#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h0r s LYS 2 N 0.00 3.80 -0.06 0.03 1.02 -1.26 -1.14 119.74 122.12 2h0r s LYS 2 Ca 0.00 0.03 0.01 0.00 0.02 0.00 0.00 55.97 56.03 2h0r s LYS 2 Cb 0.00 -3.27 0.02 0.00 -0.52 0.00 0.00 37.83 34.06 2h0r s LYS 2 CO 0.00 0.60 -0.06 0.99 -0.92 0.00 0.00 175.35 175.96 2h0r s THR 3 N -0.60 0.71 -0.20 2.17 2.01 -0.18 -0.21 115.64 119.35 2h0r s THR 3 Ca 0.17 -0.20 -0.15 0.00 0.31 0.00 0.00 61.69 61.82 2h0r s THR 3 Cb -0.13 -0.72 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 2h0r s THR 3 CO 0.05 0.27 0.34 -0.22 -0.69 0.00 0.00 174.62 174.38 2h0r s LEU 4 N 1.03 4.16 -0.26 4.42 2.96 -0.80 -0.45 118.68 129.74 2h0r s LEU 4 Ca -0.09 0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 54.22 2h0r s LEU 4 Cb -0.14 -2.43 0.01 0.00 0.50 0.00 0.00 46.19 44.13 2h0r s LEU 4 CO -0.00 -0.03 0.01 -0.63 -1.32 0.00 0.00 176.35 174.38 2h0r s ILE 5 N 1.14 3.55 -0.31 6.68 1.01 0.19 -0.33 121.20 133.13 2h0r s ILE 5 Ca 0.17 -0.70 -0.15 0.00 0.00 0.00 0.00 60.65 59.97 2h0r s ILE 5 Cb -0.14 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.54 2h0r s ILE 5 CO 0.07 0.21 0.35 -0.69 0.00 0.00 0.00 174.94 174.88 2h0r s VAL 6 N 1.46 5.18 -0.33 2.92 1.01 0.94 -1.27 120.40 130.30 2h0r s VAL 6 Ca 0.03 0.26 -0.12 0.00 0.00 0.00 0.00 61.98 62.15 2h0r s VAL 6 Cb -0.16 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2h0r s VAL 6 CO -0.01 0.03 0.23 -0.69 0.00 0.00 0.00 175.10 174.66 2h0r s VAL 7 N 2.02 5.20 -1.45 2.92 1.01 0.12 -0.62 120.40 129.61 2h0r s VAL 7 Ca 0.13 -0.22 -0.05 0.00 0.00 0.00 0.00 61.98 61.84 2h0r s VAL 7 Cb -0.16 -3.66 0.04 0.00 0.00 0.00 0.00 36.38 32.60 2h0r s VAL 7 CO 0.11 0.02 0.65 0.47 0.00 0.00 0.00 175.10 176.35 2h0r n ASP 8 N 5.09 -1.80 -3.66 3.32 9.92 -1.07 -1.61 116.55 126.74 2h0r n ASP 8 Ca -0.13 -0.91 -0.42 0.00 -0.53 0.00 0.00 54.79 52.80 2h0r n ASP 8 Cb 0.50 -3.44 -0.02 0.00 -0.64 0.00 0.00 41.12 37.52 2h0r n ASP 8 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 2h0r n MET 9 N -4.42 2.54 -4.30 -1.24 2.81 -1.26 -4.63 117.12 106.62 2h0r n MET 9 Ca -0.19 -2.34 -0.23 0.00 -1.81 0.00 0.00 57.70 53.13 2h0r n MET 9 Cb 0.63 -3.13 -0.07 0.00 -0.71 0.00 0.00 33.22 29.93 2h0r n MET 9 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2h0r s GLN 10 N 3.60 2.27 0.19 0.03 -0.21 -1.26 -0.95 119.66 123.33 2h0r s GLN 10 Ca 0.51 -1.44 -0.12 0.00 0.02 0.00 0.00 55.36 54.33 2h0r s GLN 10 Cb 0.14 -2.15 0.19 0.00 1.00 0.00 0.00 33.01 32.20 2h0r s GLN 10 CO -0.03 0.35 1.74 -0.91 -2.12 0.00 0.00 175.29 174.32 2h0r h ASN 11 N 1.89 0.16 0.57 5.90 2.35 -1.09 0.22 115.58 125.57 2h0r h ASN 11 Ca -0.44 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.38 2h0r h ASN 11 Cb 1.25 0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.68 2h0r h ASN 11 CO 0.61 0.11 0.00 0.44 -1.65 0.00 0.00 177.43 176.94 2h0r h ASP 12 N 0.34 0.00 0.00 5.81 3.32 -1.56 0.12 116.42 124.46 2h0r h ASP 12 Ca 0.25 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.12 2h0r h ASP 12 Cb 0.28 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 2h0r h ASP 12 CO -0.27 0.00 -2.12 0.49 -1.72 0.00 0.00 179.24 175.63 2h0r n PHE 13 N -3.07 0.00 -0.11 4.55 3.72 -0.60 -0.69 117.46 121.26 2h0r n PHE 13 Ca -0.01 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.21 2h0r n PHE 13 Cb 0.20 -0.71 -0.10 0.00 -0.94 0.00 0.00 39.48 37.94 2h0r n PHE 13 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 2h0r n ILE 14 N -2.46 1.29 -2.13 4.37 2.08 0.68 0.36 119.36 123.55 2h0r n ILE 14 Ca -0.18 -0.46 -0.41 0.00 0.56 0.00 0.00 62.75 62.27 2h0r n ILE 14 Cb 0.83 -1.40 -0.03 0.00 -0.75 0.00 0.00 39.64 38.30 2h0r n ILE 14 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 2h0r s SER 15 N -6.37 6.79 0.51 4.38 0.15 0.39 -4.17 113.70 115.38 2h0r s SER 15 Ca -0.31 2.57 0.26 0.00 0.70 0.00 0.00 55.95 59.17 2h0r s SER 15 Cb 0.09 -2.63 1.36 0.00 -1.71 0.00 0.00 66.02 63.13 2h0r s SER 15 CO 0.49 -0.58 1.94 -0.65 1.20 0.00 0.00 173.24 175.65 2h0r h PRO 16 N 4.61 0.08 0.00 5.44 0.11 -1.93 0.12 132.00 140.43 2h0r h PRO 16 Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2h0r h PRO 16 Cb 1.22 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2h0r h PRO 16 CO 0.74 0.05 -0.01 1.28 -0.21 0.00 0.00 178.00 179.84 2h0r n LEU 17 N -4.36 0.02 -4.73 2.35 4.77 -1.26 -4.82 117.00 108.98 2h0r n LEU 17 Ca 0.14 0.49 -0.31 0.00 -0.03 0.00 0.00 56.01 56.30 2h0r n LEU 17 Cb 0.73 -0.49 0.12 0.00 -2.33 0.00 0.00 43.42 41.46 2h0r n LEU 17 CO 0.37 0.00 0.68 -0.83 -1.33 0.00 0.00 177.39 176.28 2h0r s GLY 18 N -3.01 1.66 0.00 -0.72 0.00 0.43 -4.95 107.32 100.73 2h0r s GLY 18 Ca 0.14 0.24 0.28 0.00 0.00 0.00 0.00 44.72 45.37 2h0r s GLY 18 CO 0.54 0.65 1.71 -1.14 0.00 0.00 0.00 173.10 174.85 2h0r n SER 19 N -3.81 0.97 -2.71 1.64 3.41 -1.22 -4.07 113.62 107.83 2h0r n SER 19 Ca 0.09 -0.97 -0.09 0.00 -0.26 0.00 0.00 58.87 57.63 2h0r n SER 19 Cb 0.53 0.04 0.05 0.00 -0.26 0.00 0.00 64.21 64.58 2h0r n SER 19 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2h0r n LEU 20 N -0.53 0.34 -4.67 1.04 7.94 0.13 -4.89 117.00 116.36 2h0r n LEU 20 Ca 0.15 -3.72 -0.47 0.00 -1.11 0.00 0.00 56.01 50.86 2h0r n LEU 20 Cb 0.32 0.35 -0.04 0.00 0.53 0.00 0.00 43.42 44.57 2h0r n LEU 20 CO 0.23 1.72 1.33 0.41 -1.11 0.00 0.00 177.39 179.96 2h0r n THR 21 N -0.18 0.26 -2.59 1.96 -1.04 -1.11 -4.16 114.28 107.43 2h0r n THR 21 Ca 0.06 -0.05 -0.42 0.00 -2.04 0.00 0.00 64.05 61.60 2h0r n THR 21 Cb 0.82 -1.70 -0.03 0.00 -1.82 0.00 0.00 70.33 67.59 2h0r n THR 21 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2h0r s VAL 22 N 2.32 4.54 0.46 12.58 1.01 0.16 -5.00 120.40 136.47 2h0r s VAL 22 Ca 0.85 1.83 -0.24 0.00 0.00 0.00 0.00 61.98 64.42 2h0r s VAL 22 Cb -0.68 -4.17 -0.09 0.00 0.00 0.00 0.00 36.38 31.45 2h0r s VAL 22 CO 0.44 0.04 1.24 -2.65 0.00 0.00 0.00 175.10 174.17 2h0r n PRO 23 N 4.75 1.76 -1.20 2.72 -0.02 -1.26 -1.25 135.00 140.50 2h0r n PRO 23 Ca 0.09 0.63 -0.10 0.00 -2.02 0.00 0.00 63.50 62.10 2h0r n PRO 23 Cb 0.48 -2.38 -0.04 0.00 -0.02 0.00 0.00 33.50 31.54 2h0r n PRO 23 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2h0r n LYS 24 N -0.22 -1.44 -0.36 -0.52 4.01 -1.26 -4.84 118.16 113.53 2h0r n LYS 24 Ca 0.08 0.65 0.05 0.00 -0.51 0.00 0.00 58.31 58.58 2h0r n LYS 24 Cb 0.41 -4.77 0.21 0.00 -0.51 0.00 0.00 35.03 30.37 2h0r n LYS 24 CO 0.00 0.00 0.00 0.78 -1.11 0.00 0.00 177.40 177.07 2h0r h GLY 25 N 0.00 1.58 2.00 0.72 0.00 -1.46 -1.96 103.07 103.95 2h0r h GLY 25 Ca -0.20 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 46.66 2h0r h GLY 25 CO 0.30 0.23 -0.12 0.83 0.00 0.00 0.00 176.54 177.78 2h0r h GLU 26 N 1.06 0.00 -0.07 4.80 5.08 -1.83 -2.08 114.58 121.54 2h0r h GLU 26 Ca 0.47 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.85 2h0r h GLU 26 Cb 0.34 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 2h0r h GLU 26 CO -0.23 0.12 0.10 0.93 -1.00 0.00 0.00 179.01 178.94 2h0r h GLU 27 N 0.00 0.00 0.01 2.33 5.08 -1.74 -2.44 114.58 117.82 2h0r h GLU 27 Ca -0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 2h0r h GLU 27 Cb 0.32 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 2h0r h GLU 27 CO 0.02 0.00 -0.94 -0.07 -1.00 0.00 0.00 179.01 177.02 2h0r h LEU 28 N 0.00 0.09 -0.43 1.33 3.38 -1.52 -3.38 115.31 114.77 2h0r h LEU 28 Ca 0.03 -0.08 0.09 0.00 0.09 0.00 0.00 57.88 58.01 2h0r h LEU 28 Cb 0.23 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 40.87 2h0r h LEU 28 CO -0.00 0.97 -0.20 0.40 0.09 0.00 0.00 178.44 179.71 2h0r h ILE 29 N 0.03 0.41 -0.12 1.22 2.04 -1.59 0.11 117.51 119.61 2h0r h ILE 29 Ca -0.03 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 2h0r h ILE 29 Cb 1.63 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 2h0r h ILE 29 CO 0.13 0.00 -0.24 0.78 0.00 0.00 0.00 178.15 178.82 2h0r h ASN 30 N -0.11 0.42 0.22 1.72 2.35 -1.78 -0.72 115.58 117.68 2h0r h ASN 30 Ca 0.21 -0.56 0.01 0.00 -0.55 0.00 0.00 56.30 55.40 2h0r h ASN 30 Cb 0.43 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.64 2h0r h ASN 30 CO -0.50 0.90 -0.49 -0.65 -1.65 0.00 0.00 177.43 175.05 2h0r h PRO 31 N -0.05 -0.76 -0.74 0.81 0.11 -1.67 0.18 132.00 129.88 2h0r h PRO 31 Ca 0.00 0.05 0.12 0.00 0.11 0.00 0.00 66.00 66.28 2h0r h PRO 31 Cb 0.84 0.17 -0.08 0.00 0.11 0.00 0.00 31.00 32.04 2h0r h PRO 31 CO 0.05 -0.51 0.34 0.82 -0.21 0.00 0.00 178.00 178.50 2h0r h ILE 32 N -0.79 0.76 -0.94 4.15 2.04 -0.84 0.22 117.51 122.11 2h0r h ILE 32 Ca -0.01 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 2h0r h ILE 32 Cb 0.77 0.17 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 2h0r h ILE 32 CO -0.22 0.10 0.56 -1.28 0.00 0.00 0.00 178.15 177.31 2h0r h SER 33 N 0.54 1.14 -0.16 1.72 0.87 -0.58 0.80 113.55 117.89 2h0r h SER 33 Ca 0.39 -0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.86 2h0r h SER 33 Cb 0.50 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2h0r h SER 33 CO -0.33 0.88 0.04 0.44 -0.53 0.00 0.00 176.83 177.33 2h0r h ASP 34 N 1.30 0.25 -0.93 6.23 5.19 0.77 -3.16 116.42 126.07 2h0r h ASP 34 Ca 0.34 -0.24 0.10 0.00 -0.62 0.00 0.00 57.03 56.61 2h0r h ASP 34 Cb -0.04 -0.06 -0.07 0.00 0.18 0.00 0.00 39.33 39.34 2h0r h ASP 34 CO -0.06 0.42 0.60 0.25 -3.12 0.00 0.00 179.24 177.32 2h0r h LEU 35 N 0.06 0.86 -1.31 1.55 5.85 0.39 0.60 115.31 123.31 2h0r h LEU 35 Ca 0.05 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 2h0r h LEU 35 Cb 0.27 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2h0r h LEU 35 CO 0.00 0.50 -0.00 0.24 -0.34 0.00 0.00 178.44 178.84 2h0r h MET 36 N 0.95 0.46 -0.02 1.25 2.86 -0.85 -2.92 114.93 116.65 2h0r h MET 36 Ca 0.43 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.98 2h0r h MET 36 Cb 0.39 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2h0r h MET 36 CO -0.19 0.49 -0.26 1.04 1.06 0.00 0.00 176.91 179.04 2h0r n GLN 37 N -4.30 1.39 -2.08 1.72 6.02 0.03 -4.90 117.38 115.26 2h0r n GLN 37 Ca 0.01 -1.05 -0.42 0.00 -0.01 0.00 0.00 57.00 55.54 2h0r n GLN 37 Cb 0.23 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 29.98 2h0r n GLN 37 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2h0r s ASP 38 N -2.33 5.78 0.50 1.08 2.15 -0.18 -4.86 116.67 118.81 2h0r s ASP 38 Ca 0.25 0.90 0.15 0.00 0.43 0.00 0.00 52.55 54.28 2h0r s ASP 38 Cb 0.19 -2.53 1.20 0.00 -0.30 0.00 0.00 42.92 41.48 2h0r s ASP 38 CO 0.47 -1.87 2.12 0.00 -0.17 0.00 0.00 175.17 175.72 2h0r h ALA 39 N 13.12 1.93 0.00 3.66 0.00 -1.90 -2.36 119.26 133.71 2h0r h ALA 39 Ca -0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2h0r h ALA 39 Cb 1.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2h0r h ALA 39 CO 1.10 0.05 0.00 -0.25 0.00 0.00 0.00 179.25 180.16 2h0r n ASP 40 N -4.50 0.00 0.04 0.00 8.00 -1.26 -2.44 116.55 116.39 2h0r n ASP 40 Ca -0.03 0.27 0.11 0.00 0.71 0.00 0.00 54.79 55.86 2h0r n ASP 40 Cb 0.12 -0.33 0.01 0.00 -0.02 0.00 0.00 41.12 40.90 2h0r n ASP 40 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2h0r n ARG 41 N -1.33 0.38 -3.84 -1.24 5.12 -0.89 -4.97 116.66 109.89 2h0r n ARG 41 Ca 0.02 0.01 -0.28 0.00 -1.93 0.00 0.00 57.85 55.67 2h0r n ARG 41 Cb 0.05 -1.64 0.04 0.00 -1.16 0.00 0.00 32.46 29.75 2h0r n ARG 41 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2h0r n ASP 42 N -2.13 -5.00 -4.67 0.55 9.92 -1.02 -4.91 116.55 109.28 2h0r n ASP 42 Ca 0.01 -0.73 -0.42 0.00 -0.53 0.00 0.00 54.79 53.12 2h0r n ASP 42 Cb 0.47 -4.15 -0.03 0.00 -0.64 0.00 0.00 41.12 36.77 2h0r n ASP 42 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 2h0r s TRP 43 N -3.32 1.80 -0.00 1.24 0.23 -1.26 -4.39 118.94 113.23 2h0r s TRP 43 Ca 0.62 -0.14 -0.09 0.00 -2.03 0.00 0.00 56.10 54.46 2h0r s TRP 43 Cb -0.30 -4.15 -0.31 0.00 0.03 0.00 0.00 33.47 28.74 2h0r s TRP 43 CO 0.81 -4.91 0.85 1.25 0.96 0.00 0.00 176.95 175.91 2h0r h HIS 44 N 9.51 0.67 -4.01 -1.98 -0.00 -0.94 -3.47 115.15 114.92 2h0r h HIS 44 Ca -0.46 -0.49 -0.13 0.00 -0.00 0.00 0.00 60.37 59.28 2h0r h HIS 44 Cb 1.22 -0.03 -0.17 0.00 -0.00 0.00 0.00 27.41 28.43 2h0r h HIS 44 CO 0.87 1.52 -0.62 1.03 -0.00 0.00 0.00 177.93 180.72 2h0r s ARG 45 N -2.60 0.53 0.06 5.26 1.81 -1.15 -5.05 118.95 117.81 2h0r s ARG 45 Ca -0.11 -0.90 0.09 0.00 -1.72 0.00 0.00 55.73 53.09 2h0r s ARG 45 Cb 0.06 0.19 -0.03 0.00 -0.45 0.00 0.00 34.95 34.72 2h0r s ARG 45 CO 0.88 -0.11 -0.23 0.42 -0.68 0.00 0.00 175.30 175.57 2h0r s ILE 46 N -2.83 2.41 -0.02 1.52 1.01 -1.26 -1.90 121.20 120.13 2h0r s ILE 46 Ca -0.03 -1.39 0.02 0.00 0.00 0.00 0.00 60.65 59.24 2h0r s ILE 46 Cb 0.00 -1.99 0.01 0.00 0.01 0.00 0.00 42.46 40.49 2h0r s ILE 46 CO -0.06 0.30 -0.05 -0.69 0.00 0.00 0.00 174.94 174.44 2h0r s VAL 47 N -0.90 0.52 -0.06 2.92 1.01 0.55 -4.04 120.40 120.41 2h0r s VAL 47 Ca 0.13 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.94 2h0r s VAL 47 Cb -0.10 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 2h0r s VAL 47 CO 0.04 0.19 -0.12 0.68 0.00 0.00 0.00 175.10 175.89 2h0r s VAL 48 N 0.37 3.27 0.22 2.92 -7.23 -0.71 -0.04 120.40 119.20 2h0r s VAL 48 Ca -0.05 -0.64 0.07 0.00 -1.81 0.00 0.00 61.98 59.55 2h0r s VAL 48 Cb -0.09 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 2h0r s VAL 48 CO -0.00 0.59 0.12 0.42 -0.31 0.00 0.00 175.10 175.93 2h0r s THR 49 N -0.75 4.20 -0.02 5.32 -4.23 0.21 -1.30 115.64 119.07 2h0r s THR 49 Ca 0.12 -1.41 -0.00 0.00 -1.18 0.00 0.00 61.69 59.21 2h0r s THR 49 Cb -0.11 -3.22 0.03 0.00 1.34 0.00 0.00 72.50 70.55 2h0r s THR 49 CO 0.01 -0.27 0.03 -0.13 -0.54 0.00 0.00 174.62 173.72 2h0r s ARG 50 N -3.52 -0.02 0.09 3.99 0.52 -0.40 -2.59 118.95 117.02 2h0r s ARG 50 Ca 0.31 0.19 -0.31 0.00 -0.52 0.00 0.00 55.73 55.40 2h0r s ARG 50 Cb -0.08 -0.27 -0.09 0.00 0.52 0.00 0.00 34.95 35.03 2h0r s ARG 50 CO 0.23 -0.17 1.66 0.34 0.02 0.00 0.00 175.30 177.38 2h0r s ASP 51 N 1.11 6.57 -0.41 0.23 2.15 -1.26 -0.74 116.67 124.32 2h0r s ASP 51 Ca -0.09 2.55 0.06 0.00 0.43 0.00 0.00 52.55 55.50 2h0r s ASP 51 Cb -0.13 -2.57 0.20 0.00 -0.30 0.00 0.00 42.92 40.12 2h0r s ASP 51 CO -0.03 -0.89 0.42 1.87 -0.17 0.00 0.00 175.17 176.37 2h0r n TRP 52 N 5.33 -0.53 -3.48 -5.34 -0.00 0.66 -4.81 117.44 109.27 2h0r n TRP 52 Ca 0.16 -3.44 -0.32 0.00 -0.00 0.00 0.00 57.50 53.89 2h0r n TRP 52 Cb 0.40 -0.01 -0.05 0.00 -0.00 0.00 0.00 31.31 31.65 2h0r n TRP 52 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 177.69 176.68 2h0r s HIS 53 N -0.50 3.47 0.64 5.87 3.76 0.08 -3.26 115.29 125.35 2h0r s HIS 53 Ca 0.34 0.81 -0.11 0.00 -0.15 0.00 0.00 55.06 55.95 2h0r s HIS 53 Cb 0.09 -2.20 -0.03 0.00 1.11 0.00 0.00 32.58 31.55 2h0r s HIS 53 CO -0.16 0.34 1.04 -1.25 -0.85 0.00 0.00 174.74 173.87 2h0r s PRO 54 N -2.62 3.41 0.54 8.40 0.04 -1.26 0.48 135.00 143.98 2h0r s PRO 54 Ca 0.44 0.74 0.29 0.00 0.04 0.00 0.00 61.00 62.51 2h0r s PRO 54 Cb -0.12 -2.06 1.53 0.00 0.04 0.00 0.00 34.50 33.89 2h0r s PRO 54 CO 0.21 -0.71 2.10 0.66 0.04 0.00 0.00 177.00 179.30 2h0r h SER 55 N -0.42 0.00 -0.33 6.66 4.64 -1.96 -1.90 113.55 120.24 2h0r h SER 55 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2h0r h SER 55 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2h0r h SER 55 CO 0.61 0.10 0.00 0.54 -0.87 0.00 0.00 176.83 177.21 2h0r n ARG 56 N -3.59 3.00 -1.90 4.77 1.74 -1.26 -4.99 116.66 114.43 2h0r n ARG 56 Ca -0.02 -1.70 -0.38 0.00 -0.77 0.00 0.00 57.85 54.99 2h0r n ARG 56 Cb 0.22 -1.85 0.03 0.00 -1.02 0.00 0.00 32.46 29.84 2h0r n ARG 56 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2h0r s HIS 57 N -1.90 2.44 -0.81 -1.55 2.46 -0.72 -4.87 115.29 110.33 2h0r s HIS 57 Ca 0.30 1.40 0.21 0.00 0.47 0.00 0.00 55.06 57.44 2h0r s HIS 57 Cb 0.22 -3.71 0.86 0.00 -0.13 0.00 0.00 32.58 29.82 2h0r s HIS 57 CO 0.10 -2.58 1.66 1.51 -2.47 0.00 0.00 174.74 172.97 2h0r n ILE 58 N -0.83 0.71 1.12 0.89 3.06 -0.79 -2.55 119.36 120.98 2h0r n ILE 58 Ca 0.09 0.13 0.12 0.00 -2.50 0.00 0.00 62.75 60.59 2h0r n ILE 58 Cb 0.45 -0.90 0.28 0.00 0.54 0.00 0.00 39.64 40.01 2h0r n ILE 58 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 2h0r n SER 59 N -1.81 0.89 -4.66 9.51 3.41 -1.26 -4.80 113.62 114.89 2h0r n SER 59 Ca 0.04 -0.70 -0.40 0.00 -0.26 0.00 0.00 58.87 57.55 2h0r n SER 59 Cb 0.25 0.25 -0.06 0.00 -0.26 0.00 0.00 64.21 64.39 2h0r n SER 59 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2h0r s PHE 60 N -2.71 3.39 0.63 7.33 0.08 -1.06 -0.50 117.98 125.14 2h0r s PHE 60 Ca 0.18 0.97 0.31 0.00 0.12 0.00 0.00 56.93 58.51 2h0r s PHE 60 Cb 0.18 -2.82 1.70 0.00 -0.57 0.00 0.00 43.02 41.51 2h0r s PHE 60 CO 0.61 -0.17 2.01 0.00 -0.10 0.00 0.00 175.22 177.58 2h0r h ALA 61 N 7.44 1.60 0.00 5.36 0.00 -1.48 0.00 119.26 132.19 2h0r h ALA 61 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2h0r h ALA 61 Cb 1.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2h0r h ALA 61 CO 0.78 -0.37 0.00 1.17 0.00 0.00 0.00 179.25 180.83 2h0r n LYS 62 N -3.33 0.13 -1.05 0.00 3.00 -1.26 -2.60 118.16 113.04 2h0r n LYS 62 Ca 0.01 0.38 -0.15 0.00 -0.00 0.00 0.00 58.31 58.56 2h0r n LYS 62 Cb 0.39 -1.76 0.18 0.00 0.00 0.00 0.00 35.03 33.84 2h0r n LYS 62 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2h0r n ASN 63 N -2.00 3.35 -3.52 3.14 3.02 -0.01 -4.90 115.26 114.33 2h0r n ASN 63 Ca 0.02 -3.73 -0.07 0.00 -0.03 0.00 0.00 54.58 50.78 2h0r n ASN 63 Cb 0.20 -0.72 -0.08 0.00 -0.61 0.00 0.00 39.78 38.57 2h0r n ASN 63 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2h0r s HIS 64 N -3.32 -0.94 0.50 3.10 3.76 -1.07 -5.00 115.29 112.31 2h0r s HIS 64 Ca 0.51 1.44 -0.23 0.00 -0.15 0.00 0.00 55.06 56.63 2h0r s HIS 64 Cb 0.44 0.30 -0.07 0.00 1.11 0.00 0.00 32.58 34.36 2h0r s HIS 64 CO 0.04 -0.61 1.20 1.17 -0.85 0.00 0.00 174.74 175.70 2h0r n LYS 65 N 5.39 1.56 -3.26 1.40 3.00 -1.26 -2.97 118.16 122.03 2h0r n LYS 65 Ca -0.07 0.57 -0.23 0.00 -0.00 0.00 0.00 58.31 58.58 2h0r n LYS 65 Cb 0.50 -2.36 0.02 0.00 0.00 0.00 0.00 35.03 33.19 2h0r n LYS 65 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2h0r n ASP 66 N -0.35 -5.14 -3.74 3.14 8.00 -1.26 -4.97 116.55 112.23 2h0r n ASP 66 Ca 0.10 -0.38 -0.13 0.00 0.71 0.00 0.00 54.79 55.09 2h0r n ASP 66 Cb 0.43 -4.16 -0.13 0.00 -0.02 0.00 0.00 41.12 37.23 2h0r n ASP 66 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2h0r s LYS 67 N -5.94 0.20 0.37 -1.24 -0.14 -1.16 -5.08 119.74 106.76 2h0r s LYS 67 Ca 0.39 0.48 0.08 0.00 -1.36 0.00 0.00 55.97 55.56 2h0r s LYS 67 Cb -0.19 -0.09 -0.06 0.00 -1.68 0.00 0.00 37.83 35.81 2h0r s LYS 67 CO 0.48 -0.14 0.06 -1.21 -0.76 0.00 0.00 175.35 173.77 2h0r s GLU 68 N 1.09 2.09 0.58 1.68 0.41 -1.26 -4.57 118.70 118.71 2h0r s GLU 68 Ca -0.08 -1.85 -0.19 0.00 -0.41 0.00 0.00 54.97 52.44 2h0r s GLU 68 Cb -0.09 -1.89 -0.06 0.00 -1.78 0.00 0.00 34.13 30.32 2h0r s GLU 68 CO -0.07 0.03 0.99 -2.30 -0.49 0.00 0.00 175.26 173.42 2h0r n PRO 69 N -1.03 1.01 -0.41 0.39 -0.02 -1.26 -1.36 135.00 132.31 2h0r n PRO 69 Ca -0.03 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2h0r n PRO 69 Cb 0.64 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 2h0r n PRO 69 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2h0r n TYR 70 N -1.53 0.00 -1.63 6.00 4.02 0.13 -4.96 117.16 119.18 2h0r n TYR 70 Ca 0.13 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.71 2h0r n TYR 70 Cb 0.46 -0.67 0.04 0.00 -0.02 0.00 0.00 39.34 39.16 2h0r n TYR 70 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2h0r s SER 71 N -2.69 5.55 0.24 7.72 1.04 -0.46 -4.69 113.70 120.41 2h0r s SER 71 Ca 0.00 1.57 -0.03 0.00 0.48 0.00 0.00 55.95 57.98 2h0r s SER 71 Cb 0.00 -2.48 -0.05 0.00 0.10 0.00 0.00 66.02 63.59 2h0r s SER 71 CO 0.00 -1.33 0.46 0.28 0.98 0.00 0.00 173.24 173.64 2h0r s THR 72 N -3.08 5.12 -0.14 2.02 -1.32 -1.26 -1.44 115.64 115.55 2h0r s THR 72 Ca 0.57 -0.17 -0.15 0.00 -1.21 0.00 0.00 61.69 60.74 2h0r s THR 72 Cb -0.13 -3.73 0.04 0.00 -1.51 0.00 0.00 72.50 67.17 2h0r s THR 72 CO 0.55 -0.23 0.42 -0.47 -2.21 0.00 0.00 174.62 172.67 2h0r s TYR 73 N -1.96 -0.44 -0.43 9.09 5.04 -0.38 -4.85 117.35 123.42 2h0r s TYR 73 Ca 0.41 1.05 -0.17 0.00 -2.44 0.00 0.00 57.07 55.93 2h0r s TYR 73 Cb -0.11 0.16 0.03 0.00 0.35 0.00 0.00 41.96 42.39 2h0r s TYR 73 CO 0.29 -0.25 0.42 0.99 -1.34 0.00 0.00 175.55 175.66 2h0r s THR 74 N 0.05 5.12 0.32 4.34 2.01 -1.26 0.44 115.64 126.66 2h0r s THR 74 Ca -0.01 -0.49 -0.27 0.00 0.31 0.00 0.00 61.69 61.23 2h0r s THR 74 Cb -0.03 -4.04 -0.10 0.00 0.01 0.00 0.00 72.50 68.34 2h0r s THR 74 CO 0.01 -0.44 0.97 -0.31 -0.69 0.00 0.00 174.62 174.16 2h0r s TYR 75 N 2.02 3.67 -0.20 4.92 1.51 0.22 -4.90 117.35 124.60 2h0r s TYR 75 Ca 0.10 1.78 -0.02 0.00 -1.01 0.00 0.00 57.07 57.92 2h0r s TYR 75 Cb -0.18 -2.99 -0.00 0.00 -0.11 0.00 0.00 41.96 38.68 2h0r s TYR 75 CO 0.12 0.07 -0.09 -1.01 -1.11 0.00 0.00 175.55 173.53 2h0r s HIS 76 N -1.51 2.90 -0.27 2.71 3.76 -1.26 -1.32 115.29 120.29 2h0r s HIS 76 Ca 0.49 -1.07 -0.41 0.00 -0.15 0.00 0.00 55.06 53.92 2h0r s HIS 76 Cb -0.21 -2.03 -0.16 0.00 1.11 0.00 0.00 32.58 31.28 2h0r s HIS 76 CO 0.27 -0.57 1.68 0.45 -0.85 0.00 0.00 174.74 175.72 2h0r n SER 77 N 4.60 2.13 0.22 1.40 2.88 -0.47 -4.83 113.62 119.55 2h0r n SER 77 Ca -0.19 1.09 0.15 0.00 -1.33 0.00 0.00 58.87 58.59 2h0r n SER 77 Cb 0.51 -1.11 0.52 0.00 -0.75 0.00 0.00 64.21 63.38 2h0r n SER 77 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2h0r h PRO 78 N 6.62 0.00 -6.27 -1.46 0.13 -1.91 -3.44 132.00 125.67 2h0r h PRO 78 Ca -0.46 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.01 2h0r h PRO 78 Cb 1.33 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.49 2h0r h PRO 78 CO 0.94 0.00 0.88 -2.13 -0.23 0.00 0.00 178.00 177.46 2h0r n ARG 79 N -2.86 1.67 -1.65 0.86 3.00 -1.26 -4.90 116.66 111.51 2h0r n ARG 79 Ca 0.02 0.61 -0.57 0.00 -0.00 0.00 0.00 57.85 57.91 2h0r n ARG 79 Cb 0.35 -2.35 -0.07 0.00 0.00 0.00 0.00 32.46 30.38 2h0r n ARG 79 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2h0r n PRO 80 N 5.00 1.10 0.00 -0.14 -0.02 -1.26 -1.41 135.00 138.28 2h0r n PRO 80 Ca 0.22 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 2h0r n PRO 80 Cb 0.22 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2h0r n PRO 80 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h0r n GLY 81 N 4.71 1.89 3.63 -1.23 0.00 -1.26 -5.02 105.19 107.91 2h0r n GLY 81 Ca 0.30 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.93 2h0r n GLY 81 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2h0r s ASP 82 N -2.60 6.38 -0.04 