#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abm s TYR 3 N 0.00 2.56 0.39 0.00 -0.85 -1.26 -5.09 117.35 113.10 3abm s TYR 3 Ca 0.00 -0.46 -0.27 0.00 -0.52 0.00 0.00 57.07 55.82 3abm s TYR 3 Cb 0.00 -1.56 -0.11 0.00 0.38 0.00 0.00 41.96 40.67 3abm s TYR 3 CO 0.00 0.44 1.32 -2.30 -1.52 0.00 0.00 175.55 173.48 3abm n PRO 4 N -0.99 2.13 -1.54 -3.49 -0.02 -1.26 -2.53 135.00 127.29 3abm n PRO 4 Ca -0.04 0.75 -0.17 0.00 -2.02 0.00 0.00 63.50 62.02 3abm n PRO 4 Cb 0.63 -2.41 -0.07 0.00 -0.02 0.00 0.00 33.50 31.63 3abm n PRO 4 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3abm n MET 5 N 0.28 -1.18 -1.92 -0.52 2.81 -1.26 -4.98 117.12 110.35 3abm n MET 5 Ca 0.05 1.07 -0.41 0.00 -1.81 0.00 0.00 57.70 56.60 3abm n MET 5 Cb 0.38 -5.30 -0.02 0.00 -0.71 0.00 0.00 33.22 27.58 3abm n MET 5 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 3abm s GLN 6 N -3.52 4.21 -0.18 0.03 0.74 -1.05 -4.94 119.66 114.95 3abm s GLN 6 Ca 0.00 2.42 0.07 0.00 0.05 0.00 0.00 55.36 57.90 3abm s GLN 6 Cb 0.00 -3.05 -0.16 0.00 1.10 0.00 0.00 33.01 30.90 3abm s GLN 6 CO 0.00 -0.46 -0.06 1.28 -0.55 0.00 0.00 175.29 175.50 3abm n LEU 7 N 1.58 1.54 0.00 3.68 4.77 -1.26 -5.06 117.00 122.25 3abm n LEU 7 Ca 0.05 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3abm n LEU 7 Cb 0.40 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3abm n LEU 7 CO 0.62 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.90 3abm n GLY 8 N 2.31 7.65 3.77 -0.72 0.00 -1.26 -5.11 105.19 111.82 3abm n GLY 8 Ca -0.30 -1.98 -0.36 0.00 0.00 0.00 0.00 46.02 43.38 3abm n GLY 8 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3abm s PHE 9 N 0.84 2.65 0.34 1.61 0.40 -1.26 -5.00 117.98 117.56 3abm s PHE 9 Ca 0.00 1.53 -0.26 0.00 -0.60 0.00 0.00 56.93 57.60 3abm s PHE 9 Cb 0.00 -3.37 -0.13 0.00 0.51 0.00 0.00 43.02 40.03 3abm s PHE 9 CO 0.00 -1.74 0.97 1.04 0.70 0.00 0.00 175.22 176.19 3abm n GLN 10 N -1.16 1.30 -1.65 0.44 6.02 -1.26 -4.92 117.38 116.15 3abm n GLN 10 Ca 0.11 0.46 -0.42 0.00 -0.01 0.00 0.00 57.00 57.13 3abm n GLN 10 Cb 0.50 -1.88 -0.00 0.00 1.02 0.00 0.00 30.24 29.88 3abm n GLN 10 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3abm n ASP 11 N 1.01 1.98 -4.78 1.08 10.43 -1.26 -4.85 116.55 120.16 3abm n ASP 11 Ca 0.10 1.14 -0.35 0.00 2.57 0.00 0.00 54.79 58.24 3abm n ASP 11 Cb 0.35 -1.41 -0.01 0.00 1.84 0.00 0.00 41.12 41.90 3abm n ASP 11 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3abm s ALA 12 N -1.15 2.77 0.00 2.24 0.00 -1.26 -4.77 121.76 119.58 3abm s ALA 12 Ca 0.59 0.79 0.00 0.00 0.00 0.00 0.00 51.96 53.34 3abm s ALA 12 Cb -0.59 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.19 3abm s ALA 12 CO 0.60 -0.66 0.00 2.41 0.00 0.00 0.00 175.76 178.11 3abm n THR 13 N -1.12 0.00 -4.14 0.00 -1.04 -0.33 -4.92 114.28 102.73 3abm n THR 13 Ca 0.11 -0.42 -0.15 0.00 -2.04 0.00 0.00 64.05 61.55 3abm n THR 13 Cb 0.51 1.00 -0.11 0.00 -1.82 0.00 0.00 70.33 69.91 3abm n THR 13 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3abm s SER 14 N -0.84 1.33 0.48 8.00 1.04 -1.26 -0.59 113.70 121.86 3abm s SER 14 Ca 0.00 -0.69 0.22 0.00 0.48 0.00 0.00 55.95 55.97 3abm s SER 14 Cb 0.00 0.00 1.25 0.00 0.10 0.00 0.00 66.02 67.37 3abm s SER 14 CO 0.00 -0.20 1.91 -0.65 0.98 0.00 0.00 173.24 175.28 3abm h PRO 15 N 4.01 0.20 0.12 4.02 0.11 -1.95 -2.18 132.00 136.34 3abm h PRO 15 Ca -0.38 -0.01 -0.24 0.00 0.11 0.00 0.00 66.00 65.48 3abm h PRO 15 Cb 1.19 -0.05 0.02 0.00 0.11 0.00 0.00 31.00 32.28 3abm h PRO 15 CO 0.46 0.13 -1.01 0.82 -0.21 0.00 0.00 178.00 178.19 3abm h ILE 16 N 0.21 1.38 -0.99 4.15 1.08 -1.94 -2.16 117.51 119.23 3abm h ILE 16 Ca 0.38 -2.42 0.09 0.00 -0.39 0.00 0.00 64.86 62.52 3abm h ILE 16 Cb 1.18 2.85 -0.08 0.00 -3.07 0.00 0.00 36.82 37.71 3abm h ILE 16 CO -0.08 0.72 0.63 -0.03 -0.69 0.00 0.00 178.15 178.70 3abm h MET 17 N 0.00 1.04 -0.63 2.37 4.05 -1.60 -0.92 114.93 119.25 3abm h MET 17 Ca -0.16 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.18 3abm h MET 17 Cb 1.74 -0.24 -0.03 0.00 -0.80 0.00 0.00 31.60 32.27 3abm h MET 17 CO 0.19 0.69 0.32 0.93 0.23 0.00 0.00 176.91 179.28 3abm h GLU 18 N 1.08 0.89 -0.62 0.39 5.08 -1.24 -1.88 114.58 118.27 3abm h GLU 18 Ca 0.46 -0.12 0.09 0.00 -1.00 0.00 0.00 59.36 58.79 3abm h GLU 18 Cb 0.32 -0.17 -0.07 0.00 0.50 0.00 0.00 28.75 29.33 3abm h GLU 18 CO -0.22 0.69 0.26 1.49 -1.00 0.00 0.00 179.01 180.24 3abm h GLU 19 N 0.86 0.45 -0.73 2.33 4.57 -0.93 -2.34 114.58 118.79 3abm h GLU 19 Ca 0.22 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.38 3abm h GLU 19 Cb 0.08 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.53 3abm h GLU 19 CO -0.03 0.30 0.48 -0.07 -1.18 0.00 0.00 179.01 178.51 3abm h LEU 20 N 0.47 0.84 -0.45 1.64 3.38 -0.90 -1.87 115.31 118.43 3abm h LEU 20 Ca 0.31 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.31 3abm h LEU 20 Cb 0.35 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 3abm h LEU 20 CO -0.28 0.61 0.15 -0.07 0.09 0.00 0.00 178.44 178.95 3abm h LEU 21 N 0.99 0.15 -0.68 1.67 3.38 -1.11 0.54 115.31 120.24 3abm h LEU 21 Ca 0.27 0.06 -0.14 0.00 0.09 0.00 0.00 57.88 58.15 3abm h LEU 21 Cb -0.11 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3abm h LEU 21 CO -0.06 0.12 -0.56 0.45 0.09 0.00 0.00 178.44 178.48 3abm h HIS 22 N 0.32 0.36 -0.41 1.13 3.86 -1.23 -1.28 115.15 117.90 3abm h HIS 22 Ca 0.21 -0.13 -0.15 0.00 -1.16 0.00 0.00 60.37 59.14 3abm h HIS 22 Cb 0.22 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 3abm h HIS 22 CO -0.16 0.78 -0.34 0.35 0.86 0.00 0.00 177.93 179.42 3abm h PHE 23 N 0.22 1.11 -0.58 2.45 3.04 -1.14 -2.23 116.94 119.81 3abm h PHE 23 Ca 0.00 -0.32 0.01 0.00 3.98 0.00 0.00 57.97 61.65 3abm h PHE 23 Cb 1.06 -0.24 -0.03 0.00 2.56 0.00 0.00 35.95 39.29 3abm h PHE 23 CO 0.02 1.14 0.38 1.25 -2.02 0.00 0.00 178.31 179.08 3abm h HIS 24 N 0.78 0.71 -0.85 0.41 2.76 -0.74 -0.33 115.15 117.88 3abm h HIS 24 Ca 0.07 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.32 3abm h HIS 24 Cb 0.93 -0.24 -0.06 0.00 1.55 0.00 0.00 27.41 29.59 3abm h HIS 24 CO 0.06 0.43 0.53 -0.44 -1.30 0.00 0.00 177.93 177.21 3abm h ASP 25 N 0.76 0.83 -0.43 3.26 3.32 -1.17 0.23 116.42 123.21 3abm h ASP 25 Ca 0.22 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.25 3abm h ASP 25 Cb -0.05 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 3abm h ASP 25 CO -0.06 0.53 0.13 -0.74 -1.72 0.00 0.00 179.24 177.37 3abm h HIS 26 N 0.96 0.70 -0.16 4.55 -0.00 -1.05 -1.94 115.15 118.20 3abm h HIS 26 Ca 0.37 -0.07 -0.20 0.00 -0.00 0.00 0.00 60.37 60.47 3abm h HIS 26 Cb 0.18 -0.20 0.01 0.00 -0.00 0.00 0.00 27.41 27.39 3abm h HIS 26 CO -0.03 0.64 -0.67 1.15 -0.00 0.00 0.00 177.93 179.02 3abm h THR 27 N 0.55 1.30 -0.04 6.26 2.02 -0.67 -2.93 112.91 119.40 3abm h THR 27 Ca 0.14 -1.89 -0.04 0.00 0.77 0.00 0.00 66.41 65.39 3abm h THR 27 Cb 0.28 2.