#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 0.04 0.28 1.61 0.13 -2.01 -2.36 132.00 129.69 2b0f h PRO 2 Ca 0.00 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.10 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 0.30 -0.13 -0.97 -0.23 0.00 0.00 178.00 176.97 2b0f h ASN 3 N 0.04 -0.32 -0.28 1.44 -0.73 -1.94 -1.25 115.58 112.54 2b0f h ASN 3 Ca 0.00 -0.09 0.07 0.00 1.87 0.00 0.00 56.30 58.15 2b0f h ASN 3 Cb 0.49 0.08 -0.08 0.00 0.27 0.00 0.00 38.32 39.08 2b0f h ASN 3 CO 0.04 -0.10 -0.27 0.74 -0.37 0.00 0.00 177.43 177.46 2b0f h THR 4 N -0.53 0.33 0.01 -3.57 2.02 -1.94 0.29 112.91 109.52 2b0f h THR 4 Ca -0.04 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.16 2b0f h THR 4 Cb 0.39 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 2b0f h THR 4 CO 0.06 0.00 -0.10 -0.08 0.37 0.00 0.00 175.52 175.77 2b0f h GLU 5 N -0.27 -0.18 0.06 6.66 4.57 -1.40 -1.35 114.58 122.68 2b0f h GLU 5 Ca 0.15 0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.33 2b0f h GLU 5 Cb 0.50 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 2b0f h GLU 5 CO -0.43 -0.12 -0.03 0.35 -1.18 0.00 0.00 179.01 177.60 2b0f h PHE 6 N -0.18 -0.07 -0.49 0.92 3.57 -0.80 -1.72 116.94 118.16 2b0f h PHE 6 Ca 0.04 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2b0f h PHE 6 Cb 0.23 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 2b0f h PHE 6 CO -0.16 -0.01 0.31 0.00 -2.23 0.00 0.00 178.31 176.22 2b0f h ALA 7 N 0.83 0.63 -0.25 2.41 0.00 -0.36 0.13 119.26 122.64 2b0f h ALA 7 Ca -0.01 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 2b0f h ALA 7 Cb 0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2b0f h ALA 7 CO 0.01 0.10 -0.30 1.25 0.00 0.00 0.00 179.25 180.32 2b0f h LEU 8 N 0.66 0.53 -0.46 0.00 6.46 -1.22 -1.50 115.31 119.77 2b0f h LEU 8 Ca 0.18 -0.20 -0.16 0.00 -0.12 0.00 0.00 57.88 57.59 2b0f h LEU 8 Cb -0.03 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 39.75 2b0f h LEU 8 CO -0.04 0.80 -0.43 0.28 -0.62 0.00 0.00 178.44 178.44 2b0f h SER 9 N 0.45 0.86 -0.90 1.25 0.02 -1.00 -2.99 113.55 111.24 2b0f h SER 9 Ca 0.06 -0.41 -0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2b0f h SER 9 Cb 0.74 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.00 2b0f h SER 9 CO 0.06 1.17 0.55 0.25 -1.14 0.00 0.00 176.83 177.72 2b0f h LEU 10 N 0.65 1.06 -0.07 5.07 5.85 -0.42 -2.72 115.31 124.73 2b0f h LEU 10 Ca 0.04 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.74 2b0f h LEU 10 Cb 1.00 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 2b0f h LEU 10 CO 0.10 0.81 -0.44 -0.07 -0.34 0.00 0.00 178.44 178.49 2b0f h LEU 11 N 1.23 -1.36 -2.10 2.25 3.38 -1.14 -0.20 115.31 117.37 2b0f h LEU 11 Ca 0.32 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.46 2b0f h LEU 11 Cb -0.08 0.54 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2b0f h LEU 11 CO -0.06 -0.45 -0.04 0.03 0.09 0.00 0.00 178.44 178.01 2b0f h ARG 12 N -0.55 0.00 0.00 1.13 3.08 -1.48 -2.79 114.38 113.77 2b0f h ARG 12 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2b0f h ARG 12 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 2b0f h ARG 12 CO -0.37 0.04 -0.78 1.63 -1.07 0.00 0.00 179.97 179.42 2b0f n LYS 13 N -4.20 0.43 0.00 0.04 4.76 -0.88 -4.81 118.16 113.50 2b0f n LYS 13 Ca -0.03 0.22 0.08 0.00 -2.87 0.00 0.00 58.31 55.71 2b0f n LYS 13 Cb 0.12 -1.32 -0.05 0.00 -1.84 0.00 0.00 35.03 31.95 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 -4.15 1.28 -4.69 4.39 4.13 -0.14 -4.80 115.26 111.27 2b0f n ASN 14 Ca -0.11 -1.14 -0.38 0.00 1.68 0.00 0.00 54.58 54.63 2b0f n ASN 14 Cb 0.40 0.73 -0.07 0.00 -1.54 0.00 0.00 39.78 39.30 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 -2.30 5.17 0.04 2.41 -1.09 -1.00 -1.60 121.20 122.84 2b0f s ILE 15 Ca 0.11 0.87 0.03 0.00 -2.23 0.00 0.00 60.65 59.42 2b0f s ILE 15 Cb 0.13 -3.79 -0.02 0.00 -1.58 0.00 0.00 42.46 37.20 2b0f s ILE 15 CO 0.56 0.26 -0.10 -0.04 -1.23 0.00 0.00 174.94 174.39 2b0f s MET 16 N 1.14 0.65 -0.43 2.79 -1.94 -1.03 -4.71 119.30 115.77 2b0f s MET 16 Ca 0.23 -0.75 -0.27 0.00 -1.71 0.00 0.00 55.69 53.19 2b0f s MET 16 Cb -0.15 -0.54 0.02 0.00 2.01 0.00 0.00 34.83 36.18 2b0f s MET 16 CO 0.09 0.12 1.02 0.99 -0.01 0.00 0.00 175.02 177.23 2b0f s THR 17 N -1.15 4.40 -0.12 2.05 2.01 -1.26 -0.16 115.64 121.41 2b0f s THR 17 Ca -0.05 1.15 -0.13 0.00 0.31 0.00 0.00 61.69 62.97 2b0f s THR 17 Cb -0.09 -4.47 -0.05 0.00 0.01 0.00 0.00 72.50 67.90 2b0f s THR 17 CO 0.01 -0.79 0.30 -0.63 -0.69 0.00 0.00 174.62 172.82 2b0f s ILE 18 N 3.95 5.27 -0.33 1.82 -1.09 0.81 -0.06 121.20 131.57 2b0f s ILE 18 Ca 0.42 0.57 0.04 0.00 -2.23 0.00 0.00 60.65 59.45 2b0f s ILE 18 Cb -0.10 -3.62 0.10 0.00 -1.58 0.00 0.00 42.46 37.26 2b0f s ILE 18 CO 0.25 0.47 0.03 -0.89 -1.23 0.00 0.00 174.94 173.58 2b0f s THR 19 N -0.14 2.20 0.00 2.92 2.01 0.71 0.53 115.64 123.87 2b0f s THR 19 Ca 0.18 -2.22 0.00 0.00 0.31 0.00 0.00 61.69 59.96 2b0f s THR 19 Cb -0.14 -2.59 0.00 0.00 0.01 0.00 0.00 72.50 69.78 2b0f s THR 19 CO 0.06 -0.54 0.00 0.35 -0.69 0.00 0.00 174.62 173.80 2b0f n THR 20 N 4.30 0.00 0.29 -0.82 -2.24 -0.62 -3.28 114.28 111.91 2b0f n THR 20 Ca 0.02 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 61.99 2b0f n THR 20 Cb 0.42 -0.71 1.01 0.00 -2.10 0.00 0.00 70.33 68.95 2b0f n THR 20 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2b0f h SER 21 N 0.00 0.00 0.00 3.42 0.02 -1.62 -3.12 113.55 112.25 2b0f h SER 21 Ca 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2b0f h SER 21 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2b0f h SER 21 CO 0.00 0.00 -0.87 0.29 -1.14 0.00 0.00 176.83 175.11 2b0f n LYS 22 N -2.86 0.50 0.00 3.45 4.01 -1.22 -5.07 118.16 116.97 2b0f n LYS 22 Ca -0.02 0.37 0.00 0.00 -0.51 0.00 0.00 58.31 58.15 2b0f n LYS 22 Cb 0.08 -1.56 0.00 0.00 -0.51 0.00 0.00 35.03 33.04 2b0f n LYS 22 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2b0f n GLY 23 N 1.52 -0.80 3.66 0.72 0.00 -1.18 -5.12 105.19 