#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bjs s VAL 4 N 0.00 2.93 0.56 -3.33 1.01 -1.26 -5.11 120.40 115.21 2bjs s VAL 4 Ca 0.00 -0.76 -0.18 0.00 0.00 0.00 0.00 61.98 61.04 2bjs s VAL 4 Cb 0.00 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 2bjs s VAL 4 CO 0.00 0.58 1.09 -0.44 0.00 0.00 0.00 175.10 176.33 2bjs s SER 5 N -0.59 5.78 -0.02 3.32 0.01 -1.26 -4.77 113.70 116.16 2bjs s SER 5 Ca 0.08 1.99 -0.24 0.00 1.31 0.00 0.00 55.95 59.09 2bjs s SER 5 Cb -0.11 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 2bjs s SER 5 CO 0.01 -1.17 0.74 -0.75 0.41 0.00 0.00 173.24 172.47 2bjs s LYS 6 N -3.62 4.46 0.48 12.44 2.20 -1.26 -1.44 119.74 133.00 2bjs s LYS 6 Ca 0.68 0.97 -0.23 0.00 -0.36 0.00 0.00 55.97 57.04 2bjs s LYS 6 Cb -0.19 -3.41 -0.07 0.00 -1.51 0.00 0.00 37.83 32.65 2bjs s LYS 6 CO 0.30 0.16 1.21 0.00 -0.36 0.00 0.00 175.35 176.66 2bjs s ALA 7 N 0.43 2.93 -0.49 3.13 0.00 0.47 -4.83 121.76 123.39 2bjs s ALA 7 Ca 0.38 1.03 -0.28 0.00 0.00 0.00 0.00 51.96 53.09 2bjs s ALA 7 Cb -0.19 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.51 2bjs s ALA 7 CO 0.20 -0.84 1.41 1.21 0.00 0.00 0.00 175.76 177.75 2bjs s ASN 8 N -1.27 6.22 -0.42 0.00 3.84 -1.26 -4.80 114.94 117.25 2bjs s ASN 8 Ca 0.66 0.53 0.02 0.00 0.21 0.00 0.00 52.86 54.27 2bjs s ASN 8 Cb -0.31 -2.54 0.14 0.00 -0.55 0.00 0.00 41.25 37.98 2bjs s ASN 8 CO 0.38 -1.58 0.23 -0.69 -2.79 0.00 0.00 177.10 172.64 2bjs s VAL 9 N 5.78 1.15 0.63 -5.21 1.01 -1.26 -4.57 120.40 117.93 2bjs s VAL 9 Ca 0.56 -2.38 -0.16 0.00 0.00 0.00 0.00 61.98 60.00 2bjs s VAL 9 Cb -0.12 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 2bjs s VAL 9 CO 0.29 -0.91 1.12 -2.16 0.00 0.00 0.00 175.10 173.43 2bjs s PRO 10 N 0.50 2.95 -0.34 2.72 0.04 -1.26 -4.58 135.00 135.03 2bjs s PRO 10 Ca 0.18 1.46 -0.20 0.00 0.04 0.00 0.00 61.00 62.47 2bjs s PRO 10 Cb -0.24 -1.96 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 2bjs s PRO 10 CO 0.00 -1.14 0.61 0.15 0.04 0.00 0.00 177.00 176.66 2bjs s LYS 11 N -3.87 3.71 -0.21 4.56 1.02 -1.26 -0.94 119.74 122.75 2bjs s LYS 11 Ca 0.69 0.06 -0.04 0.00 0.02 0.00 0.00 55.97 56.69 2bjs s LYS 11 Cb -0.22 -3.79 -0.01 0.00 -0.52 0.00 0.00 37.83 33.29 2bjs s LYS 11 CO 0.37 -0.68 -0.02 0.42 -0.92 0.00 0.00 175.35 174.52 2bjs s ILE 12 N 2.62 3.59 -0.51 2.17 1.01 0.20 -4.95 121.20 125.33 2bjs s ILE 12 Ca 0.23 -0.42 -0.28 0.00 0.00 0.00 0.00 60.65 60.18 2bjs s ILE 12 Cb -0.15 -2.63 0.01 0.00 0.01 0.00 0.00 42.46 39.70 2bjs s ILE 12 CO 0.14 0.42 1.48 -0.62 0.00 0.00 0.00 174.94 176.36 2bjs s ASP 13 N 1.33 6.09 0.00 3.58 -1.08 -1.26 -1.16 116.67 124.17 2bjs s ASP 13 Ca 0.04 0.50 0.26 0.00 -0.52 0.00 0.00 52.55 52.83 2bjs s ASP 13 Cb -0.14 -2.54 0.78 0.00 -1.46 0.00 0.00 42.92 39.56 2bjs s ASP 13 CO -0.01 -1.70 1.59 1.33 0.52 0.00 0.00 175.17 176.90 2bjs n VAL 14 N 6.99 0.06 -0.06 1.11 0.24 -0.83 -4.47 118.33 121.37 2bjs n VAL 14 Ca 0.15 -0.35 0.13 0.00 -2.04 0.00 0.00 64.34 62.24 2bjs n VAL 14 Cb 0.49 0.72 0.54 0.00 -1.47 0.00 0.00 33.84 34.11 2bjs n VAL 14 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2bjs h SER 15 N 2.95 0.30 -0.02 -1.34 4.64 -1.74 -0.47 113.55 117.86 2bjs h SER 15 Ca 0.00 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2bjs h SER 15 Cb 0.63 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2bjs h SER 15 CO 0.00 0.17 0.03 -0.65 -0.87 0.00 0.00 176.83 175.51 2bjs h PRO 16 N 0.33 0.00 0.00 4.77 0.11 -1.92 -2.11 132.00 133.17 2bjs h PRO 16 Ca 0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 2bjs h PRO 16 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 2bjs h PRO 16 CO -0.07 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.00 2bjs n LEU 17 N -3.81 0.44 -0.18 2.35 4.77 -0.18 -1.75 117.00 118.64 2bjs n LEU 17 Ca -0.02 0.62 0.13 0.00 -0.03 0.00 0.00 56.01 56.70 2bjs n LEU 17 Cb 0.11 -0.58 0.37 0.00 -2.33 0.00 0.00 43.42 40.99 2bjs n LEU 17 CO 0.27 -0.51 0.63 0.49 -1.33 0.00 0.00 177.39 176.94 2bjs n PHE 18 N -1.99 0.00 -2.33 -1.77 3.72 -0.79 -4.81 117.46 109.48 2bjs n PHE 18 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 2bjs n PHE 18 Cb 0.18 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.56 2bjs n PHE 18 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bjs n GLY 19 N 1.37 5.89 0.17 1.37 0.00 -0.71 -5.09 105.19 108.19 2bjs n GLY 19 Ca 0.11 -1.79 0.05 0.00 0.00 0.00 0.00 46.02 44.39 2bjs n GLY 19 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bjs n ASP 20 N 0.00 1.53 -4.38 1.61 8.00 -1.26 -4.93 116.55 117.12 2bjs n ASP 20 Ca 0.00 -2.51 -0.45 0.00 0.71 0.00 0.00 54.79 52.54 2bjs n ASP 20 Cb 0.00 -0.28 -0.04 0.00 -0.02 0.00 0.00 41.12 40.78 2bjs n ASP 20 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2bjs s ASP 21 N -1.93 6.32 0.20 -2.24 -1.08 -1.26 -4.93 116.67 111.75 2bjs s ASP 21 Ca 0.17 -1.67 -0.07 0.00 -0.52 0.00 0.00 52.55 50.45 2bjs s ASP 21 Cb 0.15 -2.31 0.14 0.00 -1.46 0.00 0.00 42.92 39.44 2bjs s ASP 21 CO 0.02 -1.05 1.68 1.56 0.52 0.00 0.00 175.17 177.90 2bjs h GLN 22 N 8.97 1.02 -0.75 4.34 1.08 -1.95 -0.88 115.11 126.94 2bjs h GLN 22 Ca -0.18 -0.31 -0.05 0.00 -1.45 0.00 0.00 58.65 56.66 2bjs h GLN 22 Cb 1.07 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 28.37 2bjs h GLN 22 CO 1.06 0.99 0.25 0.00 -0.95 0.00 0.00 178.83 180.18 2bjs h ALA 23 N 1.07 1.04 -0.69 3.87 0.00 -1.99 -0.79 119.26 121.76 2bjs h ALA 23 Ca 0.17 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2bjs h ALA 23 Cb 0.52 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2bjs h ALA 23 CO 0.03 0.66 0.30 0.00 0.00 0.00 0.00 179.25 180.24 2bjs h ALA 24 N 1.17 0.90 -0.81 0.00 0.00 -1.91 -0.20 119.26 118.41 2bjs h ALA 24 Ca 0.24 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2bjs h ALA 24 Cb 0.28 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2bjs h ALA 24 CO -0.01 0.49 0.42 0.87 0.00 0.00 0.00 179.25 181.02 2bjs h LYS 25 N 0.98 1.14 -0.66 0.00 1.57 -0.81 -1.91 116.57 116.87 2bjs h LYS 25 Ca 0.23 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2bjs h LYS 25 Cb 0.16 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 2bjs h LYS 25 CO -0.02 0.86 0.40 0.52 -0.57 0.00 0.00 179.45 180.63 2bjs h MET 26 N 1.13 0.89 -0.15 3.15 2.86 -0.34 -0.21 114.93 122.26 2bjs h MET 26 Ca 0.28 -0.08 -0.09 0.00 -2.06 0.00 0.00 59.70 57.76 2bjs h MET 26 Cb 0.07 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.53 2bjs h MET 26 CO -0.04 0.63 -0.29 0.00 1.06 0.00 0.00 176.91 178.27 2bjs h ARG 27 N 0.91 0.28 -0.26 1.72 3.08 -0.62 0.17 114.38 119.66 2bjs h ARG 27 Ca 0.24 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 2bjs h ARG 27 Cb -0.03 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 2bjs h ARG 27 CO -0.04 0.55 -0.01 0.28 -1.07 0.00 0.00 179.97 179.67 2bjs h VAL 28 N 0.25 1.26 -0.94 2.04 2.07 -0.92 -2.98 116.25 117.03 2bjs h VAL 28 Ca 0.04 -0.95 0.08 0.00 0.82 0.00 0.00 66.70 66.69 2bjs h VAL 28 Cb 0.64 1.36 -0.07 0.00 -1.52 0.00 0.00 31.29 31.71 2bjs h VAL 28 CO 0.05 0.30 0.61 0.00 0.02 0.00 0.00 177.57 178.55 2bjs h ALA 29 N 0.81 1.51 -0.75 1.67 0.00 -0.53 -0.77 119.26 121.20 2bjs h ALA 29 Ca 0.07 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2bjs h ALA 29 Cb 0.44 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2bjs h ALA 29 CO 0.02 0.32 0.31 0.37 0.00 0.00 0.00 179.25 180.27 2bjs h GLN 30 N 1.03 1.11 -0.51 0.00 -0.00 -0.94 0.81 115.11 116.61 2bjs h GLN 30 Ca 0.42 -0.19 -0.10 0.00 -0.00 0.00 0.00 58.65 58.78 2bjs h GLN 30 Cb 0.28 -0.18 -0.02 0.00 0.00 0.00 0.00 27.48 27.56 2bjs h GLN 30 CO -0.18 0.90 -0.06 1.96 0.00 0.00 0.00 178.83 181.45 2bjs h GLN 31 N 1.07 0.91 -0.37 1.69 4.20 -1.06 -0.70 115.11 120.85 2bjs h GLN 31 Ca 0.25 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2bjs h GLN 31 Cb 0.19 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 2bjs h GLN 31 CO -0.02 0.94 0.21 0.82 -0.67 0.00 0.00 178.83 180.11 2bjs h ILE 32 N 0.83 1.14 -0.19 2.54 2.04 -0.72 -1.74 117.51 121.41 2bjs h ILE 32 Ca 0.14 -0.36 0.03 0.00 1.00 0.00 0.00 64.86 65.67 2bjs h ILE 32 Cb 0.58 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 2bjs h ILE 32 CO 0.04 0.14 0.02 -0.78 0.00 0.00 0.00 178.15 177.57 2bjs h ASP 33 N 0.48 -0.04 -0.60 1.72 3.58 -0.58 -0.47 116.42 120.50 2bjs h ASP 33 Ca 0.13 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.61 2bjs h ASP 33 Cb 0.05 0.06 -0.03 0.00 1.72 0.00 0.00 39.33 41.13 2bjs h ASP 33 CO -0.02 0.01 0.33 0.00 -2.88 0.00 0.00 179.24 176.68 2bjs h ALA 34 N 1.15 0.77 -0.36 -0.78 0.00 -0.96 -1.30 119.26 117.78 2bjs h ALA 34 Ca 0.09 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2bjs h ALA 34 Cb 0.10 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2bjs h ALA 34 CO -0.14 0.28 -0.23 0.00 0.00 0.00 0.00 179.25 179.17 2bjs h ALA 35 N 1.16 0.93 0.00 0.00 0.00 -1.16 -2.18 119.26 118.00 2bjs h ALA 35 Ca 0.21 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 2bjs h ALA 35 Cb 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2bjs h ALA 35 CO -0.04 0.62 -0.46 0.77 0.00 0.00 0.00 179.25 180.14 2bjs h SER 36 N 0.62 0.00 0.94 0.00 0.02 -0.69 -0.65 113.55 113.79 2bjs h SER 36 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2bjs h SER 36 Cb 0.72 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2bjs h SER 36 CO 0.06 0.46 -0.50 0.54 -1.14 0.00 0.00 176.83 176.25 2bjs n ARG 37 N -3.79 0.26 0.00 3.45 1.74 -0.52 -4.33 116.66 113.46 2bjs n ARG 37 Ca -0.01 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 2bjs n ARG 37 Cb 0.51 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 2bjs n ARG 37 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2bjs n ASP 38 N -2.08 0.00 0.19 0.55 2.03 -0.84 -4.90 116.55 111.51 2bjs n ASP 38 Ca 0.04 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.46 2bjs n ASP 38 Cb 0.43 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 40.95 2bjs n ASP 38 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2bjs h THR 39 N 0.00 0.08 0.00 5.18 1.35 -1.79 -3.47 112.91 114.25 2bjs h THR 39 Ca 0.00 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 2bjs h THR 39 Cb 0.00 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 2bjs h THR 39 CO 0.00 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 2bjs n GLY 40 N 1.13 0.65 3.26 5.82 0.00 -0.30 -4.82 105.19 110.93 2bjs n GLY 40 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 2bjs n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bjs s PHE 41 N -2.27 1.79 0.11 1.61 0.40 -1.26 -4.20 117.98 114.16 2bjs s PHE 41 Ca 0.00 -0.39 -0.11 0.00 -0.60 0.00 0.00 56.93 55.83 2bjs s PHE 41 Cb 0.00 -1.03 0.01 0.00 0.51 0.00 0.00 43.02 42.51 2bjs s PHE 41 CO 0.00 0.14 0.27 -0.59 0.70 0.00 0.00 175.22 175.74 2bjs s PHE 42 N -0.94 0.06 -0.22 0.36 -0.71 -0.93 -4.25 117.98 111.35 2bjs s PHE 42 Ca 0.07 -0.45 -0.13 0.00 -1.04 0.00 0.00 56.93 55.38 2bjs s PHE 42 Cb -0.09 0.05 -0.05 0.00 -1.21 0.00 0.00 43.02 41.72 2bjs s PHE 42 CO 0.03 -0.62 0.26 0.71 -1.34 0.00 0.00 175.22 174.26 2bjs s TYR 43 N -3.86 3.36 -0.20 3.49 2.02 -0.11 -0.67 117.35 121.38 2bjs s TYR 43 Ca 0.06 0.41 -0.28 0.00 -0.37 0.00 0.00 