#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 0.97 -0.35 1.61 0.11 -2.05 0.16 132.00 132.45 2b0f h PRO 2 Ca 0.00 -0.14 -0.10 0.00 0.11 0.00 0.00 66.00 65.87 2b0f h PRO 2 Cb 0.00 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 2b0f h PRO 2 CO 0.00 0.77 -0.17 -0.97 -0.21 0.00 0.00 178.00 177.42 2b0f h ASN 3 N 0.94 0.76 0.76 -2.05 -1.24 -1.98 -0.60 115.58 112.17 2b0f h ASN 3 Ca 0.23 -0.41 -0.10 0.00 0.71 0.00 0.00 56.30 56.74 2b0f h ASN 3 Cb 0.12 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 2b0f h ASN 3 CO -0.03 1.00 -0.46 0.71 -1.29 0.00 0.00 177.43 177.36 2b0f h THR 4 N 0.52 1.09 -0.24 -3.57 1.35 -1.97 -2.39 112.91 107.70 2b0f h THR 4 Ca 0.08 -1.74 -0.05 0.00 -0.55 0.00 0.00 66.41 64.15 2b0f h THR 4 Cb 0.71 2.00 -0.01 0.00 -1.73 0.00 0.00 68.15 69.13 2b0f h THR 4 CO 0.05 0.45 -0.06 -0.08 -0.25 0.00 0.00 175.52 175.64 2b0f h GLU 5 N 0.00 0.47 -0.47 4.72 4.57 -0.43 -1.84 114.58 121.61 2b0f h GLU 5 Ca -0.00 -0.18 0.02 0.00 -1.18 0.00 0.00 59.36 58.02 2b0f h GLU 5 Cb 0.97 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.50 2b0f h GLU 5 CO 0.06 0.70 0.28 0.35 -1.18 0.00 0.00 179.01 179.21 2b0f h PHE 6 N 0.21 0.52 -0.34 0.92 3.57 -0.93 -1.18 116.94 119.69 2b0f h PHE 6 Ca 0.06 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 2b0f h PHE 6 Cb 0.52 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 2b0f h PHE 6 CO 0.05 0.30 -0.01 0.00 -2.23 0.00 0.00 178.31 176.42 2b0f h ALA 7 N 1.21 0.46 -0.44 2.41 0.00 -1.41 -2.14 119.26 119.35 2b0f h ALA 7 Ca 0.19 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 2b0f h ALA 7 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2b0f h ALA 7 CO -0.08 0.23 -0.23 1.25 0.00 0.00 0.00 179.25 180.42 2b0f h LEU 8 N 0.42 0.93 -0.66 0.00 5.85 -1.20 -0.58 115.31 120.07 2b0f h LEU 8 Ca 0.10 -0.35 -0.12 0.00 0.84 0.00 0.00 57.88 58.35 2b0f h LEU 8 Cb 0.46 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 2b0f h LEU 8 CO 0.02 1.11 -0.20 0.77 -0.34 0.00 0.00 178.44 179.80 2b0f h SER 9 N 0.78 0.84 -0.63 1.25 4.64 -1.22 -2.76 113.55 116.45 2b0f h SER 9 Ca 0.10 -0.30 -0.08 0.00 -0.47 0.00 0.00 61.79 61.04 2b0f h SER 9 Cb 0.78 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2b0f h SER 9 CO 0.06 1.02 0.08 0.25 -0.87 0.00 0.00 176.83 177.38 2b0f h LEU 10 N 0.73 1.03 -0.54 5.97 5.85 -1.22 -2.94 115.31 124.19 2b0f h LEU 10 Ca 0.10 -0.27 0.11 0.00 0.84 0.00 0.00 57.88 58.66 2b0f h LEU 10 Cb 0.72 -0.27 -0.09 0.00 0.37 0.00 0.00 40.66 41.39 2b0f h LEU 10 CO 0.06 1.04 -0.02 0.25 -0.34 0.00 0.00 178.44 179.43 2b0f h LEU 11 N 0.98 -0.28 -1.02 2.25 7.12 -0.83 -0.30 115.31 123.24 2b0f h LEU 11 Ca 0.19 0.14 -0.10 0.00 0.13 0.00 0.00 57.88 58.23 2b0f h LEU 11 Cb 0.47 0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.83 2b0f h LEU 11 CO 0.02 -0.10 -0.48 0.03 -0.13 0.00 0.00 178.44 177.77 2b0f h ARG 12 N 0.10 0.00 0.00 1.25 3.08 -1.41 -2.94 114.38 114.46 2b0f h ARG 12 Ca 0.27 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.29 2b0f h ARG 12 Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 2b0f h ARG 12 CO -0.47 0.48 -0.67 1.63 -1.07 0.00 0.00 179.97 179.87 2b0f n LYS 13 N -3.91 0.47 -0.12 0.04 4.76 -0.74 -4.72 118.16 113.94 2b0f n LYS 13 Ca -0.01 0.49 0.05 0.00 -2.87 0.00 0.00 58.31 55.97 2b0f n LYS 13 Cb 0.51 -1.67 0.12 0.00 -1.84 0.00 0.00 35.03 32.15 2b0f n LYS 13 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2b0f n ASN 14 N -4.58 2.60 -4.32 4.39 4.13 -0.20 -4.80 115.26 112.49 2b0f n ASN 14 Ca -0.11 -1.85 -0.41 0.00 1.68 0.00 0.00 54.58 53.89 2b0f n ASN 14 Cb 0.34 -0.16 -0.10 0.00 -1.54 0.00 0.00 39.78 38.32 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 -0.97 4.46 0.09 2.41 -1.09 -1.11 -1.42 121.20 123.57 2b0f s ILE 15 Ca 0.19 -1.18 0.09 0.00 -2.23 0.00 0.00 60.65 57.53 2b0f s ILE 15 Cb 0.11 -3.64 -0.03 0.00 -1.58 0.00 0.00 42.46 37.31 2b0f s ILE 15 CO 0.14 -0.42 -0.25 -0.04 -1.23 0.00 0.00 174.94 173.14 2b0f s MET 16 N 1.49 1.46 -0.40 2.79 -1.94 -1.14 -4.75 119.30 116.80 2b0f s MET 16 Ca 0.03 -1.19 -0.29 0.00 -1.71 0.00 0.00 55.69 52.53 2b0f s MET 16 Cb -0.22 -1.77 0.01 0.00 2.01 0.00 0.00 34.83 34.86 2b0f s MET 16 CO 0.04 0.43 1.33 0.99 -0.01 0.00 0.00 175.02 177.80 2b0f s THR 17 N -0.97 4.03 -0.50 2.05 2.01 -1.26 -1.05 115.64 119.94 2b0f s THR 17 Ca 0.11 1.07 -0.20 0.00 0.31 0.00 0.00 61.69 62.99 2b0f s THR 17 Cb -0.10 -4.28 0.05 0.00 0.01 0.00 0.00 72.50 68.18 2b0f s THR 17 CO 0.04 -0.75 0.67 -0.63 -0.69 0.00 0.00 174.62 173.26 2b0f s ILE 18 N 4.98 4.80 -0.74 1.82 -1.09 0.09 -0.93 121.20 130.14 2b0f s ILE 18 Ca 0.57 -0.31 -0.26 0.00 -2.23 0.00 0.00 60.65 58.42 2b0f s ILE 18 Cb -0.13 -4.32 0.01 0.00 -1.58 0.00 0.00 42.46 36.44 2b0f s ILE 18 CO 0.30 -0.82 1.53 -0.89 -1.23 0.00 0.00 174.94 173.84 2b0f s THR 19 N 2.83 3.60 0.48 2.92 2.01 0.30 -0.84 115.64 126.94 2b0f s THR 19 Ca 0.18 0.17 0.07 0.00 0.31 0.00 0.00 61.69 62.42 2b0f s THR 19 Cb -0.18 -4.55 0.07 0.00 0.01 0.00 0.00 72.50 67.85 2b0f s THR 19 CO 0.14 -1.50 0.55 0.41 -0.69 0.00 0.00 174.62 173.54 2b0f n THR 20 N 6.80 0.00 0.10 -0.82 -1.04 0.32 -2.59 114.28 117.05 2b0f n THR 20 Ca 0.14 -1.69 0.07 0.00 -2.04 0.00 0.00 64.05 60.53 2b0f n THR 20 Cb 0.50 -0.42 0.53 0.00 -1.82 0.00 0.00 70.33 69.12 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 0.24 0.25 0.08 8.00 0.02 -1.53 -1.21 113.55 119.41 2b0f h SER 21 Ca -0.25 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2b0f h SER 21 Cb 1.05 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2b0f h SER 21 CO 0.37 0.18 -0.07 0.29 -1.14 0.00 0.00 176.83 176.46 2b0f n LYS 22 N -4.50 1.34 0.00 3.45 5.02 -1.16 -5.04 118.16 117.27 2b0f n LYS 22 Ca 0.02 -0.72 0.00 0.00 -2.02 0.00 0.00 58.31 55.58 2b0f n LYS 22 Cb 0.12 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 2b0f n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b0f n GLY 23 N 1.21 0.74 3.71 0.72 0.00 -0.46 -5.05 105.19 106.06 2b0f n GLY 23 Ca 0.17 -2.07 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.12 