#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b0f h PRO 2 N 0.00 0.74 -0.10 1.61 0.11 -2.03 0.21 132.00 132.54 2b0f h PRO 2 Ca 0.00 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.88 2b0f h PRO 2 Cb 0.00 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 30.94 2b0f h PRO 2 CO 0.00 0.49 -0.70 -0.91 -0.21 0.00 0.00 178.00 176.67 2b0f h ASN 3 N 0.77 0.54 -0.34 -2.05 4.21 -1.96 -0.40 115.58 116.35 2b0f h ASN 3 Ca 0.23 -0.34 -0.04 0.00 1.21 0.00 0.00 56.30 57.35 2b0f h ASN 3 Cb -0.02 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 37.01 2b0f h ASN 3 CO -0.06 1.08 0.06 0.74 -1.29 0.00 0.00 177.43 177.96 2b0f h THR 4 N 0.32 1.24 -0.37 2.81 2.02 -1.81 0.90 112.91 118.02 2b0f h THR 4 Ca -0.03 -0.83 0.03 0.00 0.77 0.00 0.00 66.41 66.36 2b0f h THR 4 Cb 1.27 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.77 2b0f h THR 4 CO 0.12 0.28 0.18 -0.08 0.37 0.00 0.00 175.52 176.39 2b0f h GLU 5 N 0.40 0.35 -0.24 6.66 4.81 -0.50 0.25 114.58 126.31 2b0f h GLU 5 Ca 0.10 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2b0f h GLU 5 Cb 0.35 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2b0f h GLU 5 CO 0.01 0.23 0.02 0.35 -0.73 0.00 0.00 179.01 178.89 2b0f h PHE 6 N 0.36 0.44 -0.71 0.92 3.57 -0.93 -2.91 116.94 117.68 2b0f h PHE 6 Ca 0.16 -0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.60 2b0f h PHE 6 Cb 0.08 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.67 2b0f h PHE 6 CO -0.11 0.56 0.46 0.00 -2.23 0.00 0.00 178.31 176.99 2b0f h ALA 7 N 0.83 0.91 -0.42 2.41 0.00 -0.49 0.37 119.26 122.86 2b0f h ALA 7 Ca 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2b0f h ALA 7 Cb 0.37 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2b0f h ALA 7 CO 0.01 0.29 0.17 1.25 0.00 0.00 0.00 179.25 180.97 2b0f h LEU 8 N 0.94 0.58 -0.66 0.00 5.85 -0.94 0.65 115.31 121.72 2b0f h LEU 8 Ca 0.27 -0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.74 2b0f h LEU 8 Cb -0.08 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 2b0f h LEU 8 CO -0.07 0.59 0.09 -1.28 -0.34 0.00 0.00 178.44 177.42 2b0f h SER 9 N 0.53 1.07 -0.37 1.25 0.87 -1.31 -1.87 113.55 113.72 2b0f h SER 9 Ca 0.14 -0.27 -0.04 0.00 -1.23 0.00 0.00 61.79 60.39 2b0f h SER 9 Cb 0.19 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 2b0f h SER 9 CO -0.01 1.07 0.09 0.25 -0.53 0.00 0.00 176.83 177.70 2b0f h LEU 10 N 1.03 0.57 -0.50 2.23 5.85 -0.57 -2.49 115.31 121.43 2b0f h LEU 10 Ca 0.20 -0.23 0.07 0.00 0.84 0.00 0.00 57.88 58.76 2b0f h LEU 10 Cb 0.47 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.29 2b0f h LEU 10 CO 0.02 0.65 0.17 0.25 -0.34 0.00 0.00 178.44 179.19 2b0f h LEU 11 N 0.46 0.17 -0.17 2.25 6.46 0.53 0.31 115.31 125.33 2b0f h LEU 11 Ca 0.12 0.06 -0.08 0.00 -0.12 0.00 0.00 57.88 57.86 2b0f h LEU 11 Cb 0.30 0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 40.28 2b0f h LEU 11 CO 0.00 0.12 -0.19 0.03 -0.62 0.00 0.00 178.44 177.78 2b0f h ARG 12 N 0.35 0.42 -0.01 1.25 3.08 -1.25 -2.99 114.38 115.23 2b0f h ARG 12 Ca 0.24 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2b0f h ARG 12 Cb 0.26 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2b0f h ARG 12 CO -0.25 0.81 -0.14 1.63 -1.07 0.00 0.00 179.97 180.95 2b0f n LYS 13 N -4.48 1.42 0.00 0.04 5.02 -0.95 -4.68 118.16 114.53 2b0f n LYS 13 Ca -0.06 -1.08 0.00 0.00 -2.02 0.00 0.00 58.31 55.15 2b0f n LYS 13 Cb 0.40 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.16 2b0f n LYS 13 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2b0f n ASN 14 N 0.36 0.25 -4.23 4.39 4.13 0.99 -3.72 115.26 117.43 2b0f n ASN 14 Ca 0.07 -0.09 -0.41 0.00 1.68 0.00 0.00 54.58 55.84 2b0f n ASN 14 Cb 0.34 0.22 -0.09 0.00 -1.54 0.00 0.00 39.78 38.71 2b0f n ASN 14 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2b0f s ILE 15 N -0.27 4.21 -0.05 2.41 -1.09 -0.51 -0.59 121.20 125.31 2b0f s ILE 15 Ca 0.00 -1.65 0.06 0.00 -2.23 0.00 0.00 60.65 56.84 2b0f s ILE 15 Cb 0.00 -3.70 -0.01 0.00 -1.58 0.00 0.00 42.46 37.17 2b0f s ILE 15 CO 0.00 -0.68 -0.25 -0.04 -1.23 0.00 0.00 174.94 172.75 2b0f s MET 16 N 1.38 2.47 -0.57 2.79 -1.94 -0.88 -4.73 119.30 117.83 2b0f s MET 16 Ca 0.05 -0.90 -0.27 0.00 -1.71 0.00 0.00 55.69 52.86 2b0f s MET 16 Cb -0.25 -2.12 -0.01 0.00 2.01 0.00 0.00 34.83 34.45 2b0f s MET 16 CO 0.00 0.40 1.75 0.99 -0.01 0.00 0.00 175.02 178.15 2b0f s THR 17 N -0.21 3.46 -0.60 2.05 2.01 -1.26 -0.50 115.64 120.59 2b0f s THR 17 Ca -0.02 0.33 -0.19 0.00 0.31 0.00 0.00 61.69 62.12 2b0f s THR 17 Cb -0.13 -4.03 0.10 0.00 0.01 0.00 0.00 72.50 68.45 2b0f s THR 17 CO 0.03 -0.93 0.73 -0.63 -0.69 0.00 0.00 174.62 173.13 2b0f s ILE 18 N 8.10 4.77 -0.15 1.82 1.01 -0.12 -0.07 121.20 136.56 2b0f s ILE 18 Ca 0.65 -0.94 -0.15 0.00 0.00 0.00 0.00 60.65 60.21 2b0f s ILE 18 Cb -0.13 -4.51 -0.05 0.00 0.01 0.00 0.00 42.46 37.78 2b0f s ILE 18 CO 0.23 -1.16 0.35 0.28 0.00 0.00 0.00 174.94 174.63 2b0f s THR 19 N 2.82 5.27 0.00 2.92 -1.32 -0.88 -1.83 115.64 122.62 2b0f s THR 19 Ca 0.12 0.66 0.00 0.00 -1.21 0.00 0.00 61.69 61.27 2b0f s THR 19 Cb -0.23 -3.68 0.00 0.00 -1.51 0.00 0.00 72.50 67.07 2b0f s THR 19 CO 0.07 0.37 0.00 1.07 -2.21 0.00 0.00 174.62 173.92 2b0f n THR 20 N 3.58 0.00 -0.11 5.08 5.66 0.67 -2.14 114.28 127.02 2b0f n THR 20 Ca -0.11 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.84 2b0f n THR 20 Cb 0.52 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.31 2b0f n THR 20 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 2b0f h SER 21 N 0.00 -0.48 1.16 1.09 0.02 -1.74 -2.81 113.55 110.79 2b0f h SER 21 Ca 0.00 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2b0f h SER 21 Cb 0.00 0.29 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2b0f h SER 21 CO 0.00 -0.17 -0.46 0.50 -1.14 0.00 0.00 176.83 175.55 2b0f h LYS 22 N -0.06 0.00 0.00 3.45 1.63 -1.65 -3.50 116.57 116.44 2b0f h LYS 22 Ca 0.19 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.99 2b0f h LYS 22 Cb 0.34 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 2b0f h LYS 22 CO -0.42 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 