#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 0.00 -0.38 1.61 0.13 -2.04 0.74 132.00 132.07 2b0f h PRO 2 Ca 0.00 -0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.98 2b0f h PRO 2 Cb 0.00 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2b0f h PRO 2 CO 0.00 0.00 -0.36 -0.97 -0.23 0.00 0.00 178.00 176.45 2b0f h ASN 3 N 0.00 0.97 -0.01 1.44 -0.73 -1.96 -2.41 115.58 112.87 2b0f h ASN 3 Ca 0.52 -0.46 -0.00 0.00 1.87 0.00 0.00 56.30 58.23 2b0f h ASN 3 Cb 0.90 -0.27 -0.00 0.00 0.27 0.00 0.00 38.32 39.22 2b0f h ASN 3 CO -0.99 1.23 0.00 0.74 -0.37 0.00 0.00 177.43 178.04 2b0f h THR 4 N 0.72 1.21 -0.38 -3.57 2.02 -1.04 -1.56 112.91 110.30 2b0f h THR 4 Ca 0.06 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 66.63 2b0f h THR 4 Cb 0.95 1.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.93 2b0f h THR 4 CO 0.09 0.16 0.24 -0.33 0.37 0.00 0.00 175.52 176.05 2b0f h GLU 5 N -0.23 0.50 0.49 6.66 4.39 0.29 0.17 114.58 126.85 2b0f h GLU 5 Ca 0.00 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 2b0f h GLU 5 Cb 0.26 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2b0f h GLU 5 CO 0.00 0.35 -0.23 0.35 -1.16 0.00 0.00 179.01 178.31 2b0f h PHE 6 N 0.52 -0.61 -0.52 4.33 3.57 -1.28 -2.66 116.94 120.30 2b0f h PHE 6 Ca 0.14 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 2b0f h PHE 6 Cb -0.03 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.88 2b0f h PHE 6 CO 0.00 -0.31 0.22 0.00 -2.23 0.00 0.00 178.31 175.99 2b0f h ALA 7 N -0.95 0.68 -0.10 2.41 0.00 -1.11 0.17 119.26 120.35 2b0f h ALA 7 Ca -0.07 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 2b0f h ALA 7 Cb 0.57 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2b0f h ALA 7 CO 0.11 0.27 -0.50 1.25 0.00 0.00 0.00 179.25 180.38 2b0f h LEU 8 N 0.70 0.30 0.10 0.00 5.85 -0.79 -1.46 115.31 120.02 2b0f h LEU 8 Ca 0.18 -0.15 -0.27 0.00 0.84 0.00 0.00 57.88 58.48 2b0f h LEU 8 Cb 0.17 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.12 2b0f h LEU 8 CO -0.02 0.76 -1.21 -1.28 -0.34 0.00 0.00 178.44 176.35 2b0f h SER 9 N 0.22 0.39 -0.74 1.25 0.87 -1.39 -3.16 113.55 110.99 2b0f h SER 9 Ca 0.01 -0.41 0.07 0.00 -1.23 0.00 0.00 61.79 60.22 2b0f h SER 9 Cb 0.97 -0.13 -0.05 0.00 -0.44 0.00 0.00 62.40 62.75 2b0f h SER 9 CO 0.08 1.32 0.49 0.25 -0.53 0.00 0.00 176.83 178.43 2b0f h LEU 10 N 0.07 0.68 0.49 2.23 5.85 -0.46 -0.96 115.31 123.20 2b0f h LEU 10 Ca -0.12 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 2b0f h LEU 10 Cb 1.94 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.80 2b0f h LEU 10 CO 0.20 0.43 -0.50 0.25 -0.34 0.00 0.00 178.44 178.48 2b0f h LEU 11 N 0.77 -1.38 -0.85 2.25 5.85 -1.23 0.25 115.31 120.97 2b0f h LEU 11 Ca 0.32 0.11 -0.09 0.00 0.84 0.00 0.00 57.88 59.06 2b0f h LEU 11 Cb 0.27 0.46 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2b0f h LEU 11 CO -0.11 -0.66 -0.44 0.03 -0.34 0.00 0.00 178.44 176.92 2b0f h ARG 12 N -0.99 0.00 0.09 1.25 -0.00 -1.57 -0.67 114.38 112.49 2b0f h ARG 12 Ca -0.06 0.00 -0.15 0.00 -0.50 0.00 0.00 59.98 59.27 2b0f h ARG 12 Cb 0.87 0.00 0.01 0.00 0.00 0.00 0.00 29.97 30.84 2b0f h ARG 12 CO -0.07 0.44 -0.72 0.87 0.00 0.00 0.00 179.97 180.50 2b0f h LYS 13 N 0.00 0.18 0.00 0.04 1.79 -1.04 -3.42 116.57 114.12 2b0f h LYS 13 Ca -0.00 -0.31 0.00 0.00 -2.18 0.00 0.00 60.65 58.15 2b0f h LYS 13 Cb 0.97 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.74 2b0f h LYS 13 CO 0.06 1.15 0.00 0.09 -1.08 0.00 0.00 179.45 179.67 2b0f n ASN 14 N -4.25 0.36 -4.36 0.86 4.13 0.84 -4.42 115.26 108.42 2b0f n ASN 14 Ca -0.16 -0.67 -0.35 0.00 1.68 0.00 0.00 54.58 55.08 2b0f n ASN 14 Cb 0.73 0.56 -0.13 0.00 -1.54 0.00 0.00 39.78 39.39 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 -0.56 3.65 0.06 2.41 1.01 -0.26 -0.68 121.20 126.84 2b0f s ILE 15 Ca 0.00 -0.40 0.06 0.00 0.00 0.00 0.00 60.65 60.31 2b0f s ILE 15 Cb 0.00 -2.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 2b0f s ILE 15 CO 0.00 0.41 -0.17 -0.04 0.00 0.00 0.00 174.94 175.14 2b0f s MET 16 N 1.38 1.07 -0.26 2.79 -1.94 -0.71 -4.51 119.30 117.11 2b0f s MET 16 Ca 0.05 -0.93 -0.28 0.00 -1.71 0.00 0.00 55.69 52.81 2b0f s MET 16 Cb -0.14 -1.16 -0.03 0.00 2.01 0.00 0.00 34.83 35.50 2b0f s MET 16 CO -0.01 0.28 1.94 0.99 -0.01 0.00 0.00 175.02 178.21 2b0f s THR 17 N -0.98 3.31 -0.50 2.05 2.01 -1.26 -1.78 115.64 118.48 2b0f s THR 17 Ca 0.03 0.32 -0.18 0.00 0.31 0.00 0.00 61.69 62.17 2b0f s THR 17 Cb -0.09 -3.39 0.06 0.00 0.01 0.00 0.00 72.50 69.10 2b0f s THR 17 CO 0.02 -0.23 0.58 -0.63 -0.69 0.00 0.00 174.62 173.67 2b0f s ILE 18 N 7.11 4.96 -0.72 1.82 -1.09 0.11 0.10 121.20 133.48 2b0f s ILE 18 Ca 0.87 -0.65 -0.19 0.00 -2.23 0.00 0.00 60.65 58.45 2b0f s ILE 18 Cb -0.28 -4.27 0.11 0.00 -1.58 0.00 0.00 42.46 36.45 2b0f s ILE 18 CO 0.34 -0.77 0.88 -0.89 -1.23 0.00 0.00 174.94 173.28 2b0f s THR 19 N 2.40 4.74 0.00 2.92 2.01 -0.50 -0.35 115.64 126.87 2b0f s THR 19 Ca 0.12 -1.12 0.00 0.00 0.31 0.00 0.00 61.69 61.00 2b0f s THR 19 Cb -0.21 -4.61 0.00 0.00 0.01 0.00 0.00 72.50 67.69 2b0f s THR 19 CO 0.10 -1.30 0.00 0.35 -0.69 0.00 0.00 174.62 173.08 2b0f n THR 20 N 5.49 0.00 0.11 -0.82 -2.24 0.20 -3.39 114.28 113.63 2b0f n THR 20 Ca 0.03 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2b0f n THR 20 Cb 0.45 -0.86 0.29 0.00 -2.10 0.00 0.00 70.33 68.11 2b0f n THR 20 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2b0f h SER 21 N 0.00 0.21 0.52 3.42 0.02 -1.37 -3.00 113.55 113.34 2b0f h SER 21 Ca 0.00 -0.07 -0.29 0.00 -0.84 0.00 0.00 61.79 60.58 2b0f h SER 21 Cb 0.00 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.48 2b0f h SER 21 CO 0.00 0.53 -1.44 0.50 -1.14 0.00 0.00 176.83 175.28 2b0f h LYS 22 N 0.19 0.25 0.00 3.45 3.64 -1.43 -3.50 116.57 119.16 2b0f h LYS 22 Ca 0.03 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 2b0f h LYS 22 Cb 0.66 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 