#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b0f h PRO 2 N 0.00 0.00 0.22 1.61 0.13 -2.02 -1.56 132.00 130.39 2b0f h PRO 2 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 2b0f h PRO 2 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2b0f h PRO 2 CO 0.00 0.07 -0.10 -0.97 -0.23 0.00 0.00 178.00 176.77 2b0f h ASN 3 N 0.00 -0.25 -0.36 1.44 -1.24 -1.94 0.11 115.58 113.34 2b0f h ASN 3 Ca -0.00 -0.26 -0.04 0.00 0.71 0.00 0.00 56.30 56.70 2b0f h ASN 3 Cb 0.20 0.06 -0.02 0.00 0.73 0.00 0.00 38.32 39.29 2b0f h ASN 3 CO 0.01 0.18 0.08 0.74 -1.29 0.00 0.00 177.43 177.15 2b0f h THR 4 N -0.73 1.20 0.15 -3.57 2.02 -1.95 0.23 112.91 110.26 2b0f h THR 4 Ca -0.03 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 2b0f h THR 4 Cb 0.50 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 2b0f h THR 4 CO 0.05 0.27 -0.07 -0.08 0.37 0.00 0.00 175.52 176.05 2b0f h GLU 5 N 0.64 -0.20 -0.25 6.66 4.22 -1.25 -0.11 114.58 124.29 2b0f h GLU 5 Ca 0.14 0.01 0.03 0.00 0.08 0.00 0.00 59.36 59.62 2b0f h GLU 5 Cb 0.28 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 2b0f h GLU 5 CO 0.00 -0.06 0.08 0.35 -2.18 0.00 0.00 179.01 177.21 2b0f h PHE 6 N -0.30 0.15 -0.28 0.92 3.57 -0.36 -1.56 116.94 119.08 2b0f h PHE 6 Ca -0.02 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 2b0f h PHE 6 Cb 0.23 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 2b0f h PHE 6 CO -0.04 0.07 0.01 0.00 -2.23 0.00 0.00 178.31 176.11 2b0f h ALA 7 N 1.16 0.25 -0.55 2.41 0.00 -0.41 0.39 119.26 122.51 2b0f h ALA 7 Ca 0.11 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2b0f h ALA 7 Cb 0.08 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2b0f h ALA 7 CO -0.12 -0.41 0.28 1.25 0.00 0.00 0.00 179.25 180.25 2b0f h LEU 8 N 0.09 0.71 -0.31 0.00 7.12 -0.80 0.24 115.31 122.35 2b0f h LEU 8 Ca 0.13 -0.12 -0.19 0.00 0.13 0.00 0.00 57.88 57.84 2b0f h LEU 8 Cb 0.17 -0.18 0.00 0.00 -0.53 0.00 0.00 40.66 40.12 2b0f h LEU 8 CO -0.22 0.63 -0.56 0.28 -0.13 0.00 0.00 178.44 178.44 2b0f h SER 9 N 0.74 0.95 -0.82 1.25 0.02 -1.01 -1.38 113.55 113.29 2b0f h SER 9 Ca 0.19 -0.51 -0.01 0.00 -0.84 0.00 0.00 61.79 60.62 2b0f h SER 9 Cb 0.10 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.32 2b0f h SER 9 CO -0.03 1.31 0.50 0.25 -1.14 0.00 0.00 176.83 177.72 2b0f h LEU 10 N 0.65 0.99 0.60 5.07 5.85 -0.05 -0.73 115.31 127.70 2b0f h LEU 10 Ca 0.01 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 2b0f h LEU 10 Cb 1.16 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.94 2b0f h LEU 10 CO 0.12 0.77 -0.31 0.25 -0.34 0.00 0.00 178.44 178.93 2b0f h LEU 11 N 1.13 -0.76 -1.09 2.25 5.85 -0.79 0.79 115.31 122.70 2b0f h LEU 11 Ca 0.30 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.96 2b0f h LEU 11 Cb -0.04 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2b0f h LEU 11 CO -0.06 -0.52 -0.43 0.03 -0.34 0.00 0.00 178.44 177.13 2b0f h ARG 12 N -0.84 0.00 0.00 1.25 2.47 -1.11 -2.58 114.38 113.56 2b0f h ARG 12 Ca -0.08 0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.36 2b0f h ARG 12 Cb 0.66 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.93 2b0f h ARG 12 CO 0.12 0.43 -2.14 1.63 0.56 0.00 0.00 179.97 180.57 2b0f n LYS 13 N -3.86 1.17 -0.00 0.04 4.76 -0.29 -4.76 118.16 115.22 2b0f n LYS 13 Ca -0.01 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 2b0f n LYS 13 Cb 0.48 -1.44 -0.00 0.00 -1.84 0.00 0.00 35.03 32.23 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 -2.59 4.51 -4.59 4.39 4.13 0.19 -4.29 115.26 117.00 2b0f n ASN 14 Ca -0.26 -0.04 -0.40 0.00 1.68 0.00 0.00 54.58 55.56 2b0f n ASN 14 Cb 1.01 1.02 -0.08 0.00 -1.54 0.00 0.00 39.78 40.19 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 -1.97 5.06 0.18 2.41 1.01 -0.68 -0.30 121.20 126.91 2b0f s ILE 15 Ca -0.00 0.62 0.08 0.00 0.00 0.00 0.00 60.65 61.35 2b0f s ILE 15 Cb 0.00 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 2b0f s ILE 15 CO 0.02 -0.02 -0.17 -0.04 0.00 0.00 0.00 174.94 174.73 2b0f s MET 16 N 2.31 1.27 -0.54 2.79 -1.94 -0.83 -4.68 119.30 117.68 2b0f s MET 16 Ca 0.19 -1.45 -0.24 0.00 -1.71 0.00 0.00 55.69 52.48 2b0f s MET 16 Cb -0.16 -1.23 0.04 0.00 2.01 0.00 0.00 34.83 35.50 2b0f s MET 16 CO 0.11 0.23 0.92 0.95 -0.01 0.00 0.00 175.02 177.22 2b0f s THR 17 N -2.36 4.43 -0.43 2.05 -4.23 -1.26 -1.46 115.64 112.38 2b0f s THR 17 Ca 0.17 0.27 -0.20 0.00 -1.18 0.00 0.00 61.69 60.76 2b0f s THR 17 Cb -0.04 -4.51 0.02 0.00 1.34 0.00 0.00 72.50 69.31 2b0f s THR 17 CO 0.06 -1.07 0.57 -0.63 -0.54 0.00 0.00 174.62 173.02 2b0f s ILE 18 N 3.85 4.91 -0.27 2.99 1.09 0.18 -0.29 121.20 133.66 2b0f s ILE 18 Ca 0.30 -0.01 -0.29 0.00 -1.10 0.00 0.00 60.65 59.55 2b0f s ILE 18 Cb -0.13 -4.14 -0.01 0.00 -1.06 0.00 0.00 42.46 37.11 2b0f s ILE 18 CO 0.19 -0.53 1.50 -0.89 -0.10 0.00 0.00 174.94 175.12 2b0f s THR 19 N 2.59 3.85 0.00 2.92 2.01 -0.08 -1.83 115.64 125.10 2b0f s THR 19 Ca 0.19 0.95 0.00 0.00 0.31 0.00 0.00 61.69 63.14 2b0f s THR 19 Cb -0.15 -3.89 0.00 0.00 0.01 0.00 0.00 72.50 68.47 2b0f s THR 19 CO 0.17 -0.40 0.00 0.35 -0.69 0.00 0.00 174.62 174.05 2b0f n THR 20 N 6.44 0.00 0.10 -0.82 -2.24 -0.22 -3.70 114.28 113.83 2b0f n THR 20 Ca 0.17 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.92 2b0f n THR 20 Cb 0.46 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 2b0f n THR 20 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2b0f h SER 21 N 0.00 0.00 0.37 3.42 0.87 -1.27 -3.33 113.55 113.61 2b0f h SER 21 Ca 0.00 0.00 -0.32 0.00 -1.23 0.00 0.00 61.79 60.24 2b0f h SER 21 Cb 0.00 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.92 2b0f h SER 21 CO 0.00 0.81 -1.81 0.29 -0.53 0.00 0.00 176.83 175.59 2b0f n LYS 22 N -3.46 0.67 -3.60 2.24 5.02 -1.15 -5.08 118.16 112.80 2b0f n LYS 22 Ca -0.00 0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 2b0f n LYS 22 Cb 0.81 -1.76 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 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 1.70 -1.10 