#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 0.17 0.01 1.61 0.13 -2.03 1.00 132.00 132.89 2b0f h PRO 2 Ca 0.00 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.10 2b0f h PRO 2 Cb 0.00 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.09 2b0f h PRO 2 CO 0.00 0.11 -0.07 -0.97 -0.23 0.00 0.00 178.00 176.84 2b0f h ASN 3 N 0.18 0.04 -0.37 1.44 -1.24 -1.96 -2.93 115.58 110.74 2b0f h ASN 3 Ca 0.39 -0.99 -0.11 0.00 0.71 0.00 0.00 56.30 56.30 2b0f h ASN 3 Cb 1.26 -0.01 -0.01 0.00 0.73 0.00 0.00 38.32 40.29 2b0f h ASN 3 CO -0.07 1.02 -0.18 0.71 -1.29 0.00 0.00 177.43 177.62 2b0f h THR 4 N -0.94 1.28 0.00 -3.57 1.35 -1.89 -2.40 112.91 106.74 2b0f h THR 4 Ca -0.01 -1.31 -0.12 0.00 -0.55 0.00 0.00 66.41 64.42 2b0f h THR 4 Cb 1.05 1.34 -0.02 0.00 -1.73 0.00 0.00 68.15 68.79 2b0f h THR 4 CO 0.01 0.43 -0.59 1.05 -0.25 0.00 0.00 175.52 176.17 2b0f h GLU 5 N 0.57 0.00 -0.24 4.72 4.11 -0.98 -2.34 114.58 120.41 2b0f h GLU 5 Ca 0.08 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.48 2b0f h GLU 5 Cb 0.73 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2b0f h GLU 5 CO 0.05 0.59 0.02 0.35 0.07 0.00 0.00 179.01 180.10 2b0f h PHE 6 N 0.00 0.44 -0.19 2.06 3.57 -1.44 -1.36 116.94 120.02 2b0f h PHE 6 Ca -0.01 -0.07 0.03 0.00 3.53 0.00 0.00 57.97 61.46 2b0f h PHE 6 Cb 1.08 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.67 2b0f h PHE 6 CO 0.00 0.55 -0.01 0.00 -2.23 0.00 0.00 178.31 176.62 2b0f h ALA 7 N 0.83 0.16 -0.56 2.41 0.00 -1.32 0.36 119.26 121.15 2b0f h ALA 7 Ca 0.07 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2b0f h ALA 7 Cb 0.36 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2b0f h ALA 7 CO 0.01 -0.44 0.28 1.25 0.00 0.00 0.00 179.25 180.34 2b0f h LEU 8 N 0.05 0.72 -0.32 0.00 5.85 -1.38 -0.56 115.31 119.66 2b0f h LEU 8 Ca 0.09 -0.12 -0.13 0.00 0.84 0.00 0.00 57.88 58.56 2b0f h LEU 8 Cb 0.12 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 2b0f h LEU 8 CO -0.16 0.63 -0.32 0.28 -0.34 0.00 0.00 178.44 178.53 2b0f h SER 9 N 0.75 0.84 -0.76 1.25 0.02 -0.96 -2.72 113.55 111.97 2b0f h SER 9 Ca 0.19 -0.47 -0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2b0f h SER 9 Cb 0.10 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.36 2b0f h SER 9 CO -0.03 1.14 0.46 0.25 -1.14 0.00 0.00 176.83 177.51 2b0f h LEU 10 N 0.55 0.91 0.11 5.07 5.85 -0.14 -2.52 115.31 125.15 2b0f h LEU 10 Ca 0.05 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.72 2b0f h LEU 10 Cb 0.91 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 2b0f h LEU 10 CO 0.08 0.70 -0.21 0.25 -0.34 0.00 0.00 178.44 178.93 2b0f h LEU 11 N 1.04 -0.58 -1.60 2.25 6.46 -1.00 -0.08 115.31 121.81 2b0f h LEU 11 Ca 0.27 0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 58.06 2b0f h LEU 11 Cb -0.04 0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.10 2b0f h LEU 11 CO -0.05 -0.29 -0.20 0.03 -0.62 0.00 0.00 178.44 177.31 2b0f h ARG 12 N -0.39 0.00 0.00 1.25 3.08 -1.39 0.68 114.38 117.61 2b0f h ARG 12 Ca 0.03 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 2b0f h ARG 12 Cb 0.41 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2b0f h ARG 12 CO -0.11 0.20 -0.29 0.87 -1.07 0.00 0.00 179.97 179.57 2b0f h LYS 13 N 0.00 0.00 -0.00 0.04 1.57 -1.05 -3.43 116.57 113.69 2b0f h LYS 13 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2b0f h LYS 13 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2b0f h LYS 13 CO 0.03 0.44 -0.02 0.09 -0.57 0.00 0.00 179.45 179.41 2b0f n ASN 14 N -4.65 0.93 -4.47 0.86 4.13 -0.08 -4.84 115.26 107.14 2b0f n ASN 14 Ca -0.09 -0.96 -0.40 0.00 1.68 0.00 0.00 54.58 54.80 2b0f n ASN 14 Cb 0.29 0.24 -0.11 0.00 -1.54 0.00 0.00 39.78 38.67 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 -0.44 4.97 0.14 2.41 -1.09 0.23 -1.03 121.20 126.40 2b0f s ILE 15 Ca 0.02 -0.41 0.07 0.00 -2.23 0.00 0.00 60.65 58.10 2b0f s ILE 15 Cb 0.02 -3.60 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 2b0f s ILE 15 CO 0.04 -0.05 -0.15 -0.04 -1.23 0.00 0.00 174.94 173.52 2b0f s MET 16 N 1.66 1.11 -0.48 2.79 -1.94 -0.33 -4.52 119.30 117.59 2b0f s MET 16 Ca 0.05 -1.30 -0.25 0.00 -1.71 0.00 0.00 55.69 52.47 2b0f s MET 16 Cb -0.18 -1.03 0.03 0.00 2.01 0.00 0.00 34.83 35.66 2b0f s MET 16 CO 0.09 0.20 0.93 0.99 -0.01 0.00 0.00 175.02 177.22 2b0f s THR 17 N -2.16 4.45 -0.38 2.05 2.01 -1.26 -0.10 115.64 120.26 2b0f s THR 17 Ca 0.11 0.65 -0.12 0.00 0.31 0.00 0.00 61.69 62.65 2b0f s THR 17 Cb -0.05 -4.46 0.02 0.00 0.01 0.00 0.00 72.50 68.02 2b0f s THR 17 CO 0.04 -0.90 0.23 -0.63 -0.69 0.00 0.00 174.62 172.67 2b0f s ILE 18 N 3.81 4.79 -0.37 1.82 1.01 -0.41 0.01 121.20 131.86 2b0f s ILE 18 Ca 0.36 -0.76 -0.25 0.00 0.00 0.00 0.00 60.65 60.01 2b0f s ILE 18 Cb -0.10 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.73 2b0f s ILE 18 CO 0.25 -0.23 0.87 -0.89 0.00 0.00 0.00 174.94 174.94 2b0f s THR 19 N 1.60 4.64 0.36 2.92 2.01 0.19 -1.38 115.64 125.99 2b0f s THR 19 Ca 0.03 1.05 0.04 0.00 0.31 0.00 0.00 61.69 63.12 2b0f s THR 19 Cb -0.19 -4.28 0.04 0.00 0.01 0.00 0.00 72.50 68.08 2b0f s THR 19 CO 0.08 -0.50 0.35 0.35 -0.69 0.00 0.00 174.62 174.21 2b0f n THR 20 N 5.91 0.00 0.47 -0.82 -2.24 0.15 -2.96 114.28 114.79 2b0f n THR 20 Ca 0.05 -1.36 0.13 0.00 -2.27 0.00 0.00 64.05 60.60 2b0f n THR 20 Cb 0.48 -0.36 0.43 0.00 -2.10 0.00 0.00 70.33 68.78 2b0f n THR 20 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2b0f h SER 21 N 0.30 0.00 0.17 3.42 0.87 -1.82 -3.07 113.55 113.43 2b0f h SER 21 Ca -0.21 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.07 2b0f h SER 21 Cb 0.82 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.80 2b0f h SER 21 CO 0.32 0.00 -1.32 0.50 -0.53 0.00 0.00 176.83 175.80 2b0f h LYS 22 N 0.00 0.37 0.00 2.24 1.63 -1.88 -3.50 116.57 115.42 2b0f h LYS 22 Ca 0.00 -0.63 0.00 0.00 -0.85 0.00 0.00 60.65 59.17 2b0f h LYS 22 Cb 0.63 0.23 0.00 0.00 -0.60 0.00 