1.61 2.15 -0.50 -4.94 116.67 118.72 2h0r s ASP 82 Ca 0.00 0.45 0.10 0.00 0.43 0.00 0.00 52.55 53.53 2h0r s ASP 82 Cb 0.00 -2.24 0.29 0.00 -0.30 0.00 0.00 42.92 40.67 2h0r s ASP 82 CO 0.00 -0.17 1.23 -0.90 -0.17 0.00 0.00 175.17 175.16 2h0r n ASP 83 N 5.05 2.91 -4.74 -0.34 5.68 -1.26 -4.48 116.55 119.37 2h0r n ASP 83 Ca -0.07 -2.26 -0.29 0.00 -0.50 0.00 0.00 54.79 51.67 2h0r n ASP 83 Cb 0.51 -0.26 0.15 0.00 -1.14 0.00 0.00 41.12 40.37 2h0r n ASP 83 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2h0r s SER 84 N -1.28 3.22 0.10 -1.12 1.04 -1.26 -4.84 113.70 109.56 2h0r s SER 84 Ca 0.23 1.12 -0.11 0.00 0.48 0.00 0.00 55.95 57.67 2h0r s SER 84 Cb 0.15 -1.75 0.01 0.00 0.10 0.00 0.00 66.02 64.52 2h0r s SER 84 CO 0.11 -2.75 0.24 0.42 0.98 0.00 0.00 173.24 172.24 2h0r s THR 85 N -3.12 0.12 0.02 2.02 -4.23 -1.26 -1.37 115.64 107.82 2h0r s THR 85 Ca 0.64 -1.03 0.01 0.00 -1.18 0.00 0.00 61.69 60.13 2h0r s THR 85 Cb -0.16 -1.30 -0.01 0.00 1.34 0.00 0.00 72.50 72.36 2h0r s THR 85 CO 0.55 -0.57 -0.05 -1.10 -0.54 0.00 0.00 174.62 172.92 2h0r s GLN 86 N -3.85 0.39 0.03 3.99 -0.21 -0.43 -4.96 119.66 114.61 2h0r s GLN 86 Ca 0.04 -0.46 -0.25 0.00 0.02 0.00 0.00 55.36 54.71 2h0r s GLN 86 Cb 0.04 -0.23 -0.05 0.00 1.00 0.00 0.00 33.01 33.77 2h0r s GLN 86 CO -0.11 0.05 0.78 -2.00 -2.12 0.00 0.00 175.29 171.89 2h0r s GLU 87 N -0.91 4.50 0.35 2.91 2.56 -1.26 0.71 118.70 127.56 2h0r s GLU 87 Ca -0.06 1.08 0.07 0.00 0.00 0.00 0.00 54.97 56.07 2h0r s GLU 87 Cb -0.06 -3.38 -0.03 0.00 2.00 0.00 0.00 34.13 32.65 2h0r s GLU 87 CO -0.00 0.22 0.27 0.20 -0.56 0.00 0.00 175.26 175.39 2h0r s GLY 88 N 0.17 2.45 -0.06 -1.50 0.00 0.17 -4.92 107.32 103.63 2h0r s GLY 88 Ca 0.40 -1.97 0.05 0.00 0.00 0.00 0.00 44.72 43.20 2h0r s GLY 88 CO 0.23 -1.53 -0.23 -0.42 0.00 0.00 0.00 173.10 171.15 2h0r s ILE 89 N -3.36 1.88 0.19 0.90 -1.09 -1.26 -1.25 121.20 117.21 2h0r s ILE 89 Ca 0.38 -0.96 -0.13 0.00 -2.23 0.00 0.00 60.65 57.71 2h0r s ILE 89 Cb 0.02 -1.60 -0.07 0.00 -1.58 0.00 0.00 42.46 39.23 2h0r s ILE 89 CO 0.27 0.53 0.58 -0.76 -1.23 0.00 0.00 174.94 174.32 2h0r s LEU 90 N -0.07 4.26 0.32 2.97 1.43 -0.52 -4.94 118.68 122.13 2h0r s LEU 90 Ca -0.05 1.06 0.10 0.00 -1.03 0.00 0.00 54.13 54.21 2h0r s LEU 90 Cb -0.13 -3.50 -0.05 0.00 0.03 0.00 0.00 46.19 42.53 2h0r s LEU 90 CO 0.04 0.01 -0.04 0.26 0.23 0.00 0.00 176.35 176.85 2h0r s TRP 91 N -1.63 2.51 0.62 0.29 0.52 0.34 0.19 118.94 121.78 2h0r s TRP 91 Ca 0.43 -0.39 -0.18 0.00 0.02 0.00 0.00 56.10 55.98 2h0r s TRP 91 Cb -0.13 -1.34 -0.04 0.00 -1.15 0.00 0.00 33.47 30.81 2h0r s TRP 91 CO 0.20 0.56 1.04 -2.30 0.02 0.00 0.00 176.95 176.46 2h0r n PRO 92 N -0.87 0.93 -1.68 4.98 -0.02 -1.26 -1.29 135.00 135.79 2h0r n PRO 92 Ca -0.05 0.36 -0.45 0.00 -2.02 0.00 0.00 63.50 61.35 2h0r n PRO 92 Cb 0.61 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 2h0r n PRO 92 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2h0r n VAL 93 N -1.81 0.87 -3.58 -1.45 0.31 -1.26 -4.87 118.33 106.53 2h0r n VAL 93 Ca 0.14 -0.22 -0.16 0.00 -0.01 0.00 0.00 64.34 64.10 2h0r n VAL 93 Cb 0.48 -1.51 -0.06 0.00 -0.91 0.00 0.00 33.84 31.83 2h0r n VAL 93 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 2h0r s HIS 94 N 0.03 -0.49 -1.64 3.52 -3.43 -1.26 -4.83 115.29 107.20 2h0r s HIS 94 Ca 0.69 0.73 -0.12 0.00 -0.80 0.00 0.00 55.06 55.56 2h0r s HIS 94 Cb -0.64 0.33 0.11 0.00 -1.43 0.00 0.00 32.58 30.94 2h0r s HIS 94 CO 0.48 -0.58 0.53 0.00 -2.00 0.00 0.00 174.74 173.18 2h0r s VAL 96 N -3.63 2.16 0.26 0.00 1.01 -1.26 -0.74 120.40 118.20 2h0r s VAL 96 Ca 0.45 0.12 -0.29 0.00 0.00 0.00 0.00 61.98 62.26 2h0r s VAL 96 Cb -0.25 -3.07 -0.14 0.00 0.00 0.00 0.00 36.38 32.91 2h0r s VAL 96 CO 0.95 0.01 1.12 2.29 0.00 0.00 0.00 175.10 179.47 2h0r n LYS 97 N 3.69 1.49 -2.41 2.72 2.85 0.18 -2.03 118.16 124.64 2h0r n LYS 97 Ca 0.14 0.52 -0.19 0.00 -1.05 0.00 0.00 58.31 57.74 2h0r n LYS 97 Cb 0.36 -1.98 -0.01 0.00 -0.65 0.00 0.00 35.03 32.76 2h0r n LYS 97 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2h0r n ASN 98 N 1.47 -5.49 -4.49 -5.58 3.02 -1.26 -5.01 115.26 97.91 2h0r n ASN 98 Ca 0.10 -0.04 -0.26 0.00 -0.03 0.00 0.00 54.58 54.36 2h0r n ASN 98 Cb 0.31 -4.52 -0.10 0.00 -0.61 0.00 0.00 39.78 34.85 2h0r n ASN 98 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2h0r s THR 99 N -2.96 2.70 0.14 3.41 -4.23 -0.86 -5.03 115.64 108.81 2h0r s THR 99 Ca 0.02 -2.03 -0.26 0.00 -1.18 0.00 0.00 61.69 58.25 2h0r s THR 99 Cb -0.01 -2.35 -0.04 0.00 1.34 0.00 0.00 72.50 71.44 2h0r s THR 99 CO 0.03 -0.21 1.32 1.87 -0.54 0.00 0.00 174.62 177.09 2h0r n TRP 100 N -0.14 -0.34 -0.29 3.99 -0.00 -1.26 -0.58 117.44 118.83 2h0r n TRP 100 Ca -0.10 1.07 0.32 0.00 -0.00 0.00 0.00 57.50 58.80 2h0r n TRP 100 Cb 0.57 -0.59 0.71 0.00 -0.00 0.00 0.00 31.31 32.01 2h0r n TRP 100 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 177.69 178.47 2h0r h GLY 101 N 0.00 0.16 1.48 5.87 0.00 -1.93 -0.02 103.07 108.62 2h0r h GLY 101 Ca 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2h0r h GLY 101 CO -0.81 -0.02 -0.33 -1.14 0.00 0.00 0.00 176.54 174.24 2h0r n SER 102 N -4.26 0.54 -4.76 0.19 3.41 0.26 -1.49 113.62 107.50 2h0r n SER 102 Ca 0.24 0.21 -0.41 0.00 -0.26 0.00 0.00 58.87 58.65 2h0r n SER 102 Cb 1.13 -0.16 -0.01 0.00 -0.26 0.00 0.00 64.21 64.91 2h0r n SER 102 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2h0r s GLN 103 N -3.08 4.17 0.36 4.33 -0.21 -0.02 -4.78 119.66 120.43 2h0r s GLN 103 Ca 0.10 2.48 -0.28 0.00 0.02 0.00 0.00 55.36 57.68 2h0r s GLN 103 Cb 0.15 -3.03 -0.11 0.00 1.00 0.00 0.00 33.01 31.02 2h0r s GLN 103 CO 0.65 -0.51 1.44 -0.51 -2.12 0.00 0.00 175.29 174.24 2h0r s LEU 104 N -1.07 4.35 0.49 2.90 1.43 -1.26 -1.32 118.68 124.19 2h0r s LEU 104 Ca 0.58 2.95 -0.21 0.00 -1.03 0.00 0.00 54.13 56.41 2h0r s LEU 104 Cb -0.45 -3.66 -0.09 0.00 0.03 0.00 0.00 46.19 42.01 2h0r s LEU 104 CO 0.52 -0.78 0.79 1.33 0.23 0.00 0.00 176.35 178.43 2h0r n VAL 105 N 0.64 2.50 -0.19 -1.59 0.24 -0.12 -4.36 118.33 115.45 2h0r n VAL 105 Ca 0.01 -0.50 -0.02 0.00 -2.04 0.00 0.00 64.34 61.79 2h0r n VAL 105 Cb 0.40 -0.91 0.08 0.00 -1.47 0.00 0.00 33.84 31.94 2h0r n VAL 105 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2h0r h ASP 106 N 0.88 0.31 -0.89 -1.34 3.32 -1.92 0.15 116.42 116.93 2h0r h ASP 106 Ca -0.45 0.05 0.13 0.00 0.02 0.00 0.00 57.03 56.78 2h0r h ASP 106 Cb 1.37 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.84 2h0r h ASP 106 CO 0.52 0.20 0.51 -0.61 -1.72 0.00 0.00 179.24 178.14 2h0r h GLN 107 N 0.47 0.76 0.01 3.56 5.75 -1.98 0.13 115.11 123.81 2h0r h GLN 107 Ca 0.27 -0.05 -0.11 0.00 -0.15 0.00 0.00 58.65 58.61 2h0r h GLN 107 Cb 0.26 -0.17 0.01 0.00 1.07 0.00 0.00 27.48 28.65 2h0r h GLN 107 CO -0.23 0.50 -0.45 0.82 -2.65 0.00 0.00 178.83 176.82 2h0r h ILE 108 N 0.78 1.49 -0.96 2.39 1.08 -1.51 -3.15 117.51 117.63 2h0r h ILE 108 Ca 0.46 -2.06 0.16 0.00 -0.39 0.00 0.00 64.86 63.03 2h0r h ILE 108 Cb 0.53 2.73 -0.09 0.00 -3.07 0.00 0.00 36.82 36.92 2h0r h ILE 108 CO -0.30 0.58 0.61 -0.03 -0.69 0.00 0.00 178.15 178.32 2h0r h MET 109 N -0.31 0.74 -0.11 2.37 4.05 0.22 0.26 114.93 122.15 2h0r h MET 109 Ca -0.06 -0.04 -0.21 0.00 -0.28 0.00 0.00 59.70 59.11 2h0r h MET 109 Cb 1.19 -0.17 0.01 0.00 -0.80 0.00 0.00 31.60 31.84 2h0r h MET 109 CO 0.09 0.49 -0.74 0.22 0.23 0.00 0.00 176.91 177.20 2h0r h ASP 110 N 0.77 0.84 -0.13 1.39 -0.00 -0.86 -0.01 116.42 118.42 2h0r h ASP 110 Ca 0.51 -0.66 0.03 