4.21 0.34 1.61 2.02 -1.26 0.12 118.70 124.61 2b0f s GLU 24 Ca 0.00 0.02 0.07 0.00 0.02 0.00 0.00 54.97 55.08 2b0f s GLU 24 Cb 0.00 -3.46 -0.07 0.00 0.10 0.00 0.00 34.13 30.70 2b0f s GLU 24 CO 0.00 0.16 -0.03 -0.06 0.02 0.00 0.00 175.26 175.35 2b0f s PHE 25 N 0.71 2.21 -0.59 1.61 0.08 -0.02 -0.95 117.98 121.03 2b0f s PHE 25 Ca 0.15 -0.68 -0.27 0.00 0.12 0.00 0.00 56.93 56.25 2b0f s PHE 25 Cb -0.13 -1.37 -0.03 0.00 -0.57 0.00 0.00 43.02 40.92 2b0f s PHE 25 CO 0.04 0.36 1.92 0.99 -0.10 0.00 0.00 175.22 178.43 2b0f s THR 26 N -2.88 3.32 -0.49 0.64 2.01 -1.07 -0.73 115.64 116.44 2b0f s THR 26 Ca 0.33 0.19 -0.28 0.00 0.31 0.00 0.00 61.69 62.24 2b0f s THR 26 Cb 0.06 -3.82 0.03 0.00 0.01 0.00 0.00 72.50 68.77 2b0f s THR 26 CO 0.15 -0.79 1.10 -0.83 -0.69 0.00 0.00 174.62 173.56 2b0f s GLY 27 N 8.48 1.32 -0.82 4.40 0.00 -0.22 -4.81 107.32 115.67 2b0f s GLY 27 Ca 0.71 -0.59 -0.21 0.00 0.00 0.00 0.00 44.72 44.63 2b0f s GLY 27 CO 0.22 2.34 1.10 -2.27 0.00 0.00 0.00 173.10 174.49 2b0f s LEU 28 N 4.36 4.53 -0.08 0.66 2.96 -1.05 -2.89 118.68 127.18 2b0f s LEU 28 Ca 0.45 -1.48 -0.30 0.00 -0.22 0.00 0.00 54.13 52.58 2b0f s LEU 28 Cb -0.08 -2.43 -0.04 0.00 0.50 0.00 0.00 46.19 44.14 2b0f s LEU 28 CO 0.30 -1.30 1.36 -0.83 -1.32 0.00 0.00 176.35 174.56 2b0f s GLY 29 N 3.82 1.76 -0.24 7.98 0.00 -0.51 -0.76 107.32 119.38 2b0f s GLY 29 Ca 0.30 0.70 -0.18 0.00 0.00 0.00 0.00 44.72 45.54 2b0f s GLY 29 CO -0.01 2.55 -0.06 1.39 0.00 0.00 0.00 173.10 176.98 2b0f n ILE 30 N 5.05 1.53 -3.49 0.90 2.08 0.72 -4.79 119.36 121.37 2b0f n ILE 30 Ca 0.14 -0.18 -0.15 0.00 0.56 0.00 0.00 62.75 63.12 2b0f n ILE 30 Cb 0.44 -1.98 -0.04 0.00 -0.75 0.00 0.00 39.64 37.30 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 -2.43 -0.58 0.00 1.39 -3.43 -1.18 -0.38 115.29 108.67 2b0f s HIS 31 Ca -0.33 0.79 0.00 0.00 -0.80 0.00 0.00 55.06 54.72 2b0f s HIS 31 Cb 0.10 0.47 0.00 0.00 -1.43 0.00 0.00 32.58 31.71 2b0f s HIS 31 CO 0.54 -0.65 0.00 -0.25 -2.00 0.00 0.00 174.74 172.37 2b0f n ASP 32 N 0.43 0.00 -0.32 7.38 8.00 -1.18 0.54 116.55 131.41 2b0f n ASP 32 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.33 2b0f n ASP 32 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.70 2b0f n ASP 32 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2b0f n ARG 33 N 0.00 0.00 -3.48 -1.24 1.85 -1.26 -1.49 116.66 111.04 2b0f n ARG 33 Ca 0.00 -0.81 -0.40 0.00 -1.00 0.00 0.00 57.85 55.63 2b0f n ARG 33 Cb 0.00 -0.50 -0.10 0.00 -1.05 0.00 0.00 32.46 30.81 2b0f n ARG 33 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2b0f s VAL 34 N 0.00 5.24 0.11 8.89 1.01 0.19 -1.00 120.40 134.84 2b0f s VAL 34 Ca 0.00 -0.11 0.11 0.00 0.00 0.00 0.00 61.98 61.98 2b0f s VAL 34 Cb 0.00 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 2b0f s VAL 34 CO 0.00 -0.04 -0.27 0.00 0.00 0.00 0.00 175.10 174.80 2b0f s VAL 36 N -1.00 3.62 0.14 0.00 1.01 0.06 0.08 120.40 124.31 2b0f s VAL 36 Ca 0.13 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.63 2b0f s VAL 36 Cb -0.10 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 2b0f s VAL 36 CO 0.05 0.51 0.10 0.27 0.00 0.00 0.00 175.10 176.03 2b0f s ILE 37 N 0.32 0.09 0.88 2.22 -4.36 -0.94 -2.52 121.20 116.89 2b0f s ILE 37 Ca -0.06 -1.82 -0.11 0.00 -0.26 0.00 0.00 60.65 58.40 2b0f s ILE 37 Cb -0.15 -2.02 0.12 0.00 1.25 0.00 0.00 42.46 41.66 2b0f s ILE 37 CO 0.04 -0.43 1.09 -2.84 0.24 0.00 0.00 174.94 173.04 2b0f s PRO 38 N -4.04 1.41 0.02 0.37 0.02 -1.26 0.42 135.00 131.94 2b0f s PRO 38 Ca 0.23 0.96 -0.13 0.00 0.02 0.00 0.00 61.00 62.08 2b0f s PRO 38 Cb 0.07 -1.82 -0.34 0.00 0.02 0.00 0.00 34.50 32.44 2b0f s PRO 38 CO 0.02 -2.17 0.96 1.15 -0.33 0.00 0.00 177.00 176.63 2b0f h THR 39 N -1.50 1.25 0.00 0.99 2.02 -1.69 -3.26 112.91 110.72 2b0f h THR 39 Ca -0.48 -2.73 0.00 0.00 0.77 0.00 0.00 66.41 63.97 2b0f h THR 39 Cb 1.27 2.97 0.00 0.00 -1.74 0.00 0.00 68.15 70.65 2b0f h THR 39 CO 0.53 0.83 0.00 0.00 0.37 0.00 0.00 175.52 177.25 2b0f n HIS 40 N -3.65 0.00 0.63 3.16 1.44 -1.26 -2.44 115.22 113.10 2b0f n HIS 40 Ca -0.17 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.66 2b0f n HIS 40 Cb 1.09 0.00 0.46 0.00 0.12 0.00 0.00 29.99 31.66 2b0f n HIS 40 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2b0f n ALA 41 N -0.89 2.03 -2.81 1.59 0.00 -1.23 -4.89 120.51 114.32 2b0f n ALA 41 Ca 0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 53.44 53.51 2b0f n ALA 41 Cb 0.05 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.09 2b0f n ALA 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2b0f n GLN 42 N -1.96 -1.46 -1.49 0.00 6.02 -1.02 -2.88 117.38 114.58 2b0f n GLN 42 Ca 0.05 1.56 -0.31 0.00 -0.01 0.00 0.00 57.00 58.28 2b0f n GLN 42 Cb 0.32 -5.23 0.06 0.00 1.02 0.00 0.00 30.24 26.41 2b0f n GLN 42 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2b0f s PRO 43 N -2.81 2.71 0.43 -1.09 0.04 -1.26 -3.34 135.00 129.67 2b0f s PRO 43 Ca 0.07 1.06 0.04 0.00 0.04 0.00 0.00 61.00 62.21 2b0f s PRO 43 Cb -0.02 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 2b0f s PRO 43 CO 0.66 -1.29 0.13 0.20 0.04 0.00 0.00 177.00 176.74 2b0f s GLY 44 N -3.55 2.72 0.38 0.56 0.00 -1.26 -5.00 107.32 101.17 2b0f s GLY 44 Ca 0.60 -1.08 0.23 0.00 0.00 0.00 0.00 44.72 44.47 2b0f s GLY 44 CO 0.54 -1.87 1.51 -0.55 0.00 0.00 0.00 173.10 172.73 2b0f h ASP 45 N 1.70 0.00 -3.20 1.64 3.32 -1.94 -3.41 116.42 114.53 2b0f h ASP 45 Ca -0.35 -0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.23 2b0f h ASP 45 Cb 1.28 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.43 2b0f h ASP 45 CO 0.57 0.00 -0.76 1.51 -1.72 0.00 0.00 179.24 178.84 2b0f s ASP 46 N -5.96 2.23 0.45 6.45 -4.77 -1.26 0.31 116.67 114.12 2b0f s ASP 46 Ca 0.06 -0.49 0.06 0.00 -3.30 0.00 0.00 52.55 48.87 2b0f s ASP 46 Cb 0.06 -0.38 -0.04 0.00 -1.09 0.00 0.00 42.92 41.47 2b0f s ASP 46 CO 0.69 -0.29 0.14 0.68 0.70 0.00 0.00 175.17 177.09 2b0f s VAL 47 N 2.02 1.90 -0.07 2.11 -7.23 -0.27 -4.88 120.40 