#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c83 h MET 3 N 0.00 0.00 0.10 5.31 -0.00 -1.86 -2.11 114.93 116.37 1c83 h MET 3 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 59.70 59.41 1c83 h MET 3 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.59 1c83 h MET 3 CO 0.00 0.00 -1.44 1.49 -0.00 0.00 0.00 176.91 176.96 1c83 h GLU 4 N 0.00 0.22 -0.29 -0.10 4.81 -1.98 0.14 114.58 117.38 1c83 h GLU 4 Ca 0.45 -0.37 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 1c83 h GLU 4 Cb 2.41 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 31.91 1c83 h GLU 4 CO -0.00 1.09 0.03 0.87 -0.73 0.00 0.00 179.01 180.26 1c83 h LYS 5 N 0.06 0.49 -0.70 1.92 1.57 -1.92 -1.44 116.57 116.55 1c83 h LYS 5 Ca -0.20 -0.14 0.03 0.00 -1.87 0.00 0.00 60.65 58.46 1c83 h LYS 5 Cb 1.99 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 34.20 1c83 h LYS 5 CO 0.16 0.62 0.44 1.49 -0.57 0.00 0.00 179.45 181.59 1c83 h GLU 6 N 0.30 0.83 -0.24 3.15 4.81 -1.45 0.01 114.58 122.00 1c83 h GLU 6 Ca 0.09 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 1c83 h GLU 6 Cb 0.37 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.53 1c83 h GLU 6 CO 0.01 0.55 0.01 0.35 -0.73 0.00 0.00 179.01 179.20 1c83 h PHE 7 N 0.86 0.00 -0.38 0.92 3.04 -0.59 -0.10 116.94 120.69 1c83 h PHE 7 Ca 0.28 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.24 1c83 h PHE 7 Cb 0.02 0.04 -0.02 0.00 2.56 0.00 0.00 35.95 38.55 1c83 h PHE 7 CO -0.04 -0.03 0.20 0.93 -2.02 0.00 0.00 178.31 177.35 1c83 h GLU 8 N 0.09 0.54 -0.09 1.11 5.08 -1.05 0.44 114.58 120.69 1c83 h GLU 8 Ca 0.12 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1c83 h GLU 8 Cb 0.14 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.24 1c83 h GLU 8 CO -0.19 0.45 -0.47 0.37 -1.00 0.00 0.00 179.01 178.17 1c83 h GLN 9 N 0.49 -0.50 -0.93 2.33 4.15 -0.86 -0.47 115.11 119.31 1c83 h GLN 9 Ca 0.13 0.03 0.11 0.00 0.77 0.00 0.00 58.65 59.70 1c83 h GLN 9 Cb 0.07 0.11 -0.07 0.00 0.21 0.00 0.00 27.48 27.80 1c83 h GLN 9 CO -0.02 -0.34 0.59 0.82 -1.93 0.00 0.00 178.83 177.96 1c83 h ILE 10 N -0.52 0.93 0.35 2.39 2.04 -0.84 0.13 117.51 121.99 1c83 h ILE 10 Ca 0.02 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 1c83 h ILE 10 Cb 0.60 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1c83 h ILE 10 CO -0.36 0.16 -0.17 -0.78 0.00 0.00 0.00 178.15 177.00 1c83 h ASP 11 N 0.89 -0.40 -0.41 1.72 3.58 -0.81 -0.14 116.42 120.84 1c83 h ASP 11 Ca 0.44 -0.13 0.08 0.00 0.42 0.00 0.00 57.03 57.85 1c83 h ASP 11 Cb 0.48 0.10 -0.08 0.00 1.72 0.00 0.00 39.33 41.55 1c83 h ASP 11 CO -0.21 -0.08 -0.11 0.07 -2.88 0.00 0.00 179.24 176.03 1c83 h LYS 12 N -0.73 -0.01 0.00 0.28 2.10 -0.77 -1.11 116.57 116.33 1c83 h LYS 12 Ca -0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1c83 h LYS 12 Cb 0.50 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.83 1c83 h LYS 12 CO 0.08 -0.01 0.00 -1.13 -2.00 0.00 0.00 179.45 176.39 1c83 n SER 13 N -5.32 0.00 -4.27 7.07 3.41 0.41 -4.89 113.62 110.03 1c83 n SER 13 Ca 0.03 -1.55 -0.34 0.00 -0.26 0.00 0.00 58.87 56.74 1c83 n SER 13 Cb 0.23 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.12 1c83 n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c83 n GLY 14 N 0.44 -0.30 1.27 5.00 0.00 -0.42 -4.92 105.19 106.26 1c83 n GLY 14 Ca 0.04 0.13 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 1c83 n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1c83 n SER 15 N -2.74 2.76 -0.28 1.61 3.41 -0.14 -4.64 113.62 113.60 1c83 n SER 15 Ca -0.10 -3.69 -0.05 0.00 -0.26 0.00 0.00 58.87 54.77 1c83 n SER 15 Cb 0.57 -0.65 0.06 0.00 -0.26 0.00 0.00 64.21 63.93 1c83 n SER 15 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1c83 h TRP 16 N 1.09 1.06 -0.76 7.33 4.06 -1.92 -0.63 115.95 126.18 1c83 h TRP 16 Ca 0.25 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 61.16 1c83 h TRP 16 Cb 1.79 -0.34 -0.04 0.00 -1.00 0.00 0.00 29.16 29.58 1c83 h TRP 16 CO 1.06 0.76 0.45 0.00 -3.56 0.00 0.00 178.44 177.15 1c83 h ALA 17 N 1.21 0.97 -0.43 1.49 0.00 -1.91 -0.82 119.26 119.76 1c83 h ALA 17 Ca 0.27 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 1c83 h ALA 17 Cb 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1c83 h ALA 17 CO -0.04 0.45 -0.23 0.00 0.00 0.00 0.00 179.25 179.43 1c83 h ALA 18 N 1.24 0.78 -0.38 0.00 0.00 -1.79 -1.21 119.26 117.91 1c83 h ALA 18 Ca 0.27 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1c83 h ALA 18 Cb -0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1c83 h ALA 18 CO -0.05 0.65 0.24 0.82 0.00 0.00 0.00 179.25 180.91 1c83 h ILE 19 N 0.76 1.11 -0.04 0.00 1.08 -0.93 0.15 117.51 119.64 1c83 h ILE 19 Ca 0.10 -0.24 -0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1c83 h ILE 19 Cb 0.77 0.60 -0.00 0.00 -3.07 0.00 0.00 36.82 35.12 1c83 h ILE 19 CO 0.06 0.11 0.02 0.22 -0.69 0.00 0.00 178.15 177.88 1c83 h TYR 20 N 0.50 0.05 -0.94 1.37 3.20 -1.12 -2.10 116.97 117.93 1c83 h TYR 20 Ca 0.14 0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.09 1c83 h TYR 20 Cb -0.02 -0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.17 1c83 h TYR 20 CO -0.04 0.07 0.60 1.96 -1.64 0.00 0.00 178.16 179.11 1c83 h GLN 21 N 0.02 0.96 -0.77 1.82 1.08 -1.05 -1.03 115.11 116.14 1c83 h GLN 21 Ca 0.01 -0.06 0.09 0.00 -1.45 0.00 0.00 58.65 57.25 1c83 h GLN 21 Cb 0.03 -0.22 -0.07 0.00 -0.05 0.00 0.00 27.48 27.17 1c83 h GLN 21 CO -0.00 0.64 0.42 -0.44 -0.95 0.00 0.00 178.83 178.49 1c83 h ASP 22 N 0.99 0.58 0.13 1.46 3.32 -0.27 -0.45 116.42 122.18 1c83 h ASP 22 Ca 0.43 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.52 1c83 h ASP 22 Cb 0.34 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1c83 h ASP 22 CO -0.18 0.33 -0.06 0.40 -1.72 0.00 0.00 179.24 178.01 1c83 h ILE 23 N 0.71 0.94 -0.68 0.35 2.04 -0.62 -1.92 117.51 118.32 1c83 h ILE 23 Ca 0.37 -0.24 0.14 0.00 1.00 0.00 0.00 64.86 66.13 1c83 h ILE 23 Cb 0.36 1.09 -0.11 0.00 -0.74 0.00 0.00 36.82 37.42 1c83 h ILE 23 CO -0.25 0.06 0.11 0.03 0.00 0.00 0.00 178.15 178.09 1c83 h ARG 24 N -0.28 0.20 -0.92 2.37 3.08 -0.99 0.14 114.38 117.98 1c83 h ARG 24 Ca -0.02 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1c83 h ARG 24 Cb 0.23 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 1c83 h ARG 24 CO 0.03 0.13 0.52 1.25 -1.07 0.00 0.00 179.97 180.83 1c83 h HIS 25 N 0.21 1.24 0.00 3.04 2.76 -0.88 -2.86 115.15 118.66 1c83 h HIS 25 Ca 0.37 -0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.45 1c83 h HIS 25 Cb 0.62 -0.40 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 1c83 h HIS 25 CO -0.30 0.85 -0.35 0.93 -1.30 0.00 0.00 177.93 177.76 1c83 h GLU 26 N 1.28 0.00 -6.81 5.26 5.08 -0.83 -3.47 114.58 115.09 1c83 h GLU 26 Ca 0.32 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 58.12 1c83 h GLU 26 Cb 0.00 0.00 0.13 0.00 0.50 0.00 0.00 28.75 29.38 1c83 h GLU 26 CO -0.05 0.35 0.41 0.00 -1.00 0.00 0.00 179.01 178.71 1c83 n ALA 27 N -2.22 1.01 -1.60 3.43 0.00 0.45 -4.95 120.51 116.63 1c83 n ALA 27 Ca 0.01 0.23 -0.42 0.00 0.00 0.00 0.00 53.44 53.26 1c83 n ALA 27 Cb 0.59 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1c83 n ALA 27 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1c83 n SER 28 N 0.12 1.23 -3.76 0.00 7.64 -1.26 -5.03 113.62 112.56 1c83 n SER 28 Ca 0.08 1.08 -0.30 0.00 1.01 0.00 0.00 58.87 60.74 1c83 n SER 28 Cb 0.40 -1.33 -0.15 0.00 -1.01 0.00 0.00 64.21 62.13 1c83 n SER 28 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1c83 s ASP 29 N -0.68 4.05 0.26 6.43 2.15 -1.26 -4.94 116.67 122.69 1c83 s ASP 29 Ca 0.61 -1.81 0.09 0.00 0.43 0.00 0.00 52.55 51.87 1c83 s ASP 29 Cb -0.60 -0.95 -0.04 0.00 -0.30 0.00 0.00 42.92 41.03 1c83 s ASP 29 CO 0.58 -0.39 0.06 -0.36 -0.17 0.00 0.00 175.17 174.89 1c83 s PHE 30 N 1.40 2.84 0.42 -5.34 0.08 -1.26 -5.11 117.98 111.01 1c83 s PHE 30 Ca 0.11 -0.18 -0.26 0.00 0.12 0.00 0.00 56.93 56.72 1c83 s PHE 30 Cb -0.18 -1.26 -0.09 0.00 -0.57 0.00 0.00 43.02 40.92 1c83 s PHE 30 CO -0.20 0.59 1.38 -1.25 -0.10 0.00 0.00 175.22 175.63 1c83 s PRO 31 N -3.73 3.87 -0.45 0.24 0.04 -1.26 -4.85 135.00 128.86 1c83 s PRO 31 Ca 0.32 2.32 0.07 0.00 0.04 0.00 0.00 61.00 63.74 1c83 s PRO 31 Cb -0.07 -2.74 0.41 0.00 0.04 0.00 0.00 34.50 32.13 1c83 s PRO 31 CO 0.22 -0.63 1.05 0.00 0.04 0.00 0.00 177.00 177.67 1c83 h ARG 33 N 2.72 0.32 -0.70 0.00 -0.00 -1.93 -2.41 114.38 112.39 1c83 h ARG 33 Ca 0.21 -0.02 -0.08 0.00 -0.50 0.00 0.00 59.98 59.60 1c83 h ARG 33 Cb 0.86 -0.07 -0.03 0.00 0.00 0.00 0.00 29.97 30.73 1c83 h ARG 33 CO 0.79 0.21 0.14 -0.24 0.00 0.00 0.00 179.97 180.88 1c83 h VAL 34 N 0.33 1.26 -0.80 2.04 3.04 -1.92 -2.11 116.25 118.09 1c83 h VAL 34 Ca 0.25 -1.02 0.13 0.00 -1.01 0.00 0.00 66.70 65.05 1c83 h VAL 34 Cb 0.29 0.57 -0.09 0.00 -2.01 0.00 0.00 31.29 30.06 1c83 h VAL 34 CO -0.27 0.39 0.40 0.00 -1.01 0.00 0.00 177.57 177.08 1c83 h ALA 35 N 1.07 1.16 -0.06 3.17 0.00 -1.79 -1.26 119.26 121.55 1c83 h ALA 35 Ca 0.22 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1c83 h ALA 35 Cb 0.41 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1c83 h ALA 35 CO 0.01 -0.07 0.00 1.63 0.00 0.00 0.00 179.25 180.82 1c83 n LYS 36 N -4.87 1.28 -1.92 0.00 4.76 -0.93 -4.60 118.16 111.89 1c83 n LYS 36 Ca 0.15 -0.42 -0.40 0.00 -2.87 0.00 0.00 58.31 54.77 1c83 n LYS 36 Cb 0.37 -1.34 0.01 0.00 -1.84 0.00 0.00 35.03 32.23 1c83 n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1c83 s LEU 37 N -1.60 4.16 0.31 -0.35 1.43 -0.48 -4.89 118.68 117.27 1c83 s LEU 37 Ca 0.30 2.80 0.07 0.00 -1.03 0.00 0.00 54.13 56.27 1c83 s LEU 37 Cb 0.15 -3.92 0.86 0.00 0.03 0.00 0.00 46.19 43.32 1c83 s LEU 37 CO 0.24 -1.02 1.66 -0.65 0.23 0.00 0.00 176.35 176.81 1c83 h PRO 38 N 2.49 0.29 0.00 1.29 0.11 -1.90 -0.40 132.00 133.88 1c83 h PRO 38 Ca -0.50 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 1c83 h PRO 38 Cb 1.26 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1c83 h PRO 38 CO 0.62 0.19 -0.01 1.57 -0.21 0.00 0.00 178.00 180.16 1c83 h LYS 39 N 0.30 0.00 -0.67 1.05 2.10 -1.95 -2.73 116.57 114.66 1c83 h LYS 39 Ca 0.63 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.28 1c83 h LYS 39 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 1c83 