3.62 0.72 0.00 -1.25 -5.09 105.19 103.78 2b0f n GLY 23 Ca -0.22 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.21 3.94 0.25 1.61 0.41 -1.26 -1.06 118.70 121.38 2b0f s GLU 24 Ca 0.00 0.75 0.11 0.00 -0.41 0.00 0.00 54.97 55.42 2b0f s GLU 24 Cb 0.00 -3.77 -0.05 0.00 -1.78 0.00 0.00 34.13 28.53 2b0f s GLU 24 CO 0.00 -0.91 -0.19 -0.06 -0.49 0.00 0.00 175.26 173.61 2b0f s PHE 25 N 3.49 2.16 -0.30 1.61 0.08 -0.76 -1.36 117.98 122.90 2b0f s PHE 25 Ca 0.40 -0.39 -0.29 0.00 0.12 0.00 0.00 56.93 56.78 2b0f s PHE 25 Cb -0.12 -0.96 -0.01 0.00 -0.57 0.00 0.00 43.02 41.36 2b0f s PHE 25 CO 0.17 0.61 1.49 0.99 -0.10 0.00 0.00 175.22 178.38 2b0f s THR 26 N -2.50 3.86 -0.13 0.64 2.01 -1.20 -0.65 115.64 117.68 2b0f s THR 26 Ca 0.27 0.94 0.00 0.00 0.31 0.00 0.00 61.69 63.21 2b0f s THR 26 Cb -0.04 -3.96 -0.01 0.00 0.01 0.00 0.00 72.50 68.49 2b0f s THR 26 CO 0.13 -0.48 -0.14 -0.83 -0.69 0.00 0.00 174.62 172.61 2b0f s GLY 27 N 3.91 1.52 -0.54 4.40 0.00 -0.54 -4.74 107.32 111.34 2b0f s GLY 27 Ca 0.65 -0.90 -0.20 0.00 0.00 0.00 0.00 44.72 44.27 2b0f s GLY 27 CO 0.29 -0.20 0.72 1.08 0.00 0.00 0.00 173.10 174.98 2b0f s LEU 28 N 0.35 4.81 -0.95 0.66 1.43 -0.62 -1.97 118.68 122.40 2b0f s LEU 28 Ca -0.12 -0.87 -0.24 0.00 -1.03 0.00 0.00 54.13 51.87 2b0f s LEU 28 Cb -0.16 -2.50 0.02 0.00 0.03 0.00 0.00 46.19 43.57 2b0f s LEU 28 CO 0.06 -1.02 1.61 -0.83 0.23 0.00 0.00 176.35 176.40 2b0f s GLY 29 N 2.90 0.86 0.09 -3.19 0.00 0.59 -0.49 107.32 108.09 2b0f s GLY 29 Ca 0.18 -1.91 -0.24 0.00 0.00 0.00 0.00 44.72 42.75 2b0f s GLY 29 CO 0.12 2.96 1.72 -2.22 0.00 0.00 0.00 173.10 175.68 2b0f h ILE 30 N 6.90 0.86 -2.31 0.90 1.08 -1.62 -3.43 117.51 119.90 2b0f h ILE 30 Ca 0.12 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.73 2b0f h ILE 30 Cb 1.02 0.86 -0.12 0.00 -3.07 0.00 0.00 36.82 35.51 2b0f h ILE 30 CO 1.34 0.00 0.49 -1.38 -0.69 0.00 0.00 178.15 177.91 2b0f s HIS 31 N -6.17 -0.26 0.00 1.37 -3.43 -1.19 -1.41 115.29 104.20 2b0f s HIS 31 Ca -0.14 0.05 0.00 0.00 -0.80 0.00 0.00 55.06 54.17 2b0f s HIS 31 Cb 0.06 0.58 0.00 0.00 -1.43 0.00 0.00 32.58 31.79 2b0f s HIS 31 CO 0.66 -0.66 0.00 -0.25 -2.00 0.00 0.00 174.74 172.49 2b0f n ASP 32 N -0.34 0.00 -0.49 7.38 9.92 -1.26 -0.23 116.55 131.52 2b0f n ASP 32 Ca -0.08 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.18 2b0f n ASP 32 Cb 0.61 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.09 2b0f n ASP 32 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 2b0f n ARG 33 N 0.00 0.00 -3.83 -1.24 1.85 -1.26 -3.55 116.66 108.62 2b0f n ARG 33 Ca 0.00 -0.87 -0.36 0.00 -1.00 0.00 0.00 57.85 55.63 2b0f n ARG 33 Cb 0.00 -0.44 -0.13 0.00 -1.05 0.00 0.00 32.46 30.84 2b0f n ARG 33 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2b0f s VAL 34 N 0.00 3.79 -0.03 8.89 -7.23 0.67 -0.83 120.40 125.66 2b0f s VAL 34 Ca 0.00 -0.38 0.06 0.00 -1.81 0.00 0.00 61.98 59.85 2b0f s VAL 34 Cb 0.00 -2.76 -0.02 0.00 0.56 0.00 0.00 36.38 34.15 2b0f s VAL 34 CO 0.00 0.37 -0.21 0.00 -0.31 0.00 0.00 175.10 174.95 2b0f s VAL 36 N -0.66 5.35 0.14 0.00 1.01 0.36 0.61 120.40 127.21 2b0f s VAL 36 Ca 0.11 0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.29 2b0f s VAL 36 Cb -0.10 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2b0f s VAL 36 CO -0.00 0.34 0.01 0.27 0.00 0.00 0.00 175.10 175.71 2b0f s ILE 37 N 1.11 0.48 0.58 2.22 -4.36 -0.32 -1.58 121.20 119.32 2b0f s ILE 37 Ca 0.08 -1.94 -0.19 0.00 -0.26 0.00 0.00 60.65 58.34 2b0f s ILE 37 Cb -0.14 -2.01 -0.04 0.00 1.25 0.00 0.00 42.46 41.53 2b0f s ILE 37 CO 0.05 -0.55 1.17 -2.84 0.24 0.00 0.00 174.94 173.01 2b0f s PRO 38 N -3.95 3.09 -0.03 0.37 0.02 -1.26 -0.23 135.00 133.01 2b0f s PRO 38 Ca 0.21 1.72 -0.18 0.00 0.02 0.00 0.00 61.00 62.77 2b0f s PRO 38 Cb 0.07 -1.96 -0.32 0.00 0.02 0.00 0.00 34.50 32.30 2b0f s PRO 38 CO 0.01 -1.09 0.87 1.15 -0.33 0.00 0.00 177.00 177.62 2b0f h THR 39 N 0.92 1.33 0.00 0.99 2.02 -1.87 -3.29 112.91 113.01 2b0f h THR 39 Ca -0.50 -2.58 0.00 0.00 0.77 0.00 0.00 66.41 64.10 2b0f h THR 39 Cb 1.28 3.06 0.00 0.00 -1.74 0.00 0.00 68.15 70.75 2b0f h THR 39 CO 0.56 0.76 0.00 1.12 0.37 0.00 0.00 175.52 178.32 2b0f h HIS 40 N -0.15 0.00 0.00 3.16 2.07 -1.93 -0.74 115.15 117.56 2b0f h HIS 40 Ca -0.22 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.30 2b0f h HIS 40 Cb 1.88 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.86 2b0f h HIS 40 CO 0.16 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 175.02 2b0f h ALA 41 N 2.05 1.00 -4.41 6.11 0.00 -1.97 -3.47 119.26 118.58 2b0f h ALA 41 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2b0f h ALA 41 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2b0f h ALA 41 CO 0.00 0.00 -0.09 1.04 0.00 0.00 0.00 179.25 180.20 2b0f n GLN 42 N -2.96 -0.98 -2.59 0.00 6.02 -0.28 -2.03 117.38 114.56 2b0f n GLN 42 Ca -0.00 1.21 -0.41 0.00 -0.01 0.00 0.00 57.00 57.78 2b0f n GLN 42 Cb 0.23 -4.05 -0.04 0.00 1.02 0.00 0.00 30.24 27.41 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 -2.70 4.58 0.00 -1.09 0.02 -1.26 -2.90 135.00 131.64 2b0f s PRO 43 Ca 0.04 1.60 0.00 0.00 0.02 0.00 0.00 61.00 62.66 2b0f s PRO 43 Cb -0.01 -3.36 0.00 0.00 0.02 0.00 0.00 34.50 31.15 2b0f s PRO 43 CO 0.45 0.01 0.00 0.41 -0.33 0.00 0.00 177.00 177.54 2b0f n GLY 44 N 2.53 1.44 0.33 0.52 0.00 -1.26 -5.00 105.19 103.76 2b0f n GLY 44 Ca 0.05 -1.74 0.09 0.00 0.00 0.00 0.00 46.02 44.42 2b0f n GLY 44 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2b0f n ASP 45 N 0.00 1.61 -3.60 1.61 5.75 -1.26 -4.75 116.55 115.91 2b0f n ASP 45 Ca 0.00 -1.30 -0.27 0.00 -0.01 0.00 0.00 54.79 53.21 2b0f n ASP 45 Cb 0.00 0.59 -0.16 0.00 -1.03 0.00 0.00 41.12 40.51 2b0f n ASP 45 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2b0f s ASP 46 N -2.28 2.68 0.07 -1.12 -1.08 -1.26 -0.43 116.67 113.24 2b0f s ASP 46 Ca 0.14 -0.80 0.05 0.00 -0.52 0.00 0.00 52.55 51.42 2b0f s ASP 46 Cb 0.15 -0.29 -0.04 0.00 -1.46 0.00 0.00 42.92 41.29 2b0f s ASP 46 CO 0.54 -0.37 -0.07 -0.69 0.52 0.00 0.00 175.17 175.10 2b0f s VAL 47 N 2.11 3.59 -0.52 1.11 1.01 -0.30 -4.83 120.40 122.57 2b0f s VAL 47 Ca 0.04 -1.05 -0.18 0.00 0.00 0.00 0.00 61.98 60.79 2b0f s VAL 47 Cb -0.16 -2.64 0.08 0.00 0.00 0.00 0.00 36.38 33.66 2b0f s VAL 47 CO -0.16 0.21 0.55 -0.76 0.00 0.00 0.00 175.10 174.94 2b0f s LEU 48 N -1.96 5.41 -0.52 3.92 1.02 -1.24 0.43 118.68 125.73 2b0f s LEU 48 Ca 0.21 -1.25 -0.23 0.00 0.02 0.00 0.00 54.13 52.87 2b0f s LEU 48 Cb -0.11 -2.31 0.04 0.00 0.02 0.00 0.00 46.19 43.83 2b0f s LEU 48 CO 0.13 -0.85 0.86 0.54 0.02 0.00 0.00 176.35 177.05 2b0f s VAL 49 N 2.19 4.51 -1.62 -1.59 0.11 0.24 -0.90 120.40 123.35 2b0f s VAL 49 Ca 0.09 0.21 0.00 0.00 -2.93 0.00 0.00 61.98 59.35 2b0f s VAL 49 Cb -0.23 -4.46 0.00 0.00 -1.53 0.00 0.00 36.38 30.16 2b0f s VAL 49 CO 0.08 -0.98 0.00 0.59 -3.33 0.00 0.00 175.10 171.46 2b0f n ASN 50 N 7.12 -4.96 0.00 3.54 3.02 0.60 -1.80 115.26 122.77 2b0f n ASN 50 Ca 0.01 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.80 2b0f n ASN 50 Cb 0.47 -3.98 0.00 0.00 -0.61 0.00 0.00 39.78 35.66 2b0f n ASN 50 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b0f n GLY 51 N -0.97 2.51 3.55 7.41 0.00 -1.24 -5.04 105.19 111.40 2b0f n GLY 51 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.78 3.40 -0.27 1.61 -0.21 -0.75 -4.89 119.66 117.78 2b0f s GLN 52 Ca 0.00 -0.05 -0.29 0.00 0.02 0.00 0.00 55.36 55.04 2b0f s GLN 52 Cb 0.00 -4.04 -0.01 0.00 1.00 0.00 0.00 33.01 29.95 2b0f s GLN 52 CO 0.00 -1.59 1.51 -1.59 -2.12 0.00 0.00 175.29 171.50 2b0f s LYS 53 N 4.43 3.79 0.02 2.91 -2.85 -1.26 -0.59 119.74 126.20 2b0f s LYS 53 Ca 0.36 1.46 0.06 0.00 -1.00 0.00 0.00 55.97 56.84 2b0f s LYS 53 Cb -0.10 -4.00 -0.02 0.00 -2.06 0.00 0.00 37.83 31.65 2b0f s LYS 53 CO 0.22 -1.30 -0.17 -1.50 0.10 0.00 0.00 175.35 172.70 2b0f s ILE 54 N 5.07 1.37 0.41 3.79 2.07 0.17 -4.92 121.20 129.15 2b0f s ILE 54 Ca 0.66 -0.97 -0.26 0.00 -1.41 0.00 0.00 60.65 58.68 2b0f s ILE 54 Cb -0.21 -1.19 -0.09 0.00 0.13 0.00 0.00 42.46 41.10 2b0f s ILE 54 CO 0.28 0.20 1.28 -0.13 -1.91 0.00 0.00 174.94 174.66 2b0f s ARG 55 N -0.90 3.96 0.24 3.50 1.81 -1.26 -1.16 118.95 125.14 2b0f s ARG 55 Ca 0.05 2.11 -0.09 0.00 -1.72 0.00 0.00 55.73 56.08 2b0f s ARG 55 Cb -0.08 -2.73 -0.07 0.00 -0.45 0.00 0.00 34.95 31.62 2b0f s ARG 55 CO 0.01 -0.49 0.56 0.54 -0.68 0.00 0.00 175.30 175.24 2b0f s VAL 56 N -1.29 4.93 -0.25 3.52 0.11 0.42 -3.14 120.40 124.71 2b0f s VAL 56 Ca 0.57 0.44 -0.17 0.00 -2.93 0.00 0.00 61.98 59.89 2b0f s VAL 56 Cb -0.37 -3.63 -0.15 0.00 -1.53 0.00 0.00 36.38 30.69 2b0f s VAL 56 CO 0.47 -0.12 -0.09 0.29 -3.33 0.00 0.00 175.10 172.32 2b0f n LYS 57 N -0.27 0.58 -3.38 1.54 5.02 0.50 -4.88 118.16 117.27 2b0f n LYS 57 Ca 0.00 0.40 0.01 0.00 -2.02 0.00 0.00 58.31 56.71 2b0f n LYS 57 Cb 0.53 -1.61 -0.03 0.00 -0.02 0.00 0.00 35.03 33.90 2b0f n LYS 57 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b0f s ASP 58 N -7.20 -1.21 -0.15 4.39 2.15 -0.85 -5.04 116.67 108.77 2b0f s ASP 58 Ca -0.34 1.16 -0.04 0.00 0.43 0.00 0.00 52.55 53.76 2b0f s ASP 58 Cb 0.11 2.18 -0.03 0.00 -0.30 0.00 0.00 42.92 44.87 2b0f s ASP 58 CO 0.54 -0.24 -0.00 -1.59 -0.17 0.00 0.00 175.17 173.70 2b0f s LYS 59 N 2.86 3.61 -0.13 4.34 -2.85 -1.26 -1.03 119.74 125.28 2b0f s LYS 59 Ca 0.09 -0.45 -0.01 0.00 -1.00 0.00 0.00 55.97 54.60 2b0f s LYS 59 Cb -0.14 -2.97 0.03 0.00 -2.06 0.00 0.00 37.83 32.70 2b0f s LYS 59 CO -0.20 0.35 -0.06 -0.47 0.10 0.00 0.00 175.35 175.07 2b0f s TYR 60 N 0.09 1.45 -0.62 1.78 5.04 -0.53 -4.98 117.35 119.59 2b0f s TYR 60 Ca 0.01 -0.79 -0.28 0.00 -2.44 0.00 0.00 57.07 53.58 2b0f s TYR 60 Cb -0.13 -1.21 0.03 0.00 0.35 0.00 0.00 41.96 41.00 2b0f s TYR 60 CO 0.02 -0.53 1.25 0.15 -1.34 0.00 0.00 175.55 175.10 2b0f s LYS 61 N 1.72 3.40 -0.27 4.97 1.02 -1.26 -0.05 119.74 129.26 2b0f s LYS 61 Ca 0.04 0.16 -0.28 0.00 0.02 0.00 0.00 55.97 55.91 2b0f s LYS 61 Cb -0.13 -4.07 -0.04 0.00 -0.52 0.00 0.00 37.83 33.06 2b0f s LYS 61 CO -0.08 -1.84 2.10 -0.51 -0.92 0.00 0.00 175.35 174.10 2b0f s LEU 62 N 5.33 3.45 0.52 3.17 1.43 0.39 -4.92 118.68 128.06 2b0f s LEU 62 Ca 0.42 1.67 -0.00 0.00 -1.03 0.00 0.00 54.13 55.19 2b0f s LEU 62 Cb -0.08 -3.46 0.02 0.00 0.03 0.00 0.00 46.19 42.69 2b0f s LEU 62 CO 0.23 -1.93 0.76 0.68 0.23 0.00 0.00 176.35 176.32 2b0f s VAL 63 N 8.08 3.29 -0.05 -1.59 -7.23 -1.26 -2.24 120.40 119.40 2b0f s VAL 63 Ca 0.94 -0.50 -0.21 0.00 -1.81 0.00 0.00 61.98 60.41 2b0f s VAL 63 Cb -0.29 -3.24 -0.05 0.00 0.56 0.00 0.00 36.38 33.36 2b0f s VAL 63 CO 0.34 -0.19 0.59 -0.62 -0.31 0.00 0.00 175.10 174.92 2b0f s ASP 64 N -4.33 6.91 0.56 4.85 2.15 0.40 -4.43 116.67 122.78 2b0f s ASP 64 Ca 0.53 1.09 0.18 0.00 0.43 0.00 0.00 52.55 54.78 2b0f s ASP 64 Cb -0.10 -2.36 1.00 0.00 -0.30 0.00 0.00 42.92 41.16 2b0f s ASP 64 CO 0.39 0.03 1.52 -0.65 -0.17 0.00 0.00 175.17 176.30 2b0f h PRO 65 N 6.15 0.00 -0.78 4.34 0.11 -1.97 0.10 132.00 139.95 2b0f h PRO 65 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2b0f h PRO 65 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2b0f h PRO 65 CO 0.72 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.90 2b0f n GLU 66 N -2.55 2.89 -1.04 1.05 1.02 -1.26 -4.83 120.64 115.92 2b0f n GLU 66 Ca -0.01 -1.55 -0.02 0.00 -0.02 0.00 0.00 57.16 55.56 2b0f n GLU 66 Cb 0.51 -1.86 -0.01 0.00 -0.02 0.00 0.00 31.44 30.06 2b0f n GLU 66 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2b0f n ASN 67 N 0.32 -3.37 -4.92 1.62 2.85 0.32 -5.03 115.26 107.06 2b0f n ASN 67 Ca 0.14 0.04 -0.26 0.00 -0.11 0.00 0.00 54.58 54.38 2b0f n ASN 67 Cb 0.70 -1.00 0.00 0.00 1.24 0.00 0.00 39.78 40.72 2b0f n ASN 67 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2b0f s ILE 68 N -1.99 1.63 0.13 -1.44 -1.09 -1.06 -4.94 121.20 112.44 2b0f s ILE 68 Ca 0.00 -1.46 -0.11 0.00 -2.23 0.00 0.00 60.65 56.84 2b0f s ILE 68 Cb 0.00 -2.09 -0.06 0.00 -1.58 0.00 0.00 42.46 38.73 2b0f s ILE 68 CO 0.00 0.00 0.48 0.21 -1.23 0.00 0.00 174.94 174.40 