#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wk6 h LEU 36 N 0.00 -0.71 -0.86 1.08 -0.00 -1.99 -1.21 115.31 111.62 2wk6 h LEU 36 Ca 0.00 0.21 0.14 0.00 -0.00 0.00 0.00 57.88 58.24 2wk6 h LEU 36 Cb 0.00 0.45 -0.09 0.00 -0.00 0.00 0.00 40.66 41.02 2wk6 h LEU 36 CO 0.00 -0.24 0.46 -0.65 -0.00 0.00 0.00 178.44 178.01 2wk6 h PRO 37 N -0.02 0.64 -0.19 1.13 0.11 -2.00 -1.50 132.00 130.17 2wk6 h PRO 37 Ca 0.33 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.27 2wk6 h PRO 37 Cb 0.52 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.48 2wk6 h PRO 37 CO -0.72 0.42 -0.39 1.49 -0.21 0.00 0.00 178.00 178.60 2wk6 h GLU 38 N 0.66 0.60 -0.79 1.05 4.81 -1.69 -1.77 114.58 117.44 2wk6 h GLU 38 Ca 0.46 -0.39 0.11 0.00 -0.13 0.00 0.00 59.36 59.41 2wk6 h GLU 38 Cb 0.64 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 29.99 2wk6 h GLU 38 CO -0.35 1.00 0.42 -0.07 -0.73 0.00 0.00 179.01 179.29 2wk6 h LEU 39 N 0.27 0.57 -0.45 1.64 3.38 -0.87 -0.60 115.31 119.25 2wk6 h LEU 39 Ca 0.01 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2wk6 h LEU 39 Cb 0.99 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 2wk6 h LEU 39 CO 0.09 0.31 0.08 0.40 0.09 0.00 0.00 178.44 179.40 2wk6 h ILE 40 N 0.69 1.24 -0.95 1.22 2.04 -1.20 -2.70 117.51 117.85 2wk6 h ILE 40 Ca 0.40 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2wk6 h ILE 40 Cb 0.43 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 2wk6 h ILE 40 CO -0.28 0.31 0.61 -0.09 0.00 0.00 0.00 178.15 178.70 2wk6 h ARG 41 N 0.60 1.27 0.08 2.37 2.43 -0.35 0.64 114.38 121.42 2wk6 h ARG 41 Ca 0.14 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2wk6 h ARG 41 Cb 0.38 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2wk6 h ARG 41 CO 0.01 0.86 -0.04 0.52 -1.51 0.00 0.00 179.97 179.81 2wk6 h MET 42 N 1.30 -0.10 -0.53 0.20 2.86 -0.97 0.22 114.93 117.91 2wk6 h MET 42 Ca 0.35 0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.89 2wk6 h MET 42 Cb -0.11 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 2wk6 h MET 42 CO -0.07 -0.00 -0.09 -0.22 1.06 0.00 0.00 176.91 177.59 2wk6 h LYS 43 N -0.17 0.98 -0.85 1.72 1.63 -1.24 0.69 116.57 119.33 2wk6 h LYS 43 Ca -0.01 -0.35 0.05 0.00 -0.85 0.00 0.00 60.65 59.50 2wk6 h LYS 43 Cb 0.14 -0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 31.65 2wk6 h LYS 43 CO 0.02 1.02 0.56 -0.09 -3.45 0.00 0.00 179.45 177.50 2wk6 h ARG 44 N 0.88 0.95 -0.01 1.90 2.43 0.73 -1.02 114.38 120.25 2wk6 h ARG 44 Ca 0.14 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2wk6 h ARG 44 Cb 0.64 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2wk6 h ARG 44 CO 0.04 0.63 -0.05 -0.25 -1.51 0.00 0.00 179.97 178.83 2wk6 n ASP 45 N -4.47 0.82 0.00 -3.80 8.00 0.72 -4.91 116.55 112.91 2wk6 n ASP 45 Ca 0.12 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.54 2wk6 n ASP 45 Cb 0.17 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 2wk6 n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wk6 n GLY 46 N 1.17 0.69 3.87 0.44 0.00 -0.39 -5.07 105.19 105.91 2wk6 n GLY 46 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2wk6 n GLY 46 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wk6 s GLY 47 N -1.15 1.64 0.34 -0.02 0.00 0.24 -4.95 107.32 103.41 2wk6 s GLY 47 Ca 0.00 -0.23 0.03 0.00 0.00 0.00 0.00 44.72 44.52 2wk6 s GLY 47 CO 0.00 0.10 0.52 1.09 0.00 0.00 0.00 173.10 174.81 2wk6 s ARG 48 N -5.28 3.31 -0.12 2.90 1.70 -1.26 -3.97 118.95 116.23 2wk6 s ARG 48 Ca 0.57 -0.61 -0.06 0.00 -0.47 0.00 0.00 55.73 55.17 2wk6 s ARG 48 Cb -0.11 -2.72 -0.04 0.00 -0.57 0.00 0.00 34.95 31.50 2wk6 s ARG 48 CO 0.53 0.10 0.09 -0.51 -1.08 0.00 0.00 175.30 174.43 2wk6 s LEU 49 N -4.26 4.07 0.83 -1.89 1.43 -1.26 -4.86 118.68 112.73 2wk6 s LEU 49 Ca 0.41 0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 53.71 2wk6 s LEU 49 Cb -0.10 -1.98 0.09 0.00 0.03 0.00 0.00 46.19 44.23 2wk6 s LEU 49 CO 0.34 0.35 1.09 -0.94 0.23 0.00 0.00 176.35 177.42 2wk6 s SER 50 N -0.71 4.08 0.46 2.29 1.04 -1.26 -4.73 113.70 114.86 2wk6 s SER 50 Ca 0.12 1.51 0.13 0.00 0.48 0.00 0.00 55.95 58.19 2wk6 s SER 50 Cb -0.12 -2.22 1.06 0.00 0.10 0.00 0.00 66.02 64.84 2wk6 s SER 50 CO 0.03 -2.26 2.06 -0.08 0.98 0.00 0.00 173.24 173.96 2wk6 h GLU 51 N -1.29 0.32 -0.01 4.02 4.81 -1.98 0.17 114.58 120.62 2wk6 h GLU 51 Ca -0.47 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 58.60 2wk6 h GLU 51 Cb 1.26 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 2wk6 h GLU 51 CO 0.55 0.21 -0.63 0.00 -0.73 0.00 0.00 179.01 178.42 2wk6 h ALA 52 N 1.80 0.93 0.17 2.92 0.00 -1.98 -1.55 119.26 121.56 2wk6 h ALA 52 Ca 0.15 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2wk6 h ALA 52 Cb 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2wk6 h ALA 52 CO -0.03 0.77 -0.08 -0.44 0.00 0.00 0.00 179.25 179.47 2wk6 h ASP 53 N 0.04 -0.20 -0.37 0.00 3.32 -1.06 0.11 116.42 118.27 2wk6 h ASP 53 Ca -0.01 -0.29 0.01 0.00 0.02 0.00 0.00 57.03 56.76 2wk6 h ASP 53 Cb 1.12 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.70 2wk6 h ASP 53 CO 0.09 0.22 0.23 0.40 -1.72 0.00 0.00 179.24 178.45 2wk6 h ILE 54 N -0.65 1.07 -0.00 0.35 2.04 -1.14 0.62 117.51 119.81 2wk6 h ILE 54 Ca -0.02 -0.16 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 2wk6 h ILE 54 Cb 0.47 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 2wk6 h ILE 54 CO 0.04 0.09 -0.35 0.03 0.00 0.00 0.00 178.15 177.96 2wk6 h ARG 55 N 0.47 0.00 -0.17 2.37 3.08 -1.33 0.16 114.38 118.96 2wk6 h ARG 55 Ca 0.14 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 2wk6 h ARG 55 Cb -0.03 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 2wk6 h ARG 55 CO -0.04 0.35 -0.09 0.78 -1.07 0.00 0.00 179.97 179.89 2wk6 h GLY 56 N 1.04 0.39 0.92 0.04 0.00 0.71 -2.05 103.07 104.12 2wk6 h GLY 56 Ca -0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 2wk6 h GLY 56 CO 0.05 0.33 0.10 -2.75 0.00 0.00 0.00 176.54 174.27 2wk6 h PHE 57 N 0.03 0.59 -0.92 5.60 3.57 0.58 -2.60 116.94 123.80 2wk6 h PHE 57 Ca 0.04 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 2wk6 h PHE 57 Cb 0.58 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.11 2wk6 h PHE 57 CO 0.07 0.58 0.54 0.28 -2.23 0.00 0.00 178.31 177.55 2wk6 h VAL 58 N 0.43 1.26 -0.12 1.41 2.07 -0.69 -0.87 116.25 119.74 2wk6 h VAL 58 Ca 0.12 -0.58 -0.10 0.00 0.82 0.00 0.00 66.70 66.96 2wk6 h VAL 58 Cb 0.27 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 2wk6 h VAL 58 CO -0.00 0.27 -0.35 0.00 0.02 0.00 0.00 177.57 177.51 2wk6 h ALA 59 N 1.30 1.18 0.00 1.67 0.00 -1.30 -1.22 119.26 120.88 2wk6 h ALA 59 Ca 0.33 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2wk6 h ALA 59 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2wk6 h ALA 59 CO -0.06 0.54 -0.49 0.00 0.00 0.00 0.00 179.25 179.24 2wk6 h ALA 60 N 1.43 0.99 -0.02 0.00 0.00 -0.92 0.30 119.26 121.04 2wk6 h ALA 60 Ca 0.02 -0.45 -0.19 0.00 0.00 0.00 0.00 54.91 54.29 2wk6 h ALA 60 Cb 0.73 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.45 2wk6 h ALA 60 CO 0.06 0.62 -0.74 0.28 0.00 0.00 0.00 179.25 179.46 2wk6 h VAL 61 N 0.00 1.37 -0.03 0.00 2.07 -0.66 0.14 116.25 119.13 2wk6 h VAL 61 Ca -0.00 -2.10 -0.17 0.00 0.82 0.00 0.00 66.70 65.25 2wk6 h VAL 61 Cb 0.99 2.46 -0.01 0.00 -1.52 0.00 0.00 31.29 33.21 2wk6 h VAL 61 CO 0.06 0.63 -0.74 0.58 0.02 0.00 0.00 177.57 178.13 2wk6 h VAL 62 N 0.11 1.45 -0.02 2.57 2.07 -1.11 -3.32 116.25 117.99 2wk6 h VAL 62 Ca -0.09 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.12 2wk6 h VAL 62 Cb 1.42 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 2wk6 h VAL 62 CO 0.15 0.68 -0.20 -0.46 0.02 0.00 0.00 177.57 177.75 2wk6 n ASN 63 N -3.76 2.16 0.00 0.57 2.04 0.08 -4.99 115.26 111.37 2wk6 n ASN 63 Ca -0.03 -1.60 0.00 0.00 -0.44 0.00 0.00 54.58 52.51 2wk6 n ASN 63 Cb 0.71 0.19 0.00 0.00 -2.53 0.00 0.00 39.78 38.14 2wk6 n ASN 63 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2wk6 n GLY 64 N 1.35 3.41 0.31 4.83 0.00 -1.11 -4.93 105.19 109.05 2wk6 n GLY 64 Ca 0.13 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.21 2wk6 n GLY 64 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wk6 h SER 65 N 0.00 0.39 -3.02 1.61 4.64 -1.82 -3.39 113.55 111.96 2wk6 h SER 65 Ca 0.00 -0.01 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 2wk6 h SER 65 Cb 0.00 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 61.97 2wk6 h SER 65 CO 0.00 0.27 0.77 0.00 -0.87 0.00 0.00 176.83 177.01 2wk6 s ALA 66 N -5.42 3.55 0.55 5.18 0.00 0.45 -5.02 121.76 121.06 2wk6 s ALA 66 Ca -0.08 0.57 -0.05 0.00 0.00 0.00 0.00 51.96 52.40 2wk6 s ALA 66 Cb 0.18 -3.55 -0.00 0.00 0.00 0.00 0.00 23.12 19.74 2wk6 s ALA 66 CO 0.73 -0.91 0.85 -0.65 0.00 0.00 0.00 175.76 175.78 2wk6 s GLN 67 N 2.66 3.08 0.17 0.00 -0.21 -1.26 -4.84 119.66 119.25 2wk6 s GLN 67 Ca 0.56 -0.02 -0.24 0.00 0.02 0.00 0.00 55.36 55.67 2wk6 s GLN 67 Cb -0.24 -2.33 0.05 0.00 1.00 0.00 0.00 33.01 31.49 2wk6 s GLN 67 CO 0.19 -0.53 1.58 0.78 -2.12 0.00 0.00 175.29 175.20 2wk6 h GLY 68 N -0.01 -0.35 1.26 3.09 0.00 -1.95 -0.45 103.07 104.66 2wk6 h GLY 68 Ca -0.46 0.48 0.08 0.00 0.00 0.00 0.00 47.33 47.44 2wk6 h GLY 68 CO 0.60 -0.19 0.30 0.00 0.00 0.00 0.00 176.54 177.25 2wk6 h ALA 69 N 0.68 2.11 -0.08 3.60 0.00 -1.99 -0.81 119.26 122.77 2wk6 h ALA 69 Ca 0.17 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.84 2wk6 h ALA 69 Cb 0.56 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.32 2wk6 h ALA 69 CO -0.60 -0.21 -0.86 1.96 0.00 0.00 0.00 179.25 179.53 2wk6 h GLN 70 N 0.23 0.64 -0.52 0.00 4.20 -1.51 0.53 115.11 118.68 2wk6 h GLN 70 Ca 0.20 -0.59 -0.04 0.00 0.06 0.00 0.00 58.65 58.29 2wk6 h GLN 70 Cb 0.50 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 2wk6 h GLN 70 CO -0.04 1.20 0.17 0.82 -0.67 0.00 0.00 178.83 180.31 2wk6 h ILE 71 N 0.41 1.23 -0.42 2.54 1.08 -0.38 -0.80 117.51 121.17 2wk6 h ILE 71 Ca -0.07 -0.76 -0.08 0.00 -0.39 0.00 0.00 64.86 63.56 2wk6 h ILE 71 Cb 1.49 0.74 -0.01 0.00 -3.07 0.00 0.00 36.82 35.96 2wk6 h ILE 71 CO 0.17 0.28 -0.03 1.23 -0.69 0.00 0.00 178.15 179.11 2wk6 h GLY 72 N 0.72 0.82 0.92 5.37 0.00 -1.13 -1.22 103.07 108.55 2wk6 h GLY 72 Ca 0.17 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 2wk6 h GLY 72 CO -0.01 0.58 0.01 0.00 0.00 0.00 0.00 176.54 177.12 2wk6 h ALA 73 N 0.88 0.01 -0.20 3.60 0.00 -0.70 -0.64 119.26 122.21 2wk6 h ALA 73 Ca 0.11 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2wk6 h ALA 73 Cb 0.53 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2wk6 h ALA 73 CO 0.03 -0.45 -0.06 0.52 0.00 0.00 0.00 179.25 179.29 2wk6 h MET 74 N -0.06 -0.01 -0.44 0.00 2.07 -1.08 0.18 114.93 115.58 2wk6 h MET 74 Ca 0.00 0.00 0.03 0.00 -2.07 0.00 0.00 59.70 57.66 2wk6 h MET 74 Cb 0.08 0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 29.77 2wk6 h MET 74 CO -0.00 -0.01 0.23 -0.07 1.07 0.00 0.00 176.91 178.13 2wk6 h LEU 75 N -0.01 0.35 -0.59 1.22 3.38 -1.06 0.03 115.31 118.62 2wk6 h LEU 75 Ca 0.10 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 2wk6 h LEU 75 Cb 0.16 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2wk6 h LEU 75 CO -0.21 0.25 0.03 -0.03 0.09 0.00 0.00 178.44 178.57 2wk6 h MET 76 N 0.46 1.02 -0.19 1.13 4.05 -0.83 0.18 114.93 120.76 2wk6 h MET 76 Ca 0.18 -0.31 0.01 0.00 -0.28 0.00 0.00 59.70 59.31 2wk6 h MET 76 Cb 0.07 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 30.75 2wk6 h MET 76 CO -0.12 0.99 0.09 0.00 0.23 0.00 0.00 176.91 178.11 2wk6 h ALA 77 N 0.99 0.22 -0.49 0.39 0.00 -0.56 0.31 119.26 120.12 2wk6 h ALA 77 Ca 0.17 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2wk6 h ALA 77 Cb 0.51 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2wk6 h ALA 77 CO 0.02 -0.33 0.29 0.82 0.00 0.00 0.00 179.25 180.04 2wk6 h ILE 78 N 0.19 1.16 -0.14 0.00 2.04 -0.80 0.21 117.51 120.17 2wk6 h ILE 78 Ca 0.08 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.57 2wk6 h ILE 78 Cb 0.02 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 2wk6 h ILE 78 CO -0.06 0.16 0.09 -0.09 0.00 0.00 0.00 178.15 178.26 2wk6 h ARG 79 N 0.65 0.15 0.00 2.37 9.65 0.05 0.29 114.38 127.54 2wk6 h ARG 79 Ca 0.17 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.05 2wk6 h ARG 79 Cb 0.01 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.56 2wk6 h ARG 79 CO -0.03 0.10 -1.72 1.28 2.80 0.00 0.00 179.97 182.39 2wk6 n LEU 80 N -4.52 0.23 -0.05 3.80 4.77 0.03 -4.48 117.00 116.79 2wk6 n LEU 80 Ca -0.01 0.05 0.01 0.00 -0.03 0.00 0.00 56.01 56.04 2wk6 n LEU 80 Cb 0.11 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2wk6 n LEU 80 CO 0.34 -0.03 0.19 0.54 -1.33 0.00 0.00 177.39 177.11 2wk6 n ARG 81 N -2.31 1.37 -0.84 3.23 5.12 0.67 -5.08 116.66 118.80 2wk6 n ARG 81 Ca -0.03 -0.42 0.11 0.00 -1.93 0.00 0.00 57.85 55.58 2wk6 n ARG 81 Cb 0.55 -0.90 -0.03 0.00 -1.16 0.00 0.00 32.46 30.93 2wk6 n ARG 81 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2wk6 n GLY 82 N 0.37 -1.53 3.15 -0.13 0.00 1.00 -4.94 105.19 103.11 2wk6 n GLY 82 Ca 0.01 -1.10 -0.08 0.00 0.00 0.00 0.00 46.02 44.84 2wk6 n GLY 82 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wk6 s MET 83 N -1.31 0.75 0.45 1.61 -1.94 -1.26 -4.81 119.30 112.80 2wk6 s MET 83 Ca 0.00 -1.15 0.07 0.00 -1.71 0.00 0.00 55.69 52.90 2wk6 s MET 83 Cb 0.00 0.27 0.02 0.00 2.01 0.00 0.00 34.83 37.13 2wk6 s MET 83 CO 0.00 -0.20 0.62 0.16 -0.01 0.00 0.00 175.02 175.59 2wk6 s ASP 84 N -2.92 5.56 0.30 3.03 3.84 -1.26 -4.87 116.67 120.35 2wk6 s ASP 84 Ca 0.09 -0.36 0.05 0.00 -0.00 0.00 0.00 52.55 52.33 2wk6 s ASP 84 Cb 0.07 -0.67 0.76 0.00 -1.38 0.00 0.00 42.92 41.70 2wk6 s ASP 84 CO -0.09 -0.86 1.70 -0.07 -0.00 0.00 0.00 175.17 175.85 2wk6 h LEU 85 N 0.51 0.35 -0.20 2.11 3.38 -2.02 -0.15 115.31 119.30 2wk6 h LEU 85 Ca -0.40 0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 2wk6 h LEU 85 Cb 1.28 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 2wk6 h LEU 85 CO 0.46 -0.00 0.01 -0.08 0.09 0.00 0.00 178.44 178.92 2wk6 h GLU 86 N 0.40 0.34 0.15 1.13 4.81 -1.98 0.18 114.58 119.61 2wk6 h GLU 86 Ca 0.57 -0.10 0.01 0.00 -0.13 0.00 0.00 59.36 59.71 2wk6 h GLU 86 Cb 1.10 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.43 2wk6 h GLU 86 CO -0.53 0.53 -0.21 0.93 -0.73 0.00 0.00 179.01 178.99 2wk6 h GLU 87 N 0.11 -0.41 -0.39 1.92 5.08 -1.60 0.35 114.58 119.64 2wk6 h GLU 87 Ca 0.06 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.52 2wk6 h GLU 87 Cb 0.37 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.63 2wk6 h GLU 87 CO 0.01 -0.27 -0.28 1.15 -1.00 0.00 0.00 179.01 178.62 2wk6 h THR 88 N -0.42 0.30 -0.86 1.13 2.02 -0.97 0.43 112.91 114.53 2wk6 h THR 88 Ca 0.02 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.27 2wk6 h THR 88 Cb 0.43 0.30 -0.07 0.00 -1.74 0.00 0.00 68.15 67.07 2wk6 h THR 88 CO -0.10 0.00 0.52 -1.28 0.37 0.00 0.00 175.52 175.03 2wk6 h SER 89 N -0.21 0.79 -0.04 4.18 0.87 0.01 -0.77 113.55 118.37 2wk6 h SER 89 Ca 0.18 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.65 2wk6 h SER 89 Cb 0.50 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 2wk6 h SER 89 CO -0.51 0.48 -0.34 0.58 -0.53 0.00 0.00 176.83 176.51 2wk6 h VAL 90 N 0.91 1.29 0.29 2.23 2.07 0.18 -2.44 116.25 120.78 2wk6 h VAL 90 Ca 0.39 -1.44 -0.01 0.00 0.82 0.00 0.00 66.70 66.45 2wk6 h VAL 90 Cb 0.26 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2wk6 