#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 -0.15 -0.23 1.61 0.13 -2.03 0.38 132.00 131.71 2b0f h PRO 2 Ca 0.00 0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 65.07 2b0f h PRO 2 Cb 0.00 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.16 2b0f h PRO 2 CO 0.00 -0.10 -0.12 -0.97 -0.23 0.00 0.00 178.00 176.58 2b0f h ASN 3 N -0.16 0.50 -0.69 1.44 -0.73 -1.95 -1.88 115.58 112.12 2b0f h ASN 3 Ca 0.12 -0.42 0.05 0.00 1.87 0.00 0.00 56.30 57.92 2b0f h ASN 3 Cb 0.33 -0.14 -0.05 0.00 0.27 0.00 0.00 38.32 38.73 2b0f h ASN 3 CO -0.29 0.81 0.41 0.74 -0.37 0.00 0.00 177.43 178.72 2b0f h THR 4 N 0.19 1.02 0.00 -3.57 2.02 -1.90 0.14 112.91 110.83 2b0f h THR 4 Ca 0.05 -0.26 -0.08 0.00 0.77 0.00 0.00 66.41 66.89 2b0f h THR 4 Cb 0.63 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 2b0f h THR 4 CO 0.04 0.14 -0.36 -0.33 0.37 0.00 0.00 175.52 175.37 2b0f h GLU 5 N 0.77 0.00 -0.09 6.66 5.08 -0.24 -0.60 114.58 126.16 2b0f h GLU 5 Ca 0.30 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.51 2b0f h GLU 5 Cb 0.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.38 2b0f h GLU 5 CO -0.15 0.36 -0.53 0.35 -1.00 0.00 0.00 179.01 178.04 2b0f h PHE 6 N 0.00 0.70 -0.07 4.33 3.57 -0.75 -2.23 116.94 122.48 2b0f h PHE 6 Ca -0.00 -0.32 0.00 0.00 3.53 0.00 0.00 57.97 61.18 2b0f h PHE 6 Cb 1.13 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.76 2b0f h PHE 6 CO 0.00 1.10 0.04 0.00 -2.23 0.00 0.00 178.31 177.23 2b0f h ALA 7 N 0.45 0.09 -0.96 2.41 0.00 -0.63 0.18 119.26 120.80 2b0f h ALA 7 Ca -0.04 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2b0f h ALA 7 Cb 1.18 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 2b0f h ALA 7 CO 0.11 -0.42 0.63 1.25 0.00 0.00 0.00 179.25 180.82 2b0f h LEU 8 N 0.09 1.08 -0.11 0.00 7.12 -1.16 0.27 115.31 122.60 2b0f h LEU 8 Ca 0.03 -0.02 -0.04 0.00 0.13 0.00 0.00 57.88 57.97 2b0f h LEU 8 Cb -0.00 -0.26 -0.00 0.00 -0.53 0.00 0.00 40.66 39.86 2b0f h LEU 8 CO -0.01 0.76 -0.10 -1.28 -0.13 0.00 0.00 178.44 177.69 2b0f h SER 9 N 1.26 0.27 -0.83 1.25 0.87 -1.08 -2.85 113.55 112.44 2b0f h SER 9 Ca 0.36 -0.47 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 2b0f h SER 9 Cb -0.09 -0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 61.75 2b0f h SER 9 CO -0.09 0.68 0.53 0.25 -0.53 0.00 0.00 176.83 177.67 2b0f h LEU 10 N -0.14 0.98 -0.29 2.23 5.85 -0.28 -2.38 115.31 121.28 2b0f h LEU 10 Ca 0.02 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.75 2b0f h LEU 10 Cb 0.60 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 2b0f h LEU 10 CO 0.02 0.73 0.00 0.25 -0.34 0.00 0.00 178.44 179.11 2b0f h LEU 11 N 1.14 -0.10 -1.26 2.25 5.85 -0.41 0.91 115.31 123.68 2b0f h LEU 11 Ca 0.30 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 59.01 2b0f h LEU 11 Cb -0.09 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2b0f h LEU 11 CO -0.06 -0.02 -0.34 0.03 -0.34 0.00 0.00 178.44 177.71 2b0f h ARG 12 N 0.09 0.00 0.00 1.25 3.08 -1.24 -2.94 114.38 114.62 2b0f h ARG 12 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2b0f h ARG 12 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2b0f h ARG 12 CO -0.23 0.34 -0.22 0.87 -1.07 0.00 0.00 179.97 179.66 2b0f h LYS 13 N 0.00 0.00 -0.00 0.04 1.79 -0.89 -3.45 116.57 114.06 2b0f h LYS 13 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2b0f h LYS 13 Cb 0.69 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 2b0f h LYS 13 CO 0.04 0.00 -0.09 0.09 -1.08 0.00 0.00 179.45 178.42 2b0f n ASN 14 N -3.82 1.04 -4.75 0.86 4.13 0.25 -4.75 115.26 108.22 2b0f n ASN 14 Ca -0.03 -1.02 -0.35 0.00 1.68 0.00 0.00 54.58 54.85 2b0f n ASN 14 Cb 0.12 0.36 -0.08 0.00 -1.54 0.00 0.00 39.78 38.64 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 -0.85 5.42 -0.07 2.41 1.01 -1.10 -0.44 121.20 127.58 2b0f s ILE 15 Ca 0.05 0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.73 2b0f s ILE 15 Cb 0.05 -3.46 0.04 0.00 0.01 0.00 0.00 42.46 39.09 2b0f s ILE 15 CO 0.12 0.47 0.40 0.00 0.00 0.00 0.00 174.94 175.92 2b0f s MET 16 N 0.16 0.65 -0.13 2.79 0.23 0.01 -4.72 119.30 118.28 2b0f s MET 16 Ca 0.09 0.14 -0.29 0.00 -1.03 0.00 0.00 55.69 54.60 2b0f s MET 16 Cb -0.11 0.30 -0.04 0.00 -1.53 0.00 0.00 34.83 33.45 2b0f s MET 16 CO -0.01 -0.16 1.60 0.99 -2.03 0.00 0.00 175.02 175.41 2b0f s THR 17 N -0.76 3.70 -0.59 3.16 2.01 -1.26 -0.89 115.64 121.01 2b0f s THR 17 Ca -0.08 0.82 -0.16 0.00 0.31 0.00 0.00 61.69 62.58 2b0f s THR 17 Cb -0.04 -3.61 0.13 0.00 0.01 0.00 0.00 72.50 69.00 2b0f s THR 17 CO 0.04 -0.16 0.59 -0.63 -0.69 0.00 0.00 174.62 173.76 2b0f s ILE 18 N 4.50 5.16 -0.65 1.82 1.01 0.14 0.67 121.20 133.85 2b0f s ILE 18 Ca 0.71 -1.50 -0.26 0.00 0.00 0.00 0.00 60.65 59.59 2b0f s ILE 18 Cb -0.29 -4.40 -0.02 0.00 0.01 0.00 0.00 42.46 37.77 2b0f s ILE 18 CO 0.28 -0.96 1.81 -0.89 0.00 0.00 0.00 174.94 175.17 2b0f s THR 19 N 1.70 3.40 0.33 2.92 2.01 0.02 -1.76 115.64 124.26 2b0f s THR 19 Ca 0.07 0.17 0.05 0.00 0.31 0.00 0.00 61.69 62.30 2b0f s THR 19 Cb -0.26 -4.05 0.06 0.00 0.01 0.00 0.00 72.50 68.25 2b0f s THR 19 CO 0.02 -1.02 0.46 0.41 -0.69 0.00 0.00 174.62 173.81 2b0f n THR 20 N 7.17 0.00 0.17 -0.82 -1.04 0.15 -2.64 114.28 117.27 2b0f n THR 20 Ca 0.20 -1.10 0.02 0.00 -2.04 0.00 0.00 64.05 61.13 2b0f n THR 20 Cb 0.51 -0.73 0.29 0.00 -1.82 0.00 0.00 70.33 68.58 2b0f n THR 20 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2b0f h SER 21 N 0.05 0.00 0.06 8.00 0.02 -1.49 -3.29 113.55 116.90 2b0f h SER 21 Ca -0.16 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.53 2b0f h SER 21 Cb 0.71 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 2b0f h SER 21 CO 0.22 0.46 -1.40 0.50 -1.14 0.00 0.00 176.83 175.47 2b0f h LYS 22 N 0.00 0.14 0.00 3.45 3.64 -1.64 -3.50 116.57 118.66 2b0f h LYS 22 Ca -0.00 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 2b0f h LYS 22 Cb 0.88 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 2b0f h LYS 22 CO 0.06 1.11 