0.00 -0.00 0.00 0.00 57.03 56.91 2h0r h ASP 110 Cb 0.77 -0.25 -0.03 0.00 -0.00 0.00 0.00 39.33 39.82 2h0r h ASP 110 CO -0.28 1.37 -0.05 -0.61 -0.00 0.00 0.00 179.24 179.68 2h0r h GLN 111 N 0.37 -0.02 -0.16 0.28 5.75 -1.27 -0.86 115.11 119.20 2h0r h GLN 111 Ca -0.06 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.48 2h0r h GLN 111 Cb 1.39 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.90 2h0r h GLN 111 CO 0.15 -0.01 -0.08 0.28 -2.65 0.00 0.00 178.83 176.52 2h0r h VAL 112 N -0.02 0.75 -0.40 2.39 2.07 -0.35 -1.89 116.25 118.80 2h0r h VAL 112 Ca 0.07 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 2h0r h VAL 112 Cb 0.12 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 2h0r h VAL 112 CO -0.15 0.00 0.20 0.58 0.02 0.00 0.00 177.57 178.22 2h0r h VAL 113 N -0.06 1.16 0.01 2.57 2.07 -0.82 0.89 116.25 122.07 2h0r h VAL 113 Ca 0.09 -0.45 -0.20 0.00 0.82 0.00 0.00 66.70 66.96 2h0r h VAL 113 Cb 0.19 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2h0r h VAL 113 CO -0.20 0.17 -0.92 0.71 0.02 0.00 0.00 177.57 177.36 2h0r h THR 114 N 0.51 1.62 -0.62 2.57 1.35 -1.10 -3.21 112.91 114.03 2h0r h THR 114 Ca 0.14 -3.02 0.00 0.00 -0.55 0.00 0.00 66.41 62.98 2h0r h THR 114 Cb 0.09 2.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 2h0r h THR 114 CO -0.02 0.87 0.00 0.29 -0.25 0.00 0.00 175.52 176.41 2h0r n LYS 115 N -3.50 2.58 -3.89 4.72 5.02 -0.72 -4.98 118.16 117.40 2h0r n LYS 115 Ca -0.01 -2.44 -0.28 0.00 -2.02 0.00 0.00 58.31 53.55 2h0r n LYS 115 Cb 0.86 -1.54 -0.00 0.00 -0.02 0.00 0.00 35.03 34.33 2h0r n LYS 115 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2h0r n HIS 116 N 1.52 -1.70 -2.71 2.13 8.25 0.22 -4.92 115.22 118.01 2h0r n HIS 116 Ca 0.22 0.62 -0.41 0.00 -0.26 0.00 0.00 57.72 57.89 2h0r n HIS 116 Cb 0.59 -3.59 -0.05 0.00 1.12 0.00 0.00 29.99 28.06 2h0r n HIS 116 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2h0r s ILE 117 N -3.80 4.32 0.24 1.59 1.01 -0.65 -5.00 121.20 118.91 2h0r s ILE 117 Ca 0.17 2.02 -0.31 0.00 0.00 0.00 0.00 60.65 62.53 2h0r s ILE 117 Cb -0.07 -4.29 -0.12 0.00 0.01 0.00 0.00 42.46 37.99 2h0r s ILE 117 CO 0.89 0.36 1.63 1.17 0.00 0.00 0.00 174.94 178.99 2h0r n LYS 118 N 2.42 2.64 -4.48 2.79 3.00 -1.26 -4.91 118.16 118.36 2h0r n LYS 118 Ca 0.01 0.95 -0.34 0.00 -0.00 0.00 0.00 58.31 58.93 2h0r n LYS 118 Cb 0.48 -2.75 -0.12 0.00 0.00 0.00 0.00 35.03 32.64 2h0r n LYS 118 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2h0r s ILE 119 N 0.54 3.75 -0.14 3.15 1.01 -1.26 -1.74 121.20 126.52 2h0r s ILE 119 Ca 0.70 -0.41 -0.01 0.00 0.00 0.00 0.00 60.65 60.92 2h0r s ILE 119 Cb -0.53 -2.62 -0.02 0.00 0.01 0.00 0.00 42.46 39.30 2h0r s ILE 119 CO 0.41 0.51 -0.10 -0.69 0.00 0.00 0.00 174.94 175.07 2h0r s VAL 120 N 0.20 3.29 -0.19 2.92 1.01 -0.42 -4.98 120.40 122.24 2h0r s VAL 120 Ca -0.03 -0.57 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 2h0r s VAL 120 Cb -0.14 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 2h0r s VAL 120 CO 0.03 0.51 0.06 -1.81 0.00 0.00 0.00 175.10 173.90 2h0r s ASP 121 N 0.43 5.55 0.26 3.32 1.01 -1.26 -1.28 116.67 124.71 2h0r s ASP 121 Ca -0.08 0.03 0.10 0.00 0.71 0.00 0.00 52.55 53.31 2h0r s ASP 121 Cb -0.15 -1.96 -0.04 0.00 1.01 0.00 0.00 42.92 41.77 2h0r s ASP 121 CO 0.04 0.14 -0.03 -1.59 0.21 0.00 0.00 175.17 173.94 2h0r s LYS 122 N 0.57 2.20 0.00 8.23 -2.85 0.08 -4.70 119.74 123.28 2h0r s LYS 122 Ca 0.03 -1.44 0.00 0.00 -1.00 0.00 0.00 55.97 53.56 2h0r s LYS 122 Cb -0.13 -2.12 0.00 0.00 -2.06 0.00 0.00 37.83 33.52 2h0r s LYS 122 CO 0.01 0.37 0.00 0.41 0.10 0.00 0.00 175.35 176.24 2h0r n GLY 123 N -0.78 0.73 0.30 0.59 0.00 -1.26 -0.24 105.19 104.53 2h0r n GLY 123 Ca -0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.89 2h0r n GLY 123 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2h0r h PHE 124 N 0.00 1.06 -3.33 1.61 3.57 -1.83 -3.37 116.94 114.65 2h0r h PHE 124 Ca 0.00 -0.08 -0.54 0.00 3.53 0.00 0.00 57.97 60.89 2h0r h PHE 124 Cb 0.00 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.41 2h0r h PHE 124 CO 0.00 0.82 0.45 -0.51 -2.23 0.00 0.00 178.31 176.84 2h0r s LEU 125 N -9.75 4.38 0.31 0.59 1.43 -1.26 -4.36 118.68 110.01 2h0r s LEU 125 Ca -0.13 1.84 0.02 0.00 -1.03 0.00 0.00 54.13 54.84 2h0r s LEU 125 Cb 0.14 -3.58 0.59 0.00 0.03 0.00 0.00 46.19 43.38 2h0r s LEU 125 CO 0.82 -0.34 1.88 0.74 0.23 0.00 0.00 176.35 179.68 2h0r h THR 126 N 4.59 0.98 -0.32 5.49 2.02 -1.94 -3.18 112.91 120.55 2h0r h THR 126 Ca -0.42 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.44 2h0r h THR 126 Cb 1.22 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 2h0r h THR 126 CO 0.77 0.17 0.00 -0.90 0.37 0.00 0.00 175.52 175.94 2h0r n ASP 127 N -4.54 1.77 -3.53 4.18 3.85 -1.26 -1.89 116.55 115.12 2h0r n ASP 127 Ca 0.16 -1.97 -0.17 0.00 -0.71 0.00 0.00 54.79 52.10 2h0r n ASP 127 Cb 0.30 -0.21 -0.06 0.00 -1.35 0.00 0.00 41.12 39.80 2h0r n ASP 127 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2h0r s ARG 128 N -1.58 1.02 0.29 0.11 1.70 -1.20 -4.90 118.95 114.39 2h0r s ARG 128 Ca 0.23 0.31 -0.17 0.00 -0.47 0.00 0.00 55.73 55.64 2h0r s ARG 128 Cb 0.12 0.48 -0.09 0.00 -0.57 0.00 0.00 34.95 34.90 2h0r s ARG 128 CO 0.16 -0.30 0.74 -2.00 -1.08 0.00 0.00 175.30 172.82 2h0r s GLU 129 N -1.06 4.10 -0.07 3.89 2.56 -1.26 -4.74 118.70 122.13 2h0r s GLU 129 Ca -0.10 0.75 0.03 0.00 0.00 0.00 0.00 54.97 55.65 2h0r s GLU 129 Cb -0.00 -2.57 0.01 0.00 2.00 0.00 0.00 34.13 33.56 2h0r s GLU 129 CO 0.09 0.23 -0.14 0.71 -0.56 0.00 0.00 175.26 175.59 2h0r s TYR 130 N -1.84 1.59 -0.22 5.30 1.51 -1.26 -1.60 117.35 120.83 2h0r s TYR 130 Ca 0.51 -0.59 0.05 0.00 -1.01 0.00 0.00 57.07 56.03 2h0r s TYR 130 Cb -0.12 -1.14 -0.17 0.00 -0.11 0.00 0.00 41.96 40.42 2h0r s TYR 130 CO 0.18 -0.28 -0.14 0.66 -1.11 0.00 0.00 175.55 174.86 2h0r n TYR 131 N 3.73 0.00 -2.62 2.71 4.01 -1.26 -4.76 117.16 118.98 2h0r n TYR 131 Ca -0.22 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.12 2h0r n TYR 131 Cb 0.52 -0.89 -0.05 0.00 -0.31 0.00 0.00 39.34 38.61 2h0r n TYR 131 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2h0r s SER 132 N -5.99 7.37 0.00 7.72 0.15 -1.26 -4.13 113.70 117.57 2h0r s SER 132 Ca -0.26 2.08 0.15 0.00 0.70 0.00 0.00 55.95 58.63 2h0r s SER 132 Cb 0.07 -2.61 0.75 0.00 -1.71 0.00 0.00 66.02 62.53 2h0r s SER 132 CO 0.58 -0.05 1.44 0.00 1.20 0.00 0.00 173.24 176.41 2h0r n ALA 133 N 1.12 1.83 -0.03 5.45 0.00 -1.26 -3.21 120.51 124.41 2h0r n ALA 133 Ca -0.01 -0.07 -0.11 0.00 0.00 0.00 0.00 53.44 53.26 2h0r n ALA 133 Cb 0.47 -1.25 -0.14 0.00 0.00 0.00 0.00 19.45 18.52 2h0r n ALA 133 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2h0r n PHE 134 N -1.32 0.86 -3.62 0.00 3.72 -1.26 -4.61 117.46 111.23 2h0r n PHE 134 Ca 0.07 0.29 -0.01 0.00 -0.05 0.00 0.00 57.45 57.74 2h0r n PHE 134 Cb 0.13 -1.15 -0.01 0.00 -0.94 0.00 0.00 39.48 37.51 2h0r n PHE 134 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 2h0r s HIS 135 N -2.58 -0.09 1.07 1.38 -3.43 -1.20 0.04 115.29 110.49 2h0r s HIS 135 Ca -0.08 -0.02 -0.16 0.00 -0.80 0.00 0.00 55.06 54.00 2h0r s HIS 135 Cb 0.08 0.54 0.22 0.00 -1.43 0.00 0.00 32.58 31.99 2h0r s HIS 135 CO 0.81 -0.31 1.13 0.16 -2.00 0.00 0.00 174.74 174.54 2h0r s ASP 136 N -2.70 2.07 0.09 7.38 3.84 -0.51 -4.03 116.67 122.81 2h0r s ASP 136 Ca 0.12 0.80 0.20 0.00 -0.00 0.00 0.00 52.55 53.67 2h0r s ASP 136 Cb 0.02 -1.20 0.82 0.00 -1.38 0.00 0.00 42.92 41.18 2h0r s