#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2art s GLU 2 N 0.00 2.82 0.32 2.12 2.12 -1.26 0.34 118.70 125.16 2art s GLU 2 Ca 0.00 -0.55 0.04 0.00 0.36 0.00 0.00 54.97 54.82 2art s GLU 2 Cb 0.00 -2.68 -0.03 0.00 0.26 0.00 0.00 34.13 31.68 2art s GLU 2 CO 0.00 0.65 0.20 0.20 -0.54 0.00 0.00 175.26 175.77 2art s GLY 3 N -1.26 2.20 -0.21 -1.50 0.00 -0.68 -4.12 107.32 101.75 2art s GLY 3 Ca 0.17 -1.78 -0.05 0.00 0.00 0.00 0.00 44.72 43.05 2art s GLY 3 CO 0.07 -1.57 0.01 0.50 0.00 0.00 0.00 173.10 172.11 2art s ARG 4 N -3.69 3.59 -0.37 2.90 0.52 0.31 -1.49 118.95 120.71 2art s ARG 4 Ca 0.36 -0.52 -0.13 0.00 -0.52 0.00 0.00 55.73 54.91 2art s ARG 4 Cb 0.04 -3.13 0.00 0.00 0.52 0.00 0.00 34.95 32.38 2art s ARG 4 CO 0.20 -0.06 0.26 -1.17 0.02 0.00 0.00 175.30 174.54 2art s LEU 5 N 1.21 4.76 -0.33 2.53 2.96 -0.89 -0.89 118.68 128.03 2art s LEU 5 Ca 0.03 -0.68 -0.05 0.00 -0.22 0.00 0.00 54.13 53.21 2art s LEU 5 Cb -0.15 -2.13 0.04 0.00 0.50 0.00 0.00 46.19 44.46 2art s LEU 5 CO 0.01 -0.34 0.08 -0.76 -1.32 0.00 0.00 176.35 174.02 2art s LEU 6 N 1.68 4.20 -0.91 -0.68 1.43 0.23 -0.42 118.68 124.21 2art s LEU 6 Ca 0.05 -1.16 -0.05 0.00 -1.03 0.00 0.00 54.13 51.95 2art s LEU 6 Cb -0.18 -1.83 0.10 0.00 0.03 0.00 0.00 46.19 44.31 2art s LEU 6 CO 0.10 -0.31 2.55 0.18 0.23 0.00 0.00 176.35 179.10 2art n LEU 7 N 4.77 7.30 -4.53 1.79 4.77 -1.26 -1.58 117.00 128.25 2art n LEU 7 Ca -0.13 -4.52 -0.43 0.00 -0.03 0.00 0.00 56.01 50.90 2art n LEU 7 Cb 0.44 -1.29 -0.04 0.00 -2.33 0.00 0.00 43.42 40.19 2art n LEU 7 CO 0.30 1.91 0.70 -0.22 -1.33 0.00 0.00 177.39 178.75 2art s LEU 8 N -2.23 4.15 0.09 2.23 2.96 -1.24 -4.97 118.68 119.67 2art s LEU 8 Ca 0.56 -0.25 0.07 0.00 -0.22 0.00 0.00 54.13 54.29 2art s LEU 8 Cb 0.28 -2.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.03 2art s LEU 8 CO -0.16 -1.13 -0.19 -0.70 -1.32 0.00 0.00 176.35 172.86 2art s GLU 9 N 3.75 1.02 -0.37 1.98 2.12 -1.26 -4.51 118.70 121.42 2art s GLU 9 Ca 0.31 -1.09 0.12 0.00 0.36 0.00 0.00 54.97 54.67 2art s GLU 9 Cb -0.12 -1.19 0.39 0.00 0.26 0.00 0.00 34.13 33.47 2art s GLU 9 CO 0.21 0.27 1.00 2.41 -0.54 0.00 0.00 175.26 178.61 2art n THR 10 N 1.15 0.29 -0.66 -1.70 -1.04 -1.26 -5.06 114.28 106.00 2art n THR 10 Ca -0.20 -2.91 -0.31 0.00 -2.04 0.00 0.00 64.05 58.59 2art n THR 10 Cb 0.54 0.61 0.18 0.00 -1.82 0.00 0.00 70.33 69.84 2art n THR 10 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2art n PRO 11 N -0.00 -1.04 0.00 -2.82 -0.02 -1.24 -1.77 135.00 128.11 2art n PRO 11 Ca 0.11 -0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 2art n PRO 11 Cb 0.76 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 2art n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2art n GLY 12 N 1.05 2.62 2.41 -1.23 0.00 -1.26 -4.83 105.19 103.95 2art n GLY 12 Ca 0.07 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 2art n GLY 12 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2art n ASN 13 N 0.69 -0.05 -0.30 1.61 2.85 -0.73 -4.98 115.26 114.35 2art n ASN 13 Ca 0.00 -2.50 0.04 0.00 -0.11 0.00 0.00 54.58 52.01 2art n ASN 13 Cb 0.00 -0.58 0.18 0.00 1.24 0.00 0.00 39.78 40.62 2art n ASN 13 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 2art h THR 14 N 4.27 0.89 -0.68 -0.44 2.02 -1.88 -1.85 112.91 115.23 2art h THR 14 Ca 0.23 -0.27 0.05 0.00 0.77 0.00 0.00 66.41 67.19 2art h THR 14 Cb 0.89 0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.29 2art h THR 14 CO 0.42 0.14 0.45 0.03 0.37 0.00 0.00 175.52 176.93 2art h ARG 15 N 0.79 0.73 -0.01 6.66 3.08 -1.89 0.28 114.38 124.03 2art h ARG 15 Ca 0.42 -0.04 -0.20 0.00 0.07 0.00 0.00 59.98 60.22 2art h ARG 15 Cb 0.41 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 2art h ARG 15 CO -0.26 0.49 -0.87 1.98 -1.07 0.00 0.00 179.97 180.23 2art h MET 16 N 0.76 0.28 -0.32 0.04 4.05 -1.70 -2.44 114.93 115.60 2art h MET 16 Ca 0.28 -0.29 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 2art h MET 16 Cb 0.17 0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.03 2art h MET 16 CO -0.09 0.99 0.16 1.03 0.23 0.00 0.00 176.91 179.23 2art h SER 17 N 0.16 0.41 0.18 1.39 0.87 -0.56 -0.85 113.55 115.15 2art h SER 17 Ca -0.05 -0.12 -0.07 0.00 -1.23 0.00 0.00 61.79 60.32 2art h SER 17 Cb 1.49 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 63.33 2art h SER 17 CO 0.14 0.41 -0.28 -0.07 -0.53 0.00 0.00 176.83 176.50 2art h LEU 18 N 0.38 0.16 -0.83 2.23 3.38 -1.00 -2.02 115.31 117.61 2art h LEU 18 Ca 0.11 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2art h LEU 18 Cb 0.10 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2art h LEU 18 CO -0.01 0.44 0.08 0.00 0.09 0.00 0.00 178.44 179.04 2art h ALA 19 N 1.57 1.03 -0.52 1.53 0.00 -0.90 -1.81 119.26 120.16 2art h ALA 19 Ca 0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2art h ALA 19 Cb 0.57 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2art h ALA 19 CO 0.04 0.62 0.28 1.88 0.00 0.00 0.00 179.25 182.06 2art h TYR 20 N 0.90 0.73 0.21 0.00 0.05 -0.49 -0.79 116.97 117.58 2art h TYR 20 Ca 0.18 -0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.95 2art h TYR 20 Cb 0.41 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.89 2art h TYR 20 CO 0.03 0.55 -0.31 0.22 -1.05 0.00 0.00 178.16 177.60 2art h ASP 21 N 0.70 -0.86 0.14 3.88 3.58 -0.94 -0.15 116.42 122.78 2art h ASP 21 Ca 0.18 0.09 -0.05 0.00 0.42 0.00 0.00 57.03 57.67 2art h ASP 21 Cb 0.07 0.31 -0.01 0.00 1.72 0.00 0.00 39.33 41.42 2art h ASP 21 CO -0.03 -0.41 -0.19 -0.08 -2.88 0.00 0.00 179.24 175.65 2art h GLU 22 N -0.58 0.10 -0.14 0.28 4.81 -1.26 -1.86 114.58 115.93 2art h GLU 22 Ca 0.01 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2art h GLU 22 Cb 0.57 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 2art h GLU 22 CO -0.13 0.29 -0.02 0.00 -0.73 0.00 0.00 179.01 178.43 2art h ALA 23 N 1.71 0.19 -0.09 2.92 0.00 -0.47 0.31 119.26 123.84 2art h ALA 23 Ca 0.02 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 2art h ALA 23 Cb 0.40 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2art h ALA 23 CO 0.03 -0.08 -0.21 -0.84 0.00 0.00 0.00 179.25 178.14 2art h ILE 24 N -0.03 1.20 0.08 0.00 3.07 -0.78 -0.71 117.51 120.34 2art h ILE 24 Ca 0.04 -0.91 -0.00 0.00 1.55 0.00 0.00 64.86 65.53 2art h ILE 24 Cb 0.42 1.36 0.00 0.00 -0.27 0.00 0.00 36.82 38.33 2art h ILE 24 CO 0.01 0.27 -0.04 0.22 -1.05 0.00 0.00 178.15 177.56 2art h TYR 25 N 0.14 -0.10 0.00 0.16 3.20 -1.07 -3.07 116.97 116.23 2art h TYR 25 Ca 0.03 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 2art h TYR 25 Cb 0.46 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.76 2art h TYR 25 CO 0.00 0.40 -0.16 0.00 -1.64 0.00 0.00 178.16 176.76 2art h ARG 26 N -0.67 0.00 0.00 1.82 3.08 -0.18 -2.99 114.38 115.45 2art h ARG 26 Ca -0.01 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.86 2art h ARG 26 Cb 0.54 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 2art h ARG 26 CO 0.02 0.16 -0.90 0.77 -1.07 0.00 0.00 179.97 178.95 2art h SER 27 N 0.00 0.00 -2.13 7.04 0.02 -1.22 -3.46 113.55 113.80 2art h SER 27 Ca -0.00 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.32 2art h SER 27 Cb 0.61 0.00 0.08 0.00 0.14 0.00 0.00 62.40 63.23 2art h SER 27 CO 0.02 0.82 0.41 0.33 -1.14 0.00 0.00 176.83 177.27 2art n PHE 28 N -3.27 1.61 -4.39 3.45 -0.00 -1.13 -4.99 117.46 108.75 2art n PHE 28 Ca -0.01 0.58 -0.29 0.00 -0.00 0.00 0.00 57.45 57.74 2art n PHE 28 Cb 0.88 -2.35 -0.13 0.00 -0.00 0.00 0.00 39.48 37.88 2art n PHE 28 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 2art s GLN 29 N -0.21 1.44 0.04 -4.13 -0.21 -1.26 -4.94 119.66 110.38 2art s GLN 29 Ca 0.73 -1.36 -0.36 0.00 0.02 0.00 0.00 55.36 54.40 2art s GLN 29 Cb -0.80 -1.91 -0.14 0.00 1.00 0.00 0.00 33.01 31.16 2art s GLN 29 CO 0.50 0.45 1.59 0.98 -2.12 0.00 0.00 175.29 176.69 2art n TYR 30 N 0.84 2.05 0.00 0.91 9.36 -1.26 -1.33 117.16 127.72 2art n TYR 30 Ca -0.17 0.35 0.00 0.00 3.32 0.00 0.00 57.90 61.40 2art n TYR 30 Cb 0.53 -2.50 0.00 0.00 -0.63 0.00 0.00 39.34 36.74 2art n TYR 30 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2art n GLY 31 N 3.46 1.89 3.52 2.98 0.00 -1.26 -5.07 105.19 110.70 2art n GLY 31 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 2art n GLY 31 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2art s ASP 32 N -1.51 1.10 0.21 1.61 1.01 -0.44 -4.95 116.67 113.70 2art s ASP 32 Ca 0.00 1.29 -0.30 0.00 0.71 0.00 0.00 52.55 54.26 2art s ASP 32 Cb 0.00 -2.00 -0.09 0.00 1.01 0.00 0.00 42.92 41.84 2art s ASP 32 CO 0.00 -4.10 1.19 -0.54 0.21 0.00 0.00 175.17 171.94 2art