0.00 0.41 -2.27 0.00 0.00 179.45 178.76 2b0f n GLY 23 N 1.66 1.73 3.22 5.01 0.00 -1.24 -5.11 105.19 110.47 2b0f n GLY 23 Ca -0.29 -0.91 -0.39 0.00 0.00 0.00 0.00 46.02 44.43 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 -1.42 2.46 0.38 1.61 2.02 -1.26 0.34 118.70 122.83 2b0f s GLU 24 Ca 0.00 -1.59 0.05 0.00 0.02 0.00 0.00 54.97 53.45 2b0f s GLU 24 Cb 0.00 -3.75 -0.00 0.00 0.10 0.00 0.00 34.13 30.47 2b0f s GLU 24 CO 0.00 -1.02 0.54 -0.06 0.02 0.00 0.00 175.26 174.74 2b0f s PHE 25 N 1.35 3.12 -0.51 1.61 0.40 -0.72 -2.02 117.98 121.21 2b0f s PHE 25 Ca 0.04 -0.09 -0.26 0.00 -0.60 0.00 0.00 56.93 56.02 2b0f s PHE 25 Cb -0.24 -2.13 0.03 0.00 0.51 0.00 0.00 43.02 41.19 2b0f s PHE 25 CO 0.00 -0.16 1.03 0.99 0.70 0.00 0.00 175.22 177.78 2b0f s THR 26 N -2.32 4.30 -0.13 0.64 2.01 -1.25 0.27 115.64 119.16 2b0f s THR 26 Ca 0.47 0.77 -0.05 0.00 0.31 0.00 0.00 61.69 63.18 2b0f s THR 26 Cb -0.10 -4.56 -0.04 0.00 0.01 0.00 0.00 72.50 67.82 2b0f s THR 26 CO 0.33 -1.05 0.06 -0.83 -0.69 0.00 0.00 174.62 172.44 2b0f s GLY 27 N 2.59 1.95 -0.04 4.40 0.00 -0.07 -4.65 107.32 111.50 2b0f s GLY 27 Ca 0.39 -0.74 0.05 0.00 0.00 0.00 0.00 44.72 44.42 2b0f s GLY 27 CO 0.26 -0.30 -0.19 0.48 0.00 0.00 0.00 173.10 173.34 2b0f s LEU 28 N -0.49 1.96 0.31 0.66 2.34 -1.18 -0.81 118.68 121.47 2b0f s LEU 28 Ca 0.10 -0.39 -0.27 0.00 0.06 0.00 0.00 54.13 53.63 2b0f s LEU 28 Cb -0.12 -1.06 -0.09 0.00 -0.56 0.00 0.00 46.19 44.36 2b0f s LEU 28 CO 0.02 0.18 1.00 -0.83 -1.06 0.00 0.00 176.35 175.66 2b0f s GLY 29 N -0.05 2.92 -0.23 -3.48 0.00 0.41 -1.45 107.32 105.46 2b0f s GLY 29 Ca -0.03 0.67 -0.16 0.00 0.00 0.00 0.00 44.72 45.21 2b0f s GLY 29 CO 0.02 1.18 -0.27 1.39 0.00 0.00 0.00 173.10 175.42 2b0f n ILE 30 N 0.79 1.51 -3.64 0.90 2.08 0.42 -4.77 119.36 116.64 2b0f n ILE 30 Ca 0.01 -0.11 -0.09 0.00 0.56 0.00 0.00 62.75 63.12 2b0f n ILE 30 Cb 0.48 -2.10 -0.07 0.00 -0.75 0.00 0.00 39.64 37.20 2b0f n ILE 30 CO 0.00 0.00 0.00 -1.38 0.56 0.00 0.00 176.55 175.73 2b0f s HIS 31 N -2.60 -0.50 0.00 1.39 -3.43 -1.12 -0.56 115.29 108.46 2b0f s HIS 31 Ca -0.32 1.19 0.00 0.00 -0.80 0.00 0.00 55.06 55.13 2b0f s HIS 31 Cb 0.09 0.36 0.00 0.00 -1.43 0.00 0.00 32.58 31.60 2b0f s HIS 31 CO 0.46 -0.24 0.00 -0.25 -2.00 0.00 0.00 174.74 172.71 2b0f n ASP 32 N 2.42 0.00 0.00 7.38 8.00 -0.28 -0.40 116.55 133.67 2b0f n ASP 32 Ca -0.13 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.37 2b0f n ASP 32 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 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 0.95 -3.05 -1.24 0.00 -1.26 -0.92 116.66 111.15 2b0f n ARG 33 Ca 0.00 -0.86 -0.41 0.00 -0.00 0.00 0.00 57.85 56.58 2b0f n ARG 33 Cb 0.00 -0.86 -0.06 0.00 -0.00 0.00 0.00 32.46 31.54 2b0f n ARG 33 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2b0f s VAL 34 N -0.42 4.95 0.00 8.89 1.01 0.47 -0.53 120.40 134.76 2b0f s VAL 34 Ca 0.00 1.27 0.04 0.00 0.00 0.00 0.00 61.98 63.29 2b0f s VAL 34 Cb 0.00 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 2b0f s VAL 34 CO 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 175.10 175.00 2b0f s VAL 36 N -0.39 1.46 0.22 0.00 -7.23 -0.53 0.71 120.40 114.65 2b0f s VAL 36 Ca 0.03 -1.52 -0.14 0.00 -1.81 0.00 0.00 61.98 58.54 2b0f s VAL 36 Cb -0.05 -1.41 0.00 0.00 0.56 0.00 0.00 36.38 35.48 2b0f s VAL 36 CO -0.00 -0.19 0.47 0.27 -0.31 0.00 0.00 175.10 175.34 2b0f s ILE 37 N -1.42 0.02 1.31 -0.62 -4.36 -1.06 -3.11 121.20 111.96 2b0f s ILE 37 Ca 0.05 -1.22 -0.19 0.00 -0.26 0.00 0.00 60.65 59.03 2b0f s ILE 37 Cb -0.09 -1.97 0.33 0.00 1.25 0.00 0.00 42.46 41.98 2b0f s ILE 37 CO 0.04 -0.08 0.99 -2.84 0.24 0.00 0.00 174.94 173.28 2b0f s PRO 38 N -3.97 -2.02 0.05 0.37 0.02 -1.26 0.48 135.00 128.67 2b0f s PRO 38 Ca 0.17 0.33 -0.08 0.00 0.02 0.00 0.00 61.00 61.44 2b0f s PRO 38 Cb -0.00 -1.47 -0.31 0.00 0.02 0.00 0.00 34.50 32.74 2b0f s PRO 38 CO 0.04 -4.32 1.05 1.15 -0.33 0.00 0.00 177.00 174.59 2b0f h THR 39 N -3.03 1.38 0.00 0.99 2.02 -1.68 -3.25 112.91 109.34 2b0f h THR 39 Ca -0.50 -2.91 0.00 0.00 0.77 0.00 0.00 66.41 63.77 2b0f h THR 39 Cb 1.33 2.96 0.00 0.00 -1.74 0.00 0.00 68.15 70.70 2b0f h THR 39 CO 0.37 0.86 0.00 0.00 0.37 0.00 0.00 175.52 177.12 2b0f n HIS 40 N -3.59 0.00 0.19 3.16 1.44 -1.26 -2.92 115.22 112.23 2b0f n HIS 40 Ca -0.12 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.62 2b0f n HIS 40 Cb 1.06 0.00 0.36 0.00 0.12 0.00 0.00 29.99 31.52 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 1.20 -5.28 1.59 0.00 -1.93 -3.45 119.26 114.13 2b0f h ALA 41 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2b0f h ALA 41 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2b0f h ALA 41 CO 0.00 0.49 -0.14 1.04 0.00 0.00 0.00 179.25 180.64 2b0f n GLN 42 N -3.86 -1.58 -2.54 0.00 6.02 -1.15 -2.41 117.38 111.87 2b0f n GLN 42 Ca -0.01 1.64 -0.43 0.00 -0.01 0.00 0.00 57.00 58.20 2b0f n GLN 42 Cb 0.45 -5.62 -0.02 0.00 1.02 0.00 0.00 30.24 26.06 2b0f n GLN 42 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 2b0f s PRO 43 N -2.88 4.33 0.20 -1.09 0.02 -1.26 -2.18 135.00 132.14 2b0f s PRO 43 Ca 0.07 1.55 -0.03 0.00 0.02 0.00 0.00 61.00 62.61 2b0f s PRO 43 Cb -0.02 -3.60 0.04 0.00 0.02 0.00 0.00 34.50 30.94 2b0f s PRO 43 CO 0.73 -0.49 0.27 0.41 -0.33 0.00 0.00 177.00 177.59 2b0f n GLY 44 N 3.33 -0.99 0.12 0.52 0.00 -1.26 -4.96 105.19 101.94 2b0f n GLY 44 Ca 0.11 -1.71 0.12 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.33 0.00 -3.26 1.61 3.32 -1.95 -3.42 116.42 112.39 2b0f h ASP 45 Ca -0.09 -0.07 -0.52 0.00 0.02 0.00 0.00 57.03 56.37 2b0f h ASP 45 Cb 0.24 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.39 2b0f h ASP 45 CO 0.06 0.04 -0.76 -0.62 -1.72 0.00 0.00 179.24 176.24 2b0f s ASP 46 N -4.97 2.91 0.17 6.45 2.15 -1.26 -0.40 116.67 121.71 2b0f s ASP 46 Ca 0.06 -0.83 0.07 0.00 0.43 0.00 0.00 52.55 52.28 2b0f s ASP 46 Cb 0.10 -0.58 -0.04 0.00 -0.30 0.00 0.00 42.92 42.11 2b0f s ASP 46 CO 0.70 -0.31 