#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1suf n ASN 5 N 0.00 0.18 0.22 1.08 0.23 -1.26 -0.65 115.26 115.05 1suf n ASN 5 Ca 0.00 0.55 0.13 0.00 -0.53 0.00 0.00 54.58 54.73 1suf n ASN 5 Cb 0.00 -0.58 0.30 0.00 -2.08 0.00 0.00 39.78 37.41 1suf n ASN 5 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 1suf h LEU 6 N 0.00 0.00 0.00 -4.53 3.38 -2.02 -3.36 115.31 108.78 1suf h LEU 6 Ca 0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.68 1suf h LEU 6 Cb 0.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1suf h LEU 6 CO 0.00 0.00 -1.56 0.29 0.09 0.00 0.00 178.44 177.26 1suf n LYS 7 N -3.00 0.58 -3.92 1.13 5.02 0.17 -4.36 118.16 113.78 1suf n LYS 7 Ca 0.03 0.50 -0.12 0.00 -2.02 0.00 0.00 58.31 56.71 1suf n LYS 7 Cb 0.47 -1.69 -0.14 0.00 -0.02 0.00 0.00 35.03 33.65 1suf n LYS 7 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1suf s SER 8 N -7.00 0.11 0.00 4.39 0.15 -0.65 -1.19 113.70 109.51 1suf s SER 8 Ca -0.31 -0.10 0.29 0.00 0.70 0.00 0.00 55.95 56.54 1suf s SER 8 Cb 0.08 0.01 1.36 0.00 -1.71 0.00 0.00 66.02 65.75 1suf s SER 8 CO 0.57 -0.05 1.92 0.35 1.20 0.00 0.00 173.24 177.24 1suf n THR 9 N 2.80 0.00 -2.96 6.45 -2.24 -0.64 -4.13 114.28 113.56 1suf n THR 9 Ca -0.14 -0.11 -0.41 0.00 -2.27 0.00 0.00 64.05 61.11 1suf n THR 9 Cb 0.59 0.02 -0.05 0.00 -2.10 0.00 0.00 70.33 68.79 1suf n THR 9 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1suf s ASP 10 N -2.16 6.73 0.40 3.42 -1.08 -1.26 -4.96 116.67 117.76 1suf s ASP 10 Ca 0.38 0.88 0.12 0.00 -0.52 0.00 0.00 52.55 53.41 1suf s ASP 10 Cb 0.21 -2.40 0.81 0.00 -1.46 0.00 0.00 42.92 40.08 1suf s ASP 10 CO 0.39 -0.49 1.90 0.03 0.52 0.00 0.00 175.17 177.52 1suf h ARG 11 N 7.81 0.07 -0.37 4.34 3.08 -1.96 -0.31 114.38 127.05 1suf h ARG 11 Ca -0.24 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 59.68 1suf h ARG 11 Cb 1.10 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 1suf h ARG 11 CO 0.85 0.32 -0.21 0.00 -1.07 0.00 0.00 179.97 179.87 1suf h ALA 12 N 1.68 0.52 -0.59 0.04 0.00 -1.94 -1.87 119.26 117.11 1suf h ALA 12 Ca 0.01 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1suf h ALA 12 Cb 0.49 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1suf h ALA 12 CO 0.03 0.48 0.26 0.28 0.00 0.00 0.00 179.25 180.31 1suf h VAL 13 N 0.58 1.22 -0.64 0.00 2.07 -1.80 -2.07 116.25 115.61 1suf h VAL 13 Ca 0.08 -0.65 0.06 0.00 0.82 0.00 0.00 66.70 67.01 1suf h VAL 13 Cb 0.76 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 1suf h VAL 13 CO 0.06 0.26 0.34 1.56 0.02 0.00 0.00 177.57 179.81 1suf h GLN 14 N 0.82 0.62 -0.87 1.57 4.20 -0.96 0.11 115.11 120.59 1suf h GLN 14 Ca 0.20 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 1suf h GLN 14 Cb 0.16 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.76 1suf h GLN 14 CO -0.02 0.41 0.46 0.37 -0.67 0.00 0.00 178.83 179.38 1suf h GLN 15 N 0.63 1.22 0.00 1.46 4.15 -1.07 -2.08 115.11 119.42 1suf h GLN 15 Ca 0.29 -0.15 -0.12 0.00 0.77 0.00 0.00 58.65 59.44 1suf h GLN 15 Cb 0.20 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 1suf h GLN 15 CO -0.19 0.90 -0.56 0.52 -1.93 0.00 0.00 178.83 177.57 1suf h MET 16 N 1.21 0.00 -0.46 1.69 2.86 -0.74 -2.19 114.93 117.30 1suf h MET 16 Ca 0.30 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.88 1suf h MET 16 Cb 0.05 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1suf h MET 16 CO -0.05 0.56 0.04 -0.07 1.06 0.00 0.00 176.91 178.46 1suf h LEU 17 N 0.00 0.69 -0.53 1.22 3.38 -0.26 0.12 115.31 119.93 1suf h LEU 17 Ca -0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 1suf h LEU 17 Cb 1.05 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1suf h LEU 17 CO 0.07 0.74 0.10 0.44 0.09 0.00 0.00 178.44 179.89 1suf h ASP 18 N 0.70 0.83 -0.35 -0.43 3.32 -1.09 -0.37 116.42 119.02 1suf h ASP 18 Ca 0.15 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1suf h ASP 18 Cb 0.37 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1suf h ASP 18 CO 0.01 0.86 0.08 0.50 -1.72 0.00 0.00 179.24 178.98 1suf h LYS 19 N 0.75 0.56 -0.94 3.56 3.64 -0.89 -1.44 116.57 121.81 1suf h LYS 19 Ca 0.16 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1suf h LYS 19 Cb 0.38 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.08 1suf h LYS 19 CO 0.01 0.61 0.60 0.00 -2.27 0.00 0.00 179.45 178.40 1suf h ALA 20 N 0.92 1.29 0.03 5.00 0.00 -0.65 -1.36 119.26 124.49 1suf h ALA 20 Ca 0.11 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1suf h ALA 20 Cb 0.31 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1suf h ALA 20 CO 0.00 0.64 -0.01 -0.22 0.00 0.00 0.00 179.25 179.66 1suf h LYS 21 N 1.28 -0.04 0.00 0.00 3.64 -0.86 -0.62 116.57 119.97 1suf h LYS 21 Ca 0.34 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1suf h LYS 21 Cb -0.11 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1suf h LYS 21 CO -0.07 0.05 -0.03 0.07 -2.27 0.00 0.00 179.45 177.19 1suf h ARG 22 N -0.12 0.00 -0.01 1.90 0.11 -1.01 -2.67 114.38 112.58 1suf h ARG 22 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1suf h ARG 22 Cb 0.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.18 1suf h ARG 22 CO 0.01 0.03 -0.13 0.39 0.10 0.00 0.00 179.97 180.37 1suf n GLU 23 N -3.13 1.25 -2.23 0.08 1.02 -0.54 -4.96 120.64 112.13 1suf n GLU 23 Ca 0.01 -0.73 -0.11 0.00 -0.02 0.00 0.00 57.16 56.31 1suf n GLU 23 Cb 0.38 -1.48 -0.00 0.00 -0.02 0.00 0.00 31.44 30.31 1suf n GLU 23 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1suf n GLY 24 N 1.26 -0.10 3.59 0.62 0.00 -0.37 -5.00 105.19 105.19 1suf n GLY 24 Ca 0.16 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 1suf n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1suf s ILE 25 N -2.58 5.07 0.15 -0.61 1.01 -0.46 -5.03 121.20 118.75 1suf s ILE 25 Ca 0.01 0.56 -0.30 0.00 0.00 0.00 0.00 60.65 60.91 1suf s ILE 25 Cb -0.00 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.54 1suf s ILE 25 CO 0.01 -0.03 1.26 -1.58 0.00 0.00 0.00 174.94 174.60 1suf s GLN 26 N 2.28 4.42 0.43 2.79 0.74 -1.26 -4.55 119.66 124.51 1suf s GLN 26 Ca 0.18 1.94 0.07 0.00 0.05 0.00 0.00 55.36 57.60 1suf s GLN 26 Cb -0.16 -3.25 -0.04 0.00 1.10 0.00 0.00 33.01 30.66 1suf s GLN 26 CO 0.11 -0.22 0.20 0.95 -0.55 0.00 0.00 175.29 175.78 1suf s THR 27 N 0.39 2.23 0.36 -0.34 -4.23 -1.26 -4.99 115.64 107.80 1suf s THR 27 Ca 0.57 -1.67 0.10 0.00 -1.18 0.00 0.00 61.69 59.50 1suf s THR 27 Cb -0.34 -2.90 0.33 0.00 1.34 0.00 0.00 72.50 70.93 1suf s THR 27 CO 0.35 0.00 1.87 1.62 -0.54 0.00 0.00 174.62 177.92 1suf h VAL 28 N 1.35 0.82 -0.23 2.29 3.04 -1.96 -0.33 116.25 121.23 1suf h VAL 28 Ca -0.42 -0.23 -0.11 0.00 -1.01 0.00 0.00 66.70 64.93 1suf h VAL 28 Cb 1.26 0.10 -0.01 0.00 -2.01 0.00 0.00 31.29 30.63 1suf h VAL 28 CO 0.68 0.12 -0.31 -0.50 -1.01 0.00 0.00 177.57 176.56 1suf h TRP 29 N 0.66 0.53 -0.33 3.17 6.55 -1.96 -0.62 115.95 123.96 1suf h TRP 29 Ca 0.45 -0.13 -0.16 0.00 0.95 0.00 0.00 58.89 60.00 1suf h TRP 29 Cb 0.75 -0.13 -0.01 0.00 -0.86 0.00 0.00 29.16 28.92 1suf h TRP 29 CO -0.00 0.73 -0.43 -0.44 -1.05 0.00 0.00 178.44 177.25 1suf h ASP 30 N 0.41 0.89 0.11 -3.49 3.32 -1.58 -1.30 116.42 114.78 1suf h ASP 30 Ca 0.05 -0.42 -0.10 0.00 0.02 0.00 0.00 57.03 56.58 1suf h ASP 30 Cb 0.74 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1suf h ASP 30 CO 0.06 1.19 -0.34 0.03 -1.72 0.00 0.00 179.24 178.46 1suf h ARG 31 N 0.67 0.33 -0.04 3.56 3.08 -0.86 -1.42 114.38 119.71 1suf h ARG 31 Ca 0.05 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 1suf h ARG 31 Cb 1.00 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.04 1suf h ARG 31 CO 0.10 0.64 0.01 -0.92 -1.07 0.00 0.00 179.97 178.73 1suf h TYR 32 N 0.29 0.06 -0.95 3.04 3.20 -1.01 -2.53 116.97 119.07 1suf h TYR 32 Ca 0.03 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.00 1suf h TYR 32 Cb 0.75 -0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.93 1suf h TYR 32 CO 0.02 0.24 0.61 1.49 -1.64 0.00 0.00 178.16 178.88 1suf h GLU 33 N -0.14 0.95 0.00 1.82 4.57 -0.94 -0.08 114.58 120.77 1suf h GLU 33 Ca 0.01 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1suf h GLU 33 Cb 0.21 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 1suf h GLU 33 CO -0.00 0.63 0.00 0.00 -1.18 0.00 0.00 179.01 178.46 1suf n ALA 34 N -2.38 1.66 0.65 2.92 0.00 -0.56 -2.48 120.51 120.32 1suf n ALA 34 Ca 0.17 0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.81 1suf n ALA 34 Cb 0.30 -1.38 0.16 0.00 0.00 0.00 0.00 19.45 18.52 1suf n ALA 34 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1suf n MET 35 N -2.22 0.24 -2.54 0.00 0.00 -0.05 -4.93 117.12 107.61 1suf n MET 35 Ca 0.02 0.05 -0.37 0.00 -0.00 0.00 0.00 57.70 57.40 1suf n MET 35 Cb 0.23 -1.63 -0.04 0.00 0.00 0.00 0.00 33.22 31.78 1suf n MET 35 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1suf s LYS 36 N -3.14 4.23 0.30 2.12 1.02 -1.03 -3.48 119.74 119.75 1suf s LYS 36 Ca 0.07 1.54 -0.27 0.00 0.02 0.00 0.00 55.97 57.33 1suf s LYS 36 Cb 0.14 -2.62 -0.10 0.00 -0.52 0.00 0.00 37.83 34.73 1suf s LYS 36 CO 0.73 -0.09 0.94 -1.25 -0.92 0.00 0.00 175.35 174.77 1suf s PRO 37 N -2.36 4.65 0.61 -1.68 0.04 -1.26 -5.08 135.00 129.92 1suf s PRO 37 Ca 0.56 1.37 -0.12 0.00 0.04 0.00 0.00 61.00 62.84 1suf s PRO 37 Cb -0.23 -2.91 -0.04 0.00 0.04 0.00 0.00 34.50 31.36 1suf s PRO 37 CO 0.29 0.33 1.03 -0.65 0.04 0.00 0.00 177.00 178.04 1suf s GLN 38 N -1.86 3.55 0.12 4.56 -0.21 -1.23 -4.96 119.66 119.64 1suf s GLN 38 Ca 0.48 0.85 -0.31 0.00 0.02 0.00 0.00 55.36 56.40 1suf s GLN 38 Cb -0.20 -2.07 -0.09 0.00 1.00 0.00 0.00 33.01 31.64 1suf s GLN 38 CO 0.26 -0.60 1.57 0.00 -2.12 0.00 0.00 175.29 174.40 1suf h GLY 40 N 7.47 0.00 0.60 0.00 0.00 -1.99 -1.71 103.07 107.44 1suf h GLY 40 Ca -0.42 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 1suf h GLY 40 CO 0.91 0.00 -0.01 0.74 0.00 0.00 0.00 176.54 178.19 1suf h PHE 41 N 0.00 -0.02 -0.38 5.60 0.04 -1.90 -2.74 116.94 117.53 1suf h PHE 41 Ca 0.00 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.70 1suf h PHE 41 Cb 0.81 0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.95 1suf h PHE 41 CO 0.00 0.38 -0.04 0.78 -0.60 0.00 0.00 178.31 178.82 1suf h GLY 42 N -0.42 0.68 1.41 -1.45 0.00 -1.83 0.03 103.07 101.49 1suf h GLY 42 Ca -0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 1suf h GLY 42 CO 0.00 0.42 0.25 0.83 0.00 0.00 0.00 176.54 178.04 1suf h GLU 43 N 0.59 0.76 -0.01 4.80 5.08 -1.32 -2.50 114.58 121.99 1suf h GLU 43 Ca 0.12 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1suf h GLU 43 Cb 0.44 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1suf h GLU 43 CO 0.02 0.60 -0.30 0.25 -1.00 0.00 0.00 179.01 178.59 1suf n THR 44 N -4.36 0.00 -0.53 1.13 -2.24 -1.04 -4.11 114.28 103.13 1suf n THR 44 Ca 0.05 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1suf n THR 44 Cb 0.14 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.93 1suf n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1suf n GLY 45 N 1.35 0.90 2.47 3.38 0.00 -0.60 -0.78 105.19 111.90 1suf n GLY 45 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1suf n GLY 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1suf n LEU 46 N 0.00 7.49 -3.78 0.99 4.77 -0.10 -4.16 117.00 122.21 1suf n LEU 46 Ca 0.00 -4.57 -0.13 0.00 -0.03 0.00 0.00 56.01 51.28 1suf n LEU 46 Cb 0.00 -1.32 -0.11 0.00 -2.33 0.00 0.00 43.42 39.66 1suf n LEU 46 CO 0.00 1.95 -0.05 0.00 -1.33 0.00 0.00 177.39 177.96 1suf n ARG 49 N 3.81 1.14 0.00 0.00 1.74 -1.26 -0.91 116.66 121.18 1suf n ARG 49 Ca -0.23 -2.91 0.15 0.00 -0.77 0.00 0.00 57.85 54.09 1suf n ARG 49 Cb 0.53 -1.10 0.87 0.00 -1.02 0.00 0.00 32.46 31.74 1suf n ARG 49 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1suf n HIS 50 N -0.55 0.00 -4.06 -1.55 8.25 -1.26 -4.83 115.22 111.22 1suf n HIS 50 Ca 0.15 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.49 1suf n HIS 50 Cb 0.86 -0.09 -0.05 0.00 1.12 0.00 0.00 29.99 31.83 1suf n HIS 50 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1suf n LEU 52 N -0.48 0.18 0.12 0.00 4.77 -1.26 -1.94 117.00 118.39 1suf n LEU 52 Ca -0.00 -0.07 0.12 0.00 -0.03 0.00 0.00 56.01 56.03 1suf n LEU 52 Cb 0.62 -0.01 0.26 0.00 -2.33 0.00 0.00 43.42 41.96 1suf n LEU 52 CO 0.28 0.04 0.67 1.56 -1.33 0.00 0.00 177.39 178.60 1suf h GLN 53 N 0.23 0.00 0.00 3.23 4.20 -1.97 -3.46 115.11 117.34 1suf h GLN 53 Ca 0.00 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 1suf h GLN 53 Cb 0.05 0.00 0.06 0.00 0.30 0.00 0.00 27.48 27.89 1suf h GLN 53 CO 0.00 0.00 0.12 0.41 -0.67 0.00 0.00 178.83 178.69 1suf n GLY 54 N 1.25 -1.59 3.75 3.46 0.00 -0.82 -4.79 105.19 106.46 1suf n GLY 54 Ca 0.04 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 1suf n GLY 54 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1suf s PRO 55 N -3.94 4.61 0.08 1.61 0.04 -1.26 -5.04 135.00 131.10 1suf s PRO 55 Ca 0.25 1.79 0.03 0.00 0.04 0.00 0.00 61.00 63.11 1suf s PRO 55 Cb -0.01 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 1suf s PRO 55 CO 0.18 0.14 0.07 0.00 0.04 0.00 0.00 177.00 177.43 1suf s ARG 57 N -2.36 0.88 -0.06 0.00 1.70 -1.26 -0.60 118.95 117.25 1suf s ARG 57 Ca 0.29 -1.17 0.01 0.00 -0.47 0.00 0.00 55.73 54.38 1suf s ARG 57 Cb -0.12 0.30 0.02 0.00 -0.57 0.00 0.00 34.95 34.58 1suf s ARG 57 CO 0.21 -0.27 -0.07 0.42 -1.08 0.00 0.00 175.30 174.52 1suf s ILE 58 N -3.94 0.76 0.19 4.99 1.01 -0.88 -4.69 121.20 118.65 1suf s ILE 58 Ca 0.12 -0.24 -0.32 0.00 0.00 0.00 0.00 60.65 60.22 1suf s ILE 58 Cb 0.06 -0.76 -0.11 0.00 0.01 0.00 0.00 42.46 41.66 1suf s ILE 58 CO -0.05 0.28 1.71 0.20 0.00 0.00 0.00 174.94 177.08 1suf s ASN 59 N 0.97 6.42 0.24 3.58 0.02 -0.44 -4.82 114.94 120.90 1suf s ASN 59 Ca -0.10 2.82 -0.05 0.00 -1.02 0.00 0.00 52.86 54.51 1suf s ASN 59 Cb -0.15 -2.59 0.42 0.00 0.02 0.00 0.00 41.25 38.95 1suf s ASN 59 CO 0.00 -0.95 1.74 -0.65 0.02 0.00 0.00 177.10 177.25 1suf h PRO 60 N 7.02 0.44 -3.87 -0.60 0.11 -1.93 -3.43 132.00 129.74 1suf h PRO 60 Ca -0.43 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 65.50 1suf h PRO 60 Cb 1.20 -0.10 -0.20 0.00 0.11 0.00 0.00 31.00 32.01 1suf h PRO 60 CO 0.95 0.29 -0.63 -0.06 -0.21 0.00 0.00 178.00 178.34 1suf s PHE 61 N -6.03 0.22 0.00 0.65 0.08 -1.26 -5.10 117.98 106.54 1suf s PHE 61 Ca -0.12 -0.48 0.00 0.00 0.12 0.00 0.00 56.93 56.45 1suf s PHE 61 Cb 0.20 -0.17 0.00 0.00 -0.57 0.00 0.00 43.02 42.48 1suf s PHE 61 CO 0.76 -0.25 0.00 0.41 -0.10 0.00 0.00 175.22 176.04 1suf n GLY 62 N 1.36 0.39 0.00 4.36 0.00 -1.26 -5.05 105.19 104.99 1suf n GLY 62 Ca -0.22 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1suf n GLY 62 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1suf n ASP 63 N 0.00 0.19 -4.74 1.61 8.00 -1.26 -5.06 116.55 115.30 1suf n ASP 63 Ca 0.00 -0.48 -0.35 0.00 0.71 0.00 0.00 54.79 54.68 1suf n ASP 63 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.17 1suf n ASP 63 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1suf s GLU 64 N 0.51 2.47 0.31 -1.24 2.02 -1.26 -4.42 118.70 117.09 1suf s GLU 64 Ca 0.00 1.75 -0.28 0.00 0.02 0.00 0.00 54.97 56.46 1suf s GLU 64 Cb 0.00 -1.87 -0.09 0.00 0.10 0.00 0.00 34.13 32.26 1suf s GLU 64 CO 0.00 -1.58 1.10 -1.25 0.02 0.00 0.00 175.26 173.55 1suf s PRO 65 N -3.74 4.53 -0.00 0.39 0.04 -1.26 -4.91 135.00 130.04 1suf s PRO 65 Ca 0.75 1.77 0.07 0.00 0.04 0.00 0.00 61.00 63.63 1suf s PRO 65 Cb -0.29 -3.06 -0.09 0.00 0.04 0.00 0.00 34.50 31.10 1suf s PRO 65 CO 0.41 0.12 0.24 1.63 0.04 0.00 0.00 177.00 179.45 1suf n LYS 66 N 0.92 2.91 -3.68 4.56 5.02 -1.26 -1.33 118.16 125.31 1suf n LYS 66 Ca 0.00 -0.03 -0.15 0.00 -2.02 0.00 0.00 58.31 56.12 1suf n LYS 66 Cb 0.46 -0.97 -0.08 0.00 -0.02 0.00 0.00 35.03 34.42 1suf n LYS 66 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1suf s VAL 67 N -2.00 0.04 0.88 -0.18 0.11 -1.26 -4.63 120.40 113.36 1suf s VAL 67 Ca 0.01 -0.33 -0.11 0.00 -2.93 0.00 0.00 61.98 58.61 1suf s VAL 67 Cb 0.05 -0.77 0.12 0.00 -1.53 0.00 0.00 36.38 34.25 1suf s VAL 67 CO 0.29 -0.18 1.09 -0.83 -3.33 0.00 0.00 175.10 172.15 1suf s GLY 68 N -1.36 1.63 0.33 6.54 0.00 0.22 -4.90 107.32 109.77 1suf s GLY 68 Ca -0.12 0.01 0.01 0.00 0.00 0.00 0.00 44.72 44.63 1suf s GLY 68 CO 0.05 0.48 1.96 -2.22 0.00 0.00 0.00 173.10 173.38 1suf h ILE 69 N -1.52 1.18 -0.00 0.90 2.04 -1.95 -0.16 117.51 118.00 1suf h ILE 69 Ca -0.49 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1suf h ILE 69 Cb 1.28 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1suf h ILE 69 CO 0.53 0.20 -0.01 0.00 0.00 0.00 0.00 178.15 178.87 1suf n GLY 71 N 1.11 0.71 3.70 0.00 0.00 -0.07 -5.07 105.19 105.58 1suf n GLY 71 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1suf n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1suf s ALA 72 N -2.00 3.72 0.80 4.61 0.00 -1.25 -4.69 121.76 122.95 1suf s ALA 72 Ca 0.00 1.27 -0.11 0.00 0.00 0.00 0.00 51.96 53.13 1suf s ALA 72 Cb 0.00 -3.66 0.09 0.00 0.00 0.00 0.00 23.12 19.55 1suf s ALA 72 CO 0.00 -0.94 1.15 0.95 0.00 0.00 0.00 175.76 176.91 1suf s THR 73 N 1.93 2.08 0.26 0.00 -4.23 -1.26 -0.61 115.64 113.80 1suf s THR 73 Ca 0.72 -0.09 -0.03 0.00 -1.18 0.00 0.00 61.69 61.11 1suf s THR 73 Cb -0.41 -2.99 0.24 0.00 1.34 0.00 0.00 72.50 70.68 1suf s THR 73 CO 0.32 0.00 1.84 0.00 -0.54 0.00 0.00 174.62 176.24 1suf h ALA 74 N -0.99 1.30 -0.15 3.99 0.00 -1.93 -0.10 119.26 121.37 1suf h ALA 74 Ca -0.45 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.31 1suf h ALA 74 Cb 1.31 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1suf h ALA 74 CO 0.61 0.25 -0.57 1.05 0.00 0.00 0.00 179.25 180.59 1suf h GLU 75 N 0.97 0.48 0.04 0.00 4.11 -1.93 -0.43 114.58 117.82 1suf h GLU 75 Ca 0.42 -0.31 -0.00 0.00 0.07 0.00 0.00 59.36 59.54 1suf h GLU 75 Cb 0.29 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1suf h GLU 75 CO -0.21 0.91 -0.02 0.28 0.07 0.00 0.00 179.01 180.04 1suf h VAL 76 N 0.36 1.11 -0.41 -1.06 2.07 -1.82 -1.85 116.25 114.65 1suf h VAL 76 Ca 0.00 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.06 1suf h VAL 76 Cb 1.10 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 1suf h VAL 76 CO 0.10 0.12 0.27 0.40 0.02 0.00 0.00 177.57 178.48 1suf h ILE 77 N -0.26 1.10 -0.56 4.57 2.04 -0.90 -0.37 117.51 123.13 1suf h ILE 77 Ca -0.01 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1suf h ILE 77 Cb 0.24 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 1suf h ILE 77 CO 0.01 0.10 0.24 0.58 0.00 0.00 0.00 178.15 179.08 1suf h VAL 78 N 0.55 1.21 -0.31 1.67 2.07 -1.09 -1.47 116.25 118.88 1suf h VAL 78 Ca 0.15 -0.64 -0.11 0.00 0.82 0.00 0.00 66.70 66.92 1suf h VAL 78 Cb -0.06 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1suf h VAL 78 CO -0.04 0.25 -0.28 0.00 0.02 0.00 0.00 177.57 177.53 1suf h ALA 79 N 1.09 0.93 -0.40 1.67 0.00 -0.99 -1.75 119.26 119.81 1suf h ALA 79 Ca 0.19 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1suf h ALA 79 Cb 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1suf h ALA 79 CO -0.02 0.61 -0.10 0.00 0.00 0.00 0.00 179.25 179.75 1suf h ARG 80 N 0.55 0.78 -0.57 0.00 3.08 -0.86 -0.77 114.38 116.59 1suf h ARG 80 Ca 0.07 -0.30 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 1suf h ARG 80 Cb 0.76 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.74 1suf h ARG 80 CO 0.06 0.91 0.13 0.78 -1.07 0.00 0.00 179.97 180.79 1suf h GLY 81 N 0.60 0.99 0.98 0.04 0.00 -1.15 -1.52 103.07 103.01 1suf h GLY 81 Ca 0.10 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 1suf h GLY 81 CO 0.04 0.58 0.27 -2.00 0.00 0.00 0.00 176.54 175.43 1suf h LEU 82 N 0.83 0.60 -0.84 3.11 5.85 -1.19 -2.15 115.31 121.52 1suf h LEU 82 Ca 0.18 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.84 1suf h LEU 82 Cb 0.35 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 1suf h LEU 82 CO 0.00 0.51 0.55 0.44 -0.34 0.00 0.00 178.44 179.60 1suf h ASP 83 N 0.64 0.92 0.03 1.25 5.19 -0.93 -1.24 116.42 122.28 1suf h ASP 83 Ca 0.17 -0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.51 1suf h ASP 83 Cb 0.05 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.33 1suf h ASP 83 CO -0.03 0.64 -0.16 0.03 -3.12 0.00 0.00 179.24 176.61 1suf h ARG 84 N 1.08 0.26 -0.57 3.56 3.08 -0.93 -1.08 114.38 119.79 1suf h ARG 84 Ca 0.33 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 1suf h ARG 84 Cb -0.04 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 1suf h ARG 84 CO -0.10 0.43 0.31 0.77 -1.07 0.00 0.00 179.97 180.31 1suf h SER 85 N 0.25 0.71 -0.42 7.04 0.02 -0.68 -0.45 113.55 120.02 1suf h SER 85 Ca 0.05 -0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1suf h SER 85 Cb 0.44 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1suf h SER 85 CO 0.03 0.60 0.13 0.40 -1.14 0.00 0.00 176.83 176.84 1suf h ILE 86 N 0.76 1.22 -0.83 3.27 2.04 -0.80 -0.97 117.51 122.21 1suf h ILE 86 Ca 0.20 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 1suf h ILE 86 Cb 0.05 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 1suf h ILE 86 CO -0.03 0.26 0.37 0.00 0.00 0.00 0.00 178.15 178.75 1suf h ALA 87 N 0.97 1.09 -0.57 1.87 0.00 -0.95 -0.30 119.26 121.39 1suf h ALA 87 Ca 0.13 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1suf h ALA 87 Cb 0.27 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1suf h ALA 87 CO -0.00 0.67 0.19 0.00 0.00 0.00 0.00 179.25 180.11 1suf h ALA 88 N 1.21 0.74 -0.35 0.00 0.00 -0.84 0.77 119.26 120.79 1suf h ALA 88 Ca 0.28 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1suf h ALA 88 Cb 0.16 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1suf