#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c87 h MET 3 N 0.00 0.17 -0.49 5.31 -0.00 -1.88 -0.81 114.93 117.24 1c87 h MET 3 Ca 0.00 -0.01 -0.08 0.00 -0.00 0.00 0.00 59.70 59.61 1c87 h MET 3 Cb 0.00 -0.04 -0.02 0.00 -0.00 0.00 0.00 31.60 31.54 1c87 h MET 3 CO 0.00 0.11 -0.02 1.49 -0.00 0.00 0.00 176.91 178.50 1c87 h GLU 4 N 0.18 0.87 -0.32 -0.10 4.81 -1.98 0.22 114.58 118.26 1c87 h GLU 4 Ca 0.52 -0.29 -0.10 0.00 -0.13 0.00 0.00 59.36 59.37 1c87 h GLU 4 Cb 1.72 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 31.02 1c87 h GLU 4 CO -0.12 0.92 -0.17 0.87 -0.73 0.00 0.00 179.01 179.77 1c87 h LYS 5 N 0.73 0.68 -0.53 1.92 1.57 -1.64 -1.93 116.57 117.36 1c87 h LYS 5 Ca 0.14 -0.30 0.11 0.00 -1.87 0.00 0.00 60.65 58.72 1c87 h LYS 5 Cb 0.54 -0.01 -0.10 0.00 0.08 0.00 0.00 32.23 32.73 1c87 h LYS 5 CO 0.03 0.90 -0.16 1.49 -0.57 0.00 0.00 179.45 181.14 1c87 h GLU 6 N 0.44 -0.03 -0.80 3.15 4.81 -1.26 0.74 114.58 121.63 1c87 h GLU 6 Ca 0.07 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.44 1c87 h GLU 6 Cb 0.71 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.01 1c87 h GLU 6 CO 0.05 -0.02 0.38 0.35 -0.73 0.00 0.00 179.01 179.04 1c87 h PHE 7 N -0.03 0.65 0.08 0.92 3.57 -0.36 -0.06 116.94 121.71 1c87 h PHE 7 Ca 0.25 0.03 -0.27 0.00 3.53 0.00 0.00 57.97 61.52 1c87 h PHE 7 Cb 0.42 -0.17 0.01 0.00 2.79 0.00 0.00 35.95 39.01 1c87 h PHE 7 CO -0.47 0.14 -1.14 0.93 -2.23 0.00 0.00 178.31 175.55 1c87 h GLU 8 N 0.55 0.46 -0.48 1.11 5.08 -0.20 -0.58 114.58 120.52 1c87 h GLU 8 Ca 0.43 -0.60 0.08 0.00 -1.00 0.00 0.00 59.36 58.27 1c87 h GLU 8 Cb 0.61 0.20 -0.07 0.00 0.50 0.00 0.00 28.75 29.99 1c87 h GLU 8 CO -0.37 1.24 0.07 0.37 -1.00 0.00 0.00 179.01 179.32 1c87 h GLN 9 N 0.21 0.19 -0.14 2.33 4.15 -0.73 0.84 115.11 121.96 1c87 h GLN 9 Ca -0.14 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.25 1c87 h GLN 9 Cb 1.81 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 29.45 1c87 h GLN 9 CO 0.20 0.13 -0.02 0.82 -1.93 0.00 0.00 178.83 178.03 1c87 h ILE 10 N 0.20 1.28 0.02 2.39 2.04 -0.44 -1.08 117.51 121.92 1c87 h ILE 10 Ca 0.24 -0.92 0.02 0.00 1.00 0.00 0.00 64.86 65.19 1c87 h ILE 10 Cb 0.33 1.62 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 1c87 h ILE 10 CO -0.33 0.27 -0.13 0.44 0.00 0.00 0.00 178.15 178.40 1c87 h ASP 11 N -0.04 -0.36 -0.39 1.72 5.19 -1.11 0.36 116.42 121.80 1c87 h ASP 11 Ca 0.04 0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.49 1c87 h ASP 11 Cb 0.42 0.15 -0.02 0.00 0.18 0.00 0.00 39.33 40.06 1c87 h ASP 11 CO 0.01 -0.18 0.22 0.07 -3.12 0.00 0.00 179.24 176.24 1c87 h LYS 12 N -0.23 0.54 0.00 3.56 5.09 -0.67 0.51 116.57 125.37 1c87 h LYS 12 Ca 0.04 -0.06 0.00 0.00 0.09 0.00 0.00 60.65 60.72 1c87 h LYS 12 Cb 0.27 -0.11 0.00 0.00 0.10 0.00 0.00 32.23 32.49 1c87 h LYS 12 CO -0.11 0.43 0.00 -1.13 -2.09 0.00 0.00 179.45 176.55 1c87 n SER 13 N -4.75 0.70 -3.80 7.07 3.41 -0.42 -4.94 113.62 110.89 1c87 n SER 13 Ca 0.00 0.66 -0.35 0.00 -0.26 0.00 0.00 58.87 58.92 1c87 n SER 13 Cb 0.07 -0.81 0.04 0.00 -0.26 0.00 0.00 64.21 63.24 1c87 n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c87 n GLY 14 N 0.15 -0.92 1.48 5.00 0.00 0.18 -4.96 105.19 106.11 1c87 n GLY 14 Ca 0.02 0.41 -0.13 0.00 0.00 0.00 0.00 46.02 46.33 1c87 n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1c87 n SER 15 N -2.55 3.75 -0.29 1.61 3.41 0.61 -4.77 113.62 115.38 1c87 n SER 15 Ca -0.10 -3.81 0.04 0.00 -0.26 0.00 0.00 58.87 54.74 1c87 n SER 15 Cb 0.59 -0.48 0.19 0.00 -0.26 0.00 0.00 64.21 64.24 1c87 n SER 15 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1c87 h TRP 16 N 1.63 0.83 -0.52 7.33 4.06 -1.93 -0.54 115.95 126.81 1c87 h TRP 16 Ca 0.25 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 61.23 1c87 h TRP 16 Cb 1.35 -0.25 -0.03 0.00 -1.00 0.00 0.00 29.16 29.24 1c87 h TRP 16 CO 0.89 0.29 0.32 0.00 -3.56 0.00 0.00 178.44 176.38 1c87 h ALA 17 N 1.49 0.66 -0.29 1.49 0.00 -1.91 0.27 119.26 120.97 1c87 h ALA 17 Ca 0.42 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 55.08 1c87 h ALA 17 Cb 0.46 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1c87 h ALA 17 CO -0.28 0.14 -0.55 0.00 0.00 0.00 0.00 179.25 178.55 1c87 h ALA 18 N 1.16 0.46 -0.16 0.00 0.00 -1.81 0.36 119.26 119.26 1c87 h ALA 18 Ca 0.19 -0.52 0.05 0.00 0.00 0.00 0.00 54.91 54.63 1c87 h ALA 18 Cb -0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1c87 h ALA 18 CO -0.04 0.68 -0.17 0.82 0.00 0.00 0.00 179.25 180.54 1c87 h ILE 19 N 0.68 0.54 -0.35 0.00 1.08 -0.88 0.13 117.51 118.72 1c87 h ILE 19 Ca 0.01 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.48 1c87 h ILE 19 Cb 1.17 0.54 -0.02 0.00 -3.07 0.00 0.00 36.82 35.44 1c87 h ILE 19 CO 0.12 0.00 0.21 0.22 -0.69 0.00 0.00 178.15 178.02 1c87 h TYR 20 N -0.20 0.47 -0.92 1.37 3.20 -0.36 -1.15 116.97 119.37 1c87 h TYR 20 Ca 0.11 -0.00 0.27 0.00 3.14 0.00 0.00 58.73 62.25 1c87 h TYR 20 Cb 0.36 -0.15 -0.15 0.00 1.54 0.00 0.00 36.73 38.32 1c87 h TYR 20 CO -0.30 0.34 0.27 1.96 -1.64 0.00 0.00 178.16 178.79 1c87 h GLN 21 N 0.46 0.16 -0.27 1.82 4.20 0.02 0.76 115.11 122.26 1c87 h GLN 21 Ca 0.13 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.71 1c87 h GLN 21 Cb 0.01 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 27.75 1c87 h GLN 21 CO -0.02 0.11 -0.28 -0.44 -0.67 0.00 0.00 178.83 177.53 1c87 h ASP 22 N 0.17 0.71 -0.52 1.46 3.32 0.35 0.26 116.42 122.17 1c87 h ASP 22 Ca 0.61 -0.47 0.06 0.00 0.02 0.00 0.00 57.03 57.25 1c87 h ASP 22 Cb 1.31 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.61 1c87 h ASP 22 CO -0.71 1.04 0.23 0.40 -1.72 0.00 0.00 179.24 178.49 1c87 h ILE 23 N 0.40 0.89 -0.37 0.35 2.04 -0.17 0.06 117.51 120.71 1c87 h ILE 23 Ca 0.04 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 1c87 h ILE 23 Cb 0.84 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1c87 h ILE 23 CO 0.07 0.08 0.13 0.03 0.00 0.00 0.00 178.15 178.46 1c87 h ARG 24 N 0.45 0.52 -0.03 2.37 3.08 -0.38 0.57 114.38 120.96 1c87 h ARG 24 Ca 0.24 -0.07 -0.18 0.00 0.07 0.00 0.00 59.98 60.05 1c87 h ARG 24 Cb 0.21 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1c87 h ARG 24 CO -0.21 0.44 -0.77 0.45 -1.07 0.00 0.00 179.97 178.82 1c87 h HIS 25 N 0.52 0.32 0.00 3.04 3.86 0.79 -3.19 115.15 120.49 1c87 h HIS 25 Ca 0.13 -0.15 -0.06 0.00 -1.16 0.00 0.00 60.37 59.12 1c87 h HIS 25 Cb 0.13 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 1c87 h HIS 25 CO 0.01 0.91 -0.30 0.93 0.86 0.00 0.00 177.93 180.34 1c87 h GLU 26 N 0.15 0.00 -6.96 2.45 5.08 -0.77 -3.48 114.58 111.04 1c87 h GLU 26 Ca -0.03 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.77 1c87 h GLU 26 Cb 1.34 0.00 0.17 0.00 0.50 0.00 0.00 28.75 30.77 1c87 h GLU 26 CO 0.12 0.30 0.17 0.00 -1.00 0.00 0.00 179.01 178.60 1c87 n ALA 27 N -2.18 0.02 -1.45 3.43 0.00 0.17 -4.92 120.51 115.58 1c87 n ALA 27 Ca 0.03 -0.14 -0.34 0.00 0.00 0.00 0.00 53.44 52.99 1c87 n ALA 27 Cb 0.64 -2.15 0.07 0.00 0.00 0.00 0.00 19.45 18.00 1c87 n ALA 27 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1c87 s SER 28 N -1.56 4.73 -0.14 0.00 0.01 -1.26 -5.04 113.70 110.44 1c87 s SER 28 Ca 0.75 2.16 -0.03 0.00 1.31 0.00 0.00 55.95 60.14 1c87 s SER 28 Cb -0.36 -2.57 0.05 0.00 0.21 0.00 0.00 66.02 63.35 1c87 s SER 28 CO 0.48 -1.89 0.04 -0.62 0.41 0.00 0.00 173.24 171.66 1c87 s ASP 29 N -2.32 2.20 0.22 2.44 2.15 -1.26 -4.93 116.67 115.16 1c87 s ASP 29 Ca 0.70 -0.46 0.07 0.00 0.43 0.00 0.00 52.55 53.29 1c87 s ASP 29 Cb -0.24 -0.41 -0.05 0.00 -0.30 0.00 0.00 42.92 41.92 1c87 s ASP 29 CO 0.43 -0.28 -0.13 -0.36 -0.17 0.00 0.00 175.17 174.66 1c87 s PHE 30 N 2.00 1.74 0.52 -5.34 0.08 -1.26 -5.12 117.98 110.59 1c87 s PHE 30 Ca 0.02 -0.60 -0.21 0.00 0.12 0.00 0.00 56.93 56.25 1c87 s PHE 30 Cb -0.15 -0.84 -0.06 0.00 -0.57 0.00 0.00 43.02 41.40 1c87 s PHE 30 CO -0.07 0.33 1.22 -1.25 -0.10 0.00 0.00 175.22 175.35 1c87 s PRO 31 N -3.66 3.39 -0.49 0.24 0.04 -1.26 -4.86 135.00 128.40 1c87 s PRO 31 Ca 0.24 1.89 0.05 0.00 0.04 0.00 0.00 61.00 63.22 1c87 s PRO 31 Cb 0.00 -2.22 0.39 0.00 0.04 0.00 0.00 34.50 32.71 1c87 s PRO 31 CO 0.08 -0.89 1.05 0.00 0.04 0.00 0.00 177.00 177.27 1c87 h ARG 33 N 2.74 1.00 -0.40 0.00 -0.00 -1.93 -2.60 114.38 113.18 1c87 h ARG 33 Ca 0.23 -0.08 -0.07 0.00 -0.50 0.00 0.00 59.98 59.55 1c87 h ARG 33 Cb 0.77 -0.21 -0.02 0.00 0.00 0.00 0.00 29.97 30.51 1c87 h ARG 33 CO 0.83 0.70 -0.06 -0.39 0.00 0.00 0.00 179.97 181.05 1c87 h VAL 34 N 1.01 1.24 -0.06 2.04 -1.51 -1.92 -1.82 116.25 115.23 1c87 h VAL 34 Ca 0.27 -1.01 -0.01 0.00 -1.23 0.00 0.00 66.70 64.71 1c87 h VAL 34 Cb -0.06 1.00 -0.00 0.00 -2.13 0.00 0.00 31.29 30.10 1c87 h VAL 34 CO -0.05 0.35 -0.02 0.00 -1.23 0.00 0.00 177.57 176.61 1c87 h ALA 35 N 1.32 1.85 -0.04 5.19 0.00 -1.81 -1.14 119.26 124.63 1c87 h ALA 35 Ca 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1c87 h ALA 35 Cb 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1c87 h ALA 35 CO 0.02 0.12 0.00 1.63 0.00 0.00 0.00 179.25 181.02 1c87 n LYS 36 N -4.46 1.89 -1.96 0.00 4.76 -0.78 -4.67 118.16 112.95 1c87 n LYS 36 Ca -0.02 -1.30 -0.39 0.00 -2.87 0.00 0.00 58.31 53.73 1c87 n LYS 36 Cb 0.14 -1.47 0.01 0.00 -1.84 0.00 0.00 35.03 31.86 1c87 n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1c87 s LEU 37 N -1.96 4.15 0.49 -0.35 1.43 -0.43 -4.89 118.68 117.12 1c87 s LEU 37 Ca 0.35 2.74 0.18 0.00 -1.03 0.00 0.00 54.13 56.37 1c87 s LEU 37 Cb 0.21 -3.94 1.21 0.00 0.03 0.00 0.00 46.19 43.69 1c87 s LEU 37 CO 0.32 -1.00 2.03 -0.65 0.23 0.00 0.00 176.35 177.28 1c87 h PRO 38 N 2.47 0.17 0.00 1.29 0.11 -1.92 0.20 132.00 134.32 1c87 h PRO 38 Ca -0.50 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1c87 h PRO 38 Cb 1.26 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1c87 h PRO 38 CO 0.62 0.11 -0.06 1.57 -0.21 0.00 0.00 178.00 180.03 1c87 h LYS 39 N 0.17 0.00 -0.31 1.05 2.10 -1.94 -2.84 116.57 114.80 1c87 h LYS 39 Ca 0.19 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.84 1c87 h LYS 39 Cb 0.