2b0f h LYS 22 CO 0.05 1.13 0.00 0.41 -2.27 0.00 0.00 179.45 178.77 2b0f n GLY 23 N 1.62 -0.39 3.64 5.01 0.00 -1.14 -5.10 105.19 108.83 2b0f n GLY 23 Ca -0.14 -0.90 -0.41 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 4.17 0.20 1.61 2.02 -1.26 -0.63 118.70 122.81 2b0f s GLU 24 Ca 0.00 0.82 0.08 0.00 0.02 0.00 0.00 54.97 55.89 2b0f s GLU 24 Cb 0.00 -3.64 -0.05 0.00 0.10 0.00 0.00 34.13 30.54 2b0f s GLU 24 CO 0.00 -0.47 -0.15 -0.06 0.02 0.00 0.00 175.26 174.60 2b0f s PHE 25 N 2.68 1.72 -0.71 1.61 0.40 0.53 -1.02 117.98 123.19 2b0f s PHE 25 Ca 0.32 -0.56 -0.27 0.00 -0.60 0.00 0.00 56.93 55.82 2b0f s PHE 25 Cb -0.15 -0.80 0.03 0.00 0.51 0.00 0.00 43.02 42.60 2b0f s PHE 25 CO 0.08 0.36 1.29 0.99 0.70 0.00 0.00 175.22 178.63 2b0f s THR 26 N -2.89 3.75 -0.40 0.64 2.01 -1.23 -0.72 115.64 116.80 2b0f s THR 26 Ca 0.22 0.47 -0.21 0.00 0.31 0.00 0.00 61.69 62.48 2b0f s THR 26 Cb -0.01 -4.86 0.01 0.00 0.01 0.00 0.00 72.50 67.65 2b0f s THR 26 CO 0.07 -1.75 0.68 -0.83 -0.69 0.00 0.00 174.62 172.09 2b0f s GLY 27 N 3.77 1.70 -0.45 4.40 0.00 -0.74 -4.80 107.32 111.20 2b0f s GLY 27 Ca 0.37 -0.98 -0.14 0.00 0.00 0.00 0.00 44.72 43.98 2b0f s GLY 27 CO 0.17 1.58 0.35 -2.27 0.00 0.00 0.00 173.10 172.93 2b0f s LEU 28 N 2.89 5.43 -0.24 0.66 2.96 -1.19 -1.75 118.68 127.44 2b0f s LEU 28 Ca 0.25 -1.32 -0.29 0.00 -0.22 0.00 0.00 54.13 52.55 2b0f s LEU 28 Cb -0.14 -2.13 -0.01 0.00 0.50 0.00 0.00 46.19 44.42 2b0f s LEU 28 CO 0.18 -0.59 1.36 -0.83 -1.32 0.00 0.00 176.35 175.14 2b0f s GLY 29 N 2.37 1.43 -0.11 7.98 0.00 0.15 -0.84 107.32 118.30 2b0f s GLY 29 Ca 0.04 0.30 -0.03 0.00 0.00 0.00 0.00 44.72 45.02 2b0f s GLY 29 CO 0.06 2.65 -0.06 -2.22 0.00 0.00 0.00 173.10 173.53 2b0f h ILE 30 N 5.85 0.00 -3.56 0.90 1.08 -1.33 -3.43 117.51 117.02 2b0f h ILE 30 Ca -0.28 -0.98 -0.13 0.00 -0.39 0.00 0.00 64.86 63.09 2b0f h ILE 30 Cb 1.11 0.00 -0.19 0.00 -3.07 0.00 0.00 36.82 34.67 2b0f h ILE 30 CO 1.01 0.00 -0.45 -1.38 -0.69 0.00 0.00 178.15 176.64 2b0f s HIS 31 N -1.77 0.06 0.00 1.37 -3.43 -1.14 -0.61 115.29 109.77 2b0f s HIS 31 Ca -0.05 -0.23 0.00 0.00 -0.80 0.00 0.00 55.06 53.98 2b0f s HIS 31 Cb 0.01 -0.05 0.00 0.00 -1.43 0.00 0.00 32.58 31.10 2b0f s HIS 31 CO 0.07 -0.36 0.00 -0.25 -2.00 0.00 0.00 174.74 172.20 2b0f n ASP 32 N 1.03 0.00 -1.05 7.38 8.00 -1.26 0.41 116.55 131.06 2b0f n ASP 32 Ca -0.21 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.31 2b0f n ASP 32 Cb 0.57 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.68 2b0f n ASP 32 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2b0f n ARG 33 N 0.00 0.00 -3.72 -1.24 1.85 -1.26 -0.99 116.66 111.30 2b0f n ARG 33 Ca 0.00 -1.50 -0.37 0.00 -1.00 0.00 0.00 57.85 54.98 2b0f n ARG 33 Cb 0.00 -0.17 -0.12 0.00 -1.05 0.00 0.00 32.46 31.11 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 0.00 4.41 0.06 8.89 1.01 0.17 -1.21 120.40 133.73 2b0f s VAL 34 Ca 0.18 -0.25 0.08 0.00 0.00 0.00 0.00 61.98 61.99 2b0f s VAL 34 Cb 0.21 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 2b0f s VAL 34 CO -0.09 0.25 -0.21 0.00 0.00 0.00 0.00 175.10 175.05 2b0f s VAL 36 N -0.94 5.25 0.00 0.00 -7.23 -0.02 -1.13 120.40 116.32 2b0f s VAL 36 Ca 0.14 0.47 0.02 0.00 -1.81 0.00 0.00 61.98 60.80 2b0f s VAL 36 Cb -0.10 -3.64 -0.01 0.00 0.56 0.00 0.00 36.38 33.19 2b0f s VAL 36 CO 0.05 0.25 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.39 2b0f s ILE 37 N 1.54 0.55 0.48 -0.62 1.01 -0.85 -3.19 121.20 120.13 2b0f s ILE 37 Ca 0.13 -0.38 -0.24 0.00 0.00 0.00 0.00 60.65 60.16 2b0f s ILE 37 Cb -0.15 -0.48 -0.07 0.00 0.01 0.00 0.00 42.46 41.77 2b0f s ILE 37 CO 0.08 0.10 1.33 -2.65 0.00 0.00 0.00 174.94 173.80 2b0f n PRO 38 N 2.75 1.88 0.09 2.79 -0.02 -1.26 -0.30 135.00 140.93 2b0f n PRO 38 Ca -0.14 0.68 -0.06 0.00 -2.02 0.00 0.00 63.50 61.95 2b0f n PRO 38 Cb 0.57 -2.51 0.06 0.00 -0.02 0.00 0.00 33.50 31.60 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 1.83 1.45 0.00 3.45 2.02 -1.70 -2.79 112.91 117.17 2b0f h THR 39 Ca -0.50 -2.33 0.00 0.00 0.77 0.00 0.00 66.41 64.35 2b0f h THR 39 Cb 1.29 2.25 0.00 0.00 -1.74 0.00 0.00 68.15 69.96 2b0f h THR 39 CO 0.59 0.68 0.00 0.00 0.37 0.00 0.00 175.52 177.16 2b0f n HIS 40 N -3.75 0.00 0.17 3.16 1.44 -1.26 -2.09 115.22 112.88 2b0f n HIS 40 Ca -0.03 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.70 2b0f n HIS 40 Cb 0.71 -0.36 0.29 0.00 0.12 0.00 0.00 29.99 30.75 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 2.73 1.17 -4.58 1.59 0.00 -1.87 -3.42 119.26 114.89 2b0f h ALA 41 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2b0f h ALA 41 Cb 0.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2b0f h ALA 41 CO 0.00 0.58 -0.03 1.04 0.00 0.00 0.00 179.25 180.84 2b0f n GLN 42 N -3.90 -0.95 -3.05 0.00 6.02 -0.89 -1.27 117.38 113.34 2b0f n GLN 42 Ca -0.01 1.21 -0.41 0.00 -0.01 0.00 0.00 57.00 57.77 2b0f n GLN 42 Cb 0.50 -4.35 -0.06 0.00 1.02 0.00 0.00 30.24 27.35 2b0f n GLN 42 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2b0f s PRO 43 N -2.91 4.02 0.00 -1.09 0.04 -1.26 -2.89 135.00 130.90 2b0f s PRO 43 Ca 0.02 0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.57 2b0f s PRO 43 Cb -0.00 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.84 2b0f s PRO 43 CO 0.50 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 177.42 2b0f n GLY 44 N 4.21 1.34 0.11 0.56 0.00 -1.26 -4.94 105.19 105.21 2b0f n GLY 44 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 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 0.00 1.32 -4.44 1.61 2.03 -1.26 -4.81 116.55 111.00 2b0f n ASP 45 Ca 0.00 0.11 -0.30 0.00 0.52 0.00 0.00 54.79 55.13 2b0f n ASP 45 Cb 0.00 -0.13 -0.12 0.00 -0.72 0.00 0.00 41.12 40.15 2b0f n ASP 45 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 2b0f s ASP 46 N -6.33 3.62 -0.08 1.67 1.47 -1.26 -0.05 116.67 115.71 2b0f s ASP 46 Ca -0.19 -0.60 0.00 0.00 1.18 0.00 0.00 52.55 