113.97 2b0f s VAL 47 Ca 0.02 -1.79 0.02 0.00 -1.81 0.00 0.00 61.98 58.41 2b0f s VAL 47 Cb -0.15 -2.69 -0.03 0.00 0.56 0.00 0.00 36.38 34.07 2b0f s VAL 47 CO -0.07 0.00 -0.10 -0.76 -0.31 0.00 0.00 175.10 173.85 2b0f s LEU 48 N -3.91 2.94 -1.02 1.32 1.02 -1.07 0.59 118.68 118.55 2b0f s LEU 48 Ca 0.31 -0.14 -0.10 0.00 0.02 0.00 0.00 54.13 54.22 2b0f s LEU 48 Cb 0.04 -1.63 0.26 0.00 0.02 0.00 0.00 46.19 44.88 2b0f s LEU 48 CO 0.17 0.32 1.00 -0.69 0.02 0.00 0.00 176.35 177.17 2b0f s VAL 49 N -0.57 5.84 -1.71 -1.59 1.01 0.15 0.11 120.40 123.64 2b0f s VAL 49 Ca 0.08 -3.15 0.00 0.00 0.00 0.00 0.00 61.98 58.91 2b0f s VAL 49 Cb -0.12 -4.54 0.00 0.00 0.00 0.00 0.00 36.38 31.73 2b0f s VAL 49 CO 0.02 -1.14 0.00 -3.20 0.00 0.00 0.00 175.10 170.78 2b0f n ASN 50 N 3.07 -5.36 0.00 3.32 4.05 -0.10 -3.17 115.26 117.07 2b0f n ASN 50 Ca 0.21 0.13 0.00 0.00 0.45 0.00 0.00 54.58 55.36 2b0f n ASN 50 Cb 0.41 -4.44 0.00 0.00 1.23 0.00 0.00 39.78 36.98 2b0f n ASN 50 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2b0f n GLY 51 N -0.92 4.07 3.63 8.20 0.00 -1.26 -5.07 105.19 113.84 2b0f n GLY 51 Ca -0.21 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.56 2b0f n GLY 51 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2b0f s GLN 52 N 0.00 3.95 -0.14 1.61 0.74 -1.19 -4.91 119.66 119.72 2b0f s GLN 52 Ca 0.00 1.35 -0.29 0.00 0.05 0.00 0.00 55.36 56.47 2b0f s GLN 52 Cb 0.00 -3.88 -0.02 0.00 1.10 0.00 0.00 33.01 30.22 2b0f s GLN 52 CO 0.00 -1.07 1.19 -1.59 -0.55 0.00 0.00 175.29 173.27 2b0f s LYS 53 N 4.11 4.29 0.09 1.67 -2.85 -1.26 0.32 119.74 126.11 2b0f s LYS 53 Ca 0.57 1.60 0.08 0.00 -1.00 0.00 0.00 55.97 57.22 2b0f s LYS 53 Cb -0.18 -3.67 -0.03 0.00 -2.06 0.00 0.00 37.83 31.89 2b0f s LYS 53 CO 0.22 -0.59 -0.20 -1.50 0.10 0.00 0.00 175.35 173.38 2b0f s ILE 54 N 2.95 1.66 0.04 3.79 2.07 0.20 -4.96 121.20 126.94 2b0f s ILE 54 Ca 0.53 -1.46 -0.07 0.00 -1.41 0.00 0.00 60.65 58.24 2b0f s ILE 54 Cb -0.21 -1.50 -0.05 0.00 0.13 0.00 0.00 42.46 40.83 2b0f s ILE 54 CO 0.16 -0.02 0.31 -0.13 -1.91 0.00 0.00 174.94 173.34 2b0f s ARG 55 N -1.75 3.62 0.09 3.50 3.00 -1.26 -1.12 118.95 125.03 2b0f s ARG 55 Ca 0.06 -0.03 -0.22 0.00 0.00 0.00 0.00 55.73 55.54 2b0f s ARG 55 Cb -0.10 -3.03 -0.07 0.00 0.00 0.00 0.00 34.95 31.75 2b0f s ARG 55 CO 0.04 0.61 0.66 0.54 0.00 0.00 0.00 175.30 177.15 2b0f s VAL 56 N -1.37 4.63 -0.05 3.52 0.11 0.15 -1.45 120.40 125.94 2b0f s VAL 56 Ca 0.31 1.43 -0.16 0.00 -2.93 0.00 0.00 61.98 60.62 2b0f s VAL 56 Cb -0.13 -4.01 -0.31 0.00 -1.53 0.00 0.00 36.38 30.40 2b0f s VAL 56 CO 0.18 0.51 0.76 0.50 -3.33 0.00 0.00 175.10 173.72 2b0f h LYS 57 N 4.70 0.36 -2.09 1.54 1.63 0.73 -3.46 116.57 119.98 2b0f h LYS 57 Ca -0.48 -0.61 -0.01 0.00 -0.85 0.00 0.00 60.65 58.70 2b0f h LYS 57 Cb 1.21 0.23 -0.22 0.00 -0.60 0.00 0.00 32.23 32.85 2b0f h LYS 57 CO 0.66 1.29 -0.00 0.34 -3.45 0.00 0.00 179.45 178.29 2b0f s ASP 58 N -7.20 -0.85 -0.22 4.20 2.15 -0.92 -5.05 116.67 108.78 2b0f s ASP 58 Ca -0.15 1.42 -0.00 0.00 0.43 0.00 0.00 52.55 54.25 2b0f s ASP 58 Cb 0.04 1.32 0.03 0.00 -0.30 0.00 0.00 42.92 44.00 2b0f s ASP 58 CO 0.84 -0.23 -0.12 -1.59 -0.17 0.00 0.00 175.17 173.90 2b0f s LYS 59 N 1.34 2.83 -0.20 4.34 -2.85 -1.26 -0.93 119.74 123.01 2b0f s LYS 59 Ca -0.08 -0.96 -0.02 0.00 -1.00 0.00 0.00 55.97 53.92 2b0f s LYS 59 Cb -0.05 -2.83 0.00 0.00 -2.06 0.00 0.00 37.83 32.90 2b0f s LYS 59 CO -0.15 -0.35 -0.12 -0.47 0.10 0.00 0.00 175.35 174.37 2b0f s TYR 60 N 1.29 2.87 -0.21 1.78 6.14 -0.39 -4.94 117.35 123.89 2b0f s TYR 60 Ca 0.01 -1.23 -0.25 0.00 0.64 0.00 0.00 57.07 56.24 2b0f s TYR 60 Cb -0.16 -2.01 -0.01 0.00 0.42 0.00 0.00 41.96 40.20 2b0f s TYR 60 CO -0.07 -0.64 0.85 0.15 0.64 0.00 0.00 175.55 176.48 2b0f s LYS 61 N 1.34 4.25 -0.18 4.97 1.02 -1.26 0.77 119.74 130.65 2b0f s LYS 61 Ca 0.04 1.03 -0.24 0.00 0.02 0.00 0.00 55.97 56.82 2b0f s LYS 61 Cb -0.14 -3.61 -0.02 0.00 -0.52 0.00 0.00 37.83 33.54 2b0f s LYS 61 CO -0.07 -0.44 0.77 -0.51 -0.92 0.00 0.00 175.35 174.18 2b0f s LEU 62 N 2.56 4.16 0.41 3.17 1.43 0.30 -4.96 118.68 125.75 2b0f s LEU 62 Ca 0.38 1.06 0.05 0.00 -1.03 0.00 0.00 54.13 54.59 2b0f s LEU 62 Cb -0.16 -3.12 -0.06 0.00 0.03 0.00 0.00 46.19 42.87 2b0f s LEU 62 CO 0.10 -0.36 0.02 0.68 0.23 0.00 0.00 176.35 177.02 2b0f s VAL 63 N 2.09 1.63 0.31 -1.59 -7.23 -1.26 -2.51 120.40 111.83 2b0f s VAL 63 Ca 0.35 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.25 2b0f s VAL 63 Cb -0.16 -2.78 -0.10 0.00 0.56 0.00 0.00 36.38 33.90 2b0f s VAL 63 CO 0.12 0.00 0.97 -0.62 -0.31 0.00 0.00 175.10 175.26 2b0f s ASP 64 N -3.69 7.33 0.59 4.85 2.15 0.54 -4.65 116.67 123.78 2b0f s ASP 64 Ca 0.29 1.94 0.30 0.00 0.43 0.00 0.00 52.55 55.51 2b0f s ASP 64 Cb 0.08 -2.59 1.35 0.00 -0.30 0.00 0.00 42.92 41.46 2b0f s ASP 64 CO 0.15 -0.08 1.73 1.55 -0.17 0.00 0.00 175.17 178.35 2b0f h PRO 65 N 3.38 0.00 -0.81 4.34 0.13 -1.99 0.45 132.00 137.51 2b0f h PRO 65 Ca -0.47 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.58 2b0f h PRO 65 Cb 1.20 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 2b0f h PRO 65 CO 0.66 0.00 0.11 -1.91 -0.23 0.00 0.00 178.00 176.63 2b0f n GLU 66 N -3.63 2.98 -1.03 0.86 4.07 -1.26 -4.86 120.64 117.77 2b0f n GLU 66 Ca 0.15 -1.93 -0.01 0.00 -0.06 0.00 0.00 57.16 55.30 2b0f n GLU 66 Cb 0.97 -1.91 -0.00 0.00 -0.06 0.00 0.00 31.44 30.44 2b0f n GLU 66 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2b0f n ASN 67 N 0.14 -4.01 -4.92 4.31 5.03 0.16 -5.02 115.26 110.95 2b0f n ASN 67 Ca 0.23 0.03 -0.26 0.00 0.87 0.00 0.00 54.58 55.45 2b0f n ASN 67 Cb 0.95 -1.61 0.02 0.00 -1.02 0.00 0.00 39.78 38.12 2b0f n ASN 67 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2b0f s ILE 68 N -1.75 3.93 0.27 2.41 -1.09 -1.17 -4.82 121.20 118.98 2b0f s ILE 68 Ca 0.00 -0.09 -0.29 0.00 -2.23 0.00 0.00 60.65 58.03 2b0f s ILE 68 Cb 0.00 -3.52 -0.09 0.00 -1.58 0.00 0.00 42.46 37.27 2b0f s ILE 68 CO 0.00 -0.49 1.13 0.21 -1.23 0.00 0.00 174.94 174.56 2b0f s ASN 69 N -4.25 7.19 -0.17 3.58 2.47 -1.24 0.20 114.94 122.71 2b0f s ASN 69 Ca 0.51 2.31 0.05 0.00 0.42 0.00 0.00 52.86 56.15 2b0f s ASN 69 Cb -0.10 -2.63 -0.14 0.00 -1.45 0.00 0.00 41.25 36.93 2b0f s ASN 69 CO 0.43 -0.22 -0.09 -0.11 -3.72 0.00 0.00 177.10 173.39 2b0f n LEU 70 N 1.34 2.00 0.00 3.21 -0.00 -1.18 -0.23 117.00 122.14 2b0f n LEU 70 Ca -0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 56.01 55.94 2b0f n LEU 70 Cb 0.44 -0.31 0.00 0.00 -0.00 0.00 0.00 43.42 43.55 2b0f n LEU 70 CO 0.55 0.66 0.00 1.21 -0.00 0.00 0.00 177.39 179.81 2b0f n GLU 71 N -2.87 0.00 -4.39 1.96 4.07 -1.04 -4.80 120.64 113.57 2b0f n GLU 71 Ca -0.30 0.32 -0.31 0.00 -0.06 0.00 0.00 57.16 56.81 2b0f n GLU 71 Cb 0.89 -3.11 -0.10 0.00 -0.06 0.00 0.00 31.44 29.06 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 0.00 3.14 -0.24 4.31 2.01 -1.20 -2.07 118.68 124.63 2b0f s LEU 72 Ca 0.00 -0.21 0.00 0.00 0.01 0.00 0.00 54.13 53.93 2b0f s LEU 72 Cb 0.00 -1.84 0.03 0.00 0.01 0.00 0.00 46.19 44.39 2b0f s LEU 72 CO 0.00 0.25 -0.10 -0.89 1.01 0.00 0.00 176.35 176.62 2b0f s THR 73 N -1.07 2.54 -0.73 5.49 2.01 0.17 0.11 115.64 124.16 2b0f s THR 73 Ca 0.19 -1.19 -0.27 0.00 0.31 0.00 0.00 61.69 60.73 2b0f s THR 73 Cb -0.11 -2.31 0.03 0.00 0.01 0.00 0.00 72.50 70.12 2b0f s THR 73 CO 0.10 0.19 1.24 -0.69 -0.69 0.00 0.00 174.62 174.77 2b0f s VAL 74 N 1.26 3.79 -0.60 3.82 1.01 0.23 -2.22 120.40 127.70 2b0f s VAL 74 Ca -0.02 0.33 -0.20 0.00 0.00 0.00 0.00 61.98 62.10 2b0f s VAL 74 Cb -0.17 -4.89 0.09 0.00 0.00 0.00 0.00 36.38 31.41 2b0f s VAL 74 CO -0.06 -1.81 0.75 -0.22 0.00 0.00 0.00 175.10 173.76 2b0f s LEU 75 N 5.54 5.14 -0.79 3.92 2.96 0.11 -1.26 118.68 134.30 2b0f s LEU 75 Ca 0.34 -1.28 -0.19 0.00 -0.22 0.00 0.00 54.13 52.78 2b0f s LEU 75 Cb -0.09 -2.35 0.13 0.00 0.50 0.00 0.00 46.19 44.38 2b0f s LEU 75 CO 0.15 -1.16 0.94 -0.89 -1.32 0.00 0.00 176.35 174.07 2b0f s THR 76 N 2.96 4.84 0.50 3.68 2.01 -0.11 -0.76 115.64 128.76 2b0f s THR 76 Ca 0.14 -1.42 -0.07 0.00 0.31 0.00 0.00 61.69 60.65 2b0f s THR 76 Cb -0.22 -4.64 -0.04 0.00 0.01 0.00 0.00 72.50 67.60 2b0f s THR 76 CO 0.08 -1.33 0.83 -0.76 -0.69 0.00 0.00 174.62 172.75 2b0f s LEU 77 N 2.45 3.58 -0.94 4.42 1.43 -0.17 0.12 118.68 129.57 2b0f s LEU 77 Ca 0.23 1.06 -0.24 0.00 -1.03 0.00 0.00 54.13 54.16 2b0f s LEU 77 Cb -0.12 -4.02 0.04 0.00 0.03 0.00 0.00 46.19 42.11 2b0f s LEU 77 CO -0.03 -0.61 1.47 -0.62 0.23 0.00 0.00 176.35 176.80 2b0f s ASP 78 N -3.97 6.27 -0.10 2.29 2.15 -0.53 -4.61 116.67 118.17 2b0f s ASP 78 Ca 0.50 -1.14 0.01 0.00 0.43 0.00 0.00 52.55 52.35 2b0f s ASP 78 Cb -0.10 -2.57 0.02 0.00 -0.30 0.00 0.00 42.92 39.97 2b0f s ASP 78 CO 0.44 -1.71 -0.10 -0.60 -0.17 0.00 0.00 175.17 173.03 2b0f s ARG 79 N 5.37 1.68 -0.11 4.34 6.06 -1.26 -4.85 118.95 130.18 2b0f s ARG 79 Ca 0.47 -0.34 -0.08 0.00 -2.50 0.00 0.00 55.73 53.27 2b0f s ARG 79 Cb -0.03 -1.60 -0.07 0.00 0.06 0.00 0.00 34.95 33.32 2b0f s ARG 79 CO -0.03 -0.17 0.19 -0.97 -2.50 0.00 0.00 175.30 171.81 2b0f h ASN 80 N 7.77 0.00 -2.51 -2.12 -1.24 -1.91 -3.43 115.58 112.15 2b0f h ASN 80 Ca -0.31 -0.26 -0.56 0.00 0.71 0.00 0.00 56.30 55.88 2b0f h ASN 80 Cb 1.15 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.19 2b0f h ASN 80 CO 0.44 0.66 1.23 -1.61 -1.29 0.00 0.00 177.43 176.87 2b0f s GLU 81 N -1.77 3.71 0.39 6.67 2.02 -1.26 -4.94 118.70 123.51 2b0f s GLU 81 Ca -0.06 1.93 -0.24 0.00 0.02 0.00 0.00 54.97 56.62 2b0f s GLU 81 Cb -0.00 -4.14 -0.09 0.00 0.10 0.00 0.00 34.13 29.99 2b0f s GLU 81 CO 0.20 -1.42 1.03 -1.59 0.02 0.00 0.00 175.26 173.50 2b0f s LYS 82 N 5.02 4.24 0.40 1.61 -2.85 -1.25 -4.86 119.74 122.05 2b0f s LYS 82 Ca 0.81 1.48 -0.24 0.00 -1.00 0.00 0.00 55.97 57.02 2b0f s LYS 82 Cb -0.30 -2.58 -0.09 0.00 -2.06 0.00 0.00 37.83 32.80 2b0f s LYS 82 CO 0.33 -0.07 1.06 -0.06 0.10 0.00 0.00 175.35 176.72 2b0f s PHE 83 N -1.66 3.23 0.02 1.78 0.08 -0.55 -4.82 117.98 116.05 2b0f s PHE 83 Ca 0.56 1.63 -0.33 0.00 0.12 0.00 0.00 56.93 58.92 2b0f s PHE 83 Cb -0.21 -3.15 -0.11 0.00 -0.57 0.00 0.00 43.02 38.97 2b0f s PHE 83 CO 0.27 -0.71 1.84 -2.13 -0.10 0.00 0.00 175.22 174.38 2b0f n ARG 84 N -0.10 2.43 -1.59 0.44 3.00 -1.26 -3.09 116.66 116.48 2b0f n ARG 84 Ca 0.05 0.89 -0.14 0.00 -0.00 0.00 0.00 57.85 58.64 2b0f n ARG 84 Cb 0.49 -2.75 -0.07 0.00 0.00 0.00 0.00 32.46 30.14 2b0f n ARG 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2b0f s ASP 85 N 3.34 3.95 -0.40 6.15 1.11 -1.25 -4.43 116.67 125.14 2b0f s ASP 85 Ca 0.88 0.04 0.02 0.00 0.18 0.00 0.00 52.55 53.67 2b0f s ASP 85 Cb -0.60 -2.55 0.51 0.00 1.07 0.00 0.00 42.92 41.35 2b0f s ASP 85 CO 0.45 -3.82 1.81 2.30 1.18 0.00 0.00 175.17 177.09 2b0f n ILE 86 N 8.74 2.91 0.17 0.77 -5.35 0.48 -4.53 119.36 122.55 2b0f n ILE 86 Ca 0.46 -1.75 0.03 0.00 -0.27 0.00 0.00 62.75 61.23 2b0f n ILE 86 Cb 0.44 -0.70 0.41 0.00 -1.74 0.00 0.00 39.64 38.04 2b0f n ILE 86 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 2b0f h ARG 87 N 1.02 0.08 0.00 6.28 3.08 -1.85 -1.96 114.38 121.03 2b0f h ARG 87 Ca 0.52 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.54 2b0f h ARG 87 Cb 2.19 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 32.23 2b0f h ARG 87 CO 0.98 0.32 0.00 0.78 -1.07 0.00 0.00 179.97 180.98 2b0f h GLY 88 N 0.81 0.00 1.99 0.04 0.00 -1.96 -2.41 103.07 101.54 2b0f h GLY 88 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2b0f h GLY 88 CO 0.03 0.00 -0.01 0.74 0.00 0.00 0.00 176.54 177.30 2b0f h PHE 89 N 0.00 0.00 -3.40 5.60 0.04 -1.65 -3.43 116.94 114.11 2b0f h PHE 89 Ca 0.00 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 60.24 2b0f h PHE 89 Cb 0.70 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.85 2b0f h PHE 89 CO 0.00 0.00 0.47 0.42 -0.60 0.00 0.00 178.31 178.60 2b0f s ILE 90 N -3.14 4.24 -0.24 -0.55 1.01 -0.91 -1.36 121.20 120.27 2b0f s ILE 90 Ca 0.09 1.72 -0.16 0.00 0.00 0.00 0.00 60.65 62.31 2b0f s ILE 90 Cb 0.10 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 2b0f s ILE 90 CO 0.62 