#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g1f h MET 3 N 0.00 1.05 -0.42 5.31 -0.00 -1.82 -2.62 114.93 116.43 1g1f h MET 3 Ca 0.00 -0.30 -0.15 0.00 -0.00 0.00 0.00 59.70 59.25 1g1f h MET 3 Cb 0.00 -0.11 -0.01 0.00 -0.00 0.00 0.00 31.60 31.48 1g1f h MET 3 CO 0.00 0.99 -0.33 1.49 -0.00 0.00 0.00 176.91 179.06 1g1f h GLU 4 N 0.97 0.97 -0.07 -0.10 4.81 -1.97 0.15 114.58 119.34 1g1f h GLU 4 Ca 0.18 -0.48 -0.12 0.00 -0.13 0.00 0.00 59.36 58.81 1g1f h GLU 4 Cb 0.49 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 1g1f h GLU 4 CO 0.02 1.14 -0.51 1.57 -0.73 0.00 0.00 179.01 180.50 1g1f h LYS 5 N 0.80 0.18 -0.27 1.92 5.09 -2.00 -2.50 116.57 119.79 1g1f h LYS 5 Ca 0.08 -0.10 -0.17 0.00 0.09 0.00 0.00 60.65 60.54 1g1f h LYS 5 Cb 0.93 0.01 0.00 0.00 0.10 0.00 0.00 32.23 33.27 1g1f h LYS 5 CO 0.09 0.65 -0.49 1.49 -2.09 0.00 0.00 179.45 179.10 1g1f h GLU 6 N 0.14 0.81 -0.01 0.07 4.81 -1.33 -2.16 114.58 116.92 1g1f h GLU 6 Ca 0.00 -0.51 0.02 0.00 -0.13 0.00 0.00 59.36 58.74 1g1f h GLU 6 Cb 0.96 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 1g1f h GLU 6 CO 0.08 1.14 -0.11 0.35 -0.73 0.00 0.00 179.01 179.74 1g1f h PHE 7 N 0.57 -0.27 -0.31 0.92 3.57 -0.77 -1.15 116.94 119.50 1g1f h PHE 7 Ca 0.02 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 1g1f h PHE 7 Cb 1.10 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.95 1g1f h PHE 7 CO 0.08 -0.16 -0.04 0.93 -2.23 0.00 0.00 178.31 176.89 1g1f h GLU 8 N -0.18 0.50 -0.31 1.11 5.08 -1.46 -0.56 114.58 118.76 1g1f h GLU 8 Ca 0.04 -0.11 -0.15 0.00 -1.00 0.00 0.00 59.36 58.13 1g1f h GLU 8 Cb 0.23 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1g1f h GLU 8 CO -0.11 0.55 -0.43 0.37 -1.00 0.00 0.00 179.01 178.39 1g1f h GLN 9 N 0.47 0.77 0.06 2.33 4.15 -1.02 -1.37 115.11 120.50 1g1f h GLN 9 Ca 0.10 -0.42 -0.24 0.00 0.77 0.00 0.00 58.65 58.86 1g1f h GLN 9 Cb 0.36 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1g1f h GLN 9 CO 0.01 1.05 -1.07 0.82 -1.93 0.00 0.00 178.83 177.72 1g1f h ILE 10 N 0.62 1.53 -0.23 2.39 2.04 -1.03 -2.64 117.51 120.19 1g1f h ILE 10 Ca 0.04 -2.95 -0.13 0.00 1.00 0.00 0.00 64.86 62.82 1g1f h ILE 10 Cb 0.99 2.75 -0.01 0.00 -0.74 0.00 0.00 36.82 39.81 1g1f h ILE 10 CO 0.09 0.86 -0.41 -0.78 0.00 0.00 0.00 178.15 177.91 1g1f h ASP 11 N 0.08 0.59 0.03 1.72 -0.00 -1.03 -0.03 116.42 117.77 1g1f h ASP 11 Ca -0.08 -0.26 -0.23 0.00 -0.00 0.00 0.00 57.03 56.45 1g1f h ASP 11 Cb 1.77 -0.16 0.01 0.00 -0.00 0.00 0.00 39.33 40.94 1g1f h ASP 11 CO 0.17 0.93 -0.89 0.50 -0.00 0.00 0.00 179.24 179.95 1g1f h LYS 12 N 0.45 0.66 0.00 0.28 3.64 -1.30 -3.22 116.57 117.07 1g1f h LYS 12 Ca 0.04 -0.62 -0.06 0.00 -1.27 0.00 0.00 60.65 58.74 1g1f h LYS 12 Cb 0.91 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1g1f h LYS 12 CO 0.08 1.22 -0.30 0.77 -2.27 0.00 0.00 179.45 178.95 1g1f h SER 13 N 0.41 0.00 -3.24 4.20 0.02 -1.41 -3.48 113.55 110.06 1g1f h SER 13 Ca -0.08 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.62 1g1f h SER 13 Cb 1.52 0.00 0.05 0.00 0.14 0.00 0.00 62.40 64.11 1g1f h SER 13 CO 0.17 0.30 -0.38 0.61 -1.14 0.00 0.00 176.83 176.39 1g1f n GLY 14 N 0.86 -0.02 1.61 -3.77 0.00 -0.06 -4.96 105.19 98.86 1g1f n GLY 14 Ca 0.02 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 1g1f n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1g1f n SER 15 N -0.97 3.52 0.03 1.61 3.41 -1.00 -4.69 113.62 115.53 1g1f n SER 15 Ca -0.05 -3.52 0.02 0.00 -0.26 0.00 0.00 58.87 55.07 1g1f n SER 15 Cb 0.56 -0.71 0.38 0.00 -0.26 0.00 0.00 64.21 64.18 1g1f n SER 15 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1g1f h TRP 16 N 1.45 0.46 -0.47 7.33 4.06 -1.93 -1.57 115.95 125.28 1g1f h TRP 16 Ca 0.32 -0.02 -0.13 0.00 2.06 0.00 0.00 58.89 61.13 1g1f h TRP 16 Cb 2.13 -0.14 -0.01 0.00 -1.00 0.00 0.00 29.16 30.13 1g1f h TRP 16 CO 1.18 0.40 -0.20 0.00 -3.56 0.00 0.00 178.44 176.26 1g1f h ALA 17 N 1.64 0.75 -0.25 1.49 0.00 -1.92 -2.09 119.26 118.89 1g1f h ALA 17 Ca 0.11 -0.38 -0.16 0.00 0.00 0.00 0.00 54.91 54.47 1g1f h ALA 17 Cb 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1g1f h ALA 17 CO -0.01 0.66 -0.49 0.00 0.00 0.00 0.00 179.25 179.42 1g1f h ALA 18 N 0.94 0.39 -0.41 0.00 0.00 -1.82 -1.87 119.26 116.50 1g1f h ALA 18 Ca 0.11 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 1g1f h ALA 18 Cb 0.76 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1g1f h ALA 18 CO 0.06 0.56 0.08 0.82 0.00 0.00 0.00 179.25 180.77 1g1f h ILE 19 N 0.51 1.24 -0.23 0.00 1.08 -1.28 -2.38 117.51 116.44 1g1f h ILE 19 Ca 0.01 -0.84 -0.12 0.00 -0.39 0.00 0.00 64.86 63.51 1g1f h ILE 19 Cb 1.10 1.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.83 1g1f h ILE 19 CO 0.11 0.29 -0.37 0.22 -0.69 0.00 0.00 178.15 177.71 1g1f h TYR 20 N 0.53 0.60 0.00 1.37 3.20 -1.40 -2.81 116.97 118.45 1g1f h TYR 20 Ca 0.13 -0.16 -0.06 0.00 3.14 0.00 0.00 58.73 61.77 1g1f h TYR 20 Cb 0.35 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1g1f h TYR 20 CO 0.02 0.81 -0.29 0.37 -1.64 0.00 0.00 178.16 177.44 1g1f h GLN 21 N 0.43 0.00 -0.04 1.82 5.75 -1.20 -2.41 115.11 119.46 1g1f h GLN 21 Ca 0.04 0.00 -0.18 0.00 -0.15 0.00 0.00 58.65 58.37 1g1f h GLN 21 Cb 0.85 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.39 1g1f h GLN 21 CO 0.07 0.29 -0.75 -0.44 -2.65 0.00 0.00 178.83 175.35 1g1f h ASP 22 N 0.00 0.32 -0.36 -0.69 3.32 -1.18 -2.51 116.42 115.32 1g1f h ASP 22 Ca -0.00 -0.22 -0.14 0.00 0.02 0.00 0.00 57.03 56.69 1g1f h ASP 22 Cb 0.67 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1g1f h ASP 22 CO 0.04 0.96 -0.32 0.40 -1.72 0.00 0.00 179.24 178.60 1g1f h ILE 23 N 0.17 1.28 -0.57 0.35 2.04 -1.30 -2.07 117.51 117.41 1g1f h ILE 23 Ca -0.03 -1.49 -0.04 0.00 1.00 0.00 0.00 64.86 64.30 1g1f h ILE 23 Cb 1.32 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 38.79 1g1f h ILE 23 CO 0.12 0.49 0.18 0.03 0.00 0.00 0.00 178.15 178.97 1g1f h ARG 24 N 0.66 0.86 -0.26 2.37 3.08 -1.40 -0.59 114.38 119.10 1g1f h ARG 24 Ca 0.06 -0.16 -0.17 0.00 0.07 0.00 0.00 59.98 59.78 1g1f h ARG 24 Cb 0.90 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.81 1g1f h ARG 24 CO 0.08 0.75 -0.53 1.25 -1.07 0.00 0.00 179.97 180.45 1g1f h HIS 25 N 0.84 0.94 0.00 3.04 2.76 -1.35 -3.17 115.15 118.21 1g1f h HIS 25 Ca 0.19 -0.33 0.00 0.00 -2.20 0.00 0.00 60.37 58.03 1g1f h HIS 25 Cb 0.25 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 29.03 1g1f h HIS 25 CO 0.02 1.12 -0.07 0.93 -1.30 0.00 0.00 177.93 178.62 1g1f h GLU 26 N 0.58 0.00 -6.96 5.26 5.08 -1.05 -3.47 114.58 114.02 1g1f h GLU 26 Ca 0.02 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.83 1g1f h GLU 26 Cb 1.11 0.00 0.12 0.00 0.50 0.00 0.00 28.75 30.48 1g1f h GLU 26 CO 0.11 0.00 0.69 0.00 -1.00 0.00 0.00 179.01 178.81 1g1f n ALA 27 N -1.84 2.00 -1.71 3.43 0.00 -0.26 -4.98 120.51 117.17 1g1f n ALA 27 Ca 0.05 0.26 -0.37 0.00 0.00 0.00 0.00 53.44 53.38 1g1f n ALA 27 Cb 0.45 -2.38 0.07 0.00 0.00 0.00 0.00 19.45 17.58 1g1f n ALA 27 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1g1f s SER 28 N -0.43 4.57 -0.25 0.00 0.01 -1.26 -5.04 113.70 111.30 1g1f s SER 28 Ca 0.60 2.61 -0.03 0.00 1.31 0.00 0.00 55.95 60.45 1g1f s SER 28 Cb -0.46 -2.62 0.08 0.00 0.21 0.00 0.00 66.02 63.23 1g1f s SER 28 CO 0.58 -2.03 0.08 -0.62 0.41 0.00 0.00 173.24 171.67 1g1f s ASP 29 N -1.42 3.29 0.26 2.44 3.68 -1.26 -4.95 116.67 118.70 1g1f s ASP 29 Ca 0.82 -1.13 0.11 0.00 2.13 0.00 0.00 52.55 54.49 1g1f s ASP 29 Cb -0.37 -0.56 -0.05 0.00 -1.45 0.00 0.00 42.92 40.49 1g1f s ASP 29 CO 0.40 -0.37 -0.18 -0.36 0.13 0.00 0.00 175.17 174.79 1g1f s PHE 30 N 1.89 2.36 0.59 -5.34 0.40 -1.26 -5.13 117.98 111.49 1g1f s PHE 30 Ca 0.05 -0.32 -0.18 0.00 -0.60 0.00 0.00 56.93 55.88 1g1f s PHE 30 Cb -0.17 -1.06 -0.03 0.00 0.51 0.00 0.00 43.02 42.27 1g1f s PHE 30 CO -0.20 0.66 1.16 -2.14 0.70 0.00 0.00 175.22 175.40 1g1f s PRO 31 N -3.34 3.04 -0.36 0.24 0.02 -1.26 -4.90 135.00 128.44 1g1f s PRO 31 Ca 0.28 1.66 0.13 0.00 0.02 0.00 0.00 61.00 63.09 1g1f s PRO 31 Cb -0.06 -1.96 0.45 0.00 0.02 0.00 0.00 34.50 32.95 1g1f s PRO 31 CO 0.15 -1.11 1.03 0.00 -0.33 0.00 0.00 177.00 176.73 1g1f h ARG 33 N 2.80 0.73 -0.26 0.00 2.43 -1.93 -2.23 114.38 115.91 1g1f h ARG 33 Ca 0.06 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 1g1f h ARG 33 Cb 1.11 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 1g1f h ARG 33 CO 0.61 0.48 -0.30 0.28 -1.51 0.00 0.00 179.97 179.53 1g1f h VAL 34 N 0.75 1.28 -0.19 0.20 2.07 -1.93 -2.94 116.25 115.49 1g1f h VAL 34 Ca 0.22 -1.39 -0.12 0.00 0.82 0.00 0.00 66.70 66.23 1g1f h VAL 34 Cb -0.05 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1g1f h VAL 34 CO -0.07 0.44 -0.38 0.00 0.02 0.00 0.00 177.57 177.58 1g1f h ALA 35 N 1.21 0.99 -0.05 1.67 0.00 -1.81 -2.98 119.26 118.28 1g1f h ALA 35 Ca 0.06 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1g1f h ALA 35 Cb 0.76 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1g1f h ALA 35 CO 0.06 0.61 0.00 1.63 0.00 0.00 0.00 179.25 181.55 1g1f n LYS 36 N -4.04 1.47 -2.10 0.00 4.76 -0.86 -4.66 118.16 112.73 1g1f n LYS 36 Ca -0.01 -0.69 -0.42 0.00 -2.87 0.00 0.00 58.31 54.32 1g1f n LYS 36 Cb 0.48 -1.44 -0.03 0.00 -1.84 0.00 0.00 35.03 32.21 1g1f n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1g1f s LEU 37 N -1.83 4.39 0.32 -0.35 1.02 -1.12 -4.93 118.68 116.18 1g1f s LEU 37 Ca 0.37 2.52 0.10 0.00 0.02 0.00 0.00 54.13 57.14 1g1f s LEU 37 Cb 0.19 -3.61 0.94 0.00 0.02 0.00 0.00 46.19 43.73 1g1f s LEU 37 CO 0.31 -0.64 1.69 -0.65 0.02 0.00 0.00 176.35 177.07 1g1f h PRO 38 N 5.57 0.40 0.00 1.29 0.11 -1.90 -0.72 132.00 136.75 1g1f h PRO 38 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1g1f h PRO 38 Cb 1.21 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1g1f h PRO 38 CO 0.80 0.26 0.00 1.57 -0.21 0.00 0.00 178.00 180.43 1g1f h LYS 39 N 0.41 0.00 -0.58 1.05 2.10 -1.95 -2.82 116.57 114.78 1g1f h LYS 39 Ca 0.67 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.32 1g1f h LYS 39 Cb 1.39 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.72 1g1f h LYS 39 CO -0.56 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 176.98 1g1f n ASN 40 N -2.81 3.70 -0.20 7.07 3.02 -0.28 -4.58 