h ALA 88 CO -0.03 0.39 0.14 0.78 0.00 0.00 0.00 179.25 180.53 1suf h GLY 89 N 0.79 0.56 1.05 0.00 0.00 -0.77 -2.32 103.07 102.38 1suf h GLY 89 Ca 0.19 -0.30 0.05 0.00 0.00 0.00 0.00 47.33 47.26 1suf h GLY 89 CO -0.01 0.29 0.52 0.00 0.00 0.00 0.00 176.54 177.34 1suf h ALA 90 N 0.99 1.57 -0.41 3.60 0.00 -0.77 -1.85 119.26 122.38 1suf h ALA 90 Ca 0.12 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1suf h ALA 90 Cb 0.18 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1suf h ALA 90 CO -0.01 0.33 -0.08 0.00 0.00 0.00 0.00 179.25 179.49 1suf h ALA 91 N 1.55 1.09 -0.05 0.00 0.00 -0.49 0.17 119.26 121.53 1suf h ALA 91 Ca 0.33 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1suf h ALA 91 Cb 0.13 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1suf h ALA 91 CO -0.10 0.57 -0.02 0.78 0.00 0.00 0.00 179.25 180.47 1suf h GLY 92 N 0.97 0.12 1.87 0.00 0.00 -0.83 -1.10 103.07 104.10 1suf h GLY 92 Ca 0.12 -0.10 -0.09 0.00 0.00 0.00 0.00 47.33 47.25 1suf h GLY 92 CO 0.03 0.09 -0.39 0.45 0.00 0.00 0.00 176.54 176.73 1suf h HIS 93 N -0.27 0.17 0.00 5.60 -0.00 -1.30 -1.85 115.15 117.50 1suf h HIS 93 Ca 0.01 -0.04 -0.06 0.00 -0.00 0.00 0.00 60.37 60.28 1suf h HIS 93 Cb 0.45 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 27.81 1suf h HIS 93 CO 0.07 0.52 -0.72 0.66 -0.00 0.00 0.00 177.93 178.46 1suf h SER 94 N 0.13 0.00 -0.62 2.45 4.64 -0.63 -1.19 113.55 118.33 1suf h SER 94 Ca 0.01 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.35 1suf h SER 94 Cb 0.75 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.80 1suf h SER 94 CO 0.06 0.24 0.39 1.23 -0.87 0.00 0.00 176.83 177.88 1suf h GLY 95 N 3.82 0.89 0.81 -0.77 0.00 -1.04 0.15 103.07 106.93 1suf h GLY 95 Ca -0.04 -0.30 0.02 0.00 0.00 0.00 0.00 47.33 47.01 1suf h GLY 95 CO 0.03 0.27 -0.04 0.84 0.00 0.00 0.00 176.54 177.64 1suf h HIS 96 N 0.78 -0.08 -0.55 5.60 6.17 -1.14 -1.55 115.15 124.38 1suf h HIS 96 Ca 0.24 0.01 -0.10 0.00 0.71 0.00 0.00 60.37 61.23 1suf h HIS 96 Cb -0.01 0.05 -0.02 0.00 2.52 0.00 0.00 27.41 29.95 1suf h HIS 96 CO -0.05 -0.06 -0.04 0.00 0.71 0.00 0.00 177.93 178.49 1suf h ALA 97 N 1.04 0.75 -0.86 5.26 0.00 -0.92 -2.46 119.26 122.07 1suf h ALA 97 Ca 0.04 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1suf h ALA 97 Cb 0.09 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1suf h ALA 97 CO -0.09 0.61 0.57 -0.22 0.00 0.00 0.00 179.25 180.11 1suf h LYS 98 N 0.88 1.13 -0.25 0.00 3.64 -0.55 -0.74 116.57 120.67 1suf h LYS 98 Ca 0.15 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.48 1suf h LYS 98 Cb 0.60 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 1suf h LYS 98 CO 0.04 0.74 0.11 1.25 -2.27 0.00 0.00 179.45 179.32 1suf h HIS 99 N 1.16 0.19 -0.60 1.91 2.76 -0.98 -0.67 115.15 118.93 1suf h HIS 99 Ca 0.32 0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.41 1suf h HIS 99 Cb -0.13 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 28.76 1suf h HIS 99 CO -0.00 0.10 0.05 -0.07 -1.30 0.00 0.00 177.93 176.71 1suf h LEU 100 N 0.23 0.97 -0.42 0.26 3.38 -1.02 -1.55 115.31 117.15 1suf h LEU 100 Ca 0.10 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1suf h LEU 100 Cb 0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1suf h LEU 100 CO -0.09 0.99 0.24 0.00 0.09 0.00 0.00 178.44 179.67 1suf h ALA 101 N 1.11 0.54 -0.35 1.53 0.00 -0.66 -0.13 119.26 121.30 1suf h ALA 101 Ca 0.18 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1suf h ALA 101 Cb 0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1suf h ALA 101 CO 0.02 0.06 -0.07 0.45 0.00 0.00 0.00 179.25 179.71 1suf h HIS 102 N 0.55 0.62 -0.15 0.00 3.86 -1.01 -1.39 115.15 117.62 1suf h HIS 102 Ca 0.15 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.25 1suf h HIS 102 Cb 0.04 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1suf h HIS 102 CO -0.02 0.64 0.01 1.15 0.86 0.00 0.00 177.93 180.57 1suf h THR 103 N 0.54 1.24 -0.44 2.45 2.02 -0.87 -0.91 112.91 116.94 1suf h THR 103 Ca 0.10 -0.79 0.03 0.00 0.77 0.00 0.00 66.41 66.53 1suf h THR 103 Cb 0.46 1.47 -0.04 0.00 -1.74 0.00 0.00 68.15 68.30 1suf h THR 103 CO 0.02 0.23 0.23 0.25 0.37 0.00 0.00 175.52 176.63 1suf h LEU 104 N 0.02 0.35 -0.07 2.58 5.85 -0.85 0.36 115.31 123.56 1suf h LEU 104 Ca 0.04 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1suf h LEU 104 Cb 0.35 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1suf h LEU 104 CO 0.01 0.25 -0.15 0.50 -0.34 0.00 0.00 178.44 178.71 1suf h LYS 105 N 0.47 -0.21 -0.59 1.25 3.64 -1.17 -1.70 116.57 118.26 1suf h LYS 105 Ca 0.19 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.64 1suf h LYS 105 Cb 0.07 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.88 1suf h LYS 105 CO -0.12 -0.14 0.30 0.87 -2.27 0.00 0.00 179.45 178.09 1suf h LYS 106 N -0.22 0.53 -0.25 1.90 1.57 -0.92 -1.31 116.57 117.87 1suf h LYS 106 Ca 0.07 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.86 1suf h LYS 106 Cb 0.32 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.47 1suf h LYS 106 CO -0.20 0.35 0.02 0.00 -0.57 0.00 0.00 179.45 179.06 1suf h ALA 107 N 1.34 0.24 0.00 3.86 0.00 -0.43 -0.64 119.26 123.62 1suf h ALA 107 Ca 0.27 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1suf h ALA 107 Cb 0.21 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1suf h ALA 107 CO -0.20 -0.40 -0.14 1.33 0.00 0.00 0.00 179.25 179.84 1suf n VAL 108 N -5.12 0.55 1.69 0.00 0.24 -0.68 -2.34 118.33 112.67 1suf n VAL 108 Ca -0.01 -0.29 0.09 0.00 -2.04 0.00 0.00 64.34 62.09 1suf n VAL 108 Cb 0.12 -0.49 0.44 0.00 -1.47 0.00 0.00 33.84 32.45 1suf n VAL 108 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1suf n GLN 109 N -2.24 1.29 -1.05 7.34 6.02 -0.53 -4.92 117.38 123.28 1suf n GLN 109 Ca 0.05 -0.43 -0.02 0.00 -0.01 0.00 0.00 57.00 56.59 1suf n GLN 109 Cb 0.43 -1.31 -0.01 0.00 1.02 0.00 0.00 30.24 30.38 1suf n GLN 109 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1suf n GLY 110 N 0.90 0.53 1.01 1.08 0.00 -0.99 -4.93 105.19 102.80 1suf n GLY 110 Ca 0.14 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.62 1suf n GLY 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1suf n LYS 111 N -2.79 2.29 -2.75 1.61 5.02 -0.27 -4.72 118.16 116.55 1suf n LYS 111 Ca -0.02 -2.08 -0.05 0.00 -2.02 0.00 0.00 58.31 54.14 1suf n LYS 111 Cb 0.08 -1.46 0.02 0.00 -0.02 0.00 0.00 35.03 33.65 1suf n LYS 111 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1suf n ALA 112 N 1.33 -1.91 0.26 7.82 0.00 -1.20 -4.28 120.51 122.54 1suf n ALA 112 Ca 0.16 -1.03 0.11 0.00 0.00 0.00 0.00 53.44 52.68 1suf n ALA 112 Cb 0.57 -1.56 0.54 0.00 0.00 0.00 0.00 19.45 18.99 1suf n ALA 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1suf n ALA 113 N 2.69 1.32 0.52 0.00 0.00 -1.26 -1.95 120.51 121.82 1suf n ALA 113 Ca 0.16 0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.86 1suf n ALA 113 Cb 0.58 -1.34 0.45 0.00 0.00 0.00 0.00 19.45 19.14 1suf n ALA 113 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1suf n SER 114 N -2.24 0.55 -4.49 0.00 7.64 -1.26 -4.79 113.62 109.03 1suf n SER 114 Ca 0.00 0.61 -0.27 0.00 1.01 0.00 0.00 58.87 60.22 1suf n SER 114 Cb 0.12 -0.73 -0.11 0.00 -1.01 0.00 0.00 64.21 62.48 1suf n SER 114 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1suf s TYR 115 N -3.19 2.43 0.24 1.43 1.51 -0.82 -5.06 117.35 113.88 1suf s TYR 115 Ca 0.07 -0.30 -0.22 0.00 -1.01 0.00 0.00 57.07 55.60 1suf s TYR 115 Cb 0.11 -1.18 0.04 0.00 -0.11 0.00 0.00 41.96 40.81 1suf s TYR 115 CO 0.43 0.52 0.80 0.00 -1.11 0.00 0.00 175.55 176.20 1suf s MET 116 N -2.82 1.58 -0.58 -0.62 0.23 -1.26 -4.86 119.30 110.97 1suf s MET 116 Ca 0.23 -0.87 -0.28 0.00 -1.03 0.00 0.00 55.69 53.74 1suf s MET 116 Cb -0.08 0.54 0.02 0.00 -1.53 0.00 0.00 34.83 33.78 1suf s MET 116 CO 0.12 -0.72 1.37 0.42 -2.03 0.00 0.00 175.02 174.18 1suf s ILE 117 N -3.70 3.82 -0.13 3.16 1.01 -1.26 -4.41 121.20 119.69 1suf s ILE 117 Ca 0.11 0.68 -0.09 0.00 0.00 0.00 0.00 60.65 61.35 1suf s ILE 117 Cb -0.04 -4.54 -0.25 0.00 0.01 0.00 0.00 42.46 37.64 1suf s ILE 117 CO 0.05 -1.27 0.35 0.29 0.00 0.00 0.00 174.94 174.36 1suf n LYS 118 N 8.70 0.73 -3.59 2.79 5.02 -0.02 -4.67 118.16 127.12 1suf n LYS 118 Ca 0.11 0.31 -0.40 0.00 -2.02 0.00 0.00 58.31 56.31 1suf n LYS 118 Cb 0.49 -1.72 -0.07 0.00 -0.02 0.00 0.00 35.03 33.71 1suf n LYS 118 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1suf s ASP 119 N -7.03 5.74 0.23 4.39 -1.08 -0.55 -4.85 116.67 113.54 1suf s ASP 119 Ca -0.23 -2.88 -0.01 0.00 -0.52 0.00 0.00 52.55 48.91 1suf s ASP 119 Cb 0.06 -1.97 0.24 0.00 -1.46 0.00 0.00 42.92 39.80 1suf s ASP 119 CO 0.74 -0.41 1.62 -0.09 0.52 0.00 0.00 175.17 177.54 1suf h ARG 120 N 7.17 0.58 -0.33 4.34 2.43 -1.86 -1.57 114.38 125.14 1suf h ARG 120 Ca 0.03 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 1suf h ARG 120 Cb 0.97 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.50 1suf h ARG 120 CO 0.73 0.85 0.22 1.15 -1.51 0.00 0.00 179.97 181.42 1suf h THR 121 N 0.49 1.09 -0.62 0.20 2.02 -2.00 -1.34 112.91 112.74 1suf h THR 121 Ca 0.05 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1suf h THR 121 Cb 0.85 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1suf h THR 121 CO 0.07 0.09 0.34 0.50 0.37 0.00 0.00 175.52 176.89 1suf h LYS 122 N 0.45 0.87 -0.23 6.66 1.63 -1.92 -1.23 116.57 122.81 1suf h LYS 122 Ca 0.12 -0.10 0.05 0.00 -0.85 0.00 0.00 60.65 59.88 1suf h LYS 122 Cb -0.05 -0.17 -0.06 0.00 -0.60 0.00 0.00 32.23 31.36 1suf h LYS 122 CO -0.03 0.66 -0.14 1.25 -3.45 0.00 0.00 179.45 177.75 1suf h LEU 123 N 0.85 -0.45 -0.76 5.20 5.85 -0.91 -0.17 115.31 124.91 1suf h LEU 123 Ca 0.22 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.98 1suf h LEU 123 Cb 0.04 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1suf h LEU 123 CO -0.04 -0.17 0.22 0.45 -0.34 0.00 0.00 178.44 178.56 1suf h HIS 124 N -0.12 1.19 -0.48 1.25 3.86 -1.07 -0.71 115.15 119.07 1suf h HIS 124 Ca 0.13 -0.12 -0.10 0.00 -1.16 0.00 0.00 60.37 59.11 1suf h HIS 124 Cb 0.31 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1suf h HIS 124 CO -0.30 0.94 -0.11 0.66 0.86 0.00 0.00 177.93 179.99 1suf h SER 125 N 1.10 0.88 -0.35 2.45 4.64 -0.65 -0.83 113.55 120.79 1suf h SER 125 Ca 0.24 -0.27 -0.04 0.00 -0.47 0.00 0.00 61.79 61.24 1suf h SER 125 Cb 0.32 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1suf h SER 125 CO -0.01 1.00 0.05 0.40 -0.87 0.00 0.00 176.83 177.41 1suf h ILE 126 N 0.80 1.24 -0.27 0.95 2.04 -0.92 -1.47 117.51 119.87 1suf h ILE 126 Ca 0.13 -0.85 0.03 0.00 1.00 0.00 0.00 64.86 65.17 1suf h ILE 126 Cb 0.63 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 1suf h ILE 126 CO 0.04 0.28 0.06 0.00 0.00 0.00 0.00 178.15 178.54 1suf h ALA 127 N 0.90 0.28 -0.56 1.87 0.00 -0.95 -0.90 119.26 119.90 1suf h ALA 127 Ca 0.11 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1suf h ALA 127 Cb 0.37 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1suf h ALA 127 CO 0.01 -0.35 0.28 -0.22 0.00 0.00 0.00 179.25 178.96 1suf h LYS 128 N 0.17 0.78 -0.28 0.00 3.64 -0.99 -0.98 116.57 118.91 1suf h LYS 128 Ca 0.12 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 1suf h LYS 128 Cb 0.12 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1suf h LYS 128 CO -0.15 0.60 -0.07 -0.09 -2.27 0.00 0.00 179.45 177.46 1suf h ARG 129 N 0.78 0.44 -0.00 1.90 2.43 -0.58 -2.47 114.38 116.88 1suf h ARG 129 Ca 0.20 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1suf h ARG 129 Cb 0.07 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1suf h ARG 129 CO -0.03 0.53 -0.21 1.28 -1.51 0.00 0.00 179.97 180.04 1suf n LEU 130 N -4.25 0.38 0.00 3.80 4.77 -0.41 -4.93 117.00 116.36 1suf n LEU 130 Ca 0.01 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1suf n LEU 130 Cb 0.27 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1suf n LEU 130 CO 0.39 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1suf n GLY 131 N 1.41 0.55 3.63 -0.72 0.00 -0.68 -5.05 105.19 104.33 1suf n GLY 131 Ca 0.10 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 1suf n GLY 131 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1suf s ILE 132 N -2.00 4.88 0.40 -0.61 1.01 -0.47 -5.01 121.20 119.39 1suf s ILE 132 Ca 0.00 1.29 -0.27 0.00 0.00 0.00 0.00 60.65 61.67 1suf s ILE 132 Cb 0.00 -4.06 -0.10 0.00 0.01 0.00 0.00 42.46 38.31 1suf s ILE 132 CO 0.00 -0.09 1.40 -2.65 0.00 0.00 0.00 174.94 173.60 1suf n PRO 133 N 5.96 2.33 -0.01 2.79 -0.02 -1.26 -4.18 135.00 140.61 1suf n PRO 133 Ca 0.03 0.82 -0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1suf n PRO 133 Cb 0.48 -2.54 -0.02 0.00 -0.02 0.00 0.00 33.50 31.40 1suf n PRO 133 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1suf n THR 134 N 0.14 0.11 -1.88 3.45 -2.24 -1.26 -4.90 114.28 107.70 1suf n THR 134 Ca 0.04 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.30 1suf n THR 134 Cb 0.39 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.27 1suf n THR 134 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1suf s GLU 135 N -2.13 4.18 -0.06 -0.78 1.03 -1.26 -1.07 118.70 118.61 1suf s GLU 135 Ca -0.01 2.39 0.00 0.00 0.03 0.00 0.00 54.97 57.38 1suf s GLU 135 Cb 0.01 -3.57 0.00 0.00 -0.80 0.00 0.00 34.13 29.77 1suf s GLU 135 CO 0.12 -0.75 0.00 0.41 -1.33 0.00 0.00 175.26 173.71 1suf n GLY 136 N 4.03 0.21 3.87 -3.83 0.00 -1.26 -5.02 105.19 103.20 1suf n GLY 136 Ca 0.16 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1suf n GLY 136 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1suf s GLN 137 N -1.45 3.79 0.40 1.61 -1.52 -0.23 -5.08 119.66 117.18 1suf s GLN 137 Ca 0.00 0.22 -0.26 0.00 -1.95 0.00 0.00 55.36 53.37 1suf s GLN 137 Cb 0.00 -2.88 -0.08 0.00 -0.22 0.00 0.00 33.01 29.83 1suf s GLN 137 CO 0.00 0.47 1.21 0.15 -0.25 0.00 0.00 175.29 176.87 1suf s LYS 138 N -2.25 4.04 0.29 2.91 1.02 -1.26 -4.91 119.74 119.57 1suf s LYS 138 Ca 0.39 1.94 -0.01 0.00 0.02 0.00 0.00 55.97 58.31 1suf s LYS 138 Cb -0.13 -2.71 0.48 0.00 -0.52 0.00 0.00 37.83 34.95 1suf s LYS 138 CO 0.20 -0.36 1.90 -0.44 -0.92 0.00 0.00 175.35 175.73 1suf h ASP 139 N 2.68 0.96 -0.20 2.83 3.32 -1.98 -1.17 116.42 122.86 1suf h ASP 139 Ca -0.49 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.49 1suf h ASP 139 Cb 1.24 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.57 1suf h ASP 139 CO 0.63 0.61 -0.10 -0.33 -1.72 0.00 0.00 179.24 178.33 1suf h GLU 140 N 1.09 0.57 -0.33 3.56 3.07 -1.94 0.43 114.58 121.03 1suf h GLU 140 Ca 0.41 -0.17 -0.17 0.00 -0.50 0.00 0.00 59.36 58.93 1suf h GLU 140 Cb 0.19 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1suf h GLU 140 CO -0.16 0.67 -0.45 -0.44 -1.40 0.00 0.00 179.01 177.24 1suf h ASP 141 N 0.53 0.97 -0.34 1.42 3.32 -1.70 -0.36 116.42 120.26 1suf h ASP 141 Ca 0.10 -0.50 -0.00 0.00 0.02 0.00 0.00 57.03 56.65 1suf h ASP 141 Cb 0.50 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1suf h ASP 141 CO 0.03 1.28 0.20 0.40 -1.72 0.00 0.00 179.24 179.42 1suf h ILE 142 N 0.68 1.12 -0.46 0.35 2.04 -0.92 -1.55 117.51 118.78 1suf h ILE 142 Ca 0.04 -0.30 -0.05 0.00 1.00 0.00 0.00 64.86 65.55 1suf h ILE 142 Cb 1.05 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1suf h ILE 142 CO 0.11 0.12 0.09 0.00 0.00 0.00 0.00 178.15 178.46 1suf h ALA 143 N 1.07 1.29 -0.83 1.87 0.00 -0.85 -0.34 119.26 121.47 1suf h ALA 143 Ca 0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1suf h ALA 143 Cb 0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1suf h ALA 143 CO -0.02 0.49 0.43 1.25 0.00 0.00 0.00 179.25 181.40 1suf h LEU 144 N 0.68 1.05 -0.69 0.00 5.85 -0.70 0.56 115.31 122.06 1suf h LEU 144 Ca 0.15 -0.11 -0.14 0.00 0.84 0.00 0.00 57.88 58.62 1suf h LEU 144 Cb 0.29 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1suf h LEU 144 CO 0.00 0.87 -0.45 -0.33 -0.34 0.00 0.00 178.44 178.19 1suf h GLU 145 N 1.16 0.47 -0.50 1.25 4.39 -0.60 -0.31 114.58 120.45 1suf h GLU 145 Ca 0.29 -0.26 -0.12 0.00 0.34 0.00 0.00 59.36 59.61 1suf h GLU 145 Cb 0.07 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1suf h GLU 145 CO -0.04 0.83 -0.18 0.28 -1.16 0.00 0.00 179.01 178.74 1suf h VAL 146 N 0.38 1.27 -0.42 3.13 2.07 -0.68 -0.97 116.25 121.03 1suf h VAL 146 Ca 0.03 -1.34 -0.08 0.00 0.82 0.00 0.00 66.70 66.13 1suf h VAL 146 Cb 0.95 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1suf h VAL 146 CO 0.08 0.46 -0.07 0.00 0.02 0.00 0.00 177.57 178.07 1suf h ALA 147 N 0.88 1.09 -0.70 1.67 0.00 -0.66 -1.07 119.26 120.47 1suf h ALA 147 Ca 0.12 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1suf h ALA 147 Cb 0.75 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1suf h ALA 147 CO 0.06 0.57 0.20 0.87 0.00 0.00 0.00 179.25 180.94 1suf h LYS 148 N 0.66 1.09 -0.48 0.00 1.57 -0.92 -1.30 116.57 117.20 1suf h LYS 148 Ca 0.12 -0.24 -0.12 0.00 -1.87 0.00 0.00 60.65 58.55 1suf h LYS 148 Cb 0.51 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1suf h LYS 148 CO 0.03 0.94 -0.16 0.00 -0.57 0.00 0.00 179.45 179.69 1suf h ALA 149 N 1.17 0.82 -0.08 3.86 0.00 -0.80 0.17 119.26 124.38 1suf h ALA 149 Ca 0.22 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1suf h ALA 149 Cb 0.32 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1suf h ALA 149 CO -0.00 0.65 0.04 0.00 0.00 0.00 0.00 179.25 179.94 1suf h ALA 150 N 1.00 0.10 -0.05 0.00 0.00 -0.96 -2.33 119.26 117.02 1suf h ALA 150 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1suf h ALA 150 Cb 0.70 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1suf h ALA 150 CO 0.05 -0.43 -0.41 -0.07 0.00 0.00 0.00 179.25 178.39 1suf h LEU 151 N 0.09 0.11 -1.41 0.00 3.38 -1.05 -2.56 115.31 113.87 1suf h LEU 151 Ca 0.03 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1suf h LEU 151 Cb 0.01 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1suf h LEU 151 CO -0.03 0.52 -0.29 0.00 0.09 0.00 0.00 178.44 178.73 1suf h ALA 152 N 1.49 1.37 0.00 1.53 0.00 -0.56 -2.50 119.26 120.59 1suf h ALA 152 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1suf h ALA 152 Cb 0.77 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1suf h ALA 152 CO 0.06 0.36 0.00 -0.25 0.00 0.00 0.00 179.25 179.42 1suf n ASP 153 N -3.97 0.00 0.12 0.00 9.92 -0.91 -2.40 116.55 119.31 1suf n ASP 153 Ca -0.02 0.32 0.13 0.00 -0.53 0.00 0.00 54.79 54.69 1suf n ASP 153 Cb 0.36 -0.40 0.35 0.00 -0.64 0.00 0.00 41.12 40.78 1suf n ASP 153 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 1suf h PHE 154 N 0.00 0.00 -3.58 1.24 0.04 -1.57 0.59 116.94 113.66 1suf h PHE 154 Ca 0.00 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.43 1suf h PHE 154 Cb 0.18 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 38.19 1suf h PHE 154 CO 0.00 0.00 -0.65 -3.38 -0.60 0.00 0.00 178.31 173.68 1suf s HIS 155 N -3.13 1.44 0.59 -0.55 -3.43 -1.01 -0.85 115.29 108.36 1suf s HIS 155 Ca 0.10 -1.03 -0.19 0.00 -0.80 0.00 0.00 55.06 53.14 1suf s HIS 155 Cb 0.11 -0.84 -0.03 0.00 -1.43 0.00 0.00 32.58 30.39 1suf s HIS 155 CO 0.62 -0.18 1.27 -1.21 -2.00 0.00 0.00 174.74 173.25 1suf s GLU 156 N -3.93 2.90 0.00 -0.38 2.02 -1.26 -4.45 118.70 113.61 1suf s GLU 156 Ca 0.29 2.01 0.00 0.00 0.02 0.00 0.00 54.97 57.29 1suf s GLU 156 Cb 0.06 -2.00 0.00 0.00 0.10 0.00 0.00 34.13 32.29 1suf s GLU 156 CO 0.08 -1.31 0.00 0.36 0.02 0.00 0.00 175.26 174.41 1suf n LYS 157 N -1.51 0.00 0.00 1.61 2.85 -1.26 -5.03 118.16 114.82 1suf n LYS 157 Ca 0.13 0.00 0.14 0.00 -1.05 0.00 0.00 58.31 57.53 1suf n LYS 157 Cb 0.48 0.00 0.55 0.00 -0.65 0.00 0.00 35.03 35.40 1suf n LYS 157 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1suf n ASP 158 N -0.21 1.28 -4.37 -5.58 8.00 -1.26 -4.76 116.55 109.66 1suf n ASP 158 Ca 0.00 -1.35 -0.20 0.00 0.71 0.00 0.00 54.79 53.94 1suf n ASP 158 Cb 0.00 0.01 -0.10 0.00 -0.02 0.00 0.00 41.12 41.01 1suf n ASP 158 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1suf s THR 159 N -2.08 1.92 0.64 -3.53 -4.23 -1.26 -5.17 115.64 101.93 1suf s THR 159 Ca 0.37 -2.18 -0.11 0.00 -1.18 0.00 0.00 61.69 58.59 1suf s THR 159 Cb 0.21 -2.05 0.15 0.00 1.34 0.00 0.00 72.50 72.15 1suf s THR 159 CO 0.37 -0.48 0.68 -0.81 -0.54 0.00 0.00 174.62 173.83 1suf n PRO 160 N -0.26 -1.62 -1.99 3.99 -0.04 -1.26 -4.92 135.00 128.90 1suf n PRO 160 Ca -0.09 -1.06 -0.43 0.00 -0.04 0.00 0.00 63.50 61.88 1suf n PRO 160 Cb 0.59 -0.87 -0.03 0.00 -0.04 0.00 0.00 33.50 33.16 1suf n PRO 160 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1suf s VAL 161 N -2.34 3.50 0.27 0.52 1.01 -0.84 -4.85 120.40 117.67 1suf s VAL 161 Ca 0.41 0.55 0.13 0.00 0.00 0.00 0.00 61.98 63.07 1suf s VAL 161 Cb -0.03 -3.56 0.03 0.00 0.00 0.00 0.00 36.38 32.83 1suf s VAL 161 CO 0.31 -0.28 1.69 -0.07 0.00 0.00 0.00 175.10 176.74 1suf h LEU 162 N 12.58 0.00 0.00 3.92 3.38 -1.92 -1.27 115.31 132.00 1suf h LEU 162 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1suf h LEU 162 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1suf h LEU 162 CO 1.00 0.51 0.00 0.79 0.09 0.00 0.00 178.44 180.83 1suf n TRP 163 N -3.80 0.00 -0.07 1.13 8.01 -1.26 -0.84 117.44 120.62 1suf n TRP 163 Ca -0.01 0.00 -0.11 0.00 -1.31 0.00 0.00 57.50 56.07 1suf n TRP 163 Cb 0.55 0.00 -0.04 0.00 -2.01 0.00 0.00 31.31 29.81 1suf n TRP 163 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.69 176.96 1suf n VAL 164 N -0.59 1.35 0.23 -0.99 0.31 -0.57 -4.24 118.33 113.83 1suf n VAL 164 Ca 0.03 0.08 0.11 0.00 -0.01 0.00 0.00 64.34 64.56 1suf n VAL 164 Cb 0.02 -2.05 0.47 0.00 -0.91 0.00 0.00 33.84 31.36 1suf n VAL 