175.99 2b0f n GLY 23 N 1.28 -0.33 3.25 5.01 0.00 -1.06 -5.05 105.19 108.29 2b0f n GLY 23 Ca 0.03 -1.13 -0.36 0.00 0.00 0.00 0.00 46.02 44.57 2b0f n GLY 23 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b0f s GLU 24 N -2.00 2.88 0.26 1.61 2.02 -1.26 -0.24 118.70 121.97 2b0f s GLU 24 Ca 0.00 -0.97 0.11 0.00 0.02 0.00 0.00 54.97 54.13 2b0f s GLU 24 Cb 0.00 -3.16 -0.05 0.00 0.10 0.00 0.00 34.13 31.02 2b0f s GLU 24 CO 0.00 -0.45 -0.19 -0.06 0.02 0.00 0.00 175.26 174.58 2b0f s PHE 25 N 1.38 2.17 -0.49 1.61 0.40 -0.76 -1.18 117.98 121.12 2b0f s PHE 25 Ca 0.00 -0.38 -0.28 0.00 -0.60 0.00 0.00 56.93 55.67 2b0f s PHE 25 Cb -0.17 -0.95 -0.00 0.00 0.51 0.00 0.00 43.02 42.40 2b0f s PHE 25 CO -0.01 0.64 1.60 0.99 0.70 0.00 0.00 175.22 179.14 2b0f s THR 26 N -2.57 3.64 -0.51 0.64 2.01 -1.22 -0.94 115.64 116.67 2b0f s THR 26 Ca 0.28 0.57 -0.22 0.00 0.31 0.00 0.00 61.69 62.63 2b0f s THR 26 Cb -0.04 -4.10 0.04 0.00 0.01 0.00 0.00 72.50 68.41 2b0f s THR 26 CO 0.13 -0.86 0.79 -0.83 -0.69 0.00 0.00 174.62 173.17 2b0f s GLY 27 N 5.54 1.58 -0.53 4.40 0.00 0.34 -4.72 107.32 113.94 2b0f s GLY 27 Ca 0.64 -1.36 -0.23 0.00 0.00 0.00 0.00 44.72 43.76 2b0f s GLY 27 CO 0.27 1.78 0.88 -2.27 0.00 0.00 0.00 173.10 173.77 2b0f s LEU 28 N 3.33 4.23 -0.14 0.66 2.96 -0.60 -2.07 118.68 127.04 2b0f s LEU 28 Ca 0.25 -0.36 -0.29 0.00 -0.22 0.00 0.00 54.13 53.50 2b0f s LEU 28 Cb -0.15 -2.82 -0.04 0.00 0.50 0.00 0.00 46.19 43.69 2b0f s LEU 28 CO 0.17 -1.13 1.58 -0.83 -1.32 0.00 0.00 176.35 174.82 2b0f s GLY 29 N 2.70 1.41 -0.08 7.98 0.00 0.25 -0.49 107.32 119.08 2b0f s GLY 29 Ca 0.29 0.66 -0.05 0.00 0.00 0.00 0.00 44.72 45.62 2b0f s GLY 29 CO 0.19 2.95 -0.09 -2.22 0.00 0.00 0.00 173.10 173.93 2b0f h ILE 30 N 5.82 0.00 -2.78 0.90 1.08 -0.97 -3.43 117.51 118.13 2b0f h ILE 30 Ca -0.35 -0.58 -0.14 0.00 -0.39 0.00 0.00 64.86 63.40 2b0f h ILE 30 Cb 1.16 0.00 -0.27 0.00 -3.07 0.00 0.00 36.82 34.64 2b0f h ILE 30 CO 0.98 0.00 -0.34 -1.38 -0.69 0.00 0.00 178.15 176.72 2b0f s HIS 31 N -1.68 -0.50 0.00 1.37 -3.43 -1.03 -0.99 115.29 109.04 2b0f s HIS 31 Ca -0.08 1.11 0.00 0.00 -0.80 0.00 0.00 55.06 55.29 2b0f s HIS 31 Cb 0.01 0.19 0.00 0.00 -1.43 0.00 0.00 32.58 31.35 2b0f s HIS 31 CO 0.11 -0.29 0.00 -3.47 -2.00 0.00 0.00 174.74 169.10 2b0f n ASP 32 N 3.96 0.00 -0.15 7.38 2.03 -1.12 -0.62 116.55 128.04 2b0f n ASP 32 Ca -0.22 0.00 0.03 0.00 0.52 0.00 0.00 54.79 55.12 2b0f n ASP 32 Cb 0.55 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.99 2b0f n ASP 32 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2b0f n ARG 33 N 0.00 1.07 -3.86 -0.67 1.85 -1.26 -0.35 116.66 113.44 2b0f n ARG 33 Ca 0.00 -1.43 -0.36 0.00 -1.00 0.00 0.00 57.85 55.06 2b0f n ARG 33 Cb 0.00 -0.89 -0.12 0.00 -1.05 0.00 0.00 32.46 30.40 2b0f n ARG 33 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2b0f s VAL 34 N -1.01 4.37 0.20 8.89 1.01 0.21 -1.97 120.40 132.09 2b0f s VAL 34 Ca 0.09 -0.16 0.10 0.00 0.00 0.00 0.00 61.98 62.01 2b0f s VAL 34 Cb 0.07 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 2b0f s VAL 34 CO 0.01 0.37 -0.20 0.00 0.00 0.00 0.00 175.10 175.28 2b0f s VAL 36 N -2.05 2.94 -0.05 0.00 1.01 0.36 0.74 120.40 123.35 2b0f s VAL 36 Ca 0.21 -0.74 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 2b0f s VAL 36 Cb -0.06 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.16 2b0f s VAL 36 CO 0.09 0.56 0.17 -0.51 0.00 0.00 0.00 175.10 175.41 2b0f s ILE 37 N -0.20 0.02 0.58 2.22 2.07 -0.65 -1.56 121.20 123.68 2b0f s ILE 37 Ca 0.00 -0.14 -0.18 0.00 -1.41 0.00 0.00 60.65 58.92 2b0f s ILE 37 Cb -0.13 -0.29 -0.07 0.00 0.13 0.00 0.00 42.46 42.10 2b0f s ILE 37 CO 0.03 -0.08 0.78 -2.65 -1.91 0.00 0.00 174.94 171.11 2b0f n PRO 38 N 2.66 0.73 0.02 3.50 -0.02 -1.26 -1.90 135.00 138.73 2b0f n PRO 38 Ca -0.15 0.29 -0.12 0.00 -2.02 0.00 0.00 63.50 61.50 2b0f n PRO 38 Cb 0.58 -1.96 -0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2b0f n PRO 38 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2b0f h THR 39 N 0.39 1.34 0.00 3.45 2.02 -1.86 -3.03 112.91 115.22 2b0f h THR 39 Ca -0.47 -2.06 0.00 0.00 0.77 0.00 0.00 66.41 64.65 2b0f h THR 39 Cb 1.38 2.04 0.00 0.00 -1.74 0.00 0.00 68.15 69.83 2b0f h THR 39 CO 0.49 0.63 0.00 0.00 0.37 0.00 0.00 175.52 177.01 2b0f n HIS 40 N -3.88 0.00 0.22 3.16 1.44 -1.26 -1.61 115.22 113.29 2b0f n HIS 40 Ca -0.05 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.77 2b0f n HIS 40 Cb 0.71 -0.06 0.38 0.00 0.12 0.00 0.00 29.99 31.14 2b0f n HIS 40 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2b0f h ALA 41 N 2.65 0.96 -5.61 1.59 0.00 -1.90 -3.45 119.26 113.50 2b0f h ALA 41 Ca 0.00 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 2b0f h ALA 41 Cb 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2b0f h ALA 41 CO 0.00 0.20 -0.29 1.04 0.00 0.00 0.00 179.25 180.19 2b0f n GLN 42 N -3.22 -1.55 -1.93 0.00 6.02 -0.64 -2.33 117.38 113.74 2b0f n GLN 42 Ca 0.01 1.48 -0.42 0.00 -0.01 0.00 0.00 57.00 58.07 2b0f n GLN 42 Cb 0.47 -5.09 -0.03 0.00 1.02 0.00 0.00 30.24 26.61 2b0f n GLN 42 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 2b0f s PRO 43 N -3.21 4.20 0.00 -1.09 0.02 -1.26 -3.76 135.00 129.90 2b0f s PRO 43 Ca 0.05 2.34 0.00 0.00 0.02 0.00 0.00 61.00 63.42 2b0f s PRO 43 Cb -0.01 -3.42 0.00 0.00 0.02 0.00 0.00 34.50 31.09 2b0f s PRO 43 CO 0.78 -0.68 0.00 0.41 -0.33 0.00 0.00 177.00 177.18 2b0f n GLY 44 N 3.90 -1.54 0.15 0.52 0.00 -1.26 -4.93 105.19 102.02 2b0f n GLY 44 Ca 0.15 -1.59 0.13 0.00 0.00 0.00 0.00 46.02 44.71 2b0f n GLY 44 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2b0f h ASP 45 N -0.31 0.00 -3.69 1.61 2.03 -1.95 -3.43 116.42 110.67 2b0f h ASP 45 Ca 0.00 0.00 -0.21 0.00 -0.73 0.00 0.00 57.03 56.09 2b0f h ASP 45 Cb 0.00 0.00 -0.28 0.00 -0.83 0.00 0.00 39.33 38.22 2b0f h ASP 45 CO 0.00 0.00 -0.59 1.51 -1.03 0.00 0.00 179.24 179.13 2b0f s ASP 46 N -4.96 -0.11 0.16 4.15 -4.77 -1.26 -1.12 116.67 108.75 2b0f s ASP 46 Ca 0.08 0.24 0.08 0.00 -3.30 0.00 0.00 52.55 49.65 2b0f s ASP 46 Cb 0.10 0.22 -0.04 0.00 -1.09 0.00 0.00 42.92 42.11 2b0f s