0.20 0.40 -0.44 0.00 0.00 0.00 174.94 175.72 2b0f s SER 91 N 0.59 6.36 0.50 3.58 0.01 -1.19 -4.59 113.70 118.95 2b0f s SER 91 Ca 0.53 0.42 0.16 0.00 1.31 0.00 0.00 55.95 58.37 2b0f s SER 91 Cb -0.27 -2.23 1.20 0.00 0.21 0.00 0.00 66.02 64.93 2b0f s SER 91 CO 0.31 -0.15 2.09 1.05 0.41 0.00 0.00 173.24 176.95 2b0f h GLU 92 N 7.78 0.00 -5.10 12.44 4.11 -1.89 -1.56 114.58 130.36 2b0f h GLU 92 Ca -0.33 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 58.73 2b0f h GLU 92 Cb 1.16 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.26 2b0f h GLU 92 CO 0.69 0.07 -0.68 0.34 0.07 0.00 0.00 179.01 179.50 2b0f s ASP 93 N -6.98 1.86 0.00 3.06 2.15 -1.26 -4.17 116.67 111.33 2b0f s ASP 93 Ca -0.05 -1.14 0.00 0.00 0.43 0.00 0.00 52.55 51.80 2b0f s ASP 93 Cb 0.16 -0.01 0.00 0.00 -0.30 0.00 0.00 42.92 42.78 2b0f s ASP 93 CO 0.67 -0.43 0.12 0.18 -0.17 0.00 0.00 175.17 175.54 2b0f n LEU 94 N -0.34 1.93 -3.09 -1.34 4.77 -1.26 -4.94 117.00 112.73 2b0f n LEU 94 Ca -0.07 0.12 -0.21 0.00 -0.03 0.00 0.00 56.01 55.83 2b0f n LEU 94 Cb 0.63 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.73 2b0f n LEU 94 CO 0.35 0.00 -0.18 -1.84 -1.33 0.00 0.00 177.39 174.39 2b0f n GLU 95 N -0.45 -1.14 -3.23 3.23 0.28 -1.26 -4.93 120.64 113.15 2b0f n GLU 95 Ca 0.00 0.68 -0.02 0.00 -0.16 0.00 0.00 57.16 57.66 2b0f n GLU 95 Cb 0.00 -1.41 -0.02 0.00 1.43 0.00 0.00 31.44 31.44 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 -1.97 -1.04 0.34 -1.84 0.00 -1.26 -5.04 107.32 96.52 2b0f s GLY 96 Ca 0.11 0.17 0.03 0.00 0.00 0.00 0.00 44.72 45.03 2b0f s GLY 96 CO 0.59 3.49 1.93 -2.08 0.00 0.00 0.00 173.10 177.04 2b0f h VAL 97 N 5.24 1.18 -3.63 1.40 2.07 -1.92 -3.41 116.25 117.18 2b0f h VAL 97 Ca 0.03 -0.55 -0.60 0.00 0.82 0.00 0.00 66.70 66.40 2b0f h VAL 97 Cb 1.16 0.62 -0.32 0.00 -1.52 0.00 0.00 31.29 31.22 2b0f h VAL 97 CO 0.13 0.22 -0.85 -0.62 0.02 0.00 0.00 177.57 176.47 2b0f s ASP 98 N -6.63 2.42 0.28 0.57 2.15 -1.26 -0.97 116.67 113.24 2b0f s ASP 98 Ca -0.09 -0.41 -0.02 0.00 0.43 0.00 0.00 52.55 52.46 2b0f s ASP 98 Cb 0.16 -0.91 -0.02 0.00 -0.30 0.00 0.00 42.92 41.86 2b0f s ASP 98 CO 0.77 0.13 0.33 0.00 -0.17 0.00 0.00 175.17 176.23 2b0f s ALA 99 N 0.26 0.95 0.04 3.66 0.00 0.12 -4.76 121.76 122.03 2b0f s ALA 99 Ca -0.11 -1.58 0.04 0.00 0.00 0.00 0.00 51.96 50.32 2b0f s ALA 99 Cb -0.15 1.28 -0.02 0.00 0.00 0.00 0.00 23.12 24.23 2b0f s ALA 99 CO 0.05 -0.72 -0.13 0.99 0.00 0.00 0.00 175.76 175.95 2b0f s THR 100 N -3.64 1.01 -0.32 0.00 2.01 0.12 -1.28 115.64 113.54 2b0f s THR 100 Ca 0.34 -0.99 -0.09 0.00 0.31 0.00 0.00 61.69 61.26 2b0f s THR 100 Cb 0.02 -0.94 0.01 0.00 0.01 0.00 0.00 72.50 71.61 2b0f s THR 100 CO 0.17 -0.05 0.14 -0.22 -0.69 0.00 0.00 174.62 173.97 2b0f s LEU 101 N -1.18 4.16 -0.40 4.42 2.96 0.17 -0.73 118.68 128.09 2b0f s LEU 101 Ca 0.00 -0.72 -0.14 0.00 -0.22 0.00 0.00 54.13 53.05 2b0f s LEU 101 Cb -0.08 -1.96 0.01 0.00 0.50 0.00 0.00 46.19 44.67 2b0f s LEU 101 CO 0.01 -0.24 0.28 -0.69 -1.32 0.00 0.00 176.35 174.39 2b0f s VAL 102 N 1.55 5.21 -0.25 1.68 1.01 0.12 -0.57 120.40 129.15 2b0f s VAL 102 Ca 0.03 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.37 2b0f s VAL 102 Cb -0.18 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.34 2b0f s VAL 102 CO 0.05 -0.25 -0.02 -0.69 0.00 0.00 0.00 175.10 174.19 2b0f s VAL 103 N 1.68 3.36 -0.51 2.92 1.01 0.75 -0.20 120.40 129.41 2b0f s VAL 103 Ca 0.05 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.37 2b0f s VAL 103 Cb -0.19 -2.63 0.16 0.00 0.00 0.00 0.00 36.38 33.72 2b0f s VAL 103 CO 0.10 0.27 0.36 -2.28 0.00 0.00 0.00 175.10 173.55 2b0f s HIS 104 N 1.44 2.10 0.00 5.22 5.65 -1.21 -0.58 115.29 127.91 2b0f s HIS 104 Ca 0.03 -2.65 0.00 0.00 0.25 0.00 0.00 55.06 52.69 2b0f s HIS 104 Cb -0.16 -1.74 0.00 0.00 -1.18 0.00 0.00 32.58 29.50 2b0f s HIS 104 CO -0.02 -0.73 0.00 -1.13 -0.65 0.00 0.00 174.74 172.21 2b0f n SER 105 N 2.80 1.04 0.08 9.88 3.41 0.11 -2.59 113.62 128.36 2b0f n SER 105 Ca 0.20 -0.46 0.13 0.00 -0.26 0.00 0.00 58.87 58.49 2b0f n SER 105 Cb 0.40 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.74 2b0f n SER 105 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2b0f n ASN 106 N -0.89 0.67 -0.03 4.04 6.94 -0.13 -4.09 115.26 121.77 2b0f n ASN 106 Ca 0.00 0.46 -0.02 0.00 -0.02 0.00 0.00 54.58 55.00 2b0f n ASN 106 Cb 0.00 -0.56 -0.01 0.00 -2.36 0.00 0.00 39.78 36.86 2b0f n ASN 106 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2b0f n ASN 107 N -2.10 0.72 -4.40 0.53 2.85 -1.26 -4.90 115.26 106.69 2b0f n ASN 107 Ca 0.05 0.39 -0.36 0.00 -0.11 0.00 0.00 54.58 54.56 2b0f n ASN 107 Cb 0.42 -0.65 -0.13 0.00 1.24 0.00 0.00 39.78 40.66 2b0f n ASN 107 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 2b0f s PHE 108 N -1.50 3.04 -0.40 1.20 0.08 -1.26 -5.08 117.98 114.06 2b0f s PHE 108 Ca -0.06 -0.59 -0.15 0.00 0.12 0.00 0.00 56.93 56.25 2b0f s PHE 108 Cb 0.01 -2.16 0.02 0.00 -0.57 0.00 0.00 43.02 40.31 2b0f s PHE 108 CO 0.09 -0.39 0.29 0.95 -0.10 0.00 0.00 175.22 176.06 2b0f s THR 109 N 1.44 5.26 -1.48 0.64 -4.23 -1.26 0.09 115.64 116.11 2b0f s THR 109 Ca 0.05 -0.60 -0.02 0.00 -1.18 0.00 0.00 61.69 59.94 2b0f s THR 109 Cb -0.15 -3.90 0.00 0.00 1.34 0.00 0.00 72.50 69.79 2b0f s THR 109 CO 0.01 -0.27 0.25 0.59 -0.54 0.00 0.00 174.62 174.65 2b0f n ASN 110 N 5.15 -5.45 -4.54 3.99 3.02 -1.03 -4.93 115.26 111.48 2b0f n ASN 110 Ca -0.11 -0.13 -0.42 0.00 -0.03 0.00 0.00 54.58 53.89 2b0f n ASN 110 Cb 0.47 -4.41 -0.03 0.00 -0.61 0.00 0.00 39.78 35.21 2b0f n ASN 110 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2b0f s THR 111 N -3.00 3.96 -0.77 3.41 2.01 0.26 -4.91 115.64 116.59 2b0f s THR 111 Ca 0.12 0.40 -0.14 0.00 0.31 0.00 0.00 61.69 62.38 2b0f s THR 111 Cb -0.05 -4.80 0.20 0.00 0.01 0.00 0.00 72.50 67.86 2b0f s THR 111 CO 0.15 -1.59 0.71 -0.51 -0.69 0.00 0.00 174.62 172.69 2b0f s ILE 112 N 5.10 5.52 -0.36 1.82 2.07 -1.26 -0.18 121.20 133.91 2b0f s ILE 112 Ca 0.34 -2.29 -0.13 0.00 -1.41 0.00 