.40 1.20 0.00 0.00 173.24 176.20 3d9b h ILE 743 N 3.40 0.04 -0.10 6.45 5.03 -1.98 -1.72 117.51 128.63 3d9b h ILE 743 Ca -0.47 -0.65 -0.09 0.00 -0.12 0.00 0.00 64.86 63.53 3d9b h ILE 743 Cb 1.22 1.63 0.00 0.00 -3.03 0.00 0.00 36.82 36.64 3d9b h ILE 743 CO 0.73 0.01 -0.29 0.78 -0.68 0.00 0.00 178.15 178.70 3d9b h ASN 744 N 0.00 0.42 -0.15 1.72 4.21 -2.00 -2.77 115.58 117.01 3d9b h ASN 744 Ca -0.00 -0.60 0.00 0.00 1.21 0.00 0.00 56.30 56.91 3d9b h ASN 744 Cb 0.63 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.70 3d9b h ASN 744 CO 0.00 0.95 0.10 0.44 -1.29 0.00 0.00 177.43 177.62 3d9b h ASP 745 N -0.09 0.17 0.03 5.81 3.32 -1.89 -2.25 116.42 121.52 3d9b h ASP 745 Ca -0.01 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 3d9b h ASP 745 Cb 0.91 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 3d9b h ASP 745 CO 0.06 0.13 -0.05 0.40 -1.72 0.00 0.00 179.24 178.06 3d9b h ILE 746 N 0.19 0.00 -0.70 0.35 2.04 -1.40 -2.07 117.51 115.92 3d9b h ILE 746 Ca 0.05 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.05 3d9b h ILE 746 Cb -0.02 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 35.93 3d9b h ILE 746 CO -0.01 0.00 -0.20 0.78 0.00 0.00 0.00 178.15 178.72 3d9b h ASN 747 N -0.08 -0.72 -0.86 1.72 2.35 -1.55 -0.45 115.58 115.99 3d9b h ASN 747 Ca -0.00 0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.96 3d9b h ASN 747 Cb 0.08 0.46 -0.04 0.00 0.05 0.00 0.00 38.32 38.86 3d9b h ASN 747 CO -0.02 -0.24 0.51 0.74 -1.65 0.00 0.00 177.43 176.77 3d9b h THR 748 N -0.02 1.24 0.00 2.81 2.02 -1.24 0.21 112.91 117.93 3d9b h THR 748 Ca 0.33 -0.54 -0.09 0.00 0.77 0.00 0.00 66.41 66.88 3d9b h THR 748 Cb 0.52 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 3d9b h THR 748 CO -0.73 0.26 -0.43 0.71 0.37 0.00 0.00 175.52 175.69 3d9b h THR 749 N 1.19 1.19 0.00 3.16 1.35 -0.42 0.72 112.91 120.10 3d9b h THR 749 Ca 0.31 -1.54 0.00 0.00 -0.55 0.00 0.00 66.41 64.63 3d9b h THR 749 Cb -0.04 1.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 3d9b h THR 749 CO -0.06 0.42 0.00 -0.11 -0.25 0.00 0.00 175.52 175.53 3d9b n LEU 750 N -3.85 0.08 -0.20 3.87 7.94 0.04 -2.31 117.00 122.57 3d9b n LEU 750 Ca -0.01 0.74 0.14 0.00 -1.11 0.00 0.00 56.01 55.77 3d9b n LEU 750 Cb 0.48 -0.47 0.47 0.00 0.53 0.00 0.00 43.42 44.43 3d9b n LEU 750 CO 0.39 -0.47 1.21 1.23 -1.11 0.00 0.00 177.39 178.64 3d9b h GLY 751 N 0.00 0.86 0.41 -3.96 0.00 -0.75 -0.82 103.07 98.80 3d9b h GLY 751 Ca 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 3d9b h GLY 751 CO 0.00 0.07 -0.23 0.00 0.00 0.00 0.00 176.54 176.38 3d9b h ALA 752 N 1.63 -1.11 -0.82 3.60 0.00 -0.98 0.21 119.26 121.79 3d9b h ALA 752 Ca 0.40 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.26 3d9b h ALA 752 Cb 0.82 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 18.85 3d9b h ALA 752 CO -0.15 -1.08 0.48 0.00 0.00 0.00 0.00 179.25 178.50 3d9b h ALA 753 N -1.62 1.14 0.06 0.00 0.00 -0.91 -0.29 119.26 117.64 3d9b h ALA 753 Ca -0.06 0.01 -0.37 0.00 0.00 0.00 0.00 54.91 54.50 3d9b h ALA 753 Cb 0.47 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 3d9b h ALA 753 CO 0.07 0.16 -2.17 0.91 0.00 0.00 0.00 179.25 178.22 3d9b n TRP 754 N -4.70 0.70 -0.10 0.00 7.02 -0.40 -1.56 117.44 118.39 3d9b n TRP 754 Ca 0.12 0.16 -0.13 0.00 -1.02 0.00 0.00 57.50 56.63 3d9b n TRP 754 Cb 0.23 -1.10 -0.14 0.00 -2.42 0.00 0.00 31.31 27.88 3d9b n TRP 754 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3d9b n GLY 755 N 2.04 -0.76 0.00 6.99 0.00 0.58 -4.96 105.19 109.07 3d9b n GLY 755 Ca -0.36 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.40 3d9b n GLY 755 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d9b n GLY 756 N 1.93 0.67 2.67 -0.02 0.00 -0.12 -4.37 105.19 105.95 3d9b n GLY 756 Ca -0.37 -1.60 -0.26 0.00 0.00 0.00 0.00 46.02 43.79 3d9b n GLY 756 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3d9b s SER 757 N -0.91 2.39 -0.46 1.61 0.15 -0.40 -4.69 113.70 111.39 3d9b s SER 757 Ca 0.00 -0.60 -0.29 0.00 0.70 0.00 0.00 55.95 55.76 3d9b s SER 757 Cb 0.00 -0.37 -0.09 0.00 -1.71 0.00 0.00 66.02 63.85 3d9b s SER 757 CO 0.00 -0.32 2.36 0.00 1.20 0.00 0.00 173.24 176.48 3d9b n TYR 758 N 5.19 1.48 -0.04 3.44 9.36 -1.26 -2.18 117.16 133.16 3d9b n TYR 758 Ca -0.07 0.13 -0.00 0.00 3.32 0.00 0.00 57.90 61.27 3d9b n TYR 758 Cb 0.48 -2.60 -0.00 0.00 -0.63 0.00 0.00 39.34 36.59 3d9b n TYR 758 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 3d9b h VAL 759 N 7.49 0.00 -1.32 2.97 2.07 -0.71 -3.49 116.25 123.26 3d9b h VAL 759 Ca -0.26 -0.69 0.17 0.00 0.82 0.00 0.00 66.70 66.74 3d9b h VAL 759 Cb 1.28 0.00 -0.25 0.00 -1.52 0.00 0.00 31.29 30.80 3d9b h VAL 759 CO 1.11 0.00 0.75 0.54 0.02 0.00 0.00 177.57 180.00 3d9b s ASN 760 N -4.78 -0.20 1.04 0.57 2.20 -1.25 -4.99 114.94 107.54 3d9b s ASN 760 Ca -0.01 0.21 -0.12 0.00 -0.94 0.00 0.00 52.86 52.00 3d9b s ASN 760 Cb 0.00 0.17 0.22 0.00 -2.00 0.00 0.00 41.25 39.63 3d9b s ASN 760 CO 0.01 -0.19 1.08 -1.81 -2.94 0.00 0.00 177.10 173.25 3d9b s ASP 761 N -1.13 1.95 0.25 3.54 1.01 -1.26 -3.11 116.67 117.93 3d9b s ASP 761 Ca 0.04 1.77 -0.06 0.00 0.71 0.00 0.00 52.55 55.01 3d9b s ASP 761 Cb -0.01 -2.40 -0.02 0.00 1.01 0.00 0.00 42.92 41.51 3d9b s ASP 761 CO -0.03 -3.64 0.35 0.72 0.21 0.00 0.00 175.17 172.77 3d9b s PHE 762 N -2.58 0.83 -0.16 4.23 -0.12 -0.37 -4.83 117.98 114.98 3d9b s PHE 762 Ca 0.67 -1.10 -0.05 0.00 -0.05 0.00 0.00 56.93 56.40 3d9b s PHE 762 Cb -0.23 -0.16 -0.03 0.00 -0.63 0.00 0.00 43.02 41.96 3d9b s PHE 762 CO 0.61 -0.89 0.01 0.42 -0.05 0.00 0.00 175.22 175.32 3d9b s ILE 763 N -3.86 4.28 -0.40 -4.49 -1.09 -1.14 -1.30 121.20 113.20 3d9b s ILE 763 Ca 0.31 -0.22 0.04 0.00 -2.23 0.00 0.00 60.65 58.54 3d9b s ILE 763 Cb 0.02 -2.90 0.11 0.00 -1.58 0.00 0.00 42.46 38.11 3d9b s ILE 763 CO 0.13 0.48 0.12 -0.62 -1.23 0.00 0.00 174.94 173.82 3d9b s ASP 764 N 0.31 4.58 -1.06 3.58 2.15 0.12 -4.13 116.67 122.22 3d9b s ASP 764 Ca -0.01 -2.41 -0.08 0.00 0.43 0.00 0.00 52.55 50.48 3d9b s ASP 764 Cb -0.13 -1.59 -0.06 0.00 -0.30 0.00 0.00 42.92 40.83 3d9b s ASP 764 CO 0.02 -0.33 0.90 0.54 -0.17 0.00 0.00 175.17 176.12 3d9b n ARG 765 N 3.91 -2.08 -1.14 4.34 1.74 -1.26 -3.14 116.66 119.03 3d9b n ARG 765 Ca 0.04 0.81 -0.05 0.00 -0.77 0.00 0.00 57.85 57.89 3d9b n ARG 765 Cb 0.39 -5.57 -0.02 0.00 -1.02 0.00 0.00 32.46 26.24 3d9b n ARG 765 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d9b n GLY 766 N -1.30 0.73 2.87 -0.13 0.00 -1.26 -4.99 105.19 101.10 3d9b n GLY 766 Ca -0.07 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 3d9b n GLY 766 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3d9b s ARG 767 N -1.97 0.01 -0.07 1.61 3.52 -1.19 -5.13 118.95 115.74 3d9b s ARG 767 Ca 0.00 0.08 -0.26 0.00 -0.13 0.00 0.00 55.73 55.42 3d9b s ARG 767 Cb 0.00 -0.06 -0.03 0.00 -1.56 0.00 0.00 34.95 33.31 3d9b s ARG 767 CO 0.00 -0.05 0.81 0.54 -0.81 0.00 0.00 175.30 175.79 3d9b s VAL 768 N 0.30 4.96 0.21 7.11 0.11 -1.26 0.15 120.40 131.97 3d9b s VAL 768 Ca -0.02 1.66 0.01 0.00 -2.93 0.00 0.00 61.98 60.70 3d9b s VAL 768 Cb -0.04 -4.14 -0.05 0.00 -1.53 0.00 0.00 36.38 30.63 3d9b s VAL 768 CO -0.01 0.17 0.07 -0.54 -3.33 0.00 0.00 175.10 171.46 3d9b s LYS 769 N 1.19 1.22 0.44 1.54 1.02 -0.42 -4.95 119.74 119.79 3d9b s LYS 769 Ca 0.42 -1.63 -0.01 0.00 0.02 0.00 0.00 55.97 54.76 3d9b s LYS 769 Cb -0.18 -0.10 -0.02 0.00 -0.52 0.00 0.00 37.83 37.00 3d9b s LYS 769 CO 0.19 -0.26 0.68 0.15 -0.92 0.00 0.00 175.35 175.19 3d9b s LYS 770 N -4.02 3.28 -0.17 1.68 1.02 -1.26 -1.23 119.74 119.03 3d9b s LYS 770 Ca 0.32 -0.25 0.01 0.00 0.02 0.00 0.00 55.97 56.06 3d9b s LYS 770 Cb 0.07 -2.53 0.01 0.00 -0.52 0.00 0.00 37.83 34.87 3d9b s LYS 770 CO 0.09 -0.17 -0.18 0.08 -0.92 0.00 0.00 175.35 174.26 3d9b s VAL 771 N -2.56 2.33 -0.17 3.17 1.01 -1.18 -1.94 120.40 121.06 3d9b s VAL 771 Ca 0.46 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.58 3d9b s VAL 771 Cb -0.10 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.30 3d9b s VAL 771 CO 0.39 0.52 -0.16 -0.31 0.00 0.00 0.00 175.10 175.55 3d9b s TYR 772 N 1.11 2.79 0.10 5.22 2.02 -0.65 0.11 117.35 128.04 3d9b s TYR 772 Ca 0.00 -1.25 -0.03 0.00 -0.37 0.00 0.00 57.07 55.42 3d9b s TYR 772 Cb -0.14 -1.92 -0.05 0.00 -0.40 0.00 0.00 41.96 39.45 3d9b s TYR 772 CO -0.07 -0.60 0.30 0.54 -1.57 0.00 0.00 175.55 174.15 3d9b s VAL 773 N 1.04 5.26 -0.07 0.71 0.11 -0.92 -2.27 120.40 124.27 3d9b s VAL 773 Ca -0.01 -0.11 -0.31 0.00 -2.93 0.00 0.00 61.98 58.62 3d9b s VAL 773 Cb -0.15 -3.62 0.11 0.00 -1.53 0.00 0.00 36.38 31.20 3d9b s VAL 773 CO -0.04 0.11 1.00 -0.32 -3.33 0.00 0.00 175.10 172.52 3d9b s MET 774 N -2.51 0.65 0.13 1.54 0.00 -0.61 -1.27 119.30 117.23 3d9b s MET 774 Ca 0.37 -0.24 -0.31 0.00 0.00 0.00 0.00 55.69 55.52 3d9b s MET 774 Cb -0.13 0.30 -0.08 0.00 0.00 0.00 0.00 34.83 34.92 3d9b s MET 774 CO 0.25 -0.28 1.35 0.45 0.00 0.00 0.00 175.02 176.78 3d9b s SER 775 N -2.38 6.87 0.12 1.11 0.15 -0.60 0.81 113.70 119.77 3d9b s SER 775 Ca 0.07 2.32 -0.34 0.00 0.70 0.00 0.00 55.95 58.69 3d9b s SER 775 Cb -0.01 -2.59 -0.17 0.00 -1.71 0.00 0.00 66.02 61.53 3d9b s SER 775 CO -0.07 -0.60 1.03 1.21 1.20 0.00 0.00 173.24 176.01 3d9b n GLU 776 N 3.57 0.60 0.24 5.44 0.00 -0.54 -4.62 120.64 125.32 3d9b n GLU 776 Ca 0.10 0.21 0.12 0.00 0.00 0.00 0.00 57.16 57.59 3d9b n GLU 776 Cb 0.43 -1.63 0.75 0.00 0.00 0.00 0.00 31.44 30.98 3d9b n GLU 776 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3d9b h ALA 777 N 2.92 1.90 -1.27 4.31 0.00 -1.94 -2.00 119.26 123.18 3d9b h ALA 777 Ca -0.43 -0.00 0.38 0.00 0.00 0.00 0.00 54.91 54.85 3d9b h ALA 777 Cb 1.39 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 19.09 3d9b h ALA 777 CO 0.67 -0.11 0.85 0.87 0.00 0.00 0.00 179.25 181.53 3d9b h LYS 778 N 0.00 0.15 -0.57 0.00 1.57 -1.97 -2.83 116.57 112.92 3d9b h LYS 778 Ca 0.04 -0.01 -0.37 0.00 -1.87 0.00 0.00 60.65 58.44 3d9b h LYS 778 Cb 0.17 -0.03 -0.23 0.00 0.08 0.00 0.00 32.23 32.21 3d9b h LYS 778 CO -0.00 0.10 -0.17 0.66 -0.57 0.00 0.00 179.45 179.47 3d9b n TYR 779 N -4.48 1.91 -2.60 -1.35 4.02 -0.75 -4.51 117.16 109.38 3d9b n TYR 779 Ca 0.32 -2.02 -0.02 0.00 -0.01 0.00 0.00 57.90 56.16 3d9b n TYR 779 Cb 1.27 -0.59 0.11 0.00 -0.02 0.00 0.00 39.34 40.11 3d9b n TYR 779 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 3d9b n ARG 780 N -0.97 1.21 -0.00 -0.72 1.85 -1.07 -4.88 116.66 112.08 3d9b n ARG 780 Ca 0.41 -1.16 0.02 0.00 -1.00 0.00 0.00 57.85 56.13 3d9b n ARG 780 Cb 0.95 0.43 -0.03 0.00 -1.05 0.00 0.00 32.46 32.75 3d9b n ARG 