ASP 46 CO 0.59 -0.07 -0.16 0.68 0.70 0.00 0.00 175.17 176.91 2b0f s VAL 47 N 0.33 1.65 -0.52 2.11 -7.23 -0.40 -4.87 120.40 111.46 2b0f s VAL 47 Ca -0.02 -1.92 -0.17 0.00 -1.81 0.00 0.00 61.98 58.05 2b0f s VAL 47 Cb -0.03 -1.80 0.09 0.00 0.56 0.00 0.00 36.38 35.20 2b0f s VAL 47 CO -0.01 -0.41 0.54 -0.76 -0.31 0.00 0.00 175.10 174.15 2b0f s LEU 48 N -2.75 5.53 -0.64 1.32 1.02 -0.91 0.29 118.68 122.54 2b0f s LEU 48 Ca 0.15 -1.34 -0.25 0.00 0.02 0.00 0.00 54.13 52.71 2b0f s LEU 48 Cb -0.04 -2.28 0.05 0.00 0.02 0.00 0.00 46.19 43.93 2b0f s LEU 48 CO 0.05 -0.85 1.06 0.54 0.02 0.00 0.00 176.35 177.17 2b0f s VAL 49 N 2.11 4.16 -1.36 -1.59 0.11 0.47 -2.08 120.40 122.21 2b0f s VAL 49 Ca 0.08 0.16 0.00 0.00 -2.93 0.00 0.00 61.98 59.29 2b0f s VAL 49 Cb -0.24 -4.70 0.00 0.00 -1.53 0.00 0.00 36.38 29.90 2b0f s VAL 49 CO 0.07 -1.44 0.00 -3.20 -3.33 0.00 0.00 175.10 167.20 2b0f n ASN 50 N 8.13 -4.71 0.00 3.54 5.15 0.89 -2.56 115.26 125.70 2b0f n ASN 50 Ca 0.01 0.32 0.00 0.00 -0.60 0.00 0.00 54.58 54.31 2b0f n ASN 50 Cb 0.47 -3.34 0.00 0.00 -0.53 0.00 0.00 39.78 36.38 2b0f n ASN 50 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2b0f n GLY 51 N -1.18 2.14 3.57 8.20 0.00 -1.24 -4.89 105.19 111.79 2b0f n GLY 51 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2b0f n GLY 51 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2b0f s GLN 52 N -0.15 3.72 0.10 1.61 0.74 -1.06 -4.91 119.66 119.72 2b0f s GLN 52 Ca 0.00 0.02 -0.31 0.00 0.05 0.00 0.00 55.36 55.12 2b0f s GLN 52 Cb 0.00 -3.78 -0.08 0.00 1.10 0.00 0.00 33.01 30.24 2b0f s GLN 52 CO 0.00 -0.64 1.52 -1.59 -0.55 0.00 0.00 175.29 174.03 2b0f s LYS 53 N 2.53 4.25 -0.01 1.67 -2.85 -1.26 -0.39 119.74 123.68 2b0f s LYS 53 Ca 0.22 2.22 0.00 0.00 -1.00 0.00 0.00 55.97 57.41 2b0f s LYS 53 Cb -0.15 -3.35 0.01 0.00 -2.06 0.00 0.00 37.83 32.27 2b0f s LYS 53 CO 0.13 -0.59 -0.00 -1.50 0.10 0.00 0.00 175.35 173.49 2b0f s ILE 54 N 1.69 0.06 0.34 3.79 1.10 0.15 -4.93 121.20 123.40 2b0f s ILE 54 Ca 0.69 0.01 -0.29 0.00 -0.51 0.00 0.00 60.65 60.55 2b0f s ILE 54 Cb -0.39 -0.09 -0.10 0.00 0.15 0.00 0.00 42.46 42.02 2b0f s ILE 54 CO 0.31 0.04 1.36 -0.60 -2.11 0.00 0.00 174.94 173.94 2b0f s ARG 55 N 0.25 4.29 0.05 3.50 3.52 -1.26 -1.28 118.95 128.01 2b0f s ARG 55 Ca -0.02 2.31 -0.22 0.00 -0.13 0.00 0.00 55.73 57.67 2b0f s ARG 55 Cb -0.04 -3.05 -0.06 0.00 -1.56 0.00 0.00 34.95 30.25 2b0f s ARG 55 CO -0.01 -0.29 0.66 0.54 -0.81 0.00 0.00 175.30 175.40 2b0f s VAL 56 N -1.05 4.74 -0.07 7.11 0.11 -0.27 -4.21 120.40 126.76 2b0f s VAL 56 Ca 0.51 1.42 -0.25 0.00 -2.93 0.00 0.00 61.98 60.73 2b0f s VAL 56 Cb -0.42 -4.01 -0.27 0.00 -1.53 0.00 0.00 36.38 30.16 2b0f s VAL 56 CO 0.55 0.45 0.92 0.50 -3.33 0.00 0.00 175.10 174.18 2b0f h LYS 57 N 5.19 0.18 -1.55 1.54 1.63 -1.24 -3.47 116.57 118.86 2b0f h LYS 57 Ca -0.46 -0.26 0.10 0.00 -0.85 0.00 0.00 60.65 59.18 2b0f h LYS 57 Cb 1.21 0.09 -0.27 0.00 -0.60 0.00 0.00 32.23 32.65 2b0f h LYS 57 CO 0.68 1.06 0.42 0.34 -3.45 0.00 0.00 179.45 178.50 2b0f s ASP 58 N -6.53 -0.48 -0.65 4.20 2.15 -0.28 -5.02 116.67 110.06 2b0f s ASP 58 Ca -0.16 0.82 -0.08 0.00 0.43 0.00 0.00 52.55 53.56 2b0f s ASP 58 Cb -0.00 1.07 0.17 0.00 -0.30 0.00 0.00 42.92 43.86 2b0f s ASP 58 CO 0.76 -0.13 0.52 -1.59 -0.17 0.00 0.00 175.17 174.56 2b0f s LYS 59 N 0.95 2.88 -0.54 4.34 -2.85 -1.26 -0.93 119.74 122.33 2b0f s LYS 59 Ca -0.05 -2.32 -0.24 0.00 -1.00 0.00 0.00 55.97 52.36 2b0f s LYS 59 Cb -0.04 -4.01 0.04 0.00 -2.06 0.00 0.00 37.83 31.76 2b0f s LYS 59 CO -0.12 -1.22 0.94 -0.47 0.10 0.00 0.00 175.35 174.58 2b0f s TYR 60 N 0.37 2.81 -0.18 1.78 5.04 -0.37 -4.90 117.35 121.90 2b0f s TYR 60 Ca 0.14 0.02 -0.29 0.00 -2.44 0.00 0.00 57.07 54.51 2b0f s TYR 60 Cb -0.19 -4.06 -0.01 0.00 0.35 0.00 0.00 41.96 38.06 2b0f s TYR 60 CO -0.04 -1.33 1.14 0.15 -1.34 0.00 0.00 175.55 174.13 2b0f s LYS 61 N 3.93 4.28 -0.38 4.97 1.02 -1.26 0.10 119.74 132.39 2b0f s LYS 61 Ca 0.31 1.51 -0.21 0.00 0.02 0.00 0.00 55.97 57.59 2b0f s LYS 61 Cb -0.12 -3.67 0.01 0.00 -0.52 0.00 0.00 37.83 33.53 2b0f s LYS 61 CO 0.20 -0.61 0.69 -0.51 -0.92 0.00 0.00 175.35 174.20 2b0f s LEU 62 N 3.09 4.26 0.45 3.17 1.43 0.26 -4.92 118.68 126.42 2b0f s LEU 62 Ca 0.50 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.70 2b0f s LEU 62 Cb -0.19 -2.85 0.00 0.00 0.03 0.00 0.00 46.19 43.18 2b0f s LEU 62 CO 0.12 -0.69 0.67 0.68 0.23 0.00 0.00 176.35 177.35 2b0f s VAL 63 N 2.89 3.78 0.24 -1.59 -7.23 -1.26 -2.68 120.40 114.55 2b0f s VAL 63 Ca 0.26 -0.58 -0.30 0.00 -1.81 0.00 0.00 61.98 59.56 2b0f s VAL 63 Cb -0.14 -3.39 -0.09 0.00 0.56 0.00 0.00 36.38 33.32 2b0f s VAL 63 CO 0.17 -0.26 1.21 -0.62 -0.31 0.00 0.00 175.10 175.29 2b0f s ASP 64 N -4.25 7.05 0.38 4.85 -1.08 0.49 -4.60 116.67 119.52 2b0f s ASP 64 Ca 0.50 2.36 0.16 0.00 -0.52 0.00 0.00 52.55 55.04 2b0f s ASP 64 Cb -0.10 -2.62 0.86 0.00 -1.46 0.00 0.00 42.92 39.60 2b0f s ASP 64 CO 0.37 -0.36 1.40 1.55 0.52 0.00 0.00 175.17 178.66 2b0f h PRO 65 N 4.47 0.00 -0.64 4.34 0.13 -1.96 0.99 132.00 139.32 2b0f h PRO 65 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2b0f h PRO 65 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2b0f h PRO 65 CO 0.71 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.87 2b0f n GLU 66 N -2.19 2.66 -1.01 0.86 1.02 -1.26 -4.85 120.64 115.87 2b0f n GLU 66 Ca -0.01 -1.58 -0.00 0.00 -0.02 0.00 0.00 57.16 55.55 2b0f n GLU 66 Cb 0.32 -1.70 -0.00 0.00 -0.02 0.00 0.00 31.44 30.05 2b0f n GLU 66 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2b0f n ASN 67 N 0.44 -4.16 -4.74 1.62 5.15 0.34 -5.01 115.26 108.90 2b0f n ASN 67 Ca 0.14 0.01 -0.23 0.00 -0.60 0.00 0.00 54.58 53.90 2b0f n ASN 67 Cb 0.60 -1.69 0.10 0.00 -0.53 0.00 0.00 39.78 38.26 2b0f n ASN 67 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2b0f s ILE 68 N -1.64 2.19 0.27 -1.44 1.01 -1.12 -4.83 121.20 115.65 2b0f s ILE 68 Ca 0.00 -0.63 -0.25 0.00 0.00 0.00 0.00 60.65 59.77 2b0f s ILE 68 Cb 0.00 -2.56 -0.09 0.00 0.01 0.00 0.00 42.46 39.82 2b0f s ILE 68 CO 0.00 0.00 0.88 0.21 0.00 0.00 0.00 174.94 176.03 2b0f s