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.87 1c87 h LYS 39 CO -0.03 0.06 0.00 0.09 -2.00 0.00 0.00 179.45 177.57 1c87 n ASN 40 N -3.47 2.94 -0.11 7.07 3.02 0.71 -4.45 115.26 120.97 1c87 n ASN 40 Ca -0.02 -1.92 -0.06 0.00 -0.03 0.00 0.00 54.58 52.55 1c87 n ASN 40 Cb 0.18 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 1c87 n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1c87 h LYS 41 N 3.85 -0.16 0.00 3.52 3.64 -1.50 -0.33 116.57 125.59 1c87 h LYS 41 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1c87 h LYS 41 Cb 0.85 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 1c87 h LYS 41 CO 0.00 -0.10 0.00 0.27 -2.27 0.00 0.00 179.45 177.35 1c87 n ASN 42 N -5.39 0.00 -0.82 4.20 0.23 -1.26 -2.29 115.26 109.93 1c87 n ASN 42 Ca 0.02 -1.23 0.10 0.00 -0.53 0.00 0.00 54.58 52.94 1c87 n ASN 42 Cb 0.30 0.00 0.08 0.00 -2.08 0.00 0.00 39.78 38.08 1c87 n ASN 42 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1c87 n ARG 43 N -0.72 1.88 -5.17 -3.83 1.74 -0.14 -4.90 116.66 105.53 1c87 n ARG 43 Ca 0.09 -1.70 -0.32 0.00 -0.77 0.00 0.00 57.85 55.14 1c87 n ARG 43 Cb 0.04 -1.40 -0.15 0.00 -1.02 0.00 0.00 32.46 29.92 1c87 n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1c87 s ASN 44 N -1.77 3.34 0.02 0.55 0.01 -0.97 -4.46 114.94 111.66 1c87 s ASN 44 Ca 0.24 -0.41 -0.04 0.00 -0.71 0.00 0.00 52.86 51.94 1c87 s ASN 44 Cb 0.17 -0.71 -0.28 0.00 0.41 0.00 0.00 41.25 40.84 1c87 s ASN 44 CO 0.27 0.29 0.91 -0.09 -1.51 0.00 0.00 177.10 176.98 1c87 h ARG 45 N 5.73 0.27 -4.79 -0.60 2.43 -1.87 -3.45 114.38 112.10 1c87 h ARG 45 Ca -0.39 -0.47 -0.58 0.00 -0.81 0.00 0.00 59.98 57.74 1c87 h ARG 45 Cb 1.15 0.17 -0.34 0.00 -0.42 0.00 0.00 29.97 30.54 1c87 h ARG 45 CO 0.48 1.16 -0.84 0.71 -1.51 0.00 0.00 179.97 179.97 1c87 s TYR 46 N -2.62 1.90 0.41 2.20 2.02 -1.26 -5.01 117.35 114.98 1c87 s TYR 46 Ca -0.08 -0.81 0.23 0.00 -0.37 0.00 0.00 57.07 56.04 1c87 s TYR 46 Cb 0.07 -1.35 1.23 0.00 -0.40 0.00 0.00 41.96 41.51 1c87 s TYR 46 CO 0.86 -0.39 1.70 -0.09 -1.57 0.00 0.00 175.55 176.06 1c87 h ARG 47 N 7.11 0.25 -0.37 -0.62 2.43 -1.98 -1.41 114.38 119.79 1c87 h ARG 47 Ca -0.28 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1c87 h ARG 47 Cb 1.19 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1c87 h ARG 47 CO 0.48 0.17 0.00 -0.25 -1.51 0.00 0.00 179.97 178.86 1c87 n ASP 48 N -4.69 4.46 -3.64 -3.80 8.00 -1.26 -4.78 116.55 110.84 1c87 n ASP 48 Ca 0.31 -2.95 -0.27 0.00 0.71 0.00 0.00 54.79 52.59 1c87 n ASP 48 Cb 1.11 -0.58 -0.17 0.00 -0.02 0.00 0.00 41.12 41.46 1c87 n ASP 48 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1c87 s VAL 49 N -2.73 0.06 0.05 2.53 0.11 -0.53 -5.09 120.40 114.79 1c87 s VAL 49 Ca 0.46 -0.29 0.03 0.00 -2.93 0.00 0.00 61.98 59.26 1c87 s VAL 49 Cb 0.36 -0.70 -0.03 0.00 -1.53 0.00 0.00 36.38 34.48 1c87 s VAL 49 CO 0.12 -0.29 -0.11 -0.44 -3.33 0.00 0.00 175.10 171.05 1c87 s SER 50 N 2.07 1.21 0.30 3.54 0.01 -1.26 -4.62 113.70 114.95 1c87 s SER 50 Ca 0.02 -0.56 -0.29 0.00 1.31 0.00 0.00 55.95 56.43 1c87 s SER 50 Cb -0.16 -0.01 -0.10 0.00 0.21 0.00 0.00 66.02 65.96 1c87 s SER 50 CO -0.10 -0.14 1.13 -2.16 0.41 0.00 0.00 173.24 172.39 1c87 s PRO 51 N -1.58 4.55 0.45 12.44 0.04 -1.26 -4.59 135.00 145.05 1c87 s PRO 51 Ca -0.06 1.85 -0.25 0.00 0.04 0.00 0.00 61.00 62.59 1c87 s PRO 51 Cb -0.10 -3.11 -0.08 0.00 0.04 0.00 0.00 34.50 31.25 1c87 s PRO 51 CO 0.01 0.11 1.31 -0.06 0.04 0.00 0.00 177.00 178.41 1c87 s PHE 52 N -1.20 2.68 0.31 0.56 0.08 -1.26 -4.54 117.98 114.61 1c87 s PHE 52 Ca 0.46 1.40 0.02 0.00 0.12 0.00 0.00 56.93 58.93 1c87 s PHE 52 Cb -0.33 -3.69 0.58 0.00 -0.57 0.00 0.00 43.02 39.02 1c87 s PHE 52 CO 0.42 -2.27 1.91 -0.44 -0.10 0.00 0.00 175.22 174.74 1c87 h ASP 53 N 2.31 0.86 0.20 1.36 3.32 -1.31 -0.92 116.42 122.24 1c87 h ASP 53 Ca -0.50 0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.43 1c87 h ASP 53 Cb 1.26 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 1c87 h ASP 53 CO 0.61 0.54 -0.50 1.12 -1.72 0.00 0.00 179.24 179.29 1c87 h HIS 54 N 0.97 0.42 -0.30 4.55 2.07 -1.92 -3.18 115.15 117.75 1c87 h HIS 54 Ca 0.38 -0.13 0.00 0.00 -2.85 0.00 0.00 60.37 57.77 1c87 h HIS 54 Cb 0.24 -0.08 0.00 0.00 2.57 0.00 0.00 27.41 30.14 1c87 h HIS 54 CO -0.00 0.77 0.00 -1.13 -3.07 0.00 0.00 177.93 174.50 1c87 n SER 55 N -3.96 2.88 -4.74 3.10 3.41 -1.06 -5.03 113.62 108.21 1c87 n SER 55 Ca -0.02 -1.86 -0.32 0.00 -0.26 0.00 0.00 58.87 56.40 1c87 n SER 55 Cb 0.55 -0.20 0.09 0.00 -0.26 0.00 0.00 64.21 64.39 1c87 n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c87 s ARG 56 N -1.09 2.24 -0.20 4.33 1.70 -0.37 -1.13 118.95 124.42 1c87 s ARG 56 Ca 0.26 1.44 -0.22 0.00 -0.47 0.00 0.00 55.73 56.74 1c87 s ARG 56 Cb 0.15 -1.88 -0.02 0.00 -0.57 0.00 0.00 34.95 32.63 1c87 s ARG 56 CO 0.20 -1.69 0.70 0.42 -1.08 0.00 0.00 175.30 173.85 1c87 s ILE 57 N -2.45 4.96 -0.16 4.99 -1.09 -0.13 -4.73 121.20 122.59 1c87 s ILE 57 Ca 0.67 1.32 -0.19 0.00 -2.23 0.00 0.00 60.65 60.22 1c87 s ILE 57 Cb -0.22 -4.01 -0.03 0.00 -1.58 0.00 0.00 42.46 36.62 1c87 s ILE 57 CO 0.49 0.06 0.53 -0.54 -1.23 0.00 0.00 174.94 174.25 1c87 s LYS 58 N 2.13 4.26 0.40 2.79 1.02 -1.26 -4.05 119.74 125.03 1c87 s LYS 58 Ca 0.31 0.49 -0.25 0.00 0.02 0.00 0.00 55.97 56.54 1c87 s LYS 58 Cb -0.16 -3.51 -0.08 0.00 -0.52 0.00 0.00 37.83 33.55 1c87 s LYS 58 CO 0.10 -0.05 1.21 -0.51 -0.92 0.00 0.00 175.35 175.18 1c87 s LEU 59 N 1.28 4.20 -1.19 3.17 1.02 -0.33 -4.93 118.68 121.90 1c87 s LEU 59 Ca 0.26 2.44 -0.07 0.00 0.02 0.00 0.00 54.13 56.78 1c87 s LEU 59 Cb -0.16 -3.98 0.01 0.00 0.02 0.00 0.00 46.19 42.08 1c87 s LEU 59 CO 0.10 -0.73 2.75 1.41 0.02 0.00 0.00 176.35 179.91 1c87 n HIS 60 N 0.09 2.16 -4.37 0.29 8.25 -1.26 -4.51 115.22 115.88 1c87 n HIS 60 Ca 0.04 -2.68 -0.26 0.00 -0.26 0.00 0.00 57.72 54.56 1c87 n HIS 60 Cb 0.46 -1.98 -0.12 0.00 1.12 0.00 0.00 29.99 29.47 1c87 n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1c87 s GLN 61 N 0.08 1.36 0.02 -0.41 -2.07 -1.26 -5.04 119.66 112.35 1c87 s GLN 61 Ca 0.61 -1.38 -0.18 0.00 -1.82 0.00 0.00 55.36 52.60 1c87 s GLN 61 Cb 0.22 -1.70 -0.27 0.00 -1.09 0.00 0.00 33.01 30.18 1c87 s GLN 61 CO -0.09 0.38 1.08 0.93 -1.32 0.00 0.00 175.29 176.27 1c87 h GLU 62 N 3.61 0.52 0.00 9.60 5.08 -2.03 -3.36 114.58 128.00 1c87 h GLU 62 Ca -0.47 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.25 1c87 h GLU 62 Cb 1.19 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.64 1c87 h GLU 62 CO 0.44 1.26 0.00 -3.47 -1.00 0.00 0.00 179.01 176.23 1c87 n ASP 63 N -4.00 0.00 -3.57 1.42 2.03 -1.26 -4.64 116.55 106.53 1c87 n ASP 63 Ca -0.12 0.37 -0.27 0.00 0.52 0.00 0.00 54.79 55.28 1c87 n ASP 63 Cb 0.84 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 41.08 1c87 n ASP 63 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1c87 s ASN 64 N -2.79 2.94 0.00 1.67 3.84 -1.26 -5.02 114.94 114.32 1c87 s ASN 64 Ca 0.00 -0.96 0.06 0.00 0.21 0.00 0.00 52.86 52.16 1c87 s ASN 64 Cb 0.00 -0.27 0.34 0.00 -0.55 0.00 0.00 41.25 40.77 1c87 s ASN 64 CO 0.00 -0.40 0.81 -0.90 -2.79 0.00 0.00 177.10 173.82 1c87 n ASP 65 N 5.27 0.00 -4.71 -4.21 5.68 -1.26 -4.83 116.55 112.49 1c87 n ASP 65 Ca -0.06 -0.82 -0.41 0.00 -0.50 0.00 0.00 54.79 52.99 1c87 n ASP 65 Cb 0.45 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.40 1c87 n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1c87 s TYR 66 N -2.00 3.63 0.02 2.11 5.04 -1.26 -1.19 117.35 123.70 1c87 s TYR 66 Ca 0.08 1.57 0.02 0.00 -2.44 0.00 0.00 57.07 56.30 1c87 s TYR 66 Cb 0.04 -3.04 -0.02 0.00 0.35 0.00 0.00 41.96 39.29 1c87 s TYR 66 CO 0.07 -0.00 -0.07 -1.50 -1.34 0.00 0.00 175.55 172.71 1c87 s ILE 67 N 1.03 0.51 -1.11 3.14 2.07 -1.26 -4.94 121.20 120.64 1c87 s ILE 67 Ca 0.48 -0.73 -0.22 0.00 -1.41 0.00 0.00 60.65 58.77 1c87 s ILE 67 Cb -0.20 -0.52 0.01 0.00 0.13 0.00 0.00 42.46 41.89 1c87 s ILE 67 CO 0.25 -0.17 1.72 0.21 -1.91 0.00 0.00 174.94 175.04 1c87 s ASN 68 N -0.97 6.07 -0.05 4.50 3.84 -1.26 -4.58 114.94 122.49 1c87 s ASN 68 Ca -0.05 -1.65 -0.26 0.00 0.21 0.00 0.00 52.86 51.11 1c87 s ASN 68 Cb -0.07 -2.57 0.06 0.00 -0.55 0.00 0.00 41.25 38.12 1c87 s ASN 68 CO 0.00 -1.93 0.58 0.00 -2.79 0.00 0.00 177.10 172.95 1c87 s ALA 69 N 6.84 -1.49 0.03 1.71 0.00 -1.26 -2.61 121.76 124.99 1c87 s ALA 69 Ca 0.57 1.08 0.04 0.00 0.00 0.00 0.00 51.96 53.65 1c87 s ALA 69 Cb -0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1c87 s ALA 69 CO 0.02 -0.34 -0.11 -1.12 0.00 0.00 0.00 175.76 174.21 1c87 s SER 70 N -1.12 1.28 -0.36 0.00 0.01 0.14 -0.95 113.70 112.69 1c87 s SER 70 Ca -0.11 -0.43 -0.21 0.00 1.31 0.00 0.00 55.95 56.51 1c87 s SER 70 Cb -0.02 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.16 1c87 s SER 70 CO 0.08 -0.03 0.65 -0.22 0.41 0.00 0.00 173.24 174.12 1c87 s LEU 71 N -1.13 4.25 -0.46 2.44 1.98 -0.29 -0.88 118.68 124.58 1c87 s LEU 71 Ca -0.02 0.16 -0.24 0.00 -2.89 0.00 0.00 54.13 51.14 1c87 s LEU 71 Cb -0.08 -2.81 0.03 0.00 0.66 0.00 0.00 46.19 43.99 1c87 s LEU 71 CO 0.01 -0.61 0.87 -0.63 -1.89 0.00 0.00 176.35 174.10 1c87 s ILE 72 N 2.74 4.54 -0.43 6.68 1.09 0.61 -4.88 121.20 131.56 1c87 s ILE 72 Ca 0.25 0.58 -0.06 0.00 -1.10 0.00 0.00 60.65 60.31 1c87 s ILE 72 Cb -0.14 -4.39 0.11 0.00 -1.06 0.00 0.00 42.46 36.97 1c87 s ILE 72 CO 0.15 -0.80 0.26 -0.75 -0.10 0.00 0.00 174.94 173.70 1c87 s LYS 73 N 3.56 2.32 -0.71 2.79 2.20 -1.26 -1.71 119.74 126.93 1c87 s LYS 73 Ca 0.34 -1.71 -0.20 0.00 -0.36 0.00 0.00 55.97 54.04 1c87 s LYS 73 Cb -0.11 -3.74 0.11 0.00 -1.51 0.00 0.00 37.83 32.58 1c87 s LYS 73 CO 0.24 -1.08 0.89 -1.64 -0.36 0.00 0.00 175.35 173.40 1c87 s MET 74 N 1.28 3.24 0.07 4.03 -1.94 -0.47 -4.93 119.30 120.57 1c87 s MET 74 Ca 0.06 -1.36 -0.29 0.00 -1.71 0.00 0.00 55.69 52.39 1c87 s MET 74 Cb -0.24 -4.42 -0.14 0.00 2.01 0.00 0.00 34.83 32.03 1c87 s MET 74 CO -0.02 -1.67 1.45 1.49 -0.01 0.00 0.00 175.02 176.27 1c87 h GLU 75 N 9.12 -0.81 -0.48 2.03 4.81 -1.96 0.82 114.58 128.12 1c87 h GLU 75 Ca -0.16 0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1c87 h GLU 75 Cb 1.06 0.18 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 1c87 h GLU 75 CO 1.10 -0.54 0.20 1.49 -0.73 0.00 0.00 179.01 180.53 1c87 h GLU 76 N -0.84 0.38 0.00 1.92 4.81 -1.97 -1.80 114.58 117.09 1c87 h GLU 76 Ca -0.06 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 