#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yli s GLN 12 N 0.00 1.96 0.58 -0.14 -0.21 -1.26 -5.08 119.66 115.51 1yli s GLN 12 Ca 0.00 -1.29 -0.20 0.00 0.02 0.00 0.00 55.36 53.89 1yli s GLN 12 Cb 0.00 -2.11 -0.04 0.00 1.00 0.00 0.00 33.01 31.86 1yli s GLN 12 CO 0.00 0.44 1.33 -1.12 -2.12 0.00 0.00 175.29 173.81 1yli s SER 13 N -2.72 5.08 0.01 5.90 0.01 -1.26 -5.04 113.70 115.67 1yli s SER 13 Ca 0.23 2.69 0.05 0.00 1.31 0.00 0.00 55.95 60.24 1yli s SER 13 Cb -0.09 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 63.50 1yli s SER 13 CO 0.14 -1.69 -0.16 -0.75 0.41 0.00 0.00 173.24 171.18 1yli s LYS 14 N -3.07 1.22 0.00 12.44 2.20 -1.26 -5.08 119.74 126.19 1yli s LYS 14 Ca 0.75 -0.66 0.00 0.00 -0.36 0.00 0.00 55.97 55.71 1yli s LYS 14 Cb -0.39 -1.22 0.00 0.00 -1.51 0.00 0.00 37.83 34.72 1yli s LYS 14 CO 0.44 0.32 0.00 0.41 -0.36 0.00 0.00 175.35 176.17 1yli n GLY 15 N 2.41 -2.88 3.89 5.54 0.00 -1.26 -4.25 105.19 108.65 1yli n GLY 15 Ca -0.16 -2.18 -0.31 0.00 0.00 0.00 0.00 46.02 43.38 1yli n GLY 15 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yli s VAL 16 N -0.96 5.06 0.02 1.61 -7.23 0.08 -4.67 120.40 114.30 1yli s VAL 16 Ca 0.00 0.16 -0.30 0.00 -1.81 0.00 0.00 61.98 60.02 1yli s VAL 16 Cb 0.00 -3.65 -0.05 0.00 0.56 0.00 0.00 36.38 33.24 1yli s VAL 16 CO 0.00 -0.08 1.31 -0.22 -0.31 0.00 0.00 175.10 175.80 1yli s LEU 17 N -2.92 4.33 -0.23 1.32 2.96 -1.26 -0.74 118.68 122.13 1yli s LEU 17 Ca 0.43 2.06 -0.11 0.00 -0.22 0.00 0.00 54.13 56.29 1yli s LEU 17 Cb -0.11 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 42.90 1yli s LEU 17 CO 0.25 -0.62 -0.30 0.18 -1.32 0.00 0.00 176.35 174.54 1yli n LEU 18 N 4.79 1.71 -3.95 -0.68 4.77 0.11 -4.94 117.00 118.81 1yli n LEU 18 Ca 0.11 0.26 -0.15 0.00 -0.03 0.00 0.00 56.01 56.20 1yli n LEU 18 Cb 0.45 -0.69 -0.14 0.00 -2.33 0.00 0.00 43.42 40.70 1yli n LEU 18 CO 0.57 0.51 -0.40 -0.76 -1.33 0.00 0.00 177.39 175.98 1yli s LEU 19 N -7.21 2.02 -0.19 2.23 1.43 -1.18 -4.99 118.68 110.79 1yli s LEU 19 Ca -0.32 -0.10 -0.00 0.00 -1.03 0.00 0.00 54.13 52.67 1yli s LEU 19 Cb 0.12 -0.23 0.05 0.00 0.03 0.00 0.00 46.19 46.16 1yli s LEU 19 CO 0.41 0.04 -0.04 -0.60 0.23 0.00 0.00 176.35 176.40 1yli s ARG 20 N -0.18 1.40 -0.03 1.70 3.52 -1.26 -0.96 118.95 123.14 1yli s ARG 20 Ca 0.01 -0.63 0.02 0.00 -0.13 0.00 0.00 55.73 55.01 1yli s ARG 20 Cb -0.02 -2.17 0.01 0.00 -1.56 0.00 0.00 34.95 31.20 1yli s ARG 20 CO -0.00 -0.50 -0.09 0.99 -0.81 0.00 0.00 175.30 174.89 1yli s THR 21 N 1.60 0.77 0.09 4.11 2.01 -0.00 -4.95 115.64 119.28 1yli s THR 21 Ca -0.01 -0.34 -0.30 0.00 0.31 0.00 0.00 61.69 61.35 1yli s THR 21 Cb -0.16 -0.70 -0.06 0.00 0.01 0.00 0.00 72.50 71.59 1yli s THR 21 CO -0.07 0.25 1.05 -0.76 -0.69 0.00 0.00 174.62 174.39 1yli s LEU 22 N 0.31 4.44 -0.16 4.42 2.01 -1.26 0.33 118.68 128.77 1yli s LEU 22 Ca -0.05 1.89 -0.29 0.00 0.01 0.00 0.00 54.13 55.68 1yli s LEU 22 Cb -0.10 -3.59 -0.02 0.00 0.01 0.00 0.00 46.19 42.50 1yli s LEU 22 CO 0.01 -0.23 1.36 0.00 1.01 0.00 0.00 176.35 178.49 1yli s ALA 23 N 0.36 3.60 0.22 4.21 0.00 -0.26 -4.94 121.76 124.97 1yli s ALA 23 Ca 0.51 0.51 0.08 0.00 0.00 0.00 0.00 51.96 53.05 1yli s ALA 23 Cb -0.26 -3.67 -0.04 0.00 0.00 0.00 0.00 23.12 19.15 1yli s ALA 23 CO 0.31 -1.32 0.07 -1.64 0.00 0.00 0.00 175.76 173.18 1yli s MET 24 N 3.73 2.58 0.35 0.00 1.00 -1.26 -0.24 119.30 125.47 1yli s MET 24 Ca 0.59 -1.16 0.11 0.00 0.00 0.00 0.00 55.69 55.23 1yli s MET 24 Cb -0.23 -2.39 0.89 0.00 0.00 0.00 0.00 34.83 33.10 1yli s MET 24 CO 0.19 0.41 1.80 -1.35 0.00 0.00 0.00 175.02 176.07 1yli h PRO 25 N 2.05 0.59 0.00 2.03 0.11 -1.94 0.29 132.00 135.13 1yli h PRO 25 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1yli h PRO 25 Cb 1.23 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1yli h PRO 25 CO 0.60 0.39 0.00 0.43 -0.21 0.00 0.00 178.00 179.21 1yli n SER 26 N -4.66 0.00 0.05 -2.05 7.64 -1.26 -2.40 113.62 110.94 1yli n SER 26 Ca 0.22 0.34 0.12 0.00 1.01 0.00 0.00 58.87 60.56 1yli n SER 26 Cb 0.65 -0.42 0.28 0.00 -1.01 0.00 0.00 64.21 63.71 1yli n SER 26 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1yli n ASP 27 N -1.42 0.60 -4.88 6.43 8.00 0.09 -4.98 116.55 120.40 1yli n ASP 27 Ca 0.05 0.17 -0.30 0.00 0.71 0.00 0.00 54.79 55.42 1yli n ASP 27 Cb 0.16 -0.06 0.06 0.00 -0.02 0.00 0.00 41.12 41.26 1yli n ASP 27 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1yli s THR 28 N -3.10 3.12 0.68 -3.53 -4.23 -1.01 -4.59 115.64 102.98 1yli s THR 28 Ca 0.09 0.36 -0.11 0.00 -1.18 0.00 0.00 61.69 60.85 1yli s THR 28 Cb 0.15 -3.33 0.16 0.00 1.34 0.00 0.00 72.50 70.81 1yli s THR 28 CO 0.67 -0.48 0.80 -0.46 -0.54 0.00 0.00 174.62 174.62 1yli n ASN 29 N -3.12 -0.51 0.29 3.99 0.23 -0.17 -4.88 115.26 111.09 1yli n ASN 29 Ca 0.07 -1.18 0.19 0.00 -0.53 0.00 0.00 54.58 53.13 1yli n ASN 29 Cb 0.58 -0.65 0.89 0.00 -2.08 0.00 0.00 39.78 38.52 1yli n ASN 29 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1yli h ALA 30 N -2.06 1.00 -0.00 -2.53 0.00 -1.98 -1.04 119.26 112.63 1yli h ALA 30 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1yli h ALA 30 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1yli h ALA 30 CO 0.19 0.00 -0.19 -1.71 0.00 0.00 0.00 179.25 177.54 1yli n ASN 31 N -3.01 0.69 0.00 0.00 5.15 -1.26 -4.94 115.26 111.89 1yli n ASN 31 Ca -0.01 -0.65 0.00 0.00 -0.60 0.00 0.00 54.58 53.32 1yli n ASN 31 Cb 0.20 0.02 0.00 0.00 -0.53 0.00 0.00 39.78 39.46 1yli n ASN 31 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1yli n GLY 32 N 1.32 0.59 3.80 8.20 0.00 -0.39 -5.07 105.19 113.65 1yli n GLY 32 Ca 0.13 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 1yli n GLY 32 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yli s ASP 33 N -2.21 6.55 0.03 1.61 1.01 -1.26 -4.83 116.67 117.57 1yli s ASP 33 Ca 0.00 0.65 -0.30 0.00 0.71 0.00 0.00 52.55 53.60 1yli s ASP 33 Cb 0.00 -2.18 -0.07 0.00 1.01 0.00 0.00 42.92 41.68 1yli s ASP 33 CO 0.00 0.25 1.66 -0.63 0.21 0.00 0.00 175.17 176.66 1yli s ILE 34 N -0.42 3.24 0.34 0.77 -1.09 -1.26 -1.00 121.20 121.78 1yli s ILE 34 Ca 0.18 0.56 0.08 0.00 -2.23 0.00 0.00 60.65 59.24 1yli s ILE 34 Cb -0.14 -3.36 -0.04 0.00 -1.58 0.00 0.00 42.46 37.34 1yli s ILE 34 CO 0.07 -0.02 0.11 0.72 -1.23 0.00 0.00 174.94 174.59 1yli s PHE 35 N 3.14 2.68 0.20 3.97 -0.71 -1.26 -4.76 117.98 121.24 1yli s PHE 35 Ca 0.74 -0.39 -0.10 0.00 -1.04 0.00 0.00 56.93 56.14 1yli s PHE 35 Cb -0.38 -1.60 0.14 0.00 -1.21 0.00 0.00 43.02 39.98 1yli s PHE 35 CO 0.32 0.37 1.86 0.78 -1.34 0.00 0.00 175.22 177.21 1yli h GLY 36 N 1.61 1.05 -0.01 1.99 0.00 -1.99 -2.49 103.07 103.22 1yli h GLY 36 Ca -0.43 -0.42 0.17 0.00 0.00 0.00 0.00 47.33 46.64 1yli h GLY 36 CO 0.64 0.41 0.31 -1.33 0.00 0.00 0.00 176.54 176.57 1yli h GLY 37 N 1.00 1.25 1.03 4.60 0.00 -1.99 -0.14 103.07 108.83 1yli h GLY 37 Ca 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.44 1yli h GLY 37 CO -0.05 -0.17 0.45 -0.25 0.00 0.00 0.00 176.54 176.52 1yli h TRP 38 N 0.40 1.24 -0.31 5.60 7.01 -1.78 -0.75 115.95 127.37 1yli h TRP 38 Ca 0.46 -0.05 -0.05 0.00 2.11 0.00 0.00 58.89 61.37 1yli h TRP 38 Cb 0.78 -0.39 -0.01 0.00 -2.10 0.00 0.00 29.16 27.44 1yli h TRP 38 CO -0.18 0.87 0.01 0.82 -2.79 0.00 0.00 178.44 177.18 1yli h ILE 39 N 1.24 1.25 -0.99 2.65 2.04 -1.13 -1.66 117.51 120.91 1yli h ILE 39 Ca 0.31 -0.91 0.06 0.00 1.00 0.00 0.00 64.86 65.32 1yli h ILE 39 Cb 0.08 1.25 -0.07 0.00 -0.74 0.00 0.00 36.82 37.34 1yli h ILE 39 CO -0.04 0.29 0.64 0.24 0.00 0.00 0.00 178.15 179.28 1yli h MET 40 N 0.33 1.12 -0.33 2.37 2.86 -0.85 -1.22 114.93 119.22 1yli h MET 40 Ca 0.09 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1yli h MET 40 Cb 0.41 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 1yli h MET 40 CO 0.01 0.74 -0.02 1.03 1.06 0.00 0.00 176.91 179.74 1yli h SER 41 N 1.16 0.58 -0.53 1.22 0.87 -0.85 -1.21 113.55 114.79 1yli h SER 41 Ca 0.43 -0.32 0.05 0.00 -1.23 0.00 0.00 61.79 60.71 1yli h SER 41 Cb 0.17 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 61.92 1yli h SER 41 CO -0.17 0.77 0.26 1.56 -0.53 0.00 0.00 176.83 178.72 1yli h GLN 42 N 0.39 0.49 -0.28 2.24 1.08 -1.03 -0.92 115.11 117.08 1yli h GLN 42 Ca 0.09 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1yli h GLN 42 Cb 0.48 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.78 1yli h GLN 42 CO 0.02 0.32 0.18 0.52 -0.95 0.00 0.00 178.83 178.92 1yli h MET 43 N 0.50 0.37 -0.15 1.46 2.86 -1.02 0.14 114.93 119.09 1yli h MET 43 Ca 0.24 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.85 1yli h MET 43 Cb 0.16 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1yli h MET 43 CO -0.18 0.26 0.07 0.22 1.06 0.00 0.00 176.91 178.35 1yli h ASP 44 N 0.37 0.20 -0.63 1.22 3.58 -1.12 0.28 116.42 120.32 1yli h ASP 44 Ca 0.10 -0.12 -0.01 0.00 0.42 0.00 0.00 57.03 57.42 1yli h ASP 44 Cb -0.03 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 40.94 1yli h ASP 44 CO -0.02 0.27 0.36 -0.03 -2.88 0.00 0.00 179.24 176.94 1yli h MET 45 N 0.12 0.87 -0.09 0.28 4.05 -1.03 -2.14 114.93 116.98 1yli h MET 45 Ca 0.05 -0.09 -0.07 0.00 -0.28 0.00 0.00 59.70 59.32 1yli h MET 45 Cb 0.12 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 30.75 1yli h MET 45 CO -0.01 0.64 -0.20 0.78 0.23 0.00 0.00 176.91 178.35 1yli h GLY 46 N 0.86 0.33 0.50 1.39 0.00 -0.58 -3.17 103.07 102.40 1yli h GLY 46 Ca 0.22 -0.40 0.11 0.00 0.00 0.00 0.00 47.33 47.26 1yli