#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abk s TYR 3 N 0.00 1.85 0.40 0.00 -0.85 -1.26 -5.09 117.35 112.40 3abk s TYR 3 Ca 0.00 -0.68 -0.27 0.00 -0.52 0.00 0.00 57.07 55.60 3abk s TYR 3 Cb 0.00 -1.00 -0.10 0.00 0.38 0.00 0.00 41.96 41.25 3abk s TYR 3 CO 0.00 0.28 1.43 -2.14 -1.52 0.00 0.00 175.55 173.60 3abk s PRO 4 N -3.71 3.99 -1.53 -3.49 0.02 -1.26 -2.27 135.00 126.75 3abk s PRO 4 Ca 0.27 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.73 3abk s PRO 4 Cb 0.02 -2.86 0.00 0.00 0.02 0.00 0.00 34.50 31.69 3abk s PRO 4 CO 0.10 -0.58 0.00 -1.33 -0.33 0.00 0.00 177.00 174.86 3abk n MET 5 N 0.25 -1.09 -2.15 5.54 2.81 -1.26 -4.97 117.12 116.25 3abk n MET 5 Ca 0.02 0.96 -0.39 0.00 -1.81 0.00 0.00 57.70 56.48 3abk n MET 5 Cb 0.41 -5.15 -0.01 0.00 -0.71 0.00 0.00 33.22 27.75 3abk n MET 5 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 3abk s GLN 6 N -3.66 4.09 -0.16 0.03 0.74 -0.96 -4.94 119.66 114.80 3abk s GLN 6 Ca 0.00 2.07 0.02 0.00 0.05 0.00 0.00 55.36 57.50 3abk s GLN 6 Cb 0.00 -2.81 -0.11 0.00 1.10 0.00 0.00 33.01 31.19 3abk s GLN 6 CO 0.00 -0.36 -0.13 1.28 -0.55 0.00 0.00 175.29 175.53 3abk n LEU 7 N 0.28 2.79 0.00 3.68 4.77 -1.26 -5.06 117.00 122.20 3abk n LEU 7 Ca 0.03 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 3abk n LEU 7 Cb 0.44 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3abk n LEU 7 CO 0.55 0.75 0.00 0.61 -1.33 0.00 0.00 177.39 177.97 3abk n GLY 8 N 2.68 4.12 3.80 -0.72 0.00 -1.26 -5.11 105.19 108.70 3abk n GLY 8 Ca -0.29 -1.84 -0.34 0.00 0.00 0.00 0.00 46.02 43.55 3abk n GLY 8 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3abk s PHE 9 N 2.28 2.99 0.38 1.61 0.40 -1.26 -5.01 117.98 119.37 3abk s PHE 9 Ca 0.00 1.56 -0.24 0.00 -0.60 0.00 0.00 56.93 57.65 3abk s PHE 9 Cb 0.00 -3.06 -0.13 0.00 0.51 0.00 0.00 43.02 40.34 3abk s PHE 9 CO 0.00 -0.91 0.75 1.04 0.70 0.00 0.00 175.22 176.80 3abk n GLN 10 N -1.20 0.87 -1.65 0.44 6.02 -1.26 -4.93 117.38 115.67 3abk n GLN 10 Ca 0.09 0.31 -0.40 0.00 -0.01 0.00 0.00 57.00 56.99 3abk n GLN 10 Cb 0.53 -1.67 0.02 0.00 1.02 0.00 0.00 30.24 30.13 3abk n GLN 10 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3abk n ASP 11 N 1.10 1.67 -4.73 1.08 10.43 -1.26 -4.88 116.55 119.95 3abk n ASP 11 Ca 0.11 1.01 -0.41 0.00 2.57 0.00 0.00 54.79 58.07 3abk n ASP 11 Cb 0.37 -1.42 -0.03 0.00 1.84 0.00 0.00 41.12 41.88 3abk n ASP 11 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3abk s ALA 12 N -1.29 3.42 -0.22 2.24 0.00 -1.26 -4.75 121.76 119.88 3abk s ALA 12 Ca 0.65 0.91 0.19 0.00 0.00 0.00 0.00 51.96 53.71 3abk s ALA 12 Cb -0.51 -3.40 -0.27 0.00 0.00 0.00 0.00 23.12 18.94 3abk s ALA 12 CO 0.55 -0.34 0.50 2.41 0.00 0.00 0.00 175.76 178.87 3abk n THR 13 N 2.63 0.00 -4.27 0.00 -1.04 -0.58 -4.92 114.28 106.10 3abk n THR 13 Ca 0.04 -0.34 -0.21 0.00 -2.04 0.00 0.00 64.05 61.50 3abk n THR 13 Cb 0.45 0.29 -0.12 0.00 -1.82 0.00 0.00 70.33 69.14 3abk n THR 13 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3abk s SER 14 N -3.81 2.33 0.26 8.00 1.04 -1.25 -0.67 113.70 119.61 3abk s SER 14 Ca -0.04 -0.76 -0.02 0.00 0.48 0.00 0.00 55.95 55.61 3abk s SER 14 Cb 0.12 -0.11 0.45 0.00 0.10 0.00 0.00 66.02 66.58 3abk s SER 14 CO 0.77 -0.04 1.84 -0.65 0.98 0.00 0.00 173.24 176.14 3abk h PRO 15 N 3.71 0.94 -0.56 4.02 0.11 -1.95 -0.16 132.00 138.11 3abk h PRO 15 Ca -0.43 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 65.66 3abk h PRO 15 Cb 1.19 -0.21 -0.04 0.00 0.11 0.00 0.00 31.00 32.05 3abk h PRO 15 CO 0.46 0.62 0.32 0.82 -0.21 0.00 0.00 178.00 180.01 3abk h ILE 16 N 0.97 1.02 -0.04 4.15 1.08 -1.93 -0.29 117.51 122.46 3abk h ILE 16 Ca 0.44 -0.21 -0.11 0.00 -0.39 0.00 0.00 64.86 64.59 3abk h ILE 16 Cb 0.35 0.34 -0.01 0.00 -3.07 0.00 0.00 36.82 34.43 3abk h ILE 16 CO -0.23 0.11 -0.48 -0.03 -0.69 0.00 0.00 178.15 176.83 3abk h MET 17 N 0.62 0.11 -0.36 2.37 4.05 -1.64 -0.91 114.93 119.17 3abk h MET 17 Ca 0.23 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.57 3abk h MET 17 Cb 0.08 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.86 3abk h MET 17 CO -0.13 0.57 0.12 1.49 0.23 0.00 0.00 176.91 179.19 3abk h GLU 18 N 0.09 0.56 -0.62 0.39 4.81 0.64 -1.66 114.58 118.78 3abk h GLU 18 Ca 0.00 -0.12 0.13 0.00 -0.13 0.00 0.00 59.36 59.25 3abk h GLU 18 Cb 0.89 -0.08 -0.11 0.00 0.63 0.00 0.00 28.75 30.08 3abk h GLU 18 CO 0.07 0.57 -0.02 0.93 -0.73 0.00 0.00 179.01 179.83 3abk h GLU 19 N 0.43 0.09 -0.57 1.92 4.39 -0.98 -2.13 114.58 117.73 3abk h GLU 19 Ca 0.12 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.83 3abk h GLU 19 Cb 0.24 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 3abk h GLU 19 CO -0.00 0.06 0.36 -0.07 -1.16 0.00 0.00 179.01 178.19 3abk h LEU 20 N 0.10 0.59 -0.57 1.33 3.38 -0.49 -0.75 115.31 118.89 3abk h LEU 20 Ca 0.32 -0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.37 3abk h LEU 20 Cb 0.53 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 3abk h LEU 20 CO -0.55 0.42 0.22 -0.07 0.09 0.00 0.00 178.44 178.54 3abk h LEU 21 