115.26 121.19 1g1f n ASN 40 Ca 0.00 -1.99 -0.06 0.00 -0.03 0.00 0.00 54.58 52.51 1g1f n ASN 40 Cb 0.24 -0.38 0.04 0.00 -0.61 0.00 0.00 39.78 39.06 1g1f n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1g1f h LYS 41 N 4.20 0.74 0.00 3.52 3.64 -1.50 -2.27 116.57 124.90 1g1f h LYS 41 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1g1f h LYS 41 Cb 0.97 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1g1f h LYS 41 CO 0.00 0.49 0.00 0.27 -2.27 0.00 0.00 179.45 177.94 1g1f n ASN 42 N -4.70 0.00 -0.55 4.20 0.23 -1.26 -2.90 115.26 110.28 1g1f n ASN 42 Ca 0.04 -0.63 0.12 0.00 -0.53 0.00 0.00 54.58 53.59 1g1f n ASN 42 Cb 0.04 -0.10 0.15 0.00 -2.08 0.00 0.00 39.78 37.79 1g1f n ASN 42 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1g1f n ARG 43 N -1.10 1.43 -4.35 -3.83 1.74 -0.86 -4.88 116.66 104.81 1g1f n ARG 43 Ca 0.19 -1.10 -0.34 0.00 -0.77 0.00 0.00 57.85 55.83 1g1f n ARG 43 Cb 0.14 -1.48 -0.13 0.00 -1.02 0.00 0.00 32.46 29.97 1g1f n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1g1f s ASN 44 N -2.33 4.45 0.12 0.55 0.01 -1.14 -4.46 114.94 112.14 1g1f s ASN 44 Ca 0.24 -0.26 -0.11 0.00 -0.71 0.00 0.00 52.86 52.02 1g1f s ASN 44 Cb 0.19 -1.73 -0.11 0.00 0.41 0.00 0.00 41.25 40.02 1g1f s ASN 44 CO 0.48 0.11 1.34 -0.09 -1.51 0.00 0.00 177.10 177.43 1g1f h ARG 45 N 7.14 0.74 -5.33 -0.60 2.43 -1.89 -3.45 114.38 113.42 1g1f h ARG 45 Ca -0.33 -0.59 -0.49 0.00 -0.81 0.00 0.00 59.98 57.77 1g1f h ARG 45 Cb 1.19 0.12 -0.29 0.00 -0.42 0.00 0.00 29.97 30.57 1g1f h ARG 45 CO 0.60 1.20 -0.81 0.71 -1.51 0.00 0.00 179.97 180.16 1g1f s TYR 46 N -3.77 1.29 0.23 2.20 1.51 -1.26 -5.04 117.35 112.51 1g1f s TYR 46 Ca -0.10 -0.25 0.24 0.00 -1.01 0.00 0.00 57.07 55.96 1g1f s TYR 46 Cb 0.09 -0.83 1.06 0.00 -0.11 0.00 0.00 41.96 42.17 1g1f s TYR 46 CO 0.89 -0.02 1.89 0.00 -1.11 0.00 0.00 175.55 177.21 1g1f h ARG 47 N 5.74 0.00 -0.20 -0.62 3.08 -1.98 -3.11 114.38 117.29 1g1f h ARG 47 Ca -0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.70 1g1f h ARG 47 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 1g1f h ARG 47 CO 0.49 0.21 0.00 -0.40 -1.07 0.00 0.00 179.97 179.20 1g1f n ASP 48 N -3.49 3.15 -3.96 7.04 5.68 -1.26 -4.79 116.55 118.92 1g1f n ASP 48 Ca -0.01 -1.98 -0.31 0.00 -0.50 0.00 0.00 54.79 52.00 1g1f n ASP 48 Cb 0.38 -0.12 -0.15 0.00 -1.14 0.00 0.00 41.12 40.09 1g1f n ASP 48 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1g1f s VAL 49 N -1.76 1.86 0.03 2.12 1.01 -1.18 -5.06 120.40 117.43 1g1f s VAL 49 Ca 0.34 -1.82 0.03 0.00 0.00 0.00 0.00 61.98 60.52 1g1f s VAL 49 Cb 0.21 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 1g1f s VAL 49 CO 0.31 -0.41 -0.09 -0.44 0.00 0.00 0.00 175.10 174.48 1g1f s SER 50 N 1.16 0.98 0.45 3.32 0.01 -1.26 -4.66 113.70 113.71 1g1f s SER 50 Ca 0.04 -0.43 -0.15 0.00 1.31 0.00 0.00 55.95 56.71 1g1f s SER 50 Cb -0.19 -0.02 -0.08 0.00 0.21 0.00 0.00 66.02 65.94 1g1f s SER 50 CO -0.10 -0.09 0.90 -2.16 0.41 0.00 0.00 173.24 172.19 1g1f s PRO 51 N -1.17 3.95 0.37 12.44 0.04 -1.26 -4.58 135.00 144.78 1g1f s PRO 51 Ca -0.05 0.82 -0.25 0.00 0.04 0.00 0.00 61.00 61.56 1g1f s PRO 51 Cb -0.08 -2.24 -0.09 0.00 0.04 0.00 0.00 34.50 32.13 1g1f s PRO 51 CO 0.01 -0.13 1.02 -0.06 0.04 0.00 0.00 177.00 177.87 1g1f s PHE 52 N -2.43 3.43 0.29 0.56 2.99 -1.26 -4.54 117.98 117.02 1g1f s PHE 52 Ca 0.57 1.69 -0.02 0.00 0.00 0.00 0.00 56.93 59.17 1g1f s PHE 52 Cb -0.10 -3.06 0.45 0.00 0.00 0.00 0.00 43.02 40.30 1g1f s PHE 52 CO 0.27 -0.33 1.94 -0.44 -0.00 0.00 0.00 175.22 176.66 1g1f h ASP 53 N 2.81 0.97 0.60 1.36 3.32 -1.58 -1.30 116.42 122.59 1g1f h ASP 53 Ca -0.48 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.49 1g1f h ASP 53 Cb 1.21 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 1g1f h ASP 53 CO 0.63 0.67 -0.33 1.12 -1.72 0.00 0.00 179.24 179.62 1g1f h HIS 54 N 1.13 0.00 -0.04 4.55 2.07 -1.93 -3.26 115.15 117.66 1g1f h HIS 54 Ca 0.35 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.87 1g1f h HIS 54 Cb 0.01 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.99 1g1f h HIS 54 CO -0.00 0.33 0.00 -1.13 -3.07 0.00 0.00 177.93 174.06 1g1f n SER 55 N -3.73 1.68 -4.76 3.10 3.41 -1.12 -5.06 113.62 107.14 1g1f n SER 55 Ca -0.01 -1.39 -0.38 0.00 -0.26 0.00 0.00 58.87 56.83 1g1f n SER 55 Cb 0.42 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.36 1g1f n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1g1f s ARG 56 N -0.58 3.50 -0.04 4.33 1.70 -0.51 -0.72 118.95 126.63 1g1f s ARG 56 Ca 0.08 1.95 -0.25 0.00 -0.47 0.00 0.00 55.73 57.04 1g1f s ARG 56 Cb 0.05 -2.34 -0.04 0.00 -0.57 0.00 0.00 34.95 32.05 1g1f s ARG 56 CO 0.07 -0.82 0.76 0.42 -1.08 0.00 0.00 175.30 174.66 1g1f s ILE 57 N -1.45 4.98 -0.16 4.99 -1.09 -0.66 -4.81 121.20 123.00 1g1f s ILE 57 Ca 0.67 1.58 -0.06 0.00 -2.23 0.00 0.00 60.65 60.61 1g1f s ILE 57 Cb -0.33 -4.10 -0.04 0.00 -1.58 0.00 0.00 42.46 36.41 1g1f s ILE 57 CO 0.40 0.24 0.06 -0.54 -1.23 0.00 0.00 174.94 173.87 1g1f s LYS 58 N 0.76 3.76 0.48 2.79 1.02 -1.26 -4.32 119.74 122.96 1g1f s LYS 58 Ca 0.40 -0.33 -0.19 0.00 0.02 0.00 0.00 55.97 55.87 1g1f s LYS 58 Cb -0.19 -3.14 -0.09 0.00 -0.52 0.00 0.00 37.83 33.90 1g1f s LYS 58 CO 0.20 0.39 0.98 -0.51 -0.92 0.00 0.00 175.35 175.50 1g1f s LEU 59 N 0.02 3.79 -0.09 3.17 1.43 -0.12 -4.97 118.68 121.91 1g1f s LEU 59 Ca 0.06 1.71 0.03 0.00 -1.03 0.00 0.00 54.13 54.89 1g1f s LEU 59 Cb -0.12 -4.53 0.21 0.00 0.03 0.00 0.00 46.19 41.77 1g1f s LEU 59 CO 0.01 -0.56 1.04 1.41 0.23 0.00 0.00 176.35 178.48 1g1f n HIS 60 N -1.09 0.71 -4.03 0.29 8.25 -1.26 -4.63 115.22 113.47 1g1f n HIS 60 Ca 0.07 -0.52 -0.36 0.00 -0.26 0.00 0.00 57.72 56.66 1g1f n HIS 60 Cb 0.54 -0.32 -0.08 0.00 1.12 0.00 0.00 29.99 31.24 1g1f n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1g1f s GLN 61 N -1.22 3.48 0.48 -0.41 -2.07 -1.26 -5.01 119.66 113.64 1g1f s GLN 61 Ca 0.15 -0.25 0.25 0.00 -1.82 0.00 0.00 55.36 53.69 1g1f s GLN 61 Cb 0.12 -3.10 1.18 0.00 -1.09 0.00 0.00 33.01 30.12 1g1f s GLN 61 CO 0.04 0.62 1.95 1.05 -1.32 0.00 0.00 175.29 177.63 1g1f h GLU 62 N 5.49 0.00 0.22 9.60 -0.00 -2.03 -3.34 114.58 124.52 1g1f h GLU 62 Ca -0.49 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 58.86 1g1f h GLU 62 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.95 1g1f h GLU 62 CO 0.61 0.18 -0.11 0.22 -0.00 0.00 0.00 179.01 179.92 1g1f h ASP 63 N 0.00 -0.25 -2.59 3.06 3.58 -1.98 -3.45 116.42 114.78 1g1f h ASP 63 Ca -0.00 0.01 -0.16 0.00 0.42 0.00 0.00 57.03 57.30 1g1f h ASP 63 Cb 0.54 0.06 -0.30 0.00 1.72 0.00 0.00 39.33 41.36 1g1f h ASP 63 CO 0.02 -0.17 -0.45 0.21 -2.88 0.00 0.00 179.24 175.97 1g1f s ASN 64 N -2.60 0.09 0.00 2.28 3.84 -1.25 -5.05 114.94 112.25 1g1f s ASN 64 Ca -0.04 0.72 0.14 0.00 0.21 0.00 0.00 52.86 53.89 1g1f s ASN 64 Cb 0.00 1.04 0.50 0.00 -0.55 0.00 0.00 41.25 42.24 1g1f s ASN 64 CO 0.13 -0.24 1.37 -0.90 -2.79 0.00 0.00 177.10 174.67 1g1f n ASP 65 N 5.37 1.45 -4.75 -4.21 3.85 -1.26 -4.76 116.55 112.25 1g1f n ASP 65 Ca -0.07 -1.85 -0.40 0.00 -0.71 0.00 0.00 54.79 51.77 1g1f n ASP 65 Cb 0.50 -0.15 -0.05 0.00 -1.35 0.00 0.00 41.12 40.07 1g1f n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.20 175.72 1g1f s TYR 66 N -1.71 3.78 -0.15 2.11 5.04 -1.26 -0.94 117.35 124.21 1g1f s TYR 66 Ca 0.25 1.52 -0.13 0.00 -2.44 0.00 0.00 57.07 56.26 1g1f s TYR 66 Cb 0.13 -2.81 0.04 0.00 0.35 0.00 0.00 41.96 39.67 1g1f s TYR 66 CO 0.18 0.33 0.40 -1.50 -1.34 0.00 0.00 175.55 173.63 1g1f s ILE 67 N -0.32 -0.00 -1.15 3.14 2.07 -1.26 -4.95 121.20 118.73 1g1f s ILE 67 Ca 0.38 0.01 -0.21 0.00 -1.41 0.00 0.00 60.65 59.42 1g1f s ILE 67 Cb -0.21 -0.56 0.03 0.00 0.13 0.00 0.00 42.46 41.84 1g1f s ILE 67 CO 0.24 0.01 1.69 0.21 -1.91 0.00 0.00 174.94 175.17 1g1f s ASN 68 N 0.36 6.30 -0.10 4.50 3.84 -1.26 -4.66 114.94 123.91 1g1f s ASN 68 Ca -0.01 -1.82 -0.18 0.00 0.21 0.00 0.00 52.86 51.07 1g1f s ASN 68 Cb -0.04 -2.58 0.04 0.00 -0.55 0.00 0.00 41.25 38.13 1g1f s ASN 68 CO -0.01 -1.72 0.44 0.00 -2.79 0.00 0.00 177.10 173.02 1g1f s ALA 69 N 6.04 -1.10 0.05 1.71 0.00 -1.26 -2.95 121.76 124.25 1g1f s ALA 69 Ca 0.55 0.97 0.04 0.00 0.00 0.00 0.00 51.96 53.52 1g1f s ALA 69 Cb 0.01 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 1g1f s ALA 69 CO 0.02 -0.25 -0.13 -1.12 0.00 0.00 0.00 175.76 174.28 1g1f s SER 70 N -0.48 1.50 -0.32 0.00 0.01 -0.19 -1.66 113.70 112.55 1g1f s SER 70 Ca -0.06 -0.51 -0.13 0.00 1.31 0.00 0.00 55.95 56.56 1g1f s SER 70 Cb -0.03 -0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.11 1g1f s SER 70 CO 0.03 -0.04 0.25 -0.22 0.41 0.00 0.00 173.24 173.67 1g1f s LEU 71 N -1.36 4.38 -0.53 2.44 2.96 0.10 -1.26 118.68 125.41 1g1f s LEU 71 Ca -0.01 -0.28 -0.18 0.00 -0.22 0.00 0.00 54.13 53.43 1g1f s LEU 71 Cb -0.09 -2.17 0.08 0.00 0.50 0.00 0.00 46.19 44.52 1g1f s LEU 71 CO 0.01 -0.20 0.60 -0.63 -1.32 0.00 0.00 176.35 174.81 1g1f s ILE 72 N 1.78 4.94 -0.57 6.68 -1.09 0.85 -4.89 121.20 128.89 1g1f s ILE 72 Ca 0.07 -0.82 -0.18 0.00 -2.23 0.00 0.00 60.65 57.49 1g1f s ILE 72 Cb -0.17 -4.33 0.12 0.00 -1.58 0.00 0.00 42.46 36.50 1g1f s ILE 72 CO 0.11 -0.87 0.62 -0.54 -1.23 0.00 0.00 174.94 173.02 1g1f s LYS 73 N 2.40 3.03 -0.78 2.79 1.02 -1.26 -1.77 119.74 125.17 1g1f s LYS 73 Ca 0.11 -1.51 -0.18 0.00 0.02 0.00 0.00 55.97 54.41 1g1f s LYS 73 Cb -0.22 -4.29 0.13 0.00 -0.52 0.00 0.00 37.83 32.93 1g1f s LYS 73 CO 0.09 -1.45 0.91 -1.64 -0.92 0.00 0.00 175.35 172.34 1g1f s MET 74 N 2.18 3.38 0.15 1.68 -1.94 -0.66 -4.94 119.30 119.13 1g1f s MET 74 Ca 0.08 -1.67 -0.19 0.00 -1.71 0.00 0.00 55.69 52.20 1g1f s MET 74 Cb -0.27 -4.55 0.03 0.00 2.01 0.00 0.00 34.83 32.06 1g1f s MET 74 CO 0.05 -1.61 1.67 1.49 -0.01 0.00 0.00 175.02 176.61 1g1f h GLU 75 N 8.81 -0.06 -0.15 2.03 4.81 -1.95 -0.94 114.58 127.14 1g1f h GLU 75 Ca -0.04 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 58.97 1g1f h GLU 75 Cb 1.05 0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.45 1g1f h GLU 75 CO 1.04 -0.04 -0.78 1.49 -0.73 0.00 0.00 179.01 180.00 1g1f h GLU 76 N -0.06 0.78 0.00 1.92 4.81 -1.96 -3.16 114.58 116.91 1g1f h GLU 76 Ca 0.14 -0.64 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1g1f h GLU 76 Cb 0.27 