#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 0.40 0.67 1.61 0.11 -2.02 -0.41 132.00 132.36 2b0f h PRO 2 Ca 0.00 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.05 2b0f h PRO 2 Cb 0.00 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.03 2b0f h PRO 2 CO 0.00 0.26 -0.32 -0.97 -0.21 0.00 0.00 178.00 176.76 2b0f h ASN 3 N 0.41 -0.76 -0.82 -2.05 -1.24 -1.93 0.55 115.58 109.74 2b0f h ASN 3 Ca 0.60 0.01 0.06 0.00 0.71 0.00 0.00 56.30 57.69 2b0f h ASN 3 Cb 1.18 0.20 -0.06 0.00 0.73 0.00 0.00 38.32 40.37 2b0f h ASN 3 CO -0.54 -0.38 0.50 0.74 -1.29 0.00 0.00 177.43 176.46 2b0f h THR 4 N -1.21 1.01 0.00 -3.57 2.02 -1.91 -1.68 112.91 107.57 2b0f h THR 4 Ca -0.09 -0.31 -0.09 0.00 0.77 0.00 0.00 66.41 66.69 2b0f h THR 4 Cb 0.70 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 2b0f h THR 4 CO 0.15 0.16 -0.45 -0.33 0.37 0.00 0.00 175.52 175.43 2b0f h GLU 5 N 0.90 0.00 -0.19 6.66 5.08 -1.12 -1.35 114.58 124.56 2b0f h GLU 5 Ca 0.36 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.68 2b0f h GLU 5 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2b0f h GLU 5 CO -0.18 0.45 -0.05 0.35 -1.00 0.00 0.00 179.01 178.57 2b0f h PHE 6 N 0.00 0.41 -0.68 4.33 3.57 -0.13 0.18 116.94 124.62 2b0f h PHE 6 Ca -0.00 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.39 2b0f h PHE 6 Cb 1.11 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.72 2b0f h PHE 6 CO 0.00 0.63 0.39 0.00 -2.23 0.00 0.00 178.31 177.11 2b0f h ALA 7 N 0.72 0.87 -0.34 2.41 0.00 -1.24 0.16 119.26 121.84 2b0f h ALA 7 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2b0f h ALA 7 Cb 0.51 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2b0f h ALA 7 CO 0.02 0.36 0.18 1.25 0.00 0.00 0.00 179.25 181.07 2b0f h LEU 8 N 0.93 0.42 -0.32 0.00 7.12 -1.13 0.26 115.31 122.60 2b0f h LEU 8 Ca 0.24 -0.09 -0.05 0.00 0.13 0.00 0.00 57.88 58.12 2b0f h LEU 8 Cb 0.01 -0.11 -0.01 0.00 -0.53 0.00 0.00 40.66 40.02 2b0f h LEU 8 CO -0.04 0.39 0.01 0.28 -0.13 0.00 0.00 178.44 178.95 2b0f h SER 9 N 0.42 0.54 -0.67 1.25 0.02 -0.68 -2.92 113.55 111.51 2b0f h SER 9 Ca 0.12 -0.30 -0.03 0.00 -0.84 0.00 0.00 61.79 60.74 2b0f h SER 9 Cb 0.06 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 2b0f h SER 9 CO -0.02 0.70 0.29 0.25 -1.14 0.00 0.00 176.83 176.92 2b0f h LEU 10 N 0.36 0.90 -0.32 5.07 5.85 -0.54 -3.15 115.31 123.48 2b0f h LEU 10 Ca 0.09 -0.15 0.07 0.00 0.84 0.00 0.00 57.88 58.73 2b0f h LEU 10 Cb 0.42 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 2b0f h LEU 10 CO 0.01 0.80 -0.17 0.25 -0.34 0.00 0.00 178.44 179.00 2b0f h LEU 11 N 0.94 -0.56 -1.85 2.25 5.85 -0.36 0.20 115.31 121.78 2b0f h LEU 11 Ca 0.23 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 59.05 2b0f h LEU 11 Cb 0.17 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 2b0f h LEU 11 CO -0.02 -0.20 -0.12 0.03 -0.34 0.00 0.00 178.44 177.78 2b0f h ARG 12 N -0.12 0.00 0.00 1.25 3.08 -1.47 -2.96 114.38 114.16 2b0f h ARG 12 Ca 0.17 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.94 2b0f h ARG 12 Cb 0.37 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.38 2b0f h ARG 12 CO -0.40 0.12 -1.91 1.17 -1.07 0.00 0.00 179.97 177.89 2b0f n LYS 13 N -4.12 0.35 0.00 0.04 3.00 -0.97 -4.80 118.16 111.65 2b0f n LYS 13 Ca -0.02 0.15 0.09 0.00 -0.00 0.00 0.00 58.31 58.53 2b0f n LYS 13 Cb 0.20 -1.10 -0.04 0.00 0.00 0.00 0.00 35.03 34.09 2b0f n LYS 13 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2b0f n ASN 14 N -3.67 1.48 -4.40 3.14 4.13 0.02 -4.83 115.26 111.13 2b0f n ASN 14 Ca -0.32 -1.24 -0.42 0.00 1.68 0.00 0.00 54.58 54.28 2b0f n ASN 14 Cb 0.73 0.68 -0.10 0.00 -1.54 0.00 0.00 39.78 39.56 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 -2.44 4.92 0.10 2.41 1.01 -1.12 0.05 121.20 126.13 2b0f s ILE 15 Ca 0.13 -0.90 0.10 0.00 0.00 0.00 0.00 60.65 59.98 2b0f s ILE 15 Cb 0.15 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 2b0f s ILE 15 CO 0.60 -0.37 -0.25 -0.04 0.00 0.00 0.00 174.94 174.89 2b0f s MET 16 N 1.60 1.60 -0.26 2.79 -1.94 -0.68 -4.73 119.30 117.69 2b0f s MET 16 Ca 0.04 -1.24 -0.29 0.00 -1.71 0.00 0.00 55.69 52.48 2b0f s MET 16 Cb -0.21 -1.97 0.00 0.00 2.01 0.00 0.00 34.83 34.66 2b0f s MET 16 CO 0.07 0.48 1.22 0.99 -0.01 0.00 0.00 175.02 177.77 2b0f s THR 17 N -1.00 4.30 -0.68 2.05 2.01 -1.26 -0.06 115.64 120.99 2b0f s THR 17 Ca 0.14 1.52 -0.16 0.00 0.31 0.00 0.00 61.69 63.49 2b0f s THR 17 Cb -0.10 -4.17 0.15 0.00 0.01 0.00 0.00 72.50 68.39 2b0f s THR 17 CO 0.06 -0.35 0.70 -0.63 -0.69 0.00 0.00 174.62 173.70 2b0f s ILE 18 N 3.88 5.21 -0.50 1.82 -1.09 0.15 -0.50 121.20 130.16 2b0f s ILE 18 Ca 0.53 -1.71 -0.26 0.00 -2.23 0.00 0.00 60.65 56.98 2b0f s ILE 18 Cb -0.17 -4.46 0.03 0.00 -1.58 0.00 0.00 42.46 36.28 2b0f s ILE 18 CO 0.18 -1.04 0.99 -0.89 -1.23 0.00 0.00 174.94 172.94 2b0f s THR 19 N 1.48 4.36 0.03 2.92 2.01 -0.16 -0.79 115.64 125.48 2b0f s THR 19 Ca 0.13 0.72 0.00 0.00 0.31 0.00 0.00 61.69 62.85 2b0f s THR 19 Cb -0.20 -4.52 -0.00 0.00 0.01 0.00 0.00 72.50 67.79 2b0f s THR 19 CO -0.01 -0.99 0.01 1.07 -0.69 0.00 0.00 174.62 174.01 2b0f n THR 20 N 6.46 0.00 -0.06 -0.82 5.66 0.40 -2.26 114.28 123.67 2b0f n THR 20 Ca 0.06 -0.15 -0.08 0.00 -3.05 0.00 0.00 64.05 60.83 2b0f n THR 20 Cb 0.48 0.05 -0.02 0.00 -1.55 0.00 0.00 70.33 69.30 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 0.10 -0.04 0.68 1.09 0.02 -1.76 -2.84 113.55 110.80 2b0f h SER 21 Ca -0.02 0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 60.89 2b0f h SER 21 Cb 0.08 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 2b0f h SER 21 CO 0.03 0.01 -0.42 0.50 -1.14 0.00 0.00 176.83 175.81 2b0f h LYS 22 N 0.10 0.00 0.00 3.45 3.11 -1.76 -3.49 116.57 117.99 2b0f h LYS 22 Ca 0.11 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.95 2b0f h LYS 22 Cb 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.36 2b0f h LYS 22 CO -0.17 0.42 0.00 0.41 -2.81 0.00 0.00 179.45 177.31 2b0f n GLY 23 N 0.07 -0.47 3.33 5.01 0.00 -1.07 -5.09 