780 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 3d9b n MET 781 N -1.37 2.36 -3.72 2.89 1.56 -1.25 -5.04 117.12 112.54 3d9b n MET 781 Ca -0.18 -0.03 -0.14 0.00 -0.27 0.00 0.00 57.70 57.08 3d9b n MET 781 Cb 0.85 -0.95 -0.09 0.00 2.15 0.00 0.00 33.22 35.18 3d9b n MET 781 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 3d9b s LEU 782 N -2.87 0.40 0.24 -0.89 1.43 -1.26 -5.07 118.68 110.65 3d9b s LEU 782 Ca -0.00 0.68 -0.11 0.00 -1.03 0.00 0.00 54.13 53.66 3d9b s LEU 782 Cb 0.03 1.51 0.34 0.00 0.03 0.00 0.00 46.19 48.10 3d9b s LEU 782 CO 0.20 -0.25 1.44 -2.65 0.23 0.00 0.00 176.35 175.32 3d9b n PRO 783 N 2.35 -0.14 0.08 1.29 -0.02 -1.26 0.75 135.00 138.05 3d9b n PRO 783 Ca -0.16 1.43 0.08 0.00 -2.02 0.00 0.00 63.50 62.84 3d9b n PRO 783 Cb 0.57 -2.14 0.38 0.00 -0.02 0.00 0.00 33.50 32.29 3d9b n PRO 783 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3d9b n ASP 784 N -5.45 0.35 0.22 2.55 8.00 -1.26 -2.39 116.55 118.58 3d9b n ASP 784 Ca 0.13 0.61 0.10 0.00 0.71 0.00 0.00 54.79 56.33 3d9b n ASP 784 Cb 0.42 -0.68 0.49 0.00 -0.02 0.00 0.00 41.12 41.33 3d9b n ASP 784 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3d9b h ASP 785 N 0.00 0.00 -0.77 -2.24 3.32 -0.04 -3.09 116.42 113.60 3d9b h ASP 785 Ca 0.00 0.00 0.18 0.00 0.02 0.00 0.00 57.03 57.23 3d9b h ASP 785 Cb 0.20 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.62 3d9b h ASP 785 CO 0.00 0.23 0.14 0.40 -1.72 0.00 0.00 179.24 178.29 3d9b h ILE 786 N 0.00 0.42 0.00 0.35 1.08 -1.57 -0.79 117.51 117.01 3d9b h ILE 786 Ca -0.00 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 64.40 3d9b h ILE 786 Cb 0.69 0.20 0.00 0.00 -3.07 0.00 0.00 36.82 34.64 3d9b h ILE 786 CO 0.03 0.04 0.00 0.61 -0.69 0.00 0.00 178.15 178.14 3d9b n GLY 787 N -1.38 -1.08 0.17 5.37 0.00 -1.17 -2.77 105.19 104.34 3d9b n GLY 787 Ca 0.15 0.10 0.05 0.00 0.00 0.00 0.00 46.02 46.33 3d9b n GLY 787 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3d9b h ASP 788 N 0.00 0.00 -3.55 1.61 3.32 -1.31 -3.37 116.42 113.11 3d9b h ASP 788 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 3d9b h ASP 788 Cb 0.22 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 3d9b h ASP 788 CO 0.00 0.39 0.29 0.26 -1.72 0.00 0.00 179.24 178.46 3d9b s TRP 789 N -3.26 3.83 0.24 4.55 0.52 -1.12 -4.76 118.94 118.94 3d9b s TRP 789 Ca 0.03 1.72 0.12 0.00 0.02 0.00 0.00 56.10 57.98 3d9b s TRP 789 Cb 0.09 -2.96 -0.05 0.00 -1.15 0.00 0.00 33.47 29.40 3d9b s TRP 789 CO 0.70 0.29 -0.21 0.71 0.02 0.00 0.00 176.95 178.46 3d9b s TYR 790 N -0.30 2.31 0.10 -1.98 2.02 -1.26 -3.20 117.35 115.04 3d9b s TYR 790 Ca 0.43 -0.34 -0.02 0.00 -0.37 0.00 0.00 57.07 56.77 3d9b s TYR 790 Cb -0.23 -1.07 -0.04 0.00 -0.40 0.00 0.00 41.96 40.22 3d9b s TYR 790 CO 0.28 0.61 0.04 0.14 -1.57 0.00 0.00 175.55 175.05 3d9b s VAL 791 N -2.10 0.15 -0.34 0.71 -7.23 -1.09 -4.80 120.40 105.70 3d9b s VAL 791 Ca 0.26 -1.82 -0.05 0.00 -1.81 0.00 0.00 61.98 58.56 3d9b s VAL 791 Cb -0.06 -1.81 0.05 0.00 0.56 0.00 0.00 36.38 35.12 3d9b s VAL 791 CO 0.13 -0.66 0.10 -0.60 -0.31 0.00 0.00 175.10 173.75 3d9b s ARG 792 N -3.99 2.50 1.22 4.82 3.52 -1.26 -1.30 118.95 124.46 3d9b s ARG 792 Ca 0.17 -1.30 -0.16 0.00 -0.13 0.00 0.00 55.73 54.31 3d9b s ARG 792 Cb 0.07 -3.41 0.30 0.00 -1.56 0.00 0.00 34.95 30.35 3d9b s ARG 792 CO -0.03 -0.72 1.02 0.00 -0.81 0.00 0.00 175.30 174.76 3d9b s ALA 793 N 1.33 -0.31 0.16 6.12 0.00 -1.18 -4.72 121.76 123.15 3d9b s ALA 793 Ca -0.01 -0.44 -0.15 0.00 0.00 0.00 0.00 51.96 51.35 3d9b s ALA 793 Cb -0.20 -3.11 0.04 0.00 0.00 0.00 0.00 23.12 19.85 3d9b s ALA 793 CO 0.01 -3.92 1.78 0.00 0.00 0.00 0.00 175.76 173.63 3d9b h ALA 794 N -2.76 0.60 -0.95 0.00 0.00 -1.26 -2.73 119.26 112.16 3d9b h ALA 794 Ca -0.55 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.36 3d9b h ALA 794 Cb 1.33 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 3d9b h ALA 794 CO 0.45 0.10 0.62 0.38 0.00 0.00 0.00 179.25 180.80 3d9b h ASP 795 N 0.63 0.95 0.00 0.00 3.04 -1.91 -3.46 116.42 115.66 3d9b h ASP 795 Ca 0.17 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.97 3d9b h ASP 795 Cb 0.02 -0.19 0.00 0.00 -1.04 0.00 0.00 39.33 38.12 3d9b h ASP 795 CO -0.03 0.60 0.00 0.61 -2.04 0.00 0.00 179.24 178.38 3d9b n GLY 796 N -1.38 1.74 3.69 7.15 0.00 -1.03 -5.11 105.19 110.24 3d9b n GLY 796 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3d9b n GLY 796 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d9b s GLN 797 N 0.00 4.22 0.17 1.61 -0.21 -1.26 -4.74 119.66 119.45 3d9b s GLN 797 Ca 0.00 2.21 -0.30 0.00 0.02 0.00 0.00 55.36 57.29 3d9b s GLN 797 Cb 0.00 -3.62 -0.08 0.00 1.00 0.00 0.00 33.01 30.31 3d9b s GLN 797 CO 0.00 -0.69 1.27 -1.64 -2.12 0.00 0.00 175.29 172.11 3d9b s MET 798 N 2.67 4.42 -0.06 2.91 -1.94 -1.26 -3.10 119.30 122.93 3d9b s MET 798 Ca 0.71 1.97 0.05 0.00 -1.71 0.00 0.00 55.69 56.70 3d9b s MET 798 Cb -0.37 -3.23 -0.02 0.00 2.01 0.00 0.00 34.83 33.22 3d9b s MET 798 CO 0.30 -0.23 -0.21 0.08 -0.01 0.00 0.00 175.02 174.96 3d9b s VAL 799 N 0.30 2.45 1.01 -6.03 1.01 -0.42 -4.92 120.40 113.80 3d9b s VAL 799 Ca 0.57 -0.93 -0.13 0.00 0.00 0.00 0.00 61.98 61.49 3d9b s VAL 799 Cb -0.35 -1.93 0.20 0.00 0.00 0.00 0.00 36.38 34.30 3d9b s VAL 799 CO 0.36 0.57 1.10 -2.16 0.00 0.00 0.00 175.10 174.96 3d9b s PRO 800 N -0.26 0.31 0.04 2.72 0.04 -1.26 -2.67 135.00 133.93 3d9b s PRO 800 Ca 0.00 0.43 -0.04 0.00 0.04 0.00 0.00 61.00 61.43 3d9b s PRO 800 Cb -0.13 -1.73 -0.28 0.00 0.04 0.00 0.00 34.50 32.39 3d9b s PRO 800 CO 0.03 -2.79 1.02 0.35 0.04 0.00 0.00 177.00 175.64 3d9b h PHE 801 N -1.93 0.50 0.00 0.56 3.04 -1.71 -3.24 116.94 114.16 3d9b h PHE 801 Ca -0.54 -0.37 -0.00 0.00 3.98 0.00 0.00 57.97 61.04 3d9b h PHE 801 Cb 1.33 -0.02 -0.00 0.00 2.56 0.00 0.00 35.95 39.82 3d9b h PHE 801 CO 0.16 1.34 -0.01 0.66 -2.02 0.00 0.00 178.31 178.44 3d9b h SER 802 N 0.08 0.00 -0.21 0.41 4.64 -1.83 0.12 113.55 116.76 3d9b h SER 802 Ca -0.19 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.19 3d9b h SER 802 Cb 2.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 64.02 3d9b h SER 802 CO 0.19 0.01 -0.30 0.00 -0.87 0.00 0.00 176.83 175.86 3d9b h ALA 803 N 1.99 -0.27 -0.01 5.18 0.00 -1.94 -3.33 119.26 120.89 3d9b h ALA 803 Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3d9b h ALA 803 Cb 0.01 0.59 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3d9b h ALA 803 CO 0.00 -0.75 -0.04 1.97 0.00 0.00 0.00 179.25 180.43 3d9b n PHE 804 N -5.40 0.00 -4.73 0.00 -1.74 -1.06 -4.98 117.46 99.54 3d9b n PHE 804 Ca -0.02 0.00 -0.32 0.00 -0.56 0.00 0.00 57.45 56.55 3d9b n PHE 804 Cb 0.32 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.19 3d9b n PHE 804 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 3d9b s SER 805 N -0.65 4.03 -0.14 5.98 1.04 0.40 -0.35 113.70 124.01 3d9b s SER 805 Ca 0.06 -0.28 -0.00 0.00 0.48 0.00 0.00 55.95 56.20 3d9b s SER 805 Cb 0.04 -0.79 0.03 0.00 0.10 0.00 0.00 66.02 65.41 3d9b s SER 805 CO 0.09 0.30 -0.07 -0.94 0.98 0.00 0.00 173.24 173.60 3d9b s SER 806 N -1.12 2.51 0.73 7.02 1.04 -0.56 -4.51 113.70 118.81 3d9b s SER 806 Ca 0.14 -0.48 -0.01 0.00 0.48 0.00 0.00 55.95 56.08 3d9b s SER 806 Cb -0.11 -0.90 0.13 0.00 0.10 0.00 0.00 66.02 65.25 3d9b s SER 806 CO 0.04 -0.14 1.00 -0.94 0.98 0.00 0.00 173.24 174.18 3d9b s SER 807 N 1.66 4.29 0.00 7.02 1.04 -1.26 -1.23 113.70 125.22 3d9b s SER 807 Ca 0.03 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.06 3d9b s SER 807 Cb -0.14 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.04 3d9b s SER 807 CO -0.08 -1.90 0.00 -2.11 0.98 0.00 0.00 173.24 170.13 3d9b n ARG 808 N -2.85 0.00 -1.47 4.02 1.85 -0.60 -4.91 116.66 112.70 3d9b n ARG 808 Ca 0.16 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.70 3d9b n ARG 808 Cb 0.61 0.00 0.08 0.00 -1.05 0.00 0.00 32.46 32.09 3d9b n ARG 808 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 3d9b s TRP 809 N -1.92 2.86 -0.26 2.89 0.52 -1.26 -1.86 118.94 119.91 3d9b s TRP 809 Ca 0.00 1.36 -0.28 0.00 0.02 0.00 0.00 56.10 57.21 3d9b s TRP 809 Cb 0.00 -3.00 0.16 0.00 -1.15 0.00 0.00 33.47 29.48 3d9b s TRP 809 CO 0.00 -1.59 1.23 -2.00 0.02 0.00 0.00 176.95 174.61 3d9b s GLU 810 N -5.03 0.27 0.73 4.98 2.12 -1.03 -4.83 118.70 115.90 3d9b s GLU 810 Ca 0.60 0.16 -0.06 0.00 0.36 0.00 0.00 54.97 56.03 3d9b s GLU 810 Cb -0.15 0.13 0.09 0.00 0.26 0.00 0.00 34.13 34.46 3d9b s GLU 810 CO 0.55 -0.06 1.03 0.71 -0.54 0.00 0.00 175.26 176.94 3d9b s TYR 811 N -0.56 2.44 0.00 5.30 2.02 -1.26 0.72 117.35 126.01 3d9b s TYR 811 Ca 0.05 0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.97 3d9b s TYR 811 Cb -0.03 -3.23 0.00 0.00 -0.40 0.00 0.00 41.96 38.30 3d9b s TYR 811 CO -0.07 -1.59 0.00 0.41 -1.57 0.00 0.00 175.55 172.73 3d9b n GLY 812 N -2.96 1.95 3.90 0.71 0.00 -1.25 -4.74 105.19 102.81 3d9b n GLY 812 Ca 0.10 -1.02 -0.33 0.00 0.00 0.00 0.00 46.02 44.78 3d9b n GLY 812 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3d9b s SER 813 N 0.00 6.45 0.00 1.61 0.15 -1.26 -1.66 113.70 118.99 3d9b s SER 813 Ca 0.00 0.49 0.19 0.00 0.70 0.00 0.00 55.95 57.33 3d9b s SER 813 Cb 0.00 -2.05 0.46 0.00 -1.71 0.00 0.00 66.02 62.71 3d9b s SER 813 CO 0.00 0.17 1.38 -0.81 1.20 0.00 0.00 173.24 175.18 3d9b n PRO 814 N 0.57 2.55 -2.83 5.44 -0.04 -1.26 -4.46 135.00 134.96 3d9b n PRO 814 Ca -0.07 -2.30 -0.11 0.00 -0.04 0.00 0.00 63.50 60.99 3d9b n PRO 814 Cb 0.52 -1.45 0.06 0.00 -0.04 0.00 0.00 33.50 32.59 3d9b n PRO 814 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 3d9b n ARG 815 N 1.25 1.03 -1.72 0.54 0.63 -1.25 -2.44 116.66 114.69 3d9b n ARG 815 Ca 0.18 -2.31 -0.60 0.00 -0.92 0.00 0.00 57.85 54.21 3d9b n ARG 815 Cb 0.54 -1.11 -0.08 0.00 0.45 0.00 0.00 32.46 32.26 3d9b n ARG 815 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3d9b n LEU 816 N 0.25 2.04 -4.80 6.15 4.32 -1.00 -4.78 117.00 119.18 3d9b n LEU 816 Ca 0.10 1.11 -0.22 0.00 -0.02 0.00 0.00 56.01 56.98 3d9b n LEU 816 Cb 0.71 -1.07 -0.05 0.00 -1.62 0.00 0.00 43.42 41.39 3d9b n LEU 816 CO 0.08 -0.56 -0.14 -1.61 -1.22 0.00 0.00 177.39 173.93 3d9b s GLU 817 N 3.31 2.61 -0.16 3.23 2.02 -1.26 -1.96 118.70 126.50 3d9b s GLU 817 Ca 1.00 -1.35 -0.10 0.00 0.02 0.00 0.00 54.97 54.53 3d9b s GLU 817 Cb -1.18 -2.37 0.05 0.00 0.10 0.00 0.00 34.13 30.73 3d9b s GLU 817 CO 0.70 0.15 0.39 1.03 0.02 0.00 0.00 175.26 177.55 3d9b s ARG 818 N -3.91 0.40 -0.13 1.61 0.52 -0.39 -2.72 118.95 114.33 3d9b s ARG 818 Ca 0.38 0.70 0.03 0.00 -0.52 0.00 0.00 55.73 56.32 3d9b s ARG 818 Cb -0.05 0.04 0.01 0.00 