0.00 60.65 57.17 2b0f s ILE 112 Cb -0.10 -4.43 0.00 0.00 0.13 0.00 0.00 42.46 38.06 2b0f s ILE 112 CO 0.17 -1.00 0.24 -0.22 -1.91 0.00 0.00 174.94 172.23 2b0f s LEU 113 N 0.44 4.66 -0.31 8.50 0.20 0.26 -4.94 118.68 127.50 2b0f s LEU 113 Ca 0.15 -0.65 -0.29 0.00 0.69 0.00 0.00 54.13 54.03 2b0f s LEU 113 Cb -0.14 -2.11 -0.01 0.00 -0.43 0.00 0.00 46.19 43.50 2b0f s LEU 113 CO -0.07 -0.31 1.61 -1.61 -0.29 0.00 0.00 176.35 175.69 2b0f s GLU 114 N 1.67 3.59 -0.01 1.98 2.02 -1.26 0.46 118.70 127.15 2b0f s GLU 114 Ca 0.05 1.39 0.02 0.00 0.02 0.00 0.00 54.97 56.45 2b0f s GLU 114 Cb -0.18 -4.08 -0.25 0.00 0.10 0.00 0.00 34.13 29.72 2b0f s GLU 114 CO 0.09 -1.54 0.79 -0.39 0.02 0.00 0.00 175.26 174.23 2b0f h VAL 115 N 6.45 1.07 0.00 2.63 -1.51 -1.83 -3.47 116.25 119.59 2b0f h VAL 115 Ca -0.32 -2.79 0.00 0.00 -1.23 0.00 0.00 66.70 62.36 2b0f h VAL 115 Cb 1.14 2.64 0.00 0.00 -2.13 0.00 0.00 31.29 32.95 2b0f h VAL 115 CO 1.03 0.75 0.00 0.61 -1.23 0.00 0.00 177.57 178.74 2b0f n GLY 116 N 1.64 1.14 3.69 5.19 0.00 -0.40 -4.94 105.19 111.50 2b0f n GLY 116 Ca -0.16 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 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 4.19 -0.11 1.61 0.04 -1.25 -0.70 135.00 138.78 2b0f s PRO 117 Ca 0.00 2.34 -0.03 0.00 0.04 0.00 0.00 61.00 63.35 2b0f s PRO 117 Cb 0.00 -3.65 -0.03 0.00 0.04 0.00 0.00 34.50 30.86 2b0f s PRO 117 CO 0.00 -0.75 0.02 0.08 0.04 0.00 0.00 177.00 176.38 2b0f s VAL 118 N 2.81 4.42 0.29 -0.36 1.01 -0.14 -4.44 120.40 123.99 2b0f s VAL 118 Ca 0.75 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.55 2b0f s VAL 118 Cb -0.40 -2.89 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 2b0f s VAL 118 CO 0.33 0.57 0.09 0.42 0.00 0.00 0.00 175.10 176.51 2b0f s THR 119 N -0.58 0.73 -0.02 3.92 -4.23 0.39 -4.77 115.64 111.08 2b0f s THR 119 Ca 0.10 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.69 2b0f s THR 119 Cb -0.12 -2.65 -0.02 0.00 1.34 0.00 0.00 72.50 71.05 2b0f s THR 119 CO 0.02 0.00 -0.26 -0.32 -0.54 0.00 0.00 174.62 173.52 2b0f s MET 120 N -3.95 2.13 -0.23 3.99 1.75 -1.26 -0.29 119.30 121.44 2b0f s MET 120 Ca 0.36 -0.92 -0.03 0.00 -1.25 0.00 0.00 55.69 53.85 2b0f s MET 120 Cb 0.07 -2.04 -0.13 0.00 2.84 0.00 0.00 34.83 35.58 2b0f s MET 120 CO 0.15 0.54 -0.24 0.00 -0.65 0.00 0.00 175.02 174.82 2b0f n ALA 121 N 2.48 1.47 0.00 4.11 0.00 0.57 -4.79 120.51 124.35 2b0f n ALA 121 Ca -0.16 -0.98 0.00 0.00 0.00 0.00 0.00 53.44 52.30 2b0f n ALA 121 Cb 0.51 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 2.06 1.02 3.47 0.00 0.00 -0.63 -4.86 105.19 106.26 2b0f n GLY 122 Ca -0.43 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.31 2b0f n GLY 122 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b0f s LEU 123 N 0.00 4.06 0.00 0.99 1.98 -1.26 -0.89 118.68 123.56 2b0f s LEU 123 Ca 0.00 -0.41 0.02 0.00 -2.89 0.00 0.00 54.13 50.85 2b0f s LEU 123 Cb 0.00 -2.02 -0.01 0.00 0.66 0.00 0.00 46.19 44.82 2b0f s LEU 123 CO 0.00 -0.16 0.27 2.30 -1.89 0.00 0.00 176.35 176.87 2b0f n ILE 124 N 5.00 0.00 -3.71 6.68 -5.35 -0.75 -4.99 119.36 116.24 2b0f n ILE 124 Ca -0.14 -1.42 -0.37 0.00 -0.27 0.00 0.00 62.75 60.55 2b0f n ILE 124 Cb 0.50 0.79 -0.11 0.00 -1.74 0.00 0.00 39.64 39.08 2b0f n ILE 124 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 2b0f s ASN 125 N -2.54 5.79 -0.37 7.28 -0.87 -1.26 0.48 114.94 123.44 2b0f s ASN 125 Ca 0.23 -0.00 -0.13 0.00 -1.57 0.00 0.00 52.86 51.39 2b0f s ASN 125 Cb 0.00 -2.05 0.01 0.00 -0.02 0.00 0.00 41.25 39.20 2b0f s ASN 125 CO 0.17 0.02 0.24 -0.76 -2.57 0.00 0.00 177.10 174.20 2b0f s LEU 126 N 1.30 4.74 -1.72 0.60 2.01 0.16 -4.32 118.68 121.45 2b0f s LEU 126 Ca 0.06 -0.80 -0.01 0.00 0.01 0.00 0.00 54.13 53.39 2b0f s LEU 126 Cb -0.14 -2.09 0.00 0.00 0.01 0.00 0.00 46.19 43.97 2b0f s LEU 126 CO 0.06 -0.36 0.10 -0.24 1.01 0.00 0.00 176.35 176.92 2b0f n SER 127 N 5.07 -5.89 0.00 2.29 2.88 -1.26 -0.91 113.62 115.80 2b0f n SER 127 Ca -0.12 -0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 2b0f n SER 127 Cb 0.47 -4.86 0.00 0.00 -0.75 0.00 0.00 64.21 59.07 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 -2.01 -0.58 -4.28 -3.46 7.64 -1.26 -5.03 113.62 104.63 2b0f n SER 128 Ca -0.22 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.30 2b0f n SER 128 Cb 0.67 -0.10 -0.14 0.00 -1.01 0.00 0.00 64.21 63.64 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 -3.27 3.37 -0.11 0.44 2.01 -0.09 -4.99 115.64 113.00 2b0f s THR 129 Ca 0.00 -0.76 -0.37 0.00 0.31 0.00 0.00 61.69 60.86 2b0f s THR 129 Cb 0.00 -2.67 -0.15 0.00 0.01 0.00 0.00 72.50 69.69 2b0f s THR 129 CO 0.00 0.22 1.67 -2.65 -0.69 0.00 0.00 174.62 173.18 2b0f n PRO 130 N 4.77 1.50 -4.43 4.92 -0.02 -1.26 0.35 135.00 140.83 2b0f n PRO 130 Ca -0.16 0.55 -0.20 0.00 -2.02 0.00 0.00 63.50 61.66 2b0f n PRO 130 Cb 0.48 -2.27 -0.15 0.00 -0.02 0.00 0.00 33.50 31.54 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 2.72 0.82 0.41 3.45 2.01 0.18 -3.72 115.64 121.51 2b0f s THR 131 Ca 0.92 -0.42 0.08 0.00 0.31 0.00 0.00 61.69 62.58 2b0f s THR 131 Cb -0.91 -0.70 -0.00 0.00 0.01 0.00 0.00 72.50 70.89 2b0f s THR 131 CO 0.55 0.24 0.51 0.21 -0.69 0.00 0.00 174.62 175.44 2b0f s ASN 132 N -0.08 5.51 -1.33 3.53 3.84 0.68 -1.81 114.94 125.28 2b0f s ASN 132 Ca 0.01 -0.49 -0.04 0.00 0.21 0.00 0.00 52.86 52.56 2b0f s ASN 132 Cb -0.06 -0.68 0.00 0.00 -0.55 0.00 0.00 41.25 39.97 2b0f s ASN 132 CO -0.00 -0.70 0.47 0.54 -2.79 0.00 0.00 177.10 174.62 2b0f n ARG 133 N -1.75 -3.93 -2.81 0.43 5.12 -0.33 -4.64 116.66 108.75 2b0f n ARG 133 Ca 0.06 0.78 -0.41 0.00 -1.93 0.00 0.00 57.85 56.34 2b0f n ARG 133 Cb 0.60 -5.33 -0.03 0.00 -1.16 0.00 0.00 32.46 26.53 2b0f n ARG 133 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2b0f s MET 134 N -5.46 4.47 0.04 5.56 -1.94 -0.06 -2.48 119.30 119.42 2b0f s MET 134 Ca 0.24 1.23 -0.09 0.00 -1.71 0.00 0.00 55.69 55.35 2b0f s MET 134 Cb -0.10 -3.49 -0.05 0.00 2.01 0.00 0.00 34.83 33.20 2b0f s MET 134 