0.03 0.68 -0.17 0.00 0.00 175.17 176.10 2b0f s VAL 47 N 1.87 3.91 -0.56 1.11 -7.23 -0.16 -4.87 120.40 114.47 2b0f s VAL 47 Ca -0.01 -1.33 -0.16 0.00 -1.81 0.00 0.00 61.98 58.68 2b0f s VAL 47 Cb -0.17 -2.97 0.13 0.00 0.56 0.00 0.00 36.38 33.93 2b0f s VAL 47 CO -0.08 -0.10 0.53 -0.76 -0.31 0.00 0.00 175.10 174.38 2b0f s LEU 48 N -2.95 6.12 -0.89 1.32 1.43 -1.08 -0.53 118.68 122.10 2b0f s LEU 48 Ca 0.28 -1.79 -0.23 0.00 -1.03 0.00 0.00 54.13 51.36 2b0f s LEU 48 Cb -0.10 -2.22 0.06 0.00 0.03 0.00 0.00 46.19 43.97 2b0f s LEU 48 CO 0.20 -0.88 1.28 0.68 0.23 0.00 0.00 176.35 177.86 2b0f s VAL 49 N 1.66 4.09 -1.23 -1.59 -7.23 0.14 -0.80 120.40 115.45 2b0f s VAL 49 Ca 0.05 -0.61 0.00 0.00 -1.81 0.00 0.00 61.98 59.61 2b0f s VAL 49 Cb -0.29 -4.92 0.00 0.00 0.56 0.00 0.00 36.38 31.74 2b0f s VAL 49 CO 0.03 -1.77 0.00 -3.20 -0.31 0.00 0.00 175.10 169.85 2b0f n ASN 50 N 8.36 -4.81 0.00 4.85 5.15 0.21 -2.21 115.26 126.81 2b0f n ASN 50 Ca 0.19 0.29 0.00 0.00 -0.60 0.00 0.00 54.58 54.46 2b0f n ASN 50 Cb 0.49 -3.33 0.00 0.00 -0.53 0.00 0.00 39.78 36.41 2b0f n ASN 50 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2b0f n GLY 51 N -1.00 1.85 3.64 8.20 0.00 -1.24 -5.05 105.19 111.58 2b0f n GLY 51 Ca -0.12 0.00 -0.42 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 0.00 4.10 -0.25 1.61 1.11 -0.94 -4.93 119.66 120.36 2b0f s GLN 52 Ca 0.00 0.96 -0.27 0.00 0.01 0.00 0.00 55.36 56.06 2b0f s GLN 52 Cb 0.00 -3.70 0.01 0.00 -1.01 0.00 0.00 33.01 28.31 2b0f s GLN 52 CO 0.00 -0.71 0.96 -1.59 0.01 0.00 0.00 175.29 173.96 2b0f s LYS 53 N 3.21 4.19 -0.05 2.91 0.00 -1.26 0.24 119.74 128.98 2b0f s LYS 53 Ca 0.39 1.14 0.02 0.00 0.00 0.00 0.00 55.97 57.52 2b0f s LYS 53 Cb -0.14 -3.66 0.02 0.00 0.00 0.00 0.00 37.83 34.05 2b0f s LYS 53 CO 0.11 -0.63 -0.09 -1.50 0.00 0.00 0.00 175.35 173.24 2b0f s ILE 54 N 3.13 0.84 -0.12 3.79 2.07 0.31 -4.96 121.20 126.26 2b0f s ILE 54 Ca 0.41 -0.32 -0.24 0.00 -1.41 0.00 0.00 60.65 59.09 2b0f s ILE 54 Cb -0.15 -0.80 -0.03 0.00 0.13 0.00 0.00 42.46 41.62 2b0f s ILE 54 CO 0.08 0.29 0.75 -0.13 -1.91 0.00 0.00 174.94 174.02 2b0f s ARG 55 N 0.69 4.35 0.31 3.50 0.52 -1.26 -0.99 118.95 126.08 2b0f s ARG 55 Ca -0.12 0.92 -0.27 0.00 -0.52 0.00 0.00 55.73 55.74 2b0f s ARG 55 Cb -0.14 -3.52 -0.10 0.00 0.52 0.00 0.00 34.95 31.71 2b0f s ARG 55 CO 0.02 -0.14 0.97 0.54 0.02 0.00 0.00 175.30 176.71 2b0f s VAL 56 N 1.51 4.06 -0.11 3.52 0.11 0.47 -4.80 120.40 125.17 2b0f s VAL 56 Ca 0.37 1.81 -0.22 0.00 -2.93 0.00 0.00 61.98 61.01 2b0f s VAL 56 Cb -0.17 -4.04 -0.19 0.00 -1.53 0.00 0.00 36.38 30.45 2b0f s VAL 56 CO 0.15 0.23 0.67 0.50 -3.33 0.00 0.00 175.10 173.32 2b0f h LYS 57 N 3.38 -0.04 -3.33 1.54 3.64 -1.64 -3.47 116.57 116.66 2b0f h LYS 57 Ca -0.47 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 58.63 2b0f h LYS 57 Cb 1.20 0.01 -0.34 0.00 -0.41 0.00 0.00 32.23 32.68 2b0f h LYS 57 CO 0.66 0.62 -0.67 0.34 -2.27 0.00 0.00 179.45 178.13 2b0f s ASP 58 N -5.91 0.30 -0.40 4.20 2.15 -1.23 -5.04 116.67 110.73 2b0f s ASP 58 Ca -0.14 0.18 -0.07 0.00 0.43 0.00 0.00 52.55 52.96 2b0f s ASP 58 Cb -0.01 0.06 0.08 0.00 -0.30 0.00 0.00 42.92 42.75 2b0f s ASP 58 CO 0.51 -0.18 0.21 -1.59 -0.17 0.00 0.00 175.17 173.96 2b0f s LYS 59 N 1.49 2.44 -0.26 4.34 -2.85 -1.26 -1.01 119.74 122.64 2b0f s LYS 59 Ca -0.05 -1.52 -0.08 0.00 -1.00 0.00 0.00 55.97 53.32 2b0f s LYS 59 Cb -0.12 -3.65 -0.04 0.00 -2.06 0.00 0.00 37.83 31.96 2b0f s LYS 59 CO -0.04 -0.93 0.11 -0.47 0.10 0.00 0.00 175.35 174.11 2b0f s TYR 60 N 1.34 3.13 -0.05 1.78 5.04 -0.46 -4.94 117.35 123.18 2b0f s TYR 60 Ca 0.03 -0.26 -0.30 0.00 -2.44 0.00 0.00 57.07 54.10 2b0f s TYR 60 Cb -0.22 -2.28 -0.03 0.00 0.35 0.00 0.00 41.96 39.77 2b0f s TYR 60 CO 0.00 -0.29 1.23 0.15 -1.34 0.00 0.00 175.55 175.29 2b0f s LYS 61 N 1.64 4.34 -0.41 4.97 1.02 -1.26 0.38 119.74 130.43 2b0f s LYS 61 Ca 0.07 1.71 -0.21 0.00 0.02 0.00 0.00 55.97 57.55 2b0f s LYS 61 Cb -0.15 -3.56 0.02 0.00 -0.52 0.00 0.00 37.83 33.61 2b0f s LYS 61 CO 0.06 -0.47 0.67 -0.51 -0.92 0.00 0.00 175.35 174.18 2b0f s LEU 62 N 2.27 4.35 0.25 3.17 1.43 0.44 -4.92 118.68 125.68 2b0f s LEU 62 Ca 0.57 -0.10 0.10 0.00 -1.03 0.00 0.00 54.13 53.66 2b0f s LEU 62 Cb -0.25 -2.80 -0.04 0.00 0.03 0.00 0.00 46.19 43.12 2b0f s LEU 62 CO 0.22 -0.74 -0.04 0.68 0.23 0.00 0.00 176.35 176.71 2b0f s VAL 63 N 2.88 3.32 0.29 -1.59 -7.23 -1.26 -2.74 120.40 114.07 2b0f s VAL 63 Ca 0.25 -1.92 -0.29 0.00 -1.81 0.00 0.00 61.98 58.21 2b0f s VAL 63 Cb -0.14 -2.75 -0.10 0.00 0.56 0.00 0.00 36.38 33.95 2b0f s VAL 63 CO 0.18 -0.34 1.31 -0.62 -0.31 0.00 0.00 175.10 175.32 2b0f s ASP 64 N -3.53 6.82 0.64 4.85 -1.08 0.88 -4.77 116.67 120.48 2b0f s ASP 64 Ca 0.30 2.61 0.33 0.00 -0.52 0.00 0.00 52.55 55.27 2b0f s ASP 64 Cb -0.07 -2.64 1.79 0.00 -1.46 0.00 0.00 42.92 40.55 2b0f s ASP 64 CO 0.19 -0.52 2.06 1.55 0.52 0.00 0.00 175.17 178.96 2b0f h PRO 65 N 3.96 0.00 -0.01 4.34 0.13 -1.99 1.55 132.00 139.98 2b0f h PRO 65 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2b0f h PRO 65 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2b0f h PRO 65 CO 0.69 0.00 -0.00 -1.91 -0.23 0.00 0.00 178.00 176.55 2b0f n GLU 66 N -3.24 1.44 -2.12 0.86 2.13 -1.26 -4.95 120.64 113.50 2b0f n GLU 66 Ca -0.00 -0.65 -0.01 0.00 0.66 0.00 0.00 57.16 57.16 2b0f n GLU 66 Cb 0.33 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.56 2b0f n GLU 66 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2b0f n ASN 67 N -0.22 -4.41 -4.05 4.31 3.02 0.53 -5.11 115.26 109.33 2b0f n ASN 67 Ca 0.21 0.03 -0.11 0.00 -0.03 0.00 0.00 54.58 54.68 2b0f n ASN 67 Cb 0.27 -2.79 -0.11 0.00 -0.61 0.00 0.00 39.78 36.55 2b0f n ASN 67 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2b0f s ILE 68 N -2.66 0.41 -0.21 2.41 -1.09 -1.21 -4.91 121.20 113.94 2b0f s ILE 68 Ca 0.03 -1.19 -0.28 0.00 -2.23 0.00 0.00 60.65 56.97 2b0f s ILE 68 Cb -0.01 -0.71 -0.05 0.00 -1.58 0.00 0.00 42.46 40.12 2b0f s ILE 68 CO 