s LYS 33 N -4.69 4.50 0.72 8.23 1.02 -1.26 -4.80 119.74 123.46 2art s LYS 33 Ca 0.68 1.90 -0.16 0.00 0.02 0.00 0.00 55.97 58.41 2art s LYS 33 Cb -0.22 -3.22 0.03 0.00 -0.52 0.00 0.00 37.83 33.90 2art s LYS 33 CO 0.62 -0.05 1.19 -2.30 -0.92 0.00 0.00 175.35 173.89 2art n PRO 34 N 2.14 0.65 -5.02 -1.68 -0.02 -1.26 -4.68 135.00 125.13 2art n PRO 34 Ca 0.03 0.29 -0.27 0.00 -2.02 0.00 0.00 63.50 61.52 2art n PRO 34 Cb 0.44 -2.43 -0.16 0.00 -0.02 0.00 0.00 33.50 31.34 2art n PRO 34 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2art s ILE 35 N -1.74 1.64 -0.12 4.25 1.01 0.40 -0.53 121.20 126.11 2art s ILE 35 Ca 0.77 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 60.54 2art s ILE 35 Cb -0.34 -1.37 0.03 0.00 0.01 0.00 0.00 42.46 40.78 2art s ILE 35 CO 0.46 0.47 -0.06 -0.22 0.00 0.00 0.00 174.94 175.59 2art s LEU 36 N -0.40 1.16 -0.02 2.97 2.96 -0.07 -1.12 118.68 124.17 2art s LEU 36 Ca 0.06 -0.34 0.08 0.00 -0.22 0.00 0.00 54.13 53.71 2art s LEU 36 Cb -0.09 -0.79 -0.02 0.00 0.50 0.00 0.00 46.19 45.79 2art s LEU 36 CO -0.00 -0.14 -0.25 -0.60 -1.32 0.00 0.00 176.35 174.03 2art s ARG 37 N 1.74 2.02 -0.06 1.98 3.52 0.36 -0.60 118.95 127.91 2art s ARG 37 Ca 0.04 -0.91 0.06 0.00 -0.13 0.00 0.00 55.73 54.79 2art s ARG 37 Cb -0.13 -1.97 -0.01 0.00 -1.56 0.00 0.00 34.95 31.28 2art s ARG 37 CO -0.08 0.54 -0.24 -0.06 -0.81 0.00 0.00 175.30 174.65 2art s PHE 38 N -0.60 2.46 0.11 5.12 0.08 -0.62 -0.03 117.98 124.50 2art s PHE 38 Ca 0.10 -0.70 -0.22 0.00 0.12 0.00 0.00 56.93 56.22 2art s PHE 38 Cb -0.10 -1.61 0.06 0.00 -0.57 0.00 0.00 43.02 40.81 2art s PHE 38 CO -0.01 -0.20 0.56 1.52 -0.10 0.00 0.00 175.22 176.99 2art s TYR 39 N -0.17 -0.47 0.12 0.36 1.13 -0.78 -3.61 117.35 113.93 2art s TYR 39 Ca -0.03 0.37 0.06 0.00 -1.41 0.00 0.00 57.07 56.06 2art s TYR 39 Cb -0.14 0.44 -0.04 0.00 -1.10 0.00 0.00 41.96 41.13 2art s TYR 39 CO 0.04 -0.75 -0.15 1.03 -2.51 0.00 0.00 175.55 173.20 2art s ARG 40 N -3.20 1.04 0.10 -3.49 0.52 -1.26 -1.89 118.95 110.77 2art s ARG 40 Ca -0.01 -1.22 0.08 0.00 -0.52 0.00 0.00 55.73 54.05 2art s ARG 40 Cb -0.00 -0.98 -0.03 0.00 0.52 0.00 0.00 34.95 34.46 2art s ARG 40 CO -0.08 0.20 -0.21 -1.01 0.02 0.00 0.00 175.30 174.22 2art s HIS 41 N -1.97 1.78 0.87 -0.53 3.76 -1.26 -3.69 115.29 114.25 2art s HIS 41 Ca 0.08 -0.41 -0.13 0.00 -0.15 0.00 0.00 55.06 54.45 2art s HIS 41 Cb -0.06 -0.98 0.14 0.00 1.11 0.00 0.00 32.58 32.79 2art s HIS 41 CO 0.03 0.19 1.22 0.34 -0.85 0.00 0.00 174.74 175.68 2art s ASP 42 N -1.85 3.86 -0.37 1.40 -1.08 -1.26 -2.48 116.67 114.90 2art s ASP 42 Ca 0.06 0.45 -0.23 0.00 -0.52 0.00 0.00 52.55 52.32 2art s ASP 42 Cb -0.10 -0.74 -0.11 0.00 -1.46 0.00 0.00 42.92 40.51 2art s ASP 42 CO 0.04 -2.27 1.31 0.54 0.52 0.00 0.00 175.17 175.31 2art n ARG 43 N -3.47 0.00 -3.81 4.34 1.74 -1.23 -4.40 116.66 109.82 2art n ARG 43 Ca 0.12 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.11 2art n ARG 43 Cb 0.60 -0.85 -0.07 0.00 -1.02 0.00 0.00 32.46 31.12 2art n ARG 43 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2art s SER 44 N 3.91 0.04 -0.11 0.55 0.01 0.84 -1.39 113.70 117.55 2art s SER 44 Ca 0.71 -0.56 0.02 0.00 1.31 0.00 0.00 55.95 57.43 2art s SER 44 Cb -0.81 0.36 0.02 0.00 0.21 0.00 0.00 66.02 65.79 2art s SER 44 CO 0.35 -0.74 -0.15 -0.69 0.41 0.00 0.00 173.24 172.43 2art s VAL 45 N -3.72 1.47 -0.21 3.43 1.01 0.10 0.23 120.40 122.71 2art s VAL 45 Ca 0.04 -0.62 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 2art s VAL 45 Cb 0.04 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 35.08 2art s VAL 45 CO -0.10 0.44 -0.12 -0.63 0.00 0.00 0.00 175.10 174.68 2art s ILE 46 N 1.04 2.61 0.27 2.22 1.01 0.54 -2.03 121.20 126.87 2art s ILE 46 Ca -0.06 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 59.79 2art s ILE 46 Cb -0.15 -2.19 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 2art s ILE 46 CO -0.02 0.43 0.42 0.27 0.00 0.00 0.00 174.94 176.04 2art s ILE 47 N 1.35 5.21 0.79 2.92 -4.36 -0.47 -1.53 121.20 125.11 2art s ILE 47 Ca 0.04 -0.81 -0.12 0.00 -0.26 0.00 0.00 60.65 59.50 2art s ILE 47 Cb -0.14 -3.86 0.07 0.00 1.25 0.00 0.00 42.46 39.78 2art s ILE 47 CO -0.08 -0.40 1.14 -0.83 0.24 0.00 0.00 174.94 175.01 2art s GLY 48 N -3.98 1.60 0.21 6.27 0.00 -1.24 -1.41 107.32 108.77 2art s GLY 48 Ca 0.36 -0.49 -0.10 0.00 0.00 0.00 0.00 44.72 44.49 2art s GLY 48 CO 0.31 -0.03 1.75 -1.82 0.00 0.00 0.00 173.10 173.31 2art h TYR 49 N -1.01 0.42 -0.24 1.90 3.20 -1.07 -1.70 116.97 118.47 2art h TYR 49 Ca -0.46 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.43 2art h TYR 49 Cb 1.30 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.47 2art h TYR 49 CO 0.38 0.12 0.00 1.19 -1.64 0.00 0.00 178.16 178.22 2art n PHE 50 N -4.97 0.49 -4.00 -3.82 3.01 -1.26 -4.92 117.46 101.99 2art n PHE 50 Ca 0.08 -0.21 -0.24 0.00 1.01 0.00 0.00 57.45 58.10 2art n PHE 50 Cb 0.26 -0.09 -0.03 0.00 -0.01 0.00 0.00 39.48 39.60 2art n PHE 50 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 2art s GLN 51 N -1.64 3.27 -0.20 -1.08 -0.21 -0.64 -5.10 119.66 114.06 2art s GLN 51 Ca 0.18 -0.77 -0.02 0.00 0.02 0.00 0.00 55.36 54.78 2art s GLN 51 Cb 0.11 -2.83 0.00 0.00 1.00 0.00 0.00 33.01 31.30 2art s GLN 51 CO 0.10 0.47 -0.10 0.08 -2.12 0.00 0.00 175.29 173.71 2art s VAL 52 N -1.88 2.91 0.19 1.09 1.01 -1.26 -4.43 120.40 118.02 2art s VAL 52 Ca 0.33 -0.65 -0.20 0.00 0.00 0.00 0.00 61.98 61.46 2art s VAL 52 Cb -0.10 -2.29 0.13 0.00 0.00 0.00 0.00 36.38 34.12 2art s VAL 52 CO 0.27 0.47 1.59 0.00 0.00 0.00 0.00 175.10 177.43 2art h ALA 53 N 8.00 -0.02 0.00 5.51 0.00 -1.53 0.10 119.26 131.32 2art h ALA 53 Ca -0.42 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2art h ALA 53 Cb 1.16 0.78 0.00 0.00 0.00 0.00 0.00 17.79 19.72 2art h ALA 53 CO 0.61 -0.67 0.00 -0.85 0.00 0.00 0.00 179.25 178.35 2art n GLU 54 N -5.44 0.09 0.04 0.00 0.00 -1.26 -0.86 120.64 113.21 2art n GLU 54 Ca 0.04 0.52 0.11 0.00 0.00 0.00 0.00 57.16 57.84 2art n GLU 54 Cb 0.36 -1.75 -0.01 0.00 0.00 0.00 0.00 31.44 30.04 2art n GLU 54 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2art n GLU 55 N -1.94 0.40 -0.03 3.44 1.02 0.00 -4.42 120.64 119.12 2art n GLU 55 Ca 0.00 -0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.13 2art n GLU 55 Cb 0.07 -1.63 -0.07 0.00 -0.02 0.00 0.00 31.44 29.78 2art n GLU 55 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2art n GLU 56 N -2.15 1.75 -4.27 3.49 4.71 -0.47 -4.88 120.64 118.81 2art n GLU 56 Ca 0.01 -0.03 -0.15 0.00 -0.01 0.00 0.00 57.16 56.98 2art n GLU 56 Cb 0.48 -1.22 -0.10 0.00 -1.01 0.00 0.00 31.44 29.59 2art n GLU 56 CO 0.00 0.00 0.00 0.14 0.09 0.00 0.00 177.13 177.36 2art s VAL 57 N -2.36 0.57 -0.47 2.62 -7.23 -0.04 -0.78 120.40 112.70 2art s VAL 57 Ca -0.04 -1.99 -0.16 0.00 -1.81 0.00 0.00 61.98 57.98 2art s VAL 57 Cb 0.04 -2.39 0.07 0.00 0.56 0.00 0.00 36.38 34.65 2art s VAL 57 CO 0.36 -0.22 0.42 -0.62 -0.31 0.00 0.00 175.10 174.73 2art s ASP 58 N -3.24 6.15 0.00 4.85 2.15 -1.26 -4.46 116.67 120.87 2art s ASP 58 Ca 0.32 -1.24 0.00 0.00 0.43 0.00 0.00 52.55 52.05 2art s ASP 58 Cb 0.07 -2.19 0.00 0.00 -0.30 0.00 0.00 42.92 40.50 2art s ASP 58 CO 0.09 -0.66 0.60 0.18 -0.17 0.00 0.00 175.17 175.21 2art n LEU 59 N 5.31 0.00 -0.10 -1.34 4.77 -1.26 -2.01 117.00 122.36 2art n LEU 59 Ca -0.12 0.16 -0.16 0.00 -0.03 0.00 0.00 56.01 55.86 2art n LEU 59 Cb 0.44 -0.16 -0.06 0.00 -2.33 0.00 0.00 43.42 41.32 2art n LEU 59 CO 0.48 -0.16 -0.88 0.47 -1.33 0.00 0.00 177.39 175.97 2art n ASP 60 N -1.10 1.92 -0.27 -1.43 9.92 -1.26 -3.10 116.55 121.23 2art n ASP 60 Ca 0.00 0.38 0.08 0.00 -0.53 0.00 0.00 54.79 54.72 2art n ASP 60 Cb 0.04 -0.80 0.22 0.00 -0.64 0.00 0.00 41.12 39.93 2art n ASP 60 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2art h TYR 61 N -1.00 0.42 -0.37 1.24 3.20 -1.83 0.62 116.97 119.25 2art h TYR 61 Ca -0.26 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.57 2art h TYR 61 Cb 1.16 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.36 2art h TYR 61 CO -0.25 -0.05 -0.07 0.52 -1.64 0.00 0.00 178.16 176.68 2art h MET 62 N 0.34 0.71 0.65 1.82 2.86 -1.69 0.34 114.93 119.96 2art h MET 62 Ca 0.46 -0.26 -0.02 0.00 -2.06 0.00 0.00 59.70 57.81 2art h MET 62 Cb 0.79 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 2art h MET 62 CO -0.50 0.85 -0.49 -0.22 1.06 0.00 0.00 176.91 177.61 2art h LYS 63 N 0.51 -1.05 0.00 1.72 1.63 -0.72 0.75 116.57 119.40 2art h LYS 63 Ca 0.10 0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 59.96 2art h LYS 63 Cb 0.57 0.24 -0.00 0.00 -0.60 0.00 0.00 32.23 32.44 2art h