52.94 2b0f s ASP 46 Cb 0.07 -0.43 0.02 0.00 -0.34 0.00 0.00 42.92 42.25 2b0f s ASP 46 CO 0.75 0.20 -0.07 -0.69 0.68 0.00 0.00 175.17 176.04 2b0f s VAL 47 N -1.05 0.84 -1.00 2.11 1.01 0.60 -4.93 120.40 117.99 2b0f s VAL 47 Ca 0.16 -0.22 -0.23 0.00 0.00 0.00 0.00 61.98 61.68 2b0f s VAL 47 Cb -0.10 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.41 2b0f s VAL 47 CO 0.07 0.32 1.74 -0.76 0.00 0.00 0.00 175.10 176.47 2b0f s LEU 48 N 1.40 3.33 -0.74 3.92 1.43 -1.22 -2.34 118.68 124.47 2b0f s LEU 48 Ca -0.02 -1.20 -0.25 0.00 -1.03 0.00 0.00 54.13 51.63 2b0f s LEU 48 Cb -0.13 -2.57 0.05 0.00 0.03 0.00 0.00 46.19 43.57 2b0f s LEU 48 CO -0.04 -2.19 1.17 -0.69 0.23 0.00 0.00 176.35 174.84 2b0f s VAL 49 N 7.80 3.98 -1.63 -1.59 1.01 -0.37 -1.41 120.40 128.20 2b0f s VAL 49 Ca 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.56 2b0f s VAL 49 Cb -0.03 -4.84 0.00 0.00 0.00 0.00 0.00 36.38 31.51 2b0f s VAL 49 CO -0.02 -1.71 0.00 -3.20 0.00 0.00 0.00 175.10 170.17 2b0f n ASN 50 N 8.65 -4.92 0.00 3.32 4.05 0.11 -1.95 115.26 124.52 2b0f n ASN 50 Ca 0.03 0.28 0.00 0.00 0.45 0.00 0.00 54.58 55.34 2b0f n ASN 50 Cb 0.48 -3.91 0.00 0.00 1.23 0.00 0.00 39.78 37.58 2b0f n ASN 50 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2b0f n GLY 51 N -0.99 0.19 3.73 8.20 0.00 -1.24 -5.01 105.19 110.07 2b0f n GLY 51 Ca -0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.94 4.29 -0.99 1.61 -0.21 -0.82 -4.96 119.66 117.63 2b0f s GLN 52 Ca 0.00 0.30 -0.23 0.00 0.02 0.00 0.00 55.36 55.44 2b0f s GLN 52 Cb 0.00 -3.42 -0.01 0.00 1.00 0.00 0.00 33.01 30.58 2b0f s GLN 52 CO 0.00 0.21 1.74 0.15 -2.12 0.00 0.00 175.29 175.27 2b0f s LYS 53 N 0.50 3.04 -0.14 2.91 -0.14 -1.26 -1.23 119.74 123.42 2b0f s LYS 53 Ca 0.22 -0.78 -0.06 0.00 -1.36 0.00 0.00 55.97 53.98 2b0f s LYS 53 Cb -0.14 -5.22 -0.04 0.00 -1.68 0.00 0.00 37.83 30.75 2b0f s LYS 53 CO 0.08 -2.91 0.08 0.42 -0.76 0.00 0.00 175.35 172.26 2b0f s ILE 54 N 7.82 4.97 0.15 2.17 1.01 -0.99 -4.92 121.20 131.42 2b0f s ILE 54 Ca 0.60 0.01 0.03 0.00 0.00 0.00 0.00 60.65 61.29 2b0f s ILE 54 Cb -0.03 -3.18 -0.04 0.00 0.01 0.00 0.00 42.46 39.23 2b0f s ILE 54 CO -0.03 0.55 0.26 0.00 0.00 0.00 0.00 174.94 175.73 2b0f s ARG 55 N -0.45 3.38 0.16 2.79 1.04 -1.26 -0.29 118.95 124.32 2b0f s ARG 55 Ca 0.10 -0.62 -0.30 0.00 -1.04 0.00 0.00 55.73 53.87 2b0f s ARG 55 Cb -0.12 -2.93 -0.08 0.00 -2.04 0.00 0.00 34.95 29.78 2b0f s ARG 55 CO 0.02 0.52 1.26 0.08 -0.04 0.00 0.00 175.30 177.13 2b0f s VAL 56 N -1.73 3.49 -0.20 4.99 1.01 0.93 -2.28 120.40 126.60 2b0f s VAL 56 Ca 0.34 1.19 -0.16 0.00 0.00 0.00 0.00 61.98 63.35 2b0f s VAL 56 Cb -0.11 -3.76 -0.08 0.00 0.00 0.00 0.00 36.38 32.43 2b0f s VAL 56 CO 0.28 0.16 -0.34 1.17 0.00 0.00 0.00 175.10 176.37 2b0f n LYS 57 N 2.92 0.53 -3.92 2.72 0.00 0.17 -4.83 118.16 115.75 2b0f n LYS 57 Ca 0.06 0.22 -0.29 0.00 0.00 0.00 0.00 58.31 58.31 2b0f n LYS 57 Cb 0.44 -1.41 -0.16 0.00 0.00 0.00 0.00 35.03 33.90 2b0f n LYS 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2b0f s ASP 58 N -6.47 2.86 -0.67 3.14 1.01 -0.63 -4.99 116.67 110.91 2b0f s ASP 58 Ca -0.31 -0.66 -0.08 0.00 0.71 0.00 0.00 52.55 52.21 2b0f s ASP 58 Cb 0.08 -0.98 0.17 0.00 1.01 0.00 0.00 42.92 43.21 2b0f s ASP 58 CO 0.43 -0.16 0.54 -0.75 0.21 0.00 0.00 175.17 175.44 2b0f s LYS 59 N 1.59 2.92 -0.18 8.23 2.20 -1.26 -0.92 119.74 132.32 2b0f s LYS 59 Ca 0.01 -2.36 -0.02 0.00 -0.36 0.00 0.00 55.97 53.24 2b0f s LYS 59 Cb -0.15 -4.02 -0.01 0.00 -1.51 0.00 0.00 37.83 32.14 2b0f s LYS 59 CO -0.08 -1.22 -0.09 -0.47 -0.36 0.00 0.00 175.35 173.13 2b0f s TYR 60 N 0.29 2.90 -0.61 4.03 5.04 -1.18 -5.02 117.35 122.80 2b0f s TYR 60 Ca 0.15 -0.87 -0.24 0.00 -2.44 0.00 0.00 57.07 53.67 2b0f s TYR 60 Cb -0.18 -2.00 0.05 0.00 0.35 0.00 0.00 41.96 40.19 2b0f s TYR 60 CO -0.05 -0.44 0.99 0.15 -1.34 0.00 0.00 175.55 174.87 2b0f s LYS 61 N 1.03 3.24 -0.22 4.97 3.01 -1.26 -0.10 119.74 130.41 2b0f s LYS 61 Ca -0.00 -0.45 -0.29 0.00 -1.01 0.00 0.00 55.97 54.22 2b0f s LYS 61 Cb -0.15 -4.13 -0.03 0.00 -1.01 0.00 0.00 37.83 32.52 2b0f s LYS 61 CO -0.01 -1.67 1.64 -1.17 0.51 0.00 0.00 175.35 174.65 2b0f s LEU 62 N 4.20 3.88 0.17 3.17 2.96 0.23 -4.92 118.68 128.37 2b0f s LEU 62 Ca 0.28 1.64 0.09 0.00 -0.22 0.00 0.00 54.13 55.92 2b0f s LEU 62 Cb -0.13 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 2b0f s LEU 62 CO 0.16 -1.28 -0.11 0.68 -1.32 0.00 0.00 176.35 174.47 2b0f s VAL 63 N 5.31 3.14 0.28 1.68 -7.23 -1.26 -2.92 120.40 119.39 2b0f s VAL 63 Ca 0.73 -1.61 -0.29 0.00 -1.81 0.00 0.00 61.98 58.99 2b0f s VAL 63 Cb -0.25 -2.53 -0.10 0.00 0.56 0.00 0.00 36.38 34.06 2b0f s VAL 63 CO 0.30 -0.06 1.10 -0.62 -0.31 0.00 0.00 175.10 175.50 2b0f s ASP 64 N -2.68 7.27 0.50 4.85 -1.08 0.90 -4.85 116.67 121.59 2b0f s ASP 64 Ca 0.24 2.27 0.08 0.00 -0.52 0.00 0.00 52.55 54.61 2b0f s ASP 64 Cb -0.09 -2.63 0.44 0.00 -1.46 0.00 0.00 42.92 39.18 2b0f s ASP 64 CO 0.14 -0.14 1.16 -0.65 0.52 0.00 0.00 175.17 176.20 2b0f h PRO 65 N 3.84 0.00 0.00 4.34 0.11 -2.00 1.35 132.00 139.64 2b0f h PRO 65 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2b0f h PRO 65 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2b0f h PRO 65 CO 0.67 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.55 2b0f n GLU 66 N -2.27 0.36 -2.17 1.05 4.07 -1.26 -4.80 120.64 115.61 2b0f n GLU 66 Ca -0.01 0.04 -0.08 0.00 -0.06 0.00 0.00 57.16 57.05 2b0f n GLU 66 Cb 0.69 -1.50 -0.00 0.00 -0.06 0.00 0.00 31.44 30.56 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 -1.07 -2.95 -4.26 4.31 5.15 0.46 -5.04 115.26 111.86 2b0f n ASN 67 Ca 0.09 -0.01 -0.27 0.00 -0.60 0.00 0.00 54.58 53.79 2b0f n ASN 67 Cb 0.06 -2.24 -0.15 0.00 -0.53 0.00 0.00 39.78 36.92 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 -2.42 1.77 0.52 -1.44 1.01 -1.13 -4.96 121.20 114.55 2b0f s ILE 68 Ca 0.00 -1.16 -0.23 0.00 0.00 0.00 0.00 60.65 59.27 2b0f s