N 0.71 0.24 -0.76 1.67 3.38 -0.70 0.71 115.31 120.55 3abk h LEU 21 Ca 0.23 0.07 -0.12 0.00 0.09 0.00 0.00 57.88 58.14 3abk h LEU 21 Cb -0.00 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3abk h LEU 21 CO -0.09 0.15 -0.41 0.45 0.09 0.00 0.00 178.44 178.64 3abk h HIS 22 N 0.41 0.54 -0.31 1.13 3.86 -1.17 0.12 115.15 119.74 3abk h HIS 22 Ca 0.28 -0.15 -0.15 0.00 -1.16 0.00 0.00 60.37 59.18 3abk h HIS 22 Cb 0.31 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 3abk h HIS 22 CO -0.16 0.79 -0.41 0.35 0.86 0.00 0.00 177.93 179.37 3abk h PHE 23 N 0.38 1.01 -0.59 2.45 3.04 -0.64 -2.47 116.94 120.11 3abk h PHE 23 Ca 0.03 -0.33 0.05 0.00 3.98 0.00 0.00 57.97 61.70 3abk h PHE 23 Cb 0.88 -0.20 -0.05 0.00 2.56 0.00 0.00 35.95 39.14 3abk h PHE 23 CO 0.03 1.13 0.33 1.25 -2.02 0.00 0.00 178.31 179.03 3abk h HIS 24 N 0.60 0.60 -0.71 0.41 2.76 0.65 -1.59 115.15 117.87 3abk h HIS 24 Ca 0.04 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.30 3abk h HIS 24 Cb 1.01 -0.18 -0.06 0.00 1.55 0.00 0.00 27.41 29.72 3abk h HIS 24 CO 0.07 0.30 0.39 -0.44 -1.30 0.00 0.00 177.93 176.96 3abk h ASP 25 N 0.62 0.56 -0.30 3.26 3.32 -0.83 0.35 116.42 123.41 3abk h ASP 25 Ca 0.26 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.33 3abk h ASP 25 Cb 0.13 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3abk h ASP 25 CO -0.16 0.34 0.09 -0.74 -1.72 0.00 0.00 179.24 177.06 3abk h HIS 26 N 0.69 0.48 -0.30 4.55 -0.00 -1.24 -1.76 115.15 117.58 3abk h HIS 26 Ca 0.33 -0.05 -0.17 0.00 -0.00 0.00 0.00 60.37 60.48 3abk h HIS 26 Cb 0.26 -0.14 -0.00 0.00 -0.00 0.00 0.00 27.41 27.53 3abk h HIS 26 CO -0.08 0.50 -0.50 1.15 -0.00 0.00 0.00 177.93 179.00 3abk h THR 27 N 0.33 1.28 -0.25 6.26 2.02 -0.88 -2.78 112.91 118.88 3abk h THR 27 Ca 0.10 -1.69 -0.06 0.00 0.77 0.00 0.00 66.41 65.53 3abk h THR 27 Cb 0.24 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 3abk h THR 27 CO -0.00 0.55 -0.10 0.25 0.37 0.00 0.00 175.52 176.58 3abk h LEU 28 N 0.65 0.39 -0.69 2.58 5.85 -0.27 -1.36 115.31 122.47 3abk h LEU 28 Ca 0.03 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.56 3abk h LEU 28 Cb 1.09 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 3abk h LEU 28 CO 0.11 0.53 -0.06 -0.03 -0.34 0.00 0.00 178.44 178.65 3abk h MET 29 N 0.38 0.95 -0.10 1.25 4.05 -1.12 -0.73 114.93 119.62 3abk h MET 29 Ca 0.08 -0.32 0.01 0.00 -0.28 0.00 0.00 59.70 59.19 3abk h MET 29 Cb 0.42 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.12 3abk h MET 29 CO 0.02 0.98 0.00 0.82 0.23 0.00 0.00 176.91 178.97 3abk h ILE 30 N 0.86 0.94 -0.69 1.77 2.04 -1.17 -1.71 117.51 119.55 3abk h ILE 30 Ca 0.15 -0.01 0.06 0.00 1.00 0.00 0.00 64.86 66.05 3abk h ILE 30 Cb 0.59 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 3abk h ILE 30 CO 0.04 0.01 0.39 0.58 0.00 0.00 0.00 178.15 179.17 3abk h VAL 31 N 0.04 0.99 -0.38 1.67 2.07 -1.01 -0.95 116.25 118.69 3abk h VAL 31 Ca 0.05 -0.25 -0.15 0.00 0.82 0.00 0.00 66.70 67.16 3abk h VAL 31 Cb 0.05 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 3abk h VAL 31 CO -0.07 0.13 -0.36 -0.26 0.02 0.00 0.00 177.57 177.03 3abk h PHE 32 N 0.73 1.05 -0.33 1.57 0.05 -1.01 -1.25 116.94 117.76 3abk h PHE 32 Ca 0.30 -0.30 -0.05 0.00 3.82 0.00 0.00 57.97 61.74 3abk h PHE 32 Cb 0.16 -0.23 -0.01 0.00 2.00 0.00 0.00 35.95 37.87 3abk h PHE 32 CO -0.07 1.11 -0.01 1.25 -0.18 0.00 0.00 178.31 180.41 3abk h LEU 33 N 0.73 0.57 0.02 1.54 7.12 -1.01 -1.04 115.31 123.24 3abk h LEU 33 Ca 0.07 -0.32 -0.00 0.00 0.13 0.00 0.00 57.88 57.76 3abk h LEU 33 Cb 0.94 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 40.91 3abk h LEU 33 CO 0.09 0.75 -0.01 0.40 -0.13 0.00 0.00 178.44 179.54 3abk h ILE 34 N 0.38 1.19 -0.23 4.05 2.04 -1.16 0.31 117.51 124.09 3abk h ILE 34 Ca 0.09 -0.67 -0.07 0.00 1.00 0.00 0.00 64.86 65.21 3abk h ILE 34 Cb 0.46 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 3abk h ILE 34 CO 0.02 0.17 -0.15 0.77 0.00 0.00 0.00 178.15 178.96 3abk h SER 35 N -0.32 0.38 0.86 1.72 4.64 -1.19 -1.14 113.55 118.49 3abk h SER 35 Ca -0.00 -0.10 -0.23 0.00 -0.47 0.00 0.00 61.79 60.99 3abk h SER 35 Cb 0.30 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.27 3abk h SER 35 CO 0.00 0.56 -1.16 0.77 -0.87 0.00 0.00 176.83 176.13 3abk h SER 36 N 0.36 0.07 -0.51 4.97 4.64 -1.04 -1.66 113.55 120.38 3abk h SER 36 Ca 0.07 -0.08 0.04 0.00 -0.47 0.00 0.00 61.79 61.35 3abk h SER 36 Cb 0.49 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.51 3abk h SER 36 CO 0.03 1.06 0.26 0.25 -0.87 0.00 0.00 176.83 177.57 3abk h LEU 37 N 0.01 0.39 -0.43 5.97 5.85 -0.04 0.95 115.31 128.00 3abk h LEU 37 Ca -0.08 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 3abk h LEU 37 Cb 1.84 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.80 3abk h LEU 37 CO 0.13 0.27 0.22 0.58 -0.34 0.00 0.00 178.44 179.30 3abk h VAL 38 N 0.51 1.17 -0.76 1.05 2.07 -1.13 -0.39 116.25 118.78 3abk h VAL 38 Ca 0.22 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 3abk h VAL 38 Cb 0.12 