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 3abm h THR 27 CO -0.00 0.59 -0.16 0.25 0.37 0.00 0.00 175.52 176.57 3abm h LEU 28 N 0.43 0.06 -0.42 2.58 5.85 -0.55 -1.02 115.31 122.24 3abm h LEU 28 Ca -0.04 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 3abm h LEU 28 Cb 1.30 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 3abm h LEU 28 CO 0.14 0.23 -0.04 -0.03 -0.34 0.00 0.00 178.44 178.39 3abm h MET 29 N 0.06 0.78 -0.52 1.25 4.05 -1.19 0.01 114.93 119.36 3abm h MET 29 Ca 0.01 -0.27 0.03 0.00 -0.28 0.00 0.00 59.70 59.20 3abm h MET 29 Cb 0.32 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 31.02 3abm h MET 29 CO 0.02 0.87 0.29 0.82 0.23 0.00 0.00 176.91 179.15 3abm h ILE 30 N 0.61 1.01 -0.46 1.77 2.04 -1.26 -0.89 117.51 120.33 3abm h ILE 30 Ca 0.11 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.81 3abm h ILE 30 Cb 0.55 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 3abm h ILE 30 CO 0.03 0.10 0.24 0.58 0.00 0.00 0.00 178.15 179.10 3abm h VAL 31 N 0.57 0.97 -0.12 1.67 2.07 -0.98 -1.05 116.25 119.39 3abm h VAL 31 Ca 0.22 -0.16 -0.19 0.00 0.82 0.00 0.00 66.70 67.39 3abm h VAL 31 Cb 0.08 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.31 3abm h VAL 31 CO -0.12 0.09 -0.71 -0.26 0.02 0.00 0.00 177.57 176.58 3abm h PHE 32 N 0.47 0.73 0.22 1.57 0.05 -0.76 -1.25 116.94 117.97 3abm h PHE 32 Ca 0.20 -0.31 -0.01 0.00 3.82 0.00 0.00 57.97 61.67 3abm h PHE 32 Cb 0.10 -0.12 0.00 0.00 2.00 0.00 0.00 35.95 37.93 3abm h PHE 32 CO -0.10 1.08 -0.10 1.25 -0.18 0.00 0.00 178.31 180.26 3abm h LEU 33 N 0.38 -0.25 -0.53 1.54 5.85 -0.85 -0.52 115.31 120.94 3abm h LEU 33 Ca -0.03 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 3abm h LEU 33 Cb 1.29 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.36 3abm h LEU 33 CO 0.13 0.03 0.32 0.40 -0.34 0.00 0.00 178.44 178.98 3abm h ILE 34 N -0.54 1.16 -0.16 4.05 2.04 -1.18 0.46 117.51 123.34 3abm h ILE 34 Ca -0.03 -0.35 -0.14 0.00 1.00 0.00 0.00 64.86 65.34 3abm h ILE 34 Cb 0.40 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 3abm h ILE 34 CO 0.05 0.16 -0.49 0.77 0.00 0.00 0.00 178.15 178.64 3abm h SER 35 N 0.70 0.47 0.78 1.72 4.64 -1.20 -0.77 113.55 119.90 3abm h SER 35 Ca 0.19 -0.23 -0.13 0.00 -0.47 0.00 0.00 61.79 61.15 3abm h SER 35 Cb -0.01 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 3abm h SER 35 CO -0.04 0.89 -0.60 0.77 -0.87 0.00 0.00 176.83 176.98 3abm h SER 36 N 0.35 0.00 -0.58 4.97 4.64 -0.74 -1.27 113.55 120.92 3abm h SER 36 Ca 0.02 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 3abm h SER 36 Cb 0.99 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.05 3abm h SER 36 CO 0.09 0.60 0.24 0.25 -0.87 0.00 0.00 176.83 177.13 3abm h LEU 37 N 0.00 0.79 -0.39 5.97 5.85 0.32 -1.68 115.31 126.17 3abm h LEU 37 Ca -0.01 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.51 3abm h LEU 37 Cb 1.15 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 3abm h LEU 37 CO 0.08 0.74 0.09 0.58 -0.34 0.00 0.00 178.44 179.59 3abm h VAL 38 N 0.79 1.23 -0.45 1.05 2.07 -0.98 -1.38 116.25 118.59 3abm h VAL 38 Ca 0.19 -0.80 -0.06 0.00 0.82 0.00 0.00 66.70 66.86 3abm h VAL 38 Cb 0.19 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 3abm h VAL 38 CO -0.02 0.27 0.04 0.25 0.02 0.00 0.00 177.57 178.14 3abm h LEU 39 N 0.49 0.67 0.79 2.57 5.85 -1.17 -0.77 115.31 123.75 3abm h LEU 39 Ca 0.12 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 3abm h LEU 39 Cb 0.32 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 41.18 3abm h LEU 39 CO 0.00 0.72 -0.38 0.22 -0.34 0.00 0.00 178.44 178.66 3abm h TYR 40 N 0.68 -0.98 -0.86 1.25 3.20 -1.11 -1.07 116.97 118.08 3abm h TYR 40 Ca 0.14 -0.02 0.22 0.00 3.14 0.00 0.00 58.73 62.21 3abm h TYR 40 Cb 0.36 0.32 -0.14 0.00 1.54 0.00 0.00 36.73 38.81 3abm h TYR 40 CO 0.02 -0.61 0.13 0.82 -1.64 0.00 0.00 178.16 176.88 3abm h ILE 41 N -1.20 0.27 -0.12 1.81 2.04 -1.27 0.23 117.51 119.27 3abm h ILE 41 Ca -0.11 -0.05 0.02 0.00 1.00 0.00 0.00 64.86 65.73 3abm h ILE 41 Cb 0.81 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 3abm h ILE 41 CO 0.18 0.03 -0.03 0.40 0.00 0.00 0.00 178.15 178.72 3abm h ILE 42 N 0.14 0.88 -0.03 -0.67 2.04 -1.02 0.74 117.51 119.60 3abm h ILE 42 Ca 0.52 -0.00 -0.09 0.00 1.00 0.00 0.00 64.86 66.28 3abm h ILE 42 Cb 1.01 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 3abm h ILE 42 CO -0.70 0.00 -0.43 0.77 0.00 0.00 0.00 178.15 177.79 3abm h SER 43 N 0.00 0.06 -0.06 1.72 4.64 -0.16 -2.77 113.55 116.98 3abm h SER 43 Ca 0.06 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3abm h SER 43 Cb 0.09 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3abm h SER 43 CO -0.12 0.48 0.03 0.25 -0.87 0.00 0.00 176.83 176.60 3abm h LEU 44 N 0.05 0.07 -2.07 5.97 5.85 0.23 -2.94 115.31 122.47 3abm h LEU 44 Ca 0.00 -0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.75 3abm h LEU 44 Cb 0.78 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 3abm h LEU 44 CO 0.06 0.12 0.31 0.24 -0.34 0.00 0.00 178.44 178.83 3abm h MET 45 N 0.02 0.00 -0.26 1.25 2.86 -0.61 -3.07 114.93 115.11 3abm h MET 45 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3abm h MET 45 Cb 0.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.72 3abm h MET 45 CO -0.00 0.00 0.00 1.28 1.06 0.00 0.00 176.91 179.25 3abm n LEU 46 N -4.05 2.76 -0.52 1.22 4.77 -1.10 -4.52 117.00 115.55 3abm n LEU 46 Ca 0.06 -1.57 0.06 0.00 -0.03 0.00 0.00 56.01 54.53 3abm n LEU 46 Cb 0.48 -0.17 0.19 0.00 -2.33 0.00 0.00 43.42 41.59 3abm n LEU 46 CO 0.31 0.63 0.49 0.35 -1.33 0.00 0.00 177.39 177.84 3abm n THR 47 N 0.80 2.16 -4.58 -5.08 -2.24 -1.15 -5.00 114.28 99.20 3abm n THR 47 Ca 0.12 -2.80 -0.22 0.00 -2.27 0.00 0.00 64.05 58.89 3abm n THR 47 Cb 0.42 -0.25 -0.15 0.00 -2.10 0.00 0.00 70.33 68.25 3abm n THR 47 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3abm s THR 48 N -3.10 1.02 -1.07 4.28 -1.32 -1.26 -5.02 115.64 109.16 3abm s THR 48 Ca 0.37 -0.54 0.26 0.00 -1.21 0.00 0.00 61.69 60.58 3abm s THR 48 Cb 0.34 -0.86 0.26 0.00 -1.51 0.00 0.00 72.50 70.74 3abm s THR 48 CO -0.02 0.29 1.85 0.29 -2.21 0.00 0.00 174.62 174.83 3abm n LYS 49 N 2.85 0.06 -2.12 7.08 4.76 -1.26 -4.89 118.16 124.63 3abm n LYS 49 Ca -0.15 0.05 -0.39 0.00 -2.87 0.00 0.00 58.31 54.95 3abm n LYS 49 Cb 0.55 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 32.24 3abm n LYS 49 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3abm s LEU 50 N -2.93 4.16 0.14 -0.35 1.43 -1.26 -5.04 118.68 114.83 3abm s LEU 50 Ca 0.15 2.54 0.06 0.00 -1.03 0.00 0.00 54.13 55.85 3abm s LEU 50 Cb 0.17 -4.00 -0.04 0.00 0.03 0.00 0.00 46.19 42.36 3abm s LEU 50 CO 0.47 -0.86 -0.13 0.42 0.23 0.00 0.00 176.35 176.48 3abm s THR 51 N -1.33 1.35 -0.29 5.49 -4.23 -1.26 -5.10 115.64 110.26 3abm s THR 51 Ca 0.59 -1.86 0.04 0.00 -1.18 0.00 0.00 61.69 59.28 3abm s THR 51 Cb -0.35 -1.67 0.18 0.00 1.34 0.00 0.00 72.50 72.00 3abm s THR 51 CO 0.44 -0.52 0.52 -2.28 -0.54 0.00 0.00 174.62 172.24 3abm s HIS 52 N -2.52 -1.51 -0.09 3.99 5.04 -1.26 -5.05 115.29 113.90 3abm s HIS 52 Ca 0.12 0.80 0.01 0.00 -1.54 0.00 0.00 55.06 54.46 3abm s HIS 52 Cb -0.03 0.13 0.04 0.00 0.04 0.00 0.00 32.58 32.76 3abm s HIS 52 CO 0.03 -1.04 1.03 0.25 -2.34 0.00 0.00 174.74 172.67 3abm n THR 53 N 5.39 1.03 -2.51 0.89 -2.24 -1.26 -5.01 114.28 110.56 3abm n THR 53 Ca 0.03 -1.04 -0.24 0.00 -2.27 0.00 0.00 64.05 60.53 3abm n THR 53 Cb 0.52 0.48 0.12 0.00 -2.10 0.00 0.00 70.33 69.35 3abm n THR 53 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3abm s SER 54 N -1.05 4.20 0.28 3.42 1.04 -1.26 -4.98 113.70 115.35 3abm s SER 54 Ca 0.03 -0.30 -0.30 0.00 0.48 0.00 0.00 55.95 55.86 3abm s SER 54 Cb 0.02 -0.04 -0.11 0.00 0.10 0.00 0.00 66.02 65.99 3abm s SER 54 CO 0.01 -1.97 1.62 -0.89 0.98 0.00 0.00 173.24 173.00 3abm s THR 55 N -3.23 2.04 -0.11 2.02 2.01 -1.26 -4.99 115.64 112.12 3abm s THR 55 Ca 0.67 0.03 -0.01 0.00 0.31 0.00 0.00 61.69 62.69 3abm s THR 55 Cb -0.05 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.41 3abm s THR 55 CO 0.45 0.00 -0.07 -0.04 -0.69 0.00 0.00 174.62 174.28 3abm s MET 56 N -0.29 3.19 0.02 4.92 1.00 -1.26 -5.11 119.30 121.77 3abm s MET 56 Ca 0.65 -0.57 -0.30 0.00 0.00 0.00 0.00 55.69 55.47 3abm s MET 56 Cb -0.48 -2.71 -0.05 0.00 0.00 0.00 0.00 34.83 31.59 3abm s MET 56 CO 0.46 0.43 1.21 0.34 0.00 0.00 0.00 175.02 177.46 3abm s ASP 57 N -0.18 7.06 -0.18 3.03 2.15 -1.26 -4.95 116.67 122.33 3abm s ASP 57 Ca 0.02 1.95 0.16 0.00 0.43 0.00 0.00 52.55 55.10 3abm s ASP 57 Cb -0.13 -2.57 -0.22 0.00 -0.30 0.00 0.00 42.92 39.70 3abm s ASP 57 CO 0.03 -0.52 0.05 0.00 -0.17 0.00 0.00 175.17 174.56 3abm n ALA 58 N 4.46 1.55 -2.55 3.66 0.00 -1.26 -4.78 120.51 121.58 3abm n ALA 58 Ca 0.10 -1.20 -0.42 0.00 0.00 0.00 0.00 53.44 51.92 3abm n ALA 58 Cb 0.46 -0.13 -0.02 0.00 0.00 0.00 0.00 19.45 19.76 3abm n ALA 58 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3abm s GLN 59 N -2.44 3.74 0.00 0.00 2.00 -1.26 -2.46 119.66 119.24 3abm s GLN 59 Ca -0.10 -1.52 0.00 0.00 -2.00 0.00 0.00 55.36 51.74 3abm s GLN 59 Cb 0.06 -5.44 0.00 0.00 0.80 0.00 0.00 33.01 28.43 3abm s GLN 59 CO 0.74 -2.28 0.00 -0.85 -0.50 0.00 0.00 175.29 172.40 3abm n GLU 60 N 8.65 0.00 0.18 1.67 -0.00 -1.26 -4.90 120.64 124.98 3abm n GLU 60 Ca 0.41 0.00 0.06 0.00 -0.00 0.00 0.00 57.16 57.63 3abm n GLU 60 Cb 0.49 0.00 0.18 0.00 -0.00 0.00 0.00 31.44 32.10 3abm n GLU 60 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.13 176.89 3abm h VAL 61 N 0.00 0.61 0.00 3.84 3.04 -1.84 -2.98 116.25 118.92 3abm h VAL 61 Ca 0.00 -1.68 -0.05 0.00 -1.01 0.00 0.00 66.70 63.97 3abm h VAL 61 Cb 0.00 2.16 -0.01 0.00 -2.01 0.00 0.00 31.29 31.43 3abm h VAL 61 CO 0.00 0.32 -0.22 -0.33 -1.01 0.00 0.00 177.57 176.33 3abm h GLU 62 N 0.00 0.00 -0.34 4.17 5.08 -1.83 -1.32 114.58 120.34 3abm h GLU 62 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3abm h GLU 62 Cb 1.13 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 3abm h GLU 62 CO 0.04 0.22 0.15 1.15 -1.00 0.00 0.00 179.01 179.58 3abm h THR 63 N 0.00 1.17 -0.11 1.13 2.02 -1.82 -2.66 112.91 112.64 3abm h THR 63 Ca -0.00 -0.49 -0.15 0.00 0.77 0.00 0.00 66.41 66.54 3abm h THR 63 Cb 0.71 0.87 0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3abm h THR 63 CO 0.03 0.18 -0.52 0.40 0.37 0.00 0.00 175.52 175.97 3abm h ILE 64 N 0.40 1.36 -0.24 3.11 1.08 -1.46 -0.34 117.51 121.42 3abm h ILE 64 Ca 0.11 -1.83 0.00 0.00 -0.39 0.00 0.00 64.86 62.75 3abm h ILE 64 Cb 0.14 2.17 0.00 0.00 -3.07 0.00 0.00 36.82 36.05 3abm h ILE 64 CO -0.01 0.55 0.00 -2.67 -0.69 0.00 0.00 178.15 175.33 3abm n TRP 65 N -4.21 0.80 -0.01 1.37 2.14 -0.56 -1.41 117.44 115.56 3abm n TRP 65 Ca -0.08 -0.29 -0.02 0.00 2.07 0.00 0.00 57.50 59.19 3abm n TRP 65 Cb 0.61 -0.24 -0.01 0.00 -0.81 0.00 0.00 31.31 30.86 3abm n TRP 65 CO 0.00 0.00 0.00 -2.37 2.07 0.00 0.00 177.69 177.39 3abm n THR 66 N 0.27 0.12 -0.08 -1.67 5.66 -1.01 -4.56 114.28 113.00 3abm n THR 66 Ca 0.11 -0.03 -0.12 0.00 -3.05 0.00 0.00 64.05 60.95 3abm n THR 66 Cb 0.59 -1.17 -0.05 0.00 -1.55 0.00 0.00 70.33 68.15 3abm n THR 66 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 3abm h ILE 67 N -0.05 1.31 -0.02 1.09 1.08 -0.89 -2.18 117.51 117.85 3abm h ILE 67 Ca -0.05 -1.23 0.03 0.00 -0.39 0.00 0.00 64.86 63.22 3abm h ILE 67 Cb 1.06 1.60 -0.04 0.00 -3.07 0.00 0.00 36.82 36.37 3abm h ILE 67 CO -0.02 0.38 -0.18 -0.07 -0.69 0.00 0.00 178.15 177.57 3abm h LEU 68 N 0.22 -0.52 -0.92 1.44 4.07 -1.45 -0.18 115.31 117.97 3abm h LEU 68 Ca 0.05 0.08 0.05 0.00 0.08 0.00 0.00 57.88 58.14 3abm h LEU 68 Cb 0.64 0.22 -0.06 0.00 1.08 0.00 0.00 40.66 42.55 3abm h LEU 68 CO 0.04 -0.24 0.59 -0.65 -1.08 0.00 0.00 178.44 177.10 3abm h PRO 69 N -0.28 1.07 -0.96 1.13 0.11 -1.78 -1.16 132.00 130.14 3abm h PRO 69 Ca 0.06 -0.06 0.10 0.00 0.11 0.00 0.00 66.00 66.21 3abm h PRO 69 Cb 0.36 -0.24 -0.08 0.00 0.11 0.00 0.00 31.00 31.15 3abm h PRO 69 CO -0.18 0.71 0.60 0.00 -0.21 0.00 0.00 178.00 178.92 3abm h ALA 70 N 1.40 1.41 0.02 -0.75 0.00 -0.89 -0.37 119.26 120.08 3abm h ALA 70 Ca 0.38 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.30 3abm h ALA 70 Cb 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3abm h ALA 70 CO -0.15 0.24 -0.01 0.82 0.00 0.00 0.00 179.25 180.15 3abm h ILE 71 N 0.99 1.30 -0.76 0.00 2.04 -0.01 -2.38 117.51 118.68 3abm h ILE 71 Ca 0.46 -1.04 0.17 0.00 1.00 0.00 0.00 64.86 65.46 3abm h ILE 71 Cb 0.39 1.99 -0.13 0.00 -0.74 0.00 0.00 36.82 38.33 3abm h ILE 71 CO -0.24 0.26 -0.02 0.40 0.00 0.00 0.00 178.15 178.56 3abm h ILE 72 N -0.49 0.32 -0.97 -0.67 2.04 -0.96 -0.92 117.51 115.86 3abm h ILE 72 Ca -0.00 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 65.87 3abm h ILE 72 Cb 0.46 0.23 -0.06 0.00 -0.74 0.00 0.00 36.82 36.70 3abm h ILE 72 CO 0.01 0.02 0.63 -0.07 0.00 0.00 0.00 178.15 178.73 3abm h LEU 73 N 0.09 1.03 -0.69 1.44 3.38 -0.92 -1.89 115.31 117.75 3abm h LEU 73 Ca 0.41 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.31 3abm h LEU 73 Cb 0.72 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 3abm h LEU 73 CO -0.68 0.69 0.18 0.40 0.09 0.00 0.00 178.44 179.11 3abm h ILE 74 N 1.18 1.26 0.00 1.22 2.04 -0.76 0.26 117.51 122.71 3abm h ILE 74 Ca 0.40 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 65.31 3abm h ILE 74 Cb 0.07 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3abm h ILE 74 CO -0.14 0.36 0.00 -0.07 0.00 0.00 0.00 178.15 178.31 3abm h LEU 75 N 1.03 0.00 0.02 1.44 4.07 -0.43 -2.24 115.31 119.19 3abm h LEU 75 Ca 0.22 0.00 -0.37 0.00 0.08 0.00 0.00 57.88 57.80 3abm h LEU 75 Cb 0.36 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.05 3abm h LEU 75 CO 0.00 0.00 -2.10 -0.38 -1.08 0.00 0.00 178.44 174.88 3abm n ILE 76 N -2.63 1.57 -0.26 1.22 5.41 -0.66 -4.51 119.36 119.49 3abm n ILE 76 Ca -0.01 -0.37 -0.07 0.00 1.00 0.00 0.00 62.75 63.30 3abm n ILE 76 Cb 0.13 -1.81 0.05 0.00 -0.71 0.00 0.00 39.64 37.30 3abm n ILE 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3abm h ALA 77 N -0.48 0.96 0.57 -1.39 0.00 -0.83 -2.25 119.26 115.84 3abm h ALA 77 Ca -0.54 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.11 3abm h ALA 77 Cb 1.66 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 3abm h ALA 77 CO -0.22 0.67 -0.44 -0.07 0.00 0.00 0.00 179.25 179.19 3abm h LEU 78 N 1.10 -1.17 -1.35 0.00 4.07 -1.64 0.20 115.31 116.52 3abm h LEU 78 Ca 0.23 0.08 -0.07 0.00 0.08 0.00 0.00 57.88 58.21 3abm h LEU 78 Cb 0.35 0.37 -0.01 0.00 1.08 0.00 0.00 40.66 42.45 3abm h LEU 78 CO -0.00 -0.64 -0.32 1.55 -1.08 0.00 0.00 178.44 177.95 3abm h PRO 79 N -0.99 0.01 -0.40 1.13 0.13 -1.79 -1.19 132.00 128.90 3abm h PRO 79 Ca -0.07 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 3abm h PRO 79 Cb 0.83 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.94 3abm h PRO 79 CO 0.01 0.33 0.23 1.03 -0.23 0.00 0.00 178.00 179.36 3abm h SER 80 N 0.00 0.49 1.31 1.44 0.87 -0.75 -1.67 113.55 115.25 3abm h SER 80 Ca -0.00 -0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.41 3abm h SER 80 Cb 0.57 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 3abm h SER 80 CO 0.04 0.42 -0.71 -0.07 -0.53 0.00 0.00 176.83 175.98 3abm h LEU 81 N 0.52 0.00 -0.26 2.23 3.38 -0.50 -1.73 115.31 118.94 3abm h LEU 81 Ca 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3abm h LEU 81 Cb 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3abm h LEU 81 CO -0.02 0.30 0.14 -0.09 0.09 0.00 0.00 178.44 178.85 3abm h ARG 82 N 0.00 0.37 -0.79 1.13 2.43 -1.01 -2.30 114.38 114.20 3abm h ARG 82 Ca -0.04 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.05 3abm h ARG 82 Cb 1.26 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.70 3abm h ARG 82 CO 0.03 0.34 0.35 0.82 -1.51 0.00 0.00 179.97 180.00 3abm h ILE 83 N 0.31 1.25 0.00 1.20 2.04 -1.20 -1.49 117.51 119.63 3abm h ILE 83 Ca 0.09 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.20 3abm h ILE 83 Cb 0.08 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 3abm h ILE 83 CO -0.01 0.32 -0.00 0.25 0.00 0.00 0.00 178.15 178.70 3abm h LEU 84 N 1.14 -0.00 -0.76 1.44 5.85 -1.26 -1.53 115.31 120.19 3abm h LEU 84 Ca 0.27 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.86 3abm h LEU 84 Cb 0.16 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 3abm h LEU 84 CO -0.03 0.01 -0.60 1.88 -0.34 0.00 0.00 178.44 179.36 3abm h TYR 85 N -0.01 0.00 0.33 1.25 -1.99 -1.26 -2.96 116.97 112.33 3abm h TYR 85 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3abm h TYR 85 Cb 0.01 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.71 