105.19 106.97 2b0f n GLY 23 Ca -0.01 -1.03 -0.36 0.00 0.00 0.00 0.00 46.02 44.62 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 3.22 0.31 1.61 2.02 -1.26 -0.45 118.70 122.15 2b0f s GLU 24 Ca 0.00 -0.75 0.07 0.00 0.02 0.00 0.00 54.97 54.31 2b0f s GLU 24 Cb 0.00 -3.21 -0.03 0.00 0.10 0.00 0.00 34.13 30.99 2b0f s GLU 24 CO 0.00 -0.33 0.26 -0.06 0.02 0.00 0.00 175.26 175.15 2b0f s PHE 25 N 1.49 2.95 -0.77 1.61 0.40 0.03 -4.22 117.98 119.46 2b0f s PHE 25 Ca 0.04 -0.26 -0.21 0.00 -0.60 0.00 0.00 56.93 55.90 2b0f s PHE 25 Cb -0.16 -1.68 0.09 0.00 0.51 0.00 0.00 43.02 41.78 2b0f s PHE 25 CO -0.00 0.28 1.03 0.99 0.70 0.00 0.00 175.22 178.22 2b0f s THR 26 N -2.27 4.49 -0.31 0.64 2.01 -1.23 0.31 115.64 119.28 2b0f s THR 26 Ca 0.39 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 61.22 2b0f s THR 26 Cb -0.06 -4.73 0.02 0.00 0.01 0.00 0.00 72.50 67.74 2b0f s THR 26 CO 0.26 -1.48 1.06 -0.83 -0.69 0.00 0.00 174.62 172.94 2b0f s GLY 27 N 3.71 1.58 -0.59 4.40 0.00 0.92 -4.77 107.32 112.56 2b0f s GLY 27 Ca 0.27 -0.04 -0.20 0.00 0.00 0.00 0.00 44.72 44.75 2b0f s GLY 27 CO 0.02 2.24 0.76 -2.27 0.00 0.00 0.00 173.10 173.85 2b0f s LEU 28 N 3.57 5.06 0.07 0.66 2.96 -0.98 -1.68 118.68 128.33 2b0f s LEU 28 Ca 0.45 -1.22 -0.31 0.00 -0.22 0.00 0.00 54.13 52.83 2b0f s LEU 28 Cb -0.13 -2.37 -0.07 0.00 0.50 0.00 0.00 46.19 44.12 2b0f s LEU 28 CO 0.14 -1.16 1.46 -0.83 -1.32 0.00 0.00 176.35 174.64 2b0f s GLY 29 N 3.48 1.81 -0.25 7.98 0.00 0.11 -0.74 107.32 119.70 2b0f s GLY 29 Ca 0.15 1.08 -0.12 0.00 0.00 0.00 0.00 44.72 45.83 2b0f s GLY 29 CO 0.08 2.54 -0.16 1.39 0.00 0.00 0.00 173.10 176.95 2b0f n ILE 30 N 4.36 1.54 -3.68 0.90 2.08 -0.08 -4.77 119.36 119.71 2b0f n ILE 30 Ca 0.13 -0.37 -0.06 0.00 0.56 0.00 0.00 62.75 63.02 2b0f n ILE 30 Cb 0.42 -1.82 -0.02 0.00 -0.75 0.00 0.00 39.64 37.48 2b0f n ILE 30 CO 0.00 0.00 0.00 -1.38 0.56 0.00 0.00 176.55 175.73 2b0f s HIS 31 N -2.49 -0.22 0.00 1.39 -3.43 -1.18 -0.75 115.29 108.62 2b0f s HIS 31 Ca -0.35 -0.06 0.00 0.00 -0.80 0.00 0.00 55.06 53.85 2b0f s HIS 31 Cb 0.11 0.62 0.00 0.00 -1.43 0.00 0.00 32.58 31.88 2b0f s HIS 31 CO 0.55 -0.79 0.00 -3.47 -2.00 0.00 0.00 174.74 169.03 2b0f n ASP 32 N -0.41 0.00 -0.64 7.38 2.03 -1.26 0.05 116.55 123.71 2b0f n ASP 32 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 2b0f n ASP 32 Cb 0.61 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.01 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 0.00 -5.19 -0.67 1.85 -1.26 -3.00 116.66 108.40 2b0f n ARG 33 Ca 0.00 -0.96 -0.32 0.00 -1.00 0.00 0.00 57.85 55.58 2b0f n ARG 33 Cb 0.00 -0.33 -0.16 0.00 -1.05 0.00 0.00 32.46 30.92 2b0f n ARG 33 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2b0f s VAL 34 N 0.00 2.22 0.27 8.89 0.11 0.11 -1.30 120.40 130.69 2b0f s VAL 34 Ca 0.04 -1.00 0.12 0.00 -2.93 0.00 0.00 61.98 58.21 2b0f s VAL 34 Cb 0.05 -1.83 -0.05 0.00 -1.53 0.00 0.00 36.38 33.02 2b0f s VAL 34 CO -0.02 0.57 -0.19 0.00 -3.33 0.00 0.00 175.10 172.12 2b0f s VAL 36 N -2.39 2.42 0.14 0.00 1.01 0.08 -0.22 120.40 121.43 2b0f s VAL 36 Ca 0.29 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.33 2b0f s VAL 36 Cb -0.05 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 2b0f s VAL 36 CO 0.15 0.55 0.11 0.27 0.00 0.00 0.00 175.10 176.18 2b0f s ILE 37 N 0.16 0.10 0.99 2.22 -4.36 -1.05 -2.33 121.20 116.93 2b0f s ILE 37 Ca -0.11 -1.79 -0.13 0.00 -0.26 0.00 0.00 60.65 58.36 2b0f s ILE 37 Cb -0.16 -1.98 0.18 0.00 1.25 0.00 0.00 42.46 41.75 2b0f s ILE 37 CO 0.06 -0.44 1.12 -2.84 0.24 0.00 0.00 174.94 173.08 2b0f s PRO 38 N -4.03 0.53 0.06 0.37 0.02 -1.26 0.40 135.00 131.09 2b0f s PRO 38 Ca 0.22 0.35 0.01 0.00 0.02 0.00 0.00 61.00 61.60 2b0f s PRO 38 Cb 0.07 -1.76 -0.26 0.00 0.02 0.00 0.00 34.50 32.57 2b0f s PRO 38 CO 0.01 -2.63 1.06 1.15 -0.33 0.00 0.00 177.00 176.26 2b0f h THR 39 N -1.81 1.40 0.00 0.99 2.02 -1.54 -3.21 112.91 110.76 2b0f h THR 39 Ca -0.52 -3.06 0.00 0.00 0.77 0.00 0.00 66.41 63.59 2b0f h THR 39 Cb 1.33 2.82 0.00 0.00 -1.74 0.00 0.00 68.15 70.56 2b0f h THR 39 CO 0.57 0.86 0.00 0.00 0.37 0.00 0.00 175.52 177.32 2b0f n HIS 40 N -3.41 0.00 0.28 3.16 1.44 -1.26 -1.90 115.22 113.53 2b0f n HIS 40 Ca -0.09 0.00 0.16 0.00 -2.01 0.00 0.00 57.72 55.78 2b0f n HIS 40 Cb 1.01 0.00 0.58 0.00 0.12 0.00 0.00 29.99 31.70 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 3.08 1.00 -5.81 1.59 0.00 -1.94 -3.46 119.26 113.72 2b0f h ALA 41 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 2b0f h ALA 41 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2b0f h ALA 41 CO 0.00 0.00 -0.37 1.04 0.00 0.00 0.00 179.25 179.92 2b0f n GLN 42 N -3.02 -1.42 -2.25 0.00 1.13 -0.80 -3.30 117.38 107.72 2b0f n GLN 42 Ca 0.01 1.28 -0.42 0.00 -1.94 0.00 0.00 57.00 55.93 2b0f n GLN 42 Cb 0.34 -4.64 -0.03 0.00 0.11 0.00 0.00 30.24 26.02 2b0f n GLN 42 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2b0f s PRO 43 N -3.60 4.29 0.00 -1.09 0.04 -1.26 -3.82 135.00 129.56 2b0f s PRO 43 Ca 0.01 1.92 0.00 0.00 0.04 0.00 0.00 61.00 62.97 2b0f s PRO 43 Cb -0.00 -3.58 0.00 0.00 0.04 0.00 0.00 34.50 30.96 2b0f s PRO 43 CO 0.80 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.68 2b0f n GLY 44 N 3.62 -1.52 0.09 0.56 0.00 -1.26 -4.99 105.19 101.69 2b0f n GLY 44 Ca 0.13 -1.55 -0.10 0.00 0.00 0.00 0.00 46.02 44.50 2b0f n GLY 44 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b0f n ASP 45 N -1.28 0.91 -3.82 1.61 2.03 -1.26 -4.79 116.55 109.96 2b0f n ASP 45 Ca 0.00 0.35 -0.25 0.00 0.52 0.00 0.00 54.79 55.41 2b0f n ASP 45 Cb 0.00 -0.03 -0.17 0.00 -0.72 0.00 0.00 41.12 40.20 2b0f n ASP 45 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2b0f s ASP 46 N -6.12 1.99 0.23 1.67 -1.08 -1.26 -0.40 116.67 111.71 2b0f s ASP 46 Ca -0.07 -0.27 0.10 0.00 -0.52 0.00 0.00 52.55 51.79 2b0f s ASP 46 Cb 0.08 -0.61 -0.05 0.00 -1.46 0.00 0.00 42.92 40.88 2b0f s ASP 46 CO 0.82 -0.18 -0.18 0.68 0.52 0.00 0.00 175.17 176.83 2b0f s VAL 47 N 1.86 2.09 -0.49 1.11 -7.23 -0.98 -4.93 120.40 111.83 2b0f s VAL 47 Ca 0.04 -2.25 -0.22 0.00 -1.81 0.00 0.00 61.98 57.74 2b0f s VAL 47 Cb -0.13 -2.13 0.04 0.00 0.56 0.00 0.00 36.38 34.72 2b0f s VAL 47 CO -0.07 -0.46 0.74 -0.76 -0.31 0.00 0.00 175.10 174.25 2b0f s LEU 48 N -3.29 4.48 -0.57 1.32 1.43 -0.96 -0.30 118.68 120.80 2b0f s LEU 48 Ca 0.25 -0.46 -0.18 0.00 -1.03 0.00 0.00 54.13 52.70 2b0f s LEU 48 Cb -0.03 -2.72 0.10 0.00 0.03 0.00 0.00 46.19 43.57 2b0f s LEU 48 CO 0.10 -0.95 0.64 -0.69 0.23 0.00 0.00 176.35 175.68 2b0f s VAL 49 N 3.14 4.92 -1.35 -1.59 1.01 0.11 -0.99 120.40 125.65 2b0f s VAL 49 Ca 0.24 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 2b0f s VAL 49 Cb -0.15 -4.42 0.00 0.00 0.00 0.00 0.00 36.38 31.81 2b0f s VAL 49 CO 0.18 -1.02 0.26 -3.20 0.00 0.00 0.00 175.10 171.32 2b0f n ASN 50 N 6.06 -5.14 0.00 3.32 5.15 0.34 -2.20 115.26 122.78 2b0f n ASN 50 Ca -0.10 -0.13 0.00 0.00 -0.60 0.00 0.00 54.58 53.75 2b0f n ASN 50 Cb 0.42 -4.10 0.00 0.00 -0.53 0.00 0.00 39.78 35.57 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 -1.21 2.13 3.66 8.20 0.00 -1.26 -4.99 105.19 111.71 2b0f n GLY 51 Ca -0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 2b0f n GLY 51 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b0f s GLN 52 N -0.69 4.05 -0.27 1.61 -1.52 -0.94 -4.95 119.66 116.96 2b0f s GLN 52 Ca 0.00 -0.28 -0.29 0.00 -1.95 0.00 0.00 55.36 52.84 2b0f s GLN 52 Cb 0.00 -3.46 -0.02 0.00 -0.22 0.00 0.00 33.01 29.31 2b0f s GLN 52 CO 0.00 0.12 1.72 -1.59 -0.25 0.00 0.00 175.29 175.29 2b0f s LYS 53 N 0.86 3.57 -0.22 2.91 -2.85 -1.26 0.06 119.74 122.81 2b0f s LYS 53 Ca 0.07 1.56 -0.02 0.00 -1.00 0.00 0.00 55.97 56.57 2b0f s LYS 53 Cb -0.13 -4.12 0.01 0.00 -2.06 0.00 0.00 37.83 31.53 2b0f s LYS 53 CO 0.03 -1.58 -0.08 0.42 0.10 0.00 0.00 175.35 174.24 2b0f s ILE 54 N 6.05 2.94 0.16 3.79 -1.09 0.59 -4.93 121.20 128.71 2b0f s ILE 54 Ca 0.76 -0.77 -0.26 0.00 -2.23 0.00 0.00 60.65 58.15 2b0f s ILE 54 Cb -0.24 -2.38 -0.08 0.00 -1.58 0.00 0.00 42.46 38.18 2b0f s ILE 54 CO 0.32 0.36 0.81 -0.60 -1.23 0.00 0.00 174.94 174.61 2b0f s ARG 55 N 1.39 4.61 0.70 2.79 3.52 -1.26 -2.31 118.95 128.39 2b0f s ARG 55 Ca 0.04 1.22 -0.12 0.00 -0.13 0.00 0.00 55.73 56.73 2b0f s ARG 55 Cb -0.15 -3.28 0.02 0.00 -1.56 0.00 0.00 34.95 29.98 2b0f s ARG 55 CO -0.06 0.51 1.08 0.14 -0.81 0.00 0.00 175.30 176.17 2b0f s VAL 56 N -0.97 3.53 0.00 7.11 -7.23 0.47 -1.50 120.40 121.80 2b0f s VAL 56 Ca 0.37 0.58 0.00 0.00 -1.81 0.00 0.00 61.98 61.13 2b0f s VAL 56 Cb -0.23 -3.14 0.00 0.00 0.56 0.00 0.00 36.38 33.57 2b0f s VAL 56 CO 0.27 -0.56 0.00 1.17 -0.31 0.00 0.00 175.10 175.67 2b0f n LYS 57 N -2.93 0.00 -3.46 4.82 3.00 0.58 -4.73 118.16 115.44 2b0f n LYS 57 Ca 0.09 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.15 2b0f n LYS 57 Cb 0.53 -0.67 -0.12 0.00 0.00 0.00 0.00 35.03 34.77 2b0f n LYS 57 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2b0f s ASP 58 N -4.43 2.62 -0.89 3.14 2.15 -0.83 -5.04 116.67 113.39 2b0f s ASP 58 Ca 0.00 -1.57 -0.17 0.00 0.43 0.00 0.00 52.55 51.24 2b0f s ASP 58 Cb 0.00 -0.07 0.16 0.00 -0.30 0.00 0.00 42.92 42.71 2b0f s ASP 58 CO 0.00 -0.35 1.00 -1.59 -0.17 0.00 0.00 175.17 174.06 2b0f s LYS 59 N 1.67 3.59 -0.34 4.34 -2.85 -1.26 -1.78 119.74 123.11 2b0f s LYS 59 Ca 0.14 -1.98 -0.15 0.00 -1.00 0.00 0.00 55.97 52.98 2b0f s LYS 59 Cb -0.18 -4.74 -0.01 0.00 -2.06 0.00 0.00 37.83 30.84 2b0f s LYS 59 CO -0.17 -1.61 0.36 -0.47 0.10 0.00 0.00 175.35 173.56 2b0f s TYR 60 N 1.87 3.21 0.04 1.78 5.04 -0.69 -4.93 117.35 123.67 2b0f s TYR 60 Ca 0.27 -0.04 -0.30 0.00 -2.44 0.00 0.00 57.07 54.56 2b0f s TYR 60 Cb -0.07 -2.67 -0.05 0.00 0.35 0.00 0.00 41.96 39.52 2b0f s TYR 60 CO -0.09 -0.44 1.18 0.15 -1.34 0.00 0.00 175.55 175.01 2b0f s LYS 61 N 2.02 4.43 -0.63 4.97 1.02 -1.26 0.72 119.74 131.01 2b0f s LYS 61 Ca 0.12 1.72 -0.22 0.00 0.02 0.00 0.00 55.97 57.61 2b0f s LYS 61 Cb -0.17 -3.39 0.07 0.00 -0.52 0.00 0.00 37.83 33.82 2b0f s LYS 61 CO 0.12 -0.26 0.93 -0.51 -0.92 0.00 0.00 175.35 174.70 2b0f s LEU 62 N 1.21 4.42 -0.01 3.17 1.43 0.52 -4.89 118.68 124.53 2b0f s LEU 62 Ca 0.58 -0.90 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 2b0f s LEU 62 Cb -0.28 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.42 2b0f s LEU 62 CO 0.28 -1.36 -0.01 0.68 0.23 0.00 0.00 176.35 176.17 2b0f s VAL 63 N 3.89 4.10 0.44 -1.59 -7.23 -1.26 -1.68 120.40 117.06 2b0f s VAL 63 Ca 0.22 -0.59 -0.20 0.00 -1.81 0.00 0.00 61.98 59.60 2b0f s VAL 63 Cb -0.17 -2.81 -0.11 0.00 0.56 0.00 0.00 36.38 33.86 2b0f s VAL 63 CO 0.12 0.40 0.95 -0.62 -0.31 0.00 0.00 175.10 175.63 2b0f s ASP 64 N -1.48 6.89 0.65 4.85 -1.08 0.15 -4.80 116.67 121.86 2b0f s ASP 64 Ca 0.19 1.66 0.14 0.00 -0.52 0.00 0.00 52.55 54.02 2b0f s ASP 64 Cb -0.11 -2.53 0.73 0.00 -1.46 0.00 0.00 42.92 39.54 2b0f s ASP 64 CO 0.09 -0.39 1.39 -0.65 0.52 0.00 0.00 175.17 176.14 2b0f h PRO 65 N 1.79 0.00 0.00 4.34 0.11 -2.00 2.25 132.00 138.49 2b0f h PRO 65 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2b0f h PRO 65 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2b0f h PRO 65 CO 0.61 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.49 2b0f n GLU 66 N -2.78 0.16 -0.98 1.05 4.07 -1.26 -4.81 120.64 116.09 2b0f n GLU 66 Ca 0.02 0.57 0.00 0.00 -0.06 0.00 0.00 57.16 57.69 2b0f n GLU 66 Cb 0.83 -1.93 0.00 0.00 -0.06 0.00 0.00 31.44 30.28 2b0f n GLU 66 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2b0f n ASN 67 N -2.24 -0.99 -4.93 4.31 5.15 0.76 -5.03 115.26 112.29 2b0f n ASN 67 Ca -0.00 0.00 -0.27 0.00 -0.60 0.00 0.00 54.58 53.71 2b0f n ASN 67 Cb 0.09 -0.16 -0.03 0.00 -0.53 0.00 0.00 39.78 39.15 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 -3.30 5.21 0.06 -1.44 -1.09 -1.23 -4.86 121.20 114.55 2b0f s ILE 68 Ca 0.00 -0.42 -0.31 0.00 -2.23 0.00 0.00 60.65 57.69 2b0f s ILE 68 Cb 0.00 -3.75 -0.07 0.00 -1.58 0.00 0.00 42.46 37.06 2b0f s ILE 68 CO 0.00 -0.20 1.50 0.21 -1.23 0.00 0.00 174.94 175.23 2b0f s ASN 69 N -3.26 