LYS 63 CO 0.03 -0.70 -0.04 0.87 -3.45 0.00 0.00 179.45 176.16 2art h LYS 64 N -1.09 0.00 -0.43 1.90 6.56 0.12 -2.88 116.57 120.74 2art h LYS 64 Ca -0.08 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.51 2art h LYS 64 Cb 0.91 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.57 2art h LYS 64 CO 0.03 0.04 0.00 0.09 -2.06 0.00 0.00 179.45 177.55 2art n ASN 65 N -3.40 3.33 -3.10 0.86 3.02 0.11 -4.98 115.26 111.10 2art n ASN 65 Ca -0.02 -2.13 -0.23 0.00 -0.03 0.00 0.00 54.58 52.17 2art n ASN 65 Cb 0.17 -0.33 0.04 0.00 -0.61 0.00 0.00 39.78 39.05 2art n ASN 65 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2art n GLY 66 N 0.65 -0.53 3.66 7.41 0.00 -0.26 -4.96 105.19 111.16 2art n GLY 66 Ca 0.16 0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.92 2art n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2art s ILE 67 N -3.20 4.99 0.35 -0.61 -1.09 0.09 -4.87 121.20 116.86 2art s ILE 67 Ca 0.34 1.26 -0.26 0.00 -2.23 0.00 0.00 60.65 59.76 2art s ILE 67 Cb -0.15 -3.98 -0.09 0.00 -1.58 0.00 0.00 42.46 36.66 2art s ILE 67 CO 0.43 0.08 1.08 -0.04 -1.23 0.00 0.00 174.94 175.26 2art s MET 68 N 2.04 4.34 -0.09 2.79 -1.94 -0.49 -4.65 119.30 121.31 2art s MET 68 Ca 0.30 1.65 0.00 0.00 -1.71 0.00 0.00 55.69 55.93 2art s MET 68 Cb -0.16 -2.81 -0.03 0.00 2.01 0.00 0.00 34.83 33.85 2art s MET 68 CO 0.10 -0.01 -0.07 -1.17 -0.01 0.00 0.00 175.02 173.85 2art s LEU 69 N -2.16 3.11 -0.13 -0.03 2.96 -1.26 -0.72 118.68 120.45 2art s LEU 69 Ca 0.52 -0.08 -0.27 0.00 -0.22 0.00 0.00 54.13 54.08 2art s LEU 69 Cb -0.27 -1.69 0.06 0.00 0.50 0.00 0.00 46.19 44.80 2art s LEU 69 CO 0.34 0.30 0.65 0.00 -1.32 0.00 0.00 176.35 176.32 2art s ALA 70 N -0.46 -1.66 -0.15 5.97 0.00 -0.86 -4.87 121.76 119.74 2art s ALA 70 Ca 0.07 1.47 -0.00 0.00 0.00 0.00 0.00 51.96 53.50 2art s ALA 70 Cb -0.12 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.56 2art s ALA 70 CO 0.02 -0.34 -0.13 0.50 0.00 0.00 0.00 175.76 175.81 2art s ARG 71 N -0.60 3.34 0.63 0.00 3.52 -1.26 -1.37 118.95 123.21 2art s ARG 71 Ca -0.07 -0.70 -0.05 0.00 -0.13 0.00 0.00 55.73 54.79 2art s ARG 71 Cb -0.02 -2.67 0.03 0.00 -1.56 0.00 0.00 34.95 30.73 2art s ARG 71 CO 0.06 0.12 0.92 -0.98 -0.81 0.00 0.00 175.30 174.61 2art s ARG 72 N 0.59 2.57 0.08 5.12 1.70 -0.50 -4.90 118.95 123.61 2art s ARG 72 Ca -0.08 -0.24 0.27 0.00 -0.47 0.00 0.00 55.73 55.21 2art s ARG 72 Cb -0.16 -2.27 0.86 0.00 -0.57 0.00 0.00 34.95 32.82 2art s ARG 72 CO 0.03 -0.91 1.71 2.48 -1.08 0.00 0.00 175.30 177.53 2art n TYR 73 N -2.67 0.36 -3.59 5.89 0.18 -1.26 -3.43 117.16 112.64 2art n TYR 73 Ca 0.06 0.10 -0.26 0.00 1.88 0.00 0.00 57.90 59.69 2art n TYR 73 Cb 0.59 -0.61 -0.02 0.00 -0.38 0.00 0.00 39.34 38.91 2art n TYR 73 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 2art s THR 74 N -3.05 5.16 0.00 -3.48 -4.23 -1.26 -4.70 115.64 104.07 2art s THR 74 Ca 0.11 -0.41 0.00 0.00 -1.18 0.00 0.00 61.69 60.22 2art s THR 74 Cb 0.16 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 70.22 2art s THR 74 CO 0.61 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.98 2art n GLY 75 N -1.10 -2.20 0.00 3.99 0.00 -1.26 -0.97 105.19 103.65 2art n GLY 75 Ca -0.05 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.49 2art n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2art n GLY 76 N 2.91 -2.32 2.48 -0.02 0.00 -1.26 -4.58 105.19 102.41 2art n GLY 76 Ca 0.00 -2.19 -0.16 0.00 0.00 0.00 0.00 46.02 43.67 2art n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2art n GLY 77 N -0.33 0.17 3.74 -0.02 0.00 -1.26 -3.72 105.19 103.77 2art n GLY 77 Ca 0.00 -1.93 -0.39 0.00 0.00 0.00 0.00 46.02 43.70 2art n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2art s ALA 78 N -3.27 3.42 0.14 4.61 0.00 -1.26 -3.88 121.76 121.52 2art s ALA 78 Ca 0.44 0.06 0.06 0.00 0.00 0.00 0.00 51.96 52.51 2art s ALA 78 Cb -0.02 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 20.23 2art s ALA 78 CO 0.30 0.04 -0.13 0.14 0.00 0.00 0.00 175.76 176.11 2art s VAL 79 N 0.29 1.33 -0.15 0.00 -7.23 -0.58 -4.97 120.40 109.09 2art s VAL 79 Ca 0.33 -1.91 -0.05 0.00 -1.81 0.00 0.00 61.98 58.54 2art s VAL 79 Cb -0.18 -1.71 -0.03 0.00 0.56 0.00 0.00 36.38 35.01 2art s VAL 79 CO 0.17 -0.56 0.01 -0.47 -0.31 0.00 0.00 175.10 173.94 2art s TYR 80 N -2.68 3.15 0.12 2.82 5.04 -1.26 -0.34 117.35 124.20 2art s TYR 80 Ca 0.14 -0.04 0.10 0.00 -2.44 0.00 0.00 57.07 54.82 2art s TYR 80 Cb -0.02 -1.98 -0.04 0.00 0.35 0.00 0.00 41.96 40.28 2art s TYR 80 CO 0.03 0.15 -0.25 -1.01 -1.34 0.00 0.00 175.55 173.13 2art s HIS 81 N 0.12 2.11 0.32 4.97 3.76 0.14 -4.97 115.29 121.73 2art s HIS 81 Ca 0.02 -0.40 -0.11 0.00 -0.15 0.00 0.00 55.06 54.43 2art s HIS 81 Cb -0.13 -1.14 0.02 0.00 1.11 0.00 0.00 32.58 32.44 2art s HIS 81 CO 0.02 0.29 0.59 0.16 -0.85 0.00 0.00 174.74 174.95 2art s ASP 82 N -2.03 0.27 0.00 1.40 1.47 -1.22 -0.11 116.67 116.46 2art s ASP 82 Ca 0.11 -1.16 0.04 0.00 1.18 0.00 0.00 52.55 52.72 2art s ASP 82 Cb -0.10 0.71 0.19 0.00 -0.34 0.00 0.00 42.92 43.37 2art s ASP 82 CO 0.05 -1.38 0.92 0.18 0.68 0.00 0.00 175.17 175.62 2art n LEU 83 N -0.50 0.00 -0.52 2.11 4.77 -1.04 -0.30 117.00 121.52 2art n LEU 83 Ca -0.03 0.26 0.13 0.00 -0.03 0.00 0.00 56.01 56.35 2art n LEU 83 Cb 0.61 -0.26 0.43 0.00 -2.33 0.00 0.00 43.42 41.86 2art n LEU 83 CO 0.25 -0.23 0.79 0.61 -1.33 0.00 0.00 177.39 177.48 2art n GLY 84 N -0.96 0.07 3.63 -0.72 0.00 -1.26 -4.83 105.19 101.13 2art n GLY 84 Ca 0.02 -0.48 -0.35 0.00 0.00 0.00 0.00 46.02 45.21 2art n GLY 84 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2art s ASP 85 N -2.08 5.25 -0.28 1.61 2.15 0.59 -0.72 116.67 123.19 2art s ASP 85 Ca 0.34 0.08 -0.04 0.00 0.43 0.00 0.00 52.55 53.36 2art s ASP 85 Cb 0.21 -1.67 0.03 0.00 -0.30 0.00 0.00 42.92 41.18 2art s ASP 85 CO 0.36 0.28 0.01 -0.22 -0.17 0.00 0.00 175.17 175.43 2art s LEU 86 N -0.32 3.61 0.15 -1.34 2.96 0.45 -4.62 118.68 119.57 2art s LEU 86 Ca 0.07 -0.90 0.03 0.00 -0.22 0.00 0.00 54.13 53.11 2art s LEU 86 Cb -0.12 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 2art s LEU 86 CO 0.02 -0.19 0.25 0.20 -1.32 0.00 0.00 176.35 175.32 2art s ASN 87 N 1.38 6.15 -0.20 3.68 -0.87 -0.79 -1.22 114.94 123.07 2art s ASN 87 Ca -0.00 0.10 -0.26 0.00 -1.57 0.00 0.00 52.86 51.13 2art s ASN 87 Cb -0.18 -1.80 0.07 0.00 -0.02 0.00 0.00 41.25 39.32 2art s ASN 87 CO -0.01 0.05 0.68 0.72 -2.57 0.00 0.00 177.10 175.97 2art s PHE 88 N -1.75 -0.72 0.15 2.20 -0.12 -0.86 -1.87 117.98 115.00 2art s PHE 88 Ca 0.34 1.64 0.11 0.00 -0.05 0.00 0.00 56.93 58.97 2art s PHE 88 Cb -0.11 0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.54 2art s PHE 88 CO 0.27 -0.43 -0.26 -1.12 -0.05 0.00 0.00 175.22 173.64 2art s SER 89 N -0.06 3.32 -0.07 1.98 0.01 0.95 -1.64 113.70 118.19 2art s SER 89 Ca -0.03 -0.78 0.02 0.00 1.31 0.00 0.00 55.95 56.46 2art s SER 89 Cb -0.04 -0.23 0.02 0.00 0.21 0.00 0.00 66.02 65.98 2art s SER 89 CO 0.03 0.16 -0.10 -0.69 0.41 0.00 0.00 173.24 173.05 2art s VAL 90 N -1.25 1.03 -0.08 3.43 1.01 0.78 -0.48 120.40 124.83 2art s VAL 90 Ca 0.16 -0.40 -0.00 0.00 0.00 0.00 0.00 61.98 61.73 2art s VAL 90 Cb -0.09 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.35 2art s VAL 90 CO 0.07 0.33 -0.06 -0.69 0.00 0.00 0.00 175.10 174.76 2art s VAL 91 N 0.81 0.78 0.09 2.92 1.01 -0.28 -1.65 120.40 124.08 2art s VAL 91 Ca -0.12 -0.17 -0.01 0.00 0.00 0.00 0.00 61.98 61.68 2art s VAL 91 Cb -0.15 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 2art s VAL 91 CO 0.02 0.31 0.00 -0.13 0.00 0.00 0.00 175.10 175.31 2art s ARG 92 N 1.53 0.76 0.60 2.72 0.52 -1.15 -0.46 118.95 123.47 2art s ARG 92 Ca 0.00 -1.32 -0.19 0.00 -0.52 0.00 0.00 55.73 53.70 2art s ARG 92 Cb -0.13 0.20 -0.03 0.00 0.52 0.00 0.00 34.95 35.51 2art s ARG 92 CO -0.05 -0.17 1.20 -1.12 0.02 0.00 0.00 175.30 175.19 2art s SER 93 N -2.98 5.17 -0.03 0.23 0.01 -1.26 -2.17 113.70 112.68 2art s SER 93 Ca 0.14 2.38 0.03 0.00 1.31 0.00 0.00 55.95 59.82 2art s SER 93 Cb 0.08 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.71 2art s SER 93 CO -0.05 -1.60 -0.13 -0.55 0.41 0.00 0.00 173.24 171.32 2art s SER 94 N -1.62 1.58 0.00 2.44 0.15 -0.28 -4.71 113.70 111.25 2art s SER 94 Ca 0.77 -0.25 0.07 0.00 0.70 0.00 0.00 55.95 57.24 2art s SER 94 Cb -0.30 -0.35 0.16 0.00 -1.71 0.00 0.00 66.02 63.83 2art s SER 94 CO 0.33 0.12 1.07 0.47 1.20 0.00 0.00 173.24 176.43 2art n ASP 95 N 3.08 2.37 -2.55 5.45 8.00 -1.26 -3.82 116.55 127.82 2art n ASP 95 Ca -0.17 -1.85 -0.09 0.00 0.71 0.00 0.00 54.79 53.39 2art n ASP 95 Cb 0.54 -0.12 0.01 0.00 -0.02 0.00 0.00 41.12 41.54 