h GLY 46 CO -0.04 0.36 0.55 -1.33 0.00 0.00 0.00 176.54 176.08 1yli h GLY 47 N -0.15 1.46 2.00 4.60 0.00 -0.40 -0.41 103.07 110.17 1yli h GLY 47 Ca 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 1yli h GLY 47 CO 0.04 0.15 -0.03 0.00 0.00 0.00 0.00 176.54 176.70 1yli h ALA 48 N 1.49 1.05 0.02 3.60 0.00 -1.39 -1.91 119.26 122.12 1yli h ALA 48 Ca 0.44 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 1yli h ALA 48 Cb 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1yli h ALA 48 CO -0.25 0.04 -0.01 0.82 0.00 0.00 0.00 179.25 179.84 1yli h ILE 49 N 0.00 1.14 -0.35 0.00 2.04 -1.04 -0.59 117.51 118.71 1yli h ILE 49 Ca -0.00 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.33 1yli h ILE 49 Cb 0.33 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1yli h ILE 49 CO 0.00 0.13 0.08 0.25 0.00 0.00 0.00 178.15 178.61 1yli h LEU 50 N -0.24 0.54 -0.62 1.44 5.85 -1.55 -1.75 115.31 118.97 1yli h LEU 50 Ca -0.00 -0.24 0.10 0.00 0.84 0.00 0.00 57.88 58.57 1yli h LEU 50 Cb 0.23 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.04 1yli h LEU 50 CO 0.00 0.64 0.24 0.00 -0.34 0.00 0.00 178.44 178.98 1yli h ALA 51 N 0.92 0.81 -0.53 1.25 0.00 -1.26 -2.22 119.26 118.22 1yli h ALA 51 Ca 0.11 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1yli h ALA 51 Cb 0.32 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1yli h ALA 51 CO 0.00 -0.19 0.08 -0.22 0.00 0.00 0.00 179.25 178.93 1yli h LYS 52 N 0.42 0.89 -0.46 0.00 3.64 -0.93 0.11 116.57 120.25 1yli h LYS 52 Ca 0.32 -0.24 0.09 0.00 -1.27 0.00 0.00 60.65 59.55 1yli h LYS 52 Cb 0.39 -0.10 -0.09 0.00 -0.41 0.00 0.00 32.23 32.02 1yli h LYS 52 CO -0.31 0.87 -0.13 0.93 -2.27 0.00 0.00 179.45 178.53 1yli h GLU 53 N 0.77 -0.02 -0.01 1.90 5.08 -1.01 0.84 114.58 122.13 1yli h GLU 53 Ca 0.16 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.33 1yli h GLU 53 Cb 0.42 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1yli h GLU 53 CO 0.01 -0.02 -0.83 0.82 -1.00 0.00 0.00 179.01 177.99 1yli h ILE 54 N -0.02 1.48 0.00 3.13 2.04 -1.06 -3.26 117.51 119.81 1yli h ILE 54 Ca 0.22 -2.53 0.00 0.00 1.00 0.00 0.00 64.86 63.55 1yli h ILE 54 Cb 0.36 2.39 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1yli h ILE 54 CO -0.48 0.74 -0.37 0.00 0.00 0.00 0.00 178.15 178.03 1yli h ALA 55 N 1.01 0.76 -5.89 1.87 0.00 -0.34 -3.41 119.26 113.26 1yli h ALA 55 Ca -0.04 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.48 1yli h ALA 55 Cb 1.44 0.00 0.11 0.00 0.00 0.00 0.00 17.79 19.34 1yli h ALA 55 CO 0.13 0.00 -0.74 0.72 0.00 0.00 0.00 179.25 179.36 1yli n HIS 56 N -2.30 -2.48 -3.43 0.00 8.25 0.25 -4.53 115.22 110.98 1yli n HIS 56 Ca 0.04 0.96 0.00 0.00 -0.26 0.00 0.00 57.72 58.46 1yli n HIS 56 Cb 0.45 -4.81 0.00 0.00 1.12 0.00 0.00 29.99 26.75 1yli n HIS 56 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1yli n GLY 57 N -1.66 -0.83 3.58 -1.41 0.00 -1.19 -5.04 105.19 98.64 1yli n GLY 57 Ca -0.11 -1.30 -0.49 0.00 0.00 0.00 0.00 46.02 44.12 1yli n GLY 57 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1yli n ARG 58 N 0.00 1.17 -4.16 1.61 0.63 -1.26 -4.61 116.66 110.04 1yli n ARG 58 Ca 0.00 0.42 -0.15 0.00 -0.92 0.00 0.00 57.85 57.20 1yli n ARG 58 Cb 0.00 -1.94 -0.11 0.00 0.45 0.00 0.00 32.46 30.86 1yli n ARG 58 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 1yli s VAL 59 N -0.08 0.91 0.17 5.15 -7.23 -1.26 -1.63 120.40 116.43 1yli s VAL 59 Ca 0.75 -1.50 0.05 0.00 -1.81 0.00 0.00 61.98 59.47 1yli s VAL 59 Cb -0.87 -1.20 -0.05 0.00 0.56 0.00 0.00 36.38 34.83 1yli s VAL 59 CO 0.51 -0.48 -0.09 0.68 -0.31 0.00 0.00 175.10 175.41 1yli s VAL 60 N -2.09 1.26 -0.21 1.32 -7.23 -0.03 -4.93 120.40 108.49 1yli s VAL 60 Ca 0.02 -2.09 -0.20 0.00 -1.81 0.00 0.00 61.98 57.91 1yli s VAL 60 Cb -0.05 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 1yli s VAL 60 CO 0.00 -0.64 0.58 -0.89 -0.31 0.00 0.00 175.10 173.85 1yli s THR 61 N -3.27 5.05 -0.12 5.32 2.01 -1.26 -0.05 115.64 123.31 1yli s THR 61 Ca 0.20 1.08 0.19 0.00 0.31 0.00 0.00 61.69 63.47 1yli s THR 61 Cb 0.03 -3.90 -0.26 0.00 0.01 0.00 0.00 72.50 68.37 1yli s THR 61 CO 0.03 0.11 0.36 0.55 -0.69 0.00 0.00 174.62 174.99 1yli n VAL 62 N 4.78 0.83 -3.49 3.82 3.14 -0.14 -4.95 118.33 122.32 1yli n VAL 62 Ca -0.03 -0.69 -0.16 0.00 -2.96 0.00 0.00 64.34 60.50 1yli n VAL 62 Cb 0.50 -0.33 -0.05 0.00 -1.06 0.00 0.00 33.84 32.90 1yli n VAL 62 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1yli s ALA 63 N -2.96 -1.72 0.00 1.55 0.00 -1.13 -5.02 121.76 112.49 1yli s ALA 63 Ca -0.08 1.06 -0.00 0.00 0.00 0.00 0.00 51.96 52.94 1yli s ALA 63 Cb 0.09 0.27 -0.00 0.00 0.00 0.00 0.00 23.12 23.48 1yli s ALA 63 CO 0.86 -0.50 -0.00 0.54 0.00 0.00 0.00 