ILE 68 Cb -0.00 -1.51 -0.06 0.00 0.01 0.00 0.00 42.46 40.90 2b0f s ILE 68 CO 0.01 0.31 1.39 0.59 0.00 0.00 0.00 174.94 177.23 2b0f n ASN 69 N 2.03 2.89 0.00 3.58 4.13 -1.26 -0.07 115.26 126.56 2b0f n ASN 69 Ca -0.17 1.02 0.00 0.00 1.68 0.00 0.00 54.58 57.11 2b0f n ASN 69 Cb 0.53 -1.59 0.00 0.00 -1.54 0.00 0.00 39.78 37.18 2b0f n ASN 69 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2b0f n LEU 70 N -0.78 0.15 0.00 3.41 4.77 -1.19 -2.93 117.00 120.42 2b0f n LEU 70 Ca 0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2b0f n LEU 70 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2b0f n LEU 70 CO 0.55 0.02 0.00 -0.62 -1.33 0.00 0.00 177.39 176.02 2b0f n GLU 71 N -1.58 0.00 -2.85 3.23 -0.58 -1.15 -4.77 120.64 112.94 2b0f n GLU 71 Ca 0.00 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.31 2b0f n GLU 71 Cb 0.34 -1.75 -0.04 0.00 -0.57 0.00 0.00 31.44 29.43 2b0f n GLU 71 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2b0f s LEU 72 N 0.00 4.44 -0.61 -4.62 1.43 -1.17 -1.69 118.68 116.47 2b0f s LEU 72 Ca 0.00 -1.16 -0.28 0.00 -1.03 0.00 0.00 54.13 51.66 2b0f s LEU 72 Cb 0.00 -2.42 0.01 0.00 0.03 0.00 0.00 46.19 43.81 2b0f s LEU 72 CO 0.00 -1.39 1.43 -0.89 0.23 0.00 0.00 176.35 175.73 2b0f s THR 73 N 3.91 3.73 -1.05 5.49 2.01 0.59 0.75 115.64 131.07 2b0f s THR 73 Ca 0.25 0.57 -0.23 0.00 0.31 0.00 0.00 61.69 62.59 2b0f s THR 73 Cb -0.14 -4.49 0.03 0.00 0.01 0.00 0.00 72.50 67.90 2b0f s THR 73 CO 0.07 -1.29 1.61 -0.69 -0.69 0.00 0.00 174.62 173.62 2b0f s VAL 74 N 6.30 3.84 -0.35 3.82 1.01 0.85 -2.01 120.40 133.86 2b0f s VAL 74 Ca 0.50 -0.87 -0.18 0.00 0.00 0.00 0.00 61.98 61.43 2b0f s VAL 74 Cb -0.10 -4.86 -0.00 0.00 0.00 0.00 0.00 36.38 31.42 2b0f s VAL 74 CO 0.22 -1.72 0.51 -0.22 0.00 0.00 0.00 175.10 173.89 2b0f s LEU 75 N 6.12 4.35 -0.42 3.92 2.96 -0.29 -3.09 118.68 132.23 2b0f s LEU 75 Ca 0.53 -0.03 -0.16 0.00 -0.22 0.00 0.00 54.13 54.25 2b0f s LEU 75 Cb -0.01 -2.58 0.02 0.00 0.50 0.00 0.00 46.19 44.13 2b0f s LEU 75 CO -0.04 -0.47 0.37 -0.89 -1.32 0.00 0.00 176.35 174.00 2b0f s THR 76 N 2.38 5.17 0.19 3.68 2.01 -0.09 -0.11 115.64 128.86 2b0f s THR 76 Ca 0.18 -0.51 -0.05 0.00 0.31 0.00 0.00 61.69 61.62 2b0f s THR 76 Cb -0.15 -3.99 -0.06 0.00 0.01 0.00 0.00 72.50 68.31 2b0f s THR 76 CO 0.13 -0.38 0.43 -0.76 -0.69 0.00 0.00 174.62 173.36 2b0f s LEU 77 N 1.92 4.21 -1.08 4.42 2.01 -0.35 0.45 118.68 130.26 2b0f s LEU 77 Ca 0.09 0.63 -0.20 0.00 0.01 0.00 0.00 54.13 54.66 2b0f s LEU 77 Cb -0.18 -3.39 0.08 0.00 0.01 0.00 0.00 46.19 42.72 2b0f s LEU 77 CO 0.12 -0.02 1.44 -0.62 1.01 0.00 0.00 176.35 178.28 2b0f s ASP 78 N -2.65 6.65 0.02 2.29 2.15 -0.96 -4.78 116.67 119.40 2b0f s ASP 78 Ca 0.42 -1.94 0.00 0.00 0.43 0.00 0.00 52.55 51.47 2b0f s ASP 78 Cb -0.12 -2.52 -0.04 0.00 -0.30 0.00 0.00 42.92 39.95 2b0f s ASP 78 CO 0.26 -1.27 0.10 -0.13 -0.17 0.00 0.00 175.17 173.96 2b0f s ARG 79 N 4.01 3.09 -0.25 4.34 1.81 -1.26 -4.83 118.95 125.86 2b0f s ARG 79 Ca 0.45 -0.51 -0.16 0.00 -1.72 0.00 0.00 55.73 53.79 2b0f s ARG 79 Cb -0.00 -2.87 -0.12 0.00 -0.45 0.00 0.00 34.95 31.51 2b0f s ARG 79 CO -0.05 0.63 -0.26 0.09 -0.68 0.00 0.00 175.30 175.03 2b0f n ASN 80 N 0.91 1.94 -4.62 0.23 4.13 -1.26 -4.81 115.26 111.78 2b0f n ASN 80 Ca -0.11 0.36 -0.43 0.00 1.68 0.00 0.00 54.58 56.08 2b0f n ASN 80 Cb 0.52 -0.84 -0.02 0.00 -1.54 0.00 0.00 39.78 37.90 2b0f n ASN 80 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2b0f s GLU 81 N -2.53 3.86 0.86 3.52 0.41 -1.26 -5.00 118.70 118.56 2b0f s GLU 81 Ca -0.35 1.14 -0.10 0.00 -0.41 0.00 0.00 54.97 55.25 2b0f s GLU 81 Cb 0.12 -3.89 0.19 0.00 -1.78 0.00 0.00 34.13 28.76 2b0f s GLU 81 CO 0.49 -1.19 1.17 0.36 -0.49 0.00 0.00 175.26 175.60 2b0f n LYS 82 N 7.44 -0.83 -3.92 1.61 2.85 -1.26 -4.97 118.16 119.07 2b0f n LYS 82 Ca 0.15 -2.23 -0.21 0.00 -1.05 0.00 0.00 58.31 54.96 2b0f n LYS 82 Cb 0.47 -1.08 -0.04 0.00 -0.65 0.00 0.00 35.03 33.73 2b0f n LYS 82 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2b0f s PHE 83 N -3.52 2.95 -0.13 5.58 0.08 -0.16 -5.03 117.98 117.74 2b0f s PHE 83 Ca 0.70 -0.25 -0.29 0.00 0.12 0.00 0.00 56.93 57.21 2b0f s PHE 83 Cb -0.03 -1.67 -0.04 0.00 -0.57 0.00 0.00 43.02 40.71 2b0f s PHE 83 CO 0.48 0.29 1.70 0.50 -0.10 0.00 0.00 175.22 178.09 2b0f s ARG 84 N -3.94 3.93 -0.82 0.44 3.52 -1.26 -4.21 118.95 116.61 2b0f s ARG 84 Ca 0.38 1.97 -0.25 0.00 -0.13 0.00 0.00 55.73 57.70 2b0f s ARG 84 Cb -0.06 -4.05 -0.07 0.00 -1.56 0.00 0.00 34.95 29.21 2b0f s ARG 84 CO 0.26 -1.14 2.11 -0.51 -0.81 0.00 0.00 175.30 175.20 2b0f s ASP 85 N 4.16 4.72 -0.12 -2.12 1.01 -1.26 -4.65 116.67 118.41 2b0f s ASP 85 Ca 0.75 -0.25 0.07 0.00 0.71 0.00 0.00 52.55 53.83 2b0f s ASP 85 Cb -0.30 -2.55 0.42 0.00 1.01 0.00 0.00 42.92 41.50 2b0f s ASP 85 CO 0.30 -3.07 1.14 2.30 0.21 0.00 0.00 175.17 176.05 2b0f n ILE 86 N 8.11 1.42 0.31 0.77 -5.35 0.22 -4.30 119.36 120.54 2b0f n ILE 86 Ca 0.40 -0.72 0.19 0.00 -0.27 0.00 0.00 62.75 62.35 2b0f n ILE 86 Cb 0.47 -0.39 1.00 0.00 -1.74 0.00 0.00 39.64 38.98 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 2.05 0.00 0.00 6.28 0.11 -1.85 -1.07 114.38 119.90 2b0f h ARG 87 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2b0f h ARG 87 Cb 1.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.34 2b0f h ARG 87 CO 0.25 0.02 -0.04 0.78 0.10 0.00 0.00 179.97 181.09 2b0f h GLY 88 N 0.55 0.00 0.12 0.08 0.00 -1.93 -3.07 103.07 98.81 2b0f h GLY 88 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2b0f h GLY 88 CO 0.00 0.00 -0.08 0.69 0.00 0.00 0.00 176.54 177.15 2b0f n PHE 89 N -2.83 0.00 -2.92 5.60 3.72 -0.41 -4.77 117.46 115.85 2b0f n PHE 89 Ca 0.04 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.03 2b0f n PHE 89 Cb 0.50 -0.06 -0.04 0.00 -0.94 0.00 0.00 39.48 38.94 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 -2.20 4.93 -0.07 4.37 1.01 -1.16 -1.07 121.20 127.01 2b0f s ILE 90 Ca 0.34 1.60 -0.25 0.00 0.00 0.00 0.00 60.65 62.35 2b0f s ILE 90 Cb 0.21 -4.