2b0f s ASN 69 N -4.32 6.70 -0.04 3.58 2.47 -0.71 0.15 114.94 122.77 2b0f s ASN 69 Ca 0.35 0.91 0.12 0.00 0.42 0.00 0.00 52.86 54.67 2b0f s ASN 69 Cb -0.03 -2.22 -0.19 0.00 -1.45 0.00 0.00 41.25 37.36 2b0f s ASN 69 CO 0.22 0.10 0.22 -0.11 -3.72 0.00 0.00 177.10 173.81 2b0f n LEU 70 N 0.64 0.00 -0.27 3.21 7.94 -1.01 -0.83 117.00 126.68 2b0f n LEU 70 Ca -0.05 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.81 2b0f n LEU 70 Cb 0.52 0.07 -0.01 0.00 0.53 0.00 0.00 43.42 44.53 2b0f n LEU 70 CO 0.43 0.07 -0.03 1.21 -1.11 0.00 0.00 177.39 177.96 2b0f n GLU 71 N -2.06 -1.02 -3.63 1.96 4.07 -0.95 -4.88 120.64 114.13 2b0f n GLU 71 Ca -0.06 0.47 -0.40 0.00 -0.06 0.00 0.00 57.16 57.11 2b0f n GLU 71 Cb 0.46 -4.35 -0.11 0.00 -0.06 0.00 0.00 31.44 27.38 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 -0.80 4.60 -0.32 4.31 1.43 -1.20 -2.68 118.68 124.02 2b0f s LEU 72 Ca 0.00 -1.00 -0.19 0.00 -1.03 0.00 0.00 54.13 51.91 2b0f s LEU 72 Cb 0.00 -1.99 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 2b0f s LEU 72 CO 0.00 -0.36 0.57 -0.89 0.23 0.00 0.00 176.35 175.90 2b0f s THR 73 N 1.53 4.98 -0.54 5.49 2.01 0.68 0.15 115.64 129.93 2b0f s THR 73 Ca 0.01 0.63 -0.24 0.00 0.31 0.00 0.00 61.69 62.41 2b0f s THR 73 Cb -0.19 -3.97 0.04 0.00 0.01 0.00 0.00 72.50 68.39 2b0f s THR 73 CO 0.06 -0.16 0.90 -0.69 -0.69 0.00 0.00 174.62 174.04 2b0f s VAL 74 N 2.50 4.46 -0.63 3.82 1.01 0.92 -1.18 120.40 131.30 2b0f s VAL 74 Ca 0.22 0.20 -0.20 0.00 0.00 0.00 0.00 61.98 62.19 2b0f s VAL 74 Cb -0.15 -4.50 0.09 0.00 0.00 0.00 0.00 36.38 31.82 2b0f s VAL 74 CO 0.12 -1.06 0.83 -0.22 0.00 0.00 0.00 175.10 174.78 2b0f s LEU 75 N 3.77 4.95 -0.89 3.92 2.96 0.20 -1.45 118.68 132.14 2b0f s LEU 75 Ca 0.29 -1.27 -0.22 0.00 -0.22 0.00 0.00 54.13 52.71 2b0f s LEU 75 Cb -0.13 -2.36 0.08 0.00 0.50 0.00 0.00 46.19 44.28 2b0f s LEU 75 CO 0.19 -1.26 1.24 -0.89 -1.32 0.00 0.00 176.35 174.31 2b0f s THR 76 N 3.28 4.22 0.28 3.68 2.01 -0.20 -1.43 115.64 127.49 2b0f s THR 76 Ca 0.17 -0.79 -0.03 0.00 0.31 0.00 0.00 61.69 61.35 2b0f s THR 76 Cb -0.20 -4.89 -0.05 0.00 0.01 0.00 0.00 72.50 67.38 2b0f s THR 76 CO 0.07 -1.71 0.52 -0.22 -0.69 0.00 0.00 174.62 172.60 2b0f s LEU 77 N 4.19 4.08 -1.30 4.42 2.96 -0.01 -0.37 118.68 132.65 2b0f s LEU 77 Ca 0.36 0.60 -0.08 0.00 -0.22 0.00 0.00 54.13 54.78 2b0f s LEU 77 Cb -0.06 -3.41 0.15 0.00 0.50 0.00 0.00 46.19 43.37 2b0f s LEU 77 CO -0.03 -0.19 2.02 -0.67 -1.32 0.00 0.00 176.35 176.17 2b0f n ASP 78 N -1.07 5.89 -4.07 3.68 2.03 -1.19 -4.74 116.55 117.08 2b0f n ASP 78 Ca -0.03 -3.11 -0.33 0.00 0.52 0.00 0.00 54.79 51.84 2b0f n ASP 78 Cb 0.54 -1.45 -0.14 0.00 -0.72 0.00 0.00 41.12 39.36 2b0f n ASP 78 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2b0f s ARG 79 N 0.01 1.82 0.00 -0.67 6.06 -1.26 -4.95 118.95 119.96 2b0f s ARG 79 Ca 0.44 -1.75 0.26 0.00 -2.50 0.00 0.00 55.73 52.18 2b0f s ARG 79 Cb 0.12 -3.31 0.78 0.00 0.06 0.00 0.00 34.95 32.60 2b0f s ARG 79 CO -0.02 -0.92 1.58 0.09 -2.50 0.00 0.00 175.30 173.53 2b0f n ASN 80 N 4.42 0.84 -4.53 -2.12 3.02 -1.26 -4.30 115.26 111.34 2b0f n ASN 80 Ca -0.01 -0.71 -0.43 0.00 -0.03 0.00 0.00 54.58 53.40 2b0f n ASN 80 Cb 0.42 0.12 -0.04 0.00 -0.61 0.00 0.00 39.78 39.66 2b0f n ASN 80 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2b0f s GLU 81 N -2.60 3.36 0.60 3.52 0.41 -1.26 -5.01 118.70 117.72 2b0f s GLU 81 Ca 0.22 -0.21 -0.13 0.00 -0.41 0.00 0.00 54.97 54.44 2b0f s GLU 81 Cb 0.19 -4.02 -0.04 0.00 -1.78 0.00 0.00 34.13 28.48 2b0f s GLU 81 CO 0.55 -1.36 1.03 -1.59 -0.49 0.00 0.00 175.26 173.39 2b0f s LYS 82 N 3.72 3.53 0.60 1.61 -2.85 -1.26 -4.94 119.74 120.15 2b0f s LYS 82 Ca 0.30 0.91 -0.04 0.00 -1.00 0.00 0.00 55.97 56.14 2b0f s LYS 82 Cb -0.13 -2.07 0.03 0.00 -2.06 0.00 0.00 37.83 33.60 2b0f s LYS 82 CO 0.20 -0.62 0.88 -0.06 0.10 0.00 0.00 175.35 175.85 2b0f s PHE 83 N -2.90 3.09 0.18 1.78 0.08 -1.23 -4.91 117.98 114.07 2b0f s PHE 83 Ca 0.58 0.43 -0.31 0.00 0.12 0.00 0.00 56.93 57.74 2b0f s PHE 83 Cb -0.12 -2.82 -0.10 0.00 -0.57 0.00 0.00 43.02 39.41 2b0f s PHE 83 CO 0.45 -0.94 1.57 0.50 -0.10 0.00 0.00 175.22 176.70 2b0f s ARG 84 N -4.97 4.21 -0.74 0.44 3.52 -1.26 -4.16 118.95 115.99 2b0f s ARG 84 Ca 0.56 2.38 -0.26 0.00 -0.13 0.00 0.00 55.73 58.28 2b0f s ARG 84 Cb -0.10 -3.14 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2b0f s ARG 84 CO 0.43 -0.60 1.97 -0.51 -0.81 0.00 0.00 175.30 175.77 2b0f s ASP 85 N 1.07 5.07 -0.30 -2.12 1.01 -1.26 -4.47 116.67 115.67 2b0f s ASP 85 Ca 0.69 -0.06 0.07 0.00 0.71 0.00 0.00 52.55 53.96 2b0f s ASP 85 Cb -0.44 -2.54 0.60 0.00 1.01 0.00 0.00 42.92 41.55 2b0f s ASP 85 CO 0.33 -2.66 1.66 2.30 0.21 0.00 0.00 175.17 177.01 2b0f n ILE 86 N 7.64 2.60 -0.09 0.77 -5.35 -0.50 -4.43 119.36 120.00 2b0f n ILE 86 Ca 0.31 -1.40 -0.01 0.00 -0.27 0.00 0.00 62.75 61.38 2b0f n ILE 86 Cb 0.50 -0.47 0.25 0.00 -1.74 0.00 0.00 39.64 38.17 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 1.82 0.73 0.00 6.28 3.08 -1.86 -2.17 114.38 122.26 2b0f h ARG 87 Ca 0.31 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2b0f h ARG 87 Cb 2.21 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 32.14 2b0f h ARG 87 CO 0.71 0.65 0.00 0.41 -1.07 0.00 0.00 179.97 180.67 2b0f n GLY 88 N -0.96 -1.44 0.09 0.04 0.00 -1.26 -2.69 105.19 98.97 2b0f n GLY 88 Ca 0.04 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.12 2b0f n GLY 88 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2b0f n PHE 89 N -1.78 0.74 -2.17 1.61 3.72 -0.83 -4.82 117.46 113.94 2b0f n PHE 89 Ca 0.05 0.22 -0.42 0.00 -0.05 0.00 0.00 57.45 57.25 2b0f n PHE 89 Cb 0.32 -0.80 -0.03 0.00 -0.94 0.00 0.00 39.48 38.04 2b0f n PHE 89 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2b0f s ILE 90 N -3.28 3.26 -0.17 4.37 1.01 -1.09 -0.66 121.20 124.64 2b0f s ILE 90 Ca 0.02 0.93 -0.05 0.00 0.00 0.00 0.00 60.65 61.55 2b0f s ILE 90 Cb 0.11 -3.60 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 2b0f s ILE 90 CO 0.77 