103.98 2b0f n GLY 23 Ca -0.14 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.78 4.24 0.23 1.61 8.01 -1.25 -1.59 118.70 129.16 2b0f s GLU 24 Ca 0.00 0.95 0.08 0.00 0.01 0.00 0.00 54.97 56.00 2b0f s GLU 24 Cb 0.00 -3.61 -0.05 0.00 -4.31 0.00 0.00 34.13 26.16 2b0f s GLU 24 CO 0.00 -0.41 -0.12 -0.06 0.01 0.00 0.00 175.26 174.68 2b0f s PHE 25 N 2.45 1.82 -0.41 1.61 0.40 0.19 -1.01 117.98 123.03 2b0f s PHE 25 Ca 0.36 -0.60 -0.22 0.00 -0.60 0.00 0.00 56.93 55.87 2b0f s PHE 25 Cb -0.16 -0.91 0.02 0.00 0.51 0.00 0.00 43.02 42.48 2b0f s PHE 25 CO 0.10 0.35 0.73 0.99 0.70 0.00 0.00 175.22 178.09 2b0f s THR 26 N -2.96 4.75 -0.48 0.64 2.01 -1.24 -0.13 115.64 118.23 2b0f s THR 26 Ca 0.25 0.52 -0.24 0.00 0.31 0.00 0.00 61.69 62.53 2b0f s THR 26 Cb 0.00 -4.22 0.03 0.00 0.01 0.00 0.00 72.50 68.32 2b0f s THR 26 CO 0.09 -0.55 0.87 -0.83 -0.69 0.00 0.00 174.62 173.51 2b0f s GLY 27 N 1.97 1.51 -0.71 4.40 0.00 0.77 -4.77 107.32 110.49 2b0f s GLY 27 Ca 0.28 -0.97 -0.22 0.00 0.00 0.00 0.00 44.72 43.80 2b0f s GLY 27 CO 0.19 1.94 1.01 -2.27 0.00 0.00 0.00 173.10 173.97 2b0f s LEU 28 N 3.60 4.38 -0.05 0.66 2.96 -0.89 -2.46 118.68 126.88 2b0f s LEU 28 Ca 0.33 -1.11 -0.30 0.00 -0.22 0.00 0.00 54.13 52.83 2b0f s LEU 28 Cb -0.11 -2.43 -0.05 0.00 0.50 0.00 0.00 46.19 44.10 2b0f s LEU 28 CO 0.23 -1.42 1.41 -0.83 -1.32 0.00 0.00 176.35 174.43 2b0f s GLY 29 N 3.72 1.76 -0.19 7.98 0.00 -0.63 -0.49 107.32 119.47 2b0f s GLY 29 Ca 0.25 0.80 -0.15 0.00 0.00 0.00 0.00 44.72 45.62 2b0f s GLY 29 CO 0.07 2.60 -0.14 1.39 0.00 0.00 0.00 173.10 177.02 2b0f n ILE 30 N 4.96 1.48 -3.67 0.90 2.08 0.66 -4.75 119.36 121.03 2b0f n ILE 30 Ca 0.14 0.05 -0.14 0.00 0.56 0.00 0.00 62.75 63.36 2b0f n ILE 30 Cb 0.44 -2.22 -0.08 0.00 -0.75 0.00 0.00 39.64 37.03 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 -2.46 -0.52 0.00 1.39 -3.43 -1.16 0.12 115.29 109.24 2b0f s HIS 31 Ca -0.25 1.13 0.00 0.00 -0.80 0.00 0.00 55.06 55.14 2b0f s HIS 31 Cb 0.05 0.22 0.00 0.00 -1.43 0.00 0.00 32.58 31.43 2b0f s HIS 31 CO 0.40 -0.37 0.00 -0.40 -2.00 0.00 0.00 174.74 172.37 2b0f n ASP 32 N 2.10 0.00 -0.16 7.38 5.68 -1.08 0.21 116.55 130.68 2b0f n ASP 32 Ca -0.16 0.00 0.01 0.00 -0.50 0.00 0.00 54.79 54.14 2b0f n ASP 32 Cb 0.56 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.56 2b0f n ASP 32 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 2b0f n ARG 33 N 0.00 0.66 -3.26 0.11 1.85 -1.26 -1.40 116.66 113.35 2b0f n ARG 33 Ca 0.00 -1.07 -0.42 0.00 -1.00 0.00 0.00 57.85 55.36 2b0f n ARG 33 Cb 0.00 -0.70 -0.08 0.00 -1.05 0.00 0.00 32.46 30.62 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 -0.51 5.03 0.19 8.89 1.01 0.13 -1.71 120.40 133.43 2b0f s VAL 34 Ca 0.04 0.09 0.11 0.00 0.00 0.00 0.00 61.98 62.22 2b0f s VAL 34 Cb 0.03 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 2b0f s VAL 34 CO 0.00 -0.31 -0.21 0.00 0.00 0.00 0.00 175.10 174.59 2b0f s VAL 36 N -1.65 4.03 -0.02 0.00 1.01 0.35 0.61 120.40 124.73 2b0f s VAL 36 Ca 0.21 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 61.83 2b0f s VAL 36 Cb -0.08 -2.74 0.00 0.00 0.00 0.00 0.00 36.38 33.56 2b0f s VAL 36 CO 0.11 0.53 0.10 -0.51 0.00 0.00 0.00 175.10 175.32 2b0f s ILE 37 N -0.02 0.03 0.73 2.22 2.07 -0.74 -2.10 121.20 123.38 2b0f s ILE 37 Ca 0.02 -0.27 -0.16 0.00 -1.41 0.00 0.00 60.65 58.83 2b0f s ILE 37 Cb -0.13 -0.24 0.03 0.00 0.13 0.00 0.00 42.46 42.24 2b0f s ILE 37 CO 0.02 -0.15 1.15 -2.65 -1.91 0.00 0.00 174.94 171.40 2b0f n PRO 38 N 2.47 0.60 -0.01 3.50 -0.02 -1.26 -0.22 135.00 140.05 2b0f n PRO 38 Ca -0.16 0.27 -0.17 0.00 -2.02 0.00 0.00 63.50 61.41 2b0f n PRO 38 Cb 0.58 -2.39 -0.07 0.00 -0.02 0.00 0.00 33.50 31.60 2b0f n PRO 38 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2b0f h THR 39 N -0.22 1.28 0.00 3.45 2.02 -1.39 -3.09 112.91 114.96 2b0f h THR 39 Ca -0.48 -2.01 0.00 0.00 0.77 0.00 0.00 66.41 64.69 2b0f h THR 39 Cb 1.32 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 69.76 2b0f h THR 39 CO 0.48 0.63 0.00 0.00 0.37 0.00 0.00 175.52 177.01 2b0f n HIS 40 N -3.92 0.00 0.16 3.16 1.44 -1.26 -1.91 115.22 112.89 2b0f n HIS 40 Ca -0.08 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.67 2b0f n HIS 40 Cb 0.76 -0.09 0.17 0.00 0.12 0.00 0.00 29.99 30.95 2b0f n HIS 40 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2b0f h ALA 41 N 2.47 0.81 -4.74 1.59 0.00 -1.92 -3.46 119.26 114.01 2b0f h ALA 41 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2b0f h ALA 41 Cb 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2b0f h ALA 41 CO 0.00 0.56 -0.08 1.04 0.00 0.00 0.00 179.25 180.77 2b0f n GLN 42 N -3.36 -1.15 -2.94 0.00 6.02 -0.80 -3.43 117.38 111.73 2b0f n GLN 42 Ca 0.01 1.34 -0.41 0.00 -0.01 0.00 0.00 57.00 57.93 2b0f n GLN 42 Cb 0.63 -4.64 -0.04 0.00 1.02 0.00 0.00 30.24 27.21 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 -2.83 4.29 0.00 -1.09 0.05 -1.26 -3.63 135.00 130.53 2b0f s PRO 43 Ca 0.04 0.94 0.00 0.00 0.05 0.00 0.00 61.00 62.03 2b0f s PRO 43 Cb -0.01 -3.57 0.00 0.00 0.05 0.00 0.00 34.50 30.97 2b0f s PRO 43 CO 0.56 -0.29 0.00 0.41 0.05 0.00 0.00 177.00 177.73 2b0f n GLY 44 N 3.50 0.93 0.12 0.56 0.00 -1.26 -5.01 105.19 104.03 2b0f n GLY 44 Ca 0.03 -0.50 -0.20 0.00 0.00 0.00 0.00 46.02 45.35 2b0f n GLY 44 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2b0f h ASP 45 N 0.00 0.35 -4.29 1.61 3.58 -1.97 -3.46 116.42 112.25 2b0f h ASP 45 Ca 0.00 -0.87 -0.51 0.00 0.42 0.00 0.00 57.03 56.07 2b0f h ASP 45 Cb 0.00 -0.11 -0.26 0.00 1.72 0.00 0.00 39.33 40.67 2b0f h ASP 45 CO 0.00 1.49 -0.82 1.51 -2.88 0.00 0.00 179.24 178.54 2b0f s ASP 46 N -6.94 1.98 0.17 2.28 1.47 -1.26 -0.60 116.67 113.76 2b0f s ASP 46 Ca -0.18 -0.44 0.10 0.00 1.18 0.00 0.00 52.55 53.20 2b0f s ASP 46 Cb 0.03 -0.16 -0.04 0.00 -0.34 0.00 0.00 42.92 42.40 2b0f s ASP 46 CO 0.77 0.11 -0.21 0.68 0.68 0.00 0.00 175.17 177.20 2b0f s VAL 47 N -0.72 2.05 -0.55 2.11 -7.23 0.95 -4.93 120.40 112.08 2b0f s VAL 47 Ca 0.05 -1.92 -0.20 0.00 -1.81 0.00 0.00 61.98 58.10 2b0f s VAL 47 Cb -0.08 -1.94 0.07 0.00 0.56 0.00 0.00 36.38 34.99 2b0f s VAL 47 CO 0.01 -0.18 0.71 -0.76 -0.31 0.00 0.00 175.10 174.57 2b0f s LEU 48 N -2.56 4.91 -0.82 1.32 1.43 -1.20 -0.93 118.68 120.83 2b0f s LEU 48 Ca 0.17 -0.98 -0.20 0.00 -1.03 0.00 0.00 54.13 52.09 2b0f s LEU 48 Cb -0.07 -2.45 0.11 0.00 0.03 0.00 0.00 46.19 43.80 2b0f s LEU 48 CO 0.08 -1.04 1.05 0.68 0.23 0.00 0.00 176.35 177.35 2b0f s VAL 49 N 2.93 4.60 -0.35 -1.59 -7.23 0.18 -0.20 120.40 118.74 2b0f s VAL 49 Ca 0.17 -1.15 0.00 0.00 -1.81 0.00 0.00 61.98 59.19 2b0f s VAL 49 Cb -0.19 -4.73 0.00 0.00 0.56 0.00 0.00 36.38 32.01 2b0f s VAL 49 CO 0.11 -1.47 0.00 -3.20 -0.31 0.00 0.00 175.10 170.23 2b0f n ASN 50 N 6.92 -4.45 0.00 4.85 2.85 0.91 -2.29 115.26 124.05 2b0f n ASN 50 Ca 0.13 0.08 0.00 0.00 -0.11 0.00 0.00 54.58 54.68 2b0f n ASN 50 Cb 0.47 -2.24 0.00 0.00 1.24 0.00 0.00 39.78 39.26 2b0f n ASN 50 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2b0f n GLY 51 N -1.19 0.49 3.66 8.20 0.00 -1.26 -5.08 105.19 110.02 2b0f n GLY 51 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 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 4.23 -0.35 1.61 0.74 -0.97 -4.90 119.66 120.02 2b0f s GLN 52 Ca 0.00 1.81 -0.25 0.00 0.05 0.00 0.00 55.36 56.97 2b0f s GLN 52 Cb 0.00 -3.78 0.01 0.00 1.10 0.00 0.00 33.01 30.34 2b0f s GLN 52 CO 0.00 -0.71 0.89 -1.59 -0.55 0.00 0.00 175.29 173.33 2b0f s LYS 53 N 3.42 3.86 0.01 1.67 -2.85 -1.26 0.48 119.74 125.07 2b0f s LYS 53 Ca 0.60 0.57 0.06 0.00 -1.00 0.00 0.00 55.97 56.20 2b0f s LYS 53 Cb -0.25 -3.79 -0.02 0.00 -2.06 0.00 0.00 37.83 31.71 2b0f s LYS 53 CO 0.20 -0.88 -0.19 -1.50 0.10 0.00 0.00 175.35 173.07 2b0f s ILE 54 N 3.34 1.53 0.25 3.79 2.07 -0.10 -4.96 121.20 127.12 2b0f s ILE 54 Ca 0.37 -0.94 -0.09 0.00 -1.41 0.00 0.00 60.65 58.57 2b0f s ILE 54 Cb -0.13 -1.30 -0.07 0.00 0.13 0.00 0.00 42.46 41.10 2b0f s ILE 54 CO 0.17 0.33 0.57 -0.60 -1.91 0.00 0.00 174.94 173.51 2b0f s ARG 55 N -0.71 3.78 0.12 3.50 3.52 -1.26 -0.04 118.95 127.86 2b0f s ARG 55 Ca 0.07 0.26 -0.11 0.00 -0.13 0.00 0.00 55.73 55.82 2b0f s ARG 55 Cb -0.08 -2.62 -0.06 0.00 -1.56 0.00 0.00 34.95 30.63 2b0f s ARG 55 CO 0.00 0.27 0.47 0.54 -0.81 0.00 0.00 175.30 175.77 2b0f s VAL 56 N -1.90 4.99 -0.12 7.11 0.11 0.23 -0.29 120.40 130.53 2b0f s VAL 56 Ca 0.47 0.59 -0.11 0.00 -2.93 0.00 0.00 61.98 60.00 2b0f s VAL 56 Cb -0.11 -3.68 -0.26 0.00 -1.53 0.00 0.00 36.38 30.80 2b0f s VAL 56 CO 0.23 0.23 0.41 0.50 -3.33 0.00 0.00 175.10 173.14 2b0f h LYS 57 N 3.52 0.24 -2.00 1.54 1.63 -0.53 -3.43 116.57 117.54 2b0f h LYS 57 Ca -0.49 -0.41 0.02 0.00 -0.85 0.00 0.00 60.65 58.92 2b0f h LYS 57 Cb 1.19 0.15 -0.21 0.00 -0.60 0.00 0.00 32.23 32.76 2b0f h LYS 57 CO 0.67 1.20 0.02 0.34 -3.45 0.00 0.00 179.45 178.22 2b0f s ASP 58 N -7.05 -0.95 -0.27 4.20 -1.08 -1.02 -5.05 116.67 105.45 2b0f s ASP 58 Ca -0.22 1.52 -0.01 0.00 -0.52 0.00 0.00 52.55 53.31 2b0f s ASP 58 Cb 0.06 1.41 0.04 0.00 -1.46 0.00 0.00 42.92 42.97 2b0f s ASP 58 CO 0.75 -0.24 -0.04 -1.59 0.52 0.00 0.00 175.17 174.57 2b0f s LYS 59 N 1.66 2.60 -0.41 4.34 -2.85 -1.26 -1.44 119.74 122.38 2b0f s LYS 59 Ca -0.10 -1.14 -0.11 0.00 -1.00 0.00 0.00 55.97 53.62 2b0f s LYS 59 Cb -0.05 -3.06 0.06 0.00 -2.06 0.00 0.00 37.83 32.72 2b0f s LYS 59 CO -0.20 -0.51 0.26 -0.47 0.10 0.00 0.00 175.35 174.52 2b0f s TYR 60 N 1.27 3.29 0.07 1.78 5.04 -0.28 -4.93 117.35 123.59 2b0f s TYR 60 Ca -0.03 -1.22 -0.31 0.00 -2.44 0.00 0.00 57.07 53.07 2b0f s TYR 60 Cb -0.18 -2.77 -0.08 0.00 0.35 0.00 0.00 41.96 39.28 2b0f s TYR 60 CO -0.03 -0.76 1.54 0.15 -1.34 0.00 0.00 175.55 175.11 2b0f s LYS 61 N 1.51 4.24 -0.56 4.97 1.02 -1.26 0.17 119.74 129.82 2b0f s LYS 61 Ca 0.03 2.20 -0.21 0.00 0.02 0.00 0.00 55.97 58.01 2b0f s LYS 61 Cb -0.22 -3.49 0.06 0.00 -0.52 0.00 0.00 37.83 33.66 2b0f s LYS 61 CO 0.05 -0.64 0.81 -0.51 -0.92 0.00 0.00 175.35 174.13 2b0f s LEU 62 N 2.21 4.61 -0.07 3.17 1.43 0.70 -4.90 118.68 125.83 2b0f s LEU 62 Ca 0.70 -0.80 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 2b0f s LEU 62 Cb -0.38 -2.55 -0.03 0.00 0.03 0.00 0.00 46.19 43.26 2b0f s LEU 62 CO 0.30 -1.14 0.01 0.68 0.23 0.00 0.00 176.35 176.43 2b0f s VAL 63 N 3.36 4.31 0.20 -1.59 -7.23 -1.26 -2.46 120.40 115.74 2b0f s VAL 63 Ca 0.21 -0.31 -0.30 0.00 -1.81 0.00 0.00 61.98 59.77 2b0f s VAL 63 Cb -0.17 -2.84 -0.08 0.00 0.56 0.00 0.00 36.38 33.85 2b0f s VAL 63 CO 0.13 0.55 1.18 -0.62 -0.31 0.00 0.00 175.10 176.04 2b0f s ASP 64 N -1.04 7.11 0.00 4.85 -1.08 0.19 -4.77 116.67 121.92 2b0f s ASP 64 Ca 0.15 2.24 0.00 0.00 -0.52 0.00 0.00 52.55 54.42 2b0f s ASP 64 Cb -0.11 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.74 2b0f s ASP 64 CO 0.04 -0.34 0.72 -2.65 0.52 0.00 0.00 175.17 173.47 2b0f n PRO 65 N 2.27 0.00 -0.01 4.34 -0.02 -1.26 0.15 135.00 140.47 2b0f n PRO 65 Ca 0.03 0.26 0.11 0.00 -2.02 0.00 0.00 63.50 61.88 2b0f n PRO 65 Cb 0.45 -1.65 0.61 0.00 -0.02 0.00 0.00 33.50 32.88 2b0f n PRO 65 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2b0f n GLU 66 N -1.22 1.11 -1.69 -0.52 2.13 -1.26 -4.86 120.64 114.33 2b0f n GLU 66 Ca 0.00 -0.17 -0.07 0.00 0.66 0.00 0.00 57.16 57.58 2b0f n GLU 66 Cb 0.15 -1.35 -0.02 0.00 0.27 0.00 0.00 31.44 30.50 2b0f n GLU 66 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2b0f n ASN 67 N -0.66 -3.19 -4.45 4.31 4.13 0.39 -5.04 115.26 110.73 2b0f n ASN 67 Ca 0.16 0.08 -0.28 0.00 1.68 0.00 0.00 54.58 56.22 2b0f n ASN 67 Cb 0.12 -1.94 -0.12 0.00 -1.54 0.00 0.00 39.78 36.30 2b0f n ASN 67 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2b0f s ILE 68 N -2.30 2.58 0.26 2.41 -1.09 -1.10 -4.95 121.20 117.01 2b0f s ILE 68 Ca 0.00 -1.80 -0.30 0.00 -2.23 0.00 0.00 60.65 56.32 2b0f s ILE 68 Cb 0.00 -2.21 -0.10 0.00 -1.58 0.00 0.00 42.46 38.56 2b0f s ILE 68 CO 0.00 -0.03 1.49 0.21 -1.23 0.00 0.00 174.94 175.39 2b0f s ASN 69 N -2.46 6.56 -0.06 3.58 2.47 -1.22 0.53 114.94 124.35 2b0f s