h VAL 90 CO -0.21 0.46 -0.14 0.25 0.02 0.00 0.00 177.57 177.95 2wk6 h LEU 91 N 0.44 -0.33 -0.73 2.57 6.46 0.43 -1.34 115.31 122.82 2wk6 h LEU 91 Ca 0.05 -0.14 0.15 0.00 -0.12 0.00 0.00 57.88 57.82 2wk6 h LEU 91 Cb 0.80 0.08 -0.14 0.00 -0.73 0.00 0.00 40.66 40.68 2wk6 h LEU 91 CO 0.07 -0.04 -0.16 0.74 -0.62 0.00 0.00 178.44 178.42 2wk6 h THR 92 N -0.63 0.28 0.01 1.05 2.02 -1.08 0.20 112.91 114.76 2wk6 h THR 92 Ca -0.04 -0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 2wk6 h THR 92 Cb 0.45 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 2wk6 h THR 92 CO 0.07 0.00 -0.01 1.56 0.37 0.00 0.00 175.52 177.51 2wk6 h GLN 93 N 0.01 -0.01 -0.59 6.66 4.20 -1.34 -0.86 115.11 123.19 2wk6 h GLN 93 Ca 0.35 0.00 0.08 0.00 0.06 0.00 0.00 58.65 59.15 2wk6 h GLN 93 Cb 0.55 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.27 2wk6 h GLN 93 CO -0.74 0.15 0.24 0.00 -0.67 0.00 0.00 178.83 177.81 2wk6 h ALA 94 N 0.81 0.76 -0.41 3.87 0.00 0.03 0.40 119.26 124.72 2wk6 h ALA 94 Ca -0.00 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2wk6 h ALA 94 Cb 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2wk6 h ALA 94 CO 0.00 -0.16 0.01 -0.07 0.00 0.00 0.00 179.25 179.03 2wk6 h LEU 95 N 0.44 0.70 -1.00 0.00 3.38 -0.56 0.12 115.31 118.38 2wk6 h LEU 95 Ca 0.29 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2wk6 h LEU 95 Cb 0.32 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 2wk6 h LEU 95 CO -0.27 0.83 0.58 0.00 0.09 0.00 0.00 178.44 179.66 2wk6 h ALA 96 N 0.90 1.26 -0.01 1.53 0.00 -0.29 -2.22 119.26 120.43 2wk6 h ALA 96 Ca 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2wk6 h ALA 96 Cb 0.46 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2wk6 h ALA 96 CO 0.02 0.65 -0.02 1.04 0.00 0.00 0.00 179.25 180.94 2wk6 n GLN 97 N -4.36 1.38 0.24 0.00 6.02 0.13 -3.76 117.38 117.03 2wk6 n GLN 97 Ca 0.11 -0.63 0.16 0.00 -0.01 0.00 0.00 57.00 56.63 2wk6 n GLN 97 Cb 0.05 -1.49 0.62 0.00 1.02 0.00 0.00 30.24 30.44 2wk6 n GLN 97 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2wk6 h SER 98 N 1.53 0.00 0.00 1.08 4.64 -0.11 -3.45 113.55 117.24 2wk6 h SER 98 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wk6 h SER 98 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2wk6 h SER 98 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2wk6 n GLY 99 N 0.09 5.33 3.94 -0.77 0.00 -1.25 -4.60 105.19 107.94 2wk6 n GLY 99 Ca 0.01 -1.41 -0.25 0.00 0.00 0.00 0.00 46.02 44.38 2wk6 n GLY 99 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wk6 s GLN 100 N 4.11 3.50 -0.21 1.61 -0.21 0.11 -4.92 119.66 123.64 2wk6 s GLN 100 Ca 0.00 -0.39 -0.11 0.00 0.02 0.00 0.00 55.36 54.88 2wk6 s GLN 100 Cb 0.00 -2.76 -0.05 0.00 1.00 0.00 0.00 33.01 31.20 2wk6 s GLN 100 CO 0.00 0.29 0.19 -1.14 -2.12 0.00 0.00 175.29 172.51 2wk6 s GLN 101 N -3.87 4.16 -0.05 2.91 2.00 -1.26 -4.70 119.66 118.84 2wk6 s GLN 101 Ca 0.39 -0.15 -0.30 0.00 -2.00 0.00 0.00 55.36 53.30 2wk6 s GLN 101 Cb -0.10 -3.48 -0.04 0.00 0.80 0.00 0.00 33.01 30.19 2wk6 s GLN 101 CO 0.32 0.17 1.34 -0.51 -0.50 0.00 0.00 175.29 176.10 2wk6 s LEU 102 N 0.72 4.28 -0.31 3.68 1.43 -0.34 -4.98 118.68 123.16 2wk6 s LEU 102 Ca 0.10 1.95 -0.12 0.00 -1.03 0.00 0.00 54.13 55.03 2wk6 s LEU 102 Cb -0.13 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 2wk6 s LEU 102 CO 0.02 -0.71 0.22 -1.61 0.23 0.00 0.00 176.35 174.50 2wk6 s GLU 103 N 2.70 3.76 0.29 1.70 2.02 -1.26 -4.62 118.70 123.29 2wk6 s GLU 103 Ca 0.60 -0.45 0.09 0.00 0.02 0.00 0.00 54.97 55.23 2wk6 s GLU 103 Cb -0.28 -3.72 -0.04 0.00 0.10 0.00 0.00 34.13 30.19 2wk6 s GLU 103 CO 0.23 -0.29 0.06 -1.58 0.02 0.00 0.00 175.26 173.70 2wk6 s TRP 104 N 1.75 2.75 0.06 1.61 0.52 -1.26 -5.01 118.94 119.37 2wk6 s TRP 104 Ca 0.07 -0.26 -0.31 0.00 0.02 0.00 0.00 56.10 55.62 2wk6 s TRP 104 Cb -0.17 -1.35 -0.07 0.00 -1.15 0.00 0.00 33.47 30.73 2wk6 s TRP 104 CO 0.11 0.53 1.47 -2.14 0.02 0.00 0.00 176.95 176.94 2wk6 s PRO 105 N -3.74 4.27 0.49 4.98 0.02 -1.26 -4.86 135.00 134.89 2wk6 s PRO 105 Ca 0.33 2.12 0.38 0.00 0.02 0.00 0.00 61.00 63.85 2wk6 s PRO 105 Cb -0.05 -3.46 1.55 0.00 0.02 0.00 0.00 34.50 32.56 2wk6 s PRO 105 CO 0.21 -0.58 1.61 0.93 -0.33 0.00 0.00 177.00 178.85 2wk6 h GLU 106 N 7.59 0.04 0.00 5.54 3.07 -2.02 0.53 114.58 129.33 2wk6 h GLU 106 Ca -0.41 -0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.45 2wk6 h GLU 106 Cb 1.19 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 29.10 2wk6 h GLU 106 CO 0.90 0.02 -0.00 0.00 -1.40 0.00 0.00 179.01 178.53 2wk6 h ALA 107 N 1.39 1.08 0.04 3.43 0.00 -2.06 -2.67 119.26 120.47 2wk6 h ALA 107 Ca 0.85 -0.00 -0.33 0.00 0.00 0.00 0.00 54.91 55.43 2wk6 h ALA 107 Cb 3.00 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 20.74 2wk6 h ALA 107 CO -0.27 0.00 -1.96 0.91 0.00 0.00 0.00 179.25 177.93 2wk6 n TRP 108 N -3.19 0.86 0.00 0.00 8.01 0.19 -4.65 117.44 118.65 2wk6 n TRP 108 Ca -0.03 0.25 0.00 0.00 -1.31 0.00 0.00 57.50 56.41 2wk6 n TRP 108 Cb 0.07 -1.14 0.00 0.00 -2.01 0.00 0.00 31.31 28.24 2wk6 n TRP 108 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.69 174.55 2wk6 n ARG 109 N -3.16 0.00 0.20 -0.99 0.63 -1.01 0.35 116.66 112.68 2wk6 n ARG 109 Ca -0.26 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 56.80 2wk6 n ARG 109 Cb 1.06 0.00 0.36 0.00 0.45 0.00 0.00 32.46 34.33 2wk6 n ARG 109 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2wk6 h GLN 110 N 0.00 0.00 0.00 -0.14 1.08 -1.82 -3.32 115.11 110.91 2wk6 h GLN 110 Ca 0.00 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.00 2wk6 h GLN 110 Cb 0.00 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.40 2wk6 h GLN 110 CO 0.00 0.00 -1.51 1.04 -0.95 0.00 0.00 178.83 177.41 2wk6 n GLN 111 N -2.86 0.62 -1.60 1.46 6.02 1.09 -4.86 117.38 117.25 2wk6 n GLN 111 Ca 0.03 0.24 -0.39 0.00 -0.01 0.00 0.00 57.00 56.87 2wk6 n GLN 111 Cb 0.43 -1.80 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 2wk6 n GLN 111 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2wk6 s LEU 112 N -5.84 3.41 0.39 1.08 1.43 -1.12 -2.02 118.68 116.00 2wk6 s LEU 112 Ca -0.03 1.32 0.04 0.00 -1.03 0.00 0.00 54.13 54.42 2wk6 s LEU 112 Cb 0.08 -2.85 -0.03 0.00 0.03 0.00 0.00 46.19 43.42 2wk6 s LEU 112 CO 0.82 -2.55 0.11 0.68 0.23 0.00 0.00 176.35 175.64 2wk6 s VAL 113 N 10.74 0.73 -0.10 -1.59 -7.23 0.02 -1.09 120.40 121.88 2wk6 s VAL 113 Ca 0.97 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 58.82 2wk6 s VAL 113 Cb -0.22 -2.44 0.12 0.00 0.56 0.00 0.00 36.38 34.40 2wk6 s VAL 113 CO 0.29 0.00 1.16 -0.62 -0.31 0.00 0.00 175.10 175.62 2wk6 s ASP 114 N -3.58 -0.16 0.05 4.85 2.15 -1.20 -4.11 116.67 114.68 2wk6 s ASP 114 Ca 0.26 -0.06 0.02 0.00 0.43 0.00 0.00 52.55 53.20 2wk6 s ASP 114 Cb 0.04 0.21 -0.03 0.00 -0.30 0.00 0.00 42.92 42.84 2wk6 s ASP 114 CO 0.14 -0.35 -0.06 -1.59 -0.17 0.00 0.00 175.17 173.14 2wk6 s LYS 115 N -2.59 0.55 0.06 4.34 0.00 -1.26 -2.54 119.74 118.30 2wk6 s LYS 115 Ca 0.10 -0.86 -0.00 0.00 0.00 0.00 0.00 55.97 55.21 2wk6 s LYS 115 Cb 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 37.83 37.62 2wk6 s LYS 115 CO -0.05 0.01 -0.04 -1.58 0.00 0.00 0.00 175.35 173.69 2wk6 s HIS 116 N -1.94 0.62 0.19 1.78 2.46 0.23 -4.95 115.29 113.68 2wk6 s HIS 116 Ca -0.06 -1.01 0.09 0.00 0.47 0.00 0.00 55.06 54.55 2wk6 s HIS 116 Cb -0.06 -0.42 -0.04 0.00 -0.13 0.00 0.00 32.58 31.92 2wk6 s HIS 116 CO -0.01 -0.31 -0.17 0.45 -2.47 0.00 0.00 174.74 172.23 2wk6 s SER 117 N -2.90 2.73 0.00 9.88 0.15 -1.26 0.20 113.70 122.49 2wk6 s SER 117 Ca 0.08 -0.93 0.29 0.00 0.70 0.00 0.00 55.95 56.08 2wk6 s SER 117 Cb 0.07 -0.16 1.27 0.00 -1.71 0.00 0.00 66.02 65.48 2wk6 s SER 117 CO -0.08 -0.08 1.87 0.35 1.20 0.00 0.00 173.24 176.50 2wk6 n THR 118 N -0.03 0.00 0.00 6.45 -2.24 -0.47 -4.87 114.28 113.12 2wk6 n THR 118 Ca -0.11 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2wk6 n THR 118 Cb 0.58 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 2wk6 n THR 118 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wk6 n GLY 119 N 1.13 0.72 0.00 3.38 0.00 -1.26 -4.71 105.19 104.45 2wk6 n GLY 119 Ca 0.20 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2wk6 n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wk6 n GLY 120 N 1.33 3.16 3.02 -0.02 0.00 -1.26 -4.46 105.19 106.95 2wk6 n GLY 120 Ca 0.00 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 2wk6 n GLY 120 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wk6 s VAL 121 N -0.93 1.65 -0.02 1.61 1.01 -1.26 -2.95 120.40 119.51 2wk6 s VAL 121 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.17 2wk6 s VAL 121 Cb 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.77 2wk6 s VAL 121 CO 0.00 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2wk6 n GLY 122 N 4.72 0.46 3.12 4.51 0.00 -1.26 -0.58 105.19 116.16 2wk6 n GLY 122 Ca -0.16 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 2wk6 n GLY 122 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2wk6 n ASP 123 N 0.05 3.50 -2.08 1.61 2.03 -1.26 -4.33 116.55 116.06 2wk6 n ASP 123 Ca -0.00 -2.78 -0.23 0.00 0.52 0.00 0.00 54.79 52.29 2wk6 n ASP 123 Cb 0.05 -1.51 0.12 0.00 -0.72 0.00 0.00 41.12 39.06 2wk6 n ASP 123 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 2wk6 n LYS 124 N 7.11 2.18 -0.15 -0.67 0.00 -1.26 -4.62 118.16 120.73 2wk6 n LYS 124 Ca 0.50 -2.58 -0.08 0.00 -0.00 0.00 0.00 58.31 56.15 2wk6 n LYS 124 Cb 0.42 -2.01 0.06 0.00 -0.00 0.00 0.00 35.03 33.50 2wk6 n LYS 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2wk6 h VAL 125 N 0.89 1.26 -0.63 0.58 2.07 -1.95 -2.99 116.25 115.49 2wk6 h VAL 125 Ca 0.52 -1.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.78 2wk6 h VAL 125 Cb 1.87 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 32.59 2wk6 h VAL 125 CO 1.08 0.43 0.25 0.28 0.02 0.00 0.00 177.57 179.62 2wk6 h SER 126 N 0.84 0.84 -0.66 0.57 0.02 -1.96 0.66 113.55 113.86 2wk6 h SER 126 Ca 0.14 -0.11 0.03 0.00 -0.84 0.00 0.00 61.79 61.01 2wk6 h SER 126 Cb 0.63 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.91 2wk6 h SER 126 CO 0.04 0.76 0.41 -0.07 -1.14 0.00 0.00 176.83 176.83 2wk6 h LEU 127 N 0.91 0.66 0.22 5.07 3.38 -1.89 0.95 115.31 124.60 2wk6 h LEU 127 Ca 0.21 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.84 2wk6 h LEU 127 Cb 0.18 -0.14 0.02 0.00 0.09 0.00 0.00 40.66 40.82 2wk6 h LEU 127 CO -0.02 0.45 -1.63 0.58 0.09 0.00 0.00 178.44 177.91 2wk6 h VAL 128 N 0.79 1.09 -0.18 1.22 2.07 -1.40 -3.39 116.25 116.45 2wk6 h VAL 128 Ca 0.27 -2.60 -0.20 0.00 0.82 0.00 0.00 66.70 64.99 2wk6 h VAL 128 Cb 0.04 2.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.71 2wk6 h VAL 128 CO -0.12 0.84 -0.69 0.25 0.02 0.00 0.00 177.57 177.87 2wk6 h LEU 129 N 0.13 0.87 0.38 2.57 7.12 0.41 -2.87 115.31 123.91 2wk6 h LEU 129 Ca -0.31 -0.53 -0.00 0.00 0.13 0.00 0.00 57.88 57.17 2wk6 h LEU 129 Cb 2.14 -0.25 -0.02 0.00 -0.53 0.00 0.00 40.66 41.99 2wk6 h LEU 129 CO 0.22 1.31 -0.38 0.00 -0.13 0.00 0.00 178.44 179.47 2wk6 h ALA 130 N 0.68 -0.83 0.00 1.25 0.00 -1.00 -0.03 119.26 119.33 2wk6 h ALA 130 Ca -0.03 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2wk6 h ALA 130 Cb 1.30 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 19.63 2wk6 h ALA 130 CO 0.14 -1.00 -0.31 -1.00 0.00 0.00 0.00 179.25 177.08 2wk6 h PRO 131 N -0.78 0.00 -0.51 0.00 0.13 -1.75 -2.04 132.00 127.04 2wk6 h PRO 131 Ca -0.03 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.01 2wk6 h PRO 131 Cb 0.70 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.81 2wk6 h PRO 131 CO -0.06 0.31 -0.05 0.00 -0.23 0.00 0.00 178.00 177.96 2wk6 h ALA 132 N 1.69 0.94 -0.14 -0.56 0.00 -1.22 -2.12 119.26 117.84 2wk6 h ALA 132 Ca -0.00 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 2wk6 h ALA 132 Cb 0.60 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2wk6 h ALA 132 CO 0.04 0.63 -0.13 -0.07 0.00 0.00 0.00 179.25 179.72 2wk6 h LEU 133 N 0.83 0.36 0.00 0.00 3.38 -0.60 -2.07 115.31 117.20 2wk6 h LEU 133 Ca 0.15 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2wk6 h LEU 133 Cb 0.56 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2wk6 h LEU 133 CO 0.03 0.76 0.00 0.00 0.09 0.00 0.00 178.44 179.32 2wk6 n ALA 134 N -2.41 1.83 0.18 1.53 0.00 -0.81 0.10 120.51 120.93 2wk6 n ALA 134 Ca -0.06 -0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.40 2wk6 n ALA 134 Cb 0.35 -1.15 0.25 0.00 0.00 0.00 0.00 19.45 18.90 2wk6 n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wk6 n ALA 135 N -1.00 2.59 -2.69 0.00 0.00 -0.78 -3.85 120.51 114.78 2wk6 n ALA 135 Ca 0.07 -1.02 0.01 0.00 0.00 0.00 0.00 53.44 52.50 2wk6 n ALA 135 Cb 0.03 -0.98 0.04 0.00 0.00 0.00 0.00 19.45 18.55 2wk6 n ALA 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wk6 n GLY 137 N -0.34 1.30 3.77 0.00 0.00 -1.25 -4.97 105.19 103.70 2wk6 n GLY 137 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2wk6 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk6 s LYS 139 N -1.95 3.69 -0.49 0.00 -0.14 -0.86 -3.97 119.74 116.02 2wk6 s LYS 139 Ca 0.52 -0.24 0.00 0.00 -1.36 0.00 0.00 55.97 54.89 2wk6 s LYS 139 Cb -0.31 -3.77 0.13 0.00 -1.68 0.00 0.00 37.83 32.20 2wk6 s LYS 139 CO 0.40 -0.50 0.26 0.08 -0.76 0.00 0.00 175.35 174.83 2wk6 s VAL 140 N 2.13 3.05 -1.30 3.17 1.01 0.21 -0.80 120.40 127.86 2wk6 s VAL 140 Ca 0.14 -2.70 -0.05 0.00 0.00 0.00 0.00 61.98 59.37 2wk6 s VAL 140 Cb -0.16 -3.08 0.14 0.00 0.00 0.00 0.00 36.38 33.27 2wk6 s VAL 140 CO 0.12 -0.76 2.34 -0.81 0.00 0.00 0.00 175.10 175.99 2wk6 n PRO 141 N 3.82 4.66 -1.77 2.72 -0.04 -1.26 -1.88 135.00 141.25 2wk6 n PRO 141 Ca 0.04 -3.55 -0.43 0.00 -0.04 0.00 0.00 63.50 59.52 2wk6 n PRO 141 Cb 0.38 -2.62 -0.03 0.00 -0.04 0.00 0.00 33.50 31.19 2wk6 n PRO 141 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 2wk6 s MET 142 N -1.39 3.74 -0.58 0.54 1.75 -1.00 -4.94 119.30 117.43 2wk6 s MET 142 Ca 0.53 2.19 -0.11 0.00 -1.25 0.00 0.00 55.69 57.05 2wk6 s MET 142 Cb 0.18 -4.19 0.15 0.00 2.84 0.00 0.00 34.83 33.81 2wk6 s MET 142 CO -0.10 -1.39 0.49 0.42 -0.65 0.00 0.00 175.02 173.79 2wk6 s ILE 143 N 5.83 4.74 0.00 10.11 1.09 -1.26 -1.22 121.20 140.49 2wk6 s ILE 143 Ca 0.88 -1.97 0.00 0.00 -1.10 0.00 0.00 60.65 58.46 2wk6 s ILE 143 Cb -0.35 -4.04 0.00 0.00 -1.06 0.00 0.00 42.46 37.00 2wk6 s ILE 143 CO 0.36 -0.87 0.00 -1.54 -0.10 0.00 0.00 174.94 172.79 2wk6 n SER 144 N 4.67 0.00 -3.47 3.58 3.41 -0.44 -4.86 113.62 116.52 2wk6 n SER 144 Ca -0.04 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.55 2wk6 n SER 144 Cb 0.41 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.37 2wk6 n SER 144 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2wk6 s GLY 145 N 0.00 0.01 0.18 5.00 0.00 -1.26 -4.39 107.32 106.85 2wk6 s GLY 145 Ca 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 44.72 44.52 2wk6 s GLY 145 CO 0.00 1.81 0.24 0.54 0.00 0.00 0.00 173.10 175.69 2wk6 n ARG 146 N -0.64 -0.05 -1.50 2.90 1.74 -1.26 -2.11 116.66 115.74 2wk6 n ARG 146 Ca -0.04 -0.43 -0.36 0.00 -0.77 0.00 0.00 57.85 56.25 2wk6 n ARG 146 Cb 0.60 -0.23 0.09 0.00 -1.02 0.00 0.00 32.46 31.90 2wk6 n ARG 146 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wk6 n GLY 147 N 3.38 0.26 2.61 -0.13 0.00 -1.26 -3.94 105.19 106.09 2wk6 n GLY 147 Ca 0.03 -0.27 -0.26 0.00 0.00 0.00 0.00 46.02 