0.08 -0.01 -0.44 0.00 0.00 0.00 174.94 175.35 2b0f s SER 91 N 0.97 5.01 0.03 3.58 0.01 -1.06 -4.34 113.70 117.90 2b0f s SER 91 Ca 0.63 -0.09 -0.18 0.00 1.31 0.00 0.00 55.95 57.62 2b0f s SER 91 Cb -0.37 -1.84 -0.22 0.00 0.21 0.00 0.00 66.02 63.80 2b0f s SER 91 CO 0.32 0.15 1.15 -0.08 0.41 0.00 0.00 173.24 175.19 2b0f h GLU 92 N 6.84 0.50 -5.11 12.44 4.22 -1.89 -3.25 114.58 128.32 2b0f h GLU 92 Ca -0.33 -0.50 -0.64 0.00 0.08 0.00 0.00 59.36 57.97 2b0f h GLU 92 Cb 1.18 0.13 -0.20 0.00 0.50 0.00 0.00 28.75 30.36 2b0f h GLU 92 CO 0.64 1.14 -0.62 0.34 -2.18 0.00 0.00 179.01 178.34 2b0f s ASP 93 N -6.84 5.20 0.00 1.04 2.15 -1.26 -4.80 116.67 112.17 2b0f s ASP 93 Ca -0.12 -0.11 0.00 0.00 0.43 0.00 0.00 52.55 52.75 2b0f s ASP 93 Cb 0.05 -1.91 0.00 0.00 -0.30 0.00 0.00 42.92 40.76 2b0f s ASP 93 CO 0.84 0.07 0.20 0.18 -0.17 0.00 0.00 175.17 176.29 2b0f n LEU 94 N 4.25 0.35 -3.40 -1.34 4.77 -1.26 -4.99 117.00 115.38 2b0f n LEU 94 Ca -0.16 0.53 -0.16 0.00 -0.03 0.00 0.00 56.01 56.19 2b0f n LEU 94 Cb 0.52 -0.43 0.01 0.00 -2.33 0.00 0.00 43.42 41.19 2b0f n LEU 94 CO 0.33 -0.43 -0.00 1.21 -1.33 0.00 0.00 177.39 177.17 2b0f n GLU 95 N -1.78 -1.59 -2.87 3.23 2.13 -1.26 -4.99 120.64 113.52 2b0f n GLU 95 Ca 0.00 1.24 -0.02 0.00 0.66 0.00 0.00 57.16 59.04 2b0f n GLU 95 Cb 0.00 -3.86 0.01 0.00 0.27 0.00 0.00 31.44 27.85 2b0f n GLU 95 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2b0f s GLY 96 N -2.78 -1.33 0.00 8.31 0.00 -1.26 -4.99 107.32 105.27 2b0f s GLY 96 Ca 0.07 -0.10 0.18 0.00 0.00 0.00 0.00 44.72 44.87 2b0f s GLY 96 CO 0.83 3.75 1.59 1.55 0.00 0.00 0.00 173.10 180.81 2b0f n VAL 97 N 3.31 0.00 -3.65 1.40 3.14 -1.26 -4.46 118.33 116.81 2b0f n VAL 97 Ca 0.15 0.00 -0.17 0.00 -2.96 0.00 0.00 64.34 61.36 2b0f n VAL 97 Cb 0.57 -0.43 -0.15 0.00 -1.06 0.00 0.00 33.84 32.77 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 -1.74 0.78 0.24 6.55 2.15 -1.24 -0.97 116.67 122.44 2b0f s ASP 98 Ca 0.27 0.31 -0.02 0.00 0.43 0.00 0.00 52.55 53.55 2b0f s ASP 98 Cb 0.13 0.32 -0.03 0.00 -0.30 0.00 0.00 42.92 43.03 2b0f s ASP 98 CO 0.21 -0.25 0.24 0.00 -0.17 0.00 0.00 175.17 175.20 2b0f s ALA 99 N 2.31 1.03 0.05 3.66 0.00 -1.08 -4.92 121.76 122.80 2b0f s ALA 99 Ca 0.03 -1.62 0.09 0.00 0.00 0.00 0.00 51.96 50.46 2b0f s ALA 99 Cb -0.12 1.34 -0.03 0.00 0.00 0.00 0.00 23.12 24.30 2b0f s ALA 99 CO -0.06 -0.66 -0.26 0.99 0.00 0.00 0.00 175.76 175.77 2b0f s THR 100 N -3.93 2.08 -0.19 0.00 2.01 0.11 -2.60 115.64 113.11 2b0f s THR 100 Ca 0.36 -1.38 -0.03 0.00 0.31 0.00 0.00 61.69 60.95 2b0f s THR 100 Cb 0.04 -1.78 -0.02 0.00 0.01 0.00 0.00 72.50 70.75 2b0f s THR 100 CO 0.15 0.34 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.15 2b0f s LEU 101 N -1.26 3.01 -0.21 4.42 2.96 0.30 -0.27 118.68 127.63 2b0f s LEU 101 Ca 0.11 -0.29 -0.02 0.00 -0.22 0.00 0.00 54.13 53.71 2b0f s LEU 101 Cb -0.10 -1.74 -0.00 0.00 0.50 0.00 0.00 46.19 44.85 2b0f s LEU 101 CO 0.02 0.06 -0.09 0.68 -1.32 0.00 0.00 176.35 175.71 2b0f s VAL 102 N 0.98 3.01 -0.11 1.68 -7.23 0.19 0.11 120.40 119.04 2b0f s VAL 102 Ca 0.00 -0.62 0.01 0.00 -1.81 0.00 0.00 61.98 59.56 2b0f s VAL 102 Cb -0.15 -2.34 -0.02 0.00 0.56 0.00 0.00 36.38 34.43 2b0f s VAL 102 CO 0.01 0.46 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.44 2b0f s VAL 103 N 1.38 3.18 -0.40 1.32 1.01 0.80 -0.10 120.40 127.59 2b0f s VAL 103 Ca 0.05 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.45 2b0f s VAL 103 Cb -0.14 -2.31 0.21 0.00 0.00 0.00 0.00 36.38 34.14 2b0f s VAL 103 CO -0.06 0.55 0.44 1.57 0.00 0.00 0.00 175.10 177.60 2b0f n HIS 104 N 3.10 -0.79 -3.62 5.22 -0.00 -1.19 -1.08 115.22 116.87 2b0f n HIS 104 Ca -0.18 -3.35 0.00 0.00 0.46 0.00 0.00 57.72 54.65 2b0f n HIS 104 Cb 0.53 0.03 0.00 0.00 -0.12 0.00 0.00 29.99 30.43 2b0f n HIS 104 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2b0f n SER 105 N 2.17 1.84 -0.10 0.26 3.41 0.13 -3.26 113.62 118.07 2b0f n SER 105 Ca 0.25 -0.70 -0.10 0.00 -0.26 0.00 0.00 58.87 58.06 2b0f n SER 105 Cb 0.51 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.50 2b0f n SER 105 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2b0f h ASN 106 N 0.00 0.87 0.00 4.04 -1.07 -1.56 -3.36 115.58 114.49 2b0f h ASN 106 Ca 0.00 -0.36 0.00 0.00 0.07 0.00 0.00 56.30 56.01 2b0f h ASN 106 Cb 0.00 -0.24 0.00 0.00 -2.07 0.00 0.00 38.32 36.01 2b0f h ASN 106 CO 0.00 1.10 -0.25 -1.13 0.07 0.00 0.00 177.43 177.23 2b0f h ASN 107 N 0.70 0.00 -3.48 6.14 -0.73 -1.87 -3.44 115.58 112.91 2b0f h ASN 107 Ca 0.08 0.00 -0.70 0.00 1.87 0.00 0.00 56.30 57.55 2b0f h ASN 107 Cb 0.86 0.00 -0.19 0.00 0.27 0.00 0.00 38.32 39.26 2b0f h ASN 107 CO 0.08 0.58 -0.18 -0.36 -0.37 0.00 0.00 177.43 177.17 2b0f s PHE 108 N -1.84 3.16 -0.24 0.67 0.08 -1.26 -5.04 117.98 113.52 2b0f s PHE 108 Ca -0.07 -0.45 -0.03 0.00 0.12 0.00 0.00 56.93 56.50 2b0f s PHE 108 Cb 0.01 -3.01 0.01 0.00 -0.57 0.00 0.00 43.02 39.46 2b0f s PHE 108 CO 0.11 -0.76 -0.05 0.99 -0.10 0.00 0.00 175.22 175.41 2b0f s THR 109 N 2.16 3.15 -0.77 0.64 2.01 -1.26 0.21 115.64 121.78 2b0f s THR 109 Ca 0.12 -0.74 -0.02 0.00 0.31 0.00 0.00 61.69 61.35 2b0f s THR 109 Cb -0.18 -2.51 0.00 0.00 0.01 0.00 0.00 72.50 69.82 2b0f s THR 109 CO 0.13 0.31 0.26 0.59 -0.69 0.00 0.00 174.62 175.22 2b0f n ASN 110 N 4.74 -3.72 -4.65 3.53 5.03 -0.86 -4.98 115.26 114.35 2b0f n ASN 110 Ca -0.17 -0.12 -0.41 0.00 0.87 0.00 0.00 54.58 54.75 2b0f n ASN 110 Cb 0.49 -2.66 -0.05 0.00 -1.02 0.00 0.00 39.78 36.54 2b0f n ASN 110 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2b0f s THR 111 N -2.80 4.95 -0.27 3.41 2.01 -0.24 -4.95 115.64 117.75 2b0f s THR 111 Ca 0.13 1.36 0.03 0.00 0.31 0.00 0.00 61.69 63.52 2b0f s THR 111 Cb -0.06 -4.02 0.06 0.00 0.01 0.00 0.00 72.50 68.49 2b0f s THR 111 CO 0.16 0.04 -0.10 -0.51 -0.69 0.00 0.00 174.62 173.53 2b0f s ILE 112 N 2.22 2.18 -0.14 1.82 2.07 -1.26 -0.14 121.20 127.96 2b0f s ILE 112 Ca 0.32 -1.69 0.00 0.00 -1.41 0.00 0.00 60.65 57.87 2b0f s ILE 112 