#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wk5 s PRO 33 N 0.00 3.64 1.11 3.44 0.04 -1.26 -5.10 135.00 136.88 2wk5 s PRO 33 Ca 0.00 -0.01 -0.18 0.00 0.04 0.00 0.00 61.00 60.84 2wk5 s PRO 33 Cb 0.00 -2.71 0.26 0.00 0.04 0.00 0.00 34.50 32.09 2wk5 s PRO 33 CO 0.00 0.31 1.22 0.15 0.04 0.00 0.00 177.00 178.72 2wk5 s LYS 34 N -3.21 -0.55 0.13 4.56 1.02 -1.26 -5.08 119.74 115.36 2wk5 s LYS 34 Ca 0.43 -0.30 0.06 0.00 0.02 0.00 0.00 55.97 56.18 2wk5 s LYS 34 Cb -0.11 -1.70 -0.04 0.00 -0.52 0.00 0.00 37.83 35.46 2wk5 s LYS 34 CO 0.27 -3.22 -0.02 -1.14 -0.92 0.00 0.00 175.35 170.32 2wk5 s GLN 35 N -5.69 2.41 0.27 1.68 2.00 -1.26 -5.00 119.66 114.08 2wk5 s GLN 35 Ca 0.73 -0.98 -0.06 0.00 -2.00 0.00 0.00 55.36 53.05 2wk5 s GLN 35 Cb -0.06 -2.42 0.49 0.00 0.80 0.00 0.00 33.01 31.82 2wk5 s GLN 35 CO 0.55 0.50 1.59 -0.07 -0.50 0.00 0.00 175.29 177.35 2wk5 h LEU 36 N 3.17 -0.67 -1.39 3.68 3.38 -1.99 0.43 115.31 121.93 2wk5 h LEU 36 Ca -0.48 0.26 0.34 0.00 0.09 0.00 0.00 57.88 58.10 2wk5 h LEU 36 Cb 1.18 0.51 -0.11 0.00 0.09 0.00 0.00 40.66 42.33 2wk5 h LEU 36 CO 0.58 -0.29 0.75 -0.65 0.09 0.00 0.00 178.44 178.91 2wk5 h PRO 37 N 0.02 0.24 0.21 1.13 0.11 -1.99 0.21 132.00 131.93 2wk5 h PRO 37 Ca 0.47 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.55 2wk5 h PRO 37 Cb 0.81 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2wk5 h PRO 37 CO -0.88 0.16 -0.10 0.93 -0.21 0.00 0.00 178.00 177.89 2wk5 h GLU 38 N 0.24 -0.28 -0.78 1.05 4.39 -0.53 -2.44 114.58 116.23 2wk5 h GLU 38 Ca 0.70 0.02 0.09 0.00 0.34 0.00 0.00 59.36 60.51 2wk5 h GLU 38 Cb 2.00 0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 30.64 2wk5 h GLU 38 CO -0.35 0.11 0.43 -0.07 -1.16 0.00 0.00 179.01 177.96 2wk5 h LEU 39 N -0.84 0.60 0.30 1.33 3.38 -0.89 0.23 115.31 119.42 2wk5 h LEU 39 Ca -0.03 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2wk5 h LEU 39 Cb 0.51 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2wk5 h LEU 39 CO 0.05 0.34 -0.24 0.40 0.09 0.00 0.00 178.44 179.08 2wk5 h ILE 40 N 0.73 0.49 -0.72 1.22 2.04 -0.70 -1.79 117.51 118.78 2wk5 h ILE 40 Ca 0.38 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.30 2wk5 h ILE 40 Cb 0.36 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 2wk5 h ILE 40 CO -0.25 0.00 0.41 -0.09 0.00 0.00 0.00 178.15 178.22 2wk5 h ARG 41 N -0.54 0.72 0.02 2.37 2.43 -0.87 0.21 114.38 118.71 2wk5 h ARG 41 Ca -0.02 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.13 2wk5 h ARG 41 Cb 0.48 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 29.81 2wk5 h ARG 41 CO -0.02 0.47 -0.47 0.52 -1.51 0.00 0.00 179.97 178.97 2wk5 h MET 42 N 0.74 -0.61 -0.67 0.20 2.86 -0.16 0.26 114.93 117.55 2wk5 h MET 42 Ca 0.33 0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.97 2wk5 h MET 42 Cb 0.22 0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.99 2wk5 h MET 42 CO -0.20 -0.40 0.26 -0.22 1.06 0.00 0.00 176.91 177.41 2wk5 h LYS 43 N -0.63 0.98 -0.62 1.72 3.11 -0.93 0.20 116.57 120.40 2wk5 h LYS 43 Ca 0.03 -0.16 0.02 0.00 -2.81 0.00 0.00 60.65 57.73 2wk5 h LYS 43 Cb 0.69 -0.17 -0.04 0.00 -1.00 0.00 0.00 32.23 31.72 2wk5 h LYS 43 CO -0.33 0.80 0.39 -0.09 -2.81 0.00 0.00 179.45 177.41 2wk5 h ARG 44 N 0.96 0.75 0.00 1.90 2.43 0.34 -0.56 114.38 120.21 2wk5 h ARG 44 Ca 0.22 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.33 2wk5 h ARG 44 Cb 0.19 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2wk5 h ARG 44 CO -0.02 0.50 -0.11 -0.44 -1.51 0.00 0.00 179.97 178.38 2wk5 h ASP 45 N 0.77 0.00 0.00 -3.80 3.45 -0.12 -3.46 116.42 113.26 2wk5 h ASP 45 Ca 0.24 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.70 2wk5 h ASP 45 Cb -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.76 2wk5 h ASP 45 CO -0.09 0.11 0.00 0.61 -1.57 0.00 0.00 179.24 178.30 2wk5 n GLY 46 N -0.01 1.16 3.78 2.75 0.00 -0.22 -5.11 105.19 107.54 2wk5 n GLY 46 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2wk5 n GLY 46 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wk5 s GLY 47 N -0.95 1.67 0.53 -0.02 0.00 0.65 -4.93 107.32 104.27 2wk5 s GLY 47 Ca 0.00 0.21 -0.06 0.00 0.00 0.00 0.00 44.72 44.87 2wk5 s GLY 47 CO 0.00 0.55 0.85 0.50 0.00 0.00 0.00 173.10 175.00 2wk5 s ARG 48 N -4.94 3.40 -0.08 2.90 0.52 -1.26 -4.17 118.95 115.31 2wk5 s ARG 48 Ca 0.60 0.23 0.03 0.00 -0.52 0.00 0.00 55.73 56.08 2wk5 s ARG 48 Cb -0.16 -2.31 -0.02 0.00 0.52 0.00 0.00 34.95 32.98 2wk5 s ARG 48 CO 0.56 -0.38 -0.17 -0.51 0.02 0.00 0.00 175.30 174.82 2wk5 s LEU 49 N -4.87 2.54 0.70 2.53 1.43 -1.26 -4.87 118.68 114.88 2wk5 s LEU 49 Ca 0.50 -0.33 -0.14 0.00 -1.03 0.00 0.00 54.13 53.13 2wk5 s LEU 49 Cb -0.10 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.62 2wk5 s LEU 49 CO 0.46 0.26 1.14 -0.94 0.23 0.00 0.00 176.35 177.49 2wk5 s SER 50 N -0.20 4.68 0.25 2.29 1.04 -1.26 -4.65 113.70 115.85 2wk5 s SER 50 Ca -0.01 2.09 0.15 0.00 0.48 0.00 0.00 55.95 58.66 2wk5 s SER 50 Cb -0.13 -2.56 0.83 0.00 0.10 0.00 0.00 66.02 64.26 2wk5 s SER 50 CO 0.03 -1.93 1.44 1.21 0.98 0.00 0.00 173.24 174.98 2wk5 n GLU 51 N -2.72 0.10 -0.01 4.02 2.13 -1.26 0.12 120.64 123.02 2wk5 n GLU 51 Ca 0.11 0.59 -0.08 0.00 0.66 0.00 0.00 57.16 58.44 2wk5 n GLU 51 Cb 0.52 -1.89 -0.13 0.00 0.27 0.00 0.00 31.44 30.20 2wk5 n GLU 51 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2wk5 h ALA 52 N 1.82 0.72 0.00 4.31 0.00 -1.98 -3.25 119.26 120.89 2wk5 h ALA 52 Ca 0.00 -1.35 -0.06 0.00 0.00 0.00 0.00 54.91 53.50 2wk5 h ALA 52 Cb 0.13 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2wk5 h ALA 52 CO 0.00 1.49 -0.33 -0.44 0.00 0.00 0.00 179.25 179.97 2wk5 h ASP 53 N 0.00 0.00 0.07 0.00 3.32 0.55 -2.62 116.42 117.73 2wk5 h ASP 53 Ca -0.25 -0.79 0.03 0.00 0.02 0.00 0.00 57.03 56.04 2wk5 h ASP 53 Cb 1.95 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 41.45 2wk5 h ASP 53 CO 0.08 1.09 -0.35 0.40 -1.72 0.00 0.00 179.24 178.74 2wk5 h ILE 54 N -1.00 0.26 -0.77 0.35 1.08 -1.15 0.30 117.51 116.57 2wk5 h ILE 54 Ca -0.09 0.00 0.18 0.00 -0.39 0.00 0.00 64.86 64.56 2wk5 h ILE 54 Cb 1.00 0.26 -0.05 0.00 -3.07 0.00 0.00 36.82 34.97 2wk5 h ILE 54 CO -0.05 0.00 0.53 -0.09 -0.69 0.00 0.00 178.15 177.84 2wk5 h ARG 55 N -0.55 0.29 0.39 2.37 2.43 -1.71 -1.29 114.38 116.31 2wk5 h ARG 55 Ca 0.04 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 2wk5 h ARG 55 Cb 0.60 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 2wk5 h ARG 55 CO -0.24 0.19 -0.19 0.78 -1.51 0.00 0.00 179.97 179.01 2wk5 h GLY 56 N 0.30 -0.54 -0.34 2.80 0.00 -0.13 -2.26 103.07 102.90 2wk5 h GLY 56 Ca 0.38 0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.95 2wk5 h GLY 56 CO -0.10 -0.20 -0.20 -2.75 0.00 0.00 0.00 176.54 173.28 2wk5 h PHE 57 N -0.56 -0.65 -0.90 5.60 3.57 0.17 0.15 116.94 124.30 2wk5 h PHE 57 Ca -0.05 0.04 0.18 0.00 3.53 0.00 0.00 57.97 61.67 2wk5 h PHE 57 Cb 0.40 0.33 -0.17 0.00 2.79 0.00 0.00 35.95 39.30 2wk5 h PHE 57 CO 0.12 -0.13 -0.23 0.28 -2.23 0.00 0.00 178.31 176.12 2wk5 h VAL 58 N -0.01 0.10 -0.80 1.41 2.07 -1.41 1.03 116.25 118.64 2wk5 h VAL 58 Ca 0.05 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.73 2wk5 h VAL 58 Cb 0.15 0.10 -0.10 0.00 -1.52 0.00 0.00 31.29 29.91 2wk5 h VAL 58 CO -0.32 0.00 0.34 0.00 0.02 0.00 0.00 177.57 177.61 2wk5 h ALA 59 N 1.90 1.16 -0.03 1.67 0.00 -0.13 0.10 119.26 123.94 2wk5 h ALA 59 Ca 0.43 0.12 -0.14 0.00 0.00 0.00 0.00 54.91 55.32 2wk5 h ALA 59 Cb 0.66 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2wk5 h ALA 59 CO -0.93 -0.21 -0.62 0.00 0.00 0.00 0.00 179.25 177.49 2wk5 h ALA 60 N 1.58 0.89 -0.25 0.00 0.00 0.23 -2.48 119.26 119.23 2wk5 h ALA 60 Ca 0.45 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 2wk5 h ALA 60 Cb 0.70 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2wk5 h ALA 60 CO -0.42 0.76 0.01 0.28 0.00 0.00 0.00 179.25 179.88 2wk5 h VAL 61 N 0.09 1.25 -0.11 0.00 2.07 0.11 0.85 116.25 120.52 2wk5 h VAL 61 Ca -0.01 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.60 2wk5 h VAL 61 Cb 1.12 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 32.23 2wk5 h VAL 61 CO 0.09 0.28 -0.06 0.58 0.02 0.00 0.00 177.57 178.48 2wk5 h VAL 62 N 0.21 1.32 0.00 2.57 2.07 -1.23 -3.22 116.25 117.98 2wk5 h VAL 62 Ca 0.07 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.49 2wk5 h VAL 62 Cb 0.40 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2wk5 h VAL 62 CO 0.01 0.31 0.00 -0.46 0.02 0.00 0.00 177.57 177.45 2wk5 n ASN 63 N -4.71 0.27 0.00 0.57 2.04 -0.94 -4.87 115.26 107.63 2wk5 n ASN 63 Ca -0.06 -1.91 0.00 0.00 -0.44 0.00 0.00 54.58 52.16 2wk5 n ASN 63 Cb 0.28 -0.13 0.00 0.00 -2.53 0.00 0.00 39.78 37.40 2wk5 n ASN 63 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2wk5 n GLY 64 N 0.33 2.71 0.35 4.83 0.00 -1.18 -4.85 105.19 107.38 2wk5 n GLY 64 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2wk5 n GLY 64 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wk5 h SER 65 N 0.00 0.36 -3.36 1.61 4.64 -1.79 -3.39 113.55 111.62 2wk5 h SER 65 Ca 0.00 0.01 -0.55 0.00 -0.47 0.00 0.00 61.79 60.78 2wk5 h SER 65 Cb 0.00 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 61.99 2wk5 h SER 65 CO 0.00 0.22 0.44 0.00 -0.87 0.00 0.00 176.83 176.62 2wk5 s ALA 66 N -5.38 3.24 0.19 5.18 0.00 0.27 -5.01 121.76 120.25 2wk5 s ALA 66 Ca -0.08 0.49 -0.03 0.00 0.00 0.00 0.00 51.96 52.34 2wk5 s ALA 66 Cb 0.19 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.89 2wk5 s ALA 66 CO 0.75 -0.36 0.40 -0.65 0.00 0.00 0.00 175.76 175.90 2wk5 s GLN 67 N 1.34 3.56 0.02 0.00 -0.21 -1.26 -4.81 119.66 118.31 2wk5 s GLN 67 Ca 0.51 -0.22 -0.04 0.00 0.02 0.00 0.00 55.36 55.63 2wk5 s GLN 67 Cb -0.20 -2.83 -0.01 0.00 1.00 0.00 0.00 33.01 30.97 2wk5 s GLN 67 CO 0.25 0.41 0.85 0.41 -2.12 0.00 0.00 175.29 175.08 2wk5 n GLY 68 N -0.41 -2.38 0.30 3.09 0.00 -1.26 -0.98 105.19 103.54 2wk5 n GLY 68 Ca -0.04 0.54 0.10 0.00 0.00 0.00 0.00 46.02 46.62 2wk5 n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk5 h ALA 69 N -0.59 1.14 0.37 4.61 0.00 -1.97 0.40 119.26 123.21 2wk5 h ALA 69 Ca 0.02 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2wk5 h ALA 69 Cb 0.05 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2wk5 h ALA 69 CO -0.12 -0.42 -0.28 1.96 0.00 0.00 0.00 179.25 180.39 2wk5 h GLN 70 N 0.22 -0.62 -0.85 0.00 4.20 -1.46 0.82 115.11 117.41 2wk5 h GLN 70 Ca 0.50 0.04 0.16 0.00 0.06 0.00 0.00 58.65 59.41 2wk5 h GLN 70 Cb 0.95 0.14 -0.06 0.00 0.30 0.00 0.00 27.48 28.81 2wk5 h GLN 70 CO -0.62 -0.42 0.56 0.82 -0.67 0.00 0.00 178.83 178.51 2wk5 h ILE 71 N -0.65 0.78 0.05 2.54 2.04 0.51 0.43 117.51 123.21 2wk5 h ILE 71 Ca -0.03 -0.18 -0.26 0.00 1.00 0.00 0.00 64.86 65.39 2wk5 h ILE 71 Cb 0.56 0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.86 2wk5 h ILE 71 CO -0.01 0.10 -1.09 1.23 0.00 0.00 0.00 178.15 178.38 2wk5 h GLY 72 N 0.53 0.57 0.59 5.37 0.00 0.49 -2.14 103.07 108.48 2wk5 h GLY 72 Ca 0.43 -1.11 -0.03 0.00 0.00 0.00 0.00 47.33 46.63 2wk5 h GLY 72 CO -0.17 0.98 -0.06 0.00 0.00 0.00 0.00 176.54 177.28 2wk5 h ALA 73 N 0.53 0.08 -0.16 3.60 0.00 0.19 -1.02 119.26 122.47 2wk5 h ALA 73 Ca -0.13 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.53 2wk5 h ALA 73 Cb 1.75 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.49 2wk5 h ALA 73 CO 0.20 -0.11 -0.07 1.98 0.00 0.00 0.00 179.25 181.26 2wk5 h MET 74 N -0.31 -0.04 -0.66 0.00 -1.53 -0.30 0.50 114.93 112.58 2wk5 h MET 74 Ca 0.01 0.00 0.10 0.00 -3.44 0.00 0.00 59.70 56.37 2wk5 h MET 74 Cb 0.59 0.01 -0.07 0.00 -0.55 0.00 0.00 31.60 31.57 2wk5 h MET 74 CO 0.02 -0.03 0.28 -0.07 0.14 0.00 0.00 176.91 177.25 2wk5 h LEU 75 N -0.04 0.31 -0.82 3.39 3.38 -1.36 0.17 115.31 120.34 2wk5 h LEU 75 Ca 0.09 0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 2wk5 h LEU 75 Cb 0.17 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2wk5 h LEU 75 CO -0.19 0.17 0.10 -0.03 0.09 0.00 0.00 178.44 178.58 2wk5 h MET 76 N 0.48 0.99 -0.74 1.13 4.05 0.03 -1.61 114.93 119.25 2wk5 h MET 76 Ca 0.33 -0.25 0.08 0.00 -0.28 0.00 0.00 59.70 59.59 2wk5 h MET 76 Cb 0.41 -0.13 -0.07 0.00 -0.80 0.00 0.00 31.60 31.02 2wk5 h MET 76 CO -0.31 0.91 0.41 0.00 0.23 0.00 0.00 176.91 178.15 2wk5 h ALA 77 N 1.17 1.02 0.00 0.39 0.00 0.26 0.37 119.26 122.48 2wk5 h ALA 77 Ca 0.19 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 2wk5 h ALA 77 Cb 0.40 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2wk5 h ALA 77 CO 0.01 0.06 -0.15 0.82 0.00 0.00 0.00 179.25 179.99 2wk5 h ILE 78 N 0.72 0.75 0.12 0.00 2.04 0.05 -2.77 117.51 118.41 2wk5 h ILE 78 Ca 0.35 -0.58 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 2wk5 h ILE 78 Cb 0.29 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 2wk5 h ILE 78 CO -0.22 0.14 -0.06 0.03 0.00 0.00 0.00 178.15 178.04 2wk5 h ARG 79 N 0.00 -0.15 0.00 2.37 2.47 0.54 0.19 114.38 119.80 2wk5 h ARG 79 Ca -0.00 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2wk5 h ARG 79 Cb 0.34 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.69 2wk5 h ARG 79 CO 0.02 0.24 -0.43 1.28 0.56 0.00 0.00 179.97 181.64 2wk5 n LEU 80 N -4.97 0.44 -0.02 3.04 4.77 -1.08 -4.33 117.00 114.85 2wk5 n LEU 80 Ca -0.09 0.10 -0.02 0.00 -0.03 0.00 0.00 56.01 55.98 2wk5 n LEU 80 Cb 0.24 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 2wk5 n LEU 80 CO 0.32 0.09 -0.62 0.54 -1.33 0.00 0.00 177.39 176.38 2wk5 n ARG 81 N -1.56 3.32 -1.17 3.23 5.12 -1.05 -5.14 116.66 119.41 2wk5 n ARG 81 Ca 0.06 -0.00 0.15 0.00 -1.93 0.00 0.00 57.85 56.12 2wk5 n ARG 81 Cb 0.35 -1.10 -0.06 0.00 -1.16 0.00 0.00 32.46 30.49 2wk5 n ARG 81 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2wk5 n GLY 82 N 2.76 -2.60 3.50 -0.13 0.00 0.68 -5.00 105.19 104.39 2wk5 n GLY 82 Ca -0.06 -1.17 -0.24 0.00 0.00 0.00 0.00 46.02 44.55 2wk5 n GLY 82 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wk5 s MET 83 N -3.14 1.71 0.43 1.61 -1.94 -1.26 -4.93 119.30 111.79 2wk5 s MET 83 Ca 0.00 -1.86 0.08 0.00 -1.71 0.00 0.00 55.69 52.20 2wk5 s MET 83 Cb 0.00 -1.59 0.01 0.00 2.01 0.00 0.00 34.83 35.27 2wk5 s MET 83 CO 0.00 0.17 0.59 0.16 -0.01 0.00 0.00 175.02 175.93 2wk5 s ASP 84 N -3.54 5.62 0.36 3.03 3.84 -1.26 -4.85 116.67 119.86 2wk5 s ASP 84 Ca 0.31 -0.41 0.12 0.00 -0.00 0.00 0.00 52.55 52.57 2wk5 s ASP 84 Cb 0.01 -0.64 0.91 0.00 -1.38 0.00 0.00 42.92 41.81 2wk5 s ASP 84 CO 0.15 -0.80 1.80 -0.07 -0.00 0.00 0.00 175.17 176.25 2wk5 h LEU 85 N 0.59 0.61 0.47 2.11 3.38 -2.01 0.34 115.31 120.80 2wk5 h LEU 85 Ca -0.40 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 2wk5 h LEU 85 Cb 1.28 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 2wk5 h LEU 85 CO 0.45 0.21 -0.32 -0.08 0.09 0.00 0.00 178.44 178.80 2wk5 h GLU 86 N 0.59 -0.74 -0.41 1.13 4.22 -2.00 -0.74 114.58 116.63 2wk5 h GLU 86 Ca 0.54 0.05 0.02 0.00 0.08 0.00 0.00 59.36 60.06 2wk5 h GLU 86 Cb 1.08 0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2wk5 h GLU 86 CO -0.30 -0.49 0.23 0.93 -2.18 0.00 0.00 179.01 177.20 2wk5 h GLU 87 N -0.77 0.46 -0.50 1.92 5.08 -1.43 -1.69 114.58 117.66 2wk5 h GLU 87 Ca -0.05 -0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.38 2wk5 h GLU 87 Cb 0.64 -0.10 -0.10 0.00 0.50 0.00 0.00 28.75 29.69 2wk5 h GLU 87 CO 0.03 0.30 -0.17 1.15 -1.00 0.00 0.00 179.01 179.32 2wk5 h THR 88 N 0.47 0.41 -0.50 1.13 2.02 -0.19 0.16 112.91 116.42 2wk5 h THR 88 Ca 0.17 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.31 2wk5 h THR 88 Cb 0.03 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 2wk5 h THR 88 CO -0.09 0.00 0.16 -1.28 0.37 0.00 0.00 175.52 174.68 2wk5 h SER 89 N -0.06 0.72 0.19 4.18 0.87 -0.74 -0.08 113.55 118.64 2wk5 h SER 89 Ca 0.24 -0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 2wk5 h SER 89 Cb 0.43 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2wk5 h SER 89 CO -0.55 0.73 -0.20 0.58 -0.53 0.00 0.00 176.83 176.87 2wk5 h VAL 90 N 0.67 0.00 -0.36 2.23 2.07 -0.24 -1.41 116.25 119.21 2wk5 h VAL 90 Ca 0.16 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.72 2wk5 h VAL 90 Cb 0.27 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.98 2wk5 h VAL 90 CO -0.01 0.00 -0.36 0.25 0.02 0.00 0.00 177.57 177.47 2wk5 h LEU 91 N -0.38 -1.24 -1.50 2.57 6.46 -0.72 0.15 115.31 120.66 2wk5 h LEU 91 Ca -0.02 0.17 0.38 0.00 -0.12 0.00 0.00 57.88 58.29 2wk5 h LEU 91 Cb 0.33 0.52 -0.11 0.00 -0.73 0.00 0.00 40.66 40.68 2wk5 h LEU 91 CO -0.03 -0.23 0.83 0.00 -0.62 0.00 0.00 178.44 178.40 2wk5 h THR 92 N -0.18 0.27 0.15 1.05 1.03 -0.95 -1.95 112.91 112.32 2wk5 h THR 92 Ca 0.06 -0.06 -0.01 0.00 -0.01 0.00 0.00 66.41 66.40 2wk5 h THR 92 Cb 0.35 0.09 0.00 0.00 -1.07 0.00 0.00 68.15 67.52 2wk5 h THR 92 CO -0.44 0.03 -0.07 -0.61 -0.01 0.00 0.00 175.52 174.42 2wk5 h GLN 93 N 0.17 -0.19 -0.96 0.00 4.15 0.39 -3.25 115.11 115.43 2wk5 h GLN 93 Ca 0.73 0.01 0.26 0.00 0.77 0.00 0.00 58.65 60.42 2wk5 h GLN 93 Cb 2.28 0.04 -0.18 0.00 0.21 0.00 0.00 27.48 29.84 2wk5 h GLN 93 CO -0.31 -0.13 0.06 0.00 -1.93 0.00 0.00 178.83 176.52 2wk5 h ALA 94 N -1.33 1.18 -0.64 3.38 0.00 -0.47 0.41 119.26 121.78 2wk5 h ALA 94 Ca -0.02 0.32 0.04 0.00 0.00 0.00 0.00 54.91 55.25 2wk5 h ALA 94 Cb 0.15 0.55 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 2wk5 h ALA 94 CO 0.03 -0.56 0.37 -0.07 0.00 0.00 0.00 179.25 179.03 2wk5 h LEU 95 N 0.03 0.58 -2.19 0.00 3.38 -1.53 0.21 115.31 115.81 2wk5 h LEU 95 Ca 0.59 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.58 2wk5 h LEU 95 Cb 1.21 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 2wk5 h LEU 95 CO -0.87 0.39 0.01 0.00 0.09 0.00 0.00 178.44 178.06 2wk5 h ALA 96 N 1.31 1.82 -0.01 1.53 0.00 -0.23 -1.08 119.26 122.60 2wk5 h ALA 96 Ca 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2wk5 h ALA 96 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2wk5 h ALA 96 CO -0.14 -0.02 -0.25 1.04 0.00 0.00 0.00 179.25 179.88 2wk5 n GLN 97 N -4.26 0.87 -0.34 0.00 6.02 -0.04 -4.05 117.38 115.57 2wk5 n GLN 97 Ca -0.03 -0.51 0.03 0.00 -0.01 0.00 0.00 57.00 56.49 2wk5 n GLN 97 Cb 0.10 -1.49 0.18 0.00 1.02 0.00 0.00 30.24 30.05 2wk5 n GLN 97 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 2wk5 h SER 98 N 1.24 0.92 0.00 1.08 0.02 -0.10 -3.44 113.55 113.27 2wk5 h SER 98 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2wk5 h SER 98 Cb 0.51 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.88 2wk5 h SER 98 CO 0.00 0.56 0.00 0.61 -1.14 0.00 0.00 176.83 176.86 2wk5 n GLY 99 N -1.35 4.66 3.96 -3.77 0.00 -1.26 -4.75 105.19 102.68 2wk5 n GLY 99 Ca 0.15 -1.67 -0.22 0.00 0.00 0.00 0.00 46.02 44.28 2wk5 n GLY 99 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wk5 s GLN 100 N 4.36 2.88 -0.09 1.61 -0.21 0.48 -4.91 119.66 123.78 2wk5 s GLN 100 Ca 0.00 -0.61 -0.01 0.00 0.02 0.00 0.00 55.36 54.76 2wk5 s GLN 100 Cb 0.00 -2.54 -0.03 0.00 1.00 0.00 0.00 33.01 31.44 2wk5 s GLN 100 CO 0.00 -0.42 -0.04 -1.14 -2.12 0.00 0.00 175.29 171.57 2wk5 s GLN 101 N -4.62 2.95 -0.13 2.91 2.00 -1.26 -4.77 119.66 116.73 2wk5 s GLN 101 Ca 0.52 -0.49 -0.27 0.00 -2.00 0.00 0.00 55.36 53.12 2wk5 s GLN 101 Cb -0.10 -2.71 -0.01 0.00 0.80 0.00 0.00 33.01 30.98 2wk5 s GLN 101 CO 0.38 0.63 0.92 -0.51 -0.50 0.00 0.00 175.29 176.21 2wk5 s LEU 102 N -0.71 4.21 -0.29 3.68 1.43 -1.21 -5.03 118.68 120.77 2wk5 s LEU 102 Ca 0.11 1.36 0.00 0.00 -1.03 0.00 0.00 54.13 54.57 2wk5 s LEU 102 Cb -0.11 -3.40 0.06 0.00 0.03 0.00 0.00 46.19 42.76 2wk5 s LEU 102 CO 0.02 -0.42 -0.03 -0.70 0.23 0.00 0.00 176.35 175.45 2wk5 s GLU 103 N 2.06 2.31 0.05 1.70 -6.30 -1.26 -4.81 118.70 112.45 2wk5 s GLU 103 Ca 0.43 -1.34 0.05 0.00 -2.50 0.00 0.00 54.97 51.62 2wk5 s GLU 103 Cb -0.17 -3.08 -0.04 0.00 0.00 0.00 0.00 34.13 30.84 2wk5 s GLU 103 CO 0.15 -0.63 -0.09 -1.58 0.02 0.00 0.00 175.26 173.13 2wk5 s TRP 104 N 1.18 2.79 0.00 5.30 0.52 -1.26 -5.10 118.94 122.36 2wk5 s TRP 104 Ca -0.06 -0.12 0.00 0.00 0.02 0.00 0.00 56.10 55.95 2wk5 s TRP 104 Cb -0.20 -1.52 0.00 0.00 -1.15 0.00 0.00 33.47 30.60 2wk5 s TRP 104 CO -0.03 0.38 0.64 -2.30 0.02 0.00 0.00 176.95 175.66 2wk5 n PRO 105 N 1.20 0.00 0.00 4.98 -0.02 -1.26 -4.84 135.00 135.06 2wk5 n PRO 105 Ca -0.15 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2wk5 n PRO 105 Cb 0.52 -1.14 0.00 0.00 -0.02 0.00 0.00 33.50 32.86 2wk5 n PRO 105 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2wk5 n TRP 108 N -1.37 0.00 0.07 6.00 7.02 -1.26 -5.01 117.44 122.90 2wk5 n TRP 108 Ca 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.46 2wk5 n TRP 108 Cb 0.00 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 28.83 2wk5 n TRP 108 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2wk5 h ARG 109 N 0.00 0.00 0.00 -0.99 -0.00 -1.95 -3.19 114.38 108.25 2wk5 h ARG 109 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 2wk5 h ARG 109 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.97 2wk5 h ARG 109 CO 0.00 0.63 0.00 0.94 0.00 0.00 0.00 179.97 181.54 2wk5 n GLN 110 N -3.19 0.84 -0.02 0.04 -0.06 -1.26 -3.31 117.38 110.42 2wk5 n GLN 110 Ca -0.03 0.00 -0.03 0.00 -2.00 0.00 0.00 57.00 54.94 2wk5 n GLN 110 Cb 0.86 -1.21 -0.02 0.00 -4.06 0.00 0.00 30.24 25.81 2wk5 n GLN 110 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2wk5 n GLN 111 N -0.71 0.62 -1.52 3.69 6.02 -1.22 -4.97 117.38 119.29 2wk5 n GLN 111 Ca 0.08 0.02 -0.17 0.00 -0.01 0.00 0.00 57.00 56.92 2wk5 n GLN 111 Cb 0.04 -1.10 -0.15 0.00 1.02 0.00 0.00 30.24 30.05 2wk5 n GLN 111 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2wk5 n LEU 112 N -2.57 0.08 -4.68 1.08 4.77 -1.21 -3.14 117.00 111.34 2wk5 n LEU 112 Ca -0.08 -1.03 -0.30 0.00 -0.03 0.00 0.00 56.01 54.58 2wk5 n LEU 112 Cb 0.60 -1.07 -0.10 0.00 -2.33 0.00 0.00 43.42 40.52 2wk5 n LEU 112 CO 0.05 -2.03 -0.27 0.68 -1.33 0.00 0.00 177.39 174.49 2wk5 s VAL 113 N 7.15 1.72 -0.28 4.08 -7.23 -0.43 0.64 120.40 126.04 2wk5 s VAL 113 Ca 1.12 -1.98 -0.32 0.00 -1.81 0.00 0.00 61.98 58.99 2wk5 s VAL 113 Cb -0.49 -2.69 0.18 0.00 0.56 0.00 0.00 36.38 33.93 2wk5 s VAL 113 CO 0.33 0.00 1.35 -0.62 -0.31 0.00 0.00 175.10 175.85 2wk5 s ASP 114 N -3.79 -0.05 0.11 4.85 2.15 -1.12 -4.26 116.67 114.57 2wk5 s ASP 114 Ca 0.25 0.04 0.08 0.00 0.43 0.00 0.00 52.55 53.34 2wk5 s ASP 114 Cb 0.07 0.04 -0.04 0.00 -0.30 0.00 0.00 42.92 42.69 2wk5 s ASP 114 CO 0.13 -0.05 -0.18 -1.59 -0.17 0.00 0.00 175.17 173.30 2wk5 s LYS 115 N -1.34 1.10 -0.03 4.34 0.00 -1.26 -1.70 119.74 120.84 2wk5 s LYS 115 Ca 0.09 -1.19 -0.01 0.00 0.00 0.00 0.00 55.97 54.86 2wk5 s LYS 115 Cb -0.01 -1.23 0.03 0.00 0.00 0.00 0.00 37.83 36.62 2wk5 s LYS 115 CO -0.06 0.27 0.04 -1.58 0.00 0.00 0.00 175.35 174.02 2wk5 s HIS 116 N -1.49 0.13 0.74 1.78 2.46 -0.68 -4.98 115.29 113.25 2wk5 s HIS 116 Ca 0.07 0.15 -0.12 0.00 0.47 0.00 0.00 55.06 55.64 2wk5 s HIS 116 Cb -0.08 -0.42 0.03 0.00 -0.13 0.00 0.00 32.58 31.98 2wk5 s HIS 116 CO 0.04 -0.16 1.12 0.45 -2.47 0.00 0.00 174.74 173.72 2wk5 s SER 117 N 1.68 5.16 -0.08 9.88 0.15 -1.26 -1.35 113.70 127.87 2wk5 s SER 117 Ca -0.01 1.05 0.12 0.00 0.70 0.00 0.00 55.95 57.81 2wk5 s SER 117 Cb -0.13 -1.77 -0.17 0.00 -1.71 0.00 0.00 66.02 62.24 2wk5 s SER 117 CO -0.03 -1.52 0.13 0.35 1.20 0.00 0.00 173.24 173.37 2wk5 n THR 118 N -3.11 0.54 0.00 6.45 -2.24 -0.76 -4.85 114.28 110.31 2wk5 n THR 118 Ca 0.07 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 2wk5 n THR 118 Cb 0.58 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 2wk5 n THR 118 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wk5 n GLY 119 N 2.07 -0.19 0.83 3.38 0.00 -1.26 -4.88 105.19 105.15 2wk5 n GLY 119 Ca -0.14 0.54 0.10 0.00 0.00 0.00 0.00 46.02 46.53 2wk5 n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wk5 n GLY 120 N 0.00 -2.92 3.07 -0.02 0.00 -1.26 -4.77 105.19 99.29 2wk5 n GLY 120 Ca 0.00 -1.23 -0.32 0.00 0.00 0.00 0.00 46.02 44.47 2wk5 n GLY 120 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wk5 s VAL 121 N -3.54 2.04 -0.17 1.61 1.01 -1.26 -4.17 120.40 115.93 2wk5 s VAL 121 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 61.98 60.65 2wk5 s VAL 121 Cb 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.32 2wk5 s VAL 121 CO 0.00 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.88 2wk5 n GLY 122 N 4.53 0.31 2.26 4.51 0.00 -1.26 -2.33 105.19 113.21 2wk5 n GLY 122 Ca -0.16 -0.82 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 2wk5 n GLY 122 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2wk5 n ASP 123 N 1.64 8.16 -1.10 1.61 4.64 -1.26 -4.05 116.55 126.18 2wk5 n ASP 123 Ca -0.02 -2.56 -0.03 0.00 -1.38 0.00 0.00 54.79 50.80 2wk5 n ASP 123 Cb 0.48 -1.53 0.02 0.00 -1.04 0.00 0.00 41.12 39.05 2wk5 n ASP 123 CO 0.00 0.00 0.00 2.29 -0.82 0.00 0.00 177.20 178.67 2wk5 n LYS 124 N 3.36 1.18 -0.19 -0.67 0.00 -1.26 -4.30 118.16 116.28 2wk5 n LYS 124 Ca 0.72 -0.37 -0.05 0.00 -0.00 0.00 0.00 58.31 58.62 2wk5 n LYS 124 Cb 0.35 -1.19 0.05 0.00 -0.00 0.00 0.00 35.03 34.24 2wk5 n LYS 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2wk5 h VAL 125 N 0.16 1.05 -0.96 0.58 2.07 -1.94 -2.67 116.25 114.54 2wk5 h VAL 125 Ca 0.07 -0.22 0.05 0.00 0.82 0.00 0.00 66.70 67.41 2wk5 h VAL 125 Cb 1.18 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 2wk5 h VAL 125 CO 0.13 0.12 0.62 0.28 0.02 0.00 0.00 177.57 178.73 2wk5 h SER 126 N 0.65 1.01 -0.49 0.57 0.02 -1.98 0.26 113.55 113.60 2wk5 h SER 126 Ca 0.22 -0.00 0.10 0.00 -0.84 0.00 0.00 61.79 61.28 2wk5 h SER 126 Cb 0.03 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 2wk5 h SER 126 CO -0.10 0.67 0.34 -0.07 -1.14 0.00 0.00 176.83 176.53 2wk5 h LEU 127 N 1.17 0.18 0.02 5.07 3.38 -1.80 -2.94 115.31 120.39 2wk5 h LEU 127 Ca 0.39 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.99 2wk5 h LEU 127 Cb 0.07 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 2wk5 h LEU 127 CO -0.14 0.11 -2.16 0.52 0.09 0.00 0.00 178.44 176.86 2wk5 n VAL 128 N -4.45 1.56 -0.31 1.22 0.31 -0.75 -4.47 118.33 111.44 2wk5 n VAL 128 Ca 0.08 -0.38 0.08 0.00 -0.01 0.00 0.00 64.34 64.11 2wk5 n VAL 128 Cb 0.42 -1.79 0.25 0.00 -0.91 0.00 0.00 33.84 31.80 2wk5 n VAL 128 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2wk5 h LEU 129 N -0.62 0.62 0.27 7.52 6.46 -0.47 -2.26 115.31 126.82 2wk5 h LEU 129 Ca -0.56 0.09 -0.01 0.00 -0.12 0.00 0.00 57.88 57.28 2wk5 h LEU 129 Cb 1.67 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 41.59 2wk5 h LEU 129 CO -0.23 0.26 -0.13 0.00 -0.62 0.00 0.00 178.44 177.72 2wk5 h ALA 130 N 1.58 -0.36 -0.29 1.25 0.00 -1.76 -1.77 119.26 117.91 2wk5 h ALA 130 Ca 0.49 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.30 2wk5 h ALA 130 Cb 0.69 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2wk5 h ALA 130 CO -0.36 -0.69 0.10 -1.35 0.00 0.00 0.00 179.25 176.95 2wk5 h PRO 131 N -0.39 0.40 0.33 0.00 0.11 -1.70 -2.32 132.00 128.43 2wk5 h PRO 131 Ca -0.04 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 2wk5 h PRO 131 Cb 0.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.33 2wk5 h PRO 131 CO 0.06 0.35 -0.16 0.00 -0.21 0.00 0.00 178.00 178.04 2wk5 h ALA 132 N 1.71 -0.62 -0.73 -0.75 0.00 -1.24 -2.10 119.26 115.53 2wk5 h ALA 132 Ca 0.10 -0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.08 2wk5 h ALA 132 Cb 0.11 0.17 -0.11 0.00 0.00 0.00 0.00 17.79 17.95 2wk5 h ALA 132 CO -0.01 -0.59 0.14 -0.07 0.00 0.00 0.00 179.25 178.72 2wk5 h LEU 133 N -0.76 -0.06 -2.13 0.00 3.38 -1.36 1.40 115.31 115.77 2wk5 h LEU 133 Ca -0.05 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2wk5 h LEU 133 Cb 0.34 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 2wk5 h LEU 133 CO 0.07 -0.07 -0.02 0.00 0.09 0.00 0.00 178.44 178.51 2wk5 h ALA 134 N 1.63 1.05 0.20 1.53 0.00 -1.50 0.96 119.26 123.12 2wk5 h ALA 134 Ca 0.41 -0.02 -0.31 0.00 0.00 0.00 0.00 54.91 54.99 2wk5 h ALA 134 Cb 0.72 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.53 2wk5 h ALA 134 CO -0.54 0.03 -1.41 0.00 0.00 0.00 0.00 179.25 177.33 2wk5 h ALA 135 N 1.98 -0.03 0.00 0.00 0.00 0.23 -3.22 119.26 118.21 2wk5 h ALA 135 Ca -0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.01 2wk5 h ALA 135 Cb 0.29 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2wk5 h ALA 135 CO 0.00 0.84 0.00 0.00 0.00 0.00 0.00 179.25 180.09 2wk5 n GLY 137 N 0.24 0.09 3.64 0.00 0.00 -1.11 -5.01 105.19 103.03 2wk5 n GLY 137 Ca 0.00 -0.55 -0.23 0.00 0.00 0.00 0.00 46.02 45.24 2wk5 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk5 s LYS 139 N -3.68 2.74 -0.32 0.00 2.47 -1.19 -3.82 119.74 115.94 2wk5 s LYS 139 Ca 0.32 -1.09 0.02 0.00 -1.56 0.00 0.00 55.97 53.67 2wk5 s LYS 139 Cb -0.05 -3.34 0.09 0.00 -1.46 0.00 0.00 37.83 33.06 2wk5 s LYS 139 CO 0.20 -0.57 0.02 0.08 0.16 0.00 0.00 175.35 175.23 2wk5 s VAL 140 N 1.40 2.44 -1.03 4.02 1.01 -0.78 -1.31 120.40 126.13 2wk5 s VAL 140 Ca -0.01 -2.04 -0.02 0.00 0.00 0.00 0.00 61.98 59.92 2wk5 s VAL 140 Cb -0.19 -2.65 0.32 0.00 0.00 0.00 0.00 36.38 33.86 2wk5 s VAL 140 CO 0.01 -0.41 1.74 -0.81 0.00 0.00 0.00 175.10 175.64 2wk5 n PRO 141 N 4.37 5.22 -1.86 2.72 -0.04 -1.26 -1.93 135.00 142.23 2wk5 n PRO 141 Ca -0.03 -4.65 -0.41 0.00 -0.04 0.00 0.00 63.50 58.37 2wk5 n PRO 141 Cb 0.42 -2.47 -0.01 0.00 -0.04 0.00 0.00 33.50 31.39 2wk5 n PRO 141 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 2wk5 s MET 142 N -4.01 4.16 -0.53 0.54 1.75 -0.89 -4.93 119.30 115.39 2wk5 s MET 142 Ca 0.37 2.50 0.04 0.00 -1.25 0.00 0.00 55.69 57.35 2wk5 s MET 142 Cb 0.16 -3.02 0.14 0.00 2.84 0.00 0.00 34.83 34.96 2wk5 s MET 142 CO -0.08 -0.51 0.31 0.42 -0.65 0.00 0.00 175.02 174.51 2wk5 s ILE 143 N -0.58 2.13 0.00 10.11 -1.09 -1.25 -1.24 121.20 129.27 2wk5 s ILE 143 Ca 0.57 -3.26 0.00 0.00 -2.23 0.00 0.00 60.65 55.73 2wk5 s ILE 143 Cb -0.46 -2.46 0.00 0.00 -1.58 0.00 0.00 42.46 37.97 2wk5 s ILE 143 CO 0.54 -0.91 0.00 -1.20 -1.23 0.00 0.00 174.94 172.14 2wk5 n SER 144 N 2.96 0.00 -3.90 3.58 7.64 -1.02 -4.90 113.62 117.97 2wk5 n SER 144 Ca 0.11 -0.02 -0.09 0.00 1.01 0.00 0.00 58.87 59.88 2wk5 n SER 144 Cb 0.35 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.49 2wk5 n SER 144 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2wk5 s GLY 145 N -1.04 0.30 0.70 0.23 0.00 -1.26 -4.48 107.32 101.77 2wk5 s GLY 145 Ca 0.00 -0.65 -0.08 0.00 0.00 0.00 0.00 44.72 43.99 2wk5 s GLY 145 CO 0.00 -0.55 0.95 0.54 0.00 0.00 0.00 173.10 174.04 2wk5 n ARG 146 N -0.33 -0.63 -1.66 2.90 1.74 -1.26 -2.86 116.66 114.56 2wk5 n ARG 146 Ca -0.06 -1.81 -0.42 0.00 -0.77 0.00 0.00 57.85 54.79 2wk5 n ARG 146 Cb 0.62 -0.87 -0.00 0.00 -1.02 0.00 0.00 32.46 31.19 2wk5 n ARG 146 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wk5 n GLY 147 N -1.52 0.29 3.10 -0.13 0.00 -1.26 -4.15 105.19 101.52 2wk5 n GLY 147 Ca 0.13 0.26 -0.33 0.00 0.00 0.00 0.00 46.02 46.08 2wk5 n GLY 147 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wk5 s LEU 148 N -0.83 3.59 0.00 0.99 2.96 -0.81 -4.78 118.68 119.81 2wk5 s LEU 148 Ca 0.59 -1.