175.76 176.65 1yli s VAL 64 N -2.01 0.02 0.82 0.00 0.11 -1.26 -1.11 120.40 116.97 1yli s VAL 64 Ca -0.07 -0.18 -0.11 0.00 -2.93 0.00 0.00 61.98 58.69 1yli s VAL 64 Cb -0.00 -0.06 0.08 0.00 -1.53 0.00 0.00 36.38 34.87 1yli s VAL 64 CO 0.02 -0.10 1.10 -1.61 -3.33 0.00 0.00 175.10 171.18 1yli s GLU 65 N -0.28 1.88 0.84 1.54 2.02 -0.38 -5.02 118.70 119.30 1yli s GLU 65 Ca -0.03 0.67 -0.13 0.00 0.02 0.00 0.00 54.97 55.50 1yli s GLU 65 Cb -0.02 -1.89 0.07 0.00 0.10 0.00 0.00 34.13 32.39 1yli s GLU 65 CO -0.00 -1.77 0.96 -1.13 0.02 0.00 0.00 175.26 173.34 1yli n SER 66 N -3.54 0.06 -3.88 -0.19 3.41 -1.26 -4.82 113.62 103.40 1yli n SER 66 Ca 0.07 0.51 -0.11 0.00 -0.26 0.00 0.00 58.87 59.08 1yli n SER 66 Cb 0.56 -1.41 -0.10 0.00 -0.26 0.00 0.00 64.21 63.00 1yli n SER 66 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1yli s MET 67 N -3.93 0.43 -0.03 4.33 1.75 -1.26 -4.83 119.30 115.75 1yli s MET 67 Ca 0.68 -0.35 0.04 0.00 -1.25 0.00 0.00 55.69 54.81 1yli s MET 67 Cb -0.27 0.18 -0.00 0.00 2.84 0.00 0.00 34.83 37.57 1yli s MET 67 CO 0.56 -0.10 -0.15 -0.80 -0.65 0.00 0.00 175.02 173.88 1yli s ASN 68 N -1.22 1.86 -0.40 1.11 0.01 -1.26 -5.11 114.94 109.92 1yli s ASN 68 Ca -0.13 -0.30 -0.13 0.00 -0.71 0.00 0.00 52.86 51.60 1yli s ASN 68 Cb -0.07 -0.43 0.04 0.00 0.41 0.00 0.00 41.25 41.19 1yli s ASN 68 CO 0.01 0.14 0.27 -0.36 -1.51 0.00 0.00 177.10 175.65 1yli s PHE 69 N -0.03 3.25 -0.05 2.20 0.08 -1.26 -4.46 117.98 117.70 1yli s PHE 69 Ca -0.01 -0.90 0.06 0.00 0.12 0.00 0.00 56.93 56.20 1yli s PHE 69 Cb -0.09 -2.64 -0.24 0.00 -0.57 0.00 0.00 43.02 39.47 1yli s PHE 69 CO 0.01 -0.67 0.62 -0.84 -0.10 0.00 0.00 175.22 174.24 1yli h ILE 70 N 5.81 0.84 -3.95 0.64 3.07 -1.61 -3.48 117.51 118.83 1yli h ILE 70 Ca -0.26 -2.64 -0.38 0.00 1.55 0.00 0.00 64.86 63.13 1yli h ILE 70 Cb 1.11 2.48 -0.21 0.00 -0.27 0.00 0.00 36.82 39.92 1yli h ILE 70 CO 0.73 0.63 -0.77 -0.54 -1.05 0.00 0.00 178.15 177.15 1yli s LYS 71 N -2.59 0.75 0.66 0.16 1.02 -1.26 -5.10 119.74 113.38 1yli s LYS 71 Ca -0.09 -0.91 -0.11 0.00 0.02 0.00 0.00 55.97 54.88 1yli s LYS 71 Cb 0.08 -0.70 -0.01 0.00 -0.52 0.00 0.00 37.83 36.67 1yli s LYS 71 CO 0.81 0.15 1.05 -1.25 -0.92 0.00 0.00 175.35 175.19 1yli s PRO 72 N -1.70 3.24 -0.04 -1.68 0.04 -1.26 -4.85 135.00 128.75 1yli s PRO 72 Ca -0.04 0.79 0.05 0.00 0.04 0.00 0.00 61.00 61.84 1yli s PRO 72 Cb -0.10 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.39 1yli s PRO 72 CO 0.02 -0.84 -0.20 0.42 0.04 0.00 0.00 177.00 176.45 1yli s ILE 73 N -3.15 1.60 0.12 0.56 1.01 -1.26 -5.08 121.20 115.00 1yli s ILE 73 Ca 0.57 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 60.43 1yli s ILE 73 Cb -0.12 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 1yli s ILE 73 CO 0.54 0.46 0.07 -0.44 0.00 0.00 0.00 174.94 175.57 1yli s SER 74 N -0.17 5.33 0.24 3.58 0.01 -1.26 -4.27 113.70 117.17 1yli s SER 74 Ca 0.00 -0.12 -0.31 0.00 1.31 0.00 0.00 55.95 56.83 1yli s SER 74 Cb -0.11 -1.36 -0.11 0.00 0.21 0.00 0.00 66.02 64.65 1yli s SER 74 CO 0.01 0.13 1.62 -0.69 0.41 0.00 0.00 173.24 174.73 1yli s VAL 75 N -1.51 2.17 0.00 3.43 1.01 -1.26 -1.65 120.40 122.59 1yli s VAL 75 Ca 0.29 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.40 1yli s VAL 75 Cb -0.11 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1yli s VAL 75 CO 0.21 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.94 1yli n GLY 76 N 2.99 2.31 3.78 4.51 0.00 0.67 -4.58 105.19 114.88 1yli n GLY 76 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 1yli n GLY 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yli s ASP 77 N -0.31 5.60 -0.09 1.61 1.01 -0.66 -4.56 116.67 119.29 1yli s ASP 77 Ca 0.00 2.02 -0.18 0.00 0.71 0.00 0.00 52.55 55.10 1yli s ASP 77 Cb 0.00 -2.56 -0.05 0.00 1.01 0.00 0.00 42.92 41.32 1yli s ASP 77 CO 0.00 -1.29 0.48 -0.69 0.21 0.00 0.00 175.17 173.87 1yli s VAL 78 N -2.12 5.13 -0.18 -1.27 1.01 -0.54 -1.10 120.40 121.34 1yli s VAL 78 Ca 0.68 0.97 0.01 0.00 0.00 0.00 0.00 61.98 63.64 1yli s VAL 78 Cb -0.20 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.38 1yli s VAL 78 CO 0.33 0.38 -0.18 -0.69 0.00 0.00 0.00 175.10 174.94 1yli s VAL 79 N 0.26 2.30 -0.13 2.92 1.01 0.15 -1.16 120.40 125.75 1yli s VAL 79 Ca 0.26 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1yli s VAL 79 Cb -0.16 -1.97 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 1yli s VAL 79 CO 0.11 0.52 -0.10 0.00 0.00 0.00 0.00 175.10 175.63 1yli s TYR 82 N 0.60 2.74 -0.05 0.00 1.51 0.05 0.07 117.35 122.27 1yli s TYR 82 Ca 0.01 -0.14 0.03 0.00 -1.01 0.00 0.00 57.07 55.96 1yli s TYR 82 Cb -0.13 -1.55 0.01 0.00 -0.11 0.00 0.00 41.96 40.18 1yli s TYR 82 CO 0.02 0.31 -0.12 0.20 -1.11 0.00 0.00 175.55 174.85 1yli s GLY 83 N -1.41 0.72 -0.13 0.71 0.00 0.08 -1.06 107.32 106.22 1yli s GLY 83 Ca 0.16 -0.42 -0.03 0.00 0.00 0.00 0.00 44.72 44.43 1yli s GLY 83 CO 0.06 -0.02 0.05 1.62 0.00 0.00 0.00 173.10 174.81 1yli s GLN 84 N 0.40 0.33 -0.06 2.90 0.74 -0.34 -0.74 119.66 122.88 1yli s GLN 84 Ca -0.09 -0.04 -0.30 0.00 0.05 0.00 0.00 55.36 54.98 1yli s GLN 84 Cb -0.13 -1.46 -0.03 0.00 1.10 0.00 0.00 33.01 32.50 1yli s GLN 84 CO 0.02 -0.51 1.23 0.00 -0.55 0.00 0.00 175.29 175.48 1yli n LEU 86 N 5.38 0.00 -3.70 0.00 4.77 0.82 -4.70 117.00 119.57 1yli n LEU 86 Ca 0.11 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.96 1yli n LEU 86 Cb 0.46 0.42 -0.09 0.00 -2.33 0.00 0.00 43.42 41.88 1yli n LEU 86 CO 0.56 0.42 0.18 -0.75 -1.33 0.00 0.00 177.39 176.47 1yli s LYS 87 N -2.57 0.61 -0.18 3.23 2.20 -1.21 -4.98 119.74 116.84 1yli s LYS 87 Ca -0.09 0.63 -0.00 0.00 -0.36 0.00 0.00 55.97 56.15 1yli s LYS 87 Cb 0.06 0.29 0.01 0.00 -1.51 0.00 0.00 37.83 36.68 1yli s LYS 87 CO 0.79 -0.09 -0.15 0.08 -0.36 0.00 0.00 175.35 175.62 1yli s VAL 88 N 0.12 2.53 0.00 4.02 1.01 -1.26 -1.10 120.40 125.72 1yli s VAL 88 Ca -0.01 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1yli s VAL 88 Cb -0.03 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.26 1yli s VAL 88 CO 0.01 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1yli n GLY 89 N 4.40 1.90 0.07 4.51 0.00 0.10 -5.02 105.19 111.16 1yli n GLY 89 Ca -0.20 -1.82 -0.07 0.00 0.00 0.00 0.00 46.02 43.94 1yli n GLY 89 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1yli h ARG 90 N 0.00 -0.03 0.00 1.61 2.47 -1.96 -3.41 114.38 113.06 1yli h ARG 90 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1yli h ARG 90 Cb 0.00 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.33 1yli h ARG 90 CO 0.00 0.43 -0.94 -1.13 0.56 0.00 0.00 179.97 178.89 1yli n SER 91 N -4.73 3.07 -4.89 7.04 3.41 -1.26 -1.38 113.62 114.89 1yli n SER 91 Ca -0.05 -0.15 -0.31 0.00 -0.26 0.00 0.00 58.87 58.10 1yli n SER 91 Cb 0.23 1.15 -0.05 0.00 -0.26 0.00 0.00 64.21 65.28 1yli n SER 91 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1yli s SER 92 N -2.21 6.54 -0.06 4.04 1.04 -1.26 -0.42 113.70 121.38 1yli s SER 92 Ca -0.01 0.78 -0.01 0.00 0.48 0.00 0.00 55.95 57.19 1yli s SER 92 Cb 0.03 -2.17 0.03 0.00 0.10 0.00 0.00 66.02 64.01 1yli s SER 92 CO 0.17 -0.07 -0.00 -0.63 0.98 0.00 0.00 173.24 173.70 1yli s ILE 93 N -1.83 0.32 -0.26 -1.02 1.01 -0.16 0.02 121.20 119.27 1yli s ILE 93 Ca 0.45 0.11 -0.17 0.00 0.00 0.00 0.00 60.65 61.03 1yli s ILE 93 Cb -0.11 -0.45 -0.03 0.00 0.01 0.00 0.00 42.46 41.87 1yli s ILE 93 CO 0.24 0.23 0.48 -0.54 0.00 0.00 0.00 174.94 175.35 1yli s LYS 94 N 1.65 4.06 -0.15 2.79 1.02 -0.26 -0.87 119.74 127.98 1yli s LYS 94 Ca -0.00 0.26 0.02 0.00 0.02 0.00 0.00 55.97 56.26 1yli s LYS 94 Cb -0.13 -3.65 0.01 0.00 -0.52 0.00 0.00 37.83 33.54 1yli s LYS 94 CO -0.03 -0.33 -0.20 0.42 -0.92 0.00 0.00 175.35 174.29 1yli s ILE 95 N 2.23 2.28 -0.14 2.17 1.01 0.73 -0.13 121.20 129.35 1yli s ILE 95 Ca 0.20 -0.91 -0.28 0.00 0.00 0.00 0.00 60.65 59.66 1yli s ILE 95 Cb -0.16 -1.93 -0.01 0.00 0.01 0.00 0.00 42.46 40.37 1yli s ILE 95 CO 0.09 0.54 0.95 -0.75 0.00 0.00 0.00 174.94 175.77 1yli s LYS 96 N 0.82 4.37 -0.17 2.79 2.20 0.71 -0.35 119.74 130.11 1yli s LYS 96 Ca -0.06 1.27 -0.02 0.00 -0.36 0.00 0.00 55.97 56.79 1yli s LYS 96 Cb -0.15 -3.56 -0.01 0.00 -1.51 0.00 0.00 37.83 32.59 1yli s LYS 96 CO -0.01 -0.35 -0.08 0.08 -0.36 0.00 0.00 175.35 174.63 1yli s VAL 97 N 2.16 3.30 -0.03 4.02 1.01 0.64 -1.19 120.40 130.30 1yli s VAL 97 Ca 0.45 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.87 1yli s VAL 97 Cb -0.17 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1yli s VAL 97 CO 0.15 0.48 0.06 -1.61 0.00 0.00 0.00 175.10 174.18 1yli s GLU 98 N 0.79 3.04 -0.18 2.72 2.02 -0.22 -1.09 118.70 125.78 1yli s GLU 98 Ca -0.03 -0.46 -0.00 0.00 0.02 0.00 0.00 54.97 54.50 1yli s GLU 98 Cb -0.15 -2.85 0.01 0.00 0.10 0.00 0.00 34.13 31.24 1yli s GLU 98 CO 0.01 0.66 -0.15 0.08 0.02 0.00 0.00 175.26 175.89 1yli s VAL 99 N -1.11 2.56 0.05 2.63 1.01 -0.28 -0.77 120.40 124.48 1yli s VAL 99 Ca 0.20 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.48 1yli s VAL 99 Cb -0.12 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1yli s VAL 99 CO 0.11 0.50 -0.22 0.26 0.00 0.00 0.00 175.10 175.74 1yli s TRP 100 N 1.19 1.96 -0.05 5.22 0.52 -0.41 -0.49 118.94 126.88 1yli s TRP 100 Ca 0.02 -0.39 0.06 0.00 0.02 0.00 0.00 56.10 55.82 1yli s TRP 100 Cb -0.14 -1.16 -0.01 0.00 -1.15 0.00 0.00 33.47 31.00 1yli s TRP 100 CO -0.07 0.12 -0.24 0.08 0.02 0.00 0.00 176.95 176.86 1yli s VAL 101 N -0.83 2.14 -0.21 4.03 