Cb -0.16 -2.31 -0.01 0.00 0.13 0.00 0.00 42.46 40.11 2b0f s ILE 112 CO 0.10 -0.07 -0.14 -0.76 -1.91 0.00 0.00 174.94 172.16 2b0f s LEU 113 N 1.09 2.61 -0.54 8.50 1.43 0.12 -4.97 118.68 126.93 2b0f s LEU 113 Ca -0.08 -0.38 -0.23 0.00 -1.03 0.00 0.00 54.13 52.41 2b0f s LEU 113 Cb -0.20 -1.59 0.04 0.00 0.03 0.00 0.00 46.19 44.48 2b0f s LEU 113 CO -0.05 0.14 0.88 -1.61 0.23 0.00 0.00 176.35 175.93 2b0f s GLU 114 N 0.50 3.30 0.06 1.70 2.02 -1.26 0.11 118.70 125.12 2b0f s GLU 114 Ca -0.10 -0.36 -0.12 0.00 0.02 0.00 0.00 54.97 54.41 2b0f s GLU 114 Cb -0.16 -4.05 -0.30 0.00 0.10 0.00 0.00 34.13 29.72 2b0f s GLU 114 CO 0.04 -1.41 1.09 -0.39 0.02 0.00 0.00 175.26 174.61 2b0f h VAL 115 N 5.99 1.34 0.00 2.63 -1.51 -1.85 -3.48 116.25 119.37 2b0f h VAL 115 Ca -0.26 -2.68 0.00 0.00 -1.23 0.00 0.00 66.70 62.52 2b0f h VAL 115 Cb 1.08 2.86 0.00 0.00 -2.13 0.00 0.00 31.29 33.10 2b0f h VAL 115 CO 1.06 0.80 0.00 0.61 -1.23 0.00 0.00 177.57 178.81 2b0f n GLY 116 N 1.50 1.00 3.59 5.19 0.00 -1.14 -4.59 105.19 110.74 2b0f n GLY 116 Ca -0.13 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 2b0f n GLY 116 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2b0f s PRO 117 N 0.00 3.04 -0.09 1.61 0.02 -1.24 -2.65 135.00 135.69 2b0f s PRO 117 Ca 0.00 1.86 -0.02 0.00 0.02 0.00 0.00 61.00 62.86 2b0f s PRO 117 Cb 0.00 -4.37 -0.03 0.00 0.02 0.00 0.00 34.50 30.11 2b0f s PRO 117 CO 0.00 -2.21 0.01 0.08 -0.33 0.00 0.00 177.00 174.56 2b0f s VAL 118 N 8.54 4.42 -0.00 3.83 1.01 -0.14 -0.87 120.40 137.20 2b0f s VAL 118 Ca 0.97 -0.20 -0.19 0.00 0.00 0.00 0.00 61.98 62.55 2b0f s VAL 118 Cb -0.30 -2.87 0.04 0.00 0.00 0.00 0.00 36.38 33.25 2b0f s VAL 118 CO 0.34 0.60 0.43 -0.89 0.00 0.00 0.00 175.10 175.57 2b0f s THR 119 N -0.84 0.04 0.40 3.92 2.01 0.13 -4.32 115.64 116.98 2b0f s THR 119 Ca 0.13 -0.37 -0.17 0.00 0.31 0.00 0.00 61.69 61.59 2b0f s THR 119 Cb -0.11 -0.82 -0.09 0.00 0.01 0.00 0.00 72.50 71.48 2b0f s THR 119 CO 0.02 -0.20 0.86 0.00 -0.69 0.00 0.00 174.62 174.61 2b0f s MET 120 N -1.71 4.06 -0.06 4.92 0.23 -1.26 0.14 119.30 125.61 2b0f s MET 120 Ca -0.10 0.86 0.02 0.00 -1.03 0.00 0.00 55.69 55.45 2b0f s MET 120 Cb -0.03 -2.29 -0.06 0.00 -1.53 0.00 0.00 34.83 30.93 2b0f s MET 120 CO 0.03 0.01 -0.03 0.00 -2.03 0.00 0.00 175.02 173.00 2b0f n ALA 121 N -0.73 1.85 0.00 3.16 0.00 0.60 -4.69 120.51 120.70 2b0f n ALA 121 Ca 0.05 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2b0f n ALA 121 Cb 0.54 0.25 0.00 0.00 0.00 0.00 0.00 19.45 20.24 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 2.95 0.87 2.88 0.00 0.00 -0.77 -4.90 105.19 106.23 2b0f n GLY 122 Ca -0.11 -0.76 -0.23 0.00 0.00 0.00 0.00 46.02 44.93 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 1.15 0.34 0.99 0.20 -1.26 -0.47 118.68 119.63 2b0f s LEU 123 Ca 0.00 -0.17 0.06 0.00 0.69 0.00 0.00 54.13 54.70 2b0f s LEU 123 Cb 0.00 -0.57 -0.02 0.00 -0.43 0.00 0.00 46.19 45.16 2b0f s LEU 123 CO 0.00 -0.09 0.32 0.27 -0.29 0.00 0.00 176.35 176.56 2b0f s ILE 124 N 1.31 0.00 -0.71 6.68 -4.36 -0.69 -4.98 121.20 118.45 2b0f s ILE 124 Ca -0.04 -1.92 -0.14 0.00 -0.26 0.00 0.00 60.65 58.28 2b0f s ILE 124 Cb -0.14 -2.54 0.18 0.00 1.25 0.00 0.00 42.46 41.22 2b0f s ILE 124 CO -0.02 0.00 0.66 0.20 0.24 0.00 0.00 174.94 176.01 2b0f s ASN 125 N -3.36 6.50 -0.73 4.36 0.01 -1.26 -0.59 114.94 119.87 2b0f s ASN 125 Ca 0.39 -2.36 -0.26 0.00 -0.71 0.00 0.00 52.86 49.92 2b0f s ASN 125 Cb 0.02 -2.20 -0.01 0.00 0.41 0.00 0.00 41.25 39.47 2b0f s ASN 125 CO 0.27 -0.67 1.72 -0.22 -1.51 0.00 0.00 177.10 176.69 2b0f s LEU 126 N 0.69 3.25 -1.37 0.60 2.96 0.28 -3.07 118.68 122.03 2b0f s LEU 126 Ca 0.12 -0.18 -0.04 0.00 -0.22 0.00 0.00 54.13 53.82 2b0f s LEU 126 Cb -0.18 -2.55 0.00 0.00 0.50 0.00 0.00 46.19 43.97 2b0f s LEU 126 CO -0.04 -2.27 0.54 -1.20 -1.32 0.00 0.00 176.35 172.06 2b0f n SER 127 N 11.99 -5.59 0.00 3.68 7.64 -1.26 -1.17 113.62 128.91 2b0f n SER 127 Ca 0.22 -0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.84 2b0f n SER 127 Cb 0.50 -4.42 0.00 0.00 -1.01 0.00 0.00 64.21 59.28 2b0f n SER 127 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2b0f n SER 128 N -1.99 -0.28 -4.35 6.43 7.64 -1.17 -4.99 113.62 114.91 2b0f n SER 128 Ca -0.10 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.37 2b0f n SER 128 Cb 0.61 -0.15 -0.10 0.00 -1.01 0.00 0.00 64.21 63.55 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 -3.70 4.66 0.08 0.44 2.01 -0.32 -5.00 115.64 113.82 2b0f s THR 129 Ca 0.00 -1.08 -0.31 0.00 0.31 0.00 0.00 61.69 60.61 2b0f s THR 129 Cb 0.00 -3.73 -0.09 0.00 0.01 0.00 0.00 72.50 68.68 2b0f s THR 129 CO 0.00 -0.42 1.86 -2.16 -0.69 0.00 0.00 174.62 173.21 2b0f s PRO 130 N 1.54 4.14 0.05 4.92 0.04 -1.26 -0.56 135.00 143.87 2b0f s PRO 130 Ca 0.03 2.57 0.08 0.00 0.04 0.00 0.00 61.00 63.72 2b0f s PRO 130 Cb -0.22 -3.82 -0.03 0.00 0.04 0.00 0.00 34.50 30.48 2b0f s PRO 130 CO 0.05 -0.88 -0.22 0.95 0.04 0.00 0.00 177.00 176.94 2b0f s THR 131 N 3.42 1.81 0.38 1.26 -4.23 0.24 -1.75 115.64 116.78 2b0f s THR 131 Ca 0.83 -1.27 0.08 0.00 -1.18 0.00 0.00 61.69 60.15 2b0f s THR 131 Cb -0.44 -1.57 -0.06 0.00 1.34 0.00 0.00 72.50 71.77 2b0f s THR 131 CO 0.38 0.24 0.04 0.21 -0.54 0.00 0.00 174.62 174.95 2b0f s ASN 132 N -1.22 4.08 -1.25 3.99 2.47 -0.01 -1.70 114.94 121.29 2b0f s ASN 132 Ca 0.09 -1.18 -0.01 0.00 0.42 0.00 0.00 52.86 52.18 2b0f s ASN 132 Cb -0.09 -0.45 0.00 0.00 -1.45 0.00 0.00 41.25 39.26 2b0f s ASN 132 CO 0.02 -0.39 0.13 0.54 -3.72 0.00 0.00 177.10 173.68 2b0f n ARG 133 N -1.01 -1.88 -2.82 0.43 3.00 0.38 -4.71 116.66 110.05 2b0f n ARG 133 Ca -0.04 0.72 -0.41 0.00 -0.01 0.00 0.00 57.85 58.11 2b0f n ARG 133 Cb 0.65 -5.06 -0.04 0.00 0.00 0.00 0.00 32.46 28.01 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 -4.93 4.53 -0.05 5.56 -1.94 -0.14 -1.23 119.30 121.10 2b0f s MET 134 Ca 0.06 1.24 -0.07 0.00 -1.71 0.00 0.00 55.69 55.22 2b0f s MET 134 Cb -0.03 -3.45 -0.04 0.00 2.01 0.00 0.00 34.83 33.32 2b0f s