h LYS 39 CO -0.61 0.01 0.00 0.09 -2.00 0.00 0.00 179.45 176.94 1c83 n ASN 40 N -3.35 3.83 -0.05 7.07 3.02 -0.16 -4.47 115.26 121.15 1c83 n ASN 40 Ca -0.03 -2.00 -0.08 0.00 -0.03 0.00 0.00 54.58 52.44 1c83 n ASN 40 Cb 0.10 -0.45 -0.02 0.00 -0.61 0.00 0.00 39.78 38.80 1c83 n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1c83 h LYS 41 N 4.30 0.05 0.00 3.52 3.64 -1.50 -0.76 116.57 125.82 1c83 h LYS 41 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1c83 h LYS 41 Cb 0.98 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1c83 h LYS 41 CO 0.00 0.03 0.00 0.27 -2.27 0.00 0.00 179.45 177.48 1c83 n ASN 42 N -5.16 0.00 -0.77 4.20 0.23 -1.26 -2.63 115.26 109.88 1c83 n ASN 42 Ca -0.02 -1.09 0.10 0.00 -0.53 0.00 0.00 54.58 53.04 1c83 n ASN 42 Cb 0.12 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 37.89 1c83 n ASN 42 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1c83 n ARG 43 N -0.77 1.78 -4.75 -3.83 1.74 -0.30 -4.89 116.66 105.64 1c83 n ARG 43 Ca 0.10 -1.61 -0.33 0.00 -0.77 0.00 0.00 57.85 55.23 1c83 n ARG 43 Cb 0.04 -1.39 -0.14 0.00 -1.02 0.00 0.00 32.46 29.96 1c83 n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1c83 s ASN 44 N -1.76 4.15 -0.03 0.55 0.01 -1.08 -4.35 114.94 112.44 1c83 s ASN 44 Ca 0.23 -0.25 -0.23 0.00 -0.71 0.00 0.00 52.86 51.90 1c83 s ASN 44 Cb 0.17 -1.41 -0.24 0.00 0.41 0.00 0.00 41.25 40.18 1c83 s ASN 44 CO 0.28 0.23 1.04 -0.09 -1.51 0.00 0.00 177.10 177.05 1c83 h ARG 45 N 6.25 0.27 -5.50 -0.60 2.43 -1.87 -3.45 114.38 111.90 1c83 h ARG 45 Ca -0.33 -0.29 -0.68 0.00 -0.81 0.00 0.00 59.98 57.86 1c83 h ARG 45 Cb 1.19 0.09 -0.32 0.00 -0.42 0.00 0.00 29.97 30.50 1c83 h ARG 45 CO 0.55 1.01 -0.88 0.71 -1.51 0.00 0.00 179.97 179.85 1c83 s TYR 46 N -3.10 2.54 0.40 2.20 2.02 -1.26 -5.03 117.35 115.11 1c83 s TYR 46 Ca -0.15 -0.96 0.18 0.00 -0.37 0.00 0.00 57.07 55.77 1c83 s TYR 46 Cb 0.02 -1.69 1.09 0.00 -0.40 0.00 0.00 41.96 40.98 1c83 s TYR 46 CO 0.78 -0.36 1.79 -0.09 -1.57 0.00 0.00 175.55 176.09 1c83 h ARG 47 N 6.55 0.40 -0.71 -0.62 2.43 -1.98 -2.67 114.38 117.78 1c83 h ARG 47 Ca -0.22 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1c83 h ARG 47 Cb 1.22 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1c83 h ARG 47 CO 0.47 0.26 0.00 -0.25 -1.51 0.00 0.00 179.97 178.95 1c83 n ASP 48 N -4.61 3.95 -3.90 -3.80 8.00 -1.26 -4.76 116.55 110.18 1c83 n ASP 48 Ca 0.24 -2.03 -0.29 0.00 0.71 0.00 0.00 54.79 53.42 1c83 n ASP 48 Cb 0.83 -0.48 -0.16 0.00 -0.02 0.00 0.00 41.12 41.29 1c83 n ASP 48 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1c83 s VAL 49 N -1.05 1.27 0.06 2.53 0.11 -1.01 -5.07 120.40 117.24 1c83 s VAL 49 Ca 0.48 -0.98 0.02 0.00 -2.93 0.00 0.00 61.98 58.57 1c83 s VAL 49 Cb 0.25 -1.56 -0.03 0.00 -1.53 0.00 0.00 36.38 33.52 1c83 s VAL 49 CO 0.32 -0.06 -0.08 -0.44 -3.33 0.00 0.00 175.10 171.51 1c83 s SER 50 N 1.52 0.98 0.30 3.54 0.01 -1.26 -4.61 113.70 114.18 1c83 s SER 50 Ca -0.03 -0.65 -0.29 0.00 1.31 0.00 0.00 55.95 56.29 1c83 s SER 50 Cb -0.18 0.04 -0.09 0.00 0.21 0.00 0.00 66.02 66.00 1c83 s SER 50 CO -0.07 -0.25 1.07 -2.16 0.41 0.00 0.00 173.24 172.25 1c83 s PRO 51 N -2.04 4.59 0.50 12.44 0.04 -1.26 -4.52 135.00 144.75 1c83 s PRO 51 Ca -0.05 1.72 -0.23 0.00 0.04 0.00 0.00 61.00 62.48 1c83 s PRO 51 Cb -0.07 -3.09 -0.07 0.00 0.04 0.00 0.00 34.50 31.31 1c83 s PRO 51 CO -0.00 0.19 1.33 1.19 0.04 0.00 0.00 177.00 179.75 1c83 n PHE 52 N 1.01 2.27 -0.14 0.56 3.72 -1.26 -4.47 117.46 119.16 1c83 n PHE 52 Ca -0.00 0.45 0.02 0.00 -0.05 0.00 0.00 57.45 57.87 1c83 n PHE 52 Cb 0.46 -2.37 0.32 0.00 -0.94 0.00 0.00 39.48 36.94 1c83 n PHE 52 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1c83 h ASP 53 N 1.69 0.70 0.67 4.37 3.32 -0.97 -2.52 116.42 123.69 1c83 h ASP 53 Ca -0.50 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.48 1c83 h ASP 53 Cb 1.30 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.67 1c83 h ASP 53 CO 0.58 0.51 -0.25 1.12 -1.72 0.00 0.00 179.24 179.47 1c83 h HIS 54 N 0.83 0.00 -0.03 4.55 2.07 -1.92 -3.19 115.15 117.45 1c83 h HIS 54 Ca 0.23 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.75 1c83 h HIS 54 Cb -0.06 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.92 1c83 h HIS 54 CO -0.00 0.25 0.00 -1.13 -3.07 0.00 0.00 177.93 173.98 1c83 n SER 55 N -3.58 1.65 -4.75 3.10 3.41 -1.17 -5.04 113.62 107.23 1c83 n SER 55 Ca -0.01 -1.36 -0.35 0.00 -0.26 0.00 0.00 58.87 56.89 1c83 n SER 55 Cb 0.39 -0.02 0.04 0.00 -0.26 0.00 0.00 64.21 64.36 1c83 n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c83 s ARG 56 N -0.58 2.94 -0.11 4.33 1.70 -0.96 -0.41 118.95 125.86 1c83 s ARG 56 Ca 0.08 1.76 -0.24 0.00 -0.47 0.00 0.00 55.73 56.86 1c83 s ARG 56 Cb 0.05 -1.93 -0.03 0.00 -0.57 0.00 0.00 34.95 32.47 1c83 s ARG 56 CO 0.08 -1.21 0.74 0.42 -1.08 0.00 0.00 175.30 174.24 1c83 s ILE 57 N -1.71 4.99 -0.19 4.99 -1.09 -0.73 -4.76 121.20 122.71 1c83 s ILE 57 Ca 0.76 1.49 -0.16 0.00 -2.23 0.00 0.00 60.65 60.51 1c83 s ILE 57 Cb -0.29 -4.07 -0.04 0.00 -1.58 0.00 0.00 42.46 36.49 1c83 s ILE 57 CO 0.34 0.16 0.40 -0.54 -1.23 0.00 0.00 174.94 174.07 1c83 s LYS 58 N 1.34 4.20 0.47 2.79 1.02 -1.26 -4.11 119.74 124.19 1c83 s LYS 58 Ca 0.37 0.22 -0.25 0.00 0.02 0.00 0.00 55.97 56.34 1c83 s LYS 58 Cb -0.17 -3.52 -0.08 0.00 -0.52 0.00 0.00 37.83 33.54 1c83 s LYS 58 CO 0.16 0.00 1.42 1.28 -0.92 0.00 0.00 175.35 177.29 1c83 n LEU 59 N 4.32 5.20 -3.76 3.17 4.32 0.96 -4.91 117.00 126.30 1c83 n LEU 59 Ca -0.08 1.09 -0.42 0.00 -0.02 0.00 0.00 56.01 56.58 1c83 n LEU 59 Cb 0.51 -1.60 0.00 0.00 -1.62 0.00 0.00 43.42 40.71 1c83 n LEU 59 CO 0.40 -0.25 2.28 1.41 -1.22 0.00 0.00 177.39 180.01 1c83 n HIS 60 N -0.39 3.03 -3.93 -1.77 8.25 -1.26 -4.59 115.22 114.56 1c83 n HIS 60 Ca 0.06 -2.86 -0.09 0.00 -0.26 0.00 0.00 57.72 54.57 1c83 n HIS 60 Cb 0.42 -2.13 -0.09 0.00 1.12 0.00 0.00 29.99 29.31 1c83 n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1c83 s GLN 61 N 1.09 0.58 0.14 -0.41 -2.07 -1.26 -5.07 119.66 112.67 1c83 s GLN 61 Ca 0.45 -0.76 0.20 0.00 -1.82 0.00 0.00 55.36 53.42 1c83 s GLN 61 Cb 0.12 0.23 -0.06 0.00 -1.09 0.00 0.00 33.01 32.21 1c83 s GLN 61 CO -0.03 -0.14 0.96 0.93 -1.32 0.00 0.00 175.29 175.68 1c83 h GLU 62 N 3.67 0.00 0.48 9.60 5.08 -2.02 -3.37 114.58 128.02 1c83 h GLU 62 Ca -0.33 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.01 1c83 h GLU 62 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1c83 h GLU 62 CO 0.51 0.14 -0.26 0.22 -1.00 0.00 0.00 179.01 178.61 1c83 h ASP 63 N 0.00 -0.63 -0.66 1.42 3.58 -1.98 -3.44 116.42 114.70 1c83 h ASP 63 Ca -0.07 0.03 0.17 0.00 0.42 0.00 0.00 57.03 57.57 1c83 h ASP 63 Cb 1.27 0.18 -0.21 0.00 1.72 0.00 0.00 39.33 42.29 1c83 h ASP 63 CO 0.02 -0.43 -0.06 0.21 -2.88 0.00 0.00 179.24 176.11 1c83 s ASN 64 N -4.59 -0.90 0.00 2.28 3.84 -1.26 -5.05 114.94 109.25 1c83 s ASN 64 Ca -0.17 0.58 0.07 0.00 0.21 0.00 0.00 52.86 53.55 1c83 s ASN 64 Cb 0.04 1.76 0.31 0.00 -0.55 0.00 0.00 41.25 42.82 1c83 s ASN 64 CO 0.63 -0.17 1.21 -0.90 -2.79 0.00 0.00 177.10 175.08 1c83 n ASP 65 N 5.45 0.40 -4.71 -4.21 5.68 -1.26 -4.86 116.55 113.04 1c83 n ASP 65 Ca -0.04 -1.87 -0.40 0.00 -0.50 0.00 0.00 54.79 51.98 1c83 n ASP 65 Cb 0.52 -0.04 -0.05 0.00 -1.14 0.00 0.00 41.12 40.41 1c83 n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1c83 s TYR 66 N -1.91 3.57 0.02 2.11 5.04 -1.26 -0.03 117.35 124.89 1c83 s TYR 66 Ca 0.11 1.26 0.01 0.00 -2.44 0.00 0.00 57.07 56.01 1c83 s TYR 66 Cb 0.05 -2.82 -0.02 0.00 0.35 0.00 0.00 41.96 39.53 1c83 s TYR 66 CO 0.08 0.07 -0.05 -1.50 -1.34 0.00 0.00 175.55 172.81 1c83 s ILE 67 N 0.88 0.30 -1.25 3.14 2.07 -1.26 -4.90 121.20 120.17 1c83 s ILE 67 Ca 0.38 -0.73 -0.20 0.00 -1.41 0.00 0.00 60.65 58.69 1c83 s ILE 67 Cb -0.18 -0.36 0.00 0.00 0.13 0.00 0.00 42.46 42.05 1c83 s ILE 67 CO 0.18 -0.29 1.83 -3.20 -1.91 0.00 0.00 174.94 171.55 1c83 n ASN 68 N 1.97 4.13 -3.77 4.50 2.85 -1.26 -4.65 115.26 119.04 1c83 n ASN 68 Ca -0.20 -2.83 -0.13 0.00 -0.11 0.00 0.00 54.58 51.31 1c83 n ASN 68 Cb 0.56 -1.73 -0.09 0.00 1.24 0.00 0.00 39.78 39.76 1c83 n ASN 68 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1c83 s ALA 69 N 6.88 -0.76 0.03 5.20 0.00 -1.26 -2.86 121.76 128.99 1c83 s ALA 69 Ca 0.59 0.46 0.03 0.00 0.00 0.00 0.00 51.96 53.05 1c83 s ALA 69 Cb 0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 1c83 s ALA 69 CO 0.10 -0.23 -0.10 -1.12 0.00 0.00 0.00 175.76 174.41 1c83 s SER 70 N -0.90 1.17 -0.32 0.00 0.01 0.48 -1.78 113.70 112.36 1c83 s SER 70 Ca -0.10 -0.39 -0.20 0.00 1.31 0.00 0.00 55.95 56.58 1c83 s SER 70 Cb -0.05 -0.06 -0.01 0.00 0.21 0.00 0.00 66.02 66.12 1c83 s SER 70 CO 0.03 -0.03 0.59 -0.22 0.41 0.00 0.00 173.24 174.03 1c83 s LEU 71 N -1.00 4.19 -0.42 2.44 0.20 0.45 -0.93 118.68 123.61 1c83 s LEU 71 Ca -0.02 0.29 -0.18 0.00 0.69 0.00 0.00 54.13 54.92 1c83 s LEU 71 Cb -0.07 -2.75 0.02 0.00 -0.43 0.00 0.00 46.19 42.97 1c83 s LEU 71 CO 0.01 -0.48 0.46 -0.63 -0.29 0.00 0.00 176.35 175.42 1c83 s ILE 72 N 2.56 5.05 -0.35 6.68 1.09 0.11 -4.87 121.20 131.46 1c83 s ILE 72 Ca 0.23 -0.28 -0.02 0.00 -1.10 0.00 0.00 60.65 59.47 1c83 s ILE 72 Cb -0.15 -4.06 0.08 0.00 -1.06 0.00 0.00 42.46 37.27 1c83 s ILE 72 CO 0.12 -0.44 0.10 -0.75 -0.10 0.00 0.00 174.94 173.87 1c83 s LYS 73 N 2.23 2.22 -0.48 2.79 2.20 -1.26 -1.34 119.74 126.10 1c83 s LYS 73 Ca 0.13 -1.52 -0.21 0.00 -0.36 0.00 0.00 55.97 54.02 1c83 s LYS 73 Cb -0.17 -3.38 0.04 0.00 -1.51 0.00 0.00 37.83 32.81 1c83 s LYS 73 CO 0.14 -0.83 0.68 -1.64 -0.36 0.00 0.00 175.35 173.34 1c83 s MET 74 N 1.20 3.23 -0.03 4.03 -1.94 -0.18 -4.95 119.30 120.66 1c83 s MET 74 Ca 0.02 -0.55 -0.20 0.00 -1.71 0.00 0.00 55.69 53.25 1c83 s MET 74 Cb -0.21 -4.02 -0.14 0.00 2.01 0.00 0.00 34.83 32.48 1c83 s MET 74 CO -0.02 -1.16 0.87 1.49 -0.01 0.00 0.00 175.02 176.18 1c83 h GLU 75 N 8.99 -0.36 0.05 2.03 4.81 -1.96 0.19 114.58 128.32 1c83 h GLU 75 Ca -0.26 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.00 1c83 h GLU 75 Cb 1.09 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.54 1c83 h GLU 75 CO 0.95 -0.04 -0.11 1.49 -0.73 0.00 0.00 179.01 180.57 1c83 h GLU 76 N -0.94 -0.20 -0.15 1.92 4.81 -1.97 -1.52 114.58 116.53 1c83 h GLU 76 Ca -0.04 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1c83 h GLU 76 Cb 0.50 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1c83 h GLU 76 CO 0.06 -0.13 0.16 0.00 -0.73 0.00 0.00 179.01 178.37 1c83 h ALA 77 N 0.72 1.78 -3.03 2.92 0.00 -1.93 -3.47 119.26 116.24 1c83 h ALA 77 Ca 0.02 -0.01 -0.37 0.00 0.00 0.00 0.00 54.91 54.56 1c83 h ALA 77 Cb 0.