57.07 56.89 2bjs s TYR 43 Cb 0.04 -2.36 0.00 0.00 -0.40 0.00 0.00 41.96 39.23 2bjs s TYR 43 CO -0.10 0.07 0.97 0.00 -1.57 0.00 0.00 175.55 174.92 2bjs s ALA 44 N 1.05 3.60 0.30 3.71 0.00 0.60 -0.63 121.76 130.40 2bjs s ALA 44 Ca 0.13 0.15 0.11 0.00 0.00 0.00 0.00 51.96 52.35 2bjs s ALA 44 Cb -0.14 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 2bjs s ALA 44 CO 0.05 -0.89 -0.14 0.14 0.00 0.00 0.00 175.76 174.92 2bjs s VAL 45 N 2.77 2.52 -1.35 0.00 -7.23 -0.31 -1.78 120.40 115.02 2bjs s VAL 45 Ca 0.43 -2.27 -0.08 0.00 -1.81 0.00 0.00 61.98 58.24 2bjs s VAL 45 Cb -0.16 -2.48 0.01 0.00 0.56 0.00 0.00 36.38 34.31 2bjs s VAL 45 CO 0.09 -0.33 1.12 0.59 -0.31 0.00 0.00 175.10 176.27 2bjs n ASN 46 N -0.72 -6.31 0.08 4.85 3.02 -1.26 -1.97 115.26 112.94 2bjs n ASN 46 Ca -0.05 -0.51 0.12 0.00 -0.03 0.00 0.00 54.58 54.11 2bjs n ASN 46 Cb 0.61 -4.95 0.25 0.00 -0.61 0.00 0.00 39.78 35.08 2bjs n ASN 46 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bjs n HIS 47 N -4.94 0.69 -0.28 3.10 1.44 -1.26 -3.72 115.22 110.25 2bjs n HIS 47 Ca -0.00 0.20 0.00 0.00 -2.01 0.00 0.00 57.72 55.91 2bjs n HIS 47 Cb 0.56 -0.75 0.00 0.00 0.12 0.00 0.00 29.99 29.92 2bjs n HIS 47 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2bjs n GLY 48 N 1.33 1.63 3.82 -1.39 0.00 -1.26 -4.91 105.19 104.41 2bjs n GLY 48 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2bjs n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bjs s ILE 49 N -2.99 4.99 -1.13 -0.61 1.01 -1.26 -5.01 121.20 116.21 2bjs s ILE 49 Ca 0.00 0.91 -0.20 0.00 0.00 0.00 0.00 60.65 61.36 2bjs s ILE 49 Cb 0.00 -3.75 0.07 0.00 0.01 0.00 0.00 42.46 38.79 2bjs s ILE 49 CO 0.00 0.56 1.53 0.21 0.00 0.00 0.00 174.94 177.24 2bjs s ASN 50 N -0.96 6.68 0.36 3.58 3.84 -1.26 -4.81 114.94 122.37 2bjs s ASN 50 Ca 0.25 -1.98 0.19 0.00 0.21 0.00 0.00 52.86 51.52 2bjs s ASN 50 Cb -0.17 -2.55 0.59 0.00 -0.55 0.00 0.00 41.25 38.58 2bjs s ASN 50 CO 0.14 -1.29 1.69 -0.37 -2.79 0.00 0.00 177.10 174.48 2bjs h VAL 51 N 6.11 0.85 -0.63 -5.21 -1.51 -1.94 -2.38 116.25 111.55 2bjs h VAL 51 Ca 0.30 -1.61 -0.09 0.00 -1.23 0.00 0.00 66.70 64.07 2bjs h VAL 51 Cb 0.95 2.00 -0.02 0.00 -2.13 0.00 0.00 31.29 32.09 2bjs h VAL 51 CO 1.40 0.38 0.04 -0.61 -1.23 0.00 0.00 177.57 177.55 2bjs h GLN 52 N 0.00 1.08 -0.19 5.19 -0.00 -1.88 -0.40 115.11 118.91 2bjs h GLN 52 Ca -0.00 -0.32 -0.19 0.00 -0.00 0.00 0.00 58.65 58.13 2bjs h GLN 52 Cb 0.97 -0.11 0.01 0.00 0.00 0.00 0.00 27.48 28.35 2bjs h GLN 52 CO 0.05 1.03 -0.64 -0.09 0.00 0.00 0.00 178.83 179.18 2bjs h ARG 53 N 1.00 0.77 -0.37 1.69 2.43 -1.94 -0.54 114.38 117.42 2bjs h ARG 53 Ca 0.18 -0.57 0.08 0.00 -0.81 0.00 0.00 59.98 58.86 2bjs h ARG 53 Cb 0.52 0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 30.09 2bjs h ARG 53 CO 0.02 1.19 -0.13 1.25 -1.51 0.00 0.00 179.97 180.79 2bjs h LEU 54 N 0.51 -0.47 -0.52 3.80 5.85 -1.23 -0.13 115.31 123.11 2bjs h LEU 54 Ca -0.02 0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 2bjs h LEU 54 Cb 1.26 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 42.54 2bjs h LEU 54 CO 0.14 -0.17 0.32 -1.28 -0.34 0.00 0.00 178.44 177.11 2bjs h SER 55 N -0.06 0.63 -0.19 1.25 0.87 -0.79 -1.33 113.55 113.93 2bjs h SER 55 Ca 0.18 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2bjs h SER 55 Cb 0.33 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 2bjs h SER 55 CO -0.41 0.50 0.12 -0.61 -0.53 0.00 0.00 176.83 175.90 2bjs h GLN 56 N 0.70 0.26 -0.65 2.24 5.75 -0.65 -0.51 115.11 122.25 2bjs h GLN 56 Ca 0.19 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.59 2bjs h GLN 56 Cb -0.02 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2bjs h GLN 56 CO -0.04 0.19 0.08 0.87 -2.65 0.00 0.00 178.83 177.27 2bjs h LYS 57 N 0.25 1.09 -0.44 1.69 1.79 -0.94 -1.17 116.57 118.84 2bjs h LYS 57 Ca 0.07 -0.31 -0.03 0.00 -2.18 0.00 0.00 60.65 58.20 2bjs h LYS 57 Cb -0.01 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 2bjs h LYS 57 CO -0.01 1.02 0.16 1.15 -1.08 0.00 0.00 179.45 180.69 2bjs h THR 58 N 1.01 1.21 -0.35 -0.16 2.02 -1.13 -2.19 112.91 113.32 2bjs h THR 58 Ca 0.19 -0.68 0.01 0.00 0.77 0.00 0.00 66.41 66.71 2bjs h THR 58 Cb 0.48 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 2bjs h THR 58 CO 0.02 0.25 0.21 0.50 0.37 0.00 0.00 175.52 176.86 2bjs h LYS 59 N 0.58 0.41 -0.84 6.66 3.64 -0.88 -0.42 116.57 125.72 2bjs h LYS 59 Ca 0.15 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.57 2bjs h LYS 59 Cb 0.22 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.89 2bjs h LYS 59 CO -0.01 0.27 0.51 0.93 -2.27 0.00 0.00 179.45 178.89 2bjs h GLU 60 N 0.43 0.88 0.61 1.90 5.08 -1.04 -0.54 114.58 121.91 2bjs h GLU 60 Ca 0.14 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2bjs h GLU 60 Cb -0.01 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.05 2bjs h GLU 60 CO -0.06 0.58 -0.29 0.35 -1.00 0.00 0.00 179.01 178.59 2bjs h PHE 61 N 0.91 -0.76 -0.94 4.33 3.57 -1.03 -2.76 116.94 120.26 2bjs h PHE 61 Ca 0.38 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.91 2bjs h PHE 61 Cb 0.23 0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.17 2bjs h PHE 61 CO -0.04 -0.42 0.61 0.45 -2.23 0.00 0.00 178.31 176.68 2bjs h HIS 62 N -1.00 1.12 0.00 0.41 3.86 -0.86 -1.68 115.15 117.01 2bjs h HIS 62 Ca -0.08 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 2bjs h HIS 62 Cb 0.68 -0.37 0.00 0.00 1.06 0.00 0.00 27.41 28.77 2bjs h HIS 62 CO -0.00 0.62 -0.25 0.52 0.86 0.00 0.00 177.93 179.68 2bjs h MET 63 N 1.14 0.00 0.00 2.45 2.86 -1.15 -3.35 114.93 116.88 2bjs h MET 63 Ca 0.38 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.02 2bjs h MET 63 Cb 0.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.74 2bjs h MET 63 CO -0.13 0.00 -1.69 -1.13 1.06 0.00 0.00 176.91 175.02 2bjs n SER 64 N -2.48 1.44 -4.77 1.22 3.41 -0.98 -5.00 113.62 106.47 2bjs n SER 64 Ca 0.04 -0.02 -0.40 0.00 -0.26 0.00 0.00 58.87 58.23 2bjs n SER 64 Cb 0.47 1.70 -0.01 0.00 -0.26 0.00 0.00 64.21 66.10 2bjs n SER 64 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2bjs s ILE 65 N -3.07 2.62 0.33 -1.33 2.07 -0.67 -5.01 121.20 116.15 2bjs s ILE 65 Ca -0.05 0.60 0.07 0.00 -1.41 0.00 0.00 60.65 59.86 2bjs s ILE 65 Cb 0.10 -3.37 -0.03 0.00 0.13 0.00 0.00 42.46 39.29 2bjs s ILE 65 CO 0.64 0.13 0.28 0.42 -1.91 0.00 0.00 174.94 174.51 2bjs s THR 66 N -1.18 3.58 0.36 4.00 -4.23 -1.26 -4.98 115.64 111.93 2bjs s THR 66 Ca 0.52 -1.38 0.09 0.00 -1.18 0.00 0.00 61.69 59.74 2bjs s THR 66 Cb -0.40 -3.19 0.32 0.00 1.34 0.00 0.00 72.50 70.57 2bjs s THR 66 CO 0.53 -0.18 1.89 -0.65 -0.54 0.00 0.00 174.62 175.66 2bjs h PRO 67 N 1.27 0.67 -0.39 3.99 0.11 -2.00 -1.56 132.00 134.09 2bjs h PRO 67 Ca -0.45 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2bjs h PRO 67 Cb 1.25 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2bjs h PRO 67 CO 0.59 0.44 0.22 1.49 -0.21 0.00 0.00 178.00 180.53 2bjs h GLU 68 N 0.69 0.54 -0.44 1.05 4.81 -2.00 -2.09 114.58 117.13 2bjs h GLU 68 Ca 0.42 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.51 2bjs h GLU 68 Cb 0.65 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 2bjs h GLU 68 CO -0.18 0.42 -0.07 0.93 -0.73 0.00 0.00 179.01 179.38 2bjs h GLU 69 N 0.51 0.77 -0.51 1.92 5.08 -1.74 -2.19 114.58 118.42 2bjs h GLU 69 Ca 0.14 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 2bjs h GLU 69 Cb 0.03 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2bjs h GLU 69 CO -0.02 0.82 0.21 0.87 -1.00 0.00 0.00 179.01 179.89 2bjs h LYS 70 N 0.70 0.75 -0.81 2.33 1.57 -0.87 -1.60 116.57 118.65 2bjs h LYS 70 Ca 0.13 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2bjs h LYS 70 Cb 0.53 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.68 2bjs h LYS 70 CO 0.03 0.66 0.45 -1.49 -0.57 0.00 0.00 179.45 178.53 2bjs h TRP 71 N 0.67 1.10 0.00 -1.35 -0.00 -1.20 -1.33 115.95 113.85 2bjs h TRP 71 Ca 0.17 -0.02 -0.03 0.00 -0.00 0.00 0.00 58.89 59.01 2bjs h TRP 71 Cb 0.19 -0.35 -0.00 0.00 -0.00 0.00 0.00 29.16 28.99 2bjs h TRP 71 CO 0.00 0.76 -0.13 -0.44 -0.00 0.00 0.00 178.44 178.64 2bjs h ASP 72 N 1.12 0.00 -0.02 -3.49 3.32 -0.92 -2.60 116.42 113.83 2bjs h ASP 72 Ca 0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 2bjs h ASP 72 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2bjs h ASP 72 CO -0.05 0.13 -0.27 0.18 -1.72 0.00 0.00 179.24 177.51 2bjs n LEU 73 N -3.65 2.13 -4.77 1.55 4.77 -0.64 -5.05 117.00 111.34 2bjs n LEU 73 Ca -0.02 -0.84 -0.39 0.00 -0.03 0.00 0.00 56.01 54.73 2bjs n LEU 73 Cb 0.25 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.34 2bjs n LEU 73 CO 0.30 0.39 0.99 0.00 -1.33 0.00 0.00 177.39 177.74 2bjs s ALA 74 N -2.02 3.20 0.97 -1.18 0.00 -0.52 -1.07 121.76 121.13 2bjs s ALA 74 Ca 0.19 1.30 -0.12 0.00 0.00 0.00 0.00 51.96 53.33 2bjs s ALA 74 Cb 0.16 -3.52 0.17 0.00 0.00 0.00 0.00 23.12 19.93 2bjs s ALA 74 CO 0.41 -0.98 1.09 0.96 0.00 0.00 0.00 175.76 177.23 2bjs s ILE 75 N -1.26 2.32 0.52 0.00 -4.36 -0.68 -4.69 121.20 113.04 2bjs s ILE 75 Ca 0.60 0.10 0.33 0.00 -0.26 0.00 0.00 60.65 61.42 2bjs s ILE 75 Cb -0.40 -2.55 0.36 0.00 1.25 0.00 0.00 42.46 41.13 2bjs s ILE 75 CO 0.50 -0.14 2.21 0.08 0.24 0.00 0.00 174.94 177.84 2bjs h ARG 76 N -1.80 0.00 0.00 0.37 0.11 -1.18 -0.95 114.38 110.92 2bjs h ARG 76 Ca -0.53 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.54 2bjs h ARG 76 Cb 1.31 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.39 2bjs h ARG 76 CO 0.55 0.04 -0.06 0.00 0.10 0.00 0.00 179.97 180.60 2bjs h ALA 77 N 1.96 1.65 0.00 0.08 0.00 -1.92 -3.09 119.26 117.95 2bjs h ALA 77 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2bjs h ALA 77 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2bjs h ALA 77 CO 0.01 0.08 -1.26 0.66 0.00 0.00 0.00 179.25 178.73 2bjs n TYR 78 N -4.11 0.00 -3.51 0.00 4.01 -0.44 -4.95 117.16 108.17 2bjs n TYR 78 Ca -0.03 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.50 2bjs n TYR 78 Cb 0.15 -0.19 -0.14 0.00 -0.31 0.00 0.00 39.34 38.85 2bjs n TYR 78 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2bjs s ASN 79 N -3.00 2.00 0.60 7.72 3.84 -0.74 -5.01 114.94 120.35 2bjs s ASN 79 Ca -0.02 -0.57 0.36 0.00 0.21 0.00 0.00 52.86 52.84 2bjs s ASN 79 Cb 0.08 0.14 1.90 0.00 -0.55 0.00 0.00 41.25 42.82 2bjs s ASN 79 CO 0.48 -0.36 2.21 0.11 -2.79 0.00 0.00 177.10 176.75 2bjs h LYS 80 N 8.34 0.00 0.00 0.43 1.57 -1.87 -2.10 116.57 122.94 2bjs h LYS 80 Ca -0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2bjs h LYS 80 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.43 2bjs h LYS 80 CO 0.32 0.03 0.00 0.39 -0.57 0.00 0.00 179.45 179.62 2bjs n GLU 81 N -3.34 0.20 -2.73 3.15 1.02 -1.26 -4.08 120.64 113.59 2bjs n GLU 81 Ca -0.02 0.41 -0.35 0.00 -0.02 0.00 0.00 57.16 57.18 2bjs n GLU 81 Cb 0.16 -1.87 -0.00 0.00 -0.02 0.00 0.00 31.44 29.70 2bjs n GLU 81 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2bjs n HIS 82 N -2.26 3.28 0.30 -0.32 8.25 -0.79 -4.84 115.22 118.85 2bjs n HIS 82 Ca 0.02 -3.11 0.19 0.00 -0.26 0.00 0.00 57.72 54.56 2bjs n HIS 82 Cb 0.25 -0.91 0.87 0.00 1.12 0.00 0.00 29.99 