1.01 0.90 -0.54 120.40 126.90 1yli s VAL 101 Ca 0.09 -1.05 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 1yli s VAL 101 Cb -0.09 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 1yli s VAL 101 CO 0.02 0.57 0.01 -0.75 0.00 0.00 0.00 175.10 174.95 1yli s LYS 102 N -0.33 3.62 0.11 2.72 2.20 -0.31 -1.23 119.74 126.52 1yli s LYS 102 Ca 0.02 -0.51 -0.30 0.00 -0.36 0.00 0.00 55.97 54.81 1yli s LYS 102 Cb -0.12 -3.11 -0.06 0.00 -1.51 0.00 0.00 37.83 33.02 1yli s LYS 102 CO 0.02 -0.02 1.08 0.15 -0.36 0.00 0.00 175.35 176.22 1yli s LYS 103 N 1.09 4.57 0.00 4.03 1.02 -0.39 -1.47 119.74 128.58 1yli s LYS 103 Ca 0.03 1.64 0.00 0.00 0.02 0.00 0.00 55.97 57.66 1yli s LYS 103 Cb -0.14 -3.34 0.00 0.00 -0.52 0.00 0.00 37.83 33.83 1yli s LYS 103 CO 0.02 -0.00 0.00 0.28 -0.92 0.00 0.00 175.35 174.73 1yli n VAL 104 N 3.03 0.00 -0.12 3.17 0.31 -1.26 -1.36 118.33 122.09 1yli n VAL 104 Ca 0.05 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.28 1yli n VAL 104 Cb 0.47 -0.80 -0.02 0.00 -0.91 0.00 0.00 33.84 32.59 1yli n VAL 104 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yli h ALA 105 N 0.00 0.48 -2.34 3.52 0.00 -1.82 -3.46 119.26 115.64 1yli h ALA 105 Ca 0.00 -0.18 -0.35 0.00 0.00 0.00 0.00 54.91 54.38 1yli h ALA 105 Cb 0.82 -0.14 -0.14 0.00 0.00 0.00 0.00 17.79 18.33 1yli h ALA 105 CO 0.00 0.16 -0.61 -1.54 0.00 0.00 0.00 179.25 177.25 1yli s SER 106 N -5.95 1.15 0.57 0.00 1.04 -1.26 -5.10 113.70 104.14 1yli s SER 106 Ca -0.13 -1.39 -0.19 0.00 0.48 0.00 0.00 55.95 54.73 1yli s SER 106 Cb 0.09 0.17 -0.05 0.00 0.10 0.00 0.00 66.02 66.34 1yli s SER 106 CO 0.76 -0.74 1.13 -1.61 0.98 0.00 0.00 173.24 173.76 1yli s GLU 107 N -4.04 3.24 -0.15 4.02 0.41 -1.26 -3.52 118.70 117.40 1yli s GLU 107 Ca 0.38 1.58 -0.28 0.00 -0.41 0.00 0.00 54.97 56.24 1yli s GLU 107 Cb 0.08 -1.99 -0.01 0.00 -1.78 0.00 0.00 34.13 30.43 1yli s GLU 107 CO 0.14 -0.94 0.96 -1.25 -0.49 0.00 0.00 175.26 173.68 1yli s PRO 108 N -3.43 4.35 0.08 0.39 0.04 -1.26 -5.11 135.00 130.06 1yli s PRO 108 Ca 0.72 1.27 -0.31 0.00 0.04 0.00 0.00 61.00 62.72 1yli s PRO 108 Cb -0.24 -3.57 -0.08 0.00 0.04 0.00 0.00 34.50 30.66 1yli s PRO 108 CO 0.30 -0.38 1.49 0.42 0.04 0.00 0.00 177.00 178.87 1yli s ILE 109 N 2.27 3.26 0.00 0.56 1.01 -1.23 -2.71 121.20 124.36 1yli s ILE 109 Ca 0.44 0.79 0.00 0.00 0.00 0.00 0.00 60.65 61.89 1yli s ILE 109 Cb -0.17 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.79 1yli s ILE 109 CO 0.14 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.72 1yli n GLY 110 N 3.70 1.88 3.77 6.18 0.00 -0.47 -4.98 105.19 115.27 1yli n GLY 110 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 1yli n GLY 110 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yli s GLU 111 N -0.85 4.03 -0.11 1.61 2.12 -1.10 -4.58 118.70 119.82 1yli s GLU 111 Ca 0.00 2.08 0.01 0.00 0.36 0.00 0.00 54.97 57.41 1yli s GLU 111 Cb 0.00 -2.77 -0.02 0.00 0.26 0.00 0.00 34.13 31.60 1yli s GLU 111 CO 0.00 -0.42 -0.12 1.03 -0.54 0.00 0.00 175.26 175.21 1yli s ARG 112 N -2.20 3.15 0.05 4.30 0.52 -1.26 -1.27 118.95 122.24 1yli s ARG 112 Ca 0.56 -0.67 -0.04 0.00 -0.52 0.00 0.00 55.73 55.06 1yli s ARG 112 Cb -0.36 -2.58 -0.02 0.00 0.52 0.00 0.00 34.95 32.50 1yli s ARG 112 CO 0.47 0.35 0.06 1.52 0.02 0.00 0.00 175.30 177.71 1yli s TYR 113 N 0.01 0.32 -0.17 -0.53 1.13 -0.37 -4.95 117.35 112.79 1yli s TYR 113 Ca -0.03 -0.75 -0.16 0.00 -1.41 0.00 0.00 57.07 54.72 1yli s TYR 113 Cb -0.14 -0.22 -0.04 0.00 -1.10 0.00 0.00 41.96 40.45 1yli s TYR 113 CO 0.04 -0.40 0.41 0.00 -2.51 0.00 0.00 175.55 173.09 1yli n VAL 115 N 3.98 1.63 -3.82 0.00 0.31 0.35 -4.56 118.33 116.22 1yli n VAL 115 Ca -0.08 -0.32 -0.05 0.00 -0.01 0.00 0.00 64.34 63.88 1yli n VAL 115 Cb 0.51 -1.88 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 1yli n VAL 115 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1yli s THR 116 N -2.46 0.00 0.06 2.52 -1.32 -1.24 -1.59 115.64 111.61 1yli s THR 116 Ca -0.28 -0.72 -0.19 0.00 -1.21 0.00 0.00 61.69 59.30 1yli s THR 116 Cb 0.07 -2.49 0.04 0.00 -1.51 0.00 0.00 72.50 68.61 1yli s THR 116 CO 0.65 0.00 0.43 1.51 -2.21 0.00 0.00 174.62 175.00 1yli s ASP 117 N -3.14 -0.30 -0.01 8.08 1.47 -1.26 -1.13 116.67 120.37 1yli s ASP 117 Ca 0.16 -0.02 -0.29 0.00 1.18 0.00 0.00 52.55 53.58 1yli s ASP 117 Cb -0.03 0.45 0.08 0.00 -0.34 0.00 0.00 42.92 43.08 1yli s ASP 117 CO 0.05 -0.71 0.72 0.00 0.68 0.00 0.00 175.17 175.92 1yli s ALA 118 N -2.69 -1.76 -0.17 2.11 0.00 -0.25 -4.67 121.76 114.33 1yli s ALA 118 Ca -0.04 1.14 -0.20 0.00 0.00 0.00 0.00 51.96 52.86 1yli s ALA 118 Cb -0.00 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 1yli s ALA 118 CO -0.04 -0.48 0.59 0.08 0.00 0.00 0.00 175.76 