ASN 69 N -4.70 7.32 -0.01 3.58 2.47 -0.65 0.19 114.94 123.14 2b0f s ASN 69 Ca 0.65 1.73 0.01 0.00 0.42 0.00 0.00 52.86 55.68 2b0f s ASN 69 Cb -0.06 -2.54 -0.02 0.00 -1.45 0.00 0.00 41.25 37.18 2b0f s ASN 69 CO 0.43 0.01 0.01 -0.11 -3.72 0.00 0.00 177.10 173.73 2b0f n LEU 70 N 0.82 0.00 -0.05 3.21 7.94 -1.22 -0.01 117.00 127.70 2b0f n LEU 70 Ca -0.00 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 54.89 2b0f n LEU 70 Cb 0.50 0.03 -0.00 0.00 0.53 0.00 0.00 43.42 44.47 2b0f n LEU 70 CO 0.45 0.03 -0.01 1.21 -1.11 0.00 0.00 177.39 177.96 2b0f n GLU 71 N -1.93 -0.93 -3.20 1.96 4.07 -1.09 -4.86 120.64 114.66 2b0f n GLU 71 Ca -0.02 0.27 -0.44 0.00 -0.06 0.00 0.00 57.16 56.91 2b0f n GLU 71 Cb 0.42 -4.00 -0.06 0.00 -0.06 0.00 0.00 31.44 27.75 2b0f n GLU 71 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 2b0f s LEU 72 N -0.14 5.36 -0.34 4.31 2.96 -1.17 -2.55 118.68 127.11 2b0f s LEU 72 Ca 0.00 -1.25 -0.20 0.00 -0.22 0.00 0.00 54.13 52.46 2b0f s LEU 72 Cb 0.00 -2.33 -0.00 0.00 0.50 0.00 0.00 46.19 44.36 2b0f s LEU 72 CO 0.00 -0.91 0.62 -0.89 -1.32 0.00 0.00 176.35 173.85 2b0f s THR 73 N 2.35 4.91 -0.87 3.68 2.01 -0.80 0.89 115.64 127.81 2b0f s THR 73 Ca 0.11 0.64 -0.23 0.00 0.31 0.00 0.00 61.69 62.52 2b0f s THR 73 Cb -0.23 -4.05 0.07 0.00 0.01 0.00 0.00 72.50 68.30 2b0f s THR 73 CO 0.08 -0.26 1.24 -0.69 -0.69 0.00 0.00 174.62 174.31 2b0f s VAL 74 N 2.66 4.14 -0.61 3.82 1.01 0.28 -1.63 120.40 130.06 2b0f s VAL 74 Ca 0.24 -0.61 -0.27 0.00 0.00 0.00 0.00 61.98 61.34 2b0f s VAL 74 Cb -0.15 -4.89 0.03 0.00 0.00 0.00 0.00 36.38 31.38 2b0f s VAL 74 CO 0.14 -1.73 1.16 -0.22 0.00 0.00 0.00 175.10 174.45 2b0f s LEU 75 N 4.45 3.54 -0.34 3.92 2.96 0.23 -1.24 118.68 132.19 2b0f s LEU 75 Ca 0.36 -0.14 -0.14 0.00 -0.22 0.00 0.00 54.13 53.99 2b0f s LEU 75 Cb -0.06 -2.95 -0.01 0.00 0.50 0.00 0.00 46.19 43.67 2b0f s LEU 75 CO -0.00 -1.51 0.30 -0.89 -1.32 0.00 0.00 176.35 172.93 2b0f s THR 76 N 4.91 5.23 0.12 3.68 2.01 -0.11 -0.52 115.64 130.96 2b0f s THR 76 Ca 0.38 -0.11 0.10 0.00 0.31 0.00 0.00 61.69 62.37 2b0f s THR 76 Cb -0.09 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.60 2b0f s THR 76 CO 0.21 -0.07 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.11 2b0f s LEU 77 N 1.87 2.58 -0.93 4.42 1.02 -0.83 -0.72 118.68 126.08 2b0f s LEU 77 Ca 0.09 -0.62 -0.21 0.00 0.02 0.00 0.00 54.13 53.40 2b0f s LEU 77 Cb -0.17 -1.44 0.08 0.00 0.02 0.00 0.00 46.19 44.68 2b0f s LEU 77 CO 0.11 0.18 1.26 1.51 0.02 0.00 0.00 176.35 179.43 2b0f s ASP 78 N -2.12 6.50 -0.31 2.29 -4.77 -1.26 -4.74 116.67 112.26 2b0f s ASP 78 Ca 0.17 -1.60 -0.04 0.00 -3.30 0.00 0.00 52.55 47.78 2b0f s ASP 78 Cb -0.10 -2.48 0.04 0.00 -1.09 0.00 0.00 42.92 39.29 2b0f s ASP 78 CO 0.09 -1.34 0.04 -0.60 0.70 0.00 0.00 175.17 174.06 2b0f s ARG 79 N 3.98 2.54 0.08 2.11 6.06 -1.26 -4.93 118.95 127.52 2b0f s ARG 79 Ca 0.38 -1.21 -0.29 0.00 -2.50 0.00 0.00 55.73 52.11 2b0f s ARG 79 Cb -0.04 -3.29 -0.16 0.00 0.06 0.00 0.00 34.95 31.52 2b0f s ARG 79 CO -0.07 -0.62 1.67 -0.97 -2.50 0.00 0.00 175.30 172.81 2b0f h ASN 80 N 8.09 -0.50 -1.23 -2.12 -0.00 -1.95 -3.33 115.58 114.54 2b0f h ASN 80 Ca -0.23 0.03 -0.46 0.00 -0.00 0.00 0.00 56.30 55.64 2b0f h ASN 80 Cb 1.07 0.14 -0.07 0.00 -0.00 0.00 0.00 38.32 39.47 2b0f h ASN 80 CO 0.56 -0.33 1.13 -1.61 -0.00 0.00 0.00 177.43 177.19 2b0f s GLU 81 N -6.10 3.02 0.47 6.67 0.41 -1.26 -4.95 118.70 116.95 2b0f s GLU 81 Ca -0.16 -0.46 -0.22 0.00 -0.41 0.00 0.00 54.97 53.72 2b0f s GLU 81 Cb 0.05 -4.97 -0.07 0.00 -1.78 0.00 0.00 34.13 27.36 2b0f s GLU 81 CO 0.64 -2.72 1.14 0.15 -0.49 0.00 0.00 175.26 173.98 2b0f s LYS 82 N 6.13 3.73 0.22 1.61 1.02 -1.25 -4.99 119.74 126.20 2b0f s LYS 82 Ca 0.57 1.68 -0.15 0.00 0.02 0.00 0.00 55.97 58.09 2b0f s LYS 82 Cb -0.05 -2.32 -0.08 0.00 -0.52 0.00 0.00 37.83 34.86 2b0f s LYS 82 CO 0.01 -0.55 0.64 -0.06 -0.92 0.00 0.00 175.35 174.47 2b0f s PHE 83 N -1.63 3.53 0.01 3.18 0.08 0.52 -4.95 117.98 118.71 2b0f s PHE 83 Ca 0.65 1.15 -0.31 0.00 0.12 0.00 0.00 56.93 58.54 2b0f s PHE 83 Cb -0.26 -2.46 -0.10 0.00 -0.57 0.00 0.00 43.02 39.63 2b0f s PHE 83 CO 0.31 0.29 1.93 -2.13 -0.10 0.00 0.00 175.22 175.53 2b0f n ARG 84 N 0.33 2.66 -2.42 0.44 0.63 -1.24 -2.78 116.66 114.27 2b0f n ARG 84 Ca -0.01 0.97 -0.39 0.00 -0.92 0.00 0.00 57.85 57.50 2b0f n ARG 84 Cb 0.52 -2.89 -0.03 0.00 0.45 0.00 0.00 32.46 30.51 2b0f n ARG 84 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 2b0f s ASP 85 N 4.16 6.06 -0.07 6.15 -4.77 -1.25 -4.51 116.67 122.43 2b0f s ASP 85 Ca 0.89 -0.83 0.07 0.00 -3.30 0.00 0.00 52.55 49.39 2b0f s ASP 85 Cb -0.52 -2.56 0.32 0.00 -1.09 0.00 0.00 42.92 39.07 2b0f s ASP 85 CO 0.44 -1.89 1.08 2.30 0.70 0.00 0.00 175.17 177.80 2b0f n ILE 86 N 6.91 0.93 0.29 2.11 -5.35 -0.16 -4.31 119.36 119.79 2b0f n ILE 86 Ca 0.23 -0.53 0.17 0.00 -0.27 0.00 0.00 62.75 62.36 2b0f n ILE 86 Cb 0.50 -0.23 0.96 0.00 -1.74 0.00 0.00 39.64 39.13 2b0f n ILE 86 CO 0.00 0.00 0.00 0.08 -1.76 0.00 0.00 176.55 174.87 2b0f h ARG 87 N 1.69 0.00 0.00 6.28 -0.00 -1.85 0.05 114.38 120.55 2b0f h ARG 87 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2b0f h ARG 87 Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.88 2b0f h ARG 87 CO 0.15 0.00 -0.28 0.41 -0.00 0.00 0.00 179.97 180.25 2b0f n GLY 88 N -1.28 -1.53 0.50 0.08 0.00 -1.26 -3.07 105.19 98.63 2b0f n GLY 88 Ca -0.02 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 45.97 2b0f n GLY 88 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2b0f n PHE 89 N -2.02 0.00 -2.82 1.61 3.72 -0.02 -4.88 117.46 113.05 2b0f n PHE 89 Ca 0.05 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.03 2b0f n PHE 89 Cb 0.41 -0.04 -0.04 0.00 -0.94 0.00 0.00 39.48 38.88 2b0f n PHE 89 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2b0f s ILE 90 N -2.34 4.89 -0.45 4.37 1.01 -1.07 -0.06 121.20 127.56 2b0f s ILE 90 Ca 0.25 1.81 -0.26 0.00 0.00 0.00 0.00 60.65 62.45 2b0f s ILE 90 Cb 0.19 -4.21 0.03 0.00 0.01 0.00 0.00 42.46 38.48 2b0f s ILE 90 CO 0.48 0.11 0.98 -0.44 0.00 0.00 0.00 174.94 176.06 2b0f s SER 91 N 