ASN 69 Ca 0.19 2.75 0.18 0.00 0.42 0.00 0.00 52.86 56.41 2b0f s ASN 69 Cb -0.09 -2.63 -0.27 0.00 -1.45 0.00 0.00 41.25 36.81 2b0f s ASN 69 CO 0.10 -0.77 0.33 -0.11 -3.72 0.00 0.00 177.10 172.93 2b0f n LEU 70 N 2.35 0.00 -0.21 3.21 7.94 -1.04 -2.87 117.00 126.38 2b0f n LEU 70 Ca 0.07 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.95 2b0f n LEU 70 Cb 0.39 0.09 -0.01 0.00 0.53 0.00 0.00 43.42 44.42 2b0f n LEU 70 CO 0.62 0.09 -0.03 1.21 -1.11 0.00 0.00 177.39 178.17 2b0f n GLU 71 N -2.25 -0.73 -4.14 1.96 4.07 -1.03 -4.93 120.64 113.60 2b0f n GLU 71 Ca -0.09 0.39 -0.23 0.00 -0.06 0.00 0.00 57.16 57.18 2b0f n GLU 71 Cb 0.61 -4.08 -0.05 0.00 -0.06 0.00 0.00 31.44 27.86 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 -0.63 3.72 -0.07 4.31 1.02 -1.19 -1.15 118.68 124.69 2b0f s LEU 72 Ca 0.00 -0.28 -0.01 0.00 0.02 0.00 0.00 54.13 53.85 2b0f s LEU 72 Cb 0.00 -2.27 0.03 0.00 0.02 0.00 0.00 46.19 43.97 2b0f s LEU 72 CO 0.00 -0.01 0.00 -0.89 0.02 0.00 0.00 176.35 175.47 2b0f s THR 73 N -2.08 0.34 -0.66 5.49 2.01 0.69 0.25 115.64 121.69 2b0f s THR 73 Ca 0.32 0.13 -0.27 0.00 0.31 0.00 0.00 61.69 62.18 2b0f s THR 73 Cb -0.08 -0.50 0.03 0.00 0.01 0.00 0.00 72.50 71.96 2b0f s THR 73 CO 0.24 0.25 1.30 -0.69 -0.69 0.00 0.00 174.62 175.03 2b0f s VAL 74 N 1.90 3.80 -0.68 3.82 1.01 0.13 -1.79 120.40 128.60 2b0f s VAL 74 Ca 0.04 0.58 -0.19 0.00 0.00 0.00 0.00 61.98 62.41 2b0f s VAL 74 Cb -0.12 -4.75 0.11 0.00 0.00 0.00 0.00 36.38 31.61 2b0f s VAL 74 CO -0.05 -1.57 0.82 -0.22 0.00 0.00 0.00 175.10 174.09 2b0f s LEU 75 N 5.70 5.26 -0.89 3.92 2.96 0.20 -1.12 118.68 134.71 2b0f s LEU 75 Ca 0.41 -1.54 -0.18 0.00 -0.22 0.00 0.00 54.13 52.60 2b0f s LEU 75 Cb -0.08 -2.33 0.15 0.00 0.50 0.00 0.00 46.19 44.42 2b0f s LEU 75 CO 0.20 -1.13 1.02 -0.89 -1.32 0.00 0.00 176.35 174.23 2b0f s THR 76 N 2.75 4.93 0.55 3.68 2.01 -0.52 -0.72 115.64 128.31 2b0f s THR 76 Ca 0.17 -1.73 -0.18 0.00 0.31 0.00 0.00 61.69 60.26 2b0f s THR 76 Cb -0.19 -4.69 -0.06 0.00 0.01 0.00 0.00 72.50 67.57 2b0f s THR 76 CO 0.03 -1.38 1.05 -0.76 -0.69 0.00 0.00 174.62 172.88 2b0f s LEU 77 N 2.13 3.65 -1.31 4.42 1.02 -0.69 0.16 118.68 128.05 2b0f s LEU 77 Ca 0.28 1.89 -0.14 0.00 0.02 0.00 0.00 54.13 56.18 2b0f s LEU 77 Cb -0.07 -4.55 0.11 0.00 0.02 0.00 0.00 46.19 41.70 2b0f s LEU 77 CO -0.08 -1.02 1.81 -0.67 0.02 0.00 0.00 176.35 176.42 2b0f n ASP 78 N -1.56 4.78 -4.53 2.29 -0.08 0.60 -4.55 116.55 113.51 2b0f n ASP 78 Ca 0.09 -2.96 -0.34 0.00 -1.51 0.00 0.00 54.79 50.07 2b0f n ASP 78 Cb 0.53 -1.63 -0.11 0.00 2.34 0.00 0.00 41.12 42.24 2b0f n ASP 78 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 2b0f s ARG 79 N 2.51 3.77 0.09 -0.67 6.06 -1.26 -4.69 118.95 124.75 2b0f s ARG 79 Ca 0.47 -0.46 0.26 0.00 -2.50 0.00 0.00 55.73 53.50 2b0f s ARG 79 Cb 0.06 -3.08 0.65 0.00 0.06 0.00 0.00 34.95 32.64 2b0f s ARG 79 CO 0.00 0.18 1.55 0.27 -2.50 0.00 0.00 175.30 174.81 2b0f n ASN 80 N 3.76 0.54 -4.60 -2.12 6.94 -1.26 -4.71 115.26 113.81 2b0f n ASN 80 Ca -0.17 0.19 -0.41 0.00 -0.02 0.00 0.00 54.58 54.18 2b0f n ASN 80 Cb 0.52 -0.13 -0.07 0.00 -2.36 0.00 0.00 39.78 37.74 2b0f n ASN 80 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2b0f s GLU 81 N -3.08 3.93 -0.41 -3.83 2.02 -1.26 -5.03 118.70 111.04 2b0f s GLU 81 Ca 0.10 0.31 -0.19 0.00 0.02 0.00 0.00 54.97 55.21 2b0f s GLU 81 Cb 0.15 -3.71 0.02 0.00 0.10 0.00 0.00 34.13 30.68 2b0f s GLU 81 CO 0.65 -0.53 0.56 0.15 0.02 0.00 0.00 175.26 176.11 2b0f s LYS 82 N 2.56 3.32 0.69 1.61 1.02 -1.26 -4.63 119.74 123.06 2b0f s LYS 82 Ca 0.25 -0.41 -0.10 0.00 0.02 0.00 0.00 55.97 55.73 2b0f s LYS 82 Cb -0.15 -3.92 0.03 0.00 -0.52 0.00 0.00 37.83 33.27 2b0f s LYS 82 CO 0.11 -0.88 1.05 -0.59 -0.92 0.00 0.00 175.35 174.13 2b0f s PHE 83 N 2.54 3.22 0.00 3.18 -0.12 -0.49 -4.81 117.98 121.49 2b0f s PHE 83 Ca 0.19 0.85 -0.36 0.00 -0.05 0.00 0.00 56.93 57.56 2b0f s PHE 83 Cb -0.15 -3.06 -0.15 0.00 -0.63 0.00 0.00 43.02 39.02 2b0f s PHE 83 CO 0.16 -1.20 1.56 -2.13 -0.05 0.00 0.00 175.22 173.56 2b0f n ARG 84 N -2.94 1.55 -2.62 1.99 0.63 -1.26 -2.64 116.66 111.36 2b0f n ARG 84 Ca 0.07 0.56 -0.41 0.00 -0.92 0.00 0.00 57.85 57.14 2b0f n ARG 84 Cb 0.58 -2.27 -0.03 0.00 0.45 0.00 0.00 32.46 31.19 2b0f n ARG 84 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 2b0f s ASP 85 N 1.75 6.21 -0.15 6.15 -4.77 -1.26 -4.37 116.67 120.24 2b0f s ASP 85 Ca 0.87 -0.69 0.07 0.00 -3.30 0.00 0.00 52.55 49.50 2b0f s ASP 85 Cb -0.87 -2.53 0.45 0.00 -1.09 0.00 0.00 42.92 38.88 2b0f s ASP 85 CO 0.49 -1.71 1.23 2.30 0.70 0.00 0.00 175.17 178.18 2b0f n ILE 86 N 6.32 1.61 -0.11 2.11 -5.35 0.12 -4.44 119.36 119.63 2b0f n ILE 86 Ca 0.05 -0.81 0.14 0.00 -0.27 0.00 0.00 62.75 61.87 2b0f n ILE 86 Cb 0.49 -0.41 0.53 0.00 -1.74 0.00 0.00 39.64 38.50 2b0f n ILE 86 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 2b0f h ARG 87 N 2.04 0.35 -0.00 6.28 2.43 -1.87 -0.09 114.38 123.52 2b0f h ARG 87 Ca 0.04 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2b0f h ARG 87 Cb 1.41 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.88 2b0f h ARG 87 CO 0.31 0.23 -0.04 0.41 -1.51 0.00 0.00 179.97 179.37 2b0f n GLY 88 N -1.54 -1.34 0.88 2.80 0.00 -1.26 -3.07 105.19 101.66 2b0f n GLY 88 Ca 0.12 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.11 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 -1.36 0.17 -2.54 1.61 3.72 -0.05 -4.90 117.46 114.12 2b0f n PHE 89 Ca 0.11 -0.09 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 2b0f n PHE 89 Cb 0.29 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.80 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 -1.83 4.24 -0.52 4.37 -1.09 -1.18 -0.02 121.20 125.18 2b0f s ILE 90 Ca 0.33 1.70 -0.20 0.00 -2.23 0.00 0.00 60.65 60.25 2b0f s ILE 90 Cb 0.21 -4.09 0.06 0.00 -1.58 0.00 0.00 42.46 37.06 2b0f s ILE 90 CO 0.31 0.18 0.67 -0.94 -1.23 0.00 0.00 174.94 173.93 2b0f s SER 91 N 0.66 6.23 0.05 3.58 1.04 -1.17 -4.62 113.70 119.48 2b0f s