1c87 h GLU 76 Cb 0.72 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 1c87 h GLU 76 CO -0.03 0.25 -0.23 0.00 -0.73 0.00 0.00 179.01 178.27 1c87 h ALA 77 N 1.29 1.13 -5.45 2.92 0.00 -1.93 -3.47 119.26 113.75 1c87 h ALA 77 Ca 0.22 -0.21 -0.32 0.00 0.00 0.00 0.00 54.91 54.60 1c87 h ALA 77 Cb 0.19 -0.04 0.15 0.00 0.00 0.00 0.00 17.79 18.10 1c87 h ALA 77 CO -0.20 0.29 -0.70 1.04 0.00 0.00 0.00 179.25 179.68 1c87 n GLN 78 N -3.56 -6.49 -3.78 0.00 6.02 0.26 -4.86 117.38 104.98 1c87 n GLN 78 Ca -0.01 0.79 -0.13 0.00 -0.01 0.00 0.00 57.00 57.65 1c87 n GLN 78 Cb 0.38 -5.66 -0.12 0.00 1.02 0.00 0.00 30.24 25.86 1c87 n GLN 78 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1c87 s ARG 79 N -5.48 0.26 0.20 -1.09 3.52 -1.08 -4.98 118.95 110.30 1c87 s ARG 79 Ca 0.12 0.35 0.11 0.00 -0.13 0.00 0.00 55.73 56.18 1c87 s ARG 79 Cb -0.05 0.09 -0.04 0.00 -1.56 0.00 0.00 34.95 33.38 1c87 s ARG 79 CO 0.68 -0.05 -0.19 -1.12 -0.81 0.00 0.00 175.30 173.81 1c87 s SER 80 N 0.31 3.73 0.07 -2.12 0.01 -1.26 -1.37 113.70 113.07 1c87 s SER 80 Ca -0.02 -0.78 0.02 0.00 1.31 0.00 0.00 55.95 56.48 1c87 s SER 80 Cb -0.03 -0.42 -0.03 0.00 0.21 0.00 0.00 66.02 65.75 1c87 s SER 80 CO -0.01 0.11 -0.07 -0.31 0.41 0.00 0.00 173.24 173.36 1c87 s TYR 81 N -1.76 0.79 -0.28 2.43 1.51 -0.70 -4.02 117.35 115.33 1c87 s TYR 81 Ca 0.23 -0.71 -0.13 0.00 -1.01 0.00 0.00 57.07 55.45 1c87 s TYR 81 Cb -0.08 -0.47 -0.04 0.00 -0.11 0.00 0.00 41.96 41.26 1c87 s TYR 81 CO 0.12 -0.11 0.26 0.42 -1.11 0.00 0.00 175.55 175.13 1c87 s ILE 82 N -2.52 5.26 -0.14 2.71 1.01 0.07 -0.28 121.20 127.31 1c87 s ILE 82 Ca 0.01 0.26 -0.06 0.00 0.00 0.00 0.00 60.65 60.86 1c87 s ILE 82 Cb -0.02 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 1c87 s ILE 82 CO -0.02 0.18 0.09 -0.76 0.00 0.00 0.00 174.94 174.43 1c87 s LEU 83 N 1.87 4.03 0.08 2.97 1.02 -0.06 -0.45 118.68 128.14 1c87 s LEU 83 Ca 0.10 0.26 -0.08 0.00 0.02 0.00 0.00 54.13 54.43 1c87 s LEU 83 Cb -0.16 -1.99 -0.01 0.00 0.02 0.00 0.00 46.19 44.06 1c87 s LEU 83 CO 0.11 0.31 0.16 0.28 0.02 0.00 0.00 176.35 177.23 1c87 s THR 84 N -0.46 0.15 0.89 5.49 -1.32 -1.02 -0.68 115.64 118.69 1c87 s THR 84 Ca 0.11 -1.22 -0.12 0.00 -1.21 0.00 0.00 61.69 59.24 1c87 s THR 84 Cb -0.12 -1.30 0.13 0.00 -1.51 0.00 0.00 72.50 69.69 1c87 s THR 84 CO 0.02 -0.68 1.14 0.00 -2.21 0.00 0.00 174.62 172.89 1c87 s GLN 85 N -3.70 1.31 0.11 7.08 -2.07 -1.07 -3.12 119.66 118.21 1c87 s GLN 85 Ca 0.04 0.31 -0.31 0.00 -1.82 0.00 0.00 55.36 53.58 1c87 s GLN 85 Cb 0.04 -1.86 -0.10 0.00 -1.09 0.00 0.00 33.01 30.01 1c87 s GLN 85 CO -0.10 -2.08 1.83 0.20 -1.32 0.00 0.00 175.29 173.82 1c87 s GLY 86 N -4.07 1.36 0.22 2.60 0.00 0.17 -4.86 107.32 102.74 1c87 s GLY 86 Ca 0.63 1.43 -0.31 0.00 0.00 0.00 0.00 44.72 46.47 1c87 s GLY 86 CO 0.53 3.16 1.22 -1.05 0.00 0.00 0.00 173.10 176.96 1c87 n PRO 87 N 5.82 1.53 -1.77 2.90 -0.02 -1.26 -4.66 135.00 137.54 1c87 n PRO 87 Ca 0.18 0.54 -0.30 0.00 -2.02 0.00 0.00 63.50 61.90 1c87 n PRO 87 Cb 0.38 -2.07 0.05 0.00 -0.02 0.00 0.00 33.50 31.84 1c87 n PRO 87 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1c87 s LEU 88 N 0.36 2.92 0.56 2.45 2.01 -1.26 -0.04 118.68 125.68 1c87 s LEU 88 Ca 0.68 1.28 0.25 0.00 0.01 0.00 0.00 54.13 56.36 1c87 s LEU 88 Cb -0.74 -4.09 1.55 0.00 0.01 0.00 0.00 46.19 42.91 1c87 s LEU 88 CO 0.53 -1.42 2.11 -0.65 1.01 0.00 0.00 176.35 177.94 1c87 h PRO 89 N -0.70 0.00 -0.02 1.29 0.11 -1.96 -1.84 132.00 128.88 1c87 h PRO 89 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1c87 h PRO 89 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1c87 h PRO 89 CO 0.62 0.00 -0.05 0.27 -0.21 0.00 0.00 178.00 178.62 1c87 n ASN 90 N -4.07 1.60 -0.07 -2.05 6.94 -1.26 -4.18 115.26 112.17 1c87 n ASN 90 Ca 0.01 -1.46 0.04 0.00 -0.02 0.00 0.00 54.58 53.15 1c87 n ASN 90 Cb 0.29 0.03 0.05 0.00 -2.36 0.00 0.00 39.78 37.80 1c87 n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1c87 n THR 91 N 0.17 1.13 0.19 5.53 -2.24 -0.70 -4.66 114.28 113.69 1c87 n THR 91 Ca 0.17 -1.26 0.04 0.00 -2.27 0.00 0.00 64.05 60.73 1c87 n THR 91 Cb 0.38 0.29 0.37 0.00 -2.10 0.00 0.00 70.33 69.28 1c87 n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c87 h GLY 93 N 1.38 0.89 0.98 0.00 0.00 -1.89 -1.92 103.07 102.51 1c87 h GLY 93 Ca -0.00 -1.02 -0.00 0.00 0.00 0.00 0.00 47.33 46.31 1c87 h GLY 93 CO 0.05 0.91 0.23 0.45 0.00 0.00 0.00 176.54 178.18 1c87 h HIS 94 N 0.63 0.50 -0.26 5.60 3.86 -1.81 -0.79 115.15 122.88 1c87 h HIS 94 Ca 0.02 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.27 1c87 h HIS 94 Cb 1.12 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 29.38 1c87 h HIS 94 CO 0.06 0.36 -0.00 0.35 0.86 0.00 0.00 177.93 179.56 1c87 h PHE 95 N 0.50 -0.02 0.00 2.45 3.04 -0.87 0.82 116.94 122.86 1c87 h PHE 95 Ca 0.14 0.02 -0.10 0.00 3.98 0.00 0.00 57.97 62.01 1c87 h PHE 95 Cb 0.01 0.05 -0.01 0.00 2.56 0.00 0.00 35.95 38.55 1c87 h PHE 95 CO -0.04 -0.05 -0.48 -1.49 -2.02 0.00 0.00 178.31 174.24 1c87 h TRP 96 N 0.07 0.00 -0.42 0.41 4.06 -1.24 -1.81 115.95 117.03 1c87 h TRP 96 Ca 0.13 0.00 0.02 0.00 2.06 0.00 0.00 58.89 61.09 1c87 h TRP 96 Cb 0.16 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.30 1c87 h TRP 96 CO -0.21 0.48 0.25 1.49 -3.56 0.00 0.00 178.44 176.89 1c87 h GLU 97 N 0.00 0.50 -0.35 0.49 4.81 -0.70 -1.04 114.58 118.28 1c87 h GLU 97 Ca -0.00 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.26 1c87 h GLU 97 Cb 0.98 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 30.18 1c87 h GLU 97 CO 0.06 0.33 -0.04 1.98 -0.73 0.00 0.00 179.01 180.61 1c87 h MET 98 N 0.51 0.05 -0.97 1.92 4.05 -0.58 0.24 114.93 120.15 1c87 h MET 98 Ca 0.16 -0.00 0.02 0.00 -0.28 0.00 0.00 59.70 59.60 1c87 h MET 98 Cb -0.01 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 30.73 1c87 h MET 98 CO -0.07 0.03 0.64 0.28 0.23 0.00 0.00 176.91 178.02 1c87 h VAL 99 N 0.05 1.20 0.27 -5.77 2.07 -0.81 -0.33 116.25 112.93 1c87 h VAL 99 Ca 0.17 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1c87 h VAL 99 Cb 0.25 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.85 1c87 h VAL 99 CO -0.32 0.23 -0.13 -0.25 0.02 0.00 0.00 177.57 177.12 1c87 h TRP 100 N 1.26 -0.33 -0.42 1.57 2.91 -0.46 -1.96 115.95 118.52 1c87 h TRP 100 Ca 0.37 -0.01 -0.09 0.00 1.13 0.00 0.00 58.89 60.29 1c87 h TRP 100 Cb -0.07 0.11 -0.01 0.00 -0.51 0.00 0.00 29.16 28.68 1c87 h TRP 100 CO -0.00 -0.03 -0.10 0.93 -1.03 0.00 0.00 178.44 178.21 1c87 h GLU 101 N -0.64 0.81 0.00 2.65 5.08 -0.36 -2.61 114.58 119.51 1c87 h GLU 101 Ca -0.04 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1c87 h GLU 101 Cb 0.45 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1c87 h GLU 101 CO 0.06 0.93 0.00 1.04 -1.00 0.00 0.00 179.01 180.04 1c87 n GLN 102 N -4.31 0.00 -2.67 2.33 1.13 -0.15 -4.95 117.38 108.77 1c87 n GLN 102 Ca -0.01 0.13 -0.17 0.00 -1.94 0.00 0.00 57.00 55.01 1c87 n GLN 102 Cb 0.37 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 29.23 1c87 n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1c87 n LYS 103 N -1.50 -2.99 -2.53 -1.09 5.02 -0.79 -4.02 118.16 110.26 1c87 n LYS 103 Ca 0.05 0.74 -0.36 0.00 -2.02 0.00 0.00 58.31 56.73 1c87 n LYS 103 Cb 0.25 -5.18 -0.04 0.00 -0.02 0.00 0.00 35.03 30.04 1c87 n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1c87 s SER 104 N -2.60 6.61 -0.08 4.39 0.01 -0.89 0.13 113.70 121.28 1c87 s SER 104 Ca 0.16 2.01 0.21 0.00 1.31 0.00 0.00 55.95 59.64 1c87 s SER 104 Cb -0.07 -2.58 -0.30 0.00 0.21 0.00 0.00 66.02 63.28 1c87 s SER 104 CO 0.19 -0.59 0.37 -1.14 0.41 0.00 0.00 173.24 172.47 1c87 n ARG 105 N -0.36 0.67 -4.22 12.44 0.00 -1.26 -4.88 116.66 119.06 1c87 n ARG 105 Ca 0.06 -0.13 -0.19 0.00 -0.00 0.00 0.00 57.85 57.59 1c87 n ARG 105 Cb 0.50 -1.53 -0.12 0.00 0.00 0.00 0.00 32.46 31.31 1c87 n ARG 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1c87 s GLY 106 N -4.83 0.89 -0.09 5.14 0.00 -1.26 -1.34 107.32 105.83 1c87 s GLY 106 Ca -0.08 -1.00 -0.00 0.00 0.00 0.00 0.00 44.72 43.63 1c87 s GLY 106 CO 0.88 -1.01 -0.05 0.14 0.00 0.00 0.00 173.10 173.06 1c87 s VAL 107 N -1.19 0.73 -0.31 1.40 1.01 0.22 -1.78 120.40 120.48 1c87 s VAL 107 Ca -0.01 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.79 1c87 s VAL 107 Cb -0.10 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.51 1c87 s VAL 107 CO 0.02 0.31 0.08 -0.69 0.00 0.00 0.00 175.10 174.83 1c87 s VAL 108 N 1.67 3.87 -0.22 2.92 1.01 0.66 -0.96 120.40 129.35 1c87 s VAL 108 Ca 0.02 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.10 1c87 s VAL 108 Cb -0.13 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 1c87 s VAL 108 CO -0.06 -0.01 -0.02 -0.32 0.00 0.00 0.00 175.10 174.69 1c87 s MET 109 N 1.46 3.45 0.00 2.72 0.00 -0.53 0.20 119.30 126.61 1c87 s MET 109 Ca 0.01 -0.59 0.19 0.00 0.00 0.00 0.00 55.69 55.30 1c87 s MET 109 Cb -0.18 -3.06 0.31 0.00 0.00 0.00 0.00 34.83 31.90 1c87 s MET 109 CO 0.02 -0.16 1.25 1.28 0.00 0.00 0.00 175.02 177.42 1c87 n LEU 110 N 4.71 3.02 -4.50 4.11 4.77 -0.13 -1.32 117.00 127.67 1c87 n LEU 110 Ca -0.18 -1.41 -0.24 0.00 -0.03 0.00 0.00 56.01 54.15 1c87 n LEU 110 Cb 0.51 -0.17 -0.11 0.00 -2.33 0.00 0.00 43.42 41.33 1c87 n LEU 110 CO 0.30 0.64 -0.34 0.54 -1.33 0.00 0.00 177.39 177.19 1c87 s ASN 111 N -1.36 3.19 0.22 -1.43 2.20 -1.25 -4.49 114.94 112.03 1c87 s ASN 111 Ca 0.30 -1.26 0.03 0.00 -0.94 0.00 0.00 52.86 50.99 1c87 s ASN 111 Cb 0.18 -0.25 -0.03 0.00 -2.00 0.00 0.00 41.25 39.15 1c87 s ASN 111 CO 0.26 -0.37 0.36 -0.13 -2.94 0.00 0.00 177.10 174.28 1c87 s ARG 112 N -3.72 3.45 0.14 3.55 0.52 -1.26 -4.83 118.95 116.80 1c87 s ARG 112 Ca 0.33 -0.64 -0.20 0.00 -0.52 0.00 0.00 55.73 54.70 1c87 s ARG 112 Cb 0.05 -2.88 0.00 0.00 0.52 0.00 0.00 34.95 32.64 1c87 s ARG 112 CO 0.15 0.42 1.69 0.28 0.02 0.00 0.00 175.30 177.86 1c87 h VAL 113 N 1.28 0.71 -3.74 3.52 2.07 -1.93 -3.39 116.25 114.78 1c87 h VAL 113 Ca -0.51 0.00 -0.63 0.00 0.82 0.00 0.00 66.70 66.38 1c87 h VAL 113 Cb 1.22 0.71 -0.16 0.00 -1.52 0.00 0.00 31.29 31.54 1c87 h VAL 113 CO 0.64 0.00 -0.52 -0.32 0.02 0.00 0.00 177.57 177.39 1c87 s MET 114 N -6.20 3.99 -0.08 1.57 -2.45 -1.26 