2art n ASP 95 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2art n ASP 96 N 0.19 -1.79 -0.49 -2.24 3.85 -1.26 -5.05 116.55 109.77 2art n ASP 96 Ca 0.07 -2.40 0.05 0.00 -0.71 0.00 0.00 54.79 51.80 2art n ASP 96 Cb 0.32 3.02 0.14 0.00 -1.35 0.00 0.00 41.12 43.25 2art n ASP 96 CO 0.00 0.00 0.00 0.23 -1.01 0.00 0.00 177.20 176.42 2art n MET 97 N -0.46 2.75 -2.00 0.11 2.81 -1.26 -4.96 117.12 114.10 2art n MET 97 Ca -0.06 -2.16 -0.30 0.00 -1.81 0.00 0.00 57.70 53.36 2art n MET 97 Cb 0.50 -1.36 -0.04 0.00 -0.71 0.00 0.00 33.22 31.60 2art n MET 97 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2art s ASP 98 N -1.41 5.09 0.16 7.83 -1.08 -1.26 -4.84 116.67 121.15 2art s ASP 98 Ca 0.23 -0.22 -0.10 0.00 -0.52 0.00 0.00 52.55 51.94 2art s ASP 98 Cb 0.16 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 39.08 2art s ASP 98 CO 0.09 -2.69 1.55 0.40 0.52 0.00 0.00 175.17 175.04 2art h ILE 99 N 7.17 1.27 -0.69 4.11 2.04 -2.01 -3.24 117.51 126.16 2art h ILE 99 Ca -0.04 -1.36 0.07 0.00 1.00 0.00 0.00 64.86 64.52 2art h ILE 99 Cb 1.07 1.12 -0.06 0.00 -0.74 0.00 0.00 36.82 38.21 2art h ILE 99 CO 1.20 0.47 0.37 0.74 0.00 0.00 0.00 178.15 180.93 2art h THR 100 N 0.84 0.93 -0.39 -0.27 2.02 -2.00 -2.17 112.91 111.87 2art h THR 100 Ca 0.11 -0.23 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 2art h THR 100 Cb 0.78 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 2art h THR 100 CO 0.06 0.12 -0.02 0.28 0.37 0.00 0.00 175.52 176.34 2art h SER 101 N 0.67 0.60 0.52 4.18 0.02 -1.98 0.11 113.55 117.68 2art h SER 101 Ca 0.32 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 2art h SER 101 Cb 0.24 -0.16 0.01 0.00 0.14 0.00 0.00 62.40 62.63 2art h SER 101 CO -0.21 0.69 -0.25 -0.03 -1.14 0.00 0.00 176.83 175.89 2art h MET 102 N 0.60 -0.68 -0.95 3.45 -1.53 -1.45 0.37 114.93 114.75 2art h MET 102 Ca 0.12 0.05 0.02 0.00 -3.44 0.00 0.00 59.70 56.45 2art h MET 102 Cb 0.40 0.15 -0.05 0.00 -0.55 0.00 0.00 31.60 31.56 2art h MET 102 CO 0.02 -0.44 0.62 0.74 0.14 0.00 0.00 176.91 177.99 2art h PHE 103 N -0.72 1.18 -0.22 1.39 0.04 -1.32 0.32 116.94 117.60 2art h PHE 103 Ca -0.07 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.71 2art h PHE 103 Cb 0.55 -0.39 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 2art h PHE 103 CO -0.03 0.71 0.09 -0.09 -0.60 0.00 0.00 178.31 178.38 2art h ARG 104 N 1.24 0.34 -0.45 1.51 2.43 -0.46 -1.22 114.38 117.77 2art h ARG 104 Ca 0.36 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.35 2art h ARG 104 Cb -0.08 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 2art h ARG 104 CO -0.10 0.39 -0.19 1.15 -1.51 0.00 0.00 179.97 179.72 2art h THR 105 N 0.21 1.27 -0.29 0.20 2.02 0.12 -2.59 112.91 113.84 2art h THR 105 Ca 0.07 -1.33 -0.13 0.00 0.77 0.00 0.00 66.41 65.80 2art h THR 105 Cb 0.19 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 2art h THR 105 CO -0.01 0.45 -0.36 0.24 0.37 0.00 0.00 175.52 176.22 2art h MET 106 N 0.78 0.66 -0.37 6.66 2.86 -0.83 -2.87 114.93 121.81 2art h MET 106 Ca 0.11 -0.32 -0.09 0.00 -2.06 0.00 0.00 59.70 57.34 2art h MET 106 Cb 0.73 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.37 2art h MET 106 CO 0.06 0.91 -0.15 -0.91 1.06 0.00 0.00 176.91 177.88 2art h ASN 107 N 0.55 0.67 -0.49 1.22 2.35 -1.18 -1.30 115.58 117.40 2art h ASN 107 Ca 0.06 -0.20 -0.02 0.00 -0.55 0.00 0.00 56.30 55.58 2art h ASN 107 Cb 0.87 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 39.03 2art h ASN 107 CO 0.08 0.84 0.24 -0.08 -1.65 0.00 0.00 177.43 176.85 2art h GLU 108 N 0.61 0.75 -0.27 0.81 4.81 -1.28 0.12 114.58 120.14 2art h GLU 108 Ca 0.10 -0.10 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 2art h GLU 108 Cb 0.60 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 2art h GLU 108 CO 0.04 0.60 -0.34 0.00 -0.73 0.00 0.00 179.01 178.58 2art h ALA 109 N 1.51 0.40 -0.49 2.92 0.00 -1.24 -1.58 119.26 120.79 2art h ALA 109 Ca 0.18 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2art h ALA 109 Cb 0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2art h ALA 109 CO -0.02 0.46 0.22 0.28 0.00 0.00 0.00 179.25 180.19 2art h VAL 110 N 0.44 1.20 -0.45 0.00 2.07 -0.64 -0.16 116.25 118.71 2art h VAL 110 Ca 0.03 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 2art h VAL 110 Cb 0.93 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 2art h VAL 110 CO 0.08 0.22 0.23 0.58 0.02 0.00 0.00 177.57 178.71 2art h VAL 111 N 0.64 1.17 0.00 2.57 2.07 -0.73 0.08 116.25 122.06 2art h VAL 111 Ca 0.16 -0.46 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 2art h VAL 111 Cb 0.15 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2art h VAL 111 CO -0.02 0.18 -0.32 0.78 0.02 0.00 0.00 177.57 178.22 2art h ASN 112 N 0.58 0.00 0.02 0.57 2.35 -1.09 -2.02 115.58 116.00 2art h ASN 112 Ca 0.16 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2art h ASN 112 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2art h ASN 112 CO -0.02 0.32 -0.01 0.28 -1.65 0.00 0.00 177.43 176.35 2art h SER 113 N 0.00 -0.02 0.15 5.81 0.02 -0.42 -3.22 113.55 115.86 2art h SER 113 Ca -0.00 -0.59 -0.03 0.00 -0.84 0.00 0.00 61.79 60.33 2art h SER 113 Cb 0.60 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 2art h SER 113 CO 0.04 0.59 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.12 2art h LEU 114 N -0.65 0.00 -1.39 5.07 3.38 -0.91 -2.03 115.31 118.77 2art h LEU 114 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2art h LEU 114 Cb 0.61 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2art h LEU 114 CO 0.00 0.13 -0.06 -0.09 0.09 0.00 0.00 178.44 178.52 2art h ARG 115 N 0.00 0.32 -0.03 1.13 2.43 -1.29 -1.12 114.38 115.82 2art h ARG 115 Ca -0.00 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2art h ARG 115 Cb 0.25 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2art h ARG 115 CO 0.02 0.41 -0.01 0.82 -1.51 0.00 0.00 179.97 179.69 2art h ILE 116 N 0.31 1.03 -0.40 1.20 2.04 -1.39 -0.70 117.51 119.60 2art h ILE 116 Ca 0.07 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2art h ILE 116 Cb 0.32 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2art h ILE 116 CO 0.01 0.04 0.00 0.18 0.00 0.00 0.00 178.15 178.39 2art n LEU 117 N -4.50 2.51 0.00 1.44 4.77 -0.52 -4.91 117.00 115.80 2art n LEU 117 Ca -0.02 -1.19 0.00 0.00 -0.03 0.00 0.00 56.01 54.76 2art n LEU 117 Cb 0.12 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 2art n LEU 117 CO 0.35 0.60 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 2art n GLY 118 N 1.28 0.65 3.48 -0.72 0.00 -0.27 -4.94 105.19 104.68 2art n GLY 118 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2art n GLY 118 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2art s LEU 119 N 0.00 4.59 -0.55 0.99 2.96 -0.64 -4.98 118.68 121.05 2art s LEU 119 Ca 0.00 -0.59 -0.21 0.00 -0.22 0.00 0.00 54.13 53.11 2art s LEU 119 Cb 0.00 -2.11 0.06 0.00 0.50 0.00 0.00 46.19 44.64 2art s LEU 119 CO 0.00 -0.29 0.78 -0.62 -1.32 0.00 0.00 176.35 174.90 2art s ASP 120 N 1.68 6.24 0.41 3.68 2.15 -1.26 -3.08 116.67 126.48 2art s ASP 120 Ca 0.05 -0.84 0.07 0.00 0.43 0.00 0.00 52.55 52.26 2art s ASP 120 Cb -0.18 -2.35 -0.07 0.00 -0.30 0.00 0.00 42.92 40.02 2art s ASP 120 CO 0.09 -1.10 0.05 0.00 -0.17 0.00 0.00 175.17 174.04 2art s ALA 121 N 3.23 3.28 0.10 3.66 0.00 -1.26 -4.52 121.76 126.24 2art s ALA 121 Ca 0.20 -2.26 -0.12 0.00 0.00 0.00 0.00 51.96 49.78 2art s ALA 121 Cb -0.18 0.02 0.02 0.00 0.00 0.00 0.00 23.12 22.98 2art s ALA 121 CO 0.13 -0.13 0.29 -0.98 0.00 0.00 0.00 175.76 175.07 2art s ARG 122 N -3.76 0.93 0.56 0.00 1.70 0.71 -4.89 118.95 114.20 2art s ARG 122 Ca 0.37 -0.81 -0.16 0.00 -0.47 0.00 0.00 55.73 54.66 2art s ARG 122 Cb 0.08 0.39 -0.05 0.00 -0.57 0.00 0.00 34.95 34.80 2art s ARG 122 CO 0.19 -0.33 1.02 -1.25 -1.08 0.00 0.00 175.30 173.86 2art s PRO 123 N -3.70 3.60 1.28 3.89 0.04 -1.26 0.13 135.00 138.98 2art s PRO 123 Ca 0.03 1.07 -0.21 0.00 0.04 0.00 0.00 61.00 61.93 2art s PRO 123 Cb 0.03 -2.08 0.33 0.00 0.04 0.00 0.00 34.50 32.82 2art s PRO 123 CO -0.11 -0.57 0.93 0.41 0.04 0.00 0.00 177.00 177.70 2art n GLY 124 N -1.34 -3.36 0.00 0.56 0.00 0.62 -4.74 105.19 96.93 2art n GLY 124 Ca 0.08 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.71 2art n GLY 124 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2art n GLU 125 N -5.14 0.60 -3.51 1.61 0.28 0.33 -4.04 120.64 110.76 2art n GLU 125 Ca 0.14 -0.00 -0.33 0.00 -0.16 0.00 0.00 57.16 56.81 2art n GLU 125 Cb 0.56 -0.97 -0.05 0.00 1.43 0.00 0.00 31.44 32.41 2art n GLU 125 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2art