164 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1suf h THR 165 N -0.74 0.41 -0.02 2.52 1.35 -1.18 -2.46 112.91 112.81 1suf h THR 165 Ca -0.14 -1.04 0.00 0.00 -0.55 0.00 0.00 66.41 64.69 1suf h THR 165 Cb 0.92 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 69.10 1suf h THR 165 CO -0.08 0.17 -0.17 0.35 -0.25 0.00 0.00 175.52 175.54 1suf n THR 166 N -3.30 0.00 0.38 6.82 -2.24 -0.02 -4.36 114.28 111.56 1suf n THR 166 Ca 0.01 -0.29 0.04 0.00 -2.27 0.00 0.00 64.05 61.54 1suf n THR 166 Cb 0.42 0.91 -0.03 0.00 -2.10 0.00 0.00 70.33 69.53 1suf n THR 166 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1suf n VAL 167 N 0.23 0.00 -4.25 2.28 0.24 -0.93 -4.97 118.33 110.93 1suf n VAL 167 Ca 0.14 -0.35 -0.27 0.00 -2.04 0.00 0.00 64.34 61.82 1suf n VAL 167 Cb 0.44 1.04 -0.09 0.00 -1.47 0.00 0.00 33.84 33.76 1suf n VAL 167 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1suf s LEU 168 N -2.04 3.11 0.60 1.34 1.43 -1.17 -4.85 118.68 117.10 1suf s LEU 168 Ca 0.05 -0.48 -0.19 0.00 -1.03 0.00 0.00 54.13 52.47 1suf s LEU 168 Cb 0.06 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 1suf s LEU 168 CO 0.28 0.11 1.26 -2.84 0.23 0.00 0.00 176.35 175.39 1suf s PRO 169 N -2.77 2.90 0.34 1.29 0.02 -1.26 -4.72 135.00 130.80 1suf s PRO 169 Ca 0.25 1.97 0.11 0.00 0.02 0.00 0.00 61.00 63.35 1suf s PRO 169 Cb -0.09 -1.98 0.88 0.00 0.02 0.00 0.00 34.50 33.33 1suf s PRO 169 CO 0.16 -1.30 1.78 -1.35 -0.33 0.00 0.00 177.00 175.96 1suf h PRO 170 N 0.93 0.59 -0.53 5.54 0.11 -1.99 -0.67 132.00 135.98 1suf h PRO 170 Ca -0.51 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.53 1suf h PRO 170 Cb 1.31 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1suf h PRO 170 CO 0.55 0.39 0.18 0.66 -0.21 0.00 0.00 178.00 179.57 1suf h SER 171 N 0.61 0.72 -0.19 -2.05 4.64 -1.98 0.14 113.55 115.44 1suf h SER 171 Ca 0.58 -0.10 -0.17 0.00 -0.47 0.00 0.00 61.79 61.62 1suf h SER 171 Cb 1.11 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 1suf h SER 171 CO -0.35 0.68 -0.55 -0.09 -0.87 0.00 0.00 176.83 175.65 1suf h ARG 172 N 0.77 0.71 -0.76 4.77 9.65 -1.52 -2.45 114.38 125.56 1suf h ARG 172 Ca 0.18 -0.51 0.03 0.00 -1.10 0.00 0.00 59.98 58.57 1suf h ARG 172 Cb 0.21 0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.84 1suf h ARG 172 CO -0.01 1.13 0.50 0.28 2.80 0.00 0.00 179.97 184.67 1suf h VAL 173 N 0.42 1.14 -0.56 0.20 2.07 -0.80 -1.56 116.25 117.15 1suf h VAL 173 Ca -0.01 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 1suf h VAL 173 Cb 1.17 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1suf h VAL 173 CO 0.12 0.17 0.14 0.50 0.02 0.00 0.00 177.57 178.52 1suf h LYS 174 N 0.96 0.90 -0.41 1.57 3.64 -0.59 0.13 116.57 122.77 1suf h LYS 174 Ca 0.29 -0.21 0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1suf h LYS 174 Cb -0.00 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.66 1suf h LYS 174 CO -0.08 0.84 0.19 0.28 -2.27 0.00 0.00 179.45 178.40 1suf h VAL 175 N 0.80 0.94 -0.33 2.00 2.07 -0.97 -1.11 116.25 119.66 1suf h VAL 175 Ca 0.18 -0.13 -0.11 0.00 0.82 0.00 0.00 66.70 67.46 1suf h VAL 175 Cb 0.34 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1suf h VAL 175 CO 0.00 0.07 -0.21 -0.07 0.02 0.00 0.00 177.57 177.38 1suf h LEU 176 N 0.38 0.76 -1.09 2.57 3.38 -1.01 -2.85 115.31 117.46 1suf h LEU 176 Ca 0.18 -0.43 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 1suf h LEU 176 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1suf h LEU 176 CO -0.14 1.02 0.13 0.28 0.09 0.00 0.00 178.44 179.82 1suf h SER 177 N 0.49 0.72 0.19 -0.43 0.02 -0.54 -0.56 113.55 113.44 1suf h SER 177 Ca 0.07 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1suf h SER 177 Cb 0.76 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 1suf h SER 177 CO 0.06 0.71 -0.11 0.00 -1.14 0.00 0.00 176.83 176.35 1suf h ALA 178 N 1.39 1.55 -0.47 3.77 0.00 -0.96 -0.49 119.26 124.05 1suf h ALA 178 Ca 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1suf h ALA 178 Cb 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1suf h ALA 178 CO -0.00 0.14 0.00 0.72 0.00 0.00 0.00 179.25 180.10 1suf n HIS 179 N -4.02 0.61 -1.85 0.00 -0.00 -0.83 -4.96 115.22 104.17 1suf n HIS 179 Ca -0.02 -0.31 -0.08 0.00 -0.00 0.00 0.00 57.72 57.31 1suf n HIS 179 Cb 0.19 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.17 1suf n HIS 179 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1suf n GLY 180 N 1.52 0.35 0.82 -1.41 0.00 -0.19 -4.94 105.19 101.33 1suf n GLY 180 Ca 0.20 -0.60 0.12 0.00 0.00 0.00 0.00 46.02 45.74 1suf n GLY 180 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1suf n LEU 181 N -1.04 2.68 -4.69 0.99 4.77 -0.28 -4.91 117.00 114.52 1suf n LEU 181 Ca -0.09 -0.91 -0.42 0.00 -0.03 0.00 0.00 56.01 54.56 1suf n LEU 181 Cb 0.47 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 1suf n LEU 181 CO 0.11 0.46 0.92 -0.63 -1.33 0.00 0.00 177.39 176.92 1suf s ILE 182 N -2.13 4.34 0.44 -0.08 -1.09 -1.26 -4.31 121.20 117.10 1suf s ILE 182 Ca 0.26 1.65 -0.24 0.00 -2.23 0.00 0.00 60.65 60.09 1suf s ILE 182 Cb 0.20 -4.06 -0.08 0.00 -1.58 0.00 0.00 42.46 36.94 1suf s ILE 182 CO 0.37 0.01 1.23 -2.84 -1.23 0.00 0.00 174.94 172.48 1suf s PRO 183 N 2.11 3.80 0.06 2.79 0.02 -1.26 -4.94 135.00 137.57 1suf s PRO 183 Ca 0.55 1.96 0.07 0.00 0.02 0.00 0.00 61.00 63.60 1suf s PRO 183 Cb -0.24 -2.55 -0.23 0.00 0.02 0.00 0.00 34.50 31.50 1suf s PRO 183 CO 0.22 -0.57 1.04 0.00 -0.33 0.00 0.00 177.00 177.36 1suf h ALA 184 N 2.29 0.45 -1.52 -1.55 0.00 -1.94 -2.23 119.26 114.76 1suf h ALA 184 Ca -0.49 -1.10 0.09 0.00 0.00 0.00 0.00 54.91 53.41 1suf h ALA 184 Cb 1.25 0.09 -0.24 0.00 0.00 0.00 0.00 17.79 18.90 1suf h ALA 184 CO 0.61 1.32 0.58 0.20 0.00 0.00 0.00 179.25 181.96 1suf s GLY 185 N -4.86 -0.22 0.02 0.00 0.00 -1.26 -4.13 107.32 96.86 1suf s GLY 185 Ca -0.02 2.16 -0.25 0.00 0.00 0.00 0.00 44.72 46.61 1suf s GLY 185 CO 0.83 1.11 1.36 -2.22 0.00 0.00 0.00 173.10 174.18 1suf h ILE 186 N 2.61 0.98 0.00 0.90 2.04 -0.72 -1.22 117.51 122.10 1suf h ILE 186 Ca -0.18 -0.65 -0.10 0.00 1.00 0.00 0.00 64.86 64.93 1suf h ILE 186 Cb 1.17 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 1suf h ILE 186 CO 0.29 0.15 -0.47 0.44 0.00 0.00 0.00 178.15 178.55 1suf h ASP 187 N -0.51 0.00 -0.55 1.72 3.32 -1.26 -2.54 116.42 116.60 1suf h ASP 187 Ca -0.02 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.08 1suf h ASP 187 Cb 0.40 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.90 1suf h ASP 187 CO 0.03 0.47 0.27 -0.74 -1.72 0.00 0.00 179.24 177.56 1suf h HIS 188 N 0.00 0.50 -0.43 4.55 -0.00 -1.39 -1.06 115.15 117.32 1suf h HIS 188 Ca -0.00 0.02 -0.14 0.00 -0.00 0.00 0.00 60.37 60.25 1suf h HIS 188 Cb 1.08 -0.14 -0.01 0.00 -0.00 0.00 0.00 27.41 28.34 1suf h HIS 188 CO 0.00 0.23 -0.27 0.93 -0.00 0.00 0.00 177.93 178.82 1suf h GLU 189 N 0.52 0.94 -0.39 5.26 4.39 -0.94 -0.32 114.58 124.04 1suf h GLU 189 Ca 0.25 -0.44 0.03 0.00 0.34 0.00 0.00 59.36 59.54 1suf h GLU 189 Cb 0.18 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 1suf h GLU 189 CO -0.18 1.10 0.21 0.82 -1.16 0.00 0.00 179.01 179.79 1suf h ILE 190 N 0.77 1.00 -0.68 3.13 2.04 -1.22 0.14 117.51 122.69 1suf h ILE 190 Ca 0.09 -0.14 -0.08 0.00 1.00 0.00 0.00 64.86 65.73 1suf h ILE 190 Cb 0.85 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 1suf h ILE 190 CO 0.08 0.08 0.12 0.00 0.00 0.00 0.00 178.15 178.43 1suf h ALA 191 N 1.20 0.93 -0.28 1.87 0.00 -1.05 -2.06 119.26 119.86 1suf h ALA 191 Ca 0.16 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1suf h ALA 191 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1suf h ALA 191 CO -0.10 0.67 -0.15 1.49 0.00 0.00 0.00 179.25 181.15 1suf h GLU 192 N 1.05 0.49 -0.10 0.00 4.81 -0.49 -0.26 114.58 120.08 1suf h GLU 192 Ca 0.21 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1suf h GLU 192 Cb 0.42 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 1suf h GLU 192 CO 0.01 0.63 0.06 0.82 -0.73 0.00 0.00 179.01 179.80 1suf h ILE 193 N 0.45 1.04 -0.52 2.32 1.08 -0.69 0.76 117.51 121.95 1suf h ILE 193 Ca 0.08 -0.09 -0.04 0.00 -0.39 0.00 0.00 64.86 64.42 1suf h ILE 193 Cb 0.53 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 35.18 1suf h ILE 193 CO 0.03 0.04 0.16 0.24 -0.69 0.00 0.00 178.15 177.92 1suf h MET 194 N 0.11 0.77 0.73 2.37 2.86 -0.82 -1.74 114.93 119.22 1suf h MET 194 Ca 0.04 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 1suf h MET 194 Cb 0.01 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 31.55 1suf h MET 194 CO -0.01 0.67 -0.35 1.25 1.06 0.00 0.00 176.91 179.53 1suf h HIS 195 N 0.75 -0.91 0.00 -0.22 -0.00 -0.89 -2.98 115.15 110.91 1suf h HIS 195 Ca 0.17 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.50 1suf h HIS 195 Cb 0.23 0.30 -0.00 0.00 -0.00 0.00 0.00 27.41 27.94 1suf h HIS 195 CO 0.01 -0.54 -0.08 0.07 -0.00 0.00 0.00 177.93 177.39 1suf h ARG 196 N -1.14 0.00 -0.01 5.26 0.11 -0.58 -1.40 114.38 116.62 1suf h ARG 196 Ca -0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.98 1suf h ARG 196 Cb 0.78 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.86 1suf h ARG 196 CO 0.16 0.08 -0.38 0.25 0.10 0.00 0.00 179.97 180.19 1suf n THR 197 N -3.40 0.00 -1.39 0.08 -2.24 -0.68 -1.12 114.28 105.54 1suf n THR 197 Ca -0.01 -0.13 -0.29 0.00 -2.27 0.00 0.00 64.05 61.35 1suf n THR 197 Cb 0.24 0.58 0.14 0.00 -2.10 0.00 0.00 70.33 69.19 1suf n THR 197 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1suf s SER 198 N -2.60 3.33 0.34 3.42 1.04 -0.53 -4.93 113.70 113.78 1suf s SER 198 Ca 0.20 1.13 -0.29 0.00 0.48 0.00 0.00 55.95 57.47 1suf s SER 198 Cb 0.19 -1.76 -0.11 0.00 0.10 0.00 0.00 66.02 64.44 1suf s SER 198 CO 0.58 -2.68 1.46 -0.32 0.98 0.00 0.00 173.24 173.25 1suf s MET 199 N -5.13 4.18 -0.49 4.02 1.75 -1.26 -2.96 119.30 119.41 1suf s MET 199 Ca 0.64 2.47 0.00 0.00 -1.25 0.00 0.00 55.69 57.55 1suf s MET 199 Cb -0.16 -3.01 0.00 0.00 2.84 0.00 0.00 34.83 34.50 1suf s MET 199 CO 0.55 -0.46 0.00 0.41 -0.65 0.00 0.00 175.02 174.87 1suf n GLY 200 N 0.92 0.73 0.00 2.11 0.00 -1.26 -4.99 105.19 102.71 1suf n GLY 200 Ca 0.02 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1suf n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1suf s ASP 202 N 0.20 6.85 -0.33 0.00 2.15 -0.27 -4.91 116.67 120.36 1suf s ASP 202 Ca 0.00 2.42 0.16 0.00 0.43 0.00 0.00 52.55 55.56 1suf s ASP 202 Cb 0.00 -2.61 0.45 0.00 -0.30 0.00 0.00 42.92 40.46 1suf s ASP 202 CO 0.00 -0.58 1.16 0.00 -0.17 0.00 0.00 175.17 175.58 1suf n ALA 203 N 2.91 2.64 -3.69 3.66 0.00 -1.26 -4.83 120.51 119.94 1suf n ALA 203 Ca 0.07 -2.33 -0.21 0.00 0.00 0.00 0.00 53.44 50.97 1suf n ALA 203 Cb 0.42 -0.93 -0.18 0.00 0.00 0.00 0.00 19.45 18.77 1suf n ALA 203 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1suf s ASP 204 N -2.55 1.34 0.20 0.00 2.15 -1.26 -4.96 116.67 111.59 1suf s ASP 204 Ca 0.23 -0.01 -0.11 0.00 0.43 0.00 0.00 52.55 53.10 1suf s ASP 204 Cb 0.41 -0.23 0.15 0.00 -0.30 0.00 0.00 42.92 42.95 1suf s ASP 204 CO -0.03 -0.24 1.87 0.00 -0.17 0.00 0.00 175.17 176.60 1suf h ALA 205 N 8.41 0.91 -0.60 3.66 0.00 -1.95 0.42 119.26 130.11 1suf h ALA 205 Ca -0.14 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1suf h ALA 205 Cb 1.12 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1suf h ALA 205 CO 0.19 0.31 0.07 0.37 0.00 0.00 0.00 179.25 180.19 1suf h GLN 206 N 0.95 1.00 -0.54 0.00 5.75 -1.97 0.45 115.11 120.76 1suf h GLN 206 Ca 0.26 -0.28 -0.05 0.00 -0.15 0.00 0.00 58.65 58.43 1suf h GLN 206 Cb -0.09 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.33 1suf h GLN 206 CO -0.06 0.96 0.14 -0.97 -2.65 0.00 0.00 178.83 176.24 1suf h ASN 207 N 0.90 0.81 -0.53 -0.69 -1.24 -1.87 -0.60 115.58 112.36 1suf h ASN 207 Ca 0.18 -0.23 -0.00 0.00 0.71 0.00 0.00 56.30 56.96 1suf h ASN 207 Cb 0.46 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 39.27 1suf h ASN 207 CO 0.02 0.82 0.33 -0.07 -1.29 0.00 0.00 177.43 177.24 1suf h LEU 208 N 0.75 0.64 -0.77 0.34 3.38 -0.55 -2.36 115.31 116.74 1suf h LEU 208 Ca 0.17 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 1suf h LEU 208 Cb 0.33 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1suf h LEU 208 CO 0.00 0.50 -0.60 -0.07 0.09 0.00 0.00 178.44 178.35 1suf h LEU 209 N 0.72 0.00 -0.67 1.67 3.38 -0.50 -1.25 115.31 118.65 1suf h LEU 209 Ca 0.19 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 1suf h LEU 209 Cb -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1suf h LEU 209 CO -0.04 0.60 0.29 -0.07 0.09 0.00 0.00 178.44 179.32 1suf h LEU 210 N 0.00 0.90 -0.77 1.67 3.38 -0.91 -0.09 115.31 119.49 1suf h LEU 210 Ca -0.01 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1suf h LEU 210 Cb 1.08 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.56 1suf h LEU 210 CO 0.08 0.81 0.49 1.23 0.09 0.00 0.00 178.44 181.14 1suf h GLY 211 N 0.94 1.09 0.95 0.83 0.00 -0.91 -2.08 103.07 103.89 1suf h GLY 211 Ca 0.23 -0.43 0.02 0.00 0.00 0.00 0.00 47.33 47.15 1suf h GLY 211 CO -0.02 0.42 0.51 -1.33 0.00 0.00 0.00 176.54 176.11 1suf h GLY 212 N 1.04 1.11 1.00 4.60 0.00 -0.55 -0.12 103.07 110.15 1suf h GLY 212 Ca 0.28 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1suf h GLY 212 CO -0.06 0.37 0.34 1.41 0.00 0.00 0.00 176.54 178.60 1suf h LEU 213 N 1.02 0.78 -0.64 3.11 3.38 -0.66 0.65 115.31 122.96 1suf h LEU 213 Ca 0.30 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1suf h LEU 213 Cb -0.07 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1suf h LEU 213 CO -0.08 0.65 0.32 -0.09 0.09 0.00 0.00 178.44 179.33 1suf h ARG 214 N 0.85 0.91 0.00 1.13 2.43 -1.03 -2.00 114.38 116.66 1suf h ARG 214 Ca 0.22 -0.12 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 1suf h ARG 214 Cb 0.05 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1suf h ARG 214 CO -0.03 0.71 -0.37 0.00 -1.51 0.00 0.00 179.97 178.76 1suf h SER 216 N 0.00 0.28 0.71 0.00 4.64 -0.19 -1.35 113.55 117.64 1suf h SER 216 Ca -0.00 -0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.17 1suf h SER 216 Cb 0.67 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 1suf h SER 216 CO 0.05 0.46 -0.41 -0.07 -0.87 0.00 0.00 176.83 175.99 1suf h LEU 217 N 0.27 0.00 -1.04 5.97 3.38 -0.67 -0.49 115.31 122.73 1suf h LEU 217 Ca 0.05 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 1suf h LEU 217 Cb 0.44 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1suf h LEU 217 CO 0.03 0.41 0.13 0.00 0.09 0.00 0.00 178.44 179.09 1suf h ALA 218 N 1.59 1.22 -0.41 1.53 0.00 -0.78 -0.44 119.26 121.97 1suf h ALA 218 Ca -0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1suf h ALA 218 Cb 0.87 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1suf h ALA 218 CO 0.05 0.54 0.18 0.22 0.00 0.00 0.00 179.25 180.24 1suf h ASP 219 N 0.79 0.56 -0.67 0.00 1.82 -0.52 -1.89 116.42 116.52 1suf h ASP 219 Ca 0.17 -0.15 0.03 0.00 -0.39 0.00 0.00 57.03 56.70 1suf h ASP 219 Cb 0.29 -0.14 -0.04 0.00 0.68 0.00 0.00 39.33 40.11 1suf h ASP 219 CO -0.00 0.56 0.41 0.25 -1.61 0.00 0.00 179.24 178.85 1suf h LEU 220 N 0.53 0.66 -0.62 2.28 5.85 -0.75 0.22 115.31 123.48 1suf h LEU 220 Ca 0.14 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.89 1suf h LEU 220 Cb 0.16 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1suf h LEU 220 CO -0.01 0.45 0.39 0.00 -0.34 0.00 0.00 178.44 178.93 1suf h ALA 221 N 1.30 0.80 -0.56 1.25 0.00 -0.89 0.44 119.26 121.60 1suf h ALA 221 Ca 0.27 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 1suf h ALA 221 Cb 0.05 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1suf h ALA 221 CO -0.12 0.15 0.03 0.78 0.00 0.00 0.00 179.25 180.09 1suf h GLY 222 N 0.77 1.01 0.95 0.00 0.00 -0.51 0.72 103.07 106.00 1suf h GLY 222 Ca 0.24 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 1suf h GLY 222 CO -0.09 0.63 0.11 0.00 0.00 0.00 0.00 176.54 177.20 1suf h TYR 224 N 0.23 1.15 -0.63 0.00 5.03 -0.74 -1.15 116.97 120.86 1suf h TYR 224 Ca 0.07 -0.24 -0.01 0.00 2.58 0.00 0.00 58.73 61.13 1suf h TYR 224 Cb 0.07 -0.28 -0.03 0.00 1.55 0.00 0.00 36.73 38.04 1suf h TYR 224 CO -0.04 1.06 0.34 1.98 -1.32 0.00 0.00 178.16 180.19 1suf h MET 225 N 0.91 0.89 -0.51 1.82 4.05 -0.80 -0.85 114.93 120.44 1suf h MET 225 Ca 0.14 -0.11 -0.04 0.00 -0.28 0.00 0.00 59.70 59.41 1suf h MET 225 Cb 0.69 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.29 1suf h MET 225 CO 0.05 0.68 0.17 0.78 0.23 0.00 0.00 176.91 178.82 1suf h GLY 226 N 0.87 0.84 0.98 1.39 0.00 -0.61 -0.89 103.07 105.65 1suf h GLY 226 Ca 0.22 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1suf h GLY 226 CO -0.03 0.46 0.26 -0.84 0.00 0.00 0.00 176.54 176.38 1suf h THR 227 N 0.69 1.15 -0.08 4.70 2.02 -1.08 -1.21 112.91 119.10 1suf h THR 227 Ca 0.16 -0.36 0.02 0.00 0.77 0.00 0.00 66.41 67.01 1suf h THR 227 Cb 0.26 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 1suf h THR 227 CO -0.01 0.15 -0.03 0.44 0.37 0.00 0.00 175.52 176.44 1suf h ASP 228 N 0.58 -0.11 -0.26 4.18 3.32 -0.95 -0.15 116.42 123.03 1suf h ASP 228 Ca 0.16 0.03 -0.18 0.00 0.02 0.00 0.00 57.03 57.05 1suf h ASP 228 Cb 0.02 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 1suf h ASP 228 CO -0.03 -0.04 -0.55 -0.07 -1.72 0.00 0.00 179.24 176.83 1suf h LEU 229 N -0.02 0.95 -1.03 1.55 3.38 -1.12 -1.69 115.31 117.33 1suf h LEU 229 Ca 0.04 -0.51 -0.04 0.00 0.09 0.00 0.00 57.88 57.46 1suf h LEU 229 Cb 0.08 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1suf h LEU 229 CO -0.09 1.30 0.21 0.00 0.09 0.00 0.00 178.44 179.94 1suf h ALA 230 N 0.72 1.22 -0.47 1.53 0.00 -1.12 -1.53 119.26 119.61 1suf h ALA 230 Ca 0.01 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1suf h ALA 230 Cb 1.15 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1suf h ALA 230 CO 0.12 0.56 0.02 -0.44 0.00 0.00 0.00 179.25 179.50 1suf h ASP 231 N 0.88 0.80 -0.22 0.00 3.32 -0.80 0.15 116.42 120.56 1suf h ASP 231 Ca 0.20 -0.30 0.04 0.00 0.02 0.00 0.00 57.03 57.00 1suf h ASP 231 Cb 0.23 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 1suf h ASP 231 CO -0.01 0.90 -0.02 0.40 -1.72 0.00 0.00 179.24 178.79 1suf h ILE 232 N 0.68 0.82 -0.00 0.35 2.04 -1.00 0.17 117.51 120.57 1suf h ILE 232 Ca 0.14 -0.01 -0.20 0.00 1.00 0.00 0.00 64.86 65.78 1suf h ILE 232 Cb 0.48 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1suf h ILE 232 CO 0.02 0.01 -0.88 -0.07 0.00 0.00 0.00 178.15 177.23 1suf h LEU 233 N 0.04 0.32 -0.41 1.44 3.38 -1.12 0.29 115.31 119.25 1suf h LEU 233 Ca 0.11 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1suf h LEU 233 Cb 0.14 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1suf h LEU 233 CO -0.20 1.05 0.00 0.49 0.09 0.00 0.00 178.44 179.87 1suf n PHE 234 N -3.69 0.00 0.00 1.13 3.72 0.53 -4.11 117.46 115.04 1suf n PHE 234 Ca -0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1suf n PHE 234 Cb 0.80 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.34 1suf n PHE 234 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1suf n GLY 235 N 0.42 2.24 3.72 1.37 0.00 0.04 -4.99 105.19 108.00 1suf n GLY 235 Ca 0.00 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 1suf n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1suf s THR 236 N -1.10 4.02 0.54 2.61 2.01 -1.23 -4.56 115.64 117.92 1suf s THR 236 Ca 0.00 1.51 -0.22 0.00 0.31 0.00 0.00 61.69 63.29 1suf s THR 236 Cb 0.00 -3.97 -0.05 0.00 0.01 0.00 0.00 72.50 68.49 1suf s THR 236 CO 0.00 0.15 1.28 -2.65 -0.69 0.00 0.00 174.62 172.72 1suf n PRO 237 N 3.53 1.58 -4.35 4.92 -0.02 -1.26 -5.03 135.00 134.37 1suf n PRO 237 Ca 0.07 0.58 -0.18 0.00 -2.02 0.00 0.00 63.50 61.95 1suf n PRO 237 Cb 0.46 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.36 1suf n PRO 237 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1suf s ALA 238 N -1.31 1.93 0.29 3.55 0.00 -1.22 -4.26 121.76 120.74 1suf s ALA 238 Ca 0.71 -1.78 -0.30 0.00 0.00 0.00 0.00 51.96 50.59 1suf s ALA 238 Cb -0.43 0.38 -0.12 0.00 0.00 0.00 0.00 23.12 22.94 1suf s ALA 238 CO 0.50 -0.19 1.42 -2.30 0.00 0.00 0.00 175.76 175.18 1suf n PRO 239 N -0.45 2.26 -4.09 0.00 -0.02 -1.19 -4.39 135.00 127.12 1suf n PRO 239 Ca -0.06 0.80 -0.09 0.00 -2.02 0.00 0.00 63.50 62.13 1suf n PRO 239 Cb 0.63 -2.46 -0.10 0.00 -0.02 0.00 0.00 33.50 31.55 1suf n PRO 239 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1suf s VAL 240 N -0.46 0.37 -0.05 -1.45 -7.23 -0.33 -4.95 120.40 106.30 1suf s VAL 240 Ca 0.62 -1.63 0.06 0.00 -1.81 0.00 0.00 61.98 59.22 1suf s VAL 240 Cb -0.58 -1.27 -0.01 0.00 0.56 0.00 0.00 36.38 35.08 1suf s VAL 240 CO 0.55 -0.82 -0.24 -0.69 -0.31 0.00 0.00 175.10 173.58 1suf s VAL 241 N -3.19 1.98 0.00 1.32 1.01 -1.26 -0.85 120.40 119.41 1suf s VAL 241 Ca 0.03 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 60.98 1suf s VAL 241 Cb 0.03 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1suf s VAL 241 CO -0.06 0.55 0.00 1.07 0.00 0.00 0.00 175.10 176.66 1suf n THR 242 N 2.91 0.00 -4.09 3.92 5.66 0.75 -4.91 114.28 118.52 1suf n THR 242 Ca -0.17 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.74 1suf n THR 242 Cb 0.52 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.20 1suf n THR 242 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1suf s GLU 243 N 1.63 0.79 0.11 1.09 2.02 -1.26 -0.88 118.70 122.20 1suf s GLU 243 Ca 0.00 -1.29 -0.02 0.00 0.02 0.00 0.00 54.97 53.67 1suf s GLU 243 Cb 0.00 0.24 -0.03 0.00 0.10 0.00 0.00 34.13 34.44 1suf s GLU 243 CO 0.00 -0.20 0.07 -1.54 0.02 0.00 0.00 175.26 173.61 1suf s SER 244 N -2.97 0.31 0.00 -0.19 1.04 -0.55 -2.00 113.70 109.33 1suf s SER 244 Ca 0.15 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.50 1suf s SER 244 Cb 0.07 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1suf s SER 244 CO -0.05 -0.72 0.00 -3.20 0.98 0.00 0.00 173.24 170.26 1suf n ASN 245 N -0.06 0.00 0.29 7.02 4.05 0.13 -1.40 115.26 125.29 1suf n ASN 245 Ca -0.08 0.00 0.16 0.00 0.45 0.00 0.00 54.58 55.11 1suf n ASN 245 Cb 0.63 0.00 0.88 0.00 1.23 0.00 0.00 39.78 42.52 1suf n ASN 245 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1suf h LEU 246 N 0.00 0.00 0.00 1.20 3.38 -1.60 -1.75 115.31 116.54 1suf h LEU 246 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1suf h LEU 246 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1suf h LEU 246 CO 0.00 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.19 1suf n GLY 247 N -0.80 -0.53 0.06 0.83 0.00 -0.41 -1.58 105.19 102.77 1suf n GLY 247 Ca -0.02 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.08 1suf n GLY 247 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1suf n VAL 248 N -1.20 0.44 -2.36 1.61 0.24 -0.66 -4.78 118.33 111.63 1suf n VAL 248 Ca 0.06 -0.08 -0.35 0.00 -2.04 0.00 0.00 64.34 61.92 1suf n VAL 248 Cb 0.07 -0.65 -0.01 0.00 -1.47 0.00 0.00 33.84 31.77 1suf n VAL 248 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1suf s LEU 249 N -3.86 3.85 -0.14 1.34 1.43 -0.62 -5.04 118.68 115.65 1suf s LEU 249 Ca 0.11 2.12 -0.00 0.00 -1.03 0.00 0.00 54.13 55.33 1suf s LEU 249 Cb 0.14 -4.48 0.03 0.00 0.03 0.00 0.00 46.19 41.91 1suf s LEU 249 CO 0.52 -0.99 -0.07 -0.54 0.23 0.00 0.00 176.35 175.50 1suf s LYS 250 N -3.10 1.58 0.45 1.70 1.02 -1.26 -5.03 119.74 115.09 1suf s LYS 250 Ca 0.68 -0.38 0.15 0.00 0.02 0.00 0.00 55.97 56.45 1suf s LYS 250 Cb -0.23 -1.79 1.07 0.00 -0.52 0.00 0.00 37.83 36.37 1suf s LYS 250 CO 0.26 -0.32 1.99 0.00 -0.92 0.00 0.00 175.35 176.36 1suf h ALA 251 N 8.14 2.06 -0.26 5.17 0.00 -1.96 -2.06 119.26 130.34 1suf h ALA 251 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1suf h ALA 251 Cb 1.