0.31 -0.52 2.03 0.21 -1.23 0.00 0.00 174.94 175.74 2b0f s ASN 69 N -1.82 5.77 0.08 3.58 2.47 -1.23 -0.09 114.94 123.70 2b0f s ASN 69 Ca -0.08 1.83 0.14 0.00 0.42 0.00 0.00 52.86 55.18 2b0f s ASN 69 Cb -0.07 -2.52 -0.13 0.00 -1.45 0.00 0.00 41.25 37.08 2b0f s ASN 69 CO -0.01 -1.72 0.94 0.25 -3.72 0.00 0.00 177.10 172.84 2b0f h LEU 70 N 13.85 0.00 1.01 3.21 5.85 -1.85 -3.11 115.31 134.27 2b0f h LEU 70 Ca -0.40 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.15 2b0f h LEU 70 Cb 1.21 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 2b0f h LEU 70 CO 0.98 0.71 -0.23 1.21 -0.34 0.00 0.00 178.44 180.77 2b0f n GLU 71 N -3.03 -1.01 -4.33 1.25 4.07 -1.11 -4.90 120.64 111.58 2b0f n GLU 71 Ca -0.08 0.42 -0.25 0.00 -0.06 0.00 0.00 57.16 57.19 2b0f n GLU 71 Cb 0.88 -4.36 -0.12 0.00 -0.06 0.00 0.00 31.44 27.78 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 -2.66 2.35 -0.06 4.31 1.43 -1.19 -2.27 118.68 120.59 2b0f s LEU 72 Ca 0.03 -0.76 0.01 0.00 -1.03 0.00 0.00 54.13 52.38 2b0f s LEU 72 Cb -0.01 -0.98 0.02 0.00 0.03 0.00 0.00 46.19 45.25 2b0f s LEU 72 CO 0.03 0.07 -0.06 -0.89 0.23 0.00 0.00 176.35 175.74 2b0f s THR 73 N -1.38 0.71 -0.51 5.49 2.01 0.18 0.17 115.64 122.31 2b0f s THR 73 Ca 0.12 -0.19 -0.23 0.00 0.31 0.00 0.00 61.69 61.69 2b0f s THR 73 Cb -0.09 -0.73 0.04 0.00 0.01 0.00 0.00 72.50 71.73 2b0f s THR 73 CO 0.06 0.28 0.86 -0.69 -0.69 0.00 0.00 174.62 174.44 2b0f s VAL 74 N 1.11 4.52 -0.84 3.82 1.01 0.16 -2.56 120.40 127.63 2b0f s VAL 74 Ca -0.08 0.29 -0.18 0.00 0.00 0.00 0.00 61.98 62.01 2b0f s VAL 74 Cb -0.14 -4.44 0.14 0.00 0.00 0.00 0.00 36.38 31.94 2b0f s VAL 74 CO -0.01 -0.94 0.98 -0.22 0.00 0.00 0.00 175.10 174.91 2b0f s LEU 75 N 3.60 5.40 -0.94 3.92 2.96 0.22 -1.35 118.68 132.49 2b0f s LEU 75 Ca 0.29 -2.01 -0.24 0.00 -0.22 0.00 0.00 54.13 51.96 2b0f s LEU 75 Cb -0.13 -2.35 -0.00 0.00 0.50 0.00 0.00 46.19 44.21 2b0f s LEU 75 CO 0.20 -1.00 1.72 -0.89 -1.32 0.00 0.00 176.35 175.06 2b0f s THR 76 N 2.27 3.65 -0.81 3.68 2.01 -0.18 -2.48 115.64 123.79 2b0f s THR 76 Ca 0.26 -0.50 -0.16 0.00 0.31 0.00 0.00 61.69 61.60 2b0f s THR 76 Cb -0.10 -4.47 0.18 0.00 0.01 0.00 0.00 72.50 68.12 2b0f s THR 76 CO -0.06 -1.39 0.83 -0.76 -0.69 0.00 0.00 174.62 172.55 2b0f s LEU 77 N 7.78 6.24 -1.51 4.42 1.43 0.31 -1.69 118.68 135.65 2b0f s LEU 77 Ca 0.59 -2.39 -0.10 0.00 -1.03 0.00 0.00 54.13 51.19 2b0f s LEU 77 Cb -0.04 -2.26 -0.07 0.00 0.03 0.00 0.00 46.19 43.85 2b0f s LEU 77 CO -0.04 -0.74 2.75 -0.90 0.23 0.00 0.00 176.35 177.65 2b0f n ASP 78 N 4.81 7.55 -4.88 2.29 5.75 -1.26 -4.52 116.55 126.29 2b0f n ASP 78 Ca 0.12 -2.58 -0.30 0.00 -0.01 0.00 0.00 54.79 52.03 2b0f n ASP 78 Cb 0.47 -1.51 0.01 0.00 -1.03 0.00 0.00 41.12 39.05 2b0f n ASP 78 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b0f s ARG 79 N 2.51 3.53 0.07 0.11 1.70 -1.26 -5.01 118.95 120.60 2b0f s ARG 79 Ca 0.63 0.54 -0.25 0.00 -0.47 0.00 0.00 55.73 56.17 2b0f s ARG 79 Cb 0.16 -2.18 -0.16 0.00 -0.57 0.00 0.00 34.95 32.20 2b0f s ARG 79 CO -0.06 -0.47 1.64 -0.97 -1.08 0.00 0.00 175.30 174.36 2b0f h ASN 80 N -0.15 -0.18 -3.56 -2.89 -1.24 -1.97 -3.38 115.58 102.20 2b0f h ASN 80 Ca -0.45 -0.05 -0.56 0.00 0.71 0.00 0.00 56.30 55.95 2b0f h ASN 80 Cb 1.20 0.05 -0.06 0.00 0.73 0.00 0.00 38.32 40.23 2b0f h ASN 80 CO 0.62 -0.07 0.96 -0.70 -1.29 0.00 0.00 177.43 176.95 2b0f s GLU 81 N -5.89 3.72 0.51 6.67 2.56 -1.26 -4.99 118.70 120.01 2b0f s GLU 81 Ca -0.14 0.72 -0.18 0.00 0.00 0.00 0.00 54.97 55.36 2b0f s GLU 81 Cb 0.05 -3.92 -0.08 0.00 2.00 0.00 0.00 34.13 32.18 2b0f s GLU 81 CO 0.65 -1.38 1.01 0.15 -0.56 0.00 0.00 175.26 175.12 2b0f s LYS 82 N 4.51 3.81 0.26 4.30 1.02 -1.26 -5.01 119.74 127.36 2b0f s LYS 82 Ca 0.51 1.17 -0.28 0.00 0.02 0.00 0.00 55.97 57.39 2b0f s LYS 82 Cb -0.09 -2.11 -0.09 0.00 -0.52 0.00 0.00 37.83 35.02 2b0f s LYS 82 CO 0.30 -0.40 0.93 -0.06 -0.92 0.00 0.00 175.35 175.21 2b0f s PHE 83 N -2.29 3.89 0.32 3.18 0.08 -0.10 -4.86 117.98 118.20 2b0f s PHE 83 Ca 0.63 1.85 -0.29 0.00 0.12 0.00 0.00 56.93 59.25 2b0f s PHE 83 Cb -0.13 -2.94 -0.11 0.00 -0.57 0.00 0.00 43.02 39.27 2b0f s PHE 83 CO 0.25 0.39 1.42 0.50 -0.10 0.00 0.00 175.22 177.68 2b0f s ARG 84 N -1.46 4.24 -1.00 0.44 6.06 -1.26 -1.13 118.95 124.84 2b0f s ARG 84 Ca 0.44 2.37 -0.23 0.00 -2.50 0.00 0.00 55.73 55.80 2b0f s ARG 84 Cb -0.23 -3.05 -0.01 0.00 0.06 0.00 0.00 34.95 31.72 2b0f s ARG 84 CO 0.29 -0.39 1.76 0.16 -2.50 0.00 0.00 175.30 174.62 2b0f s ASP 85 N -0.06 5.71 -0.02 -2.12 -4.77 -1.25 -4.03 116.67 110.13 2b0f s ASP 85 Ca 0.54 -1.18 0.08 0.00 -3.30 0.00 0.00 52.55 48.69 2b0f s ASP 85 Cb -0.43 -2.57 0.28 0.00 -1.09 0.00 0.00 42.92 39.11 2b0f s ASP 85 CO 0.53 -2.25 1.17 2.30 0.70 0.00 0.00 175.17 177.62 2b0f n ILE 86 N 7.43 0.55 -0.31 2.11 -5.35 0.27 -4.24 119.36 119.82 2b0f n ILE 86 Ca 0.39 -0.43 0.11 0.00 -0.27 0.00 0.00 62.75 62.54 2b0f n ILE 86 Cb 0.48 0.07 0.33 0.00 -1.74 0.00 0.00 39.64 38.78 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 1.72 0.77 0.00 6.28 2.43 -1.82 -0.84 114.38 122.91 2b0f h ARG 87 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2b0f h ARG 87 Cb 0.55 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 2b0f h ARG 87 CO 0.04 0.51 0.00 0.78 -1.51 0.00 0.00 179.97 179.79 2b0f h GLY 88 N 0.79 0.00 1.25 2.80 0.00 -1.94 -2.43 103.07 103.54 2b0f h GLY 88 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 2b0f h GLY 88 CO -0.25 0.00 -0.48 0.69 0.00 0.00 0.00 176.54 176.50 2b0f n PHE 89 N -2.89 0.33 -2.59 5.60 3.72 -0.33 -4.81 117.46 116.49 2b0f n PHE 89 Ca 0.01 0.10 -0.42 0.00 -0.05 0.00 0.00 57.45 57.09 2b0f n PHE 89 Cb 0.31 -0.52 -0.03 0.00 -0.94 0.00 0.00 39.48 38.30 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 -3.09 4.53 -0.16 4.37 1.01 -0.92 -0.39 121.20 126.55 2b0f s ILE 90 Ca 0.09 1.81 0.02 0.00 0.00 0.00 0.00 60.65 62.57 2b0f s ILE 90 Cb 0.15 -4.16 0.02 0.00 0.01 0.00 0.00 42.46 38.48 2b0f s ILE 90 CO 0.69 0.14 -0.20 -0.44 0.00 0.00 0.00 174.94 175.12 2b0f s SER 91 N 1.03 3.06 0.06 3.58 0.01 -1.15 -4.34 113.70 115.96 2b0f s SER 91 Ca 0.55 -0.61 -0.22 0.00 1.31 0.00 0.00 55.95 56.98 2b0f s SER 91 Cb -0.24 -1.43 -0.13 0.00 0.21 0.00 0.00 66.02 64.43 2b0f s SER 91 CO 0.28 0.03 1.55 -0.33 0.41 0.00 0.00 173.24 175.18 2b0f h GLU 92 N 7.66 0.18 -5.17 12.44 3.07 -1.87 -3.38 114.58 127.51 2b0f h GLU 92 Ca -0.39 -0.04 -0.63 0.00 -0.50 0.00 0.00 59.36 57.80 2b0f h GLU 92 Cb 1.16 -0.02 -0.14 0.00 -0.84 0.00 0.00 28.75 28.90 2b0f h GLU 92 CO 0.59 0.36 -0.22 0.34 -1.40 0.00 0.00 179.01 178.67 2b0f s ASP 93 N -5.59 6.27 -0.09 1.42 2.15 -1.26 -4.84 116.67 114.72 2b0f s ASP 93 Ca -0.14 0.31 -0.18 0.00 0.43 0.00 0.00 52.55 52.97 2b0f s ASP 93 Cb 0.06 -2.21 -0.14 0.00 -0.30 0.00 0.00 42.92 40.32 2b0f s ASP 93 CO 0.70 -0.19 0.62 -0.07 -0.17 0.00 0.00 175.17 176.06 2b0f h LEU 94 N 8.60 -0.10 -3.78 -1.34 3.38 -1.96 -3.48 115.31 116.64 2b0f h LEU 94 Ca -0.31 -0.42 -0.52 0.00 0.09 0.00 0.00 57.88 56.71 2b0f h LEU 94 Cb 1.16 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 2b0f h LEU 94 CO 0.65 0.56 -1.04 -1.84 0.09 0.00 0.00 178.44 176.85 2b0f n GLU 95 N -4.81 -1.06 -2.73 1.13 0.28 -1.26 -4.93 120.64 107.25 2b0f n GLU 95 Ca -0.06 0.52 -0.03 0.00 -0.16 0.00 0.00 57.16 57.42 2b0f n GLU 95 Cb 0.25 -2.48 0.02 0.00 1.43 0.00 0.00 31.44 30.67 2b0f n GLU 95 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2b0f s GLY 96 N -3.20 -1.62 0.00 -1.84 0.00 -1.26 -5.02 107.32 94.38 2b0f s GLY 96 Ca 0.19 0.21 0.16 0.00 0.00 0.00 0.00 44.72 45.28 2b0f s GLY 96 CO 0.92 4.03 1.47 1.55 0.00 0.00 0.00 173.10 181.07 2b0f n VAL 97 N 2.86 0.72 -4.01 1.40 3.14 -1.26 -4.52 118.33 116.65 2b0f n VAL 97 Ca 0.14 0.18 -0.35 0.00 -2.96 0.00 0.00 64.34 61.35 2b0f n VAL 97 Cb 0.61 -0.92 -0.14 0.00 -1.06 0.00 0.00 33.84 32.33 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 -2.76 4.32 0.01 6.55 -1.08 -1.25 -0.68 116.67 121.78 2b0f s ASP 98 Ca 0.12 -0.37 -0.02 0.00 -0.52 0.00 0.00 52.55 51.77 2b0f s ASP 98 Cb 0.10 -1.73 -0.01 0.00 -1.46 0.00 0.00 42.92 39.82 2b0f s ASP 98 CO 0.26 0.01 0.01 0.00 0.52 0.00 0.00 175.17 175.97 2b0f s ALA 99 N 1.31 0.01 -0.08 3.66 0.00 -0.78 -4.62 121.76 121.27 2b0f s ALA 99 Ca 0.04 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.61 2b0f s ALA 99 Cb -0.14 0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 2b0f s ALA 99 CO -0.02 -0.15 -0.17 0.99 0.00 0.00 0.00 175.76 176.40 2b0f s THR 100 N -1.27 2.73 -0.32 0.00 2.01 0.05 -2.46 115.64 116.38 2b0f s THR 100 Ca -0.14 -0.82 -0.19 0.00 0.31 0.00 0.00 61.69 60.86 2b0f s THR 100 Cb -0.08 -2.07 -0.01 0.00 0.01 0.00 0.00 72.50 70.34 2b0f s THR 100 CO -0.00 0.56 0.56 -0.22 -0.69 0.00 0.00 174.62 174.83 2b0f s LEU 101 N -0.20 4.20 -0.50 4.42 2.96 0.22 -2.10 118.68 127.68 2b0f s LEU 101 Ca -0.01 0.26 -0.16 0.00 -0.22 0.00 0.00 54.13 54.00 2b0f s LEU 101 Cb -0.13 -2.69 0.10 0.00 0.50 0.00 0.00 46.19 43.96 2b0f s LEU 101 CO 0.03 -0.45 0.44 -0.69 -1.32 0.00 0.00 176.35 174.36 2b0f s VAL 102 N 2.47 5.22 -0.25 1.68 1.01 0.20 -0.85 120.40 129.89 2b0f s VAL 102 Ca 0.22 -1.24 -0.10 0.00 0.00 0.00 0.00 61.98 60.85 2b0f s VAL 102 Cb -0.15 -4.21 -0.05 0.00 0.00 0.00 0.00 36.38 31.97 2b0f s VAL 102 CO 0.12 -0.69 0.16 -0.69 0.00 0.00 0.00 175.10 173.99 2b0f s VAL 103 N 1.62 5.29 -0.34 2.92 1.01 0.63 -0.60 120.40 130.93 2b0f s VAL 103 Ca 0.04 0.16 0.16 0.00 0.00 0.00 0.00 61.98 62.33 2b0f s VAL 103 Cb -0.27 -3.47 0.45 0.00 0.00 0.00 0.00 36.38 33.09 2b0f s VAL 103 CO 0.05 0.33 0.96 1.57 0.00 0.00 0.00 175.10 178.02 2b0f n HIS 104 N 4.42 1.43 -3.48 5.22 -0.00 -1.26 -0.07 115.22 121.48 2b0f n HIS 104 Ca -0.15 -2.86 -0.06 0.00 -0.00 0.00 0.00 57.72 54.64 2b0f n HIS 104 Cb 0.52 -0.34 0.00 0.00 -0.00 0.00 0.00 29.99 30.17 2b0f n HIS 104 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2b0f n SER 105 N -0.11 1.28 -0.06 0.26 7.64 -1.21 -4.03 113.62 117.39 2b0f n SER 105 Ca 0.13 -1.48 0.01 0.00 1.01 0.00 0.00 58.87 58.54 2b0f n SER 105 Cb 0.79 -0.03 0.30 0.00 -1.01 0.00 0.00 64.21 64.27 2b0f n SER 105 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2b0f h ASN 106 N 0.14 0.61 -0.18 6.43 7.08 -1.70 -3.08 115.58 124.88 2b0f h ASN 106 Ca -0.09 -0.06 0.04 0.00 -3.08 0.00 0.00 56.30 53.11 2b0f h ASN 106 Cb 0.33 -0.16 -0.04 0.00 -2.08 0.00 0.00 38.32 36.38 2b0f h ASN 106 CO 0.13 0.55 -0.08 -0.55 -2.08 0.00 0.00 177.43 175.40 2b0f h ASN 107 N 0.67 -0.26 -3.31 6.14 7.08 -1.86 -3.43 115.58 120.60 2b0f h ASN 107 Ca 0.16 0.07 -0.01 0.00 -3.08 0.00 0.00 56.30 53.44 2b0f h ASN 107 Cb 0.13 0.15 -0.22 0.00 -2.08 0.00 0.00 38.32 36.30 2b0f h ASN 107 CO -0.02 -0.10 0.01 0.12 -2.08 0.00 0.00 177.43 175.35 2b0f s PHE 108 N -6.19 -0.93 -0.36 4.14 5.36 -1.16 -5.13 117.98 113.71 2b0f s PHE 108 Ca -0.14 1.96 -0.26 0.00 -0.96 0.00 0.00 56.93 57.53 2b0f s PHE 108 Cb 0.10 0.49 0.01 0.00 -0.34 0.00 0.00 43.02 43.28 2b0f s PHE 108 CO 0.68 -0.46 0.91 0.99 -1.46 0.00 0.00 175.22 175.88 2b0f s THR 109 N 1.23 4.61 -0.09 0.12 2.01 -1.25 -3.30 115.64 118.96 2b0f s THR 109 Ca -0.07 1.18 -0.01 0.00 0.31 0.00 0.00 61.69 63.10 2b0f s THR 109 Cb -0.05 -4.31 0.00 0.00 0.01 0.00 0.00 72.50 68.14 2b0f s THR 109 CO -0.13 -0.51 0.09 0.59 -0.69 0.00 0.00 174.62 173.97 2b0f n ASN 110 N 6.71 -2.81 -4.13 3.53 4.13 -0.54 -4.99 115.26 117.16 2b0f n ASN 110 Ca 0.07 0.01 -0.34 0.00 1.68 0.00 0.00 54.58 56.00 2b0f n ASN 110 Cb 0.48 -1.60 -0.14 0.00 -1.54 0.00 0.00 39.78 36.98 2b0f n ASN 110 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2b0f s THR 111 N -2.56 2.68 -0.47 3.41 2.01 0.90 -4.96 115.64 116.64 2b0f s THR 111 Ca 0.01 -1.53 -0.08 0.00 0.31 0.00 0.00 61.69 60.40 2b0f s THR 111 Cb -0.00 -2.58 0.12 0.00 0.01 0.00 0.00 72.50 70.05 2b0f s THR 111 CO 0.10 -0.12 0.33 0.27 -0.69 0.00 0.00 174.62 174.52 2b0f s ILE 112 N 1.18 4.06 -0.31 1.82 -4.36 -1.25 -0.27 121.20 122.07 2b0f s ILE 112 Ca -0.06 -1.88 -0.14 0.00 -0.26 0.00 0.00 60.65 58.31 2b0f