ASP 136 CO -0.04 -3.43 1.62 2.30 -0.00 0.00 0.00 175.17 175.62 2h0r n ILE 137 N -4.32 0.78 1.08 2.11 -5.35 -0.63 -1.36 119.36 111.66 2h0r n ILE 137 Ca 0.10 0.17 0.12 0.00 -0.27 0.00 0.00 62.75 62.87 2h0r n ILE 137 Cb 0.59 -0.94 0.21 0.00 -1.74 0.00 0.00 39.64 37.76 2h0r n ILE 137 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 2h0r n TRP 138 N -1.76 0.00 -3.00 4.28 7.02 -1.26 -4.94 117.44 117.79 2h0r n TRP 138 Ca 0.04 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.31 2h0r n TRP 138 Cb 0.23 -0.15 0.01 0.00 -2.42 0.00 0.00 31.31 28.98 2h0r n TRP 138 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2h0r n ASN 139 N -1.11 -4.75 0.00 -0.99 2.85 -0.46 -4.94 115.26 105.85 2h0r n ASN 139 Ca 0.08 -0.22 0.00 0.00 -0.11 0.00 0.00 54.58 54.33 2h0r n ASN 139 Cb 0.35 -3.91 0.00 0.00 1.24 0.00 0.00 39.78 37.46 2h0r n ASN 139 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 2h0r n PHE 140 N -4.04 0.00 -2.42 1.20 0.99 -1.26 -4.87 117.46 107.06 2h0r n PHE 140 Ca -0.09 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 56.93 2h0r n PHE 140 Cb 0.59 -0.06 -0.02 0.00 -1.00 0.00 0.00 39.48 38.99 2h0r n PHE 140 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.76 175.18 2h0r s HIS 141 N -0.21 2.75 0.26 1.38 2.46 -1.26 -4.91 115.29 115.76 2h0r s HIS 141 Ca 0.00 0.93 -0.11 0.00 0.47 0.00 0.00 55.06 56.35 2h0r s HIS 141 Cb 0.00 -3.73 -0.07 0.00 -0.13 0.00 0.00 32.58 28.64 2h0r s HIS 141 CO 0.00 -1.71 0.60 0.15 -2.47 0.00 0.00 174.74 171.31 2h0r s LYS 142 N 3.90 3.84 0.06 2.88 3.01 -1.26 -1.42 119.74 130.74 2h0r s LYS 142 Ca 0.56 0.36 -0.01 0.00 -1.01 0.00 0.00 55.97 55.87 2h0r s LYS 142 Cb -0.19 -2.58 0.01 0.00 -1.01 0.00 0.00 37.83 34.06 2h0r s LYS 142 CO 0.19 0.25 0.08 0.25 0.51 0.00 0.00 175.35 176.64 2h0r n THR 143 N -0.31 0.00 0.26 2.17 -2.24 0.11 -4.92 114.28 109.34 2h0r n THR 143 Ca 0.01 -0.09 0.15 0.00 -2.27 0.00 0.00 64.05 61.85 2h0r n THR 143 Cb 0.53 -1.62 0.52 0.00 -2.10 0.00 0.00 70.33 67.66 2h0r n THR 143 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2h0r h ASP 144 N -0.08 0.00 0.63 3.42 3.58 -1.86 -3.40 116.42 118.71 2h0r h ASP 144 Ca -0.03 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.40 2h0r h ASP 144 Cb 0.08 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 2h0r h ASP 144 CO 0.02 0.01 -0.45 -0.03 -2.88 0.00 0.00 179.24 175.91 2h0r h MET 145 N 0.00 -1.01 -0.74 0.28 4.05 -1.86 -2.29 114.93 113.36 2h0r h MET 145 Ca -0.00 0.07 -0.00 0.00 -0.28 0.00 0.00 59.70 59.48 2h0r h MET 145 Cb 0.67 0.23 -0.04 0.00 -0.80 0.00 0.00 31.60 31.66 2h0r h MET 145 CO 0.00 -0.67 0.45 -0.97 0.23 0.00 0.00 176.91 175.95 2h0r h ASN 146 N -1.04 0.89 -0.29 1.39 -1.24 -1.89 -0.26 115.58 113.14 2h0r h ASN 146 Ca -0.08 -0.06 0.07 0.00 0.71 0.00 0.00 56.30 56.94 2h0r h ASN 146 Cb 0.87 -0.23 -0.07 0.00 0.73 0.00 0.00 38.32 39.61 2h0r h ASN 146 CO 0.03 0.69 -0.22 0.11 -1.29 0.00 0.00 177.43 176.75 2h0r h LYS 147 N 1.02 -0.20 0.05 6.67 1.79 -1.81 -0.19 116.57 123.90 2h0r h LYS 147 Ca 0.27 0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.78 2h0r h LYS 147 Cb -0.04 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.62 2h0r h LYS 147 CO -0.05 -0.13 -0.29 -0.92 -1.08 0.00 0.00 179.45 176.98 2h0r h TYR 148 N -0.20 -0.78 -0.45 -1.35 5.03 -0.60 0.69 116.97 119.31 2h0r h TYR 148 Ca 0.15 0.02 0.07 0.00 2.58 0.00 0.00 58.73 61.55 2h0r h TYR 148 Cb 0.44 0.34 -0.06 0.00 1.55 0.00 0.00 36.73 39.00 2h0r h TYR 148 CO -0.41 -0.38 0.12 -0.07 -1.32 0.00 0.00 178.16 176.10 2h0r h LEU 149 N -0.46 0.07 0.06 2.82 3.38 -0.82 -1.45 115.31 118.91 2h0r h LEU 149 Ca 0.05 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.11 2h0r h LEU 149 Cb 0.52 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 2h0r h LEU 149 CO -0.21 0.07 -0.31 -0.08 0.09 0.00 0.00 178.44 177.99 2h0r h GLU 150 N 0.26 -0.48 -0.82 1.13 4.81 -0.58 -0.95 114.58 117.94 2h0r h GLU 150 Ca 0.22 0.03 0.16 0.00 -0.13 0.00 0.00 59.36 59.64 2h0r h GLU 150 Cb 0.25 0.11 -0.10 0.00 0.63 0.00 0.00 28.75 29.64 2h0r h GLU 150 CO -0.26 -0.32 0.37 -0.22 -0.73 0.00 0.00 179.01 177.85 2h0r h LYS 151 N -0.50 0.48 -0.85 1.92 3.64 -0.19 -0.05 116.57 121.02 2h0r h LYS 151 Ca 0.04 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.19 2h0r h LYS 151 Cb 0.56 -0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 32.15 2h0r h LYS 151 CO -0.22 0.32 0.26 0.72 -2.27 0.00 0.00 179.45 178.26 2h0r n HIS 152 N -4.97 1.98 -3.04 1.91 8.25 -0.61 -4.92 115.22 113.81 2h0r n HIS 152 Ca 0.17 -1.06 -0.22 0.00 -0.26 0.00 0.00 57.72 56.35 2h0r n HIS 152 Cb 0.48 -0.61 0.04 0.00 1.12 0.00 0.00 29.99 31.02 2h0r n HIS 152 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2h0r n HIS 153 N -0.17 -1.98 -2.19 4.41 8.25 -0.03 -4.90 115.22 118.61 2h0r n HIS 153 Ca 0.34 0.55 -0.42 0.00 -0.26 0.00 0.00 57.72 57.93 2h0r n HIS 153 Cb 1.19 -4.44 -0.03 0.00 1.12 0.00 0.00 29.99 27.83 2h0r n HIS 153 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2h0r s THR 154 N -3.18 3.34 0.00 1.59 2.01 -0.42 -3.16 115.64 115.83 2h0r s THR 154 Ca 0.32 0.97 0.00 0.00 0.31 0.00 0.00 61.69 63.29 2h0r s THR 154 Cb -0.14 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.75 2h0r s THR 154 CO 0.39 0.08 0.00 -0.90 -0.69 0.00 0.00 174.62 173.50 2h0r n ASP 155 N 3.90 4.05 -4.18 3.53 3.85 -0.29 -4.80 116.55 122.60 2h0r n ASP 155 Ca 0.11 0.00 -0.25 0.00 -0.71 0.00 0.00 54.79 53.94 2h0r n ASP 155 Cb 0.43 0.70 -0.15 0.00 -1.35 0.00 0.00 41.12 40.75 2h0r n ASP 155 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.20 174.36 2h0r s GLU 156 N -1.67 1.47 -0.09 0.11 -1.05 -1.10 -1.53 118.70 114.84 2h0r s GLU 156 Ca 0.00 -0.65 0.03 0.00 -0.15 0.00 0.00 54.97 54.20 2h0r s GLU 156 Cb 0.00 -1.42 0.00 0.00 -0.44 0.00 0.00 34.13 32.27 2h0r s GLU 156 CO 0.00 0.39 -0.20 0.08 0.95 0.00 0.00 175.26 176.48 2h0r s VAL 157 N -0.43 1.74 -0.13 1.83 1.01 -0.20 -1.01 120.40 123.21 2h0r s VAL 157 Ca 0.07 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.22 2h0r s VAL 157 Cb -0.07 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 2h0r s VAL 157 CO -0.01 0.49 -0.12 -0.31 0.00 0.00 0.00 175.10 175.15 2h0r s TYR 158 N 0.48 2.83 -0.12 5.22 2.02 0.40 -0.75 117.35 127.42 2h0r s TYR 158 Ca -0.17 -0.57 0.01 0.00 -0.37 0.00 0.00 57.07 55.97 2h0r s TYR 158 Cb -0.17 -1.84 -0.01 0.00 -0.40 0.00 0.00 41.96 39.54 2h0r s TYR 158 CO 0.07 -0.17 -0.17 0.42 -1.57 0.00 0.00 175.55 174.13 2h0r s ILE 159 N 0.28 2.63 0.13 2.71 1.01 0.61 0.56 121.20 129.12 2h0r s ILE 159 Ca -0.09 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.77 2h0r s ILE 159 Cb -0.15 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.20 2h0r s ILE 159 CO 0.05 0.54 -0.03 0.68 0.00 0.00 0.00 174.94 176.18 2h0r s VAL 160 N 0.43 0.65 -0.35 2.92 -7.23 -0.40 -2.25 120.40 114.17 2h0r s VAL 160 Ca -0.13 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.09 2h0r s VAL 160 Cb -0.17 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 34.89 2h0r s VAL 160 CO 0.06 -0.69 0.00 0.61 -0.31 0.00 0.00 175.10 174.77 2h0r n GLY 161 N -0.13 0.20 3.10 2.32 0.00 0.10 0.15 105.19 110.94 2h0r n GLY 161 Ca -0.09 -1.89 -0.10 0.00 0.00 0.00 0.00 46.02 43.94 2h0r n GLY 161 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2h0r s VAL 162 N -0.55 0.13 -0.01 1.61 -7.23 -0.63 -2.85 120.40 110.87 2h0r s VAL 162 Ca 0.00 -1.04 -0.02 0.00 -1.81 0.00 0.00 61.98 59.11 2h0r s VAL 162 Cb 0.00 -0.79 -0.04 0.00 0.56 0.00 0.00 36.38 36.11 2h0r s