0.00 32.23 32.49 2b0f h LYS 22 CO 0.00 1.30 0.00 0.41 -3.45 0.00 0.00 179.45 177.71 2b0f n GLY 23 N 1.74 -1.10 3.55 5.01 0.00 -1.16 -5.10 105.19 108.14 2b0f n GLY 23 Ca -0.20 -1.09 -0.40 0.00 0.00 0.00 0.00 46.02 44.33 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 -1.53 3.64 0.36 1.61 2.02 -1.26 0.33 118.70 123.87 2b0f s GLU 24 Ca 0.00 -0.34 0.09 0.00 0.02 0.00 0.00 54.97 54.73 2b0f s GLU 24 Cb 0.00 -3.78 -0.07 0.00 0.10 0.00 0.00 34.13 30.38 2b0f s GLU 24 CO 0.00 -0.48 -0.06 -0.06 0.02 0.00 0.00 175.26 174.68 2b0f s PHE 25 N 2.02 2.44 -0.53 1.61 0.40 -0.48 -1.59 117.98 121.86 2b0f s PHE 25 Ca 0.12 -0.54 -0.28 0.00 -0.60 0.00 0.00 56.93 55.63 2b0f s PHE 25 Cb -0.16 -1.50 0.00 0.00 0.51 0.00 0.00 43.02 41.87 2b0f s PHE 25 CO 0.11 0.54 1.57 0.99 0.70 0.00 0.00 175.22 179.13 2b0f s THR 26 N -2.63 3.65 -0.49 0.64 2.01 -1.07 -1.28 115.64 116.46 2b0f s THR 26 Ca 0.33 0.55 -0.18 0.00 0.31 0.00 0.00 61.69 62.71 2b0f s THR 26 Cb 0.04 -4.20 0.06 0.00 0.01 0.00 0.00 72.50 68.42 2b0f s THR 26 CO 0.17 -0.97 0.53 -0.83 -0.69 0.00 0.00 174.62 172.83 2b0f s GLY 27 N 5.44 1.88 -0.16 4.40 0.00 0.86 -4.70 107.32 115.04 2b0f s GLY 27 Ca 0.60 -1.88 -0.05 0.00 0.00 0.00 0.00 44.72 43.40 2b0f s GLY 27 CO 0.26 1.30 -0.00 0.48 0.00 0.00 0.00 173.10 175.14 2b0f s LEU 28 N 2.24 3.46 -0.10 0.66 2.34 -1.01 -1.19 118.68 125.08 2b0f s LEU 28 Ca 0.11 -0.05 -0.28 0.00 0.06 0.00 0.00 54.13 53.97 2b0f s LEU 28 Cb -0.21 -1.85 -0.02 0.00 -0.56 0.00 0.00 46.19 43.55 2b0f s LEU 28 CO 0.10 0.17 0.94 -0.83 -1.06 0.00 0.00 176.35 175.68 2b0f s GLY 29 N 0.34 2.40 -0.13 -3.48 0.00 -0.19 -0.67 107.32 105.59 2b0f s GLY 29 Ca -0.01 0.31 -0.11 0.00 0.00 0.00 0.00 44.72 44.91 2b0f s GLY 29 CO 0.02 1.78 0.12 -2.22 0.00 0.00 0.00 173.10 172.80 2b0f h ILE 30 N 5.05 0.46 -2.26 0.90 1.08 -0.60 -3.43 117.51 118.71 2b0f h ILE 30 Ca -0.33 -1.41 -0.06 0.00 -0.39 0.00 0.00 64.86 62.66 2b0f h ILE 30 Cb 1.16 0.94 -0.18 0.00 -3.07 0.00 0.00 36.82 35.66 2b0f h ILE 30 CO 0.83 0.16 0.12 -1.38 -0.69 0.00 0.00 178.15 177.19 2b0f s HIS 31 N -1.98 -0.57 0.00 1.37 -3.43 -1.14 -0.27 115.29 109.26 2b0f s HIS 31 Ca -0.12 0.91 0.00 0.00 -0.80 0.00 0.00 55.06 55.06 2b0f s HIS 31 Cb 0.01 0.38 0.00 0.00 -1.43 0.00 0.00 32.58 31.53 2b0f s HIS 31 CO 0.27 -0.60 0.00 -3.47 -2.00 0.00 0.00 174.74 168.94 2b0f n ASP 32 N 0.82 0.00 -0.52 7.38 2.03 -1.08 0.06 116.55 125.24 2b0f n ASP 32 Ca -0.19 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.12 2b0f n ASP 32 Cb 0.58 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 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 -3.08 -0.67 -4.01 -1.26 0.26 116.66 107.90 2b0f n ARG 33 Ca 0.00 -0.85 -0.43 0.00 -1.04 0.00 0.00 57.85 55.53 2b0f n ARG 33 Cb 0.00 -0.40 -0.06 0.00 -3.04 0.00 0.00 32.46 28.96 2b0f n ARG 33 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 2b0f s VAL 34 N 0.00 4.76 0.15 8.89 1.01 0.11 -2.82 120.40 132.51 2b0f s VAL 34 Ca 0.01 -0.18 0.09 0.00 0.00 0.00 0.00 61.98 61.90 2b0f s VAL 34 Cb 0.01 -4.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 2b0f s VAL 34 CO -0.00 -0.81 -0.13 0.00 0.00 0.00 0.00 175.10 174.15 2b0f s VAL 36 N -1.48 1.86 -0.09 0.00 -7.23 0.15 0.61 120.40 114.22 2b0f s VAL 36 Ca 0.22 -1.28 -0.09 0.00 -1.81 0.00 0.00 61.98 59.02 2b0f s VAL 36 Cb -0.09 -1.61 0.02 0.00 0.56 0.00 0.00 36.38 35.26 2b0f s VAL 36 CO 0.13 0.27 0.25 -0.51 -0.31 0.00 0.00 175.10 174.93 2b0f s ILE 37 N -0.80 0.00 0.41 -0.62 2.07 -0.31 -2.41 121.20 119.55 2b0f s ILE 37 Ca 0.09 -0.02 -0.23 0.00 -1.41 0.00 0.00 60.65 59.08 2b0f s ILE 37 Cb -0.09 -0.36 -0.13 0.00 0.13 0.00 0.00 42.46 42.01 2b0f s ILE 37 CO 0.02 -0.01 0.56 -0.81 -1.91 0.00 0.00 174.94 172.79 2b0f n PRO 38 N 2.88 0.59 0.07 3.50 -0.04 -1.26 -0.92 135.00 139.81 2b0f n PRO 38 Ca -0.13 0.21 -0.11 0.00 -0.04 0.00 0.00 63.50 63.43 2b0f n PRO 38 Cb 0.58 -1.51 -0.02 0.00 -0.04 0.00 0.00 33.50 32.51 2b0f n PRO 38 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2b0f h THR 39 N 0.84 1.42 0.00 0.52 2.02 -1.80 -3.08 112.91 112.83 2b0f h THR 39 Ca -0.40 -2.40 0.00 0.00 0.77 0.00 0.00 66.41 64.37 2b0f h THR 39 Cb 1.40 2.35 0.00 0.00 -1.74 0.00 0.00 68.15 70.16 2b0f h THR 39 CO 0.52 0.71 0.00 0.00 0.37 0.00 0.00 175.52 177.12 2b0f n HIS 40 N -3.75 0.32 0.18 3.16 1.44 -1.26 -0.80 115.22 114.51 2b0f n HIS 40 Ca -0.05 0.15 0.07 0.00 -2.01 0.00 0.00 57.72 55.87 2b0f n HIS 40 Cb 0.79 -0.74 0.15 0.00 0.12 0.00 0.00 29.99 30.32 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 2.20 0.83 -6.16 1.59 0.00 -1.90 -3.48 119.26 112.33 2b0f h ALA 41 Ca 0.00 -0.27 -0.28 0.00 0.00 0.00 0.00 54.91 54.36 2b0f h ALA 41 Cb 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2b0f h ALA 41 CO 0.00 0.37 -0.71 1.04 0.00 0.00 0.00 179.25 179.95 2b0f n GLN 42 N -3.21 -1.59 -1.91 0.00 1.13 0.02 -4.10 117.38 107.72 2b0f n GLN 42 Ca 0.02 1.19 -0.42 0.00 -1.94 0.00 0.00 57.00 55.86 2b0f n GLN 42 Cb 0.62 -3.65 -0.03 0.00 0.11 0.00 0.00 30.24 27.29 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 -3.82 4.21 0.00 -1.09 0.04 -1.26 -4.62 135.00 128.46 2b0f s PRO 43 Ca 0.07 2.39 0.00 0.00 0.04 0.00 0.00 61.00 63.50 2b0f s PRO 43 Cb -0.01 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.39 2b0f s PRO 43 CO 0.84 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 177.68 2b0f n GLY 44 N 3.60 -0.70 0.11 0.56 0.00 -1.26 -4.97 105.19 102.54 2b0f n GLY 44 Ca 0.13 -1.45 -0.17 0.00 0.00 0.00 0.00 46.02 44.53 2b0f n GLY 44 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2b0f h ASP 45 N 0.00 0.46 -3.26 1.61 3.32 -1.95 -3.44 116.42 113.16 2b0f h ASP 45 Ca 0.00 -0.56 -0.46 0.00 0.02 0.00 0.00 57.03 56.03 2b0f h ASP 45 Cb 0.00 -0.15 -0.37 0.00 0.22 0.00 0.00 39.33 39.03 2b0f h ASP 45 CO 0.00 1.45 -0.78 1.51 -1.72 0.00 0.00 179.24 179.70 2b0f s ASP 46 N -7.12 1.70 0.13 6.45 -4.77 -1.26 0.45 116.67 112.26 2b0f s ASP 46 Ca -0.07 -0.16 0.10 0.00 -3.30 