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1g1f h GLU 76 CO -0.32 1.25 0.00 0.00 -0.73 0.00 0.00 179.01 179.21 1g1f h ALA 77 N 0.57 1.00 -5.88 2.92 0.00 -1.92 -3.48 119.26 112.48 1g1f h ALA 77 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.47 1g1f h ALA 77 Cb 1.41 0.00 0.11 0.00 0.00 0.00 0.00 17.79 19.31 1g1f h ALA 77 CO 0.16 0.00 -0.76 1.04 0.00 0.00 0.00 179.25 179.69 1g1f n GLN 78 N -2.44 -6.48 -3.85 0.00 6.02 -0.38 -4.90 117.38 105.35 1g1f n GLN 78 Ca 0.03 0.76 -0.12 0.00 -0.01 0.00 0.00 57.00 57.66 1g1f n GLN 78 Cb 0.33 -5.68 -0.12 0.00 1.02 0.00 0.00 30.24 25.79 1g1f n GLN 78 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1g1f s ARG 79 N -5.91 0.18 0.05 -1.09 6.06 -1.06 -4.95 118.95 112.24 1g1f s ARG 79 Ca 0.24 0.02 0.07 0.00 -2.50 0.00 0.00 55.73 53.57 1g1f s ARG 79 Cb -0.11 0.08 -0.03 0.00 0.06 0.00 0.00 34.95 34.96 1g1f s ARG 79 CO 0.76 -0.03 -0.21 -1.12 -2.50 0.00 0.00 175.30 172.20 1g1f s SER 80 N -0.23 2.50 0.03 -2.12 0.01 -1.26 -1.66 113.70 110.97 1g1f s SER 80 Ca -0.03 -0.54 0.02 0.00 1.31 0.00 0.00 55.95 56.70 1g1f s SER 80 Cb -0.02 -0.20 -0.02 0.00 0.21 0.00 0.00 66.02 65.99 1g1f s SER 80 CO 0.00 0.15 -0.06 -0.31 0.41 0.00 0.00 173.24 173.43 1g1f s TYR 81 N -0.84 0.54 -0.31 2.43 1.51 -0.73 -3.96 117.35 115.99 1g1f s TYR 81 Ca 0.07 -0.40 -0.07 0.00 -1.01 0.00 0.00 57.07 55.67 1g1f s TYR 81 Cb -0.09 -0.33 0.02 0.00 -0.11 0.00 0.00 41.96 41.45 1g1f s TYR 81 CO 0.02 -0.08 0.09 0.42 -1.11 0.00 0.00 175.55 174.89 1g1f s ILE 82 N -1.09 3.88 -0.23 2.71 1.01 0.13 -0.11 121.20 127.50 1g1f s ILE 82 Ca -0.08 -0.89 -0.10 0.00 0.00 0.00 0.00 60.65 59.58 1g1f s ILE 82 Cb -0.08 -3.09 -0.05 0.00 0.01 0.00 0.00 42.46 39.25 1g1f s ILE 82 CO 0.00 -0.04 0.14 -0.76 0.00 0.00 0.00 174.94 174.28 1g1f s LEU 83 N 1.46 4.02 0.24 2.97 1.43 -0.39 -0.26 118.68 128.14 1g1f s LEU 83 Ca 0.01 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.20 1g1f s LEU 83 Cb -0.18 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 43.92 1g1f s LEU 83 CO 0.03 0.08 0.08 0.28 0.23 0.00 0.00 176.35 177.05 1g1f s THR 84 N 0.97 0.52 0.68 5.49 -1.32 -0.89 -1.02 115.64 120.06 1g1f s THR 84 Ca 0.07 -2.00 -0.09 0.00 -1.21 0.00 0.00 61.69 58.47 1g1f s THR 84 Cb -0.13 -2.53 0.03 0.00 -1.51 0.00 0.00 72.50 68.36 1g1f s THR 84 CO 0.04 -0.09 1.02 0.00 -2.21 0.00 0.00 174.62 173.38 1g1f s GLN 85 N -4.03 2.66 -0.07 7.08 -2.07 -1.15 -3.66 119.66 118.41 1g1f s GLN 85 Ca 0.35 0.12 -0.30 0.00 -1.82 0.00 0.00 55.36 53.72 1g1f s GLN 85 Cb 0.07 -2.13 -0.05 0.00 -1.09 0.00 0.00 33.01 29.82 1g1f s GLN 85 CO 0.12 -1.02 1.53 0.20 -1.32 0.00 0.00 175.29 174.80 1g1f s GLY 86 N -4.39 1.60 0.49 2.60 0.00 0.18 -4.84 107.32 102.96 1g1f s GLY 86 Ca 0.57 0.81 -0.23 0.00 0.00 0.00 0.00 44.72 45.88 1g1f s GLY 86 CO 0.48 2.84 1.22 -1.55 0.00 0.00 0.00 173.10 176.08 1g1f n PRO 87 N 6.77 1.61 -2.47 2.90 -0.04 -1.26 -4.73 135.00 137.78 1g1f n PRO 87 Ca 0.16 0.58 -0.26 0.00 -0.04 0.00 0.00 63.50 63.94 1g1f n PRO 87 Cb 0.43 -2.37 0.02 0.00 -0.04 0.00 0.00 33.50 31.55 1g1f n PRO 87 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1g1f s LEU 88 N -2.19 3.32 0.55 1.53 1.43 -1.26 -1.88 118.68 120.19 1g1f s LEU 88 Ca 0.67 0.72 0.29 0.00 -1.03 0.00 0.00 54.13 54.78 1g1f s LEU 88 Cb -0.47 -3.57 1.46 0.00 0.03 0.00 0.00 46.19 43.64 1g1f s LEU 88 CO 0.53 -0.96 1.93 -0.65 0.23 0.00 0.00 176.35 177.43 1g1f h PRO 89 N -0.07 0.00 -0.01 1.29 0.11 -1.96 -1.14 132.00 130.22 1g1f h PRO 89 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1g1f h PRO 89 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1g1f h PRO 89 CO 0.60 0.00 -0.48 0.27 -0.21 0.00 0.00 178.00 178.19 1g1f n ASN 90 N -4.15 1.33 -0.42 -2.05 6.94 -1.26 -4.25 115.26 111.39 1g1f n ASN 90 Ca 0.13 -1.06 0.04 0.00 -0.02 0.00 0.00 54.58 53.67 1g1f n ASN 90 Cb 0.76 0.40 0.10 0.00 -2.36 0.00 0.00 39.78 38.68 1g1f n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1g1f n THR 91 N -0.65 0.90 0.16 5.53 -2.24 -0.46 -4.64 114.28 112.89 1g1f n THR 91 Ca 0.09 -0.95 0.02 0.00 -2.27 0.00 0.00 64.05 60.94 1g1f n THR 91 Cb 0.39 0.57 0.36 0.00 -2.10 0.00 0.00 70.33 69.55 1g1f n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1g1f h GLY 93 N 0.97 0.69 1.25 0.00 0.00 -1.89 -2.89 103.07 101.20 1g1f h GLY 93 Ca 0.01 -1.02 -0.10 0.00 0.00 0.00 0.00 47.33 46.22 1g1f h GLY 93 CO 0.04 0.91 -0.09 0.45 0.00 0.00 0.00 176.54 177.85 1g1f h HIS 94 N 0.41 0.98 0.08 5.60 3.86 -1.76 -1.11 115.15 123.21 1g1f h HIS 94 Ca -0.06 -0.18 0.00 0.00 -1.16 0.00 0.00 60.37 58.97 1g1f h HIS 94 Cb 1.42 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.64 1g1f h HIS 94 CO 0.07 0.93 -0.07 0.35 0.86 0.00 0.00 177.93 180.07 1g1f h PHE 95 N 0.80 -0.18 0.00 2.45 3.57 -1.09 -0.93 116.94 121.55 1g1f h PHE 95 Ca 0.13 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.59 1g1f h PHE 95 Cb 0.60 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.41 1g1f h PHE 95 CO 0.04 -0.11 -0.23 -1.49 -2.23 0.00 0.00 178.31 174.28 1g1f h TRP 96 N -0.16 0.00 -0.36 0.41 4.06 -1.41 -2.20 115.95 116.28 1g1f h TRP 96 Ca 0.00 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.80 1g1f h TRP 96 Cb 0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 1g1f h TRP 96 CO -0.10 0.23 -0.39 1.49 -3.56 0.00 0.00 178.44 176.11 1g1f h GLU 97 N 0.00 0.88 -0.17 0.49 4.81 -0.84 -2.14 114.58 117.60 1g1f h GLU 97 Ca -0.00 -0.46 -0.02 0.00 -0.13 0.00 0.00 59.36 58.75 1g1f h GLU 97 Cb 0.77 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 1g1f h GLU 97 CO 0.03 1.10 0.02 1.98 -0.73 0.00 0.00 179.01 181.42 1g1f h MET 98 N 0.72 0.29 -0.85 1.92 4.05 -0.92 -1.02 114.93 119.12 1g1f h MET 98 Ca 0.06 -0.08 0.07 0.00 -0.28 0.00 0.00 59.70 59.47 1g1f h MET 98 Cb 0.97 -0.03 -0.06 0.00 -0.80 0.00 0.00 31.60 31.67 1g1f h MET 98 CO 0.09 0.46 0.52 0.28 0.23 0.00 0.00 176.91 178.49 1g1f h VAL 99 N 0.07 1.00 0.53 -5.77 2.07 -1.34 0.24 116.25 113.05 1g1f h VAL 99 Ca 0.05 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1g1f h VAL 99 Cb 0.32 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.10 1g1f h VAL 99 CO 0.00 0.17 -0.25 -0.25 0.02 0.00 0.00 177.57 177.26 1g1f h TRP 100 N 0.92 -0.66 -0.84 1.57 2.91 -1.21 -1.85 115.95 116.79 1g1f h TRP 100 Ca 0.38 -0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.38 1g1f h TRP 100 Cb 0.23 0.22 -0.04 0.00 -0.51 0.00 0.00 29.16 29.06 1g1f h TRP 100 CO -0.04 -0.33 0.52 0.93 -1.03 0.00 0.00 178.44 178.49 1g1f h GLU 101 N -1.00 1.14 -0.00 2.65 5.08 -0.99 -2.08 114.58 119.37 1g1f h GLU 101 Ca -0.07 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1g1f h GLU 101 Cb 0.62 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1g1f h GLU 101 CO 0.12 0.79 -0.02 1.04 -1.00 0.00 0.00 179.01 179.94 1g1f n GLN 102 N -4.38 1.11 -2.88 2.33 1.13 0.06 -4.93 117.38 109.83 1g1f n GLN 102 Ca 0.09 -0.30 -0.21 0.00 -1.94 0.00 0.00 57.00 54.64 1g1f n GLN 102 Cb 0.06 -1.49 0.01 0.00 0.11 0.00 0.00 30.24 28.93 1g1f n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1g1f n LYS 103 N -0.68 -3.61 -2.16 -1.09 5.02 -0.78 -3.99 118.16 110.87 1g1f n LYS 103 Ca 0.21 0.81 -0.40 0.00 -2.02 0.00 0.00 58.31 56.91 1g1f n LYS 103 Cb 0.21 -5.58 -0.02 0.00 -0.02 0.00 0.00 35.03 29.62 1g1f n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1g1f s SER 104 N -2.48 6.77 -0.02 4.39 0.01 -0.73 -0.99 113.70 120.65 1g1f s SER 104 Ca 0.22 2.63 0.15 0.00 1.31 0.00 0.00 55.95 60.25 1g1f s SER 104 Cb -0.10 -2.64 -0.22 0.00 0.21 0.00 0.00 66.02 63.26 1g1f s SER 104 CO 0.27 -0.53 0.36 -1.14 0.41 0.00 0.00 173.24 172.61 1g1f n ARG 105 N 0.74 0.69 -4.17 12.44 0.00 -1.26 -4.87 116.66 120.24 1g1f n ARG 105 Ca 0.00 -0.12 -0.16 0.00 -0.00 0.00 0.00 57.85 57.58 1g1f n ARG 105 Cb 0.42 -1.33 -0.13 0.00 0.00 0.00 0.00 32.46 31.43 1g1f n ARG 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1g1f s GLY 106 N -3.52 0.57 -0.11 5.14 0.00 -1.26 -1.22 107.32 106.92 1g1f s GLY 106 Ca -0.04 -0.71 0.01 0.00 0.00 0.00 0.00 44.72 43.98 1g1f s GLY 106 CO 0.61 -0.72 -0.11 0.14 0.00 0.00 0.00 173.10 173.02 1g1f s VAL 107 N -0.99 1.24 -0.30 1.40 1.01 -0.27 -1.98 120.40 120.51 1g1f s VAL 107 Ca -0.04 -0.46 -0.08 0.00 0.00 0.00 0.00 61.98 61.41 1g1f s VAL 107 Cb -0.08 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.12 1g1f s VAL 107 CO 0.01 0.40 0.10 -0.69 0.00 0.00 0.00 175.10 174.91 1g1f s VAL 108 N 1.31 4.15 -0.23 2.92 1.01 0.16 -0.58 120.40 129.15 1g1f s VAL 108 Ca -0.01 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.30 1g1f s VAL 108 Cb -0.14 -3.13 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 1g1f s VAL 108 CO -0.05 0.08 0.02 -0.32 0.00 0.00 0.00 175.10 174.84 1g1f s MET 109 N 1.53 3.58 0.00 2.72 0.00 0.29 -1.01 119.30 126.41 1g1f s MET 109 Ca 0.03 -0.52 0.14 0.00 0.00 0.00 0.00 55.69 55.34 1g1f s MET 109 Cb -0.17 -3.19 0.34 0.00 0.00 0.00 0.00 34.83 31.81 1g1f s MET 109 CO 0.04 -0.14 1.26 1.28 0.00 0.00 0.00 175.02 177.45 1g1f n LEU 110 N 4.72 3.01 0.00 4.11 4.77 -0.41 -0.49 117.00 132.69 1g1f n LEU 110 Ca -0.17 -1.80 -0.24 0.00 -0.03 0.00 0.00 56.01 53.77 1g1f n LEU 110 Cb 0.51 -0.24 -0.06 0.00 -2.33 0.00 0.00 43.42 41.30 1g1f n LEU 110 CO 0.31 0.72 -0.16 -0.46 -1.33 0.00 0.00 177.39 176.46 1g1f n ASN 111 N 0.82 1.75 -4.46 -1.43 2.04 -1.25 -4.55 115.26 108.17 1g1f n ASN 111 Ca 0.14 -2.95 -0.26 0.00 -0.44 0.00 0.00 54.58 51.06 1g1f n ASN 111 Cb 0.46 0.76 -0.11 0.00 -2.53 0.00 0.00 39.78 38.36 1g1f n ASN 111 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1g1f s ARG 112 N -3.45 1.67 0.34 -3.83 0.52 -1.26 -4.80 118.95 108.13 1g1f s ARG 112 Ca 0.14 -1.50 0.04 0.00 -0.52 0.00 0.00 55.73 53.88 1g1f s ARG 112 Cb 0.01 -1.91 0.65 0.00 0.52 0.00 0.00 34.95 34.22 1g1f s ARG 112 CO 0.10 0.40 1.94 0.28 0.02 0.00 0.00 175.30 178.03 1g1f h VAL 113 N 2.97 1.04 -3.28 3.52 2.07 -1.94 -3.40 116.25 117.24 1g1f h VAL 113 Ca -0.46 -0.30 -0.51 0.00 0.82 0.00 0.00 66.70 66.25 1g1f h VAL 113 Cb 1.21 0.09 -0.38 0.00 -1.52 0.00 0.00 31.29 30.69 1g1f h VAL 113 CO 0.51 0.16 -0.78 -0.32 0.02 0.00 0.00 177.57 177.16 1g1f s MET 114 N -5.77 1.02 -0.22 1.57 -2.45 -1.26 -1.77 119.30 110.42 1g1f s MET 114 Ca -0.10 -0.29 0.02 0.00 -1.25 0.00 0.00 55.69 54.06 1g1f s MET 114 Cb 0.19 -1.71 0.04 0.00 