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1suf h ALA 251 CO 0.42 -0.19 0.00 -0.40 0.00 0.00 0.00 179.25 179.08 1suf n ASP 252 N -4.46 2.15 -4.74 0.00 5.68 -1.26 -4.88 116.55 109.03 1suf n ASP 252 Ca 0.09 -1.82 -0.23 0.00 -0.50 0.00 0.00 54.79 52.33 1suf n ASP 252 Cb 0.38 -0.17 -0.06 0.00 -1.14 0.00 0.00 41.12 40.13 1suf n ASP 252 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1suf s ALA 253 N -1.66 3.49 -0.48 2.12 0.00 -0.78 -1.02 121.76 123.44 1suf s ALA 253 Ca 0.33 -1.74 -0.28 0.00 0.00 0.00 0.00 51.96 50.27 1suf s ALA 253 Cb 0.18 -0.85 0.02 0.00 0.00 0.00 0.00 23.12 22.46 1suf s ALA 253 CO 0.26 0.09 1.35 0.08 0.00 0.00 0.00 175.76 177.54 1suf s VAL 254 N -2.36 3.93 -0.24 0.00 1.01 -0.59 -4.88 120.40 117.27 1suf s VAL 254 Ca 0.37 0.90 -0.18 0.00 0.00 0.00 0.00 61.98 63.06 1suf s VAL 254 Cb -0.04 -4.38 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 1suf s VAL 254 CO 0.23 -0.96 0.50 0.20 0.00 0.00 0.00 175.10 175.07 1suf s ASN 255 N 3.78 6.47 -0.21 3.32 0.01 -1.26 -0.20 114.94 126.85 1suf s ASN 255 Ca 0.55 0.57 0.01 0.00 -0.71 0.00 0.00 52.86 53.28 1suf s ASN 255 Cb -0.11 -2.28 0.04 0.00 0.41 0.00 0.00 41.25 39.31 1suf s ASN 255 CO 0.30 -0.23 -0.13 -0.69 -1.51 0.00 0.00 177.10 174.84 1suf s VAL 256 N 2.00 1.88 -0.01 1.60 1.01 -0.55 -0.98 120.40 125.35 1suf s VAL 256 Ca 0.22 -1.13 -0.19 0.00 0.00 0.00 0.00 61.98 60.88 1suf s VAL 256 Cb -0.15 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 1suf s VAL 256 CO 0.09 0.23 0.53 0.00 0.00 0.00 0.00 175.10 175.95 1suf s ALA 257 N 1.30 3.55 -0.20 5.51 0.00 -0.06 -0.61 121.76 131.25 1suf s ALA 257 Ca -0.01 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.78 1suf s ALA 257 Cb -0.16 -2.63 -0.05 0.00 0.00 0.00 0.00 23.12 20.28 1suf s ALA 257 CO -0.09 0.25 0.19 0.14 0.00 0.00 0.00 175.76 176.25 1suf s VAL 258 N -0.41 5.36 0.02 0.00 -7.23 -0.32 -0.65 120.40 117.17 1suf s VAL 258 Ca 0.28 0.30 0.01 0.00 -1.81 0.00 0.00 61.98 60.75 1suf s VAL 258 Cb -0.18 -3.53 -0.02 0.00 0.56 0.00 0.00 36.38 33.22 1suf s VAL 258 CO 0.16 0.40 -0.03 -2.28 -0.31 0.00 0.00 175.10 173.03 1suf s HIS 259 N 0.59 0.29 0.00 2.82 5.04 -0.54 -1.04 115.29 122.46 1suf s HIS 259 Ca 0.10 -0.38 0.00 0.00 -1.54 0.00 0.00 55.06 53.24 1suf s HIS 259 Cb -0.12 -0.20 0.00 0.00 0.04 0.00 0.00 32.58 32.30 1suf s HIS 259 CO 0.01 -0.12 0.00 0.41 -2.34 0.00 0.00 174.74 172.71 1suf n GLY 260 N 1.99 0.26 0.00 1.59 0.00 -1.26 -3.08 105.19 104.69 1suf n GLY 260 Ca -0.20 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1suf n GLY 260 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1suf n HIS 261 N 0.00 0.00 -3.47 1.61 8.25 -1.18 -0.72 115.22 119.71 1suf n HIS 261 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 1suf n HIS 261 Cb 0.00 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.03 1suf n HIS 261 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1suf s ASN 262 N -2.39 6.31 0.14 0.41 3.84 -1.26 -4.06 114.94 117.93 1suf s ASN 262 Ca 0.00 0.35 0.16 0.00 0.21 0.00 0.00 52.86 53.59 1suf s ASN 262 Cb 0.00 -2.19 0.73 0.00 -0.55 0.00 0.00 41.25 39.24 1suf s ASN 262 CO 0.00 -0.05 1.50 -0.81 -2.79 0.00 0.00 177.10 174.94 1suf n PRO 263 N 4.57 0.09 -0.23 0.43 -0.04 -1.26 -2.14 135.00 136.42 1suf n PRO 263 Ca -0.10 0.43 0.12 0.00 -0.04 0.00 0.00 63.50 63.91 1suf n PRO 263 Cb 0.51 -1.71 0.41 0.00 -0.04 0.00 0.00 33.50 32.67 1suf n PRO 263 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1suf h VAL 264 N 0.00 0.85 0.00 0.52 2.07 -1.99 -0.22 116.25 117.48 1suf h VAL 264 Ca 0.00 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 1suf h VAL 264 Cb 0.19 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1suf h VAL 264 CO 0.00 0.11 -0.55 0.25 0.02 0.00 0.00 177.57 177.41 1suf h LEU 265 N 0.62 0.00 -0.71 2.57 5.85 -1.86 -3.39 115.31 118.40 1suf h LEU 265 Ca 0.41 -0.15 0.11 0.00 0.84 0.00 0.00 57.88 59.08 1suf h LEU 265 Cb 0.70 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.65 1suf h LEU 265 CO -0.17 0.87 0.33 0.77 -0.34 0.00 0.00 178.44 179.90 1suf h SER 266 N -1.00 0.39 -0.20 1.25 4.64 -1.41 -1.88 113.55 115.34 1suf h SER 266 Ca -0.07 0.08 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 1suf h SER 266 Cb 0.61 0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1suf h SER 266 CO -0.04 0.20 -0.21 -0.78 -0.87 0.00 0.00 176.83 175.13 1suf h ASP 267 N 0.54 0.65 -0.31 4.97 3.58 -1.27 -1.57 116.42 123.01 1suf h ASP 267 Ca 0.36 -0.22 -0.18 0.00 0.42 0.00 0.00 57.03 57.42 1suf h ASP 267 Cb 0.45 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 1suf h ASP 267 CO -0.31 0.86 -0.48 0.40 -2.88 0.00 0.00 179.24 176.83 1suf h ILE 268 N 0.58 1.27 -0.92 2.25 1.08 -1.62 -2.41 117.51 117.74 1suf h ILE 268 Ca 0.09 -1.66 0.08 0.00 -0.39 0.00 0.00 64.86 62.97 1suf h ILE 268 Cb 0.67 1.53 -0.07 0.00 -3.07 0.00 0.00 36.82 35.88 1suf h ILE 268 CO 0.05 0.55 0.58 0.40 -0.69 0.00 0.00 178.15 179.03 1suf h ILE 269 N 0.70 1.01 -0.39 -0.67 1.08 -0.83 0.08 117.51 118.50 1suf h ILE 269 Ca 0.03 -0.34 -0.04 0.00 -0.39 0.00 0.00 64.86 64.12 1suf h ILE 269 Cb 1.08 -0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.73 1suf h ILE 269 CO 0.11 0.18 0.07 0.58 -0.69 0.00 0.00 178.15 178.41 1suf h VAL 270 N 1.00 1.24 0.03 1.67 2.07 -1.12 -0.65 116.25 120.49 1suf h VAL 270 Ca 0.42 -0.83 -0.23 0.00 0.82 0.00 0.00 66.70 66.88 1suf h VAL 270 Cb 0.27 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1suf h VAL 270 CO -0.21 0.28 -0.99 0.28 0.02 0.00 0.00 177.57 176.95 1suf h SER 271 N 0.49 0.39 0.40 0.57 0.02 -1.04 -3.14 113.55 111.24 1suf h SER 271 Ca 0.12 -0.35 -0.16 0.00 -0.84 0.00 0.00 61.79 60.56 1suf h SER 271 Cb 0.35 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 1suf h SER 271 CO 0.01 1.18 -0.67 0.58 -1.14 0.00 0.00 176.83 176.78 1suf h VAL 272 N 0.14 1.41 -0.68 2.27 2.07 -0.98 -2.87 116.25 117.61 1suf h VAL 272 Ca -0.08 -2.14 0.10 0.00 0.82 0.00 0.00 66.70 65.41 1suf h VAL 272 Cb 1.66 2.11 -0.04 0.00 -1.52 0.00 0.00 31.29 33.49 1suf h VAL 272 CO 0.16 0.63 0.45 0.77 0.02 0.00 0.00 177.57 179.60 1suf h SER 273 N 0.17 0.47 -0.70 0.57 4.64 -1.12 0.59 113.55 118.17 1suf h SER 273 Ca -0.02 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 1suf h SER 273 Cb 1.21 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 63.19 1suf h SER 273 CO 0.11 0.28 0.38 0.11 -0.87 0.00 0.00 176.83 176.84 1suf h LYS 274 N 0.52 0.98 0.00 4.77 1.57 -1.46 -2.72 116.57 120.22 1suf h LYS 274 Ca 0.32 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 1suf h LYS 274 Cb 0.55 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 1suf h LYS 274 CO -0.10 0.73 -0.14 0.93 -0.57 0.00 0.00 179.45 180.30 1suf h GLU 275 N 0.96 0.00 -0.61 3.15 5.08 -0.74 -3.13 114.58 119.30 1suf h GLU 275 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1suf h GLU 275 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1suf h GLU 275 CO -0.04 0.14 0.00 -1.33 -1.00 0.00 0.00 179.01 176.78 1suf n MET 276 N -3.34 2.88 -0.28 2.33 2.81 -0.89 -4.41 117.12 116.21 1suf n MET 276 Ca -0.00 -1.95 0.04 0.00 -1.81 0.00 0.00 57.70 53.97 1suf n MET 276 Cb 0.35 -1.70 0.18 0.00 -0.71 0.00 0.00 33.22 31.34 1suf n MET 276 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1suf h GLU 277 N 2.80 0.68 -0.17 0.03 4.81 -1.49 -1.43 114.58 119.80 1suf h GLU 277 Ca 0.00 -0.04 -0.16 0.00 -0.13 0.00 0.00 59.36 59.03 1suf h GLU 277 Cb 1.07 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 1suf h GLU 277 CO 0.16 0.45 -0.57 -0.91 -0.73 0.00 0.00 179.01 177.41 1suf h ASN 278 N 0.70 0.58 -0.47 1.04 -0.26 -1.87 -0.37 115.58 114.92 1suf h ASN 278 Ca 0.40 -0.32 -0.06 0.00 -0.56 0.00 0.00 56.30 55.76 1suf h ASN 278 Cb 0.45 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.52 1suf h ASN 278 CO -0.29 1.02 0.08 -0.08 -1.06 0.00 0.00 177.43 177.11 1suf h GLU 279 N 0.40 0.85 -0.57 0.81 4.81 -1.75 -0.73 114.58 118.39 1suf h GLU 279 Ca 0.00 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 58.95 1suf h GLU 279 Cb 1.11 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 1suf h GLU 279 CO 0.10 0.80 0.04 0.00 -0.73 0.00 0.00 179.01 179.22 1suf h ALA 280 N 1.28 0.99 0.00 2.92 0.00 -0.80 -2.98 119.26 120.67 1suf h ALA 280 Ca 0.17 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 1suf h ALA 280 Cb 0.37 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1suf h ALA 280 CO 0.01 0.63 -0.51 0.00 0.00 0.00 0.00 179.25 179.38 1suf h ARG 281 N 0.89 0.00 0.00 0.00 3.08 -0.48 -1.81 114.38 116.06 1suf h ARG 281 Ca 0.17 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 1suf h ARG 281 Cb 0.47 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 1suf h ARG 281 CO 0.02 0.51 -0.03 0.00 -1.07 0.00 0.00 179.97 179.40 1suf h ALA 282 N 1.49 1.04 -0.01 0.04 0.00 -1.00 -0.93 119.26 119.90 1suf h ALA 282 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1suf h ALA 282 Cb 0.93 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1suf h ALA 282 CO 0.07 0.04 -0.11 0.00 0.00 0.00 0.00 179.25 179.24 1suf n ALA 283 N -2.12 2.79 -0.05 0.00 0.00 -0.72 -4.94 120.51 115.47 1suf n ALA 283 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1suf n ALA 283 Cb 0.23 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1suf n ALA 283 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1suf n GLY 284 N 1.24 0.69 3.96 0.00 0.00 -0.35 -4.79 105.19 105.94 1suf n GLY 284 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1suf n GLY 284 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1suf s ALA 285 N -2.07 3.84 -0.57 4.61 0.00 -0.95 -4.99 121.76 121.63 1suf s ALA 285 Ca 0.00 -1.18 0.25 0.00 0.00 0.00 0.00 51.96 51.03 1suf s ALA 285 Cb 0.00 -2.09 0.59 0.00 0.00 0.00 0.00 23.12 21.62 1suf s ALA 285 CO 0.00 -0.49 1.70 1.79 0.00 0.00 0.00 175.76 178.75 1suf h THR 286 N 0.30 0.00 0.00 0.00 1.35 -1.36 -3.34 112.91 109.86 1suf h THR 286 Ca -0.45 -0.73 0.00 0.00 -0.55 0.00 0.00 66.41 64.68 1suf h THR 286 Cb 1.27 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.41 1suf h THR 286 CO 0.55 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.43 1suf n GLY 287 N 1.16 -0.80 3.64 5.82 0.00 -1.26 -4.85 105.19 108.89 1suf n GLY 287 Ca 0.05 -1.43 -0.38 0.00 0.00 0.00 0.00 46.02 44.26 1suf n GLY 287 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1suf s ILE 288 N -2.63 5.29 -0.66 -0.61 1.01 -1.26 -1.54 121.20 120.80 1suf s ILE 288 Ca 0.00 0.35 -0.15 0.00 0.00 0.00 0.00 60.65 60.85 1suf s ILE 288 Cb 0.00 -3.59 0.17 0.00 0.01 0.00 0.00 42.46 39.05 1suf s ILE 288 CO 0.00 0.27 0.61 0.21 0.00 0.00 0.00 174.94 176.04 1suf s ASN 289 N 1.30 6.43 0.02 3.58 2.47 0.72 -4.94 114.94 124.53 1suf s ASN 289 Ca 0.11 -2.17 -0.30 0.00 0.42 0.00 0.00 52.86 50.92 1suf s ASN 289 Cb -0.15 -2.21 -0.04 0.00 -1.45 0.00 0.00 41.25 37.41 1suf s ASN 289 CO 0.07 -0.74 1.04 -0.69 -3.72 0.00 0.00 177.10 173.06 1suf s VAL 290 N 0.99 4.62 0.14 -5.21 1.01 -1.26 -1.48 120.40 119.21 1suf s VAL 290 Ca 0.09 1.90 0.05 0.00 0.00 0.00 0.00 61.98 64.02 1suf s VAL 290 Cb -0.22 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 1suf s VAL 290 CO -0.02 0.16 -0.11 0.68 0.00 0.00 0.00 175.10 175.81 1suf s VAL 291 N 0.95 1.17 0.09 2.92 -7.23 0.22 -4.43 120.40 114.10 1suf s VAL 291 Ca 0.53 -1.94 0.04 0.00 -1.81 0.00 0.00 61.98 58.81 1suf s VAL 291 Cb -0.23 -1.72 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 1suf s VAL 291 CO 0.29 -0.66 0.01 -0.83 -0.31 0.00 0.00 175.10 173.60 1suf s GLY 292 N -2.94 1.94 -0.01 2.32 0.00 -0.15 -1.17 107.32 107.31 1suf s GLY 292 Ca 0.14 -1.10 0.04 0.00 0.00 0.00 0.00 44.72 43.80 1suf s GLY 292 CO 0.01 -1.08 -0.14 -0.42 0.00 0.00 0.00 173.10 171.47 1suf s ILE 293 N -1.33 1.11 0.00 0.90 1.01 -0.20 -0.43 121.20 122.25 1suf s ILE 293 Ca 0.26 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 60.29 1suf s ILE 293 Cb -0.12 -0.93 0.00 0.00 0.01 0.00 0.00 42.46 41.42 1suf s ILE 293 CO 0.19 0.30 0.00 0.00 0.00 0.00 0.00 174.94 175.43 1suf h THR 296 N 0.34 1.20 -0.65 0.00 1.03 -1.05 0.13 112.91 113.90 1suf h THR 296 Ca 0.01 -0.84 0.00 0.00 -0.01 0.00 0.00 66.41 65.58 1suf h THR 296 Cb 1.00 1.13 -0.03 0.00 -1.07 0.00 0.00 68.15 69.18 1suf h THR 296 CO 0.09 0.27 0.42 1.23 -0.01 0.00 0.00 175.52 177.52 1suf h GLY 297 N 0.81 0.92 1.23 2.99 0.00 -1.13 -2.18 103.07 105.70 1suf h GLY 297 Ca 0.07 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.02 1suf h GLY 297 CO 0.02 0.35 0.33 3.43 0.00 0.00 0.00 176.54 180.67 1suf h ASN 298 N 0.88 0.91 -0.32 0.19 2.35 -0.16 0.40 115.58 119.83 1suf h ASN 298 Ca 0.24 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 1suf h ASN 298 Cb -0.08 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.05 1suf h ASN 298 CO -0.05 0.77 0.18 -0.33 -1.65 0.00 0.00 177.43 176.35 1suf h GLU 299 N 0.99 0.45 0.00 0.81 4.39 -0.38 -0.04 114.58 120.81 1suf h GLU 299 Ca 0.24 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.89 1suf h GLU 299 Cb 0.11 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1suf h GLU 299 CO -0.03 0.38 -0.07 -0.39 -1.16 0.00 0.00 179.01 177.74 1suf h VAL 300 N 0.40 0.00 -0.24 3.13 -1.51 -1.16 -2.38 116.25 114.49 1suf h VAL 300 Ca 0.11 -0.92 -0.03 0.00 -1.23 0.00 0.00 66.70 64.63 1suf h VAL 300 Cb 0.06 1.88 -0.01 0.00 -2.13 0.00 0.00 31.29 31.10 1suf h VAL 300 CO -0.02 0.00 0.02 0.25 -1.23 0.00 0.00 177.57 176.59 1suf h LEU 301 N 0.00 0.39 -0.64 4.19 6.46 -0.68 -0.67 115.31 124.36 1suf h LEU 301 Ca 0.00 -0.28 -0.11 0.00 -0.12 0.00 0.00 57.88 57.37 1suf h LEU 301 Cb 0.96 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.77 1suf h LEU 301 CO 0.00 0.57 -0.13 0.24 -0.62 0.00 0.00 178.44 178.50 1suf h MET 302 N 0.19 0.93 0.00 1.25 2.86 -0.91 0.07 114.93 119.33 1suf h MET 302 Ca 0.07 -0.34 -0.32 0.00 -2.06 0.00 0.00 59.70 57.05 1suf h MET 302 Cb 0.36 -0.06 -0.06 0.00 0.06 0.00 0.00 31.60 31.90 1suf h MET 302 CO 0.01 1.00 -1.91 0.54 1.06 0.00 0.00 176.91 177.60 1suf n ARG 303 N -4.14 0.65 0.00 1.72 1.74 -0.90 -4.34 116.66 111.38 1suf n ARG 303 Ca 0.01 0.21 0.00 0.00 -0.77 0.00 0.00 57.85 57.30 1suf n ARG 303 Cb 0.40 -1.71 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 1suf n ARG 303 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1suf n HIS 304 N -2.98 0.00 -1.15 -1.55 8.25 -0.29 -4.94 115.22 112.56 1suf n HIS 304 Ca -0.22 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.19 1suf n HIS 304 Cb 1.08 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 32.17 1suf n HIS 304 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1suf n GLY 305 N 0.09 0.79 3.72 -1.41 0.00 0.01 -4.96 105.19 103.43 1suf n GLY 305 Ca 0.00 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.80 1suf n GLY 305 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1suf s ILE 306 N -2.19 2.70 0.39 -0.61 -1.09 -1.04 -4.74 121.20 114.62 1suf s ILE 306 Ca 0.00 0.50 -0.26 0.00 -2.23 0.00 0.00 60.65 58.66 1suf s ILE 306 Cb 0.00 -3.32 -0.09 0.00 -1.58 0.00 0.00 42.46 37.47 1suf s ILE 306 CO 0.00 0.04 1.20 -2.16 -1.23 0.00 0.00 174.94 172.79 1suf s PRO 307 N 1.16 4.11 -0.20 2.79 0.04 -1.26 -3.97 135.00 137.67 1suf s PRO 307 Ca 0.69 1.93 -0.22 0.00 0.04 0.00 0.00 61.00 63.45 1suf s PRO 307 Cb -0.43 -2.77 -0.02 0.00 0.04 0.00 0.00 34.50 31.32 1suf s PRO 307 CO 0.31 -0.30 0.67 0.00 0.04 0.00 0.00 177.00 177.72 1suf s ALA 308 N -1.34 3.54 -0.07 8.56 0.00 -0.85 -0.97 121.76 130.63 1suf s ALA 308 Ca 0.55 -0.22 -0.14 0.00 0.00 0.00 0.00 51.96 52.15 1suf s ALA 308 Cb -0.33 -3.02 -0.10 0.00 0.00 0.00 0.00 23.12 19.66 1suf s ALA 308 CO 0.42 -0.59 0.51 0.00 0.00 0.00 0.00 175.76 176.11 1suf n THR 310 N -4.89 0.00 -3.84 0.00 5.66 -1.21 -2.90 114.28 107.10 1suf n THR 310 Ca -0.05 -0.40 -0.12 0.00 -3.05 0.00 0.00 64.05 60.43 1suf n THR 310 Cb 0.19 0.44 -0.09 0.00 -1.55 0.00 0.00 70.33 69.32 1suf n THR 310 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 1suf s HIS 311 N -5.01 -0.01 0.00 1.09 0.09 -1.26 -3.29 115.29 106.89 1suf s HIS 311 Ca 0.09 -0.07 0.00 0.00 -0.00 0.00 0.00 55.06 55.08 1suf s HIS 311 Cb -0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 32.58 32.55 1suf s HIS 311 CO 0.05 -0.35 0.00 0.45 -0.00 0.00 0.00 174.74 174.89 1suf n SER 312 N 1.23 0.00 0.29 1.40 2.88 -1.26 -2.07 113.62 116.08 1suf n SER 312 Ca -0.22 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.45 1suf n SER 312 Cb 0.56 0.00 0.84 0.00 -0.75 0.00 0.00 64.21 64.86 1suf n SER 312 CO 0.00 0.00 0.00 1.62 -1.23 0.00 0.00 175.04 175.43 1suf h VAL 313 N 0.00 0.66 -0.54 2.46 3.04 -1.96 -1.74 116.25 118.18 1suf h VAL 313 Ca 0.00 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.68 1suf h VAL 313 Cb 0.00 1.