0.52 0.00 0.00 34.95 35.47 3d9b s ARG 818 CO 0.25 -0.13 -0.22 -0.47 0.02 0.00 0.00 175.30 174.75 3d9b s TYR 819 N 1.04 2.66 -1.47 -0.53 5.04 0.19 -1.85 117.35 122.43 3d9b s TYR 819 Ca -0.07 -1.25 -0.07 0.00 -2.44 0.00 0.00 57.07 53.25 3d9b s TYR 819 Cb -0.07 -1.80 0.03 0.00 0.35 0.00 0.00 41.96 40.47 3d9b s TYR 819 CO -0.09 -0.55 0.66 0.09 -1.34 0.00 0.00 175.55 174.32 3d9b n ASN 820 N 3.94 -5.43 0.00 4.32 3.02 0.54 -2.16 115.26 119.50 3d9b n ASN 820 Ca -0.20 -0.37 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 3d9b n ASN 820 Cb 0.52 -4.39 0.00 0.00 -0.61 0.00 0.00 39.78 35.30 3d9b n ASN 820 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d9b n GLY 821 N -1.49 3.00 3.75 7.41 0.00 -1.26 -4.98 105.19 111.63 3d9b n GLY 821 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 3d9b n GLY 821 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d9b s LEU 822 N 0.00 3.77 0.48 0.99 1.43 -0.92 -5.05 118.68 119.38 3d9b s LEU 822 Ca 0.00 0.07 -0.23 0.00 -1.03 0.00 0.00 54.13 52.94 3d9b s LEU 822 Cb 0.00 -2.26 -0.08 0.00 0.03 0.00 0.00 46.19 43.88 3d9b s LEU 822 CO 0.00 0.25 1.14 -2.65 0.23 0.00 0.00 176.35 175.32 3d9b n PRO 823 N 1.05 1.50 -3.79 1.29 -0.02 -1.26 0.53 135.00 134.30 3d9b n PRO 823 Ca -0.12 0.54 -0.09 0.00 -2.02 0.00 0.00 63.50 61.81 3d9b n PRO 823 Cb 0.52 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 3d9b n PRO 823 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3d9b s SER 824 N -0.80 -0.22 -0.03 2.55 1.04 -1.10 -0.96 113.70 114.17 3d9b s SER 824 Ca 0.66 -0.57 0.01 0.00 0.48 0.00 0.00 55.95 56.54 3d9b s SER 824 Cb -0.49 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.24 3d9b s SER 824 CO 0.54 -1.08 -0.04 -0.04 0.98 0.00 0.00 173.24 173.60 3d9b s MET 825 N -3.90 0.68 0.15 4.02 -1.94 -1.06 -4.08 119.30 113.17 3d9b s MET 825 Ca 0.11 -0.09 -0.11 0.00 -1.71 0.00 0.00 55.69 53.90 3d9b s MET 825 Cb -0.01 -0.71 -0.07 0.00 2.01 0.00 0.00 34.83 36.06 3d9b s MET 825 CO -0.00 -0.05 0.49 -2.00 -0.01 0.00 0.00 175.02 173.44 3d9b s GLU 826 N 0.75 3.83 -0.11 2.03 2.12 -1.26 -1.62 118.70 124.44 3d9b s GLU 826 Ca -0.09 0.28 -0.03 0.00 0.36 0.00 0.00 54.97 55.49 3d9b s GLU 826 Cb -0.12 -2.86 0.04 0.00 0.26 0.00 0.00 34.13 31.44 3d9b s GLU 826 CO -0.00 0.46 0.05 0.42 -0.54 0.00 0.00 175.26 175.65 3d9b s ILE 827 N -1.56 0.12 0.51 -3.70 1.01 0.11 -2.73 121.20 114.96 3d9b s ILE 827 Ca 0.39 0.01 0.07 0.00 0.00 0.00 0.00 60.65 61.13 3d9b s ILE 827 Cb -0.13 -0.52 0.05 0.00 0.01 0.00 0.00 42.46 41.87 3d9b s ILE 827 CO 0.20 -0.00 0.69 -0.76 0.00 0.00 0.00 174.94 175.07 3d9b s LEU 828 N 2.06 3.39 0.00 2.97 1.02 -0.65 0.52 118.68 127.99 3d9b s LEU 828 Ca 0.03 -0.51 0.00 0.00 0.02 0.00 0.00 54.13 53.67 3d9b s LEU 828 Cb -0.14 -2.30 0.00 0.00 0.02 0.00 0.00 46.19 43.77 3d9b s LEU 828 CO -0.06 -1.07 0.00 0.61 0.02 0.00 0.00 176.35 175.85 3d9b n GLY 829 N -2.10 2.62 3.92 -3.19 0.00 -1.26 -2.43 105.19 102.74 3d9b n GLY 829 Ca 0.11 -1.20 -0.20 0.00 0.00 0.00 0.00 46.02 44.73 3d9b n GLY 829 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d9b s GLN 830 N -2.06 2.59 -0.35 1.61 -1.52 -1.11 -2.39 119.66 116.43 3d9b s GLN 830 Ca 0.00 -1.48 -0.12 0.00 -1.95 0.00 0.00 55.36 51.81 3d9b s GLN 830 Cb 0.00 -2.47 -0.00 0.00 -0.22 0.00 0.00 33.01 30.32 3d9b s GLN 830 CO 0.00 -0.25 0.23 0.00 -0.25 0.00 0.00 175.29 175.02 3d9b s ALA 831 N -2.46 3.42 0.42 6.09 0.00 -1.26 -3.56 121.76 124.40 3d9b s ALA 831 Ca 0.50 -1.50 -0.19 0.00 0.00 0.00 0.00 51.96 50.77 3d9b s ALA 831 Cb -0.05 -2.64 -0.14 0.00 0.00 0.00 0.00 23.12 20.29 3d9b s ALA 831 CO 0.29 -1.11 -0.01 0.00 0.00 0.00 0.00 175.76 174.93 3d9b n ALA 832 N 5.07 -2.93 -0.16 0.00 0.00 -1.26 -4.71 120.51 116.52 3d9b n ALA 832 Ca -0.12 0.04 -0.03 0.00 0.00 0.00 0.00 53.44 53.33 3d9b n ALA 832 Cb 0.48 -1.36 -0.02 0.00 0.00 0.00 0.00 19.45 18.56 3d9b n ALA 832 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3d9b n PRO 833 N 1.32 -0.14 0.02 0.00 -0.02 -1.26 -1.06 135.00 133.86 3d9b n PRO 833 Ca 0.09 0.60 0.11 0.00 -2.02 0.00 0.00 63.50 62.28 3d9b n PRO 833 Cb 0.40 -0.88 -0.09 0.00 -0.02 0.00 0.00 33.50 32.91 3d9b n PRO 833 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d9b n GLY 834 N -1.14 -1.12 3.88 -1.23 0.00 -1.26 -4.98 105.19 99.34 3d9b n GLY 834 Ca 0.02 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.25 3d9b n GLY 834 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d9b s LYS 835 N -3.34 3.74 0.45 1.61 -0.14 -0.22 -5.10 119.74 116.73 3d9b s LYS 835 Ca -0.02 0.14 -0.08 0.00 -1.36 0.00 0.00 55.97 54.65 3d9b s LYS 835 Cb 0.14 -2.85 0.11 0.00 -1.68 0.00 0.00 37.83 33.54 3d9b s LYS 835 CO 0.86 0.46 0.45 -1.13 -0.76 0.00 0.00 175.35 175.23 3d9b n SER 836 N 0.36 -1.04 -0.04 2.83 3.41 -1.26 -4.15 113.62 113.73 3d9b n SER 836 Ca -0.04 -0.87 -0.13 0.00 -0.26 0.00 0.00 58.87 57.57 3d9b n SER 836 Cb 0.52 -0.39 -0.11 0.00 -0.26 0.00 0.00 64.21 63.97 3d9b n SER 836 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3d9b h THR 837 N -1.80 1.56 -0.82 6.66 2.02 -1.93 -3.22 112.91 115.39 3d9b h THR 837 Ca -0.16 -1.66 0.19 0.00 0.77 0.00 0.00 66.41 65.54 3d9b h THR 837 Cb 0.48 2.69 -0.12 0.00 -1.74 0.00 0.00 68.15 69.46 3d9b h THR 837 CO 0.11 0.43 0.28 1.23 0.37 0.00 0.00 175.52 177.94 3d9b h GLY 838 N -0.69 1.27 0.20 2.16 0.00 -1.96 -0.87 103.07 103.17 3d9b h GLY 838 Ca -0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 3d9b h GLY 838 CO 0.00 -0.23 -0.01 0.83 0.00 0.00 0.00 176.54 177.13 3d9b h GLU 839 N 0.33 0.01 -1.06 4.80 5.08 -1.95 -2.61 114.58 119.18 3d9b h GLU 839 Ca 0.49 -0.01 0.28 0.00 -1.00 0.00 0.00 59.36 59.12 3d9b h GLU 839 Cb 0.88 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.02 3d9b h GLU 839 CO -0.52 0.82 0.67 0.00 -1.00 0.00 0.00 179.01 178.97 3d9b h ALA 840 N 0.19 2.17 0.67 3.43 0.00 -1.44 -0.02 119.26 124.26 3d9b h ALA 840 Ca -0.00 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3d9b h ALA 840 Cb 0.83 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.67 3d9b h ALA 840 CO 0.00 -0.62 -0.32 0.52 0.00 0.00 0.00 179.25 178.83 3d9b h MET 841 N 0.40 -0.87 -0.91 0.00 2.86 -1.20 -2.90 114.93 112.31 3d9b h MET 841 Ca 0.63 0.06 0.22 0.00 -2.06 0.00 0.00 59.70 58.55 3d9b h MET 841 Cb 1.55 0.20 -0.17 0.00 0.06 0.00 0.00 31.60 33.24 3d9b h MET 841 CO -0.36 -0.55 -0.09 0.39 1.06 0.00 0.00 176.91 177.36 3d9b n GLU 842 N -5.39 -0.08 -0.20 1.72 1.02 -0.07 0.16 120.64 117.80 3d9b n GLU 842 Ca -0.12 1.39 -0.08 0.00 -0.02 0.00 0.00 57.16 58.32 3d9b n GLU 842 Cb 0.37 -2.14 0.02 0.00 -0.02 0.00 0.00 31.44 29.67 3d9b n GLU 842 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3d9b h LEU 843 N 0.00 0.84 -1.44 -4.62 5.85 -1.51 -2.23 115.31 112.20 3d9b h LEU 843 Ca 0.50 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 3d9b h LEU 843 Cb 0.93 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 3d9b h LEU 843 CO -0.89 0.83 -0.28 0.24 -0.34 0.00 0.00 178.44 178.00 3d9b h MET 844 N 0.81 0.00 0.00 1.25 2.86 0.18 0.30 114.93 120.32 3d9b h MET 844 Ca 0.19 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.72 3d9b h MET 844 Cb 0.29 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 3d9b h MET 844 CO -0.00 0.28 -0.52 0.93 1.06 0.00 0.00 176.91 178.65 3d9b h GLU 845 N 0.00 0.00 0.00 1.72 5.08 -0.25 -2.72 114.58 118.41 3d9b h GLU 845 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3d9b h GLU 845 Cb 0.55 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 3d9b h GLU 845 CO 0.04 0.52 -0.00 1.96 -1.00 0.00 0.00 179.01 180.52 3d9b h GLN 846 N 0.00 0.00 -1.00 2.33 4.20 -0.77 -3.32 115.11 116.55 3d9b h GLN 846 Ca -0.01 0.00 0.21 0.00 0.06 0.00 0.00 58.65 58.91 3d9b h GLN 846 Cb 1.12 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.79 3d9b h GLN 846 CO 0.07 0.58 0.62 -0.07 -0.67 0.00 0.00 178.83 179.35 3d9b h LEU 847 N -1.00 0.68 -0.17 1.46 3.38 -0.53 0.43 115.31 119.56 3d9b h LEU 847 Ca -0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3d9b h LEU 847 Cb 0.58 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3d9b h LEU 847 CO -0.00 0.21 0.00 0.00 0.09 0.00 0.00 178.44 178.74 3d9b n ALA 848 N -2.37 1.83 0.06 1.53 0.00 -1.03 -3.04 120.51 117.50 3d9b n ALA 848 Ca 0.24 -0.02 -0.12 0.00 0.00 0.00 0.00 53.44 53.53 3d9b n ALA 848 Cb 0.65 -1.33 -0.13 0.00 0.00 0.00 0.00 19.45 18.64 3d9b n ALA 848 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3d9b h SER 849 N 0.00 0.21 0.00 0.00 4.64 -0.23 -3.23 113.55 114.94 3d9b h SER 849 Ca 0.00 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 3d9b h SER 849 Cb 0.36 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3d9b h SER 849 CO 0.00 1.20 0.00 0.29 -0.87 0.00 0.00 176.83 177.45 3d9b n LYS 850 N -3.39 0.77 -1.45 4.77 4.76 -1.17 -4.87 118.16 117.57 3d9b n LYS 850 Ca -0.08 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.07 3d9b n LYS 850 Cb 1.00 -1.07 0.16 0.00 -1.84 0.00 0.00 35.03 33.28 3d9b n LYS 850 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3d9b s LEU 851 N -1.14 1.83 0.91 -0.35 1.43 -1.22 -5.05 118.68 115.09 3d9b s LEU 851 Ca 0.05 0.91 -0.11 0.00 -1.03 0.00 0.00 54.13 53.95 3d9b s LEU 851 Cb 0.02 -3.11 0.14 0.00 0.03 0.00 0.00 46.19 43.27 3d9b s LEU 851 CO 0.04 -2.85 1.11 -2.84 0.23 0.00 0.00 176.35 172.04 3d9b s PRO 852 N -5.29 1.11 0.10 1.29 0.02 -1.26 -4.98 135.00 126.00 3d9b s PRO 852 Ca 0.66 1.23 -0.30 0.00 0.02 0.00 0.00 61.00 62.61 3d9b s PRO 852 Cb -0.14 -1.76 -0.06 0.00 0.02 0.00 0.00 34.50 32.56 3d9b s PRO 852 CO 0.54 -2.46 1.19 0.99 -0.33 0.00 0.00 177.00 176.93 3d9b s THR 853 N -2.74 3.92 0.00 0.99 2.01 -1.26 -2.97 115.64 115.59 3d9b s THR 853 Ca 0.65 1.45 0.00 0.00 0.31 0.00 0.00 61.69 64.10 3d9b s THR 853 Cb -0.21 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.37 3d9b s THR 853 CO 0.58 0.15 0.00 0.61 -0.69 0.00 0.00 174.62 175.27 3d9b n GLY 854 N 2.87 3.24 3.69 4.40 0.00 -1.26 -5.02 105.19 113.11 3d9b n GLY 854 Ca 0.07 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 3d9b n GLY 854 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d9b s VAL 855 N -0.10 4.54 0.00 1.61 1.01 -1.16 -2.52 120.40 123.79 3d9b s VAL 855 Ca 0.00 1.83 0.00 0.00 0.00 0.00 0.00 61.98 63.81 3d9b s VAL 855 Cb 0.00 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.20 3d9b s VAL 855 CO 0.00 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.73 3d9b n GLY 856 N 3.19 5.90 3.59 4.51 0.00 -0.29 -4.84 105.19 117.24 3d9b n GLY 856 Ca 0.09 -1.79 -0.09 0.00 0.00 0.00 0.00 46.02 44.23 3d9b n GLY 856 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3d9b