0.00 0.00 52.55 49.11 2b0f s ASP 46 Cb 0.07 -0.58 -0.04 0.00 -1.09 0.00 0.00 42.92 41.28 2b0f s ASP 46 CO 0.87 -0.15 -0.20 0.68 0.70 0.00 0.00 175.17 177.08 2b0f s VAL 47 N 1.71 2.70 -0.54 2.11 -7.23 -1.06 -4.90 120.40 113.20 2b0f s VAL 47 Ca 0.02 -1.63 -0.26 0.00 -1.81 0.00 0.00 61.98 58.30 2b0f s VAL 47 Cb -0.13 -2.25 0.03 0.00 0.56 0.00 0.00 36.38 34.60 2b0f s VAL 47 CO -0.05 0.05 1.04 -0.76 -0.31 0.00 0.00 175.10 175.07 2b0f s LEU 48 N -2.26 3.82 -0.92 1.32 1.43 -1.16 -2.15 118.68 118.76 2b0f s LEU 48 Ca 0.18 -0.03 -0.17 0.00 -1.03 0.00 0.00 54.13 53.08 2b0f s LEU 48 Cb -0.10 -3.08 0.16 0.00 0.03 0.00 0.00 46.19 43.20 2b0f s LEU 48 CO 0.10 -1.28 1.05 -0.69 0.23 0.00 0.00 176.35 175.75 2b0f s VAL 49 N 4.30 5.00 -1.50 -1.59 1.01 0.10 -0.64 120.40 127.09 2b0f s VAL 49 Ca 0.38 -1.91 -0.06 0.00 0.00 0.00 0.00 61.98 60.38 2b0f s VAL 49 Cb -0.10 -4.70 0.02 0.00 0.00 0.00 0.00 36.38 31.60 2b0f s VAL 49 CO 0.24 -1.38 0.72 -3.20 0.00 0.00 0.00 175.10 171.47 2b0f n ASN 50 N 5.75 -5.89 0.00 3.32 4.05 0.10 -1.89 115.26 120.70 2b0f n ASN 50 Ca 0.22 -0.36 0.00 0.00 0.45 0.00 0.00 54.58 54.89 2b0f n ASN 50 Cb 0.48 -4.74 0.00 0.00 1.23 0.00 0.00 39.78 36.75 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 -1.59 1.78 3.33 8.20 0.00 -1.26 -5.04 105.19 110.61 2b0f n GLY 51 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.90 2.72 0.11 1.61 -1.52 -0.79 -5.03 119.66 115.85 2b0f s GLN 52 Ca 0.00 -1.20 -0.22 0.00 -1.95 0.00 0.00 55.36 51.99 2b0f s GLN 52 Cb 0.00 -3.69 -0.07 0.00 -0.22 0.00 0.00 33.01 29.03 2b0f s GLN 52 CO 0.00 -0.76 0.66 -1.59 -0.25 0.00 0.00 175.29 173.35 2b0f s LYS 53 N 1.49 4.37 -0.02 2.91 0.00 -1.26 0.02 119.74 127.25 2b0f s LYS 53 Ca 0.01 0.93 0.01 0.00 0.00 0.00 0.00 55.97 56.92 2b0f s LYS 53 Cb -0.20 -3.26 0.01 0.00 0.00 0.00 0.00 37.83 34.38 2b0f s LYS 53 CO 0.05 0.58 -0.04 -1.50 0.00 0.00 0.00 175.35 174.44 2b0f s ILE 54 N -1.02 0.40 -0.09 3.79 1.10 -0.91 -4.93 121.20 119.54 2b0f s ILE 54 Ca 0.32 -0.14 -0.25 0.00 -0.51 0.00 0.00 60.65 60.07 2b0f s ILE 54 Cb -0.21 -0.39 -0.03 0.00 0.15 0.00 0.00 42.46 41.98 2b0f s ILE 54 CO 0.22 0.15 0.78 -0.60 -2.11 0.00 0.00 174.94 173.38 2b0f s ARG 55 N 0.34 4.41 0.44 3.50 3.52 -1.26 -2.56 118.95 127.35 2b0f s ARG 55 Ca -0.04 1.00 -0.25 0.00 -0.13 0.00 0.00 55.73 56.31 2b0f s ARG 55 Cb -0.07 -3.49 -0.09 0.00 -1.56 0.00 0.00 34.95 29.74 2b0f s ARG 55 CO -0.00 -0.07 1.41 1.55 -0.81 0.00 0.00 175.30 177.38 2b0f n VAL 56 N 4.10 2.74 -0.05 7.11 3.14 0.17 -4.76 118.33 130.77 2b0f n VAL 56 Ca 0.02 -0.50 -0.14 0.00 -2.96 0.00 0.00 64.34 60.76 2b0f n VAL 56 Cb 0.50 -1.81 -0.12 0.00 -1.06 0.00 0.00 33.84 31.35 2b0f n VAL 56 CO 0.00 0.00 0.00 0.50 -6.46 0.00 0.00 176.83 170.87 2b0f h LYS 57 N 2.29 0.02 -2.61 1.45 1.63 -1.54 -3.46 116.57 114.35 2b0f h LYS 57 Ca -0.50 -0.02 -0.13 0.00 -0.85 0.00 0.00 60.65 59.15 2b0f h LYS 57 Cb 1.27 0.01 -0.29 0.00 -0.60 0.00 0.00 32.23 32.62 2b0f h LYS 57 CO 0.61 0.87 -0.41 0.34 -3.45 0.00 0.00 179.45 177.41 2b0f s ASP 58 N -6.11 -0.11 -0.62 4.20 2.15 -0.43 -5.04 116.67 110.72 2b0f s ASP 58 Ca -0.18 0.89 -0.17 0.00 0.43 0.00 0.00 52.55 53.52 2b0f s ASP 58 Cb -0.02 1.16 0.13 0.00 -0.30 0.00 0.00 42.92 43.90 2b0f s ASP 58 CO 0.69 -0.23 0.64 -1.59 -0.17 0.00 0.00 175.17 174.51 2b0f s LYS 59 N 2.52 3.12 -0.25 4.34 -2.85 -1.26 -1.19 119.74 124.18 2b0f s LYS 59 Ca -0.01 -1.67 -0.10 0.00 -1.00 0.00 0.00 55.97 53.18 2b0f s LYS 59 Cb -0.12 -4.33 -0.05 0.00 -2.06 0.00 0.00 37.83 31.27 2b0f s LYS 59 CO -0.12 -1.42 0.16 -0.47 0.10 0.00 0.00 175.35 173.60 2b0f s TYR 60 N 1.85 3.28 -0.46 1.78 5.04 -0.84 -4.99 117.35 123.02 2b0f s TYR 60 Ca 0.09 0.16 -0.19 0.00 -2.44 0.00 0.00 57.07 54.70 2b0f s TYR 60 Cb -0.24 -2.29 0.04 0.00 0.35 0.00 0.00 41.96 39.82 2b0f s TYR 60 CO 0.02 -0.01 0.56 0.15 -1.34 0.00 0.00 175.55 174.94 2b0f s LYS 61 N 1.22 3.15 -0.28 4.97 3.01 -1.26 0.14 119.74 130.69 2b0f s LYS 61 Ca 0.07 -0.72 -0.24 0.00 -1.01 0.00 0.00 55.97 54.08 2b0f s LYS 61 Cb -0.14 -4.02 -0.00 0.00 -1.01 0.00 0.00 37.83 32.66 2b0f s LYS 61 CO 0.06 -1.04 0.80 -1.17 0.51 0.00 0.00 175.35 174.51 2b0f s LEU 62 N 2.50 4.08 0.47 3.17 2.96 0.13 -4.95 118.68 127.03 2b0f s LEU 62 Ca 0.16 0.79 0.08 0.00 -0.22 0.00 0.00 54.13 54.94 2b0f s LEU 62 Cb -0.17 -3.11 0.02 0.00 0.50 0.00 0.00 46.19 43.43 2b0f s LEU 62 CO 0.14 -0.58 0.54 0.68 -1.32 0.00 0.00 176.35 175.82 2b0f s VAL 63 N 2.91 2.57 0.32 1.68 -7.23 -1.26 -2.92 120.40 116.48 2b0f s VAL 63 Ca 0.33 -1.15 -0.28 0.00 -1.81 0.00 0.00 61.98 59.07 2b0f s VAL 63 Cb -0.14 -2.73 -0.10 0.00 0.56 0.00 0.00 36.38 33.97 2b0f s VAL 63 CO 0.11 0.00 1.18 -0.62 -0.31 0.00 0.00 175.10 175.46 2b0f s ASP 64 N -4.35 6.94 0.56 4.85 -1.08 0.36 -4.69 116.67 119.26 2b0f s ASP 64 Ca 0.52 2.43 0.36 0.00 -0.52 0.00 0.00 52.55 55.34 2b0f s ASP 64 Cb -0.06 -2.63 1.51 0.00 -1.46 0.00 0.00 42.92 40.27 2b0f s ASP 64 CO 0.32 -0.39 1.76 -0.65 0.52 0.00 0.00 175.17 176.73 2b0f h PRO 65 N 3.40 0.00 -0.17 4.34 0.11 -1.98 1.48 132.00 139.18 2b0f h PRO 65 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2b0f h PRO 65 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2b0f h PRO 65 CO 0.65 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.83 2b0f n GLU 66 N -4.02 1.42 -2.77 1.05 1.02 -1.26 -4.91 120.64 111.17 2b0f n GLU 66 Ca 0.24 -0.65 -0.02 0.00 -0.02 0.00 0.00 57.16 56.71 2b0f n GLU 66 Cb 1.24 -1.18 0.01 0.00 -0.02 0.00 0.00 31.44 31.48 2b0f n GLU 66 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2b0f n ASN 67 N -0.00 -6.49 -4.06 1.62 5.15 0.51 -5.07 115.26 106.91 2b0f n ASN 67 Ca 0.08 -0.14 -0.09 0.00 -0.60 0.00 0.00 54.58 53.83 2b0f n ASN 67 Cb 0.17 -4.42 -0.09 0.00 -0.53 0.00 0.00 39.78 34.91 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 -3.05 0.10 -0.17 -1.44 1.01 -1.21 -4.89 121.20 111.55 2b0f s ILE 68 Ca 0.06 -1.68 -0.29 0.00 0.00 0.00 0.00 60.65 58.74 2b0f s ILE 68 Cb -0.01 -1.88 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 2b0f s ILE 68 CO 0.60 -0.47 1.62 0.21 0.00 0.00 0.00 174.94 176.90 2b0f s ASN 69 N -3.00 6.47 -0.21 3.58 3.04 -0.86 0.14 114.94 124.10 2b0f s ASN 69 Ca 0.19 1.80 0.13 0.00 0.04 0.00 0.00 52.86 55.02 2b0f s ASN 69 Cb 0.06 -2.53 -0.22 0.00 -1.54 0.00 0.00 41.25 37.02 2b0f s ASN 69 CO -0.01 -1.15 -0.02 -0.11 -3.04 0.00 0.00 177.10 172.77 2b0f n LEU 70 N 8.05 0.87 -0.11 3.21 -0.00 -1.25 -1.72 117.00 126.05 2b0f n LEU 70 Ca 0.18 -0.04 -0.01 0.00 -0.00 0.00 0.00 56.01 56.14 2b0f n LEU 70 Cb 0.44 0.08 -0.01 0.00 -0.00 0.00 0.00 43.42 43.94 2b0f n LEU 70 CO 0.64 0.62 -0.01 1.21 -0.00 0.00 0.00 177.39 179.84 2b0f n GLU 71 N -2.88 -0.23 -3.58 1.96 4.07 -1.15 -4.93 120.64 113.90 2b0f n GLU 71 Ca -0.36 0.34 -0.40 0.00 -0.06 0.00 0.00 57.16 56.67 2b0f n GLU 71 Cb 1.09 -3.75 -0.11 0.00 -0.06 0.00 0.00 31.44 28.61 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 -0.32 4.64 -0.49 4.31 1.43 -1.18 -2.22 118.68 124.85 2b0f s LEU 72 Ca 0.00 -0.84 -0.22 0.00 -1.03 0.00 0.00 54.13 52.04 2b0f s LEU 72 Cb 0.00 -2.05 0.04 0.00 0.03 0.00 0.00 46.19 44.21 2b0f s LEU 72 CO 0.00 -0.34 0.76 -0.89 0.23 0.00 0.00 176.35 176.10 2b0f s THR 73 N 1.60 4.67 -0.81 5.49 2.01 -0.10 0.20 115.64 128.70 2b0f s THR 73 Ca 0.03 0.07 -0.26 0.00 0.31 0.00 0.00 61.69 61.84 2b0f s THR 73 Cb -0.19 -4.36 0.03 0.00 0.01 0.00 0.00 72.50 68.00 2b0f s THR 73 CO 0.07 -0.83 1.38 -0.69 -0.69 0.00 0.00 174.62 173.86 2b0f s VAL 74 N 3.20 3.74 -0.87 3.82 1.01 0.37 -1.16 120.40 130.51 2b0f s VAL 74 Ca 0.24 0.07 -0.25 0.00 0.00 0.00 0.00 61.98 62.05 2b0f s VAL 74 Cb -0.15 -4.87 0.03 0.00 0.00 0.00 0.00 36.38 31.40 2b0f s VAL 74 CO 0.18 -1.79 1.47 -0.22 0.00 0.00 0.00 175.10 174.73 2b0f s LEU 75 N 5.88 3.32 -0.74 3.92 2.96 0.20 -1.99 118.68 132.24 2b0f s LEU 75 Ca 0.41 -0.86 -0.24 0.00 -0.22 0.00 0.00 54.13 53.22 2b0f s LEU 75 Cb -0.06 -2.56 0.05 0.00 0.50 0.00 0.00 46.19 44.12 2b0f s LEU 75 CO 0.09 -1.82 1.15 -0.89 -1.32 0.00 0.00 176.35 173.56 2b0f s THR 76 N 6.08 4.05 -0.03 3.68 2.01 -0.33 -2.57 115.64 128.53 2b0f s THR 76 Ca 0.46 -0.12 -0.02 0.00 0.31 0.00 0.00 61.69 62.32 2b0f s THR 76 Cb -0.05 -4.82 -0.04 0.00 0.01 0.00 0.00 72.50 67.60 2b0f s THR 76 CO 0.03 -1.68 0.10 -1.48 -0.69 0.00 0.00 174.62 170.90 2b0f s LEU 77 N 4.80 4.00 -0.64 4.42 0.05 -1.13 -1.31 118.68 128.87 2b0f s LEU 77 Ca 0.30 0.22 -0.16 0.00 0.05 0.00 0.00 54.13 54.55 2b0f s LEU 77 Cb -0.11 -2.24 0.15 0.00 -2.05 0.00 0.00 46.19 41.94 2b0f s LEU 77 CO 0.10 0.30 0.61 -0.62 -0.55 0.00 0.00 176.35 176.19 2b0f s ASP 78 N -1.57 6.37 0.12 1.48 2.15 -1.26 -4.72 116.67 119.25 2b0f s ASP 78 Ca 0.21 -2.04 0.10 0.00 0.43 0.00 0.00 52.55 51.25 2b0f s ASP 78 Cb -0.12 -2.22 -0.04 0.00 -0.30 0.00 0.00 42.92 40.24 2b0f s ASP 78 CO 0.12 -0.80 -0.21 -0.13 -0.17 0.00 0.00 175.17 173.98 2b0f s ARG 79 N 1.28 1.65 -0.07 4.34 1.81 -1.26 -5.02 118.95 121.68 2b0f s ARG 79 Ca 0.09 -1.24 -0.21 0.00 -1.72 0.00 0.00 55.73 52.65 2b0f s ARG 79 Cb -0.23 -2.04 -0.29 0.00 -0.45 0.00 0.00 34.95 31.93 2b0f s ARG 79 CO -0.01 0.47 0.77 -0.91 -0.68 0.00 0.00 175.30 174.94 2b0f h ASN 80 N 3.78 0.40 -2.03 0.23 2.35 -2.00 -3.36 115.58 114.96 2b0f h ASN 80 Ca -0.50 -0.91 -0.75 0.00 -0.55 0.00 0.00 56.30 53.58 2b0f h ASN 80 Cb 1.17 -0.13 -0.18 0.00 0.05 0.00 0.00 38.32 39.23 2b0f h ASN 80 CO 0.44 1.44 1.50 1.21 -1.65 0.00 0.00 177.43 180.37 2b0f n GLU 81 N -4.11 3.53 -0.98 0.81 0.00 -1.26 -5.00 120.64 113.63 2b0f n GLU 81 Ca -0.17 -3.82 -0.29 0.00 0.00 0.00 0.00 57.16 52.88 2b0f n GLU 81 Cb 0.82 -2.94 0.22 0.00 0.00 0.00 0.00 31.44 29.53 2b0f n GLU 81 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.13 175.54 2b0f s LYS 82 N 0.74 -0.49 0.38 5.31 -2.85 -1.26 -5.04 119.74 116.53 2b0f s LYS 82 Ca 0.40 0.39 0.00 0.00 -1.00 0.00 0.00 55.97 55.76 2b0f s LYS 82 Cb 0.01 -1.64 -0.03 0.00 -2.06 0.00 0.00 37.83 34.12 2b0f s LYS 82 CO 0.00 -3.32 0.59 -0.06 0.10 0.00 0.00 175.35 172.66 2b0f s PHE 83 N -2.84 3.45 0.38 1.78 0.08 0.14 -5.00 117.98 115.96 2b0f s PHE 83 Ca 0.67 0.36 -0.26 0.00 0.12 0.00 0.00 56.93 57.82 2b0f s PHE 83 Cb -0.17 -2.01 -0.09 0.00 -0.57 0.00 0.00 43.02 40.18 2b0f s PHE 83 CO 0.59 -0.00 1.14 0.50 -0.10 0.00 0.00 175.22 177.35 2b0f s ARG 84 N -4.39 4.18 -0.92 0.44 6.06 -1.26 -2.62 118.95 120.44 2b0f s ARG 84 Ca 0.42 1.79 -0.24 0.00 -2.50 0.00 0.00 55.73 55.20 2b0f s ARG 84 Cb -0.10 -2.75 0.01 0.00 0.06 0.00 0.00 34.95 32.17 2b0f s ARG 84 CO 0.37 -0.19 1.65 0.34 -2.50 0.00 0.00 175.30 174.96 2b0f s ASP 85 N -1.15 5.88 -0.02 -2.12 -1.08 -1.26 -4.24 116.67 112.69 2b0f s ASP 85 Ca 0.55 -0.93 0.11 0.00 -0.52 0.00 0.00 52.55 51.75 2b0f s ASP 85 Cb -0.30 -2.56 0.34 0.00 -1.46 0.00 0.00 42.92 38.94 2b0f s ASP 85 CO 0.37 -2.06 1.25 2.30 0.52 0.00 0.00 175.17 177.56 2b0f n ILE 86 N 7.22 0.63 0.19 4.11 -5.35 0.62 -3.64 119.36 123.15 2b0f n ILE 86 Ca 0.32 -0.52 0.05 0.00 -0.27 0.00 0.00 62.75 62.33 2b0f n ILE 86 Cb 0.49 0.15 0.39 0.00 -1.74 0.00 0.00 39.64 38.93 2b0f n ILE 86 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 2b0f h ARG 87 N 2.14 0.00 0.00 6.28 2.43 -1.81 -1.82 114.38 121.60 2b0f h ARG 87 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2b0f h ARG 87 Cb 0.61 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.15 2b0f h ARG 87 CO 0.04 0.36 -0.03 0.78 -1.51 0.00 0.00 179.97 179.60 2b0f h GLY 88 N 1.66 0.00 0.75 2.80 0.00 -1.90 -1.76 103.07 104.62 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 0.05 0.00 -1.06 0.69 0.00 0.00 0.00 176.54 176.22 2b0f n PHE 89 N -3.15 0.51 -2.24 5.60 3.72 -0.71 -4.85 117.46 116.33 2b0f n PHE 89 Ca -0.00 0.15 -0.42 0.00 -0.05 0.00 0.00 57.45 57.12 2b0f n PHE 89 Cb 0.27 -0.64 -0.03 0.00 -0.94 0.00 0.00 39.48 38.14 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 -3.28 3.90 -0.43 4.37 1.01 -0.66 -0.50 121.20 125.60 2b0f s ILE 90 Ca 0.02 1.15 -0.14 0.00 0.00 0.00 0.00 60.65 