3abm h TYR 85 CO -0.08 0.60 -0.36 1.98 -0.00 0.00 0.00 178.16 180.30 3abm h MET 86 N 0.00 -0.70 0.00 4.88 4.05 -1.03 -0.91 114.93 121.23 3abm h MET 86 Ca -0.01 0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 3abm h MET 86 Cb 1.09 0.16 0.00 0.00 -0.80 0.00 0.00 31.60 32.05 3abm h MET 86 CO 0.08 -0.46 0.05 -1.33 0.23 0.00 0.00 176.91 175.47 3abm n MET 87 N -5.46 0.00 -0.00 0.39 2.81 -0.60 -2.06 117.12 112.20 3abm n MET 87 Ca -0.09 0.42 0.07 0.00 -1.81 0.00 0.00 57.70 56.29 3abm n MET 87 Cb 0.37 -1.55 -0.09 0.00 -0.71 0.00 0.00 33.22 31.24 3abm n MET 87 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3abm n ASP 88 N -1.42 0.72 -4.75 7.83 -0.08 -0.40 -4.97 116.55 113.48 3abm n ASP 88 Ca 0.00 -0.83 -0.35 0.00 -1.51 0.00 0.00 54.79 52.10 3abm n ASP 88 Cb 0.05 1.02 0.05 0.00 2.34 0.00 0.00 41.12 44.57 3abm n ASP 88 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 3abm s GLU 89 N -2.42 2.80 0.36 -0.67 2.02 -0.87 -4.93 118.70 114.99 3abm s GLU 89 Ca 0.05 1.68 -0.26 0.00 0.02 0.00 0.00 54.97 56.45 3abm s GLU 89 Cb 0.11 -1.92 -0.12 0.00 0.10 0.00 0.00 34.13 32.30 3abm s GLU 89 CO 0.61 -1.30 1.10 -0.89 0.02 0.00 0.00 175.26 174.80 3abm n ILE 90 N -1.99 2.21 -0.35 -1.63 5.41 -1.26 -4.97 119.36 116.77 3abm n ILE 90 Ca 0.12 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.37 3abm n ILE 90 Cb 0.50 -1.26 0.00 0.00 -0.71 0.00 0.00 39.64 38.18 3abm n ILE 90 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 3abm n ASN 91 N 0.75 0.00 -2.49 4.38 2.04 -1.26 -5.10 115.26 113.57 3abm n ASN 91 Ca 0.08 -0.26 -0.06 0.00 -0.44 0.00 0.00 54.58 53.90 3abm n ASN 91 Cb 0.36 0.00 0.01 0.00 -2.53 0.00 0.00 39.78 37.62 3abm n ASN 91 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 3abm n ASN 92 N 0.00 -6.42 -4.80 0.53 3.02 -1.26 -4.98 115.26 101.36 3abm n ASN 92 Ca 0.00 0.43 -0.34 0.00 -0.03 0.00 0.00 54.58 54.64 3abm n ASN 92 Cb 0.07 -4.26 -0.01 0.00 -0.61 0.00 0.00 39.78 34.97 3abm n ASN 92 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3abm s PRO 93 N -2.15 3.48 0.11 3.52 0.04 -1.26 -4.84 135.00 133.90 3abm s PRO 93 Ca 0.18 1.33 0.24 0.00 0.04 0.00 0.00 61.00 62.78 3abm s PRO 93 Cb -0.05 -2.05 0.25 0.00 0.04 0.00 0.00 34.50 32.70 3abm s PRO 93 CO 0.57 -0.70 1.24 0.77 0.04 0.00 0.00 177.00 178.92 3abm h SER 94 N 0.94 0.00 -3.78 6.66 0.02 -1.34 -3.48 113.55 112.56 3abm h SER 94 Ca -0.48 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.20 3abm h SER 94 Cb 1.23 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.55 3abm h SER 94 CO 0.58 0.11 0.06 -0.22 -1.14 0.00 0.00 176.83 176.22 3abm s LEU 95 N -4.28 -0.64 -0.10 5.07 2.96 -1.25 -5.08 118.68 115.36 3abm s LEU 95 Ca 0.05 1.38 0.03 0.00 -0.22 0.00 0.00 54.13 55.37 3abm s LEU 95 Cb 0.13 2.31 0.00 0.00 0.50 0.00 0.00 46.19 49.13 3abm s LEU 95 CO 0.74 -0.23 -0.21 -0.89 -1.32 0.00 0.00 176.35 174.43 3abm s THR 96 N 0.62 1.90 -0.08 3.68 2.01 -1.26 -0.98 115.64 121.53 3abm s THR 96 Ca -0.02 -0.91 0.04 0.00 0.31 0.00 0.00 61.69 61.11 3abm s THR 96 Cb -0.05 -1.66 -0.01 0.00 0.01 0.00 0.00 72.50 70.79 3abm s THR 96 CO -0.03 0.52 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.53 3abm s VAL 97 N 0.51 2.49 -0.04 3.82 1.01 -0.69 -4.37 120.40 123.13 3abm s VAL 97 Ca -0.15 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 60.89 3abm s VAL 97 Cb -0.17 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 3abm s VAL 97 CO 0.06 0.56 0.17 -0.54 0.00 0.00 0.00 175.10 175.35 3abm s LYS 98 N -0.13 3.44 -0.04 2.72 1.02 -0.49 -0.64 119.74 125.62 3abm s LYS 98 Ca -0.03 -0.27 0.06 0.00 0.02 0.00 0.00 55.97 55.75 3abm s LYS 98 Cb -0.14 -3.12 -0.01 0.00 -0.52 0.00 0.00 37.83 34.04 3abm s LYS 98 CO 0.04 0.70 -0.22 -0.08 -0.92 0.00 0.00 175.35 174.87 3abm s THR 99 N -1.25 1.75 -0.16 2.17 -1.32 0.38 -1.02 115.64 116.19 3abm s THR 99 Ca 0.24 -0.92 -0.01 0.00 -1.21 0.00 0.00 61.69 59.80 3abm s THR 99 Cb -0.12 -1.48 -0.01 0.00 -1.51 0.00 0.00 72.50 69.38 3abm s THR 99 CO 0.15 0.49 -0.12 -0.04 -2.21 0.00 0.00 174.62 172.90 3abm s MET 100 N -0.24 3.32 0.33 7.08 -1.94 0.03 -2.11 119.30 125.77 3abm s MET 100 Ca 0.01 -0.69 -0.20 0.00 -1.71 0.00 0.00 55.69 53.10 3abm s MET 100 Cb -0.11 -2.72 -0.10 0.00 2.01 0.00 0.00 34.83 33.92 3abm s MET 100 CO 0.02 0.04 0.83 0.20 -0.01 0.00 0.00 175.02 176.10 3abm s GLY 101 N 0.79 2.49 0.15 -0.03 0.00 -0.30 -1.34 107.32 109.08 3abm s GLY 101 Ca -0.04 0.26 -0.03 0.00 0.00 0.00 0.00 44.72 44.90 3abm s GLY 101 CO 0.01 0.56 0.13 0.30 0.00 0.00 0.00 173.10 174.10 3abm s HIS 102 N -1.89 0.74 -0.40 1.90 3.76 -0.43 -1.25 115.29 117.73 3abm s HIS 102 Ca 0.54 -1.10 -0.23 0.00 -0.15 0.00 0.00 55.06 54.11 3abm s HIS 102 Cb -0.13 -0.36 0.02 0.00 1.11 0.00 0.00 32.58 33.22 3abm s HIS 102 CO 0.18 -0.59 0.77 -0.65 -0.85 0.00 0.00 174.74 173.60 3abm s GLN 103 N -4.03 3.60 -0.45 1.40 -0.21 -1.26 -0.41 119.66 118.30 3abm s GLN 103 Ca 0.23 0.12 0.03 0.00 0.02 0.00 0.00 55.36 55.76 3abm s GLN 103 Cb 0.06 -3.86 0.12 0.00 1.00 0.00 0.00 33.01 30.33 3abm s GLN 103 CO 0.02 -0.96 0.20 -1.58 -2.12 0.00 0.00 175.29 170.85 3abm s TRP 104 N 3.16 2.90 0.02 0.91 0.51 -1.26 -5.12 118.94 120.06 3abm s TRP 104 Ca 0.30 -2.85 -0.29 0.00 -2.12 0.00 0.00 56.10 51.14 3abm s TRP 104 Cb -0.13 -2.54 0.11 0.00 -0.81 0.00 0.00 33.47 30.10 3abm s TRP 104 CO 0.19 -0.80 1.18 1.52 -0.51 0.00 0.00 176.95 178.53 3abm s TYR 105 N 0.25 -0.08 0.06 -1.98 1.13 0.45 -4.69 117.35 112.50 3abm s TYR 105 Ca 0.15 -0.07 0.06 0.00 -1.41 0.00 0.00 57.07 55.80 3abm s TYR 105 Cb -0.24 0.57 -0.04 0.00 -1.10 0.00 0.00 41.96 41.16 3abm s TYR 105 CO -0.03 -0.43 -0.12 -1.58 -2.51 0.00 0.00 175.55 170.87 3abm s TRP 106 N -2.68 2.71 0.11 -3.49 0.52 -1.02 -1.31 118.94 113.77 3abm s TRP 106 Ca 0.13 -0.16 0.09 0.00 0.02 0.00 0.00 56.10 56.18 3abm s TRP 106 Cb 0.03 -1.49 -0.04 0.00 -1.15 0.00 0.00 33.47 30.82 3abm s TRP 106 CO -0.02 0.35 -0.21 -1.54 0.02 0.00 0.00 176.95 175.55 3abm s SER 107 N -1.73 3.68 -0.00 2.95 1.04 -0.45 0.28 113.70 119.47 3abm s SER 107 Ca 0.18 -0.59 0.07 0.00 0.48 0.00 0.00 55.95 56.08 3abm s SER 107 Cb -0.11 -0.45 -0.02 0.00 0.10 0.00 0.00 66.02 65.54 3abm s SER 107 CO 0.09 0.19 -0.22 -0.31 0.98 0.00 0.00 173.24 173.98 3abm s TYR 108 N -1.07 1.93 -0.11 5.02 2.02 0.15 -0.79 117.35 124.49 3abm s TYR 108 Ca 0.16 -0.37 0.02 0.00 -0.37 0.00 0.00 57.07 56.51 3abm s TYR 108 Cb -0.10 -1.23 0.02 0.00 -0.40 0.00 0.00 41.96 40.25 3abm s TYR 108 CO 0.08 -0.01 -0.15 -1.21 -1.57 0.00 0.00 175.55 172.69 3abm s GLU 109 N -0.64 2.20 -0.42 -0.62 2.02 -0.19 -2.19 118.70 118.86 3abm s GLU 109 Ca 0.08 -0.55 0.03 0.00 0.02 0.00 0.00 54.97 54.55 3abm s GLU 109 Cb -0.08 -1.89 0.11 0.00 0.10 0.00 0.00 34.13 32.37 3abm s GLU 109 CO -0.00 -0.08 0.16 0.71 0.02 0.00 0.00 175.26 176.07 3abm s TYR 110 N 1.02 3.54 -0.18 1.61 4.12 0.70 -1.40 117.35 126.77 3abm s TYR 110 Ca -0.06 -2.99 0.13 0.00 0.02 0.00 0.00 57.07 54.18 3abm s TYR 110 Cb -0.15 -2.94 0.38 0.00 -1.52 0.00 0.00 41.96 37.74 3abm s TYR 110 CO -0.02 -0.88 1.20 0.25 0.02 0.00 0.00 175.55 176.12 3abm n THR 111 N 3.87 1.96 0.17 -0.71 -2.24 -1.26 -2.95 114.28 113.13 3abm n THR 111 Ca 0.04 -2.83 0.04 0.00 -2.27 0.00 0.00 64.05 59.02 3abm n THR 111 Cb 0.38 -0.15 0.43 0.00 -2.10 0.00 0.00 70.33 68.90 3abm n THR 111 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3abm h ASP 112 N 0.76 0.10 0.00 3.42 3.32 -1.93 -3.41 116.42 118.68 3abm h ASP 112 Ca -0.01 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3abm h ASP 112 Cb 1.06 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.59 3abm h ASP 112 CO 0.01 0.30 -0.13 -1.22 -1.72 0.00 0.00 179.24 176.48 3abm n TYR 113 N -4.27 -1.08 -4.29 4.55 4.01 -1.26 -5.12 117.16 109.71 3abm n TYR 113 Ca -0.02 0.19 -0.25 0.00 -0.16 0.00 0.00 57.90 57.66 3abm n TYR 113 Cb 0.28 0.34 -0.08 0.00 -0.31 0.00 0.00 39.34 