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1c83 h ALA 77 CO -0.07 -0.23 -0.50 1.04 0.00 0.00 0.00 179.25 179.48 1c83 n GLN 78 N -3.86 -2.24 -5.01 0.00 1.13 0.64 -4.87 117.38 103.16 1c83 n GLN 78 Ca 0.01 0.89 -0.27 0.00 -1.94 0.00 0.00 57.00 55.69 1c83 n GLN 78 Cb 0.27 -5.47 -0.16 0.00 0.11 0.00 0.00 30.24 24.99 1c83 n GLN 78 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1c83 s ARG 79 N -5.10 1.75 0.07 -1.09 3.52 -1.03 -5.00 118.95 112.07 1c83 s ARG 79 Ca 0.07 -0.73 0.07 0.00 -0.13 0.00 0.00 55.73 55.01 1c83 s ARG 79 Cb -0.03 -1.65 -0.04 0.00 -1.56 0.00 0.00 34.95 31.67 1c83 s ARG 79 CO 0.08 0.42 -0.16 -1.12 -0.81 0.00 0.00 175.30 173.71 1c83 s SER 80 N -0.40 4.00 0.00 -2.12 0.01 -1.26 -1.01 113.70 112.92 1c83 s SER 80 Ca 0.06 -0.43 0.03 0.00 1.31 0.00 0.00 55.95 56.92 1c83 s SER 80 Cb -0.09 -0.67 -0.01 0.00 0.21 0.00 0.00 66.02 65.46 1c83 s SER 80 CO -0.00 0.22 -0.11 -0.31 0.41 0.00 0.00 173.24 173.46 1c83 s TYR 81 N -1.04 0.95 -0.22 2.43 1.51 -0.45 -4.05 117.35 116.48 1c83 s TYR 81 Ca 0.17 -0.22 -0.18 0.00 -1.01 0.00 0.00 57.07 55.83 1c83 s TYR 81 Cb -0.11 -0.60 -0.03 0.00 -0.11 0.00 0.00 41.96 41.11 1c83 s TYR 81 CO 0.08 -0.01 0.50 0.42 -1.11 0.00 0.00 175.55 175.43 1c83 s ILE 82 N -0.39 5.11 -0.12 2.71 1.01 0.12 0.08 121.20 129.71 1c83 s ILE 82 Ca 0.03 0.89 -0.04 0.00 0.00 0.00 0.00 60.65 61.53 1c83 s ILE 82 Cb -0.05 -3.82 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 1c83 s ILE 82 CO -0.00 0.17 0.02 -0.76 0.00 0.00 0.00 174.94 174.37 1c83 s LEU 83 N 1.75 3.67 0.12 2.97 1.02 -0.11 0.16 118.68 128.26 1c83 s LEU 83 Ca 0.22 0.12 -0.09 0.00 0.02 0.00 0.00 54.13 54.41 1c83 s LEU 83 Cb -0.15 -1.87 -0.00 0.00 0.02 0.00 0.00 46.19 44.18 1c83 s LEU 83 CO 0.09 0.30 0.23 0.28 0.02 0.00 0.00 176.35 177.27 1c83 s THR 84 N -0.40 0.11 0.93 5.49 -1.32 -0.51 -0.39 115.64 119.56 1c83 s THR 84 Ca 0.08 -1.27 -0.12 0.00 -1.21 0.00 0.00 61.69 59.17 1c83 s THR 84 Cb -0.12 -1.55 0.15 0.00 -1.51 0.00 0.00 72.50 69.47 1c83 s THR 84 CO 0.02 -0.50 1.12 0.00 -2.21 0.00 0.00 174.62 173.05 1c83 s GLN 85 N -3.91 0.95 0.04 7.08 -2.07 -1.13 -3.31 119.66 117.31 1c83 s GLN 85 Ca 0.10 0.36 -0.31 0.00 -1.82 0.00 0.00 55.36 53.70 1c83 s GLN 85 Cb 0.04 -1.81 -0.07 0.00 -1.09 0.00 0.00 33.01 30.08 1c83 s GLN 85 CO -0.06 -2.34 1.49 0.20 -1.32 0.00 0.00 175.29 173.26 1c83 s GLY 86 N -3.86 1.75 0.31 2.60 0.00 0.11 -4.87 107.32 103.35 1c83 s GLY 86 Ca 0.64 1.04 -0.27 0.00 0.00 0.00 0.00 44.72 46.13 1c83 s GLY 86 CO 0.55 2.63 0.94 -1.05 0.00 0.00 0.00 173.10 176.16 1c83 n PRO 87 N 5.22 1.20 -2.32 2.90 -0.02 -1.26 -4.67 135.00 136.05 1c83 n PRO 87 Ca 0.14 0.42 -0.28 0.00 -2.02 0.00 0.00 63.50 61.76 1c83 n PRO 87 Cb 0.42 -1.78 0.03 0.00 -0.02 0.00 0.00 33.50 32.15 1c83 n PRO 87 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1c83 s LEU 88 N 0.63 3.26 0.64 2.45 2.01 -1.26 -0.71 118.68 125.69 1c83 s LEU 88 Ca 0.60 0.88 0.43 0.00 0.01 0.00 0.00 54.13 56.05 1c83 s LEU 88 Cb -0.69 -3.75 2.34 0.00 0.01 0.00 0.00 46.19 44.10 1c83 s LEU 88 CO 0.59 -1.00 2.32 -0.65 1.01 0.00 0.00 176.35 178.62 1c83 h PRO 89 N -0.19 0.00 -0.25 1.29 0.11 -1.95 -2.11 132.00 128.91 1c83 h PRO 89 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1c83 h PRO 89 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1c83 h PRO 89 CO 0.61 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.67 1c83 n ASN 90 N -3.01 3.02 -0.15 -2.05 6.94 -1.26 -4.44 115.26 114.32 1c83 n ASN 90 Ca -0.03 -1.89 0.07 0.00 -0.02 0.00 0.00 54.58 52.71 1c83 n ASN 90 Cb 0.07 -0.15 0.10 0.00 -2.36 0.00 0.00 39.78 37.43 1c83 n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1c83 n THR 91 N 1.18 1.40 0.07 5.53 -2.24 -0.80 -4.67 114.28 114.76 1c83 n THR 91 Ca 0.15 -1.67 -0.13 0.00 -2.27 0.00 0.00 64.05 60.13 1c83 n THR 91 Cb 0.52 -0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 1c83 n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c83 h GLY 93 N 1.35 0.57 0.68 0.00 0.00 -1.91 -2.44 103.07 101.32 1c83 h GLY 93 Ca -0.08 -0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.20 1c83 h GLY 93 CO 0.16 0.03 0.15 0.45 0.00 0.00 0.00 176.54 177.33 1c83 h HIS 94 N 0.33 0.27 -0.19 5.60 3.86 -1.83 0.74 115.15 123.93 1c83 h HIS 94 Ca 0.20 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.48 1c83 h HIS 94 Cb 0.18 -0.06 -0.06 0.00 1.06 0.00 0.00 27.41 28.54 1c83 h HIS 94 CO -0.15 0.11 -0.18 0.35 0.86 0.00 0.00 177.93 178.92 1c83 h PHE 95 N 0.32 -0.46 -0.06 2.45 3.57 -1.01 -0.56 116.94 121.18 1c83 h PHE 95 Ca 0.18 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.58 1c83 h PHE 95 Cb 0.15 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 1c83 h PHE 95 CO -0.14 -0.25 -0.53 -1.49 -2.23 0.00 0.00 178.31 173.67 1c83 h TRP 96 N -0.20 0.20 -0.39 0.41 4.06 -1.28 -1.40 115.95 117.35 1c83 h TRP 96 Ca 0.12 -0.07 0.08 0.00 2.06 0.00 0.00 58.89 61.08 1c83 h TRP 96 Cb 0.37 -0.04 -0.07 0.00 -1.00 0.00 0.00 29.16 28.42 1c83 h TRP 96 CO -0.32 0.66 -0.07 1.49 -3.56 0.00 0.00 178.44 176.64 1c83 h GLU 97 N 0.13 0.03 -0.42 0.49 4.81 -0.61 -0.60 114.58 118.41 1c83 h GLU 97 Ca 0.00 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1c83 h GLU 97 Cb 0.98 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.33 1c83 h GLU 97 CO 0.08 0.02 0.09 1.98 -0.73 0.00 0.00 179.01 180.45 1c83 h MET 98 N 0.03 0.69 -0.34 1.92 4.05 -0.74 0.96 114.93 121.49 1c83 h MET 98 Ca 0.19 -0.17 0.06 0.00 -0.28 0.00 0.00 59.70 59.50 1c83 h MET 98 Cb 0.28 -0.09 -0.05 0.00 -0.80 0.00 0.00 31.60 30.94 1c83 h MET 98 CO -0.38 0.70 0.02 0.28 0.23 0.00 0.00 176.91 177.76 1c83 h VAL 99 N 0.55 0.77 0.31 -5.77 2.07 -1.08 0.14 116.25 113.24 1c83 h VAL 99 Ca 0.13 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1c83 h VAL 99 Cb 0.33 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1c83 h VAL 99 CO 0.00 0.02 -0.34 -0.25 0.02 0.00 0.00 177.57 177.02 1c83 h TRP 100 N 0.12 -0.93 -0.62 1.57 2.91 -0.93 -2.00 115.95 116.08 1c83 h TRP 100 Ca 0.16 0.01 -0.08 0.00 1.13 0.00 0.00 58.89 60.12 1c83 h TRP 100 Cb 0.21 0.37 -0.03 0.00 -0.51 0.00 0.00 29.16 29.20 1c83 h TRP 100 CO -0.23 -0.48 0.09 0.93 -1.03 0.00 0.00 178.44 177.72 1c83 h GLU 101 N -0.69 1.02 0.00 2.65 5.08 -0.60 -2.53 114.58 119.51 1c83 h GLU 101 Ca -0.01 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1c83 h GLU 101 Cb 0.64 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1c83 h GLU 101 CO -0.08 0.94 0.00 1.04 -1.00 0.00 0.00 179.01 179.91 1c83 n GLN 102 N -4.22 0.00 -2.70 2.33 1.13 0.48 -4.93 117.38 109.47 1c83 n GLN 102 Ca 0.04 0.10 -0.19 0.00 -1.94 0.00 0.00 57.00 55.00 1c83 n GLN 102 Cb 0.29 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 29.15 1c83 n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1c83 n LYS 103 N -1.51 -3.23 -2.42 -1.09 5.02 -0.79 -3.89 118.16 110.25 1c83 n LYS 103 Ca 0.06 0.83 -0.37 0.00 -2.02 0.00 0.00 58.31 56.81 1c83 n LYS 103 Cb 0.28 -5.42 -0.03 0.00 -0.02 0.00 0.00 35.03 29.84 1c83 n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1c83 s SER 104 N -2.53 6.49 -0.16 4.39 0.01 -0.97 0.05 113.70 120.99 1c83 s SER 104 Ca 0.17 2.15 0.12 0.00 1.31 0.00 0.00 55.95 59.70 1c83 s SER 104 Cb -0.07 -2.59 -0.23 0.00 0.21 0.00 0.00 66.02 63.33 1c83 s SER 104 CO 0.20 -0.69 0.22 -1.14 0.41 0.00 0.00 173.24 172.25 1c83 n ARG 105 N -0.29 0.67 -4.28 12.44 0.00 -1.26 -4.87 116.66 119.07 1c83 n ARG 105 Ca 0.06 0.12 -0.22 0.00 -0.00 0.00 0.00 57.85 57.81 1c83 n ARG 105 Cb 0.49 -1.61 -0.12 0.00 0.00 0.00 0.00 32.46 31.22 1c83 n ARG 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1c83 s GLY 106 N -5.53 1.22 -0.15 5.14 0.00 -1.26 -0.85 107.32 105.89 1c83 s GLY 106 Ca -0.13 -1.27 0.01 0.00 0.00 0.00 0.00 44.72 43.33 1c83 s GLY 106 CO 0.79 -1.29 -0.18 0.14 0.00 0.00 0.00 173.10 172.56 1c83 s VAL 107 N -1.44 1.82 -0.30 1.40 1.01 0.25 -1.79 120.40 121.35 1c83 s VAL 107 Ca 0.08 -0.81 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 1c83 s VAL 107 Cb -0.09 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.62 1c83 s VAL 107 CO 0.04 0.50 0.15 -0.69 0.00 0.00 0.00 175.10 175.11 1c83 s VAL 108 N 1.15 4.70 -0.26 2.92 1.01 0.12 -0.38 120.40 129.66 1c83 s VAL 108 Ca -0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 1c83 s VAL 108 Cb -0.14 -3.35 0.01 0.00 0.00 0.00 0.00 36.38 32.90 1c83 s VAL 108 CO -0.07 0.12 0.00 -0.32 0.00 0.00 0.00 175.10 174.83 1c83 s MET 109 N 1.64 3.14 0.00 2.72 0.00 -0.37 -0.47 119.30 125.96 1c83 s MET 109 Ca 0.05 -0.80 0.14 0.00 0.00 0.00 0.00 55.69 55.08 1c83 s MET 109 Cb -0.17 -3.15 0.29 0.00 0.00 0.00 0.00 34.83 31.81 1c83 s MET 109 CO 0.07 -0.34 1.19 1.28 0.00 0.00 0.00 175.02 177.22 1c83 n LEU 110 N 4.79 2.83 -4.55 4.11 4.77 0.34 -1.28 117.00 128.01 1c83 n LEU 110 Ca -0.16 -1.66 -0.26 0.00 -0.03 0.00 0.00 56.01 53.90 1c83 n LEU 110 Cb 0.49 -0.19 -0.11 0.00 -2.33 0.00 0.00 43.42 41.28 1c83 n LEU 110 CO 0.29 0.66 -0.38 0.54 -1.33 0.00 0.00 177.39 177.17 1c83 s ASN 111 N -1.06 3.71 0.36 -1.43 2.20 -1.25 -4.53 114.94 112.93 1c83 s ASN 111 Ca 0.25 -1.21 0.00 0.00 -0.94 0.00 0.00 52.86 50.96 1c83 s ASN 111 Cb 0.14 -0.35 -0.03 0.00 -2.00 0.00 0.00 41.25 39.01 1c83 s ASN 111 CO 0.19 -0.23 0.56 -0.13 -2.94 0.00 0.00 177.10 174.56 1c83 s ARG 112 N -3.62 3.49 0.14 3.55 0.52 -1.26 -4.84 118.95 116.92 1c83 s ARG 112 Ca 0.33 -0.30 -0.17 0.00 -0.52 0.00 0.00 55.73 55.06 1c83 s ARG 112 Cb 0.03 -2.64 -0.01 0.00 0.52 0.00 0.00 34.95 32.84 1c83 s ARG 112 CO 0.16 0.12 1.75 0.28 0.02 0.00 0.00 175.30 177.64 1c83 h VAL 113 N 0.72 1.13 -3.40 3.52 2.07 -1.94 -3.41 116.25 114.94 1c83 h VAL 113 Ca -0.50 -0.32 -0.63 0.00 0.82 0.00 0.00 66.70 66.07 1c83 h VAL 113 Cb 1.22 0.70 -0.19 0.00 -1.52 0.00 0.00 31.29 31.50 1c83 h VAL 113 CO 0.61 0.13 -0.61 -0.32 0.02 0.00 0.00 177.57 177.41 1c83 s MET 114 N -5.93 3.81 -0.08 1.57 -2.45 -1.26 -0.03 119.30 114.93 1c83 s MET 114 Ca -0.13 -0.43 -0.07 0.00 -1.25 0.00 0.00 55.69 53.81 1c83 s MET 114 Cb 0.10 -3.18 0.02 0.00 1.25 0.00 0.00 34.83 33.02 1c83 s MET 114 CO 0.72 0.13 0.22 -1.21 1.05 0.00 0.00 175.02 175.93 1c83 s GLU 115 N 0.74 0.25 -1.53 4.11 2.02 -0.41 -4.89 118.70 119.00 1c83 s GLU 115 Ca 0.02 0.31 -0.12 0.00 0.02 0.00 0.00 54.97 55.21 1c83 s GLU 115 Cb -0.14 0.11 0.08 0.00 0.10 0.00 0.00 34.13 34.28 1c83 s GLU 115 CO 0.02 -0.04 0.86 1.63 0.02 0.00 0.00 175.26 177.75 1c83 n LYS 116 N 3.05 -4.80 -1.02 1.61 5.02 -1.26 -1.79 118.16 118.97 1c83 n LYS 116 Ca -0.13 0.54 -0.01 0.00 -2.02 0.00 0.00 58.31 56.69 1c83 n LYS 116 Cb 0.58 -5.29 -0.00 0.00 -0.02 0.00 0.00 35.03 30.30 1c83 n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c83 n GLY 117 N -1.65 0.19 3.39 0.72 0.00 -1.26 -5.00 105.19 101.59 1c83 n GLY 117 Ca -0.03 -0.01 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 1c83 n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c83 s SER 118 N -2.03 2.75 -0.32 1.61 0.01 -0.74 -5.13 113.70 109.85 1c83 s SER 118 Ca 0.00 -1.09 -0.21 0.00 1.31 0.00 0.00 55.95 55.95 1c83 s SER 118 Cb 0.00 -0.17 -0.00 0.00 0.21 0.00 0.00 66.02 66.06 1c83 s SER 118 CO 0.00 -0.22 0.69 -0.76 0.41 0.00 0.00 173.24 173.36 1c83 s LEU 119 N -3.39 4.15 0.00 2.44 1.43 -1.26 -1.29 118.68 120.76 1c83 s LEU 119 Ca 0.26 0.42 0.24 0.00 -1.03 0.00 0.00 54.13 54.02 1c83 s LEU 119 Cb 0.01 -2.90 0.20 0.00 0.03 0.00 0.00 46.19 43.53 1c83 s LEU 119 CO 0.10 -0.57 1.25 0.29 0.23 0.00 0.00 176.35 177.64 1c83 n LYS 120 N 6.07 1.87 -3.63 1.70 4.76 0.96 -4.96 118.16 124.93 1c83 n LYS 120 Ca 0.01 -1.52 -0.05 0.00 -2.87 0.00 0.00 58.31 53.88 1c83 n LYS 120 Cb 0.48 -1.47 -0.06 0.00 -1.84 0.00 0.00 35.03 32.15 1c83 n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1c83 s ALA 122 N -0.50 2.66 -1.19 0.00 0.00 0.11 -4.75 121.76 118.08 1c83 s ALA 122 Ca 0.06 0.54 -0.22 0.00 0.00 0.00 0.00 51.96 52.34 1c83 s ALA 122 Cb -0.03 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1c83 s ALA 122 CO -0.09 -0.91 1.87 -1.14 0.00 0.00 0.00 175.76 175.50 1c83 s GLN 123 N -3.86 2.90 0.00 0.00 2.00 -1.26 -4.79 119.66 114.66 1c83 s GLN 123 Ca 0.67 -1.32 0.18 0.00 -2.00 0.00 0.00 55.36 52.89 1c83 s GLN 123 Cb -0.19 -5.31 0.57 0.00 0.80 0.00 0.00 33.01 28.88 1c83 s GLN 123 CO 0.35 -3.47 1.44 2.48 -0.50 0.00 0.00 175.29 175.59 1c83 n TYR 124 N 12.72 0.37 -4.09 1.67 0.18 -1.26 -4.88 117.16 121.87 1c83 n TYR 124 Ca 0.45 -0.18 -0.12 0.00 1.88 0.00 0.00 57.90 59.92 1c83 n TYR 124 Cb 0.47 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.32 1c83 n TYR 124 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 1c83 s TRP 125 N -1.63 0.72 0.28 -3.48 -2.14 -1.26 -5.06 118.94 106.37 1c83 s TRP 125 Ca 0.31 -0.61 -0.29 0.00 2.66 0.00 0.00 56.10 58.17 1c83 s TRP 125 Cb 0.17 -0.43 -0.10 0.00 -3.10 0.00 0.00 33.47 30.01 1c83 s TRP 125 CO 0.24 -0.11 1.23 -1.25 -2.66 0.00 0.00 176.95 174.40 1c83 s PRO 126 N -2.17 4.47 0.00 3.25 0.04 -1.26 -4.95 135.00 134.38 1c83 s PRO 126 Ca -0.04 2.03 0.24 0.00 0.04 0.00 0.00 61.00 63.26 1c83 s PRO 126 Cb -0.06 -3.14 0.23 0.00 0.04 0.00 0.00 34.50 31.57 1c83 s PRO 126 CO -0.01 -0.05 1.22 1.04 0.04 0.00 0.00 177.00 179.24 1c83 n GLN 127 N 1.33 0.36 -3.78 4.56 6.02 -1.26 -4.58 117.38 120.04 1c83 n GLN 127 Ca 0.01 -0.26 -0.13 0.00 -0.01 0.00 0.00 57.00 56.61 1c83 n GLN 127 Cb 0.43 -1.49 -0.09 0.00 1.02 0.00 0.00 30.24 30.11 1c83 n GLN 127 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 1c83 s LYS 128 N -2.82 0.66 0.20 -1.09 -2.85 -1.26 -5.06 119.74 107.52 1c83 s LYS 128 Ca 0.14 -0.25 -0.16 0.00 -1.00 0.00 0.00 55.97 54.70 1c83 s LYS 128 Cb 0.17 0.29 0.19 0.00 -2.06 0.00 0.00 37.83 36.42 1c83 s LYS 128 CO 0.70 -0.18 1.62 0.93 0.10 0.00 0.00 175.35 178.52 1c83 h GLU 129 N 3.86 -0.04 0.00 1.78 3.07 -1.91 -2.31 114.58 119.03 1c83 h GLU 129 Ca -0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.56 1c83 h GLU 129 Cb 1.18 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 1c83 h GLU 129 CO 0.41 -0.03 0.00 0.39 -1.40 0.00 0.00 179.01 178.38 1c83 n GLU 130 N -5.42 0.21 -3.41 2.33 4.71 -1.26 -4.07 120.64 113.73 1c83 n GLU 130 Ca 0.06 0.36 -0.36 0.00 -0.01 0.00 0.00 57.16 57.21 1c83 n GLU 130 Cb 0.32 -1.84 -0.05 0.00 -1.01 0.00 0.00 31.44 28.86 1c83 n GLU 130 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1c83 n LYS 131 N -2.22 3.13 -0.86 3.49 5.02 -0.87 -5.08 118.16 120.77 1c83 n LYS 131 Ca 0.03 -4.55 -0.30 0.00 -2.02 0.00 0.00 58.31 51.47 1c83 n LYS 131 Cb 0.28 -2.40 0.16 0.00 -0.02 0.00 0.00 35.03 33.05 1c83 n LYS 131 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1c83 s GLU 132 N -2.04 1.04 -0.09 1.97 1.03 -1.26 -4.62 118.70 114.73 1c83 s GLU 132 Ca 0.32 1.28 -0.01 0.00 0.03 0.00 0.00 54.97 56.58 1c83 s GLU 132 Cb 0.02 -1.75 -0.03 0.00 -0.80 0.00 0.00 34.13 31.56 1c83 s GLU 132 CO -0.04 -2.52 -0.02 -1.64 -1.33 0.00 0.00 175.26 169.71 1c83 s MET 133 N -4.72 3.05 -0.12 -4.83 -1.94 0.88 -4.97 119.30 106.66 1c83 s MET 133 Ca 0.65 -0.46 0.01 0.00 -1.71 0.00 0.00 55.69 54.18 1c83 s MET 133 Cb -0.21 -2.76 -0.01 0.00 2.01 0.00 0.00 34.83 33.85 1c83 s MET 133 CO 0.58 0.61 -0.15 0.42 -0.01 0.00 0.00 175.02 176.48 1c83 s ILE 134 N -0.64 2.92 -0.67 2.53 1.01 -1.26 0.23 121.20 125.33 1c83 s ILE 134 Ca 0.10 -0.72 -0.09 0.00 0.00 0.00 0.00 60.65 59.94 1c83 s ILE 134 Cb -0.12 -2.20 0.17 0.00 0.01 0.00 0.00 42.46 40.32 1c83 s ILE 134 CO 0.02 0.54 0.55 -0.36 0.00 0.00 0.00 174.94 175.69 1c83 s PHE 135 N 0.21 3.54 0.42 3.97 0.08 0.72 -4.94 117.98 121.98 1c83 s PHE 135 Ca -0.09 -2.21 0.12 0.00 0.12 0.00 0.00 56.93 54.87 1c83 s PHE 135 Cb -0.15 -3.52 0.89 0.00 -0.57 0.00 0.00 43.02 39.66 1c83 s PHE 135 CO 0.05 -0.94 1.94 0.93 -0.10 0.00 0.00 175.22 177.11 1c83 h GLU 136 N 7.69 0.10 -0.45 0.44 5.08 -1.96 0.43 114.58 125.90 1c83 h GLU 136 Ca -0.02 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 1c83 h GLU 136 Cb 1.02 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 1c83 h GLU 136 CO 0.77 0.28 0.10 0.38 -1.00 0.00 0.00 179.01 179.54 1c83 h ASP 137 N 0.09 0.62 -0.25 1.42 2.03 -1.96 -2.86 116.42 115.51 1c83 h ASP 137 Ca 0.02 -0.10 0.00 0.00 -0.73 0.00 0.00 57.03 56.22 1c83 h ASP 137 Cb 0.37 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 38.71 1c83 h ASP 137 CO 0.03 0.62 0.00 0.35 -1.03 0.00 0.00 179.24 179.21 1c83 n THR 138 N -4.30 0.43 -3.70 1.15 -2.24 -1.04 -5.00 114.28 99.58 1c83 n THR 138 Ca 0.03 -0.72 -0.24 0.00 -2.27 0.00 0.00 64.05 60.85 1c83 n THR 138 Cb 0.21 1.00 0.05 0.00 -2.10 0.00 0.00 70.33 69.49 1c83 n THR 138 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1c83 n ASN 139 N 1.06 -4.07 -4.22 3.42 5.15 0.14 -4.90 115.26 111.83 1c83 n ASN 139 Ca 0.14 -0.69 -0.28 0.00 -0.60 0.00 0.00 54.58 53.15 1c83 n ASN 139 Cb 0.48 -4.46 -0.16 0.00 -0.53 0.00 0.00 39.78 35.11 1c83 n ASN 139 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1c83 s LEU 140 N -7.02 2.02 -0.03 1.20 1.02 -0.90 -0.60 118.68 114.37 1c83 s LEU 140 Ca 0.40 -0.41 -0.01 0.00 0.02 0.00 0.00 54.13 54.13 1c83 s LEU 140 Cb -0.19 -1.14 -0.04 0.00 0.02 0.00 0.00 46.19 44.85 1c83 s LEU 140 CO 0.78 0.24 0.06 -0.75 0.02 0.00 0.00 176.35 176.70 1c83 s LYS 141 N -0.34 3.02 -0.05 1.70 2.20 0.25 -0.20 119.74 126.32 1c83 s LYS 141 Ca 0.04 -0.47 0.01 0.00 -0.36 0.00 0.00 55.97 55.19 1c83 s LYS 141 Cb -0.10 -2.83 0.02 0.00 -1.51 0.00 0.00 37.83 33.41 1c83 s LYS 141 CO 0.01 0.66 -0.05 -1.17 -0.36 0.00 0.00 175.35 174.43 1c83 s LEU 142 N -1.51 1.33 -0.07 5.43 2.96 0.14 -0.29 118.68 126.66 1c83 s LEU 142 Ca 0.20 -0.15 0.02 0.00 -0.22 0.00 0.00 54.13 53.98 1c83 s LEU 142 Cb -0.12 -0.51 0.01 0.00 0.50 0.00 0.00 46.19 46.08 1c83 s LEU 142 CO 0.10 -0.05 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.07 1c83 s THR 143 N 0.96 1.18 -0.15 3.68 2.01 -0.10 -0.08 115.64 123.13 1c83 s THR 143 Ca -0.10 -0.49 -0.29 0.00 0.31 0.00 0.00 61.69 61.11 1c83 s THR 143 Cb -0.14 -1.08 -0.04 0.00 0.01 0.00 0.00 72.50 71.24 1c83 s THR 143 CO 0.00 0.37 1.70 -0.22 -0.69 0.00 0.00 174.62 175.78 1c83 s LEU 144 N 0.74 4.02 -0.07 4.42 2.96 -1.26 0.18 118.68 129.67 1c83 s LEU 144 Ca -0.13 1.90 0.04 0.00 -0.22 0.00 0.00 54.13 55.72 1c83 s LEU 144 Cb -0.16 -3.53 -0.25 0.00 0.50 0.00 0.00 46.19 42.76 1c83 s LEU 144 CO 0.03 -1.20 0.57 0.40 -1.32 0.00 0.00 176.35 174.83 1c83 h ILE 145 N 6.02 0.79 -1.19 6.68 1.08 -0.30 -3.38 117.51 127.22 1c83 h ILE 145 Ca -0.37 -2.58 0.33 0.00 -0.39 0.00 0.00 64.86 61.86 1c83 h ILE 145 Cb 1.17 2.48 -0.17 0.00 -3.07 0.00 0.00 36.82 37.23 1c83 h ILE 145 CO 0.98 0.68 0.93 -0.94 -0.69 0.00 0.00 178.15 179.10 1c83 s SER 146 N -6.53 -0.04 -0.05 1.72 1.04 -1.07 -4.99 113.70 103.77 1c83 s SER 146 Ca -0.12 -0.02 -0.09 0.00 0.48 0.00 0.00 55.95 56.20 1c83 s SER 146 Cb 0.07 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.27 1c83 s SER 146 CO 0.81 -0.11 0.22 -1.83 0.98 0.00 0.00 173.24 173.31 1c83 s GLU 147 N -2.17 0.38 -0.35 4.02 -1.05 -1.26 -0.73 118.70 117.54 1c83 s GLU 147 Ca 0.13 0.05 0.01 0.00 -0.15 0.00 0.00 54.97 55.01 1c83 s GLU 147 Cb 0.02 0.17 0.09 0.00 -0.44 0.00 0.00 34.13 33.98 1c83 s GLU 147 CO -0.04 -0.08 0.08 0.34 0.95 0.00 0.00 175.26 176.51 1c83 s ASP 148 N -0.49 4.90 -0.32 0.83 2.15 0.20 -4.99 116.67 118.95 1c83 s ASP 148 Ca -0.06 -1.94 -0.20 0.00 0.43 0.00 0.00 52.55 50.78 1c83 s ASP 148 Cb -0.04 -1.69 -0.01 0.00 -0.30 0.00 0.00 42.92 40.88 1c83 s ASP 148 CO 0.01 -0.40 0.62 -0.63 -0.17 0.00 0.00 175.17 174.60 1c83 s ILE 149 N 1.03 4.93 0.59 4.11 1.01 -1.26 -1.32 121.20 130.30 1c83 s ILE 149 Ca 0.06 0.73 0.10 0.00 0.00 0.00 0.00 60.65 61.54 1c83 s ILE 149 Cb -0.20 -4.01 0.09 0.00 0.01 0.00 0.00 42.46 38.35 1c83 s ILE 149 CO -0.06 -0.19 0.79 -0.54 0.00 0.00 0.00 174.94 174.94 1c83 s LYS 150 N 2.61 2.24 0.33 2.79 -0.14 0.68 -5.01 119.74 123.24 1c83 s LYS 150 Ca 0.24 -1.73 0.06 0.00 -1.36 0.00 0.00 55.97 53.18 1c83 s LYS 150 Cb -0.15 -2.58 0.59 0.00 -1.68 0.00 0.00 37.83 34.01 1c83 s LYS 150 CO 0.13 -0.92 1.83 1.79 -0.76 0.00 0.00 175.35 177.42 1c83 h THR 151 N 0.17 1.22 0.00 2.17 1.35 -0.76 -3.34 112.91 113.72 1c83 h THR 151 Ca -0.29 -0.97 0.00 0.00 -0.55 0.00 0.00 66.41 64.59 1c83 h THR 