61.68 2b0f s ILE 90 Cb 0.13 -3.74 0.05 0.00 0.01 0.00 0.00 42.46 38.90 2b0f s ILE 90 CO 0.80 -0.07 0.31 -0.44 0.00 0.00 0.00 174.94 175.54 2b0f s SER 91 N 2.35 6.00 0.24 3.58 0.01 -0.81 -4.61 113.70 120.45 2b0f s SER 91 Ca 0.63 -1.15 -0.03 0.00 1.31 0.00 0.00 55.95 56.71 2b0f s SER 91 Cb -0.28 -2.12 0.25 0.00 0.21 0.00 0.00 66.02 64.08 2b0f s SER 91 CO 0.23 -0.52 1.70 1.05 0.41 0.00 0.00 173.24 176.11 2b0f h GLU 92 N 8.61 0.81 -5.12 12.44 4.11 -1.88 -3.35 114.58 130.21 2b0f h GLU 92 Ca -0.27 -0.26 -0.66 0.00 0.07 0.00 0.00 59.36 58.24 2b0f h GLU 92 Cb 1.11 -0.07 -0.16 0.00 0.50 0.00 0.00 28.75 30.12 2b0f h GLU 92 CO 0.78 0.87 -0.10 0.34 0.07 0.00 0.00 179.01 180.96 2b0f s ASP 93 N -6.68 6.26 0.00 3.06 2.15 -1.26 -4.82 116.67 115.38 2b0f s ASP 93 Ca -0.10 -0.29 0.00 0.00 0.43 0.00 0.00 52.55 52.60 2b0f s ASP 93 Cb 0.14 -2.25 0.00 0.00 -0.30 0.00 0.00 42.92 40.51 2b0f s ASP 93 CO 0.82 -0.53 0.93 0.18 -0.17 0.00 0.00 175.17 176.40 2b0f n LEU 94 N 5.73 0.00 -3.48 -1.34 4.77 -1.26 -4.91 117.00 116.51 2b0f n LEU 94 Ca -0.06 0.93 -0.16 0.00 -0.03 0.00 0.00 56.01 56.69 2b0f n LEU 94 Cb 0.48 -0.43 0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2b0f n LEU 94 CO 0.46 -0.43 0.02 1.21 -1.33 0.00 0.00 177.39 177.32 2b0f n GLU 95 N -1.97 -1.39 0.00 3.23 2.13 -1.26 -4.95 120.64 116.43 2b0f n GLU 95 Ca 0.00 0.99 0.00 0.00 0.66 0.00 0.00 57.16 58.81 2b0f n GLU 95 Cb 0.00 -4.01 0.00 0.00 0.27 0.00 0.00 31.44 27.70 2b0f n GLU 95 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2b0f n GLY 96 N -1.70 -1.04 0.10 8.31 0.00 -1.26 -5.02 105.19 104.57 2b0f n GLY 96 Ca -0.15 0.84 0.14 0.00 0.00 0.00 0.00 46.02 46.85 2b0f n GLY 96 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2b0f n VAL 97 N 0.00 0.00 -3.90 1.61 0.31 -1.26 -4.62 118.33 110.48 2b0f n VAL 97 Ca 0.00 -0.05 -0.35 0.00 -0.01 0.00 0.00 64.34 63.93 2b0f n VAL 97 Cb 0.00 -0.17 -0.14 0.00 -0.91 0.00 0.00 33.84 32.63 2b0f n VAL 97 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2b0f s ASP 98 N -2.47 4.89 0.24 4.52 -1.08 -1.25 -0.81 116.67 120.71 2b0f s ASP 98 Ca 0.29 -1.22 0.04 0.00 -0.52 0.00 0.00 52.55 51.14 2b0f s ASP 98 Cb 0.20 -1.72 -0.05 0.00 -1.46 0.00 0.00 42.92 39.88 2b0f s ASP 98 CO 0.47 -0.26 -0.01 0.00 0.52 0.00 0.00 175.17 175.90 2b0f s ALA 99 N 1.27 1.87 0.00 3.66 0.00 -0.23 -4.89 121.76 123.44 2b0f s ALA 99 Ca -0.05 -1.79 0.08 0.00 0.00 0.00 0.00 51.96 50.21 2b0f s ALA 99 Cb -0.19 0.47 -0.02 0.00 0.00 0.00 0.00 23.12 23.38 2b0f s ALA 99 CO -0.01 -0.24 -0.26 0.99 0.00 0.00 0.00 175.76 176.24 2b0f s THR 100 N -3.38 2.09 -0.23 0.00 2.01 0.12 -1.25 115.64 115.00 2b0f s THR 100 Ca 0.29 -1.21 -0.05 0.00 0.31 0.00 0.00 61.69 61.02 2b0f s THR 100 Cb 0.06 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.80 2b0f s THR 100 CO 0.09 0.50 -0.00 -0.22 -0.69 0.00 0.00 174.62 174.30 2b0f s LEU 101 N -0.85 3.09 -0.30 4.42 2.96 0.19 -0.48 118.68 127.72 2b0f s LEU 101 Ca 0.11 -0.32 -0.00 0.00 -0.22 0.00 0.00 54.13 53.69 2b0f s LEU 101 Cb -0.10 -1.80 0.06 0.00 0.50 0.00 0.00 46.19 44.85 2b0f s LEU 101 CO 0.00 -0.02 -0.01 0.68 -1.32 0.00 0.00 176.35 175.68 2b0f s VAL 102 N 1.53 2.75 0.01 1.68 -7.23 0.10 -0.05 120.40 119.19 2b0f s VAL 102 Ca 0.06 -1.58 -0.19 0.00 -1.81 0.00 0.00 61.98 58.46 2b0f s VAL 102 Cb -0.15 -2.65 -0.06 0.00 0.56 0.00 0.00 36.38 34.09 2b0f s VAL 102 CO -0.01 -0.17 0.55 -0.69 -0.31 0.00 0.00 175.10 174.47 2b0f s VAL 103 N 1.18 4.89 -0.41 1.32 1.01 -0.44 -0.39 120.40 127.55 2b0f s VAL 103 Ca -0.04 1.15 0.06 0.00 0.00 0.00 0.00 61.98 63.15 2b0f s VAL 103 Cb -0.20 -3.88 0.20 0.00 0.00 0.00 0.00 36.38 32.51 2b0f s VAL 103 CO -0.03 0.48 0.46 1.57 0.00 0.00 0.00 175.10 177.58 2b0f n HIS 104 N 2.33 -1.04 -3.27 5.22 -0.00 -1.14 -1.76 115.22 115.57 2b0f n HIS 104 Ca -0.09 -3.20 0.00 0.00 -0.00 0.00 0.00 57.72 54.43 2b0f n HIS 104 Cb 0.51 0.18 0.00 0.00 -0.00 0.00 0.00 29.99 30.68 2b0f n HIS 104 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2b0f n SER 105 N 2.25 1.58 -0.04 0.26 3.41 0.37 -2.60 113.62 118.84 2b0f n SER 105 Ca 0.25 -0.27 -0.03 0.00 -0.26 0.00 0.00 58.87 58.56 2b0f n SER 105 Cb 0.51 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.44 2b0f n SER 105 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2b0f h ASN 106 N 0.00 -0.45 0.19 4.04 4.21 -1.59 -3.31 115.58 118.67 2b0f h ASN 106 Ca 0.00 0.06 -0.35 0.00 1.21 0.00 0.00 56.30 57.22 2b0f h ASN 106 Cb 0.00 0.19 -0.05 0.00 -1.12 0.00 0.00 38.32 37.34 2b0f h ASN 106 CO 0.00 -0.09 -2.08 -3.20 -1.29 0.00 0.00 177.43 170.76 2b0f n ASN 107 N -3.36 1.26 -4.51 5.81 5.15 -1.26 -4.70 115.26 113.66 2b0f n ASN 107 Ca -0.01 0.16 -0.43 0.00 -0.60 0.00 0.00 54.58 53.70 2b0f n ASN 107 Cb 0.08 -0.14 -0.01 0.00 -0.53 0.00 0.00 39.78 39.18 2b0f n ASN 107 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2b0f s PHE 108 N -2.55 3.10 -0.22 1.20 0.40 -1.24 -4.96 117.98 113.71 2b0f s PHE 108 Ca -0.17 -1.67 -0.17 0.00 -0.60 0.00 0.00 56.93 54.32 2b0f s PHE 108 Cb 0.07 -4.48 -0.03 0.00 0.51 0.00 0.00 43.02 39.09 2b0f s PHE 108 CO 0.77 -1.60 0.48 0.95 0.70 0.00 0.00 175.22 176.52 2b0f s THR 109 N 2.98 5.13 -1.03 0.64 -4.23 -1.26 -0.48 115.64 117.39 2b0f s THR 109 Ca 0.44 0.85 -0.24 0.00 -1.18 0.00 0.00 61.69 61.57 2b0f s THR 109 Cb -0.01 -3.80 0.03 0.00 1.34 0.00 0.00 72.50 70.06 2b0f s THR 109 CO -0.01 0.18 0.61 -0.46 -0.54 0.00 0.00 174.62 174.40 2b0f n ASN 110 N 4.89 -3.99 -4.37 3.99 2.04 -0.82 -4.92 115.26 112.07 2b0f n ASN 110 Ca -0.06 -1.14 -0.45 0.00 -0.44 0.00 0.00 54.58 52.49 2b0f n ASN 110 Cb 0.50 -1.47 -0.06 0.00 -2.53 0.00 0.00 39.78 36.22 2b0f n ASN 110 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 2b0f s THR 111 N -3.43 5.16 -0.45 5.53 2.01 -0.72 -4.94 115.64 118.80 2b0f s THR 111 Ca 0.33 -1.14 -0.20 0.00 0.31 0.00 0.00 61.69 60.99 2b0f s THR 111 Cb -0.18 -4.24 0.03 0.00 0.01 0.00 0.00 72.50 68.11 2b0f s THR 111 CO 0.89 -0.74 