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 1suf h VAL 313 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.57 175.02 1suf n SER 314 N -4.04 3.75 -0.05 3.17 3.41 -0.88 -4.54 113.62 114.43 1suf n SER 314 Ca -0.03 -2.28 0.12 0.00 -0.26 0.00 0.00 58.87 56.42 1suf n SER 314 Cb 0.09 -0.49 0.53 0.00 -0.26 0.00 0.00 64.21 64.07 1suf n SER 314 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 1suf h GLN 315 N 3.31 0.33 0.00 4.33 3.07 -1.41 -0.40 115.11 124.35 1suf h GLN 315 Ca 0.00 -0.02 -0.02 0.00 0.09 0.00 0.00 58.65 58.70 1suf h GLN 315 Cb 1.12 -0.08 -0.00 0.00 0.08 0.00 0.00 27.48 28.61 1suf h GLN 315 CO 0.15 0.22 -0.12 0.93 0.09 0.00 0.00 178.83 180.10 1suf h GLU 316 N 0.34 0.00 0.00 0.06 5.08 -1.85 -2.98 114.58 115.24 1suf h GLU 316 Ca 0.26 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.58 1suf h GLU 316 Cb 0.55 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1suf h GLU 316 CO -0.06 0.12 -0.16 0.52 -1.00 0.00 0.00 179.01 178.43 1suf h MET 317 N 0.00 0.00 -0.59 2.33 2.86 -1.42 -1.95 114.93 116.15 1suf h MET 317 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1suf h MET 317 Cb 0.30 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.93 1suf h MET 317 CO 0.02 0.16 0.24 0.00 1.06 0.00 0.00 176.91 178.38 1suf h ALA 318 N 1.84 1.31 -0.24 6.32 0.00 -1.67 -2.44 119.26 124.37 1suf h ALA 318 Ca -0.00 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1suf h ALA 318 Cb 0.39 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1suf h ALA 318 CO 0.02 0.52 -0.33 0.52 0.00 0.00 0.00 179.25 179.97 1suf h MET 319 N 0.85 0.52 0.00 0.00 2.07 -1.54 -3.14 114.93 113.68 1suf h MET 319 Ca 0.20 -0.23 -0.01 0.00 -2.07 0.00 0.00 59.70 57.59 1suf h MET 319 Cb 0.16 -0.01 -0.00 0.00 -1.87 0.00 0.00 31.60 29.88 1suf h MET 319 CO -0.02 0.79 -0.07 0.82 1.07 0.00 0.00 176.91 179.50 1suf h ILE 320 N 0.44 0.36 -0.12 -1.22 1.08 -1.20 -2.09 117.51 114.76 1suf h ILE 320 Ca 0.05 -0.40 0.03 0.00 -0.39 0.00 0.00 64.86 64.16 1suf h ILE 320 Cb 0.80 1.29 -0.00 0.00 -3.07 0.00 0.00 36.82 35.83 1suf h ILE 320 CO 0.06 0.07 0.11 0.71 -0.69 0.00 0.00 178.15 178.41 1suf h THR 321 N 0.00 0.64 0.00 -0.27 1.35 -1.49 -3.45 112.91 109.69 1suf h THR 321 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1suf h THR 321 Cb 0.28 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 1suf h THR 321 CO 0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.89 1suf n GLY 322 N -1.43 1.44 0.73 5.82 0.00 -0.79 -0.71 105.19 110.25 1suf n GLY 322 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1suf n GLY 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1suf n ALA 323 N -0.57 2.41 -2.68 4.61 0.00 -1.26 -4.89 120.51 118.13 1suf n ALA 323 Ca 0.00 -0.80 -0.43 0.00 0.00 0.00 0.00 53.44 52.21 1suf n ALA 323 Cb 0.00 -0.57 -0.05 0.00 0.00 0.00 0.00 19.45 18.83 1suf n ALA 323 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1suf s LEU 324 N -1.25 4.38 0.12 0.00 2.96 -1.26 -4.22 118.68 119.42 1suf s LEU 324 Ca 0.23 -0.51 -0.02 0.00 -0.22 0.00 0.00 54.13 53.61 1suf s LEU 324 Cb 0.15 -2.72 -0.12 0.00 0.50 0.00 0.00 46.19 44.00 1suf s LEU 324 CO 0.21 -1.10 1.28 0.44 -1.32 0.00 0.00 176.35 175.86 1suf h ASP 325 N 9.19 0.42 -4.51 3.68 3.32 -1.40 -3.35 116.42 123.76 1suf h ASP 325 Ca -0.26 -0.37 -0.14 0.00 0.02 0.00 0.00 57.03 56.28 1suf h ASP 325 Cb 1.08 -0.13 -0.22 0.00 0.22 0.00 0.00 39.33 40.28 1suf h ASP 325 CO 1.04 1.20 -0.36 0.00 -1.72 0.00 0.00 179.24 179.39 1suf s ALA 326 N -3.08 -0.66 -0.26 3.45 0.00 -0.99 -1.28 121.76 118.94 1suf s ALA 326 Ca -0.04 0.43 0.02 0.00 0.00 0.00 0.00 51.96 52.37 1suf s ALA 326 Cb 0.09 -0.14 0.07 0.00 0.00 0.00 0.00 23.12 23.13 1suf s ALA 326 CO 0.86 -0.20 -0.06 1.41 0.00 0.00 0.00 175.76 177.77 1suf s MET 327 N -0.73 1.81 -0.34 0.00 1.75 0.04 -0.88 119.30 120.95 1suf s MET 327 Ca -0.08 -1.21 -0.12 0.00 -1.25 0.00 0.00 55.69 53.02 1suf s MET 327 Cb -0.04 -2.74 -0.01 0.00 2.84 0.00 0.00 34.83 34.87 1suf s MET 327 CO 0.02 -0.63 0.23 0.42 -0.65 0.00 0.00 175.02 174.41 1suf s ILE 328 N 1.25 5.18 0.03 10.11 1.01 0.17 -0.94 121.20 138.01 1suf s ILE 328 Ca -0.05 -0.27 0.04 0.00 0.00 0.00 0.00 60.65 60.38 1suf s ILE 328 Cb -0.19 -3.67 -0.03 0.00 0.01 0.00 0.00 42.46 38.58 1suf s ILE 328 CO -0.07 -0.01 -0.08 -0.76 0.00 0.00 0.00 174.94 174.02 1suf s LEU 329 N 1.70 3.10 0.00 2.97 1.43 0.14 -1.47 118.68 126.55 1suf s LEU 329 Ca 0.06 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.94 1suf s LEU 329 Cb -0.17 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.24 1suf s LEU 329 CO 0.10 0.26 0.00 -0.90 0.23 0.00 0.00 176.35 176.03 1suf n ASP 330 N 1.36 0.00 -3.50 2.29 5.68 -1.18 -2.77 116.55 118.44 1suf n ASP 330 Ca -0.15 0.00 -0.12 0.00 -0.50 0.00 0.00 54.79 54.02 1suf n ASP 330 Cb 0.52 -0.08 -0.04 0.00 -1.14 0.00 0.00 41.12 40.39 1suf n ASP 330 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 1suf s TYR 331 N -0.54 -0.49 0.03 2.11 -0.85 -1.26 -4.51 117.35 111.85 1suf s TYR 331 Ca 0.00 0.57 0.00 0.00 -0.52 0.00 0.00 57.07 57.12 1suf s TYR 331 Cb 0.00 0.49 0.00 0.00 0.38 0.00 0.00 41.96 42.83 1suf s TYR 331 CO 0.00 -0.61 0.00 1.04 -1.52 0.00 0.00 175.55 174.46 1suf n GLN 332 N 0.21 -0.38 -1.04 -3.49 6.02 -1.26 -3.13 117.38 114.32 1suf n GLN 332 Ca -0.14 0.27 -0.01 0.00 -0.01 0.00 0.00 57.00 57.11 1suf n GLN 332 Cb 0.61 -0.30 -0.01 0.00 1.02 0.00 0.00 30.24 31.56 1suf n GLN 332 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1suf s ILE 334 N -1.73 4.80 0.02 0.00 1.01 -1.26 -4.92 121.20 119.12 1suf s ILE 334 Ca 0.00 0.42 -0.32 0.00 0.00 0.00 0.00 60.65 60.75 1suf s ILE 334 Cb 0.00 -4.19 -0.10 0.00 0.01 0.00 0.00 42.46 38.18 1suf s ILE 334 CO 0.00 -0.52 1.92 0.00 0.00 0.00 0.00 174.94 176.34 1suf n GLN 335 N 6.31 2.64 0.07 2.79 6.02 -1.26 -4.84 117.38 129.11 1suf n GLN 335 Ca -0.00 0.97 0.08 0.00 -0.01 0.00 0.00 57.00 58.03 1suf n GLN 335 Cb 0.48 -2.88 0.35 0.00 1.02 0.00 0.00 30.24 29.22 1suf n GLN 335 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1suf n PRO 336 N 6.90 0.08 -0.06 -1.09 -0.04 -1.26 -1.65 135.00 137.88 1suf n PRO 336 Ca 0.20 0.42 0.24 0.00 -0.04 0.00 0.00 63.50 64.33 1suf n PRO 336 Cb 0.37 -1.70 0.72 0.00 -0.04 0.00 0.00 33.50 32.85 1suf n PRO 336 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1suf h SER 337 N 0.00 0.00 -0.67 3.54 4.64 -2.01 -2.38 113.55 116.68 1suf h SER 337 Ca 0.00 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.44 1suf h SER 337 Cb 0.19 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.24 1suf h SER 337 CO 0.00 0.00 0.45 -0.37 -0.87 0.00 0.00 176.83 176.04 1suf h VAL 338 N 0.00 0.86 -0.18 0.95 -1.51 -1.70 -0.44 116.25 114.23 1suf h VAL 338 Ca 0.32 -0.14 -0.05 0.00 -1.23 0.00 0.00 66.70 65.59 1suf h VAL 338 Cb 1.35 0.40 -0.01 0.00 -2.13 0.00 0.00 31.29 30.90 1suf h VAL 338 CO -0.00 0.08 -0.13 0.00 -1.23 0.00 0.00 177.57 176.28 1suf h ALA 339 N 1.67 1.45 0.12 5.19 0.00 -1.68 -1.81 119.26 124.21 1suf h ALA 339 Ca 0.32 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 1suf h ALA 339 Cb 0.67 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1suf h ALA 339 CO -0.09 0.39 -0.91 1.15 0.00 0.00 0.00 179.25 179.78 1suf h THR 340 N 0.27 1.40 -0.41 0.00 2.02 -1.36 -3.33 112.91 111.51 1suf h THR 340 Ca 0.05 -2.48 0.02 0.00 0.77 0.00 0.00 66.41 64.77 1suf h THR 340 Cb 0.40 3.07 -0.02 0.00 -1.74 0.00 0.00 68.15 69.87 1suf h THR 340 CO 0.02 0.69 0.27 0.40 0.37 0.00 0.00 175.52 177.28 1suf h ILE 341 N -0.42 1.07 -0.73 3.11 2.04 -1.08 -1.89 117.51 119.61 1suf h ILE 341 Ca -0.18 -0.17 0.16 0.00 1.00 0.00 0.00 64.86 65.67 1suf h ILE 341 Cb 1.61 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 38.18 1suf h ILE 341 CO 0.11 0.09 0.50 0.00 0.00 0.00 0.00 178.15 178.84 1suf h ALA 342 N 1.75 2.24 -0.26 1.87 0.00 -1.43 -0.34 119.26 123.11 1suf h ALA 342 Ca 0.16 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1suf h ALA 342 Cb 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1suf h ALA 342 CO -0.04 -0.45 0.05 0.93 0.00 0.00 0.00 179.25 179.75 1suf h GLU 343 N 0.31 0.37 0.15 0.00 5.08 -1.48 0.09 114.58 119.10 1suf h GLU 343 Ca 0.36 -0.05 -0.31 0.00 -1.00 0.00 0.00 59.36 58.36 1suf h GLU 343 Cb 0.96 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.15 1suf h GLU 343 CO -0.09 0.35 -1.45 0.00 -1.00 0.00 0.00 179.01 176.82 1suf n THR 345 N -3.54 0.00 -0.37 0.00 -2.24 -0.66 -4.98 114.28 102.49 1suf n THR 345 Ca -0.15 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1suf n THR 345 Cb 1.05 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 69.85 1suf n THR 345 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1suf n GLY 346 N 1.40 1.31 3.77 3.38 0.00 -0.00 -4.77 105.19 110.28 1suf n GLY 346 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1suf n GLY 346 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1suf s THR 347 N -3.03 2.32 -0.39 2.61 2.01 -1.22 -4.95 115.64 112.99 1suf s THR 347 Ca 0.00 0.31 -0.21 0.00 0.31 0.00 0.00 61.69 62.11 1suf s THR 347 Cb 0.00 -3.19 0.01 0.00 0.01 0.00 0.00 72.50 69.33 1suf s THR 347 CO 0.00 0.07 0.64 -0.89 -0.69 0.00 0.00 174.62 173.75 1suf s THR 348 N -1.16 4.86 -0.22 -0.82 2.01 -0.41 -4.75 115.64 115.16 1suf s THR 348 Ca 0.54 0.43 -0.16 0.00 0.31 0.00 0.00 61.69 62.80 1suf s THR 348 Cb -0.43 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 67.92 1suf s THR 348 CO 0.57 -0.42 0.41 -0.69 -0.69 0.00 0.00 174.62 173.81 1suf s VAL 349 N 2.76 5.17 -0.14 3.82 1.01 -1.26 -0.78 120.40 130.98 1suf s VAL 349 Ca 0.24 0.72 0.01 0.00 0.00 0.00 0.00 61.98 62.95 1suf s VAL 349 Cb -0.14 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.52 1suf s VAL 349 CO 0.16 0.21 -0.15 -0.63 0.00 0.00 0.00 175.10 174.70 1suf s ILE 350 N 1.55 1.63 0.29 2.22 1.01 -0.11 -1.50 121.20 126.29 1suf s ILE 350 Ca 0.19 -0.68 -0.03 0.00 0.00 0.00 0.00 60.65 60.13 1suf s ILE 350 Cb -0.15 -1.51 -0.05 0.00 0.01 0.00 0.00 42.46 40.77 1suf s ILE 350 CO 0.08 0.47 0.53 0.42 0.00 0.00 0.00 174.94 176.44 1suf s THR 351 N 1.32 5.07 0.00 2.92 -4.23 -0.24 -0.69 115.64 119.80 1suf s THR 351 Ca 0.02 -0.12 0.00 0.00 -1.18 0.00 0.00 61.69 60.40 1suf s THR 351 Cb -0.13 -3.76 0.00 0.00 1.34 0.00 0.00 72.50 69.94 1suf s THR 351 CO -0.08 -0.36 0.00 0.35 -0.54 0.00 0.00 174.62 173.98 1suf n THR 352 N -1.11 0.00 -4.70 3.99 -2.24 -1.11 -0.97 114.28 108.14 1suf n THR 352 Ca -0.03 -0.07 -0.33 0.00 -2.27 0.00 0.00 64.05 61.35 1suf n THR 352 Cb 0.54 0.84 -0.12 0.00 -2.10 0.00 0.00 70.33 69.50 1suf n THR 352 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1suf s MET 353 N -0.20 2.79 0.46 -0.78 -1.94 -1.26 -2.15 119.30 116.22 1suf s MET 353 Ca 0.00 -0.60 0.14 0.00 -1.71 0.00 0.00 55.69 53.52 1suf s MET 353 Cb 0.00 -2.55 1.05 0.00 2.01 0.00 0.00 34.83 35.34 1suf s MET 353 CO 0.00 0.59 2.03 0.93 -0.01 0.00 0.00 175.02 178.56 1suf h GLU 354 N 5.50 0.04 -0.53 2.03 4.39 -1.95 -1.41 114.58 122.64 1suf h GLU 354 Ca -0.45 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.24 1suf h GLU 354 Cb 1.17 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1suf h GLU 354 CO 0.53 0.15 0.00 0.00 -1.16 0.00 0.00 179.01 178.53 1suf n MET 355 N -4.38 2.42 -3.30 2.33 0.00 -1.26 -4.61 117.12 108.31 1suf n MET 355 Ca -0.02 -1.79 -0.19 0.00 0.00 0.00 0.00 57.70 55.69 1suf n MET 355 Cb 0.20 -1.51 -0.08 0.00 0.00 0.00 0.00 33.22 31.83 1suf n MET 355 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1suf s SER 356 N -0.89 1.08 0.23 3.17 0.15 -0.53 -5.13 113.70 111.78 1suf s SER 356 Ca 0.33 -2.11 0.09 0.00 0.70 0.00 0.00 55.95 54.96 1suf s SER 356 Cb 0.19 0.35 -0.04 0.00 -1.71 0.00 0.00 66.02 64.81 1suf s SER 356 CO 0.19 -0.21 -0.01 -0.54 1.20 0.00 0.00 173.24 173.88 1suf s LYS 357 N 0.91 2.32 -0.08 5.44 1.02 -1.26 -4.45 119.74 123.63 1suf s LYS 357 Ca 0.23 -1.30 -0.01 0.00 0.02 0.00 0.00 55.97 54.92 1suf s LYS 357 Cb -0.09 -2.23 0.03 0.00 -0.52 0.00 0.00 37.83 35.02 1suf s LYS 357 CO -0.07 0.40 -0.03 0.42 -0.92 0.00 0.00 175.35 175.15 1suf s ILE 358 N -2.08 0.56 0.12 2.17 1.01 -1.26 -5.10 121.20 116.63 1suf s ILE 358 Ca 0.30 -0.02 -0.35 0.00 0.00 0.00 0.00 60.65 60.57 1suf s ILE 358 Cb -0.08 -0.66 -0.16 0.00 0.01 0.00 0.00 42.46 41.57 1suf s ILE 358 CO 0.19 0.28 1.41 0.41 0.00 0.00 0.00 174.94 177.23 1suf n THR 359 N 4.91 0.12 0.00 2.92 -1.04 -1.26 -1.36 114.28 118.56 1suf n THR 359 Ca -0.11 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 1suf n THR 359 Cb 0.50 -1.09 0.00 0.00 -1.82 0.00 0.00 70.33 67.93 1suf n THR 359 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1suf n GLY 360 N 2.75 1.42 3.88 3.41 0.00 -1.26 -4.82 105.19 110.58 1suf n GLY 360 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1suf n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1suf s ALA 361 N -2.35 3.59 0.23 4.61 0.00 -0.47 -4.98 121.76 122.39 1suf s ALA 361 Ca 0.00 -0.35 -0.30 0.00 0.00 0.00 0.00 51.96 51.32 1suf s ALA 361 Cb 0.00 -2.39 -0.09 0.00 0.00 0.00 0.00 23.12 20.64 1suf s ALA 361 CO 0.00 0.45 1.11 0.99 0.00 0.00 0.00 175.76 178.31 1suf s THR 362 N -1.88 3.66 -0.19 0.00 2.01 -0.56 -4.84 115.64 113.84 1suf s THR 362 Ca 0.46 1.54 -0.04 0.00 0.31 0.00 0.00 61.69 63.96 1suf s THR 362 Cb -0.11 -3.98 -0.02 0.00 0.01 0.00 0.00 72.50 68.39 1suf s THR 362 CO 0.23 0.32 -0.02 -2.28 -0.69 0.00 0.00 174.62 172.18 1suf s HIS 363 N -0.69 3.02 -0.26 4.92 2.46 -1.26 -1.08 115.29 122.40 1suf s HIS 363 Ca 0.47 -0.46 0.02 0.00 0.47 0.00 0.00 55.06 55.56 1suf s HIS 363 Cb -0.31 -2.04 0.07 0.00 -0.13 0.00 0.00 32.58 30.17 1suf s HIS 363 CO 0.38 -0.21 -0.04 0.08 -2.47 0.00 0.00 174.74 172.48 1suf s VAL 364 N 0.83 1.77 0.22 0.89 1.01 -0.14 -4.95 120.40 120.03 1suf s VAL 364 Ca -0.00 -1.52 -0.32 0.00 0.00 0.00 0.00 61.98 60.13 1suf s VAL 364 Cb -0.14 -2.06 -0.13 0.00 0.00 0.00 0.00 36.38 34.05 1suf s VAL 364 CO 0.02 -0.20 1.53 -3.20 0.00 0.00 0.00 175.10 173.24 1suf n ASN 365 N 4.55 3.18 -4.29 3.32 4.05 -1.26 -4.17 115.26 120.64 1suf n ASN 365 Ca -0.09 1.12 -0.35 0.00 0.45 0.00 0.00 54.58 55.70 1suf n ASN 365 Cb 0.43 -1.47 -0.14 0.00 1.23 0.00 0.00 39.78 39.83 1suf n ASN 365 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 1suf s PHE 366 N 0.39 2.94 -0.05 1.20 5.36 -0.92 -4.92 117.98 121.98 1suf s PHE 366 Ca 0.72 -1.00 0.05 0.00 -0.96 0.00 0.00 56.93 55.74 1suf s PHE 366 Cb -0.62 -2.09 -0.02 0.00 -0.34 0.00 0.00 43.02 39.96 1suf s PHE 366 CO 0.44 -0.57 -0.22 0.00 -1.46 0.00 0.00 175.22 173.41 1suf s ALA 367 N 1.46 2.32 0.35 11.12 0.00 -1.26 -4.92 121.76 130.84 1suf s ALA 367 Ca 0.06 -1.04 0.18 0.00 0.00 0.00 0.00 51.96 51.16 1suf s ALA 367 Cb -0.14 -0.76 0.96 0.00 0.00 0.00 0.00 23.12 23.19 1suf s ALA 367 CO -0.04 0.47 1.90 0.93 0.00 0.00 0.00 175.76 179.02 1suf h GLU 368 N 5.79 0.00 0.00 0.00 3.07 -1.97 -0.34 114.58 121.12 1suf h GLU 368 Ca -0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.48 1suf h GLU 368 Cb 1.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 1suf h GLU 368 CO 0.49 0.27 0.00 0.93 -1.40 0.00 0.00 179.01 179.30 1suf h GLU 369 N 0.00 0.00 0.00 2.33 3.07 -1.94 -2.87 114.58 115.17 1suf h GLU 369 Ca -0.00 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.78 1suf h GLU 369 Cb 0.57 0.00 -0.17 0.00 -0.84 0.00 0.00 28.75 28.31 1suf h GLU 369 CO 0.04 0.00 -0.70 0.00 -1.40 0.00 0.00 179.01 176.94 1suf n ALA 370 N -2.00 2.85 -0.16 3.43 0.00 -0.22 -4.77 120.51 119.64 1suf n ALA 370 Ca -0.01 -2.65 -0.05 0.00 0.00 0.00 0.00 53.44 50.74 1suf n ALA 370 Cb 0.19 -0.54 0.05 0.00 0.00 0.00 0.00 19.45 19.15 1suf n ALA 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1suf h ALA 371 N 0.85 0.64 -0.19 0.00 0.00 -1.10 0.11 119.26 119.57 1suf h ALA 371 Ca -0.10 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1suf h ALA 371 Cb 1.43 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1suf h ALA 371 CO 0.04 -0.09 0.02 0.28 0.00 0.00 0.00 179.25 179.50 1suf h VAL 372 N 0.50 1.24 -0.76 0.00 2.07 -1.88 -0.50 116.25 116.91 1suf h VAL 372 Ca 0.22 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 1suf h VAL 372 Cb 0.12 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 1suf h VAL 372 CO -0.15 0.24 0.39 -0.33 0.02 0.00 0.00 177.57 177.74 1suf h GLU 373 N 0.10 1.08 -0.66 1.57 5.08 -1.89 -0.71 114.58 119.16 1suf h GLU 373 Ca 0.06 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.19 1suf h GLU 373 Cb 0.35 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 1suf h GLU 373 CO 0.01 0.82 0.10 -0.91 -1.00 0.00 0.00 179.01 178.03 1suf h ASN 374 N 1.06 1.04 -0.57 1.42 2.35 -0.59 -1.66 115.58 118.63 1suf h ASN 374 Ca 0.26 -0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1suf h ASN 374 Cb 0.08 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.15 1suf h ASN 374 CO -0.04 1.04 0.30 0.00 -1.65 0.00 0.00 177.43 177.08 1suf h ALA 375 N 1.08 0.73 -0.71 -0.83 0.00 -0.83 -1.74 119.26 116.96 1suf h ALA 375 Ca 0.20 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1suf h ALA 375 Cb 0.45 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1suf h ALA 375 CO 0.01 0.26 0.43 0.87 0.00 0.00 0.00 179.25 180.82 1suf h LYS 376 N 0.77 0.80 -0.43 0.00 1.57 -0.78 0.18 116.57 118.67 1suf h LYS 376 Ca 0.20 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1suf h LYS 376 Cb 0.06 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 1suf h LYS 376 CO -0.03 0.53 0.28 0.37 -0.57 0.00 0.00 179.45 180.03 1suf h GLN 377 N 0.82 0.57 -0.32 3.15 4.15 -1.01 0.05 115.11 122.52 1suf h GLN 377 Ca 0.30 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.66 1suf h GLN 377 Cb 0.08 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1suf h GLN 377 CO -0.13 0.38 0.15 0.82 -1.93 0.00 0.00 178.83 178.11 1suf h ILE 378 N 0.58 1.17 0.00 2.39 2.04 -0.84 -2.71 117.51 120.14 1suf h ILE 378 Ca 0.16 -0.49 -0.10 0.00 1.00 0.00 0.00 64.86 65.43 1suf h ILE 378 Cb -0.06 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1suf h ILE 378 CO -0.03 0.17 -0.49 -0.07 0.00 0.00 0.00 178.15 177.73 1suf h LEU 379 N 0.38 0.00 -1.29 1.44 3.38 -0.45 -2.34 115.31 116.43 1suf h LEU 379 Ca 0.11 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1suf h LEU 379 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1suf h LEU 379 CO -0.01 0.49 -0.09 0.03 0.09 0.00 0.00 178.44 178.95 1suf h ARG 380 N 0.00 0.37 -0.93 1.13 3.08 -0.80 -0.79 114.38 116.45 1suf h ARG 380 Ca -0.00 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 59.98 1suf h ARG 380 Cb 0.91 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.86 1suf h ARG 380 CO 0.06 0.48 0.61 -0.07 -1.07 0.00 0.00 179.97 179.98 1suf h LEU 381 N 0.36 1.05 -0.29 3.04 3.38 -1.11 -1.17 115.31 120.56 1suf h LEU 381 Ca 0.07 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1suf h LEU 381 Cb 0.38 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1suf h LEU 381 CO 0.02 0.74 0.09 0.00 0.09 0.00 0.00 178.44 179.39 1suf h ALA 382 N 1.36 0.38 -0.54 1.53 0.00 -1.12 -1.85 119.26 119.02 1suf h ALA 382 Ca 0.35 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1suf h ALA 382 Cb -0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1suf h ALA 382 CO -0.09 0.02 0.31 0.82 0.00 0.00 0.00 179.25 180.30 1suf h ILE 383 N 0.31 1.17 -0.84 0.00 2.04 -0.96 -0.43 117.51 118.80 1suf h ILE 383 Ca 0.09 -0.42 0.07 0.00 1.00 0.00 0.00 64.86 65.60 1suf h ILE 383 Cb 0.24 0.47 -0.06 0.00 -0.74 0.00 0.00 36.82 36.74 1suf h ILE 383 CO -0.00 0.18 0.55 0.44 0.00 0.00 0.00 178.15 179.32 1suf h ASP 384 N 0.73 0.80 -0.29 1.72 3.45 -0.99 -1.98 116.42 119.85 1suf h ASP 384 Ca 0.19 0.01 -0.14 0.00 0.43 0.00 0.00 57.03 57.52 1suf h ASP 384 Cb 0.02 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 38.63 1suf h ASP 384 CO -0.03 0.51 -0.38 0.74 -1.57 0.00 0.00 179.24 178.50 1suf h THR 385 N 0.90 1.29 -0.66 0.35 2.02 -0.67 -2.59 112.91 113.56 1suf h THR 385 Ca 0.37 -1.56 0.11 0.00 0.77 0.00 0.00 66.41 66.10 1suf h THR 385 Cb 0.27 1.60 -0.08 0.00 -1.74 0.00 0.00 68.15 68.20 1suf h THR 385 CO -0.14 0.51 0.24 0.15 0.37 0.00 0.00 175.52 176.65 1suf h PHE 386 N 0.53 0.41 -0.25 3.16 3.57 -0.62 -1.83 116.94 121.92 1suf h PHE 386 Ca 0.04 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 1suf h PHE 386 Cb 0.97 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 1suf h PHE 386 CO 0.07 0.07 -0.02 0.87 -2.23 0.00 0.00 178.31 177.07 1suf h LYS 387 N 0.40 0.37 0.00 1.11 1.57 -1.08 -1.94 116.57 117.00 1suf h LYS 387 Ca 0.35 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 59.01 1suf h LYS 387 Cb 0.48 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1suf h LYS 387 CO -0.36 0.42 -0.25 0.00 -0.57 0.00 0.00 179.45 178.69 1suf h ARG 388 N 0.36 0.00 -0.63 3.15 3.08 -0.96 -2.75 114.38 116.63 1suf h ARG 388 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1suf h ARG 388 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1suf h ARG 388 CO 0.01 0.25 0.00 2.89 -1.07 0.00 0.00 179.97 182.05 1suf n ARG 389 N -3.65 4.12 -1.76 0.04 1.85 -0.74 -4.93 116.66 111.59 1suf n ARG 389 Ca -0.01 -2.74 -0.42 0.00 -1.00 0.00 0.00 57.85 53.69 1suf n ARG 389 Cb 0.38 -2.06 -0.02 0.00 -1.05 0.00 0.00 32.46 29.70 1suf n ARG 389 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 1suf s LYS 390 N -2.29 4.12 0.00 2.89 -2.85 -1.04 -1.64 119.74 118.92 1suf s LYS 390 Ca 0.48 2.59 0.00 0.00 -1.00 0.00 0.00 55.97 58.04 1suf s LYS 390 Cb 0.34 -3.05 0.00 0.00 -2.06 0.00 0.00 37.83 33.07 1suf s LYS 390 CO 0.17 -0.68 0.00 0.41 0.10 0.00 0.00 175.35 175.35 1suf n GLY 391 N 2.98 0.92 3.76 0.59 0.00 -1.26 -5.03 105.19 107.13 1suf n GLY 391 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1suf n GLY 391 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1suf s LYS 392 N -0.10 4.28 0.44 1.61 1.02 -0.66 -5.04 119.74 121.30 1suf s LYS 392 Ca 0.00 0.60 -0.25 0.00 0.02 0.00 0.00 55.97 56.34 1suf s LYS 392 Cb 0.00 -3.37 -0.08 0.00 -0.52 0.00 0.00 37.83 33.87 1suf s LYS 392 CO 0.00 0.32 1.29 -1.25 -0.92 0.00 0.00 175.35 174.79 1suf s PRO 393 N 0.03 3.76 0.27 -1.68 0.04 -1.26 -5.03 135.00 131.14 1suf s PRO 393 Ca 0.29 2.11 0.06 0.00 0.04 0.00 0.00 61.00 63.49 1suf s PRO 393 Cb -0.17 -2.59 -0.06 0.00 0.04 0.00 0.00 34.50 31.72 1suf s PRO 393 CO 0.14 -0.65 -0.05 0.14 0.04 0.00 0.00 177.00 176.63 1suf s VAL 394 N -1.32 1.56 -0.47 -0.36 -7.23 -1.26 -4.94 120.40 106.37 1suf s VAL 394 Ca 0.61 -2.11 0.03 0.00 -1.81 0.00 0.00 61.98 58.70 1suf s VAL 394 Cb -0.37 -2.44 0.14 0.00 0.56 0.00 0.00 36.38 34.27 1suf s VAL 394 CO 0.46 -0.30 0.28 -0.70 -0.31 0.00 0.00 175.10 174.53 1suf s GLU 395 N -3.75 1.38 -0.40 4.82 2.12 0.11 -5.05 118.70 117.94 1suf s GLU 395 Ca 0.29 -2.17 -0.17 0.00 0.36 0.00 0.00 54.97 53.28 1suf s GLU 395 Cb 0.04 -2.35 0.01 0.00 0.26 0.00 0.00 34.13 32.09 1suf s GLU 395 CO 0.12 -1.20 0.45 0.42 -0.54 0.00 0.00 175.26 174.50 1suf s ILE 396 N 0.11 5.08 0.30 -3.70 1.01 -1.26 -4.39 121.20 118.34 1suf s ILE 396 Ca 0.20 -0.17 -0.30 0.00 0.00 0.00 0.00 60.65 60.38 1suf s ILE 396 Cb -0.19 -4.00 -0.12 0.00 0.01 0.00 0.00 42.46 38.16 1suf s ILE 396 CO -0.04 -0.35 1.47 -2.65 0.00 0.00 0.00 174.94 173.36 1suf n PRO 397 N 5.62 2.39 -2.02 2.79 -0.02 -1.26 -4.84 135.00 137.66 1suf n PRO 397 Ca -0.07 0.85 -0.41 0.00 -2.02 0.00 0.00 63.50 61.85 1suf n PRO 397 Cb 0.48 -2.55 -0.00 0.00 -0.02 0.00 0.00 33.50 31.41 1suf n PRO 397 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1suf n ASN 398 N 1.71 7.32 -3.81 2.55 5.15 -1.26 -2.97 115.26 123.94 1suf n ASN 398 Ca 0.08 -3.09 -0.24 0.00 -0.60 0.00 0.00 54.58 50.73 1suf n ASN 398 Cb 0.35 -1.41 -0.17 0.00 -0.53 0.00 0.00 39.78 38.02 1suf n ASN 398 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1suf s ILE 399 N -0.48 0.60 0.15 -1.44 1.01 -1.26 -4.97 121.20 114.80 1suf s ILE 399 Ca 0.52 -0.