6.74 0.06 3.58 2.47 -1.19 -0.67 114.94 122.66 2b0f s ASN 69 Ca 0.38 2.32 0.23 0.00 0.42 0.00 0.00 52.86 56.21 2b0f s ASN 69 Cb -0.11 -2.57 0.02 0.00 -1.45 0.00 0.00 41.25 37.15 2b0f s ASN 69 CO 0.29 -0.78 1.00 -0.11 -3.72 0.00 0.00 177.10 173.78 2b0f n LEU 70 N 5.09 0.60 -0.33 3.21 7.94 -0.68 -1.79 117.00 131.04 2b0f n LEU 70 Ca 0.14 0.03 -0.04 0.00 -1.11 0.00 0.00 56.01 55.02 2b0f n LEU 70 Cb 0.42 -0.09 -0.02 0.00 0.53 0.00 0.00 43.42 44.26 2b0f n LEU 70 CO 0.60 0.01 -0.04 1.21 -1.11 0.00 0.00 177.39 178.06 2b0f n GLU 71 N -2.07 -0.86 -4.01 1.96 4.07 -1.01 -4.83 120.64 113.89 2b0f n GLU 71 Ca 0.01 0.51 -0.22 0.00 -0.06 0.00 0.00 57.16 57.40 2b0f n GLU 71 Cb 0.46 -4.32 -0.03 0.00 -0.06 0.00 0.00 31.44 27.49 2b0f n GLU 71 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2b0f s LEU 72 N -0.99 4.18 -0.10 4.31 1.02 -1.20 -1.58 118.68 124.31 2b0f s LEU 72 Ca 0.00 -0.00 -0.02 0.00 0.02 0.00 0.00 54.13 54.13 2b0f s LEU 72 Cb 0.00 -2.72 0.04 0.00 0.02 0.00 0.00 46.19 43.52 2b0f s LEU 72 CO 0.00 -0.04 0.02 -0.89 0.02 0.00 0.00 176.35 175.46 2b0f s THR 73 N -1.98 0.36 -0.81 5.49 2.01 0.16 0.19 115.64 121.06 2b0f s THR 73 Ca 0.34 -0.04 -0.26 0.00 0.31 0.00 0.00 61.69 62.04 2b0f s THR 73 Cb -0.09 -0.63 0.03 0.00 0.01 0.00 0.00 72.50 71.82 2b0f s THR 73 CO 0.28 0.11 1.41 -0.69 -0.69 0.00 0.00 174.62 175.04 2b0f s VAL 74 N 1.97 3.73 -1.08 3.82 1.01 0.22 -2.51 120.40 127.55 2b0f s VAL 74 Ca 0.03 0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.88 2b0f s VAL 74 Cb -0.14 -4.82 0.13 0.00 0.00 0.00 0.00 36.38 31.55 2b0f s VAL 74 CO -0.06 -1.75 1.35 -0.22 0.00 0.00 0.00 175.10 174.42 2b0f s LEU 75 N 6.05 4.72 -0.62 3.92 2.96 0.70 -1.70 118.68 134.71 2b0f s LEU 75 Ca 0.43 -2.36 -0.28 0.00 -0.22 0.00 0.00 54.13 51.70 2b0f s LEU 75 Cb -0.06 -2.44 0.03 0.00 0.50 0.00 0.00 46.19 44.22 2b0f s LEU 75 CO 0.08 -1.02 1.20 -0.89 -1.32 0.00 0.00 176.35 174.41 2b0f s THR 76 N 2.74 3.96 0.32 3.68 2.01 -0.73 -1.50 115.64 126.12 2b0f s THR 76 Ca 0.40 0.75 0.01 0.00 0.31 0.00 0.00 61.69 63.17 2b0f s THR 76 Cb -0.02 -4.77 -0.03 0.00 0.01 0.00 0.00 72.50 67.69 2b0f s THR 76 CO -0.04 -1.46 0.51 -0.76 -0.69 0.00 0.00 174.62 172.18 2b0f s LEU 77 N 5.09 4.08 -1.06 4.42 1.43 -0.42 -0.31 118.68 131.91 2b0f s LEU 77 Ca 0.40 0.38 -0.18 0.00 -1.03 0.00 0.00 54.13 53.70 2b0f s LEU 77 Cb -0.08 -3.22 0.12 0.00 0.03 0.00 0.00 46.19 43.04 2b0f s LEU 77 CO 0.23 -0.24 1.34 -0.62 0.23 0.00 0.00 176.35 177.28 2b0f s ASP 78 N -3.98 6.74 -0.14 2.29 -1.08 -0.56 -4.74 116.67 115.20 2b0f s ASP 78 Ca 0.39 -2.22 0.01 0.00 -0.52 0.00 0.00 52.55 50.21 2b0f s ASP 78 Cb -0.10 -2.45 0.00 0.00 -1.46 0.00 0.00 42.92 38.91 2b0f s ASP 78 CO 0.34 -1.08 -0.18 -0.60 0.52 0.00 0.00 175.17 174.17 2b0f s ARG 79 N 3.01 3.15 -0.15 4.34 6.06 -1.26 -4.62 118.95 129.48 2b0f s ARG 79 Ca 0.40 -0.79 -0.24 0.00 -2.50 0.00 0.00 55.73 52.60 2b0f s ARG 79 Cb -0.02 -2.53 -0.24 0.00 0.06 0.00 0.00 34.95 32.22 2b0f s ARG 79 CO -0.05 0.04 0.55 -0.91 -2.50 0.00 0.00 175.30 172.43 2b0f h ASN 80 N 7.18 0.08 -3.07 -2.12 4.21 -1.93 -3.44 115.58 116.51 2b0f h ASN 80 Ca -0.30 -0.80 -0.57 0.00 1.21 0.00 0.00 56.30 55.84 2b0f h ASN 80 Cb 1.20 -0.03 -0.05 0.00 -1.12 0.00 0.00 38.32 38.33 2b0f h ASN 80 CO 0.55 1.29 0.97 -0.70 -1.29 0.00 0.00 177.43 178.25 2b0f s GLU 81 N -2.32 3.97 0.39 0.81 2.12 -1.26 -4.98 118.70 117.43 2b0f s GLU 81 Ca -0.22 1.36 -0.18 0.00 0.36 0.00 0.00 54.97 56.29 2b0f s GLU 81 Cb 0.01 -3.87 -0.10 0.00 0.26 0.00 0.00 34.13 30.44 2b0f s GLU 81 CO 0.67 -1.05 0.87 0.15 -0.54 0.00 0.00 175.26 175.36 2b0f s LYS 82 N 4.07 4.13 0.74 4.30 1.02 -1.26 -4.91 119.74 127.83 2b0f s LYS 82 Ca 0.57 0.93 -0.05 0.00 0.02 0.00 0.00 55.97 57.45 2b0f s LYS 82 Cb -0.18 -2.28 0.12 0.00 -0.52 0.00 0.00 37.83 34.97 2b0f s LYS 82 CO 0.22 0.04 1.04 -0.06 -0.92 0.00 0.00 175.35 175.66 2b0f s PHE 83 N -2.12 2.00 -0.03 3.18 0.08 -1.16 -4.98 117.98 114.94 2b0f s PHE 83 Ca 0.59 0.01 -0.27 0.00 0.12 0.00 0.00 56.93 57.37 2b0f s PHE 83 Cb -0.09 -3.22 -0.03 0.00 -0.57 0.00 0.00 43.02 39.10 2b0f s PHE 83 CO 0.15 -1.73 0.86 0.50 -0.10 0.00 0.00 175.22 174.90 2b0f s ARG 84 N -5.26 4.50 -0.75 0.44 6.06 -1.26 -4.28 118.95 118.40 2b0f s ARG 84 Ca 0.65 1.19 -0.26 0.00 -2.50 0.00 0.00 55.73 54.82 2b0f s ARG 84 Cb -0.07 -3.46 0.01 0.00 0.06 0.00 0.00 34.95 31.49 2b0f s ARG 84 CO 0.45 -0.02 1.56 0.16 -2.50 0.00 0.00 175.30 174.96 2b0f s ASP 85 N 0.93 5.81 -0.35 -2.12 -4.77 -1.25 -4.36 116.67 110.55 2b0f s ASP 85 Ca 0.46 -0.33 0.04 0.00 -3.30 0.00 0.00 52.55 49.41 2b0f s ASP 85 Cb -0.20 -2.55 0.55 0.00 -1.09 0.00 0.00 42.92 39.64 2b0f s ASP 85 CO 0.23 -2.07 1.73 2.30 0.70 0.00 0.00 175.17 178.07 2b0f n ILE 86 N 6.86 2.76 0.23 2.11 -5.35 0.07 -4.48 119.36 121.56 2b0f n ILE 86 Ca 0.16 -1.53 0.08 0.00 -0.27 0.00 0.00 62.75 61.19 2b0f n ILE 86 Cb 0.50 -0.55 0.53 0.00 -1.74 0.00 0.00 39.64 38.38 2b0f n ILE 86 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 2b0f h ARG 87 N 0.96 0.00 -0.01 6.28 3.08 -1.87 -1.98 114.38 120.84 2b0f h ARG 87 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.54 2b0f h ARG 87 Cb 2.