s TYR 857 N -0.38 -0.06 0.15 1.61 -0.85 -1.26 -0.65 117.35 115.91 3d9b s TYR 857 Ca 0.00 -0.30 -0.22 0.00 -0.52 0.00 0.00 57.07 56.03 3d9b s TYR 857 Cb 0.00 0.42 0.07 0.00 0.38 0.00 0.00 41.96 42.82 3d9b s TYR 857 CO 0.00 -0.98 0.58 0.34 -1.52 0.00 0.00 175.55 173.97 3d9b s ASP 858 N -2.90 -0.53 -0.42 -0.18 -1.08 0.36 -4.93 116.67 107.00 3d9b s ASP 858 Ca 0.11 -0.01 -0.14 0.00 -0.52 0.00 0.00 52.55 52.00 3d9b s ASP 858 Cb -0.02 0.58 0.04 0.00 -1.46 0.00 0.00 42.92 42.06 3d9b s ASP 858 CO 0.00 -0.94 0.29 0.26 0.52 0.00 0.00 175.17 175.31 3d9b s TRP 859 N -3.64 3.25 0.55 -5.34 0.52 -1.26 -0.53 118.94 112.49 3d9b s TRP 859 Ca 0.01 -0.84 0.06 0.00 0.02 0.00 0.00 56.10 55.34 3d9b s TRP 859 Cb -0.01 -2.71 0.06 0.00 -1.15 0.00 0.00 33.47 29.67 3d9b s TRP 859 CO -0.12 -0.67 0.76 -0.08 0.02 0.00 0.00 176.95 176.86 3d9b s THR 860 N 1.62 2.46 0.00 2.01 -1.32 -1.12 -4.01 115.64 115.28 3d9b s THR 860 Ca 0.04 -0.88 0.00 0.00 -1.21 0.00 0.00 61.69 59.64 3d9b s THR 860 Cb -0.21 -2.59 0.00 0.00 -1.51 0.00 0.00 72.50 68.20 3d9b s THR 860 CO 0.08 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.10 3d9b n GLY 861 N -2.25 2.27 0.48 6.08 0.00 -1.26 -2.08 105.19 108.43 3d9b n GLY 861 Ca 0.12 -0.20 0.30 0.00 0.00 0.00 0.00 46.02 46.24 3d9b n GLY 861 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d9b h MET 862 N 0.00 0.08 0.00 1.61 -0.00 -1.92 0.16 114.93 114.85 3d9b h MET 862 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3d9b h MET 862 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 31.60 31.58 3d9b h MET 862 CO 0.00 0.05 0.00 0.77 -0.00 0.00 0.00 176.91 177.73 3d9b h SER 863 N 0.08 0.00 0.43 -0.10 0.02 -1.73 -3.32 113.55 108.93 3d9b h SER 863 Ca 0.52 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.44 3d9b h SER 863 Cb 1.90 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.44 3d9b h SER 863 CO -0.06 0.00 -0.20 0.22 -1.14 0.00 0.00 176.83 175.65 3d9b h TYR 864 N 0.00 -0.53 0.00 3.45 3.20 -0.60 -3.38 116.97 119.12 3d9b h TYR 864 Ca 0.00 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 3d9b h TYR 864 Cb 0.72 0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 3d9b h TYR 864 CO 0.00 -0.21 -0.16 -0.56 -1.64 0.00 0.00 178.16 175.59 3d9b h GLN 865 N -0.96 0.00 0.00 1.82 3.07 -1.72 -3.51 115.11 113.82 3d9b h GLN 865 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.68 3d9b h GLN 865 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.12 3d9b h GLN 865 CO 0.10 0.16 0.00 -1.91 0.09 0.00 0.00 178.83 177.27 3d9b n GLU 866 N -4.25 0.00 0.00 0.06 2.13 -1.25 -4.97 120.64 112.36 3d9b n GLU 866 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 3d9b n GLU 866 Cb 0.23 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.94 3d9b n GLU 866 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3d9b n ARG 867 N 0.00 0.00 0.00 5.31 5.12 -1.26 -5.03 116.66 120.80 3d9b n ARG 867 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 3d9b n ARG 867 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 3d9b n ARG 867 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3d9b n LEU 868 N 0.00 0.00 -4.55 0.55 4.77 -1.26 -4.94 117.00 111.57 3d9b n LEU 868 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 3d9b n LEU 868 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 3d9b n LEU 868 CO 0.00 0.00 1.99 -1.20 -1.33 0.00 0.00 177.39 176.85 3d9b n SER 869 N 0.00 2.42 0.00 -1.43 7.64 -1.26 -1.89 113.62 119.10 3d9b n SER 869 Ca 0.00 -0.26 0.00 0.00 1.01 0.00 0.00 58.87 59.62 3d9b n SER 869 Cb 0.00 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 61.67 3d9b n SER 869 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d9b n GLY 870 N 6.01 0.55 0.86 0.23 0.00 -1.26 -5.02 105.19 106.57 3d9b n GLY 870 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 3d9b n GLY 870 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3d9b n ASN 871 N 0.00 0.93 0.00 1.61 2.85 -0.79 -5.03 115.26 114.83 3d9b n ASN 871 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 3d9b n ASN 871 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 3d9b n ASN 871 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3d9b n GLN 872 N -2.66 0.00 -0.43 1.20 1.13 -1.26 -4.92 117.38 110.44 3d9b n GLN 872 Ca 0.00 0.00 0.36 0.00 -1.94 0.00 0.00 57.00 55.42 3d9b n GLN 872 Cb 0.37 -0.05 0.59 0.00 0.11 0.00 0.00 30.24 31.26 3d9b n GLN 872 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3d9b n ALA 873 N -2.27 1.22 0.30 -1.58 0.00 -1.26 0.92 120.51 117.83 3d9b n ALA 873 Ca 0.00 0.69 0.19 0.00 0.00 0.00 0.00 53.44 54.32 3d9b n ALA 873 Cb 0.00 -0.90 0.84 0.00 0.00 0.00 0.00 19.45 19.39 3d9b n ALA 873 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3d9b h PRO 874 N 0.00 0.00 0.00 0.00 0.11 -1.93 0.48 132.00 130.66 3d9b h PRO 874 Ca 0.74 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.78 3d9b h PRO 874 Cb 2.51 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 33.61 3d9b h PRO 874 CO -0.32 0.00 -0.36 1.03 -0.21 0.00 0.00 178.00 178.14 3d9b h SER 875 N 0.00 0.00 0.41 -2.05 0.87 0.15 -1.80 113.55 111.13 3d9b h SER 875 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 3d9b h SER 875 Cb 0.36 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 3d9b h SER 875 CO 0.00 0.36 -0.20 -0.07 -0.53 0.00 0.00 176.83 176.39 3d9b h LEU 876 N 0.00 -0.47 -0.68 2.23 3.38 -0.13 -2.23 115.31 117.41 3d9b h LEU 876 Ca -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3d9b h LEU 876 Cb 1.18 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 3d9b h LEU 876 CO 0.05 -0.07 0.38 1.88 0.09 0.00 0.00 178.44 180.77 3d9b h TYR 877 N -0.94 0.93 -0.45 1.13 0.99 -1.60 0.17 116.97 117.19 3d9b h TYR 877 Ca -0.06 -0.02 0.06 0.00 2.00 0.00 0.00 58.73 60.72 3d9b h TYR 877 Cb 0.56 -0.30 -0.05 0.00 1.00 0.00 0.00 36.73 37.93 3d9b h TYR 877 CO 0.02 0.65 0.13 0.00 -0.00 0.00 0.00 178.16 178.96 3d9b h ALA 878 N 1.19 0.52 -0.12 3.88 0.00 -1.35 1.20 119.26 124.58 3d9b h ALA 878 Ca 0.24 0.07 -0.20 0.00 0.00 0.00 0.00 54.91 55.02 3d9b h ALA 878 Cb 0.02 0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.89 3d9b h ALA 878 CO -0.04 -0.27 -0.69 -0.84 0.00 0.00 0.00 179.25 177.41 3d9b h ILE 879 N 0.28 1.31 -0.79 0.00 3.07 -1.39 -2.78 117.51 117.21 3d9b h ILE 879 Ca 0.21 -1.94 0.17 0.00 1.55 0.00 0.00 64.86 64.85 3d9b h ILE 879 Cb 0.24 2.11 -0.05 0.00 -0.27 0.00 0.00 36.82 38.84 3d9b h ILE 879 CO -0.24 0.60 0.53 -1.28 -1.05 0.00 0.00 178.15 176.71 3d9b h SER 880 N 0.36 0.37 -0.30 2.16 0.87 -0.03 1.02 113.55 118.00 3d9b h SER 880 Ca -0.05 0.03 -0.13 0.00 -1.23 0.00 0.00 61.79 60.40 3d9b h SER 880 Cb 1.34 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 63.25 3d9b h SER 880 CO 0.14 0.18 -0.33 0.25 -0.53 0.00 0.00 176.83 176.54 3d9b h LEU 881 N 0.38 0.81 -0.12 2.23 5.85 0.15 -1.67 115.31 122.95 3d9b h LEU 881 Ca 0.39 -0.48 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 3d9b h LEU 881 Cb 0.97 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.76 3d9b h LEU 881 CO -0.13 1.13 -0.03 0.40 -0.34 0.00 0.00 178.44 179.47 3d9b h ILE 882 N 0.51 1.29 -0.21 4.05 1.08 -0.74 -2.78 117.51 120.72 3d9b h ILE 882 Ca 0.04 -0.98 0.05 0.00 -0.39 0.00 0.00 64.86 63.58 3d9b h ILE 882 Cb 0.92 1.70 -0.05 0.00 -3.07 0.00 0.00 36.82 36.32 3d9b h ILE 882 CO 0.08 0.28 -0.08 0.58 -0.69 0.00 0.00 178.15 178.32 3d9b h VAL 883 N -0.09 0.73 -0.07 1.67 2.07 0.10 -1.47 116.25 119.19 3d9b h VAL 883 Ca 0.03 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.59 3d9b h VAL 883 Cb 0.45 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 3d9b h VAL 883 CO 0.01 0.00 -0.20 0.58 0.02 0.00 0.00 177.57 177.98 3d9b h VAL 884 N -0.04 0.51 -0.89 2.57 2.07 -1.39 -2.23 116.25 116.84 3d9b h VAL 884 Ca 0.11 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.87 3d9b h VAL 884 Cb 0.21 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 3d9b h VAL 884 CO -0.24 0.00 0.63 0.15 0.02 0.00 0.00 177.57 178.12 3d9b h PHE 885 N -0.29 0.13 0.19 1.57 3.57 -1.09 -1.13 116.94 119.90 3d9b h PHE 885 Ca 0.08 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 3d9b h PHE 885 Cb 0.40 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.10 3d9b h PHE 885 CO -0.28 0.03 -0.09 -0.07 -2.23 0.00 0.00 178.31 175.67 3d9b h LEU 886 N 0.09 -0.22 -1.38 0.59 3.38 -0.66 -2.29 115.31 114.82 3d9b h LEU 886 Ca 0.43 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 3d9b h LEU 886 Cb 1.57 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.37 3d9b h LEU 886 CO -0.05 0.19 -0.25 0.00 0.09 0.00 0.00 178.44 178.42 3d9b h LEU 888 N 0.00 -0.12 -0.97 0.00 3.38 -1.30 0.13 115.31 116.43 3d9b h LEU 888 Ca -0.00 -0.20 0.14 0.00 0.09 0.00 0.00 57.88 57.91 3d9b h LEU 888 Cb 0.62 0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.31 3d9b h LEU 888 CO 0.03 0.13 0.59 0.00 0.09 0.00 0.00 178.44 179.29 3d9b h ALA 889 N 0.50 1.50 0.44 1.53 0.00 -0.70 -0.86 119.26 121.67 3d9b h ALA 889 Ca -0.01 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3d9b h ALA 889 Cb 0.31 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3d9b h ALA 889 CO 0.02 0.10 -0.31 0.00 0.00 0.00 0.00 179.25 179.06 3d9b h ALA 890 N 1.57 -1.09 -0.68 0.00 0.00 -0.31 0.28 119.26 119.02 3d9b h ALA 890 Ca 0.51 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.42 3d9b h ALA 890 Cb 0.62 0.47 -0.10 0.00 0.00 0.00 0.00 17.79 18.77 3d9b h ALA 890 CO -0.31 -1.08 0.12 1.25 0.00 0.00 0.00 179.25 179.23 3d9b h LEU 891 N -0.71 -0.08 0.00 0.00 5.85 -0.25 -2.97 115.31 117.15 3d9b h LEU 891 Ca -0.06 0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.73 3d9b h LEU 891 Cb 0.59 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 3d9b h LEU 891 CO 0.03 -0.06 -1.13 1.88 -0.34 0.00 0.00 178.44 178.83 3d9b h TYR 892 N 0.22 0.00 -5.56 1.25 0.99 -1.16 -3.49 116.97 109.22 3d9b h TYR 892 Ca 0.37 0.00 -0.28 0.00 2.00 0.00 0.00 58.73 60.83 3d9b h TYR 892 Cb 0.62 0.00 0.18 0.00 1.00 0.00 0.00 36.73 38.53 3d9b h TYR 892 CO -0.29 0.26 -0.87 0.39 -0.00 0.00 0.00 178.16 177.64 3d9b n GLU 893 N -2.80 -2.15 -3.66 4.88 -0.58 0.97 -5.05 120.64 112.26 3d9b n GLU 893 Ca -0.04 0.81 -0.12 0.00 -0.42 0.00 0.00 57.16 57.39 3d9b n GLU 893 Cb 0.68 -5.59 -0.08 0.00 -0.57 0.00 0.00 31.44 25.87 3d9b n GLU 893 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3d9b s SER 894 N -3.41 -0.72 0.00 1.62 0.15 -1.08 -5.01 113.70 105.25 3d9b s SER 894 Ca 0.46 1.30 0.26 0.00 0.70 0.00 0.00 55.95 58.67 3d9b s SER 894 Cb -0.08 1.27 0.78 0.00 -1.71 0.00 0.00 66.02 66.28 3d9b s SER 894 CO 0.76 -0.22 1.60 0.79 1.20 0.00 0.00 173.24 177.36 3d9b n TRP 895 N 3.26 0.00 -0.06 3.44 5.03 -1.26 -4.20 117.44 123.66 3d9b n TRP 895 Ca -0.16 0.00 -0.11 0.00 3.03 0.00 0.00 57.50 60.26 3d9b n TRP 895 Cb 0.56 -0.30 -0.04 0.00 -1.03 0.00 0.00 31.31 30.51 3d9b n TRP 895 CO 0.00 0.00 0.00 -1.13 -0.03 0.00 0.00 177.69 176.53 3d9b n SER 896 N -1.38 1.47 -0.07 -0.99 3.41 -1.26 -4.73 113.62 110.07 3d9b n SER 896 Ca 0.07 0.24 0.19 0.00 -0.26 0.00 0.00 58.87 59.12 3d9b n SER 896 Cb 0.33 -0.56 0.63 0.00 -0.26 0.00 0.00 64.21 64.35 3d9b n SER 896 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3d9b h ILE 897 N -0.63 0.74 -0.88 -1.33 2.04 -1.85 0.59 117.51 116.18 3d9b h ILE 897 Ca -0.18 -0.05 0.19 0.00 1.00 0.00 0.00 64.86 65.82 3d9b h ILE 897 Cb 0.94 0.59 -0.11 0.00 -0.74 0.00 0.00 36.82 37.50 3d9b h ILE 897 CO -0.11 0.02 0.43 1.55 0.00 0.00 0.00 178.15 180.04 3d9b h PRO 898 N 0.13 0.51 -0.94 2.37 0.13 -1.85 -0.61 132.00 131.75 3d9b h PRO 898 Ca 0.30 -0.03 0.21 0.00 -0.87 0.00 0.00 66.00 65.61 3d9b h PRO 898 Cb 1.01 -0.11 -0.12 0.00 0.13 0.00 0.00 31.00 31.91 3d9b h PRO 898 CO -0.04 0.34 0.50 0.74 -0.23 0.00 0.00 178.00 179.30 3d9b h PHE 899 N 0.52 0.85 -1.02 1.56 0.04 -1.17 -1.70 116.94 116.03 3d9b h PHE 899 Ca 0.52 0.04 0.26 0.00 2.80 0.00 0.00 57.97 61.59 3d9b h PHE 899 Cb 0.88 -0.23 -0.12 0.00 2.20 0.00 0.00 35.95 38.67 3d9b h PHE 899 CO -0.11 0.08 0.61 0.66 -0.60 0.00 0.00 178.31 178.95 3d9b h SER 900 N 0.56 0.61 0.00 2.17 4.64 -1.21 -2.18 113.55 118.13 3d9b h SER 900 Ca 0.57 0.13 -0.00 0.00 -0.47 0.00 0.00 61.79 62.02 3d9b h SER 900 Cb 1.01 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 3d9b h SER 900 CO -0.46 0.07 -0.01 0.58 -0.87 0.00 0.00 176.83 176.14 3d9b h VAL 901 N 0.51 0.20 -0.96 0.95 2.07 -1.41 -3.39 116.25 114.23 3d9b h VAL 901 Ca 0.65 -1.15 0.31 0.00 0.82 0.00 0.00 66.70 67.32 3d9b h VAL 901 Cb 1.36 0.38 -0.16 0.00 -1.52 0.00 0.00 31.29 31.35 3d9b h VAL 901 CO -0.46 0.07 0.32 0.24 0.02 0.00 0.00 177.57 177.76 3d9b h MET 902 N -1.00 0.12 0.00 1.57 2.07 -1.11 0.24 114.93 116.82 3d9b h MET 902 Ca -0.00 -0.01 0.00 0.00 -2.07 0.00 0.00 59.70 57.62 3d9b h MET 902 Cb 0.12 -0.03 0.00 0.00 -1.87 0.00 0.00 31.60 29.82 3d9b h MET 902 CO -0.00 0.08 0.00 1.28 1.07 0.00 0.00 176.91 179.34 3d9b n LEU 903 N -5.27 0.00 0.10 1.22 4.77 -0.87 -0.43 117.00 116.51 3d9b n LEU 903 Ca 0.28 0.32 -0.06 0.00 -0.03 0.00 0.00 56.01 56.52 3d9b n LEU 903 Cb 0.91 -0.32 0.04 0.00 -2.33 0.00 0.00 43.42 41.72 3d9b n LEU 903 CO 0.02 -0.31 0.34 1.62 -1.33 0.00 0.00 177.39 177.73 3d9b h VAL 904 N 0.00 1.50 -0.96 4.08 3.04 -0.75 -3.38 116.25 119.78 3d9b h VAL 904 Ca 0.00 -2.51 0.19 0.00 -1.01 0.00 0.00 66.70 63.37 3d9b h VAL 904 Cb 0.01 2.37 -0.18 0.00 -2.01 0.00 0.00 31.29 31.47 3d9b h VAL 904 CO 0.00 0.73 -0.25 0.58 -1.01 0.00 0.00 177.57 177.62 3d9b h VAL 905 N 0.07 0.04 0.00 1.51 2.07 -0.93 0.88 116.25 119.90 3d9b h VAL 905 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 3d9b h VAL 905 Cb 1.37 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3d9b h VAL 905 CO 0.11 0.00 0.00 -2.65 0.02 0.00 0.00 177.57 175.05 3d9b n PRO 906 N -5.60 0.48 0.04 1.57 -0.02 -1.26 -3.15 135.00 127.06 3d9b n PRO 906 Ca 0.15 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.62 3d9b n PRO 906 Cb 0.48 -1.34 -0.08 0.00 -0.02 0.00 0.00 33.50 32.53 3d9b n PRO 906 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3d9b h LEU 907 N 0.00 0.00 0.12 2.45 3.38 0.54 -3.12 115.31 118.68 3d9b h LEU 907 Ca 0.00 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.67 3d9b h LEU 907 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3d9b h LEU 907 CO 0.00 0.64 -1.55 1.23 0.09 0.00 0.00 178.44 178.85 3d9b h GLY 908 N 3.64 0.29 0.66 0.83 0.00 -1.68 -2.85 103.07 103.95 3d9b h GLY 908 Ca -0.16 -0.73 0.18 0.00 0.00 0.00 0.00 47.33 46.62 3d9b h GLY 908 CO 0.06 0.64 0.49 -2.08 0.00 0.00 0.00 176.54 175.65 3d9b h VAL 909 N -0.23 0.72 -0.47 4.60 2.07 -1.69 0.66 116.25 121.90 3d9b h VAL 909 Ca -0.33 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 3d9b h VAL 909 Cb 1.82 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 3d9b h VAL 909 CO 0.06 0.03 0.11 -0.29 0.02 0.00 0.00 177.57 177.51 3d9b h ILE 910 N 0.19 1.24 -0.06 4.57 6.09 -1.71 -1.77 117.51 126.05 3d9b h ILE 910 Ca 0.35 -0.83 -0.06 0.00 -1.37 0.00 0.00 64.86 62.95 3d9b h ILE 910 Cb 1.09 0.88 0.00 0.00 0.47 0.00 0.00 36.82 39.27 3d9b h ILE 910 CO -0.06 0.30 -0.19 1.23 -3.07 0.00 0.00 178.15 176.35 3d9b h GLY 911 N 0.63 0.25 -0.29 8.18 0.00 -0.15 -1.57 103.07 110.12 3d9b h GLY 911 Ca 0.15 -0.33 0.18 0.00 0.00 0.00 0.00 47.33 47.32 3d9b h GLY 911 CO 0.00 0.30 0.11 0.00 0.00 0.00 0.00 176.54 176.95 3d9b h ALA 912 N 0.43 0.95 -0.24 3.60 0.00 -0.01 -0.92 119.26 123.06 3d9b h ALA 912 Ca -0.01 0.22 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3d9b h ALA 912 Cb 0.83 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3d9b h ALA 912 CO 0.04 -0.41 0.01 -0.07 0.00 0.00 0.00 179.25 178.82 3d9b h LEU 913 N 0.18 0.41 0.61 0.00 3.38 -1.22 -2.75 115.31 115.92 3d9b h LEU 913 Ca 0.45 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3d9b h LEU 913 Cb 0.81 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 3d9b h LEU 913 CO -0.62 0.60 -0.47 -0.07 0.09 0.00 0.00 178.44 177.97 3d9b h LEU 914 N 0.20 -1.24 -1.43 1.67 3.38 -0.15 0.18 115.31 117.92 3d9b h LEU 914 Ca 0.07 0.09 0.24 0.00 0.09 0.00 0.00 57.88 58.37 3d9b h LEU 914 Cb 0.39 0.39 -0.08 0.00 0.09 0.00 0.00 40.66 41.44 3d9b h LEU 914 CO 0.01 -0.67 0.65 0.00 0.09 0.00 0.00 178.44 178.52 3d9b h ALA 915 N -0.88 2.24 -0.13 1.53 0.00 -1.42 0.18 119.26 120.77 3d9b h ALA 915 Ca -0.08 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3d9b h ALA 915 Cb 0.88 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 3d9b h ALA 915 CO 0.02 -0.60 -0.16 0.00 0.00 0.00 0.00 179.25 178.50 3d9b h ALA 916 N 1.61 0.20 -0.27 0.00 0.00 -1.01 -3.13 119.26 116.65 3d9b h ALA 916 Ca 0.55 -0.34 -0.18 0.00 0.00 0.00 0.00 54.91 54.94 3d9b h ALA 916 Cb 1.40 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 3d9b h ALA 916 CO -0.24 0.10 -0.53 1.15 0.00 0.00 0.00 179.25 179.72 3d9b h THR 917 N -0.05 1.29 -0.04 0.00 2.02 0.56 -3.00 112.91 113.68 3d9b h THR 917 Ca 0.02 -1.73 0.00 0.00 0.77 0.00 0.00 66.41 65.47 3d9b h THR 917 Cb 0.71 1.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.76 3d9b h THR 917 CO 0.04 0.56 0.00 0.49 0.37 0.00 0.00 175.52 176.98 3d9b n PHE 918 N -4.00 0.07 -1.43 3.16 3.01 0.50 -3.22 117.46 115.55 3d9b n PHE 918 Ca -0.04 -0.03 0.03 0.00 1.01 0.00 0.00 57.45 58.42 3d9b n PHE 918 Cb 0.61 -0.02 0.04 0.00 -0.01 0.00 0.00 39.48 40.11 3d9b n PHE 918 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3d9b n ARG 919 N -0.31 0.62 0.00 -1.08 5.12 -1.18 -4.98 116.66 114.85 3d9b n ARG 919 Ca 0.02 -1.45 0.00 0.00 -1.93 0.00 0.00 57.85 54.48 3d9b n ARG 919 Cb 0.08 -0.84 0.00 0.00 -1.16 0.00 0.00 32.46 30.53 3d9b n ARG 919 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3d9b n GLY 920 N -0.48 1.46 3.44 -0.13 0.00 -1.20 -4.95 105.19 103.34 3d9b n GLY 920 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3d9b n GLY 920 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d9b n LEU 921 N 0.00 0.10 -4.53 0.99 4.32 -1.14 -5.03 117.00 111.72 3d9b n LEU 921 Ca 0.00 0.29 -0.25 0.00 -0.02 0.00 0.00 56.01 56.03 3d9b n LEU 921 Cb 0.00 -1.23 -0.10 0.00 -1.62 0.00 0.00 43.42 40.47 3d9b n LEU 921 CO 0.00 -3.37 -0.41 0.28 -1.22 0.00 0.00 177.39 172.68 3d9b s THR 922 N -2.42 2.32 -0.83 -5.08 -1.32 -1.26 -4.63 115.64 102.42 3d9b s THR 922 Ca 0.58 -2.25 -0.25 0.00 -1.21 0.00 0.00 61.69 58.57 3d9b s THR 922 Cb -0.21 -2.57 0.03 0.00 -1.51 0.00 0.00 72.50 68.24 3d9b s THR 922 CO 0.66 -0.25 1.44 0.21 -2.21 0.00 0.00 174.62 174.47 3d9b s ASN 923 N -3.59 6.12 0.34 8.08 2.47 -0.97 -4.81 114.94 122.59 3d9b s ASN 923 Ca 0.32 -0.73 0.04 0.00 0.42 0.00 0.00 52.86 52.91 3d9b s ASN 923 Cb 0.00 -2.56 -0.06 0.00 -1.45 0.00 0.00 41.25 37.19 3d9b s ASN 923 CO 0.16 -1.84 0.06 1.51 -3.72 0.00 0.00 177.10 173.28 3d9b s ASP 924 N 4.87 2.49 0.19 -4.21 -4.77 -1.26 -0.93 116.67 113.04 3d9b s ASP 924 Ca 0.44 -1.42 -0.21 0.00 -3.30 0.00 0.00 52.55 48.06 3d9b s ASP 924 Cb -0.06 -0.00 0.12 0.00 -1.09 0.00 0.00 42.92 41.89 3d9b s ASP 924 CO 0.06 -0.65 1.58 0.58 0.70 0.00 0.00 175.17 177.44 3d9b h VAL 925 N 2.05 0.15 0.02 2.11 2.07 -1.08 -1.04 116.25 120.54 3d9b h VAL 925 Ca -0.40 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.14 3d9b h VAL 925 Cb 1.25 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3d9b h VAL 925 CO 0.68 0.00 -0.15 1.88 0.02 0.00 0.00 177.57 180.00 3d9b h TYR 926 N -0.16 -0.39 -0.82 1.57 -1.99 -1.96 -1.71 116.97 111.50 3d9b h TYR 926 Ca 0.23 0.01 0.15 0.00 2.00 0.00 0.00 58.73 61.13 3d9b h TYR 926 Cb 0.55 0.17 -0.15 0.00 2.00 0.00 0.00 36.73 39.30 3d9b h TYR 926 CO -0.66 -0.22 -0.27 0.35 -0.00 0.00 0.00 178.16 177.36 3d9b h PHE 927 N -0.26 -0.65 0.53 4.88 3.04 -1.44 -0.64 116.94 122.40 3d9b h PHE 927 Ca 0.04 0.08 -0.02 0.00 3.98 0.00 0.00 57.97 62.06 3d9b h PHE 927 Cb 0.32 0.41 -0.01 0.00 2.56 0.00 0.00 35.95 39.23 3d9b h PHE 927 CO -0.19 -0.37 -0.37 1.96 -2.02 0.00 0.00 178.31 177.31 3d9b h GLN 928 N -0.03 -0.84 -0.81 1.11 4.20 -0.71 0.63 115.11 118.66 3d9b h GLN 928 Ca 0.36 0.06 0.16 0.00 0.06 0.00 0.00 58.65 59.29 3d9b h GLN 928 Cb 0.60 0.19 -0.06 0.00 0.30 0.00 0.00 27.48 28.52 3d9b h GLN 928 CO -0.86 -0.56 0.54 -0.39 -0.67 0.00 0.00 178.83 176.89 3d9b h VAL 929 N -0.87 0.78 0.27 -0.54 -1.51 -0.86 0.46 116.25 113.98 3d9b h VAL 929 Ca -0.06 -0.16 -0.01 0.00 -1.23 0.00 0.00 66.70 65.24 3d9b h VAL 929 Cb 0.73 0.27 0.00 0.00 -2.13 0.00 0.00 31.29 30.16 3d9b h VAL 929 CO 0.03 0.09 -0.13 1.23 -1.23 0.00 0.00 177.57 177.55 3d9b h GLY 930 N 0.47 -0.38 -0.43 5.19 0.00 -0.01 -2.27 103.07 105.64 3d9b h GLY 930 Ca 0.40 0.14 0.11 0.00 0.00 0.00 0.00 47.33 47.99 3d9b h GLY 930 CO -0.15 -0.14 -0.31 -2.00 0.00 0.00 0.00 176.54 173.94 3d9b h LEU 931 N -0.50 -1.08 0.06 3.11 6.46 0.46 0.18 115.31 124.00 3d9b h LEU 931 Ca -0.04 0.23 0.01 0.00 -0.12 0.00 0.00 57.88 57.96 3d9b h LEU 931 Cb 0.37 0.56 -0.03 0.00 -0.73 0.00 0.00 40.66 40.83 3d9b h LEU 931 CO 0.06 -0.29 -0.29 -0.07 -0.62 0.00 0.00 178.44 177.23 3d9b h LEU 932 N -0.13 -0.88 -1.08 2.25 4.07 -0.69 0.32 115.31 119.16 3d9b h LEU 932 Ca 0.25 0.09 0.37 0.00 0.08 0.00 0.00 57.88 58.67 3d9b h LEU 932 Cb 0.55 0.33 -0.15 0.00 1.08 0.00 0.00 40.66 42.46 3d9b h LEU 932 CO -0.69 -0.31 0.61 0.74 -1.08 0.00 0.00 178.44 