SER 91 Ca 0.54 -0.88 -0.28 0.00 0.48 0.00 0.00 55.95 55.80 2b0f s SER 91 Cb -0.27 -2.31 -0.17 0.00 0.10 0.00 0.00 66.02 63.37 2b0f s SER 91 CO 0.30 -0.95 1.51 -0.08 0.98 0.00 0.00 173.24 175.00 2b0f h GLU 92 N 9.05 -0.55 -5.55 4.02 4.22 -1.89 -3.29 114.58 120.58 2b0f h GLU 92 Ca -0.27 0.04 -0.65 0.00 0.08 0.00 0.00 59.36 58.56 2b0f h GLU 92 Cb 1.09 0.13 -0.13 0.00 0.50 0.00 0.00 28.75 30.34 2b0f h GLU 92 CO 0.99 -0.31 -0.55 0.34 -2.18 0.00 0.00 179.01 177.30 2b0f s ASP 93 N -4.77 5.75 0.06 1.04 2.15 -1.26 -4.52 116.67 115.12 2b0f s ASP 93 Ca -0.16 0.21 -0.30 0.00 0.43 0.00 0.00 52.55 52.73 2b0f s ASP 93 Cb 0.03 -1.87 -0.18 0.00 -0.30 0.00 0.00 42.92 40.60 2b0f s ASP 93 CO 0.60 0.29 1.58 -0.07 -0.17 0.00 0.00 175.17 177.40 2b0f h LEU 94 N 5.84 -0.60 -3.39 -1.34 3.38 -1.98 -3.47 115.31 113.75 2b0f h LEU 94 Ca -0.45 -0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.11 2b0f h LEU 94 Cb 1.19 0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.10 2b0f h LEU 94 CO 0.63 -0.39 -0.95 -1.84 0.09 0.00 0.00 178.44 175.99 2b0f n GLU 95 N -5.37 -1.34 0.00 1.13 0.28 -1.26 -4.90 120.64 109.17 2b0f n GLU 95 Ca -0.12 0.72 0.00 0.00 -0.16 0.00 0.00 57.16 57.60 2b0f n GLU 95 Cb 0.30 -1.80 0.00 0.00 1.43 0.00 0.00 31.44 31.37 2b0f n GLU 95 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2b0f n GLY 96 N -1.22 0.94 0.83 -1.84 0.00 -1.26 -5.02 105.19 97.61 2b0f n GLY 96 Ca -0.24 0.49 0.07 0.00 0.00 0.00 0.00 46.02 46.35 2b0f n GLY 96 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2b0f n VAL 97 N 0.00 0.60 -3.88 1.61 3.14 -1.26 -4.69 118.33 113.84 2b0f n VAL 97 Ca 0.00 -0.60 -0.35 0.00 -2.96 0.00 0.00 64.34 60.43 2b0f n VAL 97 Cb 0.00 0.30 -0.14 0.00 -1.06 0.00 0.00 33.84 32.94 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 -1.00 4.48 0.01 6.55 2.15 -1.26 -1.57 116.67 126.03 2b0f s ASP 98 Ca 0.30 -0.52 -0.09 0.00 0.43 0.00 0.00 52.55 52.67 2b0f s ASP 98 Cb 0.16 -1.76 0.01 0.00 -0.30 0.00 0.00 42.92 41.02 2b0f s ASP 98 CO 0.20 -0.07 0.18 0.00 -0.17 0.00 0.00 175.17 175.32 2b0f s ALA 99 N 1.46 -0.41 -0.05 3.66 0.00 -0.87 -4.56 121.76 121.01 2b0f s ALA 99 Ca 0.04 -0.11 0.06 0.00 0.00 0.00 0.00 51.96 51.95 2b0f s ALA 99 Cb -0.15 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.12 2b0f s ALA 99 CO -0.02 -0.27 -0.23 0.99 0.00 0.00 0.00 175.76 176.24 2b0f s THR 100 N -1.76 1.84 -0.52 0.00 2.01 0.05 -2.98 115.64 114.29 2b0f s THR 100 Ca -0.11 -0.96 -0.20 0.00 0.31 0.00 0.00 61.69 60.73 2b0f s THR 100 Cb -0.05 -1.56 0.06 0.00 0.01 0.00 0.00 72.50 70.95 2b0f s THR 100 CO 0.00 0.52 0.68 -0.22 -0.69 0.00 0.00 174.62 174.91 2b0f s LEU 101 N -0.16 4.83 -0.68 4.42 2.96 0.81 -1.32 118.68 129.55 2b0f s LEU 101 Ca -0.02 -0.83 -0.27 0.00 -0.22 0.00 0.00 54.13 52.79 2b0f s LEU 101 Cb -0.12 -2.51 0.03 0.00 0.50 0.00 0.00 46.19 44.09 2b0f s LEU 101 CO 0.03 -0.95 1.23 -0.69 -1.32 0.00 0.00 176.35 174.65 2b0f s VAL 102 N 2.85 3.85 -0.48 1.68 1.01 0.56 -0.10 120.40 129.77 2b0f s VAL 102 Ca 0.18 0.55 -0.22 0.00 0.00 0.00 0.00 61.98 62.48 2b0f s VAL 102 Cb -0.18 -4.84 0.03 0.00 0.00 0.00 0.00 36.38 31.39 2b0f s VAL 102 CO 0.13 -1.66 0.78 -0.69 0.00 0.00 0.00 175.10 173.66 2b0f s VAL 103 N 5.39 4.65 -0.26 2.92 1.01 0.04 -1.05 120.40 133.09 2b0f s VAL 103 Ca 0.37 0.20 0.15 0.00 0.00 0.00 0.00 61.98 62.70 2b0f s VAL 103 Cb -0.08 -4.35 0.48 0.00 0.00 0.00 0.00 36.38 32.42 2b0f s VAL 103 CO 0.18 -0.81 1.15 1.57 0.00 0.00 0.00 175.10 177.19 2b0f n HIS 104 N 6.75 1.88 -2.56 5.22 -0.00 -1.14 -1.64 115.22 123.72 2b0f n HIS 104 Ca 0.00 -2.10 0.00 0.00 -0.00 0.00 0.00 57.72 55.62 2b0f n HIS 104 Cb 0.47 -0.28 0.00 0.00 -0.00 0.00 0.00 29.99 30.18 2b0f n HIS 104 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2b0f n SER 105 N -0.63 0.89 0.19 0.26 3.41 -0.36 -3.69 113.62 113.68 2b0f n SER 105 Ca 0.25 -0.12 0.14 0.00 -0.26 0.00 0.00 58.87 58.88 2b0f n SER 105 Cb 0.89 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 65.31 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 0.00 0.00 4.04 7.08 -1.08 -3.35 115.58 122.27 2b0f h ASN 106 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2b0f h ASN 106 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 2b0f h ASN 106 CO 0.00 0.00 0.00 -3.20 -2.08 0.00 0.00 177.43 172.15 2b0f n ASN 107 N -2.66 0.00 -4.43 6.14 4.05 -0.63 -4.94 115.26 112.80 2b0f n ASN 107 Ca 0.03 0.21 -0.30 0.00 0.45 0.00 0.00 54.58 54.97 2b0f n ASN 107 Cb 0.35 -0.17 -0.13 0.00 1.23 0.00 0.00 39.78 41.06 2b0f n ASN 107 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 2b0f s PHE 108 N -0.46 2.44 -0.11 1.20 0.08 -1.25 -5.06 117.98 114.80 2b0f s PHE 108 Ca 0.00 -0.32 0.02 0.00 0.12 0.00 0.00 56.93 56.74 2b0f s PHE 108 Cb 0.00 -1.35 0.01 0.00 -0.57 0.00 0.00 43.02 41.11 2b0f s PHE 108 CO 0.00 0.29 -0.16 0.99 -0.10 0.00 0.00 175.22 176.25 2b0f s THR 109 N -1.01 1.56 0.00 0.64 2.01 -1.23 -1.22 115.64 116.40 2b0f s THR 109 Ca 0.15 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.47 2b0f s THR 109 Cb -0.10 -1.43 0.00 0.00 0.01 0.00 0.00 72.50 70.98 2b0f s THR 109 CO 0.06 0.45 0.00 -3.20 -0.69 0.00 0.00 174.62 171.25 2b0f n ASN 110 N 4.23 0.00 -4.61 3.53 2.85 -0.65 -4.94 115.26 115.66 2b0f n ASN 110 Ca -0.19 0.00 -0.40 0.00 -0.11 0.00 0.00 54.58 53.88 2b0f n ASN 110 Cb 0.51 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.45 2b0f n ASN 110 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2b0f s THR 111 N -3.71 5.07 -0.19 -0.44 2.01 -1.03 -4.94 115.64 112.41 2b0f s THR 111 Ca 0.00 0.80 -0.15 0.00 0.31 0.00 0.00 61.69 62.65 2b0f s THR 111 Cb 0.00 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.63 2b0f s THR 111 CO 0.00 0.05 0.35 0.27 -0.69 0.00 0.00 174.62 174.60 2b0f s ILE 112 N 2.31 5.24 -0.31 1.82 -4.36 -1.26 -0.78 121.20 123.85 2b0f s ILE 112 Ca 0.21 0.63 -0.04 0.00 -0.26 0.00 0.00 60.65 61.18 2b0f s ILE 112 Cb -0.16 -3.69 0.04 0.00 1.25 0.00 0.00 42.46 39.91 2b0f s ILE 112 CO 0.10 0.30 0.05 -0.76 0.24 0.00 0.00 