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 3abk h VAL 38 CO -0.15 0.19 0.39 0.25 0.02 0.00 0.00 177.57 178.26 3abk h LEU 39 N 0.56 0.98 0.31 2.57 5.85 -1.02 -1.16 115.31 123.39 3abk h LEU 39 Ca 0.15 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3abk h LEU 39 Cb 0.10 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.88 3abk h LEU 39 CO -0.02 0.82 -0.15 0.22 -0.34 0.00 0.00 178.44 178.97 3abk h TYR 40 N 1.06 -0.38 -0.56 1.25 3.20 -0.57 -1.32 116.97 119.65 3abk h TYR 40 Ca 0.26 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.13 3abk h TYR 40 Cb 0.09 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 3abk h TYR 40 CO 0.01 -0.22 0.37 0.82 -1.64 0.00 0.00 178.16 177.50 3abk h ILE 41 N -0.44 1.13 -0.50 1.81 2.04 -0.96 0.31 117.51 120.89 3abk h ILE 41 Ca -0.04 -0.25 0.10 0.00 1.00 0.00 0.00 64.86 65.66 3abk h ILE 41 Cb 0.34 0.32 -0.09 0.00 -0.74 0.00 0.00 36.82 36.65 3abk h ILE 41 CO 0.07 0.14 -0.07 0.40 0.00 0.00 0.00 178.15 178.68 3abk h ILE 42 N 0.74 0.55 -0.09 -0.67 2.04 -1.08 0.11 117.51 119.11 3abk h ILE 42 Ca 0.21 -0.02 -0.10 0.00 1.00 0.00 0.00 64.86 65.95 3abk h ILE 42 Cb -0.06 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 3abk h ILE 42 CO -0.06 0.01 -0.40 0.77 0.00 0.00 0.00 178.15 178.47 3abk h SER 43 N 0.05 0.20 -0.48 1.72 4.64 0.09 -2.24 113.55 117.53 3abk h SER 43 Ca 0.25 -0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 61.39 3abk h SER 43 Cb 0.38 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 3abk h SER 43 CO -0.47 0.59 -0.03 0.25 -0.87 0.00 0.00 176.83 176.30 3abk h LEU 44 N 0.16 0.90 -0.83 5.97 5.85 0.13 -2.44 115.31 125.06 3abk h LEU 44 Ca 0.02 -0.25 -0.07 0.00 0.84 0.00 0.00 57.88 58.42 3abk h LEU 44 Cb 0.79 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 3abk h LEU 44 CO 0.06 0.98 -0.31 0.24 -0.34 0.00 0.00 178.44 179.07 3abk h MET 45 N 0.85 0.00 -0.32 1.25 2.86 -0.27 -2.99 114.93 116.31 3abk h MET 45 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 3abk h MET 45 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 3abk h MET 45 CO 0.03 0.31 0.00 1.28 1.06 0.00 0.00 176.91 179.59 3abk n LEU 46 N -3.39 3.36 -0.93 1.22 4.77 -0.94 -4.52 117.00 116.57 3abk n LEU 46 Ca 0.00 -1.38 0.00 0.00 -0.03 0.00 0.00 56.01 54.60 3abk n LEU 46 Cb 0.51 -0.20 0.20 0.00 -2.33 0.00 0.00 43.42 41.60 3abk n LEU 46 CO 0.36 0.69 0.60 0.35 -1.33 0.00 0.00 177.39 178.05 3abk n THR 47 N 1.46 2.41 -4.02 -5.08 -2.24 -1.07 -5.00 114.28 100.74 3abk n THR 47 Ca 0.18 -2.80 -0.13 0.00 -2.27 0.00 0.00 64.05 59.03 3abk n THR 47 Cb 0.60 -0.29 -0.14 0.00 -2.10 0.00 0.00 70.33 68.41 3abk n THR 47 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3abk s THR 48 N -3.20 0.23 -0.74 4.28 -1.32 -1.26 -5.02 115.64 108.62 3abk s THR 48 Ca 0.42 -0.29 0.26 0.00 -1.21 0.00 0.00 61.69 60.87 3abk s THR 48 Cb 0.39 -0.23 0.24 0.00 -1.51 0.00 0.00 72.50 71.39 3abk s THR 48 CO -0.01 -0.04 1.70 0.29 -2.21 0.00 0.00 174.62 174.35 3abk n LYS 49 N 2.72 0.25 -1.75 7.08 4.76 -1.26 -4.88 118.16 125.07 3abk n LYS 49 Ca -0.15 0.18 -0.41 0.00 -2.87 0.00 0.00 58.31 55.07 3abk n LYS 49 Cb 0.58 -1.76 0.01 0.00 -1.84 0.00 0.00 35.03 32.02 3abk n LYS 49 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3abk n LEU 50 N -2.19 4.79 -4.21 -0.35 4.77 -1.26 -5.03 117.00 113.53 3abk n LEU 50 Ca 0.05 1.15 -0.13 0.00 -0.03 0.00 0.00 56.01 57.06 3abk n LEU 50 Cb 0.43 -1.59 -0.10 0.00 -2.33 0.00 0.00 43.42 39.83 3abk n LEU 50 CO 0.31 -0.15 -0.40 0.42 -1.33 0.00 0.00 177.39 176.24 3abk s THR 51 N -1.17 0.97 -0.29 -5.08 -4.23 -1.26 -5.12 115.64 99.46 3abk s THR 51 Ca 0.59 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 59.15 3abk s THR 51 Cb -0.47 -1.73 0.20 0.00 1.34 0.00 0.00 72.50 71.83 3abk s THR 51 CO 0.60 -0.77 0.60 -2.28 -0.54 0.00 0.00 174.62 172.22 3abk s HIS 52 N -3.34 -1.74 0.00 3.99 5.04 -1.26 -5.05 115.29 112.93 3abk s HIS 52 Ca 0.14 1.38 0.00 0.00 -1.54 0.00 0.00 55.06 55.03 3abk s HIS 52 Cb 0.03 0.43 0.00 0.00 0.04 0.00 0.00 32.58 33.08 3abk s HIS 52 CO -0.01 -0.99 0.41 0.25 -2.34 0.00 0.00 174.74 172.06 3abk n THR 53 N 5.42 0.00 -1.08 0.89 -2.24 -1.26 -5.02 114.28 110.99 3abk n THR 53 Ca 0.02 -0.48 -0.29 0.00 -2.27 0.00 0.00 64.05 61.04 3abk n THR 53 Cb 0.53 1.04 0.19 0.00 -2.10 0.00 0.00 70.33 69.99 3abk n THR 53 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3abk s SER 54 N -0.13 2.21 0.27 3.42 1.04 -1.26 -4.92 113.70 114.33 3abk s SER 54 Ca 0.00 1.17 -0.31 0.00 0.48 0.00 0.00 55.95 57.29 3abk s SER 54 Cb 0.00 -1.83 -0.12 0.00 0.10 0.00 0.00 66.02 64.17 3abk s SER 54 CO 0.00 -3.38 1.57 0.41 0.98 0.00 0.00 173.24 172.81 3abk n THR 55 N -4.34 0.85 -4.39 2.02 -1.04 -1.26 -5.00 114.28 101.12 3abk n THR 55 Ca 0.05 -0.21 -0.34 0.00 -2.04 0.00 0.00 64.05 61.51 3abk n THR 55 Cb 0.57 -1.84 -0.11 0.00 -1.82 0.00 0.00 70.33 67.14 3abk n THR 55 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 3abk s MET 56 N -0.24 3.34 -0.02 -2.82 1.00 -1.26 -5.09 119.30 114.21 3abk s MET 56 Ca 0.67 -0.47 -0.30 0.00 0.00 0.00 0.00 55.69 55.59 3abk s