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.52 2b0f s ILE 90 CO 0.41 0.10 0.77 -0.44 0.00 0.00 0.00 174.94 175.77 2b0f s SER 91 N 1.06 7.05 0.01 3.58 0.01 -1.19 -4.47 113.70 119.75 2b0f s SER 91 Ca 0.39 1.27 -0.25 0.00 1.31 0.00 0.00 55.95 58.67 2b0f s SER 91 Cb -0.17 -2.45 -0.16 0.00 0.21 0.00 0.00 66.02 63.45 2b0f s SER 91 CO 0.15 -0.18 1.20 -0.08 0.41 0.00 0.00 173.24 174.74 2b0f h GLU 92 N 6.85 -0.53 -5.51 12.44 4.22 -1.90 -2.08 114.58 128.08 2b0f h GLU 92 Ca -0.39 0.04 -0.61 0.00 0.08 0.00 0.00 59.36 58.47 2b0f h GLU 92 Cb 1.19 0.12 -0.10 0.00 0.50 0.00 0.00 28.75 30.47 2b0f h GLU 92 CO 0.76 -0.22 -0.39 0.34 -2.18 0.00 0.00 179.01 177.33 2b0f s ASP 93 N -4.92 6.40 0.00 1.04 2.15 -1.26 -4.25 116.67 115.83 2b0f s ASP 93 Ca -0.14 0.47 0.00 0.00 0.43 0.00 0.00 52.55 53.31 2b0f s ASP 93 Cb 0.02 -2.14 0.00 0.00 -0.30 0.00 0.00 42.92 40.50 2b0f s ASP 93 CO 0.51 0.20 0.99 0.18 -0.17 0.00 0.00 175.17 176.89 2b0f n LEU 94 N 3.07 0.00 -3.38 -1.34 4.77 -1.26 -4.93 117.00 113.93 2b0f n LEU 94 Ca -0.15 0.99 -0.13 0.00 -0.03 0.00 0.00 56.01 56.69 2b0f n LEU 94 Cb 0.53 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2b0f n LEU 94 CO 0.37 -0.49 0.04 1.21 -1.33 0.00 0.00 177.39 177.19 2b0f n GLU 95 N -2.19 -1.52 0.00 3.23 4.07 -1.26 -4.96 120.64 118.01 2b0f n GLU 95 Ca 0.00 1.23 0.00 0.00 -0.06 0.00 0.00 57.16 58.33 2b0f n GLU 95 Cb 0.00 -4.08 0.00 0.00 -0.06 0.00 0.00 31.44 27.30 2b0f n GLU 95 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2b0f n GLY 96 N -1.53 -1.66 0.00 8.31 0.00 -1.26 -5.01 105.19 104.04 2b0f n GLY 96 Ca -0.13 0.99 0.16 0.00 0.00 0.00 0.00 46.02 47.03 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 0.00 0.00 -3.89 1.61 3.14 -1.26 -4.52 118.33 113.41 2b0f n VAL 97 Ca 0.00 0.00 -0.28 0.00 -2.96 0.00 0.00 64.34 61.10 2b0f n VAL 97 Cb 0.00 -0.51 -0.16 0.00 -1.06 0.00 0.00 33.84 32.11 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 -2.09 2.92 0.26 6.55 2.15 -1.23 -0.24 116.67 124.98 2b0f s ASP 98 Ca 0.44 -0.71 0.05 0.00 0.43 0.00 0.00 52.55 52.77 2b0f s ASP 98 Cb 0.21 -0.93 -0.06 0.00 -0.30 0.00 0.00 42.92 41.85 2b0f s ASP 98 CO 0.38 -0.19 -0.03 0.00 -0.17 0.00 0.00 175.17 175.15 2b0f s ALA 99 N 1.62 2.12 -0.02 3.66 0.00 -0.82 -4.91 121.76 123.41 2b0f s ALA 99 Ca 0.00 -1.84 0.08 0.00 0.00 0.00 0.00 51.96 50.19 2b0f s ALA 99 Cb -0.16 0.31 -0.02 0.00 0.00 0.00 0.00 23.12 23.26 2b0f s ALA 99 CO -0.08 -0.15 -0.24 0.99 0.00 0.00 0.00 175.76 176.28 2b0f s THR 100 N -3.19 2.21 -0.19 0.00 2.01 0.12 -2.12 115.64 114.48 2b0f s THR 100 Ca 0.29 -1.09 -0.04 0.00 0.31 0.00 0.00 61.69 61.16 2b0f s THR 100 Cb 0.05 -1.79 -0.02 0.00 0.01 0.00 0.00 72.50 70.75 2b0f s THR 100 CO 0.10 0.56 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.34 2b0f s LEU 101 N -0.70 3.13 -0.26 4.42 2.96 0.81 -0.37 118.68 128.66 2b0f s LEU 101 Ca 0.10 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 53.78 2b0f s LEU 101 Cb -0.10 -1.78 0.05 0.00 0.50 0.00 0.00 46.19 44.86 2b0f s LEU 101 CO -0.00 0.07 -0.09 0.54 -1.32 0.00 0.00 176.35 175.54 2b0f s VAL 102 N 0.96 2.40 -0.12 1.68 0.11 -0.10 -0.86 120.40 124.47 2b0f s VAL 102 Ca 0.01 -1.47 -0.05 0.00 -2.93 0.00 0.00 61.98 57.54 2b0f s VAL 102 Cb -0.14 -2.35 -0.04 0.00 -1.53 0.00 0.00 36.38 32.32 2b0f s VAL 102 CO 0.01 0.03 0.07 -0.69 -3.33 0.00 0.00 175.10 171.19 2b0f s VAL 103 N 1.17 4.88 -0.28 2.04 1.01 0.07 -0.55 120.40 128.74 2b0f s VAL 103 Ca -0.06 -0.02 0.19 0.00 0.00 0.00 0.00 61.98 62.09 2b0f s VAL 103 Cb -0.19 -3.12 0.49 0.00 0.00 0.00 0.00 36.38 33.56 2b0f s VAL 103 CO -0.05 0.58 1.09 1.57 0.00 0.00 0.00 175.10 178.30 2b0f n HIS 104 N 2.37 1.53 -3.57 5.22 -0.00 -1.14 -0.18 115.22 119.46 2b0f n HIS 104 Ca -0.19 -2.30 -0.17 0.00 0.46 0.00 0.00 57.72 55.53 2b0f n HIS 104 Cb 0.54 -0.27 0.01 0.00 -0.12 0.00 0.00 29.99 30.16 2b0f n HIS 104 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2b0f n SER 105 N -0.52 1.99 -0.22 0.26 7.64 -0.62 -3.54 113.62 118.61 2b0f n SER 105 Ca 0.14 -2.22 -0.10 0.00 1.01 0.00 0.00 58.87 57.70 2b0f n SER 105 Cb 0.82 -0.10 -0.06 0.00 -1.01 0.00 0.00 64.21 63.87 2b0f n SER 105 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 2b0f h ASN 106 N 0.35 -1.69 0.05 6.43 -0.00 -1.21 -2.90 115.58 116.61 2b0f h ASN 106 Ca -0.22 0.26 -0.07 0.00 -0.00 0.00 0.00 56.30 56.27 2b0f h ASN 106 Cb 0.86 0.75 0.01 0.00 -0.00 0.00 0.00 38.32 39.93 2b0f h ASN 106 CO 0.34 -0.34 -0.30 -1.13 -0.00 0.00 0.00 177.43 176.00 2b0f h ASN 107 N -0.24 0.18 -3.64 1.15 -1.24 -1.71 -3.41 115.58 106.67 2b0f h ASN 107 Ca 0.15 -0.98 -0.72 0.00 0.71 0.00 0.00 56.30 55.47 2b0f h ASN 107 Cb 0.55 -0.06 -0.32 0.00 0.73 0.00 0.00 38.32 39.23 2b0f h ASN 107 CO -0.71 1.14 -0.36 -0.36 -1.29 0.00 0.00 177.43 175.85 2b0f s PHE 108 N -2.33 3.49 -0.51 0.67 0.08 -1.19 -5.03 117.98 113.16 2b0f s PHE 108 Ca -0.17 -2.25 -0.17 0.00 0.12 0.00 0.00 56.93 54.47 2b0f s PHE 108 Cb -0.01 -3.39 0.08 0.00 -0.57 0.00 0.00 43.02 39.13 2b0f s PHE 108 CO 0.74 -0.95 0.51 0.99 -0.10 0.00 0.00 175.22 176.41 2b0f s THR 109 N 0.76 5.10 -0.22 0.64 2.01 -1.10 -1.59 115.64 121.24 2b0f s THR 109 Ca 0.11 -1.02 -0.01 0.00 0.31 0.00 0.00 61.69 61.08 2b0f s THR 109 Cb -0.22 -4.25 0.00 0.00 0.01 0.00 0.00 72.50 68.04 2b0f s THR 109 CO -0.03 -0.75 0.23 -3.20 -0.69 0.00 0.00 174.62 170.17 2b0f n ASN 110 N 5.56 -3.94 -3.72 3.53 5.15 0.75 -4.94 115.26 117.66 2b0f n ASN 110 Ca -0.11 0.02 -0.17 0.00 -0.60 0.00 0.00 54.58 53.72 2b0f n ASN 110 Cb 0.43 -2.44 -0.17 0.00 -0.53 0.00 0.00 39.78 37.07 2b0f n ASN 110 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2b0f s THR 111 N -2.68 -0.09 -0.17 -0.44 2.01 -0.47 -4.99 115.64 108.82 2b0f s THR 111 Ca 0.02 0.32 -0.02 0.00 0.31 0.00 0.00 61.69 62.32 2b0f s THR 111 Cb -0.01 -0.12 -0.01 0.00 0.01 0.00 0.00 72.50 72.37 2b0f s THR 111 CO 0.25 