s ILE 112 Cb -0.20 -3.69 -0.03 0.00 1.25 0.00 0.00 42.46 39.80 2b0f s ILE 112 CO -0.03 -0.77 0.33 -0.76 0.24 0.00 0.00 174.94 173.95 2b0f s LEU 113 N 1.26 4.24 -0.74 0.37 1.43 -0.03 -4.89 118.68 120.32 2b0f s LEU 113 Ca 0.07 -0.03 -0.25 0.00 -1.03 0.00 0.00 54.13 52.89 2b0f s LEU 113 Cb -0.25 -2.32 0.05 0.00 0.03 0.00 0.00 46.19 43.70 2b0f s LEU 113 CO -0.02 -0.23 1.18 -1.61 0.23 0.00 0.00 176.35 175.90 2b0f s GLU 114 N 1.98 3.21 0.25 1.70 2.02 -1.26 0.71 118.70 127.31 2b0f s GLU 114 Ca 0.12 -0.55 0.24 0.00 0.02 0.00 0.00 54.97 54.80 2b0f s GLU 114 Cb -0.16 -4.31 0.50 0.00 0.10 0.00 0.00 34.13 30.26 2b0f s GLU 114 CO 0.11 -2.03 1.55 -0.39 0.02 0.00 0.00 175.26 174.52 2b0f h VAL 115 N 6.06 0.00 0.00 2.63 -1.51 -1.85 -3.49 116.25 118.09 2b0f h VAL 115 Ca -0.23 -0.67 0.00 0.00 -1.23 0.00 0.00 66.70 64.56 2b0f h VAL 115 Cb 1.05 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 31.74 2b0f h VAL 115 CO 1.25 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 178.20 2b0f n GLY 116 N 1.25 0.74 3.65 5.19 0.00 -1.09 -4.72 105.19 110.22 2b0f n GLY 116 Ca 0.04 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 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 4.09 0.08 1.61 0.04 -1.17 -1.86 135.00 137.79 2b0f s PRO 117 Ca 0.00 2.25 0.06 0.00 0.04 0.00 0.00 61.00 63.35 2b0f s PRO 117 Cb 0.00 -4.05 -0.04 0.00 0.04 0.00 0.00 34.50 30.45 2b0f s PRO 117 CO 0.00 -0.97 -0.08 0.14 0.04 0.00 0.00 177.00 176.13 2b0f s VAL 118 N 4.44 3.52 -0.09 -0.36 -7.23 0.15 -4.30 120.40 116.54 2b0f s VAL 118 Ca 0.78 -1.12 -0.14 0.00 -1.81 0.00 0.00 61.98 59.69 2b0f s VAL 118 Cb -0.35 -2.63 0.03 0.00 0.56 0.00 0.00 36.38 34.00 2b0f s VAL 118 CO 0.33 0.18 0.36 -0.89 -0.31 0.00 0.00 175.10 174.76 2b0f s THR 119 N -1.18 0.02 0.26 5.32 2.01 -0.15 -4.70 115.64 117.22 2b0f s THR 119 Ca 0.21 -0.19 -0.25 0.00 0.31 0.00 0.00 61.69 61.77 2b0f s THR 119 Cb -0.11 -0.58 -0.09 0.00 0.01 0.00 0.00 72.50 71.73 2b0f s THR 119 CO 0.13 -0.11 0.86 0.00 -0.69 0.00 0.00 174.62 174.82 2b0f s MET 120 N -0.47 4.55 -0.25 4.92 0.23 -1.26 0.15 119.30 127.17 2b0f s MET 120 Ca -0.06 1.22 -0.03 0.00 -1.03 0.00 0.00 55.69 55.79 2b0f s MET 120 Cb -0.04 -2.97 -0.17 0.00 -1.53 0.00 0.00 34.83 30.12 2b0f s MET 120 CO 0.02 0.39 -0.17 0.00 -2.03 0.00 0.00 175.02 173.23 2b0f n ALA 121 N 0.92 1.30 0.00 3.16 0.00 0.12 -4.86 120.51 121.16 2b0f n ALA 121 Ca -0.01 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.40 2b0f n ALA 121 Cb 0.50 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.81 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 1.99 0.35 3.47 0.00 0.00 -1.15 -4.93 105.19 104.91 2b0f n GLY 122 Ca -0.46 -1.47 -0.43 0.00 0.00 0.00 0.00 46.02 43.67 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 5.00 0.37 0.99 2.96 -1.26 -1.20 118.68 125.54 2b0f s LEU 123 Ca 0.00 -0.80 0.04 0.00 -0.22 0.00 0.00 54.13 53.14 2b0f s LEU 123 Cb 0.00 -2.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 2b0f s LEU 123 CO 0.00 -0.46 0.12 0.27 -1.32 0.00 0.00 176.35 174.96 2b0f s ILE 124 N 1.78 0.69 -0.14 6.68 -4.36 -0.59 -4.94 121.20 120.32 2b0f s ILE 124 Ca 0.07 -2.00 -0.22 0.00 -0.26 0.00 0.00 60.65 58.23 2b0f s ILE 124 Cb -0.18 -2.48 -0.03 0.00 1.25 0.00 0.00 42.46 41.01 2b0f s ILE 124 CO 0.11 0.00 0.68 0.20 0.24 0.00 0.00 174.94 176.17 2b0f s ASN 125 N -3.53 6.84 -0.35 4.36 0.01 -1.26 -0.39 114.94 120.61 2b0f s ASN 125 Ca 0.29 1.02 -0.05 0.00 -0.71 0.00 0.00 52.86 53.41 2b0f s ASN 125 Cb 0.04 -2.39 0.06 0.00 0.41 0.00 0.00 41.25 39.38 2b0f s ASN 125 CO 0.15 -0.23 0.11 -0.22 -1.51 0.00 0.00 177.10 175.40 2b0f s LEU 126 N 1.50 4.45 -1.57 0.60 2.96 0.16 -4.51 118.68 122.27 2b0f s LEU 126 Ca 0.33 -1.39 -0.02 0.00 -0.22 0.00 0.00 54.13 52.83 2b0f s LEU 126 Cb -0.17 -1.82 0.01 0.00 0.50 0.00 0.00 46.19 44.71 2b0f s LEU 126 CO 0.13 -0.37 0.23 -1.54 -1.32 0.00 0.00 176.35 173.49 2b0f n SER 127 N 4.72 -5.53 -0.39 3.68 3.41 -1.26 -1.33 113.62 116.92 2b0f n SER 127 Ca -0.10 -0.10 -0.03 0.00 -0.26 0.00 0.00 58.87 58.37 2b0f n SER 127 Cb 0.43 -4.56 -0.00 0.00 -0.26 0.00 0.00 64.21 59.82 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 -2.17 -1.85 -3.68 4.04 7.64 -1.26 -5.05 113.62 111.29 2b0f n SER 128 Ca -0.17 -0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.51 2b0f n SER 128 Cb 0.64 -1.23 -0.18 0.00 -1.01 0.00 0.00 64.21 62.44 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 -2.17 -0.12 -0.05 0.44 2.01 -0.44 -5.08 115.64 110.23 2b0f s THR 129 Ca 0.00 0.40 -0.31 0.00 0.31 0.00 0.00 61.69 62.10 2b0f s THR 129 Cb 0.00 -0.16 -0.09 0.00 0.01 0.00 0.00 72.50 72.26 2b0f s THR 129 CO 0.00 0.17 2.01 -2.65 -0.69 0.00 0.00 174.62 173.45 2b0f n PRO 130 N 5.21 2.48 -4.71 4.92 -0.02 -1.26 0.38 135.00 142.00 2b0f n PRO 130 Ca -0.05 0.87 -0.25 0.00 -2.02 0.00 0.00 63.50 62.05 2b0f n PRO 130 Cb 0.50 -2.94 -0.16 0.00 -0.02 0.00 0.00 33.50 30.88 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 5.15 1.29 0.41 3.45 2.01 0.47 -3.55 115.64 124.87 2b0f s THR 131 Ca 0.93 -0.59 0.08 0.00 0.31 0.00 0.00 61.69 62.42 2b0f s THR 131 Cb -0.50 -1.15 -0.00 0.00 0.01 0.00 0.00 72.50 70.86 2b0f s THR 131 CO 0.44 0.38 0.48 0.54 -0.69 0.00 0.00 174.62 175.77 2b0f s ASN 132 N 0.44 5.46 -1.38 3.53 4.22 -1.17 -1.54 114.94 124.49 2b0f s ASN 132 Ca -0.12 -0.52 -0.08 0.00 -2.14 0.00 0.00 52.86 50.00 2b0f s ASN 132 Cb -0.15 -0.69 0.03 0.00 1.28 0.00 0.00 41.25 41.72 2b0f s ASN 132 CO 0.04 -0.68 1.07 -1.14 -2.04 0.00 0.00 177.10 174.35 2b0f n ARG 133 N -1.71 -6.92 -3.08 3.55 0.00 -0.34 -4.85 116.66 103.31 2b0f n ARG 133 Ca 0.05 0.75 -0.39 0.00 -0.00 0.00 0.00 57.85 58.26 2b0f n ARG 133 Cb 0.60 -5.72 -0.06 0.00 0.00 0.00 0.00 32.46 27.28 2b0f n ARG 133 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.63 175.99 2b0f s MET 134 N -6.25 4.42 -0.13 -0.14 -1.94 -0.60 -2.90 119.30 111.76 2b0f s MET 134 Ca 0.49 0.95 -0.07 0.00 -1.71 0.00 0.00 55.69 55.35 2b0f s MET 134 Cb -0.23 -3.32 -0.04 0.00 