CO 0.29 -0.10 0.35 0.42 -0.01 0.00 0.00 175.02 175.97 2b0f s ILE 135 N 1.27 5.16 -0.01 2.53 -1.09 0.21 -0.32 121.20 128.95 2b0f s ILE 135 Ca 0.46 0.42 0.03 0.00 -2.23 0.00 0.00 60.65 59.33 2b0f s ILE 135 Cb -0.19 -3.62 -0.01 0.00 -1.58 0.00 0.00 42.46 37.06 2b0f s ILE 135 CO 0.22 0.36 -0.11 0.00 -1.23 0.00 0.00 174.94 174.18 2b0f s ARG 136 N -1.72 0.91 -0.03 2.79 1.70 0.60 -0.82 118.95 122.38 2b0f s ARG 136 Ca 0.29 -0.38 -0.01 0.00 -0.47 0.00 0.00 55.73 55.16 2b0f s ARG 136 Cb -0.14 -0.87 0.03 0.00 -0.57 0.00 0.00 34.95 33.40 2b0f s ARG 136 CO 0.16 0.22 0.06 1.52 -1.08 0.00 0.00 175.30 176.19 2b0f s TYR 137 N -0.20 -0.03 -0.69 5.89 -0.85 -0.53 -0.46 117.35 120.48 2b0f s TYR 137 Ca 0.03 0.23 -0.26 0.00 -0.52 0.00 0.00 57.07 56.55 2b0f s TYR 137 Cb -0.05 -0.17 -0.04 0.00 0.38 0.00 0.00 41.96 42.08 2b0f s TYR 137 CO -0.00 -0.11 1.98 0.34 -1.52 0.00 0.00 175.55 176.24 2b0f s ASP 138 N 1.01 5.06 -0.30 -0.18 -1.08 -1.26 -1.17 116.67 118.75 2b0f s ASP 138 Ca -0.08 0.12 -0.17 0.00 -0.52 0.00 0.00 52.55 51.90 2b0f s ASP 138 Cb -0.11 -2.54 0.18 0.00 -1.46 0.00 0.00 42.92 38.99 2b0f s ASP 138 CO -0.04 -2.62 1.16 -0.47 0.52 0.00 0.00 175.17 173.73 2b0f s TYR 139 N 10.02 -0.32 -0.35 -5.34 5.04 -0.86 -4.97 117.35 120.57 2b0f s TYR 139 Ca 0.73 0.57 -0.28 0.00 -2.44 0.00 0.00 57.07 55.65 2b0f s TYR 139 Cb -0.11 0.19 -0.03 0.00 0.35 0.00 0.00 41.96 42.36 2b0f s TYR 139 CO 0.15 -0.16 1.90 0.00 -1.34 0.00 0.00 175.55 176.10 2b0f s ALA 140 N 2.09 2.70 0.10 3.97 0.00 -0.93 -2.74 121.76 126.94 2b0f s ALA 140 Ca -0.02 0.22 0.10 0.00 0.00 0.00 0.00 51.96 52.27 2b0f s ALA 140 Cb -0.03 -4.08 -0.04 0.00 0.00 0.00 0.00 23.12 18.98 2b0f s ALA 140 CO -0.16 -2.91 -0.26 0.95 0.00 0.00 0.00 175.76 173.38 2b0f s THR 141 N 7.66 2.16 0.36 0.00 -4.23 -1.26 -5.01 115.64 115.31 2b0f s THR 141 Ca 0.82 -1.63 0.04 0.00 -1.18 0.00 0.00 61.69 59.75 2b0f s THR 141 Cb -0.23 -1.90 -0.03 0.00 1.34 0.00 0.00 72.50 71.69 2b0f s THR 141 CO 0.32 0.14 0.17 -0.54 -0.54 0.00 0.00 174.62 174.17 2b0f s LYS 142 N -1.82 1.79 0.54 3.99 -0.14 -1.26 -4.78 119.74 118.06 2b0f s LYS 142 Ca 0.12 -2.06 -0.18 0.00 -1.36 0.00 0.00 55.97 52.50 2b0f s LYS 142 Cb -0.10 -0.28 -0.12 0.00 -1.68 0.00 0.00 37.83 35.65 2b0f s LYS 142 CO 0.05 -0.50 0.16 0.25 -0.76 0.00 0.00 175.35 174.55 2b0f n THR 143 N -0.75 1.00 0.00 2.17 -2.24 -1.26 -1.70 114.28 111.49 2b0f n THR 143 Ca -0.01 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2b0f n THR 143 Cb 0.64 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 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 2.19 3.17 0.44 3.38 0.00 -1.26 -4.80 105.19 108.32 2b0f n GLY 144 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.22 2b0f n GLY 144 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2b0f n GLN 145 N -1.46 1.58 -1.73 1.61 3.00 -0.69 -4.76 117.38 114.92 2b0f n GLN 145 Ca 0.00 -0.87 -0.42 0.00 -0.01 0.00 0.00 57.00 55.70 2b0f n GLN 145 Cb 0.00 -1.39 -0.02 0.00 0.00 0.00 0.00 30.24 28.83 2b0f n GLN 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2b0f n GLY 147 N 2.23 0.83 3.74 0.00 0.00 0.28 -4.71 105.19 107.55 2b0f n GLY 147 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2b0f n GLY 147 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b0f s GLY 148 N -1.88 2.79 -0.30 -0.02 0.00 -1.14 -3.54 107.32 103.23 2b0f s GLY 148 Ca 0.00 0.90 -0.24 0.00 0.00 0.00 0.00 44.72 45.38 2b0f s GLY 148 CO 0.00 1.74 0.80 0.14 0.00 0.00 0.00 173.10 175.78 2b0f s VAL 149 N -0.26 4.79 -0.53 1.40 1.01 0.72 0.68 120.40 128.22 2b0f s VAL 149 Ca 0.50 1.23 -0.20 0.00 0.00 0.00 0.00 61.98 63.52 2b0f s VAL 149 Cb -0.31 -4.15 0.06 0.00 0.00 0.00 0.00 36.38 31.98 2b0f s VAL 149 CO 0.37 -0.24 0.72 -0.22 0.00 0.00 0.00 175.10 175.73 2b0f s LEU 150 N 2.96 4.76 0.14 3.92 2.96 0.87 0.12 118.68 134.40 2b0f s LEU 150 Ca 0.33 -0.81 -0.02 0.00 -0.22 0.00 0.00 54.13 53.41 2b0f s LEU 150 Cb -0.14 -2.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.98 2b0f s LEU 150 CO 0.12 -1.00 0.10 0.00 -1.32 0.00 0.00 176.35 174.24 2b0f s ALA 152 N -4.04 2.62 -0.46 0.00 0.00 0.25 0.13 121.76 120.27 2b0f s ALA 152 Ca 0.23 -1.47 -0.26 0.00 0.00 0.00 0.00 51.96 50.46 2b0f s ALA 152 Cb 0.07 1.01 -0.07 0.00 0.00 0.00 0.00 23.12 24.13 2b0f s ALA 152 CO 0.02 -0.45 2.39 -0.08 0.00 0.00 0.00 175.76 177.63 2b0f s THR 153 N -3.27 3.01 -0.80 0.00 -1.32 -1.26 -1.56 115.64 110.44 2b0f s THR 153 Ca 0.29 0.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.77 2b0f s THR 153 Cb 0.02 -3.02 0.00 0.00 -1.51 0.00 0.00 72.50 67.99 2b0f s THR 153 CO 0.19 -0.02 0.00 0.61 -2.21 0.00 0.00 174.62 173.19 2b0f n GLY 154 N 5.98 0.76 2.82 6.08 0.00 -1.26 -5.00 105.19 114.56 2b0f n GLY 154 Ca 0.36 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.58 2b0f n GLY 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b0f s LYS 155 N -3.09 0.27 -0.23 1.61 2.20 -0.60 -4.74 119.74 115.16 2b0f s LYS 155 Ca 0.00 0.29 -0.16 0.00 -0.36 0.00 0.00 55.97 55.74 2b0f s LYS 155 Cb 0.00 -0.85 -0.04 0.00 -1.51 0.00 0.00 37.83 35.44 2b0f s LYS 155 CO 0.00 -0.70 0.41 0.42 -0.36 0.00 0.00 175.35 175.12 2b0f s ILE 156 N 2.42 5.17 -0.13 5.43 1.01 -0.46 0.88 121.20 135.52 2b0f s ILE 156 Ca 0.10 0.70 -0.04 0.00 0.00 0.00 0.00 60.65 61.41 2b0f s ILE 156 Cb -0.15 -3.74 -0.25 0.00 0.01 0.00 0.00 42.46 38.33 2b0f s ILE 156 CO -0.16 0.20 0.32 0.49 0.00 0.00 0.00 174.94 175.78 2b0f n PHE 157 N 4.86 1.08 -1.80 3.97 3.01 -0.44 -3.14 117.46 125.00 2b0f n PHE 157 Ca -0.08 0.24 0.00 0.00 1.01 0.00 0.00 57.45 58.62 2b0f n PHE 157 Cb 0.51 -1.14 0.00 0.00 -0.01 0.00 0.00 39.48 38.83 2b0f n PHE 157 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2b0f n GLY 158 N 1.99 -0.31 3.21 1.37 0.00 -0.98 0.11 105.19 110.58 2b0f n GLY 158 Ca -0.32 -1.06 -0.20 0.00 0.00 0.00 0.00 46.02 44.44 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 -3.48 1.32 -0.04 -0.61 -4.36 -0.99 -0.09 121.20 112.94 2b0f s ILE 159 Ca 0.00 -1.40 -0.30 0.00 -0.26 0.00 0.00 60.65 