1.02 6.57 -0.05 3.58 0.01 -0.24 -4.19 113.70 120.40 2b0f s SER 91 Ca 0.44 0.29 -0.27 0.00 1.31 0.00 0.00 55.95 57.73 2b0f s SER 91 Cb -0.18 -2.48 -0.22 0.00 0.21 0.00 0.00 66.02 63.35 2b0f s SER 91 CO 0.19 -1.06 1.15 -0.08 0.41 0.00 0.00 173.24 173.85 2b0f h GLU 92 N 8.99 0.00 -4.91 12.44 4.22 -1.89 -3.32 114.58 130.12 2b0f h GLU 92 Ca -0.24 -0.00 -0.66 0.00 0.08 0.00 0.00 59.36 58.54 2b0f h GLU 92 Cb 1.07 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.15 2b0f h GLU 92 CO 1.04 0.61 -0.33 0.34 -2.18 0.00 0.00 179.01 178.49 2b0f s ASP 93 N -5.82 6.15 0.00 1.04 2.15 -1.26 -4.78 116.67 114.15 2b0f s ASP 93 Ca -0.17 -0.24 0.00 0.00 0.43 0.00 0.00 52.55 52.57 2b0f s ASP 93 Cb 0.01 -2.18 0.00 0.00 -0.30 0.00 0.00 42.92 40.44 2b0f s ASP 93 CO 0.68 -0.30 0.86 0.18 -0.17 0.00 0.00 175.17 176.41 2b0f n LEU 94 N 5.31 0.03 -3.15 -1.34 4.77 -1.26 -4.96 117.00 116.40 2b0f n LEU 94 Ca -0.10 0.87 -0.05 0.00 -0.03 0.00 0.00 56.01 56.70 2b0f n LEU 94 Cb 0.50 -0.39 0.02 0.00 -2.33 0.00 0.00 43.42 41.21 2b0f n LEU 94 CO 0.39 -0.39 0.24 1.21 -1.33 0.00 0.00 177.39 177.51 2b0f n GLU 95 N -1.66 -1.54 -3.12 3.23 2.13 -1.26 -4.94 120.64 113.47 2b0f n GLU 95 Ca 0.00 1.29 -0.19 0.00 0.66 0.00 0.00 57.16 58.92 2b0f n GLU 95 Cb 0.00 -5.59 -0.05 0.00 0.27 0.00 0.00 31.44 26.07 2b0f n GLU 95 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2b0f n GLY 96 N -1.64 1.57 0.86 8.31 0.00 -1.26 -4.89 105.19 108.14 2b0f n GLY 96 Ca -0.03 -0.86 0.12 0.00 0.00 0.00 0.00 46.02 45.25 2b0f n GLY 96 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2b0f n VAL 97 N 2.23 0.07 -3.69 1.61 3.14 -1.25 -4.37 118.33 116.09 2b0f n VAL 97 Ca 0.22 -0.47 -0.11 0.00 -2.96 0.00 0.00 64.34 61.02 2b0f n VAL 97 Cb 0.53 1.17 -0.11 0.00 -1.06 0.00 0.00 33.84 34.37 2b0f n VAL 97 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2b0f s ASP 98 N -1.92 -0.24 0.34 6.55 -1.08 -1.23 -1.98 116.67 117.11 2b0f s ASP 98 Ca 0.32 0.79 -0.10 0.00 -0.52 0.00 0.00 52.55 53.04 2b0f s ASP 98 Cb 0.20 0.83 0.02 0.00 -1.46 0.00 0.00 42.92 42.52 2b0f s ASP 98 CO 0.31 -0.21 0.60 0.00 0.52 0.00 0.00 175.17 176.39 2b0f s ALA 99 N 1.86 -0.05 -0.05 3.66 0.00 -1.07 -4.95 121.76 121.16 2b0f s ALA 99 Ca -0.06 -1.07 0.04 0.00 0.00 0.00 0.00 51.96 50.87 2b0f s ALA 99 Cb -0.10 0.95 -0.02 0.00 0.00 0.00 0.00 23.12 23.95 2b0f s ALA 99 CO -0.11 -0.89 -0.17 0.99 0.00 0.00 0.00 175.76 175.59 2b0f s THR 100 N -3.00 2.84 -0.29 0.00 2.01 0.21 -1.56 115.64 115.85 2b0f s THR 100 Ca 0.23 -0.80 -0.01 0.00 0.31 0.00 0.00 61.69 61.42 2b0f s THR 100 Cb -0.02 -2.10 0.05 0.00 0.01 0.00 0.00 72.50 70.43 2b0f s THR 100 CO 0.15 0.58 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.41 2b0f s LEU 101 N -0.58 3.74 -0.21 4.42 1.98 0.96 0.12 118.68 129.11 2b0f s LEU 101 Ca 0.08 -1.24 -0.06 0.00 -2.89 0.00 0.00 54.13 50.03 2b0f s LEU 101 Cb -0.11 -1.68 -0.03 0.00 0.66 0.00 0.00 46.19 45.03 2b0f s LEU 101 CO 0.01 -0.23 0.03 0.68 -1.89 0.00 0.00 176.35 174.94 2b0f s VAL 102 N 1.24 4.19 -0.05 1.68 -7.23 -0.45 -1.36 120.40 118.42 2b0f s VAL 102 Ca -0.05 -0.23 0.04 0.00 -1.81 0.00 0.00 61.98 59.93 2b0f s VAL 102 Cb -0.19 -2.91 -0.03 0.00 0.56 0.00 0.00 36.38 33.82 2b0f s VAL 102 CO -0.02 0.41 -0.15 -0.69 -0.31 0.00 0.00 175.10 174.34 2b0f s VAL 103 N 1.00 2.98 -0.44 1.32 1.01 -0.21 0.23 120.40 126.30 2b0f s VAL 103 Ca 0.03 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.32 2b0f s VAL 103 Cb -0.14 -2.16 0.23 0.00 0.00 0.00 0.00 36.38 34.31 2b0f s VAL 103 CO 0.02 0.59 0.66 1.57 0.00 0.00 0.00 175.10 177.94 2b0f n HIS 104 N 2.34 -1.86 -4.26 5.22 -0.00 -1.03 -2.31 115.22 113.31 2b0f n HIS 104 Ca -0.17 -2.66 -0.12 0.00 0.46 0.00 0.00 57.72 55.23 2b0f n HIS 104 Cb 0.52 0.60 -0.03 0.00 -0.12 0.00 0.00 29.99 30.96 2b0f n HIS 104 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2b0f n SER 105 N 1.77 1.79 -0.18 0.26 3.41 0.82 -3.46 113.62 118.02 2b0f n SER 105 Ca 0.17 -1.92 -0.06 0.00 -0.26 0.00 0.00 58.87 56.79 2b0f n SER 105 Cb 0.57 0.30 0.03 0.00 -0.26 0.00 0.00 64.21 64.84 2b0f n SER 105 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 2b0f h ASN 106 N 0.60 0.61 0.16 4.04 -0.73 -1.43 -3.24 115.58 115.60 2b0f h ASN 106 Ca -0.15 -0.01 -0.33 0.00 1.87 0.00 0.00 56.30 57.67 2b0f h ASN 106 Cb 0.52 -0.15 0.00 0.00 0.27 0.00 0.00 38.32 38.97 2b0f h ASN 106 CO 0.25 0.44 -1.67 -1.13 -0.37 0.00 0.00 177.43 174.95 2b0f h ASN 107 N 0.72 0.54 -3.70 1.15 -0.00 -1.86 -3.43 115.58 109.01 2b0f h ASN 107 Ca 0.20 -0.92 -0.68 0.00 -0.00 0.00 0.00 56.30 54.90 2b0f h ASN 107 Cb -0.07 -0.18 -0.37 0.00 -0.00 0.00 0.00 38.32 37.70 2b0f h ASN 107 CO -0.05 1.75 -0.59 -0.36 -0.00 0.00 0.00 177.43 178.18 2b0f s PHE 108 N -2.55 3.60 -0.23 0.67 0.08 -1.22 -5.04 117.98 113.28 2b0f s PHE 108 Ca -0.17 -2.71 -0.07 0.00 0.12 0.00 0.00 56.93 54.09 2b0f s PHE 108 Cb 0.05 -3.09 -0.03 0.00 -0.57 0.00 0.00 43.02 39.38 2b0f s PHE 108 CO 0.82 -0.93 0.07 0.99 -0.10 0.00 0.00 175.22 176.07 2b0f s THR 109 N 0.81 4.42 -0.42 0.64 2.01 -1.24 -0.13 115.64 121.74 2b0f s THR 109 Ca 0.11 -0.14 -0.04 0.00 0.31 0.00 0.00 61.69 61.93 2b0f s THR 109 Cb -0.22 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 69.25 2b0f s THR 109 CO -0.05 0.37 0.44 -3.20 -0.69 0.00 0.00 174.62 171.49 2b0f n ASN 110 N 4.54 -5.89 -3.51 3.53 2.85 -0.98 -4.98 115.26 110.82 2b0f n ASN 110 Ca -0.16 0.09 -0.25 0.00 -0.11 0.00 0.00 54.58 54.15 2b0f n ASN 110 Cb 0.52 -3.89 -0.14 0.00 1.24 0.00 0.00 39.78 37.51 2b0f n ASN 110 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2b0f s THR 111 N -2.69 -0.18 -0.43 -0.44 2.01 -1.02 -5.01 115.64 107.88 2b0f s THR 111 Ca 0.06 -0.52 -0.17 0.00 0.31 0.00 0.00 61.69 61.37 2b0f s THR 111 Cb -0.02 -0.88 0.03 0.00 0.01 0.00 0.00 72.50 71.65 2b0f s THR 111 CO 0.50 -0.53 0.41 -0.63 -0.69 0.00 0.00 174.62 173.68 2b0f s ILE 112 N 2.19 5.14 -0.14 1.82 1.01 -1.26 -1.04 121.20 128.92 2b0f s ILE 112 Ca 0.08 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 60.18 2b0f s ILE 112 Cb -0.15 -4.04 0.02 0.00 0.01 0.00 0.00 42.46 38.29 2b0f s ILE 112 CO -0.29 -0.45 -0.14 -0.22 0.00 