175.91 1yli s VAL 119 N -1.92 5.07 -0.10 0.00 1.01 -1.26 -0.26 120.40 122.92 1yli s VAL 119 Ca -0.06 1.13 -0.04 0.00 0.00 0.00 0.00 61.98 63.01 1yli s VAL 119 Cb -0.00 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1yli s VAL 119 CO 0.02 0.17 0.05 -0.36 0.00 0.00 0.00 175.10 174.99 1yli s PHE 120 N 1.54 3.32 -0.23 5.22 0.40 0.53 -1.25 117.98 127.51 1yli s PHE 120 Ca 0.28 0.30 -0.05 0.00 -0.60 0.00 0.00 56.93 56.86 1yli s PHE 120 Cb -0.16 -1.86 -0.02 0.00 0.51 0.00 0.00 43.02 41.49 1yli s PHE 120 CO 0.11 0.54 0.01 0.99 0.70 0.00 0.00 175.22 177.57 1yli s THR 121 N -0.85 3.85 0.19 0.64 2.01 -0.27 -0.19 115.64 121.01 1yli s THR 121 Ca 0.13 -0.34 0.05 0.00 0.31 0.00 0.00 61.69 61.85 1yli s THR 121 Cb -0.12 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.59 1yli s THR 121 CO 0.03 0.39 0.18 -0.36 -0.69 0.00 0.00 174.62 174.18 1yli s PHE 122 N 1.40 3.20 -0.07 4.92 0.08 -0.05 -0.96 117.98 126.51 1yli s PHE 122 Ca 0.05 -0.02 0.02 0.00 0.12 0.00 0.00 56.93 57.10 1yli s PHE 122 Cb -0.15 -1.51 0.01 0.00 -0.57 0.00 0.00 43.02 40.81 1yli s PHE 122 CO 0.00 0.51 -0.13 0.08 -0.10 0.00 0.00 175.22 175.59 1yli s VAL 123 N -1.86 1.20 0.05 -0.44 1.01 0.93 -0.99 120.40 120.30 1yli s VAL 123 Ca 0.32 -0.52 -0.31 0.00 0.00 0.00 0.00 61.98 61.48 1yli s VAL 123 Cb -0.10 -1.09 -0.07 0.00 0.00 0.00 0.00 36.38 35.12 1yli s VAL 123 CO 0.25 0.37 1.43 0.00 0.00 0.00 0.00 175.10 177.15 1yli s ALA 124 N 0.66 3.60 0.10 5.51 0.00 0.44 -0.85 121.76 131.22 1yli s ALA 124 Ca -0.15 1.01 0.06 0.00 0.00 0.00 0.00 51.96 52.89 1yli s ALA 124 Cb -0.16 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.34 1yli s ALA 124 CO 0.04 -0.83 -0.16 0.14 0.00 0.00 0.00 175.76 174.95 1yli s VAL 125 N 1.96 1.40 0.42 0.00 -7.23 -0.65 -0.84 120.40 115.45 1yli s VAL 125 Ca 0.65 -1.54 -0.06 0.00 -1.81 0.00 0.00 61.98 59.22 1yli s VAL 125 Cb -0.34 -1.40 0.09 0.00 0.56 0.00 0.00 36.38 35.29 1yli s VAL 125 CO 0.29 -0.25 0.57 -0.90 -0.31 0.00 0.00 175.10 174.50 1yli n ASP 126 N 0.92 0.19 0.09 4.85 5.68 0.33 -4.33 116.55 124.28 1yli n ASP 126 Ca -0.18 -1.30 0.18 0.00 -0.50 0.00 0.00 54.79 52.99 1yli n ASP 126 Cb 0.55 -0.42 0.72 0.00 -1.14 0.00 0.00 41.12 40.83 1yli n ASP 126 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 1yli h ASN 127 N -0.67 0.00 -0.71 -1.12 -1.24 -1.99 -1.59 115.58 108.26 1yli h ASN 127 Ca -0.19 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.82 1yli h ASN 127 Cb 0.55 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.60 1yli h ASN 127 CO 0.14 0.00 0.00 0.59 -1.29 0.00 0.00 177.43 176.87 1yli n ASN 128 N -4.19 4.32 0.00 1.15 5.03 -1.26 -4.94 115.26 115.37 1yli n ASN 128 Ca 0.06 -2.18 0.00 0.00 0.87 0.00 0.00 54.58 53.33 1yli n ASN 128 Cb 0.48 -0.53 0.00 0.00 -1.02 0.00 0.00 39.78 38.71 1yli n ASN 128 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1yli n GLY 129 N 1.48 0.74 3.86 7.41 0.00 -0.60 -5.05 105.19 113.03 1yli n GLY 129 Ca 0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 1yli n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yli s ARG 130 N -0.21 3.87 0.50 1.61 0.52 -1.26 -4.78 118.95 119.20 1yli s ARG 130 Ca 0.00 0.36 -0.23 0.00 -0.52 0.00 0.00 55.73 55.33 1yli s ARG 130 Cb 0.00 -2.82 -0.07 0.00 0.52 0.00 0.00 34.95 32.59 1yli s ARG 130 CO 0.00 0.42 1.38 -1.13 0.02 0.00 0.00 175.30 175.98 1yli n SER 131 N 0.40 2.90 -4.19 0.23 3.41 -1.26 -0.51 113.62 114.59 1yli n SER 131 Ca -0.03 1.04 -0.14 0.00 -0.26 0.00 0.00 58.87 59.48 1yli n SER 131 Cb 0.52 -1.58 -0.11 0.00 -0.26 0.00 0.00 64.21 62.79 1yli n SER 131 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yli s ARG 132 N -2.67 0.90 -0.02 4.33 1.70 -0.02 -4.71 118.95 118.46 1yli s ARG 132 Ca 0.67 -1.25 -0.30 0.00 -0.47 0.00 0.00 55.73 54.38 1yli s ARG 132 Cb -0.43 -0.52 -0.04 0.00 -0.57 0.00 0.00 34.95 33.38 1yli s ARG 132 CO 0.53 0.07 1.25 0.99 -1.08 0.00 0.00 175.30 177.06 1yli s THR 133 N -2.78 4.06 0.12 4.99 2.01 -1.26 -4.23 115.64 118.55 1yli s THR 133 Ca 0.09 1.43 -0.31 0.00 0.31 0.00 0.00 61.69 63.21 1yli s THR 133 Cb -0.01 -3.92 -0.10 0.00 0.01 0.00 0.00 72.50 68.49 1yli s THR 133 CO -0.00 0.02 1.70 -0.63 -0.69 0.00 0.00 174.62 175.01 1yli s ILE 134 N 2.03 2.71 0.29 1.82 1.01 -0.48 -4.94 121.20 123.64 1yli s ILE 134 Ca 0.58 0.30 -0.30 0.00 0.00 0.00 0.00 60.65 61.24 1yli s ILE 134 Cb -0.27 -3.20 -0.11 0.00 0.01 0.00 0.00 42.46 38.89 1yli s ILE 134 CO 0.25 0.01 1.52 -2.16 0.00 0.00 0.00 174.94 174.55 1yli s PRO 135 N 2.25 4.17 -0.01 2.79 0.04 -1.26 -4.93 135.00 138.06 1yli s PRO 135 Ca 0.75 2.48 0.15 0.00 0.04 0.00 0.00 61.00 64.42 1yli s PRO 135 Cb -0.43 -3.04 -0.19 0.00 0.04 0.00 0.00 34.50 30.88 1yli s PRO 135 CO 0.33 -0.54 0.51 0.54 0.04 0.00 0.00 