1.25 0.00 0.00 34.83 34.61 1g1f s MET 114 CO 0.78 -0.43 -0.15 -1.21 1.05 0.00 0.00 175.02 175.06 1g1f s GLU 115 N 1.79 2.52 -1.45 4.11 2.02 -0.90 -4.73 118.70 122.06 1g1f s GLU 115 Ca 0.02 -1.05 -0.02 0.00 0.02 0.00 0.00 54.97 53.95 1g1f s GLU 115 Cb -0.15 -2.67 0.00 0.00 0.10 0.00 0.00 34.13 31.41 1g1f s GLU 115 CO -0.07 -0.39 0.22 0.36 0.02 0.00 0.00 175.26 175.39 1g1f n LYS 116 N 4.55 -2.59 -0.95 1.61 2.85 -1.26 -3.01 118.16 119.36 1g1f n LYS 116 Ca -0.17 0.83 0.00 0.00 -1.05 0.00 0.00 58.31 57.92 1g1f n LYS 116 Cb 0.46 -5.36 0.00 0.00 -0.65 0.00 0.00 35.03 29.48 1g1f n LYS 116 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1g1f n GLY 117 N -1.18 0.49 2.96 2.58 0.00 -1.26 -5.07 105.19 103.71 1g1f n GLY 117 Ca -0.16 -0.92 -0.18 0.00 0.00 0.00 0.00 46.02 44.76 1g1f n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1g1f s SER 118 N -2.85 0.83 -0.35 1.61 0.15 -1.16 -5.11 113.70 106.81 1g1f s SER 118 Ca 0.00 -0.12 -0.29 0.00 0.70 0.00 0.00 55.95 56.24 1g1f s SER 118 Cb 0.00 -0.17 -0.01 0.00 -1.71 0.00 0.00 66.02 64.13 1g1f s SER 118 CO 0.00 0.05 1.58 -0.76 1.20 0.00 0.00 173.24 175.31 1g1f s LEU 119 N 0.10 3.61 -0.01 3.45 1.43 -1.26 -2.12 118.68 123.87 1g1f s LEU 119 Ca -0.01 1.13 0.16 0.00 -1.03 0.00 0.00 54.13 54.39 1g1f s LEU 119 Cb -0.06 -3.53 -0.22 0.00 0.03 0.00 0.00 46.19 42.41 1g1f s LEU 119 CO -0.00 -1.49 0.51 0.29 0.23 0.00 0.00 176.35 175.88 1g1f n LYS 120 N 8.12 1.04 -3.53 1.70 4.76 -0.73 -5.01 118.16 124.51 1g1f n LYS 120 Ca 0.19 -0.08 -0.17 0.00 -2.87 0.00 0.00 58.31 55.38 1g1f n LYS 120 Cb 0.47 -1.33 -0.06 0.00 -1.84 0.00 0.00 35.03 32.27 1g1f n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1g1f s ALA 122 N -1.07 3.30 -1.18 0.00 0.00 -0.79 -4.64 121.76 117.38 1g1f s ALA 122 Ca -0.09 -0.25 -0.19 0.00 0.00 0.00 0.00 51.96 51.42 1g1f s ALA 122 Cb -0.00 -2.76 0.07 0.00 0.00 0.00 0.00 23.12 20.42 1g1f s ALA 122 CO 0.09 -0.24 1.60 -1.14 0.00 0.00 0.00 175.76 176.06 1g1f s GLN 123 N -4.36 3.84 0.00 0.00 2.00 -1.26 -4.78 119.66 115.10 1g1f s GLN 123 Ca 0.51 -1.73 0.28 0.00 -2.00 0.00 0.00 55.36 52.42 1g1f s GLN 123 Cb -0.10 -5.43 1.01 0.00 0.80 0.00 0.00 33.01 29.29 1g1f s GLN 123 CO 0.39 -2.19 1.75 2.48 -0.50 0.00 0.00 175.29 177.21 1g1f n TYR 124 N 8.33 0.00 -4.33 1.67 0.18 -1.26 -4.89 117.16 116.86 1g1f n TYR 124 Ca 0.42 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.96 1g1f n TYR 124 Cb 0.48 -0.32 -0.12 0.00 -0.38 0.00 0.00 39.34 39.00 1g1f n TYR 124 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 1g1f s TRP 125 N -2.82 1.91 0.19 -3.48 -2.14 -1.26 -5.08 118.94 106.25 1g1f s TRP 125 Ca 0.18 -0.43 -0.30 0.00 2.66 0.00 0.00 56.10 58.21 1g1f s TRP 125 Cb 0.19 -0.99 -0.08 0.00 -3.10 0.00 0.00 33.47 29.49 1g1f s TRP 125 CO 0.56 0.30 1.15 -1.25 -2.66 0.00 0.00 176.95 175.05 1g1f s PRO 126 N -2.38 4.55 0.11 3.25 0.04 -1.26 -4.95 135.00 134.35 1g1f s PRO 126 Ca 0.13 1.80 0.13 0.00 0.04 0.00 0.00 61.00 63.09 1g1f s PRO 126 Cb -0.08 -3.25 -0.13 0.00 0.04 0.00 0.00 34.50 31.08 1g1f s PRO 126 CO 0.06 0.01 1.05 1.96 0.04 0.00 0.00 177.00 180.11 1g1f h GLN 127 N 5.08 0.00 -6.04 4.56 4.20 -1.99 -3.44 115.11 117.49 1g1f h GLN 127 Ca -0.45 0.00 -0.65 0.00 0.06 0.00 0.00 58.65 57.62 1g1f h GLN 127 Cb 1.21 0.00 -0.31 0.00 0.30 0.00 0.00 27.48 28.69 1g1f h GLN 127 CO 0.73 0.55 -0.87 0.15 -0.67 0.00 0.00 178.83 178.72 1g1f s LYS 128 N -2.81 2.06 0.46 1.46 1.02 -1.26 -5.05 119.74 115.63 1g1f s LYS 128 Ca -0.01 -0.81 0.16 0.00 0.02 0.00 0.00 55.97 55.33 1g1f s LYS 128 Cb 0.09 -1.88 1.08 0.00 -0.52 0.00 0.00 37.83 36.60 1g1f s LYS 128 CO 0.80 0.42 2.01 1.05 -0.92 0.00 0.00 175.35 178.71 1g1f h GLU 129 N 5.83 0.00 0.00 1.68 9.09 -1.89 -2.14 114.58 127.15 1g1f h GLU 129 Ca -0.37 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.04 1g1f h GLU 129 Cb 1.15 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.25 1g1f h GLU 129 CO 0.47 0.17 -0.02 0.39 0.05 0.00 0.00 179.01 180.08 1g1f n GLU 130 N -4.23 0.01 -3.57 1.06 4.71 -1.26 -4.30 120.64 113.05 1g1f n GLU 130 Ca -0.02 0.01 -0.31 0.00 -0.01 0.00 0.00 57.16 56.82 1g1f n GLU 130 Cb 0.24 -1.51 -0.08 0.00 -1.01 0.00 0.00 31.44 29.08 1g1f n GLU 130 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1g1f n LYS 131 N -1.53 2.57 -1.42 3.49 4.76 -0.80 -5.09 118.16 120.13 1g1f n LYS 131 Ca 0.07 -4.57 -0.31 0.00 -2.87 0.00 0.00 58.31 50.64 1g1f n LYS 131 Cb 0.34 -2.33 0.08 0.00 -1.84 0.00 0.00 35.03 31.28 1g1f n LYS 131 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1g1f s GLU 132 N -1.96 2.40 -0.14 1.97 8.01 -1.26 -4.63 118.70 123.10 1g1f s GLU 132 Ca 0.32 0.97 -0.01 0.00 0.01 0.00 0.00 54.97 56.26 1g1f s GLU 132 Cb 0.03 -1.93 -0.02 0.00 -4.31 0.00 0.00 34.13 27.90 1g1f s GLU 132 CO -0.07 -1.48 -0.10 -1.64 0.01 0.00 0.00 175.26 171.97 1g1f s MET 133 N -5.00 3.47 -0.18 1.61 -1.94 -0.18 -4.98 119.30 112.10 1g1f s MET 133 Ca 0.60 -0.64 -0.02 0.00 -1.71 0.00 0.00 55.69 53.92 1g1f s MET 133 Cb -0.16 -2.72 -0.01 0.00 2.01 0.00 0.00 34.83 33.95 1g1f s MET 133 CO 0.55 0.22 -0.08 0.42 -0.01 0.00 0.00 175.02 176.12 1g1f s ILE 134 N 0.37 3.21 -0.79 2.53 1.01 -1.26 -0.55 121.20 125.71 1g1f s ILE 134 Ca -0.09 -0.57 -0.12 0.00 0.00 0.00 0.00 60.65 59.87 1g1f s ILE 134 Cb -0.15 -2.41 0.21 0.00 0.01 0.00 0.00 42.46 40.11 1g1f s ILE 134 CO 0.05 0.47 0.71 -0.36 0.00 0.00 0.00 174.94 175.81 1g1f s PHE 135 N 1.02 3.70 0.49 3.97 0.40 -0.01 -4.93 117.98 122.61 1g1f s PHE 135 Ca -0.00 -2.13 0.20 0.00 -0.60 0.00 0.00 56.93 54.40 1g1f s PHE 135 Cb -0.15 -3.71 1.23 0.00 0.51 0.00 0.00 43.02 40.91 1g1f s PHE 135 CO -0.01 -0.96 1.99 0.93 0.70 0.00 0.00 175.22 177.87 1g1f h GLU 136 N 7.64 0.17 -0.42 0.44 5.08 -1.97 -0.61 114.58 124.92 1g1f h GLU 136 Ca 0.09 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 1g1f h GLU 136 Cb 1.02 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 1g1f h GLU 136 CO 0.75 0.11 -0.03 0.38 -1.00 0.00 0.00 179.01 179.22 1g1f h ASP 137 N 0.18 0.66 -0.01 1.42 -0.00 -1.96 -3.24 116.42 113.46 1g1f h ASP 137 Ca 0.26 -0.16 0.00 0.00 -0.00 0.00 0.00 57.03 57.14 1g1f h ASP 137 Cb 0.79 -0.17 0.00 0.00 -0.00 0.00 0.00 39.33 39.95 1g1f h ASP 137 CO -0.04 0.75 -0.09 0.35 -0.00 0.00 0.00 179.24 180.21 1g1f n THR 138 N -4.22 0.00 -3.45 1.15 -2.24 -1.07 -5.03 114.28 99.43 1g1f n THR 138 Ca 0.02 -0.46 -0.18 0.00 -2.27 0.00 0.00 64.05 61.17 1g1f n THR 138 Cb 0.30 1.15 0.09 0.00 -2.10 0.00 0.00 70.33 69.76 1g1f n THR 138 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1g1f n ASN 139 N 0.13 -2.31 -4.34 3.42 4.05 -0.26 -4.94 115.26 111.01 1g1f n ASN 139 Ca 0.05 -0.62 -0.29 0.00 0.45 0.00 0.00 54.58 54.17 1g1f n ASN 139 Cb 0.21 -5.10 -0.14 0.00 1.23 0.00 0.00 39.78 35.98 1g1f n ASN 139 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1g1f s LEU 140 N -6.43 2.21 -0.07 1.20 1.43 -1.06 -1.61 118.68 114.35 1g1f s LEU 140 Ca 0.04 -0.63 0.04 0.00 -1.03 0.00 0.00 54.13 52.56 1g1f s LEU 140 Cb -0.02 -1.20 -0.00 0.00 0.03 0.00 0.00 46.19 45.00 1g1f s LEU 140 CO 0.73 0.21 -0.21 -0.75 0.23 0.00 0.00 176.35 176.56 1g1f s LYS 141 N -1.47 2.42 -0.09 1.70 2.20 -0.08 -0.83 119.74 123.59 1g1f s LYS 141 Ca 0.11 -0.76 0.02 0.00 -0.36 0.00 0.00 55.97 54.98 1g1f s LYS 141 Cb -0.10 -1.96 0.02 0.00 -1.51 0.00 0.00 37.83 34.27 1g1f s LYS 141 CO 0.03 0.24 -0.13 -1.17 -0.36 0.00 0.00 175.35 173.96 1g1f s LEU 142 N 0.16 1.61 -0.02 5.43 2.96 0.28 -0.44 118.68 128.65 1g1f s LEU 142 Ca -0.10 -0.36 0.05 0.00 -0.22 0.00 0.00 54.13 53.50 1g1f s LEU 142 Cb -0.15 -0.95 -0.01 0.00 0.50 0.00 0.00 46.19 45.58 1g1f s LEU 142 CO 0.05 0.00 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.02 1g1f s THR 143 N 0.97 1.39 -0.22 3.68 2.01 -0.55 -1.00 115.64 121.90 1g1f s THR 143 Ca -0.08 -0.73 -0.27 0.00 0.31 0.00 0.00 61.69 60.92 1g1f s THR 143 Cb -0.15 -1.17 0.00 0.00 0.01 0.00 0.00 72.50 71.20 1g1f s THR 143 CO -0.00 0.40 0.95 -0.22 -0.69 0.00 0.00 174.62 175.06 1g1f s LEU 144 N -0.24 4.10 -0.18 4.42 2.96 -1.26 -0.99 118.68 127.49 1g1f s LEU 144 Ca 0.03 1.26 -0.18 0.00 -0.22 0.00 0.00 54.13 55.01 1g1f s LEU 144 Cb -0.08 -3.40 -0.21 0.00 0.50 0.00 0.00 46.19 42.99 1g1f s LEU 144 CO 0.00 -0.59 0.27 0.40 -1.32 0.00 0.00 176.35 175.12 1g1f h ILE 145 N 5.41 0.87 -2.36 6.68 1.08 -1.26 -3.40 117.51 124.52 1g1f h ILE 145 Ca -0.22 -2.23 0.14 0.00 -0.39 0.00 0.00 64.86 62.16 1g1f h ILE 145 Cb 1.08 2.32 -0.11 0.00 -3.07 0.00 0.00 36.82 37.04 1g1f h ILE 145 CO 0.93 0.47 0.47 -0.94 -0.69 0.00 0.00 178.15 178.38 1g1f s SER 146 N -6.90 -0.27 -0.09 1.72 1.04 -1.13 -5.00 113.70 103.06 1g1f s SER 146 Ca -0.27 -0.23 -0.07 0.00 0.48 0.00 0.00 55.95 55.86 1g1f s SER 146 Cb 0.06 0.46 0.03 0.00 0.10 0.00 0.00 66.02 66.66 1g1f s SER 146 CO 0.64 -0.81 0.23 -1.83 0.98 0.00 0.00 173.24 172.46 1g1f s GLU 147 N -3.26 0.25 -0.39 4.02 -1.05 -1.26 -0.90 118.70 116.11 1g1f s GLU 147 Ca 0.09 0.36 -0.01 0.00 -0.15 0.00 0.00 54.97 55.26 1g1f s GLU 147 Cb -0.01 0.07 0.11 0.00 -0.44 0.00 0.00 34.13 33.85 1g1f s GLU 147 CO -0.03 -0.06 0.16 0.34 0.95 0.00 0.00 175.26 176.62 1g1f s ASP 148 N 0.39 5.12 -0.17 0.83 2.15 0.15 -5.00 116.67 120.14 1g1f s ASP 148 Ca -0.02 -2.05 -0.22 0.00 0.43 0.00 0.00 52.55 50.69 1g1f s ASP 148 Cb -0.04 -1.78 -0.03 0.00 -0.30 0.00 0.00 42.92 40.78 1g1f s ASP 148 CO -0.02 -0.50 0.66 -0.63 -0.17 0.00 0.00 175.17 174.52 1g1f s ILE 149 N 1.08 5.01 0.51 4.11 1.01 -1.26 -1.78 121.20 129.89 1g1f s ILE 149 Ca 0.09 1.29 0.04 0.00 0.00 0.00 0.00 60.65 62.06 1g1f s ILE 149 Cb -0.22 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.27 1g1f s ILE 149 CO -0.05 0.14 0.18 -0.54 0.00 0.00 0.00 174.94 174.67 1g1f s LYS 150 N 1.67 2.22 0.25 2.79 -0.14 -0.10 -5.02 119.74 121.41 1g1f s LYS 150 Ca 0.32 -2.19 -0.06 0.00 -1.36 0.00 0.00 55.97 52.68 1g1f s LYS 150 Cb -0.16 -1.80 0.26 0.00 -1.68 0.00 0.00 37.83 34.45 1g1f s LYS 150 CO 0.12 -0.44 1.92 0.66 -0.76 0.00 0.00 175.35 176.85 1g1f h SER 151 N 1.12 1.13 0.00 2.83 4.64 -1.42 -3.32 113.55 118.54 1g1f h SER 151 Ca -0.41 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1g1f h SER 151 Cb 1.30 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1g1f h SER 151 CO 0.67 0.84 0.00 0.00 -0.87 0.00 0.00 176.83 177.47 1g1f n TYR 152 N -4.37 0.00 -3.78 4.77 0.18 -1.26 -4.98 117.16 107.72 1g1f n TYR 152 Ca 0.11 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.80 1g1f n TYR 152 Cb 0.03 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.93 1g1f n TYR 152 CO 0.00 0.00 0.00 1.52 -2.08 0.00 0.00 176.86 176.30 1g1f s TYR 153 N -0.44 0.03 -0.02 -3.48 -0.85 -1.25 -1.21 117.35 110.12 1g1f s TYR 153 Ca 0.00 -0.40 0.02 0.00 -0.52 0.00 0.00 57.07 56.16 1g1f s TYR 153 Cb 0.00 0.05 0.01 0.00 0.38 0.00 0.00 41.96 42.40 1g1f s TYR 153 CO 0.00 -0.59 -0.06 0.99 -1.52 0.00 0.00 175.55 174.38 1g1f s THR 154 N -3.76 0.51 -0.19 -3.49 2.01 -0.07 -0.93 115.64 109.73 1g1f s THR 154 Ca 0.04 -0.20 -0.03 0.00 0.31 0.00 0.00 61.69 61.80 1g1f s THR 154 Cb 0.04 -0.48 -0.01 0.00 0.01 0.00 0.00 72.50 72.05 1g1f s THR 154 CO -0.11 0.18 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.24 1g1f s VAL 155 N 0.32 3.33 -0.00 3.82 1.01 -0.73 -0.65 120.40 127.50 1g1f s VAL 155 Ca -0.04 -0.53 0.07 0.00 0.00 0.00 0.00 61.98 61.48 1g1f s VAL 155 Cb -0.08 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 1g1f s VAL 155 CO -0.00 0.46 -0.21 -0.13 0.00 0.00 0.00 175.10 175.22 1g1f s ARG 156 N 1.05 2.14 -0.29 2.72 0.52 0.19 -0.68 118.95 124.60 1g1f s ARG 156 Ca 0.00 -0.92 -0.09 0.00 -0.52 0.00 0.00 55.73 54.20 1g1f s ARG 156 Cb -0.15 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.16 1g1f s ARG 156 CO -0.01 0.56 0.14 -1.14 0.02 0.00 0.00 175.30 174.88 1g1f s GLN 157 N -0.95 3.50 0.15 3.54 0.74 -0.08 -0.40 119.66 126.15 1g1f s GLN 157 Ca 0.12 -0.61 0.10 0.00 0.05 0.00 0.00 55.36 55.02 1g1f s GLN 157 Cb -0.10 -3.53 -0.04 0.00 1.10 0.00 0.00 33.01 30.44 1g1f s GLN 157 CO 0.01 -0.33 -0.21 -0.51 -0.55 0.00 0.00 175.29 173.70 1g1f s LEU 158 N 1.64 2.56 -0.21 3.68 1.43 0.46 -0.70 118.68 127.54 1g1f s LEU 158 Ca 0.05 -0.69 -0.02 0.00 -1.03 0.00 0.00 54.13 52.44 1g1f s LEU 158 Cb -0.16 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.68 1g1f s LEU 158 CO 0.06 0.16 -0.08 -0.70 0.23 0.00 0.00 176.35 176.02 1g1f s GLU 159 N -2.32 3.22 -0.20 1.70 2.12 -0.16 -0.65 118.70 122.41 1g1f s GLU 159 Ca 0.18 -0.72 -0.06 0.00 0.36 0.00 0.00 54.97 54.74 1g1f s GLU 159 Cb -0.10 -2.90 -0.03 0.00 0.26 0.00 0.00 34.13 31.37 1g1f s GLU 159 CO 0.09 -0.22 0.02 -1.17 -0.54 0.00 0.00 175.26 173.44 1g1f s LEU 160 N 1.41 3.40 -0.05 2.70 2.96 0.01 -1.48 118.68 127.64 1g1f s LEU 160 Ca 0.05 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 1g1f s LEU 160 Cb -0.14 -1.86 -0.00 0.00 0.50 0.00 0.00 46.19 44.68 1g1f s LEU 160 CO -0.06 0.09 -0.18 -0.70 -1.32 0.00 0.00 176.35 174.18 1g1f s GLU 161 N 0.86 1.96 -0.33 1.98 2.12 0.42 -1.29 118.70 124.42 1g1f s GLU 161 Ca 0.02 -0.65 -0.22 0.00 0.36 0.00 0.00 54.97 54.48 1g1f s GLU 161 Cb -0.14 -1.67 -0.00 0.00 0.26 0.00 0.00 34.13 32.58 1g1f s GLU 161 CO 0.02 0.24 0.72 1.21 -0.54 0.00 0.00 175.26 176.91 1g1f s ASN 162 N 0.08 6.55 0.28 -1.70 3.84 -0.82 -0.90 114.94 122.27 1g1f s ASN 162 Ca -0.06 0.45 0.25 0.00 0.21 0.00 0.00 52.86 53.71 1g1f s ASN 162 Cb -0.13 -2.37 0.96 0.00 -0.55 0.00 0.00 41.25 39.16 1g1f s ASN 162 CO 0.03 -0.60 1.75 -0.07 -2.79 0.00 0.00 177.10 175.42 1g1f h LEU 163 N 9.41 0.00 0.19 3.21 3.38 -1.64 0.50 115.31 130.37 1g1f h LEU 163 Ca -0.25 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.42 1g1f h LEU 163 Cb 1.10 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.88 1g1f h LEU 163 CO 0.86 0.00 -1.36 0.74 0.09 0.00 0.00 178.44 178.77 1g1f h THR 164 N 0.00 1.22 0.00 0.22 2.02 -1.92 -3.38 112.91 111.07 1g1f h THR 164 Ca 0.00 -2.56 0.00 0.00 0.77 0.00 0.00 66.41 64.62 1g1f h THR 164 Cb 0.49 2.97 0.00 0.00 -1.74 0.00 0.00 68.15 69.87 1g1f h THR 164 CO 0.00 0.78 -1.69 0.35 0.37 0.00 0.00 175.52 175.33 1g1f n THR 165 N -3.84 0.00 -1.10 3.16 -2.24 -1.22 -5.00 114.28 104.05 1g1f n THR 165 Ca -0.19 -0.35 -0.03 0.00 -2.27 0.00 0.00 64.05 61.20 1g1f n THR 165 Cb 0.99 0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 69.49 1g1f n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1g1f n GLN 166 N -2.02 -0.74 -2.53 -0.78 6.02 0.16 -5.01 117.38 112.49 1g1f n GLN 166 Ca -0.02 0.44 -0.41 0.00 -0.01 0.00 0.00 57.00 57.00 1g1f n GLN 166 Cb 0.48 -4.16 -0.04 0.00 1.02 0.00 0.00 30.24 27.55 1g1f n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1g1f s GLU 167 N -1.57 4.61 -0.05 -1.09 2.12 -1.22 -4.86 118.70 116.64 1g1f s GLU 167 Ca 0.00 1.71 0.03 0.00 0.36 0.00 0.00 54.97 57.07 1g1f s GLU 167 Cb 0.00 -3.27 -0.03 0.00 0.26 0.00 0.00 34.13 31.09 1g1f s GLU 167 CO 0.00 0.11 -0.14 0.99 -0.54 0.00 0.00 175.26 175.69 1g1f s THR 168 N -0.36 3.11 0.01 -1.70 2.01 -1.26 -1.94 115.64 115.50 1g1f s THR 168 Ca 0.48 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.79 1g1f s THR 168 Cb -0.29 -2.22 -0.01 0.00 0.01 0.00 0.00 72.50 69.99 1g1f s THR 168 CO 0.35 0.59 -0.03 -0.13 -0.69 0.00 0.00 174.62 174.72 1g1f s ARG 169 N -0.72 0.22 -0.22 4.92 0.52 -0.42 -5.01 118.95 118.25 1g1f s ARG 169 Ca 0.11 -0.23 -0.17 0.00 -0.52 0.00 0.00 55.73 54.92 1g1f s ARG 169 Cb -0.11 -0.13 -0.03 0.00 0.52 0.00 0.00 34.95 35.20 1g1f s ARG 169 CO 0.01 0.03 0.47 -2.00 0.02 0.00 0.00 175.30 173.82 1g1f s GLU 170 N -0.43 4.15 -0.11 3.54 2.12 -1.26 -0.81 118.70 125.90 1g1f s GLU 170 Ca -0.03 0.30 0.02 0.00 0.36 0.00 0.00 54.97 55.61 1g1f s GLU 170 Cb -0.03 -3.58 -0.01 0.00 0.26 0.00 0.00 34.13 30.77 1g1f s GLU 170 CO -0.00 -0.16 -0.18 0.42 -0.54 0.00 0.00 175.26 174.80 1g1f s ILE 171 N 1.70 2.64 -0.17 -3.70 -1.09 0.18 -4.85 121.20 115.91 1g1f s ILE 171 Ca 0.21 -0.81 -0.11 0.00 -2.23 0.00 0.00 60.65 57.71 1g1f s ILE 171 Cb -0.15 -2.07 -0.05 0.00 -1.58 0.00 0.00 42.46 38.61 1g1f s ILE 171 CO 0.09 0.54 0.18 -0.76 -1.23 0.00 0.00 174.94 173.76 1g1f s LEU 172 N 0.30 4.25 -0.30 2.97 1.43 -0.36 -0.40 118.68 126.57 1g1f s LEU 172 Ca -0.13 0.35 -0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1g1f s LEU 172 Cb -0.17 -2.17 0.04 0.00 0.03 0.00 0.00 46.19 43.92 1g1f s LEU 172 CO 0.07 0.19 0.02 -2.28 0.23 0.00 0.00 176.35 174.58 1g1f s HIS 173 N 0.17 3.22 -0.47 0.29 2.46 0.46 -1.11 115.29 120.31 1g1f s HIS 173 Ca 0.11 -1.67 -0.15 0.00 0.47 0.00 0.00 55.06 53.83 1g1f s HIS 173 Cb -0.12 -2.14 0.08 0.00 -0.13 0.00 0.00 32.58 30.27 1g1f s HIS 173 CO 0.01 -0.76 0.39 -0.06 -2.47 0.00 0.00 174.74 171.85 1g1f s PHE 174 N 1.31 3.25 -0.36 3.88 0.40 0.26 -0.64 117.98 126.08 1g1f s PHE 174 Ca -0.03 -1.01 -0.09 0.00 -0.60 0.00 0.00 56.93 55.20 1g1f s PHE 174 Cb -0.19 -3.21 0.04 0.00 0.51 0.00 0.00 43.02 40.17 1g1f s PHE 174 CO -0.00 -0.82 0.16 -1.58 0.70 0.00 0.00 175.22 173.68 1g1f s HIS 175 N 1.62 3.26 -0.35 0.36 2.46 0.17 -0.54 115.29 122.27 1g1f s HIS 175 Ca 0.04 -1.23 -0.24 0.00 0.47 0.00 0.00 55.06 54.09 1g1f s HIS 175 Cb -0.25 -2.41 0.01 0.00 -0.13 0.00 0.00 32.58 29.80 1g1f s HIS 175 CO 0.06 -0.71 0.85 -0.47 -2.47 0.00 0.00 174.74 172.00 1g1f s TYR 176 N 1.47 3.12 -1.89 3.88 5.04 0.35 -0.89 117.35 128.43 1g1f s TYR 176 Ca 0.00 0.72 0.23 0.00 -2.44 0.00 0.00 57.07 55.58 1g1f s TYR 176 Cb -0.20 -3.47 0.17 0.00 0.35 0.00 0.00 41.96 38.82 1g1f s TYR 176 CO 0.04 -0.73 1.20 0.25 -1.34 0.00 0.00 175.55 174.97 1g1f n THR 177 N 5.81 0.00 -0.94 4.34 -2.24 -0.35 -3.92 114.28 116.97 1g1f n THR 177 Ca 0.05 -0.21 0.09 0.00 -2.27 0.00 0.00 64.05 61.71 1g1f n THR 177 Cb 0.48 1.02 0.16 0.00 -2.10 0.00 0.00 70.33 69.89 1g1f n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1g1f n THR 178 N -0.29 1.89 -3.35 4.28 -2.24 -1.22 -4.89 114.28 108.47 1g1f n THR 178 Ca 0.10 -2.04 -0.45 0.00 -2.27 0.00 0.00 64.05 59.39 1g1f n THR 178 Cb 0.43 -0.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.42 1g1f n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1g1f s TRP 179 N -2.67 3.22 0.73 4.78 -0.11 -1.26 -4.79 118.94 118.84 1g1f s TRP 179 Ca 0.32 -0.92 -0.11 0.00 1.22 0.00 0.00 56.10 56.61 1g1f s TRP 179 Cb 0.27 -3.29 0.03 0.00 -1.50 0.00 0.00 33.47 28.98 1g1f s TRP 179 CO 0.04 -0.86 1.08 -1.25 -4.62 0.00 0.00 176.95 171.35 1g1f s PRO 180 N 1.78 2.58 0.19 5.86 0.04 -1.26 -4.70 135.00 139.47 1g1f s PRO 180 Ca 0.05 1.10 -0.31 0.00 0.04 0.00 0.00 61.00 61.88 1g1f s PRO 180 Cb -0.24 -1.94 -0.10 0.00 0.04 0.00 0.00 34.50 32.26 1g1f s PRO 180 CO 0.07 -1.39 1.51 0.16 0.04 0.00 0.00 177.00 177.39 1g1f s ASP 181 N -3.49 6.63 -1.94 6.66 3.84 -1.26 -1.97 116.67 125.14 1g1f s ASP 181 Ca 0.60 2.61 0.00 0.00 -0.00 0.00 0.00 52.55 55.76 1g1f s ASP 181 Cb -0.16 -2.60 0.00 0.00 -1.38 0.00 0.00 42.92 38.78 1g1f s ASP 181 CO 0.54 -0.77 0.00 0.49 -0.00 0.00 0.00 175.17 175.43 1g1f n PHE 182 N 3.43 -0.55 -4.16 2.11 3.72 -1.26 -4.96 117.46 115.80 1g1f n PHE 182 Ca 0.11 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.41 1g1f n PHE 182 Cb 0.39 -3.71 -0.02 0.00 -0.94 0.00 0.00 39.48 35.21 1g1f n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1g1f n GLY 183 N -0.77 3.88 3.37 1.37 0.00 -0.83 -4.93 105.19 107.28 1g1f n GLY 183 Ca -0.23 -2.25 -0.19 0.00 0.00 0.00 0.00 46.02 43.35 1g1f n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1g1f s VAL 184 N -1.48 1.74 1.00 1.61 -7.23 -1.26 -4.83 120.40 109.95 1g1f s VAL 184 Ca 0.01 -2.20 -0.12 0.00 -1.81 0.00 0.00 61.98 57.86 1g1f s VAL 184 Cb -0.00 -2.15 0.19 0.00 0.56 0.00 0.00 36.38 34.98 1g1f s VAL 184 CO 0.01 -0.52 1.08 -2.84 -0.31 0.00 0.00 175.10 172.52 1g1f s PRO 185 N -3.66 0.41 0.26 4.82 0.02 -1.26 -4.63 135.00 130.97 1g1f s PRO 185 Ca 0.24 0.67 -0.03 0.00 0.02 0.00 0.00 61.00 61.90 1g1f s PRO 185 Cb 0.00 -1.72 0.36 0.00 0.02 0.00 0.00 34.50 33.16 1g1f s PRO 185 CO 0.08 -2.78 1.89 0.93 -0.33 0.00 0.00 177.00 176.80 1g1f h GLU 186 N -1.93 1.19 -2.96 5.54 3.07 -1.98 -3.46 114.58 114.05 1g1f h GLU 186 Ca -0.54 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.24 1g1f h GLU 186 Cb 1.32 -0.27 -0.12 0.00 -0.84 0.00 0.00 28.75 28.84 1g1f h GLU 186 CO 0.55 0.79 0.23 -1.54 -1.40 0.00 0.00 179.01 177.64 1g1f s SER 187 N -5.96 -0.53 0.42 1.42 1.04 -1.26 -5.03 113.70 103.80 1g1f s SER 187 Ca -0.13 -0.05 0.11 0.00 0.48 0.00 0.00 55.95 56.36 1g1f s SER 187 Cb 0.19 0.60 0.91 0.00 0.10 0.00 0.00 66.02 67.82 1g1f s SER 187 CO 0.82 -0.99 1.98 -0.65 0.98 0.00 0.00 173.24 175.38 1g1f h PRO 188 N 2.00 0.20 -0.60 4.02 0.11 -1.92 -2.75 132.00 133.06 1g1f h PRO 188 Ca -0.32 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 1g1f h PRO 188 Cb 1.30 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 1g1f h PRO 188 CO 0.36 0.28 0.27 0.00 -0.21 0.00 0.00 178.00 178.70 1g1f h ALA 189 N 1.74 0.78 -0.28 -0.75 0.00 -1.94 -0.04 119.26 118.77 1g1f h ALA 189 Ca 0.05 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1g1f h ALA 189 Cb 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1g1f h ALA 189 CO 0.01 0.37 -0.34 0.66 0.00 0.00 0.00 179.25 179.94 1g1f h SER 190 N 0.83 0.63 0.02 0.00 4.64 -1.75 -1.25 113.55 116.67 1g1f h SER 190 Ca 0.20 -0.26 -0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1g1f h SER 190 Cb 0.16 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1g1f h SER 190 CO -0.02 0.92 -0.01 0.15 -0.87 0.00 0.00 176.83 177.00 1g1f h PHE 191 N 0.51 -0.03 -0.33 4.77 3.57 -1.21 -2.95 116.94 121.28 1g1f h PHE 191 Ca 0.06 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 1g1f h PHE 191 Cb 0.84 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 1g1f h PHE 191 CO 0.04 0.43 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.45 1g1f h LEU 192 N -0.49 0.49 -0.86 0.59 3.38 -0.99 0.19 115.31 117.61 1g1f h LEU 192 Ca -0.00 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1g1f h LEU 192 Cb 0.47 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 1g1f h LEU 192 CO 0.00 0.58 0.33 -1.13 0.09 0.00 0.00 178.44 178.32 1g1f h ASN 193 N 0.49 1.07 -0.01 -0.43 -0.73 -1.26 -0.38 115.58 114.33 1g1f h ASN 193 Ca 0.10 -0.15 -0.01 0.00 1.87 0.00 0.00 56.30 58.11 1g1f h ASN 193 Cb 0.37 -0.28 -0.00 0.00 0.27 0.00 0.00 38.32 38.68 1g1f h ASN 193 CO 0.01 0.93 -0.02 0.15 -0.37 0.00 0.00 177.43 178.14 1g1f h PHE 194 N 1.14 0.04 -0.73 0.67 3.57 -1.27 -2.59 116.94 117.77 1g1f h PHE 194 Ca 0.27 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.81 1g1f h PHE 194 Cb 0.18 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 38.86 1g1f h PHE 194 CO 0.02 0.55 0.42 1.25 -2.23 0.00 0.00 178.31 178.32 1g1f h LEU 195 N -0.48 0.64 -1.04 0.59 5.85 -0.73 -1.78 115.31 118.35 1g1f h LEU 195 Ca 0.00 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1g1f h LEU 195 Cb 0.55 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 1g1f h LEU 195 CO 0.00 0.40 -0.12 -0.26 -0.34 0.00 0.00 178.44 178.13 1g1f h PHE 196 N 0.77 0.00 -0.19 1.25 -1.00 -1.10 -1.49 116.94 115.18 1g1f h PHE 196 Ca 0.33 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.93 1g1f h PHE 196 Cb 0.20 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.76 1g1f h PHE 196 CO -0.06 0.12 -0.59 -0.22 -1.61 0.00 0.00 178.31 175.94 1g1f h LYS 197 N 0.00 0.61 -0.38 1.51 1.63 -0.93 -0.35 116.57 118.66 1g1f h LYS 197 Ca -0.00 -0.41 -0.16 0.00 -0.85 0.00 0.00 60.65 59.23 1g1f h LYS 197 Cb 0.72 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.40 1g1f h LYS 197 CO 0.02 1.03 -0.40 0.28 -3.45 0.00 0.00 179.45 176.92 1g1f h VAL 198 N 0.46 1.27 -0.24 2.00 2.07 -0.97 -2.92 116.25 117.92 1g1f h VAL 198 Ca -0.00 -1.58 -0.03 0.00 0.82 0.00 0.00 66.70 65.91 1g1f h VAL 198 Cb 1.16 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 1g1f h VAL 198 CO 0.11 0.53 0.01 0.03 0.02 0.00 0.00 177.57 178.28 1g1f h ARG 199 N 0.76 0.41 0.00 1.57 3.08 -1.08 -3.16 114.38 115.96 1g1f h ARG 199 Ca 0.06 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1g1f h ARG 199 Cb 1.00 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.01 1g1f h ARG 199 CO 0.10 0.57 0.00 0.93 -1.07 0.00 0.00 179.97 180.50 1g1f h GLU 200 N 0.19 0.00 0.00 0.04 5.08 -1.08 -2.99 114.58 115.82 1g1f h GLU 200 Ca 0.07 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1g1f h GLU 200 Cb 0.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1g1f h GLU 200 CO 0.01 0.00 -0.21 0.66 -1.00 0.00 0.00 179.01 178.47 1g1f h SER 201 N 0.00 0.00 0.00 1.42 4.64 -1.47 -3.47 113.55 114.66 1g1f h SER 201 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1g1f h SER 201 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1g1f h SER 201 CO 0.00 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 176.78 1g1f n GLY 202 N 0.78 0.66 0.26 -0.77 0.00 -1.13 -4.96 105.19 100.02 1g1f n GLY 202 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1g1f n GLY 202 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1g1f h SER 203 N 0.00 0.00 -0.29 1.61 0.02 -1.80 -2.82 113.55 110.26 1g1f h SER 203 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1g1f h SER 203 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1g1f h SER 203 CO 0.00 0.14 0.00 0.18 -1.14 0.00 0.00 176.83 176.01 1g1f n LEU 204 N -3.62 2.64 -4.77 5.07 4.77 -1.26 -4.47 117.00 115.37 1g1f n LEU 204 Ca -0.02 -1.13 -0.41 0.00 -0.03 0.00 0.00 56.01 54.43 1g1f n LEU 204 Cb 0.27 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 1g1f n LEU 204 CO 0.31 0.56 0.93 -0.44 -1.33 0.00 0.00 177.39 177.42 1g1f s SER 205 N -1.51 6.90 0.00 -1.43 0.01 -1.07 -4.93 113.70 111.68 1g1f s SER 205 Ca 0.35 2.57 0.11 0.00 1.31 0.00 0.00 55.95 60.30 1g1f s SER 205 Cb 0.20 -2.64 0.53 0.00 0.21 0.00 0.00 66.02 64.32 1g1f s SER 205 CO 0.29 -0.43 1.29 -0.81 0.41 0.00 0.00 173.24 173.98 1g1f n PRO 206 N 0.95 0.10 0.23 12.44 -0.04 -1.26 -2.11 135.00 145.32 1g1f n PRO 206 Ca -0.00 0.23 0.12 0.00 -0.04 0.00 0.00 63.50 63.81 1g1f n PRO 206 Cb 0.43 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.78 1g1f n PRO 206 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1g1f h GLU 207 N 0.00 0.00 -6.12 0.54 3.07 -1.95 -3.44 114.58 106.68 1g1f h GLU 207 Ca 0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.33 1g1f h GLU 207 Cb 0.14 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.01 1g1f h GLU 207 CO 0.00 0.11 -0.33 -1.01 -1.40 0.00 0.00 179.01 176.39 1g1f s HIS 208 N -3.44 2.17 0.97 4.33 3.76 -0.90 -5.13 115.29 117.05 1g1f s HIS 208 Ca 0.03 -0.65 -0.15 0.00 -0.15 0.00 0.00 55.06 54.15 1g1f s HIS 208 Cb 0.08 -2.07 0.18 0.00 1.11 0.00 0.00 32.58 31.87 1g1f s HIS 208 CO 0.63 -0.35 1.19 0.20 -0.85 0.00 0.00 174.74 175.57 1g1f s GLY 209 N -4.23 1.64 0.44 -2.22 0.00 -0.16 -4.92 107.32 97.87 1g1f s GLY 209 Ca 0.44 -0.83 -0.25 0.00 0.00 0.00 0.00 44.72 44.08 1g1f s GLY 209 CO 0.26 -0.15 1.35 -4.14 0.00 0.00 0.00 173.10 170.42 1g1f s PRO 210 N -5.53 3.79 0.30 2.90 0.02 -1.26 -4.44 135.00 130.78 1g1f s PRO 210 Ca 0.68 2.25 -0.29 0.00 0.02 0.00 0.00 61.00 63.66 1g1f s PRO 210 Cb -0.10 -2.67 -0.10 0.00 0.02 0.00 0.00 34.50 31.65 1g1f s PRO 210 CO 0.53 -0.67 1.26 0.54 -0.33 0.00 0.00 177.00 178.33 1g1f s VAL 211 N -1.25 2.96 -0.25 3.83 0.11 -1.25 -4.51 120.40 120.04 1g1f s VAL 211 Ca 0.60 0.94 -0.19 0.00 -2.93 0.00 0.00 61.98 60.40 1g1f s VAL 211 Cb -0.40 -3.60 -0.03 0.00 -1.53 0.00 0.00 36.38 30.83 1g1f s VAL 211 CO 0.51 0.21 0.55 -0.69 -3.33 0.00 0.00 175.10 172.35 1g1f s VAL 212 N -0.94 5.05 -0.11 2.04 1.01 -0.84 -0.69 120.40 125.92 1g1f s VAL 212 Ca 0.49 0.97 0.03 0.00 0.00 0.00 0.00 61.98 63.47 1g1f s VAL 212 Cb -0.38 -3.86 -0.00 0.00 0.00 0.00 0.00 36.38 32.14 1g1f s VAL 212 CO 0.48 0.09 -0.22 -0.69 0.00 0.00 0.00 175.10 174.76 1g1f s VAL 213 N 2.23 2.25 0.15 2.92 1.01 0.64 0.37 120.40 129.98 1g1f s VAL 213 Ca 0.23 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 1g1f s VAL 213 Cb -0.16 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 1g1f s VAL 213 CO 0.09 0.55 0.26 -1.38 0.00 0.00 0.00 175.10 174.62 1g1f s HIS 214 N 0.37 0.37 0.00 5.22 -3.43 -0.18 -2.10 115.29 115.54 1g1f s HIS 214 Ca -0.17 -0.75 0.00 0.00 -0.80 0.00 0.00 55.06 53.35 1g1f s HIS 214 Cb -0.17 -0.07 0.00 0.00 -1.43 0.00 0.00 32.58 30.90 1g1f s HIS 214 CO 0.08 -0.68 0.00 0.00 -2.00 0.00 0.00 174.74 172.14 1g1f n ALA 215 N -0.18 0.00 -0.08 -1.38 0.00 -1.26 -1.29 120.51 116.32 1g1f n ALA 215 Ca -0.09 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.18 1g1f n ALA 215 Cb 0.63 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.95 1g1f n ALA 215 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1g1f h SER 216 N 0.00 0.02 0.18 0.00 0.87 -1.90 -2.66 113.55 110.05 1g1f h SER 216 Ca 0.00 -0.79 -0.17 0.00 -1.23 0.00 0.00 61.79 59.60 1g1f h SER 216 Cb 0.00 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 1g1f h SER 216 CO 0.00 1.23 -1.98 0.00 -0.53 0.00 0.00 176.83 175.55 1g1f n ALA 217 N -2.95 2.15 -2.40 6.23 0.00 -1.26 -0.65 120.51 121.63 1g1f n ALA 217 Ca -0.20 -0.81 -0.05 0.00 0.00 0.00 0.00 53.44 52.39 1g1f n ALA 217 Cb 0.58 -0.60 0.01 0.00 0.00 0.00 0.00 19.45 19.44 1g1f n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g1f n GLY 218 N 1.46 0.43 0.37 0.00 0.00 -1.24 -3.81 105.19 102.39 1g1f n GLY 218 Ca -0.15 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1g1f n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1g1f n ILE 219 N -3.50 0.00 0.02 -0.61 -5.35 -1.26 -4.44 119.36 104.22 1g1f n ILE 219 Ca -0.02 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.45 1g1f n ILE 219 Cb 0.52 -0.42 -0.00 0.00 -1.74 0.00 0.00 39.64 38.00 1g1f n ILE 219 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1g1f h GLY 220 N 0.00 -0.07 1.82 3.28 0.00 -1.91 -1.83 103.07 104.35 1g1f h GLY 220 Ca 0.00 0.02 -0.14 0.00 0.00 0.00 0.00 47.33 47.22 1g1f h GLY 220 CO 0.00 -0.02 -0.58 3.21 0.00 0.00 0.00 176.54 179.15 1g1f h ARG 221 N -0.14 0.19 -0.58 4.80 3.08 -1.94 -2.98 114.38 116.81 1g1f h ARG 221 Ca -0.01 -0.13 -0.11 0.00 0.07 0.00 0.00 59.98 59.81 1g1f h ARG 221 Cb 0.05 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1g1f h ARG 221 CO 0.01 0.71 -0.05 0.77 -1.07 0.00 0.00 179.97 180.34 1g1f h SER 222 N 0.14 1.05 -0.14 7.04 0.02 -1.87 -2.44 113.55 117.36 1g1f h SER 222 Ca -0.00 -0.33 -0.09 0.00 -0.84 0.00 0.00 61.79 60.54 1g1f h SER 222 Cb 1.06 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.30 1g1f h SER 222 CO 0.09 1.13 -0.18 1.23 -1.14 0.00 0.00 176.83 177.96 1g1f h GLY 223 N 0.96 0.59 0.92 -3.77 0.00 -1.31 -1.70 103.07 98.76 1g1f h GLY 223 Ca 0.16 -0.45 -0.06 0.00 0.00 0.00 0.00 47.33 46.98 1g1f h GLY 223 CO 0.04 0.41 -0.03 -0.84 0.00 0.00 0.00 176.54 176.12 1g1f h THR 224 N 0.49 1.27 0.10 4.70 2.02 -1.36 -1.04 112.91 119.08 1g1f h THR 224 Ca 0.08 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 1g1f h THR 224 Cb 0.59 1.