0.13 -0.09 -0.51 -0.69 0.00 0.00 174.62 173.71 2b0f s ILE 112 N 1.62 3.21 -0.06 1.82 2.07 -1.26 -0.75 121.20 127.84 2b0f s ILE 112 Ca -0.02 -0.58 -0.03 0.00 -1.41 0.00 0.00 60.65 58.61 2b0f s ILE 112 Cb -0.12 -2.39 0.04 0.00 0.13 0.00 0.00 42.46 40.11 2b0f s ILE 112 CO -0.03 0.49 0.13 -0.22 -1.91 0.00 0.00 174.94 173.40 2b0f s LEU 113 N 0.77 0.59 -0.53 8.50 0.20 -0.04 -4.99 118.68 123.18 2b0f s LEU 113 Ca -0.04 0.27 -0.28 0.00 0.69 0.00 0.00 54.13 54.77 2b0f s LEU 113 Cb -0.15 0.28 0.03 0.00 -0.43 0.00 0.00 46.19 45.92 2b0f s LEU 113 CO 0.01 -0.17 1.13 -1.83 -0.29 0.00 0.00 176.35 175.20 2b0f s GLU 114 N 1.40 3.58 0.21 1.98 -1.05 -1.26 -0.14 118.70 123.42 2b0f s GLU 114 Ca -0.06 0.32 0.03 0.00 -0.15 0.00 0.00 54.97 55.11 2b0f s GLU 114 Cb -0.12 -3.97 0.15 0.00 -0.44 0.00 0.00 34.13 29.75 2b0f s GLU 114 CO -0.06 -1.51 1.49 -0.39 0.95 0.00 0.00 175.26 175.75 2b0f h VAL 115 N 6.17 1.41 0.00 1.83 -1.51 -1.77 -3.48 116.25 118.90 2b0f h VAL 115 Ca -0.24 -2.16 0.00 0.00 -1.23 0.00 0.00 66.70 63.06 2b0f h VAL 115 Cb 1.06 2.13 0.00 0.00 -2.13 0.00 0.00 31.29 32.35 2b0f h VAL 115 CO 1.14 0.64 0.00 0.61 -1.23 0.00 0.00 177.57 178.73 2b0f n GLY 116 N 0.47 1.31 3.56 5.19 0.00 -0.93 -4.69 105.19 110.10 2b0f n GLY 116 Ca -0.03 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 2b0f n GLY 116 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2b0f n PRO 117 N 3.38 1.54 -3.41 1.61 -0.04 -1.21 -1.94 135.00 134.92 2b0f n PRO 117 Ca 0.00 0.35 -0.39 0.00 -0.04 0.00 0.00 63.50 63.41 2b0f n PRO 117 Cb 0.00 -3.13 -0.09 0.00 -0.04 0.00 0.00 33.50 30.24 2b0f n PRO 117 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2b0f s VAL 118 N 9.19 5.19 0.00 0.52 1.01 0.67 -2.25 120.40 134.72 2b0f s VAL 118 Ca 1.03 0.41 0.01 0.00 0.00 0.00 0.00 61.98 63.43 2b0f s VAL 118 Cb -0.40 -3.71 -0.00 0.00 0.00 0.00 0.00 36.38 32.27 2b0f s VAL 118 CO 0.35 0.11 -0.03 -0.89 0.00 0.00 0.00 175.10 174.64 2b0f s THR 119 N 2.03 0.26 -0.01 3.92 2.01 0.16 -4.64 115.64 119.36 2b0f s THR 119 Ca 0.13 -0.24 -0.28 0.00 0.31 0.00 0.00 61.69 61.62 2b0f s THR 119 Cb -0.16 -0.24 -0.03 0.00 0.01 0.00 0.00 72.50 72.08 2b0f s THR 119 CO 0.11 0.01 0.90 -0.04 -0.69 0.00 0.00 174.62 174.90 2b0f s MET 120 N -0.25 4.53 0.09 4.92 -1.94 -1.26 0.43 119.30 125.81 2b0f s MET 120 Ca -0.01 1.26 0.22 0.00 -1.71 0.00 0.00 55.69 55.46 2b0f s MET 120 Cb -0.02 -3.45 -0.09 0.00 2.01 0.00 0.00 34.83 33.27 2b0f s MET 120 CO -0.00 -0.01 0.86 0.00 -0.01 0.00 0.00 175.02 175.87 2b0f n ALA 121 N 3.82 2.88 0.00 3.03 0.00 -0.33 -4.88 120.51 125.02 2b0f n ALA 121 Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2b0f n ALA 121 Cb 0.51 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.00 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 1.26 0.34 3.53 0.00 0.00 -1.24 -4.71 105.19 104.37 2b0f n GLY 122 Ca -0.01 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 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 4.49 0.00 0.99 1.98 -1.26 -1.28 118.68 123.60 2b0f s LEU 123 Ca 0.00 -0.24 0.03 0.00 -2.89 0.00 0.00 54.13 51.03 2b0f s LEU 123 Cb 0.00 -2.60 -0.01 0.00 0.66 0.00 0.00 46.19 44.23 2b0f s LEU 123 CO 0.00 -0.60 0.11 2.30 -1.89 0.00 0.00 176.35 176.27 2b0f n ILE 124 N 5.58 0.00 -3.68 6.68 -5.35 -0.41 -4.96 119.36 117.23 2b0f n ILE 124 Ca -0.04 -1.20 -0.39 0.00 -0.27 0.00 0.00 62.75 60.85 2b0f n ILE 124 Cb 0.48 0.52 -0.11 0.00 -1.74 0.00 0.00 39.64 38.80 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 -2.20 5.48 -0.44 7.28 0.02 -1.26 0.12 114.94 123.94 2b0f s ASN 125 Ca 0.16 -1.41 -0.27 0.00 -1.02 0.00 0.00 52.86 50.32 2b0f s ASN 125 Cb 0.01 -1.93 0.03 0.00 0.02 0.00 0.00 41.25 39.37 2b0f s ASN 125 CO 0.11 -0.46 1.02 -0.22 0.02 0.00 0.00 177.10 177.57 2b0f s LEU 126 N 1.39 3.85 -1.46 0.60 2.96 0.98 -3.64 118.68 123.37 2b0f s LEU 126 Ca 0.02 0.40 -0.09 0.00 -0.22 0.00 0.00 54.13 54.24 2b0f s LEU 126 Cb -0.22 -3.37 0.04 0.00 0.50 0.00 0.00 46.19 43.14 2b0f s LEU 126 CO 0.02 -1.09 0.79 -1.54 -1.32 0.00 0.00 176.35 173.21 2b0f n SER 127 N 7.35 -5.45 -0.02 3.68 3.41 -1.26 -1.16 113.62 120.17 2b0f n SER 127 Ca 0.09 -0.47 -0.00 0.00 -0.26 0.00 0.00 58.87 58.23 2b0f n SER 127 Cb 0.49 -4.38 -0.00 0.00 -0.26 0.00 0.00 64.21 60.06 2b0f n SER 127 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2b0f n SER 128 N -2.65 -3.34 -4.15 4.04 7.64 -1.24 -5.02 113.62 108.90 2b0f n SER 128 Ca -0.03 0.01 -0.33 0.00 1.01 0.00 0.00 58.87 59.52 2b0f n SER 128 Cb 0.57 -0.86 -0.15 0.00 -1.01 0.00 0.00 64.21 62.76 2b0f n SER 128 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2b0f s THR 129 N -1.91 2.37 -0.18 0.44 2.01 -0.31 -4.99 115.64 113.07 2b0f s THR 129 Ca 0.00 -0.97 -0.34 0.00 0.31 0.00 0.00 61.69 60.69 2b0f s THR 129 Cb 0.00 -2.09 -0.11 0.00 0.01 0.00 0.00 72.50 70.31 2b0f s THR 129 CO 0.00 0.41 1.98 -2.65 -0.69 0.00 0.00 174.62 173.67 2b0f n PRO 130 N 4.63 1.81 -4.59 4.92 -0.02 -1.26 -0.01 135.00 140.48 2b0f n PRO 130 Ca -0.19 0.62 -0.25 0.00 -2.02 0.00 0.00 63.50 61.66 2b0f n PRO 130 Cb 0.49 -2.62 -0.14 0.00 -0.02 0.00 0.00 33.50 31.21 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 5.27 1.63 0.31 3.45 -4.23 0.12 -4.14 115.64 118.05 2b0f s THR 131 Ca 0.98 -1.21 0.09 0.00 -1.18 0.00 0.00 61.69 60.36 2b0f s THR 131 Cb -0.72 -1.43 -0.04 0.00 1.34 0.00 0.00 72.50 71.65 2b0f s THR 131 CO 0.51 0.17 0.07 0.54 -0.54 0.00 0.00 174.62 175.36 2b0f s ASN 132 N -1.24 4.54 -1.36 3.99 4.22 -1.15 -1.28 114.94 122.66 2b0f s ASN 132 Ca 0.07 -0.77 -0.08 0.00 -2.14 0.00 0.00 52.86 49.94 2b0f s ASN 132 Cb -0.09 -0.74 0.02 0.00 1.28 0.00 0.00 41.25 41.72 2b0f s ASN 132 CO 0.02 -0.18 1.12 0.54 -2.04 0.00 0.00 177.10 176.56 2b0f n ARG 133 N -1.02 -7.38 -2.58 3.55 1.74 -0.40 -4.84 116.66 105.72 2b0f n ARG 133 Ca -0.04 0.80 -0.42 0.00 -0.77 0.00 0.00 57.85 57.41 2b0f n ARG 133 Cb 0.61 -5.81 -0.03 0.00 -1.02 0.00 0.00 32.46 26.20 