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.12 2wk5 s LEU 148 Cb -0.57 -1.60 0.00 0.00 0.50 0.00 0.00 46.19 44.52 2wk5 s LEU 148 CO 0.60 -0.21 0.00 0.61 -1.32 0.00 0.00 176.35 176.03 2wk5 n GLY 149 N 4.48 1.36 0.20 7.98 0.00 -1.22 -1.59 105.19 116.41 2wk5 n GLY 149 Ca -0.14 0.16 0.02 0.00 0.00 0.00 0.00 46.02 46.06 2wk5 n GLY 149 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2wk5 n HIS 150 N 0.00 0.07 -3.35 1.61 1.44 -1.26 -4.83 115.22 108.90 2wk5 n HIS 150 Ca 0.00 -0.20 -0.46 0.00 -2.01 0.00 0.00 57.72 55.06 2wk5 n HIS 150 Cb 0.00 -0.02 -0.04 0.00 0.12 0.00 0.00 29.99 30.05 2wk5 n HIS 150 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 2wk5 s THR 151 N -0.61 5.26 0.26 0.61 -4.23 -0.62 -4.83 115.64 111.48 2wk5 s THR 151 Ca 0.06 -1.95 -0.10 0.00 -1.18 0.00 0.00 61.69 58.53 2wk5 s THR 151 Cb 0.04 -4.32 -0.08 0.00 1.34 0.00 0.00 72.50 69.48 2wk5 s THR 151 CO 0.06 -0.93 -0.06 0.61 -0.54 0.00 0.00 174.62 173.76 2wk5 n GLY 152 N 4.66 -1.68 3.44 3.99 0.00 -1.26 -1.92 105.19 112.43 2wk5 n GLY 152 Ca -0.02 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 2wk5 n GLY 152 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wk5 s GLY 153 N -0.53 1.73 0.10 -0.02 0.00 -1.26 -4.49 107.32 102.86 2wk5 s GLY 153 Ca 0.30 -1.02 0.05 0.00 0.00 0.00 0.00 44.72 44.05 2wk5 s GLY 153 CO 0.35 0.30 1.07 -1.30 0.00 0.00 0.00 173.10 173.52 2wk5 n THR 154 N 4.39 1.33 0.07 0.90 -2.24 -1.21 -0.85 114.28 116.67 2wk5 n THR 154 Ca -0.17 0.58 -0.22 0.00 -2.27 0.00 0.00 64.05 61.96 2wk5 n THR 154 Cb 0.52 -1.58 -0.15 0.00 -2.10 0.00 0.00 70.33 67.02 2wk5 n THR 154 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2wk5 h LEU 155 N 0.00 0.58 -0.87 3.22 3.38 -1.88 -2.82 115.31 116.93 2wk5 h LEU 155 Ca 0.00 -0.91 -0.07 0.00 0.09 0.00 0.00 57.88 56.98 2wk5 h LEU 155 Cb 0.25 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2wk5 h LEU 155 CO 0.00 1.65 0.04 0.44 0.09 0.00 0.00 178.44 180.67 2wk5 h ASP 156 N -0.09 0.85 -1.00 -0.43 3.32 -1.25 -2.29 116.42 115.52 2wk5 h ASP 156 Ca -0.28 -0.20 0.08 0.00 0.02 0.00 0.00 57.03 56.65 2wk5 h ASP 156 Cb 1.94 -0.22 -0.07 0.00 0.22 0.00 0.00 39.33 41.19 2wk5 h ASP 156 CO 0.16 0.88 0.65 0.11 -1.72 0.00 0.00 179.24 179.32 2wk5 h LYS 157 N 0.83 1.11 0.00 3.56 1.57 -1.36 -1.46 116.57 120.82 2wk5 h LYS 157 Ca 0.16 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 58.76 2wk5 h LYS 157 Cb 0.43 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 2wk5 h LYS 157 CO 0.02 0.74 -0.56 -0.07 -0.57 0.00 0.00 179.45 179.00 2wk5 h LEU 158 N 1.15 0.00 -0.11 2.94 3.38 -1.16 -2.96 115.31 118.54 2wk5 h LEU 158 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 2wk5 h LEU 158 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2wk5 h LEU 158 CO -0.19 0.56 0.00 -0.62 0.09 0.00 0.00 178.44 178.28 2wk5 n GLU 159 N -3.62 0.54 0.06 1.13 1.02 -0.55 -1.65 120.64 117.56 2wk5 n GLU 159 Ca -0.01 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.06 2wk5 n GLU 159 Cb 0.61 -1.03 -0.12 0.00 -0.02 0.00 0.00 31.44 30.88 2wk5 n GLU 159 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 2wk5 h SER 160 N 0.05 0.01 -3.35 1.62 0.02 -1.56 -3.42 113.55 106.92 2wk5 h SER 160 Ca 0.00 -0.01 -0.59 0.00 -0.84 0.00 0.00 61.79 60.35 2wk5 h SER 160 Cb 0.03 -0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.48 2wk5 h SER 160 CO 0.00 1.01 0.60 -0.63 -1.14 0.00 0.00 176.83 176.67 2wk5 s ILE 161 N -2.70 4.69 0.19 3.27 1.01 -0.66 -4.55 121.20 122.45 2wk5 s ILE 161 Ca 0.00 1.48 -0.32 0.00 0.00 0.00 0.00 60.65 61.82 2wk5 s ILE 161 Cb 0.10 -4.26 -0.11 0.00 0.01 0.00 0.00 42.46 38.20 2wk5 s ILE 161 CO 0.82 -0.31 1.63 -2.16 0.00 0.00 0.00 174.94 174.92 2wk5 s PRO 162 N 3.22 4.17 0.00 2.79 0.04 -1.26 -2.32 135.00 141.64 2wk5 s PRO 162 Ca 0.38 2.47 0.00 0.00 0.04 0.00 0.00 61.00 63.89 2wk5 s PRO 162 Cb -0.14 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2wk5 s PRO 162 CO 0.12 -0.66 0.00 0.41 0.04 0.00 0.00 177.00 176.92 2wk5 n GLY 163 N 3.67 3.31 3.76 0.56 0.00 -1.26 -4.54 105.19 110.69 2wk5 n GLY 163 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2wk5 n GLY 163 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wk5 s PHE 164 N -2.97 2.38 -0.10 1.61 2.19 -0.98 -3.40 117.98 116.71 2wk5 s PHE 164 Ca 0.00 1.30 0.01 0.00 0.33 0.00 0.00 56.93 58.57 2wk5 s PHE 164 Cb 0.00 -3.88 0.02 0.00 -1.31 0.00 0.00 43.02 37.84 2wk5 s PHE 164 CO 0.00 -2.95 -0.13 1.21 1.83 0.00 0.00 175.22 175.19 2wk5 s ASN 165 N -0.67 2.24 0.00 6.13 3.84 0.58 -4.91 114.94 122.16 2wk5 s ASN 165 Ca 0.65 -0.37 0.25 0.00 0.21 0.00 0.00 52.86 53.59 2wk5 s ASN 165 Cb -0.43 -0.98 0.39 0.00 -0.55 0.00 0.00 41.25 39.68 2wk5 s ASN 165 CO 0.53 -0.01 1.36 1.33 -2.79 0.00 0.00 177.10 177.52 2wk5 n VAL 166 N 4.30 0.00 -3.61 -5.21 0.24 -1.26 -4.76 118.33 108.03 2wk5 n VAL 166 Ca -0.18 -0.37 -0.40 0.00 -2.04 0.00 0.00 64.34 61.34 2wk5 n VAL 166 Cb 0.51 1.15 -0.10 0.00 -1.47 0.00 0.00 33.84 33.93 2wk5 n VAL 166 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2wk5 s ILE 167 N -2.12 4.27 -0.03 1.34 1.09 -1.26 0.25 121.20 124.73 2wk5 s ILE 167 Ca 0.28 -1.30 0.03 0.00 -1.10 0.00 0.00 60.65 58.56 2wk5 s ILE 167 Cb 0.20 -3.57 0.00 0.00 -1.06 0.00 0.00 42.46 38.04 2wk5 s ILE 167 CO 0.37 -0.45 -0.11 -1.10 -0.10 0.00 0.00 174.94 173.56 2wk5 s GLN 168 N 1.45 1.18 0.59 2.79 -1.52 -1.26 -5.06 119.66 117.83 2wk5 s GLN 168 Ca 0.03 -0.37 -0.09 0.00 -1.95 0.00 0.00 55.36 52.98 2wk5 s GLN 168 Cb -0.22 -1.07 -0.02 0.00 -0.22 0.00 0.00 33.01 31.47 2wk5 s GLN 168 CO 0.03 0.13 0.96 -1.54 -0.25 0.00 0.00 175.29 174.62 2wk5 s SER 169 N 0.21 6.01 0.44 5.90 1.04 -1.26 -4.83 113.70 121.21 2wk5 s SER 169 Ca -0.04 1.14 0.27 0.00 0.48 0.00 0.00 55.95 57.79 2wk5 s SER 169 Cb -0.10 -2.21 1.32 0.00 0.10 0.00 0.00 66.02 65.14 2wk5 s SER 169 CO 0.01 -0.90 1.71 -0.65 0.98 0.00 0.00 173.24 174.39 2wk5 h PRO 170 N -0.21 0.19 0.35 4.02 0.11 -1.98 0.22 132.00 134.70 2wk5 h PRO 170 Ca -0.45 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 2wk5 h PRO 170 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2wk5 h PRO 170 CO 0.62 0.13 -0.17 0.93 -0.21 0.00 0.00 178.00 179.30 2wk5 h GLU 171 N 0.20 -0.45 -0.92 1.05 3.07 -2.01 -2.55 114.58 112.97 2wk5 h GLU 171 Ca 0.69 0.03 0.18 0.00 -0.50 0.00 0.00 59.36 59.76 2wk5 h GLU 171 Cb 2.13 0.10 -0.08 0.00 -0.84 0.00 0.00 28.75 30.07 2wk5 h GLU 171 CO -0.29 -0.15 0.59 1.96 -1.40 0.00 0.00 179.01 179.72 2wk5 h GLN 172 N -0.77 0.57 0.00 2.33 4.20 -0.98 -0.94 115.11 119.52 2wk5 h GLN 172 Ca -0.05 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 2wk5 h GLN 172 Cb 0.51 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 2wk5 h GLN 172 CO 0.08 0.38 -0.19 0.52 -0.67 0.00 0.00 178.83 178.94 2wk5 h MET 173 N 0.59 0.00 -0.06 1.46 2.86 -0.84 -2.60 114.93 116.34 2wk5 h MET 173 Ca 0.48 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.96 2wk5 h MET 173 Cb 0.95 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 2wk5 h MET 173 CO -0.23 0.19 -0.69 -0.56 1.06 0.00 0.00 176.91 176.69 2wk5 h GLN 174 N 0.00 0.28 -0.40 1.72 -0.00 -0.77 -1.59 115.11 114.36 2wk5 h GLN 174 Ca -0.00 -0.22 -0.07 0.00 -0.00 0.00 0.00 58.65 58.35 2wk5 h GLN 174 Cb 0.35 0.04 -0.01 0.00 -0.00 0.00 0.00 27.48 27.86 2wk5 h GLN 174 CO 0.03 0.86 -0.05 -0.24 -0.00 0.00 0.00 178.83 179.43 2wk5 h VAL 175 N 0.20 1.27 0.32 1.86 3.04 -1.47 -2.55 116.25 118.91 2wk5 h VAL 175 Ca -0.02 -1.09 -0.01 0.00 -1.01 0.00 0.00 66.70 64.56 2wk5 h VAL 175 Cb 1.24 1.18 -0.01 0.00 -2.01 0.00 0.00 31.29 31.69 2wk5 h VAL 175 CO 0.11 0.37 -0.25 -0.07 -1.01 0.00 0.00 177.57 176.72 2wk5 h LEU 176 N 0.55 -0.65 -2.09 3.16 -0.00 -1.25 0.71 115.31 115.74 2wk5 h LEU 176 Ca 0.11 0.05 0.09 0.00 -0.00 0.00 0.00 57.88 58.12 2wk5 h LEU 176 Cb 0.54 0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 41.40 2wk5 h LEU 176 CO 0.03 -0.35 0.26 -0.07 -0.00 0.00 0.00 178.44 178.30 2wk5 h LEU 177 N -0.54 0.00 0.54 1.67 3.38 -1.37 0.21 115.31 119.19 2wk5 h LEU 177 Ca -0.04 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2wk5 h LEU 177 Cb 0.45 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.21 2wk5 h LEU 177 CO 0.01 0.00 -0.26 -0.78 0.09 0.00 0.00 178.44 177.50 2wk5 h ASP 178 N 0.00 -0.61 -0.04 -0.43 3.58 -1.03 -1.09 116.42 116.80 2wk5 h ASP 178 Ca 0.14 0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.57 2wk5 h ASP 178 Cb 0.65 0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.86 2wk5 h ASP 178 CO -0.00 -0.24 -0.13 1.56 -2.88 0.00 0.00 179.24 177.55 2wk5 h GLN 179 N -1.12 0.16 0.00 0.28 4.20 -0.47 -3.37 115.11 114.79 2wk5 h GLN 179 Ca -0.07 -0.12 -0.22 0.00 0.06 0.00 0.00 58.65 58.30 2wk5 h GLN 179 Cb 0.55 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 2wk5 h GLN 179 CO 0.12 0.74 -2.22 0.00 -0.67 0.00 0.00 178.83 176.81 2wk5 n ALA 180 N -2.45 2.02 -0.91 3.87 0.00 0.53 -4.97 120.51 118.59 2wk5 n ALA 180 Ca -0.08 -1.00 0.00 0.00 0.00 0.00 0.00 53.44 52.36 2wk5 n ALA 180 Cb 0.38 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.44 2wk5 n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wk5 n GLY 181 N 1.58 0.76 3.49 0.00 0.00 -0.01 -4.82 105.19 106.19 2wk5 n GLY 181 Ca -0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 2wk5 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk5 s ILE 184 N -3.80 -0.42 0.04 0.00 1.01 -1.26 -2.11 121.20 114.68 2wk5 s ILE 184 Ca 0.10 0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.82 2wk5 s ILE 184 Cb -0.05 -0.57 -0.01 0.00 0.01 0.00 0.00 42.46 41.84 2wk5 s ILE 184 CO 0.04 -0.01 0.08 0.68 0.00 0.00 0.00 174.94 175.73 2wk5 s VAL 185 N 2.41 0.14 0.28 2.92 -7.23 -0.38 -4.76 120.40 113.80 2wk5 s VAL 185 Ca 0.04 -1.18 0.01 0.00 -1.81 0.00 0.00 61.98 59.04 2wk5 s VAL 185 Cb -0.14 -0.99 0.05 0.00 0.56 0.00 0.00 36.38 35.87 2wk5 s VAL 185 CO -0.11 -0.65 0.39 0.61 -0.31 0.00 0.00 175.10 175.03 2wk5 n GLY 186 N 0.65 1.12 3.71 2.32 0.00 0.14 -2.43 105.19 110.70 2wk5 n GLY 186 Ca -0.18 -2.05 -0.39 0.00 0.00 0.00 0.00 46.02 43.40 2wk5 n GLY 186 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wk5 n GLN 187 N -1.69 1.56 -3.92 1.61 3.00 -1.26 -4.82 117.38 111.86 2wk5 n GLN 187 Ca 0.07 0.57 -0.11 0.00 -0.01 0.00 0.00 57.00 57.52 2wk5 n GLN 187 Cb 0.25 -2.47 0.00 0.00 0.00 0.00 0.00 30.24 28.02 2wk5 n GLN 187 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2wk5 s SER 188 N -0.93 0.39 0.34 1.08 1.04 -0.36 -4.95 113.70 110.30 2wk5 s SER 188 Ca 0.71 -1.30 0.13 0.00 0.48 0.00 0.00 55.95 55.97 2wk5 s SER 188 Cb -0.43 0.79 1.06 0.00 0.10 0.00 0.00 66.02 67.53 2wk5 s SER 188 CO 0.50 -1.55 1.62 -0.33 0.98 0.00 0.00 173.24 174.46 2wk5 h GLU 189 N 2.03 0.15 0.00 4.02 4.39 -1.95 -2.38 114.58 120.85 2wk5 h GLU 189 Ca -0.31 -0.01 -0.23 0.00 0.34 0.00 0.00 59.36 59.15 2wk5 h GLU 189 Cb 1.25 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.82 2wk5 h GLU 189 CO 0.40 0.10 -2.11 1.04 -1.16 0.00 0.00 179.01 177.28 2wk5 n GLN 190 N -5.21 0.97 -3.52 2.33 6.02 -1.26 -4.68 117.38 112.03 2wk5 n GLN 190 Ca 0.31 -0.06 -0.39 0.00 -0.01 0.00 0.00 57.00 56.85 2wk5 n GLN 190 Cb 1.00 -1.45 -0.10 0.00 1.02 0.00 0.00 30.24 30.70 2wk5 n GLN 190 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2wk5 s LEU 191 N -5.02 4.28 -0.75 1.08 1.43 -0.89 0.18 118.68 118.98 2wk5 s LEU 191 Ca -0.08 -0.17 -0.19 0.00 -1.03 0.00 0.00 54.13 52.66 2wk5 s LEU 191 Cb 0.07 -2.19 0.03 0.00 0.03 0.00 0.00 46.19 44.12 2wk5 s LEU 191 CO 0.74 -0.18 0.36 1.33 0.23 0.00 0.00 176.35 178.83 2wk5 n VAL 192 N 5.11 -1.44 -0.32 -1.59 0.24 -1.26 -1.22 118.33 117.85 2wk5 n VAL 192 Ca -0.12 -0.35 0.10 0.00 -2.04 0.00 0.00 64.34 61.93 2wk5 n VAL 192 Cb 0.51 -1.24 0.31 0.00 -1.47 0.00 0.00 33.84 31.94 2wk5 n VAL 192 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 2wk5 h PRO 193 N -0.39 0.82 -0.46 7.34 0.11 -1.81 -2.39 132.00 135.22 2wk5 h PRO 193 Ca -0.43 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.51 2wk5 h PRO 193 Cb 0.84 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.75 2wk5 h PRO 193 CO 0.32 0.55 -0.18 0.00 -0.21 0.00 0.00 178.00 178.48 2wk5 h ALA 194 N 1.57 0.64 -0.41 -0.75 0.00 -1.87 -3.13 119.26 115.32 2wk5 h ALA 194 Ca 0.48 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2wk5 h ALA 194 Cb 0.62 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2wk5 h ALA 194 CO -0.25 0.60 -0.06 0.22 0.00 0.00 0.00 179.25 179.76 2wk5 h ASP 195 N 0.78 0.67 0.03 0.00 -0.00 -1.71 -2.40 116.42 113.78 2wk5 h ASP 195 Ca 0.11 -0.17 -0.02 0.00 -0.00 0.00 0.00 57.03 56.95 2wk5 h ASP 195 Cb 0.75 -0.18 -0.01 0.00 -0.00 0.00 0.00 39.33 39.90 2wk5 h ASP 195 CO 0.06 0.78 -0.06 1.23 -0.00 0.00 0.00 179.24 181.25 2wk5 h GLY 196 N 0.96 0.09 1.41 -0.78 0.00 -1.45 0.30 103.07 103.60 2wk5 h GLY 196 Ca 0.12 -0.04 -0.27 0.00 0.00 0.00 0.00 47.33 47.13 2wk5 h GLY 196 CO 0.03 0.04 -1.16 -2.22 0.00 0.00 0.00 176.54 173.22 2wk5 h ILE 197 N 0.08 1.36 0.00 2.60 2.04 -1.42 -2.77 117.51 119.41 2wk5 h ILE 197 Ca 0.02 -2.59 -0.00 0.00 1.00 0.00 0.00 64.86 63.29 2wk5 h ILE 197 Cb 0.16 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 2wk5 h ILE 197 CO 0.01 0.78 -0.00 -0.07 0.00 0.00 0.00 178.15 178.86 2wk5 h LEU 198 N 0.22 -0.00 -0.46 1.44 3.38 -1.20 -2.94 115.31 115.75 2wk5 h LEU 198 Ca -0.15 -0.91 0.05 0.00 0.09 0.00 0.00 57.88 56.97 2wk5 h LEU 198 Cb 1.84 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.51 2wk5 h LEU 198 CO 0.21 0.92 -0.51 0.22 0.09 0.00 0.00 178.44 179.37 2wk5 h TYR 199 N -0.94 -1.58 -1.00 1.13 5.03 -0.53 0.94 116.97 120.02 2wk5 h TYR 199 Ca -0.00 0.08 0.22 0.00 2.58 0.00 0.00 58.73 61.61 2wk5 h TYR 199 Cb 0.91 0.75 -0.10 0.00 1.55 0.00 0.00 36.73 39.84 2wk5 h TYR 199 CO 0.25 -0.43 0.62 0.00 -1.32 0.00 0.00 178.16 177.29 2wk5 h ALA 200 N -0.08 1.95 0.11 1.82 0.00 -1.61 -2.14 119.26 119.31 2wk5 h ALA 200 Ca 0.08 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2wk5 h ALA 200 Cb 0.51 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2wk5 h ALA 200 CO -0.59 -0.32 -0.05 0.00 0.00 0.00 0.00 179.25 178.28 2wk5 h ALA 201 N 1.64 -0.15 -0.92 0.00 0.00 -0.29 -3.29 119.26 116.25 2wk5 h ALA 201 Ca 0.57 -0.25 0.25 0.00 0.00 0.00 0.00 54.91 55.48 2wk5 h ALA 201 Cb 1.16 0.06 -0.16 0.00 0.00 0.00 0.00 17.79 18.84 2wk5 h ALA 201 CO -0.33 -0.23 0.08 0.00 0.00 0.00 0.00 179.25 178.77 2wk5 h ARG 202 N -0.86 0.07 -0.84 0.00 3.08 0.13 -1.53 114.38 114.42 2wk5 h ARG 202 Ca -0.02 -0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.16 2wk5 h ARG 202 Cb 0.55 -0.02 -0.14 0.00 0.08 0.00 0.00 29.97 30.45 2wk5 h ARG 202 CO 0.03 0.04 -0.39 0.22 -1.07 0.00 0.00 179.97 178.80 2wk5 h ASP 203 N 0.07 -1.41 -0.58 7.04 3.58 -1.48 -2.16 116.42 121.48 2wk5 h ASP 203 Ca 0.56 0.28 -0.29 0.00 0.42 0.00 0.00 57.03 58.00 2wk5 h ASP 203 Cb 1.13 0.71 -0.17 0.00 1.72 0.00 0.00 39.33 42.72 2wk5 h ASP 203 CO -0.81 -0.29 0.18 1.33 -2.88 0.00 0.00 179.24 176.76 2wk5 n VAL 204 N -5.44 2.78 -0.53 2.25 0.24 -0.60 -3.43 118.33 113.60 2wk5 n VAL 204 Ca 0.07 -2.40 0.00 0.00 -2.04 0.00 0.00 64.34 59.98 2wk5 n VAL 204 Cb 