s LEU 126 N -2.94 4.25 -0.98 -1.84 1.43 0.44 -4.69 118.68 114.36 2art s LEU 126 Ca -0.00 0.82 -0.03 0.00 -1.03 0.00 0.00 54.13 53.89 2art s LEU 126 Cb 0.00 -3.39 0.28 0.00 0.03 0.00 0.00 46.19 43.11 2art s LEU 126 CO 0.01 0.03 1.15 0.59 0.23 0.00 0.00 176.35 178.37 2art n ASN 127 N 0.25 5.37 -3.39 2.29 3.02 -1.26 -1.68 115.26 119.85 2art n ASN 127 Ca -0.03 -3.29 -0.17 0.00 -0.03 0.00 0.00 54.58 51.07 2art n ASN 127 Cb 0.52 -1.15 -0.09 0.00 -0.61 0.00 0.00 39.78 38.44 2art n ASN 127 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2art s ASP 128 N -0.93 1.60 0.66 6.41 -1.08 -1.26 -5.01 116.67 117.05 2art s ASP 128 Ca 0.32 -0.76 0.42 0.00 -0.52 0.00 0.00 52.55 52.01 2art s ASP 128 Cb 0.01 0.54 2.34 0.00 -1.46 0.00 0.00 42.92 44.35 2art s ASP 128 CO 0.00 -0.38 2.34 0.58 0.52 0.00 0.00 175.17 178.23 2art h VAL 129 N 6.22 0.06 0.00 1.11 2.07 -2.01 -2.40 116.25 121.31 2art h VAL 129 Ca -0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2art h VAL 129 Cb 1.08 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 2art h VAL 129 CO 0.33 0.00 -0.12 -1.54 0.02 0.00 0.00 177.57 176.25 2art n SER 130 N -3.17 0.82 -4.79 0.57 3.41 -1.26 -4.77 113.62 104.44 2art n SER 130 Ca -0.03 0.49 -0.39 0.00 -0.26 0.00 0.00 58.87 58.68 2art n SER 130 Cb 0.09 -0.62 -0.06 0.00 -0.26 0.00 0.00 64.21 63.36 2art n SER 130 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2art s ILE 131 N -3.12 4.87 0.25 -1.33 -4.36 -0.91 -5.00 121.20 111.61 2art s ILE 131 Ca 0.10 1.18 -0.06 0.00 -0.26 0.00 0.00 60.65 61.60 2art s ILE 131 Cb 0.12 -3.89 0.26 0.00 1.25 0.00 0.00 42.46 40.20 2art s ILE 131 CO 0.62 0.48 1.93 1.55 0.24 0.00 0.00 174.94 179.76 2art h PRO 132 N 5.19 1.32 -4.98 0.37 0.13 -1.88 -3.46 132.00 128.69 2art h PRO 132 Ca -0.47 -0.08 -0.52 0.00 -0.87 0.00 0.00 66.00 64.06 2art h PRO 132 Cb 1.21 -0.30 -0.13 0.00 0.13 0.00 0.00 31.00 31.91 2art h PRO 132 CO 0.67 0.88 -0.51 0.14 -0.23 0.00 0.00 178.00 178.95 2art s VAL 133 N -6.10 0.37 -1.50 1.56 -7.23 -1.26 -4.87 120.40 101.37 2art s VAL 133 Ca -0.13 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 2art s VAL 133 Cb 0.18 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.72 2art s VAL 133 CO 0.82 0.00 0.00 -3.20 -0.31 0.00 0.00 175.10 172.41 2art n ASN 134 N -1.35 -4.71 -4.93 4.85 4.05 -1.26 -4.94 115.26 106.96 2art n ASN 134 Ca -0.01 0.30 -0.25 0.00 0.45 0.00 0.00 54.58 55.06 2art n ASN 134 Cb 0.64 -3.57 0.02 0.00 1.23 0.00 0.00 39.78 38.10 2art n ASN 134 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 2art s LYS 135 N -3.51 3.03 0.06 1.20 1.02 -1.26 -0.42 119.74 119.87 2art s LYS 135 Ca 0.00 -0.18 0.16 0.00 0.02 0.00 0.00 55.97 55.97 2art s LYS 135 Cb 0.00 -2.40 0.68 0.00 -0.52 0.00 0.00 37.83 35.60 2art s LYS 135 CO 0.00 -0.48 1.51 1.63 -0.92 0.00 0.00 175.35 177.08 2art n LYS 136 N -2.35 0.04 0.00 1.68 5.02 -0.68 -1.47 118.16 120.41 2art n LYS 136 Ca 0.03 0.30 0.12 0.00 -2.02 0.00 0.00 58.31 56.74 2art n LYS 136 Cb 0.57 -1.58 0.23 0.00 -0.02 0.00 0.00 35.03 34.23 2art n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2art n THR 137 N -1.66 0.00 -3.92 -0.18 -2.24 -1.26 -4.51 114.28 100.51 2art n THR 137 Ca 0.03 -0.24 -0.30 0.00 -2.27 0.00 0.00 64.05 61.27 2art n THR 137 Cb 0.18 0.85 -0.04 0.00 -2.10 0.00 0.00 70.33 69.22 2art n THR 137 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2art s ASP 138 N -2.36 6.36 -0.20 3.42 1.01 -0.54 -2.96 116.67 121.40 2art s ASP 138 Ca 0.25 0.26 -0.02 0.00 0.71 0.00 0.00 52.55 53.75 2art s ASP 138 Cb 0.19 -1.96 0.00 0.00 1.01 0.00 0.00 42.92 42.17 2art s ASP 138 CO 0.49 0.15 -0.11 -0.63 0.21 0.00 0.00 175.17 175.28 2art s ILE 139 N -1.55 2.86 0.10 0.77 -1.09 -0.25 -0.28 121.20 121.76 2art s ILE 139 Ca 0.35 -0.67 0.04 0.00 -2.23 0.00 0.00 60.65 58.14 2art s ILE 139 Cb -0.13 -2.26 -0.04 0.00 -1.58 0.00 0.00 42.46 38.45 2art s ILE 139 CO 0.28 0.47 0.06 -0.04 -1.23 0.00 0.00 174.94 174.48 2art s MET 140 N 1.33 2.74 -0.14 2.79 -1.94 0.35 -2.21 119.30 122.22 2art s MET 140 Ca 0.04 -0.79 -0.00 0.00 -1.71 0.00 0.00 55.69 53.23 2art s MET 140 Cb -0.14 -2.63 0.03 0.00 2.01 0.00 0.00 34.83 34.10 2art s MET 140 CO -0.06 0.54 -0.10 0.00 -0.01 0.00 0.00 175.02 175.39 2art s ALA 141 N -1.44 1.59 0.00 3.03 0.00 -0.33 -0.21 121.76 124.40 2art s ALA 141 Ca 0.28 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.47 2art s ALA 141 Cb -0.12 -1.03 0.00 0.00 0.00 0.00 0.00 23.12 21.98 2art s ALA 141 CO 0.21 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.87 2art n GLY 142 N 4.85 2.72 0.94 0.00 0.00 -1.26 -1.42 105.19 111.02 2art n GLY 142 Ca -0.14 -0.28 0.08 0.00 0.00 0.00 0.00 46.02 45.68 2art n GLY 142 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2art n GLU 143 N 13.48 3.01 -4.12 1.61 -0.58 -1.26 -4.99 120.64 127.80 2art n GLU 143 Ca 0.00 -2.41 -0.26 0.00 -0.42 0.00 0.00 57.16 54.06 2art n GLU 143 Cb 0.00 -1.51 -0.06 0.00 -0.57 0.00 0.00 31.44 29.30 2art n GLU 143 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2art s LYS 144 N -1.45 2.77 -0.15 3.49 -0.14 -0.51 -4.92 119.74 118.83 2art s LYS 144 Ca 0.35 -0.94 -0.14 0.00 -1.36 0.00 0.00 55.97 53.88 2art s LYS 144 Cb 0.21 -2.57 -0.05 0.00 -1.68 0.00 0.00 37.83 33.75 2art s LYS 144 CO 0.19 0.48 0.30 0.21 -0.76 0.00 0.00 175.35 175.77 2art s LYS 145 N -3.07 4.20 -0.00 1.68 2.20 0.63 -1.19 119.74 124.20 2art s LYS 145 Ca 0.30 0.13 0.01 0.00 -0.36 0.00 0.00 55.97 56.04 2art s LYS 145 Cb -0.10 -3.40 -0.01 0.00 -1.51 0.00 0.00 37.83 32.81 2art s LYS 145 CO 0.22 0.29 0.03 0.44 -0.36 0.00 0.00 175.35 175.96 2art n ILE 146 N 3.40 0.00 -3.68 5.43 -5.35 -0.94 -1.49 119.36 116.74 2art n ILE 146 Ca -0.12 -0.32 -0.11 0.00 -0.27 0.00 0.00 62.75 61.92 2art n ILE 146 Cb 0.52 0.82 -0.09 0.00 -1.74 0.00 0.00 39.64 39.15 2art n ILE 146 CO 0.00 0.00 0.00 -0.32 -1.76 0.00 0.00 176.55 174.47 2art s MET 147 N -1.40 0.59 0.28 6.28 0.00 -1.17 -0.79 119.30 123.09 2art s MET 147 Ca 0.00 0.88 0.12 0.00 0.00 0.00 0.00 55.69 56.68 2art s MET 147 Cb 0.01 0.19 -0.05 0.00 0.00 0.00 0.00 34.83 34.97 2art s MET 147 CO 0.03 -0.11 -0.18 0.20 0.00 0.00 0.00 175.02 174.96 2art s GLY 148 N 0.88 1.88 0.18 2.11 0.00 -0.91 -1.09 107.32 110.37 2art s GLY 148 Ca -0.05 -1.87 -0.09 0.00 0.00 0.00 0.00 44.72 42.72 2art s GLY 148 CO -0.07 -1.95 0.30 0.00 0.00 0.00 0.00 173.10 171.38 2art s ALA 149 N -2.50 0.09 0.21 3.20 0.00 -1.15 -1.34 121.76 120.27 2art s ALA 149 Ca 0.30 -0.98 -0.14 0.00 0.00 0.00 0.00 51.96 51.15 2art s ALA 149 Cb -0.05 0.96 0.01 0.00 0.00 0.00 0.00 23.12 24.04 2art s ALA 149 CO 0.15 -0.68 0.47 0.00 0.00 0.00 0.00 175.76 175.70 2art s ALA 150 N -4.00 -0.48 0.28 0.00 0.00 -0.79 -4.93 121.76 111.85 2art s ALA 150 Ca 0.21 -0.63 -0.21 0.00 0.00 0.00 0.00 51.96 51.33 2art s ALA 150 Cb 0.03 0.94 0.03 0.00 0.00 0.00 0.00 23.12 24.12 2art s ALA 150 CO 0.03 -0.81 0.75 0.20 0.00 0.00 0.00 175.76 175.93 2art s GLY 151 N -2.95 -0.05 -0.00 0.00 0.00 -1.26 -2.01 107.32 101.05 2art s GLY 151 Ca 0.16 -0.33 -0.09 0.00 0.00 0.00 0.00 44.72 44.46 2art s GLY 151 CO 0.03 -0.09 0.18 0.00 0.00 0.00 0.00 173.10 173.22 2art s ALA 152 N -3.69 -0.44 -0.00 3.20 0.00 0.21 -4.50 121.76 116.54 2art s ALA 152 Ca 0.12 -0.01 0.01 0.00 0.00 0.00 0.00 51.96 52.07 2art s ALA 152 Cb -0.06 0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.16 2art s ALA 152 CO 0.07 -0.22 -0.04 -1.64 0.00 0.00 0.00 175.76 173.93 2art s MET 153 N -1.36 0.34 0.18 0.00 -1.94 -1.26 0.89 119.30 116.15 2art s MET 153 Ca -0.14 -0.15 -0.07 0.00 -1.71 0.00 0.00 55.69 53.62 2art s MET 153 Cb -0.07 -0.33 -0.02 0.00 2.01 0.00 0.00 34.83 36.42 2art s MET 153 CO 0.02 0.09 0.25 -0.98 -0.01 0.00 0.00 175.02 174.39 2art s ARG 154 N -0.10 1.19 -0.06 2.03 1.70 0.07 -5.01 118.95 118.77 2art s ARG 154 Ca 0.02 -1.32 -0.34 0.00 -0.47 0.00 0.00 55.73 53.61 2art s ARG 154 Cb -0.02 0.35 -0.12 0.00 -0.57 0.00 0.00 34.95 34.59 2art s ARG 154 CO -0.00 -0.43 1.83 1.17 -1.08 0.00 0.00 175.30 176.79 2art n LYS 155 N -0.23 2.12 0.00 3.89 4.81 -1.26 -1.44 118.16 126.06 2art n LYS 155 Ca -0.04 0.78 0.00 0.00 -0.87 0.00 0.00 58.31 58.17 2art n LYS 155 Cb 0.63 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 33.08 2art n LYS 155 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2art n GLY 156 N 4.24 2.82 3.29 3.14 0.00 -1.25 -4.95 105.19 112.48 2art n GLY 156 Ca 0.22 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 2art n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2art s ALA 157 N -2.16 -0.81 0.04 4.61 0.00 -0.52 -1.13 121.76 121.79 2art s ALA 157 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 