0.17 119.30 115.04 1c87 s MET 114 Ca -0.14 -0.31 -0.07 0.00 -1.25 0.00 0.00 55.69 53.93 1c87 s MET 114 Cb 0.11 -3.58 0.02 0.00 1.25 0.00 0.00 34.83 32.64 1c87 s MET 114 CO 0.69 -0.07 0.22 -1.21 1.05 0.00 0.00 175.02 175.70 1c87 s GLU 115 N 1.42 0.24 -1.51 4.11 2.02 0.90 -4.89 118.70 120.99 1c87 s GLU 115 Ca 0.07 0.33 -0.12 0.00 0.02 0.00 0.00 54.97 55.27 1c87 s GLU 115 Cb -0.15 0.08 0.08 0.00 0.10 0.00 0.00 34.13 34.24 1c87 s GLU 115 CO 0.08 -0.05 0.90 1.63 0.02 0.00 0.00 175.26 177.83 1c87 n LYS 116 N 3.15 -5.11 -0.25 1.61 5.02 -1.26 -1.38 118.16 119.94 1c87 n LYS 116 Ca -0.15 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 1c87 n LYS 116 Cb 0.58 -5.36 0.00 0.00 -0.02 0.00 0.00 35.03 30.23 1c87 n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c87 n GLY 117 N -1.66 1.83 3.45 0.72 0.00 -1.26 -4.98 105.19 103.28 1c87 n GLY 117 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1c87 n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c87 s SER 118 N -3.35 3.46 -0.80 1.61 0.01 -0.48 -5.09 113.70 109.05 1c87 s SER 118 Ca 0.00 -1.01 -0.23 0.00 1.31 0.00 0.00 55.95 56.02 1c87 s SER 118 Cb 0.00 -0.28 0.07 0.00 0.21 0.00 0.00 66.02 66.02 1c87 s SER 118 CO 0.00 0.02 1.17 -0.76 0.41 0.00 0.00 173.24 174.09 1c87 s LEU 119 N -3.41 4.03 0.08 2.44 1.43 -1.26 -0.07 118.68 121.91 1c87 s LEU 119 Ca 0.28 -1.15 0.28 0.00 -1.03 0.00 0.00 54.13 52.51 1c87 s LEU 119 Cb -0.05 -2.48 1.07 0.00 0.03 0.00 0.00 46.19 44.76 1c87 s LEU 119 CO 0.14 -1.48 1.87 0.29 0.23 0.00 0.00 176.35 177.39 1c87 n LYS 120 N 8.15 0.10 -3.61 1.70 4.76 0.13 -4.90 118.16 124.48 1c87 n LYS 120 Ca 0.11 0.08 -0.10 0.00 -2.87 0.00 0.00 58.31 55.53 1c87 n LYS 120 Cb 0.48 -1.62 -0.06 0.00 -1.84 0.00 0.00 35.03 31.99 1c87 n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1c87 s ALA 122 N -0.39 2.59 -1.13 0.00 0.00 0.94 -4.74 121.76 119.03 1c87 s ALA 122 Ca 0.01 0.40 -0.21 0.00 0.00 0.00 0.00 51.96 52.16 1c87 s ALA 122 Cb -0.03 -3.26 0.06 0.00 0.00 0.00 0.00 23.12 19.89 1c87 s ALA 122 CO -0.03 -1.11 1.56 -1.14 0.00 0.00 0.00 175.76 175.05 1c87 s GLN 123 N -4.28 3.75 0.00 0.00 2.00 -1.26 -4.80 119.66 115.08 1c87 s GLN 123 Ca 0.64 -1.49 0.26 0.00 -2.00 0.00 0.00 55.36 52.77 1c87 s GLN 123 Cb -0.17 -5.43 0.58 0.00 0.80 0.00 0.00 33.01 28.78 1c87 s GLN 123 CO 0.42 -2.22 1.47 2.48 -0.50 0.00 0.00 175.29 176.94 1c87 n TYR 124 N 8.66 0.00 -4.30 1.67 0.18 -1.26 -4.87 117.16 117.24 1c87 n TYR 124 Ca 0.39 0.00 -0.22 0.00 1.88 0.00 0.00 57.90 59.96 1c87 n TYR 124 Cb 0.49 -0.02 -0.13 0.00 -0.38 0.00 0.00 39.34 39.30 1c87 n TYR 124 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 1c87 s TRP 125 N -2.18 1.50 0.13 -3.48 -2.14 -1.26 -5.04 118.94 106.47 1c87 s TRP 125 Ca 0.29 -0.42 -0.31 0.00 2.66 0.00 0.00 56.10 58.32 1c87 s TRP 125 Cb 0.20 -0.85 -0.09 0.00 -3.10 0.00 0.00 33.47 29.63 1c87 s TRP 125 CO 0.40 0.11 1.59 -1.25 -2.66 0.00 0.00 176.95 175.14 1c87 s PRO 126 N -1.64 4.21 0.00 3.25 0.04 -1.26 -4.94 135.00 134.67 1c87 s PRO 126 Ca 0.03 2.34 0.29 0.00 0.04 0.00 0.00 61.00 63.69 1c87 s PRO 126 Cb -0.10 -3.31 1.26 0.00 0.04 0.00 0.00 34.50 32.39 1c87 s PRO 126 CO 0.03 -0.64 1.92 1.04 0.04 0.00 0.00 177.00 179.39 1c87 n GLN 127 N 4.53 0.12 -3.84 4.56 6.02 -1.26 -4.60 117.38 122.91 1c87 n GLN 127 Ca 0.14 -0.01 -0.11 0.00 -0.01 0.00 0.00 57.00 57.01 1c87 n GLN 127 Cb 0.39 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.06 1c87 n GLN 127 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 1c87 s LYS 128 N -2.88 0.61 0.11 -1.09 -2.85 -1.26 -5.07 119.74 107.31 1c87 s LYS 128 Ca 0.18 -0.47 -0.31 0.00 -1.00 0.00 0.00 55.97 54.37 1c87 s LYS 128 Cb 0.19 0.26 -0.11 0.00 -2.06 0.00 0.00 37.83 36.11 1c87 s LYS 128 CO 0.52 -0.17 1.60 0.93 0.10 0.00 0.00 175.35 178.34 1c87 h GLU 129 N 3.82 -0.66 -0.06 1.78 3.07 -1.90 -2.32 114.58 118.32 1c87 h GLU 129 Ca -0.31 0.04 0.02 0.00 -0.50 0.00 0.00 59.36 58.61 1c87 h GLU 129 Cb 1.19 0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 29.25 1c87 h GLU 129 CO 0.44 -0.44 0.31 0.93 -1.40 0.00 0.00 179.01 178.85 1c87 h GLU 130 N -0.68 0.00 -2.75 2.33 3.07 -1.98 -3.33 114.58 111.24 1c87 h GLU 130 Ca 0.00 0.00 -0.63 0.00 -0.50 0.00 0.00 59.36 58.24 1c87 h GLU 130 Cb 0.67 0.00 -0.41 0.00 -0.84 0.00 0.00 28.75 28.17 1c87 h GLU 130 CO -0.16 0.00 -0.47 1.63 -1.40 0.00 0.00 179.01 178.60 1c87 n LYS 131 N -3.05 2.31 -0.67 2.33 5.02 -0.87 -5.10 118.16 118.13 1c87 n LYS 131 Ca -0.01 -4.57 -0.31 0.00 -2.02 0.00 0.00 58.31 51.40 1c87 n LYS 131 Cb 0.37 -2.30 0.17 0.00 -0.02 0.00 0.00 35.03 33.25 1c87 n LYS 131 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1c87 n GLU 132 N 1.52 -0.84 -4.37 1.97 4.71 -1.25 -4.62 120.64 117.77 1c87 n GLU 132 Ca 0.24 -0.19 -0.34 0.00 -0.01 0.00 0.00 57.16 56.86 1c87 n GLU 132 Cb 0.37 -2.15 -0.11 0.00 -1.01 0.00 0.00 31.44 28.55 1c87 n GLU 132 CO 0.00 0.00 0.00 -1.64 0.09 0.00 0.00 177.13 175.58 1c87 s MET 133 N -4.23 3.53 -0.12 3.49 -1.94 -0.21 -4.98 119.30 114.84 1c87 s MET 133 Ca 0.64 -0.48 -0.02 0.00 -1.71 0.00 0.00 55.69 54.11 1c87 s MET 133 Cb -0.22 -2.91 -0.03 0.00 2.01 0.00 0.00 34.83 33.69 1c87 s MET 133 CO 0.62 0.35 -0.04 0.42 -0.01 0.00 0.00 175.02 176.36 1c87 s ILE 134 N 0.08 3.87 -0.46 2.53 1.09 -1.26 -0.47 121.20 126.57 1c87 s ILE 134 Ca 0.01 -0.38 -0.05 0.00 -1.10 0.00 0.00 60.65 59.12 1c87 s ILE 134 Cb -0.13 -2.66 0.12 0.00 -1.06 0.00 0.00 42.46 38.73 1c87 s ILE 134 CO 0.02 0.53 0.29 -0.36 -0.10 0.00 0.00 174.94 175.33 1c87 s PHE 135 N -0.08 3.52 0.27 3.97 0.08 0.36 -4.96 117.98 121.14 1c87 s PHE 135 Ca 0.02 -2.30 0.03 0.00 0.12 0.00 0.00 56.93 54.80 1c87 s PHE 135 Cb -0.13 -3.31 0.39 0.00 -0.57 0.00 0.00 43.02 39.39 1c87 s PHE 135 CO 0.03 -0.96 1.68 0.93 -0.10 0.00 0.00 175.22 176.80 1c87 h GLU 136 N 8.01 0.39 -0.35 0.44 5.08 -1.96 0.40 114.58 126.59 1c87 h GLU 136 Ca -0.13 -0.17 0.02 0.00 -1.00 0.00 0.00 59.36 58.08 1c87 h GLU 136 Cb 1.04 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 1c87 h GLU 136 CO 0.75 0.70 0.18 0.38 -1.00 0.00 0.00 179.01 180.02 1c87 h ASP 137 N 0.33 0.27 -0.38 1.42 2.03 -1.96 -2.59 116.42 115.55 1c87 h ASP 137 Ca 0.04 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.35 1c87 h ASP 137 Cb 0.78 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.25 1c87 h ASP 137 CO 0.06 0.20 0.00 0.35 -1.03 0.00 0.00 179.24 178.82 1c87 n THR 138 N -4.93 1.23 -3.42 1.15 -2.24 -1.18 -4.99 114.28 99.91 1c87 n THR 138 Ca 0.00 -1.14 -0.17 0.00 -2.27 0.00 0.00 64.05 60.47 1c87 n THR 138 Cb 0.08 0.37 0.08 0.00 -2.10 0.00 0.00 70.33 68.75 1c87 n THR 138 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1c87 n ASN 139 N 0.47 -3.41 -4.19 3.42 5.15 0.13 -4.96 115.26 111.87 1c87 n ASN 139 Ca 0.15 -0.69 -0.20 0.00 -0.60 0.00 0.00 54.58 53.24 1c87 n ASN 139 Cb 0.53 -4.96 -0.12 0.00 -0.53 0.00 0.00 39.78 34.70 1c87 n ASN 139 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1c87 s LEU 140 N -6.12 2.26 0.05 1.20 2.01 -0.58 -2.54 118.68 114.96 1c87 s LEU 140 Ca 0.15 -0.59 0.08 0.00 0.01 0.00 0.00 54.13 53.77 1c87 s LEU 140 Cb -0.02 -0.62 -0.03 0.00 0.01 0.00 0.00 46.19 45.53 1c87 s LEU 140 CO 0.75 -0.02 -0.21 -0.75 1.01 0.00 0.00 176.35 177.12 1c87 s LYS 141 N -1.63 1.43 -0.02 1.70 2.20 0.25 -0.49 119.74 123.18 1c87 s LYS 141 Ca 0.01 -0.97 0.00 0.00 -0.36 0.00 0.00 55.97 54.64 1c87 s LYS 141 Cb -0.10 -1.56 0.03 0.00 -1.51 0.00 0.00 37.83 34.69 1c87 s LYS 141 CO 0.02 0.40 0.02 -1.17 -0.36 0.00 0.00 175.35 174.26 1c87 s LEU 142 N -1.21 1.10 -0.05 5.43 2.96 0.38 0.07 118.68 127.36 1c87 s LEU 142 Ca 0.08 0.02 0.03 0.00 -0.22 0.00 0.00 54.13 54.04 1c87 s LEU 142 Cb -0.09 -0.11 0.01 0.00 0.50 0.00 0.00 46.19 46.49 1c87 s LEU 142 CO 0.02 -0.12 -0.13 -0.89 -1.32 0.00 0.00 176.35 173.91 1c87 s THR 143 N 1.07 1.11 0.07 3.68 2.01 0.09 -1.05 115.64 122.62 1c87 s THR 143 Ca -0.09 -0.51 -0.31 0.00 0.31 0.00 0.00 61.69 61.09 1c87 s THR 143 Cb -0.13 -0.99 -0.08 0.00 0.01 0.00 0.00 72.50 71.31 1c87 s THR 143 CO -0.03 0.34 1.66 -0.22 -0.69 0.00 0.00 174.62 175.68 1c87 s LEU 144 N 0.33 4.37 -0.24 4.42 2.96 -1.26 -0.14 118.68 129.11 1c87 s LEU 144 Ca -0.08 2.49 0.02 0.00 -0.22 0.00 0.00 54.13 56.34 1c87 s LEU 144 Cb -0.12 -3.56 -0.19 0.00 0.50 0.00 0.00 46.19 42.82 1c87 s LEU 144 CO 0.02 -0.89 -0.14 -0.38 -1.32 0.00 0.00 176.35 173.64 1c87 n ILE 145 N 4.75 1.52 -3.65 6.68 2.08 0.12 -4.39 119.36 126.47 1c87 n ILE 145 Ca 0.16 -0.60 0.01 0.00 0.56 0.00 0.00 62.75 62.88 1c87 n ILE 145 Cb 0.40 -1.39 -0.00 0.00 -0.75 0.00 0.00 39.64 37.91 1c87 n ILE 145 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1c87 s SER 146 N -6.50 -0.06 0.11 4.38 1.04 -1.07 -4.98 113.70 106.62 1c87 s SER 146 Ca -0.32 -0.16 -0.02 0.00 0.48 0.00 0.00 55.95 55.93 1c87 s SER 146 Cb 0.09 0.19 -0.04 0.00 0.10 0.00 0.00 66.02 66.36 1c87 s SER 146 CO 0.64 -0.35 0.06 -1.83 0.98 0.00 0.00 173.24 172.73 1c87 s GLU 147 N -2.47 0.85 -0.31 4.02 -1.05 -1.26 -0.67 118.70 117.81 1c87 s GLU 147 Ca 0.15 -1.33 -0.01 0.00 -0.15 0.00 0.00 54.97 53.63 1c87 s GLU 147 Cb 0.04 0.25 0.10 0.00 -0.44 0.00 0.00 34.13 34.08 1c87 s GLU 147 CO -0.03 -0.23 0.12 0.34 0.95 0.00 0.00 175.26 176.41 1c87 s ASP 148 N -2.99 3.82 -0.27 0.83 2.15 0.20 -4.96 116.67 115.44 1c87 s ASP 148 Ca 0.17 -1.63 -0.21 0.00 0.43 0.00 0.00 52.55 51.32 1c87 s ASP 148 Cb 0.07 -0.71 -0.02 0.00 -0.30 0.00 0.00 42.92 41.97 1c87 s ASP 148 CO -0.03 -0.41 0.64 -0.63 -0.17 0.00 0.00 175.17 174.58 1c87 s ILE 149 N 1.65 4.96 0.47 4.11 1.01 -1.26 -1.00 121.20 131.14 1c87 s ILE 149 Ca 0.10 1.08 0.07 0.00 0.00 0.00 0.00 60.65 61.90 1c87 s ILE 149 Cb -0.18 -3.96 -0.00 0.00 0.01 0.00 0.00 42.46 38.33 1c87 s ILE 149 CO -0.26 -0.03 0.35 -0.54 0.00 0.00 0.00 174.94 174.46 1c87 s LYS 150 N 2.56 2.34 0.33 2.79 -0.14 0.20 -4.99 119.74 122.84 1c87 s LYS 150 Ca 0.26 -1.82 0.06 0.00 -1.36 0.00 0.00 55.97 53.11 1c87 s LYS 150 Cb -0.15 -2.17 0.60 0.00 -1.68 0.00 0.00 37.83 34.43 1c87 s LYS 150 CO 0.09 -0.37 1.83 1.79 -0.76 0.00 0.00 175.35 177.94 1c87 h THR 151 N 0.98 1.22 -0.01 2.17 1.35 -0.28 -3.22 112.91 115.13 1c87 h THR 151 Ca -0.40 -0.97 0.00 0.00 -0.55 0.00 0.00 66.41 64.49 1c87 h THR 151 Cb 1.28 