177.71 3d9b h THR 933 N -0.41 0.19 -0.15 0.22 2.02 -0.81 1.45 112.91 115.41 3d9b h THR 933 Ca -0.00 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.08 3d9b h THR 933 Cb 0.42 -0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 3d9b h THR 933 CO -0.16 0.03 -0.03 0.74 0.37 0.00 0.00 175.52 176.48 3d9b h THR 934 N 0.19 1.28 -0.06 3.16 2.02 0.62 0.15 112.91 120.26 3d9b h THR 934 Ca 0.78 -0.95 -0.09 0.00 0.77 0.00 0.00 66.41 66.93 3d9b h THR 934 Cb 1.99 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 69.98 3d9b h THR 934 CO -0.62 0.28 -0.36 0.16 0.37 0.00 0.00 175.52 175.35 3d9b h ILE 935 N -0.00 1.28 0.33 3.11 3.07 0.36 -2.02 117.51 123.64 3d9b h ILE 935 Ca 0.04 -1.34 -0.02 0.00 1.55 0.00 0.00 64.86 65.09 3d9b h ILE 935 Cb 0.44 1.64 0.00 0.00 -0.27 0.00 0.00 36.82 38.63 3d9b h ILE 935 CO 0.01 0.39 -0.19 1.23 -1.05 0.00 0.00 178.15 178.55 3d9b h GLY 936 N 1.14 -0.66 -0.11 0.16 0.00 0.20 -1.74 103.07 102.07 3d9b h GLY 936 Ca 0.01 0.27 0.17 0.00 0.00 0.00 0.00 47.33 47.77 3d9b h GLY 936 CO 0.05 -0.23 0.18 1.41 0.00 0.00 0.00 176.54 177.95 3d9b h LEU 937 N -0.49 0.01 -0.64 3.11 3.38 -0.68 -0.72 115.31 119.30 3d9b h LEU 937 Ca -0.05 0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 3d9b h LEU 937 Cb 0.38 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 3d9b h LEU 937 CO 0.05 -0.05 0.19 0.77 0.09 0.00 0.00 178.44 179.50 3d9b h SER 938 N 0.27 0.93 -0.08 -0.43 4.64 -1.42 -0.25 113.55 117.21 3d9b h SER 938 Ca 0.43 -0.21 0.04 0.00 -0.47 0.00 0.00 61.79 61.57 3d9b h SER 938 Cb 0.74 -0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 62.54 3d9b h SER 938 CO -0.52 0.90 -0.21 0.00 -0.87 0.00 0.00 176.83 176.13 3d9b h ALA 939 N 1.07 -0.21 -0.02 5.18 0.00 -0.22 -0.34 119.26 124.73 3d9b h ALA 939 Ca 0.20 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.17 3d9b h ALA 939 Cb 0.31 0.40 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 3d9b h ALA 939 CO -0.00 -0.68 -0.28 -0.22 0.00 0.00 0.00 179.25 178.07 3d9b h LYS 940 N -0.29 -0.40 -0.59 0.00 3.64 -0.97 0.54 116.57 118.50 3d9b h LYS 940 Ca 0.08 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.61 3d9b h LYS 940 Cb 0.41 0.09 -0.09 0.00 -0.41 0.00 0.00 32.23 32.23 3d9b h LYS 940 CO -0.25 -0.26 0.07 -0.91 -2.27 0.00 0.00 179.45 175.82 3d9b h ASN 941 N -0.41 -0.12 0.66 4.20 -0.26 -0.62 -1.56 115.58 117.46 3d9b h ASN 941 Ca 0.07 0.13 -0.03 0.00 -0.56 0.00 0.00 56.30 55.90 3d9b h ASN 941 Cb 0.51 0.20 0.01 0.00 -1.06 0.00 0.00 38.32 37.97 3d9b h ASN 941 CO -0.25 -0.05 -0.32 0.00 -1.06 0.00 0.00 177.43 175.75 3d9b h ALA 942 N 1.50 -0.98 -0.77 -0.83 0.00 -0.58 -3.16 119.26 114.44 3d9b h ALA 942 Ca 0.31 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 55.18 3d9b h ALA 942 Cb 0.47 0.34 -0.15 0.00 0.00 0.00 0.00 17.79 18.46 3d9b h ALA 942 CO -0.44 -0.91 -0.16 -0.89 0.00 0.00 0.00 179.25 176.84 3d9b n ILE 943 N -5.03 -0.32 -0.03 0.00 5.41 0.19 0.85 119.36 120.43 3d9b n ILE 943 Ca -0.11 1.75 -0.09 0.00 1.00 0.00 0.00 62.75 65.29 3d9b n ILE 943 Cb 0.35 -2.44 0.06 0.00 -0.71 0.00 0.00 39.64 36.90 3d9b n ILE 943 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3d9b h LEU 944 N 0.00 0.72 0.56 1.39 3.38 -1.38 0.40 115.31 120.38 3d9b h LEU 944 Ca 0.38 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3d9b h LEU 944 Cb 0.63 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 41.18 3d9b h LEU 944 CO -0.78 1.05 -0.27 0.40 0.09 0.00 0.00 178.44 178.93 3d9b h ILE 945 N 0.54 0.44 0.12 1.22 2.04 0.49 -0.72 117.51 121.64 3d9b h ILE 945 Ca 0.04 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.84 3d9b h ILE 945 Cb 0.97 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3d9b h ILE 945 CO 0.09 0.01 -0.24 1.62 0.00 0.00 0.00 178.15 179.63 3d9b h VAL 946 N -0.79 0.00 -0.34 1.67 3.04 -1.31 0.34 116.25 118.86 3d9b h VAL 946 Ca -0.08 0.00 0.03 0.00 -1.01 0.00 0.00 66.70 65.64 3d9b h VAL 946 Cb 0.59 0.00 -0.04 0.00 -2.01 0.00 0.00 31.29 29.83 3d9b h VAL 946 CO 0.13 0.00 -0.20 1.21 -1.01 0.00 0.00 177.57 177.70 3d9b n GLU 947 N -3.78 -0.15 -0.07 4.17 4.07 0.14 0.18 120.64 125.19 3d9b n GLU 947 Ca -0.04 0.65 -0.07 0.00 -0.06 0.00 0.00 57.16 57.64 3d9b n GLU 947 Cb 0.20 -0.97 -0.01 0.00 -0.06 0.00 0.00 31.44 30.60 3d9b n GLU 947 CO 0.00 0.00 0.00 0.74 -0.06 0.00 0.00 177.13 177.81 3d9b h PHE 948 N 0.00 0.05 -0.56 4.31 -1.00 -0.80 -1.23 116.94 117.70 3d9b h PHE 948 Ca 0.05 0.02 0.11 0.00 2.81 0.00 0.00 57.97 60.96 3d9b h PHE 948 Cb 0.14 0.02 -0.11 0.00 3.61 0.00 0.00 35.95 39.61 3d9b h PHE 948 CO -0.48 -0.01 -0.29 0.00 -1.61 0.00 0.00 178.31 175.92 3d9b h ALA 949 N 1.21 0.04 0.02 2.45 0.00 0.19 -1.97 119.26 121.22 3d9b h ALA 949 Ca 0.13 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.23 3d9b h ALA 949 Cb 0.15 0.70 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 3d9b h ALA 949 CO -0.19 -0.63 -0.20 -0.22 0.00 0.00 0.00 179.25 178.02 3d9b h LYS 950 N -0.14 -0.32 -0.96 0.00 3.64 0.14 -2.29 116.57 116.63 3d9b h LYS 950 Ca 0.24 0.02 0.22 0.00 -1.27 0.00 0.00 60.65 59.86 3d9b h LYS 950 Cb 0.53 0.07 -0.08 0.00 -0.41 0.00 0.00 32.23 32.35 3d9b h LYS 950 CO -0.65 -0.21 0.62 -0.44 -2.27 0.00 0.00 179.45 176.50 3d9b h ASP 951 N -0.33 0.46 0.18 4.20 3.32 -0.60 0.90 116.42 124.54 3d9b h ASP 951 Ca 0.05 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3d9b h ASP 951 Cb 0.39 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3d9b h ASP 951 CO -0.17 0.16 0.00 0.18 -1.72 0.00 0.00 179.24 177.69 3d9b n LEU 952 N -4.56 0.00 -0.10 1.55 4.77 -0.87 -0.42 117.00 117.36 3d9b n LEU 952 Ca 0.21 0.10 -0.16 0.00 -0.03 0.00 0.00 56.01 56.14 3d9b n LEU 952 Cb 0.74 -0.10 -0.09 0.00 -2.33 0.00 0.00 43.42 41.64 3d9b n LEU 952 CO 0.28 -0.01 -1.16 0.23 -1.33 0.00 0.00 177.39 175.40 3d9b n MET 953 N -1.10 0.48 0.00 3.23 2.81 0.28 -3.27 117.12 119.56 3d9b n MET 953 Ca 0.19 0.13 0.14 0.00 -1.81 0.00 0.00 57.70 56.35 3d9b n MET 953 Cb 0.14 -1.36 0.55 0.00 -0.71 0.00 0.00 33.22 31.85 3d9b n MET 953 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3d9b n ASP 954 N -3.29 0.31 -0.05 7.83 10.43 0.47 -3.46 116.55 128.78 3d9b n ASP 954 Ca -0.37 -0.18 -0.09 0.00 2.57 0.00 0.00 54.79 56.72 3d9b n ASP 954 Cb 0.85 -0.14 -0.05 0.00 1.84 0.00 0.00 41.12 43.63 3d9b n ASP 954 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 3d9b n LYS 955 N -1.23 0.25 0.00 -1.24 4.81 0.44 -4.99 118.16 116.19 3d9b n LYS 955 Ca 0.11 0.08 0.00 0.00 -0.87 0.00 0.00 58.31 57.62 3d9b n LYS 955 Cb 0.30 -1.09 0.00 0.00 0.02 0.00 0.00 35.03 34.26 3d9b n LYS 955 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3d9b n GLU 956 N -3.06 0.00 0.00 1.64 4.71 -1.25 -4.60 120.64 118.07 3d9b n GLU 956 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 56.95 3d9b n GLU 956 Cb 0.68 -0.30 0.00 0.00 -1.01 0.00 0.00 31.44 30.81 3d9b n GLU 956 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3d9b n GLY 957 N 2.65 -0.01 2.91 0.62 0.00 -1.22 -2.55 105.19 107.59 3d9b n GLY 957 Ca 0.00 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 3d9b n GLY 957 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d9b s LYS 958 N 0.00 1.57 0.36 1.61 1.02 -1.20 -3.43 119.74 119.67 3d9b s LYS 958 Ca 0.00 -0.27 -0.26 0.00 0.02 0.00 0.00 55.97 55.46 3d9b s LYS 958 Cb 0.00 -1.61 -0.12 0.00 -0.52 0.00 0.00 37.83 35.58 3d9b s LYS 958 CO 0.00 -0.26 0.98 0.41 -0.92 0.00 0.00 175.35 175.56 3d9b n GLY 959 N 4.90 -0.31 0.34 -3.33 0.00 -0.20 -4.33 105.19 102.26 3d9b n GLY 959 Ca -0.13 0.22 0.11 0.00 0.00 0.00 0.00 46.02 46.22 3d9b n GLY 959 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3d9b n LEU 960 N 0.89 -0.21 0.28 0.99 -0.00 -1.26 0.10 117.00 117.80 3d9b n LEU 960 Ca 0.09 1.65 0.12 0.00 -0.00 0.00 0.00 56.01 57.87 3d9b n LEU 960 Cb 0.36 -0.56 0.80 0.00 -0.00 0.00 0.00 43.42 44.02 3d9b n LEU 960 CO 0.58 -1.63 1.10 -0.29 -0.00 0.00 0.00 177.39 177.15 3d9b h ILE 961 N 0.00 0.71 0.06 1.47 2.10 -1.88 0.12 117.51 120.09 3d9b h ILE 961 Ca 0.54 -0.03 -0.21 0.00 1.08 0.00 0.00 64.86 66.24 3d9b h ILE 961 Cb 1.00 1.02 -0.01 0.00 -1.09 0.00 0.00 36.82 37.74 3d9b h ILE 961 CO -0.94 0.01 -1.09 -0.08 -1.08 0.00 0.00 178.15 174.96 3d9b h GLU 962 N 0.00 0.13 0.01 2.19 4.22 0.39 -3.39 114.58 118.13 3d9b h GLU 962 Ca -0.00 -0.22 -0.19 0.00 0.08 0.00 0.00 59.36 59.04 3d9b h GLU 962 Cb 0.02 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 3d9b h GLU 962 CO 0.00 1.10 -0.88 0.00 -2.18 0.00 0.00 179.01 177.05 3d9b h ALA 963 N -0.17 0.55 -0.11 2.92 0.00 -0.75 -3.11 119.26 118.59 3d9b h ALA 963 Ca -0.26 -0.77 -0.01 0.00 0.00 0.00 0.00 54.91 53.87 3d9b h ALA 963 Cb 1.48 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 3d9b h ALA 963 CO -0.03 1.03 0.04 1.79 0.00 0.00 0.00 179.25 182.08 3d9b h THR 964 N 0.03 1.16 -0.07 0.00 1.35 -0.98 0.96 112.91 115.35 3d9b h THR 964 Ca -0.02 -0.47 -0.11 0.00 -0.55 0.00 0.00 66.41 65.26 3d9b h THR 964 Cb 1.54 1.26 0.01 0.00 -1.73 0.00 0.00 68.15 69.23 3d9b h THR 964 CO 0.12 0.14 -0.38 0.17 -0.25 0.00 0.00 175.52 175.32 3d9b h LEU 965 N 0.01 0.45 -1.63 3.87 8.10 -1.75 0.35 115.31 124.71 3d9b h LEU 965 Ca 0.04 -0.66 0.29 0.00 0.11 0.00 0.00 57.88 57.66 3d9b h LEU 965 Cb 0.18 -0.13 -0.07 0.00 -0.44 0.00 0.00 40.66 40.20 3d9b h LEU 965 CO -0.00 1.04 0.73 -0.78 -4.11 0.00 0.00 178.44 175.32 3d9b h ASP 966 N -0.11 0.25 0.13 0.17 -0.00 -1.55 0.46 116.42 115.78 3d9b h ASP 966 Ca -0.03 0.05 -0.01 0.00 -0.00 0.00 0.00 57.03 57.04 3d9b h ASP 966 Cb 1.05 0.01 0.00 0.00 -0.00 0.00 0.00 39.33 40.39 3d9b h ASP 966 CO 0.08 0.04 -0.06 0.00 -0.00 0.00 0.00 179.24 179.30 3d9b h ALA 967 N 1.54 -0.18 -0.61 -0.78 0.00 -0.31 -3.22 119.26 115.71 3d9b h ALA 967 Ca 0.57 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 55.33 3d9b h ALA 967 Cb 1.79 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.59 3d9b h ALA 967 CO -0.18 -0.33 0.26 0.28 0.00 0.00 0.00 179.25 179.28 3d9b h VAL 968 N -0.71 0.84 0.00 0.00 2.07 0.40 0.68 116.25 119.52 3d9b h VAL 968 Ca -0.02 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 67.28 3d9b h VAL 968 Cb 0.52 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 3d9b h VAL 968 CO 0.03 0.09 -0.28 0.08 0.02 0.00 0.00 177.57 177.51 3d9b h ARG 969 N 0.48 0.00 -0.03 1.57 0.11 -1.15 -0.31 114.38 115.04 3d9b h ARG 969 Ca 0.29 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 60.23 3d9b h ARG 969 Cb 0.31 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.37 3d9b h ARG 969 CO -0.26 0.28 -0.65 1.98 0.10 0.00 0.00 179.97 181.42 3d9b h MET 970 N 0.00 0.14 0.00 0.08 4.05 -0.93 -3.34 