0.37 -0.37 0.01 0.00 -1.47 0.00 0.00 33.84 32.38 2wk5 n VAL 204 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2wk5 n THR 205 N -1.07 0.60 -1.42 3.34 -1.04 -0.82 -4.98 114.28 108.90 2wk5 n THR 205 Ca 0.42 -0.62 -0.15 0.00 -2.04 0.00 0.00 64.05 61.66 2wk5 n THR 205 Cb 1.26 0.66 -0.06 0.00 -1.82 0.00 0.00 70.33 70.37 2wk5 n THR 205 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wk5 n ALA 206 N -0.33 -0.23 -1.16 2.41 0.00 -1.20 -4.81 120.51 115.20 2wk5 n ALA 206 Ca 0.01 0.24 -0.03 0.00 0.00 0.00 0.00 53.44 53.66 2wk5 n ALA 206 Cb 0.39 -1.81 0.25 0.00 0.00 0.00 0.00 19.45 18.28 2wk5 n ALA 206 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wk5 n THR 207 N -2.19 2.68 0.04 0.00 -2.24 -1.19 -4.64 114.28 106.74 2wk5 n THR 207 Ca -0.15 -2.03 -0.20 0.00 -2.27 0.00 0.00 64.05 59.40 2wk5 n THR 207 Cb 0.60 -0.33 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 2wk5 n THR 207 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2wk5 h VAL 208 N 1.84 1.28 -0.96 2.28 2.07 -1.87 -3.40 116.25 117.49 2wk5 h VAL 208 Ca 0.21 -2.23 -0.74 0.00 0.82 0.00 0.00 66.70 64.77 2wk5 h VAL 208 Cb 1.96 2.35 -0.12 0.00 -1.52 0.00 0.00 31.29 33.96 2wk5 h VAL 208 CO 0.54 0.69 2.36 -0.90 0.02 0.00 0.00 177.57 180.28 2wk5 n ASP 209 N -3.86 4.71 -3.96 0.57 5.75 -1.26 -4.65 116.55 113.84 2wk5 n ASP 209 Ca -0.11 -3.02 -0.29 0.00 -0.01 0.00 0.00 54.79 51.36 2wk5 n ASP 209 Cb 0.87 -1.54 -0.16 0.00 -1.03 0.00 0.00 41.12 39.26 2wk5 n ASP 209 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2wk5 s SER 210 N 1.71 2.76 0.17 -1.12 0.15 -1.26 -5.02 113.70 111.09 2wk5 s SER 210 Ca 0.42 -0.57 -0.23 0.00 0.70 0.00 0.00 55.95 56.27 2wk5 s SER 210 Cb 0.11 -1.06 0.07 0.00 -1.71 0.00 0.00 66.02 63.42 2wk5 s SER 210 CO -0.02 -0.12 1.58 0.25 1.20 0.00 0.00 173.24 176.13 2wk5 h LEU 211 N 8.08 -1.24 0.51 3.45 6.46 -1.97 0.41 115.31 131.00 2wk5 h LEU 211 Ca -0.31 0.22 -0.02 0.00 -0.12 0.00 0.00 57.88 57.65 2wk5 h LEU 211 Cb 1.12 0.58 -0.01 0.00 -0.73 0.00 0.00 40.66 41.62 2wk5 h LEU 211 CO 0.46 -0.33 -0.35 1.55 -0.62 0.00 0.00 178.44 179.15 2wk5 h PRO 212 N -0.23 -0.81 -1.00 5.25 0.13 -1.95 0.12 132.00 133.50 2wk5 h PRO 212 Ca 0.19 0.05 0.13 0.00 -0.87 0.00 0.00 66.00 65.51 2wk5 h PRO 212 Cb 0.56 0.18 -0.09 0.00 0.13 0.00 0.00 31.00 31.78 2wk5 h PRO 212 CO -0.62 -0.54 0.63 -0.07 -0.23 0.00 0.00 178.00 177.17 2wk5 h LEU 213 N -0.84 0.89 -0.45 1.56 3.38 -1.79 0.51 115.31 118.56 2wk5 h LEU 213 Ca -0.06 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2wk5 h LEU 213 Cb 0.70 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 2wk5 h LEU 213 CO 0.03 0.44 0.09 0.40 0.09 0.00 0.00 178.44 179.49 2wk5 h ILE 214 N 0.94 1.24 0.06 1.22 2.04 0.05 0.94 117.51 124.01 2wk5 h ILE 214 Ca 0.51 -0.87 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 2wk5 h ILE 214 Cb 0.58 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2wk5 h ILE 214 CO -0.28 0.31 -0.03 0.74 0.00 0.00 0.00 178.15 178.88 2wk5 h THR 215 N 0.61 1.03 0.15 -0.27 2.02 0.14 -1.60 112.91 114.99 2wk5 h THR 215 Ca 0.14 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 2wk5 h THR 215 Cb 0.36 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 2wk5 h THR 215 CO 0.01 0.08 -0.07 0.00 0.37 0.00 0.00 175.52 175.90 2wk5 h ALA 216 N 0.71 -0.21 -0.29 6.16 0.00 0.03 -0.80 119.26 124.86 2wk5 h ALA 216 Ca -0.01 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.87 2wk5 h ALA 216 Cb 0.19 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 2wk5 h ALA 216 CO 0.01 -0.55 -0.17 1.03 0.00 0.00 0.00 179.25 179.58 2wk5 h SER 217 N -0.33 -0.56 0.60 0.00 0.87 -0.82 0.18 113.55 113.49 2wk5 h SER 217 Ca -0.02 0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 2wk5 h SER 217 Cb 0.26 0.29 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 2wk5 h SER 217 CO 0.03 -0.20 -0.33 0.40 -0.53 0.00 0.00 176.83 176.20 2wk5 h ILE 218 N -0.14 0.32 -0.24 2.23 2.04 -1.19 -3.17 117.51 117.38 2wk5 h ILE 218 Ca 0.15 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.93 2wk5 h ILE 218 Cb 0.37 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2wk5 h ILE 218 CO -0.37 0.00 -0.16 -0.07 0.00 0.00 0.00 178.15 177.55 2wk5 h LEU 219 N -0.87 0.55 -0.99 1.44 3.38 -0.98 -3.03 115.31 114.80 2wk5 h LEU 219 Ca -0.08 -0.43 0.29 0.00 0.09 0.00 0.00 57.88 57.75 2wk5 h LEU 219 Cb 0.69 -0.15 -0.14 0.00 0.09 0.00 0.00 40.66 41.14 2wk5 h LEU 219 CO 0.10 0.87 0.56 0.77 0.09 0.00 0.00 178.44 180.83 2wk5 h SER 220 N 0.24 0.53 0.53 -0.43 4.64 -0.72 1.61 113.55 119.96 2wk5 h SER 220 Ca 0.05 0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 61.52 2wk5 h SER 220 Cb 0.68 0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.89 2wk5 h SER 220 CO 0.04 -0.06 -0.26 0.11 -0.87 0.00 0.00 176.83 175.80 2wk5 h LYS 221 N 0.40 -0.69 0.00 4.77 1.57 -1.50 -3.18 116.57 117.94 2wk5 h LYS 221 Ca 0.69 0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 59.50 2wk5 h LYS 221 Cb 1.49 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.96 2wk5 h LYS 221 CO -0.57 -0.38 -0.10 0.87 -0.57 0.00 0.00 179.45 178.70 2wk5 h LYS 222 N -1.02 0.00 0.00 3.15 1.79 -0.93 -2.77 116.57 116.79 2wk5 h LYS 222 Ca -0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 2wk5 h LYS 222 Cb 0.62 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.27 2wk5 h LYS 222 CO 0.12 0.10 0.00 -0.11 -1.08 0.00 0.00 179.45 178.48 2wk5 n LEU 223 N -3.32 0.00 0.00 2.94 0.00 0.53 -3.14 117.00 114.01 2wk5 n LEU 223 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.00 2wk5 n LEU 223 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.72 2wk5 n LEU 223 CO 0.29 0.00 0.08 0.55 0.00 0.00 0.00 177.39 178.31 2wk5 n VAL 224 N -0.72 0.03 0.20 1.96 3.14 -1.05 -4.68 118.33 117.21 2wk5 n VAL 224 Ca 0.08 -0.11 0.12 0.00 -2.96 0.00 0.00 64.34 61.46 2wk5 n VAL 224 Cb 0.04 1.69 0.08 0.00 -1.06 0.00 0.00 33.84 34.58 2wk5 n VAL 224 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 2wk5 h GLU 225 N 0.00 0.00 -4.04 1.45 5.08 -1.61 -3.18 114.58 112.28 2wk5 h GLU 225 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wk5 h GLU 225 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2wk5 h GLU 225 CO 0.00 0.00 -0.13 0.41 -1.00 0.00 0.00 179.01 178.29 2wk5 n GLY 226 N 1.18 -0.87 3.58 -3.84 0.00 -1.26 -4.87 105.19 99.11 2wk5 n GLY 226 Ca 0.02 0.34 -0.31 0.00 0.00 0.00 0.00 46.02 46.07 2wk5 n GLY 226 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wk5 s LEU 227 N -2.21 3.10 -0.01 0.99 1.43 -1.26 -4.79 118.68 115.94 2wk5 s LEU 227 Ca 0.07 -0.23 -0.23 0.00 -1.03 0.00 0.00 54.13 52.71 2wk5 s LEU 227 Cb -0.02 -1.82 -0.19 0.00 0.03 0.00 0.00 46.19 44.19 2wk5 s LEU 227 CO 0.34 0.25 1.20 -1.28 0.23 0.00 0.00 176.35 177.09 2wk5 h SER 228 N 4.24 0.25 -3.53 2.29 0.87 0.05 -3.44 113.55 114.29 2wk5 h SER 228 Ca -0.48 -0.61 -0.27 0.00 -1.23 0.00 0.00 61.79 59.20 2wk5 h SER 228 Cb 1.17 -0.07 -0.32 0.00 -0.44 0.00 0.00 62.40 62.73 2wk5 h SER 228 CO 0.53 0.82 -0.68 0.00 -0.53 0.00 0.00 176.83 176.97 2wk5 s ALA 229 N -3.79 -0.05 -0.08 6.23 0.00 -1.26 -4.46 121.76 118.36 2wk5 s ALA 229 Ca -0.15 0.39 0.05 0.00 0.00 0.00 0.00 51.96 52.24 2wk5 s ALA 229 Cb 0.03 -0.28 -0.00 0.00 0.00 0.00 0.00 23.12 22.86 2wk5 s ALA 229 CO 0.74 -0.11 -0.23 -1.17 0.00 0.00 0.00 175.76 174.99 2wk5 s LEU 230 N 0.94 2.03 -0.12 0.00 1.98 -0.86 -2.79 118.68 119.85 2wk5 s LEU 230 Ca -0.08 -0.51 0.01 0.00 -2.89 0.00 0.00 54.13 50.66 2wk5 s LEU 230 Cb -0.11 -1.31 -0.01 0.00 0.66 0.00 0.00 46.19 45.42 2wk5 s LEU 230 CO -0.03 0.17 -0.15 -0.69 -1.89 0.00 0.00 176.35 173.76 2wk5 s VAL 231 N 0.19 2.90 -0.17 1.68 1.01 -0.69 -1.34 120.40 123.98 2wk5 s VAL 231 Ca -0.13 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.12 2wk5 s VAL 231 Cb -0.16 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 2wk5 s VAL 231 CO 0.06 0.53 -0.11 -0.69 0.00 0.00 0.00 175.10 174.90 2wk5 s VAL 232 N 0.34 3.05 -0.54 2.92 1.01 -0.22 -1.68 120.40 125.27 2wk5 s VAL 232 Ca -0.12 -0.63 -0.22 0.00 0.00 0.00 0.00 61.98 61.01 2wk5 s VAL 232 Cb -0.16 -2.32 0.05 0.00 0.00 0.00 0.00 36.38 33.95 2wk5 s VAL 232 CO 0.06 0.49 0.79 -0.62 0.00 0.00 0.00 175.10 175.83 2wk5 s ASP 233 N 0.86 6.27 -0.20 3.32 2.15 -0.46 -1.92 116.67 126.69 2wk5 s ASP 233 Ca -0.03 -0.70 -0.16 0.00 0.43 0.00 0.00 52.55 52.09 2wk5 s ASP 233 Cb -0.15 -2.36 -0.04 0.00 -0.30 0.00 0.00 42.92 40.07 2wk5 s ASP 233 CO 0.00 -1.09 0.41 -0.69 -0.17 0.00 0.00 175.17 173.63 2wk5 s VAL 234 N 3.33 5.19 0.11 1.11 1.01 -0.24 -1.82 120.40 129.09 2wk5 s VAL 234 Ca 0.22 0.74 -0.09 0.00 0.00 0.00 0.00 61.98 62.85 2wk5 s VAL 234 Cb -0.16 -3.74 -0.06 0.00 0.00 0.00 0.00 36.38 32.42 2wk5 s VAL 234 CO 0.15 0.25 0.42 -0.54 0.00 0.00 0.00 175.10 175.37 2wk5 s LYS 235 N 1.31 3.75 -0.05 2.72 -0.14 -1.26 -2.15 119.74 123.91 2wk5 s LYS 235 Ca 0.20 0.15 -0.03 0.00 -1.36 0.00 0.00 55.97 54.92 2wk5 s LYS 235 Cb -0.15 -2.93 0.03 0.00 -1.68 0.00 0.00 37.83 33.10 2wk5 s LYS 235 CO 0.08 0.51 0.12 -0.59 -0.76 0.00 0.00 175.35 174.71 2wk5 s PHE 236 N -1.50 -0.13 0.00 3.18 -0.12 -0.97 -4.60 117.98 113.84 2wk5 s PHE 236 Ca 0.36 0.37 0.00 0.00 -0.05 0.00 0.00 56.93 57.62 2wk5 s PHE 236 Cb -0.13 -0.04 0.00 0.00 -0.63 0.00 0.00 43.02 42.22 2wk5 s PHE 236 CO 0.20 -0.11 0.00 0.41 -0.05 0.00 0.00 175.22 175.66 2wk5 n GLY 237 N 3.68 2.10 0.35 1.99 0.00 -1.03 -0.86 105.19 111.42 2wk5 n GLY 237 Ca -0.20 -1.65 0.14 0.00 0.00 0.00 0.00 46.02 44.30 2wk5 n GLY 237 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wk5 h GLY 238 N 0.00 1.79 1.72 -0.02 0.00 -1.83 -1.68 103.07 103.06 2wk5 h GLY 238 Ca 0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 2wk5 h GLY 238 CO 0.00 -0.10 -0.43 0.00 0.00 0.00 0.00 176.54 176.01 2wk5 h ALA 239 N 1.66 0.79 -2.29 3.60 0.00 -1.24 -3.44 119.26 118.35 2wk5 h ALA 239 Ca 0.59 -0.18 -0.51 0.00 0.00 0.00 0.00 54.91 54.81 2wk5 h ALA 239 Cb 0.96 0.00 0.17 0.00 0.00 0.00 0.00 17.79 18.92 2wk5 h ALA 239 CO -0.40 0.23 0.25 0.00 0.00 0.00 0.00 179.25 179.32 2wk5 s ALA 240 N -3.16 1.63 0.32 0.00 0.00 -0.63 -4.53 121.76 115.39 2wk5 s ALA 240 Ca 0.04 0.34 0.06 0.00 0.00 0.00 0.00 51.96 52.40 2wk5 s ALA 240 Cb 0.07 -3.34 0.53 0.00 0.00 0.00 0.00 23.12 20.38 2wk5 s ALA 240 CO 0.72 -2.43 1.77 0.28 0.00 0.00 0.00 175.76 176.11 2wk5 h VAL 241 N -1.62 1.25 -3.19 0.00 2.07 -1.85 -3.32 116.25 109.59 2wk5 h VAL 241 Ca -0.45 -1.20 -0.63 0.00 0.82 0.00 0.00 66.70 65.24 2wk5 h VAL 241 Cb 1.26 1.40 -0.41 0.00 -1.52 0.00 0.00 31.29 32.02 2wk5 h VAL 241 CO 0.47 0.37 -0.56 -0.36 0.02 0.00 0.00 177.57 177.51 2wk5 s PHE 242 N -4.47 3.48 0.19 1.57 2.99 -1.26 -4.96 117.98 115.51 2wk5 s PHE 242 Ca -0.06 -3.27 -0.21 0.00 0.00 0.00 0.00 56.93 53.39 2wk5 s PHE 242 Cb 0.14 -2.78 0.12 0.00 0.00 0.00 0.00 43.02 40.50 2wk5 s PHE 242 CO 0.77 -0.61 1.58 -1.35 -0.00 0.00 0.00 175.22 175.61 2wk5 h PRO 243 N 5.77 -0.16 -6.64 0.24 0.11 -1.67 -3.38 132.00 126.27 2wk5 h PRO 243 Ca 0.08 0.01 -0.58 0.00 0.11 0.00 0.00 66.00 65.62 2wk5 h PRO 243 Cb 0.80 0.04 0.17 0.00 0.11 0.00 0.00 31.00 32.11 2wk5 h PRO 243 CO 0.72 -0.10 -0.17 -1.71 -0.21 0.00 0.00 178.00 176.52 2wk5 n ASN 244 N -5.43 -0.25 -0.07 -2.05 4.05 -1.26 -2.46 115.26 107.78 2wk5 n ASN 244 Ca 0.04 0.77 -0.18 0.00 0.45 0.00 0.00 54.58 55.66 2wk5 n ASN 244 Cb 0.36 -1.26 -0.13 0.00 1.23 0.00 0.00 39.78 39.98 2wk5 n ASN 244 CO 0.00 0.00 0.00 -0.61 -3.05 0.00 0.00 177.26 173.60 2wk5 h GLN 245 N 0.38 0.04 -0.45 1.20 4.15 -1.97 -2.81 115.11 115.64 2wk5 h GLN 245 Ca -0.47 -0.06 -0.04 0.00 0.77 0.00 0.00 58.65 58.86 2wk5 h GLN 245 Cb 1.38 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 29.08 2wk5 h GLN 245 CO 0.49 1.03 0.13 1.05 -1.93 0.00 0.00 178.83 179.60 2wk5 h GLU 246 N -0.90 0.66 0.00 1.69 4.11 -1.96 0.11 114.58 118.28 2wk5 h GLU 246 Ca -0.18 -0.11 -0.03 0.00 0.07 0.00 0.00 59.36 59.12 2wk5 h GLU 246 Cb 1.22 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 2wk5 h GLU 246 CO -0.07 0.59 -0.12 0.37 0.07 0.00 0.00 179.01 179.84 2wk5 h GLN 247 N 0.64 0.00 0.18 1.06 4.15 -1.94 -1.00 115.11 118.21 2wk5 h GLN 247 Ca 0.15 0.00 -0.31 0.00 0.77 0.00 0.00 58.65 59.26 2wk5 h GLN 247 Cb 0.21 0.00 0.02 0.00 0.21 0.00 0.00 27.48 27.92 2wk5 h GLN 247 CO -0.01 0.12 -1.44 0.00 -1.93 0.00 0.00 178.83 175.58 2wk5 h ALA 248 N 1.88 0.03 0.00 3.38 0.00 -0.83 -3.13 119.26 120.59 2wk5 h ALA 248 Ca -0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 54.91 53.96 2wk5 h ALA 248 Cb 0.61 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 2wk5 h ALA 248 CO 0.02 0.90 -0.06 0.00 0.00 0.00 0.00 179.25 180.11 2wk5 h ARG 249 N 0.11 0.00 0.01 0.00 3.08 -0.20 -1.56 114.38 115.82 2wk5 h ARG 249 Ca -0.22 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.56 2wk5 h ARG 249 Cb 2.07 0.00 0.02 0.00 0.08 0.00 0.00 29.97 32.14 2wk5 h ARG 249 CO 0.22 0.06 -1.05 0.93 -1.07 0.00 0.00 179.97 179.06 2wk5 h GLU 250 N 0.00 0.69 -0.67 0.04 4.39 -1.16 -1.34 114.58 116.53 2wk5 h GLU 250 Ca -0.00 -0.76 -0.08 0.00 0.34 0.00 0.00 59.36 58.86 2wk5 h GLU 250 Cb 0.43 0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 29.28 2wk5 h GLU 250 CO 0.01 1.33 0.11 1.25 -1.16 0.00 0.00 179.01 180.55 2wk5 h LEU 251 N 0.37 1.06 -0.48 1.33 5.85 -1.44 -0.84 115.31 121.15 2wk5 h LEU 251 Ca -0.14 -0.25 0.09 0.00 0.84 0.00 0.00 57.88 58.43 2wk5 h LEU 251 Cb 1.71 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 42.38 2wk5 h LEU 251 CO 0.21 1.05 0.00 0.00 -0.34 0.00 0.00 178.44 179.36 2wk5 h ALA 252 N 1.07 0.46 -0.02 1.25 0.00 -1.13 -0.79 119.26 120.10 2wk5 h ALA 252 Ca 0.21 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 2wk5 h ALA 252 Cb 0.44 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2wk5 h ALA 252 CO 0.01 -0.38 -0.00 0.87 0.00 0.00 0.00 179.25 179.75 2wk5 h LYS 253 N 0.12 0.04 -0.91 0.00 1.79 -0.89 -2.62 116.57 114.10 2wk5 h LYS 253 Ca 0.24 -0.01 0.25 0.00 -2.18 0.00 0.00 60.65 58.95 2wk5 h LYS 253 Cb 0.36 -0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.96 2wk5 h LYS 253 CO -0.40 0.36 0.64 1.15 -1.08 0.00 0.00 179.45 180.12 2wk5 h THR 254 N -0.28 0.57 0.01 -0.16 2.02 -0.56 0.62 112.91 115.13 2wk5 h THR 254 Ca 0.01 -0.03 -0.22 0.00 0.77 0.00 0.00 66.41 66.94 2wk5 h THR 254 Cb 0.34 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 2wk5 h THR 254 CO 0.00 0.02 -1.03 -0.07 0.37 0.00 0.00 175.52 174.81 2wk5 h LEU 255 N 0.09 0.03 0.18 2.58 3.38 -0.92 -1.63 115.31 119.03 2wk5 h LEU 255 Ca 0.45 -0.04 -0.26 0.00 0.09 0.00 0.00 57.88 58.12 2wk5 h LEU 255 Cb 1.62 -0.01 0.03 0.00 0.09 0.00 0.00 40.66 42.39 2wk5 h LEU 255 CO -0.05 1.03 -1.14 -0.37 0.09 0.00 0.00 178.44 178.00 2wk5 h VAL 256 N 0.01 1.38 0.00 1.22 -1.51 -0.53 -2.23 116.25 114.60 2wk5 h VAL 256 Ca -0.02 -2.57 0.00 0.00 -1.23 0.00 0.00 66.70 62.87 2wk5 h VAL 256 Cb 1.79 3.05 0.00 0.00 -2.13 0.00 0.00 31.29 34.00 2wk5 h VAL 256 CO 0.13 0.75 0.00 0.61 -1.23 0.00 0.00 177.57 177.84 2wk5 n GLY 257 N 1.62 -2.92 0.32 5.19 0.00 0.19 -1.10 105.19 108.49 2wk5 n GLY 257 Ca -0.15 0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.03 2wk5 n GLY 257 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wk5 h VAL 258 N 0.00 0.19 -0.51 1.61 2.07 -1.49 0.34 116.25 118.46 2wk5 h VAL 258 Ca 0.00 -0.04 0.10 0.00 0.82 0.00 0.00 66.70 67.59 2wk5 h VAL 258 Cb 0.00 0.08 -0.10 0.00 -1.52 0.00 0.00 31.29 29.75 2wk5 h VAL 258 