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1c87 h THR 151 CO 0.60 0.31 -0.13 0.00 -0.25 0.00 0.00 175.52 176.05 1c87 n TYR 152 N -4.21 0.00 -3.51 4.73 0.18 -1.26 -4.98 117.16 108.10 1c87 n TYR 152 Ca 0.00 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.67 1c87 n TYR 152 Cb 0.31 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.24 1c87 n TYR 152 CO 0.00 0.00 0.00 1.52 -2.08 0.00 0.00 176.86 176.30 1c87 s TYR 153 N -1.06 -0.42 0.01 -3.48 -0.85 -1.22 -0.49 117.35 109.84 1c87 s TYR 153 Ca 0.07 0.47 0.02 0.00 -0.52 0.00 0.00 57.07 57.11 1c87 s TYR 153 Cb 0.06 0.50 -0.01 0.00 0.38 0.00 0.00 41.96 42.89 1c87 s TYR 153 CO 0.18 -0.54 -0.07 0.99 -1.52 0.00 0.00 175.55 174.58 1c87 s THR 154 N -2.42 0.55 -0.18 -3.49 2.01 -0.63 0.60 115.64 112.09 1c87 s THR 154 Ca 0.00 -0.46 -0.03 0.00 0.31 0.00 0.00 61.69 61.52 1c87 s THR 154 Cb -0.01 -0.49 -0.02 0.00 0.01 0.00 0.00 72.50 71.99 1c87 s THR 154 CO -0.04 0.05 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.19 1c87 s VAL 155 N -0.40 3.51 0.05 3.82 1.01 -0.17 -1.13 120.40 127.10 1c87 s VAL 155 Ca 0.00 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.55 1c87 s VAL 155 Cb -0.04 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 1c87 s VAL 155 CO -0.00 0.47 -0.04 -0.13 0.00 0.00 0.00 175.10 175.40 1c87 s ARG 156 N 0.83 2.50 -0.18 2.72 0.52 -0.24 0.59 118.95 125.69 1c87 s ARG 156 Ca -0.02 -0.80 -0.06 0.00 -0.52 0.00 0.00 55.73 54.34 1c87 s ARG 156 Cb -0.15 -2.50 -0.03 0.00 0.52 0.00 0.00 34.95 32.79 1c87 s ARG 156 CO 0.01 0.57 0.01 -1.14 0.02 0.00 0.00 175.30 174.77 1c87 s GLN 157 N -1.89 3.77 0.03 3.54 0.74 0.16 -0.93 119.66 125.08 1c87 s GLN 157 Ca 0.21 -0.45 0.08 0.00 0.05 0.00 0.00 55.36 55.24 1c87 s GLN 157 Cb -0.11 -3.09 -0.03 0.00 1.10 0.00 0.00 33.01 30.88 1c87 s GLN 157 CO 0.13 0.17 -0.21 -0.51 -0.55 0.00 0.00 175.29 174.32 1c87 s LEU 158 N 0.60 2.45 -0.19 3.68 1.02 -0.04 0.12 118.68 126.31 1c87 s LEU 158 Ca 0.00 -0.46 -0.05 0.00 0.02 0.00 0.00 54.13 53.64 1c87 s LEU 158 Cb -0.14 -1.44 -0.03 0.00 0.02 0.00 0.00 46.19 44.61 1c87 s LEU 158 CO 0.02 0.27 0.00 -0.70 0.02 0.00 0.00 176.35 175.96 1c87 s GLU 159 N -1.28 3.65 -0.19 1.70 2.12 0.80 -1.61 118.70 123.89 1c87 s GLU 159 Ca 0.13 -0.51 -0.06 0.00 0.36 0.00 0.00 54.97 54.90 1c87 s GLU 159 Cb -0.10 -3.07 -0.03 0.00 0.26 0.00 0.00 34.13 31.18 1c87 s GLU 159 CO 0.04 0.05 0.02 -1.17 -0.54 0.00 0.00 175.26 173.66 1c87 s LEU 160 N 0.89 3.45 -0.13 2.70 0.20 -0.31 -0.73 118.68 124.76 1c87 s LEU 160 Ca 0.01 -0.09 0.03 0.00 0.69 0.00 0.00 54.13 54.76 1c87 s LEU 160 Cb -0.14 -1.87 0.00 0.00 -0.43 0.00 0.00 46.19 43.75 1c87 s LEU 160 CO 0.02 0.11 -0.21 -0.70 -0.29 0.00 0.00 176.35 175.28 1c87 s GLU 161 N 0.71 3.07 -0.74 1.98 2.12 0.11 0.31 118.70 126.25 1c87 s GLU 161 Ca 0.01 -0.84 -0.25 0.00 0.36 0.00 0.00 54.97 54.24 1c87 s GLU 161 Cb -0.14 -2.42 0.04 0.00 0.26 0.00 0.00 34.13 31.87 1c87 s GLU 161 CO 0.02 0.07 1.21 1.21 -0.54 0.00 0.00 175.26 177.23 1c87 s ASN 162 N 0.63 6.20 0.36 -1.70 2.47 0.24 -0.58 114.94 122.55 1c87 s ASN 162 Ca -0.11 -0.68 0.08 0.00 0.42 0.00 0.00 52.86 52.57 1c87 s ASN 162 Cb -0.16 -2.52 0.80 0.00 -1.45 0.00 0.00 41.25 37.91 1c87 s ASN 162 CO 0.02 -1.71 1.89 -0.07 -3.72 0.00 0.00 177.10 173.52 1c87 h LEU 163 N 12.56 0.66 -0.75 3.21 4.07 -1.76 0.94 115.31 134.23 1c87 h LEU 163 Ca -0.24 0.03 0.01 0.00 0.08 0.00 0.00 57.88 57.76 1c87 h LEU 163 Cb 1.05 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 42.65 1c87 h LEU 163 CO 1.26 0.36 0.49 0.74 -1.08 0.00 0.00 178.44 180.21 1c87 h THR 164 N 0.71 1.20 -0.21 0.22 2.02 -1.90 -2.46 112.91 112.48 1c87 h THR 164 Ca 0.42 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 67.23 1c87 h THR 164 Cb 0.62 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 1c87 h THR 164 CO -0.18 0.19 0.00 0.35 0.37 0.00 0.00 175.52 176.25 1c87 n THR 165 N -4.55 0.36 -1.35 3.16 -2.24 -0.63 -4.95 114.28 104.08 1c87 n THR 165 Ca 0.07 -0.68 -0.10 0.00 -2.27 0.00 0.00 64.05 61.07 1c87 n THR 165 Cb 0.02 1.06 -0.04 0.00 -2.10 0.00 0.00 70.33 69.27 1c87 n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c87 n GLN 166 N 1.05 -1.28 -2.60 -0.78 6.02 0.32 -4.96 117.38 115.14 1c87 n GLN 166 Ca 0.13 0.57 -0.37 0.00 -0.01 0.00 0.00 57.00 57.32 1c87 n GLN 166 Cb 0.48 -4.78 -0.05 0.00 1.02 0.00 0.00 30.24 26.91 1c87 n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1c87 s GLU 167 N -2.96 4.37 0.18 -1.09 2.12 -1.09 -4.84 118.70 115.38 1c87 s GLU 167 Ca 0.00 1.51 0.09 0.00 0.36 0.00 0.00 54.97 56.93 1c87 s GLU 167 Cb 0.00 -2.73 -0.04 0.00 0.26 0.00 0.00 34.13 31.62 1c87 s GLU 167 CO 0.00 0.04 -0.19 0.95 -0.54 0.00 0.00 175.26 175.52 1c87 s THR 168 N -1.56 1.94 0.05 -1.70 -4.23 -1.26 -0.59 115.64 108.28 1c87 s THR 168 Ca 0.53 -1.99 -0.06 0.00 -1.18 0.00 0.00 61.69 58.99 1c87 s THR 168 Cb -0.23 -1.93 -0.01 0.00 1.34 0.00 0.00 72.50 71.67 1c87 s THR 168 CO 0.29 -0.31 0.10 -0.13 -0.54 0.00 0.00 174.62 174.02 1c87 s ARG 169 N -2.89 0.65 -0.17 3.99 0.52 0.15 -4.97 118.95 116.22 1c87 s ARG 169 Ca 0.18 -0.86 -0.07 0.00 -0.52 0.00 0.00 55.73 54.46 1c87 s ARG 169 Cb -0.06 0.25 -0.04 0.00 0.52 0.00 0.00 34.95 35.63 1c87 s ARG 169 CO 0.08 -0.17 0.08 -2.00 0.02 0.00 0.00 175.30 173.31 1c87 s GLU 170 N -3.06 3.87 -0.11 3.54 2.12 -1.26 -1.16 118.70 122.64 1c87 s GLU 170 Ca -0.01 -0.29 0.00 0.00 0.36 0.00 0.00 54.97 55.03 1c87 s GLU 170 Cb 0.01 -3.22 -0.02 0.00 0.26 0.00 0.00 34.13 31.16 1c87 s GLU 170 CO -0.07 0.38 -0.11 0.42 -0.54 0.00 0.00 175.26 175.35 1c87 s ILE 171 N 0.07 3.26 -0.18 -3.70 -1.09 -0.63 -4.83 121.20 114.10 1c87 s ILE 171 Ca 0.07 -0.61 -0.12 0.00 -2.23 0.00 0.00 60.65 57.75 1c87 s ILE 171 Cb -0.12 -2.35 -0.05 0.00 -1.58 0.00 0.00 42.46 38.36 1c87 s ILE 171 CO 0.00 0.54 0.23 -0.76 -1.23 0.00 0.00 174.94 173.73 1c87 s LEU 172 N -0.04 4.23 -0.22 2.97 1.02 -0.45 -0.86 118.68 125.33 1c87 s LEU 172 Ca -0.02 0.40 -0.02 0.00 0.02 0.00 0.00 54.13 54.51 1c87 s LEU 172 Cb -0.14 -2.26 0.01 0.00 0.02 0.00 0.00 46.19 43.82 1c87 s LEU 172 CO 0.04 0.13 -0.09 -2.28 0.02 0.00 0.00 176.35 174.16 1c87 s HIS 173 N 0.43 2.95 -0.37 0.29 2.46 -0.10 -0.61 115.29 120.34 1c87 s HIS 173 Ca 0.13 -1.38 -0.05 0.00 0.47 0.00 0.00 55.06 54.23 1c87 s HIS 173 Cb -0.12 -2.03 0.07 0.00 -0.13 0.00 0.00 32.58 30.37 1c87 s HIS 173 CO 0.02 -0.69 0.15 -0.06 -2.47 0.00 0.00 174.74 171.69 1c87 s PHE 174 N 1.37 3.37 -0.44 3.88 0.40 -0.13 -1.08 117.98 125.35 1c87 s PHE 174 Ca 0.03 -1.83 -0.10 0.00 -0.60 0.00 0.00 56.93 54.44 1c87 s PHE 174 Cb -0.15 -2.69 0.09 0.00 0.51 0.00 0.00 43.02 40.78 1c87 s PHE 174 CO -0.06 -0.85 0.30 -1.58 0.70 0.00 0.00 175.22 173.73 1c87 s HIS 175 N 1.30 3.36 -0.29 0.36 2.46 -0.28 -1.45 115.29 120.75 1c87 s HIS 175 Ca 0.02 -1.60 -0.29 0.00 0.47 0.00 0.00 55.06 53.66 1c87 s HIS 175 Cb -0.21 -3.18 0.01 0.00 -0.13 0.00 0.00 32.58 29.07 1c87 s HIS 175 CO -0.00 -0.90 1.06 -0.47 -2.47 0.00 0.00 174.74 171.96 1c87 s TYR 176 N 1.42 3.21 -0.61 3.88 6.14 -0.43 -1.60 117.35 129.36 1c87 s TYR 176 Ca 0.04 1.27 0.12 0.00 0.64 0.00 0.00 57.07 59.14 1c87 s TYR 176 Cb -0.24 -3.56 0.37 0.00 0.42 0.00 0.00 41.96 38.95 1c87 s TYR 176 CO 0.01 -0.68 1.30 0.25 0.64 0.00 0.00 175.55 177.08 1c87 n THR 177 N 5.70 1.46 -2.54 4.34 -2.24 0.35 -3.84 114.28 117.51 1c87 n THR 177 Ca 0.12 -1.32 0.02 0.00 -2.27 0.00 0.00 64.05 60.60 1c87 n THR 177 Cb 0.47 0.23 0.02 0.00 -2.10 0.00 0.00 70.33 68.95 1c87 n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1c87 n THR 178 N 0.08 0.29 -3.72 4.28 -2.24 -1.25 -4.86 114.28 106.86 1c87 n THR 178 Ca 0.14 -1.36 -0.38 0.00 -2.27 0.00 0.00 64.05 60.18 1c87 n THR 178 Cb 0.58 1.03 -0.11 0.00 -2.10 0.00 0.00 70.33 69.73 1c87 n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1c87 s TRP 179 N -0.88 3.40 0.31 4.78 -0.11 -1.26 -4.58 118.94 120.60 1c87 s TRP 179 Ca 0.29 -1.87 -0.30 0.00 1.22 0.00 0.00 56.10 55.45 1c87 s TRP 179 Cb 0.34 -2.85 -0.12 0.00 -1.50 0.00 0.00 33.47 29.35 1c87 s TRP 179 CO -0.13 -0.87 1.56 -2.30 -4.62 0.00 0.00 176.95 170.59 1c87 n PRO 180 N 4.76 2.66 -1.63 5.86 -0.02 -1.26 -4.72 135.00 140.64 1c87 n PRO 180 Ca -0.08 0.94 -0.46 0.00 -2.02 0.00 0.00 63.50 61.89 1c87 n PRO 180 Cb 0.43 -2.71 -0.03 0.00 -0.02 0.00 0.00 33.50 31.17 1c87 n PRO 180 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1c87 n ASP 181 N 1.77 2.03 -1.29 2.55 2.03 -1.26 -0.03 116.55 122.35 1c87 n ASP 181 Ca 0.07 1.16 -0.13 0.00 0.52 0.00 0.00 54.79 56.41 1c87 n ASP 181 Cb 0.37 -1.34 -0.05 0.00 -0.72 0.00 0.00 41.12 39.37 1c87 n ASP 181 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1c87 n PHE 182 N 1.21 -0.31 -2.89 -0.67 3.72 -1.26 -4.94 117.46 112.33 1c87 n PHE 182 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 1c87 n PHE 182 Cb 0.30 -2.56 0.00 0.00 -0.94 0.00 0.00 39.48 36.29 1c87 n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1c87 n GLY 183 N -0.18 4.31 3.41 1.37 0.00 0.96 -4.94 105.19 110.12 1c87 n GLY 183 Ca -0.13 -2.09 -0.22 0.00 0.00 0.00 0.00 46.02 43.59 1c87 n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1c87 s VAL 184 N 0.92 2.15 0.69 1.61 -7.23 -1.26 -4.77 120.40 112.51 1c87 s VAL 184 Ca 0.00 -2.26 -0.17 0.00 -1.81 0.00 0.00 61.98 57.74 1c87 s VAL 184 Cb 0.00 -2.15 -0.01 0.00 0.56 0.00 0.00 36.38 34.78 1c87 s VAL 184 CO 0.00 -0.44 0.98 -2.65 -0.31 0.00 0.00 175.10 172.69 1c87 n PRO 185 N -0.37 0.64 -0.33 4.82 -0.02 -1.26 -4.32 135.00 134.16 1c87 n PRO 185 Ca -0.07 0.27 0.18 0.00 -2.02 0.00 0.00 63.50 61.85 1c87 n PRO 185 Cb 0.59 -2.22 0.42 0.00 -0.02 0.00 0.00 33.50 32.27 1c87 n PRO 185 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1c87 h GLU 186 N -0.02 0.55 -2.96 -0.52 3.07 -2.00 -3.44 114.58 109.26 1c87 h GLU 186 Ca -0.48 -0.03 0.01 0.00 -0.50 0.00 0.00 59.36 58.36 1c87 h GLU 186 Cb 1.34 -0.12 -0.10 0.00 -0.84 0.00 0.00 28.75 29.03 1c87 h GLU 186 CO 0.48 0.36 0.23 -1.54 -1.40 0.00 0.00 179.01 177.15 1c87 s SER 187 N -5.34 -0.48 0.35 1.42 1.04 -1.26 -5.01 113.70 104.42 1c87 s SER 187 Ca -0.10 -0.16 0.07 0.00 0.48 0.00 0.00 55.95 56.24 1c87 s SER 187 Cb 0.25 0.62 0.77 0.00 0.10 0.00 0.00 66.02 67.76 1c87 s SER 187 CO 0.80 -1.05 1.89 -0.65 0.98 0.00 0.00 173.24 175.21 1c87 h PRO 188 N 2.00 0.73 -0.25 4.02 0.11 -1.94 -2.15 132.00 134.52 1c87 h PRO 188 Ca -0.30 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.80 1c87 h PRO 188 Cb 1.29 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 1c87 h PRO 188 CO 0.34 0.48 0.06 0.00 -0.21 0.00 0.00 178.00 178.66 1c87 h ALA 189 N 1.59 0.26 0.00 -0.75 0.00 -1.95 0.43 119.26 118.85 1c87 h ALA 189 Ca 0.41 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.24 1c87 h ALA 189 Cb 0.57 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1c87 h ALA 189 CO -0.18 -0.36 -0.62 0.66 0.00 0.00 0.00 179.25 178.75 1c87 h SER 190 N 0.16 0.00 0.04 0.00 4.64 -1.76 0.14 113.55 116.77 1c87 h SER 190 Ca 0.11 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1c87 h SER 190 Cb 0.