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.53 2b0f h ARG 87 CO 0.87 0.23 0.00 0.41 -1.07 0.00 0.00 179.97 180.42 2b0f n GLY 88 N -0.51 -0.80 0.52 0.04 0.00 -1.26 -2.75 105.19 100.43 2b0f n GLY 88 Ca -0.02 -0.23 0.08 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.74 0.00 -2.91 1.61 3.72 -0.75 -4.94 117.46 113.45 2b0f n PHE 89 Ca 0.21 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.23 2b0f n PHE 89 Cb 0.15 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.63 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 -1.52 4.30 -0.27 4.37 1.01 -1.11 -0.41 121.20 127.58 2b0f s ILE 90 Ca 0.16 1.75 -0.17 0.00 0.00 0.00 0.00 60.65 62.39 2b0f s ILE 90 Cb 0.13 -4.11 -0.03 0.00 0.01 0.00 0.00 42.46 38.45 2b0f s ILE 90 CO 0.27 0.39 0.46 -0.44 0.00 0.00 0.00 174.94 175.62 2b0f s SER 91 N -1.33 6.36 0.01 3.58 0.01 -1.03 -4.44 113.70 116.86 2b0f s SER 91 Ca 0.41 0.42 -0.22 0.00 1.31 0.00 0.00 55.95 57.87 2b0f s SER 91 Cb -0.22 -2.25 -0.17 0.00 0.21 0.00 0.00 66.02 63.59 2b0f s SER 91 CO 0.26 -0.25 1.27 1.05 0.41 0.00 0.00 173.24 175.99 2b0f h GLU 92 N 8.09 0.26 -6.45 12.44 4.11 -1.90 -2.83 114.58 128.30 2b0f h GLU 92 Ca -0.30 -0.16 -0.68 0.00 0.07 0.00 0.00 59.36 58.29 2b0f h GLU 92 Cb 1.15 0.02 -0.21 0.00 0.50 0.00 0.00 28.75 30.21 2b0f h GLU 92 CO 0.69 0.73 -0.77 0.34 0.07 0.00 0.00 179.01 180.07 2b0f s ASP 93 N -6.08 4.08 0.00 3.06 2.15 -1.26 -4.67 116.67 113.95 2b0f s ASP 93 Ca -0.15 -0.31 0.00 0.00 0.43 0.00 0.00 52.55 52.53 2b0f s ASP 93 Cb 0.04 -0.79 0.00 0.00 -0.30 0.00 0.00 42.92 41.87 2b0f s ASP 93 CO 0.74 0.28 0.61 0.18 -0.17 0.00 0.00 175.17 176.81 2b0f n LEU 94 N 1.66 0.12 -3.07 -1.34 4.77 -1.26 -4.97 117.00 112.91 2b0f n LEU 94 Ca -0.16 0.77 -0.02 0.00 -0.03 0.00 0.00 56.01 56.57 2b0f n LEU 94 Cb 0.52 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2b0f n LEU 94 CO 0.28 -0.44 0.30 1.21 -1.33 0.00 0.00 177.39 177.41 2b0f n GLU 95 N -1.82 -1.42 -3.43 3.23 2.13 -1.26 -5.00 120.64 113.07 2b0f n GLU 95 Ca 0.00 1.53 -0.24 0.00 0.66 0.00 0.00 57.16 59.11 2b0f n GLU 95 Cb 0.00 -5.62 -0.11 0.00 0.27 0.00 0.00 31.44 25.98 2b0f n GLU 95 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2b0f s GLY 96 N -2.96 0.42 0.00 8.31 0.00 -1.26 -4.88 107.32 106.95 2b0f s GLY 96 Ca 0.02 -1.32 0.20 0.00 0.00 0.00 0.00 44.72 43.62 2b0f s GLY 96 CO 0.76 2.35 0.90 1.55 0.00 0.00 0.00 173.10 178.66 2b0f n VAL 97 N 4.39 0.00 -3.78 1.40 3.14 -1.26 -4.15 118.33 118.07 2b0f n VAL 97 Ca 0.08 -0.11 -0.13 0.00 -2.96 0.00 0.00 64.34 61.22 2b0f n VAL 97 Cb 0.41 1.08 -0.13 0.00 -1.06 0.00 0.00 33.84 34.14 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 -2.69 -0.16 0.05 6.55 2.15 -1.25 -2.80 116.67 118.51 2b0f s ASP 98 Ca 0.10 0.34 -0.15 0.00 0.43 0.00 0.00 52.55 53.28 2b0f s ASP 98 Cb 0.15 0.30 0.02 0.00 -0.30 0.00 0.00 42.92 43.09 2b0f s ASP 98 CO 0.72 -0.10 0.33 0.00 -0.17 0.00 0.00 175.17 175.95 2b0f s ALA 99 N 0.57 -0.74 -0.02 3.66 0.00 -0.78 -4.89 121.76 119.56 2b0f s ALA 99 Ca -0.04 0.05 0.08 0.00 0.00 0.00 0.00 51.96 52.04 2b0f s ALA 99 Cb -0.05 0.34 -0.02 0.00 0.00 0.00 0.00 23.12 23.39 2b0f s ALA 99 CO -0.03 -0.43 -0.25 0.99 0.00 0.00 0.00 175.76 176.04 2b0f s THR 100 N -2.61 1.99 -0.23 0.00 2.01 0.10 -1.67 115.64 115.23 2b0f s THR 100 Ca -0.05 -1.07 -0.06 0.00 0.31 0.00 0.00 61.69 60.82 2b0f s THR 100 Cb -0.01 -1.65 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 2b0f s THR 100 CO -0.04 0.56 0.02 -0.22 -0.69 0.00 0.00 174.62 174.26 2b0f s LEU 101 N -0.57 3.23 -0.19 4.42 1.98 0.11 0.21 118.68 127.86 2b0f s LEU 101 Ca 0.09 -0.27 -0.02 0.00 -2.89 0.00 0.00 54.13 51.05 2b0f s LEU 101 Cb -0.10 -1.84 -0.00 0.00 0.66 0.00 0.00 46.19 44.91 2b0f s LEU 101 CO -0.01 -0.01 -0.11 0.54 -1.89 0.00 0.00 176.35 174.87 2b0f s VAL 102 N 1.46 2.90 -0.12 1.68 0.11 0.68 -0.74 120.40 126.36 2b0f s VAL 102 Ca 0.05 -0.66 -0.03 0.00 -2.93 0.00 0.00 61.98 58.41 2b0f s VAL 102 Cb -0.15 -2.28 -0.03 0.00 -1.53 0.00 0.00 36.38 32.40 2b0f s VAL 102 CO 0.01 0.48 -0.00 -0.69 -3.33 0.00 0.00 175.10 171.56 2b0f s VAL 103 N 1.22 4.24 -0.40 2.04 1.01 -0.45 -1.03 120.40 127.02 2b0f s VAL 103 Ca 0.02 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.77 2b0f s VAL 103 Cb -0.14 -2.82 0.15 0.00 0.00 0.00 0.00 36.38 33.57 2b0f s VAL 103 CO -0.04 0.55 0.29 -2.28 0.00 0.00 0.00 175.10 173.61 2b0f s HIS 104 N -0.34 1.15 0.00 5.22 2.46 -1.20 -1.85 115.29 120.73 2b0f s HIS 104 Ca 0.07 -2.11 0.00 0.00 0.47 0.00 0.00 55.06 53.49 2b0f s HIS 104 Cb -0.12 -1.10 0.00 0.00 -0.13 0.00 0.00 32.58 31.23 2b0f s HIS 104 CO 0.02 -0.81 0.00 0.45 -2.47 0.00 0.00 174.74 171.93 2b0f n SER 105 N 3.35 0.37 -0.06 9.88 2.88 0.88 -3.63 113.62 127.29 2b0f n SER 105 Ca 0.20 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.66 2b0f n SER 105 Cb 0.42 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.82 2b0f n SER 105 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2b0f h ASN 106 N 0.00 -1.02 0.00 -3.46 -1.24 -1.95 -3.36 115.58 104.54 2b0f h ASN 106 Ca 0.00 0.13 -0.41 0.00 0.71 0.00 0.00 56.30 56.73 2b0f h ASN 106 Cb 0.00 0.42 -0.07 0.00 0.73 0.00 0.00 38.32 39.40 2b0f h ASN 106 CO 0.00 -0.23 -2.44 -3.20 -1.29 0.00 0.00 177.43 170.26 2b0f n ASN 107 N -4.18 1.97 -4.56 1.15 4.05 -1.26 -4.88 115.26 107.54 2b0f n ASN 107 Ca -0.02 0.10 -0.43 0.00 0.45 0.00 0.00 54.58 54.68 2b0f n ASN 107 Cb 0.19 -0.58 -0.03 0.00 1.23 0.00 0.00 39.78 40.59 2b0f n ASN 107 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 2b0f s PHE 108 N -2.49 2.73 -0.05 1.20 0.40 -1.26 -5.01 117.98 113.51 2b0f s PHE 108 Ca -0.35 0.30 0.05 0.00 -0.60 0.00 0.00 56.93 56.33 2b0f s PHE 108 Cb 0.11 -4.30 -0.02 0.00 0.51 0.00 0.00 43.02 39.33 2b0f s PHE 108 CO 0.52 -1.42 -0.19 0.95 0.70 0.00 0.00 175.22 175.79 2b0f s THR 109 N 4.42 2.67 -1.11 0.64 -4.23 -1.26 -0.09 115.64 116.69 2b0f s THR 109 Ca 0.39 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 60.03 2b0f s THR 109 Cb -0.09 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.73 2b0f s THR 109 CO 0.24 0.58 0.00 -0.46 -0.54 0.00 0.00 174.62 174.44 2b0f n ASN 110 N 2.50 -3.80 -4.56 3.99 6.94 -0.77 -4.85 115.26 114.71 2b0f n ASN 110 Ca -0.17 0.21 -0.34 0.00 -0.02 0.00 0.00 54.58 54.27 2b0f n ASN 110 Cb 0.52 -3.29 -0.04 0.00 -2.36 0.00 0.00 39.78 34.61 2b0f n ASN 110 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2b0f s THR 111 N -2.51 3.68 -0.70 5.53 2.01 -0.81 -4.89 115.64 117.94 2b0f s THR 111 Ca 0.00 -0.56 -0.20 0.00 0.31 0.00 0.00 61.69 61.24 2b0f s THR 111 Cb 0.00 -4.52 0.10 0.00 0.01 0.00 0.00 72.50 68.08 2b0f s THR 111 CO 0.00 -1.44 0.92 -0.63 -0.69 0.00 0.00 174.62 172.78 2b0f s ILE 112 N 7.56 4.60 -0.16 1.82 1.01 -1.26 -1.34 121.20 133.44 2b0f s ILE 112 Ca 0.58 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 60.35 2b0f s ILE 112 Cb -0.03 -4.64 0.02 0.00 0.01 0.00 0.00 42.46 37.82 2b0f s