151 Cb 1.29 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 1c83 h THR 151 CO 0.42 0.31 0.00 0.00 -0.25 0.00 0.00 175.52 176.00 1c83 n TYR 152 N -4.21 0.00 -3.85 4.73 4.11 -1.26 -4.99 117.16 111.68 1c83 n TYR 152 Ca 0.00 -0.09 -0.09 0.00 -0.00 0.00 0.00 57.90 57.72 1c83 n TYR 152 Cb 0.31 -0.01 -0.04 0.00 -0.00 0.00 0.00 39.34 39.61 1c83 n TYR 152 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.86 178.38 1c83 s TYR 153 N -0.19 0.02 0.00 -3.48 1.13 -1.25 -1.68 117.35 111.89 1c83 s TYR 153 Ca 0.00 -0.39 0.00 0.00 -1.41 0.00 0.00 57.07 55.27 1c83 s TYR 153 Cb 0.00 0.40 -0.00 0.00 -1.10 0.00 0.00 41.96 41.26 1c83 s TYR 153 CO 0.00 -1.02 -0.02 0.99 -2.51 0.00 0.00 175.55 172.99 1c83 s THR 154 N -3.93 0.13 -0.10 -3.49 2.01 0.16 -0.23 115.64 110.19 1c83 s THR 154 Ca 0.14 -0.18 0.01 0.00 0.31 0.00 0.00 61.69 61.97 1c83 s THR 154 Cb -0.02 -0.14 -0.02 0.00 0.01 0.00 0.00 72.50 72.33 1c83 s THR 154 CO 0.03 -0.03 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.11 1c83 s VAL 155 N -0.22 3.11 0.05 3.82 1.01 -0.43 -0.54 120.40 127.20 1c83 s VAL 155 Ca -0.01 -0.67 0.07 0.00 0.00 0.00 0.00 61.98 61.37 1c83 s VAL 155 Cb -0.02 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 1c83 s VAL 155 CO -0.00 0.55 -0.19 -0.13 0.00 0.00 0.00 175.10 175.33 1c83 s ARG 156 N -0.13 1.27 -0.26 2.72 0.52 0.11 0.59 118.95 123.76 1c83 s ARG 156 Ca -0.01 -0.93 -0.09 0.00 -0.52 0.00 0.00 55.73 54.18 1c83 s ARG 156 Cb -0.14 -1.37 -0.04 0.00 0.52 0.00 0.00 34.95 33.92 1c83 s ARG 156 CO 0.03 0.35 0.13 -1.14 0.02 0.00 0.00 175.30 174.69 1c83 s GLN 157 N -1.24 3.82 -0.08 3.54 0.74 0.09 -0.23 119.66 126.29 1c83 s GLN 157 Ca 0.06 -0.39 0.01 0.00 0.05 0.00 0.00 55.36 55.09 1c83 s GLN 157 Cb -0.09 -3.48 -0.03 0.00 1.10 0.00 0.00 33.01 30.51 1c83 s GLN 157 CO 0.02 -0.16 -0.10 -0.51 -0.55 0.00 0.00 175.29 173.99 1c83 s LEU 158 N 1.62 2.98 -0.16 3.68 1.02 -0.15 0.50 118.68 128.18 1c83 s LEU 158 Ca 0.07 -0.13 -0.05 0.00 0.02 0.00 0.00 54.13 54.03 1c83 s LEU 158 Cb -0.15 -1.65 -0.04 0.00 0.02 0.00 0.00 46.19 44.37 1c83 s LEU 158 CO 0.07 0.31 0.02 -0.70 0.02 0.00 0.00 176.35 176.07 1c83 s GLU 159 N -0.51 3.75 -0.21 1.70 2.12 0.13 -0.80 118.70 124.89 1c83 s GLU 159 Ca 0.07 -0.41 -0.05 0.00 0.36 0.00 0.00 54.97 54.94 1c83 s GLU 159 Cb -0.12 -3.06 -0.02 0.00 0.26 0.00 0.00 34.13 31.19 1c83 s GLU 159 CO 0.02 0.32 -0.00 -1.17 -0.54 0.00 0.00 175.26 173.89 1c83 s LEU 160 N 0.20 3.20 -0.17 2.70 0.20 0.34 -0.93 118.68 124.21 1c83 s LEU 160 Ca 0.02 -0.24 -0.01 0.00 0.69 0.00 0.00 54.13 54.59 1c83 s LEU 160 Cb -0.13 -1.81 -0.01 0.00 -0.43 0.00 0.00 46.19 43.81 1c83 s LEU 160 CO 0.01 0.04 -0.11 -0.70 -0.29 0.00 0.00 176.35 175.31 1c83 s GLU 161 N 1.12 3.30 -0.38 1.98 2.12 0.60 -0.43 118.70 127.02 1c83 s GLU 161 Ca 0.02 -0.69 -0.28 0.00 0.36 0.00 0.00 54.97 54.39 1c83 s GLU 161 Cb -0.14 -2.76 -0.03 0.00 0.26 0.00 0.00 34.13 31.45 1c83 s GLU 161 CO 0.01 -0.02 1.97 1.21 -0.54 0.00 0.00 175.26 177.89 1c83 s ASN 162 N 0.96 5.50 0.45 -1.70 3.84 -0.22 -0.58 114.94 123.19 1c83 s ASN 162 Ca -0.02 1.21 0.31 0.00 0.21 0.00 0.00 52.86 54.57 1c83 s ASN 162 Cb -0.15 -2.52 1.33 0.00 -0.55 0.00 0.00 41.25 39.36 1c83 s ASN 162 CO -0.01 -2.04 1.91 -0.07 -2.79 0.00 0.00 177.10 174.10 1c83 h LEU 163 N 15.24 0.00 -0.07 3.21 4.07 -1.16 0.25 115.31 136.84 1c83 h LEU 163 Ca -0.32 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.63 1c83 h LEU 163 Cb 1.19 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.93 1c83 h LEU 163 CO 1.07 0.00 0.00 0.74 -1.08 0.00 0.00 178.44 179.17 1c83 h THR 164 N 0.00 1.24 -0.01 0.22 2.02 -1.90 -3.35 112.91 111.13 1c83 h THR 164 Ca 0.00 -0.73 0.00 0.00 0.77 0.00 0.00 66.41 66.45 1c83 h THR 164 Cb 0.38 1.59 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 1c83 h THR 164 CO 0.00 0.20 -0.16 0.35 0.37 0.00 0.00 175.52 176.29 1c83 n THR 165 N -4.87 0.00 -1.35 3.16 -2.24 -1.05 -4.97 114.28 102.97 1c83 n THR 165 Ca -0.07 -0.42 -0.05 0.00 -2.27 0.00 0.00 64.05 61.24 1c83 n THR 165 Cb 0.18 1.16 -0.02 0.00 -2.10 0.00 0.00 70.33 69.55 1c83 n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c83 n GLN 166 N 0.02 -1.34 -2.10 -0.78 6.02 0.85 -4.98 117.38 115.07 1c83 n GLN 166 Ca 0.05 0.30 -0.39 0.00 -0.01 0.00 0.00 57.00 56.95 1c83 n GLN 166 Cb 0.24 -4.46 -0.01 0.00 1.02 0.00 0.00 30.24 27.03 1c83 n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1c83 s GLU 167 N -2.82 3.93 0.03 -1.09 2.12 -1.23 -4.85 118.70 114.78 1c83 s GLU 167 Ca 0.00 2.07 0.07 0.00 0.36 0.00 0.00 54.97 57.47 1c83 s GLU 167 Cb 0.00 -2.69 -0.03 0.00 0.26 0.00 0.00 34.13 31.67 1c83 s GLU 167 CO 0.00 -0.50 -0.21 0.99 -0.54 0.00 0.00 175.26 175.01 1c83 s THR 168 N -1.31 2.59 0.05 -1.70 2.01 -1.26 -1.05 115.64 114.96 1c83 s THR 168 Ca 0.58 -1.20 0.03 0.00 0.31 0.00 0.00 61.69 61.41 1c83 s THR 168 Cb -0.36 -2.05 -0.03 0.00 0.01 0.00 0.00 72.50 70.07 1c83 s THR 168 CO 0.46 0.38 -0.10 -0.13 -0.69 0.00 0.00 174.62 174.54 1c83 s ARG 169 N -1.27 0.63 -0.17 4.92 0.52 0.43 -4.99 118.95 119.01 1c83 s ARG 169 Ca 0.13 -0.82 -0.20 0.00 -0.52 0.00 0.00 55.73 54.32 1c83 s ARG 169 Cb -0.10 -0.48 -0.03 0.00 0.52 0.00 0.00 34.95 34.86 1c83 s ARG 169 CO 0.04 0.10 0.60 -2.00 0.02 0.00 0.00 175.30 174.05 1c83 s GLU 170 N -1.62 4.25 -0.09 3.54 2.12 -1.26 -0.51 118.70 125.13 1c83 s GLU 170 Ca -0.07 0.59 0.02 0.00 0.36 0.00 0.00 54.97 55.86 1c83 s GLU 170 Cb -0.10 -3.54 -0.02 0.00 0.26 0.00 0.00 34.13 30.73 1c83 s GLU 170 CO 0.01 -0.14 -0.12 0.42 -0.54 0.00 0.00 175.26 174.89 1c83 s ILE 171 N 1.58 3.18 -0.13 -3.70 -1.09 0.02 -4.84 121.20 116.22 1c83 s ILE 171 Ca 0.28 -0.65 -0.11 0.00 -2.23 0.00 0.00 60.65 57.94 1c83 s ILE 171 Cb -0.16 -2.29 -0.05 0.00 -1.58 0.00 0.00 42.46 38.38 1c83 s ILE 171 CO 0.11 0.56 0.23 -0.76 -1.23 0.00 0.00 174.94 173.85 1c83 s LEU 172 N -0.31 4.33 -0.18 2.97 1.02 -0.03 -0.97 118.68 125.51 1c83 s LEU 172 Ca 0.03 0.52 -0.00 0.00 0.02 0.00 0.00 54.13 54.70 1c83 s LEU 172 Cb -0.13 -2.25 0.00 0.00 0.02 0.00 0.00 46.19 43.84 1c83 s LEU 172 CO 0.03 0.26 -0.15 -2.28 0.02 0.00 0.00 176.35 174.23 1c83 s HIS 173 N -0.35 2.82 -0.33 0.29 2.46 0.68 -0.58 115.29 120.27 1c83 s HIS 173 Ca 0.16 -1.22 -0.02 0.00 0.47 0.00 0.00 55.06 54.44 1c83 s HIS 173 Cb -0.13 -1.95 0.06 0.00 -0.13 0.00 0.00 32.58 30.44 1c83 s HIS 173 CO 0.04 -0.60 0.06 -0.06 -2.47 0.00 0.00 174.74 171.71 1c83 s PHE 174 N 1.12 3.35 -0.45 3.88 0.08 0.49 -0.71 117.98 125.74 1c83 s PHE 174 Ca 0.01 -1.98 -0.06 0.00 0.12 0.00 0.00 56.93 55.01 1c83 s PHE 174 Cb -0.14 -2.40 0.12 0.00 -0.57 0.00 0.00 43.02 40.02 1c83 s PHE 174 CO -0.05 -0.84 0.28 -1.58 -0.10 0.00 0.00 175.22 172.94 1c83 s HIS 175 N 1.23 3.50 -0.10 0.36 2.46 0.30 -1.24 115.29 121.80 1c83 s HIS 175 Ca -0.01 -2.12 -0.30 0.00 0.47 0.00 0.00 55.06 53.10 1c83 s HIS 175 Cb -0.20 -3.38 -0.03 0.00 -0.13 0.00 0.00 32.58 28.84 1c83 s HIS 175 CO -0.02 -0.99 1.37 -0.47 -2.47 0.00 0.00 174.74 172.17 1c83 s TYR 176 N 1.25 2.68 -0.98 3.88 6.14 -0.41 -0.67 117.35 129.25 1c83 s TYR 176 Ca 0.07 0.81 0.08 0.00 0.64 0.00 0.00 57.07 58.68 1c83 s TYR 176 Cb -0.25 -3.61 0.05 0.00 0.42 0.00 0.00 41.96 38.57 1c83 s TYR 176 CO -0.02 -2.27 0.71 0.25 0.64 0.00 0.00 175.55 174.86 1c83 n THR 177 N 5.21 0.00 -1.56 4.34 -2.24 -0.68 -3.90 114.28 115.46 1c83 n THR 177 Ca 0.14 -0.47 0.07 0.00 -2.27 0.00 0.00 64.05 61.51 1c83 n THR 177 Cb 0.44 1.15 0.16 0.00 -2.10 0.00 0.00 70.33 69.99 1c83 n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1c83 n THR 178 N 0.25 1.81 -3.64 4.28 -2.24 -1.24 -4.83 114.28 108.68 1c83 n THR 178 Ca 0.05 -2.62 -0.39 0.00 -2.27 0.00 0.00 64.05 58.81 1c83 n THR 178 Cb 0.20 -0.09 -0.10 0.00 -2.10 0.00 0.00 70.33 68.24 1c83 n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1c83 s TRP 179 N -2.69 3.41 0.56 4.78 -0.11 -1.26 -4.60 118.94 119.03 1c83 s TRP 179 Ca 0.34 -1.82 -0.19 0.00 1.22 0.00 0.00 56.10 55.65 1c83 s TRP 179 Cb 0.33 -3.12 -0.05 0.00 -1.50 0.00 0.00 33.47 29.13 1c83 s TRP 179 CO -0.05 -0.91 1.15 -2.14 -4.62 0.00 0.00 176.95 170.38 1c83 s PRO 180 N 1.34 3.22 0.32 5.86 0.02 -1.26 -4.75 135.00 139.75 1c83 s PRO 180 Ca 0.04 1.67 -0.29 0.00 0.02 0.00 0.00 61.00 62.44 1c83 s PRO 180 Cb -0.24 -1.98 -0.10 0.00 0.02 0.00 0.00 34.50 32.20 1c83 s PRO 180 CO -0.00 -0.97 1.41 0.34 -0.33 0.00 0.00 177.00 177.45 1c83 s ASP 181 N -1.75 6.60 -1.19 2.53 2.15 -1.26 -0.56 116.67 123.18 1c83 s ASP 181 Ca 0.74 2.80 0.00 0.00 0.43 0.00 0.00 52.55 56.52 1c83 s ASP 181 Cb -0.26 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.72 1c83 s ASP 181 CO 0.29 -0.70 0.00 0.49 -0.17 0.00 0.00 175.17 175.09 1c83 n PHE 182 N 1.22 -1.03 -3.87 -5.34 3.72 -1.26 -4.95 117.46 105.96 1c83 n PHE 182 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1c83 n PHE 182 Cb 0.40 -2.71 0.00 0.00 -0.94 0.00 0.00 39.48 36.23 1c83 n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1c83 n GLY 183 N -0.60 4.29 3.45 1.37 0.00 0.27 -4.95 105.19 109.01 1c83 n GLY 183 Ca -0.14 -2.19 -0.22 0.00 0.00 0.00 0.00 46.02 43.46 1c83 n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1c83 s VAL 184 N -0.74 2.03 0.90 1.61 -7.23 -1.26 -4.79 120.40 110.92 1c83 s VAL 184 Ca 0.00 -2.24 -0.11 0.00 -1.81 0.00 0.00 61.98 57.82 1c83 s VAL 184 Cb 0.00 -2.36 0.13 0.00 0.56 0.00 0.00 36.38 34.71 1c83 s VAL 184 CO 0.00 -0.37 1.13 -2.65 -0.31 0.00 0.00 175.10 172.90 1c83 n PRO 185 N -0.59 -0.33 0.10 4.82 -0.02 -1.26 -4.42 135.00 133.30 1c83 n PRO 185 Ca -0.06 -0.03 0.04 0.00 -2.02 0.00 0.00 63.50 61.43 1c83 n PRO 185 Cb 0.62 -2.37 0.44 0.00 -0.02 0.00 0.00 33.50 32.17 1c83 n PRO 185 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1c83 h GLU 186 N -1.68 0.31 -2.95 -0.52 3.07 -1.98 -3.45 114.58 107.38 1c83 h GLU 186 Ca -0.44 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.36 58.33 1c83 h GLU 186 Cb 1.28 -0.06 -0.14 0.00 -0.84 0.00 0.00 28.75 28.98 1c83 h GLU 186 CO 0.42 0.31 0.06 -1.54 -1.40 0.00 0.00 179.01 176.86 1c83 s SER 187 N -6.84 -0.43 0.32 1.42 1.04 -1.26 -5.03 113.70 102.91 1c83 s SER 187 Ca -0.06 0.03 0.05 0.00 0.48 0.00 0.00 55.95 56.45 1c83 s SER 187 Cb 0.16 0.52 0.69 0.00 0.10 0.00 0.00 66.02 67.49 1c83 s SER 187 CO 0.72 -0.81 1.84 -0.65 0.98 0.00 0.00 