MET 134 CO 0.08 0.01 0.21 0.42 -0.01 0.00 0.00 175.02 175.72 2b0f s ILE 135 N 0.87 5.39 0.21 2.53 1.01 0.43 -0.29 121.20 131.35 2b0f s ILE 135 Ca 0.47 0.17 0.10 0.00 0.00 0.00 0.00 60.65 61.39 2b0f s ILE 135 Cb -0.20 -3.50 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 2b0f s ILE 135 CO 0.25 0.48 -0.19 0.00 0.00 0.00 0.00 174.94 175.47 2b0f s ARG 136 N -1.44 1.45 -0.20 2.79 1.70 0.36 -1.38 118.95 122.22 2b0f s ARG 136 Ca 0.22 -1.57 -0.23 0.00 -0.47 0.00 0.00 55.73 53.68 2b0f s ARG 136 Cb -0.13 -1.53 0.06 0.00 -0.57 0.00 0.00 34.95 32.78 2b0f s ARG 136 CO 0.11 0.30 0.63 1.52 -1.08 0.00 0.00 175.30 176.79 2b0f s TYR 137 N -2.26 -0.68 -0.76 5.89 -0.85 -0.79 0.20 117.35 118.10 2b0f s TYR 137 Ca 0.22 1.57 -0.26 0.00 -0.52 0.00 0.00 57.07 58.08 2b0f s TYR 137 Cb -0.05 0.26 0.02 0.00 0.38 0.00 0.00 41.96 42.57 2b0f s TYR 137 CO 0.10 -0.38 1.41 0.34 -1.52 0.00 0.00 175.55 175.50 2b0f s ASP 138 N 0.06 6.04 -0.29 -0.18 2.15 -0.04 -0.39 116.67 124.01 2b0f s ASP 138 Ca -0.02 -0.47 -0.20 0.00 0.43 0.00 0.00 52.55 52.29 2b0f s ASP 138 Cb -0.04 -2.56 0.15 0.00 -0.30 0.00 0.00 42.92 40.18 2b0f s ASP 138 CO 0.02 -1.91 1.10 -0.47 -0.17 0.00 0.00 175.17 173.74 2b0f s TYR 139 N 6.29 -0.40 -0.18 -5.34 5.04 -0.10 -4.49 117.35 118.17 2b0f s TYR 139 Ca 0.43 0.87 -0.29 0.00 -2.44 0.00 0.00 57.07 55.64 2b0f s TYR 139 Cb -0.08 0.33 -0.04 0.00 0.35 0.00 0.00 41.96 42.52 2b0f s TYR 139 CO 0.12 -0.20 1.86 0.00 -1.34 0.00 0.00 175.55 176.00 2b0f s ALA 140 N 0.80 3.15 0.29 3.97 0.00 -1.26 -3.40 121.76 125.31 2b0f s ALA 140 Ca -0.03 0.70 0.10 0.00 0.00 0.00 0.00 51.96 52.74 2b0f s ALA 140 Cb -0.04 -3.93 -0.06 0.00 0.00 0.00 0.00 23.12 19.10 2b0f s ALA 140 CO -0.12 -2.17 -0.15 0.95 0.00 0.00 0.00 175.76 174.28 2b0f s THR 141 N 6.04 2.24 -0.03 0.00 -4.23 -0.60 -5.01 115.64 114.05 2b0f s THR 141 Ca 0.83 -2.29 -0.26 0.00 -1.18 0.00 0.00 61.69 58.78 2b0f s THR 141 Cb -0.30 -2.40 0.06 0.00 1.34 0.00 0.00 72.50 71.20 2b0f s THR 141 CO 0.34 -0.35 0.58 -0.75 -0.54 0.00 0.00 174.62 173.90 2b0f s LYS 142 N -3.58 0.97 0.83 3.99 2.20 -1.26 -4.47 119.74 118.42 2b0f s LYS 142 Ca 0.30 0.11 -0.15 0.00 -0.36 0.00 0.00 55.97 55.87 2b0f s LYS 142 Cb -0.01 0.45 -0.13 0.00 -1.51 0.00 0.00 37.83 36.63 2b0f s LYS 142 CO 0.14 -0.30 -0.64 0.25 -0.36 0.00 0.00 175.35 174.44 2b0f n THR 143 N 0.94 0.00 0.00 3.43 -2.24 -1.26 -2.20 114.28 112.95 2b0f n THR 143 Ca -0.20 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 2b0f n THR 143 Cb 0.57 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 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 2.97 2.91 0.41 3.38 0.00 -1.26 -4.78 105.19 108.83 2b0f n GLY 144 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 2b0f n GLY 144 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2b0f n GLN 145 N -0.88 1.49 -2.60 1.61 6.02 -0.94 -4.71 117.38 117.38 2b0f n GLN 145 Ca 0.00 -0.83 -0.39 0.00 -0.01 0.00 0.00 57.00 55.77 2b0f n GLN 145 Cb 0.00 -1.48 -0.05 0.00 1.02 0.00 0.00 30.24 29.73 2b0f n GLN 145 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b0f n GLY 147 N 0.88 2.65 3.72 0.00 0.00 0.27 -4.69 105.19 108.02 2b0f n GLY 147 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 2b0f n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b0f n GLY 148 N -0.72 0.60 3.66 -0.02 0.00 -1.17 -4.30 105.19 103.23 2b0f n GLY 148 Ca 0.00 0.09 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2b0f n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b0f s VAL 149 N -1.26 5.18 -0.41 1.61 1.01 0.85 0.96 120.40 128.33 2b0f s VAL 149 Ca 0.67 0.74 -0.21 0.00 0.00 0.00 0.00 61.98 63.17 2b0f s VAL 149 Cb -0.46 -3.75 0.02 0.00 0.00 0.00 0.00 36.38 32.19 2b0f s VAL 149 CO 0.53 0.22 0.67 -0.22 0.00 0.00 0.00 175.10 176.30 2b0f s LEU 150 N 1.50 4.37 0.32 3.92 2.96 0.50 -0.64 118.68 131.61 2b0f s LEU 150 Ca 0.19 -0.13 -0.02 0.00 -0.22 0.00 0.00 54.13 53.95 2b0f s LEU 150 Cb -0.15 -2.79 -0.00 0.00 0.50 0.00 0.00 46.19 43.74 2b0f s LEU 150 CO 0.08 -0.74 0.43 0.00 -1.32 0.00 0.00 176.35 174.80 2b0f s ALA 152 N -3.25 0.32 -0.19 0.00 0.00 0.10 0.05 121.76 118.80 2b0f s ALA 152 Ca 0.31 -1.28 -0.28 0.00 0.00 0.00 0.00 51.96 50.71 2b0f s ALA 152 Cb 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 23.12 24.11 2b0f s ALA 152 CO 0.20 -0.84 2.14 -0.08 0.00 0.00 0.00 175.76 177.17 2b0f s THR 153 N -3.00 3.06 -1.02 0.00 -1.32 -1.26 -1.72 115.64 110.37 2b0f s THR 153 Ca 0.26 0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.81 2b0f s THR 153 Cb -0.01 -3.07 0.00 0.00 -1.51 0.00 0.00 72.50 67.90 2b0f s THR 153 CO 0.17 -0.04 0.00 0.61 -2.21 0.00 0.00 174.62 173.15 2b0f n GLY 154 N 5.53 1.01 3.26 6.08 0.00 -1.26 -4.99 105.19 114.82 2b0f n GLY 154 Ca 0.28 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.01 0.33 -0.19 1.61 2.20 -0.70 -4.84 119.74 115.13 2b0f s LYS 155 Ca 0.00 1.00 -0.07 0.00 -0.36 0.00 0.00 55.97 56.54 2b0f s LYS 155 Cb 0.00 0.28 -0.04 0.00 -1.51 0.00 0.00 37.83 36.56 2b0f s LYS 155 CO 0.00 -0.24 0.06 0.42 -0.36 0.00 0.00 175.35 175.23 2b0f s ILE 156 N 2.47 4.74 -0.18 5.43 1.01 0.17 0.03 121.20 134.87 2b0f s ILE 156 Ca -0.03 -0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.52 2b0f s ILE 156 Cb -0.12 -3.14 -0.22 0.00 0.01 0.00 0.00 42.46 38.99 2b0f s ILE 156 CO -0.13 0.44 0.13 0.49 0.00 0.00 0.00 174.94 175.88 2b0f n PHE 157 N 3.71 0.78 -3.24 3.97 3.72 0.15 -2.57 117.46 123.99 2b0f n PHE 157 Ca -0.16 0.18 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 2b0f n PHE 157 Cb 0.52 -1.10 0.00 0.00 -0.94 0.00 0.00 39.48 37.96 2b0f n PHE 157 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b0f n GLY 158 N 2.01 -0.43 3.32 1.37 0.00 -1.08 -0.43 105.19 109.95 2b0f n GLY 158 Ca -0.38 -1.10 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 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 -3.15 2.03 -0.58 -0.61 -4.36 -1.17 -0.37 121.20 112.98 2b0f s ILE 159 Ca 0.00 -1.29 -0.27 0.00 -0.26 0.00 0.00 60.65 58.82 2b0f s ILE 159 Cb 