174.94 174.86 2b0f s LEU 113 N 1.05 4.05 -0.05 0.37 1.43 0.86 -4.95 118.68 121.45 2b0f s LEU 113 Ca 0.18 -1.16 -0.30 0.00 -1.03 0.00 0.00 54.13 51.82 2b0f s LEU 113 Cb -0.14 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.24 2b0f s LEU 113 CO 0.07 -0.28 1.50 -1.61 0.23 0.00 0.00 176.35 176.26 2b0f s GLU 114 N 1.34 4.23 -0.19 1.70 2.02 -1.26 -0.13 118.70 126.40 2b0f s GLU 114 Ca -0.03 2.03 0.13 0.00 0.02 0.00 0.00 54.97 57.12 2b0f s GLU 114 Cb -0.19 -3.78 -0.23 0.00 0.10 0.00 0.00 34.13 30.03 2b0f s GLU 114 CO 0.01 -0.72 0.07 1.33 0.02 0.00 0.00 175.26 175.97 2b0f n VAL 115 N 5.13 1.45 0.00 2.63 0.24 -1.17 -4.91 118.33 121.70 2b0f n VAL 115 Ca 0.15 -0.77 0.00 0.00 -2.04 0.00 0.00 64.34 61.68 2b0f n VAL 115 Cb 0.43 -0.80 0.00 0.00 -1.47 0.00 0.00 33.84 32.00 2b0f n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2b0f n GLY 116 N 1.86 1.17 3.71 7.63 0.00 -1.16 -4.95 105.19 113.44 2b0f n GLY 116 Ca -0.34 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 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 4.44 -0.31 1.61 0.04 -1.23 -2.05 135.00 137.51 2b0f s PRO 117 Ca 0.00 1.04 -0.07 0.00 0.04 0.00 0.00 61.00 62.02 2b0f s PRO 117 Cb 0.00 -3.47 0.02 0.00 0.04 0.00 0.00 34.50 31.08 2b0f s PRO 117 CO 0.00 -0.04 0.08 0.54 0.04 0.00 0.00 177.00 177.63 2b0f s VAL 118 N 1.10 3.89 0.19 -0.36 0.11 -0.61 -4.61 120.40 120.12 2b0f s VAL 118 Ca 0.41 -0.81 0.03 0.00 -2.93 0.00 0.00 61.98 58.68 2b0f s VAL 118 Cb -0.18 -3.06 -0.05 0.00 -1.53 0.00 0.00 36.38 31.56 2b0f s VAL 118 CO 0.20 0.02 -0.03 0.42 -3.33 0.00 0.00 175.10 172.37 2b0f s THR 119 N 1.47 0.99 0.14 5.04 -4.23 -1.09 -4.55 115.64 113.41 2b0f s THR 119 Ca 0.01 -2.03 0.04 0.00 -1.18 0.00 0.00 61.69 58.54 2b0f s THR 119 Cb -0.18 -2.15 -0.04 0.00 1.34 0.00 0.00 72.50 71.47 2b0f s THR 119 CO 0.02 -0.48 0.16 0.00 -0.54 0.00 0.00 174.62 173.79 2b0f s MET 120 N -3.84 3.04 0.00 3.99 0.23 -1.26 0.13 119.30 121.58 2b0f s MET 120 Ca 0.24 -0.76 0.02 0.00 -1.03 0.00 0.00 55.69 54.16 2b0f s MET 120 Cb 0.05 -2.75 0.01 0.00 -1.53 0.00 0.00 34.83 30.62 2b0f s MET 120 CO 0.05 0.51 0.56 0.00 -2.03 0.00 0.00 175.02 174.12 2b0f n ALA 121 N -0.23 2.49 0.00 3.16 0.00 0.12 -4.70 120.51 121.35 2b0f n ALA 121 Ca -0.08 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.84 2b0f n ALA 121 Cb 0.54 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 0.10 1.96 3.17 0.00 0.00 -1.23 -4.74 105.19 104.45 2b0f n GLY 122 Ca 0.01 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 2b0f n GLY 122 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b0f s LEU 123 N 0.00 2.03 0.36 0.99 0.20 -1.26 -1.58 118.68 119.42 2b0f s LEU 123 Ca 0.00 -0.55 0.06 0.00 0.69 0.00 0.00 54.13 54.34 2b0f s LEU 123 Cb 0.00 -1.35 -0.03 0.00 -0.43 0.00 0.00 46.19 44.38 2b0f s LEU 123 CO 0.00 0.10 0.24 0.27 -0.29 0.00 0.00 176.35 176.67 2b0f s ILE 124 N 0.65 0.16 -1.04 6.68 -4.36 -0.59 -4.95 121.20 117.75 2b0f s ILE 124 Ca -0.12 -2.00 -0.13 0.00 -0.26 0.00 0.00 60.65 58.14 2b0f s ILE 124 Cb -0.16 -2.43 0.22 0.00 1.25 0.00 0.00 42.46 41.33 2b0f s ILE 124 CO 0.03 0.00 1.11 0.20 0.24 0.00 0.00 174.94 176.52 2b0f s ASN 125 N -3.46 7.02 -0.40 4.36 -0.87 -1.26 -0.80 114.94 119.54 2b0f s ASN 125 Ca 0.35 -3.00 -0.27 0.00 -1.57 0.00 0.00 52.86 48.37 2b0f s ASN 125 Cb 0.02 -2.29 -0.03 0.00 -0.02 0.00 0.00 41.25 38.93 2b0f s ASN 125 CO 0.24 -0.59 2.00 -0.22 -2.57 0.00 0.00 177.10 175.96 2b0f s LEU 126 N 0.39 3.43 -1.47 0.60 2.96 0.54 -1.82 118.68 123.30 2b0f s LEU 126 Ca 0.31 1.15 -0.02 0.00 -0.22 0.00 0.00 54.13 55.35 2b0f s LEU 126 Cb -0.07 -3.10 0.00 0.00 0.50 0.00 0.00 46.19 43.51 2b0f s LEU 126 CO -0.06 -2.12 0.28 -1.20 -1.32 0.00 0.00 176.35 171.92 2b0f n SER 127 N 12.15 -5.47 0.00 3.68 7.64 -1.26 -1.03 113.62 129.32 2b0f n SER 127 Ca 0.26 -0.14 0.00 0.00 1.01 0.00 0.00 58.87 60.00 2b0f n SER 127 Cb 0.49 -4.42 0.00 0.00 -1.01 0.00 0.00 64.21 59.27 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 -1.76 0.00 -4.63 6.43 7.64 -0.76 -5.00 113.62 115.54 2b0f n SER 128 Ca -0.16 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.32 2b0f n SER 128 Cb 0.64 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.77 2b0f n SER 128 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2b0f s THR 129 N -2.83 5.06 -0.13 0.44 2.01 -0.20 -4.90 115.64 115.09 2b0f s THR 129 Ca 0.00 0.96 -0.30 0.00 0.31 0.00 0.00 61.69 62.66 2b0f s THR 129 Cb 0.00 -3.86 -0.08 0.00 0.01 0.00 0.00 72.50 68.57 2b0f s THR 129 CO 0.00 0.09 2.10 -2.65 -0.69 0.00 0.00 174.62 173.47 2b0f n PRO 130 N 5.41 2.19 -4.23 4.92 -0.02 -1.26 -0.34 135.00 141.67 2b0f n PRO 130 Ca -0.03 0.71 -0.19 0.00 -2.02 0.00 0.00 63.50 61.97 2b0f n PRO 130 Cb 0.50 -3.01 -0.15 0.00 -0.02 0.00 0.00 33.50 30.81 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 6.43 0.56 0.42 3.45 2.01 0.02 -3.46 115.64 125.07 2b0f s THR 131 Ca 0.97 -0.22 0.03 0.00 0.31 0.00 0.00 61.69 62.77 2b0f s THR 131 Cb -0.47 -0.53 0.03 0.00 0.01 0.00 0.00 72.50 71.54 2b0f s THR 131 CO 0.41 0.19 0.21 -0.46 -0.69 0.00 0.00 174.62 174.28 2b0f n ASN 132 N 3.46 2.64 -1.52 3.53 0.23 -1.14 -1.55 115.26 120.92 2b0f n ASN 132 Ca -0.19 -2.58 -0.15 0.00 -0.53 0.00 0.00 54.58 51.12 2b0f n ASN 132 Cb 0.54 0.08 -0.02 0.00 -2.08 0.00 0.00 39.78 38.30 2b0f n ASN 132 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2b0f n ARG 133 N -1.33 -1.14 -2.72 -3.83 3.00 -0.61 -4.79 116.66 105.24 2b0f n ARG 133 Ca -0.07 0.81 -0.42 0.00 -0.01 0.00 0.00 57.85 58.16 2b0f n ARG 133 Cb 0.50 -5.08 -0.03 0.00 0.00 0.00 0.00 32.46 27.85 2b0f n ARG 133 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.63 179.04 2b0f s MET 134 N -4.29 4.46 -0.05 5.56 1.75 -0.90 -0.66 119.30 125.18 2b0f s MET 134 Ca 0.00 1.36 -0.17 0.00 -1.25 0.00 0.00 55.69 55.64 2b0f s MET 134 Cb 0.00 -3.51 -0.05 0.00 2.84 0.00 0.00 34.83 34.10 2b0f s MET 134 CO 0.00 -0.22 0.45 0.42 -0.65 0.00 0.00 175.02 175.02 2b0f s ILE 135 N 1.66 5.07 -0.11 10.11 1.01 0.37 0.13 121.20 139.44 