CO 0.00 0.02 -0.19 1.23 0.02 0.00 0.00 177.57 178.65 2wk5 h GLY 259 N 0.10 0.23 0.86 2.17 0.00 -1.37 -2.20 103.07 102.86 2wk5 h GLY 259 Ca 0.56 0.25 -0.03 0.00 0.00 0.00 0.00 47.33 48.11 2wk5 h GLY 259 CO -0.76 -0.21 -0.38 0.00 0.00 0.00 0.00 176.54 175.18 2wk5 h ALA 260 N 1.34 -0.98 -0.67 3.60 0.00 0.13 -1.91 119.26 120.78 2wk5 h ALA 260 Ca 0.24 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.15 2wk5 h ALA 260 Cb 0.44 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 2wk5 h ALA 260 CO -0.56 -1.06 1.00 1.03 0.00 0.00 0.00 179.25 179.65 2wk5 h SER 261 N -0.96 0.00 -0.40 0.00 0.87 -0.76 1.01 113.55 113.31 2wk5 h SER 261 Ca -0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 2wk5 h SER 261 Cb 0.77 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.73 2wk5 h SER 261 CO 0.09 0.00 0.00 0.18 -0.53 0.00 0.00 176.83 176.57 2wk5 n LEU 262 N -3.15 3.34 0.00 2.23 4.77 -0.98 -4.94 117.00 118.26 2wk5 n LEU 262 Ca 0.15 -1.60 0.00 0.00 -0.03 0.00 0.00 56.01 54.52 2wk5 n LEU 262 Cb 1.21 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 42.04 2wk5 n LEU 262 CO 0.19 0.75 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 2wk5 n GLY 263 N 1.31 0.91 3.87 -0.72 0.00 0.35 -5.09 105.19 105.81 2wk5 n GLY 263 Ca 0.18 -0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 2wk5 n GLY 263 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wk5 s LEU 264 N 0.00 4.02 -1.04 0.99 1.43 -0.75 -5.01 118.68 118.32 2wk5 s LEU 264 Ca 0.00 -0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 53.02 2wk5 s LEU 264 Cb 0.00 -2.59 0.32 0.00 0.03 0.00 0.00 46.19 43.95 2wk5 s LEU 264 CO 0.00 0.01 1.72 0.54 0.23 0.00 0.00 176.35 178.85 2wk5 n ARG 265 N -0.80 5.14 -2.36 1.70 5.12 -1.26 -3.81 116.66 120.39 2wk5 n ARG 265 Ca -0.08 -4.64 -0.41 0.00 -1.93 0.00 0.00 57.85 50.80 2wk5 n ARG 265 Cb 0.56 -2.48 -0.03 0.00 -1.16 0.00 0.00 32.46 29.34 2wk5 n ARG 265 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2wk5 s VAL 266 N -3.85 3.39 -0.03 1.55 1.01 -1.26 -2.02 120.40 119.19 2wk5 s VAL 266 Ca 0.36 1.27 -0.01 0.00 0.00 0.00 0.00 61.98 63.60 2wk5 s VAL 266 Cb 0.15 -3.81 0.03 0.00 0.00 0.00 0.00 36.38 32.75 2wk5 s VAL 266 CO -0.05 0.25 0.05 0.00 0.00 0.00 0.00 175.10 175.35 2wk5 s ALA 267 N -0.55 0.18 0.04 5.51 0.00 -0.45 -2.99 121.76 123.50 2wk5 s ALA 267 Ca 0.50 0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.72 2wk5 s ALA 267 Cb -0.34 -0.50 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 2wk5 s ALA 267 CO 0.40 -0.37 0.02 0.00 0.00 0.00 0.00 175.76 175.81 2wk5 s ALA 268 N 1.82 3.35 -0.00 0.00 0.00 -0.45 -1.06 121.76 125.43 2wk5 s ALA 268 Ca 0.01 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 51.03 2wk5 s ALA 268 Cb -0.12 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.65 2wk5 s ALA 268 CO -0.03 0.68 -0.22 0.00 0.00 0.00 0.00 175.76 176.20 2wk5 s ALA 269 N -1.21 1.82 -0.24 0.00 0.00 -0.81 0.99 121.76 122.31 2wk5 s ALA 269 Ca 0.23 -0.98 -0.10 0.00 0.00 0.00 0.00 51.96 51.11 2wk5 s ALA 269 Cb -0.12 -0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.52 2wk5 s ALA 269 CO 0.15 0.44 0.14 -0.51 0.00 0.00 0.00 175.76 175.98 2wk5 s LEU 270 N -0.69 3.97 0.03 0.00 2.01 -1.11 -1.08 118.68 121.81 2wk5 s LEU 270 Ca 0.08 0.04 0.03 0.00 0.01 0.00 0.00 54.13 54.29 2wk5 s LEU 270 Cb -0.09 -2.07 -0.02 0.00 0.01 0.00 0.00 46.19 44.03 2wk5 s LEU 270 CO -0.00 0.04 -0.09 0.42 1.01 0.00 0.00 176.35 177.73 2wk5 s THR 271 N 1.21 0.68 0.32 5.49 -4.23 -0.91 0.76 115.64 118.95 2wk5 s THR 271 Ca 0.07 -0.81 -0.28 0.00 -1.18 0.00 0.00 61.69 59.49 2wk5 s THR 271 Cb -0.14 -0.66 -0.10 0.00 1.34 0.00 0.00 72.50 72.95 2wk5 s THR 271 CO 0.05 -0.12 1.17 0.00 -0.54 0.00 0.00 174.62 175.18 2wk5 s ALA 272 N -0.85 3.38 -0.29 3.99 0.00 0.16 -2.29 121.76 125.85 2wk5 s ALA 272 Ca -0.03 1.00 0.20 0.00 0.00 0.00 0.00 51.96 53.14 2wk5 s ALA 272 Cb -0.07 -3.38 0.48 0.00 0.00 0.00 0.00 23.12 20.16 2wk5 s ALA 272 CO 0.00 -0.36 1.06 -0.12 0.00 0.00 0.00 175.76 176.34 2wk5 n MET 273 N 0.83 1.45 -0.01 0.00 0.00 -0.04 -4.82 117.12 114.54 2wk5 n MET 273 Ca 0.00 -3.30 -0.13 0.00 0.00 0.00 0.00 57.70 54.28 2wk5 n MET 273 Cb 0.44 -1.36 -0.14 0.00 0.00 0.00 0.00 33.22 32.16 2wk5 n MET 273 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 2wk5 h ASP 274 N 2.72 0.14 -4.15 6.12 3.32 -1.87 -0.05 116.42 122.65 2wk5 h ASP 274 Ca -0.13 -0.31 -0.59 0.00 0.02 0.00 0.00 57.03 56.02 2wk5 h ASP 274 Cb 1.23 -0.05 -0.22 0.00 0.22 0.00 0.00 39.33 40.51 2wk5 h ASP 274 CO 0.30 1.28 -0.84 -1.59 -1.72 0.00 0.00 179.24 176.67 2wk5 s LYS 275 N -2.59 1.22 0.88 3.56 -2.85 -1.26 0.37 119.74 119.07 2wk5 s LYS 275 Ca -0.10 -1.16 -0.13 0.00 -1.00 0.00 0.00 55.97 53.57 2wk5 s LYS 275 Cb 0.08 -1.50 0.03 0.00 -2.06 0.00 0.00 37.83 34.37 2wk5 s LYS 275 CO 0.81 0.36 0.54 -2.30 0.10 0.00 0.00 175.35 174.86 2wk5 n PRO 276 N 1.17 -0.12 -3.31 1.78 -0.02 -1.26 -4.87 135.00 128.36 2wk5 n PRO 276 Ca -0.19 0.01 -0.38 0.00 -2.02 0.00 0.00 63.50 60.92 2wk5 n PRO 276 Cb 0.53 -1.93 -0.06 0.00 -0.02 0.00 0.00 33.50 32.03 2wk5 n PRO 276 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2wk5 s LEU 277 N -1.57 4.48 0.00 2.45 0.20 -0.98 -4.86 118.68 118.39 2wk5 s LEU 277 Ca 0.61 1.15 0.00 0.00 0.69 0.00 0.00 54.13 56.57 2wk5 s LEU 277 Cb -0.25 -2.82 0.00 0.00 -0.43 0.00 0.00 46.19 42.69 2wk5 s LEU 277 CO 0.63 0.23 0.00 0.61 -0.29 0.00 0.00 176.35 177.54 2wk5 n GLY 278 N 1.99 0.49 0.06 7.98 0.00 -1.26 -4.38 105.19 110.07 2wk5 n GLY 278 Ca -0.10 -0.91 -0.06 0.00 0.00 0.00 0.00 46.02 44.94 2wk5 n GLY 278 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wk5 n ARG 279 N 0.00 1.63 -3.24 1.61 0.63 -1.26 -4.98 116.66 111.06 2wk5 n ARG 279 Ca 0.00 -0.02 -0.24 0.00 -0.92 0.00 0.00 57.85 56.68 2wk5 n ARG 279 Cb 0.00 -1.36 -0.00 0.00 0.45 0.00 0.00 32.46 31.55 2wk5 n ARG 279 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wk5 s VAL 281 N -2.40 -0.32 0.00 0.00 1.01 -0.84 -4.58 120.40 113.27 2wk5 s VAL 281 Ca 0.43 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.43 2wk5 s VAL 281 Cb -0.10 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.36 2wk5 s VAL 281 CO 0.37 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.09 2wk5 n GLY 282 N 4.70 -0.15 1.25 4.51 0.00 -1.26 -0.10 105.19 114.13 2wk5 n GLY 282 Ca -0.17 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.17 2wk5 n GLY 282 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wk5 n HIS 283 N 0.00 -0.52 1.08 1.61 8.25 -1.26 -4.66 115.22 119.72 2wk5 n HIS 283 Ca 0.00 0.09 0.13 0.00 -0.26 0.00 0.00 57.72 57.68 2wk5 n HIS 283 Cb 0.00 0.13 0.33 0.00 1.12 0.00 0.00 29.99 31.57 2wk5 n HIS 283 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wk5 n ALA 284 N -3.42 3.29 0.06 -1.41 0.00 -0.17 -3.74 120.51 115.12 2wk5 n ALA 284 Ca 0.00 -0.33 0.07 0.00 0.00 0.00 0.00 53.44 53.18 2wk5 n ALA 284 Cb 0.00 -1.17 -0.05 0.00 0.00 0.00 0.00 19.45 18.23 2wk5 n ALA 284 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wk5 n LEU 285 N -1.29 0.73 0.08 0.00 4.77 -1.26 -4.05 117.00 115.97 2wk5 n LEU 285 Ca 0.08 0.30 -0.17 0.00 -0.03 0.00 0.00 56.01 56.18 2wk5 n LEU 285 Cb 0.33 0.01 -0.14 0.00 -2.33 0.00 0.00 43.42 41.29 2wk5 n LEU 285 CO 0.32 -0.03 -0.25 -0.33 -1.33 0.00 0.00 177.39 175.76 2wk5 h GLU 286 N 0.00 0.27 0.00 3.23 5.08 -1.83 -3.20 114.58 118.14 2wk5 h GLU 286 Ca -0.07 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 2wk5 h GLU 286 Cb 1.23 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.66 2wk5 h GLU 286 CO 0.02 1.16 0.00 0.28 -1.00 0.00 0.00 179.01 179.47 2wk5 h VAL 287 N 0.07 0.00 0.02 3.13 2.07 -1.74 -0.85 116.25 118.95 2wk5 h VAL 287 Ca -0.22 -0.28 -0.27 0.00 0.82 0.00 0.00 66.70 66.76 2wk5 h VAL 287 Cb 2.01 1.19 0.02 0.00 -1.52 0.00 0.00 31.29 32.99 2wk5 h VAL 287 CO 0.18 0.00 -1.06 -0.33 0.02 0.00 0.00 177.57 176.38 2wk5 h GLU 288 N 0.00 0.66 0.00 1.57 5.08 -1.69 -2.97 114.58 117.23 2wk5 h GLU 288 Ca 0.00 -0.74 -0.04 0.00 -1.00 0.00 0.00 59.36 57.59 2wk5 h GLU 288 Cb 0.30 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2wk5 h GLU 288 CO 0.00 1.31 -0.17 1.49 -1.00 0.00 0.00 179.01 180.64 2wk5 h GLU 289 N 0.36 0.00 -0.55 2.33 4.81 -1.32 -2.90 114.58 117.32 2wk5 h GLU 289 Ca -0.13 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 58.99 2wk5 h GLU 289 Cb 1.72 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.08 2wk5 h GLU 289 CO 0.21 0.17 -0.07 0.00 -0.73 0.00 0.00 179.01 178.58 2wk5 h ALA 290 N 1.83 0.83 0.04 2.92 0.00 -1.21 -2.60 119.26 121.07 2wk5 h ALA 290 Ca -0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 2wk5 h ALA 290 Cb 1.11 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2wk5 h ALA 290 CO 0.02 0.66 -0.02 -0.07 0.00 0.00 0.00 179.25 179.84 2wk5 h LEU 291 N 0.90 -0.05 -1.07 0.00 3.38 -1.39 -2.53 115.31 114.55 2wk5 h LEU 291 Ca 0.15 -0.25 0.21 0.00 0.09 0.00 0.00 57.88 58.08 2wk5 h LEU 291 Cb 0.63 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.28 2wk5 h LEU 291 CO 0.04 0.22 0.61 -0.07 0.09 0.00 0.00 178.44 179.34 2wk5 h LEU 292 N -0.32 0.72 -1.04 1.67 4.07 -1.45 0.52 115.31 119.47 2wk5 h LEU 292 Ca -0.01 0.10 -0.07 0.00 0.08 0.00 0.00 57.88 57.98 2wk5 h LEU 292 Cb 0.29 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 2wk5 h LEU 292 CO 0.01 0.22 -0.09 0.00 -1.08 0.00 0.00 178.44 177.50 2wk5 n MET 294 N -4.21 1.87 -0.05 0.00 2.81 0.22 -3.45 117.12 114.31 2wk5 n MET 294 Ca 0.01 -1.29 0.12 0.00 -1.81 0.00 0.00 57.70 54.74 2wk5 n MET 294 Cb 0.32 -1.45 0.31 0.00 -0.71 0.00 0.00 33.22 31.69 2wk5 n MET 294 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2wk5 n ASP 295 N 0.53 2.34 0.00 7.83 2.03 0.16 -4.48 116.55 124.96 2wk5 n ASP 295 Ca 0.17 -1.78 0.00 0.00 0.52 0.00 0.00 54.79 53.70 2wk5 n ASP 295 Cb 0.40 -0.07 0.00 0.00 -0.72 0.00 0.00 41.12 40.74 2wk5 n ASP 295 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2wk5 n GLY 296 N 1.28 3.24 3.64 0.27 0.00 -1.08 -5.00 105.19 107.55 2wk5 n GLY 296 Ca 0.17 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 45.32 2wk5 n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk5 s ALA 297 N 0.00 -1.97 0.00 4.61 0.00 -1.05 -4.74 121.76 118.61 2wk5 s ALA 297 Ca 0.00 2.15 0.00 0.00 0.00 0.00 0.00 51.96 54.11 2wk5 s ALA 297 Cb 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 23.12 21.68 2wk5 s ALA 297 CO 0.00 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.84 2wk5 n GLY 298 N 3.30 5.46 3.73 0.00 0.00 -1.25 -4.52 105.19 111.91 2wk5 n GLY 298 Ca -0.16 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 2wk5 n GLY 298 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wk5 s PRO 299 N 4.82 4.20 0.24 1.61 0.02 -1.26 -4.88 135.00 139.75 2wk5 s PRO 299 Ca 0.00 2.42 -0.08 0.00 0.02 0.00 0.00 61.00 63.36 2wk5 s PRO 299 Cb 0.00 -3.11 0.42 0.00 0.02 0.00 0.00 34.50 31.83 2wk5 s PRO 299 CO 0.00 -0.60 1.63 -1.35 -0.33 0.00 0.00 177.00 176.35 2wk5 h PRO 300 N 6.16 0.07 0.00 5.54 0.11 -1.99 -1.35 132.00 140.56 2wk5 h PRO 300 Ca -0.44 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 2wk5 h PRO 300 Cb 1.21 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2wk5 h PRO 300 CO 0.88 0.05 -0.16 0.38 -0.21 0.00 0.00 178.00 178.93 2wk5 h ASP 301 N 0.08 0.00 -0.04 -2.05 2.03 -1.92 0.24 116.42 114.77 2wk5 h ASP 301 Ca 0.41 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.70 2wk5 h ASP 301 Cb 0.71 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.21 2wk5 h ASP 301 CO -0.70 0.16 -0.01 0.25 -1.03 0.00 0.00 179.24 177.92 2wk5 h LEU 302 N 0.00 0.07 -0.10 0.15 6.46 -1.62 -2.37 115.31 117.90 2wk5 h LEU 302 Ca -0.00 -0.38 -0.00 0.00 -0.12 0.00 0.00 57.88 57.38 2wk5 h LEU 302 Cb 0.51 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 40.41 2wk5 h LEU 302 CO 0.02 0.44 0.06 -0.09 -0.62 0.00 0.00 178.44 178.24 2wk5 h ARG 303 N -0.29 0.15 -1.06 1.25 2.43 -1.31 0.59 114.38 116.15 2wk5 h ARG 303 Ca 0.01 -0.02 0.31 0.00 -0.81 0.00 0.00 59.98 59.47 2wk5 h ARG 303 Cb 0.41 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 2wk5 h ARG 303 CO 0.00 0.19 0.86 0.22 -1.51 0.00 0.00 179.97 179.74 2wk5 h ASP 304 N 0.07 0.00 0.03 -3.80 -0.00 -0.44 -1.35 116.42 110.92 2wk5 h ASP 304 Ca 0.04 0.00 -0.37 0.00 -0.00 0.00 0.00 57.03 56.70 2wk5 h ASP 304 Cb 0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 39.33 39.35 2wk5 h ASP 304 CO -0.01 0.00 -2.37 0.18 -0.00 0.00 0.00 179.24 177.04 2wk5 n LEU 305 N -3.92 0.87 -0.17 2.28 4.77 -0.58 -3.15 117.00 117.09 2wk5 n LEU 305 Ca 0.23 -0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 56.10 2wk5 n LEU 305 Cb 1.21 0.09 0.00 0.00 -2.33 0.00 0.00 43.42 42.39 2wk5 n LEU 305 CO 0.35 0.62 0.81 0.58 -1.33 0.00 0.00 177.39 178.42 2wk5 h VAL 306 N 0.00 1.26 0.04 4.08 2.07 0.00 -2.38 116.25 121.33 2wk5 h VAL 306 Ca -0.54 -1.06 -0.28 0.00 0.82 0.00 0.00 66.70 65.64 2wk5 h VAL 306 Cb 2.14 0.98 0.02 0.00 -1.52 0.00 0.00 31.29 32.92 2wk5 h VAL 306 CO 0.00 0.37 -1.11 0.71 0.02 0.00 0.00 177.57 177.56 2wk5 h THR 307 N 0.72 1.29 -0.18 2.57 1.35 -1.50 -2.06 112.91 115.10 2wk5 h THR 307 Ca 0.14 -2.35 -0.04 0.00 -0.55 0.00 0.00 66.41 63.60 2wk5 h THR 307 Cb 0.50 2.50 -0.01 0.00 -1.73 0.00 0.00 68.15 69.41 2wk5 h THR 307 CO 0.02 0.72 -0.06 0.74 -0.25 0.00 0.00 175.52 176.69 2wk5 h THR 308 N 0.34 1.30 -0.33 6.82 2.02 -1.58 0.35 112.91 121.83 2wk5 h THR 308 Ca -0.15 -1.06 -0.06 0.00 0.77 0.00 0.00 66.41 65.91 2wk5 h THR 308 Cb 1.77 1.62 -0.01 0.00 -1.74 0.00 0.00 68.15 69.79 2wk5 h THR 308 CO 0.21 0.32 -0.03 -0.07 0.37 0.00 0.00 175.52 176.33 2wk5 h LEU 309 N 0.06 0.59 -1.73 2.58 3.38 -1.56 -2.36 115.31 116.28 2wk5 h LEU 309 Ca 0.04 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 2wk5 h LEU 309 Cb 0.52 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2wk5 h LEU 309 CO 0.02 0.78 -0.00 1.23 0.09 0.00 0.00 178.44 180.56 2wk5 h GLY 310 N 0.39 0.17 1.21 0.83 0.00 -1.28 -0.31 103.07 104.08 2wk5 h GLY 310 Ca 0.09 -0.08 -0.09 0.00 0.00 0.00 0.00 47.33 47.25 2wk5 h GLY 310 CO 0.02 0.07 -0.02 -1.33 0.00 0.00 0.00 176.54 175.28 2wk5 h GLY 311 N 0.36 1.02 1.04 4.60 0.00 0.04 -2.16 103.07 107.98 2wk5 h GLY 311 Ca 0.04 -0.74 -0.15 0.00 0.00 0.00 0.00 47.33 46.48 2wk5 h GLY 311 CO 0.00 0.68 -0.41 0.00 0.00 0.00 0.00 176.54 176.81 2wk5 h ALA 312 N 1.10 0.43 0.18 3.60 0.00 -0.67 -1.69 119.26 122.21 2wk5 h ALA 312 Ca 0.16 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2wk5 h ALA 312 Cb 0.54 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2wk5 h ALA 312 CO 0.03 0.55 -0.16 -0.07 0.00 0.00 0.00 179.25 179.59 2wk5 h LEU 313 N 0.54 -0.43 -1.91 0.00 3.38 -0.95 0.35 115.31 116.28 2wk5 h LEU 313 Ca 0.03 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.04 2wk5 h LEU 313 Cb 1.00 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 2wk5 h LEU 313 CO 0.10 -0.25 0.07 -0.07 0.09 0.00 0.00 178.44 178.38 2wk5 h LEU 314 N -0.36 0.10 0.48 1.67 3.38 -1.42 0.42 115.31 119.57 2wk5 h LEU 314 Ca -0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2wk5 h LEU 314 Cb 0.34 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2wk5 h LEU 314 CO -0.03 0.07 -0.23 -0.25 0.09 0.00 0.00 178.44 178.09 2wk5 h TRP 315 N 0.12 -0.59 -0.64 1.13 7.01 -0.43 0.27 115.95 122.81 2wk5 h TRP 315 Ca 0.04 -0.01 0.12 0.00 2.11 0.00 0.00 58.89 61.14 2wk5 h TRP 315 Cb 0.01 0.20 -0.09 0.00 -2.10 0.00 0.00 