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.92 1suf s ILE 399 Cb 0.16 -0.72 0.06 0.00 0.01 0.00 0.00 42.46 41.97 1suf s ILE 399 CO -0.07 0.28 0.52 -1.59 0.00 0.00 0.00 174.94 174.08 1suf s LYS 400 N 1.88 1.20 0.27 2.79 -2.85 -1.26 -1.29 119.74 120.49 1suf s LYS 400 Ca 0.05 -0.57 0.11 0.00 -1.00 0.00 0.00 55.97 54.55 1suf s LYS 400 Cb -0.13 0.54 -0.05 0.00 -2.06 0.00 0.00 37.83 36.14 1suf s LYS 400 CO -0.06 -0.51 -0.17 0.95 0.10 0.00 0.00 175.35 175.66 1suf s THR 401 N -3.77 2.27 0.06 3.79 -4.23 -0.49 -4.95 115.64 108.31 1suf s THR 401 Ca 0.02 -2.33 -0.26 0.00 -1.18 0.00 0.00 61.69 57.94 1suf s THR 401 Cb 0.00 -2.31 -0.06 0.00 1.34 0.00 0.00 72.50 71.48 1suf s THR 401 CO -0.12 -0.40 0.80 -0.75 -0.54 0.00 0.00 174.62 173.60 1suf s LYS 402 N -3.56 4.53 -0.17 3.99 2.20 -1.26 -1.48 119.74 123.99 1suf s LYS 402 Ca 0.29 1.13 -0.00 0.00 -0.36 0.00 0.00 55.97 57.03 1suf s LYS 402 Cb -0.03 -3.36 0.04 0.00 -1.51 0.00 0.00 37.83 32.97 1suf s LYS 402 CO 0.14 0.29 -0.06 0.08 -0.36 0.00 0.00 175.35 175.43 1suf s VAL 403 N -0.11 1.18 -0.14 4.02 1.01 -0.06 -3.66 120.40 122.64 1suf s VAL 403 Ca 0.40 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.57 1suf s VAL 403 Cb -0.21 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.79 1suf s VAL 403 CO 0.24 0.16 0.34 -0.69 0.00 0.00 0.00 175.10 175.15 1suf s VAL 404 N 1.60 5.27 0.00 2.92 1.01 0.21 -0.18 120.40 131.23 1suf s VAL 404 Ca 0.01 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.65 1suf s VAL 404 Cb -0.15 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1suf s VAL 404 CO -0.08 0.39 0.00 0.00 0.00 0.00 0.00 175.10 175.41 1suf n ALA 405 N 3.46 0.00 -0.86 5.51 0.00 -0.03 -4.67 120.51 123.92 1suf n ALA 405 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1suf n ALA 405 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1suf n ALA 405 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1suf n GLY 406 N 0.00 0.66 2.78 0.00 0.00 -1.24 -1.19 105.19 106.19 1suf n GLY 406 Ca 0.00 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 1suf n GLY 406 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1suf n PHE 407 N -2.78 2.88 -0.69 1.61 3.01 -0.55 -3.18 117.46 117.76 1suf n PHE 407 Ca 0.00 -2.81 -0.32 0.00 1.01 0.00 0.00 57.45 55.34 1suf n PHE 407 Cb 0.09 -1.97 0.16 0.00 -0.01 0.00 0.00 39.48 37.75 1suf n PHE 407 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1suf n SER 408 N 3.61 -1.27 -0.08 4.37 3.41 -1.26 -4.23 113.62 118.17 1suf n SER 408 Ca 0.45 0.23 -0.02 0.00 -0.26 0.00 0.00 58.87 59.27 1suf n SER 408 Cb 0.34 -1.27 0.24 0.00 -0.26 0.00 0.00 64.21 63.26 1suf n SER 408 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1suf h THR 409 N -1.91 1.21 -0.70 6.66 2.02 -1.92 -0.21 112.91 118.05 1suf h THR 409 Ca -0.47 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 65.95 1suf h THR 409 Cb 1.30 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 1suf h THR 409 CO 0.39 0.28 0.45 -0.33 0.37 0.00 0.00 175.52 176.68 1suf h GLU 410 N 0.68 0.86 -0.62 6.66 3.07 -1.91 -0.84 114.58 122.48 1suf h GLU 410 Ca 0.15 -0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 58.88 1suf h GLU 410 Cb 0.29 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 27.99 1suf h GLU 410 CO 0.00 0.57 0.08 0.00 -1.40 0.00 0.00 179.01 178.26 1suf h ALA 411 N 1.29 0.82 -0.21 3.43 0.00 -1.55 0.39 119.26 123.43 1suf h ALA 411 Ca 0.28 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1suf h ALA 411 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1suf h ALA 411 CO -0.10 0.60 0.08 0.82 0.00 0.00 0.00 179.25 180.66 1suf h ILE 412 N 0.94 1.16 -0.62 0.00 2.04 -0.76 -0.55 117.51 119.72 1suf h ILE 412 Ca 0.18 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 1suf h ILE 412 Cb 0.46 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 1suf h ILE 412 CO 0.02 0.16 0.37 0.40 0.00 0.00 0.00 178.15 179.09 1suf h ILE 413 N 0.19 1.18 -0.74 -0.67 2.04 -1.00 -0.79 117.51 117.72 1suf h ILE 413 Ca 0.07 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 1suf h ILE 413 Cb 0.17 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.57 1suf h ILE 413 CO -0.01 0.19 0.46 -1.13 0.00 0.00 0.00 178.15 177.67 1suf h ASN 414 N 0.83 0.87 -0.48 1.72 -1.24 -0.73 0.29 115.58 116.85 1suf h ASN 414 Ca 0.22 -0.05 -0.00 0.00 0.71 0.00 0.00 56.30 57.18 1suf h ASN 414 Cb -0.01 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 38.80 1suf h ASN 414 CO -0.04 0.66 0.29 0.00 -1.29 0.00 0.00 177.43 177.05 1suf h ALA 415 N 1.25 0.61 0.00 1.57 0.00 -0.76 -2.55 119.26 119.37 1suf h ALA 415 Ca 0.27 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1suf h ALA 415 Cb -0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1suf h ALA 415 CO -0.05 0.11 -0.33 -0.07 0.00 0.00 0.00 179.25 178.90 1suf h LEU 416 N 0.64 0.00 -2.10 0.00 3.38 -0.76 -2.60 115.31 113.87 1suf h LEU 416 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1suf h LEU 416 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1suf h LEU 416 CO -0.03 0.33 0.00 0.77 0.09 0.00 0.00 178.44 179.60 1suf h SER 417 N 0.00 0.00 0.70 -0.43 4.64 -0.51 -0.32 113.55 117.63 1suf h SER 417 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1suf h SER 417 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1suf h SER 417 CO 0.04 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.11 1suf h LYS 418 N 0.00 0.00 0.00 4.77 1.79 -1.43 -2.23 116.57 119.47 1suf h LYS 418 Ca 0.00 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.29 1suf h LYS 418 Cb 0.21 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.83 1suf h LYS 418 CO 0.00 0.00 -2.09 1.28 -1.08 0.00 0.00 179.45 177.56 1suf n LEU 419 N -3.02 0.11 -3.29 2.94 4.77 -0.17 -4.83 117.00 113.52 1suf n LEU 419 Ca -0.00 0.05 -0.08 0.00 -0.03 0.00 0.00 56.01 55.95 1suf n LEU 419 Cb 0.23 0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 41.50 1suf n LEU 419 CO 0.24 0.23 -0.05 0.21 -1.33 0.00 0.00 177.39 176.70 1suf s ASN 420 N -5.11 0.07 0.20 -1.43 3.84 -0.97 -5.00 114.94 106.54 1suf s ASN 420 Ca -0.08 -0.62 -0.11 0.00 0.21 0.00 0.00 52.86 52.27 1suf s ASN 420 Cb 0.10 1.21 0.14 0.00 -0.55 0.00 0.00 41.25 42.15 1suf s ASN 420 CO 0.86 -0.31 1.84 0.00 -2.79 0.00 0.00 177.10 176.71 1suf h ALA 421 N 7.77 0.92 -0.21 1.71 0.00 -1.70 -3.02 119.26 124.73 1suf h ALA 421 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1suf h ALA 421 Cb 1.12 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1suf h ALA 421 CO 0.22 0.39 0.00 0.09 0.00 0.00 0.00 179.25 179.95 1suf n ASN 422 N -4.52 3.05 -3.09 0.00 3.02 -1.26 -4.50 115.26 107.96 1suf n ASN 422 Ca 0.06 -1.92 -0.19 0.00 -0.03 0.00 0.00 54.58 52.50 1suf n ASN 422 Cb 0.06 -0.13 -0.03 0.00 -0.61 0.00 0.00 39.78 39.07 1suf n ASN 422 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1suf n ASP 423 N 1.26 -0.35 0.05 6.41 -0.08 -1.17 -5.02 116.55 117.64 1suf n ASP 423 Ca 0.15 -2.91 0.04 0.00 -1.51 0.00 0.00 54.79 50.56 1suf n ASP 423 Cb 0.55 -0.09 0.42 0.00 2.34 0.00 0.00 41.12 44.34 1suf n ASP 423 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1suf h PRO 424 N 3.76 0.43 0.00 -0.67 0.11 -1.76 -1.38 132.00 132.49 1suf h PRO 424 Ca 0.03 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1suf h PRO 424 Cb 0.93 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1suf h PRO 424 CO 0.43 0.35 0.00 -0.07 -0.21 0.00 0.00 178.00 178.50 1suf h LEU 425 N 0.43 0.00 -0.45 2.35 3.38 -1.92 -3.33 115.31 115.78 1suf h LEU 425 Ca 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1suf h LEU 425 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1suf h LEU 425 CO -0.01 0.00 0.25 0.50 0.09 0.00 0.00 178.44 179.27 1suf h LYS 426 N 0.00 0.63 -0.82 1.13 3.64 -1.63 -1.58 116.57 117.95 1suf h LYS 426 Ca 0.00 -0.07 0.07 0.00 -1.27 0.00 0.00 60.65 59.37 1suf h LYS 426 Cb 0.63 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.27 1suf h LYS 426 CO 0.00 0.50 0.54 -1.35 -2.27 0.00 0.00 179.45 176.87 1suf h PRO 427 N 0.60 0.86 -0.10 1.90 0.11 -1.74 0.52 132.00 134.15 1suf h PRO 427 Ca 0.16 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 1suf h PRO 427 Cb 0.05 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 30.96 1suf h PRO 427 CO -0.03 0.57 0.03 1.25 -0.21 0.00 0.00 178.00 179.62 1suf h LEU 428 N 0.89 0.15 -0.83 2.35 5.85 -1.58 -2.60 115.31 119.54 1suf h LEU 428 Ca 0.36 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1suf h LEU 428 Cb 0.25 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 1suf h LEU 428 CO -0.13 0.31 0.48 0.40 -0.34 0.00 0.00 178.44 179.16 1suf h ILE 429 N -0.02 1.24 -0.84 4.05 2.04 -0.56 -1.17 117.51 122.24 1suf h ILE 429 Ca 0.03 -0.56 0.16 0.00 1.00 0.00 0.00 64.86 65.49 1suf h ILE 429 Cb 0.21 0.10 -0.10 0.00 -0.74 0.00 0.00 36.82 36.29 1suf h ILE 429 CO -0.00 0.26 0.41 0.44 0.00 0.00 0.00 178.15 179.26 1suf h ASP 430 N 1.15 0.47 1.63 1.72 3.32 0.06 -0.44 116.42 124.32 1suf h ASP 430 Ca 0.30 0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.38 1suf h ASP 430 Cb -0.01 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1suf h ASP 430 CO -0.05 0.17 -0.38 0.78 -1.72 0.00 0.00 179.24 178.04 1suf h ASN 431 N 0.57 0.00 -0.43 6.45 2.35 -1.01 0.04 115.58 123.54 1suf h ASN 431 Ca 0.47 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.16 1suf h ASN 431 Cb 0.71 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.07 1suf h ASN 431 CO -0.39 0.30 0.04 0.58 -1.65 0.00 0.00 177.43 176.31 1suf h VAL 432 N 0.00 1.25 -0.33 2.81 2.07 -0.48 -0.06 116.25 121.52 1suf h VAL 432 Ca -0.01 -0.95 -0.06 0.00 0.82 0.00 0.00 66.70 66.50 1suf h VAL 432 Cb 1.24 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 1suf h VAL 432 CO 0.04 0.33 -0.03 0.58 0.02 0.00 0.00 177.57 178.51 1suf h VAL 433 N 0.58 1.27 -0.00 2.57 2.07 -0.93 -2.81 116.25 118.99 1suf h VAL 433 Ca 0.13 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1suf h VAL 433 Cb 0.42 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1suf h VAL 433 CO 0.01 0.33 -0.04 -0.46 0.02 0.00 0.00 177.57 177.44 1suf n ASN 434 N -4.50 0.23 0.00 0.57 0.23 -0.02 -4.82 115.26 106.95 1suf n ASN 434 Ca -0.02 -0.57 0.00 0.00 -0.53 0.00 0.00 54.58 53.46 1suf n ASN 434 Cb 0.29 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 37.86 1suf n ASN 434 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1suf n GLY 435 N 1.21 0.64 0.23 4.83 0.00 -0.80 -4.92 105.19 106.38 1suf n GLY 435 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 1suf n GLY 435 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1suf h ASN 436 N 0.00 0.00 -3.42 1.61 -0.26 -1.60 -3.36 115.58 108.55 1suf h ASN 436 Ca 0.00 0.00 -0.67 0.00 -0.56 0.00 0.00 56.30 55.07 1suf h ASN 436 Cb 0.00 0.00 -0.32 0.00 -1.06 0.00 0.00 38.32 36.94 1suf h ASN 436 CO 0.00 0.18 -0.77 -0.63 -1.06 0.00 0.00 177.43 175.15 1suf s ILE 437 N -4.53 2.71 0.10 2.81 -1.09 -0.12 -2.22 121.20 118.86 1suf s ILE 437 Ca -0.04 -0.97 -0.14 0.00 -2.23 0.00 0.00 60.65 57.27 1suf s ILE 437 Cb 0.15 -2.32 -0.13 0.00 -1.58 0.00 0.00 42.46 38.58 1suf s ILE 437 CO 0.67 0.29 1.34 -0.09 -1.23 0.00 0.00 174.94 175.93 1suf h ARG 438 N 7.99 0.77 0.00 2.79 2.43 -1.07 -3.34 114.38 123.95 1suf h ARG 438 Ca -0.36 -0.54 0.00 0.00 -0.81 0.00 0.00 59.98 58.27 1suf h ARG 438 Cb 1.12 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1suf h ARG 438 CO 0.59 1.17 0.00 0.41 -1.51 0.00 0.00 179.97 180.62 1suf n GLY 439 N 0.52 0.54 3.22 2.80 0.00 -1.26 -4.92 105.19 106.08 1suf n GLY 439 Ca -0.06 -0.72 -0.28 0.00 0.00 0.00 0.00 46.02 44.96 1suf n GLY 439 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1suf s VAL 440 N -2.02 1.66 -0.09 1.61 1.01 -0.18 -1.01 120.40 121.38 1suf s VAL 440 Ca 0.00 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1suf s VAL 440 Cb 0.00 -1.39 0.02 0.00 0.00 0.00 0.00 36.38 35.01 1suf s VAL 440 CO 0.00 0.47 -0.13 0.00 0.00 0.00 0.00 175.10 175.44 1suf s LEU 442 N 0.98 4.19 -0.06 0.00 2.96 -0.47 -1.24 118.68 125.05 1suf s LEU 442 Ca -0.08 0.23 -0.20 0.00 -0.22 0.00 0.00 54.13 53.86 1suf s LEU 442 Cb -0.15 -2.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.90 1suf s LEU 442 CO -0.01 -0.37 0.56 -0.36 -1.32 0.00 0.00 176.35 174.85 1suf s PHE 443 N 2.33 3.60 0.13 5.38 0.08 -0.18 -0.41 117.98 128.92 1suf s PHE 443 Ca 0.19 1.08 -0.04 0.00 0.12 0.00 0.00 56.93 58.28 1suf s PHE 443 Cb -0.16 -2.60 -0.03 0.00 -0.57 0.00 0.00 43.02 39.67 1suf s PHE 443 CO 0.11 0.26 0.13 0.00 -0.10 0.00 0.00 175.22 175.62 1suf s ALA 444 N 0.22 0.49 0.00 5.36 0.00 -0.51 -1.45 121.76 125.87 1suf s ALA 444 Ca 0.30 -1.21 0.00 0.00 0.00 0.00 0.00 51.96 51.05 1suf s ALA 444 Cb -0.17 0.79 0.00 0.00 0.00 0.00 0.00 23.12 23.75 1suf s ALA 444 CO 0.15 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 175.78 1suf n GLY 445 N -0.11 -2.10 3.95 0.00 0.00 -1.26 -4.01 105.19 101.65 1suf n GLY 445 Ca -0.07 -1.56 -0.27 0.00 0.00 0.00 0.00 46.02 44.11 1suf n GLY 445 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1suf s ASN 447 N -4.75 5.75 -0.05 0.00 0.01 -1.23 -3.87 114.94 110.80 1suf s ASN 447 Ca 0.68 0.30 -0.02 0.00 -0.71 0.00 0.00 52.86 53.11 1suf s ASN 447 Cb -0.06 -1.48 0.03 0.00 0.41 0.00 0.00 41.25 40.15 1suf s ASN 447 CO 0.49 -0.78 0.10 0.21 -1.51 0.00 0.00 177.10 175.61 1suf s ASN 448 N -4.25 -0.06 0.55 -1.22 3.84 -1.05 -4.41 114.94 108.34 1suf s ASN 448 Ca 0.50 0.21 0.35 0.00 0.21 0.00 0.00 52.86 54.13 1suf s ASN 448 Cb -0.10 0.12 1.93 0.00 -0.55 0.00 0.00 41.25 42.65 1suf s ASN 448 CO 0.39 -0.12 2.08 1.62 -2.79 0.00 0.00 177.10 178.28 1suf h VAL 449 N 5.89 0.00 0.00 -5.21 3.04 -1.95 -0.01 116.25 118.02 1suf h VAL 449 Ca -0.40 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.29 1suf h VAL 449 Cb 1.15 0.79 0.00 0.00 -2.01 0.00 0.00 31.29 31.22 1suf h VAL 449 CO 0.44 0.00 0.00 0.11 -1.01 0.00 0.00 177.57 177.11 1suf h LYS 450 N 0.00 0.00 -5.31 4.17 1.57 -1.98 -3.43 116.57 111.60 1suf h LYS 450 Ca 0.00 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.13 1suf h LYS 450 Cb 0.07 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.14 1suf h LYS 450 CO 0.00 0.00 -0.72 0.08 -0.57 0.00 0.00 179.45 178.24 1suf s VAL 451 N -3.55 3.45 -0.12 0.50 1.01 -0.02 -5.06 120.40 116.61 1suf s VAL 451 Ca 0.03 -0.52 -0.37 0.00 0.00 0.00 0.00 61.98 61.12 1suf s VAL 451 Cb 0.08 -2.48 -0.15 0.00 0.00 0.00 0.00 36.38 33.83 1suf s VAL 451 CO 0.56 0.51 1.68 -2.65 0.00 0.00 0.00 175.10 175.20 1suf n PRO 452 N 3.53 1.50 -1.67 2.72 -0.02 -1.26 -4.64 135.00 135.15 1suf n PRO 452 Ca -0.18 0.55 -0.48 0.00 -2.02 0.00 0.00 63.50 61.37 1suf n PRO 452 Cb 0.53 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.69 1suf n PRO 452 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1suf n GLN 453 N 4.92 2.09 -0.19 -0.52 7.27 -0.33 -1.49 117.38 129.12 1suf n GLN 453 Ca 0.23 0.76 0.00 0.00 0.07 0.00 0.00 57.00 58.06 1suf n GLN 453 Cb 0.20 -2.55 0.00 0.00 2.41 0.00 0.00 30.24 30.29 1suf n GLN 453 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1suf n ASP 454 N 4.90 0.00 -0.14 1.69 8.00 -1.26 -1.62 116.55 128.12 1suf n ASP 454 Ca 0.20 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.68 1suf n ASP 454 Cb 0.28 0.00 0.22 0.00 -0.02 0.00 0.00 41.12 41.60 1suf n ASP 454 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 1suf h GLN 455 N 2.50 0.84 0.04 -1.24 4.15 -1.61 -0.77 115.11 119.02 1suf h GLN 455 Ca 0.00 -0.13 -0.18 0.00 0.77 0.00 0.00 58.65 59.10 1suf h GLN 455 Cb 0.00 -0.15 0.02 0.00 0.21 0.00 0.00 27.48 27.56 1suf h GLN 455 CO 0.00 0.70 -0.75 -0.91 -1.93 0.00 0.00 178.83 175.94 1suf h ASN 456 N 0.82 0.59 -0.36 -0.69 2.35 -1.89 -2.03 115.58 114.37 1suf h ASN 456 Ca 0.19 -0.80 0.06 0.00 -0.55 0.00 0.00 56.30 55.20 1suf h ASN 456 Cb 0.18 -0.18 -0.05 0.00 0.05 0.00 0.00 38.32 38.31 1suf h ASN 456 CO -0.02 1.32 0.04 -0.26 -1.65 0.00 0.00 177.43 176.86 1suf h PHE 457 N -0.08 0.05 -0.10 1.19 -1.00 -1.79 -1.42 116.94 113.79 1suf h PHE 457 Ca -0.10 0.02 -0.22 0.00 2.81 0.00 0.00 57.97 60.48 1suf h PHE 457 Cb 1.47 0.03 0.01 0.00 3.61 0.00 0.00 35.95 41.07 1suf h PHE 457 CO 0.15 -0.02 -0.82 1.79 -1.61 0.00 0.00 178.31 177.79 1suf h THR 458 N 0.15 1.31 -0.23 -1.55 1.35 -1.21 -0.09 112.91 112.63 1suf h THR 458 Ca 0.17 -2.10 -0.02 0.00 -0.55 0.00 0.00 66.41 63.92 1suf h THR 458 Cb 0.22 2.11 -0.01 0.00 -1.73 0.00 0.00 68.15 68.74 1suf h THR 458 CO -0.25 0.65 0.09 0.74 -0.25 0.00 0.00 175.52 176.49 1suf h THR 459 N 0.43 1.18 -0.19 6.82 2.02 -1.25 -0.59 112.91 121.32 1suf h THR 459 Ca -0.06 -0.55 -0.06 0.00 0.77 0.00 0.00 66.41 66.51 1suf h THR 459 Cb 1.44 1.10 -0.00 0.00 -1.74 0.00 0.00 68.15 68.95 1suf h THR 459 CO 0.16 0.18 -0.11 0.40 0.37 0.00 0.00 175.52 176.51 1suf h ILE 460 N 0.22 1.32 -0.79 3.11 2.04 -1.26 -2.94 117.51 119.20 1suf h ILE 460 Ca 0.08 -1.20 0.03 0.00 1.00 0.00 0.00 64.86 64.76 1suf h ILE 460 Cb 0.20 1.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.93 1suf h ILE 460 CO -0.00 0.36 0.51 0.00 0.00 0.00 0.00 178.15 179.02 1suf h ALA 461 N 0.68 1.03 -0.54 1.87 0.00 -0.95 -1.84 119.26 119.50 1suf h ALA 461 Ca 0.04 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1suf h ALA 461 Cb 0.61 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1suf h ALA 461 CO 0.03 0.35 0.33 0.00 0.00 0.00 0.00 179.25 179.96 1suf h ARG 462 N 1.01 0.63 -0.50 0.00 3.08 -1.05 -0.10 114.38 117.45 1suf h ARG 462 Ca 0.31 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.24 1suf h ARG 462 Cb -0.03 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1suf h ARG 462 CO -0.10 0.42 0.00 -0.22 -1.07 0.00 0.00 179.97 179.00 1suf h LYS 463 N 0.65 0.88 -0.54 0.04 3.64 -1.27 -2.31 116.57 117.66 1suf h LYS 463 Ca 0.22 -0.28 -0.09 0.00 -1.27 0.00 0.00 60.65 59.23 1suf h LYS 463 Cb 0.02 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1suf h LYS 463 CO -0.09 0.91 -0.00 -0.07 -2.27 0.00 0.00 179.45 177.92 1suf h LEU 464 N 0.74 0.94 -0.73 5.20 3.38 -1.11 -2.68 115.31 121.04 1suf h LEU 464 Ca 0.14 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 1suf h LEU 464 Cb 0.51 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1suf h LEU 464 CO 0.02 1.02 0.21 -0.07 0.09 0.00 0.00 178.44 179.71 1suf h LEU 465 N 0.83 1.08 -2.05 1.67 3.38 -0.95 -1.38 115.31 117.89 1suf h LEU 465 Ca 0.15 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1suf h LEU 465 Cb 0.54 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1suf h LEU 465 CO 0.03 1.02 -0.09 0.11 0.09 0.00 0.00 178.44 179.60 1suf h LYS 466 N 1.09 0.00 -0.66 1.13 1.79 -1.31 -1.10 116.57 117.51 1suf h LYS 466 Ca 0.23 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 1suf h LYS 466 Cb 0.34 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 1suf h LYS 466 CO -0.00 0.09 0.00 1.04 -1.08 0.00 0.00 179.45 179.50 1suf n GLN 467 N -3.83 3.05 -2.15 3.15 1.13 -0.62 -4.05 117.38 114.06 1suf n GLN 467 Ca -0.02 -1.89 -0.12 0.00 -1.94 0.00 0.00 57.00 53.03 1suf n GLN 467 Cb 0.19 -1.80 -0.01 0.00 0.11 0.00 0.00 30.24 28.73 1suf n GLN 467 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1suf n ASN 468 N 0.53 -3.80 -4.72 1.08 3.02 -0.69 -4.50 115.26 106.18 1suf n ASN 468 Ca 0.17 0.01 -0.41 0.00 -0.03 0.00 0.00 54.58 54.33 1suf n ASN 468 Cb 0.71 -2.96 -0.04 0.00 -0.61 0.00 0.00 39.78 36.88 1suf n ASN 468 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1suf s VAL 469 N -2.57 4.84 -0.20 2.41 1.01 -0.62 -0.69 120.40 124.58 1suf s VAL 469 Ca 0.00 1.78 -0.29 0.00 0.00 0.00 0.00 61.98 63.47 1suf s VAL 469 Cb 0.00 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.17 1suf s VAL 469 CO 0.00 0.26 1.44 -0.22 0.00 0.00 0.00 175.10 176.58 1suf s LEU 470 N 0.56 4.03 -0.18 3.92 2.96 -0.18 -4.46 118.68 125.34 1suf s LEU 470 Ca 0.44 1.62 -0.04 0.00 -0.22 0.00 0.00 54.13 55.93 1suf s LEU 470 Cb -0.20 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.93 1suf s LEU 470 CO 0.24 -1.03 -0.02 -0.69 -1.32 0.00 0.00 176.35 173.54 1suf s VAL 471 N 4.34 3.92 0.26 1.68 1.01 -1.26 -1.22 120.40 129.13 1suf s VAL 471 Ca 0.63 -0.33 0.11 0.00 0.00 0.00 0.00 61.98 62.39 1suf s VAL 471 Cb -0.23 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.35 1suf s VAL 471 CO 0.24 0.46 -0.18 0.68 0.00 0.00 0.00 175.10 176.30 1suf s VAL 472 N 0.70 2.61 0.01 2.92 -7.23 -0.37 -1.62 120.40 117.42 1suf s VAL 472 Ca -0.01 -2.24 -0.19 0.00 -1.81 0.00 0.00 61.98 57.73 1suf s VAL 472 Cb -0.14 -2.35 0.04 0.00 0.56 0.00 0.00 36.38 34.49 1suf s VAL 472 CO 0.02 -0.33 0.42 0.00 -0.31 0.00 0.00 175.10 174.90 1suf s ALA 473 N -2.29 -1.05 0.20 1.32 0.00 -0.44 -1.01 121.76 118.49 1suf s ALA 473 Ca 0.28 0.47 -0.01 0.00 0.00 0.00 0.00 51.96 52.70 1suf s ALA 473 Cb -0.06 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 1suf s ALA 473 CO 0.15 -0.38 0.13 0.95 0.00 0.00 0.00 175.76 176.60 1suf s THR 474 N -1.92 0.00 0.00 0.00 -4.23 -0.53 -0.70 115.64 108.26 1suf s THR 474 Ca -0.09 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.43 1suf s THR 474 Cb -0.02 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.34 1suf s THR 474 CO 0.02 -0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1suf n GLY 475 N -0.26 2.11 0.00 3.99 0.00 0.25 -1.26 105.19 110.03 1suf n GLY 475 Ca 0.02 -0.46 0.14 0.00 0.00 0.00 0.00 46.02 45.72 1suf n GLY 475 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1suf h GLY 477 N 5.00 0.32 0.91 0.00 0.00 -0.32 -0.00 103.07 108.98 1suf h GLY 477 Ca 0.00 -0.29 0.04 0.00 0.00 0.00 0.00 47.33 47.08 1suf h GLY 477 CO 0.00 0.26 0.64 0.00 0.00 0.00 0.00 176.54 177.44 1suf h ALA 478 N 0.67 1.36 -0.32 3.60 0.00 -0.85 -1.74 119.26 121.98 1suf h ALA 478 Ca 0.03 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1suf h ALA 478 Cb 0.53 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1suf h ALA 478 CO 0.02 0.54 0.20 0.78 0.00 0.00 0.00 179.25 180.79 1suf h GLY 479 N 1.24 0.46 0.93 0.00 0.00 -0.95 0.14 103.07 104.88 1suf h GLY 479 Ca 0.39 -0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.55 1suf h GLY 479 CO -0.12 0.18 0.13 0.00 0.00 0.00 0.00 176.54 176.73 1suf h ALA 480 N 1.09 0.29 -0.45 3.60 0.00 -0.74 -1.81 119.26 121.24 1suf h ALA 480 Ca 0.11 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 1suf h ALA 480 Cb -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1suf