173.24 175.32 1c83 h PRO 188 N 2.49 0.81 0.30 4.02 0.11 -1.93 -2.43 132.00 135.37 1c83 h PRO 188 Ca -0.32 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 1c83 h PRO 188 Cb 1.25 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1c83 h PRO 188 CO 0.42 0.54 -0.16 0.00 -0.21 0.00 0.00 178.00 178.58 1c83 h ALA 189 N 1.58 -0.42 -0.10 -0.75 0.00 -1.96 -0.33 119.26 117.28 1c83 h ALA 189 Ca 0.49 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.24 1c83 h ALA 189 Cb 0.65 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1c83 h ALA 189 CO -0.25 -0.74 -0.24 0.66 0.00 0.00 0.00 179.25 178.67 1c83 h SER 190 N -0.43 0.17 0.45 0.00 4.64 -1.79 0.43 113.55 117.02 1c83 h SER 190 Ca -0.04 -0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.21 1c83 h SER 190 Cb 0.34 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1c83 h SER 190 CO 0.05 0.42 -0.22 0.15 -0.87 0.00 0.00 176.83 176.37 1c83 h PHE 191 N 0.16 -0.56 -0.56 4.77 3.57 -1.25 -2.13 116.94 120.93 1c83 h PHE 191 Ca 0.03 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 1c83 h PHE 191 Cb 0.52 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 1c83 h PHE 191 CO 0.01 -0.35 0.10 -0.07 -2.23 0.00 0.00 178.31 175.77 1c83 h LEU 192 N -0.60 0.84 -0.57 0.59 3.38 -0.90 0.48 115.31 118.54 1c83 h LEU 192 Ca -0.06 -0.17 0.08 0.00 0.09 0.00 0.00 57.88 57.81 1c83 h LEU 192 Cb 0.46 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 1c83 h LEU 192 CO 0.10 0.84 0.24 -1.13 0.09 0.00 0.00 178.44 178.58 1c83 h ASN 193 N 0.85 0.28 -0.12 -0.43 -1.24 -0.90 0.89 115.58 114.90 1c83 h ASN 193 Ca 0.18 0.06 -0.03 0.00 0.71 0.00 0.00 56.30 57.22 1c83 h ASN 193 Cb 0.36 0.02 -0.00 0.00 0.73 0.00 0.00 38.32 39.43 1c83 h ASN 193 CO 0.01 0.18 -0.03 0.15 -1.29 0.00 0.00 177.43 176.45 1c83 h PHE 194 N 0.44 0.27 -0.55 0.67 3.57 -0.65 0.54 116.94 121.22 1c83 h PHE 194 Ca 0.28 -0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.79 1c83 h PHE 194 Cb 0.29 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.90 1c83 h PHE 194 CO -0.14 0.53 0.23 1.25 -2.23 0.00 0.00 178.31 177.95 1c83 h LEU 195 N -0.07 0.28 -0.92 0.59 5.85 -0.80 -1.49 115.31 118.74 1c83 h LEU 195 Ca 0.03 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 1c83 h LEU 195 Cb 0.44 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 1c83 h LEU 195 CO 0.01 0.18 0.02 -0.26 -0.34 0.00 0.00 178.44 178.06 1c83 h PHE 196 N 0.44 0.87 -0.45 1.25 -1.00 -0.75 -0.67 116.94 116.62 1c83 h PHE 196 Ca 0.26 -0.12 0.09 0.00 2.81 0.00 0.00 57.97 61.01 1c83 h PHE 196 Cb 0.26 -0.24 -0.08 0.00 3.61 0.00 0.00 35.95 39.50 1c83 h PHE 196 CO -0.14 0.78 -0.01 0.87 -1.61 0.00 0.00 178.31 178.20 1c83 h LYS 197 N 0.77 0.10 -0.30 1.51 1.79 -0.26 -0.60 116.57 119.57 1c83 h LYS 197 Ca 0.15 -0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.67 1c83 h LYS 197 Cb 0.43 -0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 31.01 1c83 h LYS 197 CO 0.02 0.06 0.01 0.28 -1.08 0.00 0.00 179.45 178.74 1c83 h VAL 198 N 0.10 0.79 -0.49 0.50 2.07 -0.76 -2.17 116.25 116.29 1c83 h VAL 198 Ca 0.23 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 1c83 h VAL 198 Cb 0.33 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1c83 h VAL 198 CO -0.39 0.02 0.26 0.03 0.02 0.00 0.00 177.57 177.51 1c83 h ARG 199 N 0.10 0.69 -0.87 1.57 3.08 -0.94 -2.85 114.38 115.16 1c83 h ARG 199 Ca 0.14 -0.09 0.14 0.00 0.07 0.00 0.00 59.98 60.25 1c83 h ARG 199 Cb 0.19 -0.13 -0.07 0.00 0.08 0.00 0.00 29.97 30.04 1c83 h ARG 199 CO -0.24 0.55 0.56 0.93 -1.07 0.00 0.00 179.97 180.70 1c83 h GLU 200 N 0.64 0.66 0.00 0.04 4.39 -0.98 -1.57 114.58 117.77 1c83 h GLU 200 Ca 0.17 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.83 1c83 h GLU 200 Cb 0.07 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 1c83 h GLU 200 CO -0.03 0.44 0.00 -1.13 -1.16 0.00 0.00 179.01 177.13 1c83 n SER 201 N -4.55 0.19 0.00 1.42 3.41 -0.83 -4.86 113.62 108.40 1c83 n SER 201 Ca 0.17 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.34 1c83 n SER 201 Cb 0.45 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1c83 n SER 201 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c83 n GLY 202 N -0.61 0.34 0.12 5.00 0.00 -0.59 -4.91 105.19 104.54 1c83 n GLY 202 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1c83 n GLY 202 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1c83 n SER 203 N -0.32 0.67 -0.34 1.61 7.64 -1.25 -2.56 113.62 119.09 1c83 n SER 203 Ca 0.00 0.63 0.12 0.00 1.01 0.00 0.00 58.87 60.63 1c83 n SER 203 Cb 0.16 -0.79 0.16 0.00 -1.01 0.00 0.00 64.21 62.73 1c83 n SER 203 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1c83 n LEU 204 N -2.20 1.47 -4.80 -3.43 4.77 -1.26 -4.31 117.00 107.24 1c83 n LEU 204 Ca 0.03 -0.50 -0.35 0.00 -0.03 0.00 0.00 56.01 55.17 1c83 n LEU 204 Cb 0.29 -0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 41.26 1c83 n LEU 204 CO 0.23 0.28 0.68 -0.44 -1.33 0.00 0.00 177.39 176.81 1c83 s SER 205 N -2.54 6.90 0.00 -1.43 0.01 -1.06 -4.90 113.70 110.68 1c83 s SER 205 Ca 0.20 1.84 0.20 0.00 1.31 0.00 0.00 55.95 59.49 1c83 s SER 205 Cb 0.18 -2.56 1.02 0.00 0.21 0.00 0.00 66.02 64.87 1c83 s SER 205 CO 0.57 -0.38 1.61 -0.81 0.41 0.00 0.00 173.24 174.64 1c83 n PRO 206 N -0.28 0.32 0.00 12.44 -0.04 -1.26 -2.19 135.00 143.99 1c83 n PRO 206 Ca 0.06 0.09 0.13 0.00 -0.04 0.00 0.00 63.50 63.73 1c83 n PRO 206 Cb 0.52 -1.50 0.63 0.00 -0.04 0.00 0.00 33.50 33.11 1c83 n PRO 206 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1c83 n GLU 207 N -1.25 0.31 -4.07 0.54 0.00 -1.26 -4.80 120.64 110.11 1c83 n GLU 207 Ca 0.10 0.05 -0.24 0.00 0.00 0.00 0.00 57.16 57.07 1c83 n GLU 207 Cb 0.15 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 30.04 1c83 n GLU 207 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 1c83 s HIS 208 N -2.64 3.20 1.13 -1.84 3.76 -0.93 -5.12 115.29 112.86 1c83 s HIS 208 Ca 0.23 -0.05 -0.17 0.00 -0.15 0.00 0.00 55.06 54.92 1c83 s HIS 208 Cb 0.17 -1.48 0.16 0.00 1.11 0.00 0.00 32.58 32.54 1c83 s HIS 208 CO 0.40 0.51 0.35 0.41 -0.85 0.00 0.00 174.74 175.56 1c83 n GLY 209 N -0.87 -2.33 3.77 -2.22 0.00 0.11 -4.92 105.19 98.73 1c83 n GLY 209 Ca -0.08 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.62 1c83 n GLY 209 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1c83 s PRO 210 N -3.76 3.93 0.45 1.61 0.04 -1.26 -4.40 135.00 131.61 1c83 s PRO 210 Ca 0.60 2.54 -0.25 0.00 0.04 0.00 0.00 61.00 63.93 1c83 s PRO 210 Cb -0.17 -2.84 -0.09 0.00 0.04 0.00 0.00 34.50 31.44 1c83 s PRO 210 CO 0.66 -0.67 1.26 1.55 0.04 0.00 0.00 177.00 179.84 1c83 n VAL 211 N 0.18 2.77 -3.36 -0.36 3.14 -1.26 -4.42 118.33 115.03 1c83 n VAL 211 Ca 0.03 -0.50 -0.39 0.00 -2.96 0.00 0.00 64.34 60.52 1c83 n VAL 211 Cb 0.40 -1.55 -0.08 0.00 -1.06 0.00 0.00 33.84 31.55 1c83 n VAL 211 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1c83 s VAL 212 N -1.23 5.16 -0.13 1.55 1.01 -0.74 -0.70 120.40 125.32 1c83 s VAL 212 Ca 0.63 0.68 -0.01 0.00 0.00 0.00 0.00 61.98 63.28 1c83 s VAL 212 Cb -0.49 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1c83 s VAL 212 CO 0.56 0.18 -0.11 -0.69 0.00 0.00 0.00 175.10 175.05 1c83 s VAL 213 N 1.83 3.28 0.02 2.92 1.01 0.12 0.13 120.40 129.71 1c83 s VAL 213 Ca 0.18 -0.58 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 1c83 s VAL 213 Cb -0.15 -2.39 -0.00 0.00 0.00 0.00 0.00 36.38 33.83 1c83 s VAL 213 CO 0.09 0.52 0.11 -1.38 0.00 0.00 0.00 175.10 174.44 1c83 s HIS 214 N 0.23 0.12 0.00 5.22 -3.43 0.38 -1.42 115.29 116.38 1c83 s HIS 214 Ca -0.07 -0.30 0.00 0.00 -0.80 0.00 0.00 55.06 53.89 1c83 s HIS 214 Cb -0.15 -0.09 0.00 0.00 -1.43 0.00 0.00 32.58 30.91 1c83 s HIS 214 CO 0.05 -0.31 0.00 0.00 -2.00 0.00 0.00 174.74 172.47 1c83 h SER 216 N 0.00 -0.03 0.48 0.00 0.87 -1.90 -2.47 113.55 110.50 1c83 h SER 216 Ca 0.00 -0.65 0.00 0.00 -1.23 0.00 0.00 61.79 59.91 1c83 h SER 216 Cb 0.00 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 1c83 h SER 216 CO 0.00 0.66 -1.00 0.00 -0.53 0.00 0.00 176.83 175.96 1c83 n ALA 217 N -2.48 3.33 -1.33 6.23 0.00 -1.26 0.07 120.51 125.07 1c83 n ALA 217 Ca -0.09 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1c83 n ALA 217 Cb 0.33 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1c83 n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c83 n GLY 218 N 1.36 0.41 1.78 0.00 0.00 -1.21 -3.87 105.19 103.66 1c83 n GLY 218 Ca 0.02 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1c83 n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1c83 n ILE 219 N -3.32 0.08 0.07 -0.61 -5.35 -1.26 -4.40 119.36 104.57 1c83 n ILE 219 Ca 0.00 0.03 -0.03 0.00 -0.27 0.00 0.00 62.75 62.47 1c83 n ILE 219 Cb 0.18 -0.73 -0.02 0.00 -1.74 0.00 0.00 39.64 37.34 1c83 n ILE 219 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1c83 h GLY 220 N 0.00 -0.22 1.09 3.28 0.00 -1.91 0.05 103.07 105.36 1c83 h GLY 220 Ca 0.00 0.08 -0.13 0.00 0.00 0.00 0.00 47.33 47.29 1c83 h GLY 220 CO 0.00 -0.08 -0.18 3.21 0.00 0.00 0.00 176.54 179.49 1c83 h ARG 221 N -0.42 0.99 -0.43 4.80 3.08 -1.95 -2.31 114.38 118.13 1c83 h ARG 221 Ca -0.02 -0.41 0.04 0.00 0.07 0.00 0.00 59.98 59.66 1c83 h ARG 221 Cb 0.16 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 1c83 h ARG 221 CO 0.04 1.08 0.20 0.77 -1.07 0.00 0.00 179.97 180.99 1c83 h SER 222 N 0.84 0.27 -0.87 7.04 0.02 -1.87 -0.82 113.55 118.16 1c83 h SER 222 Ca 0.12 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.12 1c83 h SER 222 Cb 0.76 -0.02 -0.05 0.00 0.14 0.00 0.00 62.40 63.24 1c83 h SER 222 CO 0.06 0.19 0.57 1.23 -1.14 0.00 0.00 176.83 177.74 1c83 h GLY 223 N 0.40 1.24 0.83 -3.77 0.00 -1.00 -0.81 103.07 99.96 1c83 h GLY 223 Ca 0.19 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 47.06 1c83 h GLY 223 CO -0.15 0.41 0.02 -0.84 0.00 0.00 0.00 176.54 175.98 1c83 h THR 224 N 1.14 1.23 -0.18 4.70 2.02 -1.11 0.45 112.91 121.17 1c83 h THR 224 Ca 0.33 -0.75 0.05 0.00 0.77 0.00 0.00 66.41 66.81 1c83 h THR 224 Cb -0.08 1.38 -0.06 0.00 -1.74 0.00 0.00 68.15 67.65 1c83 h THR 224 CO -0.09 0.23 -0.18 0.15 0.37 0.00 0.00 175.52 175.99 1c83 h PHE 225 N 0.09 -0.48 -0.01 3.16 3.04 -1.08 -2.18 116.94 119.49 1c83 h PHE 225 Ca 0.05 0.03 -0.11 0.00 3.98 