0.00 0.00 174.94 173.85 2b0f s LEU 113 N 1.97 1.64 -0.18 2.97 0.20 -0.46 -4.99 118.68 119.84 2b0f s LEU 113 Ca 0.09 -0.46 -0.29 0.00 0.69 0.00 0.00 54.13 54.16 2b0f s LEU 113 Cb -0.19 -1.13 -0.02 0.00 -0.43 0.00 0.00 46.19 44.42 2b0f s LEU 113 CO 0.11 -0.05 1.42 -1.61 -0.29 0.00 0.00 176.35 175.93 2b0f s GLU 114 N 1.42 4.08 0.01 1.98 0.41 -1.26 -0.03 118.70 125.31 2b0f s GLU 114 Ca 0.03 1.70 0.17 0.00 -0.41 0.00 0.00 54.97 56.45 2b0f s GLU 114 Cb -0.13 -3.88 -0.17 0.00 -1.78 0.00 0.00 34.13 28.16 2b0f s GLU 114 CO -0.09 -0.93 0.69 1.55 -0.49 0.00 0.00 175.26 175.99 2b0f n VAL 115 N 5.75 1.17 0.00 2.63 3.14 -0.60 -4.93 118.33 125.48 2b0f n VAL 115 Ca 0.16 -0.71 0.00 0.00 -2.96 0.00 0.00 64.34 60.83 2b0f n VAL 115 Cb 0.45 -0.68 0.00 0.00 -1.06 0.00 0.00 33.84 32.55 2b0f n VAL 115 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2b0f n GLY 116 N 1.45 1.07 3.65 7.55 0.00 -1.17 -4.85 105.19 112.89 2b0f n GLY 116 Ca -0.13 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 2b0f n GLY 116 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2b0f s PRO 117 N 0.00 4.05 0.00 1.61 0.02 -1.25 -2.59 135.00 136.85 2b0f s PRO 117 Ca 0.00 2.38 0.01 0.00 0.02 0.00 0.00 61.00 63.41 2b0f s PRO 117 Cb 0.00 -4.12 -0.01 0.00 0.02 0.00 0.00 34.50 30.40 2b0f s PRO 117 CO 0.00 -1.03 -0.05 0.54 -0.33 0.00 0.00 177.00 176.13 2b0f s VAL 118 N 4.68 0.37 -0.18 3.83 0.11 -0.84 -3.96 120.40 124.42 2b0f s VAL 118 Ca 0.84 -0.35 -0.16 0.00 -2.93 0.00 0.00 61.98 59.38 2b0f s VAL 118 Cb -0.38 -0.35 0.05 0.00 -1.53 0.00 0.00 36.38 34.17 2b0f s VAL 118 CO 0.37 0.00 0.47 -0.89 -3.33 0.00 0.00 175.10 171.72 2b0f s THR 119 N -0.35 -0.00 0.29 5.04 2.01 0.98 -3.82 115.64 119.79 2b0f s THR 119 Ca -0.01 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 61.71 2b0f s THR 119 Cb -0.03 -0.66 -0.10 0.00 0.01 0.00 0.00 72.50 71.72 2b0f s THR 119 CO -0.00 0.00 1.11 0.00 -0.69 0.00 0.00 174.62 175.04 2b0f s MET 120 N 0.32 4.61 -0.05 4.92 0.23 -1.26 -0.94 119.30 127.13 2b0f s MET 120 Ca -0.01 1.81 -0.03 0.00 -1.03 0.00 0.00 55.69 56.43 2b0f s MET 120 Cb -0.04 -3.16 -0.01 0.00 -1.53 0.00 0.00 34.83 30.09 2b0f s MET 120 CO -0.00 0.18 -0.07 0.00 -2.03 0.00 0.00 175.02 173.10 2b0f n ALA 121 N 1.13 0.17 0.00 3.16 0.00 -0.26 -4.78 120.51 119.92 2b0f n ALA 121 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2b0f n ALA 121 Cb 0.45 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.90 2b0f n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b0f n GLY 122 N 1.70 0.41 3.49 0.00 0.00 -1.13 -4.97 105.19 104.69 2b0f n GLY 122 Ca -0.03 -0.56 -0.38 0.00 0.00 0.00 0.00 46.02 45.06 2b0f n GLY 122 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b0f s LEU 123 N 0.00 3.98 0.00 0.99 0.20 -1.26 -1.18 118.68 121.40 2b0f s LEU 123 Ca 0.00 -0.30 0.05 0.00 0.69 0.00 0.00 54.13 54.57 2b0f s LEU 123 Cb 0.00 -2.03 -0.02 0.00 -0.43 0.00 0.00 46.19 43.71 2b0f s LEU 123 CO 0.00 -0.12 0.17 2.30 -0.29 0.00 0.00 176.35 178.41 2b0f n ILE 124 N 5.01 0.00 -3.49 6.68 -5.35 0.09 -4.98 119.36 117.32 2b0f n ILE 124 Ca -0.14 -1.59 -0.41 0.00 -0.27 0.00 0.00 62.75 60.33 2b0f n ILE 124 Cb 0.50 0.76 -0.04 0.00 -1.74 0.00 0.00 39.64 39.13 2b0f n ILE 124 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 2b0f s ASN 125 N -2.55 6.47 -0.35 7.28 -0.87 -1.26 0.34 114.94 124.00 2b0f s ASN 125 Ca 0.24 -3.33 -0.28 0.00 -1.57 0.00 0.00 52.86 47.92 2b0f s ASN 125 Cb 0.01 -2.06 -0.03 0.00 -0.02 0.00 0.00 41.25 39.15 2b0f s ASN 125 CO 0.17 -0.33 1.94 -0.22 -2.57 0.00 0.00 177.10 176.09 2b0f s LEU 126 N -0.80 3.46 -1.55 0.60 2.96 0.06 -2.17 118.68 121.25 2b0f s LEU 126 Ca 0.25 1.30 -0.03 0.00 -0.22 0.00 0.00 54.13 55.43 2b0f s LEU 126 Cb -0.11 -3.32 0.00 0.00 0.50 0.00 0.00 46.19 43.26 2b0f s LEU 126 CO -0.09 -1.93 0.39 -1.20 -1.32 0.00 0.00 176.35 172.20 2b0f n SER 127 N 11.29 -5.82 0.00 3.68 7.64 -1.26 -0.92 113.62 128.24 2b0f n SER 127 Ca 0.25 -0.19 0.00 0.00 1.01 0.00 0.00 58.87 59.94 2b0f n SER 127 Cb 0.48 -4.71 0.00 0.00 -1.01 0.00 0.00 64.21 58.97 2b0f n SER 127 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2b0f n SER 128 N -2.11 -3.10 -4.25 6.43 2.88 -0.92 -5.01 113.62 107.55 2b0f n SER 128 Ca -0.15 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.03 2b0f n SER 128 Cb 0.64 -0.89 -0.13 0.00 -0.75 0.00 0.00 64.21 63.07 2b0f n SER 128 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2b0f s THR 129 N -2.02 3.37 -0.27 2.46 2.01 -0.09 -5.01 115.64 116.09 2b0f s THR 129 Ca 0.00 -0.99 -0.35 0.00 0.31 0.00 0.00 61.69 60.66 2b0f s THR 129 Cb 0.00 -2.79 -0.11 0.00 0.01 0.00 0.00 72.50 69.61 2b0f s THR 129 CO 0.00 0.05 2.08 -0.81 -0.69 0.00 0.00 174.62 175.25 2b0f n PRO 130 N 4.74 1.44 -4.97 4.92 -0.04 -1.26 -0.76 135.00 139.08 2b0f n PRO 130 Ca -0.15 0.45 -0.27 0.00 -0.04 0.00 0.00 63.50 63.50 2b0f n PRO 130 Cb 0.46 -2.56 -0.16 0.00 -0.04 0.00 0.00 33.50 31.21 2b0f n PRO 130 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2b0f s THR 131 N 6.31 1.57 0.26 0.52 2.01 0.15 -1.63 115.64 124.83 2b0f s THR 131 Ca 1.04 -0.85 0.10 0.00 0.31 0.00 0.00 61.69 62.29 2b0f s THR 131 Cb -0.78 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.38 2b0f s THR 131 CO 0.50 0.44 -0.02 0.21 -0.69 0.00 0.00 174.62 175.06 2b0f s ASN 132 N -0.43 4.48 -1.03 3.53 2.47 0.99 -0.74 114.94 124.21 2b0f s ASN 132 Ca 0.07 -0.66 -0.10 0.00 0.42 0.00 0.00 52.86 52.59 2b0f s ASN 132 Cb -0.08 -0.81 -0.04 0.00 -1.45 0.00 0.00 41.25 38.87 2b0f s ASN 132 CO -0.01 0.01 0.85 0.54 -3.72 0.00 0.00 177.10 174.77 2b0f n ARG 133 N -0.83 -1.80 -4.48 0.43 1.74 -0.33 -4.67 116.66 106.73 2b0f n ARG 133 Ca -0.07 0.81 -0.34 0.00 -0.77 0.00 0.00 57.85 57.49 2b0f n ARG 133 Cb 0.59 -5.21 -0.12 0.00 -1.02 0.00 0.00 32.46 26.70 2b0f n ARG 133 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2b0f s MET 134 N -4.73 3.42 0.27 5.56 -1.94 -0.75 -2.78 119.30 118.35 2b0f s MET 134 Ca 0.40 -0.53 -0.17 0.00 -1.71 0.00 0.00 55.69 53.68 2b0f s MET 134 Cb -0.09 -2.82 -0.08 0.00 2.01 0.00 0.00 34.83 33.85 2b0f s MET 134 CO 0.78 0.36 0.72 0.42 -0.01 0.00 0.00 175.02 