MET 56 Cb -0.54 -2.85 -0.06 0.00 0.00 0.00 0.00 34.83 31.38 3abk s MET 56 CO 0.47 0.46 1.51 0.34 0.00 0.00 0.00 175.02 177.80 3abk s ASP 57 N -0.22 6.76 0.13 3.03 2.15 -1.26 -4.97 116.67 122.29 3abk s ASP 57 Ca 0.05 2.17 0.23 0.00 0.43 0.00 0.00 52.55 55.43 3abk s ASP 57 Cb -0.13 -2.55 0.16 0.00 -0.30 0.00 0.00 42.92 40.10 3abk s ASP 57 CO 0.02 -0.82 1.16 0.00 -0.17 0.00 0.00 175.17 175.36 3abk n ALA 58 N 6.14 2.88 -2.27 3.66 0.00 -1.26 -4.80 120.51 124.87 3abk n ALA 58 Ca 0.15 -0.28 -0.41 0.00 0.00 0.00 0.00 53.44 52.90 3abk n ALA 58 Cb 0.43 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.78 3abk n ALA 58 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3abk n GLN 59 N -2.27 4.43 0.07 0.00 -0.06 -1.26 -1.95 117.38 116.34 3abk n GLN 59 Ca 0.02 -3.74 0.00 0.00 -2.00 0.00 0.00 57.00 51.28 3abk n GLN 59 Cb 0.48 -2.68 0.00 0.00 -4.06 0.00 0.00 30.24 23.98 3abk n GLN 59 CO 0.00 0.00 0.00 -0.85 -0.20 0.00 0.00 177.06 176.01 3abk n GLU 60 N 2.05 0.00 0.23 3.69 -0.00 -1.26 -4.82 120.64 120.54 3abk n GLU 60 Ca 0.51 0.00 0.10 0.00 -0.00 0.00 0.00 57.16 57.76 3abk n GLU 60 Cb 0.29 0.00 0.54 0.00 -0.00 0.00 0.00 31.44 32.27 3abk n GLU 60 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.13 176.89 3abk h VAL 61 N 0.00 0.68 0.00 3.84 3.04 -1.84 -2.52 116.25 119.44 3abk h VAL 61 Ca 0.00 -0.96 -0.07 0.00 -1.01 0.00 0.00 66.70 64.66 3abk h VAL 61 Cb 0.00 1.61 -0.01 0.00 -2.01 0.00 0.00 31.29 30.88 3abk h VAL 61 CO 0.00 0.22 -0.32 -0.33 -1.01 0.00 0.00 177.57 176.13 3abk h GLU 62 N 0.00 0.00 -0.12 4.17 5.08 -1.71 -1.84 114.58 120.17 3abk h GLU 62 Ca -0.00 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 3abk h GLU 62 Cb 0.59 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 3abk h GLU 62 CO 0.03 0.32 -0.14 1.15 -1.00 0.00 0.00 179.01 179.37 3abk h THR 63 N 0.00 0.62 -0.75 1.13 2.02 -1.74 -2.73 112.91 111.46 3abk h THR 63 Ca -0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3abk h THR 63 Cb 1.12 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 3abk h THR 63 CO 0.04 0.00 0.32 0.40 0.37 0.00 0.00 175.52 176.66 3abk h ILE 64 N -0.18 1.25 -0.29 3.11 1.08 -1.47 0.15 117.51 121.15 3abk h ILE 64 Ca 0.09 -0.75 0.00 0.00 -0.39 0.00 0.00 64.86 63.81 3abk h ILE 64 Cb 0.30 0.35 0.00 0.00 -3.07 0.00 0.00 36.82 34.40 3abk h ILE 64 CO -0.22 0.31 0.00 -2.67 -0.69 0.00 0.00 178.15 174.88 3abk n TRP 65 N -4.36 0.74 0.00 1.37 2.14 -0.72 -1.81 117.44 114.80 3abk n TRP 65 Ca 0.06 -0.28 0.00 0.00 2.07 0.00 0.00 57.50 59.35 3abk n TRP 65 Cb 0.16 -0.17 0.00 0.00 -0.81 0.00 0.00 31.31 30.49 3abk n TRP 65 CO 0.00 0.00 0.00 2.41 2.07 0.00 0.00 177.69 182.17 3abk n THR 66 N 0.36 0.00 -0.13 -1.67 -1.04 -0.81 -4.50 114.28 106.49 3abk n THR 66 Ca 0.12 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.03 3abk n THR 66 Cb 0.51 -1.08 -0.02 0.00 -1.82 0.00 0.00 70.33 67.93 3abk n THR 66 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3abk h ILE 67 N 0.00 1.25 0.29 12.58 1.08 -0.76 -0.85 117.51 131.11 3abk h ILE 67 Ca 0.00 -0.92 -0.01 0.00 -0.39 0.00 0.00 64.86 63.54 3abk h ILE 67 Cb 0.78 1.11 0.00 0.00 -3.07 0.00 0.00 36.82 35.64 3abk h ILE 67 CO 0.00 0.31 -0.14 -0.07 -0.69 0.00 0.00 178.15 177.56 3abk h LEU 68 N 0.48 -0.33 -1.41 1.44 4.07 -1.54 0.18 115.31 118.20 3abk h LEU 68 Ca 0.11 -0.14 0.19 0.00 0.08 0.00 0.00 57.88 58.12 3abk h LEU 68 Cb 0.41 0.09 -0.07 0.00 1.08 0.00 0.00 40.66 42.16 3abk h LEU 68 CO 0.01 -0.04 0.59 -0.65 -1.08 0.00 0.00 178.44 177.28 3abk h PRO 69 N -0.64 0.49 -0.50 1.13 0.11 -1.76 -0.89 132.00 129.96 3abk h PRO 69 Ca -0.04 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.91 3abk h PRO 69 Cb 0.45 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 3abk h PRO 69 CO 0.07 0.33 -0.20 0.00 -0.21 0.00 0.00 178.00 177.98 3abk h ALA 70 N 1.61 0.70 -0.46 -0.75 0.00 0.39 -0.35 119.26 120.40 3abk h ALA 70 Ca 0.47 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3abk h ALA 70 Cb 1.03 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3abk h ALA 70 CO -0.20 0.68 0.07 0.82 0.00 0.00 0.00 179.25 180.61 3abk h ILE 71 N 0.87 1.25 -0.77 0.00 2.04 0.08 -1.91 117.51 119.08 3abk h ILE 71 Ca 0.12 -0.91 0.05 0.00 1.00 0.00 0.00 64.86 65.11 3abk h ILE 71 Cb 0.78 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 3abk h ILE 71 CO 0.07 0.32 0.47 0.40 0.00 0.00 0.00 178.15 179.41 3abk h ILE 72 N 0.63 1.05 -0.52 -0.67 2.04 -0.56 -1.74 117.51 117.74 3abk h ILE 72 Ca 0.14 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.66 3abk h ILE 72 Cb 0.39 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.53 3abk h ILE 72 CO 0.01 0.16 0.18 -0.07 0.00 0.00 0.00 178.15 178.43 3abk h LEU 73 N 0.89 0.74 -1.04 1.44 3.38 -0.89 -1.47 115.31 118.35 3abk h LEU 73 Ca 0.33 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 58.13 3abk h LEU 73 Cb 0.11 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 3abk h LEU 73 CO -0.15 0.73 0.64 0.40 0.09 0.00 0.00 178.44 180.16 3abk h ILE 74 N 0.71 1.19 0.00 1.22 2.04 -0.94 0.16 117.51 121.88 3abk h