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 -6.20 4.45 -0.23 5.56 -1.94 -1.01 -3.11 119.30 116.82 2b0f s MET 134 Ca 0.49 1.55 -0.22 0.00 -1.71 0.00 0.00 55.69 55.80 2b0f s MET 134 Cb -0.22 -3.48 -0.01 0.00 2.01 0.00 0.00 34.83 33.13 2b0f s MET 134 CO 0.75 -0.25 0.72 0.42 -0.01 0.00 0.00 175.02 176.65 2b0f s ILE 135 N 1.52 4.93 -0.22 2.53 -1.09 0.33 -1.19 121.20 128.01 2b0f s ILE 135 Ca 0.54 1.35 -0.07 0.00 -2.23 0.00 0.00 60.65 60.23 2b0f s ILE 135 Cb -0.23 -4.02 -0.04 0.00 -1.58 0.00 0.00 42.46 36.59 2b0f s ILE 135 CO 0.25 0.00 0.07 -0.60 -1.23 0.00 0.00 174.94 173.43 2b0f s ARG 136 N 2.51 3.81 -0.23 2.79 3.52 0.17 -0.57 118.95 130.95 2b0f s ARG 136 Ca 0.31 -0.41 -0.00 0.00 -0.13 0.00 0.00 55.73 55.49 2b0f s ARG 136 Cb -0.16 -3.28 0.03 0.00 -1.56 0.00 0.00 34.95 29.98 2b0f s ARG 136 CO 0.09 0.03 -0.11 1.52 -0.81 0.00 0.00 175.30 176.02 2b0f s TYR 137 N 1.04 3.02 -0.91 5.12 1.13 -0.56 0.40 117.35 126.59 2b0f s TYR 137 Ca 0.04 -1.68 -0.24 0.00 -1.41 0.00 0.00 57.07 53.77 2b0f s TYR 137 Cb -0.14 -2.00 -0.03 0.00 -1.10 0.00 0.00 41.96 38.69 2b0f s TYR 137 CO 0.03 -0.77 1.86 0.34 -2.51 0.00 0.00 175.55 174.50 2b0f s ASP 138 N 1.28 5.38 -0.29 -0.18 -1.08 -0.96 -0.49 116.67 120.35 2b0f s ASP 138 Ca 0.00 -0.77 -0.18 0.00 -0.52 0.00 0.00 52.55 51.08 2b0f s ASP 138 Cb -0.16 -2.56 0.13 0.00 -1.46 0.00 0.00 42.92 38.86 2b0f s ASP 138 CO -0.07 -2.52 0.92 -0.47 0.52 0.00 0.00 175.17 173.56 2b0f s TYR 139 N 9.16 -0.66 -0.59 -5.34 5.04 -0.42 -4.72 117.35 119.82 2b0f s TYR 139 Ca 0.66 1.37 -0.26 0.00 -2.44 0.00 0.00 57.07 56.39 2b0f s TYR 139 Cb -0.06 0.40 -0.04 0.00 0.35 0.00 0.00 41.96 42.61 2b0f s TYR 139 CO -0.01 -0.32 2.06 0.00 -1.34 0.00 0.00 175.55 175.93 2b0f s ALA 140 N 1.17 1.93 -0.08 3.97 0.00 -1.18 -2.61 121.76 124.96 2b0f s ALA 140 Ca -0.07 -0.46 0.04 0.00 0.00 0.00 0.00 51.96 51.47 2b0f s ALA 140 Cb -0.04 -4.34 -0.00 0.00 0.00 0.00 0.00 23.12 18.74 2b0f s ALA 140 CO -0.14 -4.18 -0.22 0.99 0.00 0.00 0.00 175.76 172.22 2b0f s THR 141 N 10.33 1.84 0.50 0.00 2.01 -1.25 -4.98 115.64 124.09 2b0f s THR 141 Ca 0.78 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.89 2b0f s THR 141 Cb -0.14 -1.59 -0.01 0.00 0.01 0.00 0.00 72.50 70.78 2b0f s THR 141 CO 0.21 0.51 0.03 -0.54 -0.69 0.00 0.00 174.62 174.15 2b0f s LYS 142 N 0.25 2.17 0.50 4.92 1.02 -1.26 -4.62 119.74 122.72 2b0f s LYS 142 Ca -0.13 -2.39 -0.17 0.00 0.02 0.00 0.00 55.97 53.30 2b0f s LYS 142 Cb -0.16 -1.31 -0.14 0.00 -0.52 0.00 0.00 37.83 35.70 2b0f s LYS 142 CO 0.06 -0.42 -0.16 2.41 -0.92 0.00 0.00 175.35 176.32 2b0f n THR 143 N -1.22 0.00 0.00 2.17 -1.04 -1.26 -2.53 114.28 110.41 2b0f n THR 143 Ca -0.18 -0.47 0.00 0.00 -2.04 0.00 0.00 64.05 61.37 2b0f n THR 143 Cb 0.66 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.17 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 2.41 3.27 1.07 3.41 0.00 -1.26 -4.82 105.19 109.26 2b0f n GLY 144 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.96 2.43 -2.68 1.61 3.00 -1.05 -1.89 117.38 116.83 2b0f n GLN 145 Ca 0.00 -2.23 -0.39 0.00 -0.01 0.00 0.00 57.00 54.37 2b0f n GLN 145 Cb 0.00 -1.47 -0.06 0.00 0.00 0.00 0.00 30.24 28.71 2b0f n GLN 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2b0f n GLY 147 N 1.22 2.33 3.66 0.00 0.00 0.31 -4.67 105.19 108.05 2b0f n GLY 147 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.30 -0.01 3.66 -0.02 0.00 -1.20 -4.27 105.19 103.05 2b0f n GLY 148 Ca 0.00 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.52 5.23 -0.45 1.61 1.01 0.28 0.88 120.40 127.45 2b0f s VAL 149 Ca 0.79 0.55 -0.20 0.00 0.00 0.00 0.00 61.98 63.12 2b0f s VAL 149 Cb -0.39 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.35 2b0f s VAL 149 CO 0.44 0.26 0.60 -0.22 0.00 0.00 0.00 175.10 176.18 2b0f s LEU 150 N 1.40 4.68 0.00 3.92 2.96 0.81 -0.93 118.68 131.52 2b0f s LEU 150 Ca 0.15 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 2b0f s LEU 150 Cb -0.15 -2.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.95 2b0f s LEU 150 CO 0.08 -0.77 0.36 0.00 -1.32 0.00 0.00 176.35 174.70 2b0f s ALA 152 N -2.90 0.71 -0.10 0.00 0.00 0.11 0.14 121.76 119.72 2b0f s ALA 152 Ca 0.30 -1.50 -0.29 0.00 0.00 0.00 0.00 51.96 50.47 2b0f s ALA 152 Cb 0.00 1.10 -0.05 0.00 0.00 0.00 0.00 23.12 24.17 2b0f s ALA 152 CO 0.22 -0.81 1.80 -0.08 0.00 0.00 0.00 175.76 176.88 2b0f s THR 153 N -2.82 3.40 -1.00 0.00 -1.32 -1.26 -2.16 115.64 110.47 2b0f s THR 153 Ca 0.29 0.47 0.00 0.00 -1.21 0.00 0.00 61.69 61.24 2b0f s THR 153 Cb -0.01 -3.36 0.00 0.00 -1.51 0.00 0.00 72.50 67.62 2b0f s THR 153 CO 0.21 -0.11 0.00 0.61 -2.21 0.00 0.00 174.62 173.12 2b0f n GLY 154 N 4.60 1.10 3.60 6.08 0.00 -1.26 -5.00 105.19 114.32 2b0f n GLY 154 Ca 0.20 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.51 2b0f n GLY 154 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b0f s LYS 155 N -2.76 0.80 -0.09 1.61 -2.85 -0.92 -4.79 119.74 110.74 2b0f s LYS 155 Ca 0.00 0.99 0.01 0.00 -1.00 0.00 0.00 55.97 55.98 2b0f s LYS 155 Cb 0.00 0.37 -0.02 0.00 -2.06 0.00 0.00 37.83 36.11 2b0f s LYS 155 CO 0.00 -0.10 -0.12 0.42 0.10 0.00 0.00 175.35 175.64 2b0f s ILE 156 N 0.50 3.18 -0.19 3.79 1.01 -0.23 0.06 121.20 129.32 2b0f s ILE 156 Ca -0.01 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 60.01 2b0f s ILE 156 Cb -0.05 -2.29 -0.13 0.00 0.01 0.00 0.00 42.46 40.00 2b0f s ILE 156 CO -0.01 0.56 -0.16 0.49 0.00 0.00 0.00 174.94 175.82 2b0f n PHE 157 N 2.81 0.00 -2.89 3.97 3.72 -0.11 -3.15 117.46 121.82 2b0f n PHE 157 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 2b0f n PHE 157 Cb 0.52 -0.75 0.00 0.00 -0.94 0.00 0.00 39.48 38.32 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 2.55 -1.31 3.21 1.37 0.00 -1.05 -0.08 105.19 109.89 2b0f n GLY 158 Ca -0.34 -0.93 -0.25 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 -2.89 1.53 -0.17 -0.61 -4.36 -1.14 -0.13 121.20 113.43 2b0f s ILE 159 Ca 