177.29 2b0f s ILE 135 N 0.04 4.65 0.04 2.53 1.01 0.36 -1.11 121.20 128.72 2b0f s ILE 135 Ca -0.00 1.07 0.04 0.00 0.00 0.00 0.00 60.65 61.76 2b0f s ILE 135 Cb -0.13 -3.72 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 2b0f s ILE 135 CO 0.03 0.01 -0.12 -0.60 0.00 0.00 0.00 174.94 174.26 2b0f s ARG 136 N -2.49 0.76 -0.05 2.79 3.52 -0.12 -0.61 118.95 122.74 2b0f s ARG 136 Ca 0.48 -0.74 -0.03 0.00 -0.13 0.00 0.00 55.73 55.32 2b0f s ARG 136 Cb -0.13 -0.70 0.02 0.00 -1.56 0.00 0.00 34.95 32.58 2b0f s ARG 136 CO 0.19 0.17 0.12 1.52 -0.81 0.00 0.00 175.30 176.49 2b0f s TYR 137 N -0.99 -0.13 -0.86 5.12 -0.85 -0.73 -0.02 117.35 118.89 2b0f s TYR 137 Ca -0.02 0.38 -0.23 0.00 -0.52 0.00 0.00 57.07 56.68 2b0f s TYR 137 Cb -0.08 -0.03 0.06 0.00 0.38 0.00 0.00 41.96 42.29 2b0f s TYR 137 CO 0.01 -0.11 1.25 0.16 -1.52 0.00 0.00 175.55 175.34 2b0f s ASP 138 N 0.62 6.37 -0.22 -0.18 -4.77 -1.25 -0.38 116.67 116.85 2b0f s ASP 138 Ca -0.05 -1.21 -0.15 0.00 -3.30 0.00 0.00 52.55 47.84 2b0f s ASP 138 Cb -0.06 -2.51 0.06 0.00 -1.09 0.00 0.00 42.92 39.33 2b0f s ASP 138 CO -0.03 -1.50 0.56 -0.47 0.70 0.00 0.00 175.17 174.43 2b0f s TYR 139 N 4.57 -0.76 -0.34 2.11 5.04 0.12 -4.98 117.35 123.10 2b0f s TYR 139 Ca 0.36 1.65 -0.27 0.00 -2.44 0.00 0.00 57.07 56.37 2b0f s TYR 139 Cb -0.06 0.37 -0.06 0.00 0.35 0.00 0.00 41.96 42.56 2b0f s TYR 139 CO 0.00 -0.39 2.31 0.00 -1.34 0.00 0.00 175.55 176.13 2b0f s ALA 140 N 1.08 2.23 0.01 3.97 0.00 -1.26 -3.89 121.76 123.89 2b0f s ALA 140 Ca -0.06 0.44 0.08 0.00 0.00 0.00 0.00 51.96 52.42 2b0f s ALA 140 Cb -0.06 -4.20 -0.02 0.00 0.00 0.00 0.00 23.12 18.84 2b0f s ALA 140 CO -0.10 -3.56 -0.24 0.95 0.00 0.00 0.00 175.76 172.81 2b0f s THR 141 N 10.10 2.23 0.23 0.00 -4.23 -1.24 -5.06 115.64 117.68 2b0f s THR 141 Ca 0.99 -1.18 0.05 0.00 -1.18 0.00 0.00 61.69 60.37 2b0f s THR 141 Cb -0.26 -1.83 -0.05 0.00 1.34 0.00 0.00 72.50 71.70 2b0f s THR 141 CO 0.31 0.49 -0.04 -0.54 -0.54 0.00 0.00 174.62 174.30 2b0f s LYS 142 N -0.91 1.37 0.53 3.99 1.02 -1.26 -4.67 119.74 119.81 2b0f s LYS 142 Ca 0.11 -1.68 -0.18 0.00 0.02 0.00 0.00 55.97 54.24 2b0f s LYS 142 Cb -0.10 -0.81 -0.13 0.00 -0.52 0.00 0.00 37.83 36.27 2b0f s LYS 142 CO 0.01 -0.02 0.09 2.41 -0.92 0.00 0.00 175.35 176.91 2b0f n THR 143 N -0.44 0.76 0.00 2.17 -1.04 -1.26 -1.70 114.28 112.77 2b0f n THR 143 Ca -0.06 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.45 2b0f n THR 143 Cb 0.63 -0.23 0.00 0.00 -1.82 0.00 0.00 70.33 68.91 2b0f n THR 143 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2b0f n GLY 144 N 2.27 2.95 0.00 3.41 0.00 -1.26 -4.82 105.19 107.74 2b0f n GLY 144 Ca 0.09 -0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.13 2b0f n GLY 144 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2b0f n GLN 145 N 0.00 0.09 -1.75 1.61 -0.06 -0.69 -3.92 117.38 112.67 2b0f n GLN 145 Ca 0.00 0.22 -0.42 0.00 -2.00 0.00 0.00 57.00 54.81 2b0f n GLN 145 Cb 0.00 -1.50 -0.01 0.00 -4.06 0.00 0.00 30.24 24.67 2b0f n GLN 145 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2b0f n GLY 147 N 1.23 2.76 3.67 0.00 0.00 0.62 -4.50 105.19 108.98 2b0f n GLY 147 Ca 0.05 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.59 2b0f n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b0f n GLY 148 N -2.00 1.14 3.61 -0.02 0.00 -1.10 -4.43 105.19 102.39 2b0f n GLY 148 Ca 0.00 0.73 -0.41 0.00 0.00 0.00 0.00 46.02 46.33 2b0f n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b0f s VAL 149 N 1.85 4.86 -0.46 1.61 1.01 0.14 0.99 120.40 130.40 2b0f s VAL 149 Ca 0.84 1.07 -0.27 0.00 0.00 0.00 0.00 61.98 63.61 2b0f s VAL 149 Cb -0.73 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 31.60 2b0f s VAL 149 CO 0.44 -0.19 1.04 -0.22 0.00 0.00 0.00 175.10 176.17 2b0f s LEU 150 N 2.79 3.81 0.00 3.92 2.96 0.12 -1.34 118.68 130.94 2b0f s LEU 150 Ca 0.29 0.35 -0.00 0.00 -0.22 0.00 0.00 54.13 54.55 2b0f s LEU 150 Cb -0.15 -3.39 0.00 0.00 0.50 0.00 0.00 46.19 43.15 2b0f s LEU 150 CO 0.12 -1.14 0.34 0.00 -1.32 0.00 0.00 176.35 174.34 2b0f s ALA 152 N -2.58 -1.29 -0.30 0.00 0.00 0.13 0.66 121.76 118.38 2b0f s ALA 152 Ca 0.23 -0.08 -0.28 0.00 0.00 0.00 0.00 51.96 51.83 2b0f s ALA 152 Cb -0.00 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 2b0f s ALA 152 CO 0.17 -0.94 2.10 -0.08 0.00 0.00 0.00 175.76 177.01 2b0f s THR 153 N -3.87 3.16 0.00 0.00 -1.32 -1.26 -1.17 115.64 111.18 2b0f s THR 153 Ca 0.08 0.16 0.00 0.00 -1.21 0.00 0.00 61.69 60.72 2b0f s THR 153 Cb -0.04 -3.24 0.00 0.00 -1.51 0.00 0.00 72.50 67.71 2b0f s THR 153 CO 0.01 -0.17 0.00 0.61 -2.21 0.00 0.00 174.62 172.86 2b0f n GLY 154 N 5.69 0.74 2.76 6.08 0.00 -1.26 -5.04 105.19 114.16 2b0f n GLY 154 Ca 0.28 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.12 2b0f n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b0f s LYS 155 N -0.52 -0.02 -0.18 1.61 1.02 -0.32 -4.77 119.74 116.56 2b0f s LYS 155 Ca 0.00 0.44 -0.08 0.00 0.02 0.00 0.00 55.97 56.35 2b0f s LYS 155 Cb 0.00 -0.38 -0.04 0.00 -0.52 0.00 0.00 37.83 36.88 2b0f s LYS 155 CO 0.00 -0.30 0.08 0.42 -0.92 0.00 0.00 175.35 174.62 2b0f s ILE 156 N 2.11 4.93 -0.16 2.17 -1.09 0.91 0.21 121.20 130.29 2b0f s ILE 156 Ca 0.03 0.02 -0.10 0.00 -2.23 0.00 0.00 60.65 58.36 2b0f s ILE 156 Cb -0.12 -3.23 -0.07 0.00 -1.58 0.00 0.00 42.46 37.46 2b0f s ILE 156 CO -0.04 0.46 -0.24 0.49 -1.23 0.00 0.00 174.94 174.38 2b0f n PHE 157 N 3.51 0.00 -3.91 3.97 3.72 -0.00 -1.08 117.46 123.66 2b0f n PHE 157 Ca -0.16 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.25 2b0f n PHE 157 Cb 0.52 -0.57 0.01 0.00 -0.94 0.00 0.00 39.48 38.49 2b0f n PHE 157 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b0f n GLY 158 N 1.91 0.46 3.33 1.37 0.00 -1.07 -2.46 105.19 108.74 2b0f n GLY 158 Ca -0.29 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 2b0f n GLY 158 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2b0f s ILE 159 N -2.10 2.23 -0.04 -0.61 -4.36 -0.83 0.13 121.20 115.62 2b0f s ILE 159 Ca 0.12 -1.03 -0.30 0.00 -0.26 0.00 0.00 60.65 59.18 2b0f s ILE 159 Cb -0.00 -1.79 -0.05 0.00 1.25 0.00 0.00 42.46 41.86 2b0f s ILE 159 CO -0.00 0.58 1.50 -2.28 0.24 0.00 0.00 174.94 174.97 2b0f s HIS 160 N -0.54 2.48 -0.12 1.37 5.65 0.28 -0.40 115.29 124.00 2b0f s HIS 160 Ca 0.08 0.57 0.02 0.00 0.25 0.00 0.00 55.06 55.98 2b0f s HIS 160 Cb -0.11 -3.76 -0.02 0.00 -1.18 0.00 0.00 32.58 27.51 2b0f s HIS 160 CO 0.00 -2.99 0.12 1.33 -0.65 0.00 0.00 174.74 172.56 2b0f n VAL 161 N 5.11 0.00 -3.11 0.89 0.24 -0.71 -0.27 118.33 120.47 2b0f n VAL 161 Ca 0.15 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 2b0f n VAL 161 Cb 0.43 1.