177.00 177.89 1yli n ARG 136 N 1.90 1.51 -3.50 4.56 1.74 -1.26 -4.80 116.66 116.81 1yli n ARG 136 Ca 0.06 -0.05 -0.37 0.00 -0.77 0.00 0.00 57.85 56.72 1yli n ARG 136 Cb 0.39 -1.26 -0.07 0.00 -1.02 0.00 0.00 32.46 30.50 1yli n ARG 136 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1yli s GLU 137 N -2.64 4.18 -1.26 5.56 2.12 -1.26 -4.24 118.70 121.16 1yli s GLU 137 Ca 0.01 0.21 -0.06 0.00 0.36 0.00 0.00 54.97 55.49 1yli s GLU 137 Cb 0.11 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 31.10 1yli s GLU 137 CO 0.61 0.31 0.69 0.09 -0.54 0.00 0.00 175.26 176.42 1yli n ASN 138 N 3.26 -2.58 -3.67 -1.70 3.02 -1.26 -4.96 115.26 107.37 1yli n ASN 138 Ca -0.11 -0.90 -0.28 0.00 -0.03 0.00 0.00 54.58 53.25 1yli n ASN 138 Cb 0.52 -3.76 -0.12 0.00 -0.61 0.00 0.00 39.78 35.81 1yli n ASN 138 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1yli s ASN 139 N -4.04 3.34 0.27 6.41 3.84 -1.26 -4.97 114.94 118.54 1yli s ASN 139 Ca 0.17 -3.06 0.25 0.00 0.21 0.00 0.00 52.86 50.44 1yli s ASN 139 Cb -0.05 -1.02 0.90 0.00 -0.55 0.00 0.00 41.25 40.53 1yli s ASN 139 CO 0.84 -0.19 1.75 0.06 -2.79 0.00 0.00 177.10 176.77 1yli h GLN 140 N 6.09 0.00 -0.18 0.43 3.07 -1.94 -2.21 115.11 120.38 1yli h GLN 140 Ca 0.11 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.73 1yli h GLN 140 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.44 1yli h GLN 140 CO 0.51 0.00 -0.35 0.93 0.09 0.00 0.00 178.83 180.01 1yli h GLU 141 N 0.00 0.55 -0.45 0.06 3.07 -1.93 -1.35 114.58 114.53 1yli h GLU 141 Ca 0.00 -0.36 -0.00 0.00 -0.50 0.00 0.00 59.36 58.50 1yli h GLU 141 Cb 0.57 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.50 1yli h GLU 141 CO 0.00 0.97 0.28 1.25 -1.40 0.00 0.00 179.01 180.10 1yli h LEU 142 N 0.21 0.53 -0.33 1.33 5.85 -1.76 -2.00 115.31 119.14 1yli h LEU 142 Ca 0.01 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1yli h LEU 142 Cb 0.95 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1yli h LEU 142 CO 0.08 0.42 0.22 -0.33 -0.34 0.00 0.00 178.44 178.49 1yli h GLU 143 N 0.60 0.43 -0.49 1.25 5.08 -1.37 0.22 114.58 120.29 1yli h GLU 143 Ca 0.16 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.54 1yli h GLU 143 Cb -0.02 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.09 1yli h GLU 143 CO -0.03 0.28 0.24 -0.22 -1.00 0.00 0.00 179.01 178.28 1yli h LYS 144 N 0.44 0.45 0.22 2.33 3.64 -1.15 -0.54 116.57 121.97 1yli h LYS 144 Ca 0.12 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 1yli h LYS 144 Cb -0.05 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1yli h LYS 144 CO -0.03 0.30 -0.11 0.00 -2.27 0.00 0.00 179.45 177.34 1yli h ALA 145 N 1.28 -0.30 -0.67 5.00 0.00 -0.96 -1.96 119.26 121.65 1yli h ALA 145 Ca 0.22 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1yli h ALA 145 Cb 0.15 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1yli h ALA 145 CO -0.17 -0.62 0.44 -0.07 0.00 0.00 0.00 179.25 178.83 1yli h LEU 146 N -0.39 0.58 -0.32 0.00 3.38 -0.87 -0.51 115.31 117.17 1yli h LEU 146 Ca -0.03 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.77 1yli h LEU 146 Cb 0.30 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1yli h LEU 146 CO 0.05 0.37 -0.48 0.00 0.09 0.00 0.00 178.44 178.47 1yli h ALA 147 N 1.64 0.49 -0.74 1.53 0.00 -0.89 -1.13 119.26 120.17 1yli h ALA 147 Ca 0.29 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1yli h ALA 147 Cb 0.30 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1yli h ALA 147 CO -0.09 0.67 0.28 -0.07 0.00 0.00 0.00 179.25 180.03 1yli h LEU 148 N 0.70 1.03 -0.95 0.00 3.38 -0.83 -2.85 115.31 115.79 1yli h LEU 148 Ca 0.03 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 1yli h LEU 148 Cb 1.09 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1yli h LEU 148 CO 0.11 0.93 0.27 0.40 0.09 0.00 0.00 178.44 180.24 1yli h ILE 149 N 1.06 1.24 0.00 1.22 2.04 -0.97 -2.58 117.51 119.53 1yli h ILE 149 Ca 0.24 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.35 1yli h ILE 149 Cb 0.23 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 1yli h ILE 149 CO -0.02 0.30 0.00 -0.24 0.00 0.00 0.00 178.15 178.20 1yli n SER 150 N -4.29 0.00 0.05 1.72 2.88 -0.44 -3.15 113.62 110.39 1yli n SER 150 Ca 0.06 -0.41 0.00 0.00 -1.33 0.00 0.00 58.87 57.19 1yli n SER 150 Cb 0.18 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 1yli n SER 150 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1yli n GLU 151 N -0.74 0.00 0.00 -1.46 1.02 -1.05 -5.08 120.64 113.33 1yli n GLU 151 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1yli n GLU 151 Cb 0.01 -0.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 1yli n GLU 151 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31