2b0f s ILE 135 Ca 0.49 0.92 0.02 0.00 0.00 0.00 0.00 60.65 62.08 2b0f s ILE 135 Cb -0.19 -3.77 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 2b0f s ILE 135 CO 0.21 0.47 -0.19 -0.60 0.00 0.00 0.00 174.94 174.82 2b0f s ARG 136 N -0.32 3.12 -0.17 2.79 3.52 0.34 -1.97 118.95 126.26 2b0f s ARG 136 Ca 0.25 -0.79 -0.04 0.00 -0.13 0.00 0.00 55.73 55.01 2b0f s ARG 136 Cb -0.16 -2.43 0.07 0.00 -1.56 0.00 0.00 34.95 30.87 2b0f s ARG 136 CO 0.12 0.24 0.16 1.52 -0.81 0.00 0.00 175.30 176.53 2b0f s TYR 137 N 0.24 -0.09 -0.44 5.12 1.13 -1.01 -2.66 117.35 119.65 2b0f s TYR 137 Ca -0.13 0.11 -0.28 0.00 -1.41 0.00 0.00 57.07 55.36 2b0f s TYR 137 Cb -0.16 -0.46 -0.02 0.00 -1.10 0.00 0.00 41.96 40.21 2b0f s TYR 137 CO 0.07 -0.50 1.86 0.34 -2.51 0.00 0.00 175.55 174.81 2b0f s ASP 138 N 2.25 5.58 -0.28 -0.18 -1.08 -1.26 -1.13 116.67 120.56 2b0f s ASP 138 Ca 0.04 0.95 -0.21 0.00 -0.52 0.00 0.00 52.55 52.81 2b0f s ASP 138 Cb -0.15 -2.53 0.13 0.00 -1.46 0.00 0.00 42.92 38.91 2b0f s ASP 138 CO -0.10 -2.02 0.97 -0.47 0.52 0.00 0.00 175.17 174.07 2b0f s TYR 139 N 8.02 -0.57 -0.50 -5.34 5.04 0.60 -4.96 117.35 119.64 2b0f s TYR 139 Ca 0.76 1.26 -0.27 0.00 -2.44 0.00 0.00 57.07 56.38 2b0f s TYR 139 Cb -0.19 0.38 -0.03 0.00 0.35 0.00 0.00 41.96 42.47 2b0f s TYR 139 CO 0.29 -0.28 1.99 0.00 -1.34 0.00 0.00 175.55 176.21 2b0f s ALA 140 N 0.77 2.23 0.01 3.97 0.00 -1.24 -3.89 121.76 123.61 2b0f s ALA 140 Ca -0.03 -0.23 -0.00 0.00 0.00 0.00 0.00 51.96 51.70 2b0f s ALA 140 Cb -0.04 -4.24 -0.01 0.00 0.00 0.00 0.00 23.12 18.82 2b0f s ALA 140 CO -0.10 -3.69 -0.01 -0.08 0.00 0.00 0.00 175.76 171.87 2b0f s THR 141 N 9.27 0.08 0.31 0.00 -1.32 -1.26 -5.08 115.64 117.64 2b0f s THR 141 Ca 0.78 -0.64 0.06 0.00 -1.21 0.00 0.00 61.69 60.69 2b0f s THR 141 Cb -0.17 -0.20 -0.02 0.00 -1.51 0.00 0.00 72.50 70.60 2b0f s THR 141 CO 0.25 -0.35 0.30 0.29 -2.21 0.00 0.00 174.62 172.91 2b0f n LYS 142 N 2.03 0.43 -1.10 7.08 5.02 -1.26 -4.80 118.16 125.56 2b0f n LYS 142 Ca -0.20 -3.04 -0.34 0.00 -2.02 0.00 0.00 58.31 52.70 2b0f n LYS 142 Cb 0.56 2.56 0.01 0.00 -0.02 0.00 0.00 35.03 38.15 2b0f n LYS 142 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2b0f n THR 143 N -0.59 0.00 0.00 -0.18 -1.04 -1.26 -2.62 114.28 108.60 2b0f n THR 143 Ca 0.06 -0.44 0.00 0.00 -2.04 0.00 0.00 64.05 61.63 2b0f n THR 143 Cb 0.56 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.07 2b0f n THR 143 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2b0f n GLY 144 N 2.22 3.00 0.52 3.41 0.00 -1.26 -4.82 105.19 108.26 2b0f n GLY 144 Ca 0.07 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.13 2b0f n GLY 144 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2b0f n GLN 145 N -0.33 1.66 -1.92 1.61 7.27 -1.08 -1.61 117.38 122.99 2b0f n GLN 145 Ca 0.00 -0.97 -0.41 0.00 0.07 0.00 0.00 57.00 55.68 2b0f n GLN 145 Cb 0.00 -1.24 -0.02 0.00 2.41 0.00 0.00 30.24 31.39 2b0f n GLN 145 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2b0f n GLY 147 N 2.16 3.22 3.59 0.00 0.00 0.11 -4.37 105.19 109.90 2b0f n GLY 147 Ca 0.07 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.60 2b0f n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b0f n GLY 148 N -1.47 0.22 3.54 -0.02 0.00 -1.10 -4.12 105.19 102.23 2b0f n GLY 148 Ca 0.00 0.56 -0.42 0.00 0.00 0.00 0.00 46.02 46.16 2b0f n GLY 148 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2b0f s VAL 149 N -0.05 4.90 -0.47 1.61 -7.23 -0.22 0.59 120.40 119.53 2b0f s VAL 149 Ca 0.74 0.27 -0.25 0.00 -1.81 0.00 0.00 61.98 60.94 2b0f s VAL 149 Cb -0.84 -4.11 0.03 0.00 0.56 0.00 0.00 36.38 32.02 2b0f s VAL 149 CO 0.51 -0.43 0.91 -0.22 -0.31 0.00 0.00 175.10 175.56 2b0f s LEU 150 N 2.67 4.05 0.26 1.32 2.96 0.66 -0.32 118.68 130.27 2b0f s LEU 150 Ca 0.22 0.04 -0.05 0.00 -0.22 0.00 0.00 54.13 54.12 2b0f s LEU 150 Cb -0.15 -3.13 -0.02 0.00 0.50 0.00 0.00 46.19 43.39 2b0f s LEU 150 CO 0.16 -1.05 0.35 0.00 -1.32 0.00 0.00 176.35 174.49 2b0f s ALA 152 N -3.79 2.32 -0.51 0.00 0.00 0.18 -0.77 121.76 119.19 2b0f s ALA 152 Ca 0.31 -1.76 -0.27 0.00 0.00 0.00 0.00 51.96 50.24 2b0f s ALA 152 Cb 0.02 0.83 -0.02 0.00 0.00 0.00 0.00 23.12 23.95 2b0f s ALA 152 CO 0.14 -0.37 1.87 -0.08 0.00 0.00 0.00 175.76 177.32 2b0f s THR 153 N -3.42 3.38 0.00 0.00 -1.32 -1.26 -2.07 115.64 110.95 2b0f s THR 153 Ca 0.33 0.29 0.00 0.00 -1.21 0.00 0.00 61.69 61.10 2b0f s THR 153 Cb 0.06 -3.78 0.00 0.00 -1.51 0.00 0.00 72.50 67.27 2b0f s THR 153 CO 0.15 -0.68 0.00 0.61 -2.21 0.00 0.00 174.62 172.49 2b0f n GLY 154 N 5.62 0.77 2.62 6.08 0.00 -1.26 -4.98 105.19 114.05 2b0f n GLY 154 Ca 0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 2b0f n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b0f s LYS 155 N -0.53 0.16 -0.41 1.61 1.02 -0.88 -4.48 119.74 116.23 2b0f s LYS 155 Ca 0.00 -0.16 -0.21 0.00 0.02 0.00 0.00 55.97 55.61 2b0f s LYS 155 Cb 0.00 -1.83 0.02 0.00 -0.52 0.00 0.00 37.83 35.49 2b0f s LYS 155 CO 0.00 -0.69 0.68 0.42 -0.92 0.00 0.00 175.35 174.84 2b0f s ILE 156 N 2.09 4.80 -0.12 2.17 -1.09 0.97 0.51 121.20 130.53 2b0f s ILE 156 Ca 0.02 0.36 -0.27 0.00 -2.23 0.00 0.00 60.65 58.53 2b0f s ILE 156 Cb -0.16 -4.20 -0.27 0.00 -1.58 0.00 0.00 42.46 36.25 2b0f s ILE 156 CO -0.11 -0.54 0.78 -0.26 -1.23 0.00 0.00 174.94 173.59 2b0f h PHE 157 N 8.77 0.13 0.00 3.97 0.04 -1.67 -3.09 116.94 125.09 2b0f h PHE 157 Ca -0.25 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.42 2b0f h PHE 157 Cb 1.10 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.24 2b0f h PHE 157 CO 0.75 1.09 0.00 0.41 -0.60 0.00 0.00 178.31 179.97 2b0f n GLY 158 N 1.62 -0.57 3.29 -1.45 0.00 -0.59 0.16 105.19 107.65 2b0f n GLY 158 Ca -0.12 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 44.76 2b0f n GLY 158 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2b0f s ILE 159 N -3.00 1.87 -0.08 -0.61 -4.36 -1.00 -0.25 121.20 113.78 2b0f s ILE 159 Ca 0.00 -1.21 -0.30 0.00 -0.26 0.00 0.00 60.65 58.89 2b0f s ILE 159 