31.31 2bjs n HIS 82 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2bjs h GLN 83 N 3.69 0.00 0.00 -0.41 1.08 -1.81 -1.14 115.11 116.51 2bjs h GLN 83 Ca 0.38 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.58 2bjs h GLN 83 Cb 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 2bjs h GLN 83 CO 1.04 0.00 -0.19 -0.25 -0.95 0.00 0.00 178.83 178.48 2bjs n ASP 84 N -2.98 0.45 -4.40 1.46 8.00 -1.26 -4.60 116.55 113.22 2bjs n ASP 84 Ca -0.01 0.33 -0.45 0.00 0.71 0.00 0.00 54.79 55.37 2bjs n ASP 84 Cb 0.20 -0.35 -0.03 0.00 -0.02 0.00 0.00 41.12 40.93 2bjs n ASP 84 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2bjs s GLN 85 N -3.06 3.53 -0.25 -1.24 -0.21 -0.43 -4.80 119.66 113.21 2bjs s GLN 85 Ca 0.11 -1.92 -0.09 0.00 0.02 0.00 0.00 55.36 53.48 2bjs s GLN 85 Cb 0.16 -4.68 -0.16 0.00 1.00 0.00 0.00 33.01 29.33 2bjs s GLN 85 CO 0.61 -1.59 -0.18 0.28 -2.12 0.00 0.00 175.29 172.29 2bjs n VAL 86 N 5.01 1.54 -0.12 1.09 0.31 -1.26 -1.05 118.33 123.85 2bjs n VAL 86 Ca 0.17 -0.44 -0.24 0.00 -0.01 0.00 0.00 64.34 63.82 2bjs n VAL 86 Cb 0.48 -1.72 -0.08 0.00 -0.91 0.00 0.00 33.84 31.60 2bjs n VAL 86 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2bjs n ARG 87 N -3.85 0.57 -3.21 5.55 1.74 -1.26 -4.81 116.66 111.39 2bjs n ARG 87 Ca -0.47 0.29 -0.39 0.00 -0.77 0.00 0.00 57.85 56.51 2bjs n ARG 87 Cb 0.92 -1.51 -0.06 0.00 -1.02 0.00 0.00 32.46 30.79 2bjs n ARG 87 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bjs s ALA 88 N -2.59 3.47 0.00 7.54 0.00 -1.26 -4.66 121.76 124.25 2bjs s ALA 88 Ca -0.35 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.60 2bjs s ALA 88 Cb 0.11 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.49 2bjs s ALA 88 CO 0.48 0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.74 2bjs n GLY 89 N 2.72 0.74 3.79 0.00 0.00 -0.33 -4.63 105.19 107.48 2bjs n GLY 89 Ca -0.06 -2.09 -0.38 0.00 0.00 0.00 0.00 46.02 43.49 2bjs n GLY 89 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2bjs s TYR 90 N -1.42 3.66 -0.34 1.61 6.14 -0.23 -1.05 117.35 125.72 2bjs s TYR 90 Ca 0.00 1.01 -0.02 0.00 0.64 0.00 0.00 57.07 58.70 2bjs s TYR 90 Cb 0.00 -2.43 0.07 0.00 0.42 0.00 0.00 41.96 40.02 2bjs s TYR 90 CO 0.00 0.45 0.09 0.71 0.64 0.00 0.00 175.55 177.44 2bjs s TYR 91 N -0.44 3.40 0.49 4.97 1.51 0.51 -1.69 117.35 126.09 2bjs s TYR 91 Ca 0.26 -2.07 -0.19 0.00 -1.01 0.00 0.00 57.07 54.05 2bjs s TYR 91 Cb -0.17 -2.56 -0.09 0.00 -0.11 0.00 0.00 41.96 39.03 2bjs s TYR 91 CO 0.13 -0.86 0.99 -0.51 -1.11 0.00 0.00 175.55 174.19 2bjs s LEU 92 N 1.21 3.78 0.80 -1.29 1.02 -1.26 -1.58 118.68 121.36 2bjs s LEU 92 Ca 0.01 1.72 -0.12 0.00 0.02 0.00 0.00 54.13 55.76 2bjs s LEU 92 Cb -0.21 -4.53 0.07 0.00 0.02 0.00 0.00 46.19 41.54 2bjs s LEU 92 CO -0.02 -0.61 1.11 -0.94 0.02 0.00 0.00 176.35 175.91 2bjs s SER 93 N -2.47 4.48 -0.40 2.29 1.04 -1.24 -4.77 113.70 112.63 2bjs s SER 93 Ca 0.62 1.19 0.01 0.00 0.48 0.00 0.00 55.95 58.25 2bjs s SER 93 Cb -0.12 -1.89 0.13 0.00 0.10 0.00 0.00 66.02 64.24 2bjs s SER 93 CO 0.23 -1.96 0.21 -0.63 0.98 0.00 0.00 173.24 172.06 2bjs s ILE 94 N -3.23 1.02 0.29 -1.02 1.01 -0.37 -4.98 121.20 113.91 2bjs s ILE 94 Ca 0.61 -2.16 -0.30 0.00 0.00 0.00 0.00 60.65 58.80 2bjs s ILE 94 Cb -0.14 -1.73 -0.13 0.00 0.01 0.00 0.00 42.46 40.48 2bjs s ILE 94 CO 0.53 -0.88 1.31 -2.65 0.00 0.00 0.00 174.94 173.25 2bjs n PRO 95 N 3.88 1.97 0.00 2.79 -0.02 -1.26 -0.51 135.00 141.85 2bjs n PRO 95 Ca 0.08 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2bjs n PRO 95 Cb 0.36 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 2bjs n PRO 95 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bjs n GLY 96 N 1.46 2.29 1.09 -1.23 0.00 -1.26 -4.78 105.19 102.77 2bjs n GLY 96 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2bjs n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bjs n LYS 97 N -2.00 0.00 -3.82 1.61 4.76 0.33 -4.58 118.16 114.46 2bjs n LYS 97 Ca 0.00 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.17 2bjs n LYS 97 Cb 0.00 -0.33 -0.17 0.00 -1.84 0.00 0.00 35.03 32.69 2bjs n LYS 97 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2bjs s LYS 98 N -1.76 1.06 -0.05 1.97 2.20 0.28 -2.66 119.74 120.78 2bjs s LYS 98 Ca 0.00 -0.43 -0.17 0.00 -0.36 0.00 0.00 55.97 55.01 2bjs s LYS 98 Cb 0.00 -1.93 -0.31 0.00 -1.51 0.00 0.00 37.83 34.09 2bjs s LYS 98 CO 0.00 -0.49 0.77 0.00 -0.36 0.00 0.00 175.35 175.26 2bjs h ALA 99 N 8.18 0.02 -2.72 3.13 0.00 -1.88 -0.96 119.26 125.03 2bjs h ALA 99 Ca -0.20 -0.92 -0.51 0.00 0.00 0.00 0.00 54.91 53.27 2bjs h ALA 99 Cb 1.11 0.29 0.09 0.00 0.00 0.00 0.00 17.79 19.28 2bjs h ALA 99 CO 0.36 0.68 0.47 0.54 0.00 0.00 0.00 179.25 181.30 2bjs s VAL 100 N -2.50 2.93 0.09 0.00 0.11 -1.26 -4.56 120.40 115.20 2bjs s VAL 100 Ca -0.15 0.62 -0.08 0.00 -2.93 0.00 0.00 61.98 59.43 2bjs s VAL 100 Cb 0.03 -3.27 -0.00 0.00 -1.53 0.00 0.00 36.38 31.60 2bjs s VAL 100 CO 0.83 -0.08 0.18 -1.83 -3.33 0.00 0.00 175.10 170.87 2bjs s GLU 101 N -3.10 0.85 0.17 1.54 -1.05 -1.03 -3.71 118.70 112.37 2bjs s GLU 101 Ca 0.71 -0.98 -0.24 0.00 -0.15 0.00 0.00 54.97 54.31 2bjs s GLU 101 Cb -0.28 0.34 0.06 0.00 -0.44 0.00 0.00 34.13 33.80 2bjs s GLU 101 CO 0.32 -0.27 0.74 -1.54 0.95 0.00 0.00 175.26 175.47 2bjs s SER 102 N -2.87 -0.37 -0.11 0.83 1.04 -0.61 -0.70 113.70 110.91 2bjs s SER 102 Ca 0.06 -0.27 0.01 0.00 0.48 0.00 0.00 55.95 56.22 2bjs s SER 102 Cb 0.05 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.78 2bjs s SER 102 CO -0.10 -1.03 -0.13 0.12 0.98 0.00 0.00 173.24 173.07 2bjs s PHE 103 N -3.63 1.78 -0.07 5.02 5.36 -0.80 -0.36 117.98 125.27 2bjs s PHE 103 Ca 0.07 -0.84 0.02 0.00 -0.96 0.00 0.00 56.93 55.21 2bjs s PHE 103 Cb -0.03 -1.33 -0.03 0.00 -0.34 0.00 0.00 43.02 41.30 2bjs s PHE 103 CO -0.03 -0.47 -0.11 0.00 -1.46 0.00 0.00 175.22 173.15 2bjs s TYR 105 N -0.55 0.67 0.13 0.00 1.13 -0.66 -1.18 117.35 116.87 2bjs s TYR 105 Ca 0.08 -0.72 0.01 0.00 -1.41 0.00 0.00 57.07 55.03 2bjs s TYR 105 Cb -0.12 -0.41 0.01 0.00 -1.10 0.00 0.00 41.96 40.35 2bjs s TYR 105 CO 0.02 -0.16 0.10 1.28 -2.51 0.00 0.00 175.55 174.27 2bjs n LEU 106 N 0.78 0.00 -4.69 -3.49 4.77 -1.26 -1.38 117.00 111.74 2bjs n LEU 106 Ca -0.18 -0.67 -0.55 0.00 -0.03 0.00 0.00 56.01 54.57 2bjs n LEU 106 Cb 0.58 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.59 2bjs n LEU 106 CO 0.25 -0.34 1.27 -3.20 -1.33 0.00 0.00 177.39 174.04 2bjs n ASN 107 N -1.98 2.40 0.33 -1.43 2.85 -1.24 -4.84 115.26 111.34 2bjs n ASN 107 Ca -0.00 1.07 0.22 0.00 -0.11 0.00 0.00 54.58 55.76 2bjs n ASN 107 Cb 0.15 -1.18 1.15 0.00 1.24 0.00 0.00 39.78 41.14 2bjs n ASN 107 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2bjs h PRO 108 N 6.96 0.00 0.00 1.20 0.11 -1.94 -1.35 132.00 136.98 2bjs h PRO 108 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2bjs h PRO 108 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2bjs h PRO 108 CO 0.93 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.81 2bjs n ASN 109 N -3.10 0.00 -4.57 -2.05 3.02 -1.26 -4.37 115.26 102.93 2bjs n ASN 109 Ca -0.03 -0.01 -0.43 0.00 -0.03 0.00 0.00 54.58 54.09 2bjs n ASN 109 Cb 0.10 -0.30 -0.00 0.00 -0.61 0.00 0.00 39.78 38.96 2bjs n ASN 109 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2bjs s PHE 110 N -2.61 2.81 0.51 3.10 0.08 -0.51 -4.76 117.98 116.62 2bjs s PHE 110 Ca 0.22 -1.59 0.05 0.00 0.12 0.00 0.00 56.93 55.72 2bjs s PHE 110 Cb 0.16 -4.72 0.04 0.00 -0.57 0.00 0.00 43.02 37.93 2bjs s PHE 110 CO 0.37 -1.79 0.71 0.95 -0.10 0.00 0.00 175.22 175.36 2bjs s THR 111 N 4.09 2.70 0.44 0.64 -4.23 -1.26 -4.18 115.64 113.83 2bjs s THR 111 Ca 0.52 -0.83 0.14 0.00 -1.18 0.00 0.00 61.69 60.34 2bjs s THR 111 Cb 0.03 -2.86 0.32 0.00 1.34 0.00 0.00 72.50 71.33 2bjs s THR 111 CO 0.06 0.00 2.00 -0.65 -0.54 0.00 0.00 174.62 175.48 2bjs h PRO 112 N 0.26 0.38 -0.01 3.99 0.11 -1.98 -0.65 132.00 134.11 2bjs h PRO 112 Ca -0.39 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2bjs h PRO 112 Cb 1.29 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2bjs h PRO 112 CO 0.47 0.25 -0.09 -0.40 -0.21 0.00 0.00 178.00 178.02 2bjs n ASP 113 N -4.47 0.90 -4.75 -2.05 5.75 -1.26 -4.28 116.55 106.40 2bjs n ASP 113 Ca 0.08 -1.02 -0.41 0.00 -0.01 0.00 0.00 54.79 53.43 2bjs n ASP 113 Cb 0.33 0.01 -0.02 0.00 -1.03 0.00 0.00 41.12 40.42 2bjs n ASP 113 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 2bjs s HIS 114 N -2.26 2.95 0.46 2.11 2.46 -0.25 -4.82 115.29 115.94 2bjs s HIS 114 Ca 0.33 1.03 0.15 0.00 0.47 0.00 0.00 55.06 57.04 2bjs s HIS 114 Cb 0.20 -3.86 1.11 0.00 -0.13 0.00 0.00 32.58 29.90 2bjs s HIS 114 CO 0.42 -2.76 2.04 -1.35 -2.47 0.00 0.00 174.74 170.62 2bjs h PRO 115 N 4.74 0.27 0.00 2.88 0.11 -1.91 0.09 132.00 138.18 2bjs h PRO 115 Ca -0.47 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.52 2bjs h PRO 115 Cb 1.22 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2bjs h PRO 115 CO 0.76 0.18 -0.53 0.00 -0.21 0.00 0.00 178.00 178.20 2bjs h ARG 116 N 0.28 0.00 -0.13 1.05 2.47 -1.95 -1.23 114.38 114.88 2bjs h ARG 116 Ca 0.18 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.82 2bjs h ARG 116 Cb 0.36 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.68 2bjs h ARG 116 CO -0.04 0.53 -0.25 0.82 0.56 0.00 0.00 179.97 181.59 2bjs h ILE 117 N 0.00 1.37 -0.71 2.04 1.08 -1.55 -0.96 117.51 118.78 2bjs h ILE 117 Ca -0.01 -1.52 0.05 0.00 -0.39 0.00 0.00 64.86 63.00 2bjs h ILE 117 Cb 1.30 2.05 -0.05 0.00 -3.07 0.00 0.00 36.82 37.05 2bjs h ILE 117 CO 0.07 0.45 0.42 1.56 -0.69 0.00 0.00 178.15 179.96 2bjs h GLN 118 N -0.02 0.76 0.00 2.37 1.08 -1.01 -1.54 115.11 116.76 2bjs h GLN 118 Ca 0.00 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2bjs h GLN 118 Cb 0.84 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 28.10 2bjs h GLN 118 CO 0.06 0.50 0.00 0.00 -0.95 0.00 0.00 178.83 178.44 2bjs n ALA 119 N -2.34 2.17 -3.54 3.87 0.00 -0.47 -4.91 120.51 115.29 2bjs n ALA 119 Ca 0.09 -0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.21 2bjs n ALA 119 Cb 0.15 -1.40 0.08 0.00 0.00 0.00 0.00 19.45 18.28 2bjs n ALA 119 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2bjs n LYS 120 N -1.44 -7.55 -2.20 0.00 4.76 -0.58 -4.94 118.16 106.21 2bjs n LYS 120 Ca 0.08 0.81 -0.41 0.00 -2.87 0.00 0.00 58.31 55.91 2bjs n LYS 120 Cb 0.26 -5.78 -0.03 0.00 -1.84 0.00 0.00 35.03 27.65 2bjs n LYS 120 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2bjs s THR 121 N -3.32 3.15 0.54 -0.18 2.01 -0.42 -4.94 115.64 112.49 2bjs s THR 121 Ca 0.48 0.95 -0.20 0.00 0.31 0.00 0.00 61.69 63.24 2bjs s THR 121 Cb -0.21 -3.61 -0.08 0.00 0.01 0.00 0.00 72.50 68.61 2bjs s THR 121 CO 0.71 0.14 0.77 -2.65 -0.69 0.00 0.00 174.62 172.90 2bjs n PRO 122 N 2.58 0.80 -0.44 4.92 -0.02 -1.26 -2.50 135.00 139.08 2bjs n PRO 122 Ca 0.06 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 2bjs n PRO 122 Cb 0.43 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 2bjs n PRO 122 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2bjs n THR 123 N -1.43 0.00 -3.91 3.45 -2.24 -1.26 -5.01 114.28 103.88 2bjs n THR 123 Ca 0.12 