45.52 2wk6 n GLY 147 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wk6 s LEU 148 N -4.55 0.35 0.00 0.99 2.96 -0.42 -4.84 118.68 113.17 2wk6 s LEU 148 Ca 0.79 -0.74 0.00 0.00 -0.22 0.00 0.00 54.13 53.96 2wk6 s LEU 148 Cb -0.35 -0.22 0.00 0.00 0.50 0.00 0.00 46.19 46.12 2wk6 s LEU 148 CO 0.45 -0.37 0.00 0.61 -1.32 0.00 0.00 176.35 175.72 2wk6 n GLY 149 N 5.28 2.15 0.40 7.98 0.00 -1.24 -1.98 105.19 117.78 2wk6 n GLY 149 Ca -0.07 -0.40 0.10 0.00 0.00 0.00 0.00 46.02 45.65 2wk6 n GLY 149 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2wk6 n HIS 150 N 13.16 0.16 -3.73 1.61 1.44 -1.26 -4.77 115.22 121.83 2wk6 n HIS 150 Ca 0.00 -0.08 -0.35 0.00 -2.01 0.00 0.00 57.72 55.28 2wk6 n HIS 150 Cb 0.00 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.06 2wk6 n HIS 150 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 2wk6 s THR 151 N -1.84 5.28 0.36 0.61 -4.23 -0.84 -4.78 115.64 110.20 2wk6 s THR 151 Ca 0.31 0.25 -0.24 0.00 -1.18 0.00 0.00 61.69 60.83 2wk6 s THR 151 Cb 0.16 -3.57 -0.10 0.00 1.34 0.00 0.00 72.50 70.33 2wk6 s THR 151 CO 0.24 0.40 0.94 -0.83 -0.54 0.00 0.00 174.62 174.83 2wk6 s GLY 152 N -1.60 2.63 -0.07 3.99 0.00 -1.15 -1.30 107.32 109.82 2wk6 s GLY 152 Ca 0.27 0.46 -0.01 0.00 0.00 0.00 0.00 44.72 45.43 2wk6 s GLY 152 CO 0.15 0.83 0.00 -0.32 0.00 0.00 0.00 173.10 173.76 2wk6 s GLY 153 N -1.85 1.86 0.48 0.20 0.00 -1.25 -4.62 107.32 102.15 2wk6 s GLY 153 Ca 0.55 -0.84 0.23 0.00 0.00 0.00 0.00 44.72 44.66 2wk6 s GLY 153 CO 0.19 -0.63 2.00 -0.91 0.00 0.00 0.00 173.10 173.76 2wk6 h THR 154 N 4.00 0.73 -0.54 0.90 1.35 -1.79 -1.93 112.91 115.63 2wk6 h THR 154 Ca -0.50 -0.72 -0.07 0.00 -0.55 0.00 0.00 66.41 64.57 2wk6 h THR 154 Cb 1.19 1.44 -0.02 0.00 -1.73 0.00 0.00 68.15 69.03 2wk6 h THR 154 CO 0.55 0.17 0.07 -0.07 -0.25 0.00 0.00 175.52 175.99 2wk6 h LEU 155 N 0.00 0.83 -0.55 3.87 3.38 -1.77 0.84 115.31 121.91 2wk6 h LEU 155 Ca -0.00 -0.18 -0.15 0.00 0.09 0.00 0.00 57.88 57.64 2wk6 h LEU 155 Cb 0.43 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2wk6 h LEU 155 CO 0.02 0.85 -0.41 0.44 0.09 0.00 0.00 178.44 179.43 2wk6 h ASP 156 N 0.83 0.76 -0.61 -0.43 3.32 -1.58 -2.67 116.42 116.03 2wk6 h ASP 156 Ca 0.17 -0.35 -0.03 0.00 0.02 0.00 0.00 57.03 56.84 2wk6 h ASP 156 Cb 0.39 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 2wk6 h ASP 156 CO 0.01 1.08 0.25 0.11 -1.72 0.00 0.00 179.24 178.97 2wk6 h LYS 157 N 0.58 0.91 0.00 3.56 1.57 -0.83 -1.63 116.57 120.74 2wk6 h LYS 157 Ca 0.05 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2wk6 h LYS 157 Cb 0.96 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.11 2wk6 h LYS 157 CO 0.09 0.77 0.00 -0.07 -0.57 0.00 0.00 179.45 179.67 2wk6 h LEU 158 N 0.85 0.00 0.00 2.94 3.38 -0.71 -2.21 115.31 119.56 2wk6 h LEU 158 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2wk6 h LEU 158 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2wk6 h LEU 158 CO -0.02 0.00 -0.33 -0.62 0.09 0.00 0.00 178.44 177.56 2wk6 n GLU 159 N -2.64 0.01 0.00 1.13 1.02 -0.62 -2.12 120.64 117.42 2wk6 n GLU 159 Ca 0.01 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.24 2wk6 n GLU 159 Cb 0.23 -1.50 0.39 0.00 -0.02 0.00 0.00 31.44 30.54 2wk6 n GLU 159 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2wk6 n SER 160 N -1.51 0.03 -4.53 1.62 3.41 -0.83 -4.47 113.62 107.33 2wk6 n SER 160 Ca 0.06 0.51 -0.43 0.00 -0.26 0.00 0.00 58.87 58.75 2wk6 n SER 160 Cb 0.34 -0.51 -0.05 0.00 -0.26 0.00 0.00 64.21 63.73 2wk6 n SER 160 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2wk6 s ILE 161 N -3.01 4.50 -0.15 -1.33 1.01 -0.90 -4.30 121.20 117.03 2wk6 s ILE 161 Ca 0.09 0.41 -0.40 0.00 0.00 0.00 0.00 60.65 60.74 2wk6 s ILE 161 Cb 0.12 -4.44 -0.18 0.00 0.01 0.00 0.00 42.46 37.97 2wk6 s ILE 161 CO 0.34 -0.92 1.45 -2.65 0.00 0.00 0.00 174.94 173.16 2wk6 n PRO 162 N 7.13 0.71 0.00 2.79 -0.02 -1.26 -1.46 135.00 142.88 2wk6 n PRO 162 Ca 0.03 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2wk6 n PRO 162 Cb 0.48 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2wk6 n PRO 162 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wk6 n GLY 163 N 3.08 3.16 3.68 -1.23 0.00 -1.26 -4.44 105.19 108.18 2wk6 n GLY 163 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 2wk6 n GLY 163 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wk6 s PHE 164 N -2.26 2.05 -0.16 1.61 2.19 -0.53 -3.55 117.98 117.32 2wk6 s PHE 164 Ca 0.00 0.00 -0.06 0.00 0.33 0.00 0.00 56.93 57.20 2wk6 s PHE 164 Cb 0.00 -4.11 -0.04 0.00 -1.31 0.00 0.00 43.02 37.56 2wk6 s PHE 164 CO 0.00 -4.65 0.06 1.21 1.83 0.00 0.00 175.22 173.66 2wk6 s ASN 165 N 2.99 5.61 0.06 6.13 3.84 0.27 -4.83 114.94 129.02 2wk6 s ASN 165 Ca 0.80 0.12 0.22 0.00 0.21 0.00 0.00 52.86 54.21 2wk6 s ASN 165 Cb -0.43 -1.89 -0.20 0.00 -0.55 0.00 0.00 41.25 38.18 2wk6 s ASN 165 CO 0.36 0.23 0.71 1.33 -2.79 0.00 0.00 177.10 176.94 2wk6 n VAL 166 N 3.15 0.24 -3.13 -5.21 0.24 -1.26 -4.78 118.33 107.59 2wk6 n VAL 166 Ca -0.17 -0.51 -0.45 0.00 -2.04 0.00 0.00 64.34 61.17 2wk6 n VAL 166 Cb 0.53 -0.11 -0.04 0.00 -1.47 0.00 0.00 33.84 32.75 2wk6 n VAL 166 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2wk6 s ILE 167 N -3.45 5.00 -0.12 1.34 -1.09 -1.26 -0.89 121.20 120.72 2wk6 s ILE 167 Ca -0.05 -1.47 -0.01 0.00 -2.23 0.00 0.00 60.65 56.90 2wk6 s ILE 167 Cb 0.12 -4.54 -0.02 0.00 -1.58 0.00 0.00 42.46 36.44 2wk6 s ILE 167 CO 0.86 -1.17 -0.10 -1.10 -1.23 0.00 0.00 174.94 172.19 2wk6 s GLN 168 N 2.08 3.33 0.92 2.79 -1.52 -1.26 -5.05 119.66 120.94 2wk6 s GLN 168 Ca 0.17 -0.64 -0.12 0.00 -1.95 0.00 0.00 55.36 52.82 2wk6 s GLN 168 Cb -0.17 -2.67 0.14 0.00 -0.22 0.00 0.00 33.01 30.09 2wk6 s GLN 168 CO -0.01 0.29 1.11 -1.54 -0.25 0.00 0.00 175.29 174.89 2wk6 s SER 169 N 0.17 3.32 0.22 5.90 1.04 -1.26 -4.77 113.70 118.32 2wk6 s SER 169 Ca -0.06 1.20 -0.07 0.00 0.48 0.00 0.00 55.95 57.50 2wk6 s SER 169 Cb -0.15 -1.85 0.36 0.00 0.10 0.00 0.00 66.02 64.48 2wk6 s SER 169 CO 0.04 -2.70 1.73 -0.65 0.98 0.00 0.00 173.24 172.64 2wk6 h PRO 170 N -1.59 0.37 0.07 4.02 0.11 -1.99 -1.66 132.00 131.32 2wk6 h PRO 170 Ca -0.51 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.59 2wk6 h PRO 170 Cb 1.31 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 2wk6 h PRO 170 CO 0.58 0.25 -0.18 0.93 -0.21 0.00 0.00 178.00 179.38 2wk6 h GLU 171 N 0.39 -0.31 -0.79 1.05 3.07 -1.98 -1.58 114.58 114.44 2wk6 h GLU 171 Ca 0.36 0.02 0.11 0.00 -0.50 0.00 0.00 59.36 59.35 2wk6 h GLU 171 Cb 0.51 0.07 -0.05 0.00 -0.84 0.00 0.00 28.75 28.44 2wk6 h GLU 171 CO -0.38 -0.21 0.51 1.96 -1.40 0.00 0.00 179.01 179.50 2wk6 h GLN 172 N -0.32 0.64 -0.46 2.33 4.20 -1.80 0.33 115.11 120.02 2wk6 h GLN 172 Ca 0.03 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 2wk6 h GLN 172 Cb 0.36 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 2wk6 h GLN 172 CO -0.12 0.42 0.14 0.52 -0.67 0.00 0.00 178.83 179.12 2wk6 h MET 173 N 0.65 0.67 -0.14 1.46 2.86 -0.38 0.15 114.93 120.20 2wk6 h MET 173 Ca 0.37 -0.11 -0.04 0.00 -2.06 0.00 0.00 59.70 57.86 2wk6 h MET 173 Cb 0.55 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.09 2wk6 h MET 173 CO -0.14 0.59 -0.07 0.37 1.06 0.00 0.00 176.91 178.72 2wk6 h GLN 174 N 0.66 0.30 -0.71 1.72 4.15 -0.23 -2.07 115.11 118.93 2wk6 h GLN 174 Ca 0.15 -0.13 0.02 0.00 0.77 0.00 0.00 58.65 59.47 2wk6 h GLN 174 Cb 0.20 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.84 2wk6 h GLN 174 CO -0.01 0.62 0.45 0.28 -1.93 0.00 0.00 178.83 178.25 2wk6 h VAL 175 N -0.03 1.13 -0.19 2.39 2.07 -0.97 -0.81 116.25 119.83 2wk6 h VAL 175 Ca 0.03 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.26 2wk6 h VAL 175 Cb 0.53 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2wk6 h VAL 175 CO 0.02 0.16 0.08 -0.07 0.02 0.00 0.00 177.57 177.79 2wk6 h LEU 176 N 0.90 0.12 -0.92 2.57 4.07 -0.60 -0.66 115.31 120.78 2wk6 h LEU 176 Ca 0.28 0.01 -0.06 0.00 0.08 0.00 0.00 57.88 58.19 2wk6 h LEU 176 Cb -0.03 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 41.68 2wk6 h LEU 176 CO -0.09 0.09 0.10 -0.07 -1.08 0.00 0.00 178.44 177.40 2wk6 h LEU 177 N 0.19 0.85 -1.02 1.67 3.38 -1.04 0.48 115.31 119.81 2wk6 h LEU 177 Ca 0.08 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 2wk6 h LEU 177 Cb 0.03 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2wk6 h LEU 177 CO -0.07 0.85 0.09 -0.78 0.09 0.00 0.00 178.44 178.62 2wk6 h ASP 178 N 0.85 0.75 0.12 -0.43 3.58 -0.76 0.39 116.42 120.92 2wk6 h ASP 178 Ca 0.18 -0.14 -0.11 0.00 0.42 0.00 0.00 57.03 57.37 2wk6 h ASP 178 Cb 0.36 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 2wk6 h ASP 178 CO 0.01 0.76 -1.99 0.00 -2.88 0.00 0.00 179.24 175.13 2wk6 n GLN 179 N -4.26 0.66 0.00 0.28 1.13 -0.29 -4.67 117.38 110.22 2wk6 n GLN 179 Ca 0.03 -0.09 0.00 0.00 -1.94 0.00 0.00 57.00 55.00 2wk6 n GLN 179 Cb 0.24 -1.56 0.00 0.00 0.11 0.00 0.00 30.24 29.03 2wk6 n GLN 179 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wk6 n ALA 180 N -2.40 1.07 -0.15 -1.58 0.00 0.16 -4.97 120.51 112.65 2wk6 n ALA 180 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2wk6 n ALA 180 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.20 2wk6 n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wk6 n GLY 181 N 0.68 2.21 3.57 0.00 0.00 0.14 -4.87 105.19 106.93 2wk6 n GLY 181 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2wk6 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk6 s ILE 184 N -2.14 0.36 0.40 0.00 1.01 -1.25 -2.37 121.20 117.21 2wk6 s ILE 184 Ca 0.07 -0.85 0.07 0.00 0.00 0.00 0.00 60.65 59.95 2wk6 s ILE 184 Cb -0.01 -1.16 -0.06 0.00 0.01 0.00 0.00 42.46 41.23 2wk6 s ILE 184 CO -0.05 -0.54 0.09 0.68 0.00 0.00 0.00 174.94 175.12 2wk6 s VAL 185 N 1.90 2.21 0.44 2.92 -7.23 -0.36 -4.77 120.40 115.51 2wk6 s VAL 185 Ca 0.06 -1.86 0.06 0.00 -1.81 0.00 0.00 61.98 58.43 2wk6 s VAL 185 Cb -0.17 -2.97 -0.04 0.00 0.56 0.00 0.00 36.38 33.76 2wk6 s VAL 185 CO -0.24 -0.02 0.15 -0.83 -0.31 0.00 0.00 175.10 173.85 2wk6 s GLY 186 N -3.80 2.48 0.54 2.32 0.00 -0.07 -1.32 107.32 107.47 2wk6 s GLY 186 Ca 0.38 -1.79 -0.21 0.00 0.00 0.00 0.00 44.72 43.10 2wk6 s GLY 186 CO 0.20 -2.00 1.26 1.20 0.00 0.00 0.00 173.10 173.76 2wk6 s GLN 187 N -3.91 3.24 0.05 2.90 1.11 -1.26 -4.80 119.66 116.99 2wk6 s GLN 187 Ca 0.34 1.98 0.00 0.00 0.01 0.00 0.00 55.36 57.69 2wk6 s GLN 187 Cb 0.04 -2.19 -0.00 0.00 -1.01 0.00 0.00 33.01 29.85 2wk6 s GLN 187 CO 0.19 -1.03 0.06 -1.13 0.01 0.00 0.00 175.29 173.39 2wk6 n SER 188 N -1.07 -0.17 0.26 5.90 3.41 0.06 -4.94 113.62 117.07 2wk6 n SER 188 Ca 0.11 -1.29 0.12 0.00 -0.26 0.00 0.00 58.87 57.55 2wk6 n SER 188 Cb 0.47 0.34 0.69 0.00 -0.26 0.00 0.00 64.21 65.45 2wk6 n SER 188 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2wk6 h GLU 189 N 0.00 0.00 0.03 4.33 5.08 -1.94 -2.86 114.58 119.22 2wk6 h GLU 189 Ca -0.04 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.97 2wk6 h GLU 189 Cb 0.17 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.37 2wk6 h GLU 189 CO 0.05 0.13 -2.16 1.04 -1.00 0.00 0.00 179.01 177.07 2wk6 n GLN 190 N -3.59 0.68 -3.84 2.33 6.02 -1.26 -4.59 117.38 113.14 2wk6 n GLN 190 Ca -0.01 0.17 -0.36 0.00 -0.01 0.00 0.00 57.00 56.79 2wk6 n GLN 190 Cb 0.26 -1.63 -0.13 0.00 1.02 0.00 0.00 30.24 29.76 2wk6 n GLN 190 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2wk6 s LEU 191 N -6.29 3.44 -1.18 1.08 1.43 -1.16 0.04 118.68 116.05 2wk6 s LEU 191 Ca -0.19 -0.64 -0.22 0.00 -1.03 0.00 0.00 54.13 52.06 2wk6 s LEU 191 Cb 0.07 -1.80 0.03 0.00 0.03 0.00 0.00 46.19 44.52 2wk6 s LEU 191 CO 0.75 -0.13 0.41 1.33 0.23 0.00 0.00 176.35 178.94 2wk6 n VAL 192 N 4.81 -1.85 -0.22 -1.59 0.24 -1.26 -0.76 118.33 117.70 2wk6 n VAL 192 Ca -0.16 -0.50 0.02 0.00 -2.04 0.00 0.00 64.34 61.67 2wk6 n VAL 192 Cb 0.49 -1.61 0.14 0.00 -1.47 0.00 0.00 33.84 31.38 2wk6 n VAL 192 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 2wk6 h PRO 193 N -1.86 0.32 -0.72 7.34 0.11 -1.76 -1.15 132.00 134.28 2wk6 h PRO 193 Ca -0.62 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.51 2wk6 h PRO 193 Cb 1.25 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 2wk6 h PRO 193 CO 0.52 0.21 0.44 0.00 -0.21 0.00 0.00 178.00 178.96 2wk6 h ALA 194 N 1.50 0.96 -0.46 -0.75 0.00 -1.86 -1.88 119.26 116.77 2wk6 h ALA 194 Ca 0.35 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 2wk6 h ALA 194 Cb 0.52 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2wk6 h ALA 194 CO -0.40 0.18 -0.04 0.22 0.00 0.00 0.00 179.25 179.21 2wk6 h ASP 195 N 0.83 0.83 -0.83 0.00 1.82 -1.52 -1.92 116.42 115.63 2wk6 h ASP 195 Ca 0.30 -0.33 0.14 0.00 -0.39 0.00 0.00 57.03 56.76 2wk6 h ASP 195 Cb 0.09 -0.23 -0.09 0.00 0.68 0.00 0.00 39.33 39.78 2wk6 h ASP 195 CO -0.14 0.97 0.41 1.23 -1.61 0.00 0.00 179.24 180.10 2wk6 h GLY 196 N 0.68 1.33 0.55 -0.78 0.00 -0.57 0.63 103.07 104.92 2wk6 h GLY 196 Ca 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 2wk6 h GLY 196 CO 0.03 -0.04 -0.02 -2.22 0.00 0.00 0.00 176.54 174.29 2wk6 h ILE 197 N 0.59 1.38 -0.67 2.60 2.04 -1.12 -2.30 117.51 120.03 2wk6 h ILE 197 Ca 0.45 -1.16 -0.06 0.00 1.00 0.00 0.00 64.86 65.09 2wk6 h ILE 197 Cb 0.64 2.12 -0.03 0.00 -0.74 0.00 0.00 36.82 38.80 2wk6 h ILE 197 CO -0.36 0.31 0.17 -0.07 0.00 0.00 0.00 178.15 178.19 2wk6 h LEU 198 N -0.41 0.99 0.30 1.44 3.38 -0.81 -2.29 115.31 117.91 2wk6 h LEU 198 Ca 0.00 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 2wk6 h LEU 198 Cb 0.51 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2wk6 h LEU 198 CO 0.01 0.95 -0.25 0.22 0.09 0.00 0.00 178.44 179.45 2wk6 h TYR 199 N 1.00 -0.66 -0.04 1.13 5.03 0.26 0.23 116.97 123.93 2wk6 h TYR 199 Ca 0.21 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.49 2wk6 h TYR 199 Cb 0.34 0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.86 2wk6 h TYR 199 CO 0.02 -0.37 -0.13 0.00 -1.32 0.00 0.00 178.16 176.36 2wk6 h ALA 200 N 0.07 1.72 0.23 1.82 0.00 -1.34 -2.46 119.26 119.31 2wk6 h ALA 200 Ca -0.02 -0.14 -0.33 0.00 0.00 0.00 0.00 54.91 54.43 2wk6 h ALA 200 Cb 0.50 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.28 2wk6 h ALA 200 CO -0.02 0.21 -1.47 0.00 0.00 0.00 0.00 179.25 177.97 2wk6 h ALA 201 N 1.82 -0.09 -0.79 0.00 0.00 -1.01 -3.31 119.26 115.88 2wk6 h ALA 201 Ca 0.01 -0.90 0.04 0.00 0.00 0.00 0.00 54.91 54.05 2wk6 h ALA 201 Cb 0.27 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 2wk6 h ALA 201 CO 0.02 0.73 0.50 0.00 0.00 0.00 0.00 179.25 180.49 2wk6 h ARG 202 N 0.08 0.93 -0.81 0.00 3.08 -0.45 -2.43 114.38 114.78 2wk6 h ARG 202 Ca -0.27 -0.06 0.16 0.00 0.07 0.00 0.00 59.98 59.89 2wk6 h ARG 202 Cb 2.10 -0.21 -0.10 0.00 0.08 0.00 0.00 29.97 31.84 2wk6 h ARG 202 CO 0.24 0.61 0.36 0.22 -1.07 0.00 0.00 179.97 180.33 2wk6 h ASP 203 N 0.95 0.36 -0.58 7.04 3.58 -1.53 -1.64 116.42 124.60 2wk6 h ASP 203 Ca 0.32 0.11 -0.16 0.00 0.42 0.00 0.00 57.03 57.73 2wk6 h ASP 203 Cb 0.05 0.07 -0.09 0.00 1.72 0.00 0.00 39.33 41.08 2wk6 h ASP 203 CO -0.13 0.12 0.16 1.33 -2.88 0.00 0.00 179.24 177.84 2wk6 n VAL 204 N -4.97 2.75 -0.74 2.25 0.24 -0.99 -3.71 118.33 113.15 2wk6 n VAL 204 Ca 0.17 -1.83 0.00 0.00 -2.04 0.00 0.00 64.34 60.64 2wk6 n VAL 204 Cb 0.46 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.51 2wk6 n VAL 204 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2wk6 n THR 205 N -0.33 0.33 -3.44 3.34 -2.24 -0.63 -4.95 114.28 106.37 2wk6 n THR 205 Ca 0.35 -0.34 -0.23 0.00 -2.27 0.00 0.00 64.05 61.57 2wk6 n THR 205 Cb 1.23 0.81 0.07 0.00 -2.10 0.00 0.00 70.33 70.34 2wk6 n THR 205 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wk6 n ALA 206 N -0.17 -1.20 -1.88 6.98 0.00 -1.15 -4.87 120.51 118.21 2wk6 n ALA 206 Ca 0.00 0.37 0.05 0.00 0.00 0.00 0.00 53.44 53.87 2wk6 n ALA 206 Cb 0.43 -5.06 0.12 0.00 0.00 0.00 0.00 19.45 14.95 2wk6 n ALA 206 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wk6 n THR 207 N -4.85 1.23 -0.06 0.00 -2.24 -1.17 -4.76 114.28 102.43 2wk6 n THR 207 Ca -0.02 -2.09 -0.16 0.00 -2.27 0.00 0.00 64.05 59.51 2wk6 n THR 207 Cb 0.57 0.25 -0.13 0.00 -2.10 0.00 0.00 70.33 68.92 2wk6 n THR 207 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2wk6 h VAL 208 N 3.44 1.63 0.00 2.28 2.07 -1.90 -3.39 116.25 120.38 2wk6 h VAL 208 Ca -0.08 -2.35 -0.60 0.00 0.82 0.00 0.00 66.70 64.49 2wk6 h VAL 208 Cb 1.34 3.21 0.01 0.00 -1.52 0.00 0.00 31.29 34.33 2wk6 h VAL 208 CO 0.03 0.59 2.89 -0.90 0.02 0.00 0.00 177.57 180.20 2wk6 n ASP 209 N -4.51 4.68 -3.92 0.57 5.75 -1.26 -4.58 116.55 113.28 2wk6 n ASP 209 Ca -0.14 -2.60 -0.30 0.00 -0.01 0.00 0.00 54.79 51.74 2wk6 n ASP 209 Cb 0.56 -1.33 -0.16 0.00 -1.03 0.00 0.00 41.12 39.16 2wk6 n ASP 209 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2wk6 s SER 210 N 3.59 3.50 0.17 -1.12 0.15 -1.26 -5.04 113.70 113.70 2wk6 s SER 210 Ca 0.52 -1.00 -0.22 0.00 0.70 0.00 0.00 55.95 55.95 2wk6 s SER 210 Cb 0.14 -1.08 0.08 0.00 -1.71 0.00 0.00 66.02 63.46 2wk6 s SER 210 CO -0.01 -0.22 1.60 0.25 1.20 0.00 0.00 173.24 176.06 2wk6 h LEU 211 N 8.02 -1.01 -1.00 3.45 6.46 -1.97 0.31 115.31 129.57 2wk6 h LEU 211 Ca -0.20 0.19 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 2wk6 h LEU 211 Cb 1.09 0.49 -0.04 0.00 -0.73 0.00 0.00 40.66 41.47 2wk6 h LEU 211 CO 0.41 -0.30 0.49 1.55 -0.62 0.00 0.00 178.44 179.97 2wk6 h PRO 212 N -0.21 1.18 -0.43 5.25 0.13 -1.96 -0.42 132.00 135.54 2wk6 h PRO 212 Ca 0.19 -0.12 -0.13 0.00 -0.87 0.00 0.00 66.00 65.06 2wk6 h PRO 212 Cb 0.52 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.40 2wk6 h PRO 212 CO -0.55 0.85 -0.25 -0.07 -0.23 0.00 0.00 178.00 177.75 2wk6 h LEU 213 N 1.19 0.96 -0.26 1.56 3.38 -1.65 -1.27 115.31 119.22 2wk6 h LEU 213 Ca 0.30 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2wk6 h LEU 213 Cb -0.00 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 2wk6 h LEU 213 CO -0.05 1.17 0.11 0.40 0.09 0.00 0.00 178.44 180.15 2wk6 h ILE 214 N 0.75 1.17 0.23 1.22 2.04 -0.81 -0.42 117.51 121.70 2wk6 h ILE 214 Ca 0.09 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.44 2wk6 h ILE 214 Cb 0.82 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.89 2wk6 h ILE 214 CO 0.07 0.17 -0.45 0.74 0.00 0.00 0.00 178.15 178.69 2wk6 h THR 215 N 0.28 0.12 -0.71 -0.27 2.02 -0.92 0.65 112.91 114.08 2wk6 h THR 215 Ca 0.09 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.22 2wk6 h THR 215 Cb 0.17 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 66.67 2wk6 h THR 215 CO -0.01 0.00 0.26 0.00 0.37 0.00 0.00 175.52 176.15 2wk6 h ALA 216 N -0.39 1.13 0.34 6.16 0.00 -1.20 -1.76 119.26 123.53 2wk6 h ALA 216 Ca -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2wk6 h ALA 216 Cb 0.74 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2wk6 h ALA 216 CO -0.19 0.62 -0.17 1.03 0.00 0.00 0.00 179.25 180.54 2wk6 h SER 217 N 1.04 -0.40 0.40 0.00 0.87 -0.68 0.68 113.55 115.45 2wk6 h SER 217 Ca 0.24 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.79 2wk6 h SER 217 Cb 0.23 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 2wk6 h SER 217 CO -0.02 -0.28 -0.19 0.40 -0.53 0.00 0.00 176.83 176.21 2wk6 h ILE 218 N -0.46 0.59 -0.70 2.23 2.04 -0.81 -3.11 117.51 117.28 2wk6 h ILE 218 Ca -0.04 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 2wk6 h ILE 218 Cb 0.36 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 2wk6 h ILE 218 CO 0.07 0.06 0.38 -0.07 0.00 0.00 0.00 178.15 178.59 2wk6 h LEU 219 N -0.73 0.87 -0.46 1.44 3.38 -1.37 -2.69 115.31 115.75 2wk6 h LEU 219 Ca -0.06 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 57.87 2wk6 h LEU 219 Cb 0.51 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2wk6 h LEU 219 CO 0.09 0.70 0.28 0.77 0.09 0.00 0.00 178.44 180.37 2wk6 h SER 220 N 0.98 0.45 -0.72 -0.43 4.64 -0.89 0.23 113.55 117.82 2wk6 h SER 220 Ca 0.25 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.53 2wk6 h SER 220 Cb 0.03 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 61.99 2wk6 h SER 220 CO -0.04 0.32 0.28 0.11 -0.87 0.00 0.00 176.83 176.63 2wk6 h LYS 221 N 0.56 1.08 -0.28 4.77 1.57 -1.44 -2.89 116.57 119.94 2wk6 h LYS 221 Ca 0.18 -0.20 -0.16 0.00 -1.87 0.00 0.00 60.65 58.60 2wk6 h LYS 221 Cb 0.00 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 2wk6 h LYS 221 CO -0.08 0.89 -0.47 0.87 -0.57 0.00 0.00 179.45 180.10 2wk6 h LYS 222 N 1.03 0.80 -0.88 3.15 1.79 -1.13 -3.20 116.57 118.14 2wk6 h LYS 222 Ca 0.24 -0.50 0.01 0.00 -2.18 0.00 0.00 60.65 58.22 2wk6 h LYS 222 Cb 0.23 0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 30.88 2wk6 h LYS 222 CO -0.02 1.13 0.59 -0.07 -1.08 0.00 0.00 179.45 179.99 2wk6 h LEU 223 N 0.56 1.01 -1.77 2.94 3.38 -0.49 -1.39 115.31 119.56 2wk6 h LEU 223 Ca 0.02 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2wk6 h LEU 223 Cb 1.07 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 2wk6 h LEU 223 CO 0.11 0.72 -0.10 0.58 0.09 0.00 0.00 178.44 179.84 2wk6 h VAL 224 N 1.19 0.34 0.00 1.22 2.07 -1.53 -2.91 116.25 116.64 2wk6 h VAL 224 Ca 0.33 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 67.26 2wk6 h VAL 224 Cb -0.12 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2wk6 h VAL 224 CO -0.07 0.09 0.00 -0.33 0.02 0.00 0.00 177.57 177.28 2wk6 h GLU 225 N 0.00 0.00 -5.43 1.57 5.08 -1.24 -0.88 114.58 113.67 2wk6 h GLU 225 Ca -0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 2wk6 h GLU 225 Cb 0.43 0.00 0.16 0.00 0.50 0.00 0.00 28.75 29.84 2wk6 h GLU 225 CO 0.01 0.00 -0.72 0.41 -1.00 0.00 0.00 179.01 177.71 2wk6 n GLY 226 N 0.45 -0.32 3.94 -3.84 0.00 -1.10 -4.87 105.19 99.45 2wk6 n GLY 226 Ca 0.03 0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 2wk6 n GLY 226 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wk6 s LEU 227 N -6.09 2.86 -0.01 0.99 1.43 -1.26 -4.83 118.68 111.78 2wk6 s LEU 227 Ca 0.01 0.26 0.01 0.00 -1.03 0.00 0.00 54.13 53.37 2wk6 s LEU 227 Cb -0.00 -2.79 0.01 0.00 0.03 0.00 0.00 46.19 43.45 2wk6 s LEU 227 CO 0.69 -1.77 0.93 -1.54 0.23 0.00 0.00 176.35 174.88 2wk6 n SER 228 N -2.99 1.69 0.00 2.29 3.41 -0.25 -4.91 113.62 112.87 2wk6 n SER 228 Ca 0.10 -1.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.82 2wk6 n SER 228 Cb 0.60 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 2wk6 n SER 228 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wk6 n ALA 229 N -0.46 0.00 -3.42 7.33 0.00 -1.26 -4.63 120.51 118.07 2wk6 n ALA 229 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.23 2wk6 n ALA 229 Cb 0.31 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.60 2wk6 n ALA 229 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2wk6 s LEU 230 N 0.00 1.57 -0.22 0.00 0.20 0.12 -3.24 118.68 117.10 2wk6 s LEU 230 Ca 0.00 -0.21 -0.01 0.00 0.69 0.00 0.00 54.13 54.60 2wk6 s LEU 230 Cb 0.00 -0.62 0.02 0.00 -0.43 0.00 0.00 46.19 45.16 2wk6 s LEU 230 CO 0.00 0.01 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.27 2wk6 s VAL 231 N 0.63 2.62 -0.19 1.68 1.01 -1.05 -0.20 120.40 124.90 2wk6 s VAL 231 Ca -0.11 -0.96 -0.06 0.00 0.00 0.00 0.00 61.98 60.85 2wk6 s VAL 231 Cb -0.14 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 2wk6 s VAL 231 CO 0.02 0.33 0.04 -0.69 0.00 0.00 0.00 175.10 174.80 2wk6 s VAL 232 N 1.32 4.48 -0.58 2.92 1.01 0.21 -0.60 120.40 129.17 2wk6 s VAL 232 Ca 0.02 -0.14 -0.21 0.00 0.00 0.00 0.00 61.98 61.65 2wk6 s VAL 232 Cb -0.15 -3.02 0.07 0.00 0.00 0.00 0.00 36.38 33.28 2wk6 s VAL 232 CO -0.07 0.45 0.79 -0.62 0.00 0.00 0.00 175.10 175.64 2wk6 s ASP 233 N 0.59 6.22 -0.25 3.32 3.68 0.53 0.22 116.67 130.98 2wk6 s ASP 233 Ca 0.02 -0.98 -0.20 0.00 2.13 0.00 0.00 52.55 53.52 2wk6 s ASP 233 Cb -0.13 -2.35 -0.02 0.00 -1.45 0.00 0.00 42.92 38.96 2wk6 s ASP 233 CO 0.02 -1.15 0.61 -0.69 0.13 0.00 0.00 175.17 174.08 2wk6 s VAL 234 N 3.24 5.01 0.45 1.11 1.01 0.45 -1.37 120.40 130.29 2wk6 s VAL 234 Ca 0.19 1.09 -0.11 0.00 0.00 0.00 0.00 61.98 63.15 2wk6 s VAL 234 Cb -0.19 -3.91 -0.06 0.00 0.00 0.00 0.00 36.38 32.22 2wk6 s VAL 234 CO 0.11 0.05 0.82 -0.54 0.00 0.00 0.00 175.10 175.54 2wk6 s LYS 235 N 2.38 3.75 0.10 2.72 -0.14 -1.26 -1.37 119.74 125.92 2wk6 s LYS 235 Ca 0.25 0.51 -0.12 0.00 -1.36 0.00 0.00 55.97 55.26 2wk6 s LYS 235 Cb -0.16 -2.33 0.01 0.00 -1.68 0.00 0.00 37.83 33.68 2wk6 s LYS 235 CO 0.09 -0.13 0.28 -0.59 -0.76 0.00 0.00 175.35 174.24 2wk6 s PHE 236 N -2.52 -0.01 0.00 3.18 -0.12 -0.80 -4.54 117.98 113.18 2wk6 s PHE 236 Ca 0.52 -0.37 0.00 0.00 -0.05 0.00 0.00 56.93 57.03 2wk6 s PHE 236 Cb -0.10 0.08 0.00 0.00 -0.63 0.00 0.00 43.02 42.37 2wk6 s PHE 236 CO 0.35 -0.61 0.00 0.41 -0.05 0.00 0.00 175.22 175.32 2wk6 n GLY 237 N -0.13 1.58 0.54 1.99 0.00 0.19 -0.82 105.19 108.54 2wk6 n GLY 237 Ca -0.16 -2.20 0.37 0.00 0.00 0.00 0.00 46.02 44.03 2wk6 n GLY 237 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wk6 h GLY 238 N 0.00 0.37 -0.63 -0.02 0.00 -1.83 -1.18 103.07 99.78 2wk6 h GLY 238 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2wk6 h GLY 238 CO 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 176.54 176.46 2wk6 n ALA 239 N -2.72 2.22 -1.76 3.60 0.00 -0.62 -4.57 120.51 116.66 2wk6 n ALA 239 Ca 0.31 -1.43 -0.31 0.00 0.00 0.00 0.00 53.44 52.00 2wk6 n ALA 239 Cb 1.35 -0.29 0.02 0.00 0.00 0.00 0.00 19.45 20.54 2wk6 n ALA 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wk6 s ALA 240 N -1.48 2.94 0.13 0.00 0.00 -0.45 -4.75 121.76 118.16 2wk6 s ALA 240 Ca 0.17 0.02 -0.18 0.00 0.00 0.00 0.00 51.96 51.96 2wk6 s ALA 240 Cb 0.12 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 2wk6 s ALA 240 CO 0.07 -0.82 1.79 0.28 0.00 0.00 0.00 175.76 177.07 2wk6 h VAL 241 N -0.29 1.06 -3.52 0.00 2.07 -1.83 -3.29 116.25 110.45 2wk6 h VAL 241 Ca -0.44 -0.12 -0.69 0.00 0.82 0.00 0.00 66.70 66.27 2wk6 h VAL 241 Cb 1.20 0.68 -0.36 0.00 -1.52 0.00 0.00 31.29 31.28 2wk6 h VAL 241 CO 0.60 0.06 -0.41 -0.36 0.02 0.00 0.00 177.57 177.48 2wk6 s PHE 242 N -6.17 3.40 0.18 1.57 0.08 -1.26 -4.87 117.98 110.90 2wk6 s PHE 242 Ca -0.13 -2.76 -0.15 0.00 0.12 0.00 0.00 56.93 54.01 2wk6 s PHE 242 Cb 0.09 -3.15 0.15 0.00 -0.57 0.00 0.00 43.02 39.54 2wk6 s PHE 242 CO 0.70 -0.84 1.67 -1.35 -0.10 0.00 0.00 175.22 175.31 2wk6 h PRO 243 N 7.04 0.06 -6.18 0.24 0.11 -1.67 -3.37 132.00 128.22 2wk6 h PRO 243 Ca -0.03 -0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.47 2wk6 h PRO 243 Cb 0.95 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.06 2wk6 h PRO 243 CO 0.71 0.04 1.25 -1.71 -0.21 0.00 0.00 178.00 178.08 2wk6 n ASN 244 N -5.27 3.34 -0.02 -2.05 2.85 -1.26 -0.64 115.26 112.21 2wk6 n ASN 244 Ca 0.04 0.72 0.15 0.00 -0.11 0.00 0.00 54.58 55.38 2wk6 n ASN 244 Cb 0.25 -1.42 0.59 0.00 1.24 0.00 0.00 39.78 40.44 2wk6 n ASN 244 CO 0.00 0.00 0.00 1.56 -2.11 0.00 0.00 177.26 176.71 2wk6 h GLN 245 N 11.14 0.20 0.04 1.20 4.20 -1.96 -0.51 115.11 129.41 2wk6 h GLN 245 Ca -0.44 -0.01 -0.24 0.00 0.06 0.00 0.00 58.65 58.02 2wk6 h GLN 245 Cb 1.27 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.01 2wk6 h GLN 245 CO 0.96 0.13 -1.02 1.49 -0.67 0.00 0.00 178.83 179.72 2wk6 h GLU 246 N 0.20 0.36 -0.30 1.46 4.57 -1.93 -1.98 114.58 116.96 2wk6 h GLU 246 Ca 0.24 -0.43 -0.12 0.00 -1.18 0.00 0.00 59.36 57.87 2wk6 h GLU 246 Cb 0.69 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.40 2wk6 h GLU 246 CO -0.04 1.13 -0.33 0.37 -1.18 0.00 0.00 179.01 178.96 2wk6 h GLN 247 N 0.18 0.64 -0.39 1.92 4.15 -1.59 -1.82 115.11 118.20 2wk6 h GLN 247 Ca -0.09 -0.29 -0.10 0.00 0.77 0.00 0.00 58.65 58.94 2wk6 h GLN 247 Cb 1.68 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 29.34 2wk6 h GLN 247 CO 0.17 0.88 -0.17 0.00 -1.93 0.00 0.00 178.83 177.78 2wk6 h ALA 248 N 1.10 0.98 -0.40 3.38 0.00 -1.12 -2.30 119.26 120.90 2wk6 h ALA 248 Ca 0.06 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 2wk6 h ALA 248 Cb 0.82 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2wk6 h ALA 248 CO 0.07 0.60 -0.10 -0.09 0.00 0.00 0.00 179.25 179.73 2wk6 h ARG 249 N 0.65 0.69 -0.65 0.00 2.43 -0.99 0.13 114.38 116.65 2wk6 h ARG 249 Ca 0.10 -0.22 -0.03 0.00 -0.81 0.00 0.00 59.98 59.03 2wk6 h ARG 249 Cb 0.65 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 2wk6 h ARG 249 CO 0.05 0.78 0.30 0.93 -1.51 0.00 0.00 179.97 180.52 2wk6 h GLU 250 N 0.64 0.92 -0.19 0.20 5.08 -0.94 0.28 114.58 120.57 2wk6 h GLU 250 Ca 0.11 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 2wk6 h GLU 250 Cb 0.54 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 2wk6 h GLU 250 CO 0.03 0.72 -0.10 1.25 -1.00 0.00 0.00 179.01 179.91 2wk6 h LEU 251 N 0.91 0.41 -1.02 1.33 6.46 -0.82 -0.44 115.31 122.14 2wk6 h LEU 251 Ca 0.22 -0.42 0.02 0.00 -0.12 0.00 0.00 57.88 57.59 2wk6 h LEU 251 Cb 0.11 -0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 39.87 2wk6 h LEU 251 CO -0.03 0.74 0.66 0.00 -0.62 0.00 0.00 178.44 179.19 2wk6 h ALA 252 N 0.68 1.32 -0.12 1.25 0.00 -0.11 0.37 119.26 122.65 2wk6 h ALA 252 Ca 0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2wk6 h ALA 252 Cb 0.59 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2wk6 h ALA 252 CO 0.03 0.61 -0.07 0.87 0.00 0.00 0.00 179.25 180.69 2wk6 h LYS 253 N 1.31 0.26 -0.15 0.00 1.57 -0.34 -2.26 116.57 116.97 2wk6 h LYS 253 Ca 0.38 -0.12 0.02 0.00 -1.87 0.00 0.00 60.65 59.07 2wk6 h LYS 253 Cb -0.08 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 2wk6 h LYS 253 CO -0.10 0.62 0.01 1.15 -0.57 0.00 0.00 179.45 180.55 2wk6 h THR 254 N -0.11 0.91 -0.41 -0.16 2.02 -0.63 0.71 112.91 115.25 2wk6 h THR 254 Ca 0.02 -0.02 0.08 0.00 0.77 0.00 0.00 66.41 67.26 2wk6 h THR 254 Cb 0.55 0.84 -0.07 0.00 -1.74 0.00 0.00 68.15 67.73 2wk6 h THR 254 CO 0.02 0.01 -0.04 -0.07 0.37 0.00 0.00 175.52 175.81 2wk6 h LEU 255 N 0.06 -0.25 -0.14 2.58 3.38 -0.24 0.21 115.31 120.91 2wk6 h LEU 255 Ca 0.07 0.11 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 2wk6 h LEU 255 Cb 0.08 0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2wk6 h LEU 255 CO -0.11 -0.09 -0.16 0.58 0.09 0.00 0.00 178.44 178.76 2wk6 h VAL 256 N 0.06 1.36 0.63 1.22 2.07 -1.11 -1.80 116.25 118.68 2wk6 h VAL 256 Ca 0.20 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 2wk6 h VAL 256 Cb 0.29 1.