39.56 3abm n TYR 113 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3abm s GLU 114 N -2.00 2.14 -1.02 -0.72 0.41 -1.26 -5.04 118.70 111.20 3abm s GLU 114 Ca 0.00 -1.88 -0.17 0.00 -0.41 0.00 0.00 54.97 52.51 3abm s GLU 114 Cb 0.00 -1.89 0.14 0.00 -1.78 0.00 0.00 34.13 30.60 3abm s GLU 114 CO 0.00 -0.04 1.23 -0.51 -0.49 0.00 0.00 175.26 175.45 3abm s ASP 115 N -3.82 6.76 -0.22 -0.19 1.01 -1.26 -4.15 116.67 114.80 3abm s ASP 115 Ca 0.38 -2.32 -0.08 0.00 0.71 0.00 0.00 52.55 51.25 3abm s ASP 115 Cb 0.04 -2.41 -0.04 0.00 1.01 0.00 0.00 42.92 41.53 3abm s ASP 115 CO 0.21 -0.98 0.08 -0.22 0.21 0.00 0.00 175.17 174.47 3abm s LEU 116 N 2.44 3.71 -0.05 1.23 2.96 -1.15 -4.94 118.68 122.88 3abm s LEU 116 Ca 0.36 -0.03 -0.24 0.00 -0.22 0.00 0.00 54.13 54.00 3abm s LEU 116 Cb -0.04 -1.97 0.05 0.00 0.50 0.00 0.00 46.19 44.73 3abm s LEU 116 CO -0.06 0.07 0.53 -0.94 -1.32 0.00 0.00 176.35 174.62 3abm s SER 117 N 1.01 -0.47 0.25 3.68 1.04 -1.26 -0.21 113.70 117.73 3abm s SER 117 Ca 0.05 0.51 -0.19 0.00 0.48 0.00 0.00 55.95 56.79 3abm s SER 117 Cb -0.14 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.50 3abm s SER 117 CO 0.03 -0.52 0.63 0.72 0.98 0.00 0.00 173.24 175.08 3abm s PHE 118 N -1.13 -0.11 0.01 5.02 -0.12 -0.93 -4.98 117.98 115.73 3abm s PHE 118 Ca -0.11 -0.28 -0.00 0.00 -0.05 0.00 0.00 56.93 56.48 3abm s PHE 118 Cb -0.02 0.55 -0.04 0.00 -0.63 0.00 0.00 43.02 42.88 3abm s PHE 118 CO 0.07 -1.10 0.10 -0.51 -0.05 0.00 0.00 175.22 173.73 3abm s ASP 119 N -2.91 5.78 -0.20 1.98 1.01 -1.26 -0.68 116.67 120.39 3abm s ASP 119 Ca 0.12 0.16 -0.02 0.00 0.71 0.00 0.00 52.55 53.51 3abm s ASP 119 Cb -0.04 -1.67 0.06 0.00 1.01 0.00 0.00 42.92 42.28 3abm s ASP 119 CO 0.04 0.25 0.02 -0.55 0.21 0.00 0.00 175.17 175.14 3abm s SER 120 N -1.89 3.07 0.12 0.27 0.15 0.14 -4.57 113.70 110.99 3abm s SER 120 Ca 0.25 -0.88 0.10 0.00 0.70 0.00 0.00 55.95 56.12 3abm s SER 120 Cb -0.12 -0.70 -0.04 0.00 -1.71 0.00 0.00 66.02 63.45 3abm s SER 120 CO 0.16 -0.29 -0.24 -0.31 1.20 0.00 0.00 173.24 173.77 3abm s TYR 121 N 1.77 2.03 0.50 3.44 2.02 -1.26 -2.43 117.35 123.43 3abm s TYR 121 Ca -0.02 -0.40 -0.22 0.00 -0.37 0.00 0.00 57.07 56.06 3abm s TYR 121 Cb -0.17 -1.10 -0.06 0.00 -0.40 0.00 0.00 41.96 40.23 3abm s TYR 121 CO -0.08 0.28 1.27 1.41 -1.57 0.00 0.00 175.55 176.87 3abm s MET 122 N -2.04 3.44 -0.17 -0.62 -2.45 -1.26 -1.25 119.30 114.96 3abm s MET 122 Ca 0.11 2.03 -0.27 0.00 -1.25 0.00 0.00 55.69 56.31 3abm s MET 122 Cb -0.10 -2.34 -0.01 0.00 1.25 0.00 0.00 34.83 33.63 3abm s MET 122 CO 0.05 -0.88 0.92 0.42 1.05 0.00 0.00 175.02 176.58 3abm s ILE 123 N -1.41 4.81 0.56 10.11 -1.09 0.92 -4.71 121.20 130.39 3abm s ILE 123 Ca 0.67 1.82 -0.20 0.00 -2.23 0.00 0.00 60.65 60.71 3abm s ILE 123 Cb -0.35 -4.22 -0.04 0.00 -1.58 0.00 0.00 42.46 36.27 3abm s ILE 123 CO 0.42 -0.03 1.27 -2.84 -1.23 0.00 0.00 174.94 172.53 3abm s PRO 124 N 2.41 3.09 0.24 2.79 0.02 -1.26 -4.59 135.00 137.70 3abm s PRO 124 Ca 0.42 2.02 -0.07 0.00 0.02 0.00 0.00 61.00 63.39 3abm s PRO 124 Cb -0.17 -2.11 0.23 0.00 0.02 0.00 0.00 34.50 32.47 3abm s PRO 124 CO 0.12 -1.16 1.89 1.15 -0.33 0.00 0.00 177.00 178.66 3abm h THR 125 N 1.20 1.26 0.00 0.99 2.02 -1.99 -1.43 112.91 114.96 3abm h THR 125 Ca -0.51 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.10 3abm h THR 125 Cb 1.30 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 3abm h THR 125 CO 0.56 0.28 0.00 0.77 0.37 0.00 0.00 175.52 177.50 3abm h SER 126 N 1.31 0.00 -0.25 4.18 4.64 -2.04 -2.81 113.55 118.58 3abm h SER 126 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 3abm h SER 126 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3abm h SER 126 CO -0.06 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.28 3abm n GLU 127 N -2.37 2.23 -1.66 4.77 1.02 -0.58 -5.00 120.64 119.06 3abm n GLU 127 Ca 0.02 -2.04 -0.44 0.00 -0.02 0.00 0.00 57.16 54.68 3abm n GLU 127 Cb 0.26 -1.44 -0.01 0.00 -0.02 0.00 0.00 31.44 30.22 3abm n GLU 127 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3abm n LEU 128 N 1.28 2.98 -4.89 -4.62 4.77 -0.96 -4.90 117.00 110.66 3abm n LEU 128 Ca 0.16 1.19 -0.29 0.00 -0.03 0.00 0.00 56.01 57.04 3abm n LEU 128 Cb 0.55 -1.42 -0.02 0.00 -2.33 0.00 0.00 43.42 40.20 3abm n LEU 128 CO 0.14 -0.74 0.38 -0.54 -1.33 0.00 0.00 177.39 175.30 3abm s LYS 129 N -1.52 3.68 0.08 3.23 1.02 -1.26 -4.97 119.74 120.00 3abm s LYS 129 Ca 0.59 0.28 -0.36 0.00 0.02 0.00 0.00 55.97 56.50 3abm s LYS 129 Cb -0.62 -2.45 -0.15 0.00 -0.52 0.00 0.00 37.83 34.08 3abm s LYS 129 CO 0.59 -0.02 1.47 -2.30 -0.92 0.00 0.00 175.35 174.18 3abm n PRO 130 N -1.46 1.52 0.00 -1.68 -0.02 -1.26 -1.00 135.00 131.11 3abm n PRO 130 Ca 0.01 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 3abm n PRO 130 Cb 0.54 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 3abm n PRO 130 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3abm n GLY 131 N 3.02 2.09 3.91 -1.23 0.00 -1.26 -5.05 105.19 106.67 3abm n GLY 131 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 3abm n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3abm s GLU 132 N -0.54 3.05 -0.26 1.61 2.02 -0.17 -5.03 118.70 119.39 3abm s GLU 132 Ca 0.00 0.12 -0.11 0.00 0.02 0.00 0.00 54.97 55.00 3abm s GLU 132 Cb 0.00 -2.25 -0.05 0.00 0.10 0.00 0.00 34.13 31.93 3abm s GLU 132 CO 0.00 -0.65 0.17 -0.51 0.02 0.00 0.00 175.26 174.30 3abm s LEU 133 N -5.00 4.03 0.02 1.80 1.43 -1.26 -4.90 118.68 114.80 3abm s LEU 133 Ca 0.53 0.02 -0.34 0.00 -1.03 0.00 0.00 54.13 53.32 3abm s LEU 133 Cb -0.11 -2.10 -0.13 0.00 0.03 0.00 0.00 46.19 43.88 3abm s LEU 133 CO 0.46 -0.01 1.74 -1.14 0.23 0.00 0.00 176.35 177.64 3abm n ARG 134 N 4.77 2.14 -0.51 1.70 0.63 -1.26 -2.19 116.66 121.93 3abm n ARG 134 Ca -0.14 0.78 0.00 0.00 -0.92 0.00 0.00 57.85 57.56 3abm n ARG 134 Cb 0.52 -2.59 0.00 0.00 0.45 0.00 0.00 32.46 30.84 3abm n ARG 134 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3abm n LEU 135 N 5.16 0.02 -0.02 6.15 4.77 -1.26 -4.81 117.00 127.02 3abm n LEU 135 Ca 0.20 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.19 3abm n LEU 135 Cb 0.29 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.26 3abm n LEU 135 CO 0.69 -0.01 -0.69 0.18 -1.33 0.00 0.00 177.39 176.22 3abm n LEU 136 N 0.00 0.00 -4.86 2.23 4.77 -0.93 -4.55 117.00 113.66 3abm n LEU 136 Ca 0.00 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.66 3abm n LEU 136 Cb 0.00 0.10 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 3abm n LEU 136 CO 0.00 0.10 0.36 -1.61 -1.33 0.00 0.00 177.39 174.91 3abm s GLU 137 N -2.49 3.94 0.19 3.23 0.41 -1.19 -4.62 118.70 118.18 3abm s GLU 137 Ca -0.04 0.56 0.11 0.00 -0.41 0.00 0.00 54.97 55.19 3abm s GLU 137 Cb 0.05 -2.49 -0.04 0.00 -1.78 0.00 0.00 34.13 29.87 3abm s GLU 137 CO 0.40 0.20 -0.24 0.14 -0.49 0.00 0.00 175.26 175.27 3abm s VAL 138 N -1.95 2.31 0.13 2.63 -7.23 -1.26 -0.05 120.40 114.98 3abm s VAL 138 Ca 0.52 -2.03 -0.17 0.00 -1.81 0.00 0.00 61.98 58.49 3abm s VAL 138 Cb -0.10 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.71 3abm s VAL 138 CO 0.19 -0.13 1.73 -2.24 -0.31 0.00 0.00 175.10 174.33 3abm h ASP 139 N 3.20 0.41 -3.47 4.85 -0.00 -1.46 -3.43 116.42 116.53 3abm h ASP 139 Ca -0.46 -0.09 -0.64 0.00 -0.00 0.00 0.00 57.03 55.84 3abm h ASP 139 Cb 1.21 -0.11 -0.37 0.00 -0.00 0.00 0.00 39.33 40.07 3abm h ASP 139 CO 0.48 0.39 -0.82 0.20 -0.00 0.00 0.00 179.24 179.49 3abm s ASN 140 N -5.63 3.61 0.62 4.15 0.01 -1.26 -5.01 114.94 111.42 3abm s ASN 140 Ca -0.13 -0.97 -0.05 0.00 -0.71 0.00 0.00 52.86 51.00 3abm s ASN 140 Cb 0.09 -1.35 0.03 0.00 0.41 0.00 0.00 41.25 40.44 3abm s ASN 140 CO 0.72 -0.13 0.91 -0.13 -1.51 0.00 0.00 177.10 176.96 3abm s ARG 141 N 1.31 2.60 -0.81 -0.60 0.52 -1.26 -4.60 118.95 116.11 3abm s ARG 141 Ca -0.02 -0.24 -0.16 0.00 -0.52 0.00 0.00 55.73 54.78 3abm s ARG 141 Cb -0.17 -2.28 0.17 0.00 0.52 0.00 0.00 34.95 33.19 3abm s ARG 141 CO -0.08 -0.88 0.86 0.08 0.02 0.00 0.00 175.30 175.30 3abm s VAL 142 N -3.03 5.18 0.25 3.52 1.01 -0.19 -4.90 120.40 122.24 3abm s VAL 142 Ca 0.56 -1.