ILE 74 Ca 0.17 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 3abk h ILE 74 Cb 0.25 -0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.14 3abk h ILE 74 CO -0.01 0.23 -0.06 -0.07 0.00 0.00 0.00 178.15 178.24 3abk h LEU 75 N 1.26 0.00 0.04 1.44 4.07 -0.78 0.65 115.31 121.99 3abk h LEU 75 Ca 0.38 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 58.15 3abk h LEU 75 Cb -0.04 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.68 3abk h LEU 75 CO -0.11 0.06 -1.04 0.40 -1.08 0.00 0.00 178.44 176.67 3abk h ILE 76 N 0.00 1.14 -0.85 1.22 2.04 -0.58 -3.41 117.51 117.08 3abk h ILE 76 Ca -0.00 -2.28 0.01 0.00 1.00 0.00 0.00 64.86 63.59 3abk h ILE 76 Cb 0.42 2.64 -0.04 0.00 -0.74 0.00 0.00 36.82 39.10 3abk h ILE 76 CO 0.01 0.51 0.56 0.00 0.00 0.00 0.00 178.15 179.23 3abk h ALA 77 N -0.24 1.41 0.40 1.87 0.00 -0.46 -2.18 119.26 120.06 3abk h ALA 77 Ca -0.26 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 3abk h ALA 77 Cb 1.39 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3abk h ALA 77 CO -0.08 0.54 -0.41 -0.07 0.00 0.00 0.00 179.25 179.24 3abk h LEU 78 N 1.13 -1.13 -1.22 0.00 4.07 -1.09 -0.13 115.31 116.95 3abk h LEU 78 Ca 0.31 0.09 -0.06 0.00 0.08 0.00 0.00 57.88 58.31 3abk h LEU 78 Cb -0.11 0.37 -0.01 0.00 1.08 0.00 0.00 40.66 41.99 3abk h LEU 78 CO -0.07 -0.54 -0.10 1.55 -1.08 0.00 0.00 178.44 178.20 3abk h PRO 79 N -0.81 0.41 -0.26 1.13 0.13 -1.77 -1.06 132.00 129.77 3abk h PRO 79 Ca -0.05 -0.10 0.06 0.00 -0.87 0.00 0.00 66.00 65.04 3abk h PRO 79 Cb 0.70 -0.05 -0.06 0.00 0.13 0.00 0.00 31.00 31.72 3abk h PRO 79 CO -0.06 0.52 -0.14 1.03 -0.23 0.00 0.00 178.00 179.13 3abk h SER 80 N 0.39 -0.47 0.91 1.44 0.87 -1.09 -1.09 113.55 114.51 3abk h SER 80 Ca 0.08 0.11 -0.20 0.00 -1.23 0.00 0.00 61.79 60.54 3abk h SER 80 Cb 0.42 0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.61 3abk h SER 80 CO 0.02 -0.18 -0.96 -0.07 -0.53 0.00 0.00 176.83 175.11 3abk h LEU 81 N -0.11 0.04 -0.31 2.23 3.38 -0.87 -1.75 115.31 117.92 3abk h LEU 81 Ca 0.14 -0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.14 3abk h LEU 81 Cb 0.32 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 3abk h LEU 81 CO -0.33 0.98 -0.11 -0.09 0.09 0.00 0.00 178.44 178.98 3abk h ARG 82 N 0.01 -0.04 -0.55 1.13 2.43 -0.76 -1.91 114.38 114.69 3abk h ARG 82 Ca -0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3abk h ARG 82 Cb 1.69 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 31.22 3abk h ARG 82 CO 0.13 -0.03 0.35 0.82 -1.51 0.00 0.00 179.97 179.73 3abk h ILE 83 N -0.04 1.15 -0.19 1.20 2.04 -1.07 -0.95 117.51 119.65 3abk h ILE 83 Ca 0.15 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.74 3abk h ILE 83 Cb 0.27 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.69 3abk h ILE 83 CO -0.34 0.15 -0.06 0.25 0.00 0.00 0.00 178.15 178.15 3abk h LEU 84 N 0.74 -0.23 -0.70 1.44 5.85 -1.07 0.31 115.31 121.65 3abk h LEU 84 Ca 0.20 0.06 -0.14 0.00 0.84 0.00 0.00 57.88 58.85 3abk h LEU 84 Cb -0.05 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3abk h LEU 84 CO -0.04 -0.09 -0.63 1.88 -0.34 0.00 0.00 178.44 179.23 3abk h TYR 85 N -0.03 0.11 0.26 1.25 -1.99 -1.18 -2.76 116.97 112.64 3abk h TYR 85 Ca 0.10 -0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 3abk h TYR 85 Cb 0.17 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.89 3abk h TYR 85 CO -0.23 0.69 -0.12 1.98 -0.00 0.00 0.00 178.16 180.48 3abk h MET 86 N 0.06 -0.34 -1.13 4.88 1.85 -0.70 -0.66 114.93 118.90 3abk h MET 86 Ca -0.01 0.02 0.32 0.00 -0.61 0.00 0.00 59.70 59.42 3abk h MET 86 Cb 1.12 0.08 -0.06 0.00 0.43 0.00 0.00 31.60 33.17 3abk h MET 86 CO 0.09 -0.12 0.79 0.52 -0.40 0.00 0.00 176.91 177.78 3abk h MET 87 N -0.49 0.11 0.00 0.39 2.86 -0.93 -2.61 114.93 114.26 3abk h MET 87 Ca -0.04 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3abk h MET 87 Cb 0.37 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.00 3abk h MET 87 CO 0.06 0.07 -0.46 -3.47 1.06 0.00 0.00 176.91 174.17 3abk n ASP 88 N -4.32 0.61 -4.78 1.22 -0.08 -0.33 -4.95 116.55 103.93 3abk n ASP 88 Ca 0.25 0.14 -0.36 0.00 -1.51 0.00 0.00 54.79 53.32 3abk n ASP 88 Cb 1.13 -0.01 -0.01 0.00 2.34 0.00 0.00 41.12 44.57 3abk n ASP 88 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 3abk s GLU 89 N -3.11 3.64 0.12 -0.67 2.02 -0.76 -4.89 118.70 115.05 3abk s GLU 89 Ca 0.08 1.64 -0.35 0.00 0.02 0.00 0.00 54.97 56.37 3abk s GLU 89 Cb 0.15 -2.23 -0.16 0.00 0.10 0.00 0.00 34.13 31.99 3abk s GLU 89 CO 0.68 -0.62 1.34 -0.89 0.02 0.00 0.00 175.26 175.80 3abk n ILE 90 N -0.81 0.23 -0.01 -1.63 5.41 -1.26 -4.93 119.36 116.35 3abk n ILE 90 Ca 0.09 -0.06 0.02 0.00 1.00 0.00 0.00 62.75 63.80 3abk n ILE 90 Cb 0.50 -0.96 -0.06 0.00 -0.71 0.00 0.00 39.64 38.41 3abk n ILE 90 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3abk n ASN 91 N 2.53 3.15 -3.32 4.38 3.02 -1.26 -5.09 115.26 118.67 3abk n ASN 91 Ca 0.17 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.37 3abk n ASN 91 Cb 0.22 1.17 0.04 0.00 -0.61 0.00 0.00 39.78 