2.01 0.00 0.00 34.83 33.26 2b0f s MET 134 CO 0.76 0.43 0.12 0.42 -0.01 0.00 0.00 175.02 176.74 2b0f s ILE 135 N -0.50 5.30 0.07 2.53 -1.09 0.13 0.16 121.20 127.80 2b0f s ILE 135 Ca 0.35 0.14 0.06 0.00 -2.23 0.00 0.00 60.65 58.96 2b0f s ILE 135 Cb -0.20 -3.33 -0.03 0.00 -1.58 0.00 0.00 42.46 37.32 2b0f s ILE 135 CO 0.22 0.58 -0.17 0.00 -1.23 0.00 0.00 174.94 174.33 2b0f s ARG 136 N -0.68 1.02 0.02 2.79 1.70 0.12 -0.39 118.95 123.54 2b0f s ARG 136 Ca 0.13 -0.98 -0.05 0.00 -0.47 0.00 0.00 55.73 54.36 2b0f s ARG 136 Cb -0.12 -1.13 -0.01 0.00 -0.57 0.00 0.00 34.95 33.12 2b0f s ARG 136 CO 0.03 0.27 0.08 1.52 -1.08 0.00 0.00 175.30 176.11 2b0f s TYR 137 N -1.07 0.16 -0.38 5.89 -0.85 -0.80 -0.98 117.35 119.32 2b0f s TYR 137 Ca 0.03 -0.38 -0.24 0.00 -0.52 0.00 0.00 57.07 55.96 2b0f s TYR 137 Cb -0.09 -0.12 0.01 0.00 0.38 0.00 0.00 41.96 42.14 2b0f s TYR 137 CO 0.03 -0.29 0.81 0.34 -1.52 0.00 0.00 175.55 174.92 2b0f s ASP 138 N -1.68 6.55 -0.30 -0.18 2.15 -1.26 -0.56 116.67 121.40 2b0f s ASP 138 Ca -0.12 0.31 -0.19 0.00 0.43 0.00 0.00 52.55 52.99 2b0f s ASP 138 Cb -0.06 -2.41 0.19 0.00 -0.30 0.00 0.00 42.92 40.34 2b0f s ASP 138 CO -0.01 -0.80 1.23 -0.47 -0.17 0.00 0.00 175.17 174.96 2b0f s TYR 139 N 3.23 -0.19 -0.57 -5.34 5.04 0.87 -4.95 117.35 115.43 2b0f s TYR 139 Ca 0.33 0.40 -0.27 0.00 -2.44 0.00 0.00 57.07 55.09 2b0f s TYR 139 Cb -0.13 0.23 -0.03 0.00 0.35 0.00 0.00 41.96 42.39 2b0f s TYR 139 CO 0.19 -0.09 1.93 0.00 -1.34 0.00 0.00 175.55 176.23 2b0f s ALA 140 N 0.79 2.15 0.57 3.97 0.00 -1.25 -3.64 121.76 124.35 2b0f s ALA 140 Ca -0.04 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 51.45 2b0f s ALA 140 Cb -0.03 -4.29 0.05 0.00 0.00 0.00 0.00 23.12 18.85 2b0f s ALA 140 CO -0.12 -3.88 0.80 0.95 0.00 0.00 0.00 175.76 173.52 2b0f s THR 141 N 9.34 2.58 -0.16 0.00 -4.23 -0.69 -4.99 115.64 117.49 2b0f s THR 141 Ca 0.72 -0.67 -0.28 0.00 -1.18 0.00 0.00 61.69 60.28 2b0f s THR 141 Cb -0.14 -2.91 0.08 0.00 1.34 0.00 0.00 72.50 70.87 2b0f s THR 141 CO 0.22 0.00 0.75 -0.75 -0.54 0.00 0.00 174.62 174.31 2b0f s LYS 142 N -4.81 0.89 0.93 3.99 2.47 -1.26 -4.74 119.74 117.21 2b0f s LYS 142 Ca 0.59 0.54 -0.16 0.00 -1.56 0.00 0.00 55.97 55.37 2b0f s LYS 142 Cb -0.09 0.43 -0.12 0.00 -1.46 0.00 0.00 37.83 36.58 2b0f s LYS 142 CO 0.39 -0.21 -0.51 2.41 0.16 0.00 0.00 175.35 177.59 2b0f n THR 143 N 1.63 0.07 0.00 3.43 -1.04 -1.26 -2.66 114.28 114.46 2b0f n THR 143 Ca -0.16 -0.45 0.00 0.00 -2.04 0.00 0.00 64.05 61.40 2b0f n THR 143 Cb 0.56 -0.12 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 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 3.03 3.03 0.33 3.41 0.00 -1.26 -4.81 105.19 108.92 2b0f n GLY 144 Ca 0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2b0f n GLY 144 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2b0f n GLN 145 N -1.13 1.43 -1.88 1.61 7.27 -1.09 -4.34 117.38 119.25 2b0f n GLN 145 Ca 0.00 -0.65 -0.40 0.00 0.07 0.00 0.00 57.00 56.01 2b0f n GLN 145 Cb 0.00 -1.34 -0.00 0.00 2.41 0.00 0.00 30.24 31.31 2b0f n GLN 145 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2b0f n GLY 147 N 0.57 2.98 3.61 0.00 0.00 0.17 -3.95 105.19 108.57 2b0f n GLY 147 Ca 0.02 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.21 0.57 3.68 -0.02 0.00 -1.20 -3.98 105.19 103.03 2b0f n GLY 148 Ca 0.00 0.68 -0.42 0.00 0.00 0.00 0.00 46.02 46.28 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 0.50 4.86 -0.44 1.61 1.01 0.23 0.14 120.40 128.31 2b0f s VAL 149 Ca 0.82 1.73 -0.14 0.00 0.00 0.00 0.00 61.98 64.39 2b0f s VAL 149 Cb -0.89 -4.18 0.06 0.00 0.00 0.00 0.00 36.38 31.37 2b0f s VAL 149 CO 0.45 0.02 0.33 -0.22 0.00 0.00 0.00 175.10 175.69 2b0f s LEU 150 N 2.10 5.34 0.32 3.92 2.96 0.11 0.58 118.68 134.01 2b0f s LEU 150 Ca 0.41 -1.23 -0.06 0.00 -0.22 0.00 0.00 54.13 53.03 2b0f s LEU 150 Cb -0.17 -2.13 0.00 0.00 0.50 0.00 0.00 46.19 44.40 2b0f s LEU 150 CO 0.14 -0.56 0.49 0.00 -1.32 0.00 0.00 176.35 175.10 2b0f s ALA 152 N -3.22 1.66 -0.27 0.00 0.00 0.62 -0.77 121.76 119.78 2b0f s ALA 152 Ca 0.28 -1.79 -0.28 0.00 0.00 0.00 0.00 51.96 50.16 2b0f s ALA 152 Cb -0.01 1.24 -0.05 0.00 0.00 0.00 0.00 23.12 24.31 2b0f s ALA 152 CO 0.17 -0.54 2.18 -0.08 0.00 0.00 0.00 175.76 177.49 2b0f s THR 153 N -3.79 3.07 0.00 0.00 -1.32 -1.26 -1.77 115.64 110.57 2b0f s THR 153 Ca 0.38 0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.93 2b0f s THR 153 Cb 0.06 -3.11 0.00 0.00 -1.51 0.00 0.00 72.50 67.94 2b0f s THR 153 CO 0.16 -0.07 0.00 0.61 -2.21 0.00 0.00 174.62 173.11 2b0f n GLY 154 N 5.75 1.33 2.71 6.08 0.00 -1.26 -5.01 105.19 114.80 2b0f n GLY 154 Ca 0.30 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.11 2b0f n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b0f s LYS 155 N -0.33 0.01 -0.19 1.61 1.02 -0.73 -4.59 119.74 116.54 2b0f s LYS 155 Ca 0.00 0.31 -0.16 0.00 0.02 0.00 0.00 55.97 56.14 2b0f s LYS 155 Cb 0.00 -0.81 -0.04 0.00 -0.52 0.00 0.00 37.83 36.46 2b0f s LYS 155 CO 0.00 -0.43 0.41 0.42 -0.92 0.00 0.00 175.35 174.83 2b0f s ILE 156 N 2.21 5.20 -0.24 2.17 1.01 0.47 -0.28 121.20 131.75 2b0f s ILE 156 Ca 0.04 0.74 -0.07 0.00 0.00 0.00 0.00 60.65 61.37 2b0f s ILE 156 Cb -0.13 -3.74 -0.17 0.00 0.01 0.00 0.00 42.46 38.43 2b0f s ILE 156 CO -0.06 0.27 -0.15 0.49 0.00 0.00 0.00 174.94 175.49 2b0f n PHE 157 N 4.31 0.27 -3.16 3.97 3.72 -0.75 -2.95 117.46 122.86 2b0f n PHE 157 Ca -0.08 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2b0f n PHE 157 Cb 0.51 -1.