51.96 52.01 2art s ALA 157 Cb 0.00 0.44 -0.02 0.00 0.00 0.00 0.00 23.12 23.54 2art s ALA 157 CO 0.00 -0.50 -0.08 -1.59 0.00 0.00 0.00 175.76 173.60 2art s LYS 158 N -2.97 0.54 -0.01 0.00 -2.85 -0.92 -0.75 119.74 112.77 2art s LYS 158 Ca -0.02 -0.69 0.04 0.00 -1.00 0.00 0.00 55.97 54.29 2art s LYS 158 Cb 0.00 -0.34 -0.01 0.00 -2.06 0.00 0.00 37.83 35.42 2art s LYS 158 CO -0.06 0.07 -0.12 -1.17 0.10 0.00 0.00 175.35 174.17 2art s LEU 159 N -1.39 2.03 -0.11 2.77 1.98 0.26 -2.91 118.68 121.30 2art s LEU 159 Ca -0.08 -0.22 -0.04 0.00 -2.89 0.00 0.00 54.13 50.90 2art s LEU 159 Cb -0.09 -0.60 0.05 0.00 0.66 0.00 0.00 46.19 46.22 2art s LEU 159 CO 0.00 0.14 0.22 0.86 -1.89 0.00 0.00 176.35 175.68 2art s TRP 160 N -0.30 -0.31 0.03 5.38 -0.00 -0.66 -0.62 118.94 122.46 2art s TRP 160 Ca 0.04 0.80 0.02 0.00 -0.00 0.00 0.00 56.10 56.97 2art s TRP 160 Cb -0.05 -0.11 -0.02 0.00 -0.00 0.00 0.00 33.47 33.29 2art s TRP 160 CO -0.00 -0.30 -0.08 -3.38 -0.00 0.00 0.00 176.95 173.19 2art s HIS 161 N 2.19 0.65 0.18 5.86 -3.43 -0.85 -0.16 115.29 119.74 2art s HIS 161 Ca 0.00 -0.39 0.02 0.00 -0.80 0.00 0.00 55.06 53.89 2art s HIS 161 Cb -0.12 -0.40 -0.05 0.00 -1.43 0.00 0.00 32.58 30.59 2art s HIS 161 CO -0.07 -0.06 0.01 0.00 -2.00 0.00 0.00 174.74 172.62 2art s ALA 162 N -1.05 1.40 -0.18 -1.38 0.00 -0.65 -1.89 121.76 118.01 2art s ALA 162 Ca -0.06 -1.63 0.01 0.00 0.00 0.00 0.00 51.96 50.28 2art s ALA 162 Cb -0.08 0.61 0.03 0.00 0.00 0.00 0.00 23.12 23.68 2art s ALA 162 CO 0.00 -0.34 -0.16 0.00 0.00 0.00 0.00 175.76 175.26 2art s ALA 163 N -3.67 2.19 -0.18 0.00 0.00 -0.45 -2.04 121.76 117.61 2art s ALA 163 Ca 0.26 -1.19 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 2art s ALA 163 Cb 0.06 -1.20 -0.00 0.00 0.00 0.00 0.00 23.12 21.98 2art s ALA 163 CO 0.05 -0.50 -0.12 1.41 0.00 0.00 0.00 175.76 176.60 2art s MET 164 N 1.34 3.27 -0.34 0.00 1.75 -0.36 -2.14 119.30 122.82 2art s MET 164 Ca 0.03 -0.71 -0.29 0.00 -1.25 0.00 0.00 55.69 53.47 2art s MET 164 Cb -0.14 -2.75 0.01 0.00 2.84 0.00 0.00 34.83 34.79 2art s MET 164 CO -0.11 -0.05 1.26 -0.51 -0.65 0.00 0.00 175.02 174.95 2art s LEU 165 N 1.02 3.81 -0.17 4.11 1.43 0.03 -0.41 118.68 128.51 2art s LEU 165 Ca -0.01 1.03 -0.16 0.00 -1.03 0.00 0.00 54.13 53.96 2art s LEU 165 Cb -0.15 -3.54 -0.06 0.00 0.03 0.00 0.00 46.19 42.47 2art s LEU 165 CO -0.02 -1.12 -0.32 0.52 0.23 0.00 0.00 176.35 175.63 2art n VAL 166 N 6.36 1.47 -2.76 -1.59 0.31 -0.11 -0.87 118.33 121.14 2art n VAL 166 Ca 0.14 0.09 -0.02 0.00 -0.01 0.00 0.00 64.34 64.54 2art n VAL 166 Cb 0.47 -2.23 0.07 0.00 -0.91 0.00 0.00 33.84 31.25 2art n VAL 166 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2art n HIS 167 N -4.35 0.14 -2.19 3.52 1.44 0.10 -2.13 115.22 111.76 2art n HIS 167 Ca -0.18 -2.12 -0.34 0.00 -2.01 0.00 0.00 57.72 53.07 2art n HIS 167 Cb 0.53 0.33 0.00 0.00 0.12 0.00 0.00 29.99 30.97 2art n HIS 167 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 2art s THR 168 N -2.43 3.62 -0.80 0.61 2.01 -1.18 -4.55 115.64 112.91 2art s THR 168 Ca 0.22 0.87 -0.26 0.00 0.31 0.00 0.00 61.69 62.83 2art s THR 168 Cb 0.38 -3.35 0.03 0.00 0.01 0.00 0.00 72.50 69.57 2art s THR 168 CO -0.05 -0.35 1.42 -0.62 -0.69 0.00 0.00 174.62 174.33 2art s ASP 169 N -2.36 6.09 0.36 3.53 -1.08 -1.26 -4.84 116.67 117.11 2art s ASP 169 Ca 0.67 -0.62 0.05 0.00 -0.52 0.00 0.00 52.55 52.12 2art s ASP 169 Cb -0.18 -2.56 0.67 0.00 -1.46 0.00 0.00 42.92 39.39 2art s ASP 169 CO 0.31 -1.86 1.94 -0.07 0.52 0.00 0.00 175.17 176.01 2art h LEU 170 N 13.61 0.52 -1.02 -1.34 3.38 -1.99 -2.06 115.31 126.41 2art h LEU 170 Ca -0.14 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 2art h LEU 170 Cb 1.05 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 2art h LEU 170 CO 1.31 0.50 0.24 0.44 0.09 0.00 0.00 178.44 181.02 2art h ASP 171 N 0.57 0.87 -0.00 -0.43 3.45 -1.96 -0.26 116.42 118.66 2art h ASP 171 Ca 0.14 -0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.47 2art h ASP 171 Cb 0.17 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 38.71 2art h ASP 171 CO -0.01 0.79 0.00 -0.03 -1.57 0.00 0.00 179.24 178.42 2art h MET 172 N 0.93 0.01 -0.83 3.56 4.05 -1.81 -1.54 114.93 119.29 2art h MET 172 Ca 0.22 -0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.65 2art h MET 172 Cb 0.20 -0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 30.96 2art h MET 172 CO -0.02 0.24 0.55 1.37 0.23 0.00 0.00 176.91 179.28 2art h LEU 173 N -0.23 0.94 -0.48 3.39 8.10 -0.99 -2.25 115.31 123.79 2art h LEU 173 Ca 0.00 -0.02 -0.07 0.00 0.11 0.00 0.00 57.88 57.90 2art h LEU 173 Cb 0.23 -0.23 -0.02 0.00 -0.44 0.00 0.00 40.66 40.21 2art h LEU 173 CO 0.00 0.67 0.04 0.28 -4.11 0.00 0.00 178.44 175.32 2art h SER 174 N 1.11 0.80 -0.25 0.17 0.02 -0.96 -2.38 113.55 112.06 2art h SER 174 Ca 0.31 -0.28 -0.05 0.00 -0.84 0.00 0.00 61.79 60.92 2art h SER 174 Cb -0.10 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 2art h SER 174 CO -0.08 0.88 -0.00 0.00 -1.14 0.00 0.00 176.83 176.49 2art h ALA 175 N 0.94 1.33 0.00 3.77 0.00 -0.96 -3.20 119.26 121.14 2art h ALA 175 Ca 0.14 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 2art h ALA 175 Cb 0.45 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2art h ALA 175 CO 0.02 0.46 -1.08 -0.24 0.00 0.00 0.00 179.25 178.41 2art h VAL 176 N 0.53 0.52 -3.38 0.00 3.04 -1.33 -3.46 116.25 112.17 2art h VAL 176 Ca 0.11 -1.91 -0.58 0.00 -1.01 0.00 0.00 66.70 63.31 2art h VAL 176 Cb 0.35 2.07 -0.08 0.00 -2.01 0.00 0.00 31.29 31.62 2art h VAL 176 CO 0.01 0.30 0.15 -0.76 -1.01 0.00 0.00 177.57 176.27 2art s LEU 177 N -5.93 4.18 -0.25 3.16 1.43 -0.90 -4.02 118.68 116.36 2art s LEU 177 Ca -0.00 0.96 -0.24 0.00 -1.03 0.00 0.00 54.13 53.82 2art s LEU 177 Cb 0.08 -2.98 -0.01 0.00 0.03 0.00 0.00 46.19 43.32 2art s LEU 177 CO 0.79 -0.26 0.78 -0.54 0.23 0.00 0.00 176.35 177.35 2art s LYS 178 N 1.71 4.17 0.00 1.70 1.02 0.04 -4.89 119.74 123.49 2art s LYS 178 Ca 0.32 0.85 0.00 0.00 0.02 0.00 0.00 55.97 57.16 2art s LYS 178 Cb -0.16 -3.65 0.00 0.00 -0.52 0.00 0.00 37.83 33.50 2art s LYS 178 CO 0.12 -0.49 0.00 0.28 -0.92 0.00 0.00 175.35 174.34 2art n VAL 179 N 5.24 0.00 -1.36 3.17 0.31 -1.26 -4.83 118.33 119.60 2art n VAL 179 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2art n VAL 179 Cb 0.48 -0.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.40 2art n VAL 179 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2art n PRO 180 N -0.31 0.00 0.00 5.55 -0.06 -1.26 -5.20 135.00 133.72 2art n PRO 180 Ca 0.00 0.45 0.00 0.00 -0.06 0.00 0.00 63.50 63.89 2art n PRO 180 Cb 0.00 -0.92 0.00 0.00 -0.06 0.00 0.00 33.50 32.52 2art n PRO 180 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 175.50 175.89 2art n SER 191 N -0.02 0.00 -0.25 3.54 2.88 -1.26 -5.09 113.62 113.42 2art n SER 191 Ca 0.00 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.50 2art n SER 191 Cb 0.00 0.00 0.13 0.00 -0.75 0.00 0.00 64.21 63.59 2art n SER 191 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2art h THR 192 N 0.00 1.24 0.00 2.46 2.02 -1.98 -0.83 112.91 115.82 2art h THR 192 Ca 0.00 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 2art h THR 192 Cb 0.00 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 66.70 2art h THR 192 CO 0.00 0.29 -0.11 -0.09 0.37 0.00 0.00 175.52 175.99 2art h ARG 193 N 1.08 0.00 -0.01 6.66 9.65 -1.92 -1.93 114.38 127.91 2art h ARG 193 Ca 0.26 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.14 2art h ARG 193 Cb 0.13 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.71 2art h ARG 193 CO -0.03 0.11 -0.03 0.39 2.80 0.00 0.00 179.97 183.21 2art n GLU 194 N -4.23 1.44 0.00 0.20 1.02 -0.35 -4.00 120.64 114.71 2art n GLU 194 Ca -0.03 -0.74 0.04 0.00 -0.02 0.00 0.00 57.16 56.41 2art n GLU 194 Cb 0.19 -1.48 -0.04 0.00 -0.02 0.00 0.00 31.44 30.08 2art n GLU 194 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2art n ARG 195 N -0.13 4.19 -4.07 3.49 5.12 -0.73 -4.94 116.66 119.59 2art n ARG 195 Ca 0.19 -0.05 -0.23 0.00 -1.93 0.00 0.00 57.85 55.82 2art n ARG 195 Cb 0.32 -0.89 -0.06 0.00 -1.16 0.00 0.00 32.46 30.67 2art n ARG 195 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2art s VAL 196 N -1.69 2.79 0.08 1.55 -7.23 -1.17 -0.27 120.40 114.45 2art s VAL 196 Ca 0.03 -1.68 -0.26 0.00 -1.81 0.00 0.00 61.98 58.26 2art s VAL 196 Cb 0.06 -2.97 0.07 0.00 0.56 0.00 0.00 36.38 34.10 2art s VAL 196 CO 0.31 -0.12 0.66 0.00 -0.31 0.00 0.00 175.10 175.64 2art s ALA 197 N -2.48 -1.68 0.11 1.32 0.00 -0.55 -4.69 121.76 113.79 2art s ALA 197 Ca 0.39 0.80 -0.03 