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 2b0f n VAL 161 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2b0f n GLY 162 N 1.02 -0.68 3.59 7.63 0.00 -0.62 -4.92 105.19 111.22 2b0f n GLY 162 Ca 0.00 -0.68 -0.05 0.00 0.00 0.00 0.00 46.02 45.29 2b0f n GLY 162 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b0f s GLY 163 N 0.00 -0.27 -0.44 -0.02 0.00 -1.26 -0.09 107.32 105.24 2b0f s GLY 163 Ca 0.00 1.68 0.02 0.00 0.00 0.00 0.00 44.72 46.42 2b0f s GLY 163 CO 0.00 0.60 0.24 0.21 0.00 0.00 0.00 173.10 174.15 2b0f s ASN 164 N -2.03 3.63 1.16 1.64 3.04 0.22 -4.89 114.94 117.72 2b0f s ASN 164 Ca 0.08 -2.64 0.00 0.00 0.04 0.00 0.00 52.86 50.34 2b0f s ASN 164 Cb -0.01 -1.03 0.00 0.00 -1.54 0.00 0.00 41.25 38.67 2b0f s ASN 164 CO -0.05 -0.26 0.00 0.61 -3.04 0.00 0.00 177.10 174.36 2b0f n GLY 165 N 3.52 1.51 0.83 1.21 0.00 -1.26 -2.02 105.19 108.98 2b0f n GLY 165 Ca 0.09 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.25 2b0f n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b0f n ARG 166 N 0.00 2.12 -3.69 1.61 1.74 -1.26 -3.64 116.66 113.53 2b0f n ARG 166 Ca 0.00 -1.65 -0.39 0.00 -0.77 0.00 0.00 57.85 55.04 2b0f n ARG 166 Cb 0.00 -1.47 -0.12 0.00 -1.02 0.00 0.00 32.46 29.85 2b0f n ARG 166 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2b0f s GLN 167 N -1.87 2.66 0.18 5.56 -0.21 -0.86 0.14 119.66 125.27 2b0f s GLN 167 Ca 0.33 -1.20 -0.30 0.00 0.02 0.00 0.00 55.36 54.22 2b0f s GLN 167 Cb 0.20 -3.57 -0.08 0.00 1.00 0.00 0.00 33.01 30.57 2b0f s GLN 167 CO 0.31 -0.71 0.94 0.20 -2.12 0.00 0.00 175.29 173.90 2b0f s GLY 168 N 1.52 3.06 -0.13 3.09 0.00 0.49 0.73 107.32 116.09 2b0f s GLY 168 Ca -0.00 0.58 0.02 0.00 0.00 0.00 0.00 44.72 45.33 2b0f s GLY 168 CO 0.04 1.29 -0.20 -1.36 0.00 0.00 0.00 173.10 172.87 2b0f s PHE 169 N -0.67 2.40 0.15 1.90 0.08 0.88 -1.78 117.98 120.94 2b0f s PHE 169 Ca 0.43 -1.17 0.11 0.00 0.12 0.00 0.00 56.93 56.42 2b0f s PHE 169 Cb -0.25 -1.66 -0.04 0.00 -0.57 0.00 0.00 43.02 40.50 2b0f s PHE 169 CO 0.31 -0.55 -0.25 -1.12 -0.10 0.00 0.00 175.22 173.51 2b0f s SER 170 N 0.85 3.23 -0.12 1.36 0.01 0.22 -1.58 113.70 117.66 2b0f s SER 170 Ca -0.08 -0.79 -0.16 0.00 1.31 0.00 0.00 55.95 56.23 2b0f s SER 170 Cb -0.15 -0.22 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 2b0f s SER 170 CO -0.01 0.13 0.41 0.00 0.41 0.00 0.00 173.24 174.18 2b0f s ALA 171 N -1.35 3.53 -0.43 1.44 0.00 0.46 0.13 121.76 125.54 2b0f s ALA 171 Ca 0.16 -0.28 -0.23 0.00 0.00 0.00 0.00 51.96 51.60 2b0f s ALA 171 Cb -0.09 -2.54 0.02 0.00 0.00 0.00 0.00 23.12 20.51 2b0f s ALA 171 CO 0.07 0.07 0.80 1.14 0.00 0.00 0.00 175.76 177.85 2b0f s GLN 172 N 0.42 3.50 -0.80 0.00 -2.07 -1.12 -1.97 119.66 117.63 2b0f s GLN 172 Ca 0.23 0.02 -0.21 0.00 -1.82 0.00 0.00 55.36 53.58 2b0f s GLN 172 Cb -0.14 -3.91 0.10 0.00 -1.09 0.00 0.00 33.01 27.97 2b0f s GLN 172 CO 0.08 -1.07 1.05 -0.48 -1.32 0.00 0.00 175.29 173.55 2b0f s LEU 173 N 3.31 4.72 0.27 2.60 0.05 -1.03 -4.98 118.68 123.62 2b0f s LEU 173 Ca 0.31 -1.54 -0.30 0.00 0.05 0.00 0.00 54.13 52.66 2b0f s LEU 173 Cb -0.12 -2.41 -0.09 0.00 -2.05 0.00 0.00 46.19 41.52 2b0f s LEU 173 CO 0.22 -1.25 1.09 -0.54 -0.55 0.00 0.00 176.35 175.32 2b0f s LYS 174 N 3.37 4.66 0.43 1.48 1.02 -1.26 -4.54 119.74 124.91 2b0f s LYS 174 Ca 0.28 1.77 0.26 0.00 0.02 0.00 0.00 55.97 58.30 2b0f s LYS 174 Cb -0.11 -3.20 1.31 0.00 -0.52 0.00 0.00 37.83 35.31 2b0f s LYS 174 CO -0.00 0.23 1.70 -0.22 -0.92 0.00 0.00 175.35 176.14 2b0f h LYS 175 N 3.91 0.20 -0.32 1.68 3.64 -1.73 -1.61 116.57 122.35 2b0f h LYS 175 Ca -0.46 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.00 2b0f h LYS 175 Cb 1.21 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 2b0f h LYS 175 CO 0.67 0.13 0.32 -0.56 -2.27 0.00 0.00 179.45 177.74 2b0f h GLN 176 N 0.21 0.00 0.00 1.90 3.07 -1.92 -0.88 115.11 117.49 2b0f h GLN 176 Ca 0.70 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.44 2b0f h GLN 176 Cb 2.11 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.67 2b0f h GLN 176 CO -0.32 0.00 -0.11 1.88 0.09 0.00 0.00 178.83 180.37 2b0f h TYR 177 N 0.00 0.00 0.00 0.06 0.05 -1.68 -3.23 116.97 112.17 2b0f h TYR 177 Ca 0.15 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.70 2b0f h TYR 177 Cb 0.78 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.48 2b0f h TYR 177 CO 0.00 0.00 -1.88 1.19 -1.05 0.00 0.00 178.16 176.42 2b0f n PHE 178 N -2.38 0.00 1.76 4.88 3.72 -0.44 -4.31 117.46 120.69 2b0f n PHE 178 Ca 0.05 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.49 2b0f n PHE 178 Cb 0.45 -0.60 0.25 0.00 -0.94 0.00 0.00 39.48 38.64 2b0f n PHE 178 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2b0f n VAL 179 N -2.86 0.00 -0.05 -4.37 0.31 -0.58 -2.67 118.33 108.10 2b0f n VAL 179 Ca -0.26 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.04 2b0f n VAL 179 Cb 0.82 -0.21 0.21 0.00 -0.91 0.00 0.00 33.84 33.75 2b0f n VAL 179 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2b0f h GLU 180 N 0.00 0.65 -5.11 5.55 4.81 -1.74 -3.39 114.58 115.36 2b0f h GLU 180 Ca 0.00 -0.17 -0.68 0.00 -0.13 0.00 0.00 59.36 58.37 2b0f h GLU 180 Cb 0.00 -0.08 -0.17 0.00 0.63 0.00 0.00 28.75 29.13 2b0f h GLU 180 CO 0.00 0.70 0.91 0.15 -0.73 0.00 0.00 179.01 180.04 2b0f s LYS 181 N -4.90 3.61 0.00 1.92 1.02 -1.09 -5.13 119.74 115.17 2b0f s LYS 181 Ca -0.08 -1.73 0.03 0.00 0.02 0.00 0.00 55.97 54.20 2b0f s LYS 181 Cb 0.15 -4.96 0.02 0.00 -0.52 0.00 0.00 37.83 32.52 2b0f s LYS 181 CO 0.79 -1.81 0.59 0.94 -0.92 0.00 0.00 175.35 174.95