ILE 112 CO -0.05 -1.36 -0.16 -0.22 0.00 0.00 0.00 174.94 173.15 2b0f s LEU 113 N 3.22 1.82 0.33 2.97 2.96 0.08 -4.98 118.68 125.08 2b0f s LEU 113 Ca 0.21 -0.53 -0.26 0.00 -0.22 0.00 0.00 54.13 53.33 2b0f s LEU 113 Cb -0.16 -1.27 -0.10 0.00 0.50 0.00 0.00 46.19 45.16 2b0f s LEU 113 CO 0.04 -0.04 0.94 -1.83 -1.32 0.00 0.00 176.35 174.14 2b0f s GLU 114 N 1.41 4.55 -0.03 1.98 -1.05 -1.26 0.05 118.70 124.34 2b0f s GLU 114 Ca 0.05 1.30 0.20 0.00 -0.15 0.00 0.00 54.97 56.37 2b0f s GLU 114 Cb -0.13 -2.75 -0.31 0.00 -0.44 0.00 0.00 34.13 30.50 2b0f s GLU 114 CO -0.11 0.26 0.44 1.33 0.95 0.00 0.00 175.26 178.12 2b0f n VAL 115 N 0.46 0.00 0.00 1.83 0.24 -0.67 -4.86 118.33 115.33 2b0f n VAL 115 Ca 0.02 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 2b0f n VAL 115 Cb 0.50 0.04 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 2b0f n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2b0f n GLY 116 N 1.36 1.58 3.63 7.63 0.00 -1.10 -4.48 105.19 113.82 2b0f n GLY 116 Ca -0.04 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 2b0f n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2b0f s PRO 117 N 0.00 3.58 0.15 1.61 0.04 -1.24 -1.87 135.00 137.27 2b0f s PRO 117 Ca 0.00 2.16 0.10 0.00 0.04 0.00 0.00 61.00 63.30 2b0f s PRO 117 Cb 0.00 -4.25 -0.04 0.00 0.04 0.00 0.00 34.50 30.25 2b0f s PRO 117 CO 0.00 -1.58 -0.22 0.54 0.04 0.00 0.00 177.00 175.77 2b0f s VAL 118 N 6.48 2.52 0.27 -0.36 0.11 -1.12 -0.96 120.40 127.33 2b0f s VAL 118 Ca 0.91 -1.75 0.00 0.00 -2.93 0.00 0.00 61.98 58.22 2b0f s VAL 118 Cb -0.35 -2.16 0.00 0.00 -1.53 0.00 0.00 36.38 32.34 2b0f s VAL 118 CO 0.36 0.03 0.35 0.35 -3.33 0.00 0.00 175.10 172.86 2b0f n THR 119 N 0.65 0.00 -4.52 5.04 -2.24 0.32 -4.19 114.28 109.34 2b0f n THR 119 Ca -0.15 -1.50 -0.25 0.00 -2.27 0.00 0.00 64.05 59.88 2b0f n THR 119 Cb 0.54 0.88 -0.10 0.00 -2.10 0.00 0.00 70.33 69.54 2b0f n THR 119 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b0f s MET 120 N -2.71 1.76 0.00 -0.78 0.23 -1.26 0.83 119.30 117.37 2b0f s MET 120 Ca 0.24 -1.88 0.00 0.00 -1.03 0.00 0.00 55.69 53.02 2b0f s MET 120 Cb -0.00 -1.68 0.00 0.00 -1.53 0.00 0.00 34.83 31.61 2b0f s MET 120 CO 0.17 0.18 0.32 0.00 -2.03 0.00 0.00 175.02 173.66 2b0f n ALA 121 N -0.73 2.01 -0.16 3.16 0.00 0.98 -4.71 120.51 121.05 2b0f n ALA 121 Ca -0.05 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2b0f n ALA 121 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 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 0.22 2.28 3.20 0.00 0.00 -1.19 -4.63 105.19 105.06 2b0f n GLY 122 Ca 0.00 -0.41 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 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 2.40 0.00 0.99 0.20 -1.26 -0.75 118.68 120.26 2b0f s LEU 123 Ca 0.00 -0.55 0.01 0.00 0.69 0.00 0.00 54.13 54.28 2b0f s LEU 123 Cb 0.00 -1.56 -0.00 0.00 -0.43 0.00 0.00 46.19 44.19 2b0f s LEU 123 CO 0.00 0.01 0.04 2.30 -0.29 0.00 0.00 176.35 178.41 2b0f n ILE 124 N 4.58 0.00 -3.97 6.68 -5.35 -0.50 -4.96 119.36 115.84 2b0f n ILE 124 Ca -0.20 -0.43 -0.36 0.00 -0.27 0.00 0.00 62.75 61.50 2b0f n ILE 124 Cb 0.51 0.20 -0.08 0.00 -1.74 0.00 0.00 39.64 38.53 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 -1.42 5.94 -0.32 7.28 0.01 -1.26 0.29 114.94 125.47 2b0f s ASN 125 Ca 0.06 0.26 0.03 0.00 -0.71 0.00 0.00 52.86 52.50 2b0f s ASN 125 Cb 0.00 -1.94 0.08 0.00 0.41 0.00 0.00 41.25 39.80 2b0f s ASN 125 CO 0.04 0.29 0.01 -0.22 -1.51 0.00 0.00 177.10 175.71 2b0f s LEU 126 N -0.34 4.33 -1.37 0.60 2.96 0.43 -4.63 118.68 120.66 2b0f s LEU 126 Ca 0.10 -1.86 -0.02 0.00 -0.22 0.00 0.00 54.13 52.13 2b0f s LEU 126 Cb -0.12 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 44.95 2b0f s LEU 126 CO 0.01 -0.32 0.25 -1.20 -1.32 0.00 0.00 176.35 173.77 2b0f n SER 127 N 4.35 -5.17 0.00 3.68 7.64 -1.26 -2.05 113.62 120.81 2b0f n SER 127 Ca -0.03 -0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.72 2b0f n SER 127 Cb 0.42 -4.14 0.00 0.00 -1.01 0.00 0.00 64.21 59.48 2b0f n SER 127 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2b0f n SER 128 N -1.50 -0.41 -4.31 6.43 7.64 -1.26 -5.03 113.62 115.18 2b0f n SER 128 Ca -0.15 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.39 2b0f n SER 128 Cb 0.63 -0.07 -0.15 0.00 -1.01 0.00 0.00 64.21 63.61 2b0f n SER 128 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2b0f s THR 129 N -3.45 2.99 0.10 0.44 -1.32 -0.87 -5.04 115.64 108.49 2b0f s THR 129 Ca 0.00 -0.65 -0.32 0.00 -1.21 0.00 0.00 61.69 59.51 2b0f s THR 129 Cb 0.00 -2.30 -0.12 0.00 -1.51 0.00 0.00 72.50 68.58 2b0f s THR 129 CO 0.00 0.49 1.79 -2.65 -2.21 0.00 0.00 174.62 172.04 2b0f n PRO 130 N 4.16 2.57 -5.08 7.08 -0.02 -1.26 -0.43 135.00 142.02 2b0f n PRO 130 Ca -0.19 0.93 -0.28 0.00 -2.02 0.00 0.00 63.50 61.94 2b0f n PRO 130 Cb 0.52 -2.79 -0.16 0.00 -0.02 0.00 0.00 33.50 31.04 2b0f n PRO 130 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2b0f s THR 131 N 2.57 1.74 0.14 3.45 -4.23 0.14 -3.20 115.64 116.25 2b0f s THR 131 Ca 0.83 -0.93 0.07 0.00 -1.18 0.00 0.00 61.69 60.48 2b0f s THR 131 Cb -0.56 -1.45 -0.04 0.00 1.34 0.00 0.00 72.50 71.79 2b0f s THR 131 CO 0.40 0.49 -0.05 0.54 -0.54 0.00 0.00 174.62 175.46 2b0f s ASN 132 N -0.40 4.60 -0.78 3.99 4.22 -0.74 -1.41 114.94 124.43 2b0f s ASN 132 Ca 0.05 -0.38 -0.01 0.00 -2.14 0.00 0.00 52.86 50.38 2b0f s ASN 132 Cb -0.10 -0.94 -0.02 0.00 1.28 0.00 0.00 41.25 41.48 2b0f s ASN 132 CO 0.00 0.14 0.66 0.54 -2.04 0.00 0.00 177.10 176.40 2b0f n ARG 133 N 0.31 -3.54 -3.43 3.55 1.74 0.07 -4.68 116.66 110.69 2b0f n ARG 133 Ca -0.11 0.58 -0.38 0.00 -0.77 0.00 0.00 57.85 57.17 2b0f n ARG 133 Cb 0.54 -4.68 -0.06 0.00 -1.02 0.00 0.00 32.46 27.23 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 -4.61 4.13 -0.03 5.56 -1.94 -0.19 -1.69 119.30 120.53 2b0f s MET 134 Ca 0.10 0.39 0.01 0.00 -1.71 0.00 0.00 55.69 54.48 2b0f s MET 134 Cb -0.01 -3.33 -0.03 0.00 2.01 0.00 0.00 34.83 33.46 2b0f s MET 134 CO 0.50 0.43 -0.03 -1.50 -0.01 0.00 0.00 175.02 174.41 2b0f s ILE 135 N -0.23 3.99 -0.01 2.53 2.07 0.14 -0.02 121.20 129.66 2b0f s ILE 135 Ca 0.24 -0.53 0.05 0.00 -1.41 0.00 0.00 60.65 59.00 2b0f s ILE 135 Cb -0.16 -2.71 -0.01 0.00 0.13 0.00 0.00 42.46 39.71 2b0f s ILE 135 CO 0.11 0.48 -0.17 0.00 -1.91 0.00 0.00 174.94 173.46 2b0f s ARG 136 N -1.21 1.36 -0.05 3.50 1.70 0.24 -0.48 118.95 124.02 2b0f s ARG 136 Ca 0.16 -0.59 0.05 0.00 -0.47 0.00 0.00 55.73 54.88 2b0f s ARG 136 Cb -0.11 -1.31 -0.01 0.00 -0.57 0.00 0.00 34.95 32.95 2b0f s ARG 136 CO 0.06 0.35 -0.21 1.52 -1.08 0.00 0.00 175.30 175.93 2b0f s TYR 137 N -0.36 2.11 -1.08 5.89 1.13 -0.55 0.12 117.35 124.61 2b0f s TYR 137 Ca 0.06 -0.63 -0.22 0.00 -1.41 0.00 0.00 57.07 54.87 2b0f s TYR 137 Cb -0.07 -1.40 0.06 0.00 -1.10 0.00 0.00 41.96 39.45 2b0f s TYR 137 CO -0.01 -0.20 1.50 0.34 -2.51 0.00 0.00 175.55 174.67 2b0f s ASP 138 N -0.06 6.58 -0.29 -0.18 2.15 -0.14 -1.40 116.67 123.33 2b0f s ASP 138 Ca -0.04 -1.70 -0.16 0.00 0.43 0.00 0.00 52.55 51.08 2b0f s ASP 138 Cb -0.13 -2.56 0.17 0.00 -0.30 0.00 0.00 42.92 40.09 2b0f s ASP 138 CO 0.03 -1.41 1.05 -0.47 -0.17 0.00 0.00 175.17 174.20 2b0f s TYR 139 N 4.69 -0.47 -0.60 -5.34 5.04 -0.92 -4.59 117.35 115.16 2b0f s TYR 139 Ca 0.47 0.89 -0.27 0.00 -2.44 0.00 0.00 57.07 55.73 2b0f s TYR 139 Cb 0.01 0.28 -0.02 0.00 0.35 0.00 0.00 41.96 42.57 2b0f s TYR 139 CO -0.06 -0.23 1.88 0.00 -1.34 0.00 0.00 175.55 175.80 2b0f s ALA 140 N 1.56 2.16 -0.05 3.97 0.00 -1.13 -3.27 121.76 125.00 2b0f s ALA 140 Ca -0.07 -0.61 0.06 0.00 0.00 0.00 0.00 51.96 51.34 2b0f s ALA 140 Cb -0.04 -4.30 -0.02 0.00 0.00 0.00 0.00 23.12 18.76 2b0f s ALA 140 CO -0.14 -3.90 -0.21 0.99 0.00 0.00 0.00 175.76 172.49 2b0f s THR 141 N 9.18 2.41 0.41 0.00 2.01 -1.26 -5.00 115.64 123.39 2b0f s THR 141 Ca 0.69 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.77 2b0f s THR 141 Cb -0.13 -1.90 -0.03 0.00 0.01 0.00 0.00 72.50 70.45 2b0f s THR 141 CO 0.21 0.58 0.10 -0.54 -0.69 0.00 0.00 174.62 174.27 2b0f s LYS 142 N -0.43 1.93 0.66 4.92 1.02 -1.26 -4.65 119.74 121.92 2b0f s LYS 142 Ca 0.05 -2.17 -0.18 0.00 0.02 0.00 0.00 55.97 53.69 2b0f s LYS 142 Cb -0.12 -0.81 -0.14 0.00 -0.52 0.00 0.00 37.83 36.24 2b0f s LYS 142 CO 0.01 -0.41 -0.22 2.41 -0.92 0.00 0.00 175.35 176.23 2b0f n THR 143 N -0.93 0.24 0.00 2.17 -1.04 -1.26 -2.73 114.28 110.72 2b0f n THR 143 Ca -0.07 -0.49 0.00 0.00 -2.04 0.00 0.00 64.05 61.45 2b0f n THR 143 Cb 0.66 -0.09 0.00 0.00 -1.82 0.00 0.00 70.33 69.07 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 2.66 2.51 0.34 3.41 0.00 -1.26 -4.80 105.19 108.05 2b0f n GLY 144 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.11 2b0f n GLY 144 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2b0f n GLN 145 N -2.00 2.88 -2.66 1.61 1.13 -1.11 -5.01 117.38 112.23 2b0f n GLN 145 Ca 0.00 -1.78 -0.41 0.00 -1.94 0.00 0.00 57.00 52.87 2b0f n GLN 145 Cb 0.00 -1.14 -0.04 0.00 0.11 0.00 0.00 30.24 29.16 2b0f n GLN 145 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2b0f n GLY 147 N 2.06 1.61 3.73 0.00 0.00 0.19 -4.84 105.19 107.94 2b0f n GLY 147 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 2b0f n GLY 147 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b0f s GLY 148 N -1.34 2.37 -0.16 -0.02 0.00 -1.20 -3.54 107.32 103.43 2b0f s GLY 148 Ca 0.00 0.88 -0.15 0.00 0.00 0.00 0.00 44.72 45.45 2b0f s GLY 148 CO 0.00 1.28 0.34 0.14 0.00 0.00 0.00 173.10 174.86 2b0f s VAL 149 N -1.97 5.27 -0.40 1.40 1.01 -0.20 0.69 120.40 126.21 2b0f s VAL 149 Ca 0.74 0.64 -0.17 0.00 0.00 0.00 0.00 61.98 63.20 2b0f s VAL 149 Cb -0.29 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.42 2b0f s VAL 149 CO 0.44 0.36 0.42 -0.22 0.00 0.00 0.00 175.10 176.10 2b0f s LEU 150 N 0.57 4.76 0.35 3.92 2.96 0.12 -0.23 118.68 131.13 2b0f s LEU 150 Ca 0.19 -0.56 -0.02 0.00 -0.22 0.00 0.00 54.13 53.52 2b0f s LEU 150 Cb -0.14 -2.37 0.00 0.00 0.50 0.00 0.00 46.19 44.19 2b0f s LEU 150 CO 0.05 -0.51 0.47 0.00 -1.32 0.00 0.00 176.35 175.04 2b0f n ALA 152 N -0.58 -0.16 -1.60 0.00 0.00 0.29 0.01 120.51 118.46 2b0f n ALA 152 Ca 0.01 -1.48 -0.37 0.00 0.00 0.00 0.00 53.44 51.60 2b0f n ALA 152 Cb 0.61 1.19 -0.03 0.00 0.00 0.00 0.00 19.45 21.22 2b0f n ALA 152 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2b0f s THR 153 N -2.83 3.04 -1.15 0.00 -1.32 -1.26 -1.90 115.64 110.22 2b0f s THR 153 Ca 0.27 0.03 -0.01 0.00 -1.21 0.00 0.00 61.69 60.77 2b0f s THR 153 Cb -0.00 -3.09 0.00 0.00 -1.51 0.00 0.00 72.50 67.90 2b0f s THR 153 CO 0.19 -0.08 0.08 0.61 -2.21 0.00 0.00 174.62 173.22 2b0f n GLY 154 N 5.94 -0.18 3.01 6.08 0.00 -1.26 -4.97 105.19 113.81 2b0f n GLY 154 Ca 0.34 -0.28 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 2b0f n GLY 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b0f s LYS 155 N -4.81 0.40 -0.17 1.61 2.20 -0.80 -4.82 119.74 113.34 2b0f s LYS 155 Ca 0.04 0.70 -0.13 0.00 -0.36 0.00 0.00 55.97 56.22 2b0f s LYS 155 Cb -0.02 -0.16 -0.05 0.00 -1.51 0.00 0.00 37.83 36.10 2b0f s LYS 155 CO 0.05 -0.59 0.27 0.42 -0.36 0.00 0.00 175.35 175.14 2b0f s ILE 156 N 2.62 5.32 -0.25 5.43 1.01 0.45 0.11 121.20 135.89 2b0f s ILE 156 Ca 0.13 0.49 -0.15 0.00 0.00 0.00 0.00 60.65 61.11 2b0f s ILE 156 Cb -0.15 -3.61 -0.15 0.00 0.01 0.00 0.00 42.46 38.56 2b0f s ILE 156 CO -0.17 0.38 -0.15 0.49 0.00 0.00 0.00 174.94 175.49 2b0f n PHE 157 N 3.69 0.36 -3.20 3.97 3.72 0.03 -2.47 117.46 123.55 2b0f n PHE 157 Ca -0.12 0.15 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 2b0f n PHE 157 Cb 0.52 -1.04 0.00 0.00 -0.94 0.00 0.00 39.48 38.02 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 1.38 -1.02 3.31 1.37 0.00 -0.89 0.25 105.19 109.59 2b0f n GLY 158 Ca -0.47 -0.