0.61 -0.63 -0.69 0.00 0.00 174.62 174.06 2b0f s ILE 112 N 1.81 4.88 -0.18 1.82 1.01 -1.26 -1.33 121.20 127.93 2b0f s ILE 112 Ca 0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 60.65 60.60 2b0f s ILE 112 Cb -0.26 -4.20 -0.01 0.00 0.01 0.00 0.00 42.46 38.01 2b0f s ILE 112 CO 0.06 -0.61 -0.09 -0.76 0.00 0.00 0.00 174.94 173.53 2b0f s LEU 113 N 2.68 2.74 -0.50 2.97 2.01 0.93 -4.98 118.68 124.53 2b0f s LEU 113 Ca 0.19 -0.40 -0.28 0.00 0.01 0.00 0.00 54.13 53.65 2b0f s LEU 113 Cb -0.16 -1.66 0.02 0.00 0.01 0.00 0.00 46.19 44.40 2b0f s LEU 113 CO 0.17 0.05 1.32 -1.61 1.01 0.00 0.00 176.35 177.29 2b0f s GLU 114 N 1.06 3.51 0.16 1.70 2.02 -1.26 0.57 118.70 126.45 2b0f s GLU 114 Ca 0.00 0.59 0.17 0.00 0.02 0.00 0.00 54.97 55.75 2b0f s GLU 114 Cb -0.15 -4.03 -0.04 0.00 0.10 0.00 0.00 34.13 30.01 2b0f s GLU 114 CO -0.02 -1.67 1.08 -0.24 0.02 0.00 0.00 175.26 174.44 2b0f h VAL 115 N 6.34 0.56 0.00 2.63 3.04 -1.74 -3.48 116.25 123.60 2b0f h VAL 115 Ca -0.26 -1.94 0.00 0.00 -1.01 0.00 0.00 66.70 63.49 2b0f h VAL 115 Cb 1.08 2.11 0.00 0.00 -2.01 0.00 0.00 31.29 32.47 2b0f h VAL 115 CO 1.14 0.32 0.00 0.61 -1.01 0.00 0.00 177.57 178.63 2b0f n GLY 116 N 1.31 1.98 3.65 3.17 0.00 -0.38 -4.45 105.19 110.47 2b0f n GLY 116 Ca -0.04 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 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 3.97 0.11 1.61 0.04 -1.19 -1.07 135.00 138.46 2b0f s PRO 117 Ca 0.00 2.07 0.05 0.00 0.04 0.00 0.00 61.00 63.16 2b0f s PRO 117 Cb 0.00 -4.06 -0.04 0.00 0.04 0.00 0.00 34.50 30.44 2b0f s PRO 117 CO 0.00 -1.11 0.03 0.14 0.04 0.00 0.00 177.00 176.10 2b0f s VAL 118 N 4.82 4.09 -0.16 -0.36 -7.23 0.01 -3.16 120.40 118.41 2b0f s VAL 118 Ca 0.77 -1.04 -0.12 0.00 -1.81 0.00 0.00 61.98 59.79 2b0f s VAL 118 Cb -0.32 -2.99 0.05 0.00 0.56 0.00 0.00 36.38 33.68 2b0f s VAL 118 CO 0.32 0.06 0.41 -0.89 -0.31 0.00 0.00 175.10 174.68 2b0f s THR 119 N -1.43 -0.01 -0.00 5.32 2.01 0.18 -4.79 115.64 116.91 2b0f s THR 119 Ca 0.27 0.04 -0.30 0.00 0.31 0.00 0.00 61.69 62.01 2b0f s THR 119 Cb -0.11 -0.59 -0.06 0.00 0.01 0.00 0.00 72.50 71.75 2b0f s THR 119 CO 0.19 0.02 1.62 -0.32 -0.69 0.00 0.00 174.62 175.44 2b0f s MET 120 N 0.74 4.20 -0.00 4.92 1.75 -1.26 0.14 119.30 129.79 2b0f s MET 120 Ca -0.04 2.21 0.17 0.00 -1.25 0.00 0.00 55.69 56.77 2b0f s MET 120 Cb -0.05 -3.80 -0.18 0.00 2.84 0.00 0.00 34.83 33.63 2b0f s MET 120 CO -0.05 -0.77 0.65 0.00 -0.65 0.00 0.00 175.02 174.20 2b0f n ALA 121 N 6.37 1.89 0.00 4.11 0.00 0.56 -4.83 120.51 128.61 2b0f n ALA 121 Ca 0.16 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.91 2b0f n ALA 121 Cb 0.42 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.07 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 1.46 1.07 3.12 0.00 0.00 -0.66 -4.83 105.19 105.35 2b0f n GLY 122 Ca -0.14 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.59 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 2.27 0.00 0.99 0.20 -1.26 -0.31 118.68 120.56 2b0f s LEU 123 Ca 0.00 -0.71 0.00 0.00 0.69 0.00 0.00 54.13 54.11 2b0f s LEU 123 Cb 0.00 -1.49 -0.00 0.00 -0.43 0.00 0.00 46.19 44.27 2b0f s LEU 123 CO 0.00 -0.02 0.01 2.30 -0.29 0.00 0.00 176.35 178.35 2b0f n ILE 124 N 4.61 0.00 -3.77 6.68 -5.35 -0.16 -4.93 119.36 116.44 2b0f n ILE 124 Ca -0.20 -0.13 -0.37 0.00 -0.27 0.00 0.00 62.75 61.78 2b0f n ILE 124 Cb 0.49 0.05 -0.12 0.00 -1.74 0.00 0.00 39.64 38.32 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 -1.13 5.26 -0.41 7.28 -0.87 -1.26 0.64 114.94 124.45 2b0f s ASN 125 Ca 0.01 -1.21 -0.23 0.00 -1.57 0.00 0.00 52.86 49.86 2b0f s ASN 125 Cb 0.00 -1.85 0.02 0.00 -0.02 0.00 0.00 41.25 39.40 2b0f s ASN 125 CO 0.01 -0.33 0.80 -0.76 -2.57 0.00 0.00 177.10 174.25 2b0f s LEU 126 N 1.37 4.16 -0.05 0.60 2.01 -0.71 -3.75 118.68 122.31 2b0f s LEU 126 Ca -0.02 0.14 0.00 0.00 0.01 0.00 0.00 54.13 54.26 2b0f s LEU 126 Cb -0.20 -3.02 0.00 0.00 0.01 0.00 0.00 46.19 42.98 2b0f s LEU 126 CO 0.02 -0.84 0.00 -0.24 1.01 0.00 0.00 176.35 176.29 2b0f n SER 127 N 6.63 -5.21 -1.28 2.29 2.88 -1.26 -3.15 113.62 114.52 2b0f n SER 127 Ca 0.03 0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 2b0f n SER 127 Cb 0.48 -2.75 0.00 0.00 -0.75 0.00 0.00 64.21 61.19 2b0f n SER 127 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2b0f n SER 128 N -0.73 -1.70 -3.64 -3.46 7.64 -1.25 -5.12 113.62 105.36 2b0f n SER 128 Ca -0.01 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.81 2b0f n SER 128 Cb 0.37 -0.71 -0.07 0.00 -1.01 0.00 0.00 64.21 62.80 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 -2.85 0.00 -0.24 0.44 -1.32 -1.19 -5.09 115.64 105.39 2b0f s THR 129 Ca 0.00 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.19 2b0f s THR 129 Cb 0.00 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.93 2b0f s THR 129 CO 0.00 0.00 2.22 -2.65 -2.21 0.00 0.00 174.62 171.98 2b0f n PRO 130 N 3.86 1.80 -4.63 7.08 -0.02 -1.26 -1.73 135.00 140.09 2b0f n PRO 130 Ca -0.19 0.48 -0.33 0.00 -2.02 0.00 0.00 63.50 61.45 2b0f n PRO 130 Cb 0.58 -3.11 -0.13 0.00 -0.02 0.00 0.00 33.50 30.83 2b0f n PRO 130 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2b0f s THR 131 N 8.21 3.47 0.28 3.45 2.01 0.21 -2.02 115.64 131.23 2b0f s THR 131 Ca 1.03 -0.53 0.09 0.00 0.31 0.00 0.00 61.69 62.58 2b0f s THR 131 Cb -0.43 -2.46 -0.04 0.00 0.01 0.00 0.00 72.50 69.58 2b0f s THR 131 CO 0.38 0.54 0.06 0.21 -0.69 0.00 0.00 174.62 175.11 2b0f s ASN 132 N 0.02 4.78 -0.96 3.53 2.47 -0.70 -0.99 114.94 123.09 2b0f s ASN 132 Ca -0.02 -0.58 -0.04 0.00 0.42 0.00 0.00 52.86 52.63 2b0f s ASN 132 Cb -0.14 -0.94 0.00 0.00 -1.45 0.00 0.00 41.25 38.72 2b0f s ASN 132 CO 0.03 -0.06 0.82 0.54 -3.72 0.00 0.00 177.10 174.72 2b0f n ARG 133 N -1.00 -5.52 -3.40 0.43 1.74 -0.40 -4.78 116.66 103.71 2b0f n ARG 133 Ca -0.06 0.61 -0.38 0.00 -0.77 0.00 0.00 57.85 57.25 2b0f n ARG 133 Cb 0.59 -4.98 -0.06 0.00 -1.02 0.00 0.00 32.46 