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.55 2bjs n THR 123 Cb 0.45 -0.07 -0.09 0.00 -2.10 0.00 0.00 70.33 68.53 2bjs n THR 123 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2bjs s HIS 124 N -2.84 3.31 0.05 4.78 3.76 -1.04 -5.03 115.29 118.27 2bjs s HIS 124 Ca 0.00 0.16 -0.07 0.00 -0.15 0.00 0.00 55.06 55.00 2bjs s HIS 124 Cb 0.00 -2.10 -0.01 0.00 1.11 0.00 0.00 32.58 31.58 2bjs s HIS 124 CO 0.00 0.21 0.13 -1.21 -0.85 0.00 0.00 174.74 173.02 2bjs s GLU 125 N 0.35 0.68 -0.09 1.40 2.02 -1.26 -4.82 118.70 116.98 2bjs s GLU 125 Ca 0.05 -0.81 -0.27 0.00 0.02 0.00 0.00 54.97 53.96 2bjs s GLU 125 Cb -0.12 0.27 -0.02 0.00 0.10 0.00 0.00 34.13 34.36 2bjs s GLU 125 CO -0.01 -0.19 0.87 0.08 0.02 0.00 0.00 175.26 176.03 2bjs s VAL 126 N -3.01 4.90 0.65 2.63 1.01 -1.26 -4.80 120.40 120.52 2bjs s VAL 126 Ca -0.02 1.76 -0.18 0.00 0.00 0.00 0.00 61.98 63.55 2bjs s VAL 126 Cb 0.01 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 2bjs s VAL 126 CO -0.06 0.11 1.22 0.59 0.00 0.00 0.00 175.10 176.95 2bjs n ASN 127 N 4.52 1.72 -4.58 3.32 3.02 -1.26 -4.98 115.26 117.02 2bjs n ASN 127 Ca 0.04 0.81 -0.32 0.00 -0.03 0.00 0.00 54.58 55.07 2bjs n ASN 127 Cb 0.50 -1.52 -0.11 0.00 -0.61 0.00 0.00 39.78 38.04 2bjs n ASN 127 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2bjs s VAL 128 N -1.46 3.56 0.04 2.41 -7.23 -1.26 -5.11 120.40 111.35 2bjs s VAL 128 Ca 0.81 -0.77 0.03 0.00 -1.81 0.00 0.00 61.98 60.24 2bjs s VAL 128 Cb -0.38 -2.53 -0.02 0.00 0.56 0.00 0.00 36.38 34.01 2bjs s VAL 128 CO 0.42 0.42 -0.09 0.26 -0.31 0.00 0.00 175.10 175.80 2bjs s TRP 129 N -0.96 0.77 1.02 2.82 0.52 -1.26 -4.81 118.94 117.04 2bjs s TRP 129 Ca 0.16 -0.39 -0.12 0.00 0.02 0.00 0.00 56.10 55.77 2bjs s TRP 129 Cb -0.11 -0.46 0.20 0.00 -1.15 0.00 0.00 33.47 31.95 2bjs s TRP 129 CO 0.06 -0.04 1.08 -1.25 0.02 0.00 0.00 176.95 176.82 2bjs s PRO 130 N -1.23 0.23 0.22 4.98 0.04 -1.26 -4.94 135.00 133.03 2bjs s PRO 130 Ca -0.05 0.73 -0.31 0.00 0.04 0.00 0.00 61.00 61.41 2bjs s PRO 130 Cb -0.08 -1.70 -0.11 0.00 0.04 0.00 0.00 34.50 32.65 2bjs s PRO 130 CO 0.01 -2.92 1.64 -0.51 0.04 0.00 0.00 177.00 175.25 2bjs s ASP 131 N -3.13 6.45 0.27 6.66 1.01 -1.26 -4.90 116.67 121.76 2bjs s ASP 131 Ca 0.66 2.81 -0.04 0.00 0.71 0.00 0.00 52.55 56.69 2bjs s ASP 131 Cb -0.21 -2.61 0.34 0.00 1.01 0.00 0.00 42.92 41.46 2bjs s ASP 131 CO 0.60 -0.91 1.93 -0.08 0.21 0.00 0.00 175.17 176.92 2bjs h GLU 132 N 6.28 1.19 0.00 8.23 4.57 -1.92 -1.72 114.58 131.21 2bjs h GLU 132 Ca -0.44 -0.09 -0.06 0.00 -1.18 0.00 0.00 59.36 57.59 2bjs h GLU 132 Cb 1.21 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 29.53 2bjs h GLU 132 CO 0.90 0.81 -0.27 1.79 -1.18 0.00 0.00 179.01 181.06 2bjs h THR 133 N 1.21 1.12 0.00 0.32 1.35 -1.99 -2.12 112.91 112.81 2bjs h THR 133 Ca 0.32 -0.96 -0.20 0.00 -0.55 0.00 0.00 66.41 65.02 2bjs h THR 133 Cb -0.10 1.53 -0.03 0.00 -1.73 0.00 0.00 68.15 67.82 2bjs h THR 133 CO -0.06 0.27 -0.98 0.11 -0.25 0.00 0.00 175.52 174.60 2bjs h LYS 134 N 0.00 0.00 -2.11 4.72 1.57 -1.82 -3.38 116.57 115.55 2bjs h LYS 134 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 2bjs h LYS 134 Cb 0.51 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.41 2bjs h LYS 134 CO 0.04 0.87 -0.86 0.72 -0.57 0.00 0.00 179.45 179.65 2bjs n HIS 135 N -3.30 1.87 -1.82 -1.35 8.25 -0.70 -5.03 115.22 113.14 2bjs n HIS 135 Ca -0.01 -3.88 -0.42 0.00 -0.26 0.00 0.00 57.72 53.15 2bjs n HIS 135 Cb 0.91 -0.46 -0.02 0.00 1.12 0.00 0.00 29.99 31.54 2bjs n HIS 135 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 2bjs s PRO 136 N -2.19 4.15 0.00 -0.41 0.01 -0.82 -1.70 135.00 134.04 2bjs s PRO 136 Ca 0.40 2.52 0.00 0.00 0.01 0.00 0.00 61.00 63.93 2bjs s PRO 136 Cb 0.21 -3.06 0.00 0.00 0.01 0.00 0.00 34.50 31.65 2bjs s PRO 136 CO -0.07 -0.63 0.00 0.41 0.01 0.00 0.00 177.00 176.72 2bjs n GLY 137 N 2.80 2.96 0.08 0.52 0.00 -1.26 -4.91 105.19 105.37 2bjs n GLY 137 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2bjs n GLY 137 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2bjs h PHE 138 N 0.00 -0.09 -0.31 1.61 3.57 -1.69 -0.66 116.94 119.37 2bjs h PHE 138 Ca 0.00 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 2bjs h PHE 138 Cb 0.00 0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 2bjs h PHE 138 CO 0.00 0.15 0.03 0.37 -2.23 0.00 0.00 178.31 176.63 2bjs h GLN 139 N -0.33 0.13 -0.76 1.11 4.15 -1.91 0.79 115.11 118.28 2bjs h GLN 139 Ca -0.01 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 2bjs h GLN 139 Cb 0.28 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.91 2bjs h GLN 139 CO 0.02 0.08 0.37 -0.44 -1.93 0.00 0.00 178.83 176.93 2bjs h ASP 140 N 0.13 1.00 -0.16 -0.69 3.32 -1.94 -0.39 116.42 117.70 2bjs h ASP 140 Ca 0.15 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2bjs h ASP 140 Cb 0.18 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2bjs h ASP 140 CO -0.22 0.85 0.09 0.15 -1.72 0.00 0.00 179.24 178.40 2bjs h PHE 141 N 1.08 0.18 -0.66 4.55 3.57 -0.69 -1.84 116.94 123.11 2bjs h PHE 141 Ca 0.26 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.69 2bjs h PHE 141 Cb 0.12 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 2bjs h PHE 141 CO 0.01 0.11 0.11 0.00 -2.23 0.00 0.00 178.31 176.30 2bjs h ALA 142 N 1.07 0.93 -0.41 2.41 0.00 -0.51 0.19 119.26 122.94 2bjs h ALA 142 Ca 0.06 -0.27 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 2bjs h ALA 142 Cb -0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2bjs h ALA 142 CO -0.03 0.66 -0.35 0.93 0.00 0.00 0.00 179.25 180.47 2bjs h GLU 143 N 1.02 0.94 -0.83 0.00 5.08 -1.02 -1.57 114.58 118.21 2bjs h GLU 143 Ca 0.20 -0.47 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 2bjs h GLU 143 Cb 0.44 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 2bjs h GLU 143 CO 0.01 1.13 0.43 0.37 -1.00 0.00 0.00 179.01 179.96 2bjs h GLN 144 N 0.78 1.18 -0.66 2.33 5.75 -1.10 -2.60 115.11 120.80 2bjs h GLN 144 Ca 0.07 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 58.42 2bjs h GLN 144 Cb 0.94 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 29.23 2bjs h GLN 144 CO 0.09 0.88 0.42 -0.92 -2.65 0.00 0.00 178.83 176.65 2bjs h TYR 145 N 1.17 0.84 -0.46 3.99 3.20 -0.69 -0.05 116.97 124.96 2bjs h TYR 145 Ca 0.29 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.27 2bjs h TYR 145 Cb 0.07 -0.28 -0.09 0.00 1.54 0.00 0.00 36.73 37.96 2bjs h TYR 145 CO 0.01 0.54 -0.17 -0.92 -1.64 0.00 0.00 178.16 175.98 2bjs h TYR 146 N 0.89 -0.41 -0.03 -3.82 5.03 -0.92 0.12 116.97 117.83 2bjs h TYR 146 Ca 0.24 0.05 -0.13 0.00 2.58 0.00 0.00 58.73 61.47 2bjs h TYR 146 Cb -0.08 0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.44 2bjs h TYR 146 CO -0.02 -0.26 -0.57 -1.49 -1.32 0.00 0.00 178.16 174.50 2bjs h TRP 147 N -0.07 0.13 -0.20 -3.82 -0.00 -1.09 0.49 115.95 111.39 2bjs h TRP 147 Ca 0.22 -0.05 -0.02 0.00 -0.00 0.00 0.00 58.89 59.04 2bjs h TRP 147 Cb 0.41 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.16 29.54 2bjs h TRP 147 CO -0.44 0.65 0.03 -0.44 -0.00 0.00 0.00 178.44 178.23 2bjs h ASP 148 N 0.08 0.32 0.66 -3.49 3.32 -0.20 -1.56 116.42 115.55 2bjs h ASP 148 Ca -0.00 -0.26 -0.15 0.00 0.02 0.00 0.00 57.03 56.64 2bjs h ASP 148 Cb 1.03 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.47 2bjs h ASP 148 CO 0.08 0.51 -0.69 1.62 -1.72 0.00 0.00 179.24 179.04 2bjs h VAL 149 N 0.13 1.48 -0.52 -1.35 3.04 -0.95 -2.27 116.25 115.81 2bjs h VAL 149 Ca 0.06 -2.33 0.06 0.00 -1.01 0.00 0.00 66.70 63.48 2bjs h VAL 149 Cb 0.32 2.25 -0.05 0.00 -2.01 0.00 0.00 31.29 31.80 2bjs h VAL 149 CO 0.00 0.67 0.22 0.15 -1.01 0.00 0.00 177.57 177.60 2bjs h PHE 150 N 0.02 0.39 -0.49 3.17 3.04 -0.79 -0.21 116.94 122.06 2bjs h PHE 150 Ca -0.01 0.02 -0.08 0.00 3.98 0.00 0.00 57.97 61.88 2bjs h PHE 150 Cb 1.21 -0.10 -0.02 0.00 2.56 0.00 0.00 35.95 39.61 2bjs h PHE 150 CO 0.00 0.15 -0.02 0.78 -2.02 0.00 0.00 178.31 177.20 2bjs h GLY 151 N 0.42 0.96 1.00 2.40 0.00 -0.86 0.05 103.07 107.04 2bjs h GLY 151 Ca 0.24 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2bjs h GLY 151 CO -0.22 0.66 0.42 -2.00 0.00 0.00 0.00 176.54 175.41 2bjs h LEU 152 N 0.75 0.75 -0.78 3.11 5.85 -1.26 -2.57 115.31 121.16 2bjs h LEU 152 Ca 0.14 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 2bjs h LEU 152 Cb 0.55 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2bjs h LEU 152 CO 0.03 0.55 -0.09 0.28 -0.34 0.00 0.00 178.44 178.88 2bjs h SER 153 N 0.88 0.82 -0.51 1.25 0.02 -0.66 -0.37 113.55 114.98 2bjs h SER 153 Ca 0.24 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2bjs h SER 153 Cb -0.09 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 2bjs h SER 153 CO -0.05 0.93 0.31 0.28 -1.14 0.00 0.00 176.83 177.16 2bjs h SER 154 N 0.75 0.61 -0.47 3.07 0.02 -0.80 -0.15 113.55 116.58 2bjs h SER 154 Ca 0.13 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2bjs h SER 154 Cb 0.58 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 2bjs h SER 154 CO 0.04 0.48 0.26 0.00 -1.14 0.00 0.00 176.83 176.47 2bjs h ALA 155 N 1.15 0.60 -0.82 3.77 0.00 -1.03 -2.25 119.26 120.68 2bjs h ALA 155 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2bjs h ALA 155 Cb -0.01 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2bjs h ALA 155 CO -0.03 0.12 0.47 -0.07 0.00 0.00 0.00 179.25 179.74 2bjs h LEU 156 N 0.61 0.99 -1.45 0.00 3.38 -0.67 -1.86 115.31 116.31 2bjs h LEU 156 Ca 0.16 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2bjs h LEU 156 Cb 0.05 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2bjs h LEU 156 CO -0.03 0.78 -0.24 -0.07 0.09 0.00 0.00 178.44 178.97 2bjs h LEU 157 N 1.13 0.05 -0.60 1.67 3.38 -0.79 -0.46 115.31 119.69 2bjs h LEU 157 Ca 0.29 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.19 2bjs h LEU 157 Cb -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2bjs h LEU 157 CO -0.05 0.29 0.14 0.11 0.09 0.00 0.00 178.44 179.02 2bjs h LYS 158 N 0.05 0.97 -0.51 1.13 1.57 -0.75 -1.52 116.57 117.50 2bjs h LYS 158 Ca 0.01 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.49 2bjs h LYS 158 Cb 0.45 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 2bjs h LYS 158 CO 0.03 0.89 0.06 0.78 -0.57 0.00 0.00 179.45 180.65 2bjs h GLY 159 N 0.88 0.92 1.01 3.86 0.00 -0.81 -1.63 103.07 107.30 2bjs h GLY 159 Ca 0.19 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 2bjs h GLY 159 CO 0.00 0.58 0.34 -0.97 0.00 0.00 0.00 176.54 176.50 2bjs h TYR 160 N 0.73 1.01 -0.01 5.60 0.05 -1.04 -0.73 116.97 122.58 2bjs h TYR 160 Ca 0.15 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.89 2bjs h TYR 160 Cb 0.43 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.85 2bjs h TYR 160 CO 0.03 0.74 0.01 0.00 -1.05 0.00 0.00 178.16 177.89 2bjs h ALA 161 N 1.17 0.02 -0.84 3.88 0.00 -1.12 -2.18 119.26 120.18 2bjs h ALA 161 Ca 0.24 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.18 2bjs h ALA 161 Cb 0.11 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 2bjs h ALA 161 CO -0.03 -0.48 0.53 -0.07 0.00 0.00 0.00 179.25 179.20 2bjs h LEU 162 N 0.00 0.87 -1.43 0.00 3.38 -1.18 -1.16 