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.43 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 -3.00 2.01 -0.16 -0.61 -4.36 -1.03 0.13 121.20 114.18 2b0f s ILE 159 Ca 0.00 -1.22 -0.29 0.00 -0.26 0.00 0.00 60.65 58.89 2b0f s ILE 159 Cb 0.00 -1.70 -0.05 0.00 1.25 0.00 0.00 42.46 41.96 2b0f s ILE 159 CO 0.00 0.44 1.97 -2.28 0.24 0.00 0.00 174.94 175.31 2b0f s HIS 160 N -0.70 1.48 -0.11 1.37 5.65 0.22 -1.88 115.29 121.31 2b0f s HIS 160 Ca 0.10 0.29 0.13 0.00 0.25 0.00 0.00 55.06 55.84 2b0f s HIS 160 Cb -0.10 -4.04 -0.18 0.00 -1.18 0.00 0.00 32.58 27.08 2b0f s HIS 160 CO 0.01 -4.08 0.10 1.33 -0.65 0.00 0.00 174.74 171.45 2b0f n VAL 161 N 6.84 0.76 -1.32 0.89 0.24 -1.04 0.56 118.33 125.26 2b0f n VAL 161 Ca 0.24 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 2b0f n VAL 161 Cb 0.44 -0.47 0.00 0.00 -1.47 0.00 0.00 33.84 32.34 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 2.05 1.69 0.00 7.63 0.00 0.23 -4.85 105.19 111.94 2b0f n GLY 162 Ca -0.18 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2b0f n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b0f n GLY 163 N 0.00 0.53 2.57 -0.02 0.00 -1.26 -0.40 105.19 106.62 2b0f n GLY 163 Ca 0.00 -0.74 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 2b0f n GLY 163 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2b0f s ASN 164 N 0.00 3.50 1.26 1.61 3.84 0.89 -4.80 114.94 121.24 2b0f s ASN 164 Ca 0.00 -1.69 0.00 0.00 0.21 0.00 0.00 52.86 51.38 2b0f s ASN 164 Cb 0.00 -0.52 0.00 0.00 -0.55 0.00 0.00 41.25 40.18 2b0f s ASN 164 CO 0.00 -0.39 0.00 0.61 -2.79 0.00 0.00 177.10 174.53 2b0f n GLY 165 N 4.73 2.70 1.70 1.21 0.00 -1.26 -2.84 105.19 111.43 2b0f n GLY 165 Ca 0.01 -0.29 0.06 0.00 0.00 0.00 0.00 46.02 45.79 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 11.59 4.35 -3.77 1.61 1.74 -1.26 -4.38 116.66 126.54 2b0f n ARG 166 Ca 0.00 -2.73 -0.25 0.00 -0.77 0.00 0.00 57.85 54.09 2b0f n ARG 166 Cb 0.00 -2.15 -0.17 0.00 -1.02 0.00 0.00 32.46 29.12 2b0f n ARG 166 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2b0f s GLN 167 N -2.49 0.74 0.44 5.56 0.74 -1.13 -2.17 119.66 121.34 2b0f s GLN 167 Ca 0.47 -0.16 -0.22 0.00 0.05 0.00 0.00 55.36 55.51 2b0f s GLN 167 Cb 0.36 -1.52 -0.10 0.00 1.10 0.00 0.00 33.01 32.85 2b0f s GLN 167 CO 0.14 -0.44 0.99 0.20 -0.55 0.00 0.00 175.29 175.64 2b0f s GLY 168 N 1.89 2.52 -0.14 2.59 0.00 -0.50 -0.08 107.32 113.61 2b0f s GLY 168 Ca 0.02 0.53 0.01 0.00 0.00 0.00 0.00 44.72 45.28 2b0f s GLY 168 CO -0.07 0.85 -0.14 -1.36 0.00 0.00 0.00 173.10 172.38 2b0f s PHE 169 N -1.99 2.12 0.22 1.90 0.40 0.47 -1.48 117.98 119.62 2b0f s PHE 169 Ca 0.62 -1.14 0.11 0.00 -0.60 0.00 0.00 56.93 55.92 2b0f s PHE 169 Cb -0.14 -1.55 -0.04 0.00 0.51 0.00 0.00 43.02 41.79 2b0f s PHE 169 CO 0.18 -0.62 -0.16 0.45 0.70 0.00 0.00 175.22 175.78 2b0f s SER 170 N 1.35 3.85 -0.11 1.36 0.15 0.37 -0.60 113.70 120.07 2b0f s SER 170 Ca 0.02 -0.80 -0.13 0.00 0.70 0.00 0.00 55.95 55.74 2b0f s SER 170 Cb -0.13 -0.47 -0.05 0.00 -1.71 0.00 0.00 66.02 63.65 2b0f s SER 170 CO -0.08 0.08 0.31 0.00 1.20 0.00 0.00 173.24 174.75 2b0f s ALA 171 N -1.97 3.66 -0.06 5.45 0.00 -0.79 0.25 121.76 128.30 2b0f s ALA 171 Ca 0.26 -0.41 -0.30 0.00 0.00 0.00 0.00 51.96 51.51 2b0f s ALA 171 Cb -0.07 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 20.66 2b0f s ALA 171 CO 0.14 0.27 1.43 -0.65 0.00 0.00 0.00 175.76 176.94 2b0f s GLN 172 N -0.16 4.25 -0.86 0.00 -0.21 -0.68 -2.47 119.66 119.53 2b0f s GLN 172 Ca 0.19 1.94 -0.22 0.00 0.02 0.00 0.00 55.36 57.28 2b0f s GLN 172 Cb -0.14 -3.73 0.08 0.00 1.00 0.00 0.00 33.01 30.22 2b0f s GLN 172 CO 0.07 -0.68 1.19 -0.51 -2.12 0.00 0.00 175.29 173.24 2b0f s LEU 173 N 3.11 4.24 -0.16 2.90 2.01 0.14 -4.92 118.68 126.00 2b0f s LEU 173 Ca 0.64 -1.41 -0.17 0.00 0.01 0.00 0.00 54.13 53.19 2b0f s LEU 173 Cb -0.29 -2.47 -0.04 0.00 0.01 0.00 0.00 46.19 43.40 2b0f s LEU 173 CO 0.24 -1.38 0.43 -0.54 1.01 0.00 0.00 176.35 176.12 2b0f s LYS 174 N 4.02 4.26 0.51 1.70 1.02 -1.25 -3.59 119.74 126.41 2b0f s LYS 174 Ca 0.34 0.32 0.30 0.00 0.02 0.00 0.00 55.97 56.95 2b0f s LYS 174 Cb -0.07 -3.48 1.43 0.00 -0.52 0.00 0.00 37.83 35.19 2b0f s LYS 174 CO -0.01 0.08 1.85 -0.22 -0.92 0.00 0.00 175.35 176.13 2b0f h LYS 175 N 6.98 0.08 -0.86 1.68 3.64 -1.71 -3.07 116.57 123.30 2b0f h LYS 175 Ca -0.39 -0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.10 2b0f h LYS 175 Cb 1.17 -0.02 -0.12 0.00 -0.41 0.00 0.00 32.23 32.85 2b0f h LYS 175 CO 0.74 0.05 -0.41 1.04 -2.27 0.00 0.00 179.45 178.60 2b0f n GLN 176 N -4.31 -0.28 0.00 1.90 3.00 -1.26 -0.33 117.38 116.11 2b0f n GLN 176 Ca 0.21 1.32 0.13 0.00 -0.01 0.00 0.00 57.00 58.65 2b0f n GLN 176 Cb 1.00 -1.95 0.58 0.00 0.00 0.00 0.00 30.24 29.86 2b0f n GLN 176 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2b0f n TYR 177 N -5.19 0.00 -0.08 1.08 4.01 -1.16 -2.03 117.16 113.78 2b0f n TYR 177 Ca 0.06 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.70 2b0f n TYR 177 Cb 0.29 -0.49 -0.11 0.00 -0.31 0.00 0.00 39.34 38.73 2b0f n TYR 177 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2b0f n PHE 178 N -1.49 0.00 1.00 -0.72 3.72 -0.08 -4.23 117.46 115.66 2b0f n PHE 178 Ca 0.07 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.61 2b0f n PHE 178 Cb 0.31 -0.74 0.59 0.00 -0.94 0.00 0.00 39.48 38.70 2b0f n PHE 178 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 2b0f n VAL 179 N -2.76 0.00 0.05 -4.37 3.14 0.55 -3.22 118.33 111.72 2b0f n VAL 179 Ca -0.28 -0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 60.97 2b0f n VAL 179 Cb 0.94 -0.44 -0.08 0.00 -1.06 0.00 0.00 33.84 33.20 2b0f n VAL 179 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 2b0f h GLU 180 N 0.00 -0.08 -6.64 1.45 4.57 -1.58 -3.42 114.58 108.88 2b0f h GLU 180 Ca 0.00 0.01 -0.53 0.00 -1.18 0.00 0.00 59.36 57.66 2b0f h GLU 180 Cb 0.50 0.02 0.04 0.00 -0.16 0.00 0.00 28.75 29.15 2b0f h GLU 180 CO 0.00 0.11 0.80 0.15 -1.18 0.00 0.00 179.01 178.88 2b0f s LYS 181 N -5.47 4.26 0.00 1.92 1.02 -1.20 -5.11 119.74 115.17 2b0f s LYS 181 Ca -0.14 2.26 0.32 0.00 0.02 0.00 0.00 55.97 58.43 2b0f s LYS 181 Cb 0.04 -3.17 1.90 0.00 -0.52 0.00 0.00 37.83 36.08 2b0f s LYS 181 CO 0.65 -0.49 2.22 0.94 -0.92 0.00 0.00 175.35 177.75