h ALA 480 CO -0.02 -0.27 -0.23 -0.07 0.00 0.00 0.00 179.25 178.66 1suf h LEU 481 N 0.27 0.95 -0.69 0.00 3.38 -1.13 -2.74 115.31 115.36 1suf h LEU 481 Ca 0.09 -0.36 -0.09 0.00 0.09 0.00 0.00 57.88 57.62 1suf h LEU 481 Cb 0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1suf h LEU 481 CO -0.05 1.13 0.04 0.00 0.09 0.00 0.00 178.44 179.64 1suf h MET 482 N 0.80 1.05 0.00 1.13 -0.00 -0.57 -0.86 114.93 116.48 1suf h MET 482 Ca 0.10 -0.31 0.00 0.00 -0.00 0.00 0.00 59.70 59.49 1suf h MET 482 Cb 0.79 -0.11 0.00 0.00 -0.00 0.00 0.00 31.60 32.28 1suf h MET 482 CO 0.07 1.00 0.00 0.54 -0.00 0.00 0.00 176.91 178.52 1suf n ARG 483 N -4.19 0.18 -0.42 -0.10 1.74 -0.70 -2.15 116.66 111.02 1suf n ARG 483 Ca 0.03 0.38 0.08 0.00 -0.77 0.00 0.00 57.85 57.58 1suf n ARG 483 Cb 0.32 -1.83 0.25 0.00 -1.02 0.00 0.00 32.46 30.19 1suf n ARG 483 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1suf n HIS 484 N -2.17 0.95 -0.38 -1.55 8.25 -0.95 -4.81 115.22 114.57 1suf n HIS 484 Ca 0.03 -0.73 0.00 0.00 -0.26 0.00 0.00 57.72 56.76 1suf n HIS 484 Cb 0.24 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1suf n HIS 484 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1suf n GLY 485 N 0.05 0.76 0.00 -1.41 0.00 -0.92 -4.95 105.19 98.73 1suf n GLY 485 Ca 0.20 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.36 1suf n GLY 485 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1suf n PHE 486 N -2.23 0.00 -0.66 1.61 3.01 -0.37 -2.20 117.46 116.62 1suf n PHE 486 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.54 1suf n PHE 486 Cb 0.00 -0.23 0.25 0.00 -0.01 0.00 0.00 39.48 39.49 1suf n PHE 486 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 1suf n MET 487 N -1.23 3.12 -3.70 -1.08 2.81 -1.26 -1.73 117.12 114.05 1suf n MET 487 Ca 0.16 -2.60 -0.38 0.00 -1.81 0.00 0.00 57.70 53.08 1suf n MET 487 Cb 0.21 -1.68 -0.12 0.00 -0.71 0.00 0.00 33.22 30.92 1suf n MET 487 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1suf s ASP 488 N -1.42 5.39 0.50 7.83 -1.08 -0.94 -0.62 116.67 126.34 1suf s ASP 488 Ca 0.38 -0.37 0.33 0.00 -0.52 0.00 0.00 52.55 52.37 1suf s ASP 488 Cb 0.27 -1.97 1.81 0.00 -1.46 0.00 0.00 42.92 41.57 1suf s ASP 488 CO 0.14 -0.12 2.02 -0.65 0.52 0.00 0.00 175.17 177.08 1suf h PRO 489 N 8.30 0.00 0.00 4.34 0.11 -1.86 -0.46 132.00 142.43 1suf h PRO 489 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1suf h PRO 489 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1suf h PRO 489 CO 0.59 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.38 1suf h ALA 490 N 1.97 1.00 -0.49 -0.75 0.00 -1.93 -2.58 119.26 116.47 1suf h ALA 490 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1suf h ALA 490 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1suf h ALA 490 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 1suf n ASN 491 N -2.54 3.49 -0.27 0.00 5.03 -0.18 -4.49 115.26 116.30 1suf n ASN 491 Ca -0.00 -1.98 -0.05 0.00 0.87 0.00 0.00 54.58 53.42 1suf n ASN 491 Cb 0.16 -0.32 0.06 0.00 -1.02 0.00 0.00 39.78 38.65 1suf n ASN 491 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 1suf h VAL 492 N 4.25 1.20 -0.72 2.41 2.07 -1.62 -1.86 116.25 121.98 1suf h VAL 492 Ca 0.00 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 1suf h VAL 492 Cb 0.95 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1suf h VAL 492 CO 0.00 0.19 0.26 0.44 0.02 0.00 0.00 177.57 178.48 1suf h ASP 493 N 1.00 1.00 -0.45 0.57 3.32 -1.83 -0.64 116.42 119.39 1suf h ASP 493 Ca 0.27 -0.16 -0.10 0.00 0.02 0.00 0.00 57.03 57.05 1suf h ASP 493 Cb -0.09 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.18 1suf h ASP 493 CO -0.06 0.91 -0.11 -0.08 -1.72 0.00 0.00 179.24 178.19 1suf h GLU 494 N 1.05 0.87 0.00 3.56 4.81 -1.80 -3.37 114.58 119.70 1suf h GLU 494 Ca 0.24 -0.33 -0.35 0.00 -0.13 0.00 0.00 59.36 58.78 1suf h GLU 494 Cb 0.24 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.51 1suf h GLU 494 CO -0.01 0.98 -2.20 1.28 -0.73 0.00 0.00 179.01 178.32 1suf n LEU 495 N -4.26 0.35 -4.90 1.64 4.77 -0.72 -4.99 117.00 108.89 1suf n LEU 495 Ca -0.00 0.11 -0.34 0.00 -0.03 0.00 0.00 56.01 55.75 1suf n LEU 495 Cb 0.38 0.35 -0.05 0.00 -2.33 0.00 0.00 43.42 41.78 1suf n LEU 495 CO 0.44 0.48 -0.15 0.00 -1.33 0.00 0.00 177.39 176.83 1suf s GLY 497 N -1.70 1.63 0.26 0.00 0.00 -0.50 -4.68 107.32 102.32 1suf s GLY 497 Ca 0.24 0.17 -0.04 0.00 0.00 0.00 0.00 44.72 45.09 1suf s GLY 497 CO 0.15 0.69 1.86 -0.55 0.00 0.00 0.00 173.10 175.25 1suf h ASP 498 N -1.94 0.97 -0.08 1.64 3.32 -1.91 0.07 116.42 118.49 1suf h ASP 498 Ca -0.50 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.44 1suf h ASP 498 Cb 1.29 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.59 1suf h ASP 498 CO 0.49 0.82 0.03 1.23 -1.72 0.00 0.00 179.24 180.08 1suf h GLY 499 N 1.12 0.13 0.99 2.75 0.00 -1.92 -1.19 103.07 104.95 1suf h GLY 499 Ca 0.26 -0.08 -0.05 0.00 0.00 0.00 0.00 47.33 47.47 1suf h GLY 499 CO -0.03 0.07 0.16 -2.00 0.00 0.00 0.00 176.54 174.74 1suf h LEU 500 N -0.04 0.80 -0.74 3.11 5.85 -1.23 -2.16 115.31 120.91 1suf h LEU 500 Ca 0.03 -0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.62 1suf h LEU 500 Cb 0.19 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 40.94 1suf h LEU 500 CO -0.00 0.80 0.40 0.50 -0.34 0.00 0.00 178.44 179.80 1suf h LYS 501 N 0.76 0.67 -0.89 1.25 3.64 -0.89 0.38 116.57 121.49 1suf h LYS 501 Ca 0.18 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1suf h LYS 501 Cb 0.29 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 1suf h LYS 501 CO -0.00 0.45 0.47 0.00 -2.27 0.00 0.00 179.45 178.10 1suf h ALA 502 N 1.41 1.16 -0.11 5.00 0.00 -0.83 -0.24 119.26 125.66 1suf h ALA 502 Ca 0.35 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 1suf h ALA 502 Cb 0.31 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1suf h ALA 502 CO -0.23 0.67 -0.18 0.28 0.00 0.00 0.00 179.25 179.78 1suf h VAL 503 N 1.25 1.38 -0.40 0.00 2.07 -0.74 -0.19 116.25 119.62 1suf h VAL 503 Ca 0.31 -1.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.38 1suf h VAL 503 Cb 0.05 2.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1suf h VAL 503 CO -0.05 0.41 0.15 -0.07 0.02 0.00 0.00 177.57 178.04 1suf h LEU 504 N -0.10 0.51 -0.11 2.57 3.38 -0.80 -1.27 115.31 119.49 1suf h LEU 504 Ca 0.01 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 1suf h LEU 504 Cb 0.75 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1suf h LEU 504 CO 0.04 0.47 -0.34 0.74 0.09 0.00 0.00 178.44 179.44 1suf h THR 505 N 0.56 1.39 -0.75 0.22 2.02 -0.96 -1.07 112.91 114.31 1suf h THR 505 Ca 0.14 -1.67 -0.00 0.00 0.77 0.00 0.00 66.41 65.65 1suf h THR 505 Cb 0.12 2.16 -0.04 0.00 -1.74 0.00 0.00 68.15 68.66 1suf h THR 505 CO -0.01 0.49 0.45 0.00 0.37 0.00 0.00 175.52 176.82 1suf h ALA 506 N 0.49 0.96 -0.07 6.16 0.00 -0.75 0.10 119.26 126.15 1suf h ALA 506 Ca -0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1suf h ALA 506 Cb 0.96 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1suf h ALA 506 CO 0.07 0.43 -0.04 0.82 0.00 0.00 0.00 179.25 180.53 1suf h ILE 507 N 1.03 1.34 -0.69 0.00 2.04 -1.26 -2.25 117.51 117.71 1suf h ILE 507 Ca 0.27 -1.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.05 1suf h ILE 507 Cb -0.04 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 1suf h ILE 507 CO -0.05 0.30 0.42 1.23 0.00 0.00 0.00 178.15 180.05 1suf h GLY 508 N -0.25 1.00 1.35 5.37 0.00 -1.08 -2.03 103.07 107.43 1suf h GLY 508 Ca 0.01 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 1suf h GLY 508 CO 0.01 0.40 0.25 0.83 0.00 0.00 0.00 176.54 178.04 1suf h GLU 509 N 0.94 0.84 0.00 4.80 5.08 -0.84 -1.08 114.58 124.33 1suf h GLU 509 Ca 0.25 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1suf h GLU 509 Cb -0.03 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.06 1suf h GLU 509 CO -0.05 0.68 0.00 0.00 -1.00 0.00 0.00 179.01 178.64 1suf h ALA 510 N 1.44 1.00 -0.63 3.43 0.00 -0.97 -2.76 119.26 120.78 1suf h ALA 510 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1suf h ALA 510 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1suf h ALA 510 CO -0.02 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.32 1suf n ASN 511 N -2.75 4.50 -1.03 0.00 4.13 -0.50 -4.90 115.26 114.71 1suf n ASN 511 Ca 0.01 -2.38 -0.06 0.00 1.68 0.00 0.00 54.58 53.83 1suf n ASN 511 Cb 0.27 -0.54 0.01 0.00 -1.54 0.00 0.00 39.78 37.98 1suf n ASN 511 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1suf n GLY 512 N 1.10 0.32 0.80 7.41 0.00 -1.04 -4.97 105.19 108.80 1suf n GLY 512 Ca 0.25 -0.53 0.08 0.00 0.00 0.00 0.00 46.02 45.82 1suf n GLY 512 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1suf n LEU 513 N -1.32 2.82 -2.79 0.99 4.77 -0.67 -4.95 117.00 115.85 1suf n LEU 513 Ca -0.04 -1.41 -0.17 0.00 -0.03 0.00 0.00 56.01 54.36 1suf n LEU 513 Cb 0.54 -0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1suf n LEU 513 CO 0.13 0.60 -0.11 0.61 -1.33 0.00 0.00 177.39 177.30 1suf n GLY 514 N 0.99 -0.50 0.00 -0.72 0.00 -1.26 -4.83 105.19 98.87 1suf n GLY 514 Ca 0.13 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1suf n GLY 514 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1suf n GLY 515 N -1.02 -0.47 3.87 -0.02 0.00 -1.26 -5.02 105.19 101.28 1suf n GLY 515 Ca -0.11 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.60 1suf n GLY 515 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1suf s PRO 516 N -2.00 3.57 0.93 1.61 0.04 -1.26 -2.90 135.00 134.98 1suf s PRO 516 Ca 0.00 0.71 -0.12 0.00 0.04 0.00 0.00 61.00 61.63 1suf s PRO 516 Cb 0.00 -2.09 0.08 0.00 0.04 0.00 0.00 34.50 32.52 1suf s PRO 516 CO 0.00 -0.57 0.70 1.28 0.04 0.00 0.00 177.00 178.46 1suf n LEU 517 N -2.73 1.24 -4.69 -3.56 4.77 -0.72 -4.79 117.00 106.51 1suf n LEU 517 Ca 0.06 0.38 -0.29 0.00 -0.03 0.00 0.00 56.01 56.12 1suf n LEU 517 Cb 0.54 -1.32 0.16 0.00 -2.33 0.00 0.00 43.42 40.47 1suf n LEU 517 CO 0.58 -3.03 0.65 -2.16 -1.33 0.00 0.00 177.39 172.10 1suf s PRO 518 N -4.00 0.85 0.41 3.23 0.04 -1.26 -4.73 135.00 129.55 1suf s PRO 518 Ca 0.61 0.73 0.08 0.00 0.04 0.00 0.00 61.00 62.46 1suf s PRO 518 Cb -0.22 -1.77 0.88 0.00 0.04 0.00 0.00 34.50 33.43 1suf s PRO 518 CO 0.63 -2.50 2.05 -1.35 0.04 0.00 0.00 177.00 175.88 1suf h PRO 519 N -1.73 0.48 -5.43 0.56 0.11 -1.78 -3.41 132.00 120.80 1suf h PRO 519 Ca -0.52 -0.04 -0.54 0.00 0.11 0.00 0.00 66.00 65.02 1suf h PRO 519 Cb 1.30 -0.11 -0.30 0.00 0.11 0.00 0.00 31.00 32.01 1suf h PRO 519 CO 0.55 0.34 -0.83 0.08 -0.21 0.00 0.00 178.00 177.93 1suf s VAL 520 N -5.40 1.32 -0.31 3.15 1.01 -0.71 -4.52 120.40 114.95 1suf s VAL 520 Ca -0.08 -0.69 -0.14 0.00 0.00 0.00 0.00 61.98 61.07 1suf s VAL 520 Cb 0.17 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1suf s VAL 520 CO 0.73 0.38 0.31 -0.76 0.00 0.00 0.00 175.10 175.75 1suf s LEU 521 N -0.21 4.24 -0.45 3.92 1.43 -0.64 -4.66 118.68 122.31 1suf s LEU 521 Ca 0.02 -0.06 -0.29 0.00 -1.03 0.00 0.00 54.13 52.78 1suf s LEU 521 Cb -0.08 -2.28 0.02 0.00 0.03 0.00 0.00 46.19 43.88 1suf s LEU 521 CO 0.00 -0.21 1.23 -2.28 0.23 0.00 0.00 176.35 175.33 1suf s HIS 522 N 1.93 2.67 -2.69 0.29 5.65 -1.26 -1.33 115.29 120.56 1suf s HIS 522 Ca 0.11 0.71 0.24 0.00 0.25 0.00 0.00 55.06 56.37 1suf s HIS 522 Cb -0.16 -4.38 0.40 0.00 -1.18 0.00 0.00 32.58 27.26 1suf s HIS 522 CO 0.11 -1.52 1.38 -1.33 -0.65 0.00 0.00 174.74 172.73 1suf n MET 523 N 7.90 2.32 0.00 2.88 2.81 0.13 -1.49 117.12 131.67 1suf n MET 523 Ca 0.14 -1.95 0.00 0.00 -1.81 0.00 0.00 57.70 54.07 1suf n MET 523 Cb 0.49 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.51 1suf n MET 523 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1suf n GLY 524 N 1.39 0.37 3.18 3.03 0.00 -1.25 -4.71 105.19 107.19 1suf n GLY 524 Ca 0.17 -2.03 -0.25 0.00 0.00 0.00 0.00 46.02 43.91 1suf n GLY 524 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1suf n SER 525 N 0.00 -0.30 -0.09 1.61 3.41 -1.26 -0.58 113.62 116.40 1suf n SER 525 Ca 0.00 -1.34 -0.08 0.00 -0.26 0.00 0.00 58.87 57.20 1suf n SER 525 Cb 0.00 -0.85 0.09 0.00 -0.26 0.00 0.00 64.21 63.19 1suf n SER 525 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1suf h VAL 527 N 0.69 1.11 0.00 0.00 -1.51 -1.94 -1.01 116.25 113.58 1suf h VAL 527 Ca 0.10 -0.48 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 1suf h VAL 527 Cb 0.72 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 31.06 1suf h VAL 527 CO 0.06 0.14 0.00 0.47 -1.23 0.00 0.00 177.57 177.01 1suf n ASP 528 N -4.38 0.00 -0.02 4.19 10.43 -0.50 -0.97 116.55 125.31 1suf n ASP 528 Ca -0.02 -0.78 0.23 0.00 2.57 0.00 0.00 54.79 56.79 1suf n ASP 528 Cb 0.20 0.00 0.72 0.00 1.84 0.00 0.00 41.12 43.88 1suf n ASP 528 CO 0.00 0.00 0.00 0.78 -1.07 0.00 0.00 177.20 176.91 1suf h ASN 529 N 0.00 0.00 -0.06 -2.24 2.35 -1.01 0.11 115.58 114.72 1suf h ASN 529 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1suf h ASN 529 Cb 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 1suf h ASN 529 CO 0.00 0.00 0.06 0.77 -1.65 0.00 0.00 177.43 176.61 1suf h SER 530 N 0.00 0.00 -0.46 5.81 4.64 -1.27 -1.45 113.55 120.82 1suf h SER 530 Ca 0.29 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.48 1suf h SER 530 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 1suf h SER 530 CO -0.00 0.00 -0.18 0.03 -0.87 0.00 0.00 176.83 175.81 1suf h ARG 531 N 0.00 0.96 -0.73 4.77 3.08 -1.00 -0.57 114.38 120.89 1suf h ARG 531 Ca 0.03 -0.38 -0.04 0.00 0.07 0.00 0.00 59.98 59.65 1suf h ARG 531 Cb 0.14 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1suf h ARG 531 CO -0.00 1.05 0.28 0.00 -1.07 0.00 0.00 179.97 180.23 1suf h ALA 532 N 0.95 1.11 -0.50 0.04 0.00 -1.31 -0.96 119.26 118.59 1suf h ALA 532 Ca 0.12 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1suf h ALA 532 Cb 0.74 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1suf h ALA 532 CO 0.06 0.63 0.30 0.28 0.00 0.00 0.00 179.25 180.52 1suf h VAL 533 N 1.07 1.06 -0.50 0.00 2.07 -0.96 0.23 116.25 119.21 1suf h VAL 533 Ca 0.25 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.59 1suf h VAL 533 Cb 0.22 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 1suf h VAL 533 CO -0.02 0.11 0.29 0.00 0.02 0.00 0.00 177.57 177.97 1suf h ALA 534 N 1.22 0.64 -0.22 1.67 0.00 -0.51 0.14 119.26 122.20 1suf h ALA 534 Ca 0.20 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1suf h ALA 534 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1suf h ALA 534 CO -0.09 -0.02 0.10 1.25 0.00 0.00 0.00 179.25 180.49 1suf h LEU 535 N 0.57 0.30 -0.58 0.00 5.85 -0.86 -0.46 115.31 120.12 1suf h LEU 535 Ca 0.21 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 1suf h LEU 535 Cb 0.04 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1suf h LEU 535 CO -0.10 0.35 0.04 0.58 -0.34 0.00 0.00 178.44 178.96 1suf h VAL 536 N 0.22 1.26 -0.64 1.05 2.07 -0.62 -0.97 116.25 118.62 1suf h VAL 536 Ca 0.08 -1.08 -0.06 0.00 0.82 0.00 0.00 66.70 66.45 1suf h VAL 536 Cb 0.14 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 1suf h VAL 536 CO -0.01 0.39 0.15 0.00 0.02 0.00 0.00 177.57 178.12 1suf h ALA 537 N 0.99 1.05 -0.69 1.67 0.00 -0.68 0.10 119.26 121.70 1suf h ALA 537 Ca 0.17 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1suf h ALA 537 Cb 0.50 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1suf h ALA 537 CO 0.02 0.62 0.13 0.00 0.00 0.00 0.00 179.25 180.03 1suf h ALA 538 N 1.19 0.92 -0.47 0.00 0.00 -0.61 -0.21 119.26 120.10 1suf h ALA 538 Ca 0.20 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1suf h ALA 538 Cb 0.35 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1suf h ALA 538 CO 0.00 0.67 -0.07 -0.07 0.00 0.00 0.00 179.25 179.78 1suf h LEU 539 N 1.06 0.87 -0.50 0.00 3.38 -0.73 -1.12 115.31 118.28 1suf h LEU 539 Ca 0.21 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1suf h LEU 539 Cb 0.42 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1suf h LEU 539 CO 0.01 1.01 0.31 0.00 0.09 0.00 0.00 178.44 179.86 1suf h ALA 540 N 0.89 0.63 -0.62 1.53 0.00 -0.77 -1.61 119.26 119.31 1suf h ALA 540 Ca 0.12 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1suf h ALA 540 Cb 0.61 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1suf h ALA 540 CO 0.04 0.04 0.33 -0.91 0.00 0.00 0.00 179.25 178.74 1suf h ASN 541 N 0.64 0.80 -0.22 0.00 -0.26 -0.91 0.93 115.58 116.55 1suf h ASN 541 Ca 0.19 -0.11 -0.05 0.00 -0.56 0.00 0.00 56.30 55.77 1suf h ASN 541 Cb -0.03 -0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 37.01 1suf h ASN 541 CO -0.06 0.68 -0.02 -0.09 -1.06 0.00 0.00 177.43 176.88 1suf h ARG 542 N 0.85 0.53 0.00 0.81 9.65 -0.98 -2.55 114.38 122.70 1suf h ARG 542 Ca 0.22 -0.12 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 1suf h ARG 542 Cb 0.07 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1suf h ARG 542 CO -0.03 0.57 -0.65 -0.07 2.80 0.00 0.00 179.97 182.59 1suf h LEU 543 N 0.51 0.00 0.90 3.80 -0.00 -1.03 -3.48 115.31 116.00 1suf h LEU 543 Ca 0.11 -0.22 -0.16 0.00 -0.00 0.00 0.00 57.88 57.61 1suf h LEU 543 Cb 0.36 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.02 1suf h LEU 543 CO 0.01 0.11 -0.21 0.61 -0.00 0.00 0.00 178.44 178.96 1suf n GLY 544 N 1.33 0.08 3.28 0.83 0.00 0.25 -5.04 105.19 105.93 1suf n GLY 544 Ca 0.03 -0.53 -0.15 0.00 0.00 0.00 0.00 46.02 45.37 1suf n GLY 544 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1suf s VAL 545 N -2.48 0.96 0.72 1.61 -7.23 -0.80 -5.04 120.40 108.14 1suf s VAL 545 Ca 0.03 -2.02 -0.10 0.00 -1.81 0.00 0.00 61.98 58.07 1suf s VAL 545 Cb -0.01 -2.15 0.04 0.00 0.56 0.00 0.00 36.38 34.82 1suf s VAL 545 CO 0.03 -0.48 1.08 -0.62 -0.31 0.00 0.00 175.10 174.80 1suf s ASP 546 N -3.23 5.09 0.47 4.85 3.68 -1.26 -4.38 116.67 121.90 1suf s ASP 546 Ca 0.24 0.85 0.19 0.00 2.13 0.00 0.00 52.55 55.96 1suf s ASP 546 Cb 0.05 -1.57 1.15 0.00 -1.45 0.00 0.00 42.92 41.11 1suf s ASP 546 CO 0.05 -1.50 2.02 -0.07 0.13 0.00 0.00 175.17 175.80 1suf h LEU 547 N -0.68 0.00 0.00 -1.34 4.07 -1.93 -1.44 115.31 113.98 1suf h LEU 547 Ca -0.45 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.51 1suf h LEU 547 Cb 1.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.03 1suf h LEU 547 CO 0.63 0.17 0.00 -0.90 -1.08 0.00 0.00 178.44 177.26 1suf n ASP 548 N -4.09 0.00 -0.37 -0.43 5.75 -1.26 -1.87 116.55 114.29 1suf n ASP 548 Ca -0.02 -1.04 0.09 0.00 -0.01 0.00 0.00 54.79 53.80 1suf n ASP 548 Cb 0.24 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.32 1suf n ASP 548 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1suf n ARG 549 N -0.78 1.54 -3.20 0.11 1.74 -0.54 -4.99 116.66 110.53 1suf n ARG 549 Ca 0.10 -0.79 -0.34 0.00 -0.77 0.00 0.00 57.85 56.05 1suf n ARG 549 Cb 0.04 -1.33 -0.06 0.00 -1.02 0.00 0.00 32.46 30.10 1suf n ARG 549 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1suf s LEU 550 N -2.21 4.20 -1.55 0.55 1.43 -0.78 -4.79 118.68 115.53 1suf s LEU 550 Ca 0.14 1.23 -0.12 0.00 -1.03 0.00 0.00 54.13 54.36 1suf s LEU 550 Cb 0.14 -3.76 -0.03 0.00 0.03 0.00 0.00 46.19 42.57 1suf s LEU 550 CO 0.47 -0.07 2.63 -0.81 0.23 0.00 0.00 176.35 178.80 1suf n PRO 551 N 0.15 3.33 -4.47 1.29 -0.04 -1.26 -4.84 135.00 129.16 1suf n PRO 551 Ca 0.00 -2.39 -0.23 0.00 -0.04 0.00 0.00 63.50 60.85 1suf n PRO 551 Cb 0.52 -3.02 -0.16 0.00 -0.04 0.00 0.00 33.50 30.80 1suf n PRO 551 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1suf s VAL 552 N 2.61 0.94 0.27 0.52 1.01 -1.26 -1.01 120.40 123.48 1suf s VAL 552 Ca 0.60 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 62.20 1suf s VAL 552 Cb 0.16 -0.87 -0.05 0.00 0.00 0.00 0.00 36.38 35.62 1suf s VAL 552 CO -0.07 0.30 0.08 0.68 0.00 0.00 0.00 175.10 176.09 1suf s VAL 553 N 0.53 0.76 0.08 2.92 -7.23 -0.37 -4.34 120.40 112.75 1suf s VAL 553 Ca -0.10 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.11 1suf s VAL 553 Cb -0.13 -2.66 -0.03 0.00 0.56 0.00 0.00 36.38 34.11 1suf s VAL 553 CO 0.02 -0.02 -0.11 0.00 -0.31 0.00 0.00 175.10 174.68 1suf s ALA 554 N -3.61 1.05 -0.16 1.32 0.00 -0.69 -1.36 121.76 118.31 1suf s ALA 554 Ca 0.37 -1.06 -0.05 0.00 0.00 0.00 0.00 51.96 51.22 1suf s ALA 554 Cb 0.08 -0.01 0.06 0.00 0.00 0.00 0.00 23.12 23.25 1suf s ALA 554 CO 0.14 0.04 0.10 0.45 0.00 0.00 0.00 175.76 176.49 1suf s SER 555 N -2.07 2.12 -1.19 0.00 0.15 0.45 0.02 113.70 113.18 1suf s SER 555 Ca 0.00 -0.50 -0.10 0.00 0.70 0.00 0.00 55.95 56.05 1suf s SER 555 Cb -0.06 -0.15 0.22 0.00 -1.71 0.00 0.00 66.02 64.31 1suf s SER 555 CO 0.01 -0.34 1.47 0.00 1.20 0.00 0.00 173.24 175.58 1suf n ALA 556 N 5.29 4.49 0.27 5.45 0.00 0.15 -1.43 120.51 134.74 1suf n ALA 556 Ca -0.07 -4.45 0.16 0.00 0.00 0.00 0.00 53.44 49.09 1suf n ALA 556 Cb 0.49 -2.79 0.57 0.00 0.00 0.00 0.00 19.45 17.72 1suf n ALA 556 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1suf h ALA 557 N 6.45 1.00 -0.43 0.00 0.00 -1.80 -2.29 119.26 122.19 1suf h ALA 557 Ca 0.29 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.96 1suf h ALA 557 Cb 0.78 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.17 1suf h ALA 557 CO 1.29 0.00 -1.12 0.39 0.00 0.00 0.00 179.25 179.81 1suf n GLU 558 N -3.08 1.72 -1.70 0.00 1.02 -1.25 -3.69 120.64 113.65 1suf n GLU 558 Ca 0.01 -3.49 -0.38 0.00 -0.02 0.00 0.00 57.16 53.28 1suf n GLU 558 Cb 0.35 -1.59 0.06 0.00 -0.02 0.00 0.00 31.44 30.24 1suf n GLU 558 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1suf n ALA 559 N -0.59 1.02 0.10 0.62 0.00 -1.21 -2.52 120.51 117.91 1suf n ALA 559 Ca 0.07 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1suf