115.31 115.80 2bjs h LEU 162 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.07 2bjs h LEU 162 Cb 0.01 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 2bjs h LEU 162 CO -0.00 0.59 0.48 0.00 0.09 0.00 0.00 178.44 179.60 2bjs h ALA 163 N 1.36 1.82 -0.34 1.53 0.00 -0.82 -2.05 119.26 120.76 2bjs h ALA 163 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2bjs h ALA 163 Cb 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2bjs h ALA 163 CO -0.13 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.43 2bjs n LEU 164 N -4.49 2.03 -0.05 0.00 4.77 -0.83 -4.90 117.00 113.53 2bjs n LEU 164 Ca 0.12 -0.98 -0.01 0.00 -0.03 0.00 0.00 56.01 55.11 2bjs n LEU 164 Cb 0.32 -0.23 -0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2bjs n LEU 164 CO 0.33 0.49 -0.01 0.61 -1.33 0.00 0.00 177.39 177.48 2bjs n GLY 165 N 1.13 0.45 3.90 -0.72 0.00 -0.77 -4.95 105.19 104.23 2bjs n GLY 165 Ca 0.14 -0.82 -0.20 0.00 0.00 0.00 0.00 46.02 45.13 2bjs n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bjs s LYS 166 N -1.62 2.72 0.63 1.61 -0.14 -0.50 -5.01 119.74 117.42 2bjs s LYS 166 Ca 0.00 -1.34 -0.15 0.00 -1.36 0.00 0.00 55.97 53.12 2bjs s LYS 166 Cb 0.00 -2.52 -0.02 0.00 -1.68 0.00 0.00 37.83 33.61 2bjs s LYS 166 CO 0.00 -0.06 1.09 -1.83 -0.76 0.00 0.00 175.35 173.79 2bjs s GLU 167 N -4.11 3.05 0.41 1.68 4.04 -1.26 -3.91 118.70 118.59 2bjs s GLU 167 Ca 0.46 1.31 0.29 0.00 0.04 0.00 0.00 54.97 57.07 2bjs s GLU 167 Cb -0.06 -1.99 1.25 0.00 0.02 0.00 0.00 34.13 33.35 2bjs s GLU 167 CO 0.28 -1.04 1.86 1.05 -1.84 0.00 0.00 175.26 175.57 2bjs h GLU 168 N 0.24 0.00 -0.59 -4.83 4.11 -1.90 -2.12 114.58 109.49 2bjs h GLU 168 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 2bjs h GLU 168 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2bjs h GLU 168 CO 0.56 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.73 2bjs n ASN 169 N -2.63 3.29 -0.18 3.06 5.03 -1.26 -4.05 115.26 118.51 2bjs n ASN 169 Ca 0.01 -2.25 -0.08 0.00 0.87 0.00 0.00 54.58 53.14 2bjs n ASN 169 Cb 0.24 -0.45 0.02 0.00 -1.02 0.00 0.00 39.78 38.56 2bjs n ASN 169 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 2bjs h PHE 170 N 2.84 0.73 0.09 3.10 3.57 -1.72 -1.03 116.94 124.52 2bjs h PHE 170 Ca 0.00 -0.03 -0.28 0.00 3.53 0.00 0.00 57.97 61.19 2bjs h PHE 170 Cb 1.00 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 2bjs h PHE 170 CO 0.50 0.55 -1.51 0.74 -2.23 0.00 0.00 178.31 176.36 2bjs h PHE 171 N 0.69 0.33 0.00 0.41 0.04 -1.83 -3.41 116.94 113.17 2bjs h PHE 171 Ca 0.18 -0.24 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 2bjs h PHE 171 Cb 0.08 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 2bjs h PHE 171 CO -0.01 1.59 -0.08 0.00 -0.60 0.00 0.00 178.31 179.21 2bjs h ALA 172 N -0.13 1.52 0.00 2.45 0.00 -1.75 -0.62 119.26 120.73 2bjs h ALA 172 Ca -0.34 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2bjs h ALA 172 Cb 1.70 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2bjs h ALA 172 CO -0.00 0.11 0.00 0.07 0.00 0.00 0.00 179.25 179.42 2bjs h ARG 173 N 0.00 0.00 -0.43 0.00 0.11 -1.42 -1.41 114.38 111.23 2bjs h ARG 173 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2bjs h ARG 173 Cb 0.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.27 2bjs h ARG 173 CO 0.01 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.80 2bjs n HIS 174 N -2.91 0.56 -3.96 4.08 8.25 -0.24 -4.78 115.22 116.21 2bjs n HIS 174 Ca -0.01 -0.28 -0.30 0.00 -0.26 0.00 0.00 57.72 56.87 2bjs n HIS 174 Cb 0.16 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.12 2bjs n HIS 174 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2bjs s PHE 175 N -1.44 3.31 0.03 4.41 5.36 -0.53 -3.12 117.98 125.99 2bjs s PHE 175 Ca 0.40 -3.09 0.05 0.00 -0.96 0.00 0.00 56.93 53.33 2bjs s PHE 175 Cb 0.23 -2.81 -0.02 0.00 -0.34 0.00 0.00 43.02 40.07 2bjs s PHE 175 CO 0.31 -0.81 -0.15 0.15 -1.46 0.00 0.00 175.22 173.26 2bjs s LYS 176 N 0.11 1.07 0.48 10.12 3.01 -1.26 -4.94 119.74 128.32 2bjs s LYS 176 Ca 0.15 -0.73 0.14 0.00 -1.01 0.00 0.00 55.97 54.52 2bjs s LYS 176 Cb -0.24 -1.08 1.12 0.00 -1.01 0.00 0.00 37.83 36.62 2bjs s LYS 176 CO -0.03 0.28 2.08 -1.35 0.51 0.00 0.00 175.35 176.84 2bjs h PRO 177 N 5.12 0.08 0.00 -1.68 0.11 -1.98 -0.96 132.00 132.69 2bjs h PRO 177 Ca -0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2bjs h PRO 177 Cb 1.17 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2bjs h PRO 177 CO 0.45 0.12 0.00 -0.44 -0.21 0.00 0.00 178.00 177.92 2bjs h ASP 178 N 0.08 0.00 0.00 -2.05 3.32 -1.98 -3.39 116.42 112.40 2bjs h ASP 178 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2bjs h ASP 178 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2bjs h ASP 178 CO 0.00 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 176.62 2bjs n ASP 179 N -3.07 0.09 -4.77 6.45 5.68 -0.96 -4.88 116.55 115.09 2bjs n ASP 179 Ca 0.02 -0.49 -0.41 0.00 -0.50 0.00 0.00 54.79 53.41 2bjs n ASP 179 Cb 0.42 0.12 -0.01 0.00 -1.14 0.00 0.00 41.12 40.51 2bjs n ASP 179 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2bjs s THR 180 N -0.12 2.04 -1.87 2.12 -1.32 -0.41 -4.43 115.64 111.66 2bjs s THR 180 Ca 0.00 0.04 0.05 0.00 -1.21 0.00 0.00 61.69 60.57 2bjs s THR 180 Cb 0.00 -3.02 0.17 0.00 -1.51 0.00 0.00 72.50 68.13 2bjs s THR 180 CO 0.00 0.01 1.10 0.18 -2.21 0.00 0.00 174.62 173.70 2bjs n LEU 181 N 1.11 1.12 -4.75 9.08 4.77 -0.50 -4.53 117.00 123.31 2bjs n LEU 181 Ca 0.04 -0.56 -0.37 0.00 -0.03 0.00 0.00 56.01 55.08 2bjs n LEU 181 Cb 0.38 -0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.34 2bjs n LEU 181 CO 0.64 0.26 0.89 0.00 -1.33 0.00 0.00 177.39 177.85 2bjs s ALA 182 N -1.72 2.67 0.09 -1.18 0.00 -1.25 -4.70 121.76 115.67 2bjs s ALA 182 Ca 0.12 1.13 0.06 0.00 0.00 0.00 0.00 51.96 53.28 2bjs s ALA 182 Cb 0.07 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 2bjs s ALA 182 CO 0.08 -1.22 -0.16 -1.54 0.00 0.00 0.00 175.76 172.92 2bjs s SER 183 N -1.33 1.93 -0.13 0.00 1.04 -1.08 -3.71 113.70 110.43 2bjs s SER 183 Ca 0.74 -0.66 -0.05 0.00 0.48 0.00 0.00 55.95 56.47 2bjs s SER 183 Cb -0.34 -0.07 -0.04 0.00 0.10 0.00 0.00 66.02 65.67 2bjs s SER 183 CO 0.39 -0.05 0.03 -0.69 0.98 0.00 0.00 173.24 173.90 2bjs s VAL 184 N -1.36 4.53 -0.13 5.02 1.01 -0.48 -1.06 120.40 127.94 2bjs s VAL 184 Ca 0.02 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.87 2bjs s VAL 184 Cb -0.09 -2.97 0.01 0.00 0.00 0.00 0.00 36.38 33.33 2bjs s VAL 184 CO 0.03 0.54 -0.20 -0.69 0.00 0.00 0.00 175.10 174.78 2bjs s VAL 185 N -0.29 1.86 -0.68 2.92 1.01 -0.68 -1.66 120.40 122.88 2bjs s VAL 185 Ca 0.07 -0.86 -0.13 0.00 0.00 0.00 0.00 61.98 61.05 2bjs s VAL 185 Cb -0.12 -1.66 0.18 0.00 0.00 0.00 0.00 36.38 34.77 2bjs s VAL 185 CO 0.02 0.51 0.61 -0.76 0.00 0.00 0.00 175.10 175.48 2bjs s LEU 186 N 0.85 6.36 -0.17 3.92 1.43 0.14 -3.07 118.68 128.14 2bjs s LEU 186 Ca -0.08 -2.32 -0.15 0.00 -1.03 0.00 0.00 54.13 50.56 2bjs s LEU 186 Cb -0.15 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 43.85 2bjs s LEU 186 CO -0.01 -0.67 0.34 -0.63 0.23 0.00 0.00 176.35 175.61 2bjs s ILE 187 N 0.76 5.27 -0.28 -0.59 1.01 -0.46 -1.91 121.20 124.99 2bjs s ILE 187 Ca 0.12 0.63 -0.11 0.00 0.00 0.00 0.00 60.65 61.28 2bjs s ILE 187 Cb -0.19 -3.68 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 2bjs s ILE 187 CO -0.04 0.35 0.19 -0.60 0.00 0.00 0.00 174.94 174.84 2bjs s ARG 188 N 0.70 3.95 -0.29 2.79 3.52 0.13 -1.89 118.95 127.85 2bjs s ARG 188 Ca 0.18 -0.32 -0.10 0.00 -0.13 0.00 0.00 55.73 55.37 2bjs s ARG 188 Cb -0.14 -3.65 -0.02 0.00 -1.56 0.00 0.00 34.95 29.58 2bjs s ARG 188 CO 0.06 -0.17 0.15 0.71 -0.81 0.00 0.00 175.30 175.23 2bjs s TYR 189 N 1.73 3.17 0.42 5.12 2.02 -0.66 -2.46 117.35 126.68 2bjs s TYR 189 Ca 0.07 -0.39 -0.09 0.00 -0.37 0.00 0.00 57.07 56.30 2bjs s TYR 189 Cb -0.16 -2.34 -0.06 0.00 -0.40 0.00 0.00 41.96 39.01 2bjs s TYR 189 CO 0.11 -0.37 0.75 -1.25 -1.57 0.00 0.00 175.55 173.22 2bjs s PRO 190 N 1.65 3.70 0.03 -1.71 0.04 -1.26 -0.85 135.00 136.59 2bjs s PRO 190 Ca 0.06 0.36 -0.30 0.00 0.04 0.00 0.00 61.00 61.16 2bjs s PRO 190 Cb -0.16 -2.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.93 2bjs s PRO 190 CO 0.07 -0.06 0.96 -0.47 0.04 0.00 0.00 177.00 177.53 2bjs s TYR 191 N -2.45 3.70 -0.02 0.56 5.04 -1.25 -4.24 117.35 118.70 2bjs s TYR 191 Ca 0.50 1.70 0.01 0.00 -2.44 0.00 0.00 57.07 56.84 2bjs s TYR 191 Cb -0.10 -3.08 0.01 0.00 0.35 0.00 0.00 41.96 39.14 2bjs s TYR 191 CO 0.35 0.06 -0.01 -0.51 -1.34 0.00 0.00 175.55 174.10 2bjs s LEU 192 N 0.68 1.53 -0.23 6.97 1.43 -1.26 -4.91 118.68 122.89 2bjs s LEU 192 Ca 0.50 -0.04 -0.03 0.00 -1.03 0.00 0.00 54.13 53.52 2bjs s LEU 192 Cb -0.22 -0.20 0.08 0.00 0.03 0.00 0.00 46.19 45.88 2bjs s LEU 192 CO 0.28 -0.04 0.08 -0.62 0.23 0.00 0.00 176.35 176.28 2bjs s ASP 193 N 0.55 3.15 0.55 2.29 2.15 -1.26 -3.01 116.67 121.09 2bjs s ASP 193 Ca -0.05 -1.04 -0.14 0.00 0.43 0.00 0.00 52.55 51.75 2bjs s ASP 193 Cb -0.08 -0.53 -0.06 0.00 -0.30 0.00 0.00 42.92 41.94 2bjs s ASP 193 CO -0.01 -0.36 0.99 -2.16 -0.17 0.00 0.00 175.17 173.45 2bjs s PRO 194 N 1.91 3.81 -0.05 4.34 0.04 -1.26 -5.14 135.00 138.66 2bjs s PRO 194 Ca 0.04 0.84 -0.23 0.00 0.04 0.00 0.00 61.00 61.69 2bjs s PRO 194 Cb -0.17 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 2bjs s PRO 194 CO -0.18 -0.36 0.68 -0.47 0.04 0.00 0.00 177.00 176.71 2bjs s TYR 195 N -2.81 3.60 -0.12 0.56 6.14 -1.16 -5.00 117.35 118.55 2bjs s TYR 195 Ca 0.57 1.24 -0.31 0.00 0.64 0.00 0.00 57.07 59.21 2bjs s TYR 195 Cb -0.10 -2.77 -0.09 0.00 0.42 0.00 0.00 41.96 39.41 2bjs s TYR 195 CO 0.40 0.14 2.05 -0.35 0.64 0.00 0.00 175.55 178.42 2bjs n PRO 196 N 3.58 2.17 0.16 4.97 -0.04 -1.26 -4.90 135.00 139.67 2bjs n PRO 196 Ca -0.02 0.73 0.12 0.00 -0.04 0.00 0.00 63.50 64.28 2bjs n PRO 196 Cb 0.51 -2.89 0.64 0.00 -0.04 0.00 0.00 33.50 31.72 2bjs n PRO 196 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2bjs h GLU 197 N 11.69 0.04 0.00 0.54 4.39 -1.93 -0.52 114.58 128.79 2bjs h GLU 197 Ca -0.44 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2bjs h GLU 197 Cb 1.26 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 2bjs h GLU 197 CO 0.96 0.02 0.00 0.00 -1.16 0.00 0.00 179.01 178.83 2bjs h ALA 198 N 1.90 1.00 -0.14 3.43 0.00 -1.82 -0.95 119.26 122.68 2bjs h ALA 198 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2bjs h ALA 198 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2bjs h ALA 198 CO -0.01 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.24 2bjs n ALA 199 N -1.91 2.50 -3.14 0.00 0.00 -0.21 -4.76 120.51 113.00 2bjs n ALA 199 Ca 0.00 -0.63 -0.36 0.00 0.00 0.00 0.00 53.44 52.46 2bjs n ALA 199 Cb 0.18 -1.01 -0.13 0.00 0.00 0.00 0.00 19.45 18.50 2bjs n ALA 199 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2bjs s ILE 200 N -1.84 4.05 0.29 0.00 1.01 -0.36 -4.69 121.20 119.66 2bjs s ILE 200 Ca 0.34 -0.27 0.04 0.00 0.00 0.00 0.00 60.65 60.77 2bjs s ILE 200 Cb 0.20 -2.87 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 2bjs s ILE 200 CO 0.30 0.39 0.43 -0.54 0.00 0.00 0.00 174.94 175.52 2bjs s LYS 201 N 1.35 3.37 -0.10 2.79 3.01 0.06 -4.92 119.74 125.31 2bjs s LYS 201 Ca 0.05 -0.70 0.03 0.00 -1.01 0.00 0.00 55.97 54.33 2bjs s LYS 201 Cb -0.15 -2.81 0.01 0.00 -1.01 0.00 0.00 37.83 33.87 2bjs s LYS 201 CO 0.02 0.27 -0.20 0.99 0.51 0.00 0.00 175.35 176.95 2bjs s THR 202 N -2.11 1.77 0.72 2.17 2.01 -1.26 0.06 115.64 119.00 2bjs s THR 202 Ca 0.38 -0.83 -0.11 0.00 0.31 0.00 0.00 61.69 61.43 2bjs s THR 202 Cb -0.09 -1.56 0.02 0.00 0.01 0.00 0.00 72.50 70.88 2bjs s THR 202 CO 0.31 0.49 1.10 0.00 -0.69 0.00 0.00 174.62 175.83 2bjs s ALA 203 N 0.62 2.77 0.46 7.40 0.00 -0.19 -4.93 121.76 127.90 2bjs s ALA 203 Ca -0.13 -0.30 0.12 0.00 0.00 0.00 0.00 51.96 51.64 2bjs s ALA 203 Cb -0.16 -3.05 1.07 0.00 0.00 0.00 0.00 23.12 20.98 2bjs s ALA 203 CO 0.04 -1.24 2.09 0.00 0.00 0.00 0.00 175.76 176.65 2bjs h ALA 204 N -0.73 1.88 -0.03 0.00 0.00 -2.01 -0.21 119.26 118.16 2bjs h ALA 204 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2bjs h ALA 204 Cb 1.