0.00 -1.01 -0.29 0.00 -0.26 0.00 0.00 60.65 59.10 2b0f s ILE 159 Cb 0.00 -1.31 -0.05 0.00 1.25 0.00 0.00 42.46 42.34 2b0f s ILE 159 CO 0.00 0.28 2.07 -2.28 0.24 0.00 0.00 174.94 175.25 2b0f s HIS 160 N -0.65 1.33 -0.09 1.37 5.65 0.25 -2.07 115.29 121.09 2b0f s HIS 160 Ca 0.07 0.32 0.15 0.00 0.25 0.00 0.00 55.06 55.85 2b0f s HIS 160 Cb -0.08 -4.02 -0.22 0.00 -1.18 0.00 0.00 32.58 27.07 2b0f s HIS 160 CO 0.01 -4.22 0.20 1.33 -0.65 0.00 0.00 174.74 171.40 2b0f n VAL 161 N 7.11 0.54 -1.02 0.89 0.24 -0.81 0.11 118.33 125.39 2b0f n VAL 161 Ca 0.26 -0.52 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 2b0f n VAL 161 Cb 0.44 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.57 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 1.82 1.66 0.00 7.63 0.00 0.24 -4.83 105.19 111.71 2b0f n GLY 162 Ca -0.14 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 0.99 2.61 -0.02 0.00 -1.26 -0.68 105.19 106.84 2b0f n GLY 163 Ca 0.00 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.95 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 3.73 1.97 1.61 2.47 0.27 -4.82 114.94 120.17 2b0f s ASN 164 Ca 0.00 -1.43 0.00 0.00 0.42 0.00 0.00 52.86 51.85 2b0f s ASN 164 Cb 0.00 -0.55 0.00 0.00 -1.45 0.00 0.00 41.25 39.25 2b0f s ASN 164 CO 0.00 -0.43 0.00 0.61 -3.72 0.00 0.00 177.10 173.56 2b0f n GLY 165 N 5.09 1.32 1.36 1.21 0.00 -1.26 -1.55 105.19 111.36 2b0f n GLY 165 Ca -0.04 0.39 0.05 0.00 0.00 0.00 0.00 46.02 46.41 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 0.04 3.40 -4.08 1.61 1.74 -1.26 -3.84 116.66 114.27 2b0f n ARG 166 Ca 0.00 -2.02 -0.20 0.00 -0.77 0.00 0.00 57.85 54.86 2b0f n ARG 166 Cb 0.00 -1.94 -0.16 0.00 -1.02 0.00 0.00 32.46 29.34 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 -2.07 0.71 0.14 5.56 -0.21 -0.59 -1.30 119.66 121.90 2b0f s GLN 167 Ca 0.35 -0.05 -0.13 0.00 0.02 0.00 0.00 55.36 55.55 2b0f s GLN 167 Cb 0.26 -0.79 -0.07 0.00 1.00 0.00 0.00 33.01 33.41 2b0f s GLN 167 CO 0.12 -0.12 0.52 0.20 -2.12 0.00 0.00 175.29 173.89 2b0f s GLY 168 N 1.05 2.43 -0.09 3.09 0.00 0.36 0.95 107.32 115.11 2b0f s GLY 168 Ca -0.09 -0.19 0.02 0.00 0.00 0.00 0.00 44.72 44.46 2b0f s GLY 168 CO -0.01 0.07 -0.13 -1.36 0.00 0.00 0.00 173.10 171.67 2b0f s PHE 169 N -1.47 1.70 0.35 1.90 0.08 0.14 -1.50 117.98 119.18 2b0f s PHE 169 Ca 0.37 -0.73 0.05 0.00 0.12 0.00 0.00 56.93 56.75 2b0f s PHE 169 Cb -0.15 -1.25 -0.07 0.00 -0.57 0.00 0.00 43.02 40.99 2b0f s PHE 169 CO 0.19 -0.39 0.03 -1.54 -0.10 0.00 0.00 175.22 173.41 2b0f s SER 170 N 0.91 2.96 -0.08 1.36 1.04 0.27 -0.59 113.70 119.57 2b0f s SER 170 Ca -0.09 -1.36 -0.01 0.00 0.48 0.00 0.00 55.95 54.97 2b0f s SER 170 Cb -0.15 -0.21 -0.03 0.00 0.10 0.00 0.00 66.02 65.73 2b0f s SER 170 CO 0.00 -0.53 -0.02 0.00 0.98 0.00 0.00 173.24 173.68 2b0f s ALA 171 N -3.06 3.21 -0.14 5.32 0.00 -0.88 0.12 121.76 126.33 2b0f s ALA 171 Ca 0.36 -0.83 -0.29 0.00 0.00 0.00 0.00 51.96 51.19 2b0f s ALA 171 Cb 0.09 -1.41 -0.03 0.00 0.00 0.00 0.00 23.12 21.77 2b0f s ALA 171 CO 0.16 0.59 1.52 1.14 0.00 0.00 0.00 175.76 179.17 2b0f s GLN 172 N -0.89 4.09 -1.13 0.00 -2.07 -1.18 -2.89 119.66 115.58 2b0f s GLN 172 Ca 0.13 1.87 -0.08 0.00 -1.82 0.00 0.00 55.36 55.46 2b0f s GLN 172 Cb -0.11 -3.93 0.27 0.00 -1.09 0.00 0.00 33.01 28.14 2b0f s GLN 172 CO 0.02 -0.93 1.35 1.28 -1.32 0.00 0.00 175.29 175.69 2b0f n LEU 173 N 7.35 5.89 -4.79 2.60 4.32 0.89 -4.94 117.00 128.31 2b0f n LEU 173 Ca 0.17 -4.99 -0.38 0.00 -0.02 0.00 0.00 56.01 50.78 2b0f n LEU 173 Cb 0.44 -1.43 -0.06 0.00 -1.62 0.00 0.00 43.42 40.75 2b0f n LEU 173 CO 0.61 1.39 0.50 -0.54 -1.22 0.00 0.00 177.39 178.13 2b0f s LYS 174 N -1.29 4.49 0.63 3.23 1.02 -1.26 -4.52 119.74 122.03 2b0f s LYS 174 Ca 0.33 1.11 0.27 0.00 0.02 0.00 0.00 55.97 57.70 2b0f s LYS 174 Cb -0.03 -3.07 1.39 0.00 -0.52 0.00 0.00 37.83 35.60 2b0f s LYS 174 CO -0.00 0.47 1.80 -0.22 -0.92 0.00 0.00 175.35 176.47 2b0f h LYS 175 N 3.85 0.00 -0.14 1.68 3.64 -1.55 -1.74 116.57 122.31 2b0f h LYS 175 Ca -0.47 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 58.95 2b0f h LYS 175 Cb 1.20 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 2b0f h LYS 175 CO 0.66 0.00 0.30 -0.56 -2.27 0.00 0.00 179.45 177.57 2b0f h GLN 176 N 0.00 0.00 0.00 1.90 3.07 -1.86 -1.48 115.11 116.73 2b0f h GLN 176 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.87 2b0f h GLN 176 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.71 2b0f h GLN 176 CO -0.00 0.00 -1.45 0.66 0.09 0.00 0.00 178.83 178.13 2b0f n TYR 177 N -3.29 0.13 0.54 0.06 4.01 -0.65 -4.58 117.16 113.38 2b0f n TYR 177 Ca 0.01 0.04 0.06 0.00 -0.16 0.00 0.00 57.90 57.85 2b0f n TYR 177 Cb 0.39 -0.39 -0.02 0.00 -0.31 0.00 0.00 39.34 39.01 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 -2.03 0.00 0.28 -0.72 3.72 -0.57 -4.31 117.46 113.83 2b0f n PHE 178 Ca -0.00 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.51 2b0f n PHE 178 Cb 0.48 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.08 2b0f n PHE 178 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2b0f h VAL 179 N 0.97 0.00 0.74 -4.37 2.07 -1.77 -3.37 116.25 110.51 2b0f h VAL 179 Ca 0.00 -0.81 -0.03 0.00 0.82 0.00 0.00 66.70 66.68 2b0f h VAL 179 Cb 0.37 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2b0f h VAL 179 CO 0.00 0.00 -0.43 -0.08 0.02 0.00 0.00 177.57 177.08 2b0f h GLU 180 N 0.00 -1.05 -5.63 1.57 4.81 -1.82 -3.42 114.58 109.05 2b0f h GLU 180 Ca 0.00 0.07 -0.59 0.00 -0.13 0.00 0.00 59.36 58.71 2b0f h GLU 180 Cb 0.90 0.24 -0.09 0.00 0.63 0.00 0.00 28.75 30.43 2b0f h GLU 180 CO 0.00 -0.70 -0.11 0.21 -0.73 0.00 0.00 179.01 177.68 2b0f s LYS 181 N -5.99 4.27 0.00 1.92 2.20 -1.26 -5.20 119.74 115.68 2b0f s LYS 181 Ca -0.19 0.41 0.00 0.00 -0.36 0.00 0.00 55.97 55.83 2b0f s LYS 181 Cb 0.03 -3.49 0.00 0.00 -1.51 0.00 0.00 37.83 32.86 2b0f s LYS 181 CO 0.61 0.02 0.00 0.94 -0.36 0.00 0.00 175.35 176.56