29.16 27.18 2wk5 h TRP 315 CO -0.00 -0.37 0.18 -0.07 -2.79 0.00 0.00 178.44 175.39 2wk5 h LEU 316 N -1.09 0.10 0.00 0.65 -0.00 0.12 0.26 115.31 115.34 2wk5 h LEU 316 Ca -0.07 0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.92 2wk5 h LEU 316 Cb 0.49 0.13 0.00 0.00 -0.00 0.00 0.00 40.66 41.28 2wk5 h LEU 316 CO 0.11 0.05 0.00 -0.24 -0.00 0.00 0.00 178.44 178.35 2wk5 n SER 317 N -5.08 0.00 -2.59 -0.43 2.88 0.14 -4.82 113.62 103.71 2wk5 n SER 317 Ca 0.10 0.23 -0.15 0.00 -1.33 0.00 0.00 58.87 57.72 2wk5 n SER 317 Cb 0.34 -0.30 0.06 0.00 -0.75 0.00 0.00 64.21 63.56 2wk5 n SER 317 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wk5 n GLY 318 N -0.90 -0.06 0.10 0.46 0.00 0.91 -4.93 105.19 100.77 2wk5 n GLY 318 Ca 0.02 -0.06 0.01 0.00 0.00 0.00 0.00 46.02 45.99 2wk5 n GLY 318 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wk5 n HIS 319 N -3.95 0.06 -3.64 1.61 8.25 0.91 -4.99 115.22 113.47 2wk5 n HIS 319 Ca -0.04 -0.37 -0.08 0.00 -0.26 0.00 0.00 57.72 56.98 2wk5 n HIS 319 Cb 0.56 -0.03 -0.07 0.00 1.12 0.00 0.00 29.99 31.56 2wk5 n HIS 319 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wk5 s ALA 320 N -0.78 -1.99 0.25 -1.41 0.00 -1.03 -4.92 121.76 111.88 2wk5 s ALA 320 Ca 0.04 2.16 -0.06 0.00 0.00 0.00 0.00 51.96 54.10 2wk5 s ALA 320 Cb 0.02 -1.46 0.27 0.00 0.00 0.00 0.00 23.12 21.95 2wk5 s ALA 320 CO 0.03 -0.33 1.92 0.78 0.00 0.00 0.00 175.76 178.16 2wk5 h GLY 321 N 5.72 1.38 -1.95 0.00 0.00 -1.92 -3.40 103.07 102.90 2wk5 h GLY 321 Ca -0.29 -0.54 -0.60 0.00 0.00 0.00 0.00 47.33 45.90 2wk5 h GLY 321 CO 0.14 0.53 -0.67 -0.51 0.00 0.00 0.00 176.54 176.02 2wk5 s THR 322 N -6.04 2.11 0.12 4.70 -4.23 -1.26 -5.02 115.64 106.01 2wk5 s THR 322 Ca -0.13 -2.17 -0.09 0.00 -1.18 0.00 0.00 61.69 58.12 2wk5 s THR 322 Cb 0.18 -2.66 -0.16 0.00 1.34 0.00 0.00 72.50 71.20 2wk5 s THR 322 CO 0.82 -0.19 1.32 -0.61 -0.54 0.00 0.00 174.62 175.42 2wk5 h GLN 323 N 2.03 0.66 0.19 3.99 4.15 -1.85 -1.26 115.11 123.02 2wk5 h GLN 323 Ca -0.42 -0.58 -0.00 0.00 0.77 0.00 0.00 58.65 58.42 2wk5 h GLN 323 Cb 1.25 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 29.06 2wk5 h GLN 323 CO 0.71 1.19 -0.14 0.00 -1.93 0.00 0.00 178.83 178.66 2wk5 h ALA 324 N 0.63 -0.32 -0.69 3.38 0.00 -1.96 2.88 119.26 123.18 2wk5 h ALA 324 Ca -0.06 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 54.93 2wk5 h ALA 324 Cb 1.45 0.19 -0.10 0.00 0.00 0.00 0.00 17.79 19.34 2wk5 h ALA 324 CO 0.16 -0.70 0.20 0.37 0.00 0.00 0.00 179.25 179.29 2wk5 h GLN 325 N -0.34 0.32 -0.09 0.00 4.15 -1.93 0.33 115.11 117.55 2wk5 h GLN 325 Ca -0.01 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.39 2wk5 h GLN 325 Cb 0.30 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.92 2wk5 h GLN 325 CO -0.01 0.21 0.06 0.78 -1.93 0.00 0.00 178.83 177.94 2wk5 h GLY 326 N 0.33 0.12 1.64 2.39 0.00 0.61 -2.39 103.07 105.77 2wk5 h GLY 326 Ca 0.38 -0.05 0.03 0.00 0.00 0.00 0.00 47.33 47.69 2wk5 h GLY 326 CO -0.43 0.05 0.17 0.00 0.00 0.00 0.00 176.54 176.33 2wk5 h ALA 327 N 1.02 1.97 -0.47 3.60 0.00 0.71 -1.09 119.26 125.01 2wk5 h ALA 327 Ca 0.03 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 2wk5 h ALA 327 Cb -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2wk5 h ALA 327 CO -0.01 -0.01 -0.24 0.00 0.00 0.00 0.00 179.25 179.00 2wk5 h ALA 328 N 1.86 0.69 -0.67 0.00 0.00 0.01 -1.67 119.26 119.48 2wk5 h ALA 328 Ca 0.11 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2wk5 h ALA 328 Cb 0.16 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2wk5 h ALA 328 CO -0.02 0.67 0.39 0.00 0.00 0.00 0.00 179.25 180.29 2wk5 h ARG 329 N 0.84 0.92 -0.14 0.00 2.47 -0.74 -2.27 114.38 115.46 2wk5 h ARG 329 Ca 0.10 -0.10 -0.11 0.00 -1.26 0.00 0.00 59.98 58.62 2wk5 h ARG 329 Cb 0.81 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.93 2wk5 h ARG 329 CO 0.07 0.68 -0.39 0.28 0.56 0.00 0.00 179.97 181.16 2wk5 h VAL 330 N 0.92 1.30 -0.43 2.04 2.07 -1.31 -2.94 116.25 117.91 2wk5 h VAL 330 Ca 0.24 -1.50 -0.12 0.00 0.82 0.00 0.00 66.70 66.14 2wk5 h VAL 330 Cb 0.00 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2wk5 h VAL 330 CO -0.04 0.46 -0.20 0.00 0.02 0.00 0.00 177.57 177.80 2wk5 h ALA 331 N 1.32 0.84 0.11 1.67 0.00 -1.02 -3.16 119.26 119.03 2wk5 h ALA 331 Ca 0.03 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.58 2wk5 h ALA 331 Cb 0.82 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2wk5 h ALA 331 CO 0.06 0.64 -0.20 0.00 0.00 0.00 0.00 179.25 179.76 2wk5 h ALA 332 N 1.03 -0.34 -1.11 0.00 0.00 -1.24 -0.85 119.26 116.77 2wk5 h ALA 332 Ca 0.10 -0.03 0.32 0.00 0.00 0.00 0.00 54.91 55.31 2wk5 h ALA 332 Cb 0.73 0.32 -0.12 0.00 0.00 0.00 0.00 17.79 18.72 2wk5 h ALA 332 CO 0.06 -0.73 0.69 0.00 0.00 0.00 0.00 179.25 179.27 2wk5 h ALA 333 N 0.43 2.28 0.00 0.00 0.00 -1.51 0.66 119.26 121.12 2wk5 h ALA 333 Ca 0.03 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2wk5 h ALA 333 Cb 0.40 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2wk5 h ALA 333 CO -0.11 -0.80 0.00 -0.07 0.00 0.00 0.00 179.25 178.27 2wk5 h LEU 334 N 0.31 0.00 0.00 0.00 3.38 -1.16 -3.00 115.31 114.84 2wk5 h LEU 334 Ca 0.69 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.61 2wk5 h LEU 334 Cb 1.81 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.55 2wk5 h LEU 334 CO -0.41 0.00 -1.58 0.47 0.09 0.00 0.00 178.44 177.01 2wk5 n ASP 335 N -2.72 2.37 0.02 -0.43 8.00 0.22 -2.78 116.55 121.23 2wk5 n ASP 335 Ca 0.02 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.54 2wk5 n ASP 335 Cb 0.34 1.32 -0.10 0.00 -0.02 0.00 0.00 41.12 42.66 2wk5 n ASP 335 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2wk5 n ASP 336 N -2.03 0.63 0.00 -2.24 5.68 -0.72 -4.91 116.55 112.96 2wk5 n ASP 336 Ca -0.06 0.27 0.00 0.00 -0.50 0.00 0.00 54.79 54.50 2wk5 n ASP 336 Cb 0.45 0.54 0.00 0.00 -1.14 0.00 0.00 41.12 40.97 2wk5 n ASP 336 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wk5 n GLY 337 N 1.40 0.58 0.36 6.12 0.00 -1.17 -4.96 105.19 107.53 2wk5 n GLY 337 Ca -0.11 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.97 2wk5 n GLY 337 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wk5 h SER 338 N 0.00 0.84 0.02 1.61 4.64 -1.87 -1.53 113.55 117.25 2wk5 h SER 338 Ca 0.00 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2wk5 h SER 338 Cb 0.00 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 61.93 2wk5 h SER 338 CO 0.00 0.50 -0.01 0.00 -0.87 0.00 0.00 176.83 176.45 2wk5 h ALA 339 N 1.54 -0.02 -0.99 5.18 0.00 -1.78 0.90 119.26 124.09 2wk5 h ALA 339 Ca 0.41 -0.07 0.13 0.00 0.00 0.00 0.00 54.91 55.38 2wk5 h ALA 339 Cb 0.35 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.07 2wk5 h ALA 339 CO -0.17 -0.45 0.62 1.25 0.00 0.00 0.00 179.25 180.50 2wk5 h LEU 340 N -0.16 0.88 0.56 0.00 6.46 -1.61 0.72 115.31 122.15 2wk5 h LEU 340 Ca -0.00 0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 57.78 2wk5 h LEU 340 Cb 0.15 -0.12 0.01 0.00 -0.73 0.00 0.00 40.66 39.96 2wk5 h LEU 340 CO 0.00 0.45 -0.27 1.23 -0.62 0.00 0.00 178.44 179.24 2wk5 h GLY 341 N 0.93 -0.78 -0.62 3.75 0.00 -0.92 0.21 103.07 105.65 2wk5 h GLY 341 Ca 0.50 0.29 0.22 0.00 0.00 0.00 0.00 47.33 48.34 2wk5 h GLY 341 CO -0.26 -0.28 0.06 3.21 0.00 0.00 0.00 176.54 179.26 2wk5 h ARG 342 N -1.06 0.09 -0.74 4.80 -0.00 -0.08 0.39 114.38 117.78 2wk5 h ARG 342 Ca -0.08 -0.01 -0.04 0.00 -0.50 0.00 0.00 59.98 59.36 2wk5 h ARG 342 Cb 0.64 -0.02 -0.03 0.00 0.00 0.00 0.00 29.97 30.55 2wk5 h ARG 342 CO 0.13 0.06 0.30 0.35 0.00 0.00 0.00 179.97 180.80 2wk5 h PHE 343 N 0.09 1.12 0.00 3.04 3.57 0.74 -2.83 116.94 122.67 2wk5 h PHE 343 Ca 0.51 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.88 2wk5 h PHE 343 Cb 0.99 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 2wk5 h PHE 343 CO -0.43 0.85 -0.25 1.49 -2.23 0.00 0.00 178.31 177.75 2wk5 h GLU 344 N 1.06 0.00 0.51 1.11 4.81 0.30 -2.84 114.58 119.53 2wk5 h GLU 344 Ca 0.25 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 2wk5 h GLU 344 Cb 0.21 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.59 2wk5 h GLU 344 CO -0.02 0.25 -0.25 0.00 -0.73 0.00 0.00 179.01 178.26 2wk5 h ARG 345 N 0.00 -0.66 -0.25 1.92 -0.00 -0.93 -2.98 114.38 111.48 2wk5 h ARG 345 Ca -0.00 0.05 0.05 0.00 -0.50 0.00 0.00 59.98 59.57 2wk5 h ARG 345 Cb 0.64 0.15 -0.08 0.00 0.00 0.00 0.00 29.97 30.69 2wk5 h ARG 345 CO 0.03 -0.37 -0.46 1.98 0.00 0.00 0.00 179.97 181.15 2wk5 h MET 346 N -0.86 -0.43 -0.30 0.04 4.05 -1.41 0.44 114.93 116.45 2wk5 h MET 346 Ca -0.07 0.03 0.07 0.00 -0.28 0.00 0.00 59.70 59.45 2wk5 h MET 346 Cb 0.60 0.10 -0.08 0.00 -0.80 0.00 0.00 31.60 31.41 2wk5 h MET 346 CO 0.12 -0.29 -0.30 -0.07 0.23 0.00 0.00 176.91 176.60 2wk5 h LEU 347 N -0.45 -0.98 -0.36 3.39 3.38 -1.59 1.41 115.31 120.11 2wk5 h LEU 347 Ca 0.09 0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 2wk5 h LEU 347 Cb 0.62 0.45 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 2wk5 h LEU 347 CO -0.48 -0.32 0.21 0.00 0.09 0.00 0.00 178.44 177.94 2wk5 h ALA 348 N 0.71 0.46 -0.57 1.53 0.00 -1.30 0.15 119.26 120.24 2wk5 h ALA 348 Ca 0.15 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2wk5 h ALA 348 Cb 0.52 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2wk5 h ALA 348 CO -0.46 -0.03 0.12 0.00 0.00 0.00 0.00 179.25 178.88 2wk5 h ALA 349 N 1.08 1.13 -0.31 0.00 0.00 0.77 -2.98 119.26 118.95 2wk5 h ALA 349 Ca 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2wk5 h ALA 349 Cb 0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2wk5 h ALA 349 CO -0.02 0.58 0.02 1.04 0.00 0.00 0.00 179.25 180.86 2wk5 n GLN 350 N -4.25 2.96 0.00 0.00 6.02 0.48 -4.91 117.38 117.68 2wk5 n GLN 350 Ca 0.04 -1.64 0.00 0.00 -0.01 0.00 0.00 57.00 55.39 2wk5 n GLN 350 Cb 0.25 -1.89 0.00 0.00 1.02 0.00 0.00 30.24 29.62 2wk5 n GLN 350 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wk5 n GLY 351 N 0.29 3.69 3.75 1.08 0.00 -0.94 -0.30 105.19 112.76 2wk5 n GLY 351 Ca 0.15 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 2wk5 n GLY 351 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wk5 s VAL 352 N 0.00 2.22 0.15 1.61 1.01 0.47 -4.48 120.40 121.39 2wk5 s VAL 352 Ca 0.00 0.19 -0.31 0.00 0.00 0.00 0.00 61.98 61.85 2wk5 s VAL 352 Cb 0.00 -3.12 -0.10 0.00 0.00 0.00 0.00 36.38 33.16 2wk5 s VAL 352 CO 0.00 0.03 1.64 -0.62 0.00 0.00 0.00 175.10 176.15 2wk5 s ASP 353 N 0.45 6.53 0.37 3.32 2.15 -1.26 -3.97 116.67 124.25 2wk5 s ASP 353 Ca 0.62 2.66 0.17 0.00 0.43 0.00 0.00 52.55 56.43 2wk5 s ASP 353 Cb -0.46 -2.59 1.12 0.00 -0.30 0.00 0.00 42.92 40.69 2wk5 s ASP 353 CO 0.47 -0.88 1.70 -0.65 -0.17 0.00 0.00 175.17 175.64 2wk5 h PRO 354 N 7.24 0.34 -0.55 4.34 0.11 -1.90 0.28 132.00 141.86 2wk5 h PRO 354 Ca -0.43 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.74 2wk5 h PRO 354 Cb 1.20 -0.08 -0.06 0.00 0.11 0.00 0.00 31.00 32.17 2wk5 h PRO 354 CO 0.93 0.23 0.20 0.78 -0.21 0.00 0.00 178.00 179.92 2wk5 h GLY 355 N 0.35 0.75 0.52 -0.55 0.00 -2.00 0.16 103.07 102.30 2wk5 h GLY 355 Ca 0.69 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.89 2wk5 h GLY 355 CO -0.46 -0.00 -0.25 -2.00 0.00 0.00 0.00 176.54 173.83 2wk5 h LEU 356 N 0.38 -0.59 -0.89 3.11 7.12 -0.84 -2.12 115.31 121.49 2wk5 h LEU 356 Ca 0.27 0.02 0.11 0.00 0.13 0.00 0.00 57.88 58.40 2wk5 h LEU 356 Cb 0.31 0.15 -0.12 0.00 -0.53 0.00 0.00 40.66 40.47 2wk5 h LEU 356 CO -0.27 -0.37 -0.44 0.00 -0.13 0.00 0.00 178.44 177.22 2wk5 n ALA 357 N -2.42 -0.36 0.03 1.25 0.00 -0.67 0.41 120.51 118.74 2wk5 n ALA 357 Ca -0.09 0.81 -0.10 0.00 0.00 0.00 0.00 53.44 54.06 2wk5 n ALA 357 Cb 0.28 -0.25 -0.04 0.00 0.00 0.00 0.00 19.45 19.44 2wk5 n ALA 357 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2wk5 h ARG 358 N 0.00 -0.15 -0.87 0.00 2.43 -0.72 -0.22 114.38 114.86 2wk5 h ARG 358 Ca 0.22 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.48 2wk5 h ARG 358 Cb 0.44 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.96 2wk5 h ARG 358 CO -0.85 -0.10 0.57 0.00 -1.51 0.00 0.00 179.97 178.08 2wk5 h ALA 359 N 0.87 1.60 -0.30 2.80 0.00 0.08 0.71 119.26 125.01 2wk5 h ALA 359 Ca 0.06 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2wk5 h ALA 359 Cb 0.23 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2wk5 h ALA 359 CO -0.14 0.25 -0.28 1.25 0.00 0.00 0.00 179.25 180.33 2wk5 h LEU 360 N 0.92 0.63 0.00 0.00 6.46 0.88 0.16 115.31 124.36 2wk5 h LEU 360 Ca 0.39 -0.23 -0.16 0.00 -0.12 0.00 0.00 57.88 57.76 2wk5 h LEU 360 Cb 0.31 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.04 2wk5 h LEU 360 CO -0.15 0.88 -0.88 0.00 -0.62 0.00 0.00 178.44 177.66 2wk5 h SER 362 N -1.00 0.00 -3.99 0.00 0.02 0.30 -3.45 113.55 105.43 2wk5 h SER 362 Ca -0.24 0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.22 2wk5 h SER 362 Cb 1.16 0.00 0.19 0.00 0.14 0.00 0.00 62.40 63.89 2wk5 h SER 362 CO -0.14 0.00 0.18 -0.83 -1.14 0.00 0.00 176.83 174.90 2wk5 s GLY 363 N -3.73 1.64 0.32 -3.77 0.00 0.54 -5.02 107.32 97.30 2wk5 s GLY 363 Ca 0.02 0.29 0.07 0.00 0.00 0.00 0.00 44.72 45.10 2wk5 s GLY 363 CO 0.40 0.79 0.36 -1.35 0.00 0.00 0.00 173.10 173.29 2wk5 s SER 364 N -2.81 5.70 0.00 1.64 1.04 -1.26 -4.89 113.70 113.12 2wk5 s SER 364 Ca 0.66 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.81 2wk5 s SER 364 Cb -0.22 -1.22 0.00 0.00 0.10 0.00 0.00 66.02 64.68 2wk5 s SER 364 CO 0.59 -0.32 0.66 -2.65 0.98 0.00 0.00 173.24 172.50 2wk5 n PRO 365 N -1.46 0.00 -0.13 4.02 -0.02 -1.26 -1.50 135.00 134.64 2wk5 n PRO 365 Ca -0.03 0.22 -0.26 0.00 -2.02 0.00 0.00 63.50 61.41 2wk5 n PRO 365 Cb 0.59 -1.60 -0.09 0.00 -0.02 0.00 0.00 33.50 32.37 2wk5 n PRO 365 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wk5 n ALA 366 N -1.16 1.11 -0.00 3.55 0.00 -1.26 -4.00 120.51 118.75 2wk5 n ALA 366 Ca 0.00 -1.01 0.06 0.00 0.00 0.00 0.00 53.44 52.49 2wk5 n ALA 366 Cb 0.10 0.07 0.46 0.00 0.00 0.00 0.00 19.45 20.08 2wk5 n ALA 366 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2wk5 h GLU 367 N -1.00 0.47 -0.33 0.00 4.57 -1.70 -0.87 114.58 115.71 2wk5 h GLU 367 Ca -0.57 -0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 57.48 2wk5 h GLU 367 Cb 1.49 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.96 2wk5 h GLU 367 CO -0.34 0.31 -0.24 0.00 -1.18 0.00 0.00 179.01 177.55 2wk5 h ARG 368 N 0.48 0.66 -0.49 1.92 3.08 -1.48 -2.40 114.38 116.16 2wk5 h ARG 368 Ca 0.17 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2wk5 h ARG 368 Cb 0.09 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2wk5 h ARG 368 CO -0.04 0.84 0.31 -0.09 -1.07 0.00 0.00 179.97 179.92 2wk5 h ARG 369 N 0.58 0.64 0.00 0.04 2.43 -1.30 -1.86 114.38 114.92 2wk5 h ARG 369 Ca 0.08 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2wk5 h ARG 369 Cb 0.72 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2wk5 h ARG 369 CO 0.06 0.44 -0.05 0.37 -1.51 0.00 0.00 179.97 179.27 2wk5 h GLN 370 N 0.66 0.00 -0.00 0.20 4.15 -1.11 -3.28 115.11 115.73 2wk5 h GLN 370 Ca 0.18 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.60 2wk5 h GLN 370 Cb -0.05 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.64 2wk5 h GLN 370 CO -0.04 0.00 -0.63 1.28 -1.93 0.00 0.00 178.83 177.52 2wk5 n LEU 371 N -2.90 0.82 -4.51 -2.39 4.32 -0.73 -4.93 117.00 106.68 2wk5 n LEU 371 Ca 0.04 -0.24 -0.24 0.00 -0.02 0.00 0.00 