0.00 0.00 57.97 61.92 1c83 h PHE 225 Cb 0.32 0.24 -0.02 0.00 2.56 0.00 0.00 35.95 39.06 1c83 h PHE 225 CO 0.02 -0.26 -0.53 0.00 -2.02 0.00 0.00 178.31 175.53 1c83 h LEU 227 N 0.01 0.21 -0.52 0.00 5.85 -0.69 -0.75 115.31 119.42 1c83 h LEU 227 Ca -0.00 -0.26 0.08 0.00 0.84 0.00 0.00 57.88 58.53 1c83 h LEU 227 Cb 0.93 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.84 1c83 h LEU 227 CO 0.07 0.42 0.14 0.00 -0.34 0.00 0.00 178.44 178.73 1c83 h ALA 228 N 0.80 0.62 -0.39 1.25 0.00 -1.36 -0.78 119.26 119.40 1c83 h ALA 228 Ca 0.04 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1c83 h ALA 228 Cb 0.30 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1c83 h ALA 228 CO 0.00 -0.26 0.25 0.22 0.00 0.00 0.00 179.25 179.46 1c83 h ASP 229 N 0.30 0.43 -0.29 0.00 3.58 -1.18 -1.93 116.42 117.33 1c83 h ASP 229 Ca 0.26 -0.01 -0.18 0.00 0.42 0.00 0.00 57.03 57.52 1c83 h ASP 229 Cb 0.33 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.27 1c83 h ASP 229 CO -0.30 0.31 -0.54 0.74 -2.88 0.00 0.00 179.24 176.57 1c83 h THR 230 N 0.51 1.27 -0.90 2.25 2.02 -0.99 -1.33 112.91 115.75 1c83 h THR 230 Ca 0.14 -1.72 0.02 0.00 0.77 0.00 0.00 66.41 65.63 1c83 h THR 230 Cb -0.05 1.62 -0.05 0.00 -1.74 0.00 0.00 68.15 67.93 1c83 h THR 230 CO -0.04 0.56 0.60 0.00 0.37 0.00 0.00 175.52 177.01 1c83 h LEU 232 N 1.17 0.76 -0.31 0.00 3.38 -1.12 -1.70 115.31 117.50 1c83 h LEU 232 Ca 0.35 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1c83 h LEU 232 Cb -0.05 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1c83 h LEU 232 CO -0.09 0.99 0.02 0.25 0.09 0.00 0.00 178.44 179.70 1c83 h LEU 233 N 0.64 0.51 -0.37 1.67 6.46 -0.90 -0.80 115.31 122.52 1c83 h LEU 233 Ca 0.08 -0.29 0.01 0.00 -0.12 0.00 0.00 57.88 57.56 1c83 h LEU 233 Cb 0.77 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.54 1c83 h LEU 233 CO 0.06 0.67 0.24 -0.07 -0.62 0.00 0.00 178.44 178.73 1c83 h LEU 234 N 0.33 0.42 -1.56 2.25 4.07 -0.89 -0.32 115.31 119.61 1c83 h LEU 234 Ca 0.09 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.99 1c83 h LEU 234 Cb 0.40 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 42.03 1c83 h LEU 234 CO 0.01 0.30 -0.22 -0.03 -1.08 0.00 0.00 178.44 177.42 1c83 h MET 235 N 0.50 0.00 -0.07 1.13 4.05 -1.18 -2.75 114.93 116.61 1c83 h MET 235 Ca 0.14 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.49 1c83 h MET 235 Cb -0.05 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.75 1c83 h MET 235 CO -0.03 0.22 -0.21 0.22 0.23 0.00 0.00 176.91 177.33 1c83 h ASP 236 N 0.00 0.31 -0.35 1.39 3.58 -0.60 0.34 116.42 121.10 1c83 h ASP 236 Ca -0.00 -0.60 -0.05 0.00 0.42 0.00 0.00 57.03 56.79 1c83 h ASP 236 Cb 0.39 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 1c83 h ASP 236 CO 0.03 0.86 0.04 0.50 -2.88 0.00 0.00 179.24 177.79 1c83 h LYS 237 N -0.22 0.68 0.00 0.28 3.64 -1.00 -3.14 116.57 116.81 1c83 h LYS 237 Ca -0.01 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1c83 h LYS 237 Cb 0.83 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1c83 h LYS 237 CO 0.05 0.67 -1.08 0.54 -2.27 0.00 0.00 179.45 177.35 1c83 n ARG 238 N -4.26 0.50 -3.78 1.90 1.74 -1.04 -4.95 116.66 106.75 1c83 n ARG 238 Ca 0.02 0.05 -0.29 0.00 -0.77 0.00 0.00 57.85 56.86 1c83 n ARG 238 Cb 0.25 -1.72 -0.01 0.00 -1.02 0.00 0.00 32.46 29.97 1c83 n ARG 238 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1c83 n LYS 239 N -2.38 -3.65 -3.57 5.56 4.76 0.12 -4.97 118.16 114.03 1c83 n LYS 239 Ca 0.00 0.45 -0.29 0.00 -2.87 0.00 0.00 58.31 55.60 1c83 n LYS 239 Cb 0.51 -5.20 -0.12 0.00 -1.84 0.00 0.00 35.03 28.38 1c83 n LYS 239 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1c83 s ASP 240 N -3.02 3.15 0.35 4.39 2.15 -1.18 -5.00 116.67 117.52 1c83 s ASP 240 Ca 0.58 -2.51 0.04 0.00 0.43 0.00 0.00 52.55 51.09 1c83 s ASP 240 Cb -0.31 -0.70 0.68 0.00 -0.30 0.00 0.00 42.92 42.29 1c83 s ASP 240 CO 0.71 -0.27 1.99 -0.65 -0.17 0.00 0.00 175.17 176.78 1c83 h PRO 241 N 6.71 0.79 0.00 4.34 0.11 -1.93 -2.06 132.00 139.96 1c83 h PRO 241 Ca 0.05 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 1c83 h PRO 241 Cb 0.94 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.87 1c83 h PRO 241 CO 0.38 0.53 -0.00 0.77 -0.21 0.00 0.00 178.00 179.46 1c83 h SER 242 N 0.82 0.00 0.85 -2.05 0.02 -2.00 -1.61 113.55 109.58 1c83 h SER 242 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1c83 h SER 242 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1c83 h SER 242 CO -0.07 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.08 1c83 n SER 243 N -3.09 0.00 -4.67 3.07 3.41 -0.77 -4.74 113.62 106.83 1c83 n SER 243 Ca -0.01 0.30 -0.37 0.00 -0.26 0.00 0.00 58.87 58.52 1c83 n SER 243 Cb 0.19 -0.43 -0.08 0.00 -0.26 0.00 0.00 64.21 63.63 1c83 n SER 243 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1c83 s VAL 244 N -2.86 5.28 -0.54 -3.33 -7.23 -0.61 -5.02 120.40 106.09 1c83 s VAL 244 Ca 0.18 0.45 -0.07 0.00 -1.81 0.00 0.00 61.98 60.73 1c83 s VAL 244 Cb 0.19 -3.62 0.14 0.00 0.56 0.00 0.00 36.38 33.66 1c83 s VAL 244 CO 0.50 0.30 0.40 -0.62 -0.31 0.00 0.00 175.10 175.37 1c83 s ASP 245 N 1.03 5.66 0.21 4.85 -1.08 -1.26 -4.68 116.67 121.40 1c83 s ASP 245 Ca 0.13 -2.26 -0.09 0.00 -0.52 0.00 0.00 52.55 49.82 1c83 s ASP 245 Cb -0.14 -1.97 0.30 0.00 -1.46 0.00 0.00 42.92 39.64 1c83 s ASP 245 CO 0.06 -0.58 1.75 0.40 0.52 0.00 0.00 175.17 177.32 1c83 h ILE 246 N 5.79 0.77 -0.37 4.11 2.04 -1.97 -0.25 117.51 127.63 1c83 h ILE 246 Ca -0.11 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 1c83 h ILE 246 Cb 1.04 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1c83 h ILE 246 CO 0.79 0.08 0.21 0.11 0.00 0.00 0.00 178.15 179.34 1c83 h LYS 247 N 0.43 0.50 -0.95 2.37 1.57 -1.99 -0.05 116.57 118.45 1c83 h LYS 247 Ca 0.32 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1c83 h LYS 247 Cb 0.39 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.55 1c83 h LYS 247 CO -0.31 0.40 0.63 -0.22 -0.57 0.00 0.00 179.45 179.38 1c83 h LYS 248 N 0.47 1.22 -0.38 3.15 3.64 -1.93 -0.35 116.57 122.39 1c83 h LYS 248 Ca 0.13 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.35 1c83 h LYS 248 Cb 0.03 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.56 1c83 h LYS 248 CO -0.02 0.81 -0.14 -0.39 -2.27 0.00 0.00 179.45 177.44 1c83 h VAL 249 N 1.26 1.26 -0.65 2.00 -1.51 -0.57 -1.24 116.25 116.79 1c83 h VAL 249 Ca 0.36 -1.17 -0.05 0.00 -1.23 0.00 0.00 66.70 64.60 1c83 h VAL 249 Cb -0.10 1.12 -0.03 0.00 -2.13 0.00 0.00 31.29 30.15 1c83 h VAL 249 CO -0.09 0.39 0.19 0.25 -1.23 0.00 0.00 177.57 177.08 1c83 h LEU 250 N 0.62 0.96 -1.09 4.19 5.85 -0.80 -0.58 115.31 124.46 1c83 h LEU 250 Ca 0.10 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 1c83 h LEU 250 Cb 0.59 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1c83 h LEU 250 CO 0.04 0.92 0.15 -0.07 -0.34 0.00 0.00 178.44 179.14 1c83 h LEU 251 N 0.95 0.73 -0.59 2.25 -0.00 -0.79 0.18 115.31 118.05 1c83 h LEU 251 Ca 0.21 -0.12 -0.03 0.00 -0.00 0.00 0.00 57.88 57.94 1c83 h LEU 251 Cb 0.31 -0.19 -0.03 0.00 -0.00 0.00 0.00 40.66 40.75 1c83 h LEU 251 CO -0.00 0.71 0.26 -0.78 -0.00 0.00 0.00 178.44 178.62 1c83 h ASP 252 N 0.77 0.79 -0.72 -0.43 3.58 -0.85 -2.72 116.42 116.84 1c83 h ASP 252 Ca 0.17 -0.15 -0.03 0.00 0.42 0.00 0.00 57.03 57.45 1c83 h ASP 252 Cb 0.25 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 1c83 h ASP 252 CO -0.01 0.73 0.36 0.24 -2.88 0.00 0.00 179.24 177.68 1c83 h MET 253 N 0.81 1.04 0.00 0.28 2.86 -0.86 -2.11 114.93 116.95 1c83 h MET 253 Ca 0.20 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1c83 h MET 253 Cb 0.17 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.63 1c83 h MET 253 CO -0.02 0.80 0.00 0.00 1.06 0.00 0.00 176.91 178.75 1c83 h ARG 254 N 1.04 0.00 0.00 1.72 2.47 -0.69 -0.93 114.38 117.99 1c83 h ARG 254 Ca 0.25 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.97 1c83 h ARG 254 Cb 0.10 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.42 1c83 h ARG 254 CO -0.03 0.00 -0.01 0.87 0.56 0.00 0.00 179.97 181.36 1c83 h LYS 255 N 0.00 0.00 0.00 0.04 1.57 -1.08 -3.27 116.57 113.83 1c83 h LYS 255 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1c83 h LYS 255 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1c83 h LYS 255 CO 0.00 0.01 -1.72 1.19 -0.57 0.00 0.00 179.45 178.35 1c83 n PHE 256 N -3.17 0.00 -3.67 -1.35 3.72 -0.36 -4.98 117.46 107.65 1c83 n PHE 256 Ca -0.02 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.24 1c83 n PHE 256 Cb 0.12 -0.40 -0.08 0.00 -0.94 0.00 0.00 39.48 38.18 1c83 n PHE 256 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1c83 s ARG 257 N -2.91 0.69 0.73 -1.08 3.52 -1.17 -4.60 118.95 114.13 1c83 s ARG 257 Ca -0.06 0.69 -0.13 0.00 -0.13 0.00 0.00 55.73 56.10 1c83 s ARG 257 Cb 0.09 0.34 0.04 0.00 -1.56 0.00 0.00 34.95 33.85 1c83 s ARG 257 CO 0.61 -0.10 1.12 0.00 -0.81 0.00 0.00 175.30 176.12 1c83 s MET 258 N 0.09 2.35 0.00 5.12 0.23 -1.26 -4.24 119.30 121.59 1c83 s MET 258 Ca -0.02 1.40 0.00 0.00 -1.03 0.00 0.00 55.69 56.04 1c83 s MET 258 Cb -0.04 -1.89 0.00 0.00 -1.53 0.00 0.00 34.83 31.37 1c83 s MET 258 CO 0.02 -1.60 0.00 0.41 -2.03 0.00 0.00 175.02 171.82 1c83 n GLY 259 N -0.52 0.61 3.69 3.16 0.00 -1.26 -4.88 105.19 106.00 1c83 n GLY 259 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1c83 n GLY 259 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c83 s LEU 260 N 0.00 4.40 0.01 0.99 1.43 -1.26 -3.99 118.68 120.26 1c83 s LEU 260 Ca 0.00 2.76 0.00 0.00 -1.03 0.00 0.00 54.13 55.86 1c83 s LEU 260 Cb 0.00 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.65 1c83 s LEU 260 CO 0.00 -1.00 0.00 -0.38 0.23 0.00 0.00 176.35 175.20 1c83 n ILE 261 N 4.73 -8.06 0.92 -0.59 5.41 -0.59 -4.92 119.36 116.26 1c83 n ILE 261 Ca 0.18 1.68 0.11 0.00 1.00 0.00 0.00 62.75 65.71 1c83 n ILE 261 Cb 0.38 -4.63 -0.02 0.00 -0.71 0.00 0.00 39.64 34.66 1c83 n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1c83 n GLN 262 N 0.97 0.05 -4.09 0.38 1.13 -1.26 -4.89 117.38 109.67 1c83 n GLN 262 Ca 0.00 -0.01 -0.09 0.00 -1.94 0.00 0.00 57.00 54.96 1c83 n GLN 262 Cb 0.00 -1.51 -0.10 0.00 0.11 0.00 0.00 30.24 28.74 1c83 