114.93 114.93 3d9b h MET 970 Ca -0.00 -0.11 -0.07 0.00 -0.28 0.00 0.00 59.70 59.24 3d9b h MET 970 Cb 0.60 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.41 3d9b h MET 970 CO 0.04 0.74 -1.90 -2.13 0.23 0.00 0.00 176.91 173.88 3d9b n ARG 971 N -3.82 0.66 -0.16 0.39 3.00 -0.47 -4.63 116.66 111.63 3d9b n ARG 971 Ca -0.02 -0.10 -0.03 0.00 -0.00 0.00 0.00 57.85 57.69 3d9b n ARG 971 Cb 0.64 -1.58 0.06 0.00 0.00 0.00 0.00 32.46 31.59 3d9b n ARG 971 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 3d9b h LEU 972 N 0.00 0.20 0.66 6.15 7.12 -1.21 -2.25 115.31 125.98 3d9b h LEU 972 Ca -0.10 0.06 -0.03 0.00 0.13 0.00 0.00 57.88 57.94 3d9b h LEU 972 Cb 1.23 0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 41.39 3d9b h LEU 972 CO 0.01 0.14 -0.40 -0.09 -0.13 0.00 0.00 178.44 177.97 3d9b h ARG 973 N 0.37 -0.96 -1.01 1.25 2.43 -1.82 -0.46 114.38 114.17 3d9b h ARG 973 Ca 0.24 0.07 0.26 0.00 -0.81 0.00 0.00 59.98 59.73 3d9b h ARG 973 Cb 0.24 0.22 -0.07 0.00 -0.42 0.00 0.00 29.97 29.93 3d9b h ARG 973 CO -0.23 -0.64 0.67 -1.00 -1.51 0.00 0.00 179.97 177.26 3d9b h PRO 974 N -1.00 0.30 0.09 0.20 0.13 -1.83 0.38 132.00 130.27 3d9b h PRO 974 Ca -0.09 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 3d9b h PRO 974 Cb 0.80 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.86 3d9b h PRO 974 CO 0.09 0.20 -0.04 0.82 -0.23 0.00 0.00 178.00 178.83 3d9b h ILE 975 N 0.30 1.02 -0.90 -3.56 2.04 -0.97 -1.19 117.51 114.26 3d9b h ILE 975 Ca 0.54 -0.40 0.03 0.00 1.00 0.00 0.00 64.86 66.04 3d9b h ILE 975 Cb 1.55 1.27 -0.05 0.00 -0.74 0.00 0.00 36.82 38.85 3d9b h ILE 975 CO -0.20 0.10 0.58 -0.07 0.00 0.00 0.00 178.15 178.56 3d9b h LEU 976 N -0.31 0.97 0.57 1.44 3.38 0.55 -1.44 115.31 120.48 3d9b h LEU 976 Ca -0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3d9b h LEU 976 Cb 0.26 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.79 3d9b h LEU 976 CO 0.02 0.67 -0.28 0.24 0.09 0.00 0.00 178.44 179.19 3d9b h MET 977 N 1.14 -0.74 -0.67 1.13 2.86 -0.08 0.68 114.93 119.23 3d9b h MET 977 Ca 0.35 0.05 0.07 0.00 -2.06 0.00 0.00 59.70 58.11 3d9b h MET 977 Cb -0.02 0.17 -0.04 0.00 0.06 0.00 0.00 31.60 31.77 3d9b h MET 977 CO -0.11 -0.44 0.45 1.15 1.06 0.00 0.00 176.91 179.01 3d9b h THR 978 N -0.95 1.00 0.03 2.22 2.02 -1.28 -0.84 112.91 115.11 3d9b h THR 978 Ca -0.08 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 3d9b h THR 978 Cb 0.65 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 3d9b h THR 978 CO 0.13 0.12 -0.02 -1.28 0.37 0.00 0.00 175.52 174.85 3d9b h SER 979 N 0.67 -0.04 -0.43 4.18 0.87 -0.95 -2.19 113.55 115.67 3d9b h SER 979 Ca 0.29 -0.67 -0.02 0.00 -1.23 0.00 0.00 61.79 60.16 3d9b h SER 979 Cb 0.29 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 3d9b h SER 979 CO -0.09 0.72 0.19 0.25 -0.53 0.00 0.00 176.83 177.37 3d9b h LEU 980 N -0.86 0.61 -0.24 2.23 6.46 0.34 0.26 115.31 124.11 3d9b h LEU 980 Ca -0.00 -0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.71 3d9b h LEU 980 Cb 0.71 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.46 3d9b h LEU 980 CO 0.01 0.55 0.09 0.00 -0.62 0.00 0.00 178.44 178.47 3d9b h ALA 981 N 1.54 0.27 0.13 1.25 0.00 -1.19 -2.05 119.26 119.20 3d9b h ALA 981 Ca 0.16 0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.81 3d9b h ALA 981 Cb 0.13 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.93 3d9b h ALA 981 CO -0.02 -0.32 -1.23 0.35 0.00 0.00 0.00 179.25 178.03 3d9b h PHE 982 N 0.21 0.67 -0.20 0.00 3.57 -0.77 0.76 116.94 121.17 3d9b h PHE 982 Ca 0.10 -0.45 -0.00 0.00 3.53 0.00 0.00 57.97 61.14 3d9b h PHE 982 Cb 0.06 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 3d9b h PHE 982 CO -0.11 1.33 0.12 0.82 -2.23 0.00 0.00 178.31 178.23 3d9b h ILE 983 N 0.14 1.09 -0.11 1.41 2.04 -0.52 -0.30 117.51 121.26 3d9b h ILE 983 Ca -0.15 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 3d9b h ILE 983 Cb 1.93 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.88 3d9b h ILE 983 CO 0.21 0.09 -0.02 -0.07 0.00 0.00 0.00 178.15 178.36 3d9b h LEU 984 N 0.23 0.20 -0.97 1.44 3.38 -1.40 -3.02 115.31 115.17 3d9b h LEU 984 Ca 0.07 -0.35 0.29 0.00 0.09 0.00 0.00 57.88 57.98 3d9b h LEU 984 Cb 0.04 -0.05 -0.18 0.00 0.09 0.00 0.00 40.66 40.56 3d9b h LEU 984 CO -0.01 0.51 0.15 1.23 0.09 0.00 0.00 178.44 180.40 3d9b h GLY 985 N -0.11 1.44 1.45 0.83 0.00 0.10 0.28 103.07 107.06 3d9b h GLY 985 Ca 0.03 0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.43 3d9b h GLY 985 CO 0.01 -0.54 -0.44 -0.39 0.00 0.00 0.00 176.54 175.17 3d9b h VAL 986 N 0.04 0.00 -0.97 4.60 -1.51 -1.11 -3.39 116.25 113.91 3d9b h VAL 986 Ca 0.63 -0.60 0.32 0.00 -1.23 0.00 0.00 66.70 65.82 3d9b h VAL 986 Cb 1.38 1.33 -0.17 0.00 -2.13 0.00 0.00 31.29 31.70 3d9b h VAL 986 CO -0.85 0.00 0.32 -0.03 -1.23 0.00 0.00 177.57 175.78 3d9b h MET 987 N 0.00 0.10 -0.87 5.19 -1.53 -0.30 0.69 114.93 118.21 3d9b h MET 987 Ca 0.00 -0.01 0.15 0.00 -3.44 0.00 0.00 59.70 56.41 3d9b h MET 987 Cb 0.80 -0.02 -0.07 0.00 -0.55 0.00 0.00 31.60 31.76 3d9b h MET 987 CO 0.00 0.07 0.56 -1.35 0.14 0.00 0.00 176.91 176.33 3d9b h PRO 988 N 0.11 0.58 -0.17 0.39 0.11 -1.75 -2.67 132.00 128.60 3d9b h PRO 988 Ca 0.69 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 66.57 3d9b h PRO 988 Cb 1.58 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.56 3d9b h PRO 988 CO -0.76 0.38 -0.67 -0.07 -0.21 0.00 0.00 178.00 176.67 3d9b h LEU 989 N 0.60 0.77 -0.27 2.35 3.38 0.11 -2.19 115.31 120.05 3d9b h LEU 989 Ca 0.44 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3d9b h LEU 989 Cb 0.81 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3d9b h LEU 989 CO -0.19 1.23 0.00 0.55 0.09 0.00 0.00 178.44 180.12 3d9b n VAL 990 N -3.93 0.03 -0.08 1.22 3.14 -1.04 -3.06 118.33 114.62 3d9b n VAL 990 Ca -0.05 -0.08 -0.10 0.00 -2.96 0.00 0.00 64.34 61.15 3d9b n VAL 990 Cb 0.68 -0.16 -0.08 0.00 -1.06 0.00 0.00 33.84 33.22 3d9b n VAL 990 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 3d9b n ILE 991 N -0.57 0.91 -0.45 1.55 -0.00 -1.04 -4.91 119.36 114.85 3d9b n ILE 991 Ca 0.18 -0.41 -0.17 0.00 -0.00 0.00 0.00 62.75 62.35 3d9b n ILE 991 Cb 0.15 -0.96 -0.02 0.00 -0.00 0.00 0.00 39.64 38.81 3d9b n ILE 991 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 3d9b n SER 992 N -2.83 -0.18 -4.13 4.38 2.88 -0.83 -4.96 113.62 107.94 3d9b n SER 992 Ca -0.26 0.35 -0.29 0.00 -1.33 0.00 0.00 58.87 57.34 3d9b n SER 992 Cb 0.84 -0.29 -0.17 0.00 -0.75 0.00 0.00 64.21 63.84 3d9b n SER 992 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3d9b s THR 993 N -0.14 1.69 0.43 2.46 -4.23 -1.26 -4.84 115.64 109.74 3d9b s THR 993 Ca 0.24 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.96 3d9b s THR 993 Cb -0.34 -1.49 0.00 0.00 1.34 0.00 0.00 72.50 72.01 3d9b s THR 993 CO 0.17 0.48 0.00 0.61 -0.54 0.00 0.00 174.62 175.34 3d9b n GLY 994 N 3.73 -4.05 2.62 3.99 0.00 -1.26 -4.92 105.19 105.30 3d9b n GLY 994 Ca -0.20 -0.87 -0.05 0.00 0.00 0.00 0.00 46.02 44.90 3d9b n GLY 994 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d9b n ALA 995 N -1.53 -3.19 -0.41 4.61 0.00 -1.26 -4.11 120.51 114.62 3d9b n ALA 995 Ca 0.00 1.96 0.00 0.00 0.00 0.00 0.00 53.44 55.40 3d9b n ALA 995 Cb 0.16 -3.95 0.00 0.00 0.00 0.00 0.00 19.45 15.66 3d9b n ALA 995 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d9b n GLY 996 N 1.84 1.47 0.37 0.00 0.00 -1.26 -4.88 105.19 102.73 3d9b n GLY 996 Ca -0.33 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.79 3d9b n GLY 996 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3d9b h SER 997 N 0.00 0.70 -0.65 1.61 0.02 -1.89 -2.23 113.55 111.11 3d9b h SER 997 Ca 0.00 0.03 0.13 0.00 -0.84 0.00 0.00 61.79 61.11 3d9b h SER 997 Cb 0.00 -0.11 -0.12 0.00 0.14 0.00 0.00 62.40 62.31 3d9b h SER 997 CO 0.00 0.38 -0.15 1.23 -1.14 0.00 0.00 176.83 177.15 3d9b h GLY 998 N 0.75 0.48 0.36 -3.77 0.00 -1.89 0.72 103.07 99.72 3d9b h GLY 998 Ca 0.42 0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.94 3d9b h GLY 998 CO -0.18 -0.25 -0.17 0.00 0.00 0.00 0.00 176.54 175.94 3d9b h ALA 999 N 1.65 -0.78 -1.00 3.60 0.00 -1.74 -3.08 119.26 117.91 3d9b h ALA 999 Ca 0.32 -0.11 0.27 0.00 0.00 0.00 0.00 54.91 55.39 3d9b h ALA 999 Cb 0.48 0.19 -0.13 0.00 0.00 0.00 0.00 17.79 18.33 3d9b h ALA 999 CO -0.67 -0.75 0.57 1.96 0.00 0.00 0.00 179.25 180.37 3d9b h GLN 1000N -0.67 0.46 -0.51 0.00 4.20 -0.78 1.02 115.11 118.83 3d9b h GLN 1000Ca -0.05 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 3d9b h GLN 1000Cb 0.37 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 3d9b h GLN 1000CO 0.08 0.30 0.08 -0.91 -0.67 0.00 0.00 178.83 177.71 3d9b h ASN 1001N 0.47 0.82 0.98 1.46 -0.26 0.50 0.12 115.58 119.67 3d9b h ASN 1001Ca 0.67 -0.26 -0.05 0.00 -0.56 0.00 0.00 56.30 56.10 3d9b h ASN 1001Cb 1.38 -0.22 0.01 0.00 -1.06 0.00 0.00 38.32 38.43 3d9b h ASN 1001CO -0.53 0.87 -0.47 0.00 -1.06 0.00 0.00 177.43 176.24 3d9b h ALA 1002N 0.97 -1.31 -0.83 -0.83 0.00 0.11 0.16 119.26 117.52 3d9b h ALA 1002Ca 0.15 -0.29 0.21 0.00 0.00 0.00 0.00 54.91 54.98 3d9b h ALA 1002Cb 0.41 0.51 -0.13 0.00 0.00 0.00 0.00 17.79 18.57 3d9b h ALA 1002CO 0.01 -1.22 0.21 0.28 0.00 0.00 0.00 179.25 178.54 3d9b h VAL 1003N -1.35 0.38 0.00 0.00 2.07 -0.90 -3.25 116.25 113.20 3d9b h VAL 1003Ca -0.13 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.31 3d9b h VAL 1003Cb 1.00 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3d9b h VAL 1003CO 0.22 0.04 0.00 0.61 0.02 0.00 0.00 177.57 178.46 3d9b n GLY 1004N -1.37 -1.21 0.22 2.17 0.00 0.43 -3.49 105.19 101.94 3d9b n GLY 1004Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.20 3d9b n GLY 1004CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3d9b h THR 1005N 0.00 0.59 -0.82 2.61 1.35 -0.78 0.15 112.91 116.01 3d9b h THR 1005Ca 0.00 -0.06 0.08 0.00 -0.55 0.00 0.00 66.41 65.88 3d9b h THR 1005Cb 0.00 0.41 -0.07 0.00 -1.73 0.00 0.00 68.15 66.76 3d9b h THR 1005CO 0.00 0.03 0.48 1.23 -0.25 0.00 0.00 175.52 177.01 3d9b h GLY 1006N 0.17 1.25 0.67 5.82 0.00 -1.75 0.02 103.07 109.24 3d9b h GLY 1006Ca 0.29 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 3d9b h GLY 1006CO -0.44 0.17 -0.02 -2.08 0.00 0.00 0.00 176.54 174.18 3d9b h VAL 1007N 0.84 1.30 0.54 4.60 2.07 -0.82 -1.93 116.25 122.85 3d9b h VAL 1007Ca 0.38 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.93 3d9b h VAL 1007Cb 0.28 1.83 0.01 0.00 -1.52 0.00 0.00 31.29 31.89 3d9b h VAL 1007CO -0.22 0.26 -0.26 -0.03 0.02 0.00 0.00 177.57 177.34 3d9b h MET 1008N -0.25 -0.70 -0.88 