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1g1f h THR 224 CO 0.04 0.34 -0.05 0.15 0.37 0.00 0.00 175.52 176.37 1g1f h PHE 225 N 0.43 -0.12 -0.29 3.16 3.57 -1.28 -2.50 116.94 119.91 1g1f h PHE 225 Ca 0.09 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.49 1g1f h PHE 225 Cb 0.50 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 1g1f h PHE 225 CO 0.04 0.06 -0.25 0.00 -2.23 0.00 0.00 178.31 175.93 1g1f h LEU 227 N 0.50 0.52 -0.55 0.00 5.85 -1.18 -0.69 115.31 119.77 1g1f h LEU 227 Ca 0.07 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.42 1g1f h LEU 227 Cb 0.70 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1g1f h LEU 227 CO 0.05 0.74 0.23 0.00 -0.34 0.00 0.00 178.44 179.12 1g1f h ALA 228 N 0.80 0.71 -0.27 1.25 0.00 -1.42 -1.10 119.26 119.23 1g1f h ALA 228 Ca 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1g1f h ALA 228 Cb 0.49 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1g1f h ALA 228 CO 0.02 0.31 0.08 0.22 0.00 0.00 0.00 179.25 179.88 1g1f h ASP 229 N 0.75 0.41 -0.48 0.00 3.58 -1.28 -2.53 116.42 116.87 1g1f h ASP 229 Ca 0.19 -0.22 -0.04 0.00 0.42 0.00 0.00 57.03 57.37 1g1f h ASP 229 Cb 0.18 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 1g1f h ASP 229 CO -0.02 0.52 0.13 0.74 -2.88 0.00 0.00 179.24 177.73 1g1f h THR 230 N 0.28 1.23 -0.05 2.25 2.02 -1.02 -2.19 112.91 115.42 1g1f h THR 230 Ca 0.09 -0.81 -0.05 0.00 0.77 0.00 0.00 66.41 66.40 1g1f h THR 230 Cb 0.26 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1g1f h THR 230 CO -0.00 0.29 -0.22 0.00 0.37 0.00 0.00 175.52 175.96 1g1f h LEU 232 N 0.08 0.22 -0.42 0.00 3.38 -1.26 -3.00 115.31 114.31 1g1f h LEU 232 Ca 0.01 -0.17 -0.16 0.00 0.09 0.00 0.00 57.88 57.65 1g1f h LEU 232 Cb 0.44 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1g1f h LEU 232 CO 0.03 0.97 -0.43 -0.07 0.09 0.00 0.00 178.44 179.03 1g1f h LEU 233 N 0.09 0.93 -0.80 1.67 3.38 -0.98 -3.24 115.31 116.37 1g1f h LEU 233 Ca -0.04 -0.44 -0.08 0.00 0.09 0.00 0.00 57.88 57.41 1g1f h LEU 233 Cb 1.48 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1g1f h LEU 233 CO 0.13 1.23 -0.01 -0.07 0.09 0.00 0.00 178.44 179.80 1g1f h LEU 234 N 0.70 0.87 -0.25 1.67 3.38 -1.36 -2.91 115.31 117.40 1g1f h LEU 234 Ca 0.05 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1g1f h LEU 234 Cb 1.01 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1g1f h LEU 234 CO 0.10 0.94 0.00 1.15 0.09 0.00 0.00 178.44 180.72 1g1f n MET 235 N -4.19 1.04 -0.07 1.13 0.00 -1.14 -2.73 117.12 111.15 1g1f n MET 235 Ca 0.03 -0.05 -0.09 0.00 0.00 0.00 0.00 57.70 57.59 1g1f n MET 235 Cb 0.33 -1.11 -0.09 0.00 0.00 0.00 0.00 33.22 32.34 1g1f n MET 235 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1g1f n ASP 236 N -0.36 2.28 -0.39 3.17 2.03 -1.10 -4.56 116.55 117.62 1g1f n ASP 236 Ca 0.00 -0.05 0.08 0.00 0.52 0.00 0.00 54.79 55.35 1g1f n ASP 236 Cb 0.06 0.25 -0.00 0.00 -0.72 0.00 0.00 41.12 40.72 1g1f n ASP 236 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1g1f n LYS 237 N -2.74 1.62 0.08 -0.67 2.85 -1.20 -4.55 118.16 113.54 1g1f n LYS 237 Ca -0.25 -0.85 0.13 0.00 -1.05 0.00 0.00 58.31 56.28 1g1f n LYS 237 Cb 0.86 -1.30 0.31 0.00 -0.65 0.00 0.00 35.03 34.25 1g1f n LYS 237 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1g1f n ARG 238 N -0.08 0.26 -0.81 -1.58 1.74 -1.11 -4.94 116.66 110.14 1g1f n ARG 238 Ca 0.07 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 1g1f n ARG 238 Cb 0.36 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 1g1f n ARG 238 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1g1f n LYS 239 N -2.14 -0.96 -3.39 5.56 4.76 -1.26 -4.84 118.16 115.90 1g1f n LYS 239 Ca 0.05 0.24 -0.20 0.00 -2.87 0.00 0.00 58.31 55.53 1g1f n LYS 239 Cb 0.43 -4.49 -0.09 0.00 -1.84 0.00 0.00 35.03 29.04 1g1f n LYS 239 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1g1f s ASP 240 N -2.06 1.66 0.30 4.39 -1.08 -1.26 -5.05 116.67 113.57 1g1f s ASP 240 Ca 0.00 -1.59 -0.01 0.00 -0.52 0.00 0.00 52.55 50.43 1g1f s ASP 240 Cb 0.00 0.34 0.46 0.00 -1.46 0.00 0.00 42.92 42.26 1g1f s ASP 240 CO 0.00 -0.29 1.93 -0.65 0.52 0.00 0.00 175.17 176.68 1g1f h PRO 241 N 7.24 0.96 0.00 4.34 0.11 -1.88 -3.12 132.00 139.64 1g1f h PRO 241 Ca 0.02 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1g1f h PRO 241 Cb 1.04 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1g1f h PRO 241 CO 0.24 0.70 0.00 -1.13 -0.21 0.00 0.00 178.00 177.60 1g1f n SER 242 N -4.37 0.00 -0.01 -2.05 3.41 -1.26 -3.25 113.62 106.09 1g1f n SER 242 Ca 0.07 0.21 0.15 0.00 -0.26 0.00 0.00 58.87 59.04 1g1f n SER 242 Cb 0.09 -0.36 0.82 0.00 -0.26 0.00 0.00 64.21 64.50 1g1f n SER 242 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1g1f n SER 243 N -1.36 0.02 -4.65 4.04 3.41 -1.18 -4.50 113.62 109.40 1g1f n SER 243 Ca 0.06 -0.44 -0.43 0.00 -0.26 0.00 0.00 58.87 57.80 1g1f n SER 243 Cb 0.14 -0.18 -0.02 0.00 -0.26 0.00 0.00 64.21 63.89 1g1f n SER 243 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1g1f s VAL 244 N -2.38 4.54 -0.40 -3.33 1.01 -1.20 -5.00 120.40 113.63 1g1f s VAL 244 Ca 0.35 1.81 -0.11 0.00 0.00 0.00 0.00 61.98 64.03 1g1f s VAL 244 Cb 0.21 -4.34 0.05 0.00 0.00 0.00 0.00 36.38 32.29 1g1f s VAL 244 CO 0.43 -0.35 0.25 -0.62 0.00 0.00 0.00 175.10 174.81 1g1f s ASP 245 N 1.57 5.78 0.23 3.32 3.68 -1.26 -4.54 116.67 125.44 1g1f s ASP 245 Ca 0.46 -1.19 -0.08 0.00 2.13 0.00 0.00 52.55 53.87 1g1f s ASP 245 Cb -0.14 -2.04 0.25 0.00 -1.45 0.00 0.00 42.92 39.54 1g1f s ASP 245 CO 0.12 -0.47 1.86 0.40 0.13 0.00 0.00 175.17 177.22 1g1f h ILE 246 N 5.91 1.11 -0.51 4.11 2.04 -1.99 -2.18 117.51 126.00 1g1f h ILE 246 Ca -0.25 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.21 1g1f h ILE 246 Cb 1.10 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1g1f h ILE 246 CO 0.73 0.18 0.08 0.11 0.00 0.00 0.00 178.15 179.24 1g1f h LYS 247 N 0.98 0.80 -0.15 2.37 1.57 -1.99 -1.56 116.57 118.59 1g1f h LYS 247 Ca 0.33 -0.18 -0.17 0.00 -1.87 0.00 0.00 60.65 58.75 1g1f h LYS 247 Cb 0.04 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 1g1f h LYS 247 CO -0.12 0.76 -0.63 -0.22 -0.57 0.00 0.00 179.45 178.67 1g1f h LYS 248 N 0.76 0.54 -0.28 3.15 3.64 -1.93 -2.23 116.57 120.23 1g1f h LYS 248 Ca 0.16 -0.38 -0.13 0.00 -1.27 0.00 0.00 60.65 59.03 1g1f h LYS 248 Cb 0.35 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1g1f h LYS 248 CO 0.01 1.00 -0.37 0.28 -2.27 0.00 0.00 179.45 178.10 1g1f h VAL 249 N 0.40 1.29 -0.27 2.00 2.07 -1.13 -1.82 116.25 118.79 1g1f h VAL 249 Ca -0.01 -1.52 -0.13 0.00 0.82 0.00 0.00 66.70 65.86 1g1f h VAL 249 Cb 1.19 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 1g1f h VAL 249 CO 0.12 0.48 -0.38 0.25 0.02 0.00 0.00 177.57 178.06 1g1f h LEU 250 N 0.52 0.65 -0.80 2.57 5.85 -1.21 -1.47 115.31 121.43 1g1f h LEU 250 Ca 0.05 -0.28 -0.13 0.00 0.84 0.00 0.00 57.88 58.36 1g1f h LEU 250 Cb 0.87 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1g1f h LEU 250 CO 0.08 0.96 -0.53 -0.07 -0.34 0.00 0.00 178.44 178.54 1g1f h LEU 251 N 0.51 0.21 -0.52 2.25 3.38 -1.25 -0.89 115.31 119.00 1g1f h LEU 251 Ca 0.05 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 1g1f h LEU 251 Cb 0.89 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1g1f h LEU 251 CO 0.08 0.70 -0.39 -0.08 0.09 0.00 0.00 178.44 178.83 1g1f h GLU 252 N 0.15 0.77 -0.42 1.13 4.57 -1.07 -2.90 114.58 116.81 1g1f h GLU 252 Ca 0.00 -0.40 -0.13 0.00 -1.18 0.00 0.00 59.36 57.65 1g1f h GLU 252 Cb 0.99 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.58 1g1f h GLU 252 CO 0.08 1.02 -0.26 0.52 -1.18 0.00 0.00 179.01 179.20 1g1f h MET 253 N 0.63 0.88 0.00 1.92 2.86 -1.04 -2.96 114.93 117.22 1g1f h MET 253 Ca 0.05 -0.39 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 1g1f h MET 253 Cb 0.95 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.58 1g1f h MET 253 CO 0.09 1.03 0.00 0.54 1.06 0.00 0.00 176.91 179.63 1g1f n ARG 254 N -4.10 0.41 0.16 1.72 1.74 -0.36 -1.61 116.66 114.63 1g1f n ARG 254 Ca -0.00 0.04 0.12 0.00 -0.77 0.00 0.00 57.85 57.24 1g1f n ARG 254 Cb 0.47 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.61 1g1f n ARG 254 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1g1f h LYS 255 N 0.00 0.00 0.00 5.56 1.57 -1.44 -3.35 116.57 118.91 1g1f h LYS 255 Ca 0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 1g1f h LYS 255 Cb 0.04 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 1g1f h LYS 255 CO 0.00 0.00 -2.09 1.19 -0.57 0.00 0.00 179.45 177.98 1g1f n PHE 256 N -2.77 0.00 -3.72 -1.35 3.01 -0.63 -4.96 117.46 107.04 1g1f n PHE 256 Ca 0.04 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.37 1g1f n PHE 256 Cb 0.50 -0.76 -0.10 0.00 -0.01 0.00 0.00 39.48 39.12 1g1f n PHE 256 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1g1f s ARG 257 N -2.52 0.47 0.67 -1.08 3.52 -1.19 -4.48 118.95 114.35 1g1f s ARG 257 Ca -0.08 0.67 -0.15 0.00 -0.13 0.00 0.00 55.73 56.04 1g1f s ARG 257 Cb 0.06 0.16 0.01 0.00 -1.56 0.00 0.00 34.95 33.62 1g1f s ARG 257 CO 0.69 -0.09 1.12 0.00 -0.81 0.00 0.00 175.30 176.20 1g1f s MET 258 N 0.61 2.71 -1.26 5.12 0.23 -1.26 -4.23 119.30 121.22 1g1f s MET 258 Ca -0.03 1.42 0.00 0.00 -1.03 0.00 0.00 55.69 56.05 1g1f s MET 258 Cb -0.05 -1.94 0.00 0.00 -1.53 0.00 0.00 34.83 31.32 1g1f s MET 258 CO -0.04 -1.33 0.00 0.41 -2.03 0.00 0.00 175.02 172.04 1g1f n GLY 259 N -0.45 0.04 3.65 3.16 0.00 -1.26 -4.89 105.19 105.44 1g1f n GLY 259 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1g1f n GLY 259 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g1f s LEU 260 N -5.13 4.18 0.00 0.99 1.43 -1.26 -4.04 118.68 114.85 1g1f s LEU 260 Ca 0.00 2.22 0.00 0.00 -1.03 0.00 0.00 54.13 55.32 1g1f s LEU 260 Cb 0.00 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1g1f s LEU 260 CO 0.00 -1.15 0.00 -0.38 0.23 0.00 0.00 176.35 175.05 1g1f n ILE 261 N 5.93 -1.82 0.24 -0.59 5.41 -0.76 -4.97 119.36 122.82 1g1f n ILE 261 Ca 0.20 0.00 0.11 0.00 1.00 0.00 0.00 62.75 64.06 1g1f n ILE 261 Cb 0.43 -2.59 -0.01 0.00 -0.71 0.00 0.00 39.64 36.75 1g1f n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1g1f n GLN 262 N 0.27 0.51 -4.31 0.38 1.13 -1.26 -4.91 117.38 109.19 1g1f n GLN 262 Ca 0.00 0.02 -0.16 0.00 -1.94 0.00 0.00 57.00 54.92 1g1f n GLN 262 Cb 0.00 -1.70 -0.10 0.00 0.11 0.00 0.00 30.24 28.55 1g1f n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1g1f s THR 263 N -3.33 0.94 0.30 5.09 -4.23 -1.26 -5.04 115.64 108.11 1g1f s THR 263 Ca -0.00 -2.02 0.14 0.00 -1.18 0.00 0.00 61.69 58.63 1g1f s THR 263 Cb 0.12 -2.33 0.08 0.00 1.34 0.00 0.00 72.50 71.72 1g1f s THR 263 CO 0.81 -0.33 1.76 0.00 -0.54 0.00 0.00 174.62 176.33 1g1f h ALA 264 N 2.50 1.18 -0.01 3.99 0.00 -1.94 -2.87 119.26 122.11 1g1f h ALA 264 Ca -0.38 -0.39 -0.17 0.00 0.00 0.00 0.00 54.91 53.98 1g1f h ALA 264 Cb 1.22 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1g1f h ALA 264 CO 0.64 0.53 -0.76 0.22 0.00 0.00 0.00 179.25 179.88 1g1f h ASP 265 N 0.00 0.13 0.38 0.00 3.58 -1.96 -2.09 116.42 116.46 1g1f h ASP 265 Ca -0.00 -0.10 -0.12 0.00 0.42 0.00 0.00 57.03 57.23 1g1f h ASP 265 Cb 0.81 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.80 1g1f h ASP 265 CO 0.06 0.84 -0.50 1.56 -2.88 0.00 0.00 179.24 178.31 1g1f h GLN 266 N 0.07 0.14 -0.13 0.28 4.20 -1.84 -0.01 115.11 117.82 1g1f h GLN 266 Ca -0.02 -0.08 -0.09 0.00 0.06 0.00 0.00 58.65 58.52 1g1f h GLN 266 Cb 1.