26.99 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 -5.64 4.11 -0.05 5.56 -1.94 0.57 -0.16 119.30 121.75 2b0f s MET 134 Ca 0.29 0.47 0.05 0.00 -1.71 0.00 0.00 55.69 54.79 2b0f s MET 134 Cb -0.13 -3.30 -0.02 0.00 2.01 0.00 0.00 34.83 33.40 2b0f s MET 134 CO 0.53 0.50 -0.21 -1.50 -0.01 0.00 0.00 175.02 174.33 2b0f s ILE 135 N -0.51 2.41 0.08 2.53 2.07 0.16 -0.32 121.20 127.62 2b0f s ILE 135 Ca 0.25 -0.95 0.03 0.00 -1.41 0.00 0.00 60.65 58.57 2b0f s ILE 135 Cb -0.17 -1.90 -0.04 0.00 0.13 0.00 0.00 42.46 40.49 2b0f s ILE 135 CO 0.13 0.58 0.08 -0.60 -1.91 0.00 0.00 174.94 173.22 2b0f s ARG 136 N -0.41 2.89 0.02 3.50 3.52 0.36 -0.57 118.95 128.27 2b0f s ARG 136 Ca 0.04 -0.69 -0.07 0.00 -0.13 0.00 0.00 55.73 54.88 2b0f s ARG 136 Cb -0.12 -2.73 -0.00 0.00 -1.56 0.00 0.00 34.95 30.54 2b0f s ARG 136 CO 0.02 0.56 0.13 1.52 -0.81 0.00 0.00 175.30 176.72 2b0f s TYR 137 N -1.40 0.11 -0.73 5.12 -0.85 -0.47 0.48 117.35 119.60 2b0f s TYR 137 Ca 0.29 -0.31 -0.27 0.00 -0.52 0.00 0.00 57.07 56.27 2b0f s TYR 137 Cb -0.12 -0.08 0.03 0.00 0.38 0.00 0.00 41.96 42.16 2b0f s TYR 137 CO 0.22 -0.34 1.33 0.34 -1.52 0.00 0.00 175.55 175.57 2b0f s ASP 138 N -1.81 6.09 -0.30 -0.18 -1.08 -1.19 -0.78 116.67 117.42 2b0f s ASP 138 Ca -0.09 -0.39 -0.19 0.00 -0.52 0.00 0.00 52.55 51.36 2b0f s ASP 138 Cb -0.04 -2.56 0.19 0.00 -1.46 0.00 0.00 42.92 39.06 2b0f s ASP 138 CO -0.02 -1.88 1.27 -0.47 0.52 0.00 0.00 175.17 174.59 2b0f s TYR 139 N 6.00 -0.12 -0.09 -5.34 5.04 -1.15 -4.84 117.35 116.84 2b0f s TYR 139 Ca 0.38 0.21 -0.30 0.00 -2.44 0.00 0.00 57.07 54.92 2b0f s TYR 139 Cb -0.08 0.07 -0.04 0.00 0.35 0.00 0.00 41.96 42.26 2b0f s TYR 139 CO 0.15 -0.06 1.47 0.00 -1.34 0.00 0.00 175.55 175.77 2b0f s ALA 140 N 2.09 3.63 0.02 3.97 0.00 -0.93 -2.91 121.76 127.63 2b0f s ALA 140 Ca 0.00 0.74 -0.05 0.00 0.00 0.00 0.00 51.96 52.66 2b0f s ALA 140 Cb -0.01 -3.68 -0.01 0.00 0.00 0.00 0.00 23.12 19.42 2b0f s ALA 140 CO -0.16 -1.25 0.07 -0.08 0.00 0.00 0.00 175.76 174.34 2b0f s THR 141 N 3.62 0.11 0.31 0.00 -1.32 -1.24 -5.03 115.64 112.10 2b0f s THR 141 Ca 0.65 -0.91 0.03 0.00 -1.21 0.00 0.00 61.69 60.24 2b0f s THR 141 Cb -0.28 -0.57 -0.04 0.00 -1.51 0.00 0.00 72.50 70.10 2b0f s THR 141 CO 0.23 -0.50 0.15 -0.54 -2.21 0.00 0.00 174.62 171.75 2b0f s LYS 142 N -1.88 1.61 0.73 7.08 1.02 -1.26 -4.65 119.74 122.39 2b0f s LYS 142 Ca -0.11 -1.92 -0.17 0.00 0.02 0.00 0.00 55.97 53.79 2b0f s LYS 142 Cb -0.06 -0.18 -0.14 0.00 -0.52 0.00 0.00 37.83 36.93 2b0f s LYS 142 CO -0.01 -0.43 -0.47 0.25 -0.92 0.00 0.00 175.35 173.77 2b0f n THR 143 N -0.61 0.00 0.00 2.17 -2.24 -1.26 -2.55 114.28 109.80 2b0f n THR 143 Ca 0.00 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 2b0f n THR 143 Cb 0.65 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 2b0f n THR 143 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b0f n GLY 144 N 2.88 2.86 0.16 3.38 0.00 -1.26 -4.81 105.19 108.41 2b0f n GLY 144 Ca 0.02 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.02 0.74 -2.68 1.61 1.13 -1.06 -4.75 117.38 112.35 2b0f n GLN 145 Ca 0.00 -0.33 -0.37 0.00 -1.94 0.00 0.00 57.00 54.36 2b0f n GLN 145 Cb 0.00 -1.49 -0.06 0.00 0.11 0.00 0.00 30.24 28.80 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 0.53 2.37 3.66 0.00 0.00 0.28 -4.66 105.19 107.37 2b0f n GLY 147 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.56 0.25 3.69 -0.02 0.00 -1.19 -4.41 105.19 102.94 2b0f n GLY 148 Ca 0.00 0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.20 5.13 -0.50 1.61 1.01 0.48 1.00 120.40 127.93 2b0f s VAL 149 Ca 0.61 1.00 -0.20 0.00 0.00 0.00 0.00 61.98 63.39 2b0f s VAL 149 Cb -0.54 -3.85 0.05 0.00 0.00 0.00 0.00 36.38 32.03 2b0f s VAL 149 CO 0.58 0.24 0.67 -0.22 0.00 0.00 0.00 175.10 176.36 2b0f s LEU 150 N 1.20 4.75 0.00 3.92 2.96 0.18 -0.72 118.68 130.97 2b0f s LEU 150 Ca 0.26 -0.71 -0.02 0.00 -0.22 0.00 0.00 54.13 53.44 2b0f s LEU 150 Cb -0.15 -2.55 0.01 0.00 0.50 0.00 0.00 46.19 43.99 2b0f s LEU 150 CO 0.10 -0.90 0.33 0.00 -1.32 0.00 0.00 176.35 174.56 2b0f s ALA 152 N -2.33 0.07 -0.10 0.00 0.00 0.81 0.16 121.76 120.37 2b0f s ALA 152 Ca 0.19 -1.10 -0.29 0.00 0.00 0.00 0.00 51.96 50.75 2b0f s ALA 152 Cb -0.01 1.04 -0.06 0.00 0.00 0.00 0.00 23.12 24.09 2b0f s ALA 152 CO 0.13 -0.85 1.98 -0.08 0.00 0.00 0.00 175.76 176.95 2b0f s THR 153 N -3.37 3.15 0.00 0.00 -1.32 -1.26 -1.90 115.64 110.93 2b0f s THR 153 Ca 0.24 0.17 0.00 0.00 -1.21 0.00 0.00 61.69 60.89 2b0f s THR 153 Cb -0.01 -3.15 0.00 0.00 -1.51 0.00 0.00 72.50 67.83 2b0f s THR 153 CO 0.14 -0.05 0.00 0.61 -2.21 0.00 0.00 174.62 173.10 2b0f n GLY 154 N 4.97 0.82 3.49 6.08 0.00 -1.26 -5.01 105.19 114.28 2b0f n GLY 154 Ca 0.23 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.13 0.75 -0.08 1.61 -2.85 -0.80 -4.64 119.74 113.60 2b0f s LYS 155 Ca 0.00 0.69 0.00 0.00 -1.00 0.00 0.00 55.97 55.67 2b0f s LYS 155 Cb 0.00 0.36 -0.03 0.00 -2.06 0.00 0.00 37.83 36.10 2b0f s LYS 155 CO 0.00 -0.13 -0.07 0.42 0.10 0.00 0.00 175.35 175.68 2b0f s ILE 156 N 0.00 3.70 -0.17 3.79 1.01 0.34 -0.13 121.20 129.74 2b0f s ILE 156 Ca -0.02 -0.47 0.02 0.00 0.00 0.00 0.00 60.65 60.17 2b0f s ILE 156 Cb -0.04 -2.52 -0.12 0.00 0.01 0.00 0.00 42.46 39.79 2b0f s ILE 156 CO 0.02 0.59 -0.14 0.49 0.00 0.00 0.00 174.94 175.90 2b0f n PHE 157 N 2.37 0.00 -3.22 3.97 3.72 0.30 -1.93 117.46 122.67 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 0.53 -0.67 0.00 0.00 -0.94 0.00 0.00 39.48 38.40 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 2.63 -1.11 3.12 1.37 0.00 -0.79 -0.82 105.19 109.59 2b0f n GLY 158 Ca -0.30 -0.85 -0.22 0.00 0.00 0.00 0.00 46.02 44.65 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 1.11 -0.36 -0.61 -4.36 -1.06 0.51 121.20 113.43 2b0f s ILE 159 Ca 0.00 -0.72 -0.28 0.00 -0.26 0.00 0.00 60.65 59.39 2b0f s ILE 159 Cb 0.00 -0.95 -0.03 0.00 1.25 0.00 0.00 42.46 42.73 2b0f s ILE 159 CO 