56.01 55.56 2wk5 n LEU 371 Cb 0.51 -0.14 -0.09 0.00 -1.62 0.00 0.00 43.42 42.07 2wk5 n LEU 371 CO 0.34 0.19 -0.45 -0.76 -1.22 0.00 0.00 177.39 175.49 2wk5 s LEU 372 N -2.91 2.73 0.13 2.23 1.43 -1.03 -4.88 118.68 116.38 2wk5 s LEU 372 Ca 0.12 -0.93 -0.35 0.00 -1.03 0.00 0.00 54.13 51.95 2wk5 s LEU 372 Cb 0.17 -1.26 -0.16 0.00 0.03 0.00 0.00 46.19 44.98 2wk5 s LEU 372 CO 0.72 0.04 1.27 -2.65 0.23 0.00 0.00 176.35 175.95 2wk5 n PRO 373 N -0.64 1.19 -4.30 1.29 -0.02 -1.26 -4.92 135.00 126.34 2wk5 n PRO 373 Ca -0.06 0.43 -0.24 0.00 -2.02 0.00 0.00 63.50 61.61 2wk5 n PRO 373 Cb 0.60 -2.01 -0.08 0.00 -0.02 0.00 0.00 33.50 31.99 2wk5 n PRO 373 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2wk5 s ARG 374 N 0.09 2.13 0.18 -0.52 0.52 -1.26 -4.56 118.95 115.52 2wk5 s ARG 374 Ca 0.79 -1.69 0.07 0.00 -0.52 0.00 0.00 55.73 54.37 2wk5 s ARG 374 Cb -0.90 -1.98 -0.04 0.00 0.52 0.00 0.00 34.95 32.56 2wk5 s ARG 374 CO 0.49 0.16 0.06 0.00 0.02 0.00 0.00 175.30 176.03 2wk5 s ALA 375 N -2.49 3.35 0.06 2.13 0.00 -1.26 -4.66 121.76 118.88 2wk5 s ALA 375 Ca 0.35 -1.34 -0.21 0.00 0.00 0.00 0.00 51.96 50.76 2wk5 s ALA 375 Cb -0.01 -1.12 -0.09 0.00 0.00 0.00 0.00 23.12 21.90 2wk5 s ALA 375 CO 0.20 0.45 1.33 -0.09 0.00 0.00 0.00 175.76 177.65 2wk5 h ARG 376 N 2.45 -0.50 -3.60 0.00 2.43 -1.85 -3.46 114.38 109.86 2wk5 h ARG 376 Ca -0.47 0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 58.58 2wk5 h ARG 376 Cb 1.21 0.11 -0.22 0.00 -0.42 0.00 0.00 29.97 30.66 2wk5 h ARG 376 CO 0.60 -0.33 -0.55 -2.00 -1.51 0.00 0.00 179.97 176.18 2wk5 s GLU 377 N -4.65 0.40 -0.07 0.20 2.12 -0.89 -5.05 118.70 110.76 2wk5 s GLU 377 Ca -0.10 -0.37 -0.03 0.00 0.36 0.00 0.00 54.97 54.83 2wk5 s GLU 377 Cb 0.03 0.16 0.04 0.00 0.26 0.00 0.00 34.13 34.63 2wk5 s GLU 377 CO 0.35 -0.09 0.16 1.14 -0.54 0.00 0.00 175.26 176.28 2wk5 s GLN 378 N -1.20 0.08 0.50 4.30 -2.07 -1.26 -2.21 119.66 117.80 2wk5 s GLN 378 Ca -0.13 0.45 0.08 0.00 -1.82 0.00 0.00 55.36 53.94 2wk5 s GLN 378 Cb -0.07 -0.20 0.04 0.00 -1.09 0.00 0.00 33.01 31.69 2wk5 s GLN 378 CO 0.01 -0.21 0.60 -1.21 -1.32 0.00 0.00 175.29 173.16 2wk5 s GLU 379 N 1.55 2.47 -0.05 9.60 2.02 -0.80 -4.92 118.70 128.57 2wk5 s GLU 379 Ca -0.05 -1.58 -0.01 0.00 0.02 0.00 0.00 54.97 53.35 2wk5 s GLU 379 Cb -0.12 -2.55 0.03 0.00 0.10 0.00 0.00 34.13 31.60 2wk5 s GLU 379 CO -0.06 -0.56 0.01 -1.21 0.02 0.00 0.00 175.26 173.46 2wk5 s GLU 380 N -4.43 0.40 -0.14 1.61 2.02 -1.26 -1.19 118.70 115.70 2wk5 s GLU 380 Ca 0.53 0.12 -0.23 0.00 0.02 0.00 0.00 54.97 55.41 2wk5 s GLU 380 Cb -0.06 -0.69 -0.03 0.00 0.10 0.00 0.00 34.13 33.45 2wk5 s GLU 380 CO 0.33 -0.22 0.73 -0.51 0.02 0.00 0.00 175.26 175.60 2wk5 s LEU 381 N 1.53 4.22 0.10 1.80 1.43 -0.49 -4.98 118.68 122.28 2wk5 s LEU 381 Ca -0.02 1.08 -0.25 0.00 -1.03 0.00 0.00 54.13 53.91 2wk5 s LEU 381 Cb -0.13 -3.08 -0.07 0.00 0.03 0.00 0.00 46.19 42.94 2wk5 s LEU 381 CO -0.03 -0.26 0.77 -0.76 0.23 0.00 0.00 176.35 176.30 2wk5 s LEU 382 N 1.57 4.52 0.26 1.79 1.43 -1.26 -1.44 118.68 125.55 2wk5 s LEU 382 Ca 0.35 1.54 -0.31 0.00 -1.03 0.00 0.00 54.13 54.69 2wk5 s LEU 382 Cb -0.17 -3.26 -0.12 0.00 0.03 0.00 0.00 46.19 42.67 2wk5 s LEU 382 CO 0.14 0.11 1.65 0.00 0.23 0.00 0.00 176.35 178.48 2wk5 n ALA 383 N 2.22 2.69 0.16 4.21 0.00 0.14 -4.81 120.51 125.11 2wk5 n ALA 383 Ca -0.04 0.38 0.09 0.00 0.00 0.00 0.00 53.44 53.87 2wk5 n ALA 383 Cb 0.49 -2.49 0.08 0.00 0.00 0.00 0.00 19.45 17.53 2wk5 n ALA 383 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2wk5 h PRO 384 N 5.54 0.00 -2.28 0.00 0.13 -1.93 0.36 132.00 133.82 2wk5 h PRO 384 Ca -0.46 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.60 2wk5 h PRO 384 Cb 1.21 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.14 2wk5 h PRO 384 CO 0.86 0.11 0.03 0.00 -0.23 0.00 0.00 178.00 178.77 2wk5 s ALA 385 N -3.18 -1.50 0.19 -0.56 0.00 -1.26 -4.80 121.76 110.64 2wk5 s ALA 385 Ca 0.04 1.36 -0.33 0.00 0.00 0.00 0.00 51.96 53.03 2wk5 s ALA 385 Cb 0.07 -0.46 -0.13 0.00 0.00 0.00 0.00 23.12 22.60 2wk5 s ALA 385 CO 0.73 -0.32 1.64 -0.25 0.00 0.00 0.00 175.76 177.56 2wk5 n ASP 386 N 1.84 3.52 -3.46 0.00 9.92 -1.26 -3.97 116.55 123.13 2wk5 n ASP 386 Ca -0.17 1.08 -0.02 0.00 -0.53 0.00 0.00 54.79 55.14 2wk5 n ASP 386 Cb 0.56 -1.50 0.01 0.00 -0.64 0.00 0.00 41.12 39.56 2wk5 n ASP 386 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2wk5 s GLY 387 N 1.00 0.02 -0.34 0.44 0.00 -0.69 -4.85 107.32 102.90 2wk5 s GLY 387 Ca 0.76 -0.20 -0.02 0.00 0.00 0.00 0.00 44.72 45.27 2wk5 s GLY 387 CO 0.36 2.34 0.07 -1.59 0.00 0.00 0.00 173.10 174.28 2wk5 s THR 388 N -2.30 3.12 -0.83 0.90 2.01 0.07 0.12 115.64 118.73 2wk5 s THR 388 Ca 0.21 -1.61 -0.34 0.00 0.31 0.00 0.00 61.69 60.26 2wk5 s THR 388 Cb -0.02 -2.92 -0.21 0.00 0.01 0.00 0.00 72.50 69.37 2wk5 s THR 388 CO 0.04 -0.31 2.48 0.52 -0.69 0.00 0.00 174.62 176.66 2wk5 n VAL 389 N 4.61 0.00 0.08 3.82 0.31 -0.37 -2.89 118.33 123.89 2wk5 n VAL 389 Ca -0.09 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.08 2wk5 n VAL 389 Cb 0.43 -0.49 -0.14 0.00 -0.91 0.00 0.00 33.84 32.73 2wk5 n VAL 389 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2wk5 h GLU 390 N 10.87 0.26 0.00 5.55 4.57 -1.58 -0.89 114.58 133.36 2wk5 h GLU 390 Ca -0.06 -0.44 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 2wk5 h GLU 390 Cb 1.32 0.16 0.00 0.00 -0.16 0.00 0.00 28.75 30.07 2wk5 h GLU 390 CO 1.27 1.16 0.00 1.47 -1.18 0.00 0.00 179.01 181.73 2wk5 n LEU 391 N -3.49 0.00 -4.34 1.64 -0.00 -1.24 -4.79 117.00 104.79 2wk5 n LEU 391 Ca -0.12 0.00 -0.36 0.00 -0.00 0.00 0.00 56.01 55.52 2wk5 n LEU 391 Cb 1.03 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 44.32 2wk5 n LEU 391 CO 0.52 0.00 -0.32 -0.69 -0.00 0.00 0.00 177.39 176.90 2wk5 s VAL 392 N -2.00 3.75 -0.18 1.47 1.01 -1.26 -1.99 120.40 121.20 2wk5 s VAL 392 Ca 0.00 -0.59 -0.32 0.00 0.00 0.00 0.00 61.98 61.07 2wk5 s VAL 392 Cb 0.00 -2.84 -0.10 0.00 0.00 0.00 0.00 36.38 33.44 2wk5 s VAL 392 CO 0.00 0.23 2.06 0.54 0.00 0.00 0.00 175.10 177.93 2wk5 n ARG 393 N 4.84 1.92 0.26 2.72 3.00 0.34 -4.13 116.66 125.60 2wk5 n ARG 393 Ca -0.16 0.63 -0.14 0.00 -0.01 0.00 0.00 57.85 58.16 2wk5 n ARG 393 Cb 0.49 -2.80 -0.08 0.00 0.00 0.00 0.00 32.46 30.08 2wk5 n ARG 393 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2wk5 h ALA 394 N 11.69 -0.67 -0.54 7.54 0.00 -0.41 -3.32 119.26 133.56 2wk5 h ALA 394 Ca -0.42 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.35 2wk5 h ALA 394 Cb 1.27 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 19.26 2wk5 h ALA 394 CO 0.97 -0.74 -0.32 -0.11 0.00 0.00 0.00 179.25 179.05 2wk5 n LEU 395 N -5.28 -0.57 -0.34 0.00 7.94 -1.26 -0.55 117.00 116.95 2wk5 n LEU 395 Ca -0.11 1.32 0.10 0.00 -1.11 0.00 0.00 56.01 56.21 2wk5 n LEU 395 Cb 0.31 -0.31 0.28 0.00 0.53 0.00 0.00 43.42 44.24 2wk5 n LEU 395 CO 0.31 -0.96 1.18 -0.65 -1.11 0.00 0.00 177.39 176.15 2wk5 h PRO 396 N 0.00 0.75 -0.10 1.96 0.11 -1.95 0.27 132.00 133.03 2wk5 h PRO 396 Ca 0.09 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.14 2wk5 h PRO 396 Cb 0.22 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.16 2wk5 h PRO 396 CO -0.51 0.50 0.04 1.25 -0.21 0.00 0.00 178.00 179.07 2wk5 h LEU 397 N 0.77 0.15 0.05 2.35 5.85 -1.17 0.10 115.31 123.41 2wk5 h LEU 397 Ca 0.53 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2wk5 h LEU 397 Cb 0.76 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 2wk5 h LEU 397 CO -0.36 0.29 -0.04 0.00 -0.34 0.00 0.00 178.44 178.00 2wk5 h ALA 398 N 0.86 -0.08 -0.41 1.25 0.00 0.34 -1.97 119.26 119.24 2wk5 h ALA 398 Ca 0.03 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2wk5 h ALA 398 Cb 0.20 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2wk5 h ALA 398 CO -0.00 -0.55 0.24 -0.07 0.00 0.00 0.00 179.25 178.87 2wk5 h LEU 399 N -0.09 0.38 -0.05 0.00 3.38 -0.41 -2.18 115.31 116.34 2wk5 h LEU 399 Ca -0.00 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wk5 h LEU 399 Cb 0.08 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2wk5 h LEU 399 CO -0.00 0.27 0.02 0.58 0.09 0.00 0.00 178.44 179.40 2wk5 h VAL 400 N 0.48 1.14 -0.66 1.22 2.07 -0.89 -2.67 116.25 116.94 2wk5 h VAL 400 Ca 0.17 -0.41 0.14 0.00 0.82 0.00 0.00 66.70 67.41 2wk5 h VAL 400 Cb 0.02 1.33 -0.12 0.00 -1.52 0.00 0.00 31.29 31.00 2wk5 h VAL 400 CO -0.08 0.11 -0.05 -0.07 0.02 0.00 0.00 177.57 177.50 2wk5 h LEU 401 N -0.08 -0.40 -0.90 2.57 4.07 -1.26 0.72 115.31 120.02 2wk5 h LEU 401 Ca 0.02 0.18 0.19 0.00 0.08 0.00 0.00 57.88 58.34 2wk5 h LEU 401 Cb 0.17 0.33 -0.11 0.00 1.08 0.00 0.00 40.66 42.13 2wk5 h LEU 401 CO -0.00 -0.16 0.45 -0.74 -1.08 0.00 0.00 178.44 176.91 2wk5 h HIS 402 N 0.07 0.77 0.00 1.13 2.76 -1.07 0.61 115.15 119.43 2wk5 h HIS 402 Ca 0.34 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.50 2wk5 h HIS 402 Cb 0.55 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.31 2wk5 h HIS 402 CO -0.43 0.08 -0.20 0.93 -1.30 0.00 0.00 177.93 177.01 2wk5 h GLU 403 N 0.54 0.00 -0.05 5.26 5.08 -0.57 -2.81 114.58 122.04 2wk5 h GLU 403 Ca 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.89 2wk5 h GLU 403 Cb 0.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 2wk5 h GLU 403 CO -0.45 0.20 0.00 1.28 -1.00 0.00 0.00 179.01 179.04 2wk5 n LEU 404 N -3.53 0.74 0.00 1.33 4.77 0.21 -4.88 117.00 115.64 2wk5 n LEU 404 Ca -0.01 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 2wk5 n LEU 404 Cb 0.35 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 2wk5 n LEU 404 CO 0.32 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2wk5 n GLY 405 N 1.00 0.81 0.12 -0.72 0.00 -1.06 -4.71 105.19 100.62 2wk5 n GLY 405 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 2wk5 n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk5 h ALA 406 N 0.00 0.67 -3.26 4.61 0.00 -1.65 -1.28 119.26 118.34 2wk5 h ALA 406 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 2wk5 h ALA 406 Cb 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.38 2wk5 h ALA 406 CO 0.00 0.00 -0.67 0.20 0.00 0.00 0.00 179.25 178.78 2wk5 s GLY 407 N -4.03 2.16 -1.15 0.00 0.00 -1.21 -4.86 107.32 98.23 2wk5 s GLY 407 Ca 0.04 -3.01 -0.24 0.00 0.00 0.00 0.00 44.72 41.51 2wk5 s GLY 407 CO 0.73 1.19 2.01 -2.13 0.00 0.00 0.00 173.10 174.89 2wk5 n ARG 408 N 3.31 0.97 0.00 2.90 0.63 -1.26 -4.63 116.66 118.57 2wk5 n ARG 408 Ca 0.06 -2.15 0.14 0.00 -0.92 0.00 0.00 57.85 54.97 2wk5 n ARG 408 Cb 0.33 -3.83 0.46 0.00 0.45 0.00 0.00 32.46 29.88 2wk5 n ARG 408 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2wk5 n SER 409 N 16.83 1.18 -0.07 6.15 2.88 -1.26 -4.53 113.62 134.81 2wk5 n SER 409 Ca 0.43 -1.14 -0.12 0.00 -1.33 0.00 0.00 58.87 56.72 2wk5 n SER 409 Cb 0.47 0.06 -0.10 0.00 -0.75 0.00 0.00 64.21 63.88 2wk5 n SER 409 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2wk5 h ARG 410 N 1.65 0.00 0.00 -1.46 2.47 -1.95 -3.43 114.38 111.67 2wk5 h ARG 410 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2wk5 h ARG 410 Cb 0.49 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 2wk5 h ARG 410 CO 0.00 0.80 0.00 0.00 0.56 0.00 0.00 179.97 181.33 2wk5 n ALA 411 N -2.69 0.00 -1.02 0.04 0.00 -1.26 -5.02 120.51 110.56 2wk5 n ALA 411 Ca -0.09 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.15 2wk5 n ALA 411 Cb 0.40 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.88 2wk5 n ALA 411 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wk5 n GLY 412 N 0.00 4.37 3.78 0.00 0.00 -1.26 -4.96 105.19 107.12 2wk5 n GLY 412 Ca 0.00 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.38 2wk5 n GLY 412 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wk5 s GLU 413 N -2.08 1.63 0.79 1.61 -1.05 -1.26 -5.07 118.70 113.27 2wk5 s GLU 413 Ca 0.38 0.57 -0.12 0.00 -0.15 0.00 0.00 54.97 55.66 2wk5 s GLU 413 Cb 0.29 -1.87 0.06 0.00 -0.44 0.00 0.00 34.13 32.18 2wk5 s GLU 413 CO -0.03 -1.92 1.14 -1.25 0.95 0.00 0.00 175.26 174.15 2wk5 s PRO 414 N -5.14 2.16 0.36 -4.83 0.04 -1.26 -4.93 135.00 121.40 2wk5 s PRO 414 Ca 0.62 0.29 0.08 0.00 0.04 0.00 0.00 61.00 62.03 2wk5 s PRO 414 Cb -0.15 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 2wk5 s PRO 414 CO 0.55 -1.49 0.20 -0.51 0.04 0.00 0.00 177.00 175.78 2wk5 s LEU 415 N -5.58 3.30 -0.90 -3.56 1.02 -1.26 -4.84 118.68 106.86 2wk5 s LEU 415 Ca 0.61 -0.78 -0.11 0.00 0.02 0.00 0.00 54.13 53.86 2wk5 s LEU 415 Cb -0.12 -1.79 0.23 0.00 0.02 0.00 0.00 46.19 44.53 2wk5 s LEU 415 CO 0.51 -0.39 0.84 -0.13 0.02 0.00 0.00 176.35 177.20 2wk5 s ARG 416 N -3.91 3.69 0.00 1.70 0.52 -0.49 -4.89 118.95 115.56 2wk5 s ARG 416 Ca 0.40 -2.73 0.04 0.00 -0.52 0.00 0.00 55.73 52.92 2wk5 s ARG 416 Cb -0.02 -4.39 0.25 0.00 0.52 0.00 0.00 34.95 31.31 2wk5 s ARG 416 CO 0.24 -1.27 0.71 1.28 0.02 0.00 0.00 175.30 176.29 2wk5 n LEU 417 N 3.48 0.00 -0.06 2.53 4.77 -1.26 -2.20 117.00 124.25 2wk5 n LEU 417 Ca 0.17 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.93 2wk5 n LEU 417 Cb 0.44 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.40 2wk5 n LEU 417 CO 0.37 0.00 -0.98 0.61 -1.33 0.00 0.00 177.39 176.06 2wk5 n GLY 418 N -0.71 -0.53 3.55 -0.72 0.00 -1.26 -1.00 105.19 104.52 2wk5 n GLY 418 Ca 0.03 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 2wk5 n GLY 418 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wk5 n VAL 419 N -3.61 2.65 -1.79 1.61 0.31 -0.94 -4.47 118.33 112.09 2wk5 n VAL 419 Ca -0.38 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.45 2wk5 n VAL 419 Cb 0.97 -0.95 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 2wk5 n VAL 419 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wk5 n GLY 420 N 1.44 -1.82 3.03 2.92 0.00 -0.90 -4.00 105.19 105.87 2wk5 n GLY 420 Ca 0.11 -1.15 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 2wk5 n GLY 420 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wk5 s ALA 421 N -1.51 0.07 -0.17 4.61 0.00 0.85 -0.76 121.76 124.85 2wk5 s ALA 421 Ca 0.00 -0.59 -0.00 0.00 0.00 0.00 0.00 51.96 51.37 2wk5 s ALA 421 Cb 0.00 0.17 0.04 0.00 0.00 0.00 0.00 23.12 23.33 2wk5 s ALA 421 CO 0.00 -0.22 -0.06 -1.21 0.00 0.00 0.00 175.76 174.27 2wk5 s GLU 422 N -1.91 1.53 0.03 0.00 2.02 0.27 -1.99 118.70 118.64 2wk5 s GLU 422 Ca -0.11 -0.55 -0.30 0.00 0.02 0.00 0.00 54.97 54.02 2wk5 s GLU 422 Cb -0.06 -2.05 -0.06 0.00 0.10 0.00 0.00 34.13 32.06 2wk5 s GLU 422 CO -0.02 -0.42 1.40 -0.51 0.02 0.00 0.00 175.26 175.73 2wk5 s LEU 423 N 1.60 4.33 0.00 1.80 1.43 0.24 -1.04 118.68 127.04 2wk5 s LEU 423 Ca 0.01 2.17 0.22 0.00 -1.03 0.00 0.00 54.13 55.49 2wk5 s LEU 423 Cb -0.15 -3.57 0.55 0.00 0.03 0.00 0.00 46.19 43.05 2wk5 s LEU 423 CO -0.08 -0.70 1.47 0.18 0.23 0.00 0.00 176.35 177.45 2wk5 n LEU 424 N 5.05 3.46 -4.20 1.79 4.77 -0.36 -4.88 117.00 122.63 2wk5 n LEU 424 Ca 0.13 -1.64 -0.17 0.00 -0.03 0.00 0.00 56.01 54.30 2wk5 n LEU 424 Cb 0.43 -0.36 -0.07 0.00 -2.33 0.00 0.00 43.42 41.09 2wk5 n LEU 424 CO 0.59 0.82 -0.03 0.68 -1.33 0.00 0.00 177.39 178.11 2wk5 s VAL 425 N -1.27 0.00 0.05 4.08 -7.23 -1.24 -4.86 120.40 109.92 2wk5 s VAL 425 Ca 0.42 -1.85 0.04 0.00 -1.81 0.00 0.00 61.98 58.78 2wk5 s VAL 425 Cb 0.23 -2.54 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 2wk5 s VAL 425 CO 0.31 0.00 -0.11 -1.81 -0.31 0.00 0.00 175.10 173.18 2wk5 s ASP 426 N -3.29 1.25 0.20 4.85 1.01 -1.26 -5.05 116.67 114.37 2wk5 s ASP 426 Ca 0.37 -0.53 -0.31 0.00 0.71 0.00 0.00 52.55 52.78 2wk5 s ASP 426 Cb 0.02 -0.02 -0.11 0.00 1.01 0.00 0.00 42.92 43.82 2wk5 s ASP 426 CO 0.23 -0.11 1.59 -0.69 0.21 0.00 0.00 175.17 176.40 2wk5 s VAL 427 N -1.19 2.44 0.00 -1.27 1.01 -1.26 -0.26 120.40 119.86 2wk5 s VAL 427 Ca -0.05 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.26 2wk5 s VAL 427 Cb -0.09 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.08 2wk5 s VAL 427 CO 0.01 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.75 2wk5 n GLY 428 N 3.41 2.93 3.78 4.51 0.00 -0.34 -3.63 105.19 115.85 2wk5 n GLY 428 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2wk5 n GLY 428 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2wk5 s GLN 429 N -0.91 3.71 -0.19 1.61 0.74 0.64 -1.45 119.66 123.81 2wk5 s GLN 429 Ca 0.00 1.56 -0.13 0.00 0.05 0.00 0.00 55.36 56.84 2wk5 s GLN 429 Cb 0.00 -2.21 -0.05 0.00 1.10 0.00 0.00 33.01 31.86 2wk5 s GLN 429 CO 0.00 -0.54 0.26 0.50 -0.55 0.00 0.00 175.29 174.96 2wk5 s ARG 430 N -3.01 4.20 0.13 1.67 3.52 -1.26 -1.24 118.95 122.96 2wk5 s ARG 430 Ca 0.67 -0.00 0.05 0.00 -0.13 0.00 0.00 55.73 56.32 2wk5 s ARG 430 Cb -0.22 -3.46 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 2wk5 s ARG 430 CO 0.27 0.17 0.05 -1.17 -0.81 0.00 0.00 175.30 173.80 2wk5 s LEU 431 N 0.71 3.57 -0.27 -0.88 0.20 0.32 -4.94 118.68 117.39 2wk5 s LEU 431 Ca 0.14 -0.18 0.02 0.00 0.69 0.00 0.00 54.13 54.79 2wk5 s LEU 431 Cb -0.13 -2.25 0.06 0.00 -0.43 0.00 0.00 46.19 43.44 2wk5 s LEU 431 CO 0.04 0.13 -0.08 0.00 -0.29 0.00 0.00 176.35 176.14 2wk5 s ARG 432 N -2.66 2.27 -0.06 1.98 1.70 -1.26 -1.70 118.95 119.22 2wk5 s ARG 432 Ca 0.28 -1.34 -0.02 0.00 -0.47 0.00 0.00 55.73 54.18 2wk5 s ARG 432 Cb -0.11 -2.97 -0.01 0.00 -0.57 0.00 0.00 34.95 31.29 2wk5 s ARG 432 CO 0.20 -0.59 0.15 -2.13 -1.08 0.00 0.00 175.30 171.86 2wk5 n ARG 433 N 4.47 0.00 0.00 3.89 0.63 -1.25 -0.95 116.66 123.45 2wk5 n ARG 433 Ca -0.13 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.80 2wk5 n ARG 433 Cb 0.42 -0.08 0.00 0.00 0.45 0.00 0.00 32.46 33.25 2wk5 n ARG 433 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wk5 n GLY 434 N 0.37 1.05 3.76 5.14 0.00 0.13 -4.87 105.19 110.77 2wk5 n GLY 434 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2wk5 n GLY 434 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wk5 s THR 435 N -0.69 2.46 0.18 2.61 2.01 -0.12 -4.19 115.64 117.91 2wk5 s THR 435 Ca 0.00 0.42 -0.31 0.00 0.31 0.00 0.00 61.69 62.11 2wk5 s THR 435 Cb 0.00 -3.27 -0.09 0.00 0.01 0.00 0.00 72.50 69.15 2wk5 s THR 435 CO 0.00 0.08 1.46 -2.84 -0.69 0.00 0.00 174.62 172.64 2wk5 s PRO 436 N -1.07 4.27 0.00 4.92 0.02 -1.26 0.24 135.00 142.12 2wk5 s PRO 436 Ca 0.56 2.25 0.02 0.00 0.02 0.00 0.00 61.00 63.85 2wk5 s PRO 436 Cb -0.43 -3.17 -0.02 0.00 0.02 0.00 0.00 34.50 30.90 2wk5 s PRO 436 CO 0.50 -0.48 0.19 -2.67 -0.33 0.00 0.00 177.00 174.21 2wk5 n TRP 437 N 3.36 0.00 -3.72 6.54 4.27 -0.52 -4.83 117.44 122.55 2wk5 n TRP 437 Ca 0.10 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.58 2wk5 n TRP 437 Cb 0.40 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.26 2wk5 n TRP 437 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 2wk5 s LEU 438 N -1.79 0.23 -0.24 5.67 2.96 -1.22 -1.22 118.68 123.08 2wk5 s LEU 438 Ca 0.01 0.93 0.02 0.00 -0.22 0.00 0.00 54.13 54.87 2wk5 s LEU 438 Cb 0.02 1.58 0.05 0.00 0.50 0.00 0.00 46.19 48.33 2wk5 s LEU 438 CO 0.09 -0.16 -0.13 -0.60 -1.32 0.00 0.00 176.35 174.23 2wk5 s ARG 439 N 0.27 2.48 0.04 1.98 3.52 -0.21 -1.40 118.95 125.63 2wk5 s ARG 439 Ca -0.00 -1.19 -0.18 0.00 -0.13 0.00 0.00 55.73 54.23 2wk5 s ARG 439 Cb -0.03 -2.81 -0.06 0.00 -1.56 0.00 0.00 34.95 30.48 2wk5 s ARG 439 CO 0.00 -0.46 0.51 0.08 -0.81 0.00 0.00 175.30 174.62 2wk5 s VAL 440 N 1.17 4.85 -0.42 7.11 1.01 -0.33 -0.56 120.40 133.22 2wk5 s VAL 440 Ca -0.05 1.07 0.04 0.00 0.00 0.00 0.00 61.98 63.04 2wk5 s VAL 440 Cb -0.18 -3.83 0.11 0.00 0.00 0.00 0.00 36.38 32.49 2wk5 s VAL 440 CO -0.07 0.56 0.15 -1.00 0.00 0.00 0.00 175.10 174.74 2wk5 s HIS 441 N -1.08 3.51 0.19 5.22 0.09 0.06 -1.91 115.29 121.37 2wk5 s HIS 441 Ca 0.27 -3.07 0.07 0.00 -0.00 0.00 0.00 55.06 52.33 2wk5 s HIS 441 Cb -0.18 -2.89 -0.04 0.00 -0.00 0.00 0.00 32.58 29.47 2wk5 s HIS 441 CO 0.17 -0.86 0.07 -0.98 -0.00 0.00 0.00 174.74 173.14 2wk5 s ARG 442 N 0.37 2.61 -0.02 1.40 1.70 -0.94 -2.11 118.95 121.97 2wk5 s ARG 442 Ca 0.14 -1.06 0.18 0.00 -0.47 0.00 0.00 55.73 54.51 2wk5 s ARG 442 Cb -0.22 -2.45 -0.26 0.00 -0.57 0.00 0.00 34.95 31.45 2wk5 s ARG 442 CO -0.04 0.45 0.47 -0.25 -1.08 0.00 0.00 175.30 174.84 2wk5 n ASP 443 N -0.42 0.90 -2.31 -2.89 10.43 -1.26 -2.08 116.55 118.92 2wk5 n ASP 443 Ca -0.09 -0.20 -0.03 0.00 2.57 0.00 0.00 54.79 57.05 2wk5 n ASP 443 Cb 0.56 1.64 0.02 0.00 1.84 0.00 0.00 41.12 45.17 2wk5 n ASP 443 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2wk5 n GLY 444 N 1.47 -1.61 0.10 0.44 0.00 -1.26 -4.77 105.19 99.56 2wk5 n GLY 444 Ca -0.02 -1.60 0.12 0.00 0.00 0.00 0.00 46.02 44.53 2wk5 n GLY 444 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2wk5 n PRO 445 N -1.43 0.35 -3.51 1.61 -0.04 -1.26 -4.73 135.00 125.98 2wk5 n PRO 445 Ca 0.01 -0.21 0.03 0.00 -0.04 0.00 0.00 63.50 63.30 2wk5 n PRO 445 Cb 0.05 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.02 2wk5 n PRO 445 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wk5 n ALA 446 N -1.15 -2.88 -2.82 0.55 0.00 -1.26 -5.09 120.51 107.86 2wk5 n ALA 446 Ca 0.08 -0.57 -0.34 0.00 0.00 0.00 0.00 53.44 52.61 2wk5 n ALA 446 Cb 0.34 0.05 -0.12 0.00 0.00 0.00 0.00 19.45 19.72 2wk5 n ALA 446 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wk5 s LEU 447 N 0.00 3.27 0.69 0.00 1.43 -1.26 -5.03 118.68 117.77 2wk5 s LEU 447 Ca 0.24 -0.06 -0.15 0.00 -1.03 0.00 0.00 54.13 53.13 2wk5 s LEU 447 Cb -0.00 -1.76 0.01 0.00 0.03 0.00 0.00 46.19 44.47 2wk5 s LEU 447 CO -0.01 0.25 1.13 -0.94 0.23 0.00 0.00 176.35 177.01 2wk5 s SER 448 N -0.13 4.84 0.20 2.29 1.04 -1.26 -4.68 113.70 116.00 2wk5 s SER 448 Ca 0.02 2.07 -0.14 0.00 0.48 0.00 0.00 55.95 58.38 2wk5 s SER 448 Cb -0.13 -2.56 0.22 0.00 0.10 0.00 0.00 66.02 63.65 2wk5 s SER 448 CO 0.03 -1.82 1.64 1.23 0.98 0.00 0.00 173.24 175.30 2wk5 h GLY 449 N -0.14 0.46 0.67 7.32 0.00 -1.99 0.32 103.07 109.71 2wk5 h GLY 449 Ca -0.47 0.17 0.06 0.00 0.00 0.00 0.00 47.33 47.09 2wk5 h GLY 449 CO 0.53 -0.21 0.36 -2.55 0.00 0.00 0.00 176.54 174.66 2wk5 h PRO 450 N 0.02 0.64 0.42 4.80 0.11 -1.98 -0.26 132.00 135.75 2wk5 h PRO 450 Ca 0.28 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.33 2wk5 h PRO 450 Cb 0.44 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.41 2wk5 h PRO 450 CO -0.57 0.42 -0.20 1.96 -0.21 0.00 0.00 178.00 179.40 2wk5 h GLN 451 N 0.66 -0.54 -0.28 1.05 4.20 -1.68 -1.42 115.11 117.10 2wk5 h GLN 451 Ca 0.29 0.04 0.06 0.00 0.06 0.00 0.00 58.65 59.11 2wk5 h GLN 451 Cb 0.19 0.12 -0.08 0.00 0.30 0.00 0.00 27.48 28.02 2wk5 h GLN 451 CO -0.19 -0.23 -0.34 1.03 -0.67 0.00 0.00 178.83 178.43 2wk5 h SER 452 N -0.94 -1.09 -0.57 1.46 0.87 -0.93 -0.53 113.55 111.81 2wk5 h SER 452 Ca -0.06 0.18 0.09 0.00 -1.23 0.00 0.00 61.79 60.77 2wk5 h SER 452 Cb 0.56 0.49 -0.03 0.00 -0.44 0.00 0.00 62.40 62.97 2wk5 h SER 452 CO 0.09 -0.34 0.38 -0.09 -0.53 0.00 0.00 176.83 176.34 2wk5 h ARG 453 N -0.33 0.40 0.38 2.24 2.43 -1.08 -2.11 114.38 116.32 2wk5 h ARG 453 Ca 0.13 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 2wk5 h ARG 453 Cb 0.55 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2wk5 h ARG 453 CO -0.46 0.27 -0.18 0.00 -1.51 0.00 0.00 179.97 178.08 2wk5 h ALA 454 N 1.71 -0.51 -0.56 2.80 0.00 0.02 -2.90 119.26 119.82 2wk5 h ALA 454 Ca 0.26 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.12 2wk5 h ALA 454 Cb 0.48 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 2wk5 h ALA 454 CO -0.07 -0.73 0.15 -0.07 0.00 0.00 0.00 179.25 178.53 2wk5 h LEU 455 N -0.62 0.07 -1.12 0.00 3.38 -0.67 -1.83 115.31 114.53 2wk5 h LEU 455 Ca -0.05 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.05 2wk5 h LEU 455 Cb 0.45 0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 2wk5 h LEU 455 CO 0.08 0.06 0.60 1.56 0.09 0.00 0.00 178.44 180.83 2wk5 h GLN 456 N 0.30 1.10 0.00 1.13 1.08 -1.42 -1.57 115.11 115.72 2wk5 h GLN 456 Ca 0.29 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.40 2wk5 h GLN 456 Cb 0.39 -0.25 -0.00 0.00 -0.05 0.00 0.00 27.48 27.57 2wk5 h GLN 456 CO -0.34 0.73 -0.11 0.93 -0.95 0.00 0.00 178.83 179.09 2wk5 h GLU 457 N 1.14 0.00 0.00 1.46 3.07 -1.13 -2.81 114.58 116.30 2wk5 h GLU 457 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 2wk5 h GLU 457 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 2wk5 h GLU 457 CO -0.11 0.11 0.00 0.00 -1.40 0.00 0.00 179.01 177.61 2wk5 n ALA 458 N -2.18 1.57 -2.48 3.43 0.00 -0.59 -4.51 120.51 115.76 2wk5 n ALA 458 Ca -0.00 0.05 -0.43 0.00 0.00 0.00 0.00 53.44 53.06 2wk5 n ALA 458 Cb 0.33 -1.32 -0.09 0.00 0.00 0.00 0.00 19.45 18.37 2wk5 n ALA 458 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2wk5 s LEU 459 N -3.98 4.95 -0.13 0.00 0.20 -1.06 0.13 118.68 118.77 2wk5 s LEU 459 Ca 0.04 -0.75 -0.14 0.00 0.69 0.00 0.00 54.13 53.97 2wk5 s LEU 459 Cb 0.09 -2.31 -0.05 0.00 -0.43 0.00 0.00 46.19 43.49 2wk5 s LEU 459 CO 0.32 -0.54 0.33 -0.69 -0.29 0.00 0.00 176.35 175.48 2wk5 s VAL 460 N 1.99 5.27 -0.03 1.68 1.01 -0.84 -5.03 120.40 124.45 2wk5 s VAL 460 Ca 0.10 0.63 0.05 0.00 0.00 0.00 0.00 61.98 62.75 2wk5 s VAL 460 Cb -0.18 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 2wk5 s VAL 460 CO 0.12 0.41 -0.17 -0.76 0.00 0.00 0.00 175.10 174.71 2wk5 s LEU 461 N 0.25 1.97 0.18 3.92 1.43 -1.26 -1.45 118.68 123.72 2wk5 s LEU 461 Ca 0.19 -0.32 0.09 0.00 -1.03 0.00 0.00 54.13 53.06 2wk5 s LEU 461 Cb -0.14 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.15 2wk5 s LEU 461 CO 0.06 0.18 -0.19 -0.94 0.23 0.00 0.00 176.35 175.69 2wk5 s SER 462 N -0.19 2.89 -0.55 2.29 1.04 -1.14 -4.82 113.70 113.21 2wk5 s SER 462 Ca 0.02 -0.89 -0.03 0.00 0.48 0.00 0.00 55.95 55.53 2wk5 s SER 462 Cb -0.09 -0.19 0.16 0.00 0.10 0.00 0.00 66.02 66.00 2wk5 s SER 462 CO 0.00 -0.01 2.52 0.47 0.98 0.00 0.00 173.24 177.20 2wk5 n ASP 463 N 0.15 6.78 -4.42 7.02 8.00 -1.26 -0.75 116.55 132.07 2wk5 n ASP 463 Ca -0.12 -3.38 -0.30 0.00 0.71 0.00 0.00 54.79 51.70 2wk5 n ASP 463 Cb 0.57 -1.17 -0.13 0.00 -0.02 0.00 0.00 41.12 40.37 2wk5 n ASP 463 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2wk5 s ARG 464 N -2.38 1.96 0.11 -1.24 6.06 -1.26 -5.04 118.95 117.15 2wk5 s ARG 464 Ca 0.56 -1.04 -0.34 0.00 -2.50 0.00 0.00 55.73 52.41 2wk5 s ARG 464 Cb 0.39 -2.11 -0.18 0.00 0.06 0.00 0.00 34.95 33.11 2wk5 s ARG 464 CO -0.25 0.53 0.83 0.00 -2.50 0.00 0.00 175.30 173.91 2wk5 n ALA 465 N 1.58 -3.00 -1.68 6.12 0.00 -1.26 -4.70 120.51 117.57 2wk5 n ALA 465 Ca -0.16 0.51 -0.39 0.00 0.00 0.00 0.00 53.44 53.39 2wk5 n ALA 465 Cb 0.52 -1.72 0.03 0.00 0.00 0.00 0.00 19.45 18.28 2wk5 n ALA 465 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2wk5 n PRO 466 N 1.30 1.52 -4.42 0.00 -0.04 -1.26 -5.01 135.00 127.09 2wk5 n PRO 466 Ca 0.19 0.55 -0.22 0.00 -0.04 0.00 0.00 63.50 63.98 2wk5 n PRO 466 Cb 0.17 -2.33 -0.09 0.00 -0.04 0.00 0.00 33.50 31.21 2wk5 n PRO 466 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2wk5 s PHE 467 N -1.31 1.72 -0.13 0.54 -0.12 -0.53 -5.00 117.98 113.15 2wk5 s PHE 467 Ca 0.68 -1.32 -0.18 0.00 -0.05 0.00 0.00 56.93 56.07 2wk5 s PHE 467 Cb -0.47 -1.01 -0.04 0.00 -0.63 0.00 0.00 43.02 40.87 2wk5 s PHE 467 CO 0.52 -0.40 0.47 0.00 -0.05 0.00 0.00 175.22 175.76 2wk5 s ALA 468 N -3.40 3.48 0.59 1.99 0.00 -1.26 -4.00 121.76 119.16 2wk5 s ALA 468 Ca 0.31 -0.22 -0.19 0.00 0.00 0.00 0.00 51.96 51.87 2wk5 s ALA 468 Cb 0.04 -2.64 -0.06 0.00 0.00 0.00 0.00 23.12 20.46 2wk5 s ALA 468 CO 0.17 -0.02 0.90 0.00 0.00 0.00 0.00 175.76 176.80 2wk5 n ALA 469 N 3.74 -0.02 -2.70 0.00 0.00 -1.24 -4.94 120.51 115.35 2wk5 n ALA 469 Ca -0.07 0.01 -0.21 0.00 0.00 0.00 0.00 53.44 53.17 2wk5 n ALA 469 Cb 0.52 -2.06 0.09 0.00 0.00 0.00 0.00 19.45 17.99 2wk5 n ALA 469 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2wk5 n PRO 470 N -0.79 0.16 -3.31 0.00 -0.04 -1.26 -5.08 135.00 124.67 2wk5 n PRO 470 Ca 0.13 -2.52 -0.38 0.00 -0.04 0.00 0.00 63.50 60.68 2wk5 n PRO 470 Cb 0.47 -0.49 -0.06 0.00 -0.04 0.00 0.00 33.50 33.38 2wk5 n PRO 470 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2wk5 s SER 471 N -4.50 6.94 0.30 3.54 0.15 -1.26 -4.93 113.70 113.93 2wk5 s SER 471 Ca 0.58 1.12 0.26 0.00 0.70 0.00 0.00 55.95 58.61 2wk5 s SER 471 Cb -0.04 -2.33 0.86 0.00 -1.71 0.00 0.00 66.02 62.81 2wk5 s SER 471 CO 0.38 0.21 1.76 1.55 1.20 0.00 0.00 173.24 178.34 2wk5 h PRO 472 N 5.10 0.00 -6.26 5.44 0.13 -1.92 -3.44 132.00 131.05 2wk5 h PRO 472 Ca -0.48 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.10 2wk5 h PRO 472 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2wk5 h PRO 472 CO 0.66 0.00 0.84 0.12 -0.23 0.00 0.00 178.00 179.39 2wk5 s PHE 473 N -3.25 2.87 0.00 1.56 2.19 -1.26 0.37 117.98 120.46 2wk5 s PHE 473 Ca 0.07 0.95 0.00 0.00 0.33 0.00 0.00 56.93 58.28 2wk5 s PHE 473 Cb 0.10 -3.56 0.00 0.00 -1.31 0.00 0.00 43.02 38.25 2wk5 s PHE 473 CO 0.54 -1.97 0.00 0.00 1.83 0.00 0.00 175.22 175.62 2wk5 n ALA 474 N 5.93 0.00 -2.24 11.12 0.00 0.23 -4.97 120.51 130.58 2wk5 n ALA 474 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2wk5 n ALA 474 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 2wk5 n ALA 474 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2wk5 n GLU 475 N 0.00 1.42 -3.76 0.00 0.28 -1.25 -4.90 120.64 112.44 2wk5 n GLU 475 Ca 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.87 2wk5 n GLU 475 Cb 0.00 0.00 -0.11 0.00 1.43 0.00 0.00 31.44 32.76 2wk5 n GLU 475 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 2wk5 s LEU 476 N 0.00 0.71 -0.53 -1.84 2.96 -1.26 -2.77 118.68 115.94 2wk5 s LEU 476 Ca 0.00 0.63 -0.04 0.00 -0.22 0.00 0.00 54.13 54.50 2wk5 s LEU 476 Cb 0.00 1.04 0.14 0.00 0.50 0.00 0.00 46.19 47.86 2wk5 s LEU 476 CO 0.00 -0.12 0.35 -0.69 -1.32 0.00 0.00 176.35 174.57 2wk5 s VAL 477 N 0.39 3.64 0.76 1.68 1.01 0.28 -4.99 120.40 123.17 2wk5 s VAL 477 Ca -0.02 -2.51 -0.11 0.00 0.00 0.00 0.00 61.98 59.34 2wk5 s VAL 477 Cb -0.04 -3.41 0.05 0.00 0.00 0.00 0.00 36.38 32.98 2wk5 s VAL 477 CO -0.02 -0.80 1.10 -0.76 0.00 0.00 0.00 175.10 174.62 2wk5 s LEU 478 N 0.52 3.07 -0.61 3.92 1.43 -1.26 -1.34 118.68 124.41 2wk5 s LEU 478 Ca 0.13 1.86 -0.26 0.00 -1.03 0.00 0.00 54.13 54.83 2wk5 s LEU 478 Cb -0.21 -4.53 -0.08 0.00 0.03 0.00 0.00 46.19 41.40 2wk5 s LEU 478 CO -0.04 -2.03 2.30 -2.16 0.23 0.00 0.00 176.35 174.66 2wk5 s PRO 479 N -4.79 2.07 1.33 1.29 0.04 -1.16 -4.87 135.00 128.91 2wk5 s PRO 479 Ca 0.62 0.94 -0.20 0.00 0.04 0.00 0.00 61.00 62.40 2wk5 s PRO 479 Cb -0.18 -4.64 0.32 0.00 0.04 0.00 0.00 34.50 30.04 2wk5 s PRO 479 CO 0.54 -3.51 0.75 -0.35 0.04 0.00 0.00 177.00 174.47 2wk5 n PRO 480 N 8.98 -3.91 0.00 0.56 -0.04 -1.26 -5.09 135.00 134.24 2wk5 n PRO 480 Ca 0.37 -1.15 0.00 0.00 -0.04 0.00 0.00 63.50 62.68 2wk5 n PRO 480 Cb 0.51 -1.85 0.00 0.00 -0.04 0.00 0.00 33.50 32.12 2wk5 n PRO 480 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40