1.57 -1.53 -0.62 0.82 114.93 113.34 3d9b h MET 1008Ca 0.01 0.05 0.18 0.00 -3.44 0.00 0.00 59.70 56.50 3d9b h MET 1008Cb 0.42 0.16 -0.11 0.00 -0.55 0.00 0.00 31.60 31.52 3d9b h MET 1008CO 0.01 -0.39 0.43 0.78 0.14 0.00 0.00 176.91 177.87 3d9b h GLY 1009N -1.04 1.47 0.88 1.39 0.00 -1.15 0.68 103.07 105.30 3d9b h GLY 1009Ca -0.07 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 3d9b h GLY 1009CO 0.12 -0.14 -0.01 -1.33 0.00 0.00 0.00 176.54 175.18 3d9b h GLY 1010N 0.53 0.59 1.99 4.60 0.00 -1.18 -3.12 103.07 106.48 3d9b h GLY 1010Ca 0.51 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 47.35 3d9b h GLY 1010CO -0.43 0.41 -0.24 1.98 0.00 0.00 0.00 176.54 178.25 3d9b h MET 1011N 0.33 0.02 0.03 4.80 -1.53 0.25 -1.63 114.93 117.20 3d9b h MET 1011Ca 0.08 -0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.34 3d9b h MET 1011Cb 0.46 -0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.51 3d9b h MET 1011CO 0.02 0.26 -0.02 0.28 0.14 0.00 0.00 176.91 177.59 3d9b h VAL 1012N 0.02 1.36 0.02 -5.77 2.07 -0.95 -2.49 116.25 110.49 3d9b h VAL 1012Ca 0.00 -1.73 0.01 0.00 0.82 0.00 0.00 66.70 65.80 3d9b h VAL 1012Cb 0.44 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 3d9b h VAL 1012CO 0.03 0.41 -0.07 0.71 0.02 0.00 0.00 177.57 178.68 3d9b h THR 1013N -0.87 0.83 -0.57 2.57 1.35 -1.60 -2.83 112.91 111.79 3d9b h THR 1013Ca -0.00 0.00 0.09 0.00 -0.55 0.00 0.00 66.41 65.95 3d9b h THR 1013Cb 0.71 0.83 -0.11 0.00 -1.73 0.00 0.00 68.15 67.85 3d9b h THR 1013CO 0.01 0.00 -0.40 0.00 -0.25 0.00 0.00 175.52 174.87 3d9b h ALA 1014N 0.85 -0.25 -0.00 6.62 0.00 -1.03 -1.50 119.26 123.95 3d9b h ALA 1014Ca 0.02 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3d9b h ALA 1014Cb 0.15 0.90 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3d9b h ALA 1014CO -0.06 -0.79 -0.02 0.25 0.00 0.00 0.00 179.25 178.63 3d9b n THR 1015N -5.42 0.00 -0.04 0.00 -2.24 -0.94 -1.57 114.28 104.08 3d9b n THR 1015Ca 0.02 -0.04 0.03 0.00 -2.27 0.00 0.00 64.05 61.79 3d9b n THR 1015Cb 0.35 -0.29 -0.16 0.00 -2.10 0.00 0.00 70.33 68.13 3d9b n THR 1015CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3d9b n VAL 1016N -0.89 0.49 -0.04 2.28 0.24 -0.84 -4.06 118.33 115.51 3d9b n VAL 1016Ca 0.20 -0.60 -0.21 0.00 -2.04 0.00 0.00 64.34 61.68 3d9b n VAL 1016Cb 0.20 -0.16 -0.13 0.00 -1.47 0.00 0.00 33.84 32.28 3d9b n VAL 1016CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3d9b h LEU 1017N 0.00 0.23 -1.16 1.34 4.07 -1.15 -3.35 115.31 115.29 3d9b h LEU 1017Ca -0.19 -0.75 0.06 0.00 0.08 0.00 0.00 57.88 57.08 3d9b h LEU 1017Cb 1.41 -0.08 -0.06 0.00 1.08 0.00 0.00 40.66 43.02 3d9b h LEU 1017CO 0.01 1.61 0.58 0.00 -1.08 0.00 0.00 178.44 179.56 3d9b h ALA 1018N -0.19 1.52 -0.03 1.53 0.00 -1.52 1.07 119.26 121.64 3d9b h ALA 1018Ca -0.34 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.55 3d9b h ALA 1018Cb 1.63 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 3d9b h ALA 1018CO -0.04 0.35 0.03 0.97 0.00 0.00 0.00 179.25 180.56 3d9b h ILE 1019N 1.02 0.51 0.00 0.00 6.09 -1.70 -1.59 117.51 121.83 3d9b h ILE 1019Ca 0.38 0.00 -0.28 0.00 -1.37 0.00 0.00 64.86 63.59 3d9b h ILE 1019Cb 0.19 0.97 -0.05 0.00 0.47 0.00 0.00 36.82 38.40 3d9b h ILE 1019CO -0.14 0.00 -2.05 0.49 -3.07 0.00 0.00 178.15 173.38 3d9b n PHE 1020N -3.82 0.00 0.12 2.19 3.72 -0.54 -4.77 117.46 114.36 3d9b n PHE 1020Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3d9b n PHE 1020Cb 0.12 -0.71 0.03 0.00 -0.94 0.00 0.00 39.48 37.98 3d9b n PHE 1020CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 3d9b h PHE 1021N -0.01 0.00 -0.07 1.38 0.04 0.12 -3.32 116.94 115.08 3d9b h PHE 1021Ca -0.41 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.35 3d9b h PHE 1021Cb 1.64 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.78 3d9b h PHE 1021CO 0.02 0.63 0.03 0.28 -0.60 0.00 0.00 178.31 178.67 3d9b h VAL 1022N 0.00 1.12 0.00 -0.55 2.07 -1.47 0.32 116.25 117.75 3d9b h VAL 1022Ca -0.01 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 3d9b h VAL 1022Cb 1.42 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 32.41 3d9b h VAL 1022CO 0.08 0.11 -0.02 -0.65 0.02 0.00 0.00 177.57 177.11 3d9b h PRO 1023N -0.02 0.00 0.27 1.57 0.11 -1.78 0.51 132.00 132.66 3d9b h PRO 1023Ca 0.03 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 3d9b h PRO 1023Cb 0.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.25 3d9b h PRO 1023CO -0.00 0.02 -0.13 0.28 -0.21 0.00 0.00 178.00 177.96 3d9b h VAL 1024N 0.00 0.00 -0.86 3.15 2.07 -1.54 -3.07 116.25 116.00 3d9b h VAL 1024Ca -0.00 -0.67 0.27 0.00 0.82 0.00 0.00 66.70 67.12 3d9b h VAL 1024Cb 0.11 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.72 3d9b h VAL 1024CO 0.00 0.00 0.15 0.49 0.02 0.00 0.00 177.57 178.23 3d9b n PHE 1025N -4.84 0.69 0.32 1.57 3.72 0.11 -0.98 117.46 118.05 3d9b n PHE 1025Ca -0.04 1.04 -0.13 0.00 -0.05 0.00 0.00 57.45 58.26 3d9b n PHE 1025Cb 0.14 -1.23 -0.06 0.00 -0.94 0.00 0.00 39.48 37.39 3d9b n PHE 1025CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 3d9b h PHE 1026N 0.00 -0.79 -0.86 1.38 3.57 -1.06 -2.29 116.94 116.88 3d9b h PHE 1026Ca 0.59 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 62.14 3d9b h PHE 1026Cb 1.33 0.26 -0.07 0.00 2.79 0.00 0.00 35.95 40.27 3d9b h PHE 1026CO -0.31 -0.49 0.53 -0.39 -2.23 0.00 0.00 178.31 175.41 3d9b h VAL 1027N -1.14 0.99 -0.33 1.41 -1.51 -0.95 0.61 116.25 115.33 3d9b h VAL 1027Ca -0.09 -0.32 -0.07 0.00 -1.23 0.00 0.00 66.70 65.00 3d9b h VAL 1027Cb 0.65 -0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 29.79 3d9b h VAL 1027CO 0.14 0.17 -0.07 0.58 -1.23 0.00 0.00 177.57 177.17 3d9b h VAL 1028N 0.92 1.28 0.00 7.19 2.07 -1.23 0.37 116.25 126.85 3d9b h VAL 1028Ca 0.39 -1.10 -0.07 0.00 0.82 0.00 0.00 66.70 66.74 3d9b h VAL 1028Cb 0.26 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 3d9b h VAL 1028CO -0.20 0.36 -0.36 0.58 0.02 0.00 0.00 177.57 177.97 3d9b h VAL 1029N 0.41 1.09 -0.01 2.57 2.07 -0.81 -0.77 116.25 120.79 3d9b h VAL 1029Ca 0.08 -1.29 -0.25 0.00 0.82 0.00 0.00 66.70 66.06 3d9b h VAL 1029Cb 0.55 1.73 0.01 0.00 -1.52 0.00 0.00 31.29 32.07 3d9b h VAL 1029CO 0.03 0.35 -0.99 -0.09 0.02 0.00 0.00 177.57 176.89 3d9b h ARG 1030N 0.00 0.60 0.05 1.57 9.65 0.76 -3.10 114.38 123.91 3d9b h ARG 1030Ca -0.00 -0.63 -0.26 0.00 -1.10 0.00 0.00 59.98 57.98 3d9b h ARG 1030Cb 0.70 0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 29.44 3d9b h ARG 1030CO 0.05 1.24 -1.35 0.00 2.80 0.00 0.00 179.97 182.71 3d9b h ARG 1031N 0.34 0.10 -0.24 0.20 3.08 -0.22 -3.35 114.38 114.29 3d9b h ARG 1031Ca -0.11 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 59.73 3d9b h ARG 1031Cb 1.64 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.74 3d9b h ARG 1031CO 0.19 0.94 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.91 3d9b h ARG 1032N 0.03 0.44 -5.00 0.04 9.65 -1.27 -3.43 114.38 114.84 3d9b h ARG 1032Ca -0.16 -0.15 -0.64 0.00 -1.10 0.00 0.00 59.98 57.93 3d9b h ARG 1032Cb 1.92 -0.03 -0.22 0.00 -1.39 0.00 0.00 29.97 30.25 3d9b h ARG 1032CO 0.13 0.64 -0.62 -0.06 2.80 0.00 0.00 179.97 182.87 3d9b s PHE 1033N -4.88 3.10 0.00 2.20 0.40 -1.17 -5.02 117.98 112.61 3d9b s PHE 1033Ca -0.14 -0.35 0.00 0.00 -0.60 0.00 0.00 56.93 55.85 3d9b s PHE 1033Cb 0.07 -2.21 0.00 0.00 0.51 0.00 0.00 43.02 41.39 3d9b s PHE 1033CO 0.75 -0.28 0.00 -1.13 0.70 0.00 0.00 175.22 175.26 3d9b n SER 1034N 4.71 0.00 0.00 1.36 3.41 -1.26 -4.72 113.62 117.12 3d9b n SER 1034Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 3d9b n SER 1034Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 3d9b n SER 1034CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3d9b n ARG 1035N -1.57 0.00 -3.90 4.33 1.85 -1.26 -5.01 116.66 111.10 3d9b n ARG 1035Ca 0.00 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.55 3d9b n ARG 1035Cb 0.00 -0.36 -0.16 0.00 -1.05 0.00 0.00 32.46 30.90 3d9b n ARG 1035CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 3d9b s LYS 1036N -1.00 1.43 0.13 2.89 2.36 -1.26 -5.05 119.74 119.25 3d9b s LYS 1036Ca 0.00 -0.88 -0.24 0.00 -2.55 0.00 0.00 55.97 52.30 3d9b s LYS 1036Cb 0.00 -2.49 0.08 0.00 -1.05 0.00 0.00 37.83 34.37 3d9b s LYS 1036CO 0.00 -0.61 1.08 -0.80 1.55 0.00 0.00 175.35 176.58 3d9b s ASN 1037N 1.49 -0.03 -0.02 1.43 0.01 -1.26 -5.11 114.94 111.44 3d9b s ASN 1037Ca -0.05 -0.52 0.01 0.00 -0.71 0.00 0.00 52.86 51.59 3d9b s ASN 1037Cb -0.18 0.42 -0.02 0.00 0.41 0.00 0.00 41.25 41.88 3d9b s ASN 1037CO -0.06 -0.82 -0.01 -1.84 -1.51 0.00 0.00 177.10 172.85 3d9b n GLU 1038N -0.67 1.27 -1.04 -0.60 0.00 -1.26 -4.99 120.64 113.35 3d9b n GLU 1038Ca -0.03 0.01 -0.07 0.00 0.00 0.00 0.00 57.16 57.06 3d9b n GLU 1038Cb 0.60 -1.04 -0.03 0.00 0.00 0.00 0.00 31.44 30.97 3d9b n GLU 1038CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3d9b n ASP 1039N -2.40 -3.04 0.00 -1.84 -0.08 -1.26 -4.79 116.55 103.14 3d9b n ASP 1039Ca -0.03 0.18 0.00 0.00 -1.51 0.00 0.00 54.79 53.42 3d9b n ASP 1039Cb 0.54 -2.57 0.00 0.00 2.34 0.00 0.00 41.12 41.43 3d9b n ASP 1039CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3d9b n ILE 1040N -1.50 0.00 -3.65 5.18 0.13 -1.26 -4.71 119.36 113.55 3d9b n ILE 1040Ca -0.07 0.00 -0.37 0.00 -1.10 0.00 0.00 62.75 61.20 3d9b n ILE 1040Cb 0.33 0.00 -0.11 0.00 -0.84 0.00 0.00 39.64 39.02 3d9b n ILE 1040CO 0.00 0.00 0.00 -0.70 2.80 0.00 0.00 176.55 178.65 3d9b s GLU 1041N 1.74 3.85 0.00 9.51 2.56 -1.26 -1.04 118.70 134.06 3d9b s GLU 1041Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.97 54.60 3d9b s GLU 1041Cb 0.00 -3.54 0.00 0.00 2.00 0.00 0.00 34.13 32.59 3d9b s GLU 1041CO 0.00 -0.17 0.00 -2.39 -0.56 0.00 0.00 175.26 172.14 3d9b n HIS 1042N 4.98 0.00 0.00 5.30 1.44 -1.22 -5.02 115.22 120.70 3d9b n HIS 1042Ca -0.15 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.56 3d9b n HIS 1042Cb 0.52 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.63 3d9b n HIS 1042CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 3d9b n SER 1043N 0.00 0.00 -1.63 4.39 7.64 -1.24 -4.96 113.62 117.83 3d9b n SER 1043Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 3d9b n SER 1043Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 3d9b n SER 1043CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3d9b n HIS 1044N 0.82 -0.51 0.32 1.43 8.25 -1.06 -5.01 115.22 119.47 3d9b n HIS 1044Ca 0.00 0.29 0.04 0.00 -0.26 0.00 0.00 57.72 57.79 3d9b n HIS 1044Cb 0.00 -1.78 0.03 0.00 1.12 0.00 0.00 29.99 29.36 3d9b n HIS 1044CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61