0.00 0.00 0.00 0.00 51.96 53.12 2art s ALA 197 Cb -0.01 0.55 -0.05 0.00 0.00 0.00 0.00 23.12 23.62 2art s ALA 197 CO 0.23 -0.64 0.32 -0.80 0.00 0.00 0.00 175.76 174.86 2art s ASN 198 N -2.25 6.44 0.43 0.00 0.02 -1.26 -4.33 114.94 113.99 2art s ASN 198 Ca -0.02 0.48 0.10 0.00 -1.02 0.00 0.00 52.86 52.40 2art s ASN 198 Cb -0.01 -2.04 0.96 0.00 0.02 0.00 0.00 41.25 40.18 2art s ASN 198 CO -0.06 0.10 2.05 0.58 0.02 0.00 0.00 177.10 179.79 2art h VAL 199 N 2.07 1.04 0.00 1.60 2.07 -0.92 -0.97 116.25 121.14 2art h VAL 199 Ca -0.46 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 66.91 2art h VAL 199 Cb 1.16 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2art h VAL 199 CO 0.74 0.08 0.00 0.35 0.02 0.00 0.00 177.57 178.76 2art n THR 200 N -4.48 0.39 0.31 2.57 -2.24 -0.90 -1.36 114.28 108.57 2art n THR 200 Ca 0.04 0.10 0.15 0.00 -2.27 0.00 0.00 64.05 62.07 2art n THR 200 Cb 0.15 -0.71 0.52 0.00 -2.10 0.00 0.00 70.33 68.20 2art n THR 200 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2art h ASP 201 N 0.00 0.00 0.00 3.42 3.32 -1.43 -3.34 116.42 118.39 2art h ASP 201 Ca 0.00 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 2art h ASP 201 Cb 0.34 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2art h ASP 201 CO 0.00 0.00 -1.56 0.49 -1.72 0.00 0.00 179.24 176.45 2art n PHE 202 N -2.88 0.00 -4.67 4.55 3.72 -0.73 -5.03 117.46 112.42 2art n PHE 202 Ca 0.02 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.19 2art n PHE 202 Cb 0.35 -0.63 -0.15 0.00 -0.94 0.00 0.00 39.48 38.11 2art n PHE 202 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 2art s VAL 203 N -2.61 1.14 -1.14 -4.37 -7.23 -0.46 -5.08 120.40 100.65 2art s VAL 203 Ca -0.29 -0.62 -0.20 0.00 -1.81 0.00 0.00 61.98 59.07 2art s VAL 203 Cb 0.08 -0.95 0.07 0.00 0.56 0.00 0.00 36.38 36.14 2art s VAL 203 CO 0.39 0.32 1.54 -0.62 -0.31 0.00 0.00 175.10 176.43 2art s ASP 204 N -0.33 6.70 0.13 4.85 2.15 -1.26 -3.78 116.67 125.13 2art s ASP 204 Ca 0.05 -2.03 0.06 0.00 0.43 0.00 0.00 52.55 51.06 2art s ASP 204 Cb -0.06 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 39.98 2art s ASP 204 CO -0.01 -1.27 -0.14 0.68 -0.17 0.00 0.00 175.17 174.26 2art s VAL 205 N 4.22 1.37 0.44 1.11 -7.23 -1.26 -5.13 120.40 113.92 2art s VAL 205 Ca 0.48 -1.80 0.04 0.00 -1.81 0.00 0.00 61.98 58.89 2art s VAL 205 Cb 0.01 -1.62 0.01 0.00 0.56 0.00 0.00 36.38 35.34 2art s VAL 205 CO -0.02 -0.46 0.62 -0.94 -0.31 0.00 0.00 175.10 174.00 2art s SER 206 N -2.61 5.67 0.21 4.85 1.04 -1.26 -4.87 113.70 116.73 2art s SER 206 Ca 0.11 -0.10 -0.09 0.00 0.48 0.00 0.00 55.95 56.36 2art s SER 206 Cb -0.04 -1.05 0.31 0.00 0.10 0.00 0.00 66.02 65.34 2art s SER 206 CO 0.03 -0.77 1.74 0.40 0.98 0.00 0.00 173.24 175.63 2art h ILE 207 N 0.50 0.75 -0.79 -1.02 1.08 -1.98 0.56 117.51 116.60 2art h ILE 207 Ca -0.43 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 63.88 2art h ILE 207 Cb 1.27 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 35.28 2art h ILE 207 CO 0.51 0.08 0.46 0.44 -0.69 0.00 0.00 178.15 178.95 2art h ASP 208 N 0.41 0.98 -0.68 1.72 3.32 -1.98 0.44 116.42 120.62 2art h ASP 208 Ca 0.32 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.29 2art h ASP 208 Cb 0.42 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 2art h ASP 208 CO -0.32 0.77 0.42 -0.33 -1.72 0.00 0.00 179.24 178.06 2art h GLU 209 N 1.10 0.92 -0.23 3.56 5.08 -1.52 0.45 114.58 123.93 2art h GLU 209 Ca 0.28 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.51 2art h GLU 209 Cb -0.00 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 2art h GLU 209 CO -0.05 0.64 -0.06 0.28 -1.00 0.00 0.00 179.01 178.82 2art h VAL 210 N 0.93 1.29 -0.49 3.13 2.07 -0.26 -1.25 116.25 121.67 2art h VAL 210 Ca 0.25 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.72 2art h VAL 210 Cb -0.05 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 2art h VAL 210 CO -0.05 0.33 0.30 -0.09 0.02 0.00 0.00 177.57 178.08 2art h ARG 211 N 0.17 0.58 0.00 1.57 2.43 0.22 -1.18 114.38 118.18 2art h ARG 211 Ca 0.06 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 2art h ARG 211 Cb 0.52 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2art h ARG 211 CO 0.02 0.38 -0.26 -0.91 -1.51 0.00 0.00 179.97 177.70 2art h ASN 212 N 0.60 0.00 -0.21 -3.80 2.35 -0.01 -1.01 115.58 113.50 2art h ASN 212 Ca 0.19 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.80 2art h ASN 212 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2art h ASN 212 CO -0.08 0.26 -0.44 0.00 -1.65 0.00 0.00 177.43 175.52 2art h ALA 213 N 1.74 0.33 -0.65 -0.83 0.00 -0.57 -2.89 119.26 116.39 2art h ALA 213 Ca -0.00 -0.47 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 2art h ALA 213 Cb 0.49 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2art h ALA 213 CO 0.03 0.46 0.11 -0.07 0.00 0.00 0.00 179.25 179.79 2art h LEU 214 N 0.36 1.02 -0.49 0.00 3.38 -0.84 0.28 115.31 119.02 2art h LEU 214 Ca 0.00 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.78 2art h LEU 214 Cb 1.05 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 2art h LEU 214 CO 0.10 1.01 0.24 0.40 0.09 0.00 0.00 178.44 180.28 2art h ILE 215 N 1.00 0.95 0.04 1.22 2.04 -1.17 0.79 117.51 122.38 2art h ILE 215 Ca 0.20 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.90 2art h ILE 215 Cb 0.42 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 2art h ILE 215 CO 0.01 0.09 -0.02 0.03 0.00 0.00 0.00 178.15 178.26 2art h ARG 216 N 0.47 -0.05 -0.18 2.37 3.08 -1.25 -1.51 114.38 117.30 2art h ARG 216 Ca 0.21 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.32 2art h ARG 216 Cb 0.13 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.14 2art h ARG 216 CO -0.16 0.20 -0.18 0.78 -1.07 0.00 0.00 179.97 179.55 2art h GLY 217 N -0.31 -0.08 1.25 0.04 0.00 -0.58 0.11 103.07 103.50 2art h GLY 217 Ca -0.01 0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.47 2art h GLY 217 CO 0.01 -0.17 0.05 0.74 0.00 0.00 0.00 176.54 177.17 2art h PHE 218 N -0.20 0.97 -0.34 5.60 -1.00 -0.89 0.83 116.94 121.91 2art h PHE 218 Ca 0.12 -0.13 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 2art h PHE 218 Cb 0.37 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.65 2art h PHE 218 CO -0.32 0.85 0.08 0.77 -1.61 0.00 0.00 178.31 178.08 2art h SER 219 N 0.86 0.52 -0.22 2.17 0.02 -0.73 -0.11 113.55 116.05 2art h SER 219 Ca 0.17 -0.23 -0.09 0.00 -0.84 0.00 0.00 61.79 60.80 2art h SER 219 Cb 0.43 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.83 2art h SER 219 CO 0.01 0.61 -0.20 -0.33 -1.14 0.00 0.00 176.83 175.79 2art h GLU 220 N 0.39 0.52 -0.20 3.45 5.08 -0.62 0.34 114.58 123.54 2art h GLU 220 Ca 0.11 -0.27 -0.06 0.00 -1.00 0.00 0.00 59.36 58.14 2art h GLU 220 Cb 0.30 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 2art h GLU 220 CO 0.00 0.85 -0.12 1.15 -1.00 0.00 0.00 179.01 179.89 2art h THR 221 N 0.21 1.31 -0.00 1.13 2.02 -0.84 -3.19 112.91 113.56 2art h THR 221 Ca 0.04 -1.21 0.00 0.00 0.77 0.00 0.00 66.41 66.01 2art h THR 221 Cb 0.74 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 68.82 2art h THR 221 CO 0.05 0.37 -0.36 0.18 0.37 0.00 0.00 175.52 176.13 2art n LEU 222 N -4.53 0.53 -3.50 2.58 4.77 -0.06 -4.95 117.00 111.83 2art n LEU 222 Ca -0.05 0.02 -0.20 0.00 -0.03 0.00 0.00 56.01 55.75 2art n LEU 222 Cb 0.34 -0.25 0.08 0.00 -2.33 0.00 0.00 43.42 41.26 2art n LEU 222 CO 0.40 0.12 0.14 1.41 -1.33 0.00 0.00 177.39 178.13 2art n HIS 223 N -1.30 -2.38 -4.65 -1.77 8.25 0.11 -5.01 115.22 108.47 2art n HIS 223 Ca 0.08 0.96 -0.27 0.00 -0.26 0.00 0.00 57.72 58.22 2art n HIS 223 Cb 0.33 -5.02 -0.17 0.00 1.12 0.00 0.00 29.99 26.26 2art n HIS 223 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2art s ILE 224 N -3.36 1.42 -0.97 1.59 1.01 -0.50 -4.75 121.20 115.63 2art s ILE 224 Ca 0.19 -0.63 -0.17 0.00 0.00 0.00 0.00 60.65 60.04 2art s ILE 224 Cb -0.08 -1.28 0.15 0.00 0.01 0.00 0.00 42.46 41.26 2art s ILE 224 CO 0.74 0.42 1.15 -0.62 0.00 0.00 0.00 174.94 176.63 2art s ASP 225 N 0.73 6.73 -0.43 3.58 2.15 0.15 -4.26 116.67 125.33 2art s ASP 225 Ca -0.12 -2.30 -0.28 0.00 0.43 0.00 0.00 52.55 50.28 2art s ASP 225 Cb -0.16 -2.38 -0.01 0.00 -0.30 0.00 0.00 42.92 40.08 2art s ASP 225 CO 0.03 -0.95 1.64 -0.36 -0.17 0.00 0.00 175.17 175.36 2art s PHE 226 N 2.20 2.03 -0.19 -5.34 0.08 -1.26 -1.68 117.98 113.82 2art s PHE 226 Ca 0.33 0.64 -0.07 0.00 0.12 0.00 0.00 56.93 57.95 2art s PHE 226 Cb -0.05 -4.21 -0.04 0.00 -0.57 0.00 0.00 43.02 38.15 2art s PHE 226 CO -0.08 -2.43 0.06 1.03 -0.10 0.00 0.00 175.22 173.70 2art s ARG 227 N 5.63 