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1c87 h SER 190 CO -0.14 0.62 -0.07 0.15 -0.87 0.00 0.00 176.83 176.52 1c87 h PHE 191 N 0.00 -0.17 -0.40 4.77 3.57 -1.03 -0.74 116.94 122.94 1c87 h PHE 191 Ca -0.01 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 1c87 h PHE 191 Cb 1.23 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 40.02 1c87 h PHE 191 CO 0.00 -0.11 -0.09 -0.07 -2.23 0.00 0.00 178.31 175.81 1c87 h LEU 192 N -0.14 0.78 -0.17 0.59 3.38 -0.84 0.22 115.31 119.13 1c87 h LEU 192 Ca 0.01 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.67 1c87 h LEU 192 Cb 0.15 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.62 1c87 h LEU 192 CO -0.04 0.96 -0.41 -1.13 0.09 0.00 0.00 178.44 177.91 1c87 h ASN 193 N 0.59 -1.29 -0.62 -0.43 -1.24 -0.70 0.11 115.58 112.01 1c87 h ASN 193 Ca 0.10 0.18 0.04 0.00 0.71 0.00 0.00 56.30 57.33 1c87 h ASN 193 Cb 0.62 0.53 -0.05 0.00 0.73 0.00 0.00 38.32 40.16 1c87 h ASN 193 CO 0.04 -0.41 0.35 0.15 -1.29 0.00 0.00 177.43 176.27 1c87 h PHE 194 N -0.45 0.65 -0.59 0.67 3.57 -0.76 -1.11 116.94 118.92 1c87 h PHE 194 Ca 0.09 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1c87 h PHE 194 Cb 0.61 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 1c87 h PHE 194 CO -0.50 0.34 0.37 1.25 -2.23 0.00 0.00 178.31 177.54 1c87 h LEU 195 N 0.67 0.69 -0.76 0.59 5.85 -0.11 -2.14 115.31 120.10 1c87 h LEU 195 Ca 0.27 -0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.82 1c87 h LEU 195 Cb 0.12 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1c87 h LEU 195 CO -0.15 0.53 -0.48 -0.26 -0.34 0.00 0.00 178.44 177.74 1c87 h PHE 196 N 0.80 0.42 -0.80 1.25 -1.00 -0.62 0.36 116.94 117.34 1c87 h PHE 196 Ca 0.21 -0.13 0.09 0.00 2.81 0.00 0.00 57.97 60.95 1c87 h PHE 196 Cb -0.05 -0.09 -0.07 0.00 3.61 0.00 0.00 35.95 39.35 1c87 h PHE 196 CO -0.03 0.76 0.45 0.87 -1.61 0.00 0.00 178.31 178.75 1c87 h LYS 197 N 0.28 0.75 -0.29 1.51 1.79 -0.76 0.83 116.57 120.67 1c87 h LYS 197 Ca 0.02 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.41 1c87 h LYS 197 Cb 0.94 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.41 1c87 h LYS 197 CO 0.08 0.49 0.05 0.28 -1.08 0.00 0.00 179.45 179.27 1c87 h VAL 198 N 0.77 1.23 -0.34 0.50 2.07 -0.86 -2.91 116.25 116.70 1c87 h VAL 198 Ca 0.38 -0.78 0.03 0.00 0.82 0.00 0.00 66.70 67.14 1c87 h VAL 198 Cb 0.33 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1c87 h VAL 198 CO -0.24 0.26 0.16 0.03 0.02 0.00 0.00 177.57 177.80 1c87 h ARG 199 N 0.30 0.32 -0.91 1.57 3.08 -0.41 -3.05 114.38 115.29 1c87 h ARG 199 Ca 0.09 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.20 1c87 h ARG 199 Cb 0.33 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.24 1c87 h ARG 199 CO 0.00 0.21 0.59 0.93 -1.07 0.00 0.00 179.97 180.64 1c87 h GLU 200 N 0.33 0.93 0.00 0.04 4.39 -0.85 -2.53 114.58 116.89 1c87 h GLU 200 Ca 0.15 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1c87 h GLU 200 Cb 0.07 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.51 1c87 h GLU 200 CO -0.11 0.62 0.00 -1.13 -1.16 0.00 0.00 179.01 177.22 1c87 n SER 201 N -4.52 0.00 0.00 1.42 3.41 -1.10 -4.85 113.62 107.98 1c87 n SER 201 Ca 0.15 0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 1c87 n SER 201 Cb 0.27 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1c87 n SER 201 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c87 n GLY 202 N -0.76 0.79 0.18 5.00 0.00 -0.95 -4.92 105.19 104.53 1c87 n GLY 202 Ca 0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.18 1c87 n GLY 202 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1c87 h SER 203 N 0.00 0.00 -0.30 1.61 0.02 -1.77 -3.09 113.55 110.02 1c87 h SER 203 Ca 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 1c87 h SER 203 Cb 0.02 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1c87 h SER 203 CO 0.00 0.00 0.06 0.18 -1.14 0.00 0.00 176.83 175.93 1c87 n LEU 204 N -2.78 3.47 -4.01 5.07 4.77 -1.26 -4.42 117.00 117.84 1c87 n LEU 204 Ca 0.04 -1.77 -0.31 0.00 -0.03 0.00 0.00 56.01 53.94 1c87 n LEU 204 Cb 0.48 -0.60 -0.15 0.00 -2.33 0.00 0.00 43.42 40.82 1c87 n LEU 204 CO 0.32 0.49 -0.42 -0.94 -1.33 0.00 0.00 177.39 175.51 1c87 s SER 205 N -0.29 4.29 0.00 -1.43 1.04 -1.17 -4.97 113.70 111.17 1c87 s SER 205 Ca 0.25 -1.46 0.00 0.00 0.48 0.00 0.00 55.95 55.22 1c87 s SER 205 Cb 0.20 -1.41 0.00 0.00 0.10 0.00 0.00 66.02 64.90 1c87 s SER 205 CO 0.07 -0.25 0.57 -0.81 0.98 0.00 0.00 173.24 173.80 1c87 n PRO 206 N 4.50 0.00 0.30 4.02 -0.04 -1.26 -2.34 135.00 140.18 1c87 n PRO 206 Ca -0.10 0.15 0.17 0.00 -0.04 0.00 0.00 63.50 63.68 1c87 n PRO 206 Cb 0.43 -1.73 0.92 0.00 -0.04 0.00 0.00 33.50 33.09 1c87 n PRO 206 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1c87 h GLU 207 N 0.00 0.00 -6.76 0.54 9.09 -1.95 -3.45 114.58 112.06 1c87 h GLU 207 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 59.36 58.95 1c87 h GLU 207 Cb 0.45 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.58 1c87 h GLU 207 CO 0.00 0.04 -0.05 -1.01 0.05 0.00 0.00 179.01 178.04 1c87 s HIS 208 N -4.22 3.25 1.17 2.06 3.76 -0.99 -5.11 115.29 115.21 1c87 s HIS 208 Ca -0.04 0.31 -0.17 0.00 -0.15 0.00 0.00 55.06 55.02 1c87 s HIS 208 Cb 0.13 -2.36 0.20 0.00 1.11 0.00 0.00 32.58 31.66 1c87 s HIS 208 CO 0.52 -0.40 0.44 0.41 -0.85 0.00 0.00 174.74 174.85 1c87 n GLY 209 N -2.14 -2.45 3.78 -2.22 0.00 0.12 -4.85 105.19 97.43 1c87 n GLY 209 Ca 0.02 -1.00 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1c87 n GLY 209 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1c87 n PRO 210 N -3.40 2.68 -1.68 1.61 -0.04 -1.26 -4.47 135.00 128.44 1c87 n PRO 210 Ca 0.02 0.94 -0.44 0.00 -0.04 0.00 0.00 63.50 63.98 1c87 n PRO 210 Cb 0.58 -2.69 -0.02 0.00 -0.04 0.00 0.00 33.50 31.33 1c87 n PRO 210 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1c87 n VAL 211 N 0.39 1.12 -2.79 0.52 3.14 -1.26 -4.44 118.33 115.01 1c87 n VAL 211 Ca 0.01 -0.28 -0.42 0.00 -2.96 0.00 0.00 64.34 60.69 1c87 n VAL 211 Cb 0.39 -1.53 -0.03 0.00 -1.06 0.00 0.00 33.84 31.61 1c87 n VAL 211 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1c87 s VAL 212 N -0.21 4.78 -0.19 1.55 1.01 -0.73 -0.75 120.40 125.85 1c87 s VAL 212 Ca 0.66 1.77 -0.03 0.00 0.00 0.00 0.00 61.98 64.38 1c87 s VAL 212 Cb -0.62 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 31.54 1c87 s VAL 212 CO 0.51 -0.09 -0.05 -0.69 0.00 0.00 0.00 175.10 174.79 1c87 s VAL 213 N 2.81 3.52 0.12 2.92 1.01 0.41 -0.24 120.40 130.95 1c87 s VAL 213 Ca 0.40 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 61.96 1c87 s VAL 213 Cb -0.16 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 1c87 s VAL 213 CO 0.08 0.45 -0.11 -1.38 0.00 0.00 0.00 175.10 174.14 1c87 s HIS 214 N 0.98 1.24 0.00 5.22 -3.43 0.13 -2.42 115.29 117.01 1c87 s HIS 214 Ca 0.00 -0.65 0.00 0.00 -0.80 0.00 0.00 55.06 53.61 1c87 s HIS 214 Cb -0.15 -0.65 0.00 0.00 -1.43 0.00 0.00 32.58 30.35 1c87 s HIS 214 CO 0.01 0.08 0.00 0.00 -2.00 0.00 0.00 174.74 172.82 1c87 h SER 216 N 0.00 0.60 0.42 0.00 0.87 -1.89 -2.35 113.55 111.20 1c87 h SER 216 Ca 0.00 -0.86 -0.10 0.00 -1.23 0.00 0.00 61.79 59.60 1c87 h SER 216 Cb 0.00 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.75 1c87 h SER 216 CO 0.00 1.40 -1.67 0.00 -0.53 0.00 0.00 176.83 176.04 1c87 n ALA 217 N -2.65 2.32 -1.02 6.23 0.00 -1.26 0.42 120.51 124.56 1c87 n ALA 217 Ca -0.13 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.74 1c87 n ALA 217 Cb 0.83 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1c87 n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c87 n GLY 218 N 1.35 0.59 1.13 0.00 0.00 -1.18 -3.66 105.19 103.42 1c87 n GLY 218 Ca -0.09 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1c87 n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1c87 n ILE 219 N -2.94 0.00 0.00 -0.61 -5.35 -1.26 -4.50 119.36 104.70 1c87 n ILE 219 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1c87 n ILE 219 Cb 0.12 -0.60 0.00 0.00 -1.74 0.00 0.00 39.64 37.43 1c87 n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1c87 n GLY 220 N 2.02 -0.49 0.18 3.28 0.00 -1.26 -1.00 105.19 107.92 1c87 n GLY 220 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1c87 n GLY 220 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1c87 h ARG 221 N 0.00 0.25 -0.99 1.61 3.08 -1.95 -2.10 114.38 114.28 1c87 h ARG 221 Ca 0.00 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.07 1c87 h ARG 221 Cb 0.00 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 29.93 1c87 h ARG 221 CO 0.00 0.17 0.65 0.77 -1.07 0.00 0.00 179.97 180.49 1c87 h SER 222 N 0.26 1.08 -0.56 7.04 0.02 -1.86 -0.82 113.55 118.70 1c87 h SER 222 Ca 0.21 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 61.04 1c87 h SER 222 Cb 0.23 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1c87 h SER 222 CO -0.24 0.73 -0.05 1.23 -1.14 0.00 0.00 176.83 177.36 1c87 h GLY 223 N 1.25 1.12 0.85 -3.77 0.00 -1.10 -0.39 103.07 101.03 1c87 h GLY 223 Ca 0.40 -0.86 0.02 0.00 0.00 0.00 0.00 47.33 46.89 1c87 h GLY 223 CO -0.13 0.79 0.06 -0.84 0.00 0.00 0.00 176.54 176.42 1c87 h THR 224 N 0.94 0.95 0.05 4.70 2.02 -1.16 0.36 112.91 120.77 1c87 h THR 224 Ca 0.16 -0.05 0.02 0.00 0.77 0.00 0.00 66.41 67.31 1c87 h THR 224 Cb 0.61 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 1c87 h THR 224 CO 0.04 0.03 -0.18 0.15 0.37 0.00 