VAL 162 CO 0.00 -0.57 0.17 0.00 -0.31 0.00 0.00 175.10 174.39 2h0r s ALA 163 N -2.37 3.91 0.21 1.32 0.00 -1.26 -4.31 121.76 119.25 2h0r s ALA 163 Ca -0.07 -0.78 -0.12 0.00 0.00 0.00 0.00 51.96 50.99 2h0r s ALA 163 Cb -0.03 -1.84 0.27 0.00 0.00 0.00 0.00 23.12 21.53 2h0r s ALA 163 CO -0.04 0.74 1.65 1.25 0.00 0.00 0.00 175.76 179.37 2h0r h LEU 164 N 3.83 -0.40 -1.65 0.00 5.85 -1.44 -0.48 115.31 121.01 2h0r h LEU 164 Ca -0.49 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.40 2h0r h LEU 164 Cb 1.19 0.32 0.00 0.00 0.37 0.00 0.00 40.66 42.53 2h0r h LEU 164 CO 0.68 -0.16 0.00 -1.84 -0.34 0.00 0.00 178.44 176.79 2h0r n GLU 165 N -5.34 2.14 0.00 1.25 0.00 -1.26 -1.94 120.64 115.49 2h0r n GLU 165 Ca 0.08 -1.52 0.00 0.00 0.00 0.00 0.00 57.16 55.72 2h0r n GLU 165 Cb 0.34 -1.41 0.00 0.00 0.00 0.00 0.00 31.44 30.37 2h0r n GLU 165 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2h0r n TYR 166 N 0.65 0.00 -0.11 -1.84 4.01 -0.23 -4.81 117.16 114.84 2h0r n TYR 166 Ca 0.14 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.95 2h0r n TYR 166 Cb 0.41 0.00 0.41 0.00 -0.31 0.00 0.00 39.34 39.85 2h0r n TYR 166 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2h0r h VAL 168 N 0.62 0.15 -0.35 0.00 2.07 -1.63 -1.32 116.25 115.79 2h0r h VAL 168 Ca 0.25 -0.20 0.07 0.00 0.82 0.00 0.00 66.70 67.64 2h0r h VAL 168 Cb 0.22 0.18 -0.06 0.00 -1.52 0.00 0.00 31.29 30.11 2h0r h VAL 168 CO -0.07 0.01 -0.06 0.50 0.02 0.00 0.00 177.57 177.97 2h0r h LYS 169 N -1.16 0.03 -0.88 1.57 3.64 -1.01 -0.61 116.57 118.15 2h0r h LYS 169 Ca -0.10 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2h0r h LYS 169 Cb 0.78 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.55 2h0r h LYS 169 CO 0.17 0.02 0.58 0.00 -2.27 0.00 0.00 179.45 177.94 2h0r h ALA 170 N 1.33 1.12 -0.34 5.00 0.00 -1.05 -1.18 119.26 124.14 2h0r h ALA 170 Ca 0.17 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 2h0r h ALA 170 Cb 0.25 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2h0r h ALA 170 CO -0.34 0.50 -0.33 1.15 0.00 0.00 0.00 179.25 180.23 2h0r h THR 171 N 1.18 1.29 -0.42 0.00 2.02 -0.81 -1.92 112.91 114.24 2h0r h THR 171 Ca 0.32 -1.50 -0.00 0.00 0.77 0.00 0.00 66.41 66.00 2h0r h THR 171 Cb -0.12 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 2h0r h THR 171 CO -0.08 0.49 0.25 0.00 0.37 0.00 0.00 175.52 176.56 2h0r h ALA 172 N 0.74 0.54 0.08 6.16 0.00 -0.65 -1.05 119.26 125.07 2h0r h ALA 172 Ca 0.06 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2h0r h ALA 172 Cb 0.92 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2h0r h ALA 172 CO 0.08 0.04 -0.04 0.82 0.00 0.00 0.00 179.25 180.15 2h0r h ILE 173 N 0.55 1.00 -0.51 0.00 2.04 -1.21 -1.11 117.51 118.28 2h0r h ILE 173 Ca 0.15 -0.28 0.10 0.00 1.00 0.00 0.00 64.86 65.83 2h0r h ILE 173 Cb 0.01 1.19 -0.09 0.00 -0.74 0.00 0.00 36.82 37.19 2h0r h ILE 173 CO -0.03 0.07 -0.09 0.28 0.00 0.00 0.00 178.15 178.39 2h0r h SER 174 N -0.23 -0.39 -0.17 1.72 0.02 -1.12 0.14 113.55 113.51 2h0r h SER 174 Ca -0.01 0.14 0.04 0.00 -0.84 0.00 0.00 61.79 61.12 2h0r h SER 174 Cb 0.20 0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.98 2h0r h SER 174 CO 0.02 -0.14 -0.07 0.00 -1.14 0.00 0.00 176.83 175.50 2h0r h ALA 175 N 1.49 0.08 -0.77 3.77 0.00 -0.92 -1.44 119.26 121.47 2h0r h ALA 175 Ca 0.25 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.24 2h0r h ALA 175 Cb 0.38 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2h0r h ALA 175 CO -0.49 -0.50 0.51 0.00 0.00 0.00 0.00 179.25 178.76 2h0r h ALA 176 N 1.12 0.99 0.00 0.00 0.00 -0.32 -1.51 119.26 119.53 2h0r h ALA 176 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2h0r h ALA 176 Cb 0.18 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2h0r h ALA 176 CO -0.20 0.37 0.00 0.39 0.00 0.00 0.00 179.25 179.81 2h0r n GLU 177 N -4.56 0.12 -0.46 0.00 1.02 0.40 -0.73 120.64 116.43 2h0r n GLU 177 Ca 0.08 0.33 0.10 0.00 -0.02 0.00 0.00 57.16 57.65 2h0r n GLU 177 Cb 0.03 -1.72 0.32 0.00 -0.02 0.00 0.00 31.44 30.06 2h0r n GLU 177 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2h0r n LEU 178 N -1.95 4.07 -2.87 -4.62 4.77 -0.58 -4.94 117.00 110.88 2h0r n LEU 178 Ca 0.03 -2.04 -0.12 0.00 -0.03 0.00 0.00 56.01 53.85 2h0r n LEU 178 Cb 0.23 -0.51 0.06 0.00 -2.33 0.00 0.00 43.42 40.87 2h0r n LEU 178 CO 0.19 0.85 0.05 0.61 -1.33 0.00 0.00 177.39 177.76 2h0r n GLY 179 N 1.38 -0.49 3.57 -0.72 0.00 0.09 -5.05 105.19 103.97 2h0r n GLY 179 Ca 0.24 0.22 -0.34 0.00 0.00 0.00 0.00 46.02 46.14 2h0r n GLY 179 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2h0r s TYR 180 N -3.29 2.92 -0.43 1.61 1.51 -0.65 -5.01 117.35 114.01 2h0r s TYR 180 Ca 0.21 -0.01 -0.27 0.00 -1.01 0.00 0.00 57.07 55.99 2h0r s TYR 180 Cb -0.03 -1.72 -0.05 0.00 -0.11 0.00 0.00 41.96 40.06 2h0r s TYR 180 CO 0.57 0.31 2.15 0.21 -1.11 0.00 0.00 175.55 177.68 2h0r s LYS 181 N -0.75 2.64 -0.17 -0.62 2.20 -0.58 -4.22 119.74 118.24 2h0r s LYS 181 Ca 0.12 1.39 -0.04 0.00 -0.36 0.00 0.00 55.97 57.08 2h0r s LYS 181 Cb -0.11 -4.43 -0.02 0.00 -1.51 0.00 0.00 37.83 31.75 2h0r s LYS 181 CO 0.01 -2.67 -0.04 0.99 -0.36 0.00 0.00 175.35 173.29 2h0r s THR 182 N 9.81 3.72 -0.01 3.43 2.01 -1.26 -1.04 115.64 132.30 2h0r s THR 182 Ca 0.89 -0.41 0.06 0.00 0.31 0.00 0.00 61.69 62.54 2h0r s THR 182 Cb -0.21 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.64 2h0r s THR 182 CO 0.28 0.47 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.61 2h0r s THR 183 N 0.67 1.49 -0.14 -0.82 2.01 0.07 -1.78 115.64 117.13 2h0r s THR 183 Ca -0.02 -0.84 -0.01 0.00 0.31 0.00 0.00 61.69 61.12 2h0r s THR 183 Cb -0.14 -1.25 -0.02 0.00 0.01 0.00 0.00 72.50 71.10 2h0r s THR 183 CO 0.02 0.39 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.55 2h0r s VAL 184 N -0.48 3.20 -0.70 3.82 1.01 -1.04 -0.29 120.40 125.93 2h0r s VAL 184 Ca 0.07 -0.60 -0.16 0.00 0.00 0.00 0.00 61.98 61.29 2h0r s VAL 184 Cb -0.07 -2.37 0.17 0.00 0.00 0.00 0.00 36.38 34.11 2h0r s VAL 184 CO -0.00 0.51 0.68 -0.76 0.00 0.00 0.00 175.10 175.52 2h0r s LEU 185 N 0.49 6.28 0.24 3.92 1.43 -0.95 -2.65 118.68 127.43 2h0r s LEU 185 Ca -0.08 -2.16 -0.08 0.00 -1.03 0.00 0.00 54.13 50.79 2h0r s LEU 185 Cb -0.15 -2.23 0.40 0.00 0.03 0.00 0.00 46.19 44.24 2h0r s LEU 185 CO 0.04 -0.78 1.64 -0.07 0.23 0.00 0.00 176.35 177.41 2h0r h LEU 186 N 8.63 -0.33 -1.79 1.79 3.38 -0.74 -0.05 115.31 126.20 2h0r h LEU 186 Ca -0.09 0.19 0.32 0.00 0.09 0.00 0.00 57.88 58.38 2h0r h LEU 186 Cb 1.07 0.33 -0.06 0.00 0.09 0.00 0.00 40.66 42.08 2h0r h LEU 186 CO 0.93 -0.16 0.78 0.44 0.09 0.00 0.00 178.44 180.51 2h0r h ASP 187 N 0.11 0.14 -0.83 -0.43 5.19 -0.79 0.14 116.42 119.95 2h0r h ASP 187 Ca 0.39 0.03 -0.44 0.00 -0.62 0.00 0.00 57.03 56.39 2h0r h ASP 187 Cb 0.68 0.01 -0.26 0.00 0.18 0.00 0.00 39.33 39.94 2h0r h ASP 187 CO -0.63 0.02 0.46 -1.22 -3.12 0.00 0.00 179.24 174.75 2h0r n TYR 188 N -4.33 2.57 -4.26 4.55 4.02 -0.03 -4.94 117.16 114.73 2h0r n TYR 188 Ca 0.25 -1.84 -0.14 0.00 -0.01 0.00 0.00 57.90 56.15 2h0r n TYR 188 Cb 1.12 -0.85 -0.10 0.00 -0.02 0.00 0.00 39.34 39.49 2h0r n TYR 188 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2h0r s THR 189 N -3.36 0.53 -0.17 -0.72 -4.23 0.03 -0.72 115.64 107.00 2h0r s THR 189 Ca 0.54 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.95 2h0r s THR 189 Cb 0.46 -2.38 0.05 0.00 1.34 0.00 0.00 72.50 71.98 2h0r s THR 189 CO 0.07 -0.22 0.43 -0.13 -0.54 0.00 0.00 174.62 174.23 2h0r