3.93 -0.02 0.44 0.52 -0.56 -4.70 118.95 124.20 2art s ARG 227 Ca 0.69 -0.36 -0.39 0.00 -0.52 0.00 0.00 55.73 55.14 2art s ARG 227 Cb -0.17 -3.21 -0.18 0.00 0.52 0.00 0.00 34.95 31.91 2art s ARG 227 CO 0.30 0.23 1.29 -1.91 0.02 0.00 0.00 175.30 175.23 2art n GLU 228 N 3.66 0.63 -3.74 3.54 2.13 -1.26 -2.09 120.64 123.50 2art n GLU 228 Ca -0.17 0.23 -0.15 0.00 0.66 0.00 0.00 57.16 57.73 2art n GLU 228 Cb 0.52 -1.81 -0.05 0.00 0.27 0.00 0.00 31.44 30.37 2art n GLU 228 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2art n ASP 229 N 2.45 -0.74 -4.39 4.31 4.64 0.44 -4.80 116.55 118.47 2art n ASP 229 Ca 0.20 -2.72 -0.22 0.00 -1.38 0.00 0.00 54.79 50.68 2art n ASP 229 Cb 0.13 1.59 -0.10 0.00 -1.04 0.00 0.00 41.12 41.69 2art n ASP 229 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 2art s THR 230 N -3.00 2.03 0.45 5.18 -4.23 -1.26 -4.50 115.64 110.32 2art s THR 230 Ca 0.30 -2.19 -0.23 0.00 -1.18 0.00 0.00 61.69 58.38 2art s THR 230 Cb 0.01 -2.08 -0.07 0.00 1.34 0.00 0.00 72.50 71.69 2art s THR 230 CO 0.21 -0.43 1.19 -0.51 -0.54 0.00 0.00 174.62 174.54 2art s ILE 231 N -2.52 3.00 0.67 2.99 2.07 -1.26 -5.02 121.20 121.13 2art s ILE 231 Ca 0.23 0.77 -0.07 0.00 -1.41 0.00 0.00 60.65 60.17 2art s ILE 231 Cb -0.04 -3.40 0.04 0.00 0.13 0.00 0.00 42.46 39.19 2art s ILE 231 CO 0.10 0.01 0.99 0.42 -1.91 0.00 0.00 174.94 174.55 2art s THR 232 N -1.49 2.96 0.26 4.00 -4.23 -1.26 -4.89 115.64 110.99 2art s THR 232 Ca 0.63 -0.04 -0.00 0.00 -1.18 0.00 0.00 61.69 61.09 2art s THR 232 Cb -0.30 -3.24 0.07 0.00 1.34 0.00 0.00 72.50 70.37 2art s THR 232 CO 0.37 -0.27 1.71 -0.33 -0.54 0.00 0.00 174.62 175.57 2art h GLU 233 N -0.48 0.64 0.09 3.99 5.08 -1.97 0.58 114.58 122.51 2art h GLU 233 Ca -0.45 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 57.68 2art h GLU 233 Cb 1.29 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2art h GLU 233 CO 0.61 0.78 -0.04 -0.22 -1.00 0.00 0.00 179.01 179.14 2art h LYS 234 N 0.58 -0.12 -0.53 2.33 3.64 -1.99 0.79 116.57 121.27 2art h LYS 234 Ca 0.09 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.42 2art h LYS 234 Cb 0.62 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.44 2art h LYS 234 CO 0.04 -0.06 0.10 0.93 -2.27 0.00 0.00 179.45 178.19 2art h GLU 235 N -0.15 0.87 0.00 1.90 5.08 -1.89 -1.91 114.58 118.48 2art h GLU 235 Ca -0.01 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2art h GLU 235 Cb 0.11 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 2art h GLU 235 CO 0.02 0.84 -0.03 1.49 -1.00 0.00 0.00 179.01 180.33 2art h GLU 236 N 0.75 0.00 0.16 2.33 4.57 -0.61 -0.94 114.58 120.83 2art h GLU 236 Ca 0.16 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 58.09 2art h GLU 236 Cb 0.39 0.00 0.03 0.00 -0.16 0.00 0.00 28.75 29.00 2art h GLU 236 CO 0.01 0.03 -1.08 0.77 -1.18 0.00 0.00 179.01 177.56 2art h SER 237 N 0.00 0.68 -0.51 1.04 0.02 -0.42 -2.80 113.55 111.56 2art h SER 237 Ca -0.00 -0.90 -0.03 0.00 -0.84 0.00 0.00 61.79 60.02 2art h SER 237 Cb 0.06 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 2art h SER 237 CO 0.00 1.52 0.21 0.25 -1.14 0.00 0.00 176.83 177.68 2art h LEU 238 N -0.05 0.73 -0.43 5.07 5.85 -0.96 -0.92 115.31 124.59 2art h LEU 238 Ca -0.18 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 2art h LEU 238 Cb 1.83 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.65 2art h LEU 238 CO 0.21 0.67 0.06 0.00 -0.34 0.00 0.00 178.44 179.03 2art h ALA 239 N 1.44 0.58 -0.56 1.25 0.00 -1.23 0.23 119.26 120.97 2art h ALA 239 Ca 0.19 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2art h ALA 239 Cb 0.17 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2art h ALA 239 CO -0.02 0.31 0.24 0.00 0.00 0.00 0.00 179.25 179.79 2art h ARG 240 N 0.58 0.79 -0.05 0.00 2.47 -1.16 0.40 114.38 117.42 2art h ARG 240 Ca 0.13 -0.11 -0.24 0.00 -1.26 0.00 0.00 59.98 58.50 2art h ARG 240 Cb 0.40 -0.15 0.02 0.00 -1.65 0.00 0.00 29.97 28.58 2art h ARG 240 CO 0.01 0.64 -0.92 1.49 0.56 0.00 0.00 179.97 181.75 2art h GLU 241 N 0.79 0.70 -0.25 0.04 4.81 -0.71 -2.06 114.58 117.90 2art h GLU 241 Ca 0.19 -0.70 -0.05 0.00 -0.13 0.00 0.00 59.36 58.68 2art h GLU 241 Cb 0.12 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2art h GLU 241 CO -0.02 1.28 -0.05 -0.07 -0.73 0.00 0.00 179.01 179.43 2art h LEU 242 N 0.39 0.35 0.59 1.64 3.38 -0.23 -1.26 115.31 120.17 2art h LEU 242 Ca -0.10 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 2art h LEU 242 Cb 1.57 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 42.23 2art h LEU 242 CO 0.18 0.45 -0.28 0.15 0.09 0.00 0.00 178.44 179.03 2art h PHE 243 N 0.37 -0.73 -0.97 1.13 3.57 -0.87 -0.19 116.94 119.25 2art h PHE 243 Ca 0.08 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.63 2art h PHE 243 Cb 0.32 0.24 -0.07 0.00 2.79 0.00 0.00 35.95 39.23 2art h PHE 243 CO 0.01 -0.45 0.62 -0.44 -2.23 0.00 0.00 178.31 175.81 2art h ASP 244 N -1.21 0.97 0.72 0.41 3.45 -1.34 0.10 116.42 119.53 2art h ASP 244 Ca -0.08 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.40 2art h ASP 244 Cb 0.61 -0.19 0.00 0.00 -0.56 0.00 0.00 39.33 39.19 2art h ASP 244 CO 0.13 0.61 -0.57 0.29 -1.57 0.00 0.00 179.24 178.13 2art n LYS 245 N -4.55 0.17 0.00 3.56 5.02 -0.48 -4.72 118.16 117.17 2art n LYS 245 Ca 0.15 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.49 2art n LYS 245 Cb 0.20 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2art n LYS 245 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2art n LYS 246 N -1.85 0.00 0.28 1.97 4.81 -0.14 -4.87 118.16 118.35 2art n LYS 246 Ca 0.04 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.59 2art n LYS 246 Cb 0.40 0.00 0.58 0.00 0.02 0.00 0.00 35.03 36.02 2art n LYS 246 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 2art h TYR 247 N 0.00 0.00 -0.00 5.64 -1.99 -1.35 0.42 116.97 119.69 2art h TYR 247 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2art h TYR 247 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2art h TYR 247 CO 0.00 0.00 -0.42 -1.13 -0.00 0.00 0.00 178.16 176.61 2art n SER 248 N -2.57 0.76 -4.89 3.88 3.41 -0.00 -4.84 113.62 109.37 2art n SER 248 Ca -0.01 -0.56 -0.30 0.00 -0.26 0.00 0.00 58.87 57.73 2art n SER 248 Cb 0.43 0.23 -0.04 0.00 -0.26 0.00 0.00 64.21 64.57 2art n SER 248 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2art s THR 249 N -2.79 4.97 0.11 6.66 -4.23 0.15 -5.02 115.64 115.50 2art s THR 249 Ca 0.16 0.29 -0.10 0.00 -1.18 0.00 0.00 61.69 60.86 2art s THR 249 Cb 0.18 -3.67 -0.16 0.00 1.34 0.00 0.00 72.50 70.19 2art s THR 249 CO 0.63 -0.20 1.31 -0.33 -0.54 0.00 0.00 174.62 175.50 2art h GLU 250 N 2.12 0.70 -0.77 3.99 5.08 -1.91 -2.96 114.58 120.83 2art h GLU 250 Ca -0.47 -0.60 0.06 0.00 -1.00 0.00 0.00 59.36 57.35 2art h GLU 250 Cb 1.18 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 30.52 2art h GLU 250 CO 0.68 1.21 0.51 1.05 -1.00 0.00 0.00 179.01 181.46 2art h GLU 251 N 0.46 0.81 -0.01 2.33 9.09 -1.95 0.10 114.58 125.41 2art h GLU 251 Ca -0.06 -0.05 -0.01 0.00 0.05 0.00 0.00 59.36 59.29 2art h GLU 251 Cb 1.44 -0.18 0.00 0.00 -1.65 0.00 0.00 28.75 28.36 2art h GLU 251 CO 0.16 0.54 -0.04 2.35 0.05 0.00 0.00 179.01 182.06 2art h TRP 252 N 0.83 0.07 0.00 2.06 2.91 -1.82 0.64 115.95 120.65 2art h TRP 252 Ca 0.33 -0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.32 2art h TRP 252 Cb 0.23 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 28.87 2art h TRP 252 CO -0.00 0.68 0.00 -0.91 -1.03 0.00 0.00 178.44 177.17 2art h ASN 253 N -0.56 0.00 1.04 2.65 2.35 -1.32 -1.85 115.58 117.90 2art h ASN 253 Ca -0.00 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.66 2art h ASN 253 Cb 0.68 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.03 2art h ASN 253 CO 0.01 0.00 -1.01 0.24 -1.65 0.00 0.00 177.43 175.02 2art h MET 254 N 0.00 0.00 0.00 0.81 2.86 -0.86 -3.40 114.93 114.34 2art h MET 254 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2art h MET 254 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 2art h MET 254 CO 0.00 0.22 0.00 0.41 1.06 0.00 0.00 176.91 178.60 2art n GLY 255 N 1.28 1.19 0.10 8.32 0.00 -0.70 -1.48 105.19 113.90 2art n GLY 255 Ca -0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 2art n GLY 255 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2art h LEU 256 N 0.00 0.23 0.00 0.99 6.46 0.07 -3.46 115.31 119.60 2art h LEU 256 Ca 0.00 -0.35 0.00 0.00 -0.12 0.00 0.00 57.88 57.41 2art h LEU 256 Cb 0.00 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 39.86 2art h LEU 256 CO 0.00 1.30 0.00 -0.11 -0.62 0.00 0.00 178.44 179.01