40.59 3abk n ASN 91 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3abk n ASN 92 N -1.93 -5.10 -4.78 6.41 3.02 -1.26 -4.98 115.26 106.65 3abk n ASN 92 Ca -0.05 -0.13 -0.34 0.00 -0.03 0.00 0.00 54.58 54.03 3abk n ASN 92 Cb 0.37 -1.47 -0.00 0.00 -0.61 0.00 0.00 39.78 38.07 3abk n ASN 92 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3abk s PRO 93 N -2.21 3.42 0.02 3.52 0.04 -1.26 -4.84 135.00 133.68 3abk s PRO 93 Ca 0.35 1.48 0.24 0.00 0.04 0.00 0.00 61.00 63.11 3abk s PRO 93 Cb -0.04 -2.03 0.40 0.00 0.04 0.00 0.00 34.50 32.88 3abk s PRO 93 CO 0.78 -0.77 1.34 0.43 0.04 0.00 0.00 177.00 178.82 3abk n SER 94 N -1.40 0.56 -3.76 6.66 7.64 -0.01 -4.96 113.62 118.35 3abk n SER 94 Ca 0.11 -0.25 -0.13 0.00 1.01 0.00 0.00 58.87 59.60 3abk n SER 94 Cb 0.52 0.33 -0.09 0.00 -1.01 0.00 0.00 64.21 63.95 3abk n SER 94 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3abk s LEU 95 N -3.22 0.83 -0.04 -3.43 2.96 -1.25 -5.08 118.68 109.45 3abk s LEU 95 Ca 0.10 0.25 0.04 0.00 -0.22 0.00 0.00 54.13 54.30 3abk s LEU 95 Cb 0.17 1.22 -0.00 0.00 0.50 0.00 0.00 46.19 48.07 3abk s LEU 95 CO 0.72 -0.35 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.34 3abk s THR 96 N -0.89 1.39 -0.03 3.68 2.01 -1.26 -1.32 115.64 119.22 3abk s THR 96 Ca -0.10 -0.70 0.05 0.00 0.31 0.00 0.00 61.69 61.25 3abk s THR 96 Cb -0.04 -1.19 -0.01 0.00 0.01 0.00 0.00 72.50 71.26 3abk s THR 96 CO 0.03 0.40 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.50 3abk s VAL 97 N -0.01 1.38 0.03 3.82 1.01 -0.56 -4.39 120.40 121.68 3abk s VAL 97 Ca -0.02 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.25 3abk s VAL 97 Cb -0.11 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 3abk s VAL 97 CO 0.02 0.40 0.12 -0.54 0.00 0.00 0.00 175.10 175.10 3abk s LYS 98 N -0.14 3.15 -0.06 2.72 1.02 0.04 -1.30 119.74 125.18 3abk s LYS 98 Ca 0.01 -0.51 0.04 0.00 0.02 0.00 0.00 55.97 55.53 3abk s LYS 98 Cb -0.09 -2.90 -0.00 0.00 -0.52 0.00 0.00 37.83 34.32 3abk s LYS 98 CO 0.01 0.62 -0.18 -0.08 -0.92 0.00 0.00 175.35 174.80 3abk s THR 99 N -1.34 1.56 -0.17 2.17 -1.32 -0.40 -0.77 115.64 115.37 3abk s THR 99 Ca 0.28 -0.77 -0.02 0.00 -1.21 0.00 0.00 61.69 59.97 3abk s THR 99 Cb -0.12 -1.34 -0.01 0.00 -1.51 0.00 0.00 72.50 69.51 3abk s THR 99 CO 0.20 0.45 -0.09 -0.04 -2.21 0.00 0.00 174.62 172.93 3abk s MET 100 N 0.15 3.42 0.47 7.08 -1.94 -0.10 -0.96 119.30 127.41 3abk s MET 100 Ca -0.07 -0.64 -0.20 0.00 -1.71 0.00 0.00 55.69 53.06 3abk s MET 100 Cb -0.13 -2.81 -0.09 0.00 2.01 0.00 0.00 34.83 33.81 3abk s MET 100 CO 0.04 0.07 1.00 0.20 -0.01 0.00 0.00 175.02 176.32 3abk s GLY 101 N 0.76 2.42 0.17 -0.03 0.00 0.15 -1.63 107.32 109.16 3abk s GLY 101 Ca -0.04 0.50 -0.05 0.00 0.00 0.00 0.00 44.72 45.13 3abk s GLY 101 CO 0.02 0.80 0.19 0.30 0.00 0.00 0.00 173.10 174.41 3abk s HIS 102 N -2.11 0.73 -0.56 1.90 3.76 -0.15 -1.11 115.29 117.75 3abk s HIS 102 Ca 0.65 -1.06 -0.26 0.00 -0.15 0.00 0.00 55.06 54.24 3abk s HIS 102 Cb -0.13 -0.29 0.04 0.00 1.11 0.00 0.00 32.58 33.30 3abk s HIS 102 CO 0.19 -0.66 1.04 -0.65 -0.85 0.00 0.00 174.74 173.81 3abk s GLN 103 N -4.05 3.41 -0.40 1.40 -0.21 -1.26 -1.27 119.66 117.29 3abk s GLN 103 Ca 0.25 -0.04 0.01 0.00 0.02 0.00 0.00 55.36 55.61 3abk s GLN 103 Cb 0.05 -4.03 0.14 0.00 1.00 0.00 0.00 33.01 30.17 3abk s GLN 103 CO 0.04 -1.55 0.24 -1.58 -2.12 0.00 0.00 175.29 170.32 3abk s TRP 104 N 4.35 1.38 -0.13 0.91 0.51 -1.26 -5.13 118.94 119.57 3abk s TRP 104 Ca 0.36 -2.07 -0.33 0.00 -2.12 0.00 0.00 56.10 51.93 3abk s TRP 104 Cb -0.10 -1.40 0.13 0.00 -0.81 0.00 0.00 33.47 31.28 3abk s TRP 104 CO 0.22 -0.80 1.10 1.52 -0.51 0.00 0.00 176.95 178.48 3abk s TYR 105 N 0.62 -0.20 0.04 -1.98 1.13 -0.39 -4.72 117.35 111.85 3abk s TYR 105 Ca 0.19 0.12 0.03 0.00 -1.41 0.00 0.00 57.07 56.00 3abk s TYR 105 Cb -0.21 0.52 -0.04 0.00 -1.10 0.00 0.00 41.96 41.13 3abk s TYR 105 CO -0.01 -0.32 -0.00 -1.58 -2.51 0.00 0.00 175.55 171.13 3abk s TRP 106 N -2.65 3.03 0.10 -3.49 0.52 -1.02 -0.98 118.94 114.45 3abk s TRP 106 Ca 0.08 0.03 0.08 0.00 0.02 0.00 0.00 56.10 56.31 3abk s TRP 106 Cb -0.01 -1.61 -0.04 0.00 -1.15 0.00 0.00 33.47 30.66 3abk s TRP 106 CO -0.06 0.46 -0.17 -1.54 0.02 0.00 0.00 176.95 175.66 3abk s SER 107 N -1.85 3.93 0.02 2.95 1.04 -0.64 0.10 113.70 119.25 3abk s SER 107 Ca 0.22 -0.52 0.06 0.00 0.48 0.00 0.00 55.95 56.19 3abk s SER 107 Cb -0.12 -0.59 -0.02 0.00 0.10 0.00 0.00 66.02 65.40 3abk s SER 107 CO 0.13 0.19 -0.17 -0.31 0.98 0.00 0.00 173.24 174.06 3abk s TYR 108 N -1.11 1.53 -0.09 5.02 2.02 -0.41 -0.93 117.35 123.38 3abk s TYR 108 Ca 0.18 -0.34 0.01 0.00 -0.37 0.00 0.00 57.07 56.55 3abk s TYR 108 Cb -0.11 -0.93 0.02 0.00 -0.40 0.00 0.00 41.96 40.54 3abk s TYR 108 CO 0.10 0.04 -0.11 -1.21 -1.57 0.00 0.00 175.55 172.80 3abk s GLU 109 N -0.92 1.65 -0.36 -0.62 2.02 0.05 -1.94 118.70 118.59 3abk s GLU 109 Ca 0.05 -0.36 0.03 0.00 0.02 0.00 0.00 54.97 54.72 3abk s GLU 109 Cb -0.08 -1.49 0.10 0.00 0.10 0.00 0.00 34.13 32.77 3abk s GLU 109 CO 0.01 -0.09 0.08 0.71 