s ARG 190 N -4.00 0.45 0.23 3.99 1.81 -1.13 -4.97 118.95 115.32 2h0r s ARG 190 Ca 0.31 0.73 -0.21 0.00 -1.72 0.00 0.00 55.73 54.84 2h0r s ARG 190 Cb 0.07 0.09 -0.08 0.00 -0.45 0.00 0.00 34.95 34.57 2h0r s ARG 190 CO 0.09 -0.12 0.76 -1.25 -0.68 0.00 0.00 175.30 174.10 2h0r s PRO 191 N 0.95 4.33 0.28 3.54 0.04 -1.26 -1.30 135.00 141.58 2h0r s PRO 191 Ca -0.06 0.97 -0.02 0.00 0.04 0.00 0.00 61.00 61.93 2h0r s PRO 191 Cb -0.06 -2.90 0.39 0.00 0.04 0.00 0.00 34.50 31.97 2h0r s PRO 191 CO -0.08 0.39 1.86 0.82 0.04 0.00 0.00 177.00 180.03 2h0r h ILE 192 N 2.78 1.22 -3.04 0.56 2.04 -1.94 -3.41 117.51 115.72 2h0r h ILE 192 Ca -0.48 -0.71 -0.57 0.00 1.00 0.00 0.00 64.86 64.11 2h0r h ILE 192 Cb 1.19 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 2h0r h ILE 192 CO 0.65 0.28 0.99 -0.55 0.00 0.00 0.00 178.15 179.53 2h0r s SER 193 N -6.50 6.64 0.05 1.72 0.15 -1.26 -4.79 113.70 109.72 2h0r s SER 193 Ca -0.10 1.34 0.11 0.00 0.70 0.00 0.00 55.95 58.00 2h0r s SER 193 Cb 0.16 -2.54 0.48 0.00 -1.71 0.00 0.00 66.02 62.41 2h0r s SER 193 CO 0.80 -1.08 1.34 -0.90 1.20 0.00 0.00 173.24 174.60 2h0r n ASP 194 N 7.67 0.12 -4.61 5.45 5.75 -1.26 -4.58 116.55 125.09 2h0r n ASP 194 Ca 0.15 0.54 -0.43 0.00 -0.01 0.00 0.00 54.79 55.04 2h0r n ASP 194 Cb 0.46 -0.56 -0.02 0.00 -1.03 0.00 0.00 41.12 39.97 2h0r n ASP 194 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2h0r s ASP 195 N -3.22 6.24 -1.41 -1.12 3.68 -1.26 -4.91 116.67 114.66 2h0r s ASP 195 Ca 0.03 1.08 -0.09 0.00 2.13 0.00 0.00 52.55 55.70 2h0r s ASP 195 Cb 0.06 -2.53 0.07 0.00 -1.45 0.00 0.00 42.92 39.06 2h0r s ASP 195 CO 0.18 -1.47 2.34 -0.81 0.13 0.00 0.00 175.17 175.54 2h0r n PRO 196 N 8.08 3.76 0.00 4.34 -0.05 -1.26 -2.85 135.00 147.01 2h0r n PRO 196 Ca 0.18 -3.01 0.00 0.00 -0.05 0.00 0.00 63.50 60.62 2h0r n PRO 196 Cb 0.47 -2.89 0.00 0.00 -0.05 0.00 0.00 33.50 31.03 2h0r n PRO 196 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 175.50 173.54 2h0r n GLU 197 N 3.66 0.00 -0.20 0.54 4.07 -1.26 -4.81 120.64 122.63 2h0r n GLU 197 Ca 0.58 0.00 0.10 0.00 -0.06 0.00 0.00 57.16 57.77 2h0r n GLU 197 Cb 0.30 -0.17 0.39 0.00 -0.06 0.00 0.00 31.44 31.91 2h0r n GLU 197 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 2h0r h VAL 198 N 0.00 0.93 -0.91 6.31 2.07 -1.90 -0.78 116.25 121.96 2h0r h VAL 198 Ca 0.00 -0.23 0.18 0.00 0.82 0.00 0.00 66.70 67.47 2h0r h VAL 198 Cb 0.00 0.19 -0.07 0.00 -1.52 0.00 0.00 31.29 29.89 2h0r h VAL 198 CO 0.00 0.12 0.59 0.40 0.02 0.00 0.00 177.57 178.70 2h0r h ILE 199 N 0.68 0.73 0.05 4.57 2.04 -1.88 -1.78 117.51 121.92 2h0r h ILE 199 Ca 0.36 -0.18 -0.25 0.00 1.00 0.00 0.00 64.86 65.79 2h0r h ILE 199 Cb 0.49 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 2h0r h ILE 199 CO -0.14 0.10 -1.22 0.78 0.00 0.00 0.00 178.15 177.67 2h0r h ASN 200 N 0.53 0.16 0.08 1.72 2.35 -1.50 -1.24 115.58 117.69 2h0r h ASN 200 Ca 0.48 -0.19 -0.09 0.00 -0.55 0.00 0.00 56.30 55.95 2h0r h ASN 200 Cb 1.00 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.31 2h0r h ASN 200 CO -0.21 1.15 -0.29 0.11 -1.65 0.00 0.00 177.43 176.55 2h0r h LYS 201 N 0.03 0.33 -0.03 0.81 1.57 -1.12 0.10 116.57 118.26 2h0r h LYS 201 Ca -0.11 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.51 2h0r h LYS 201 Cb 1.88 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 34.18 2h0r h LYS 201 CO 0.15 0.59 -0.14 0.28 -0.57 0.00 0.00 179.45 179.76 2h0r h VAL 202 N 0.29 1.49 -0.80 0.50 2.07 -1.41 -2.45 116.25 115.94 2h0r h VAL 202 Ca 0.04 -1.63 0.07 0.00 0.82 0.00 0.00 66.70 66.00 2h0r h VAL 202 Cb 0.66 2.48 -0.05 0.00 -1.52 0.00 0.00 31.29 32.86 2h0r h VAL 202 CO 0.05 0.44 0.52 0.50 0.02 0.00 0.00 177.57 179.10 2h0r h LYS 203 N -0.45 0.82 0.00 1.57 3.64 -0.90 0.40 116.57 121.66 2h0r h LYS 203 Ca -0.01 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 2h0r h LYS 203 Cb 0.80 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2h0r h LYS 203 CO 0.03 0.54 -0.05 1.49 -2.27 0.00 0.00 179.45 179.19 2h0r h GLU 204 N 0.84 0.03 -0.69 1.90 4.81 -0.90 -3.16 114.58 117.42 2h0r h GLU 204 Ca 0.35 -0.04 0.18 0.00 -0.13 0.00 0.00 59.36 59.72 2h0r h GLU 204 Cb 0.27 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.63 2h0r h GLU 204 CO -0.12 0.86 0.48 1.49 -0.73 0.00 0.00 179.01 180.98 2h0r h GLU 205 N -0.78 0.14 -0.15 1.92 4.81 -0.88 -1.29 114.58 118.37 2h0r h GLU 205 Ca -0.01 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2h0r h GLU 205 Cb 0.88 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.22 2h0r h GLU 205 CO 0.01 0.09 -0.08 -0.07 -0.73 0.00 0.00 179.01 178.24 2h0r h LEU 206 N 0.15 0.32 -1.66 1.64 3.38 -0.97 -3.18 115.31 114.98 2h0r h LEU 206 Ca 0.33 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2h0r h LEU 206 Cb 1.11 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 2h0r h LEU 206 CO -0.05 0.67 -0.18 0.11 0.09 0.00 0.00 178.44 179.08 2h0r h LYS 207 N -0.03 0.00 0.00 1.13 1.57 -1.22 -1.09 116.57 116.94 2h0r h LYS 207 Ca 0.03 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 2h0r h LYS 207 Cb 0.55 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 2h0r h LYS 207 CO 0.02 0.18 -0.12 0.00 -0.57 0.00 0.00 179.45 178.96 2h0r h ALA 208 N 1.82 1.46 -0.56 3.86 0.00 -1.42 -0.30 119.26 124.12 2h0r h ALA 208 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2h0r h ALA 208 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2h0r h ALA 208 CO 0.02 0.15 0.00 0.72 0.00 0.00 0.00 179.25 180.15 2h0r n HIS 209 N -3.90 1.36 -0.84 0.00 8.25 -0.43 -4.92 115.22 114.74 2h0r n HIS 209 Ca -0.02 -0.53 0.00 0.00 -0.26 0.00 0.00 57.72 56.91 2h0r n HIS 209 Cb 0.22 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.08 2h0r n HIS 209 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2h0r n ASN 210 N 0.91 -1.66 -4.74 0.41 2.85 -0.12 -4.87 115.26 108.03 2h0r n ASN 210 Ca 0.23 0.00 -0.42 0.00 -0.11 0.00 0.00 54.58 54.28 2h0r n ASN 210 Cb 0.82 -1.57 -0.02 0.00 1.24 0.00 0.00 39.78 40.25 2h0r n ASN 210 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2h0r s ILE 211 N -2.09 2.46 -0.12 -1.44 1.01 -1.10 -4.85 121.20 115.07 2h0r s ILE 211 Ca 0.00 0.36 -0.04 0.00 0.00 0.00 0.00 60.65 60.98 2h0r s ILE 211 Cb 0.00 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.20 2h0r s ILE 211 CO 0.00 0.05 0.02 0.54 0.00 0.00 0.00 174.94 175.55 2h0r s ASN 212 N 0.69 5.35 -0.61 3.58 4.22 -0.74 -3.69 114.94 123.74 2h0r s ASN 212 Ca 0.65 0.12 0.01 0.00 -2.14 0.00 0.00 52.86 51.50 2h0r s ASN 212 Cb -0.44 -1.67 0.15 0.00 1.28 0.00 0.00 41.25 40.57 2h0r s ASN 212 CO 0.40 0.31 0.40 -0.69 -2.04 0.00 0.00 177.10 175.48 2h0r s VAL 213 N -0.47 3.21 0.44 3.54 1.01 -1.26 -2.49 120.40 124.37 2h0r s VAL 213 Ca 0.09 -3.33 0.02 0.00 0.00 0.00 0.00 61.98 58.75 2h0r s VAL 213 Cb -0.12 -3.13 -0.00 0.00 0.00 0.00 0.00 36.38 33.13 2h0r s VAL 213 CO 0.02 -0.88 0.64 0.68 0.00 0.00 0.00 175.10 175.57 2h0r s VAL 214 N -0.42 3.87 -0.01 2.92 -7.23 -1.08 -4.93 120.40 113.52 2h0r s VAL 214 Ca 0.19 -0.61 -0.02 0.00 -1.81 0.00 0.00 61.98 59.73 2h0r s VAL 214 Cb -0.20 -3.41 -0.01 0.00 0.56 0.00 0.00 36.38 33.31 2h0r s VAL 214 CO -0.04 -0.27 0.36 0.44 -0.31 0.00 0.00 175.10 175.29 2h0r h ASP 215 N 0.46 -0.06 -0.02 4.85 3.32 -1.93 -0.54 116.42 122.50 2h0r h ASP 215 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2h0r h ASP 215 Cb 1.26 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.82 2h0r h ASP 215 CO 0.56 0.01 0.00 1.17 -1.72 0.00 0.00 179.24 179.26