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2wk6 h VAL 256 CO -0.37 0.39 -0.37 1.23 0.02 0.00 0.00 177.57 178.48 2wk6 h GLY 257 N -0.04 -1.08 1.24 2.17 0.00 0.85 0.29 103.07 106.50 2wk6 h GLY 257 Ca 0.02 0.43 0.05 0.00 0.00 0.00 0.00 47.33 47.83 2wk6 h GLY 257 CO 0.04 -0.37 0.40 -2.08 0.00 0.00 0.00 176.54 174.52 2wk6 h VAL 258 N -0.93 1.03 0.58 4.60 2.07 -0.73 0.54 116.25 123.41 2wk6 h VAL 258 Ca -0.09 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 2wk6 h VAL 258 Cb 0.73 0.35 0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2wk6 h VAL 258 CO 0.10 0.11 -0.28 1.23 0.02 0.00 0.00 177.57 178.76 2wk6 h GLY 259 N 0.63 -0.81 -0.06 2.17 0.00 -1.11 -1.57 103.07 102.33 2wk6 h GLY 259 Ca 0.25 0.30 0.13 0.00 0.00 0.00 0.00 47.33 48.01 2wk6 h GLY 259 CO -0.07 -0.29 0.03 0.00 0.00 0.00 0.00 176.54 176.21 2wk6 h ALA 260 N -0.41 0.66 -0.01 3.60 0.00 0.60 0.32 119.26 124.03 2wk6 h ALA 260 Ca -0.08 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2wk6 h ALA 260 Cb 0.61 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2wk6 h ALA 260 CO 0.13 -0.38 0.01 0.77 0.00 0.00 0.00 179.25 179.77 2wk6 h SER 261 N 0.15 0.00 -0.55 0.00 0.02 -0.64 -0.83 113.55 111.70 2wk6 h SER 261 Ca 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 2wk6 h SER 261 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 2wk6 h SER 261 CO -0.52 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.35 2wk6 n LEU 262 N -3.87 4.37 -1.32 5.07 4.77 0.11 -4.92 117.00 121.21 2wk6 n LEU 262 Ca -0.03 -2.21 -0.10 0.00 -0.03 0.00 0.00 56.01 53.65 2wk6 n LEU 262 Cb 0.09 -0.56 0.01 0.00 -2.33 0.00 0.00 43.42 40.62 2wk6 n LEU 262 CO 0.28 0.68 -0.04 0.61 -1.33 0.00 0.00 177.39 177.59 2wk6 n GLY 263 N 0.93 0.10 2.99 -0.72 0.00 -0.32 -5.03 105.19 103.13 2wk6 n GLY 263 Ca 0.23 -0.42 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 2wk6 n GLY 263 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wk6 s LEU 264 N -3.01 1.52 -0.23 0.99 0.20 -0.85 -5.01 118.68 112.28 2wk6 s LEU 264 Ca 0.09 -0.40 -0.29 0.00 0.69 0.00 0.00 54.13 54.22 2wk6 s LEU 264 Cb -0.04 -1.03 -0.03 0.00 -0.43 0.00 0.00 46.19 44.67 2wk6 s LEU 264 CO 0.11 -0.06 1.75 -0.60 -0.29 0.00 0.00 176.35 177.27 2wk6 s ARG 265 N 1.40 3.62 -0.04 1.98 6.06 -1.26 -3.12 118.95 127.60 2wk6 s ARG 265 Ca 0.01 1.70 0.02 0.00 -2.50 0.00 0.00 55.73 54.97 2wk6 s ARG 265 Cb -0.13 -4.13 0.01 0.00 0.06 0.00 0.00 34.95 30.76 2wk6 s ARG 265 CO -0.07 -1.52 -0.10 0.08 -2.50 0.00 0.00 175.30 171.20 2wk6 s VAL 266 N 5.95 0.87 0.03 7.11 1.01 -1.26 0.11 120.40 134.22 2wk6 s VAL 266 Ca 0.78 -0.38 0.07 0.00 0.00 0.00 0.00 61.98 62.45 2wk6 s VAL 266 Cb -0.26 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.31 2wk6 s VAL 266 CO 0.32 0.28 -0.21 0.00 0.00 0.00 0.00 175.10 175.49 2wk6 s ALA 267 N 0.35 1.74 -0.08 5.51 0.00 0.72 -3.60 121.76 126.41 2wk6 s ALA 267 Ca -0.06 -1.02 0.02 0.00 0.00 0.00 0.00 51.96 50.90 2wk6 s ALA 267 Cb -0.11 -0.36 0.02 0.00 0.00 0.00 0.00 23.12 22.66 2wk6 s ALA 267 CO 0.01 0.40 -0.12 0.00 0.00 0.00 0.00 175.76 176.05 2wk6 s ALA 268 N -0.73 1.34 0.10 0.00 0.00 -0.57 -0.62 121.76 121.28 2wk6 s ALA 268 Ca 0.08 -0.49 -0.02 0.00 0.00 0.00 0.00 51.96 51.53 2wk6 s ALA 268 Cb -0.09 -0.67 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 2wk6 s ALA 268 CO 0.01 -0.01 0.28 0.00 0.00 0.00 0.00 175.76 176.04 2wk6 s ALA 269 N 0.90 3.92 -0.23 0.00 0.00 0.13 -0.08 121.76 126.40 2wk6 s ALA 269 Ca -0.10 -0.73 -0.02 0.00 0.00 0.00 0.00 51.96 51.11 2wk6 s ALA 269 Cb -0.15 -1.95 0.01 0.00 0.00 0.00 0.00 23.12 21.03 2wk6 s ALA 269 CO 0.01 0.75 -0.08 -0.51 0.00 0.00 0.00 175.76 175.93 2wk6 s LEU 270 N -2.60 2.93 0.10 0.00 1.43 -0.44 0.17 118.68 120.26 2wk6 s LEU 270 Ca 0.38 -0.69 0.07 0.00 -1.03 0.00 0.00 54.13 52.86 2wk6 s LEU 270 Cb -0.13 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.40 2wk6 s LEU 270 CO 0.27 -0.07 -0.17 0.42 0.23 0.00 0.00 176.35 177.02 2wk6 s THR 271 N 1.37 1.43 0.41 5.49 -4.23 -0.48 -0.93 115.64 118.70 2wk6 s THR 271 Ca 0.03 -1.50 -0.25 0.00 -1.18 0.00 0.00 61.69 58.79 2wk6 s THR 271 Cb -0.15 -1.38 -0.08 0.00 1.34 0.00 0.00 72.50 72.23 2wk6 s THR 271 CO -0.05 -0.19 1.16 0.00 -0.54 0.00 0.00 174.62 174.99 2wk6 s ALA 272 N -1.40 3.12 -0.05 3.99 0.00 -0.70 -1.90 121.76 124.82 2wk6 s ALA 272 Ca 0.04 0.95 0.22 0.00 0.00 0.00 0.00 51.96 53.17 2wk6 s ALA 272 Cb -0.09 -3.37 0.39 0.00 0.00 0.00 0.00 23.12 20.04 2wk6 s ALA 272 CO 0.03 -0.53 1.15 -0.12 0.00 0.00 0.00 175.76 176.29 2wk6 n MET 273 N -0.02 0.31 -0.01 0.00 0.00 -0.00 -4.82 117.12 112.58 2wk6 n MET 273 Ca 0.05 -2.09 -0.15 0.00 0.00 0.00 0.00 57.70 55.51 2wk6 n MET 273 Cb 0.47 -0.18 -0.03 0.00 0.00 0.00 0.00 33.22 33.48 2wk6 n MET 273 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 2wk6 h ASP 274 N 1.13 0.81 -2.04 6.12 3.32 -1.85 -1.65 116.42 122.26 2wk6 h ASP 274 Ca -0.26 -0.52 -0.59 0.00 0.02 0.00 0.00 57.03 55.68 2wk6 h ASP 274 Cb 1.72 -0.24 -0.12 0.00 0.22 0.00 0.00 39.33 40.92 2wk6 h ASP 274 CO 0.06 1.30 -0.66 -1.59 -1.72 0.00 0.00 179.24 176.62 2wk6 s LYS 275 N -3.77 1.99 0.33 3.56 -2.85 -1.26 -1.07 119.74 116.66 2wk6 s LYS 275 Ca -0.09 -1.72 -0.29 0.00 -1.00 0.00 0.00 55.97 52.87 2wk6 s LYS 275 Cb 0.09 -1.90 -0.10 0.00 -2.06 0.00 0.00 37.83 33.86 2wk6 s LYS 275 CO 0.88 0.22 1.31 -2.14 0.10 0.00 0.00 175.35 175.72 2wk6 s PRO 276 N -3.65 4.36 -0.33 1.78 0.02 -1.26 -4.75 135.00 131.17 2wk6 s PRO 276 Ca 0.33 2.22 -0.29 0.00 0.02 0.00 0.00 61.00 63.27 2wk6 s PRO 276 Cb -0.02 -3.07 0.01 0.00 0.02 0.00 0.00 34.50 31.44 2wk6 s PRO 276 CO 0.18 -0.19 1.28 -1.17 -0.33 0.00 0.00 177.00 176.77 2wk6 s LEU 277 N -1.79 3.83 0.00 -5.54 1.98 0.25 -4.76 118.68 112.66 2wk6 s LEU 277 Ca 0.49 1.09 0.00 0.00 -2.89 0.00 0.00 54.13 52.82 2wk6 s LEU 277 Cb -0.40 -3.54 0.00 0.00 0.66 0.00 0.00 46.19 42.91 2wk6 s LEU 277 CO 0.53 -1.11 0.00 0.61 -1.89 0.00 0.00 176.35 174.49 2wk6 n GLY 278 N 4.39 -1.77 0.00 7.98 0.00 -1.26 -4.33 105.19 110.20 2wk6 n GLY 278 Ca 0.14 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.40 2wk6 n GLY 278 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wk6 n ARG 279 N 0.00 4.13 -4.44 1.61 3.00 -1.26 -4.95 116.66 114.76 2wk6 n ARG 279 Ca 0.00 -0.17 -0.33 0.00 -0.01 0.00 0.00 57.85 57.34 2wk6 n ARG 279 Cb 0.00 -0.66 -0.16 0.00 0.00 0.00 0.00 32.46 31.64 2wk6 n ARG 279 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2wk6 s VAL 281 N 0.99 2.21 0.00 0.00 1.01 0.46 -4.60 120.40 120.48 2wk6 s VAL 281 Ca -0.02 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.00 2wk6 s VAL 281 Cb -0.15 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.37 2wk6 s VAL 281 CO -0.05 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.21 2wk6 n GLY 282 N 3.62 -0.04 1.27 4.51 0.00 -1.26 0.91 105.19 114.19 2wk6 n GLY 282 Ca -0.19 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2wk6 n GLY 282 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wk6 n HIS 283 N 0.00 0.00 -0.26 1.61 8.25 -1.25 -4.49 115.22 119.08 2wk6 n HIS 283 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.49 2wk6 n HIS 283 Cb 0.00 0.18 0.25 0.00 1.12 0.00 0.00 29.99 31.55 2wk6 n HIS 283 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wk6 h ALA 284 N 0.00 1.52 -0.53 -1.41 0.00 -1.42 -1.48 119.26 115.94 2wk6 h ALA 284 Ca 0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2wk6 h ALA 284 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2wk6 h ALA 284 CO 0.00 0.39 -0.07 -0.07 0.00 0.00 0.00 179.25 179.50 2wk6 h LEU 285 N 1.00 0.94 -1.37 0.00 3.38 -1.87 -2.72 115.31 114.67 2wk6 h LEU 285 Ca 0.34 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2wk6 h LEU 285 Cb 0.09 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2wk6 h LEU 285 CO -0.11 1.04 -0.29 -0.33 0.09 0.00 0.00 178.44 178.84 2wk6 h GLU 286 N 0.86 0.04 -0.33 1.13 5.08 -1.51 -2.22 114.58 117.63 2wk6 h GLU 286 Ca 0.14 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.38 2wk6 h GLU 286 Cb 0.60 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2wk6 h GLU 286 CO 0.04 0.33 -0.26 0.28 -1.00 0.00 0.00 179.01 178.39 2wk6 h VAL 287 N 0.03 1.27 0.16 3.13 2.07 -1.12 -1.44 116.25 120.35 2wk6 h VAL 287 Ca 0.00 -1.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.15 2wk6 h VAL 287 Cb 0.54 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2wk6 h VAL 287 CO 0.04 0.45 -0.08 -0.08 0.02 0.00 0.00 177.57 177.92 2wk6 h GLU 288 N 0.58 -0.20 -0.28 1.57 4.22 -1.17 -0.64 114.58 118.67 2wk6 h GLU 288 Ca 0.08 0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.53 2wk6 h GLU 288 Cb 0.75 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2wk6 h GLU 288 CO 0.06 0.07 0.16 1.49 -2.18 0.00 0.00 179.01 178.61 2wk6 h GLU 289 N -0.48 0.37 -0.01 1.92 4.81 -1.45 -0.57 114.58 119.17 2wk6 h GLU 289 Ca -0.02 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2wk6 h GLU 289 Cb 0.37 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 2wk6 h GLU 289 CO 0.04 0.27 -0.00 0.00 -0.73 0.00 0.00 179.01 178.58 2wk6 h ALA 290 N 1.80 0.02 -0.70 2.92 0.00 -1.03 -1.88 119.26 120.38 2wk6 h ALA 290 Ca 0.10 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.90 2wk6 h ALA 290 Cb 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2wk6 h ALA 290 CO -0.02 -0.31 0.46 -0.07 0.00 0.00 0.00 179.25 179.31 2wk6 h LEU 291 N -0.30 0.66 -0.80 0.00 3.38 -0.47 -0.94 115.31 116.85 2wk6 h LEU 291 Ca 0.00 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2wk6 h LEU 291 Cb 0.33 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2wk6 h LEU 291 CO 0.00 0.44 0.31 0.25 0.09 0.00 0.00 178.44 179.53 2wk6 h LEU 292 N 0.76 1.11 -0.69 1.67 5.85 -0.90 -1.32 115.31 121.79 2wk6 h LEU 292 Ca 0.29 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 2wk6 h LEU 292 Cb 0.20 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 2wk6 h LEU 292 CO -0.09 0.98 0.10 0.00 -0.34 0.00 0.00 178.44 179.09 2wk6 n MET 294 N -4.21 0.83 0.00 0.00 2.81 -0.49 -1.58 117.12 114.48 2wk6 n MET 294 Ca 0.04 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.05 2wk6 n MET 294 Cb 0.30 -1.38 0.10 0.00 -0.71 0.00 0.00 33.22 31.52 2wk6 n MET 294 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2wk6 n ASP 295 N -0.88 2.58 0.00 7.83 9.92 -0.36 -4.37 116.55 131.27 2wk6 n ASP 295 Ca 0.15 -1.80 0.00 0.00 -0.53 0.00 0.00 54.79 52.61 2wk6 n ASP 295 Cb 0.07 0.15 0.00 0.00 -0.64 0.00 0.00 41.12 40.70 2wk6 n ASP 295 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2wk6 n GLY 296 N 1.36 0.75 0.00 0.44 0.00 -0.61 -4.92 105.19 102.21 2wk6 n GLY 296 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2wk6 n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk6 n ALA 297 N -0.33 0.00 0.00 4.61 0.00 -0.64 -5.01 120.51 119.14 2wk6 n ALA 297 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wk6 n ALA 297 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wk6 n ALA 297 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wk6 n GLY 298 N 5.00 -2.29 3.79 0.00 0.00 -1.25 -3.83 105.19 106.61 2wk6 n GLY 298 Ca 0.00 -1.77 -0.36 0.00 0.00 0.00 0.00 46.02 43.89 2wk6 n GLY 298 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wk6 s PRO 299 N -0.27 4.53 0.23 1.61 0.04 -1.26 -4.96 135.00 134.92 2wk6 s PRO 299 Ca 0.00 1.29 -0.06 0.00 0.04 0.00 0.00 61.00 62.27 2wk6 s PRO 299 Cb 0.00 -2.72 0.35 0.00 0.04 0.00 0.00 34.50 32.17 2wk6 s PRO 299 CO 0.00 0.24 1.80 -1.35 0.04 0.00 0.00 177.00 177.74 2wk6 h PRO 300 N 3.01 0.71 0.00 0.56 0.11 -1.99 -2.80 132.00 131.60 2wk6 h PRO 300 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2wk6 h PRO 300 Cb 1.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2wk6 h PRO 300 CO 0.64 0.47 0.00 -3.47 -0.21 0.00 0.00 178.00 175.43 2wk6 n ASP 301 N -4.78 0.00 0.10 -2.05 2.03 -1.26 0.33 116.55 110.92 2wk6 n ASP 301 Ca 0.12 0.66 -0.07 0.00 0.52 0.00 0.00 54.79 56.02 2wk6 n ASP 301 Cb 0.25 -0.30 -0.04 0.00 -0.72 0.00 0.00 41.12 40.32 2wk6 n ASP 301 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2wk6 h LEU 302 N 0.00 -0.53 -0.57 -2.67 6.46 -1.86 -2.50 115.31 113.64 2wk6 h LEU 302 Ca 0.00 0.05 0.11 0.00 -0.12 0.00 0.00 57.88 57.92 2wk6 h LEU 302 Cb 0.00 0.18 -0.11 0.00 -0.73 0.00 0.00 40.66 40.00 2wk6 h LEU 302 CO 0.00 -0.24 -0.19 -0.09 -0.62 0.00 0.00 178.44 177.30 2wk6 h ARG 303 N -0.36 -0.05 -0.62 1.25 2.43 -1.33 0.28 114.38 115.99 2wk6 h ARG 303 Ca -0.02 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 2wk6 h ARG 303 Cb 0.32 0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 29.79 2wk6 h ARG 303 CO -0.04 -0.03 0.16 0.22 -1.51 0.00 0.00 179.97 178.76 2wk6 h ASP 304 N -0.05 0.06 -0.22 -3.80 -0.00 -0.11 0.61 116.42 112.91 2wk6 h ASP 304 Ca 0.27 0.11 -0.16 0.00 -0.00 0.00 0.00 57.03 57.25 2wk6 h ASP 304 Cb 0.47 0.14 -0.01 0.00 -0.00 0.00 0.00 39.33 39.93 2wk6 h ASP 304 CO -0.62 0.03 -0.45 0.25 -0.00 0.00 0.00 179.24 178.46 2wk6 h LEU 305 N 0.29 0.84 -0.90 2.28 6.46 -0.77 -1.77 115.31 121.75 2wk6 h LEU 305 Ca 0.33 -0.41 -0.10 0.00 -0.12 0.00 0.00 57.88 57.57 2wk6 h LEU 305 Cb 0.48 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.16 2wk6 h LEU 305 CO -0.39 1.16 -0.33 0.58 -0.62 0.00 0.00 178.44 178.85 2wk6 h VAL 306 N 0.62 1.28 0.05 1.05 2.07 -0.04 -2.18 116.25 119.11 2wk6 h VAL 306 Ca 0.04 -1.39 -0.25 0.00 0.82 0.00 0.00 66.70 65.92 2wk6 h VAL 306 Cb 1.02 1.49 0.02 0.00 -1.52 0.00 0.00 31.29 32.30 2wk6 h VAL 306 CO 0.10 0.43 -1.00 0.71 0.02 0.00 0.00 177.57 177.83 2wk6 h THR 307 N 0.36 1.33 0.63 2.57 1.35 -0.87 -2.60 112.91 115.68 2wk6 h THR 307 Ca 0.04 -2.30 -0.03 0.00 -0.55 0.00 0.00 66.41 63.57 2wk6 h THR 307 Cb 0.75 2.60 0.01 0.00 -1.73 0.00 0.00 68.15 69.78 2wk6 h THR 307 CO 0.06 0.70 -0.30 0.74 -0.25 0.00 0.00 175.52 176.46 2wk6 h THR 308 N 0.18 0.33 -0.73 6.82 2.02 -1.26 0.33 112.91 120.60 2wk6 h THR 308 Ca -0.14 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 2wk6 h THR 308 Cb 1.69 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 68.45 2wk6 h THR 308 CO 0.19 0.02 0.34 -0.07 0.37 0.00 0.00 175.52 176.37 2wk6 h LEU 309 N -0.96 0.96 -0.57 2.58 3.38 -1.54 -0.07 115.31 119.09 2wk6 h LEU 309 Ca -0.09 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 2wk6 h LEU 309 Cb 0.68 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2wk6 h LEU 309 CO 0.14 0.82 0.11 1.23 0.09 0.00 0.00 178.44 180.83 2wk6 h GLY 310 N 1.10 1.00 0.67 0.83 0.00 -1.41 0.30 103.07 105.57 2wk6 h GLY 310 Ca 0.25 -0.65 0.04 0.00 0.00 0.00 0.00 47.33 46.97 2wk6 h GLY 310 CO -0.03 0.61 0.03 -1.33 0.00 0.00 0.00 176.54 175.81 2wk6 h GLY 311 N 0.82 0.26 1.72 4.60 0.00 0.50 -0.84 103.07 110.14 2wk6 h GLY 311 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.50 2wk6 h GLY 311 CO 0.01 -0.03 0.16 0.00 0.00 0.00 0.00 176.54 176.68 2wk6 h ALA 312 N 1.19 1.75 0.10 3.60 0.00 -0.58 -2.00 119.26 123.32 2wk6 h ALA 312 Ca 0.12 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2wk6 h ALA 312 Cb 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2wk6 h ALA 312 CO -0.17 0.22 -0.05 1.25 0.00 0.00 0.00 179.25 180.50 2wk6 h LEU 313 N 0.39 -0.11 -1.50 0.00 6.46 0.36 -0.10 115.31 120.81 2wk6 h LEU 313 Ca 0.10 -0.39 -0.00 0.00 -0.12 0.00 0.00 57.88 57.47 2wk6 h LEU 313 Cb 0.00 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 39.94 2wk6 h LEU 313 CO -0.02 0.36 0.29 -0.07 -0.62 0.00 0.00 178.44 178.39 2wk6 h LEU 314 N -0.62 0.55 0.37 2.25 3.38 -1.09 -0.22 115.31 119.93 2wk6 h LEU 314 Ca -0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2wk6 h LEU 314 Cb 0.50 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2wk6 h LEU 314 CO 0.02 0.42 -0.18 -0.25 0.09 0.00 0.00 178.44 178.54 2wk6 h TRP 315 N 0.64 -0.47 -0.88 1.13 7.01 -1.34 0.15 115.95 122.19 2wk6 h TRP 315 Ca 0.17 -0.01 0.24 0.00 2.11 0.00 0.00 58.89 61.40 2wk6 h TRP 315 Cb -0.04 0.15 -0.14 0.00 -2.10 0.00 0.00 29.16 27.03 2wk6 h TRP 315 CO 0.00 -0.14 0.23 1.25 -2.79 0.00 0.00 178.44 176.99 2wk6 h LEU 316 N -0.94 -0.02 -0.34 0.65 6.46 -0.51 0.44 115.31 121.04 2wk6 h LEU 316 Ca -0.05 0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.91 2wk6 h LEU 316 Cb 0.54 0.28 0.00 0.00 -0.73 0.00 0.00 40.66 40.74 2wk6 h LEU 316 CO 0.08 -0.17 -0.06 -1.54 -0.62 0.00 0.00 178.44 176.14 2wk6 n SER 317 N -5.24 0.59 0.00 1.25 3.41 -0.14 -4.89 113.62 108.60 2wk6 n SER 317 Ca 0.21 -0.89 0.00 0.00 -0.26 0.00 0.00 58.87 57.93 2wk6 n SER 317 Cb 0.69 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.60 2wk6 n SER 317 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wk6 n GLY 318 N 1.19 0.63 1.12 5.00 0.00 0.15 -4.91 105.19 108.37 2wk6 n GLY 318 Ca 0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.25 2wk6 n GLY 318 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wk6 n HIS 319 N -2.72 0.98 -3.64 1.61 8.25 0.49 -4.78 115.22 115.41 2wk6 n HIS 319 Ca 0.00 -0.37 -0.06 0.00 -0.26 0.00 0.00 57.72 57.03 2wk6 n HIS 319 Cb 0.00 -0.22 -0.07 0.00 1.12 0.00 0.00 29.99 30.82 2wk6 n HIS 319 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wk6 s ALA 320 N -1.81 -1.94 0.26 -1.41 0.00 -0.94 -4.87 121.76 111.05 2wk6 s ALA 320 Ca 0.30 2.39 -0.05 0.00 0.00 0.00 0.00 51.96 54.61 2wk6 s ALA 320 Cb 0.21 -1.48 0.31 0.00 0.00 0.00 0.00 23.12 22.16 2wk6 s ALA 320 CO 0.13 -0.38 1.92 0.78 0.00 0.00 0.00 175.76 178.21 2wk6 h GLY 321 N 6.87 1.31 -1.61 0.00 0.00 -1.89 -3.39 103.07 104.36 2wk6 h GLY 321 Ca -0.30 -0.52 -0.50 0.00 0.00 0.00 0.00 47.33 46.02 2wk6 h GLY 321 CO 0.16 0.50 -0.53 -0.51 0.00 0.00 0.00 176.54 176.17 2wk6 s THR 322 N -5.98 0.51 0.10 4.70 -4.23 -1.26 -5.04 115.64 104.44 2wk6 s THR 322 Ca -0.12 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.32 2wk6 s THR 322 Cb 0.18 -2.45 -0.23 0.00 1.34 0.00 0.00 72.50 71.34 2wk6 s THR 322 CO 0.81 0.00 1.22 0.06 -0.54 0.00 0.00 174.62 176.18 2wk6 h GLN 323 N 1.98 0.44 -0.21 3.99 -0.00 -1.87 -3.15 115.11 116.29 2wk6 h GLN 323 Ca -0.34 -0.54 -0.09 0.00 -0.00 0.00 0.00 58.65 57.67 2wk6 h GLN 323 Cb 1.26 0.17 -0.01 0.00 -0.00 0.00 0.00 27.48 28.90 2wk6 h GLN 323 CO 0.54 1.20 -0.27 0.00 -0.00 0.00 0.00 178.83 180.30 2wk6 h ALA 324 N 0.60 1.16 -0.42 0.06 0.00 -1.97 -0.74 119.26 117.94 2wk6 h ALA 324 Ca -0.12 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 2wk6 h ALA 324 Cb 1.73 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 2wk6 h ALA 324 CO 0.19 0.54 -0.24 1.96 0.00 0.00 0.00 179.25 181.69 2wk6 h GLN 325 N 0.35 0.87 -0.20 0.00 4.20 -1.95 -1.74 115.11 116.64 2wk6 h GLN 325 Ca 0.05 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.35 2wk6 h GLN 325 Cb 0.66 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 2wk6 h GLN 325 CO 0.05 1.02 -0.01 0.78 -0.67 0.00 0.00 178.83 180.00 2wk6 h GLY 326 N 0.92 0.38 1.51 3.46 0.00 -1.43 -0.63 103.07 107.28 2wk6 h GLY 326 Ca 0.10 -0.29 0.07 0.00 0.00 0.00 0.00 47.33 47.20 2wk6 h GLY 326 CO 0.07 0.27 0.18 0.00 0.00 0.00 0.00 176.54 177.05 2wk6 h ALA 327 N 0.78 2.11 0.04 3.60 0.00 -1.05 0.16 119.26 124.90 2wk6 h ALA 327 Ca 0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2wk6 h ALA 327 Cb 0.41 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2wk6 h ALA 327 CO 0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 179.25 178.94 2wk6 h ALA 328 N 1.85 -0.05 -0.84 0.00 0.00 -0.70 -1.63 119.26 117.89 2wk6 h ALA 328 Ca 0.11 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2wk6 h ALA 328 Cb 0.47 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2wk6 h ALA 328 CO -0.00 -0.15 0.50 0.00 0.00 0.00 0.00 179.25 179.59 2wk6 h ARG 329 N -0.80 1.15 -0.27 0.00 3.08 -0.49 0.13 114.38 117.19 2wk6 h ARG 329 Ca -0.01 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2wk6 h ARG 329 Cb 0.68 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2wk6 h ARG 329 CO 0.01 0.82 0.13 0.28 -1.07 0.00 0.00 179.97 180.14 2wk6 h VAL 330 N 1.16 1.14 -0.81 2.04 2.07 -1.06 -1.30 116.25 119.49 2wk6 h VAL 330 Ca 0.30 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 2wk6 h VAL 330 Cb -0.03 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 2wk6 h VAL 330 CO -0.05 0.15 0.41 0.00 0.02 0.00 0.00 177.57 178.09 2wk6 h ALA 331 N 0.99 1.20 -0.42 1.67 0.00 -0.78 -2.28 119.26 119.65 2wk6 h ALA 331 Ca 0.09 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2wk6 h ALA 331 Cb 0.11 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2wk6 h ALA 331 CO -0.01 0.62 0.26 0.00 0.00 0.00 0.00 179.25 180.13 2wk6 h ALA 332 N 1.31 0.53 -0.20 0.00 0.00 -0.37 -0.99 119.26 119.53 2wk6 h ALA 332 Ca 0.28 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.23 2wk6 h ALA 332 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2wk6 h ALA 332 CO -0.04 -0.05 0.22 0.00 0.00 0.00 0.00 179.25 179.39 2wk6 h ALA 333 N 1.17 1.82 0.00 0.00 0.00 -0.67 2.45 119.26 124.03 2wk6 h ALA 333 Ca 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2wk6 h ALA 333 Cb -0.03 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2wk6 h ALA 333 CO -0.05 -0.32 -0.12 -0.07 0.00 0.00 0.00 179.25 178.68 2wk6 h LEU 334 N 0.00 0.00 0.00 0.00 3.38 -0.89 -0.30 115.31 117.50 2wk6 h LEU 334 Ca 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 2wk6 h LEU 334 Cb 0.54 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2wk6 h LEU 334 CO -0.00 0.12 -0.97 0.47 0.09 0.00 0.00 178.44 178.15 2wk6 n ASP 335 N -3.58 0.61 -4.27 -0.43 8.00 0.71 -3.04 116.55 114.55 2wk6 n ASP 335 Ca -0.02 0.09 -0.33 0.00 0.71 0.00 0.00 54.79 55.25 2wk6 n ASP 335 Cb 0.25 -0.22 -0.16 0.00 -0.02 0.00 0.00 41.12 40.98 2wk6 n ASP 335 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2wk6 s ASP 336 N -5.60 3.55 0.00 -2.24 3.68 0.79 -4.44 116.67 112.42 2wk6 s ASP 336 Ca -0.06 -0.47 0.00 0.00 2.13 0.00 0.00 52.55 54.14 2wk6 s ASP 336 Cb 0.02 -1.53 0.00 0.00 -1.45 0.00 0.00 42.92 39.96 2wk6 s ASP 336 CO 0.08 0.12 0.00 0.61 0.13 0.00 0.00 175.17 176.11 2wk6 n GLY 337 N 3.82 2.57 2.07 2.66 0.00 -1.26 -2.42 105.19 112.64 2wk6 n GLY 337 Ca -0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 2wk6 n GLY 337 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2wk6 n SER 338 N 0.00 -4.20 0.12 1.61 2.88 -1.21 -4.86 113.62 107.95 2wk6 n SER 338 Ca 0.00 0.69 0.05 0.00 -1.33 0.00 0.00 58.87 58.28 2wk6 n SER 338 Cb 0.00 -3.09 0.02 0.00 -0.75 0.00 0.00 64.21 60.39 2wk6 n SER 338 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wk6 h ALA 339 N 1.57 0.70 -0.29 -1.46 0.00 -1.27 -2.66 119.26 115.85 2wk6 h ALA 339 Ca -0.05 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 2wk6 h ALA 339 Cb 0.12 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2wk6 h ALA 339 CO 0.04 0.49 -0.04 1.25 0.00 0.00 0.00 179.25 180.99 2wk6 h LEU 340 N 0.00 0.42 -0.98 0.00 7.12 -1.80 0.20 115.31 120.27 2wk6 h LEU 340 Ca -0.04 -0.08 -0.09 0.00 0.13 0.00 0.00 57.88 57.80 2wk6 h LEU 340 Cb 1.30 -0.11 -0.01 0.00 -0.53 0.00 0.00 40.66 41.31 2wk6 h LEU 340 CO 0.04 0.51 -0.22 1.23 -0.13 0.00 0.00 178.44 179.87 2wk6 h GLY 341 N 0.80 0.51 1.85 3.75 0.00 -1.81 -2.25 103.07 105.93 2wk6 h GLY 341 Ca 0.09 -0.40 -0.19 0.00 0.00 0.00 0.00 47.33 46.82 2wk6 h GLY 341 CO 0.01 0.37 -0.89 -0.09 0.00 0.00 0.00 176.54 175.94 2wk6 h ARG 342 N 0.43 0.13 -0.60 4.80 9.65 -1.01 -3.17 114.38 124.60 2wk6 h ARG 342 Ca 0.07 -0.15 -0.09 0.00 -1.10 0.00 0.00 59.98 58.71 2wk6 h ARG 342 Cb 0.62 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.23 2wk6 h ARG 342 CO 0.04 0.93 0.04 0.35 2.80 0.00 0.00 179.97 184.14 2wk6 h PHE 343 N 0.07 1.12 -0.12 2.20 3.57 -0.37 -2.31 116.94 121.10 2wk6 h PHE 343 Ca -0.04 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.29 2wk6 h PHE 343 Cb 1.53 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.97 2wk6 h PHE 343 CO 0.02 0.98 0.08 1.49 -2.23 0.00 0.00 178.31 178.65 2wk6 h GLU 344 N 0.94 0.16 -0.50 1.11 4.81 -1.43 0.05 114.58 119.72 2wk6 h GLU 344 Ca 0.18 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 2wk6 h GLU 344 Cb 0.51 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 2wk6 h GLU 344 CO 0.02 0.11 0.22 0.00 -0.73 0.00 0.00 179.01 178.63 2wk6 h ARG 345 N 0.16 0.70 0.05 1.92 3.08 -1.51 -0.87 114.38 117.90 2wk6 h ARG 345 Ca 0.04 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2wk6 h ARG 345 Cb -0.02 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.90 2wk6 h ARG 345 CO -0.01 0.56 -0.02 1.98 -1.07 0.00 0.00 179.97 181.41 2wk6 h MET 346 N 0.70 -0.06 -0.28 0.04 4.05 -1.05 0.70 114.93 119.03 2wk6 h MET 346 Ca 0.17 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.65 2wk6 h MET 346 Cb 0.10 0.01 -0.06 0.00 -0.80 0.00 0.00 31.60 30.86 2wk6 h MET 346 CO -0.02 0.36 -0.09 -0.07 0.23 0.00 0.00 176.91 177.32 2wk6 h LEU 347 N -0.49 -0.31 -0.16 3.39 3.38 -0.72 0.42 115.31 120.82 2wk6 h LEU 347 Ca -0.01 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2wk6 h LEU 347 Cb 0.44 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2wk6 h LEU 347 CO 0.01 -0.11 0.08 0.00 0.09 0.00 0.00 178.44 178.51 2wk6 h ALA 348 N 1.24 0.21 0.00 1.53 0.00 -1.17 0.54 119.26 121.61 2wk6 h ALA 348 Ca 0.14 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2wk6 h ALA 348 Cb 0.24 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2wk6 h ALA 348 CO -0.30 -0.24 -0.10 0.00 0.00 0.00 0.00 179.25 178.62 2wk6 h ALA 349 N 0.96 1.35 -0.73 0.00 0.00 -0.38 -2.63 119.26 117.82 2wk6 h ALA 349 Ca 0.06 -0.09 -0.25 0.00 0.00 0.00 0.00 54.91 54.63 2wk6 h ALA 349 Cb 0.11 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.73 2wk6 h ALA 349 CO -0.01 0.12 0.32 1.04 0.00 0.00 0.00 179.25 180.72 2wk6 n GLN 350 N -3.71 3.32 0.00 0.00 6.02 0.14 -4.92 117.38 118.23 2wk6 n GLN 350 Ca -0.02 -2.83 0.00 0.00 -0.01 0.00 0.00 57.00 54.14 2wk6 n GLN 350 Cb 0.20 -2.14 0.00 0.00 1.02 0.00 0.00 30.24 29.32 2wk6 n GLN 350 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wk6 n GLY 351 N -0.26 3.16 3.74 1.08 0.00 -0.99 -0.56 105.19 111.36 2wk6 n GLY 351 Ca 0.41 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.02 2wk6 n GLY 351 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wk6 s VAL 352 N -2.76 3.13 0.06 1.61 1.01 0.14 -4.54 120.40 119.06 2wk6 s VAL 352 Ca 0.00 0.92 -0.36 0.00 0.00 0.00 0.00 61.98 62.55 2wk6 s VAL 352 Cb 0.00 -3.59 -0.15 0.00 0.00 0.00 0.00 36.38 32.64 2wk6 s VAL 352 CO 0.00 0.14 1.53 -0.67 0.00 0.00 0.00 175.10 176.09 2wk6 n ASP 353 N 2.65 2.47 -0.28 3.32 -0.08 -1.26 -4.02 116.55 119.34 2wk6 n ASP 353 Ca 0.06 1.09 0.10 0.00 -1.51 0.00 0.00 54.79 54.53 2wk6 n ASP 353 Cb 0.42 -1.30 0.26 0.00 2.34 0.00 0.00 41.12 42.84 2wk6 n ASP 353 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2wk6 h PRO 354 N 5.83 0.33 -0.23 -0.67 0.11 -1.91 0.13 132.00 135.59 2wk6 h PRO 354 Ca -0.47 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2wk6 h PRO 354 Cb 1.30 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2wk6 h PRO 354 CO 0.86 0.22 0.10 0.78 -0.21 0.00 0.00 178.00 179.74 2wk6 h GLY 355 N 0.34 0.36 1.00 -0.55 0.00 -1.99 -1.33 103.07 100.90 2wk6 h GLY 355 Ca 0.50 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 2wk6 h GLY 355 CO -0.53 0.18 0.32 -2.00 0.00 0.00 0.00 176.54 174.51 2wk6 h LEU 356 N 0.23 0.83 -0.21 3.11 5.85 -1.55 0.13 115.31 123.68 2wk6 h LEU 356 Ca 0.08 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.73 2wk6 h LEU 356 Cb 0.16 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 2wk6 h LEU 356 CO -0.01 0.71 -0.10 0.00 -0.34 0.00 0.00 178.44 178.71 2wk6 h ALA 357 N 1.15 0.09 -0.28 1.25 0.00 -0.50 0.30 119.26 121.27 2wk6 h ALA 357 Ca 0.22 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 2wk6 h ALA 357 Cb 0.09 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2wk6 h ALA 357 CO -0.03 -0.52 -0.17 0.00 0.00 0.00 0.00 179.25 178.53 2wk6 h ARG 358 N -0.07 0.49 0.43 0.00 3.08 -1.00 -2.44 114.38 114.87 2wk6 h ARG 358 Ca 0.11 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2wk6 h ARG 358 Cb 0.24 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 2wk6 h ARG 358 CO -0.26 0.65 -0.25 0.00 -1.07 0.00 0.00 179.97 179.04 2wk6 h ALA 359 N 1.38 -0.64 -0.77 0.04 0.00 0.76 -1.03 119.26 119.00 2wk6 h ALA 359 Ca 0.08 -0.13 0.12 0.00 0.00 0.00 0.00 54.91 54.98 2wk6 h ALA 359 Cb 0.55 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.59 2wk6 h ALA 359 CO 0.04 -0.87 0.51 -0.07 0.00 0.00 0.00 179.25 178.85 2wk6 h LEU 360 N -0.64 0.54 0.39 0.00 3.38 -0.28 0.70 115.31 119.40 2wk6 h LEU 360 Ca -0.05 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2wk6 h LEU 360 Cb 0.52 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2wk6 h LEU 360 CO 0.06 0.30 -0.19 0.00 0.09 0.00 0.00 178.44 178.70 2wk6 h SER 362 N -1.06 0.00 -4.08 0.00 4.64 -1.12 -3.45 113.55 108.48 2wk6 h SER 362 Ca -0.05 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.73 2wk6 h SER 362 Cb 0.40 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 62.61 2wk6 h SER 362 CO 0.09 0.19 0.50 -0.83 -0.87 0.00 0.00 176.83 175.91 2wk6 s GLY 363 N -4.27 2.79 0.62 -0.77 0.00 0.24 -5.03 107.32 100.90 2wk6 s GLY 363 Ca 0.01 1.09 0.00 0.00 0.00 0.00 0.00 44.72 45.81 2wk6 s GLY 363 CO 0.63 1.51 0.86 -1.35 0.00 0.00 0.00 173.10 174.75 2wk6 s SER 364 N -1.45 4.94 0.13 1.64 1.04 -1.26 -4.70 113.70 114.04 2wk6 s SER 364 Ca 0.76 -0.09 -0.26 0.00 0.48 0.00 0.00 55.95 56.85 2wk6 s SER 364 Cb -0.33 -0.61 -0.06 0.00 0.10 0.00 0.00 66.02 65.12 2wk6 s SER 364 CO 0.36 -1.41 1.45 -0.65 0.98 0.00 0.00 173.24 173.97 2wk6 h PRO 365 N -0.17 -0.02 -0.71 4.02 0.11 -1.96 0.92 132.00 134.19 2wk6 h PRO 365 Ca -0.40 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.84 2wk6 h PRO 365 Cb 1.29 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.31 2wk6 h PRO 365 CO 0.49 -0.01 0.24 0.00 -0.21 0.00 0.00 178.00 178.51 2wk6 h ALA 366 N 0.21 0.95 -0.36 -0.75 0.00 -2.00 0.13 119.26 117.44 2wk6 h ALA 366 Ca 0.13 0.12 -0.13 0.00 0.00 0.00 0.00 54.91 55.04 2wk6 h ALA 366 Cb 0.35 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2wk6 h ALA 366 CO -0.76 -0.25 -0.28 0.93 0.00 0.00 0.00 179.25 178.89 2wk6 h GLU 367 N 0.38 0.76 -0.35 0.00 5.08 -1.39 -2.80 114.58 116.26 2wk6 h GLU 367 Ca 0.39 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2wk6 h GLU 367 Cb 0.59 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 2wk6 h GLU 367 CO -0.41 0.95 0.23 -0.09 -1.00 0.00 0.00 179.01 178.69 2wk6 h ARG 368 N 0.65 0.47 -0.31 2.33 9.65 0.28 -2.45 114.38 124.99 2wk6 h ARG 368 Ca 0.08 -0.03 0.02 0.00 -1.10 0.00 0.00 59.98 58.94 2wk6 h ARG 368 Cb 0.81 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.26 2wk6 h ARG 368 CO 0.07 0.32 0.18 0.00 2.80 0.00 0.00 179.97 183.34 2wk6 h ARG 369 N 0.47 0.35 0.00 0.20 -0.00 -0.74 -1.86 114.38 112.80 2wk6 h ARG 369 Ca 0.13 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.98 59.58 2wk6 h ARG 369 Cb -0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 29.97 29.85 2wk6 h ARG 369 CO -0.03 0.23 -0.04 1.96 0.00 0.00 0.00 179.97 182.10 2wk6 h GLN 370 N 0.36 0.00 0.00 0.04 1.08 -1.26 -1.43 115.11 113.90 2wk6 h GLN 370 Ca 0.13 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 2wk6 h GLN 370 Cb 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 2wk6 h GLN 370 CO -0.07 0.04 -0.39 -0.07 -0.95 0.00 0.00 178.83 177.38 2wk6 h LEU 371 N 0.00 0.00 -9.83 1.46 3.38 -0.88 -3.47 115.31 105.98 2wk6 h LEU 371 Ca -0.00 -0.06 -0.53 0.00 0.09 0.00 0.00 57.88 57.38 2wk6 h LEU 371 Cb 0.10 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 2wk6 h LEU 371 CO 0.00 0.03 -0.54 -0.76 0.09 0.00 0.00 178.44 177.27 2wk6 s LEU 372 N -5.07 3.45 0.21 1.67 1.43 -0.54 -4.84 118.68 114.99 2wk6 s LEU 372 Ca 0.06 -0.56 -0.31 0.00 -1.03 0.00 0.00 54.13 52.29 2wk6 s LEU 372 Cb 0.10 -1.98 -0.11 0.00 0.03 0.00 0.00 46.19 44.23 2wk6 s LEU 372 CO 0.69 -0.19 1.62 -2.84 0.23 0.00 0.00 176.35 175.87 2wk6 s PRO 373 N -3.84 4.17 0.02 1.29 0.02 -1.26 -4.91 135.00 130.49 2wk6 s PRO 373 Ca 0.36 2.49 0.06 0.00 0.02 0.00 0.00 61.00 63.92 2wk6 s PRO 373 Cb -0.05 -3.10 -0.03 0.00 0.02 0.00 0.00 34.50 31.34 2wk6 s PRO 373 CO 0.23 -0.65 -0.15 1.03 -0.33 0.00 0.00 177.00 177.13 2wk6 s ARG 374 N 0.78 2.23 0.79 5.54 0.52 -1.26 -4.44 118.95 123.10 2wk6 s ARG 374 Ca 0.70 -0.89 -0.14 0.00 -0.52 0.00 0.00 55.73 54.88 2wk6 s ARG 374 Cb -0.47 -2.28 0.07 0.00 0.52 0.00 0.00 34.95 32.80 2wk6 s ARG 374 CO 0.35 0.56 1.20 0.00 0.02 0.00 0.00 175.30 177.43 2wk6 s ALA 375 N -0.92 1.92 0.06 2.13 0.00 -1.23 -4.81 121.76 118.92 2wk6 s ALA 375 Ca 0.15 0.82 -0.25 0.00 0.00 0.00 0.00 51.96 52.68 2wk6 s ALA 375 Cb -0.11 -3.47 -0.16 0.00 0.00 0.00 0.00 23.12 19.38 2wk6 s ALA 375 CO 0.05 -2.16 1.62 -0.09 0.00 0.00 0.00 175.76 175.18 2wk6 h ARG 376 N -0.77 -0.13 -5.10 0.00 2.43 -1.75 -3.46 114.38 105.61 2wk6 h ARG 376 Ca -0.46 0.01 -0.66 0.00 -0.81 0.00 0.00 59.98 58.05 2wk6 h ARG 376 Cb 1.29 0.03 -0.13 0.00 -0.42 0.00 0.00 29.97 30.74 2wk6 h ARG 376 CO 0.47 0.01 -0.50 -2.00 -1.51 0.00 0.00 179.97 176.44 2wk6 s GLU 377 N -5.76 2.17 -0.03 0.20 2.56 -0.68 -5.03 118.70 112.13 2wk6 s GLU 377 Ca -0.14 -2.40 -0.01 0.00 0.00 0.00 0.00 54.97 52.43 2wk6 s GLU 377 Cb 0.05 -1.26 0.03 0.00 2.00 0.00 0.00 34.13 34.94 2wk6 s GLU 377 CO 0.65 -0.44 0.04 -0.65 -0.56 0.00 0.00 175.26 174.29 2wk6 s GLN 378 N -3.84 -0.01 -0.08 4.30 1.11 -1.26 -3.12 119.66 116.77 2wk6 s GLN 378 Ca 0.06 0.25 0.04 0.00 0.01 0.00 0.00 55.36 55.72 2wk6 s GLN 378 Cb 0.01 -0.38 -0.00 0.00 -1.01 0.00 0.00 33.01 31.62 2wk6 s GLN 378 CO 0.04 -0.23 -0.22 -2.00 0.01 0.00 0.00 175.29 172.90 2wk6 s GLU 379 N 1.50 2.62 0.05 2.91 2.12 0.16 -4.96 118.70 123.10 2wk6 s GLU 379 Ca -0.04 -0.79 0.05 0.00 0.36 0.00 0.00 54.97 54.55 2wk6 s GLU 379 Cb -0.13 -2.07 -0.04 0.00 0.26 0.00 0.00 34.13 32.16 2wk6 s GLU 379 CO -0.03 0.21 -0.08 -1.21 -0.54 0.00 0.00 175.26 173.61 2wk6 s GLU 380 N 0.25 2.38 -0.02 4.30 2.02 -1.26 0.95 118.70 127.31 2wk6 s GLU 380 Ca -0.14 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.00 2wk6 s GLU 380 Cb -0.16 -2.42 -0.04 0.00 0.10 0.00 0.00 34.13 31.61 2wk6 s GLU 380 CO 0.06 0.56 0.02 -0.51 0.02 0.00 0.00 175.26 175.41 2wk6 s LEU 381 N -1.79 3.61 -0.08 1.80 1.43 0.34 -4.99 118.68 119.01 2wk6 s LEU 381 Ca 0.19 0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.34 2wk6 s LEU 381 Cb -0.11 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2wk6 s LEU 381 CO 0.11 0.30 -0.03 -0.76 0.23 0.00 0.00 176.35 176.20 2wk6 s LEU 382 N -1.45 3.39 -0.35 1.79 1.43 -1.26 -0.35 118.68 121.88 2wk6 s LEU 382 Ca 0.19 0.06 -0.41 0.00 -1.03 0.00 0.00 54.13 52.94 2wk6 s LEU 382 Cb -0.12 -1.76 -0.16 0.00 0.03 0.00 0.00 46.19 44.18 2wk6 s LEU 382 CO 0.09 0.36 1.85 0.00 0.23 0.00 0.00 176.35 178.88 2wk6 n ALA 383 N 2.28 -0.07 0.21 4.21 0.00 0.23 -4.74 120.51 122.64 2wk6 n ALA 383 Ca -0.18 0.30 0.04 0.00 0.00 0.00 0.00 53.44 53.60 2wk6 n ALA 383 Cb 0.53 -2.23 0.17 0.00 0.00 0.00 0.00 19.45 17.93 2wk6 n ALA 383 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2wk6 n PRO 384 N 5.96 0.02 -3.61 0.00 -0.04 -1.26 -2.25 135.00 133.82 2wk6 n PRO 384 Ca 0.33 0.41 0.02 0.00 -0.04 0.00 0.00 63.50 64.23 2wk6 n PRO 384 Cb 0.10 -1.55 -0.00 0.00 -0.04 0.00 0.00 33.50 32.01 2wk6 n PRO 384 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wk6 s ALA 385 N -3.05 -2.32 0.81 0.55 0.00 -1.26 -4.87 121.76 111.62 2wk6 s ALA 385 Ca 0.03 0.76 -0.11 0.00 0.00 0.00 0.00 51.96 52.64 2wk6 s ALA 385 Cb 0.04 0.33 0.08 0.00 0.00 0.00 0.00 23.12 23.57 2wk6 s ALA 385 CO 0.13 -1.06 1.09 -0.51 0.00 0.00 0.00 175.76 175.41 2wk6 s ASP 386 N -3.00 4.17 0.00 0.00 1.01 -1.26 -3.77 116.67 113.82 2wk6 s ASP 386 Ca 0.15 1.70 0.00 0.00 0.71 0.00 0.00 52.55 55.10 2wk6 s ASP 386 Cb 0.06 -2.39 0.00 0.00 1.01 0.00 0.00 42.92 41.59 2wk6 s ASP 386 CO -0.05 -2.23 0.00 0.61 0.21 0.00 0.00 175.17 173.72 2wk6 n GLY 387 N -1.21 1.63 3.72 0.21 0.00 -0.01 -4.92 105.19 104.61 2wk6 n GLY 387 Ca 0.08 -1.83 -0.35 0.00 0.00 0.00 0.00 46.02 43.93 2wk6 n GLY 387 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wk6 s THR 388 N -1.39 5.21 -0.62 2.61 2.01 -0.14 0.29 115.64 123.61 2wk6 s THR 388 Ca 0.00 0.11 -0.27 0.00 0.31 0.00 0.00 61.69 61.85 2wk6 s THR 388 Cb 0.00 -3.35 -0.01 0.00 0.01 0.00 0.00 72.50 69.15 2wk6 s THR 388 CO 0.00 0.48 1.77 -0.69 -0.69 0.00 0.00 174.62 175.49 2wk6 s VAL 389 N 0.11 3.42 -0.04 3.82 1.01 0.29 0.49 120.40 129.50 2wk6 s VAL 389 Ca 0.08 0.25 0.12 0.00 0.00 0.00 0.00 61.98 62.42 2wk6 s VAL 389 Cb -0.12 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.13 2wk6 s VAL 389 CO -0.00 -1.03 1.35 -0.08 0.00 0.00 0.00 175.10 175.33 2wk6 h GLU 390 N 14.17 0.00 -1.23 2.72 4.57 -0.97 0.45 114.58 134.30 2wk6 h GLU 390 Ca -0.26 0.00 0.23 0.00 -1.18 0.00 0.00 59.36 58.15 2wk6 h GLU 390 Cb 1.15 0.00 -0.24 0.00 -0.16 0.00 0.00 28.75 29.50 2wk6 h GLU 390 CO 1.22 0.71 0.87 -1.17 -1.18 0.00 0.00 179.01 179.45 2wk6 s LEU 391 N -6.54 -0.11 -0.44 1.64 2.96 -1.15 -4.82 118.68 110.22 2wk6 s LEU 391 Ca 0.02 0.08 0.03 0.00 -0.22 0.00 0.00 54.13 54.05 2wk6 s LEU 391 Cb 0.09 1.26 0.12 0.00 0.50 0.00 0.00 46.19 48.16 2wk6 s LEU 391 CO 0.78 -0.12 0.18 -0.69 -1.32 0.00 0.00 176.35 175.17 2wk6 s VAL 392 N -1.48 2.54 -0.18 1.68 1.01 -1.26 -1.31 120.40 121.40 2wk6 s VAL 392 Ca 0.08 -2.84 -0.32 0.00 0.00 0.00 0.00 61.98 58.90 2wk6 s VAL 392 Cb -0.01 -2.80 -0.09 0.00 0.00 0.00 0.00 36.38 33.48 2wk6 s VAL 392 CO -0.05 -0.71 2.09 0.54 0.00 0.00 0.00 175.10 176.97 2wk6 n ARG 393 N 3.67 1.92 -0.05 2.72 1.74 0.24 -4.00 116.66 122.91 2wk6 n ARG 393 Ca 0.04 0.61 -0.11 0.00 -0.77 0.00 0.00 57.85 57.63 2wk6 n ARG 393 Cb 0.37 -2.87 -0.04 0.00 -1.02 0.00 0.00 32.46 28.90 2wk6 n ARG 393 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wk6 h ALA 394 N 12.31 0.24 -0.02 7.54 0.00 -1.38 -3.23 119.26 134.72 2wk6 h ALA 394 Ca -0.41 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.46 2wk6 h ALA 394 Cb 1.27 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2wk6 h ALA 394 CO 0.97 -0.21 -0.37 1.25 0.00 0.00 0.00 179.25 180.89 2wk6 h LEU 395 N 0.18 -1.12 -1.38 0.00 5.85 -1.80 0.50 115.31 117.52 2wk6 h LEU 395 Ca 0.06 0.14 0.16 0.00 0.84 0.00 0.00 57.88 59.08 2wk6 h LEU 395 Cb 0.11 0.45 -0.07 0.00 0.37 0.00 0.00 40.66 41.52 2wk6 h LEU 395 CO -0.01 -0.42 0.56 -0.65 -0.34 0.00 0.00 178.44 177.59 2wk6 h PRO 396 N -0.51 0.56 0.02 5.25 0.11 -1.91 0.45 132.00 135.97 2wk6 h PRO 396 Ca 0.06 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.13 2wk6 h PRO 396 Cb 0.61 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.59 2wk6 h PRO 396 CO -0.31 0.37 -0.01 -0.07 -0.21 0.00 0.00 178.00 177.78 2wk6 h LEU 397 N 0.58 -0.02 0.22 2.35 3.38 -1.21 -2.28 115.31 118.34 2wk6 h LEU 397 Ca 0.44 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 2wk6 h LEU 397 Cb 0.83 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2wk6 h LEU 397 CO -0.19 0.15 -0.11 0.00 0.09 0.00 0.00 178.44 178.39 2wk6 h ALA 398 N 0.78 -0.30 -0.51 1.53 0.00 0.18 -0.75 119.26 120.18 2wk6 h ALA 398 Ca -0.00 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 54.94 2wk6 h ALA 398 Cb 0.19 0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.99 2wk6 h ALA 398 CO 0.00 -0.66 -0.26 -0.07 0.00 0.00 0.00 179.25 178.26 2wk6 h LEU 399 N -0.31 -0.90 -0.09 0.00 3.38 -0.93 0.65 115.31 117.10 2wk6 h LEU 399 Ca -0.03 0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2wk6 h LEU 399 Cb 0.24 0.47 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2wk6 h LEU 399 CO 0.05 -0.27 -0.01 0.58 0.09 0.00 0.00 178.44 178.87 2wk6 h VAL 400 N -0.14 1.28 -0.91 1.22 2.07 -1.27 -2.21 116.25 116.29 2wk6 h VAL 400 Ca 0.23 -0.90 0.10 0.00 0.82 0.00 0.00 66.70 66.95 2wk6 h VAL 400 Cb 0.51 1.70 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 2wk6 h VAL 400 CO -0.60 0.25 0.58 -0.07 0.02 0.00 0.00 177.57 177.76 2wk6 h LEU 401 N -0.15 0.80 -0.19 2.57 -0.00 -0.68 -1.20 115.31 116.47 2wk6 h LEU 401 Ca 0.02 0.03 0.05 0.00 -0.00 0.00 0.00 57.88 57.98 2wk6 h LEU 401 Cb 0.40 -0.14 -0.05 0.00 -0.00 0.00 0.00 40.66 40.87 2wk6 h LEU 401 CO 0.01 0.46 -0.13 -0.74 -0.00 0.00 0.00 178.44 178.04 2wk6 h HIS 402 N 0.88 -0.33 0.00 1.13 2.76 0.62 -1.55 115.15 118.67 2wk6 h HIS 402 Ca 0.43 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.62 2wk6 h HIS 402 Cb 0.45 0.18 0.00 0.00 1.55 0.00 0.00 27.41 29.58 2wk6 h HIS 402 CO -0.00 -0.20 0.00 -0.85 -1.30 0.00 0.00 177.93 175.58 2wk6 n GLU 403 N -5.29 0.53 -0.17 5.26 0.28 -0.50 -2.12 120.64 118.63 2wk6 n GLU 403 Ca -0.02 0.03 0.10 0.00 -0.16 0.00 0.00 57.16 57.12 2wk6 n GLU 403 Cb 0.21 -1.50 0.28 0.00 1.43 0.00 0.00 31.44 31.85 2wk6 n GLU 403 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2wk6 n LEU 404 N -1.18 2.59 0.00 -1.84 4.77 -0.65 -4.88 117.00 115.80 2wk6 n LEU 404 Ca 0.15 -1.16 0.00 0.00 -0.03 0.00 0.00 56.01 54.96 2wk6 n LEU 404 Cb 0.16 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 2wk6 n LEU 404 CO 0.17 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 2wk6 n GLY 405 N 1.31 1.06 0.03 -0.72 0.00 -0.90 -4.68 105.19 101.28 2wk6 n GLY 405 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 2wk6 n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk6 n ALA 406 N -1.11 3.24 -2.34 4.61 0.00 -0.78 -0.45 120.51 123.68 2wk6 n ALA 406 Ca 0.00 -0.30 -0.17 0.00 0.00 0.00 0.00 53.44 52.97 2wk6 n ALA 406 Cb 0.00 -1.15 -0.10 0.00 0.00 0.00 0.00 19.45 18.20 2wk6 n ALA 406 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wk6 s GLY 407 N -3.29 1.25 0.30 0.00 0.00 -0.97 -4.82 107.32 99.78 2wk6 s GLY 407 Ca 0.09 -1.54 -0.09 0.00 0.00 0.00 0.00 44.72 43.19 2wk6 s GLY 407 CO 0.71 -1.63 0.61 0.50 0.00 0.00 0.00 173.10 173.29 2wk6 s ARG 408 N -3.49 3.75 0.00 2.90 0.52 -1.26 -4.87 118.95 116.50 2wk6 s ARG 408 Ca 0.18 0.26 0.00 0.00 -0.52 0.00 0.00 55.73 55.65 2wk6 s ARG 408 Cb -0.00 -2.57 0.00 0.00 0.52 0.00 0.00 34.95 32.89 2wk6 s ARG 408 CO 0.04 0.19 0.07 0.45 0.02 0.00 0.00 175.30 176.07 2wk6 n SER 409 N -0.69 0.15 0.00 0.23 2.88 -1.26 -4.90 113.62 110.02 2wk6 n SER 409 Ca 0.00 -0.47 0.00 0.00 -1.33 0.00 0.00 58.87 57.07 2wk6 n SER 409 Cb 0.53 0.47 0.00 0.00 -0.75 0.00 0.00 64.21 64.46 2wk6 n SER 409 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2wk6 n ARG 410 N -0.47 0.29 0.00 -1.46 1.74 -1.26 -4.94 116.66 110.57 2wk6 n ARG 410 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2wk6 n ARG 410 Cb 0.02 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.46 2wk6 n ARG 410 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wk6 n ALA 411 N -3.00 0.00 0.66 7.54 0.00 -1.26 -4.45 120.51 120.00 2wk6 n ALA 411 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 2wk6 n ALA 411 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.59 2wk6 n ALA 411 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wk6 n GLY 412 N 2.63 1.28 3.70 0.00 0.00 -1.26 -4.95 105.19 106.58 2wk6 n GLY 412 Ca 0.00 -0.32 -0.67 0.00 0.00 0.00 0.00 46.02 45.03 2wk6 n GLY 412 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wk6 n GLU 413 N 0.26 0.03 -1.97 1.61 2.13 -1.26 -4.81 120.64 116.63 2wk6 n GLU 413 Ca 0.10 0.01 -0.38 0.00 0.66 0.00 0.00 57.16 57.56 2wk6 n GLU 413 Cb 0.44 -1.52 0.02 0.00 0.27 0.00 0.00 31.44 30.66 2wk6 n GLU 413 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2wk6 s PRO 414 N 3.34 3.29 0.20 5.31 0.02 -1.26 -4.82 135.00 141.08 2wk6 s PRO 414 Ca 1.06 2.02 0.05 0.00 0.02 0.00 0.00 61.00 64.15 2wk6 s PRO 414 Cb -1.49 -2.24 -0.03 0.00 0.02 0.00 0.00 34.50 30.76 2wk6 s PRO 414 CO 0.80 -1.00 0.26 -0.51 -0.33 0.00 0.00 177.00 176.22 2wk6 s LEU 415 N -3.48 4.14 -1.01 -5.54 1.43 -1.26 -4.99 118.68 107.97 2wk6 s LEU 415 Ca 0.70 0.01 -0.14 0.00 -1.03 0.00 0.00 54.13 53.68 2wk6 s LEU 415 Cb -0.35 -2.70 0.21 0.00 0.03 0.00 0.00 46.19 43.38 2wk6 s LEU 415 CO 0.41 0.00 1.07 -0.13 0.23 0.00 0.00 176.35 177.94 2wk6 s ARG 416 N -3.54 3.87 0.50 1.70 0.52 0.40 -4.90 118.95 117.50 2wk6 s ARG 416 Ca 0.33 -2.55 0.23 0.00 -0.52 0.00 0.00 55.73 53.23 2wk6 s ARG 416 Cb -0.10 -4.70 1.25 0.00 0.52 0.00 0.00 34.95 31.93 2wk6 s ARG 416 CO 0.27 -1.48 1.66 -0.07 0.02 0.00 0.00 175.30 175.71 2wk6 h LEU 417 N 8.42 0.00 0.00 2.53 3.38 -1.96 0.06 115.31 127.74 2wk6 h LEU 417 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2wk6 h LEU 417 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2wk6 h LEU 417 CO 1.00 0.00 -0.76 0.61 0.09 0.00 0.00 178.44 179.38 2wk6 n GLY 418 N -1.25 -1.30 3.76 0.83 0.00 -1.26 -1.22 105.19 104.75 2wk6 n GLY 418 Ca -0.02 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 2wk6 n GLY 418 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wk6 s VAL 419 N -3.15 3.01 -1.83 1.61 1.01 0.01 -3.49 120.40 117.57 2wk6 s VAL 419 Ca 0.06 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2wk6 s VAL 419 Cb 0.15 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.91 2wk6 s VAL 419 CO 0.75 0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.67 2wk6 n GLY 420 N 1.32 -0.55 3.22 4.51 0.00 -0.02 -3.98 105.19 109.69 2wk6 n GLY 420 Ca 0.01 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 2wk6 n GLY 420 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk6 s ALA 421 N -1.00 -0.72 -0.19 4.61 0.00 0.26 -0.53 121.76 124.19 2wk6 s ALA 421 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.22 2wk6 s ALA 421 Cb 0.00 0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.23 2wk6 s ALA 421 CO 0.00 -0.26 -0.17 -1.21 0.00 0.00 0.00 175.76 174.12 2wk6 s GLU 422 N -1.37 3.02 -0.57 0.00 2.02 0.13 -0.40 118.70 121.53 2wk6 s GLU 422 Ca -0.14 -0.82 -0.28 0.00 0.02 0.00 0.00 54.97 53.76 2wk6 s GLU 422 Cb -0.05 -2.65 0.01 0.00 0.10 0.00 0.00 34.13 31.54 2wk6 s GLU 422 CO 0.04 -0.22 1.46 -0.51 0.02 0.00 0.00 175.26 176.04 2wk6 s LEU 423 N 1.31 3.38 0.00 1.80 1.43 0.33 -0.51 118.68 126.43 2wk6 s LEU 423 Ca 0.05 0.29 0.04 0.00 -1.03 0.00 0.00 54.13 53.47 2wk6 s LEU 423 Cb -0.13 -3.00 0.16 0.00 0.03 0.00 0.00 46.19 43.25 2wk6 s LEU 423 CO -0.11 -1.77 1.12 0.18 0.23 0.00 0.00 176.35 175.99 2wk6 n LEU 424 N 9.86 0.43 -3.87 1.79 4.77 0.11 -4.78 117.00 125.31 2wk6 n LEU 424 Ca 0.13 -0.21 -0.11 0.00 -0.03 0.00 0.00 56.01 55.79 2wk6 n LEU 424 Cb 0.49 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.44 2wk6 n LEU 424 CO 0.71 0.11 -0.15 -0.69 -1.33 0.00 0.00 177.39 176.03 2wk6 s VAL 425 N -1.90 0.09 0.23 4.08 1.01 -1.16 -4.79 120.40 117.97 2wk6 s VAL 425 Ca 0.08 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.39 2wk6 s VAL 425 Cb 0.04 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 2wk6 s VAL 425 CO 0.05 -0.41 0.13 -1.81 0.00 0.00 0.00 175.10 173.07 2wk6 s ASP 426 N -1.53 5.28 0.27 3.32 1.01 -1.26 -5.07 116.67 118.69 2wk6 s ASP 426 Ca -0.13 -0.31 -0.30 0.00 0.71 0.00 0.00 52.55 52.52 2wk6 s