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.02 2b0f n PHE 157 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b0f n GLY 158 N 1.82 -0.91 3.14 1.37 0.00 -0.62 0.24 105.19 110.23 2b0f n GLY 158 Ca -0.46 -0.77 -0.21 0.00 0.00 0.00 0.00 46.02 44.58 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 1.14 -0.17 -0.61 -4.36 -0.49 0.05 121.20 113.76 2b0f s ILE 159 Ca 0.00 -0.92 -0.29 0.00 -0.26 0.00 0.00 60.65 59.18 2b0f s ILE 159 Cb 0.00 -1.01 -0.04 0.00 1.25 0.00 0.00 42.46 42.66 2b0f s ILE 159 CO 0.00 0.08 1.75 -2.28 0.24 0.00 0.00 174.94 174.73 2b0f s HIS 160 N -0.74 1.85 -0.10 1.37 5.65 0.38 -0.28 115.29 123.41 2b0f s HIS 160 Ca 0.03 0.38 0.12 0.00 0.25 0.00 0.00 55.06 55.83 2b0f s HIS 160 Cb -0.07 -4.00 -0.18 0.00 -1.18 0.00 0.00 32.58 27.15 2b0f s HIS 160 CO 0.01 -3.54 0.12 0.28 -0.65 0.00 0.00 174.74 170.96 2b0f n VAL 161 N 6.40 0.65 -1.38 0.89 0.31 -0.88 -0.66 118.33 123.66 2b0f n VAL 161 Ca 0.20 -0.49 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2b0f n VAL 161 Cb 0.44 -0.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 2b0f n VAL 161 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2b0f n GLY 162 N 2.06 1.55 0.00 2.92 0.00 -0.29 -4.91 105.19 106.52 2b0f n GLY 162 Ca -0.16 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 1.08 2.74 -0.02 0.00 -1.26 -0.85 105.19 106.88 2b0f n GLY 163 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 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 3.70 1.83 1.61 2.47 0.21 -4.83 114.94 119.93 2b0f s ASN 164 Ca 0.00 -2.82 0.00 0.00 0.42 0.00 0.00 52.86 50.46 2b0f s ASN 164 Cb 0.00 -1.13 0.00 0.00 -1.45 0.00 0.00 41.25 38.67 2b0f s ASN 164 CO 0.00 -0.24 0.00 0.61 -3.72 0.00 0.00 177.10 173.75 2b0f n GLY 165 N 3.30 1.32 0.48 1.21 0.00 -1.26 -1.71 105.19 108.53 2b0f n GLY 165 Ca 0.11 0.33 0.11 0.00 0.00 0.00 0.00 46.02 46.56 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 1.63 -4.06 1.61 0.63 -1.26 -1.70 116.66 113.51 2b0f n ARG 166 Ca 0.00 -0.95 -0.32 0.00 -0.92 0.00 0.00 57.85 55.66 2b0f n ARG 166 Cb 0.00 -1.39 -0.15 0.00 0.45 0.00 0.00 32.46 31.36 2b0f n ARG 166 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 2b0f s GLN 167 N -1.84 2.37 0.31 -0.14 2.00 -0.69 -0.09 119.66 121.59 2b0f s GLN 167 Ca 0.33 -1.11 -0.27 0.00 -2.00 0.00 0.00 55.36 52.30 2b0f s GLN 167 Cb 0.17 -2.71 -0.09 0.00 0.80 0.00 0.00 33.01 31.17 2b0f s GLN 167 CO 0.27 -0.45 0.98 0.20 -0.50 0.00 0.00 175.29 175.78 2b0f s GLY 168 N 1.21 2.89 -0.13 2.59 0.00 0.28 0.66 107.32 114.82 2b0f s GLY 168 Ca -0.04 0.62 0.02 0.00 0.00 0.00 0.00 44.72 45.32 2b0f s GLY 168 CO -0.08 1.11 -0.19 -1.36 0.00 0.00 0.00 173.10 172.58 2b0f s PHE 169 N -1.48 2.44 0.01 1.90 0.40 -0.03 -1.90 117.98 119.32 2b0f s PHE 169 Ca 0.49 -1.24 0.07 0.00 -0.60 0.00 0.00 56.93 55.66 2b0f s PHE 169 Cb -0.22 -1.69 -0.02 0.00 0.51 0.00 0.00 43.02 41.59 2b0f s PHE 169 CO 0.28 -0.59 -0.22 -1.12 0.70 0.00 0.00 175.22 174.27 2b0f s SER 170 N 0.95 2.64 -0.12 1.36 0.01 0.48 -1.14 113.70 117.87 2b0f s SER 170 Ca -0.05 -0.47 -0.27 0.00 1.31 0.00 0.00 55.95 56.46 2b0f s SER 170 Cb -0.15 -0.26 -0.02 0.00 0.21 0.00 0.00 66.02 65.80 2b0f s SER 170 CO -0.03 0.23 0.91 0.00 0.41 0.00 0.00 173.24 174.76 2b0f s ALA 171 N -0.66 3.43 -0.13 1.44 0.00 0.61 0.21 121.76 126.66 2b0f s ALA 171 Ca 0.09 0.23 -0.29 0.00 0.00 0.00 0.00 51.96 51.98 2b0f s ALA 171 Cb -0.09 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2b0f s ALA 171 CO 0.01 -0.55 1.42 -1.14 0.00 0.00 0.00 175.76 175.49 2b0f s GLN 172 N 1.89 4.20 -0.86 0.00 0.74 -1.14 -1.40 119.66 123.09 2b0f s GLN 172 Ca 0.44 1.86 -0.20 0.00 0.05 0.00 0.00 55.36 57.50 2b0f s GLN 172 Cb -0.18 -3.85 0.11 0.00 1.10 0.00 0.00 33.01 30.18 2b0f s GLN 172 CO 0.16 -0.77 1.11 -0.51 -0.55 0.00 0.00 175.29 174.73 2b0f s LEU 173 N 3.74 4.71 -0.02 3.68 1.02 0.14 -4.92 118.68 127.03 2b0f s LEU 173 Ca 0.62 -1.69 -0.23 0.00 0.02 0.00 0.00 54.13 52.85 2b0f s LEU 173 Cb -0.26 -2.42 -0.05 0.00 0.02 0.00 0.00 46.19 43.48 2b0f s LEU 173 CO 0.21 -1.21 0.68 -0.54 0.02 0.00 0.00 176.35 175.51 2b0f s LYS 174 N 3.30 4.42 0.49 1.70 1.02 -1.26 -3.94 119.74 125.47 2b0f s LYS 174 Ca 0.31 0.88 0.30 0.00 0.02 0.00 0.00 55.97 57.48 2b0f s LYS 174 Cb -0.08 -3.40 1.66 0.00 -0.52 0.00 0.00 37.83 35.49 2b0f s LYS 174 CO -0.04 0.21 1.92 -0.22 -0.92 0.00 0.00 175.35 176.30 2b0f h LYS 175 N 6.16 0.00 -0.08 1.68 3.64 -1.76 -2.77 116.57 123.45 2b0f h LYS 175 Ca -0.43 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 58.97 2b0f h LYS 175 Cb 1.20 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2b0f h LYS 175 CO 0.73 0.00 0.05 -0.56 -2.27 0.00 0.00 179.45 177.40 2b0f h GLN 176 N 0.00 0.00 0.00 1.90 3.07 -1.93 -0.21 115.11 117.94 2b0f h GLN 176 Ca 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 58.65 58.56 2b0f h GLN 176 Cb 0.13 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.66 2b0f h GLN 176 CO 0.00 0.00 -0.90 1.88 0.09 0.00 0.00 178.83 179.90 2b0f h TYR 177 N 0.00 0.00 0.05 0.06 0.05 -1.91 -3.32 116.97 111.90 2b0f h TYR 177 Ca 0.04 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.53 2b0f h TYR 177 Cb 0.14 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.85 2b0f h TYR 177 CO 0.00 0.81 -1.54 0.74 -1.05 0.00 0.00 178.16 177.13 2b0f h PHE 178 N 0.00 0.17 0.00 4.88 0.04 -1.52 -3.31 116.94 117.21 2b0f h PHE 178 Ca -0.03 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.60 2b0f h PHE 178 Cb 1.65 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.79 2b0f h PHE 178 CO 0.00 1.18 -0.06 -0.24 -0.60 0.00 0.00 178.31 178.59 2b0f h VAL 179 N 0.03 0.24 -0.49 -0.55 3.04 -1.19 -2.71 116.25 114.62 2b0f h VAL 179 Ca -0.23 -0.42 -0.10 0.00 -1.01 0.00 0.00 66.70 64.95 2b0f h VAL 179 Cb 1.97 1.33 -0.02 0.00 -2.01 0.00 0.00 31.29 32.56 2b0f h VAL 179 CO 0.11 0.05 -0.08 -0.08 -1.01 0.00 0.00 177.57 176.57 2b0f h GLU 180 N 0.00 0.88 -4.97 4.17 4.81 -1.65 -3.42 114.58 114.39 2b0f h GLU 180 Ca -0.00 -0.29 -0.64 0.00 -0.13 0.00 0.00 59.36 58.30 2b0f h GLU 180 Cb 0.32 -0.07 -0.16 0.00 0.63 0.00 0.00 28.75 29.47 2b0f h GLU 180 CO 0.01 0.93 -0.45 -1.59 -0.73 0.00 0.00 179.01 177.17 2b0f s LYS 181 N -4.86 3.97 0.00 1.92 -2.85 -1.02 -5.16 119.74 111.73 2b0f s LYS 181 Ca -0.10 -0.23 0.00 0.00 -1.00 0.00 0.00 55.97 54.64 2b0f s LYS 181 Cb 0.14 -3.66 0.00 0.00 -2.06 0.00 0.00 37.83 32.25 2b0f s LYS 181 CO 0.84 -0.20 0.00 0.00 0.10 0.00 0.00 175.35 176.09