0.00 0.22 1.97 -2.28 0.24 0.00 0.00 174.94 175.09 2b0f s HIS 160 N -0.49 1.56 -0.13 1.37 5.65 0.28 -1.40 115.29 122.13 2b0f s HIS 160 Ca 0.04 0.73 0.22 0.00 0.25 0.00 0.00 55.06 56.30 2b0f s HIS 160 Cb -0.06 -4.02 -0.19 0.00 -1.18 0.00 0.00 32.58 27.14 2b0f s HIS 160 CO 0.00 -3.08 0.71 1.33 -0.65 0.00 0.00 174.74 173.05 2b0f n VAL 161 N 7.53 0.42 0.00 0.89 0.24 -0.98 1.00 118.33 127.42 2b0f n VAL 161 Ca 0.26 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 2b0f n VAL 161 Cb 0.48 -0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 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 1.27 -0.82 3.61 7.63 0.00 -0.75 -4.82 105.19 111.31 2b0f n GLY 162 Ca -0.05 -0.25 -0.02 0.00 0.00 0.00 0.00 46.02 45.71 2b0f n GLY 162 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b0f s GLY 163 N 0.00 -0.32 -0.41 -0.02 0.00 -1.26 -0.95 107.32 104.35 2b0f s GLY 163 Ca 0.00 1.38 0.03 0.00 0.00 0.00 0.00 44.72 46.13 2b0f s GLY 163 CO 0.00 0.42 0.16 0.21 0.00 0.00 0.00 173.10 173.89 2b0f s ASN 164 N -2.42 4.31 1.05 1.64 2.47 0.11 -4.85 114.94 117.24 2b0f s ASN 164 Ca 0.12 -2.46 0.00 0.00 0.42 0.00 0.00 52.86 50.94 2b0f s ASN 164 Cb 0.01 -1.41 0.00 0.00 -1.45 0.00 0.00 41.25 38.40 2b0f s ASN 164 CO -0.04 -0.31 0.00 0.61 -3.72 0.00 0.00 177.10 173.63 2b0f n GLY 165 N 3.82 1.27 0.15 1.21 0.00 -1.26 -2.04 105.19 108.33 2b0f n GLY 165 Ca 0.04 0.22 0.11 0.00 0.00 0.00 0.00 46.02 46.39 2b0f n GLY 165 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2b0f n ARG 166 N 0.00 0.38 -4.44 1.61 0.00 -1.26 -3.61 116.66 109.35 2b0f n ARG 166 Ca 0.00 -0.30 -0.34 0.00 -0.00 0.00 0.00 57.85 57.22 2b0f n ARG 166 Cb 0.00 -1.49 -0.12 0.00 0.00 0.00 0.00 32.46 30.85 2b0f n ARG 166 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2b0f s GLN 167 N -2.82 3.42 0.32 -0.14 1.11 -0.87 -2.20 119.66 118.48 2b0f s GLN 167 Ca 0.13 -0.51 -0.15 0.00 0.01 0.00 0.00 55.36 54.84 2b0f s GLN 167 Cb 0.17 -2.84 -0.09 0.00 -1.01 0.00 0.00 33.01 29.24 2b0f s GLN 167 CO 0.74 0.38 0.74 0.20 0.01 0.00 0.00 175.29 177.36 2b0f s GLY 168 N -0.01 2.34 -0.08 3.09 0.00 0.04 0.05 107.32 112.75 2b0f s GLY 168 Ca 0.01 0.05 -0.00 0.00 0.00 0.00 0.00 44.72 44.78 2b0f s GLY 168 CO 0.03 0.26 -0.04 -1.36 0.00 0.00 0.00 173.10 171.98 2b0f s PHE 169 N -1.98 0.97 0.13 1.90 0.40 -0.13 -1.37 117.98 117.90 2b0f s PHE 169 Ca 0.54 -0.37 0.10 0.00 -0.60 0.00 0.00 56.93 56.61 2b0f s PHE 169 Cb -0.10 -0.91 -0.04 0.00 0.51 0.00 0.00 43.02 42.47 2b0f s PHE 169 CO 0.17 -0.35 -0.22 0.45 0.70 0.00 0.00 175.22 175.98 2b0f s SER 170 N 1.59 3.64 -0.14 1.36 0.15 0.27 -1.80 113.70 118.77 2b0f s SER 170 Ca 0.00 -0.67 -0.19 0.00 0.70 0.00 0.00 55.95 55.80 2b0f s SER 170 Cb -0.13 -0.40 -0.04 0.00 -1.71 0.00 0.00 66.02 63.74 2b0f s SER 170 CO -0.04 0.17 0.52 0.00 1.20 0.00 0.00 173.24 175.08 2b0f s ALA 171 N -1.19 3.48 -0.03 5.45 0.00 -0.49 0.36 121.76 129.33 2b0f s ALA 171 Ca 0.17 -0.21 -0.30 0.00 0.00 0.00 0.00 51.96 51.62 2b0f s ALA 171 Cb -0.10 -2.74 -0.07 0.00 0.00 0.00 0.00 23.12 20.21 2b0f s ALA 171 CO 0.09 -0.15 1.87 -0.65 0.00 0.00 0.00 175.76 176.92 2b0f s GLN 172 N 0.95 4.05 -1.08 0.00 -0.21 0.77 -2.56 119.66 121.58 2b0f s GLN 172 Ca 0.27 2.36 -0.17 0.00 0.02 0.00 0.00 55.36 57.84 2b0f s GLN 172 Cb -0.15 -4.12 0.13 0.00 1.00 0.00 0.00 33.01 29.87 2b0f s GLN 172 CO 0.11 -1.04 1.34 -0.51 -2.12 0.00 0.00 175.29 173.07 2b0f s LEU 173 N 4.70 4.77 -0.03 2.90 1.43 -0.00 -4.94 118.68 127.51 2b0f s LEU 173 Ca 0.83 -2.39 -0.20 0.00 -1.03 0.00 0.00 54.13 51.34 2b0f s LEU 173 Cb -0.38 -2.44 -0.05 0.00 0.03 0.00 0.00 46.19 43.36 2b0f s LEU 173 CO 0.36 -1.00 0.57 -0.54 0.23 0.00 0.00 176.35 175.97 2b0f s LYS 174 N 2.64 4.30 0.64 1.70 1.02 -1.26 -4.47 119.74 124.32 2b0f s LYS 174 Ca 0.40 0.67 0.22 0.00 0.02 0.00 0.00 55.97 57.28 2b0f s LYS 174 Cb -0.03 -3.36 1.22 0.00 -0.52 0.00 0.00 37.83 35.14 2b0f s LYS 174 CO -0.04 0.32 1.68 -0.22 -0.92 0.00 0.00 175.35 176.17 2b0f h LYS 175 N 5.88 0.00 -0.73 1.68 3.64 -1.82 -2.81 116.57 122.42 2b0f h LYS 175 Ca -0.44 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.05 2b0f h LYS 175 Cb 1.20 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.94 2b0f h LYS 175 CO 0.71 0.00 0.34 1.96 -2.27 0.00 0.00 179.45 180.19 2b0f h GLN 176 N 0.00 0.54 0.00 1.90 4.20 -1.96 -2.49 115.11 117.30 2b0f h GLN 176 Ca 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2b0f h GLN 176 Cb 0.95 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.61 2b0f h GLN 176 CO 0.00 0.35 0.00 0.66 -0.67 0.00 0.00 178.83 179.17 2b0f n TYR 177 N -4.91 0.00 -0.46 2.96 4.01 -1.06 -3.53 117.16 114.17 2b0f n TYR 177 Ca 0.12 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.93 2b0f n TYR 177 Cb 0.32 -0.45 0.22 0.00 -0.31 0.00 0.00 39.34 39.11 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 -1.45 0.75 0.00 -0.72 3.72 -0.94 -4.47 117.46 114.34 2b0f n PHE 178 Ca 0.08 -0.61 -0.22 0.00 -0.05 0.00 0.00 57.45 56.64 2b0f n PHE 178 Cb 0.28 -0.13 -0.14 0.00 -0.94 0.00 0.00 39.48 38.56 2b0f n PHE 178 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 2b0f h VAL 179 N 2.34 0.81 0.00 -4.37 3.04 -1.60 -3.38 116.25 113.10 2b0f h VAL 179 Ca 0.00 -2.36 0.00 0.00 -1.01 0.00 0.00 66.70 63.33 2b0f h VAL 179 Cb 1.03 2.55 0.00 0.00 -2.01 0.00 0.00 31.29 32.86 2b0f h VAL 179 CO 0.09 0.76 -0.66 -0.62 -1.01 0.00 0.00 177.57 176.13 2b0f n GLU 180 N -3.75 0.10 -2.42 4.17 4.71 -1.26 -4.94 120.64 117.25 2b0f n GLU 180 Ca -0.29 0.01 -0.41 0.00 -0.01 0.00 0.00 57.16 56.46 2b0f n GLU 180 Cb 0.96 -1.55 -0.04 0.00 -1.01 0.00 0.00 31.44 29.81 2b0f n GLU 180 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 2b0f s LYS 181 N -3.06 4.56 0.00 3.49 2.47 -1.26 -5.24 119.74 120.70 2b0f s LYS 181 Ca 0.09 1.84 0.00 0.00 -1.56 0.00 0.00 55.97 56.34 2b0f s LYS 181 Cb 0.16 -3.22 0.00 0.00 -1.46 0.00 0.00 37.83 33.32 2b0f s LYS 181 CO 0.74 0.05 0.00 1.04 0.16 0.00 0.00 175.35 177.34