n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1c83 s THR 263 N -3.04 0.34 0.39 5.09 -4.23 -1.26 -5.04 115.64 107.89 1c83 s THR 263 Ca 0.08 -1.60 0.11 0.00 -1.18 0.00 0.00 61.69 59.10 1c83 s THR 263 Cb 0.16 -1.24 0.14 0.00 1.34 0.00 0.00 72.50 72.90 1c83 s THR 263 CO 0.82 -0.82 1.89 0.00 -0.54 0.00 0.00 174.62 175.98 1c83 h ALA 264 N 3.52 1.48 -0.00 3.99 0.00 -1.93 -2.69 119.26 123.63 1c83 h ALA 264 Ca -0.34 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.19 1c83 h ALA 264 Cb 1.17 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1c83 h ALA 264 CO 0.59 0.37 -0.61 0.22 0.00 0.00 0.00 179.25 179.82 1c83 h ASP 265 N 0.11 0.00 0.03 0.00 3.58 -1.96 -0.21 116.42 117.97 1c83 h ASP 265 Ca 0.02 -0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.40 1c83 h ASP 265 Cb 0.47 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 1c83 h ASP 265 CO 0.03 0.61 -0.20 1.56 -2.88 0.00 0.00 179.24 178.36 1c83 h GLN 266 N 0.00 0.32 -0.01 0.28 4.20 -1.80 0.14 115.11 118.25 1c83 h GLN 266 Ca -0.01 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 1c83 h GLN 266 Cb 1.07 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.82 1c83 h GLN 266 CO 0.08 0.52 -0.00 1.25 -0.67 0.00 0.00 178.83 180.01 1c83 h LEU 267 N 0.30 0.02 -0.55 1.46 5.85 -1.28 0.25 115.31 121.35 1c83 h LEU 267 Ca 0.05 -0.37 0.11 0.00 0.84 0.00 0.00 57.88 58.51 1c83 h LEU 267 Cb 0.53 -0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.47 1c83 h LEU 267 CO 0.04 0.38 0.01 -0.09 -0.34 0.00 0.00 178.44 178.44 1c83 h ARG 268 N -0.35 0.12 -0.97 1.25 2.43 -0.94 -1.77 114.38 114.14 1c83 h ARG 268 Ca 0.00 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 1c83 h ARG 268 Cb 0.38 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.84 1c83 h ARG 268 CO 0.00 0.08 0.63 0.35 -1.51 0.00 0.00 179.97 179.53 1c83 h PHE 269 N 0.13 1.17 -0.49 2.20 3.04 -0.62 -2.23 116.94 120.14 1c83 h PHE 269 Ca 0.28 0.03 0.07 0.00 3.98 0.00 0.00 57.97 62.34 1c83 h PHE 269 Cb 0.43 -0.39 -0.06 0.00 2.56 0.00 0.00 35.95 38.50 1c83 h PHE 269 CO -0.33 0.64 0.14 0.77 -2.02 0.00 0.00 178.31 177.51 1c83 h SER 270 N 1.18 0.10 -0.45 0.41 0.02 -0.10 -0.19 113.55 114.51 1c83 h SER 270 Ca 0.41 0.07 0.04 0.00 -0.84 0.00 0.00 61.79 61.47 1c83 h SER 270 Cb 0.10 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.68 1c83 h SER 270 CO -0.15 0.08 0.22 1.88 -1.14 0.00 0.00 176.83 177.73 1c83 h TYR 271 N 0.30 0.41 -0.59 3.45 -1.99 -0.83 -0.20 116.97 117.51 1c83 h TYR 271 Ca 0.24 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.99 1c83 h TYR 271 Cb 0.29 -0.12 -0.03 0.00 2.00 0.00 0.00 36.73 38.87 1c83 h TYR 271 CO -0.19 0.20 0.37 -0.07 -0.00 0.00 0.00 178.16 178.47 1c83 h LEU 272 N 0.44 0.69 -0.43 3.88 4.07 -1.03 0.22 115.31 123.16 1c83 h LEU 272 Ca 0.20 -0.04 -0.02 0.00 0.08 0.00 0.00 57.88 58.09 1c83 h LEU 272 Cb 0.11 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.66 1c83 h LEU 272 CO -0.14 0.53 0.19 0.00 -1.08 0.00 0.00 178.44 177.93 1c83 h ALA 273 N 1.19 0.56 -0.32 1.53 0.00 -0.73 -0.37 119.26 121.12 1c83 h ALA 273 Ca 0.21 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 1c83 h ALA 273 Cb -0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1c83 h ALA 273 CO -0.04 0.15 -0.46 0.28 0.00 0.00 0.00 179.25 179.18 1c83 h VAL 274 N 0.56 1.28 -0.27 0.00 2.07 -0.91 0.13 116.25 119.11 1c83 h VAL 274 Ca 0.15 -1.64 -0.02 0.00 0.82 0.00 0.00 66.70 66.01 1c83 h VAL 274 Cb 0.16 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1c83 h VAL 274 CO -0.01 0.54 0.10 0.40 0.02 0.00 0.00 177.57 178.61 1c83 h ILE 275 N 0.67 1.18 -0.51 4.57 2.04 -0.48 -1.76 117.51 123.22 1c83 h ILE 275 Ca 0.04 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 1c83 h ILE 275 Cb 1.04 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 1c83 h ILE 275 CO 0.10 0.19 0.21 -0.08 0.00 0.00 0.00 178.15 178.57 1c83 h GLU 276 N 0.28 0.75 0.00 2.37 4.57 -1.10 -3.10 114.58 118.36 1c83 h GLU 276 Ca 0.09 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1c83 h GLU 276 Cb 0.20 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 28.66 1c83 h GLU 276 CO -0.01 0.66 -0.06 0.78 -1.18 0.00 0.00 179.01 179.20 1c83 h GLY 277 N 0.67 0.00 1.66 1.92 0.00 -0.64 -2.49 103.07 104.20 1c83 h GLY 277 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.51 1c83 h GLY 277 CO -0.02 0.00 0.22 0.00 0.00 0.00 0.00 176.54 176.74 1c83 h ALA 278 N 1.94 1.79 -0.41 3.60 0.00 -1.23 -1.48 119.26 123.47 1c83 h ALA 278 Ca -0.00 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1c83 h ALA 278 Cb 0.14 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 1c83 h ALA 278 CO 0.01 0.18 0.02 0.87 0.00 0.00 0.00 179.25 180.33 1c83 h LYS 279 N 0.42 0.13 0.64 0.00 1.57 -1.57 0.19 116.57 117.94 1c83 h LYS 279 Ca 0.12 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1c83 h LYS 279 Cb -0.01 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.27 1c83 h LYS 279 CO -0.03 0.08 -0.31 0.35 -0.57 0.00 0.00 179.45 178.98 1c83 h PHE 280 N 0.13 -0.79 -0.97 -1.35 3.57 -1.57 -0.23 116.94 115.74 1c83 h PHE 280 Ca 0.20 -0.02 0.24 0.00 3.53 0.00 0.00 57.97 61.92 1c83 h PHE 280 Cb 0.28 0.26 -0.07 0.00 2.79 0.00 0.00 35.95 39.21 1c83 h PHE 280 CO -0.25 -0.45 0.64 0.82 -2.23 0.00 0.00 178.31 176.84 1c83 h ILE 281 N -1.06 0.60 -0.34 1.41 1.08 -1.21 -0.93 117.51 117.06 1c83 h ILE 281 Ca -0.09 -0.12 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1c83 h ILE 281 Cb 0.70 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 34.67 1c83 h ILE 281 CO 0.14 0.06 0.00 0.23 -0.69 0.00 0.00 178.15 177.90 1c83 n MET 282 N -4.51 2.98 -0.01 2.37 2.81 0.65 -4.86 117.12 116.55 1c83 n MET 282 Ca 0.22 -1.73 0.00 0.00 -1.81 0.00 0.00 57.70 54.38 1c83 n MET 282 Cb 0.81 -1.83 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 1c83 n MET 282 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1c83 n GLY 283 N 0.50 0.99 3.42 3.03 0.00 -0.36 -5.02 105.19 107.75 1c83 n GLY 283 Ca 0.15 -0.01 -0.44 0.00 0.00 0.00 0.00 46.02 45.72 1c83 n GLY 283 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1c83 s ASP 284 N -2.01 7.06 0.40 1.61 2.15 -0.11 -4.85 116.67 120.92 1c83 s ASP 284 Ca 0.00 -3.01 0.12 0.00 0.43 0.00 0.00 52.55 50.09 1c83 s ASP 284 Cb 0.00 -2.33 0.94 0.00 -0.30 0.00 0.00 42.92 41.23 1c83 s ASP 284 CO 0.00 -0.65 1.91 0.28 -0.17 0.00 0.00 175.17 176.54 1c83 h SER 285 N 7.29 0.50 -0.04 -0.34 0.02 -1.84 -2.67 113.55 116.48 1c83 h SER 285 Ca 0.24 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.23 1c83 h SER 285 Cb 0.91 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.37 1c83 h SER 285 CO 1.13 0.27 0.16 0.77 -1.14 0.00 0.00 176.83 178.01 1c83 h SER 286 N 0.54 0.00 0.34 3.07 4.64 -1.96 -2.74 113.55 117.44 1c83 h SER 286 Ca 0.39 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.66 1c83 h SER 286 Cb 0.75 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.83 1c83 h SER 286 CO -0.15 0.00 -0.23 -0.37 -0.87 0.00 0.00 176.83 175.21 1c83 h VAL 287 N 0.00 0.97 -0.40 0.95 -1.51 -1.85 -2.78 116.25 111.63 1c83 h VAL 287 Ca 0.02 -0.85 0.08 0.00 -1.23 0.00 0.00 66.70 64.72 1c83 h VAL 287 Cb 0.33 1.48 -0.08 0.00 -2.13 0.00 0.00 31.29 30.89 1c83 h VAL 287 CO -0.00 0.23 -0.15 -0.61 -1.23 0.00 0.00 177.57 175.80 1c83 h GLN 288 N 0.00 -0.07 0.00 5.19 4.15 -1.71 0.14 115.11 122.81 1c83 h GLN 288 Ca -0.00 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.32 1c83 h GLN 288 Cb 0.46 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.16 1c83 h GLN 288 CO 0.03 -0.05 -0.47 -0.44 -1.93 0.00 0.00 178.83 175.98 1c83 h ASP 289 N -0.07 0.00 -0.15 -0.69 3.32 -1.70 -0.72 116.42 116.41 1c83 h ASP 289 Ca 0.20 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.28 1c83 h ASP 289 Cb 0.37 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.88 1c83 h ASP 289 CO -0.45 0.47 -0.08 1.56 -1.72 0.00 0.00 179.24 179.02 1c83 h GLN 290 N 0.00 -0.06 -0.25 3.56 4.20 -1.18 -0.65 115.11 120.72 1c83 h GLN 290 Ca -0.00 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.77 1c83 h GLN 290 Cb 0.86 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.58 1c83 h GLN 290 CO 0.06 -0.04 -0.23 -1.49 -0.67 0.00 0.00 178.83 176.45 1c83 h TRP 291 N -0.07 -0.62 -0.94 2.96 6.55 -0.44 0.00 115.95 123.39 1c83 h TRP 291 Ca 0.08 0.04 0.13 0.00 0.95 0.00 0.00 58.89 60.09 1c83 h TRP 291 Cb 0.19 0.31 -0.08 0.00 -0.86 0.00 0.00 29.16 28.73 1c83 h TRP 291 CO -0.22 -0.31 0.60 -0.22 -1.05 0.00 0.00 178.44 177.24 1c83 h LYS 292 N -0.24 0.84 -0.11 0.49 3.64 -0.90 -1.18 116.57 119.11 1c83 h LYS 292 Ca 0.14 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 1c83 h LYS 292 Cb 0.45 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1c83 h LYS 292 CO -0.39 0.55 -0.19 0.93 -2.27 0.00 0.00 179.45 178.08 1c83 h GLU 293 N 0.86 0.33 -0.75 1.90 4.39 -0.54 -3.20 114.58 117.58 1c83 h GLU 293 Ca 0.47 -0.21 0.13 0.00 0.34 0.00 0.00 59.36 60.09 1c83 h GLU 293 Cb 0.57 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.19 1c83 h GLU 293 CO -0.23 0.79 0.50 -0.07 -1.16 0.00 0.00 179.01 178.84 1c83 h LEU 294 N -0.09 0.47 -0.02 1.33 4.07 -0.88 -2.93 115.31 117.26 1c83 h LEU 294 Ca 0.01 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1c83 h LEU 294 Cb 0.77 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.43 1c83 h LEU 294 CO 0.04 0.26 0.00 -1.54 -1.08 0.00 0.00 178.44 176.12 1c83 n SER 295 N -4.49 0.07 -3.92 -0.43 3.41 -0.46 -4.86 113.62 102.94 1c83 n SER 295 Ca 0.14 0.51 -0.25 0.00 -0.26 0.00 0.00 58.87 59.01 1c83 n SER 295 Cb 0.45 -0.53 -0.02 0.00 -0.26 0.00 0.00 64.21 63.86 1c83 n SER 295 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1c83 n HIS 296 N -1.57 -1.67 0.50 7.33 8.25 -1.11 -4.89 115.22 122.05 1c83 n HIS 296 Ca 0.06 0.75 0.13 0.00 -0.26 0.00 0.00 57.72 58.39 1c83 n HIS 296 Cb 0.30 -3.79 0.44 0.00 1.12 0.00 0.00 29.99 28.05 1c83 n HIS 296 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1c83 h GLU 297 N -1.84 0.00 -0.01 -0.41 4.11 -1.88 -3.42 114.58 111.13 1c83 h GLU 297 Ca -0.63 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.80 1c83 h GLU 297 Cb 1.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1c83 h GLU 297 CO 0.61 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.44