0.00 -1.73 -0.00 0.00 1.25 0.00 0.00 42.46 41.98 2b0f s ILE 159 CO 0.00 0.38 1.65 -2.28 0.24 0.00 0.00 174.94 174.93 2b0f s HIS 160 N -0.76 1.94 -0.26 1.37 5.65 0.27 -1.37 115.29 122.14 2b0f s HIS 160 Ca 0.11 0.57 0.23 0.00 0.25 0.00 0.00 55.06 56.21 2b0f s HIS 160 Cb -0.10 -4.25 -0.01 0.00 -1.18 0.00 0.00 32.58 27.04 2b0f s HIS 160 CO 0.01 -2.26 1.00 1.33 -0.65 0.00 0.00 174.74 174.18 2b0f n VAL 161 N 7.03 0.52 -2.12 0.89 0.24 -0.74 0.95 118.33 125.10 2b0f n VAL 161 Ca 0.16 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 2b0f n VAL 161 Cb 0.50 -0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.61 2b0f n VAL 161 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2b0f n GLY 162 N 1.21 1.26 0.00 7.63 0.00 -0.60 -4.81 105.19 109.89 2b0f n GLY 162 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2b0f n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b0f n GLY 163 N 0.00 0.68 2.72 -0.02 0.00 -1.26 -0.03 105.19 107.28 2b0f n GLY 163 Ca 0.00 -0.85 -0.28 0.00 0.00 0.00 0.00 46.02 44.89 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 3.60 0.00 1.61 3.84 0.20 -4.83 114.94 119.36 2b0f s ASN 164 Ca 0.00 -3.21 0.00 0.00 0.21 0.00 0.00 52.86 49.86 2b0f s ASN 164 Cb 0.00 -1.15 0.00 0.00 -0.55 0.00 0.00 41.25 39.55 2b0f s ASN 164 CO 0.00 -0.17 0.00 0.61 -2.79 0.00 0.00 177.10 174.75 2b0f n GLY 165 N 2.77 0.75 0.99 1.21 0.00 -1.26 -2.22 105.19 107.43 2b0f n GLY 165 Ca 0.17 0.55 0.10 0.00 0.00 0.00 0.00 46.02 46.85 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 2.28 -4.47 1.61 1.74 -1.26 -1.56 116.66 115.00 2b0f n ARG 166 Ca 0.00 -2.10 -0.27 0.00 -0.77 0.00 0.00 57.85 54.71 2b0f n ARG 166 Cb 0.00 -1.44 -0.17 0.00 -1.02 0.00 0.00 32.46 29.83 2b0f n ARG 166 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2b0f s GLN 167 N -1.40 1.99 0.26 5.56 -0.21 -0.94 -0.93 119.66 124.00 2b0f s GLN 167 Ca 0.33 -0.49 -0.24 0.00 0.02 0.00 0.00 55.36 54.98 2b0f s GLN 167 Cb 0.20 -1.70 -0.09 0.00 1.00 0.00 0.00 33.01 32.41 2b0f s GLN 167 CO 0.27 -0.04 0.84 0.20 -2.12 0.00 0.00 175.29 174.44 2b0f s GLY 168 N 0.93 2.77 -0.25 3.09 0.00 0.48 0.60 107.32 114.93 2b0f s GLY 168 Ca -0.09 0.38 0.02 0.00 0.00 0.00 0.00 44.72 45.03 2b0f s GLY 168 CO -0.00 0.81 -0.08 -1.36 0.00 0.00 0.00 173.10 172.47 2b0f s PHE 169 N -1.50 2.90 0.03 1.90 0.40 0.95 -1.89 117.98 120.78 2b0f s PHE 169 Ca 0.45 -2.11 0.03 0.00 -0.60 0.00 0.00 56.93 54.70 2b0f s PHE 169 Cb -0.19 -1.82 -0.04 0.00 0.51 0.00 0.00 43.02 41.48 2b0f s PHE 169 CO 0.24 -0.84 -0.01 0.45 0.70 0.00 0.00 175.22 175.76 2b0f s SER 170 N 1.22 5.03 -0.20 1.36 0.15 -0.48 -1.56 113.70 119.23 2b0f s SER 170 Ca -0.07 -0.08 -0.17 0.00 0.70 0.00 0.00 55.95 56.34 2b0f s SER 170 Cb -0.19 -1.26 -0.04 0.00 -1.71 0.00 0.00 66.02 62.82 2b0f s SER 170 CO -0.06 0.24 0.43 0.00 1.20 0.00 0.00 173.24 175.05 2b0f s ALA 171 N -1.16 3.55 -0.18 5.45 0.00 -0.47 0.16 121.76 129.11 2b0f s ALA 171 Ca 0.22 -0.49 -0.29 0.00 0.00 0.00 0.00 51.96 51.39 2b0f s ALA 171 Cb -0.12 -2.68 -0.03 0.00 0.00 0.00 0.00 23.12 20.29 2b0f s ALA 171 CO 0.13 -0.33 1.62 1.14 0.00 0.00 0.00 175.76 178.32 2b0f s GLN 172 N 1.38 3.89 -0.94 0.00 -2.07 -0.36 -3.05 119.66 118.51 2b0f s GLN 172 Ca 0.20 1.78 -0.22 0.00 -1.82 0.00 0.00 55.36 55.30 2b0f s GLN 172 Cb -0.15 -4.02 0.07 0.00 -1.09 0.00 0.00 33.01 27.82 2b0f s GLN 172 CO 0.08 -1.18 1.30 -1.17 -1.32 0.00 0.00 175.29 173.00 2b0f s LEU 173 N 4.93 3.96 0.23 2.60 2.96 0.43 -4.95 118.68 128.83 2b0f s LEU 173 Ca 0.72 -1.46 -0.23 0.00 -0.22 0.00 0.00 54.13 52.93 2b0f s LEU 173 Cb -0.27 -2.51 -0.09 0.00 0.50 0.00 0.00 46.19 43.83 2b0f s LEU 173 CO 0.29 -1.42 0.80 -0.54 -1.32 0.00 0.00 176.35 174.16 2b0f s LYS 174 N 4.36 4.45 0.39 1.98 1.02 -1.25 -3.72 119.74 126.96 2b0f s LYS 174 Ca 0.39 1.09 0.28 0.00 0.02 0.00 0.00 55.97 57.75 2b0f s LYS 174 Cb -0.04 -2.99 1.30 0.00 -0.52 0.00 0.00 37.83 35.58 2b0f s LYS 174 CO -0.05 0.43 1.84 -0.22 -0.92 0.00 0.00 175.35 176.42 2b0f h LYS 175 N 3.66 0.00 -0.54 1.68 3.64 -1.75 -2.96 116.57 120.31 2b0f h LYS 175 Ca -0.47 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.01 2b0f h LYS 175 Cb 1.20 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.91 2b0f h LYS 175 CO 0.65 0.00 -0.18 0.37 -2.27 0.00 0.00 179.45 178.02 2b0f h GLN 176 N 0.00 -0.05 0.00 1.90 4.15 -1.91 -0.80 115.11 118.40 2b0f h GLN 176 Ca 0.00 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.32 2b0f h GLN 176 Cb 0.25 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.94 2b0f h GLN 176 CO 0.00 -0.04 -0.52 1.88 -1.93 0.00 0.00 178.83 178.23 2b0f h TYR 177 N -0.06 0.00 -0.04 3.99 0.05 -1.93 -3.11 116.97 115.87 2b0f h TYR 177 Ca 0.25 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.03 2b0f h TYR 177 Cb 0.45 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.19 2b0f h TYR 177 CO -0.49 0.52 0.00 1.19 -1.05 0.00 0.00 178.16 178.33 2b0f n PHE 178 N -3.85 0.03 0.24 4.88 3.72 -0.44 -1.52 117.46 120.52 2b0f n PHE 178 Ca -0.01 -0.02 0.10 0.00 -0.05 0.00 0.00 57.45 57.47 2b0f n PHE 178 Cb 0.54 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.94 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 0.20 0.00 0.01 -4.37 3.14 -0.43 -4.17 118.33 112.71 2b0f n VAL 179 Ca 0.19 -0.35 -0.01 0.00 -2.96 0.00 0.00 64.34 61.21 2b0f n VAL 179 Cb 0.35 0.30 -0.10 0.00 -1.06 0.00 0.00 33.84 33.33 2b0f n VAL 179 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2b0f n GLU 180 N -2.00 0.63 -4.14 1.45 1.02 -1.18 -4.77 120.64 111.66 2b0f n GLU 180 Ca -0.02 0.16 -0.34 0.00 -0.02 0.00 0.00 57.16 56.95 2b0f n GLU 180 Cb 0.46 -1.75 -0.15 0.00 -0.02 0.00 0.00 31.44 29.98 2b0f n GLU 180 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2b0f s LYS 181 N -2.91 3.12 0.00 3.49 2.20 -0.58 -5.11 119.74 119.96 2b0f s LYS 181 Ca -0.04 -0.77 0.00 0.00 -0.36 0.00 0.00 55.97 54.80 2b0f s LYS 181 Cb 0.09 -2.69 0.00 0.00 -1.51 0.00 0.00 37.83 33.72 2b0f s LYS 181 CO 0.82 -0.17 0.00 0.94 -0.36 0.00 0.00 175.35 176.58