0.00 175.52 175.93 1c87 h PHE 225 N 0.14 -0.46 -0.67 3.16 3.04 -0.99 -2.54 116.94 118.62 1c87 h PHE 225 Ca 0.08 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.00 1c87 h PHE 225 Cb 0.05 0.20 -0.03 0.00 2.56 0.00 0.00 35.95 38.73 1c87 h PHE 225 CO -0.12 -0.26 0.28 0.00 -2.02 0.00 0.00 178.31 176.19 1c87 h LEU 227 N 0.95 -1.10 -0.86 0.00 5.85 -0.23 -0.39 115.31 119.52 1c87 h LEU 227 Ca 0.22 0.09 0.13 0.00 0.84 0.00 0.00 57.88 59.16 1c87 h LEU 227 Cb 0.19 0.36 -0.09 0.00 0.37 0.00 0.00 40.66 41.50 1c87 h LEU 227 CO -0.02 -0.58 0.47 0.00 -0.34 0.00 0.00 178.44 177.97 1c87 h ALA 228 N -0.55 1.28 -0.36 1.25 0.00 -1.46 0.61 119.26 120.02 1c87 h ALA 228 Ca -0.05 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1c87 h ALA 228 Cb 0.76 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1c87 h ALA 228 CO -0.03 -0.00 0.06 0.22 0.00 0.00 0.00 179.25 179.50 1c87 h ASP 229 N 0.71 0.56 -0.43 0.00 3.58 -0.80 -2.19 116.42 117.85 1c87 h ASP 229 Ca 0.45 -0.25 -0.08 0.00 0.42 0.00 0.00 57.03 57.56 1c87 h ASP 229 Cb 0.55 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.44 1c87 h ASP 229 CO -0.32 0.67 -0.04 0.74 -2.88 0.00 0.00 179.24 177.42 1c87 h THR 230 N 0.43 1.27 -0.59 2.25 2.02 -0.78 0.44 112.91 117.94 1c87 h THR 230 Ca 0.11 -1.10 0.10 0.00 0.77 0.00 0.00 66.41 66.28 1c87 h THR 230 Cb 0.35 1.11 -0.07 0.00 -1.74 0.00 0.00 68.15 67.79 1c87 h THR 230 CO 0.01 0.38 0.20 0.00 0.37 0.00 0.00 175.52 176.47 1c87 h LEU 232 N 0.36 0.99 -0.38 0.00 3.38 -1.03 -1.56 115.31 117.07 1c87 h LEU 232 Ca 0.30 -0.36 0.06 0.00 0.09 0.00 0.00 57.88 57.98 1c87 h LEU 232 Cb 0.39 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 1c87 h LEU 232 CO -0.32 1.12 0.06 0.25 0.09 0.00 0.00 178.44 179.64 1c87 h LEU 233 N 0.85 -0.01 -0.22 1.67 6.46 -0.39 -0.39 115.31 123.29 1c87 h LEU 233 Ca 0.13 0.07 0.01 0.00 -0.12 0.00 0.00 57.88 57.97 1c87 h LEU 233 Cb 0.68 0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 40.68 1c87 h LEU 233 CO 0.05 0.03 0.11 0.25 -0.62 0.00 0.00 178.44 178.26 1c87 h LEU 234 N 0.19 0.16 -1.57 2.25 5.85 -0.94 -1.14 115.31 120.10 1c87 h LEU 234 Ca 0.18 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1c87 h LEU 234 Cb 0.22 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1c87 h LEU 234 CO -0.25 0.12 0.14 -0.03 -0.34 0.00 0.00 178.44 178.09 1c87 h MET 235 N 0.23 0.43 -0.60 1.25 4.05 -0.99 -2.94 114.93 116.36 1c87 h MET 235 Ca 0.09 -0.04 -0.06 0.00 -0.28 0.00 0.00 59.70 59.41 1c87 h MET 235 Cb 0.02 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 1c87 h MET 235 CO -0.06 0.34 0.16 0.22 0.23 0.00 0.00 176.91 177.80 1c87 h ASP 236 N 0.43 0.90 0.35 1.39 3.58 -0.09 0.31 116.42 123.28 1c87 h ASP 236 Ca 0.11 -0.23 -0.02 0.00 0.42 0.00 0.00 57.03 57.31 1c87 h ASP 236 Cb 0.06 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 40.87 1c87 h ASP 236 CO -0.01 0.89 -0.12 0.07 -2.88 0.00 0.00 179.24 177.19 1c87 h LYS 237 N 0.86 0.00 0.00 0.28 2.10 -1.05 -2.89 116.57 115.87 1c87 h LYS 237 Ca 0.19 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.84 1c87 h LYS 237 Cb 0.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.67 1c87 h LYS 237 CO 0.00 0.12 -0.53 2.89 -2.00 0.00 0.00 179.45 179.93 1c87 n ARG 238 N -3.69 3.82 -3.82 0.07 1.85 -1.21 -4.99 116.66 108.70 1c87 n ARG 238 Ca -0.02 -0.01 -0.28 0.00 -1.00 0.00 0.00 57.85 56.54 1c87 n ARG 238 Cb 0.23 -0.85 0.04 0.00 -1.05 0.00 0.00 32.46 30.83 1c87 n ARG 238 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1c87 n LYS 239 N -1.28 -6.14 -3.69 2.89 4.76 0.10 -5.00 118.16 109.81 1c87 n LYS 239 Ca 0.00 0.66 -0.29 0.00 -2.87 0.00 0.00 58.31 55.81 1c87 n LYS 239 Cb 0.10 -5.58 -0.13 0.00 -1.84 0.00 0.00 35.03 27.58 1c87 n LYS 239 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1c87 s ASP 240 N -3.39 3.58 0.46 4.39 2.15 -0.69 -4.98 116.67 118.20 1c87 s ASP 240 Ca 0.60 -2.58 0.21 0.00 0.43 0.00 0.00 52.55 51.21 1c87 s ASP 240 Cb -0.29 -0.97 1.19 0.00 -0.30 0.00 0.00 42.92 42.55 1c87 s ASP 240 CO 0.80 -0.27 1.90 -0.65 -0.17 0.00 0.00 175.17 176.78 1c87 h PRO 241 N 6.76 0.27 -0.00 4.34 0.11 -1.95 -1.57 132.00 139.97 1c87 h PRO 241 Ca -0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1c87 h PRO 241 Cb 0.93 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1c87 h PRO 241 CO 0.46 0.18 -0.18 0.43 -0.21 0.00 0.00 178.00 178.68 1c87 n SER 242 N -4.44 0.26 0.10 -2.05 7.64 -1.26 -1.01 113.62 112.86 1c87 n SER 242 Ca 0.16 0.02 0.13 0.00 1.01 0.00 0.00 58.87 60.19 1c87 n SER 242 Cb 0.68 -0.17 0.42 0.00 -1.01 0.00 0.00 64.21 64.13 1c87 n SER 242 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1c87 n SER 243 N -1.38 0.76 -4.66 6.43 3.41 -0.59 -4.80 113.62 112.79 1c87 n SER 243 Ca 0.08 0.58 -0.40 0.00 -0.26 0.00 0.00 58.87 58.87 1c87 n SER 243 Cb 0.32 -0.79 -0.05 0.00 -0.26 0.00 0.00 64.21 63.43 1c87 n SER 243 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1c87 s VAL 244 N -3.12 4.98 -0.49 -3.33 0.11 -0.18 -5.02 120.40 113.34 1c87 s VAL 244 Ca 0.10 1.31 -0.16 0.00 -2.93 0.00 0.00 61.98 60.30 1c87 s VAL 244 Cb 0.12 -4.00 0.08 0.00 -1.53 0.00 0.00 36.38 31.06 1c87 s VAL 244 CO 0.57 0.08 0.44 -0.62 -3.33 0.00 0.00 175.10 172.23 1c87 s ASP 245 N 1.22 6.16 0.05 3.54 -1.08 -1.26 -4.72 116.67 120.58 1c87 s ASP 245 Ca 0.31 -1.38 -0.27 0.00 -0.52 0.00 0.00 52.55 50.68 1c87 s ASP 245 Cb -0.16 -2.20 -0.17 0.00 -1.46 0.00 0.00 42.92 38.93 1c87 s ASP 245 CO 0.11 -0.72 1.52 0.40 0.52 0.00 0.00 175.17 177.00 1c87 h ILE 246 N 5.79 0.69 -0.52 4.11 2.04 -1.98 -0.53 117.51 127.12 1c87 h ILE 246 Ca -0.29 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.41 1c87 h ILE 246 Cb 1.11 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.94 1c87 h ILE 246 CO 0.92 0.05 0.14 0.11 0.00 0.00 0.00 178.15 179.37 1c87 h LYS 247 N -0.58 0.29 -0.35 2.37 1.57 -2.00 -0.75 116.57 117.11 1c87 h LYS 247 Ca -0.05 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 1c87 h LYS 247 Cb 0.42 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1c87 h LYS 247 CO 0.07 0.19 0.03 -0.22 -0.57 0.00 0.00 179.45 178.95 1c87 h LYS 248 N 0.29 0.54 -0.17 3.15 3.64 -1.97 0.19 116.57 122.24 1c87 h LYS 248 Ca 0.26 -0.11 -0.17 0.00 -1.27 0.00 0.00 60.65 59.36 1c87 h LYS 248 Cb 0.32 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1c87 h LYS 248 CO -0.30 0.54 -0.59 -0.24 -2.27 0.00 0.00 179.45 176.59 1c87 h VAL 249 N 0.52 1.33 -0.96 2.00 3.04 0.19 -0.45 116.25 121.92 1c87 h VAL 249 Ca 0.11 -1.86 0.07 0.00 -1.01 0.00 0.00 66.70 64.01 1c87 h VAL 249 Cb 0.30 1.83 -0.06 0.00 -2.01 0.00 0.00 31.29 31.35 1c87 h VAL 249 CO 0.01 0.58 0.62 0.25 -1.01 0.00 0.00 177.57 178.02 1c87 h LEU 250 N 0.42 0.97 -0.44 3.16 5.85 -0.72 -0.37 115.31 124.18 1c87 h LEU 250 Ca -0.00 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.63 1c87 h LEU 250 Cb 1.15 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 1c87 h LEU 250 CO 0.11 0.61 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.65 1c87 h LEU 251 N 1.10 0.86 -0.78 2.25 4.07 -0.70 0.12 115.31 122.22 1c87 h LEU 251 Ca 0.42 -0.36 0.03 0.00 0.08 0.00 0.00 57.88 58.05 1c87 h LEU 251 Cb 0.21 -0.23 -0.05 0.00 1.08 0.00 0.00 40.66 41.67 1c87 h LEU 251 CO -0.17 1.02 0.50 -0.78 -1.08 0.00 0.00 178.44 177.93 1c87 h ASP 252 N 0.68 0.84 -0.41 -0.43 3.58 -0.70 -2.21 116.42 117.78 1c87 h ASP 252 Ca 0.11 -0.01 -0.08 0.00 0.42 0.00 0.00 57.03 57.48 1c87 h ASP 252 Cb 0.64 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 1c87 h ASP 252 CO 0.04 0.59 -0.02 0.24 -2.88 0.00 0.00 179.24 177.21 1c87 h MET 253 N 0.99 0.81 0.00 0.28 2.86 -0.70 -2.32 114.93 116.85 1c87 h MET 253 Ca 0.31 -0.23 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1c87 h MET 253 Cb -0.02 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.55 1c87 h MET 253 CO -0.10 0.82 0.00 0.54 1.06 0.00 0.00 176.91 179.23 1c87 n ARG 254 N -4.20 0.25 0.29 1.72 1.74 0.38 -0.43 116.66 116.40 1c87 n ARG 254 Ca 0.02 0.11 0.13 0.00 -0.77 0.00 0.00 57.85 57.35 1c87 n ARG 254 Cb 0.31 -1.50 0.84 0.00 -1.02 0.00 0.00 32.46 31.09 1c87 n ARG 254 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1c87 h LYS 255 N 0.00 0.00 0.00 5.56 1.57 -1.00 -3.30 116.57 119.40 1c87 h LYS 255 Ca 0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1c87 h LYS 255 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1c87 h LYS 255 CO 0.00 0.02 -1.81 1.19 -0.57 0.00 0.00 179.45 178.29 1c87 n PHE 256 N -3.93 0.00 -3.75 -1.35 3.01 0.42 -4.95 117.46 106.91 1c87 n PHE 256 Ca -0.03 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.31 1c87 n PHE 256 Cb 0.11 -0.50 -0.11 0.00 -0.01 0.00 0.00 39.48 38.96 1c87 n PHE 256 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1c87 s ARG 257 N -2.70 0.36 0.55 -1.08 3.52 -1.01 -4.55 118.95 114.04 1c87 s ARG 257 Ca -0.06 0.50 -0.20 0.00 -0.13 0.00 0.00 55.73 55.84 1c87 s ARG 257 Cb 0.07 0.12 -0.05 0.00 -1.56 0.00 0.00 34.95 33.53 1c87 s ARG 257 CO 0.59 -0.07 1.23 0.00 -0.81 0.00 0.00 175.30 176.24 1c87 s MET 258 N 0.47 3.21 0.00 5.12 0.23 -1.26 -4.21 119.30 122.85 1c87 s MET 258 Ca -0.02 1.90 0.00 0.00 -1.03 0.00 0.00 55.69 56.54 1c87 s MET 258 Cb -0.04 -2.12 0.00 0.00 -1.53 0.00 0.00 34.83 31.14 1c87 s MET 258 CO -0.02 -1.04 0.00 0.41 -2.03 0.00 0.00 175.02 172.34 1c87 n GLY 259 N 0.54 0.49 3.64 3.16 0.00 -1.26 -4.85 105.19 106.91 1c87 n GLY 259 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1c87 n GLY 259 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c87 s LEU 260 N 0.00 4.13 0.02 0.99 1.43 -1.26 -4.14 118.68 119.85 1c87 s LEU 260 Ca 0.00 2.19 0.00 0.00 -1.03 0.00 0.00 54.13 55.29 1c87 s LEU 260 Cb 0.00 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1c87 s LEU 260 CO 0.00 -1.20 0.00 -0.38 0.23 0.00 0.00 176.35 175.00 1c87 n ILE 261 N 6.05 -3.68 0.31 -0.59 5.41 -0.17 -4.92 119.36 121.77 1c87 n ILE 261 Ca 0.20 0.48 0.11 0.00 1.00 0.00 0.00 62.75 64.54 1c87 n ILE 261 Cb 0.43 -2.95 -0.08 0.00 -0.71 0.00 0.00 39.64 36.32 1c87 n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1c87 n GLN 262 N 0.27 0.45 -4.07 0.38 1.13 -1.26 -4.90 117.38 109.39 1c87 n GLN 262 Ca 0.00 -0.07 -0.08 0.00 -1.94 0.00 0.00 57.00 