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.35 3abm s VAL 142 Cb -0.11 -4.57 -0.09 0.00 0.00 0.00 0.00 36.38 31.62 3abm s VAL 142 CO 0.44 -1.19 1.14 -0.69 0.00 0.00 0.00 175.10 174.80 3abm s VAL 143 N 1.46 3.47 0.01 2.92 1.01 -1.26 -0.47 120.40 127.54 3abm s VAL 143 Ca 0.21 1.39 -0.16 0.00 0.00 0.00 0.00 61.98 63.42 3abm s VAL 143 Cb -0.12 -3.89 0.03 0.00 0.00 0.00 0.00 36.38 32.41 3abm s VAL 143 CO -0.06 0.29 0.35 -0.76 0.00 0.00 0.00 175.10 174.92 3abm s LEU 144 N -1.05 0.70 0.18 3.92 1.43 -0.02 -4.90 118.68 118.93 3abm s LEU 144 Ca 0.48 0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 53.31 3abm s LEU 144 Cb -0.33 1.44 -0.07 0.00 0.03 0.00 0.00 46.19 47.26 3abm s LEU 144 CO 0.40 -0.54 1.00 -2.16 0.23 0.00 0.00 176.35 175.28 3abm s PRO 145 N -1.84 4.72 0.70 1.29 0.04 -1.26 -1.93 135.00 136.72 3abm s PRO 145 Ca -0.10 1.55 -0.11 0.00 0.04 0.00 0.00 61.00 62.38 3abm s PRO 145 Cb -0.03 -3.31 0.01 0.00 0.04 0.00 0.00 34.50 31.21 3abm s PRO 145 CO 0.01 0.28 1.07 0.00 0.04 0.00 0.00 177.00 178.40 3abm s MET 146 N -0.56 2.93 -1.94 4.56 0.23 0.46 -3.91 119.30 121.06 3abm s MET 146 Ca 0.45 0.76 0.00 0.00 -1.03 0.00 0.00 55.69 55.87 3abm s MET 146 Cb -0.26 -2.00 0.00 0.00 -1.53 0.00 0.00 34.83 31.03 3abm s MET 146 CO 0.32 -1.06 0.00 0.39 -2.03 0.00 0.00 175.02 172.65 3abm n GLU 147 N -3.07 -1.60 -4.07 3.16 1.02 0.18 -4.71 120.64 111.54 3abm n GLU 147 Ca 0.07 1.09 -0.13 0.00 -0.02 0.00 0.00 57.16 58.17 3abm n GLU 147 Cb 0.55 -5.66 -0.11 0.00 -0.02 0.00 0.00 31.44 26.19 3abm n GLU 147 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 3abm s MET 148 N -4.61 0.56 -0.15 3.49 -1.94 -1.25 -5.01 119.30 110.39 3abm s MET 148 Ca 0.00 -0.80 -0.26 0.00 -1.71 0.00 0.00 55.69 52.93 3abm s MET 148 Cb 0.00 -0.32 -0.02 0.00 2.01 0.00 0.00 34.83 36.50 3abm s MET 148 CO 0.00 0.05 0.84 0.99 -0.01 0.00 0.00 175.02 176.90 3abm s THR 149 N -1.47 4.88 -0.05 2.05 2.01 -1.26 -4.30 115.64 117.49 3abm s THR 149 Ca -0.09 1.67 0.06 0.00 0.31 0.00 0.00 61.69 63.64 3abm s THR 149 Cb -0.09 -4.15 -0.01 0.00 0.01 0.00 0.00 72.50 68.26 3abm s THR 149 CO 0.00 0.05 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.12 3abm s ILE 150 N 1.97 1.88 -0.17 1.82 1.01 0.37 -0.78 121.20 127.30 3abm s ILE 150 Ca 0.40 -0.97 -0.18 0.00 0.00 0.00 0.00 60.65 59.90 3abm s ILE 150 Cb -0.17 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 3abm s ILE 150 CO 0.14 0.53 0.49 -0.60 0.00 0.00 0.00 174.94 175.49 3abm s ARG 151 N -0.10 4.24 -0.12 2.79 3.52 -0.15 -0.47 118.95 128.66 3abm s ARG 151 Ca -0.04 0.40 -0.03 0.00 -0.13 0.00 0.00 55.73 55.93 3abm s ARG 151 Cb -0.13 -3.51 -0.03 0.00 -1.56 0.00 0.00 34.95 29.72 3abm s ARG 151 CO 0.03 -0.02 -0.02 -1.64 -0.81 0.00 0.00 175.30 172.85 3abm s MET 152 N 1.22 3.37 -0.07 5.12 -1.94 0.63 -1.71 119.30 125.91 3abm s MET 152 Ca 0.24 -0.46 0.05 0.00 -1.71 0.00 0.00 55.69 53.81 3abm s MET 152 Cb -0.15 -2.87 -0.01 0.00 2.01 0.00 0.00 34.83 33.81 3abm s MET 152 CO 0.10 0.45 -0.24 -0.51 -0.01 0.00 0.00 175.02 174.81 3abm s LEU 153 N -0.20 2.13 -0.07 -0.03 1.43 0.18 -1.16 118.68 120.96 3abm s LEU 153 Ca 0.04 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.66 3abm s LEU 153 Cb -0.13 -1.40 0.01 0.00 0.03 0.00 0.00 46.19 44.70 3abm s LEU 153 CO 0.02 0.22 -0.14 -0.69 0.23 0.00 0.00 176.35 175.98 3abm s VAL 154 N 0.01 1.32 0.00 -1.59 1.01 -0.14 -0.47 120.40 120.54 3abm s VAL 154 Ca -0.08 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.31 3abm s VAL 154 Cb -0.15 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.04 3abm s VAL 154 CO 0.05 0.40 0.00 -0.24 0.00 0.00 0.00 175.10 175.31 3abm n SER 155 N 3.80 0.00 -3.88 3.32 2.88 -0.90 -0.38 113.62 118.47 3abm n SER 155 Ca -0.22 -0.85 -0.11 0.00 -1.33 0.00 0.00 58.87 56.37 3abm n SER 155 Cb 0.52 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.88 3abm n SER 155 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3abm s SER 156 N -0.65 0.04 0.00 -3.46 0.15 -1.25 -1.15 113.70 107.38 3abm s SER 156 Ca 0.00 -0.21 0.18 0.00 0.70 0.00 0.00 55.95 56.61 3abm s SER 156 Cb 0.00 0.20 0.37 0.00 -1.71 0.00 0.00 66.02 64.88 3abm s SER 156 CO 0.00 -0.35 1.29 -0.62 1.20 0.00 0.00 173.24 174.75 3abm n GLU 157 N 1.52 2.32 0.00 5.44 1.02 -0.38 -3.99 120.64 126.57 3abm n GLU 157 Ca -0.22 -2.09 0.00 0.00 -0.02 0.00 0.00 57.16 54.82 3abm n GLU 157 Cb 0.56 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 3abm n GLU 157 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3abm n ASP 158 N 1.10 0.00 -4.77 1.62 5.68 -1.26 -5.06 116.55 113.85 3abm n ASP 158 Ca 0.16 0.00 -0.22 0.00 -0.50 0.00 0.00 54.79 54.22 3abm n ASP 158 Cb 0.50 0.00 0.10 0.00 -1.14 0.00 0.00 41.12 40.59 3abm n ASP 158 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 3abm s VAL 159 N 0.40 2.00 0.46 2.12 -7.23 -1.26 -4.62 120.40 112.27 3abm s VAL 159 Ca 0.00 -0.76 -0.24 0.00 -1.81 0.00 0.00 61.98 59.17 3abm s VAL 159 Cb 0.00 -2.24 -0.07 0.00 0.56 0.00 0.00 36.38 34.62 3abm s VAL 159 CO 0.00 0.00 1.32 -0.76 -0.31 0.00 0.00 175.10 175.35 3abm s LEU 160 N -5.02 4.08 0.00 1.32 1.43 -1.26 -4.64 118.68 114.58 3abm s LEU 160 Ca 0.66 2.67 0.06 0.00 -1.03 0.00 0.00 54.13 56.50 3abm s LEU 160 Cb -0.04 -4.05 -0.02 0.00 0.03 0.00 0.00 46.19 42.10 3abm s LEU 160 CO 0.43 -1.09 0.22 1.41 0.23 0.00 0.00 176.35 177.56 3abm n HIS 161 N -0.30 -0.56 -3.72 0.29 8.25 -0.81 -4.35 115.22 114.02 3abm n HIS 161 Ca 0.06 -2.39 -0.13 0.00 -0.26 0.00 0.00 57.72 55.00 3abm n HIS 161 Cb 0.44 0.21 -0.10 0.00 1.12 0.00 0.00 29.99 31.67 3abm n HIS 161 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3abm s SER 162 N -3.03 -0.46 -0.27 0.41 0.15 -1.26 -0.30 113.70 108.94 3abm s SER 162 Ca 0.32 0.89 -0.08 0.00 0.70 0.00 0.00 55.95 57.77 3abm s SER 162 Cb 0.02 0.90 -0.02 0.00 -1.71 0.00 0.00 66.02 65.20 3abm s SER 162 CO 0.22 -0.16 0.11 0.86 1.20 0.00 0.00 173.24 175.47 3abm s TRP 163 N 0.21 3.13 0.02 3.44 -0.00 0.18 -1.39 118.94 124.53 3abm s TRP 163 Ca -0.00 -0.44 0.04 0.00 -0.00 0.00 0.00 56.10 55.70 3abm s TRP 163 Cb -0.03 -2.29 -0.02 0.00 -0.00 0.00 0.00 33.47 31.13 3abm s TRP 163 CO 0.01 -0.38 -0.12 0.00 -0.00 0.00 0.00 176.95 176.46 3abm s ALA 164 N 1.62 0.99 -0.30 5.86 0.00 -1.26 -1.09 121.76 127.59 3abm s ALA 164 Ca 0.06 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.32 3abm s ALA 164 Cb -0.16 -0.17 0.12 0.00 0.00 0.00 0.00 23.12 22.91 3abm s ALA 164 CO 0.05 0.19 0.20 0.08 0.00 0.00 0.00 175.76 176.29 3abm s VAL 165 N -0.67 -0.16 0.25 0.00 1.01 -0.38 -3.70 120.40 116.74 3abm s VAL 165 Ca 0.01 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 3abm s VAL 165 Cb -0.07 -0.98 0.22 0.00 0.00 0.00 0.00 36.38 35.55 3abm s VAL 165 CO 0.01 -0.67 1.74 -0.65 0.00 0.00 0.00 175.10 175.52 3abm h PRO 166 N 8.15 0.46 0.00 2.72 0.11 -1.77 -1.69 132.00 139.98 3abm h PRO 166 Ca -0.14 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3abm h PRO 166 Cb 1.03 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3abm h PRO 166 CO 0.38 0.31 0.00 0.66 -0.21 0.00 0.00 178.00 179.13 3abm h SER 167 N 0.48 0.00 -0.02 -2.05 4.64 -1.86 0.04 113.55 114.77 3abm h SER 167 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 3abm h SER 167 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 3abm h SER 167 CO -0.39 0.00 -0.13 0.18 -0.87 0.00 0.00 176.83 175.62 3abm n LEU 168 N -2.58 2.54 -1.20 5.97 4.77 -0.67 -1.19 117.00 124.65 3abm n LEU 168 Ca 0.01 -0.93 -0.07 0.00 -0.03 0.00 0.00 56.01 54.99 3abm n LEU 168 Cb 0.20 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.31 3abm n LEU 