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.12 1g1f h GLN 266 CO 0.11 0.61 -0.28 1.25 -0.67 0.00 0.00 178.83 179.84 1g1f h LEU 267 N 0.11 0.47 -0.92 1.46 5.85 -1.39 -2.18 115.31 118.71 1g1f h LEU 267 Ca 0.00 -0.57 0.00 0.00 0.84 0.00 0.00 57.88 58.15 1g1f h LEU 267 Cb 0.92 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 1g1f h LEU 267 CO 0.07 0.95 0.57 -0.09 -0.34 0.00 0.00 178.44 179.61 1g1f h ARG 268 N 0.01 1.23 -0.49 1.25 2.43 -1.23 -1.97 114.38 115.60 1g1f h ARG 268 Ca 0.00 -0.10 -0.09 0.00 -0.81 0.00 0.00 59.98 58.99 1g1f h ARG 268 Cb 0.88 -0.26 -0.02 0.00 -0.42 0.00 0.00 29.97 30.15 1g1f h ARG 268 CO 0.06 0.84 -0.04 0.35 -1.51 0.00 0.00 179.97 179.67 1g1f h PHE 269 N 1.25 0.92 -0.69 2.20 3.57 -0.97 -2.37 116.94 120.86 1g1f h PHE 269 Ca 0.33 -0.15 0.01 0.00 3.53 0.00 0.00 57.97 61.69 1g1f h PHE 269 Cb -0.09 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.37 1g1f h PHE 269 CO -0.00 0.87 0.45 0.77 -2.23 0.00 0.00 178.31 178.17 1g1f h SER 270 N 0.78 0.79 0.05 0.41 0.02 -0.70 0.51 113.55 115.41 1g1f h SER 270 Ca 0.14 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1g1f h SER 270 Cb 0.53 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1g1f h SER 270 CO 0.03 0.57 -0.02 1.88 -1.14 0.00 0.00 176.83 178.15 1g1f h TYR 271 N 0.93 -0.06 -0.99 3.45 -1.99 -1.10 -2.12 116.97 115.09 1g1f h TYR 271 Ca 0.25 -0.00 0.04 0.00 2.00 0.00 0.00 58.73 61.02 1g1f h TYR 271 Cb -0.11 0.02 -0.06 0.00 2.00 0.00 0.00 36.73 38.58 1g1f h TYR 271 CO 0.00 0.19 0.65 -0.07 -0.00 0.00 0.00 178.16 178.93 1g1f h LEU 272 N -0.30 1.07 -0.45 3.88 3.38 -0.93 -0.59 115.31 121.38 1g1f h LEU 272 Ca -0.01 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1g1f h LEU 272 Cb 0.27 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1g1f h LEU 272 CO 0.01 0.73 -0.13 0.00 0.09 0.00 0.00 178.44 179.14 1g1f h ALA 273 N 1.41 0.62 -0.21 1.53 0.00 -0.84 -2.09 119.26 119.67 1g1f h ALA 273 Ca 0.40 -0.34 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 1g1f h ALA 273 Cb 0.03 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1g1f h ALA 273 CO -0.13 0.53 -0.51 0.28 0.00 0.00 0.00 179.25 179.41 1g1f h VAL 274 N 0.71 1.31 -0.70 0.00 2.07 -1.00 -0.42 116.25 118.21 1g1f h VAL 274 Ca 0.11 -1.73 -0.03 0.00 0.82 0.00 0.00 66.70 65.87 1g1f h VAL 274 Cb 0.68 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.27 1g1f h VAL 274 CO 0.05 0.55 0.32 0.40 0.02 0.00 0.00 177.57 178.90 1g1f h ILE 275 N 0.43 1.24 -0.13 4.57 2.04 -1.10 0.09 117.51 124.65 1g1f h ILE 275 Ca -0.00 -0.70 -0.22 0.00 1.00 0.00 0.00 64.86 64.94 1g1f h ILE 275 Cb 1.13 0.39 0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1g1f h ILE 275 CO 0.11 0.29 -0.78 -0.08 0.00 0.00 0.00 178.15 177.69 1g1f h GLU 276 N 0.99 0.70 0.00 2.37 4.57 -1.40 -3.21 114.58 118.61 1g1f h GLU 276 Ca 0.24 -0.58 -0.07 0.00 -1.18 0.00 0.00 59.36 57.76 1g1f h GLU 276 Cb 0.15 0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 1g1f h GLU 276 CO -0.03 1.19 -0.36 0.78 -1.18 0.00 0.00 179.01 179.42 1g1f h GLY 277 N 0.73 0.00 1.51 1.92 0.00 -0.81 -3.08 103.07 103.34 1g1f h GLY 277 Ca -0.05 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.34 1g1f h GLY 277 CO 0.15 0.00 0.18 0.00 0.00 0.00 0.00 176.54 176.88 1g1f h ALA 278 N 1.64 2.07 -0.21 3.60 0.00 -0.98 -2.37 119.26 123.02 1g1f h ALA 278 Ca -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1g1f h ALA 278 Cb 0.73 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1g1f h ALA 278 CO 0.05 -0.30 -0.02 0.87 0.00 0.00 0.00 179.25 179.85 1g1f h LYS 279 N 0.00 0.31 0.16 0.00 1.57 -1.69 -1.25 116.57 115.66 1g1f h LYS 279 Ca 0.11 -0.05 -0.31 0.00 -1.87 0.00 0.00 60.65 58.53 1g1f h LYS 279 Cb 0.47 -0.05 0.03 0.00 0.08 0.00 0.00 32.23 32.75 1g1f h LYS 279 CO -0.00 0.36 -1.31 0.35 -0.57 0.00 0.00 179.45 178.28 1g1f h PHE 280 N 0.30 0.93 0.00 -1.35 3.57 -1.59 -2.93 116.94 115.86 1g1f h PHE 280 Ca 0.07 -0.62 -0.05 0.00 3.53 0.00 0.00 57.97 60.90 1g1f h PHE 280 Cb 0.25 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 1g1f h PHE 280 CO 0.00 1.47 -0.23 0.82 -2.23 0.00 0.00 178.31 178.15 1g1f h ILE 281 N 0.21 0.75 0.00 1.41 1.08 -1.46 -2.61 117.51 116.90 1g1f h ILE 281 Ca -0.20 -0.93 0.00 0.00 -0.39 0.00 0.00 64.86 63.34 1g1f h ILE 281 Cb 1.99 1.57 0.00 0.00 -3.07 0.00 0.00 36.82 37.31 1g1f h ILE 281 CO 0.24 0.22 0.00 0.23 -0.69 0.00 0.00 178.15 178.15 1g1f n MET 282 N -3.68 0.05 0.00 2.37 2.81 -0.50 -4.90 117.12 113.27 1g1f n MET 282 Ca -0.01 0.11 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1g1f n MET 282 Cb 0.34 -1.57 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 1g1f n MET 282 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1g1f n GLY 283 N 1.08 0.97 3.45 3.03 0.00 -0.98 -5.08 105.19 107.65 1g1f n GLY 283 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1g1f n GLY 283 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1g1f s ASP 284 N -0.76 6.22 0.42 1.61 -1.08 -1.11 -4.91 116.67 117.06 1g1f s ASP 284 Ca 0.00 -0.94 0.23 0.00 -0.52 0.00 0.00 52.55 51.32 1g1f s ASP 284 Cb 0.00 -2.37 0.79 0.00 -1.46 0.00 0.00 42.92 39.88 1g1f s ASP 284 CO 0.00 -1.23 1.77 0.28 0.52 0.00 0.00 175.17 176.51 1g1f h SER 285 N 9.33 0.00 0.88 -0.34 0.02 -1.87 -3.29 113.55 118.29 1g1f h SER 285 Ca -0.28 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 1g1f h SER 285 Cb 1.08 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 1g1f h SER 285 CO 1.11 0.24 -0.04 0.77 -1.14 0.00 0.00 176.83 177.77 1g1f h SER 286 N 0.00 0.00 0.82 3.07 4.64 -1.97 -3.14 113.55 116.97 1g1f h SER 286 Ca -0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1g1f h SER 286 Cb 0.83 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 1g1f h SER 286 CO 0.03 0.04 -0.18 -0.37 -0.87 0.00 0.00 176.83 175.49 1g1f h VAL 287 N 0.00 0.48 0.00 0.95 -1.51 -1.94 -2.63 116.25 111.60 1g1f h VAL 287 Ca -0.00 -0.92 -0.12 0.00 -1.23 0.00 0.00 66.70 64.43 1g1f h VAL 287 Cb 0.49 1.64 -0.02 0.00 -2.13 0.00 0.00 31.29 31.28 1g1f h VAL 287 CO 0.01 0.17 -0.55 -0.61 -1.23 0.00 0.00 177.57 175.36 1g1f h GLN 288 N 0.00 0.00 0.01 5.19 4.15 -1.80 -2.08 115.11 120.58 1g1f h GLN 288 Ca -0.00 0.00 -0.19 0.00 0.77 0.00 0.00 58.65 59.23 1g1f h GLN 288 Cb 0.63 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.30 1g1f h GLN 288 CO 0.02 0.55 -0.87 -0.44 -1.93 0.00 0.00 178.83 176.16 1g1f h ASP 289 N 0.00 0.08 0.28 -0.69 3.32 -1.65 -3.01 116.42 114.75 1g1f h ASP 289 Ca -0.01 -0.07 -0.16 0.00 0.02 0.00 0.00 57.03 56.82 1g1f h ASP 289 Cb 1.01 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 1g1f h ASP 289 CO 0.07 0.91 -0.62 1.56 -1.72 0.00 0.00 179.24 179.44 1g1f h GLN 290 N 0.03 0.33 -0.23 3.56 4.20 -1.26 -2.93 115.11 118.82 1g1f h GLN 290 Ca -0.02 -0.23 -0.11 0.00 0.06 0.00 0.00 58.65 58.35 1g1f h GLN 290 Cb 1.52 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.33 1g1f h GLN 290 CO 0.12 0.84 -0.32 -1.49 -0.67 0.00 0.00 178.83 177.31 1g1f h TRP 291 N 0.24 0.54 -0.36 2.96 6.55 -1.36 -1.86 115.95 122.67 1g1f h TRP 291 Ca -0.01 -0.13 -0.10 0.00 0.95 0.00 0.00 58.89 59.60 1g1f h TRP 291 Cb 1.14 -0.13 -0.02 0.00 -0.86 0.00 0.00 29.16 29.30 1g1f h TRP 291 CO 0.03 0.74 -0.20 -0.22 -1.05 0.00 0.00 178.44 177.75 1g1f h LYS 292 N 0.41 0.68 -0.01 0.49 3.64 -1.43 -1.33 116.57 119.02 1g1f h LYS 292 Ca 0.05 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 1g1f h LYS 292 Cb 0.77 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1g1f h LYS 292 CO 0.06 0.83 -0.04 0.93 -2.27 0.00 0.00 179.45 178.96 1g1f h GLU 293 N 0.61 0.05 0.00 1.90 5.08 -1.33 -3.31 114.58 117.57 1g1f h GLU 293 Ca 0.09 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1g1f h GLU 293 Cb 0.67 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1g1f h GLU 293 CO 0.05 0.70 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.68 1g1f h LEU 294 N -0.60 0.00 -0.49 1.33 3.38 -1.36 -3.09 115.31 114.48 1g1f h LEU 294 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1g1f h LEU 294 Cb 0.71 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 1g1f h LEU 294 CO 0.01 0.02 -0.52 0.77 0.09 0.00 0.00 178.44 178.80 1g1f h SER 295 N 0.00 0.00 -5.90 -0.43 4.64 -1.33 -3.45 113.55 107.09 1g1f h SER 295 Ca -0.00 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.91 1g1f h SER 295 Cb 0.56 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 62.77 1g1f h SER 295 CO 0.00 0.52 -0.69 1.41 -0.87 0.00 0.00 176.83 177.20 1g1f n HIS 296 N -3.43 -2.80 0.08 4.77 8.25 -1.17 -4.89 115.22 116.03 1g1f n HIS 296 Ca 0.00 1.00 0.04 0.00 -0.26 0.00 0.00 57.72 58.51 1g1f n HIS 296 Cb 0.65 -4.92 0.46 0.00 1.12 0.00 0.00 29.99 27.30 1g1f n HIS 296 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1g1f h GLU 297 N -2.61 0.35 -0.01 -0.41 4.11 -1.88 -3.42 114.58 110.72 1g1f h GLU 297 Ca -0.57 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.82 1g1f h GLU 297 Cb 1.37 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1g1f h GLU 297 CO 0.57 0.29 0.00 -0.25 0.07 0.00 0.00 179.01 179.69