58.69 2b0f s ILE 159 Cb 0.00 -1.25 -0.05 0.00 1.25 0.00 0.00 42.46 42.41 2b0f s ILE 159 CO 0.00 -0.18 1.51 -2.28 0.24 0.00 0.00 174.94 174.24 2b0f s HIS 160 N -1.27 2.44 -0.03 1.37 5.65 0.21 -0.31 115.29 123.35 2b0f s HIS 160 Ca 0.01 0.53 0.08 0.00 0.25 0.00 0.00 55.06 55.93 2b0f s HIS 160 Cb -0.10 -3.78 -0.12 0.00 -1.18 0.00 0.00 32.58 27.40 2b0f s HIS 160 CO 0.03 -3.08 0.14 1.33 -0.65 0.00 0.00 174.74 172.51 2b0f n VAL 161 N 5.12 0.17 -2.23 0.89 0.24 -0.82 -0.56 118.33 121.14 2b0f n VAL 161 Ca 0.15 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.21 2b0f n VAL 161 Cb 0.43 -0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.77 2b0f n VAL 161 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2b0f n GLY 162 N 2.16 1.79 3.59 7.63 0.00 -0.30 -4.89 105.19 115.17 2b0f n GLY 162 Ca -0.05 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.38 -0.25 -0.42 -0.02 0.00 -1.26 -0.25 107.32 104.74 2b0f s GLY 163 Ca 0.00 1.76 0.02 0.00 0.00 0.00 0.00 44.72 46.50 2b0f s GLY 163 CO 0.00 0.64 0.20 0.21 0.00 0.00 0.00 173.10 174.15 2b0f s ASN 164 N -1.96 3.85 0.96 1.64 3.84 0.87 -4.86 114.94 119.28 2b0f s ASN 164 Ca 0.08 -2.45 0.00 0.00 0.21 0.00 0.00 52.86 50.70 2b0f s ASN 164 Cb -0.01 -1.09 0.00 0.00 -0.55 0.00 0.00 41.25 39.60 2b0f s ASN 164 CO -0.05 -0.30 0.00 0.61 -2.79 0.00 0.00 177.10 174.58 2b0f n GLY 165 N 3.78 1.38 0.84 1.21 0.00 -1.26 -2.61 105.19 108.53 2b0f n GLY 165 Ca 0.06 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.35 2b0f n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b0f n ARG 166 N 0.00 2.13 -4.66 1.61 5.12 -1.26 -4.29 116.66 115.31 2b0f n ARG 166 Ca 0.00 -1.67 -0.26 0.00 -1.93 0.00 0.00 57.85 53.99 2b0f n ARG 166 Cb 0.00 -1.47 -0.17 0.00 -1.16 0.00 0.00 32.46 29.67 2b0f n ARG 166 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 2b0f s GLN 167 N -1.82 1.93 0.27 5.56 0.74 -1.07 -2.03 119.66 123.24 2b0f s GLN 167 Ca 0.34 -0.49 -0.19 0.00 0.05 0.00 0.00 55.36 55.07 2b0f s GLN 167 Cb 0.20 -1.57 -0.09 0.00 1.10 0.00 0.00 33.01 32.66 2b0f s GLN 167 CO 0.30 0.04 0.75 0.20 -0.55 0.00 0.00 175.29 176.04 2b0f s GLY 168 N 0.65 2.53 -0.07 2.59 0.00 -0.32 -0.09 107.32 112.61 2b0f s GLY 168 Ca -0.14 0.16 0.04 0.00 0.00 0.00 0.00 44.72 44.77 2b0f s GLY 168 CO 0.04 0.47 -0.19 -1.36 0.00 0.00 0.00 173.10 172.06 2b0f s PHE 169 N -1.71 2.05 0.21 1.90 0.40 0.66 -1.45 117.98 120.05 2b0f s PHE 169 Ca 0.48 -0.76 0.09 0.00 -0.60 0.00 0.00 56.93 56.14 2b0f s PHE 169 Cb -0.14 -1.40 -0.05 0.00 0.51 0.00 0.00 43.02 41.94 2b0f s PHE 169 CO 0.20 -0.31 -0.16 -1.12 0.70 0.00 0.00 175.22 174.53 2b0f s SER 170 N 0.33 2.75 -0.06 1.36 0.01 0.00 -1.15 113.70 116.95 2b0f s SER 170 Ca -0.13 -1.00 -0.09 0.00 1.31 0.00 0.00 55.95 56.03 2b0f s SER 170 Cb -0.16 -0.17 -0.05 0.00 0.21 0.00 0.00 66.02 65.86 2b0f s SER 170 CO 0.06 -0.12 0.24 0.00 0.41 0.00 0.00 173.24 173.82 2b0f s ALA 171 N -2.80 3.83 -0.30 1.44 0.00 0.58 0.67 121.76 125.18 2b0f s ALA 171 Ca 0.23 -0.52 -0.29 0.00 0.00 0.00 0.00 51.96 51.38 2b0f s ALA 171 Cb -0.02 -2.09 0.01 0.00 0.00 0.00 0.00 23.12 21.02 2b0f s ALA 171 CO 0.08 0.59 1.08 -0.65 0.00 0.00 0.00 175.76 176.86 2b0f s GLN 172 N -1.21 4.11 -1.14 0.00 -0.21 -1.04 -2.36 119.66 117.82 2b0f s GLN 172 Ca 0.20 1.15 -0.06 0.00 0.02 0.00 0.00 55.36 56.66 2b0f s GLN 172 Cb -0.13 -3.72 0.26 0.00 1.00 0.00 0.00 33.01 30.42 2b0f s GLN 172 CO 0.09 -0.84 1.54 1.28 -2.12 0.00 0.00 175.29 175.24 2b0f n LEU 173 N 6.76 6.33 -4.73 2.90 4.77 0.30 -4.91 117.00 128.41 2b0f n LEU 173 Ca 0.12 -5.01 -0.41 0.00 -0.03 0.00 0.00 56.01 50.68 2b0f n LEU 173 Cb 0.47 -1.37 -0.05 0.00 -2.33 0.00 0.00 43.42 40.15 2b0f n LEU 173 CO 0.58 1.52 0.67 -0.54 -1.33 0.00 0.00 177.39 178.29 2b0f s LYS 174 N -1.59 4.71 0.38 3.23 1.02 -1.26 -4.38 119.74 121.85 2b0f s LYS 174 Ca 0.34 1.47 0.21 0.00 0.02 0.00 0.00 55.97 58.01 2b0f s LYS 174 Cb 0.04 -3.36 1.13 0.00 -0.52 0.00 0.00 37.83 35.12 2b0f s LYS 174 CO 0.05 0.24 1.60 -0.22 -0.92 0.00 0.00 175.35 176.10 2b0f h LYS 175 N 5.39 0.00 0.00 1.68 3.64 -1.44 0.31 116.57 126.15 2b0f h LYS 175 Ca -0.43 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 2b0f h LYS 175 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2b0f h LYS 175 CO 0.71 0.00 0.00 -0.56 -2.27 0.00 0.00 179.45 177.33 2b0f h GLN 176 N 0.00 0.00 -0.00 1.90 3.07 -1.84 -0.35 115.11 117.89 2b0f h GLN 176 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2b0f h GLN 176 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.84 2b0f h GLN 176 CO 0.00 0.00 -0.72 0.66 0.09 0.00 0.00 178.83 178.86 2b0f n TYR 177 N -2.60 0.00 -0.30 0.06 4.01 0.10 -3.92 117.16 114.51 2b0f n TYR 177 Ca 0.01 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.81 2b0f n TYR 177 Cb 0.21 -0.14 0.18 0.00 -0.31 0.00 0.00 39.34 39.28 2b0f n TYR 177 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2b0f n PHE 178 N -1.49 0.57 1.06 -0.72 3.72 -0.22 -4.42 117.46 115.96 2b0f n PHE 178 Ca 0.05 -0.55 0.11 0.00 -0.05 0.00 0.00 57.45 57.01 2b0f n PHE 178 Cb 0.33 -0.07 0.09 0.00 -0.94 0.00 0.00 39.48 38.90 2b0f n PHE 178 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 2b0f n VAL 179 N 0.45 0.00 -0.09 -4.37 3.14 -0.72 -4.19 118.33 112.55 2b0f n VAL 179 Ca 0.14 -0.15 -0.16 0.00 -2.96 0.00 0.00 64.34 61.21 2b0f n VAL 179 Cb 0.50 0.90 -0.09 0.00 -1.06 0.00 0.00 33.84 34.09 2b0f n VAL 179 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 2b0f h GLU 180 N 1.41 0.00 -6.39 1.45 4.57 -1.81 -3.44 114.58 110.38 2b0f h GLU 180 Ca 0.00 0.00 -0.54 0.00 -1.18 0.00 0.00 59.36 57.64 2b0f h GLU 180 Cb 0.62 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.21 2b0f h GLU 180 CO 0.00 0.76 0.79 0.21 -1.18 0.00 0.00 179.01 179.59 2b0f s LYS 181 N -2.25 4.30 0.00 1.92 2.47 -1.26 -5.22 119.74 119.71 2b0f s LYS 181 Ca -0.22 1.93 0.00 0.00 -1.56 0.00 0.00 55.97 56.12 2b0f s LYS 181 Cb 0.03 -3.53 0.00 0.00 -1.46 0.00 0.00 37.83 32.87 2b0f s LYS 181 CO 0.51 -0.53 0.00 0.94 0.16 0.00 0.00 175.35 176.43