168 CO 0.20 0.44 0.03 0.61 -1.33 0.00 0.00 177.39 177.35 3abm n GLY 169 N 1.26 0.42 3.42 -0.72 0.00 -0.00 -4.26 105.19 105.30 3abm n GLY 169 Ca 0.11 -0.47 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 3abm n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abm s LEU 170 N -2.52 2.64 -0.28 0.99 1.43 -1.04 -4.94 118.68 114.96 3abm s LEU 170 Ca 0.12 -0.28 -0.07 0.00 -1.03 0.00 0.00 54.13 52.87 3abm s LEU 170 Cb -0.05 -1.55 0.14 0.00 0.03 0.00 0.00 46.19 44.76 3abm s LEU 170 CO 0.15 0.28 0.59 -0.75 0.23 0.00 0.00 176.35 176.85 3abm s LYS 171 N -0.33 0.53 -0.08 1.70 2.20 -1.26 -1.26 119.74 121.25 3abm s LYS 171 Ca 0.03 1.26 -0.00 0.00 -0.36 0.00 0.00 55.97 56.89 3abm s LYS 171 Cb -0.13 0.67 0.02 0.00 -1.51 0.00 0.00 37.83 36.88 3abm s LYS 171 CO 0.02 -0.32 -0.04 0.99 -0.36 0.00 0.00 175.35 175.64 3abm s THR 172 N 2.83 0.66 0.53 3.43 2.01 -0.25 -4.94 115.64 119.91 3abm s THR 172 Ca 0.01 -0.10 -0.22 0.00 0.31 0.00 0.00 61.69 61.70 3abm s THR 172 Cb -0.13 -0.72 -0.05 0.00 0.01 0.00 0.00 72.50 71.61 3abm s THR 172 CO -0.18 0.29 1.28 -1.81 -0.69 0.00 0.00 174.62 173.51 3abm s ASP 173 N 1.52 5.49 -0.44 3.53 1.01 -1.26 0.47 116.67 126.99 3abm s ASP 173 Ca -0.01 2.58 -0.10 0.00 0.71 0.00 0.00 52.55 55.74 3abm s ASP 173 Cb -0.13 -2.62 0.09 0.00 1.01 0.00 0.00 42.92 41.27 3abm s ASP 173 CO -0.04 -1.40 0.30 0.00 0.21 0.00 0.00 175.17 174.24 3abm s ALA 174 N -1.41 3.35 -0.07 5.23 0.00 0.59 -4.72 121.76 124.72 3abm s ALA 174 Ca 0.70 -2.30 0.05 0.00 0.00 0.00 0.00 51.96 50.41 3abm s ALA 174 Cb -0.36 -2.75 -0.00 0.00 0.00 0.00 0.00 23.12 20.01 3abm s ALA 174 CO 0.42 -1.76 -0.23 0.42 0.00 0.00 0.00 175.76 174.61 3abm s ILE 175 N 1.41 1.96 0.29 0.00 1.01 -1.26 -1.93 121.20 122.69 3abm s ILE 175 Ca 0.04 -0.99 -0.29 0.00 0.00 0.00 0.00 60.65 59.41 3abm s ILE 175 Cb -0.24 -1.68 -0.10 0.00 0.01 0.00 0.00 42.46 40.44 3abm s ILE 175 CO 0.01 0.54 1.43 -2.16 0.00 0.00 0.00 174.94 174.77 3abm s PRO 176 N 0.10 4.25 0.00 2.79 0.04 -1.26 -1.64 135.00 139.28 3abm s PRO 176 Ca -0.11 2.35 0.00 0.00 0.04 0.00 0.00 61.00 63.29 3abm s PRO 176 Cb -0.15 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.32 3abm s PRO 176 CO 0.06 -0.40 0.00 0.41 0.04 0.00 0.00 177.00 177.11 3abm n GLY 177 N 1.56 1.27 3.25 0.56 0.00 -1.26 -4.97 105.19 105.60 3abm n GLY 177 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 3abm n GLY 177 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3abm s ARG 178 N -0.32 1.04 -0.39 1.61 3.52 -0.65 -5.10 118.95 118.66 3abm s ARG 178 Ca 0.00 -1.21 0.02 0.00 -0.13 0.00 0.00 55.73 54.41 3abm s ARG 178 Cb 0.00 -1.00 0.11 0.00 -1.56 0.00 0.00 34.95 32.50 3abm s ARG 178 CO 0.00 0.20 0.14 -1.17 -0.81 0.00 0.00 175.30 173.67 3abm s LEU 179 N -2.32 3.65 0.13 -0.88 2.96 -1.26 -4.39 118.68 116.57 3abm s LEU 179 Ca 0.08 -2.30 -0.12 0.00 -0.22 0.00 0.00 54.13 51.56 3abm s LEU 179 Cb -0.06 -1.33 -0.07 0.00 0.50 0.00 0.00 46.19 45.23 3abm s LEU 179 CO 0.04 -0.34 0.50 0.20 -1.32 0.00 0.00 176.35 175.43 3abm s ASN 180 N 0.72 6.73 0.10 3.68 0.01 0.49 -4.82 114.94 121.85 3abm s ASN 180 Ca 0.13 0.95 0.08 0.00 -0.71 0.00 0.00 52.86 53.32 3abm s ASN 180 Cb -0.21 -2.24 -0.04 0.00 0.41 0.00 0.00 41.25 39.17 3abm s ASN 180 CO -0.09 0.10 -0.16 -1.58 -1.51 0.00 0.00 177.10 173.86 3abm s GLN 181 N -2.06 1.91 0.05 -0.60 0.74 -1.26 -0.96 119.66 117.48 3abm s GLN 181 Ca 0.37 -1.11 -0.19 0.00 0.05 0.00 0.00 55.36 54.48 3abm s GLN 181 Cb -0.14 -2.17 0.04 0.00 1.10 0.00 0.00 33.01 31.84 3abm s GLN 181 CO 0.19 0.50 0.44 -0.08 -0.55 0.00 0.00 175.29 175.79 3abm s THR 182 N -1.11 0.05 0.15 -0.34 -1.32 -0.31 -5.01 115.64 107.74 3abm s THR 182 Ca 0.18 -0.40 0.09 0.00 -1.21 0.00 0.00 61.69 60.35 3abm s THR 182 Cb -0.11 -0.96 -0.04 0.00 -1.51 0.00 0.00 72.50 69.88 3abm s THR 182 CO 0.10 -0.22 -0.16 0.42 -2.21 0.00 0.00 174.62 172.55 3abm s THR 183 N -2.48 2.92 -0.02 5.08 -4.23 -1.26 -0.27 115.64 115.38 3abm s THR 183 Ca -0.05 -1.61 0.01 0.00 -1.18 0.00 0.00 61.69 58.86 3abm s THR 183 Cb -0.01 -2.38 0.01 0.00 1.34 0.00 0.00 72.50 71.46 3abm s THR 183 CO -0.02 0.01 -0.01 -0.22 -0.54 0.00 0.00 174.62 173.83 3abm s LEU 184 N -2.43 1.53 -0.14 4.79 0.20 0.38 -4.92 118.68 118.08 3abm s LEU 184 Ca 0.21 -0.04 -0.04 0.00 0.69 0.00 0.00 54.13 54.95 3abm s LEU 184 Cb -0.10 -0.20 0.07 0.00 -0.43 0.00 0.00 46.19 45.53 3abm s LEU 184 CO 0.12 -0.04 0.19 -0.32 -0.29 0.00 0.00 176.35 176.01 3abm s MET 185 N 0.55 0.11 -0.07 1.98 1.75 -1.26 -0.48 119.30 121.89 3abm s MET 185 Ca -0.05 0.40 -0.16 0.00 -1.25 0.00 0.00 55.69 54.63 3abm s MET 185 Cb -0.08 -0.73 -0.05 0.00 2.84 0.00 0.00 34.83 36.81 3abm s MET 185 CO -0.01 -0.47 0.41 0.45 -0.65 0.00 0.00 175.02 174.75 3abm s SER 186 N 2.31 6.71 0.00 1.11 0.15 -1.26 -4.44 113.70 118.28 3abm s SER 186 Ca 0.04 0.84 0.29 0.00 0.70 0.00 0.00 55.95 57.82 3abm s SER 186 Cb -0.14 -2.25 1.24 0.00 -1.71 0.00 0.00 66.02 63.16 3abm s SER 186 CO -0.09 0.18 1.91 -1.20 1.20 0.00 0.00 173.24 175.25 3abm n SER 187 N 2.72 0.06 -3.98 5.45 7.64 0.24 -0.65 113.62 125.11 3abm n SER 187 Ca -0.11 0.26 -0.09 0.00 1.01 0.00 0.00 58.87 59.94 3abm n SER 187 Cb 0.52 -0.38 -0.10 0.00 -1.01 0.00 0.00 64.21 63.23 3abm n SER 187 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3abm s ARG 188 N -2.89 0.42 1.03 1.43 0.52 -1.26 -4.82 118.95 113.38 3abm s ARG 188 Ca 0.17 -0.70 -0.16 0.00 -0.52 0.00 0.00 55.73 54.52 3abm s ARG 188 Cb 0.19 0.16 0.21 0.00 0.52 0.00 0.00 34.95 36.03 3abm s ARG 188 CO 0.53 -0.08 1.20 -1.25 0.02 0.00 0.00 175.30 175.72 3abm s PRO 189 N -2.01 0.16 0.00 3.54 0.04 -1.26 -4.85 135.00 130.61 3abm s PRO 189 Ca -0.11 -0.12 0.00 0.00 0.04 0.00 0.00 61.00 60.82 3abm s PRO 189 Cb -0.06 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.72 3abm s PRO 189 CO -0.03 -2.78 0.00 0.41 0.04 0.00 0.00 177.00 174.64 3abm n GLY 190 N -2.44 0.92 3.43 0.56 0.00 -0.71 -4.91 105.19 102.04 3abm n GLY 190 Ca 0.12 -1.95 -0.34 0.00 0.00 0.00 0.00 46.02 43.84 3abm n GLY 190 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abm s LEU 191 N 0.00 3.15 -0.10 0.99 1.43 -1.26 -0.81 118.68 122.07 3abm s LEU 191 Ca 0.00 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 3abm s LEU 191 Cb 0.00 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.44 3abm s LEU 191 CO 0.00 0.08 -0.19 -0.31 0.23 0.00 0.00 176.35 176.16 3abm s TYR 192 N 0.90 2.20 0.10 0.29 1.51 -0.29 -4.98 117.35 117.07 3abm s TYR 192 Ca 0.00 -0.94 0.06 0.00 -1.01 0.00 0.00 57.07 55.19 3abm s TYR 192 Cb -0.14 -1.51 -0.04 0.00 -0.11 0.00 0.00 41.96 40.15 3abm s TYR 192 CO 0.01 -0.42 -0.06 0.71 -1.11 0.00 0.00 175.55 174.69 3abm s TYR 193 N 0.59 2.84 0.27 2.71 2.02 -1.26 -0.77 117.35 123.74 3abm s TYR 193 Ca -0.14 -0.10 -0.08 0.00 -0.37 0.00 0.00 57.07 56.37 3abm s TYR 193 Cb -0.17 -1.47 -0.01 0.00 -0.40 0.00 0.00 41.96 39.91 3abm s TYR 193 CO 0.05 0.45 0.42 0.20 -1.57 0.00 0.00 175.55 175.09 3abm s GLY 194 N -2.24 0.96 0.02 0.71 0.00 -0.31 -4.07 107.32 102.39 3abm s GLY 194 Ca 0.23 -1.20 -0.03 0.00 0.00 0.00 0.00 44.72 43.72 3abm s GLY 194 CO 0.15 -0.87 0.04 1.20 0.00 0.00 0.00 173.10 173.63 3abm s GLN 195 N -3.76 0.40 0.15 2.90 -0.21 -1.24 -0.99 119.66 116.91 3abm s GLN 195 Ca 0.28 -0.56 -0.34 0.00 0.02 0.00 0.00 55.36 54.76 3abm s GLN 195 Cb 0.01 0.16 -0.14 0.00 1.00 0.00 0.00 33.01 34.04 3abm s GLN 195 CO 0.13 -0.08 1.60 0.00 -2.12 0.00 0.00 175.29 174.82 3abm n SER 197 N 3.63 2.43 -3.73 0.00 7.64 -0.49 -4.89 113.62 118.22 3abm n SER 197 Ca 0.17 -3.76 -0.12 0.00 1.01 0.00 0.00 58.87 56.17 3abm n SER 197 Cb 0.29 -0.47 -0.13 0.00 -1.01 0.00 0.00 64.21 62.89 3abm n SER 197 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3abm s GLU 198 N -3.19 0.22 0.07 1.43 2.56 -1.26 -4.59 118.70 113.94 3abm s GLU 198 Ca 0.41 0.52 -0.36 0.00 0.00 0.00 0.00 54.97 55.54 3abm s GLU 198 Cb 0.38 -0.09 -0.16 0.00 2.00 0.00 0.00 34.13 36.26 3abm s GLU 198 CO -0.05 -0.15 1.44 1.51 -0.56 0.00 0.00 175.26 177.45 3abm n ILE 199 N 4.11 0.04 -1.80 -3.70 3.06 -1.26 -4.51 119.36 115.31 3abm n ILE 199 Ca -0.24 -0.01 0.00 0.00 -2.50 0.00 0.00 62.75 60.00 3abm n ILE 199 Cb 0.54 -1.05 0.00 0.00 0.54 0.00 0.00 39.64 39.67 3abm n ILE 199 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3abm n GLY 201 N 0.00 0.03 0.40 0.00 0.00 -1.26 -4.81 105.19 99.54 3abm n GLY 201 Ca 0.00 -2.15 0.22 0.00 0.00 0.00 0.00 46.02 44.08 3abm n GLY 201 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3abm h SER 202 N 0.00 0.00 -0.32 1.61 0.02 -2.03 -2.77 113.55 110.06 3abm h SER 202 Ca 0.00 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.70 3abm h SER 202 Cb 0.00 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 62.29 3abm h SER 202 CO 0.00 0.00 -0.75 0.59 -1.14 0.00 0.00 176.83 175.53 3abm n ASN 203 N -4.12 2.81 -0.18 3.07 3.02 -1.26 -4.78 115.26 113.81 3abm n ASN 203 Ca 0.10 -3.43 0.04 0.00 -0.03 0.00 0.00 54.58 51.27 3abm n ASN 203 Cb 0.67 -0.43 0.32 0.00 -0.61 0.00 0.00 39.78 39.73 3abm n ASN 203 CO 0.00 0.00 0.00 -0.74 -2.62 0.00 0.00 177.26 173.90 3abm h HIS 204 N 1.61 0.81 0.00 3.10 -0.00 -1.80 -1.01 115.15 117.85 3abm h HIS 204 Ca 0.10 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.49 3abm h HIS 204 Cb 1.33 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 28.47 3abm h HIS 204 CO 0.70 0.46 0.00 0.43 -0.00 0.00 0.00 177.93 179.52 3abm n SER 205 N -4.46 0.52 -2.17 3.26 7.64 -1.26 -4.06 113.62 113.08 3abm n SER 205 Ca 0.09 0.63 -0.15 0.00 1.01 0.00 0.00 58.87 60.46 3abm n SER 205 Cb 0.16 -0.74 0.04 0.00 -1.01 0.00 0.00 64.21 62.65 3abm n SER 205 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3abm n PHE 206 N -2.08 2.12 -3.31 1.43 3.01 -0.38 -4.83 117.46 113.42 3abm n PHE 206 Ca 0.02 -2.12 -0.25 0.00 1.01 0.00 0.00 57.45 56.11 3abm n PHE 206 Cb 0.21 -0.30 -0.08 0.00 -0.01 0.00 0.00 39.48 39.30 3abm n PHE 206 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3abm n MET 207 N -0.67 0.72 -2.03 -1.08 0.00 -1.25 -4.42 117.12 108.39 3abm n MET 207 Ca 0.31 -3.38 -0.29 0.00 0.00 0.00 0.00 57.70 54.34 3abm n MET 207 Cb 0.91 -1.51 0.19 0.00 0.00 0.00 0.00 33.22 32.81 3abm n MET 207 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 3abm s PRO 208 N -0.86 0.64 -0.09 3.17 0.04 -1.26 -3.53 135.00 133.10 3abm s PRO 208 Ca 0.34 -0.57 0.01 0.00 0.04 0.00 0.00 61.00 60.82 3abm s PRO 208 Cb 0.11 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.77 3abm s PRO 208 CO -0.14 -2.37 -0.11 0.42 0.04 0.00 0.00 177.00 174.84 3abm s ILE 209 N -3.82 1.19 -0.13 0.56 1.01 -0.16 -4.80 121.20 115.04 3abm s ILE 209 Ca 0.74 -0.45 -0.00 0.00 0.00 0.00 0.00 60.65 60.94 3abm s ILE 209 Cb -0.03 -1.12 0.03 0.00 0.01 0.00 0.00 42.46 41.35 3abm s ILE 209 CO 0.52 0.38 -0.09 -0.69 0.00 0.00 0.00 174.94 175.07 3abm s VAL 210 N 1.09 1.17 -0.07 2.92 1.01 -1.26 -1.17 120.40 124.09 3abm s VAL 210 Ca -0.06 -0.44 -0.12 0.00 0.00 0.00 0.00 61.98 61.36 3abm s VAL 210 Cb -0.14 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.99 3abm s VAL 210 CO -0.02 0.33 0.29 -0.76 0.00 0.00 0.00 175.10 174.94 3abm s LEU 211 N 1.64 4.40 -0.31 3.92 1.43 0.05 -1.02 118.68 128.80 3abm s LEU 211 Ca 0.04 0.70 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 3abm s LEU 211 Cb -0.13 -2.35 0.07 0.00 0.03 0.00 0.00 46.19 43.81 3abm s LEU 211 CO -0.09 0.32 -0.01 -0.70 0.23 0.00 0.00 176.35 176.10 3abm s GLU 212 N -0.79 2.04 -0.25 1.70 2.12 0.38 -1.14 118.70 122.76 3abm s GLU 212 Ca 0.19 -1.53 -0.10 0.00 0.36 0.00 0.00 54.97 53.89 3abm s GLU 212 Cb -0.14 -3.11 -0.05 0.00 0.26 0.00 0.00 34.13 31.09 3abm s GLU 212 CO 0.08 -0.73 0.15 -0.51 -0.54 0.00 0.00 175.26 173.71 3abm s LEU 213 N 1.08 4.02 0.20 2.70 2.01 0.01 -0.84 118.68 127.86 3abm s LEU 213 Ca -0.01 0.06 -0.03 0.00 0.01 0.00 0.00 54.13 54.16 3abm s LEU 213 Cb -0.20 -2.09 -0.03 0.00 0.01 0.00 0.00 46.19 43.88 3abm s LEU 213 CO -0.05 0.04 0.18 0.68 1.01 0.00 0.00 176.35 178.21 3abm s VAL 214 N 1.23 0.01 0.54 -1.59 -7.23 -0.81 -1.73 120.40 110.82 3abm s VAL 214 Ca 0.07 -1.88 -0.22 0.00 -1.81 0.00 0.00 61.98 58.15 3abm s VAL 214 Cb -0.14 -2.39 -0.05 0.00 0.56 0.00 0.00 36.38 34.35 3abm s VAL 214 CO 0.06 -0.05 1.28 -2.65 -0.31 0.00 0.00 175.10 173.42 3abm n PRO 215 N -0.27 1.56 -0.31 4.82 -0.02 -1.26 -0.41 135.00 139.11 3abm n PRO 215 Ca 0.00 0.58 0.16 0.00 -2.02 0.00 0.00 63.50 62.22 3abm n PRO 215 Cb 0.65 -2.47 0.35 0.00 -0.02 0.00 0.00 33.50 32.00 3abm n PRO 215 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3abm h LEU 216 N 1.32 0.20 -0.94 2.45 5.85 -1.93 -0.79 115.31 121.47 3abm h LEU 216 Ca -0.50 0.19 -0.10 0.00 0.84 0.00 0.00 57.88 58.31 3abm h LEU 216 Cb 1.32 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.54 3abm h LEU 216 CO 0.56 -0.13 -0.32 0.11 -0.34 0.00 0.00 178.44 178.33 3abm h LYS 217 N 0.27 0.38 -0.30 1.25 1.79 -2.00 0.18 116.57 118.15 3abm h LYS 217 Ca 0.61 -0.16 -0.14 0.00 -2.18 0.00 0.00 60.65 58.78 3abm h LYS 217 Cb 1.27 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.89 3abm h LYS 217 CO -0.62 0.66 -0.39 1.88 -1.08 0.00 0.00 179.45 179.90 3abm h TYR 218 N 0.33 0.85 -0.71 -1.35 0.05 -1.53 -2.91 116.97 111.70 3abm h TYR 218 Ca 0.04 -0.25 -0.03 0.00 0.05 0.00 0.00 58.73 58.55 3abm h TYR 218 Cb 0.73 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 3abm h TYR 218 CO 0.02 0.99 0.34 0.35 -1.05 0.00 0.00 178.16 178.81 3abm h PHE 219 N 0.58 1.03 -0.60 4.88 3.57 -0.51 -0.97 116.94 124.93 3abm h PHE 219 Ca 0.05 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 3abm h PHE 219 Cb 0.93 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 3abm h PHE 219 CO 0.05 0.77 0.27 0.93 -2.23 0.00 0.00 178.31 178.09 3abm h GLU 220 N 1.00 0.88 -0.21 1.11 5.08 -0.66 0.12 114.58 121.89 3abm h GLU 220 Ca 0.24 -0.14 -0.18 0.00 -1.00 0.00 0.00 59.36 58.28 3abm h GLU 220 Cb 0.13 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 3abm h GLU 220 CO -0.03 0.73 -0.58 0.87 -1.00 0.00 0.00 179.01 179.00 3abm h LYS 221 N 0.82 0.68 -0.28 2.33 1.57 -1.40 -2.16 116.57 118.13 3abm h LYS 221 Ca 0.20 -0.45 -0.00 0.00 -1.87 0.00 0.00 60.65 58.53 3abm h LYS 221 Cb 0.16 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3abm h LYS 221 CO -0.02 1.07 0.16 2.35 -0.57 0.00 0.00 179.45 182.43 3abm h TRP 222 N 0.52 0.39 -0.68 -1.35 7.01 -0.90 -1.72 115.95 119.21 3abm h TRP 222 Ca 0.00 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.03 3abm h TRP 222 Cb 1.15 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 28.04 3abm h TRP 222 CO 0.06 0.32 0.42 0.77 -2.79 0.00 0.00 178.44 177.21 3abm h SER 223 N 0.35 0.67 -0.96 2.65 0.02 -0.57 -1.48 113.55 114.23 3abm h SER 223 Ca 0.10 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3abm h SER 223 Cb 0.05 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.41 3abm h SER 223 CO -0.02 0.46 0.59 0.00 -1.14 0.00 0.00 176.83 176.72 3abm h ALA 224 N 1.30 1.22 0.00 3.77 0.00 -1.03 -2.03 119.26 122.50 3abm h ALA 224 Ca 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3abm h ALA 224 Cb 0.05 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.45 3abm h ALA 224 CO -0.12 0.67 0.00 -1.13 0.00 0.00 0.00 179.25 178.67 3abm n SER 225 N -4.36 0.67 -1.00 0.00 3.41 -0.68 -2.68 113.62 108.98 3abm n SER 225 Ca 0.11 0.61 0.12 0.00 -0.26 0.00 0.00 58.87 59.45 3abm n SER 225 Cb 0.05 -0.77 0.22 0.00 -0.26 0.00 0.00 64.21 63.45 3abm n SER 225 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3abm n MET 226 N -2.18 2.33 0.00 4.33 2.81 -0.63 -5.08 117.12 118.69 3abm n MET 226 Ca 0.04 -1.98 0.09 0.00 -1.81 0.00 0.00 57.70 54.04 3abm n MET 226 Cb 0.32 -1.48 0.56 0.00 -0.71 0.00 0.00 33.22 31.90 3abm n MET 226 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76