0.02 0.00 0.00 175.26 175.99 3abk s TYR 110 N 1.07 3.43 -0.14 1.61 2.02 0.31 -0.78 117.35 124.87 3abk s TYR 110 Ca -0.07 -2.86 0.15 0.00 -0.37 0.00 0.00 57.07 53.91 3abk s TYR 110 Cb -0.14 -2.75 0.37 0.00 -0.40 0.00 0.00 41.96 39.03 3abk s TYR 110 CO -0.01 -0.92 1.18 0.25 -1.57 0.00 0.00 175.55 174.48 3abk n THR 111 N 4.19 1.61 0.04 -0.71 -2.24 -1.26 -2.55 114.28 113.36 3abk n THR 111 Ca 0.03 -2.43 -0.01 0.00 -2.27 0.00 0.00 64.05 59.38 3abk n THR 111 Cb 0.41 0.03 0.28 0.00 -2.10 0.00 0.00 70.33 68.94 3abk n THR 111 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3abk h ASP 112 N 0.72 0.42 0.00 3.42 3.32 -1.93 -3.42 116.42 118.94 3abk h ASP 112 Ca -0.04 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.90 3abk h ASP 112 Cb 1.18 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.62 3abk h ASP 112 CO 0.02 0.59 -0.35 -1.22 -1.72 0.00 0.00 179.24 176.56 3abk n TYR 113 N -4.20 -0.45 -4.10 4.55 4.01 -1.26 -5.13 117.16 110.57 3abk n TYR 113 Ca 0.00 0.08 -0.24 0.00 -0.16 0.00 0.00 57.90 57.58 3abk n TYR 113 Cb 0.32 0.23 -0.07 0.00 -0.31 0.00 0.00 39.34 39.51 3abk n TYR 113 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3abk s GLU 114 N -2.00 2.27 -1.12 -0.72 0.41 -1.26 -5.02 118.70 111.25 3abk s GLU 114 Ca 0.00 -1.74 -0.14 0.00 -0.41 0.00 0.00 54.97 52.68 3abk s GLU 114 Cb 0.00 -2.05 0.19 0.00 -1.78 0.00 0.00 34.13 30.49 3abk s GLU 114 CO 0.00 -0.04 1.28 -0.51 -0.49 0.00 0.00 175.26 175.50 3abk s ASP 115 N -3.89 7.04 -0.23 -0.19 -0.00 -1.26 -4.20 116.67 113.93 3abk s ASP 115 Ca 0.40 -2.95 -0.11 0.00 -0.00 0.00 0.00 52.55 49.89 3abk s ASP 115 Cb 0.01 -2.35 -0.05 0.00 -0.00 0.00 0.00 42.92 40.53 3abk s ASP 115 CO 0.23 -0.69 0.19 -0.22 -0.00 0.00 0.00 175.17 174.67 3abk s LEU 116 N 1.10 4.13 0.06 1.23 2.96 -1.06 -4.95 118.68 122.16 3abk s LEU 116 Ca 0.37 0.18 -0.12 0.00 -0.22 0.00 0.00 54.13 54.34 3abk s LEU 116 Cb -0.05 -2.16 0.01 0.00 0.50 0.00 0.00 46.19 44.49 3abk s LEU 116 CO -0.04 0.05 0.27 -0.94 -1.32 0.00 0.00 176.35 174.38 3abk s SER 117 N 1.00 -0.06 0.29 3.68 1.04 -1.26 -0.53 113.70 117.86 3abk s SER 117 Ca 0.09 -0.32 -0.17 0.00 0.48 0.00 0.00 55.95 56.04 3abk s SER 117 Cb -0.13 0.35 0.02 0.00 0.10 0.00 0.00 66.02 66.36 3abk s SER 117 CO 0.04 -0.65 0.65 0.72 0.98 0.00 0.00 173.24 174.98 3abk s PHE 118 N -2.92 0.10 0.17 5.02 -0.12 -0.82 -4.99 117.98 114.42 3abk s PHE 118 Ca -0.02 -0.55 0.05 0.00 -0.05 0.00 0.00 56.93 56.36 3abk s PHE 118 Cb 0.00 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.89 3abk s PHE 118 CO -0.06 -1.22 0.12 -0.51 -0.05 0.00 0.00 175.22 173.50 3abk s ASP 119 N -2.99 5.43 -0.24 1.98 1.01 -1.26 -1.29 116.67 119.30 3abk s ASP 119 Ca 0.16 -0.17 -0.03 0.00 0.71 0.00 0.00 52.55 53.23 3abk s ASP 119 Cb -0.04 -1.39 0.08 0.00 1.01 0.00 0.00 42.92 42.58 3abk s ASP 119 CO 0.09 0.07 0.07 -0.55 0.21 0.00 0.00 175.17 175.06 3abk s SER 120 N -3.12 3.30 0.10 0.27 0.15 0.29 -4.55 113.70 110.13 3abk s SER 120 Ca 0.31 -1.12 0.06 0.00 0.70 0.00 0.00 55.95 55.89 3abk s SER 120 Cb -0.10 -0.60 -0.04 0.00 -1.71 0.00 0.00 66.02 63.58 3abk s SER 120 CO 0.23 -0.37 -0.04 -0.31 1.20 0.00 0.00 173.24 173.95 3abk s TYR 121 N 1.86 2.88 0.39 3.44 2.02 -1.26 -2.44 117.35 124.24 3abk s TYR 121 Ca 0.04 -0.09 -0.26 0.00 -0.37 0.00 0.00 57.07 56.39 3abk s TYR 121 Cb -0.17 -1.49 -0.11 0.00 -0.40 0.00 0.00 41.96 39.80 3abk s TYR 121 CO -0.18 0.46 1.22 -0.12 -1.57 0.00 0.00 175.55 175.36 3abk n MET 122 N 0.60 1.87 -2.65 -0.62 0.00 -1.26 -1.30 117.12 113.75 3abk n MET 122 Ca -0.12 0.66 -0.43 0.00 -0.00 0.00 0.00 57.70 57.82 3abk n MET 122 Cb 0.52 -2.29 -0.02 0.00 0.00 0.00 0.00 33.22 31.43 3abk n MET 122 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 3abk s ILE 123 N -1.17 4.69 0.59 1.12 -1.09 0.55 -4.77 121.20 121.12 3abk s ILE 123 Ca 0.60 1.98 -0.20 0.00 -2.23 0.00 0.00 60.65 60.79 3abk s ILE 123 Cb -0.54 -4.27 -0.03 0.00 -1.58 0.00 0.00 42.46 36.03 3abk s ILE 123 CO 0.59 -0.03 1.30 -2.84 -1.23 0.00 0.00 174.94 172.74 3abk s PRO 124 N 2.25 2.92 0.34 2.79 0.02 -1.26 -4.66 135.00 137.41 3abk s PRO 124 Ca 0.49 2.09 0.05 0.00 0.02 0.00 0.00 61.00 63.65 3abk s PRO 124 Cb -0.19 -2.06 0.70 0.00 0.02 0.00 0.00 34.50 32.98 3abk s PRO 124 CO 0.16 -1.32 1.93 1.15 -0.33 0.00 0.00 177.00 178.59 3abk h THR 125 N 1.04 0.99 0.00 0.99 2.02 -1.99 0.48 112.91 116.44 3abk h THR 125 Ca -0.51 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.39 3abk h THR 125 Cb 1.31 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 3abk h THR 125 CO 0.55 0.15 0.00 -1.54 0.37 0.00 0.00 175.52 175.05 3abk n SER 126 N -4.50 0.38 -0.45 4.18 3.41 -1.26 -2.81 113.62 112.57 3abk n SER 126 Ca 0.13 0.59 0.06 0.00 -0.26 0.00 0.00 58.87 59.38 3abk n SER 126 Cb 0.28 -0.67 0.05 0.00 -0.26 0.00 0.00 64.21 63.61 3abk n SER 126 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3abk n GLU 127 N -1.91 0.61 -1.71 4.33 1.02 0.12 -5.01 120.64 118.09 3abk n GLU 127 Ca 0.03 -1.19 -0.39 0.00 -0.02 0.00 0.00 57.16 55.60 3abk n GLU 127 Cb 0.22 -1.21 0.04 0.00 -0.02 0.00 