n ALA 559 Cb 0.80 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.98 1suf n ALA 559 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1suf n MET 560 N -1.38 0.00 -2.03 0.00 0.00 -1.26 -4.69 117.12 107.75 1suf n MET 560 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 57.70 57.52 1suf n MET 560 Cb 0.47 -0.12 -0.00 0.00 0.00 0.00 0.00 33.22 33.57 1suf n MET 560 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 1suf s HIS 561 N -2.00 3.46 0.42 1.12 2.46 -1.26 -4.92 115.29 114.57 1suf s HIS 561 Ca 0.00 1.38 0.14 0.00 0.47 0.00 0.00 55.06 57.05 1suf s HIS 561 Cb 0.00 -2.79 1.01 0.00 -0.13 0.00 0.00 32.58 30.68 1suf s HIS 561 CO 0.00 -0.67 1.95 0.93 -2.47 0.00 0.00 174.74 174.47 1suf h GLU 562 N 0.13 0.43 -0.88 2.88 5.08 -1.96 -0.22 114.58 120.04 1suf h GLU 562 Ca -0.45 -0.03 0.09 0.00 -1.00 0.00 0.00 59.36 57.97 1suf h GLU 562 Cb 1.19 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.28 1suf h GLU 562 CO 0.61 0.29 0.57 0.87 -1.00 0.00 0.00 179.01 180.35 1suf h LYS 563 N 0.45 0.87 -0.14 2.33 1.57 -1.84 -0.98 116.57 118.83 1suf h LYS 563 Ca 0.33 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.92 1suf h LYS 563 Cb 0.67 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1suf h LYS 563 CO -0.10 0.58 -0.51 0.00 -0.57 0.00 0.00 179.45 178.84 1suf h ALA 564 N 1.55 0.86 -0.50 3.86 0.00 -1.40 -1.00 119.26 122.63 1suf h ALA 564 Ca 0.40 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1suf h ALA 564 Cb 0.36 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1suf h ALA 564 CO -0.17 0.67 0.23 0.28 0.00 0.00 0.00 179.25 180.27 1suf h VAL 565 N 0.30 1.20 -0.35 0.00 2.07 -1.05 -0.62 116.25 117.79 1suf h VAL 565 Ca 0.01 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 1suf h VAL 565 Cb 1.01 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1suf h VAL 565 CO 0.09 0.22 0.17 0.00 0.02 0.00 0.00 177.57 178.07 1suf h ALA 566 N 1.08 0.45 -0.53 1.67 0.00 -0.96 -1.37 119.26 119.60 1suf h ALA 566 Ca 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1suf h ALA 566 Cb 0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1suf h ALA 566 CO -0.02 0.02 0.24 0.82 0.00 0.00 0.00 179.25 180.30 1suf h ILE 567 N 0.43 1.20 -0.73 0.00 2.04 -1.09 -0.66 117.51 118.71 1suf h ILE 567 Ca 0.12 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1suf h ILE 567 Cb 0.12 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 1suf h ILE 567 CO -0.02 0.23 0.42 1.23 0.00 0.00 0.00 178.15 180.02 1suf h GLY 568 N 0.71 1.07 1.19 5.37 0.00 -0.98 -0.21 103.07 110.23 1suf h GLY 568 Ca 0.18 -0.46 -0.19 0.00 0.00 0.00 0.00 47.33 46.86 1suf h GLY 568 CO -0.02 0.44 -0.59 -0.84 0.00 0.00 0.00 176.54 175.53 1suf h THR 569 N 1.02 1.28 0.00 4.70 2.02 -0.74 -1.89 112.91 119.30 1suf h THR 569 Ca 0.26 -1.78 -0.10 0.00 0.77 0.00 0.00 66.41 65.56 1suf h THR 569 Cb -0.00 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1suf h THR 569 CO -0.05 0.58 -0.49 4.11 0.37 0.00 0.00 175.52 180.04 1suf h TRP 570 N 0.63 0.00 -0.53 3.16 5.08 -0.78 -0.79 115.95 122.72 1suf h TRP 570 Ca 0.00 0.00 0.04 0.00 1.08 0.00 0.00 58.89 60.01 1suf h TRP 570 Cb 1.20 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 27.32 1suf h TRP 570 CO 0.07 0.49 0.29 0.00 -1.28 0.00 0.00 178.44 178.01 1suf h ALA 571 N 1.51 0.68 -0.73 0.11 0.00 -0.73 0.48 119.26 120.59 1suf h ALA 571 Ca -0.00 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1suf h ALA 571 Cb 1.05 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1suf h ALA 571 CO 0.06 -0.04 0.21 0.28 0.00 0.00 0.00 179.25 179.76 1suf h VAL 572 N 0.55 1.26 -0.26 0.00 2.07 -1.07 -0.69 116.25 118.12 1suf h VAL 572 Ca 0.23 -0.93 -0.10 0.00 0.82 0.00 0.00 66.70 66.72 1suf h VAL 572 Cb 0.11 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1suf h VAL 572 CO -0.14 0.36 -0.25 0.74 0.02 0.00 0.00 177.57 178.30 1suf h THR 573 N 1.09 1.26 -0.00 2.57 2.02 -0.50 -2.06 112.91 117.29 1suf h THR 573 Ca 0.23 -1.26 0.00 0.00 0.77 0.00 0.00 66.41 66.15 1suf h THR 573 Cb 0.33 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 1suf h THR 573 CO -0.00 0.40 -0.06 2.30 0.37 0.00 0.00 175.52 178.53 1suf n ILE 574 N -4.12 0.00 0.00 3.11 -5.35 0.10 -4.84 119.36 108.26 1suf n ILE 574 Ca -0.00 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 1suf n ILE 574 Cb 0.40 -0.30 0.00 0.00 -1.74 0.00 0.00 39.64 38.00 1suf n ILE 574 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1suf n GLY 575 N 1.27 1.49 3.87 3.28 0.00 -0.78 -4.47 105.19 109.86 1suf n GLY 575 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1suf n GLY 575 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1suf s LEU 576 N 0.00 4.31 0.05 0.99 1.43 -0.28 -3.75 118.68 121.42 1suf s LEU 576 Ca 0.00 0.37 -0.31 0.00 -1.03 0.00 0.00 54.13 53.17 1suf s LEU 576 Cb 0.00 -2.33 -0.08 0.00 0.03 0.00 0.00 46.19 43.82 1suf s LEU 576 CO 0.00 0.33 1.60 -2.84 0.23 0.00 0.00 176.35 175.67 1suf s PRO 577 N -1.50 4.22 -0.19 1.29 0.02 -1.26 -2.56 135.00 135.01 1suf s PRO 577 Ca 0.21 2.25 -0.00 0.00 0.02 0.00 0.00 61.00 63.48 1suf s PRO 577 Cb -0.12 -3.60 0.05 0.00 0.02 0.00 0.00 34.50 30.85 1suf s PRO 577 CO 0.12 -0.70 -0.05 0.99 -0.33 0.00 0.00 177.00 177.03 1suf s THR 578 N 2.60 1.20 0.20 0.99 2.01 0.11 -1.70 115.64 121.05 1suf s THR 578 Ca 0.72 -0.81 -0.24 0.00 0.31 0.00 0.00 61.69 61.67 1suf s THR 578 Cb -0.38 -1.43 -0.08 0.00 0.01 0.00 0.00 72.50 70.62 1suf s THR 578 CO 0.31 0.03 0.79 -2.28 -0.69 0.00 0.00 174.62 172.78 1suf s HIS 579 N 1.58 3.81 -0.08 4.92 2.46 0.10 -0.42 115.29 127.66 1suf s HIS 579 Ca -0.01 1.59 0.03 0.00 0.47 0.00 0.00 55.06 57.14 1suf s HIS 579 Cb -0.16 -2.75 0.00 0.00 -0.13 0.00 0.00 32.58 29.54 1suf s HIS 579 CO -0.07 0.42 -0.18 -1.50 -2.47 0.00 0.00 174.74 170.94 1suf s ILE 580 N -1.32 1.60 -2.04 0.89 2.07 0.09 -0.67 121.20 121.81 1suf s ILE 580 Ca 0.40 -0.76 0.22 0.00 -1.41 0.00 0.00 60.65 59.10 1suf s ILE 580 Cb -0.21 -1.40 0.58 0.00 0.13 0.00 0.00 42.46 41.56 1suf s ILE 580 CO 0.24 0.46 1.49 0.61 -1.91 0.00 0.00 174.94 175.84 1suf n GLY 581 N 3.57 2.33 3.38 1.50 0.00 -0.86 -2.03 105.19 113.07 1suf n GLY 581 Ca -0.20 -0.77 -0.19 0.00 0.00 0.00 0.00 46.02 44.86 1suf n GLY 581 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1suf s VAL 582 N -1.11 1.58 -0.27 1.61 -7.23 -1.26 -4.45 120.40 109.26 1suf s VAL 582 Ca 0.46 -2.14 -0.29 0.00 -1.81 0.00 0.00 61.98 58.19 1suf s VAL 582 Cb 0.24 -2.26 0.01 0.00 0.56 0.00 0.00 36.38 34.93 1suf s VAL 582 CO 0.32 -0.43 1.11 -0.22 -0.31 0.00 0.00 175.10 175.57 1suf s LEU 583 N -3.37 4.00 0.42 1.32 2.96 -1.26 -4.86 118.68 117.90 1suf s LEU 583 Ca 0.26 1.23 -0.10 0.00 -0.22 0.00 0.00 54.13 55.31 1suf s LEU 583 Cb 0.02 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 43.11 1suf s LEU 583 CO 0.09 -0.83 0.78 -2.16 -1.32 0.00 0.00 176.35 172.91 1suf s PRO 584 N 3.56 3.74 -1.48 0.98 0.04 -1.26 -4.93 135.00 135.65 1suf s PRO 584 Ca 0.47 0.44 -0.12 0.00 0.04 0.00 0.00 61.00 61.83 1suf s PRO 584 Cb -0.14 -2.38 -0.05 0.00 0.04 0.00 0.00 34.50 31.97 1suf s PRO 584 CO 0.13 -0.07 2.61 -0.35 0.04 0.00 0.00 177.00 179.36 1suf n PRO 585 N -1.45 3.20 0.00 0.56 -0.04 -1.26 -3.87 135.00 132.14 1suf n PRO 585 Ca 0.02 -2.26 0.00 0.00 -0.04 0.00 0.00 63.50 61.22 1suf n PRO 585 Cb 0.54 -2.95 0.00 0.00 -0.04 0.00 0.00 33.50 31.05 1suf n PRO 585 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1suf n ILE 586 N 4.25 0.00 0.42 0.52 -5.35 -1.23 -3.72 119.36 114.26 1suf n ILE 586 Ca 0.66 -0.22 0.13 0.00 -0.27 0.00 0.00 62.75 63.04 1suf n ILE 586 Cb 0.28 0.80 0.49 0.00 -1.74 0.00 0.00 39.64 39.48 1suf n ILE 586 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1suf h THR 587 N 0.00 0.00 0.00 7.28 1.35 -1.66 -1.79 112.91 118.09 1suf h THR 587 Ca 0.00 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 1suf h THR 587 Cb 0.00 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 67.53 1suf h THR 587 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1suf n GLY 588 N 0.23 -0.91 2.90 5.82 0.00 0.04 -4.41 105.19 108.85 1suf n GLY 588 Ca 0.03 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1suf n GLY 588 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1suf s SER 589 N -2.74 3.72 0.12 1.61 0.15 -0.67 -4.89 113.70 111.00 1suf s SER 589 Ca 0.12 -1.15 -0.16 0.00 0.70 0.00 0.00 55.95 55.46 1suf s SER 589 Cb 0.11 -1.08 -0.02 0.00 -1.71 0.00 0.00 66.02 63.31 1suf s SER 589 CO 0.27 -0.26 1.64 0.25 1.20 0.00 0.00 173.24 176.34 1suf h LEU 590 N 8.00 0.53 -0.72 3.45 5.85 -1.82 -1.30 115.31 129.31 1suf h LEU 590 Ca -0.17 -0.20 0.08 0.00 0.84 0.00 0.00 57.88 58.43 1suf h LEU 590 Cb 1.08 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.90 1suf h LEU 590 CO 0.40 0.60 0.38 -0.65 -0.34 0.00 0.00 178.44 178.83 1suf h PRO 591 N 0.44 0.65 -0.40 5.25 0.11 -1.95 0.14 132.00 136.24 1suf h PRO 591 Ca 0.12 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.12 1suf h PRO 591 Cb 0.25 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 1suf h PRO 591 CO -0.00 0.43 -0.03 0.28 -0.21 0.00 0.00 178.00 178.46 1suf h VAL 592 N 0.67 1.27 -0.74 3.15 2.07 -1.86 -1.55 116.25 119.25 1suf h VAL 592 Ca 0.34 -1.08 0.06 0.00 0.82 0.00 0.00 66.70 66.85 1suf h VAL 592 Cb 0.31 1.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 1suf h VAL 592 CO -0.24 0.36 0.44 0.74 0.02 0.00 0.00 177.57 178.89 1suf h THR 593 N 0.55 1.00 -0.25 2.57 2.02 -0.64 -1.57 112.91 116.58 1suf h THR 593 Ca 0.11 -0.27 -0.08 0.00 0.77 0.00 0.00 66.41 66.93 1suf h THR 593 Cb 0.53 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1suf h THR 593 CO 0.03 0.15 -0.19 1.56 0.37 0.00 0.00 175.52 177.43 1suf h GLN 594 N 0.80 0.45 0.01 6.66 4.20 -0.57 -0.64 115.11 126.02 1suf h GLN 594 Ca 0.33 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.89 1suf h GLN 594 Cb 0.18 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1suf h GLN 594 CO -0.18 0.63 -0.00 0.82 -0.67 0.00 0.00 178.83 179.43 1suf h ILE 595 N 0.41 1.06 0.00 2.54 2.04 -0.75 -0.70 117.51 122.12 1suf h ILE 595 Ca 0.07 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.67 1suf h ILE 595 Cb 0.57 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1suf h ILE 595 CO 0.04 0.06 -0.20 -0.07 0.00 0.00 0.00 178.15 177.97 1suf h LEU 596 N -0.10 0.00 -0.78 1.44 3.38 -0.95 -0.06 115.31 118.23 1suf h LEU 596 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1suf h LEU 596 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1suf h LEU 596 CO 0.00 0.20 -0.27 0.35 0.09 0.00 0.00 178.44 178.82 1suf n THR 597 N -3.24 0.00 0.13 0.22 -2.24 -0.28 -1.31 114.28 107.56 1suf n THR 597 Ca 0.02 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1suf n THR 597 Cb 0.50 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.88 1suf n THR 597 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1suf n SER 598 N -0.23 -1.11 0.24 3.42 2.88 -0.40 -4.67 113.62 113.74 1suf n SER 598 Ca 0.05 0.48 0.15 0.00 -1.33 0.00 0.00 58.87 58.21 1suf n SER 598 Cb 0.26 1.20 0.45 0.00 -0.75 0.00 0.00 64.21 65.37 1suf n SER 598 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1suf h SER 599 N 0.00 0.00 0.04 -3.46 4.64 -1.03 -1.47 113.55 112.27 1suf h SER 599 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1suf h SER 599 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1suf h SER 599 CO 0.00 0.00 0.00 1.62 -0.87 0.00 0.00 176.83 177.58 1suf h VAL 600 N 0.00 0.00 -0.79 0.95 3.04 -1.25 -1.17 116.25 117.02 1suf h VAL 600 Ca 0.00 -0.02 0.10 0.00 -1.01 0.00 0.00 66.70 65.77 1suf h VAL 600 Cb 0.72 1.00 -0.05 0.00 -2.01 0.00 0.00 31.29 30.95 1suf h VAL 600 CO 0.00 0.00 0.52 0.11 -1.01 0.00 0.00 177.57 177.19 1suf h LYS 601 N 0.00 0.69 0.00 4.17 1.57 -1.20 0.16 116.57 121.97 1suf h LYS 601 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1suf h LYS 601 Cb 0.02 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.17 1suf h LYS 601 CO 0.00 0.46 0.00 -0.25 -0.57 0.00 0.00 179.45 179.09 1suf n ASP 602 N -4.51 0.00 -0.11 0.86 8.00 -0.44 -1.19 116.55 119.16 1suf n ASP 602 Ca 0.13 0.35 -0.18 0.00 0.71 0.00 0.00 54.79 55.81 1suf n ASP 602 Cb 0.34 -0.44 -0.06 0.00 -0.02 0.00 0.00 41.12 40.93 1suf n ASP 602 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1suf n ILE 603 N -1.44 1.49 0.18 0.53 5.41 -0.13 -4.83 119.36 120.56 1suf n ILE 603 Ca 0.07 -0.08 0.02 0.00 1.00 0.00 0.00 62.75 63.76 1suf n ILE 603 Cb 0.26 -2.13 -0.03 0.00 -0.71 0.00 0.00 39.64 37.02 1suf n ILE 603 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1suf n THR 604 N -4.34 0.00 0.00 1.39 -2.24 -0.18 -4.93 114.28 103.98 1suf n THR 604 Ca -0.31 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 1suf n THR 604 Cb 0.67 0.87 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 1suf n THR 604 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1suf n GLY 605 N 1.36 2.93 4.00 3.38 0.00 -0.33 -4.07 105.19 112.45 1suf n GLY 605 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1suf n GLY 605 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1suf s GLY 606 N -1.88 1.76 -0.23 -0.02 0.00 -1.22 -4.67 107.32 101.07 1suf s GLY 606 Ca 0.00 -1.77 -0.29 0.00 0.00 0.00 0.00 44.72 42.66 1suf s GLY 606 CO 0.00 -1.25 1.19 -2.52 0.00 0.00 0.00 173.10 170.52 1suf s TYR 607 N -3.02 -0.21 0.35 1.90 1.13 -1.06 -3.10 117.35 113.34 1suf s TYR 607 Ca 0.65 0.40 -0.25 0.00 -1.41 0.00 0.00 57.07 56.45 1suf s TYR 607 Cb -0.06 0.46 -0.10 0.00 -1.10 0.00 0.00 41.96 41.17 1suf s TYR 607 CO 0.43 -0.18 0.97 -0.06 -2.51 0.00 0.00 175.55 174.19 1suf s PHE 608 N -0.87 3.56 -0.33 -3.49 0.08 -0.43 -0.71 117.98 115.79 1suf s PHE 608 Ca 0.04 1.73 0.02 0.00 0.12 0.00 0.00 56.93 58.84 1suf s PHE 608 Cb -0.01 -2.96 0.09 0.00 -0.57 0.00 0.00 43.02 39.57 1suf s PHE 608 CO -0.04 0.00 0.04 0.42 -0.10 0.00 0.00 175.22 175.54 1suf s ILE 609 N -1.70 2.47 -0.32 0.64 1.01 0.45 -4.38 121.20 119.37 1suf s ILE 609 Ca 0.53 -2.11 -0.21 0.00 0.00 0.00 0.00 60.65 58.86 1suf s ILE 609 Cb -0.18 -2.71 -0.00 0.00 0.01 0.00 0.00 42.46 39.57 1suf s ILE 609 CO 0.23 -0.48 0.67 -0.69 0.00 0.00 0.00 174.94 174.67 1suf s VAL 610 N 1.00 4.89 -0.25 2.92 1.01 -1.26 -0.73 120.40 127.97 1suf s VAL 610 Ca 0.06 0.85 -0.04 0.00 0.00 0.00 0.00 61.98 62.85 1suf s VAL 610 Cb -0.20 -4.05 0.14 0.00 0.00 0.00 0.00 36.38 32.27 1suf s VAL 610 CO -0.06 -0.21 0.47 -0.70 0.00 0.00 0.00 175.10 174.60 1suf s GLU 611 N 2.71 0.42 0.40 2.72 2.56 -0.86 -4.98 118.70 121.67 1suf s GLU 611 Ca 0.27 0.86 0.23 0.00 0.00 0.00 0.00 54.97 56.32 1suf s GLU 611 Cb -0.15 0.10 0.35 0.00 2.00 0.00 0.00 34.13 36.43 1suf s GLU 611 CO 0.13 -0.51 1.57 -0.07 -0.56 0.00 0.00 175.26 175.82 1suf h LEU 612 N 8.12 0.00 -8.81 2.70 4.07 -1.81 -3.38 115.31 116.18 1suf h LEU 612 Ca -0.19 -0.00 -0.61 0.00 0.08 0.00 0.00 57.88 57.15 1suf h LEU 612 Cb 1.14 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.77 1suf h LEU 612 CO 0.22 0.00 0.38 -0.62 -1.08 0.00 0.00 178.44 177.34 1suf s ASP 613 N -5.97 6.56 0.32 -0.43 2.15 -1.26 -4.96 116.67 113.08 1suf s ASP 613 Ca 0.07 0.39 0.08 0.00 0.43 0.00 0.00 52.55 53.52 1suf s ASP 613 Cb 0.06 -2.40 0.55 0.00 -0.30 0.00 0.00 42.92 40.83 1suf s ASP 613 CO 0.68 -0.72 1.75 1.55 -0.17 0.00 0.00 175.17 178.26 1suf h PRO 614 N 8.44 0.17 -0.68 4.34 0.13 -1.93 0.96 132.00 143.43 1suf h PRO 614 Ca -0.25 -0.07 -0.05 0.00 -0.87 0.00 0.00 66.00 64.75 1suf h PRO 614 Cb 1.09 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 1suf h PRO 614 CO 0.91 0.53 0.21 0.93 -0.23 0.00 0.00 178.00 180.35 1suf h GLU 615 N 0.15 1.06 -0.61 0.86 4.39 -1.93 -0.19 114.58 118.32 1suf h GLU 615 Ca 0.02 -0.23 -0.07 0.00 0.34 0.00 0.00 59.36 59.41 1suf h GLU 615 Cb 0.74 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.21 1suf h GLU 615 CO 0.06 0.92 0.08 1.15 -1.16 0.00 0.00 179.01 180.06 1suf h THR 616 N 1.00 1.25 -0.88 1.13 2.02 -1.87 -2.26 112.91 113.30 1suf h THR 616 Ca 0.22 -1.01 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 1suf h THR 616 Cb 0.30 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.37 1suf h THR 616 CO -0.01 0.37 0.50 0.00 0.37 0.00 0.00 175.52 176.76 1suf h ALA 617 N 1.15 1.13 -0.76 6.16 0.00 -0.47 -0.52 119.26 125.94 1suf h ALA 617 Ca 0.19 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1suf h ALA 617 Cb 0.43 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1suf h ALA 617 CO 0.01 0.61 0.35 0.00 0.00 0.00 0.00 179.25 180.23 1suf h ALA 618 N 1.27 0.98 -0.71 0.00 0.00 -0.73 0.37 119.26 120.44 1suf h ALA 618 Ca 0.31 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1suf h ALA 618 Cb -0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1suf h ALA 618 CO -0.05 0.56 0.19 -0.44 0.00 0.00 0.00 179.25 179.51 1suf h ASP 619 N 1.08 1.05 -0.30 0.00 3.32 -0.81 -0.41 116.42 120.35 1suf h ASP 619 Ca 0.26 -0.21 -0.12 0.00 0.02 0.00 0.00 57.03 56.98 1suf h ASP 619 Cb 0.14 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1suf h ASP 619 CO -0.03 1.00 -0.25 0.11 -1.72 0.00 0.00 179.24 178.35 1suf h LYS 620 N 1.07 0.80 -0.43 3.56 1.57 -0.62 0.61 116.57 123.12 1suf h LYS 620 Ca 0.23 -0.34 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 1suf h LYS 620 Cb 0.34 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1suf h LYS 620 CO -0.00 0.96 -0.16 -0.07 -0.57 0.00 0.00 179.45 179.61 1suf h LEU 621 N 0.69 0.89 -0.72 2.94 3.38 -0.65 -0.90 115.31 120.95 1suf h LEU 621 Ca 0.09 -0.39 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 1suf h LEU 621 Cb 0.78 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1suf h LEU 621 CO 0.06 1.08 0.30 -0.07 0.09 0.00 0.00 178.44 179.90 1suf h LEU 622 N 0.70 0.97 -1.05 1.67 3.38 -0.91 -0.33 115.31 119.75 1suf h LEU 622 Ca 0.10 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 1suf h LEU 622 Cb 0.72 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1suf h LEU 622 CO 0.05 0.87 -0.03 0.00 0.09 0.00 0.00 178.44 179.42 1suf h ALA 623 N 1.14 1.22 -0.52 1.53 0.00 -0.62 0.80 119.26 122.81 1suf h ALA 623 Ca 0.24 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1suf h ALA 623 Cb 0.19 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1suf h ALA 623 CO -0.02 0.51 -0.01 0.00 0.00 0.00 0.00 179.25 179.73 1suf h ALA 624 N 1.37 0.71 -0.38 0.00 0.00 -0.77 0.08 119.26 120.27 1suf h ALA 624 Ca 0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1suf h ALA 624 Cb 0.43 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1suf h ALA 624 CO 0.02 0.53 0.21 0.82 0.00 0.00 0.00 179.25 180.84 1suf h ILE 625 N 0.80 1.14 -0.12 0.00 2.04 -0.69 -2.46 117.51 118.22 1suf h ILE 625 Ca 0.15 -0.36 -0.12 0.00 1.00 0.00 0.00 64.86 65.54 1suf h ILE 625 Cb 0.54 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1suf h ILE 625 CO 0.03 0.14 -0.45 0.78 0.00 0.00 0.00 178.15 178.66 1suf h ASN 626 N 0.49 0.30 -0.67 1.72 2.35 -0.66 0.17 115.58 119.28 1suf h ASN 626 Ca 0.13 -0.13 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 1suf h ASN 626 Cb 0.04 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 1suf h ASN 626 CO -0.02 0.71 0.11 -0.33 -1.65 0.00 0.00 177.43 176.25 1suf h GLU 627 N 0.23 1.11 -0.58 0.81 5.08 -0.84 0.10 114.58 120.50 1suf h GLU 627 Ca 0.02 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.04 1suf h GLU 627 Cb 0.88 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1suf h GLU 627 CO 0.07 1.01 0.19 0.00 -1.00 0.00 0.00 179.01 179.28 1suf h ARG 628 N 1.04 0.89 -0.42 2.33 2.47 -0.94 -1.01 114.38 118.75 1suf h ARG 628 Ca 0.21 -0.19 0.05 0.00 -1.26 0.00 0.00 59.98 58.79 1suf h ARG 628 Cb 0.44 -0.13 -0.04 0.00 -1.65 0.00 0.00 29.97 28.58 1suf h ARG 628 CO 0.01 0.80 0.16 0.00 0.56 0.00 0.00 179.97 181.50 1suf h ARG 629 N 0.81 0.33 -0.90 0.04 3.08 -0.52 -2.16 114.38 115.06 1suf h ARG 629 Ca 0.19 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 1suf h ARG 629 Cb 0.27 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 1suf h ARG 629 CO -0.01 0.22 0.52 0.00 -1.07 0.00 0.00 179.97 179.63 1suf h ALA 630 N 1.26 1.22 0.00 0.04 0.00 -0.51 -0.93 119.26 120.35 1suf h ALA 630 Ca 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1suf h ALA 630 Cb 0.16 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1suf h ALA 630 CO -0.18 0.65 0.00 0.78 0.00 0.00 0.00 179.25 180.50 1suf h GLY 631 N 1.25 0.00 -0.49 0.00 0.00 -0.62 -1.12 103.07 102.09 1suf h GLY 631 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1suf h GLY 631 CO -0.06 0.00 -0.00 1.04 0.00 0.00 0.00 176.54 177.52 1suf n LEU 632 N -2.84 1.53 0.00 3.11 4.77 -0.71 -4.94 117.00 117.91 1suf n LEU 632 Ca 0.00 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 1suf n LEU 632 Cb 0.23 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1suf n LEU 632 CO 0.23 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1suf n GLY 633 N 1.18 0.49 3.90 -0.72 0.00 -0.42 -5.05 105.19 104.57 1suf n GLY 633 Ca 0.19 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 1suf n GLY 633 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1suf s LEU 634 N 0.00 4.30 0.81 0.99 1.43 -0.43 -5.01 118.68 120.78 1suf s LEU 634 Ca 0.00 0.55 -0.13 0.00 -1.03 0.00 0.00 54.13 53.52 1suf s LEU 634 Cb 0.00 -3.13 0.09 0.00 0.03 0.00 0.00 46.19 43.18 1suf s LEU 634 CO 0.00 0.11 1.18 -2.84 0.23 0.00 0.00 176.35 175.03 1suf s PRO 635 N -2.44 1.65 0.00 1.29 0.02 -1.26 -4.05 135.00 130.21 1suf s PRO 635 Ca 0.37 1.66 0.00 0.00 0.02 0.00 0.00 61.00 63.06 1suf s PRO 635 Cb -0.13 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.61 1suf s PRO 635 CO 0.23 -2.19 0.00 -2.67 -0.33 0.00 0.00 177.00 172.05