Cb 0.00 -1.60 -0.05 0.00 1.25 0.00 0.00 42.46 42.06 2b0f s ILE 159 CO 0.00 0.34 1.71 -2.28 0.24 0.00 0.00 174.94 174.96 2b0f s HIS 160 N -0.73 1.87 -0.03 1.37 5.65 0.20 -0.90 115.29 122.72 2b0f s HIS 160 Ca 0.09 0.18 0.07 0.00 0.25 0.00 0.00 55.06 55.66 2b0f s HIS 160 Cb -0.09 -3.97 -0.11 0.00 -1.18 0.00 0.00 32.58 27.23 2b0f s HIS 160 CO 0.01 -3.93 0.12 1.33 -0.65 0.00 0.00 174.74 171.62 2b0f n VAL 161 N 5.74 0.14 -1.84 0.89 0.24 -0.79 0.10 118.33 122.81 2b0f n VAL 161 Ca 0.18 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 2b0f n VAL 161 Cb 0.43 -0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.79 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 2.23 1.82 0.00 7.63 0.00 0.58 -4.93 105.19 112.52 2b0f n GLY 162 Ca -0.04 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 0.98 2.90 -0.02 0.00 -1.26 -0.18 105.19 107.61 2b0f n GLY 163 Ca 0.00 -0.44 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 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 4.04 1.12 1.61 2.47 0.18 -4.86 114.94 119.49 2b0f s ASN 164 Ca 0.00 -1.47 0.00 0.00 0.42 0.00 0.00 52.86 51.81 2b0f s ASN 164 Cb 0.00 -1.17 0.00 0.00 -1.45 0.00 0.00 41.25 38.63 2b0f s ASN 164 CO 0.00 -0.31 0.00 0.61 -3.72 0.00 0.00 177.10 173.68 2b0f n GLY 165 N 4.64 1.43 0.39 1.21 0.00 -1.26 -1.87 105.19 109.74 2b0f n GLY 165 Ca -0.06 0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.15 2b0f n GLY 165 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2b0f n ARG 166 N 0.00 1.87 -4.04 1.61 0.63 -1.26 -4.67 116.66 110.80 2b0f n ARG 166 Ca 0.00 -2.70 -0.31 0.00 -0.92 0.00 0.00 57.85 53.91 2b0f n ARG 166 Cb 0.00 -1.63 -0.16 0.00 0.45 0.00 0.00 32.46 31.12 2b0f n ARG 166 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2b0f s GLN 167 N -2.88 2.37 0.45 -0.14 -0.21 -0.78 -0.29 119.66 118.17 2b0f s GLN 167 Ca 0.36 -0.85 -0.21 0.00 0.02 0.00 0.00 55.36 54.68 2b0f s GLN 167 Cb 0.31 -2.46 -0.10 0.00 1.00 0.00 0.00 33.01 31.76 2b0f s GLN 167 CO 0.05 -0.35 0.99 0.20 -2.12 0.00 0.00 175.29 174.06 2b0f s GLY 168 N 1.35 2.47 -0.16 3.09 0.00 -0.29 0.48 107.32 114.27 2b0f s GLY 168 Ca 0.01 0.51 -0.01 0.00 0.00 0.00 0.00 44.72 45.23 2b0f s GLY 168 CO -0.10 0.82 -0.04 -1.36 0.00 0.00 0.00 173.10 172.43 2b0f s PHE 169 N -2.05 1.49 0.46 1.90 0.08 0.75 -2.40 117.98 118.21 2b0f s PHE 169 Ca 0.64 -0.93 0.07 0.00 0.12 0.00 0.00 56.93 56.82 2b0f s PHE 169 Cb -0.13 -1.22 -0.01 0.00 -0.57 0.00 0.00 43.02 41.09 2b0f s PHE 169 CO 0.17 -0.58 0.34 -1.12 -0.10 0.00 0.00 175.22 173.93 2b0f s SER 170 N 1.70 4.77 -0.11 1.36 0.01 -0.83 -0.30 113.70 120.30 2b0f s SER 170 Ca 0.01 -0.98 0.01 0.00 1.31 0.00 0.00 55.95 56.30 2b0f s SER 170 Cb -0.15 -0.24 -0.02 0.00 0.21 0.00 0.00 66.02 65.82 2b0f s SER 170 CO -0.07 -0.77 -0.15 0.00 0.41 0.00 0.00 173.24 172.66 2b0f s ALA 171 N -2.60 2.56 0.01 1.44 0.00 -0.08 0.14 121.76 123.23 2b0f s ALA 171 Ca 0.42 -0.92 -0.23 0.00 0.00 0.00 0.00 51.96 51.23 2b0f s ALA 171 Cb -0.01 -1.09 -0.05 0.00 0.00 0.00 0.00 23.12 21.96 2b0f s ALA 171 CO 0.25 0.32 0.70 1.14 0.00 0.00 0.00 175.76 178.17 2b0f s GLN 172 N 0.11 4.43 -0.99 0.00 -2.07 0.16 -2.36 119.66 118.93 2b0f s GLN 172 Ca -0.07 0.92 -0.20 0.00 -1.82 0.00 0.00 55.36 54.20 2b0f s GLN 172 Cb -0.15 -3.37 0.10 0.00 -1.09 0.00 0.00 33.01 28.51 2b0f s GLN 172 CO 0.05 0.28 1.28 -0.51 -1.32 0.00 0.00 175.29 175.07 2b0f s LEU 173 N 0.03 4.48 -0.44 2.60 1.43 0.42 -4.94 118.68 122.26 2b0f s LEU 173 Ca 0.36 -1.93 -0.29 0.00 -1.03 0.00 0.00 54.13 51.24 2b0f s LEU 173 Cb -0.19 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.59 2b0f s LEU 173 CO 0.20 -1.20 1.18 -0.54 0.23 0.00 0.00 176.35 176.22 2b0f s LYS 174 N 3.45 3.76 0.35 1.70 1.02 -1.26 -3.95 119.74 124.81 2b0f s LYS 174 Ca 0.39 0.73 0.25 0.00 0.02 0.00 0.00 55.97 57.36 2b0f s LYS 174 Cb -0.03 -3.90 1.18 0.00 -0.52 0.00 0.00 37.83 34.56 2b0f s LYS 174 CO -0.08 -1.33 1.24 1.17 -0.92 0.00 0.00 175.35 175.43 2b0f n LYS 175 N 7.71 -0.03 0.13 1.68 4.81 -1.24 -1.68 118.16 129.54 2b0f n LYS 175 Ca 0.13 1.00 0.17 0.00 -0.87 0.00 0.00 58.31 58.73 2b0f n LYS 175 Cb 0.48 -1.96 0.74 0.00 0.02 0.00 0.00 35.03 34.32 2b0f n LYS 175 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 2b0f h GLN 176 N 0.00 0.00 0.00 1.64 1.08 -1.92 -0.97 115.11 114.94 2b0f h GLN 176 Ca 0.70 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.90 2b0f h GLN 176 Cb 2.23 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.66 2b0f h GLN 176 CO -0.38 0.00 0.00 1.88 -0.95 0.00 0.00 178.83 179.38 2b0f h TYR 177 N 0.00 0.00 0.00 2.96 0.05 -1.73 0.41 116.97 118.66 2b0f h TYR 177 Ca 0.14 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.92 2b0f h TYR 177 Cb 0.63 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.37 2b0f h TYR 177 CO 0.00 0.00 -0.93 1.19 -1.05 0.00 0.00 178.16 177.37 2b0f n PHE 178 N -2.83 0.09 -0.05 4.88 3.72 -0.38 -2.61 117.46 120.28 2b0f n PHE 178 Ca 0.00 0.03 -0.22 0.00 -0.05 0.00 0.00 57.45 57.21 2b0f n PHE 178 Cb 0.25 -0.24 -0.13 0.00 -0.94 0.00 0.00 39.48 38.42 2b0f n PHE 178 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2b0f h VAL 179 N 0.00 0.77 0.00 -4.37 2.07 -1.13 -3.38 116.25 110.22 2b0f h VAL 179 Ca 0.00 -2.26 -0.13 0.00 0.82 0.00 0.00 66.70 65.12 2b0f h VAL 179 Cb 0.60 2.37 -0.02 0.00 -1.52 0.00 0.00 31.29 32.72 2b0f h VAL 179 CO 0.00 0.61 -0.62 -0.33 0.02 0.00 0.00 177.57 177.25 2b0f h GLU 180 N -0.46 0.00 -6.61 1.57 3.07 -0.40 -3.42 114.58 108.33 2b0f h GLU 180 Ca -0.39 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 57.91 2b0f h GLU 180 Cb 1.68 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 29.51 2b0f h GLU 180 CO -0.06 0.62 0.93 0.21 -1.40 0.00 0.00 179.01 179.32 2b0f s LYS 181 N -3.20 3.61 0.00 2.33 2.20 -1.07 -5.07 119.74 118.53 2b0f s LYS 181 Ca 0.01 0.38 0.00 0.00 -0.36 0.00 0.00 55.97 56.00 2b0f s LYS 181 Cb 0.10 -3.96 0.00 0.00 -1.51 0.00 0.00 37.83 32.46 2b0f s LYS 181 CO 0.75 -1.52 0.00 0.00 -0.36 0.00 0.00 175.35 174.23