54.91 1c87 n GLN 262 Cb 0.00 -1.58 -0.09 0.00 0.11 0.00 0.00 30.24 28.67 1c87 n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1c87 s THR 263 N -3.33 0.15 0.37 5.09 -4.23 -1.26 -5.05 115.64 107.38 1c87 s THR 263 Ca -0.01 -1.72 0.13 0.00 -1.18 0.00 0.00 61.69 58.91 1c87 s THR 263 Cb 0.14 -1.71 0.10 0.00 1.34 0.00 0.00 72.50 72.37 1c87 s THR 263 CO 0.86 -0.70 1.83 0.00 -0.54 0.00 0.00 174.62 176.07 1c87 h ALA 264 N 2.94 1.38 0.00 3.99 0.00 -1.93 -1.92 119.26 123.71 1c87 h ALA 264 Ca -0.34 -0.33 -0.19 0.00 0.00 0.00 0.00 54.91 54.05 1c87 h ALA 264 Cb 1.18 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1c87 h ALA 264 CO 0.61 0.45 -0.88 0.22 0.00 0.00 0.00 179.25 179.64 1c87 h ASP 265 N 0.00 0.02 -0.88 0.00 3.58 -1.96 0.71 116.42 117.88 1c87 h ASP 265 Ca -0.00 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.43 1c87 h ASP 265 Cb 0.65 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 41.65 1c87 h ASP 265 CO 0.05 0.89 0.54 1.56 -2.88 0.00 0.00 179.24 179.40 1c87 h GLN 266 N 0.01 1.19 -0.26 0.28 4.20 -1.83 0.91 115.11 119.60 1c87 h GLN 266 Ca -0.01 -0.10 0.03 0.00 0.06 0.00 0.00 58.65 58.63 1c87 h GLN 266 Cb 1.56 -0.25 -0.03 0.00 0.30 0.00 0.00 27.48 29.05 1c87 h GLN 266 CO 0.12 0.82 0.05 1.25 -0.67 0.00 0.00 178.83 180.40 1c87 h LEU 267 N 1.21 0.02 -0.99 1.46 5.85 -1.00 -1.02 115.31 120.84 1c87 h LEU 267 Ca 0.32 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.08 1c87 h LEU 267 Cb -0.07 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 1c87 h LEU 267 CO -0.06 0.04 0.63 -0.09 -0.34 0.00 0.00 178.44 178.62 1c87 h ARG 268 N 0.16 1.31 -0.77 1.25 2.43 -0.55 -1.59 114.38 116.61 1c87 h ARG 268 Ca 0.12 -0.10 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 1c87 h ARG 268 Cb 0.12 -0.29 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 1c87 h ARG 268 CO -0.16 0.89 0.32 0.35 -1.51 0.00 0.00 179.97 179.87 1c87 h PHE 269 N 1.34 1.15 -0.79 2.20 3.57 0.12 -2.43 116.94 122.10 1c87 h PHE 269 Ca 0.36 -0.07 0.10 0.00 3.53 0.00 0.00 57.97 61.89 1c87 h PHE 269 Cb -0.11 -0.35 -0.08 0.00 2.79 0.00 0.00 35.95 38.20 1c87 h PHE 269 CO 0.00 0.86 0.42 0.77 -2.23 0.00 0.00 178.31 178.14 1c87 h SER 270 N 1.11 0.57 0.07 0.41 0.02 -0.20 0.74 113.55 116.27 1c87 h SER 270 Ca 0.26 0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1c87 h SER 270 Cb 0.19 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1c87 h SER 270 CO -0.02 0.31 -0.03 1.88 -1.14 0.00 0.00 176.83 177.82 1c87 h TYR 271 N 0.69 -0.09 -0.55 3.45 -1.99 -1.27 -0.99 116.97 116.22 1c87 h TYR 271 Ca 0.39 -0.00 0.11 0.00 2.00 0.00 0.00 58.73 61.23 1c87 h TYR 271 Cb 0.42 0.03 -0.10 0.00 2.00 0.00 0.00 36.73 39.08 1c87 h TYR 271 CO -0.08 -0.00 -0.05 -0.07 -0.00 0.00 0.00 178.16 177.96 1c87 h LEU 272 N -0.15 -0.33 0.05 3.88 4.07 -0.99 0.61 115.31 122.45 1c87 h LEU 272 Ca -0.01 0.15 0.01 0.00 0.08 0.00 0.00 57.88 58.10 1c87 h LEU 272 Cb 0.12 0.27 -0.01 0.00 1.08 0.00 0.00 40.66 42.13 1c87 h LEU 272 CO 0.02 -0.13 -0.07 0.00 -1.08 0.00 0.00 178.44 177.18 1c87 h ALA 273 N 1.52 -0.11 -0.46 1.53 0.00 -0.75 -0.39 119.26 120.60 1c87 h ALA 273 Ca 0.28 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 1c87 h ALA 273 Cb 0.44 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1c87 h ALA 273 CO -0.50 -0.58 -0.25 0.28 0.00 0.00 0.00 179.25 178.20 1c87 h VAL 274 N -0.14 1.27 -0.72 0.00 2.07 -0.94 0.91 116.25 118.70 1c87 h VAL 274 Ca 0.01 -1.41 -0.05 0.00 0.82 0.00 0.00 66.70 66.07 1c87 h VAL 274 Cb 0.15 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 1c87 h VAL 274 CO -0.03 0.48 0.26 0.40 0.02 0.00 0.00 177.57 178.69 1c87 h ILE 275 N 0.82 1.25 -0.18 4.57 2.04 -0.82 0.11 117.51 125.30 1c87 h ILE 275 Ca 0.10 -0.84 -0.07 0.00 1.00 0.00 0.00 64.86 65.06 1c87 h ILE 275 Cb 0.82 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1c87 h ILE 275 CO 0.07 0.33 -0.14 -0.08 0.00 0.00 0.00 178.15 178.33 1c87 h GLU 276 N 1.06 0.42 0.00 2.37 4.57 -0.83 -3.24 114.58 118.93 1c87 h GLU 276 Ca 0.24 -0.21 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1c87 h GLU 276 Cb 0.25 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 1c87 h GLU 276 CO -0.01 0.76 -0.19 0.78 -1.18 0.00 0.00 179.01 179.17 1c87 h GLY 277 N 0.08 0.00 1.31 1.92 0.00 -0.67 -1.50 103.07 104.21 1c87 h GLY 277 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.45 1c87 h GLY 277 CO 0.04 0.00 0.26 0.00 0.00 0.00 0.00 176.54 176.83 1c87 h ALA 278 N 1.81 2.18 -0.34 3.60 0.00 -0.99 -1.93 119.26 123.59 1c87 h ALA 278 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1c87 h ALA 278 Cb 0.43 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1c87 h ALA 278 CO 0.02 -0.42 0.15 0.87 0.00 0.00 0.00 179.25 179.88 1c87 h LYS 279 N 0.00 0.31 0.18 0.00 1.57 -1.41 0.32 116.57 117.55 1c87 h LYS 279 Ca 0.15 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1c87 h LYS 279 Cb 0.66 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1c87 h LYS 279 CO -0.00 0.20 -0.09 0.35 -0.57 0.00 0.00 179.45 179.34 1c87 h PHE 280 N 0.32 -0.23 -0.65 -1.35 3.04 -1.52 -2.05 116.94 114.49 1c87 h PHE 280 Ca 0.15 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 62.12 1c87 h PHE 280 Cb 0.08 0.08 -0.04 0.00 2.56 0.00 0.00 35.95 38.63 1c87 h PHE 280 CO -0.11 -0.11 0.43 0.82 -2.02 0.00 0.00 178.31 177.32 1c87 h ILE 281 N -0.29 1.10 -0.05 1.41 1.08 -1.04 0.46 117.51 120.18 1c87 h ILE 281 Ca -0.03 -0.27 0.00 0.00 -0.39 0.00 0.00 64.86 64.17 1c87 h ILE 281 Cb 0.22 0.24 0.00 0.00 -3.07 0.00 0.00 36.82 34.21 1c87 h ILE 281 CO 0.04 0.14 0.00 0.23 -0.69 0.00 0.00 178.15 177.88 1c87 n MET 282 N -4.46 1.13 0.00 2.37 2.81 0.11 -4.89 117.12 114.20 1c87 n MET 282 Ca 0.08 -0.20 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 1c87 n MET 282 Cb 0.12 -1.09 0.00 0.00 -0.71 0.00 0.00 33.22 31.54 1c87 n MET 282 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1c87 n GLY 283 N 0.64 0.85 3.42 3.03 0.00 0.15 -5.01 105.19 108.27 1c87 n GLY 283 Ca 0.04 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 1c87 n GLY 283 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1c87 s ASP 284 N -2.20 6.82 0.08 1.61 2.15 -0.80 -4.85 116.67 119.49 1c87 s ASP 284 Ca 0.00 -2.52 0.17 0.00 0.43 0.00 0.00 52.55 50.63 1c87 s ASP 284 Cb 0.00 -2.35 0.71 0.00 -0.30 0.00 0.00 42.92 40.99 1c87 s ASP 284 CO 0.00 -0.83 1.53 -1.20 -0.17 0.00 0.00 175.17 174.50 1c87 n SER 285 N 5.53 0.20 0.30 -0.34 7.64 -1.26 -2.92 113.62 122.76 1c87 n SER 285 Ca 0.25 0.55 0.17 0.00 1.01 0.00 0.00 58.87 60.85 1c87 n SER 285 Cb 0.46 -0.59 0.98 0.00 -1.01 0.00 0.00 64.21 64.05 1c87 n SER 285 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1c87 h SER 286 N 0.00 0.00 0.58 6.43 4.64 -1.95 -2.15 113.55 121.10 1c87 h SER 286 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1c87 h SER 286 Cb 0.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1c87 h SER 286 CO 0.00 0.00 -0.24 -0.37 -0.87 0.00 0.00 176.83 175.35 1c87 h VAL 287 N 0.00 0.75 -0.18 0.95 -1.51 -1.91 -2.80 116.25 111.55 1c87 h VAL 287 Ca 0.01 -0.99 0.04 0.00 -1.23 0.00 0.00 66.70 64.54 1c87 h VAL 287 Cb 0.07 1.61 -0.05 0.00 -2.13 0.00 0.00 31.29 30.80 1c87 h VAL 287 CO -0.00 0.23 -0.11 -0.61 -1.23 0.00 0.00 177.57 175.86 1c87 h GLN 288 N 0.00 -0.10 -0.16 5.19 4.15 -1.62 0.21 115.11 122.78 1c87 h GLN 288 Ca -0.00 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 1c87 h GLN 288 Cb 0.59 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 1c87 h GLN 288 CO 0.03 -0.06 0.04 -0.44 -1.93 0.00 0.00 178.83 176.47 1c87 h ASP 289 N -0.10 0.19 0.20 -0.69 3.32 -1.69 -1.69 116.42 115.97 1c87 h ASP 289 Ca 0.10 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 56.99 1c87 h ASP 289 Cb 0.25 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1c87 h ASP 289 CO -0.24 0.20 -0.58 1.56 -1.72 0.00 0.00 179.24 178.47 1c87 h GLN 290 N 0.22 0.39 -0.90 3.56 4.20 -0.87 -1.38 115.11 120.32 1c87 h GLN 290 Ca 0.06 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.50 1c87 h GLN 290 Cb 0.09 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.86 1c87 h GLN 290 CO -0.00 0.85 0.50 -1.49 -0.67 0.00 0.00 178.83 178.02 1c87 h TRP 291 N 0.29 1.23 -0.21 2.96 6.55 -0.22 0.15 115.95 126.70 1c87 h TRP 291 Ca -0.00 -0.03 -0.05 0.00 0.95 0.00 0.00 58.89 59.76 1c87 h TRP 291 Cb 1.10 -0.39 -0.01 0.00 -0.86 0.00 0.00 29.16 29.00 1c87 h TRP 291 CO 0.03 0.84 -0.08 -0.22 -1.05 0.00 0.00 178.44 177.97 1c87 h LYS 292 N 1.26 0.43 0.02 0.49 3.64 -0.96 0.85 116.57 122.30 1c87 h LYS 292 Ca 0.32 -0.18 0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1c87 h LYS 292 Cb 0.02 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 1c87 h LYS 292 CO -0.05 0.69 -0.42 0.93 -2.27 0.00 0.00 179.45 178.34 1c87 h GLU 293 N 0.15 -0.51 -1.05 1.90 4.39 -1.14 -2.72 114.58 115.59 1c87 h GLU 293 Ca 0.05 0.03 0.27 0.00 0.34 0.00 0.00 59.36 60.06 1c87 h GLU 293 Cb 0.55 0.12 -0.10 0.00 -0.10 0.00 0.00 28.75 29.21 1c87 h GLU 293 CO 0.03 -0.34 0.66 -0.07 -1.16 0.00 0.00 179.01 178.13 1c87 h LEU 294 N -0.53 0.48 -1.60 1.33 4.07 -0.62 -0.95 115.31 117.49 1c87 h LEU 294 Ca 0.01 0.10 -0.01 0.00 0.08 0.00 0.00 57.88 58.06 1c87 h LEU 294 Cb 0.56 0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.33 1c87 h LEU 294 CO -0.27 0.07 -0.05 0.77 -1.08 0.00 0.00 178.44 177.88 1c87 h SER 295 N 0.41 0.00 -5.73 -0.43 4.64 -0.50 -3.47 113.55 108.48 1c87 h SER 295 Ca 0.62 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.61 1c87 h SER 295 Cb 1.52 0.00 0.15 0.00 -0.31 0.00 0.00 62.40 63.76 1c87 h SER 295 CO -0.35 0.05 -0.83 1.41 -0.87 0.00 0.00 176.83 176.25 1c87 n HIS 296 N -3.20 -2.20 -0.21 4.77 8.25 -0.36 -4.91 115.22 117.36 1c87 n HIS 296 Ca -0.00 0.85 -0.08 0.00 -0.26 0.00 0.00 57.72 58.23 1c87 n HIS 296 Cb 0.30 -4.48 0.05 0.00 1.12 0.00 0.00 29.99 26.98 1c87 n HIS 296 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1c87 h GLU 297 N -1.62 1.05 0.00 -0.41 4.11 -1.81 -3.42 114.58 112.47 1c87 h GLU 297 Ca -0.61 -0.31 0.00 0.00 0.07 0.00 0.00 59.36 58.51 1c87 h GLU 297 Cb 1.34 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1c87 h GLU 297 CO 0.49 1.00 0.00 -0.25 0.07 0.00 0.00 179.01 180.33