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2bjs h ALA 204 CO 0.63 0.10 0.00 -0.40 0.00 0.00 0.00 179.25 179.58 2bjs n ASP 205 N -4.50 0.24 0.00 0.00 5.68 -1.26 -4.89 116.55 111.82 2bjs n ASP 205 Ca 0.01 -1.62 0.00 0.00 -0.50 0.00 0.00 54.79 52.68 2bjs n ASP 205 Cb 0.11 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.07 2bjs n ASP 205 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2bjs n GLY 206 N 0.76 0.82 3.73 6.12 0.00 -0.09 -5.04 105.19 111.49 2bjs n GLY 206 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2bjs n GLY 206 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bjs s THR 207 N -2.48 3.21 0.12 2.61 2.01 -1.26 -4.68 115.64 115.18 2bjs s THR 207 Ca 0.00 0.95 -0.30 0.00 0.31 0.00 0.00 61.69 62.65 2bjs s THR 207 Cb 0.00 -3.61 -0.06 0.00 0.01 0.00 0.00 72.50 68.84 2bjs s THR 207 CO 0.00 0.12 1.06 -0.54 -0.69 0.00 0.00 174.62 174.57 2bjs s LYS 208 N 0.30 4.59 0.10 4.92 1.02 -1.26 -1.02 119.74 128.39 2bjs s LYS 208 Ca 0.60 1.62 0.08 0.00 0.02 0.00 0.00 55.97 58.28 2bjs s LYS 208 Cb -0.37 -3.34 -0.03 0.00 -0.52 0.00 0.00 37.83 33.57 2bjs s LYS 208 CO 0.36 0.04 -0.19 -0.51 -0.92 0.00 0.00 175.35 174.13 2bjs s LEU 209 N 0.15 2.32 -0.07 3.17 1.43 0.11 -0.83 118.68 124.95 2bjs s LEU 209 Ca 0.51 -0.70 0.19 0.00 -1.03 0.00 0.00 54.13 53.10 2bjs s LEU 209 Cb -0.27 -0.80 -0.29 0.00 0.03 0.00 0.00 46.19 44.87 2bjs s LEU 209 CO 0.32 0.02 0.33 -1.20 0.23 0.00 0.00 176.35 176.04 2bjs n SER 210 N 1.01 0.42 -3.71 2.29 7.64 0.41 -0.76 113.62 120.93 2bjs n SER 210 Ca -0.19 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.57 2bjs n SER 210 Cb 0.54 1.62 -0.13 0.00 -1.01 0.00 0.00 64.21 65.24 2bjs n SER 210 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2bjs s PHE 211 N -3.11 -0.40 0.86 1.43 5.36 -1.08 -4.90 117.98 116.15 2bjs s PHE 211 Ca -0.08 0.91 -0.13 0.00 -0.96 0.00 0.00 56.93 56.67 2bjs s PHE 211 Cb 0.11 0.06 0.12 0.00 -0.34 0.00 0.00 43.02 42.96 2bjs s PHE 211 CO 0.81 -0.28 1.22 -1.21 -1.46 0.00 0.00 175.22 174.30 2bjs s GLU 212 N 1.59 1.51 0.37 10.12 0.41 -1.26 -1.35 118.70 130.08 2bjs s GLU 212 Ca -0.07 -0.04 -0.28 0.00 -0.41 0.00 0.00 54.97 54.18 2bjs s GLU 212 Cb -0.11 -1.91 -0.11 0.00 -1.78 0.00 0.00 34.13 30.22 2bjs s GLU 212 CO -0.09 -1.89 1.38 -2.67 -0.49 0.00 0.00 175.26 171.50 2bjs n TRP 213 N -3.48 2.58 -3.61 1.61 4.27 -1.26 -4.61 117.44 112.94 2bjs n TRP 213 Ca 0.10 0.50 -0.08 0.00 -3.89 0.00 0.00 57.50 54.14 2bjs n TRP 213 Cb 0.60 -2.46 -0.02 0.00 -1.36 0.00 0.00 31.31 28.07 2bjs n TRP 213 CO 0.00 0.00 0.00 -3.38 -2.29 0.00 0.00 177.69 172.02 2bjs s HIS 214 N -1.12 -0.31 0.06 -2.67 -3.43 -0.58 -4.95 115.29 102.30 2bjs s HIS 214 Ca 0.55 0.05 0.01 0.00 -0.80 0.00 0.00 55.06 54.88 2bjs s HIS 214 Cb -0.52 0.60 -0.04 0.00 -1.43 0.00 0.00 32.58 31.19 2bjs s HIS 214 CO 0.62 -0.82 0.12 -1.21 -2.00 0.00 0.00 174.74 171.46 2bjs s GLU 215 N -3.45 3.10 0.34 -0.38 2.02 -1.26 -1.80 118.70 117.26 2bjs s GLU 215 Ca 0.07 -0.57 -0.26 0.00 0.02 0.00 0.00 54.97 54.23 2bjs s GLU 215 Cb -0.02 -2.86 -0.09 0.00 0.10 0.00 0.00 34.13 31.26 2bjs s GLU 215 CO -0.04 0.60 1.04 -0.51 0.02 0.00 0.00 175.26 176.36 2bjs s ASP 216 N -2.31 7.07 -0.76 -0.19 1.01 -1.26 -4.90 116.67 115.32 2bjs s ASP 216 Ca 0.30 2.06 -0.20 0.00 0.71 0.00 0.00 52.55 55.42 2bjs s ASP 216 Cb -0.12 -2.60 0.11 0.00 1.01 0.00 0.00 42.92 41.32 2bjs s ASP 216 CO 0.22 -0.27 0.96 -0.69 0.21 0.00 0.00 175.17 175.61 2bjs s VAL 217 N -1.48 4.66 -0.03 -1.27 1.01 -1.26 -0.95 120.40 121.08 2bjs s VAL 217 Ca 0.52 -1.10 -0.31 0.00 0.00 0.00 0.00 61.98 61.09 2bjs s VAL 217 Cb -0.24 -4.67 0.12 0.00 0.00 0.00 0.00 36.38 31.59 2bjs s VAL 217 CO 0.31 -1.38 1.25 -0.94 0.00 0.00 0.00 175.10 174.33 2bjs s SER 218 N 3.57 -0.08 -0.08 3.32 1.04 -1.26 -4.92 113.70 115.28 2bjs s SER 218 Ca 0.24 -0.13 -0.06 0.00 0.48 0.00 0.00 55.95 56.47 2bjs s SER 218 Cb -0.13 0.18 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 2bjs s SER 218 CO 0.00 -0.34 0.24 0.25 0.98 0.00 0.00 173.24 174.37 2bjs h LEU 219 N 2.00 -0.13 -8.61 2.42 5.85 -1.38 -2.58 115.31 112.88 2bjs h LEU 219 Ca -0.27 -0.05 -0.28 0.00 0.84 0.00 0.00 57.88 58.11 2bjs h LEU 219 Cb 1.20 0.03 -0.15 0.00 0.37 0.00 0.00 40.66 42.12 2bjs h LEU 219 CO 0.27 0.38 -0.68 0.27 -0.34 0.00 0.00 178.44 178.34 2bjs s ILE 220 N -2.13 0.80 -0.05 4.05 -4.36 -1.24 -1.24 121.20 117.04 2bjs s ILE 220 Ca -0.03 -1.99 0.06 0.00 -0.26 0.00 0.00 60.65 58.43 2bjs s ILE 220 Cb 0.00 -1.95 -0.01 0.00 1.25 0.00 0.00 42.46 41.75 2bjs s ILE 220 CO 0.11 -0.64 -0.23 -0.89 0.24 0.00 0.00 174.94 173.54 2bjs s THR 221 N -3.57 1.90 -0.32 8.37 2.01 0.02 -0.98 115.64 123.07 2bjs s THR 221 Ca 0.19 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.23 2bjs s THR 221 Cb 0.05 -1.61 0.10 0.00 0.01 0.00 0.00 72.50 71.05 2bjs s THR 221 CO 0.01 0.53 0.06 -0.69 -0.69 0.00 0.00 174.62 173.84 2bjs s VAL 222 N -0.14 1.61 -0.12 3.82 1.01 -0.26 -2.53 120.40 123.79 2bjs s VAL 222 Ca -0.03 -1.84 0.02 0.00 0.00 0.00 0.00 61.98 60.13 2bjs s VAL 222 Cb -0.13 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 2bjs s VAL 222 CO 0.03 -0.59 -0.18 -0.22 0.00 0.00 0.00 175.10 174.14 2bjs s LEU 223 N 1.25 2.40 -0.15 3.92 2.96 -0.22 -1.16 118.68 127.69 2bjs s LEU 223 Ca 0.09 -0.46 -0.07 0.00 -0.22 0.00 0.00 54.13 53.47 2bjs s LEU 223 Cb -0.18 -1.52 -0.04 0.00 0.50 0.00 0.00 46.19 44.95 2bjs s LEU 223 CO -0.15 0.15 0.10 -0.47 -1.32 0.00 0.00 176.35 174.65 2bjs s TYR 224 N 0.45 3.39 0.07 5.38 5.04 -1.03 -0.56 117.35 130.08 2bjs s TYR 224 Ca -0.13 0.30 0.03 0.00 -2.44 0.00 0.00 57.07 54.84 2bjs s TYR 224 Cb -0.17 -2.01 -0.03 0.00 0.35 0.00 0.00 41.96 40.10 2bjs s TYR 224 CO 0.06 0.42 -0.10 -0.65 -1.34 0.00 0.00 175.55 173.94 2bjs s GLN 225 N -0.27 0.71 1.13 4.97 -0.21 -1.26 -0.52 119.66 124.21 2bjs s GLN 225 Ca 0.10 -0.96 -0.15 0.00 0.02 0.00 0.00 55.36 54.37 2bjs s GLN 225 Cb -0.12 -0.48 0.20 0.00 1.00 0.00 0.00 33.01 33.61 2bjs s GLN 225 CO 0.01 0.08 0.63 0.43 -2.12 0.00 0.00 175.29 174.32 2bjs n SER 226 N 1.05 -1.85 -3.46 5.90 7.64 -0.87 -4.18 113.62 117.85 2bjs n SER 226 Ca -0.20 -0.08 -0.40 0.00 1.01 0.00 0.00 58.87 59.21 2bjs n SER 226 Cb 0.56 -1.16 -0.01 0.00 -1.01 0.00 0.00 64.21 62.58 2bjs n SER 226 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2bjs n ASN 227 N -3.51 7.89 -3.80 6.43 4.05 -1.26 -4.74 115.26 120.33 2bjs n ASN 227 Ca 0.03 -2.93 -0.26 0.00 0.45 0.00 0.00 54.58 51.87 2bjs n ASN 227 Cb 0.57 -1.45 -0.17 0.00 1.23 0.00 0.00 39.78 39.96 2bjs n ASN 227 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2bjs s VAL 228 N 0.32 0.65 0.27 3.44 1.01 -1.26 -5.05 120.40 119.78 2bjs s VAL 228 Ca 0.58 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.93 2bjs s VAL 228 Cb 0.17 -0.93 -0.11 0.00 0.00 0.00 0.00 36.38 35.52 2bjs s VAL 228 CO -0.07 0.07 1.55 -1.58 0.00 0.00 0.00 175.10 175.06 2bjs s GLN 229 N 1.83 4.18 0.00 2.72 -0.44 -1.26 -4.83 119.66 121.86 2bjs s GLN 229 Ca 0.02 2.47 0.00 0.00 -2.50 0.00 0.00 55.36 55.35 2bjs s GLN 229 Cb -0.15 -3.06 0.00 0.00 -1.64 0.00 0.00 33.01 28.16 2bjs s GLN 229 CO -0.07 -0.56 0.00 0.27 0.50 0.00 0.00 175.29 175.43 2bjs n ASN 230 N 2.42 0.00 -4.79 6.67 0.23 -1.26 -4.96 115.26 113.57 2bjs n ASN 230 Ca 0.08 0.00 -0.36 0.00 -0.53 0.00 0.00 54.58 53.77 2bjs n ASN 230 Cb 0.38 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.02 2bjs n ASN 230 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2bjs s LEU 231 N -1.18 4.29 0.03 -4.53 1.43 -1.26 -0.88 118.68 116.57 2bjs s LEU 231 Ca 0.00 1.72 0.04 0.00 -1.03 0.00 0.00 54.13 54.86 2bjs s LEU 231 Cb 0.00 -3.99 -0.02 0.00 0.03 0.00 0.00 46.19 42.21 2bjs s LEU 231 CO 0.00 -0.09 -0.11 -1.10 0.23 0.00 0.00 176.35 175.28 2bjs s GLN 232 N -2.19 0.78 -0.07 1.70 -0.21 -0.41 -1.17 119.66 118.09 2bjs s GLN 232 Ca 0.50 -0.65 0.04 0.00 0.02 0.00 0.00 55.36 55.27 2bjs s GLN 232 Cb -0.17 -0.74 -0.02 0.00 1.00 0.00 0.00 33.01 33.09 2bjs s GLN 232 CO 0.22 0.18 -0.19 0.54 -2.12 0.00 0.00 175.29 173.92 2bjs s VAL 233 N -0.81 2.58 -0.07 1.09 0.11 -0.29 -1.46 120.40 121.54 2bjs s VAL 233 Ca -0.00 -0.88 -0.29 0.00 -2.93 0.00 0.00 61.98 57.87 2bjs s VAL 233 Cb -0.07 -1.99 -0.02 0.00 -1.53 0.00 0.00 36.38 32.77 2bjs s VAL 233 CO 0.01 0.57 0.98 -0.70 -3.33 0.00 0.00 175.10 172.63 2bjs s GLU 234 N -0.29 4.46 0.41 1.54 2.12 -0.40 -1.07 118.70 125.46 2bjs s GLU 234 Ca 0.01 1.36 0.04 0.00 0.36 0.00 0.00 54.97 56.74 2bjs s GLU 234 Cb -0.13 -3.51 -0.05 0.00 0.26 0.00 0.00 34.13 30.70 2bjs s GLU 234 CO 0.03 -0.22 0.05 0.95 -0.54 0.00 0.00 175.26 175.53 2bjs s THR 235 N 1.65 1.26 0.48 -1.70 -4.23 -0.54 -4.68 115.64 107.88 2bjs s THR 235 Ca 0.49 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 59.15 2bjs s THR 235 Cb -0.19 -2.59 0.31 0.00 1.34 0.00 0.00 72.50 71.36 2bjs s THR 235 CO 0.21 0.00 2.06 0.00 -0.54 0.00 0.00 174.62 176.35 2bjs h ALA 236 N 1.77 2.05 -0.03 3.99 0.00 -1.98 0.17 119.26 125.23 2bjs h ALA 236 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2bjs h ALA 236 Cb 1.