ASP 426 Cb -0.06 -1.28 -0.09 0.00 1.01 0.00 0.00 42.92 42.50 2wk6 s ASP 426 CO 0.01 -0.00 1.08 -0.69 0.21 0.00 0.00 175.17 175.78 2wk6 s VAL 427 N -2.07 3.58 0.00 -1.27 1.01 -1.26 -3.45 120.40 116.94 2wk6 s VAL 427 Ca 0.32 1.58 0.00 0.00 0.00 0.00 0.00 61.98 63.87 2wk6 s VAL 427 Cb -0.08 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.30 2wk6 s VAL 427 CO 0.23 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.31 2wk6 n GLY 428 N 1.30 2.59 3.91 4.51 0.00 0.16 -4.06 105.19 113.59 2wk6 n GLY 428 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 2wk6 n GLY 428 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2wk6 s GLN 429 N -0.33 3.56 0.38 1.61 -2.07 -1.22 -0.98 119.66 120.61 2wk6 s GLN 429 Ca 0.00 0.18 0.07 0.00 -1.82 0.00 0.00 55.36 53.80 2wk6 s GLN 429 Cb 0.00 -2.40 -0.00 0.00 -1.09 0.00 0.00 33.01 29.52 2wk6 s GLN 429 CO 0.00 -0.15 0.51 0.50 -1.32 0.00 0.00 175.29 174.82 2wk6 s ARG 430 N -4.60 2.96 0.14 9.60 3.52 -1.26 0.11 118.95 129.41 2wk6 s ARG 430 Ca 0.47 -1.14 -0.25 0.00 -0.13 0.00 0.00 55.73 54.68 2wk6 s ARG 430 Cb -0.10 -2.77 0.07 0.00 -1.56 0.00 0.00 34.95 30.58 2wk6 s ARG 430 CO 0.43 -0.10 0.80 -0.48 -0.81 0.00 0.00 175.30 175.14 2wk6 s LEU 431 N -4.25 -0.35 0.02 -0.88 2.34 0.14 -4.88 118.68 110.83 2wk6 s LEU 431 Ca 0.50 -0.23 0.06 0.00 0.06 0.00 0.00 54.13 54.52 2wk6 s LEU 431 Cb -0.09 2.35 -0.03 0.00 -0.56 0.00 0.00 46.19 47.85 2wk6 s LEU 431 CO 0.32 -0.93 -0.17 0.00 -1.06 0.00 0.00 176.35 174.50 2wk6 s ARG 432 N -3.49 2.19 -0.41 1.48 1.70 -1.26 -0.83 118.95 118.34 2wk6 s ARG 432 Ca 0.07 -0.90 -0.36 0.00 -0.47 0.00 0.00 55.73 54.07 2wk6 s ARG 432 Cb -0.02 -2.23 -0.13 0.00 -0.57 0.00 0.00 34.95 32.00 2wk6 s ARG 432 CO -0.04 0.56 2.22 2.89 -1.08 0.00 0.00 175.30 179.86 2wk6 n ARG 433 N 1.78 0.88 0.00 3.89 -4.01 -1.25 -1.38 116.66 116.57 2wk6 n ARG 433 Ca -0.16 0.22 0.00 0.00 -1.04 0.00 0.00 57.85 56.87 2wk6 n ARG 433 Cb 0.52 -2.33 0.00 0.00 -3.04 0.00 0.00 32.46 27.61 2wk6 n ARG 433 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2wk6 n GLY 434 N 6.65 1.29 3.65 2.89 0.00 -0.95 -4.94 105.19 113.77 2wk6 n GLY 434 Ca 0.44 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.03 2wk6 n GLY 434 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wk6 s THR 435 N -0.46 4.00 0.11 2.61 -1.32 -0.48 -4.57 115.64 115.53 2wk6 s THR 435 Ca 0.00 1.18 -0.31 0.00 -1.21 0.00 0.00 61.69 61.35 2wk6 s THR 435 Cb 0.00 -3.86 -0.10 0.00 -1.51 0.00 0.00 72.50 67.03 2wk6 s THR 435 CO 0.00 -0.21 1.87 -0.81 -2.21 0.00 0.00 174.62 173.26 2wk6 n PRO 436 N 7.05 2.83 -0.01 7.08 -0.04 -1.26 -0.60 135.00 150.05 2wk6 n PRO 436 Ca 0.16 1.03 0.08 0.00 -0.04 0.00 0.00 63.50 64.73 2wk6 n PRO 436 Cb 0.45 -2.94 -0.13 0.00 -0.04 0.00 0.00 33.50 30.84 2wk6 n PRO 436 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2wk6 n TRP 437 N 6.02 0.00 -3.77 0.54 4.27 0.53 -4.72 117.44 120.31 2wk6 n TRP 437 Ca 0.18 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.66 2wk6 n TRP 437 Cb 0.38 -0.36 -0.14 0.00 -1.36 0.00 0.00 31.31 29.84 2wk6 n TRP 437 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 2wk6 s LEU 438 N -4.08 0.97 -0.32 5.67 2.96 -1.21 -0.71 118.68 121.96 2wk6 s LEU 438 Ca -0.05 0.31 -0.07 0.00 -0.22 0.00 0.00 54.13 54.10 2wk6 s LEU 438 Cb 0.11 0.43 0.03 0.00 0.50 0.00 0.00 46.19 47.25 2wk6 s LEU 438 CO 0.69 -0.11 0.10 -0.60 -1.32 0.00 0.00 176.35 175.10 2wk6 s ARG 439 N 0.78 2.79 -0.20 1.98 3.52 0.33 -0.50 118.95 127.65 2wk6 s ARG 439 Ca -0.06 -1.07 -0.15 0.00 -0.13 0.00 0.00 55.73 54.32 2wk6 s ARG 439 Cb -0.08 -3.43 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 2wk6 s ARG 439 CO -0.04 -0.59 0.37 0.08 -0.81 0.00 0.00 175.30 174.31 2wk6 s VAL 440 N 1.44 5.22 -0.42 7.11 1.01 0.27 0.19 120.40 135.21 2wk6 s VAL 440 Ca -0.00 0.65 -0.14 0.00 0.00 0.00 0.00 61.98 62.48 2wk6 s VAL 440 Cb -0.19 -3.70 0.04 0.00 0.00 0.00 0.00 36.38 32.53 2wk6 s VAL 440 CO 0.03 0.27 0.31 -1.00 0.00 0.00 0.00 175.10 174.71 2wk6 s HIS 441 N 1.20 3.25 0.30 5.22 3.76 0.31 -0.66 115.29 128.67 2wk6 s HIS 441 Ca 0.18 -0.77 0.07 0.00 -0.15 0.00 0.00 55.06 54.39 2wk6 s HIS 441 Cb -0.14 -2.74 -0.06 0.00 1.11 0.00 0.00 32.58 30.74 2wk6 s HIS 441 CO 0.07 -0.67 -0.07 -0.98 -0.85 0.00 0.00 174.74 172.25 2wk6 s ARG 442 N 1.64 1.64 -0.04 1.40 1.70 -1.18 -0.84 118.95 123.27 2wk6 s ARG 442 Ca 0.04 -1.84 0.05 0.00 -0.47 0.00 0.00 55.73 53.52 2wk6 s ARG 442 Cb -0.21 -1.33 -0.08 0.00 -0.57 0.00 0.00 34.95 32.77 2wk6 s ARG 442 CO 0.08 0.07 0.06 -0.25 -1.08 0.00 0.00 175.30 174.18 2wk6 n ASP 443 N -0.65 3.63 -0.64 -2.89 8.00 -1.26 -1.68 116.55 121.06 2wk6 n ASP 443 Ca -0.05 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.45 2wk6 n ASP 443 Cb 0.63 0.89 0.00 0.00 -0.02 0.00 0.00 41.12 42.62 2wk6 n ASP 443 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wk6 n GLY 444 N 2.46 1.53 3.58 0.44 0.00 -1.26 -4.73 105.19 107.21 2wk6 n GLY 444 Ca -0.06 -1.68 -0.29 0.00 0.00 0.00 0.00 46.02 43.99 2wk6 n GLY 444 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wk6 s PRO 445 N 2.78 -0.04 0.99 1.61 0.02 -1.26 -4.93 135.00 134.17 2wk6 s PRO 445 Ca 0.00 1.02 -0.11 0.00 0.02 0.00 0.00 61.00 61.93 2wk6 s PRO 445 Cb 0.00 -1.64 0.19 0.00 0.02 0.00 0.00 34.50 33.06 2wk6 s PRO 445 CO 0.00 -3.18 1.09 0.00 -0.33 0.00 0.00 177.00 174.57 2wk6 s ALA 446 N -2.60 0.84 0.56 -1.55 0.00 -1.26 -4.91 121.76 112.84 2wk6 s ALA 446 Ca 0.67 0.16 -0.20 0.00 0.00 0.00 0.00 51.96 52.59 2wk6 s ALA 446 Cb -0.23 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.53 2wk6 s ALA 446 CO 0.61 -3.00 1.14 1.28 0.00 0.00 0.00 175.76 175.79 2wk6 n LEU 447 N -4.36 4.38 -5.00 0.00 4.77 -1.26 -5.00 117.00 110.53 2wk6 n LEU 447 Ca 0.07 0.90 -0.21 0.00 -0.03 0.00 0.00 56.01 56.75 2wk6 n LEU 447 Cb 0.54 -1.47 0.07 0.00 -2.33 0.00 0.00 43.42 40.23 2wk6 n LEU 447 CO 0.54 -1.27 0.40 -0.94 -1.33 0.00 0.00 177.39 174.79 2wk6 s SER 448 N -1.06 4.92 0.02 -1.43 1.04 -1.26 -4.85 113.70 111.08 2wk6 s SER 448 Ca 0.73 -0.45 -0.09 0.00 0.48 0.00 0.00 55.95 56.62 2wk6 s SER 448 Cb -0.43 -0.17 -0.04 0.00 0.10 0.00 0.00 66.02 65.47 2wk6 s SER 448 CO 0.49 -1.42 1.14 1.23 0.98 0.00 0.00 173.24 175.65 2wk6 h GLY 449 N -0.05 -0.78 1.14 7.32 0.00 -1.99 0.32 103.07 109.04 2wk6 h GLY 449 Ca -0.36 0.34 0.08 0.00 0.00 0.00 0.00 47.33 47.39 2wk6 h GLY 449 CO 0.43 -0.27 0.35 -0.56 0.00 0.00 0.00 176.54 176.49 2wk6 h PRO 450 N -0.26 0.00 -0.06 4.80 0.13 -1.99 -0.25 132.00 134.37 2wk6 h PRO 450 Ca -0.02 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.97 2wk6 h PRO 450 Cb 0.22 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.36 2wk6 h PRO 450 CO -0.01 0.00 -0.52 1.96 -0.23 0.00 0.00 178.00 179.20 2wk6 h GLN 451 N 0.00 0.46 -0.46 0.86 4.20 -1.72 -2.32 115.11 116.13 2wk6 h GLN 451 Ca 0.13 -0.41 -0.07 0.00 0.06 0.00 0.00 58.65 58.36 2wk6 h GLN 451 Cb 0.84 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.70 2wk6 h GLN 451 CO -0.00 1.05 0.02 0.77 -0.67 0.00 0.00 178.83 180.00 2wk6 h SER 452 N 0.01 0.77 -0.43 1.46 0.02 0.11 -2.30 113.55 113.20 2wk6 h SER 452 Ca -0.05 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2wk6 h SER 452 Cb 1.19 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.50 2wk6 h SER 452 CO 0.11 0.88 0.26 0.03 -1.14 0.00 0.00 176.83 176.96 2wk6 h ARG 453 N 0.64 0.58 -0.83 3.45 3.08 -1.19 -0.39 114.38 119.73 2wk6 h ARG 453 Ca 0.13 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.15 2wk6 h ARG 453 Cb 0.47 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.35 2wk6 h ARG 453 CO 0.02 0.43 0.54 0.00 -1.07 0.00 0.00 179.97 179.89 2wk6 h ALA 454 N 1.12 1.07 -0.15 0.04 0.00 -1.26 -0.62 119.26 119.47 2wk6 h ALA 454 Ca 0.15 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.80 2wk6 h ALA 454 Cb -0.00 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.48 2wk6 h ALA 454 CO -0.03 0.41 -0.76 -0.07 0.00 0.00 0.00 179.25 178.81 2wk6 h LEU 455 N 1.08 0.85 0.19 0.00 3.38 -1.16 -3.05 115.31 116.60 2wk6 h LEU 455 Ca 0.32 -0.55 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 2wk6 h LEU 455 Cb -0.06 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.44 2wk6 h LEU 455 CO -0.09 1.34 -0.09 1.56 0.09 0.00 0.00 178.44 181.25 2wk6 h GLN 456 N 0.49 -0.24 0.00 1.13 1.08 -0.78 -0.50 115.11 116.29 2wk6 h GLN 456 Ca -0.04 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2wk6 h GLN 456 Cb 1.37 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.86 2wk6 h GLN 456 CO 0.15 -0.16 0.04 0.39 -0.95 0.00 0.00 178.83 178.30 2wk6 n GLU 457 N -5.20 0.00 0.06 1.46 4.71 -0.26 -0.01 120.64 121.40 2wk6 n GLU 457 Ca -0.09 0.34 -0.04 0.00 -0.01 0.00 0.00 57.16 57.36 2wk6 n GLU 457 Cb 0.13 -1.54 -0.08 0.00 -1.01 0.00 0.00 31.44 28.93 2wk6 n GLU 457 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2wk6 h ALA 458 N 1.79 0.53 -2.24 0.62 0.00 -0.97 -3.43 119.26 115.56 2wk6 h ALA 458 Ca 0.00 -0.88 -0.60 0.00 0.00 0.00 0.00 54.91 53.43 2wk6 h ALA 458 Cb 0.08 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.79 2wk6 h ALA 458 CO 0.00 1.11 0.45 -1.17 0.00 0.00 0.00 179.25 179.64 2wk6 s LEU 459 N -6.44 4.07 -0.31 0.00 1.98 0.98 -0.59 118.68 118.37 2wk6 s LEU 459 Ca 0.00 0.81 -0.08 0.00 -2.89 0.00 0.00 54.13 51.98 2wk6 s LEU 459 Cb 0.09 -3.14 0.00 0.00 0.66 0.00 0.00 46.19 43.80 2wk6 s LEU 459 CO 0.80 -0.60 0.12 -0.69 -1.89 0.00 0.00 176.35 174.10 2wk6 s VAL 460 N 2.96 4.30 -0.17 1.68 1.01 -0.43 -5.01 120.40 124.74 2wk6 s VAL 460 Ca 0.34 -0.56 -0.08 0.00 0.00 0.00 0.00 61.98 61.68 2wk6 s VAL 460 Cb -0.14 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 2wk6 s VAL 460 CO 0.11 0.06 0.10 -0.76 0.00 0.00 0.00 175.10 174.62 2wk6 s LEU 461 N 1.56 4.10 0.32 3.92 1.43 -1.26 -0.30 118.68 128.45 2wk6 s LEU 461 Ca 0.04 0.24 0.09 0.00 -1.03 0.00 0.00 54.13 53.47 2wk6 s LEU 461 Cb -0.17 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 2wk6 s LEU 461 CO 0.04 0.25 0.03 -0.94 0.23 0.00 0.00 176.35 175.96 2wk6 s SER 462 N -0.06 4.33 0.00 2.29 1.04 0.18 -4.84 113.70 116.65 2wk6 s SER 462 Ca 0.09 -0.88 0.27 0.00 0.48 0.00 0.00 55.95 55.90 2wk6 s SER 462 Cb -0.12 -0.62 0.81 0.00 0.10 0.00 0.00 66.02 66.20 2wk6 s SER 462 CO 0.00 -0.20 1.62 -0.67 0.98 0.00 0.00 173.24 174.97 2wk6 n ASP 463 N -0.97 0.51 -3.18 7.02 -0.08 -1.26 -0.96 116.55 117.63 2wk6 n ASP 463 Ca -0.04 -0.31 -0.23 0.00 -1.51 0.00 0.00 54.79 52.70 2wk6 n ASP 463 Cb 0.61 0.04 0.22 0.00 2.34 0.00 0.00 41.12 44.33 2wk6 n ASP 463 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 2wk6 n ARG 464 N -1.23 -4.06 -3.60 -0.67 1.85 -1.26 -4.90 116.66 102.78 2wk6 n ARG 464 Ca 0.09 -1.08 -0.26 0.00 -1.00 0.00 0.00 57.85 55.60 2wk6 n ARG 464 Cb 0.33 -1.43 -0.03 0.00 -1.05 0.00 0.00 32.46 30.28 2wk6 n ARG 464 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wk6 s ALA 465 N -2.08 3.78 0.20 2.89 0.00 -1.26 -4.63 121.76 120.66 2wk6 s ALA 465 Ca 0.50 -0.84 -0.32 0.00 0.00 0.00 0.00 51.96 51.29 2wk6 s ALA 465 Cb -0.09 -2.04 -0.15 0.00 0.00 0.00 0.00 23.12 20.85 2wk6 s ALA 465 CO 0.42 0.30 1.29 -2.30 0.00 0.00 0.00 175.76 175.46 2wk6 n PRO 466 N -0.99 1.58 -4.36 0.00 -0.02 -1.26 -4.99 135.00 124.96 2wk6 n PRO 466 Ca -0.05 0.56 -0.19 0.00 -2.02 0.00 0.00 63.50 61.80 2wk6 n PRO 466 Cb 0.55 -2.14 -0.09 0.00 -0.02 0.00 0.00 33.50 31.79 2wk6 n PRO 466 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2wk6 s PHE 467 N -0.10 1.64 -0.20 6.00 -0.12 -0.15 -5.01 117.98 120.04 2wk6 s PHE 467 Ca 0.71 -1.35 -0.13 0.00 -0.05 0.00 0.00 56.93 56.12 2wk6 s PHE 467 Cb -0.76 -0.90 -0.05 0.00 -0.63 0.00 0.00 43.02 40.68 2wk6 s PHE 467 CO 0.51 -0.48 0.24 0.00 -0.05 0.00 0.00 175.22 175.44 2wk6 s ALA 468 N -3.55 3.61 0.16 1.99 0.00 -1.26 -4.23 121.76 118.48 2wk6 s ALA 468 Ca 0.35 -0.64 -0.31 0.00 0.00 0.00 0.00 51.96 51.35 2wk6 s ALA 468 Cb 0.05 -2.38 -0.11 0.00 0.00 0.00 0.00 23.12 20.68 2wk6 s ALA 468 CO 0.17 -0.06 1.74 0.00 0.00 0.00 0.00 175.76 177.61 2wk6 s ALA 469 N 0.80 3.84 1.14 0.00 0.00 -1.26 -4.97 121.76 121.31 2wk6 s ALA 469 Ca 0.13 1.49 -0.13 0.00 0.00 0.00 0.00 51.96 53.45 2wk6 s ALA 469 Cb -0.13 -3.71 0.27 0.00 0.00 0.00 0.00 23.12 19.55 2wk6 s ALA 469 CO 0.04 -1.04 1.04 -2.14 0.00 0.00 0.00 175.76 173.66 2wk6 s PRO 470 N 1.87 -0.73 -0.13 0.00 0.02 -1.26 -5.00 135.00 129.77 2wk6 s PRO 470 Ca 0.77 0.81 -0.18 0.00 0.02 0.00 0.00 61.00 62.41 2wk6 s PRO 470 Cb -0.47 -1.58 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 2wk6 s PRO 470 CO 0.34 -3.59 0.47 -1.12 -0.33 0.00 0.00 177.00 172.77 2wk6 s SER 471 N -2.65 6.67 0.22 2.53 0.01 -1.26 -4.98 113.70 114.23 2wk6 s SER 471 Ca 0.68 0.79 -0.20 0.00 1.31 0.00 0.00 55.95 58.54 2wk6 s SER 471 Cb -0.24 -2.28 0.19 0.00 0.21 0.00 0.00 66.02 63.90 2wk6 s SER 471 CO 0.63 -0.01 1.55 -0.65 0.41 0.00 0.00 173.24 175.18 2wk6 h PRO 472 N 6.77 -0.02 -6.34 12.44 0.11 -1.91 -3.42 132.00 139.63 2wk6 h PRO 472 Ca -0.41 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.05 2wk6 h PRO 472 Cb 1.18 0.00 0.07 0.00 0.11 0.00 0.00 31.00 32.36 2wk6 h PRO 472 CO 0.75 -0.01 0.43 0.34 -0.21 0.00 0.00 178.00 179.31 2wk6 n PHE 473 N -5.44 1.56 -0.01 0.65 -0.00 -1.26 -1.71 117.46 111.23 2wk6 n PHE 473 Ca 0.09 0.60 -0.05 0.00 -0.00 0.00 0.00 57.45 58.09 2wk6 n PHE 473 Cb 0.38 -2.34 -0.02 0.00 -0.00 0.00 0.00 39.48 37.50 2wk6 n PHE 473 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2wk6 n ALA 474 N 2.21 2.16 -3.66 3.13 0.00 -0.11 -4.91 120.51 119.34 2wk6 n ALA 474 Ca 0.17 -0.35 -0.08 0.00 0.00 0.00 0.00 53.44 53.17 2wk6 n ALA 474 Cb 0.23 0.19 -0.01 0.00 0.00 0.00 0.00 19.45 19.85 2wk6 n ALA 474 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2wk6 s GLU 475 N -2.35 1.89 -0.11 0.00 -1.05 -1.17 -5.01 118.70 110.91 2wk6 s GLU 475 Ca -0.12 -1.23 0.00 0.00 -0.15 0.00 0.00 54.97 53.47 2wk6 s GLU 475 Cb 0.02 0.58 0.02 0.00 -0.44 0.00 0.00 34.13 34.31 2wk6 s GLU 475 CO 0.18 -0.86 -0.09 -1.17 0.95 0.00 0.00 175.26 174.27 2wk6 s LEU 476 N -3.01 1.33 -0.07 1.83 2.96 -1.26 -1.32 118.68 119.14 2wk6 s LEU 476 Ca 0.16 -0.33 -0.15 0.00 -0.22 0.00 0.00 54.13 53.59 2wk6 s LEU 476 Cb -0.04 -0.89 -0.05 0.00 0.50 0.00 0.00 46.19 45.70 2wk6 s LEU 476 CO 0.10 -0.09 0.37 -0.69 -1.32 0.00 0.00 176.35 174.72 2wk6 s VAL 477 N 1.52 5.17 0.28 1.68 1.01 0.88 -4.97 120.40 125.97 2wk6 s VAL 477 Ca 0.02 0.73 0.09 0.00 0.00 0.00 0.00 61.98 62.82 2wk6 s VAL 477 Cb -0.13 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 2wk6 s VAL 477 CO -0.07 0.48 0.05 -0.76 0.00 0.00 0.00 175.10 174.81 2wk6 s LEU 478 N -0.35 3.30 0.37 3.92 1.43 -1.26 -1.52 118.68 124.57 2wk6 s LEU 478 Ca 0.22 -0.62 0.13 0.00 -1.03 0.00 0.00 54.13 52.83 2wk6 s LEU 478 Cb -0.15 -1.81 0.71 0.00 0.03 0.00 0.00 46.19 44.98 2wk6 s LEU 478 CO 0.10 -0.07 1.81 1.55 0.23 0.00 0.00 176.35 179.97 2wk6 h PRO 479 N 1.76 0.00 -3.22 1.29 0.13 -1.92 -3.38 132.00 126.67 2wk6 h PRO 479 Ca -0.45 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.22 2wk6 h PRO 479 Cb 1.25 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.40 2wk6 h PRO 479 CO 0.61 0.38 2.86 -2.30 -0.23 0.00 0.00 178.00 179.32 2wk6 n PRO 480 N -4.03 2.59 0.00 1.56 -0.02 -1.26 -4.94 135.00 128.90 2wk6 n PRO 480 Ca -0.02 -1.66 0.00 0.00 -2.02 0.00 0.00 63.50 59.80 2wk6 n PRO 480 Cb 0.42 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 2wk6 n PRO 480 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42