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2bjs h ALA 236 CO 0.71 -0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.84 2bjs n ALA 237 N -2.54 2.58 0.00 0.00 0.00 -1.26 -5.02 120.51 114.27 2bjs n ALA 237 Ca 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2bjs n ALA 237 Cb 0.25 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2bjs n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bjs n GLY 238 N 0.79 -1.41 3.74 0.00 0.00 0.58 -4.96 105.19 103.94 2bjs n GLY 238 Ca 0.12 -2.18 -0.41 0.00 0.00 0.00 0.00 46.02 43.55 2bjs n GLY 238 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bjs s TYR 239 N -0.41 3.54 0.05 1.61 2.02 -1.26 -1.47 117.35 121.43 2bjs s TYR 239 Ca 0.00 1.58 0.06 0.00 -0.37 0.00 0.00 57.07 58.34 2bjs s TYR 239 Cb 0.00 -3.33 -0.02 0.00 -0.40 0.00 0.00 41.96 38.21 2bjs s TYR 239 CO 0.00 -0.77 -0.17 -0.65 -1.57 0.00 0.00 175.55 172.39 2bjs s GLN 240 N -0.67 1.09 0.07 -0.62 -0.21 -0.23 -4.58 119.66 114.51 2bjs s GLN 240 Ca 0.49 -0.88 -0.30 0.00 0.02 0.00 0.00 55.36 54.68 2bjs s GLN 240 Cb -0.31 -1.16 -0.05 0.00 1.00 0.00 0.00 33.01 32.48 2bjs s GLN 240 CO 0.37 0.29 1.13 -0.51 -2.12 0.00 0.00 175.29 174.45 2bjs s ASP 241 N -1.30 7.18 -0.27 5.90 1.01 -0.52 -1.14 116.67 127.52 2bjs s ASP 241 Ca 0.04 1.96 -0.18 0.00 0.71 0.00 0.00 52.55 55.08 2bjs s ASP 241 Cb -0.09 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.24 2bjs s ASP 241 CO 0.02 -0.38 0.51 -0.63 0.21 0.00 0.00 175.17 174.91 2bjs s ILE 242 N 0.79 5.06 0.50 0.77 1.01 -0.32 -0.39 121.20 128.62 2bjs s ILE 242 Ca 0.55 0.83 -0.21 0.00 0.00 0.00 0.00 60.65 61.83 2bjs s ILE 242 Cb -0.28 -3.84 -0.07 0.00 0.01 0.00 0.00 42.46 38.29 2bjs s ILE 242 CO 0.30 0.06 1.13 -1.61 0.00 0.00 0.00 174.94 174.82 2bjs s GLU 243 N 2.32 3.58 0.49 2.79 0.41 -1.26 -4.38 118.70 122.65 2bjs s GLU 243 Ca 0.21 1.66 -0.18 0.00 -0.41 0.00 0.00 54.97 56.24 2bjs s GLU 243 Cb -0.16 -2.19 -0.09 0.00 -1.78 0.00 0.00 34.13 29.91 2bjs s GLU 243 CO 0.10 -0.67 0.98 0.00 -0.49 0.00 0.00 175.26 175.17 2bjs s ALA 244 N -1.69 3.02 -0.33 5.21 0.00 -1.26 -5.02 121.76 121.69 2bjs s ALA 244 Ca 0.68 0.31 0.05 0.00 0.00 0.00 0.00 51.96 52.99 2bjs s ALA 244 Cb -0.25 -3.15 0.17 0.00 0.00 0.00 0.00 23.12 19.89 2bjs s ALA 244 CO 0.30 -0.15 0.50 0.34 0.00 0.00 0.00 175.76 176.74 2bjs s ASP 245 N -2.65 -0.37 0.00 0.00 -1.08 -1.26 -5.02 116.67 106.29 2bjs s ASP 245 Ca 0.61 -0.57 0.00 0.00 -0.52 0.00 0.00 52.55 52.07 2bjs s ASP 245 Cb -0.10 1.41 0.00 0.00 -1.46 0.00 0.00 42.92 42.77 2bjs s ASP 245 CO 0.24 -0.28 0.82 -0.90 0.52 0.00 0.00 175.17 175.57 2bjs n ASP 246 N 4.94 0.21 -0.00 -0.34 5.75 -1.26 -2.73 116.55 123.12 2bjs n ASP 246 Ca 0.06 -1.86 0.07 0.00 -0.01 0.00 0.00 54.79 53.06 2bjs n ASP 246 Cb 0.51 -0.11 -0.10 0.00 -1.03 0.00 0.00 41.12 40.39 2bjs n ASP 246 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2bjs n THR 247 N -0.38 0.00 -3.84 2.12 -2.24 -1.26 -4.85 114.28 103.84 2bjs n THR 247 Ca 0.00 -0.26 -0.23 0.00 -2.27 0.00 0.00 64.05 61.29 2bjs n THR 247 Cb 0.05 0.54 -0.04 0.00 -2.10 0.00 0.00 70.33 68.78 2bjs n THR 247 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2bjs s GLY 248 N -3.15 2.26 -0.19 3.38 0.00 -1.11 -4.87 107.32 103.64 2bjs s GLY 248 Ca -0.00 -1.87 -0.07 0.00 0.00 0.00 0.00 44.72 42.77 2bjs s GLY 248 CO 0.63 -1.82 0.05 -0.19 0.00 0.00 0.00 173.10 171.77 2bjs s TYR 249 N -2.57 3.17 -0.12 1.90 2.02 -0.73 -4.72 117.35 116.30 2bjs s TYR 249 Ca 0.43 -0.09 -0.27 0.00 -0.37 0.00 0.00 57.07 56.77 2bjs s TYR 249 Cb -0.00 -2.10 -0.02 0.00 -0.40 0.00 0.00 41.96 39.44 2bjs s TYR 249 CO 0.25 0.01 0.91 -1.17 -1.57 0.00 0.00 175.55 173.97 2bjs s LEU 250 N 0.65 4.23 -0.06 -1.29 2.96 0.28 -0.29 118.68 125.16 2bjs s LEU 250 Ca 0.02 1.37 0.04 0.00 -0.22 0.00 0.00 54.13 55.34 2bjs s LEU 250 Cb -0.13 -3.38 -0.02 0.00 0.50 0.00 0.00 46.19 43.15 2bjs s LEU 250 CO 0.02 -0.39 -0.17 -0.63 -1.32 0.00 0.00 176.35 173.87 2bjs s ILE 251 N 1.89 2.84 0.16 6.68 -1.09 0.16 -1.05 121.20 130.78 2bjs s ILE 251 Ca 0.44 -0.79 -0.12 0.00 -2.23 0.00 0.00 60.65 57.94 2bjs s ILE 251 Cb -0.18 -2.11 0.01 0.00 -1.58 0.00 0.00 42.46 38.60 2bjs s ILE 251 CO 0.16 0.58 0.36 0.54 -1.23 0.00 0.00 174.94 175.35 2bjs s ASN 252 N -0.46 -0.06 0.34 3.58 4.22 -1.05 -2.18 114.94 119.32 2bjs s ASN 252 Ca 0.06 -0.69 -0.21 0.00 -2.14 0.00 0.00 52.86 49.88 2bjs s ASN 252 Cb -0.12 0.47 -0.10 0.00 1.28 0.00 0.00 41.25 42.79 2bjs s ASN 252 CO 0.02 -0.92 0.85 0.00 -2.04 0.00 0.00 177.10 175.01 2bjs s GLY 254 N -1.96 1.90 0.41 0.00 0.00 -0.37 -4.05 107.32 103.24 2bjs s GLY 254 Ca 0.54 -1.91 0.29 0.00 0.00 0.00 0.00 44.72 43.63 2bjs s GLY 254 CO 0.18 -1.77 1.86 1.48 0.00 0.00 0.00 173.10 174.86 2bjs h SER 255 N 0.31 0.00 -0.27 1.64 4.64 -0.94 -1.93 113.55 117.00 2bjs h SER 255 Ca -0.31 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.86 2bjs h SER 255 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 2bjs h SER 255 CO 0.45 0.00 -0.38 0.22 -0.87 0.00 0.00 176.83 176.25 2bjs h TYR 256 N 0.00 0.96 -0.83 4.77 3.20 -1.73 -1.25 116.97 122.09 2bjs h TYR 256 Ca 0.00 -0.28 -0.02 0.00 3.14 0.00 0.00 58.73 61.57 2bjs h TYR 256 Cb 0.39 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 2bjs h TYR 256 CO 0.00 1.06 0.43 1.98 -1.64 0.00 0.00 178.16 179.99 2bjs h MET 257 N 0.66 1.17 -0.60 1.82 4.05 -1.50 -1.28 114.93 119.26 2bjs h MET 257 Ca 0.06 -0.15 0.01 0.00 -0.28 0.00 0.00 59.70 59.33 2bjs h MET 257 Cb 0.94 -0.22 -0.03 0.00 -0.80 0.00 0.00 31.60 31.49 2bjs h MET 257 CO 0.09 0.88 0.39 0.00 0.23 0.00 0.00 176.91 178.50 2bjs h ALA 258 N 1.23 0.76 0.09 0.39 0.00 -1.35 -1.56 119.26 118.82 2bjs h ALA 258 Ca 0.29 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2bjs h ALA 258 Cb 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2bjs h ALA 258 CO -0.04 0.19 -0.05 1.25 0.00 0.00 0.00 179.25 180.60 2bjs h HIS 259 N 0.80 -0.12 -0.00 0.00 6.17 -0.96 0.16 115.15 121.21 2bjs h HIS 259 Ca 0.22 -0.00 -0.04 0.00 0.71 0.00 0.00 60.37 61.26 2bjs h HIS 259 Cb -0.09 0.04 -0.01 0.00 2.52 0.00 0.00 27.41 29.88 2bjs h HIS 259 CO -0.03 -0.01 -0.18 -0.07 0.71 0.00 0.00 177.93 178.35 2bjs h LEU 260 N -0.20 0.00 -2.74 0.26 3.38 -1.02 -2.58 115.31 112.42 2bjs h LEU 260 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bjs h LEU 260 Cb 0.16 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2bjs h LEU 260 CO 0.02 0.18 0.00 0.35 0.09 0.00 0.00 178.44 179.08 2bjs n THR 261 N -4.33 0.95 -3.80 0.22 -2.24 -0.61 -0.72 114.28 103.76 2bjs n THR 261 Ca -0.02 -0.97 -0.27 0.00 -2.27 0.00 0.00 64.05 60.51 2bjs n THR 261 Cb 0.24 0.55 0.04 0.00 -2.10 0.00 0.00 70.33 69.06 2bjs n THR 261 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2bjs n ASN 262 N 1.32 -4.70 -0.53 3.42 5.15 -0.74 -1.65 115.26 117.53 2bjs n ASN 262 Ca 0.20 -0.72 -0.07 0.00 -0.60 0.00 0.00 54.58 53.40 2bjs n ASN 262 Cb 0.56 -4.23 -0.03 0.00 -0.53 0.00 0.00 39.78 35.55 2bjs n ASN 262 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2bjs n ASN 263 N -2.92 -4.71 -0.09 1.20 5.15 0.49 -4.90 115.26 109.48 2bjs n ASN 263 Ca -0.02 0.17 -0.10 0.00 -0.60 0.00 0.00 54.58 54.04 2bjs n ASN 263 Cb 0.56 -2.82 -0.02 0.00 -0.53 0.00 0.00 39.78 36.96 2bjs n ASN 263 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2bjs h TYR 264 N 0.00 0.40 -3.29 1.20 3.20 -1.56 -3.28 116.97 113.64 2bjs h TYR 264 Ca -0.14 -0.02 -0.75 0.00 3.14 0.00 0.00 58.73 60.97 2bjs h TYR 264 Cb 0.74 -0.13 -0.27 0.00 1.54 0.00 0.00 36.73 38.62 2bjs h TYR 264 CO 0.38 0.35 -0.26 0.71 -1.64 0.00 0.00 178.16 177.70 2bjs s TYR 265 N -5.78 3.40 0.62 -3.82 2.02 -1.26 -4.73 117.35 107.79 2bjs s TYR 265 Ca -0.13 -1.70 -0.17 0.00 -0.37 0.00 0.00 57.07 54.70 2bjs s TYR 265 Cb 0.09 -3.65 -0.02 0.00 -0.40 0.00 0.00 41.96 37.98 2bjs s TYR 265 CO 0.72 -1.00 1.17 0.15 -1.57 0.00 0.00 175.55 175.02 2bjs s LYS 266 N 1.23 2.89 -0.52 -0.62 1.02 -1.24 -3.34 119.74 119.17 2bjs s LYS 266 Ca 0.07 1.67 -0.27 0.00 0.02 0.00 0.00 55.97 57.46 2bjs s LYS 266 Cb -0.25 -1.94 0.03 0.00 -0.52 0.00 0.00 37.83 35.15 2bjs s LYS 266 CO -0.00 -1.23 1.05 0.00 -0.92 0.00 0.00 175.35 174.25 2bjs s ALA 267 N -1.86 3.13 0.41 5.17 0.00 -1.26 -4.61 121.76 122.74 2bjs s ALA 267 Ca 0.74 -0.82 -0.25 0.00 0.00 0.00 0.00 51.96 51.62 2bjs s ALA 267 Cb -0.26 -3.83 -0.08 0.00 0.00 0.00 0.00 23.12 18.94 2bjs s ALA 267 CO 0.35 -2.34 1.23 -1.25 0.00 0.00 0.00 175.76 173.75 2bjs s PRO 268 N 4.29 3.95 0.00 0.00 0.04 -1.26 -4.87 135.00 137.16 2bjs s PRO 268 Ca 0.40 1.97 -0.30 0.00 0.04 0.00 0.00 61.00 63.11 2bjs s PRO 268 Cb -0.09 -2.66 -0.03 0.00 0.04 0.00 0.00 34.50 31.75 2bjs s PRO 268 CO 0.26 -0.45 1.00 0.42 0.04 0.00 0.00 177.00 178.27 2bjs s ILE 269 N -1.36 4.80 0.19 0.56 1.01 -1.26 -4.54 121.20 120.60 2bjs s ILE 269 Ca 0.58 2.01 -0.10 0.00 0.00 0.00 0.00 60.65 63.15 2bjs s ILE 269 Cb -0.34 -4.29 -0.01 0.00 0.01 0.00 0.00 42.46 37.84 2bjs s ILE 269 CO 0.42 0.15 0.33 -1.38 0.00 0.00 0.00 174.94 174.47 2bjs s HIS 270 N 1.05 0.43 0.17 3.97 -3.43 -0.75 -1.27 115.29 115.47 2bjs s HIS 270 Ca 0.52 -0.78 -0.13 0.00 -0.80 0.00 0.00 55.06 53.87 2bjs s HIS 270 Cb -0.22 -0.02 0.01 0.00 -1.43 0.00 0.00 32.58 30.92 2bjs s HIS 270 CO 0.28 -0.79 0.39 -0.98 -2.00 0.00 0.00 174.74 171.63 2bjs s ARG 271 N -3.99 1.23 -0.22 -0.38 1.70 -0.54 -1.52 118.95 115.23 2bjs s ARG 271 Ca 0.20 -1.02 -0.02 0.00 -0.47 0.00 0.00 55.73 54.43 2bjs s ARG 271 Cb 0.02 0.44 0.01 0.00 -0.57 0.00 0.00 34.95 34.86 2bjs s ARG 271 CO 0.03 -0.48 -0.09 0.08 -1.08 0.00 0.00 175.30 173.76 2bjs s VAL 272 N -3.92 2.83 0.47 4.99 1.01 -0.46 -1.29 120.40 124.04 2bjs s VAL 272 Ca 0.13 -0.86 -0.23 0.00 0.00 0.00 0.00 61.98 61.02 2bjs s VAL 272 Cb 0.01 -2.34 -0.07 0.00 0.00 0.00 0.00 36.38 33.98 2bjs s VAL 272 CO -0.02 0.34 1.20 -0.54 0.00 0.00 0.00 175.10 176.08 2bjs s LYS 273 N 1.36 3.67 0.04 2.72 1.02 -0.06 -0.44 119.74 128.05 2bjs s LYS 273 Ca 0.03 1.87 -0.31 0.00 0.02 0.00 0.00 55.97 57.58 2bjs s LYS 273 Cb -0.15 -2.40 -0.06 0.00 -0.52 0.00 0.00 37.83 34.69 2bjs s LYS 273 CO -0.06 -0.65 1.39 -0.46 -0.92 0.00 0.00 175.35 174.65 2bjs s TRP 274 N -1.49 3.00 -0.03 3.18 -0.00 -0.01 -4.17 118.94 119.42 2bjs s TRP 274 Ca 0.64 0.87 0.00 0.00 -0.00 0.00 0.00 56.10 57.62 2bjs s TRP 274 Cb -0.31 -3.67 0.02 0.00 -0.00 0.00 0.00 33.47 29.52 2bjs s TRP 274 CO 0.38 -2.41 0.00 0.08 -0.00 0.00 0.00 176.95 175.00 2bjs s VAL 275 N 1.90 0.16 -1.24 5.86 1.01 -1.26 -4.86 120.40 121.97 2bjs s VAL 275 Ca 0.64 0.08 -0.14 0.00 0.00 0.00 0.00 61.98 62.56 2bjs s VAL 275 Cb -0.33 -0.25 0.15 0.00 0.00 0.00 0.00 36.38 35.95 2bjs s VAL 275 CO 0.28 0.13 1.56 -3.20 0.00 0.00 0.00 175.10 173.88 2bjs n ASN 276 N 4.05 5.13 -3.78 3.32 5.15 -1.26 -4.88 115.26 122.99 2bjs n ASN 276 Ca -0.26 -2.98 -0.13 0.00 -0.60 0.00 0.00 54.58 50.61 2bjs n ASN 276 Cb 0.51 -1.59 -0.11 0.00 -0.53 0.00 0.00 39.78 38.06 2bjs n ASN 276 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2bjs s ALA 277 N 1.84 -0.71 -0.28 5.20 0.00 -1.26 -4.87 121.76 121.68 2bjs s ALA 277 Ca 0.44 0.72 -0.29 0.00 0.00 0.00 0.00 51.96 52.83 2bjs s ALA 277 Cb 0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 23.12 22.73 2bjs s ALA 277 CO 0.01 -0.15 1.46 -2.00 0.00 0.00 0.00 175.76 175.08 2bjs s GLU 278 N -0.09 3.80 0.29 0.00 2.56 -1.26 -3.75 118.70 120.25 2bjs s GLU 278 Ca -0.02 1.37 -0.10 0.00 0.00 0.00 0.00 54.97 56.23 2bjs s GLU 278 Cb -0.03 -3.97 0.00 0.00 2.00 0.00 0.00 34.13 32.13 2bjs s GLU 278 CO 0.01 -1.28 0.51 -0.98 -0.56 0.00 0.00 175.26 172.96 2bjs s ARG 279 N 4.53 1.74 -0.01 4.30 1.70 -0.03 -4.90 118.95 126.29 2bjs s ARG 279 Ca 0.64 -1.45 0.06 0.00 -0.47 0.00 0.00 55.73 54.52 2bjs s ARG 279 Cb -0.20 0.48 -0.02 0.00 -0.57 0.00 0.00 34.95 34.64 2bjs s ARG 279 CO 0.27 -0.74 -0.20 -0.65 -1.08 0.00 0.00 175.30 172.90 2bjs s GLN 280 N -3.50 1.61 -0.20 3.89 -0.21 -1.26 -1.66 119.66 118.33 2bjs s GLN 280 Ca 0.25 -0.76 -0.02 0.00 0.02 0.00 0.00 55.36 54.85 2bjs s GLN 280 Cb -0.01 -1.58 0.06 0.00 1.00 0.00 0.00 33.01 32.48 2bjs s GLN 280 CO 0.13 0.43 0.01 0.45 -2.12 0.00 0.00 175.29 174.19 2bjs s SER 281 N -0.58 3.08 -0.63 5.90 0.15 -0.79 -2.04 113.70 118.78 2bjs s SER 281 Ca 0.08 -0.88 0.06 0.00 0.70 0.00 0.00 55.95 55.91 2bjs s SER 281 Cb -0.08 -0.72 0.21 0.00 -1.71 0.00 0.00 66.02 63.72 2bjs s SER 281 CO -0.00 -0.29 0.58 0.18 1.20 0.00 0.00 173.24 174.91 2bjs n LEU 282 N 4.97 2.77 -4.81 3.45 4.77 0.33 -1.36 117.00 127.12 2bjs n LEU 282 Ca -0.10 -5.19 -0.34 0.00 -0.03 0.00 0.00 56.01 50.36 2bjs n LEU 282 Cb 0.47 -0.49 -0.05 0.00 -2.33 0.00 0.00 43.42 41.01 2bjs n LEU 282 CO 0.14 1.91 0.69 -2.16 -1.33 0.00 0.00 177.39 176.64 2bjs s PRO 283 N -1.71 4.04 -0.23 3.23 0.04 -1.18 -2.47 135.00 136.74 2bjs s PRO 283 Ca 0.32 1.26 -0.01 0.00 0.04 0.00 0.00 61.00 62.62 2bjs s PRO 283 Cb 0.06 -2.19 0.02 0.00 0.04 0.00 0.00 34.50 32.43 2bjs s PRO 283 CO -0.11 -0.21 -0.11 0.12 0.04 0.00 0.00 177.00 176.74 2bjs s PHE 284 N -2.03 2.99 -0.36 0.56 5.36 -0.31 -1.69 117.98 122.50 2bjs s PHE 284 Ca 0.64 -1.58 -0.21 0.00 -0.96 0.00 0.00 56.93 54.82 2bjs s PHE 284 Cb -0.14 -2.01 0.00 0.00 -0.34 0.00 0.00 43.02 40.54 2bjs s PHE 284 CO 0.17 -0.75 0.65 -0.06 -1.46 0.00 0.00 175.22 173.77 2bjs s PHE 285 N 1.31 3.15 -0.66 10.12 0.08 -0.22 -1.10 117.98 130.65 2bjs s PHE 285 Ca 0.01 0.35 -0.26 0.00 0.12 0.00 0.00 56.93 57.15 2bjs s PHE 285 Cb -0.16 -3.16 0.04 0.00 -0.57 0.00 0.00 43.02 39.17 2bjs s PHE 285 CO -0.07 -0.64 1.17 0.08 -0.10 0.00 0.00 175.22 175.66 2bjs s VAL 286 N 2.74 3.97 0.07 -0.44 1.01 -0.16 -2.64 120.40 124.96 2bjs s VAL 286 Ca 0.25 0.39 0.06 0.00 0.00 0.00 0.00 61.98 62.67 2bjs s VAL 286 Cb -0.14 -4.79 -0.04 0.00 0.00 0.00 0.00 36.38 31.41 2bjs s VAL 286 CO 0.15 -1.58 -0.08 0.20 0.00 0.00 0.00 175.10 173.79 2bjs s ASN 287 N 3.43 4.51 0.36 3.32 0.01 -1.26 -1.01 114.94 124.29 2bjs s ASN 287 Ca 0.34 -0.30 0.00 0.00 -0.71 0.00 0.00 52.86 52.20 2bjs s ASN 287 Cb -0.10 -0.94 0.00 0.00 0.41 0.00 0.00 41.25 40.62 2bjs s ASN 287 CO 0.17 0.21 0.00 0.18 -1.51 0.00 0.00 177.10 176.15 2bjs n LEU 288 N 0.96 0.00 -4.90 0.60 4.77 -1.26 -3.78 117.00 113.39 2bjs n LEU 288 Ca -0.14 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.55 2bjs n LEU 288 Cb 0.52 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.67 2bjs n LEU 288 CO 0.33 -0.24 0.72 -0.83 -1.33 0.00 0.00 177.39 176.04 2bjs s GLY 289 N -1.85 1.62 0.26 -0.72 0.00 -1.18 -1.40 107.32 104.05 2bjs s GLY 289 Ca 0.00 -0.55 -0.05 0.00 0.00 0.00 0.00 44.72 44.12 2bjs s GLY 289 CO 0.00 -0.15 1.92 -1.82 0.00 0.00 0.00 173.10 173.05 2bjs h TYR 290 N -0.72 1.20 -0.13 1.90 3.20 -1.93 -2.21 116.97 118.27 2bjs h TYR 290 Ca -0.45 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.43 2bjs h TYR 290 Cb 1.29 -0.40 0.00 0.00 1.54 0.00 0.00 36.73 39.16 2bjs h TYR 290 CO 0.42 0.78 0.00 -0.25 -1.64 0.00 0.00 178.16 177.46 2bjs n ASP 291 N -4.37 2.57 -4.73 -2.11 8.00 -1.26 -0.98 116.55 113.66 2bjs n ASP 291 Ca 0.11 -1.84 -0.42 0.00 0.71 0.00 0.00 54.79 53.35 2bjs n ASP 291 Cb 0.04 -0.07 -0.02 0.00 -0.02 0.00 0.00 41.12 41.04 2bjs n ASP 291 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2bjs s SER 292 N -1.82 6.51 -0.05 -2.24 0.01 -0.83 -4.78 113.70 110.50 2bjs s SER 292 Ca 0.33 2.76 0.00 0.00 1.31 0.00 0.00 55.95 60.36 2bjs s SER 292 Cb 0.20 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.85 2bjs s SER 292 CO 0.31 -0.84 -0.03 -0.69 0.41 0.00 0.00 173.24 172.40 2bjs s VAL 293 N 0.56 0.47 -0.16 3.43 1.01 -1.26 -0.74 120.40 123.70 2bjs s VAL 293 Ca 0.66 -0.05 -0.05 0.00 0.00 0.00 0.00 61.98 62.55 2bjs s VAL 293 Cb -0.45 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 2bjs s VAL 293 CO 0.39 0.23 -0.01 -0.63 0.00 0.00 0.00 175.10 175.07 2bjs s ILE 294 N 1.17 4.10 0.06 2.22 1.01 -1.26 -5.08 121.20 123.42 2bjs s ILE 294 Ca -0.07 -0.28 -0.31 0.00 0.00 0.00 0.00 60.65 59.99 2bjs s ILE 294 Cb -0.14 -2.81 -0.07 0.00 0.01 0.00 0.00 42.46 39.45 2bjs s ILE 294 CO -0.01 0.48 1.51 -1.81 0.00 0.00 0.00 174.94 175.11 2bjs s ASP 295 N 0.39 6.73 0.63 3.58 1.01 -1.26 -4.66 116.67 123.09 2bjs s ASP 295 Ca -0.02 2.33 -0.19 0.00 0.71 0.00 0.00 52.55 55.38 2bjs s ASP 295 Cb -0.14 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.21 2bjs s ASP 295 CO 0.02 -0.78 1.29 -2.84 0.21 0.00 0.00 175.17 173.07 2bjs s PRO 296 N 2.18 2.66 0.27 8.23 0.02 -1.26 -5.01 135.00 142.10 2bjs s PRO 296 Ca 0.68 2.06 -0.01 0.00 0.02 0.00 0.00 61.00 63.75 2bjs s PRO 296 Cb -0.37 -1.90 -0.02 0.00 0.02 0.00 0.00 34.50 32.24 2bjs s PRO 296 CO 0.30 -1.51 0.31 -0.59 -0.33 0.00 0.00 177.00 175.17 2bjs s PHE 297 N -1.40 1.15 -0.29 6.54 -0.71 0.10 -4.39 117.98 118.98 2bjs s PHE 297 Ca 0.81 -1.32 -0.04 0.00 -1.04 0.00 0.00 56.93 55.34 2bjs s PHE 297 Cb -0.37 -0.36 0.10 0.00 -1.21 0.00 0.00 43.02 41.18 2bjs s PHE 297 CO 0.40 -0.87 0.15 0.34 -1.34 0.00 0.00 175.22 173.89 2bjs s ASP 298 N -3.21 3.30 0.00 1.98 -1.08 -0.14 -3.25 116.67 114.27 2bjs s ASP 298 Ca 0.35 -1.22 0.14 0.00 -0.52 0.00 0.00 52.55 51.30 2bjs s ASP 298 Cb 0.03 -0.24 0.80 0.00 -1.46 0.00 0.00 42.92 42.04 2bjs s ASP 298 CO 0.17 -0.43 1.27 -0.81 0.52 0.00 0.00 175.17 175.89 2bjs n PRO 299 N 5.26 0.38 0.06 4.34 -0.04 -1.26 -2.64 135.00 141.10 2bjs n PRO 299 Ca -0.06 0.03 0.12 0.00 -0.04 0.00 0.00 63.50 63.56 2bjs n PRO 299 Cb 0.43 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.57 2bjs n PRO 299 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2bjs n ARG 300 N -1.06 0.28 -3.70 0.54 1.74 -1.26 -4.96 116.66 108.25 2bjs n ARG 300 Ca 0.10 0.09 -0.36 0.00 -0.77 0.00 0.00 57.85 56.90 2bjs n ARG 300 Cb 0.06 -1.68 -0.07 0.00 -1.02 0.00 0.00 32.46 29.74 2bjs n ARG 300 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2bjs s GLU 301 N -3.16 4.01 0.29 5.56 0.41 -1.08 -5.01 118.70 119.71 2bjs s GLU 301 Ca 0.07 -0.07 -0.04 0.00 -0.41 0.00 0.00 54.97 54.52 2bjs s GLU 301 Cb 0.13 -3.35 0.57 0.00 -1.78 0.00 0.00 34.13 29.70 2bjs s GLU 301 CO 0.71 0.42 1.53 -2.30 -0.49 0.00 0.00 175.26 175.14 2bjs n PRO 302 N 3.06 -0.08 -0.22 0.39 -0.02 -1.26 -0.97 135.00 135.88 2bjs n PRO 302 Ca -0.16 1.50 0.09 0.00 -2.02 0.00 0.00 63.50 62.91 2bjs n PRO 302 Cb 0.53 -2.30 0.24 0.00 -0.02 0.00 0.00 33.50 31.95 2bjs n PRO 302 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2bjs n ASN 303 N -5.54 2.61 0.00 2.55 0.23 -1.26 -4.93 115.26 108.92 2bjs n ASN 303 Ca 0.19 -1.96 0.00 0.00 -0.53 0.00 0.00 54.58 52.28 2bjs n ASN 303 Cb 0.59 -0.30 0.00 0.00 -2.08 0.00 0.00 39.78 38.00 2bjs n ASN 303 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bjs n GLY 304 N 1.29 0.04 3.83 4.83 0.00 -0.15 -4.97 105.19 110.06 2bjs n GLY 304 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2bjs n GLY 304 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bjs s LYS 305 N -1.59 4.18 0.15 1.61 1.02 -1.26 -0.96 119.74 122.89 2bjs s LYS 305 Ca 0.00 0.88 0.09 0.00 0.02 0.00 0.00 55.97 56.96 2bjs s LYS 305 Cb 0.00 -2.57 -0.04 0.00 -0.52 0.00 0.00 37.83 34.70 2bjs s LYS 305 CO 0.00 0.21 -0.21 -1.54 -0.92 0.00 0.00 175.35 172.89 2bjs s SER 306 N -2.00 2.87 -0.44 2.83 1.04 -1.26 -4.25 113.70 112.49 2bjs s SER 306 Ca 0.52 -0.80 0.02 0.00 0.48 0.00 0.00 55.95 56.16 2bjs s SER 306 Cb -0.13 -0.18 0.49 0.00 0.10 0.00 0.00 66.02 66.30 2bjs s SER 306 CO 0.18 0.05 1.86 0.47 0.98 0.00 0.00 173.24 176.79 2bjs n ASP 307 N 0.57 4.98 -4.77 7.02 8.00 -1.26 -4.91 116.55 126.17 2bjs n ASP 307 Ca -0.15 -3.42 -0.31 0.00 0.71 0.00 0.00 54.79 51.61 2bjs n ASP 307 Cb 0.55 -0.86 -0.07 0.00 -0.02 0.00 0.00 41.12 40.72 2bjs n ASP 307 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2bjs s ARG 308 N -2.91 2.94 0.13 -1.24 0.52 -1.26 -5.12 118.95 112.02 2bjs s ARG 308 Ca 0.50 -0.61 -0.13 0.00 -0.52 0.00 0.00 55.73 54.97 2bjs s ARG 308 Cb 0.41 -2.77 -0.07 0.00 0.52 0.00 0.00 34.95 33.04 2bjs s ARG 308 CO 0.06 0.60 0.51 -1.21 0.02 0.00 0.00 175.30 175.27 2bjs s GLU 309 N -2.11 3.91 0.37 3.54 0.41 -1.26 -4.77 118.70 118.79 2bjs s GLU 309 Ca 0.27 0.40 -0.27 0.00 -0.41 0.00 0.00 54.97 54.95 2bjs s GLU 309 Cb -0.12 -2.94 -0.11 0.00 -1.78 0.00 0.00 34.13 29.18 2bjs s GLU 309 CO 0.19 0.49 1.35 -2.30 -0.49 0.00 0.00 175.26 174.50 2bjs n PRO 310 N 0.79 2.25 -4.01 0.39 -0.02 -1.26 -4.85 135.00 128.29 2bjs n PRO 310 Ca -0.06 0.79 -0.22 0.00 -2.02 0.00 0.00 63.50 61.99 2bjs n PRO 310 Cb 0.52 -2.44 -0.17 0.00 -0.02 0.00 0.00 33.50 31.39 2bjs n PRO 310 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2bjs s LEU 311 N -1.48 1.07 0.56 2.45 2.96 -1.26 -5.09 118.68 117.89 2bjs s LEU 311 Ca 0.56 -0.15 -0.18 0.00 -0.22 0.00 0.00 54.13 54.13 2bjs s LEU 311 Cb -0.53 -0.54 -0.05 0.00 0.50 0.00 0.00 46.19 45.58 2bjs s LEU 311 CO 0.62 -0.11 1.10 -0.94 -1.32 0.00 0.00 176.35 175.70 2bjs s SER 312 N 1.39 5.75 0.26 3.68 1.04 -1.26 -4.56 113.70 119.99 2bjs s SER 312 Ca -0.03 2.04 -0.00 0.00 0.48 0.00 0.00 55.95 58.44 2bjs s SER 312 Cb -0.13 -2.56 0.33 0.00 0.10 0.00 0.00 66.02 63.75 2bjs s SER 312 CO -0.03 -1.20 1.69 0.22 0.98 0.00 0.00 173.24 174.90 2bjs h TYR 313 N 0.96 0.67 -0.81 5.02 5.03 -1.06 -1.44 116.97 125.34 2bjs h TYR 313 Ca -0.49 -0.14 -0.04 0.00 2.58 0.00 0.00 58.73 60.64 2bjs h TYR 313 Cb 1.24 -0.16 -0.04 0.00 1.55 0.00 0.00 36.73 39.33 2bjs h TYR 313 CO 0.54 0.78 0.34 0.78 -1.32 0.00 0.00 178.16 179.28 2bjs h GLY 314 N 1.00 1.28 0.93 1.82 0.00 -1.20 0.51 103.07 107.42 2bjs h GLY 314 Ca 0.08 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 2bjs h GLY 314 CO 0.05 0.64 0.12 -0.55 0.00 0.00 0.00 176.54 176.80 2bjs h ASP 315 N 1.17 0.30 -0.34 0.19 3.32 -1.68 -1.50 116.42 117.88 2bjs h ASP 315 Ca 0.27 -0.11 0.06 0.00 0.02 0.00 0.00 57.03 57.27 2bjs h ASP 315 Cb 0.19 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 39.61 2bjs h ASP 315 CO -0.03 0.32 0.01 0.22 -1.72 0.00 0.00 179.24 178.05 2bjs h TYR 316 N 0.25 0.01 -0.07 4.55 3.20 -0.93 -2.09 116.97 121.89 2bjs h TYR 316 Ca 0.08 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 2bjs h TYR 316 Cb 0.10 0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.42 2bjs h TYR 316 CO -0.03 -0.05 -0.13 1.25 -1.64 0.00 0.00 178.16 177.57 2bjs h LEU 317 N 0.11 0.23 -0.66 2.82 5.85 -0.82 -0.15 115.31 122.69 2bjs h LEU 317 Ca 0.16 -0.56 0.03 0.00 0.84 0.00 0.00 57.88 58.36 2bjs h LEU 317 Cb 0.22 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 2bjs h LEU 317 CO -0.26 0.75 0.40 0.06 -0.34 0.00 0.00 178.44 179.05 2bjs h GLN 318 N -0.28 0.76 -0.53 1.25 3.07 -1.25 -1.26 115.11 116.88 2bjs h GLN 318 Ca 0.00 -0.05 -0.05 0.00 0.09 0.00 0.00 58.65 58.65 2bjs h GLN 318 Cb 0.71 -0.17 -0.02 0.00 0.08 0.00 0.00 27.48 28.08 2bjs h GLN 318 CO 0.03 0.50 0.14 -0.91 0.09 0.00 0.00 178.83 178.68 2bjs h ASN 319 N 0.79 0.79 0.20 0.06 4.21 -1.28 -3.25 115.58 117.09 2bjs h ASN 319 Ca 0.27 -0.22 -0.11 0.00 1.21 0.00 0.00 56.30 57.44 2bjs h ASN 319 Cb 0.05 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.03 2bjs h ASN 319 CO -0.12 0.81 -0.43 1.23 -1.29 0.00 0.00 177.43 177.63 2bjs h GLY 320 N 0.73 0.31 2.00 2.83 0.00 -0.56 -3.16 103.07 105.23 2bjs h GLY 320 Ca 0.17 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2bjs h GLY 320 CO -0.00 0.28 0.00 1.41 0.00 0.00 0.00 176.54 178.23 2bjs h LEU 321 N 0.24 0.00 0.00 3.11 3.38 -1.28 -3.48 115.31 117.28 2bjs h LEU 321 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2bjs h LEU 321 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2bjs h LEU 321 CO 0.07 0.00 0.00 0.52 0.09 0.00 0.00 178.44 179.12