0.00 31.44 30.47 3abk n GLU 127 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3abk n LEU 128 N 0.62 5.01 -4.87 -4.62 4.77 -0.97 -4.91 117.00 112.03 3abk n LEU 128 Ca 0.07 0.95 -0.31 0.00 -0.03 0.00 0.00 56.01 56.69 3abk n LEU 128 Cb 0.28 -1.53 -0.05 0.00 -2.33 0.00 0.00 43.42 39.79 3abk n LEU 128 CO 0.07 -0.86 0.32 -0.54 -1.33 0.00 0.00 177.39 175.04 3abk s LYS 129 N -2.80 3.83 0.24 3.23 1.02 -1.26 -4.96 119.74 119.04 3abk s LYS 129 Ca 0.72 0.38 -0.31 0.00 0.02 0.00 0.00 55.97 56.78 3abk s LYS 129 Cb -0.43 -2.53 -0.14 0.00 -0.52 0.00 0.00 37.83 34.21 3abk s LYS 129 CO 0.49 0.19 1.35 -2.30 -0.92 0.00 0.00 175.35 174.16 3abk n PRO 130 N -0.55 1.90 -0.02 -1.68 -0.02 -1.26 -0.59 135.00 132.79 3abk n PRO 130 Ca 0.01 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 3abk n PRO 130 Cb 0.53 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 3abk n PRO 130 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3abk n GLY 131 N 2.00 2.30 3.89 -1.23 0.00 -1.26 -5.04 105.19 105.85 3abk n GLY 131 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 3abk n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3abk s GLU 132 N -0.22 3.18 -0.27 1.61 2.02 0.25 -5.01 118.70 120.25 3abk s GLU 132 Ca 0.00 0.47 -0.14 0.00 0.02 0.00 0.00 54.97 55.32 3abk s GLU 132 Cb 0.00 -2.11 -0.04 0.00 0.10 0.00 0.00 34.13 32.08 3abk s GLU 132 CO 0.00 -0.75 0.32 -0.51 0.02 0.00 0.00 175.26 174.34 3abk s LEU 133 N -5.19 4.04 0.19 1.80 1.43 -1.26 -4.91 118.68 114.78 3abk s LEU 133 Ca 0.55 0.22 -0.33 0.00 -1.03 0.00 0.00 54.13 53.54 3abk s LEU 133 Cb -0.11 -2.35 -0.14 0.00 0.03 0.00 0.00 46.19 43.63 3abk s LEU 133 CO 0.51 -0.15 1.52 -1.14 0.23 0.00 0.00 176.35 177.32 3abk n ARG 134 N 5.24 2.12 -0.79 1.70 0.63 -1.26 -2.45 116.66 121.85 3abk n ARG 134 Ca -0.10 0.76 0.00 0.00 -0.92 0.00 0.00 57.85 57.59 3abk n ARG 134 Cb 0.51 -2.49 0.00 0.00 0.45 0.00 0.00 32.46 30.93 3abk n ARG 134 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3abk n LEU 135 N 2.94 0.59 -0.01 6.15 4.77 -1.26 -4.80 117.00 125.38 3abk n LEU 135 Ca 0.15 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.12 3abk n LEU 135 Cb 0.30 -1.13 -0.02 0.00 -2.33 0.00 0.00 43.42 40.24 3abk n LEU 135 CO 0.63 -0.39 -0.57 0.18 -1.33 0.00 0.00 177.39 175.92 3abk n LEU 136 N 0.00 0.32 -4.82 2.23 4.77 -1.02 -4.58 117.00 113.90 3abk n LEU 136 Ca 0.00 -0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 3abk n LEU 136 Cb 0.09 0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 3abk n LEU 136 CO 0.00 0.10 0.68 -1.61 -1.33 0.00 0.00 177.39 175.23 3abk s GLU 137 N -2.05 4.00 0.32 3.23 0.41 -1.16 -4.65 118.70 118.80 3abk s GLU 137 Ca -0.01 1.14 0.09 0.00 -0.41 0.00 0.00 54.97 55.78 3abk s GLU 137 Cb 0.01 -2.14 -0.06 0.00 -1.78 0.00 0.00 34.13 30.16 3abk s GLU 137 CO 0.08 -0.23 -0.09 0.14 -0.49 0.00 0.00 175.26 174.67 3abk s VAL 138 N -2.26 2.05 0.08 2.63 -7.23 -1.26 -0.33 120.40 114.08 3abk s VAL 138 Ca 0.63 -2.19 -0.19 0.00 -1.81 0.00 0.00 61.98 58.41 3abk s VAL 138 Cb -0.11 -2.55 -0.09 0.00 0.56 0.00 0.00 36.38 34.19 3abk s VAL 138 CO 0.20 -0.25 1.53 -2.24 -0.31 0.00 0.00 175.10 174.03 3abk h ASP 139 N 2.13 0.38 -3.56 4.85 -0.00 -1.50 -3.42 116.42 115.29 3abk h ASP 139 Ca -0.41 -0.29 -0.63 0.00 -0.00 0.00 0.00 57.03 55.71 3abk h ASP 139 Cb 1.24 -0.10 -0.39 0.00 -0.00 0.00 0.00 39.33 40.08 3abk h ASP 139 CO 0.69 0.57 -0.76 0.20 -0.00 0.00 0.00 179.24 179.94 3abk s ASN 140 N -5.85 4.25 0.74 4.15 0.01 -1.26 -5.04 114.94 111.94 3abk s ASN 140 Ca -0.14 -1.64 -0.11 0.00 -0.71 0.00 0.00 52.86 50.26 3abk s ASN 140 Cb 0.07 -1.29 0.04 0.00 0.41 0.00 0.00 41.25 40.48 3abk s ASN 140 CO 0.73 -0.32 1.10 -0.13 -1.51 0.00 0.00 177.10 176.97 3abk s ARG 141 N 1.25 2.55 -0.64 -0.60 0.52 -1.26 -4.60 118.95 116.18 3abk s ARG 141 Ca 0.03 0.56 -0.20 0.00 -0.52 0.00 0.00 55.73 55.60 3abk s ARG 141 Cb -0.19 -1.98 0.09 0.00 0.52 0.00 0.00 34.95 33.40 3abk s ARG 141 CO -0.11 -1.27 0.83 0.08 0.02 0.00 0.00 175.30 174.85 3abk s VAL 142 N -3.26 4.64 0.23 3.52 1.01 0.09 -4.88 120.40 121.75 3abk s VAL 142 Ca 0.59 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.53 3abk s VAL 142 Cb -0.12 -4.58 -0.08 0.00 0.00 0.00 0.00 36.38 31.59 3abk s VAL 142 CO 0.53 -1.28 0.78 -0.69 0.00 0.00 0.00 175.10 174.44 3abk s VAL 143 N 3.16 4.45 -0.01 2.92 1.01 -1.26 -0.59 120.40 130.08 3abk s VAL 143 Ca 0.17 1.49 -0.15 0.00 0.00 0.00 0.00 61.98 63.49 3abk s VAL 143 Cb -0.20 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.25 3abk s VAL 143 CO 0.06 0.27 0.31 -0.76 0.00 0.00 0.00 175.10 174.99 3abk s LEU 144 N -1.79 0.85 0.15 3.92 1.43 0.72 -4.89 118.68 119.07 3abk s LEU 144 Ca 0.43 0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 53.30 3abk s LEU 144 Cb -0.19 1.27 -0.07 0.00 0.03 0.00 0.00 46.19 47.23 3abk s LEU 144 CO 0.23 -0.45 1.20 -2.16 0.23 0.00 0.00 176.35 175.40 3abk s PRO 145 N -1.35 4.47 0.61 1.29 0.04 -1.26 -1.50 135.00 137.30 3abk s PRO 145 Ca -0.13 1.86 -0.15 0.00 0.04 0.00 0.00 61.00 62.61 3abk s PRO 145 Cb -0.05 -3.27 -0.03 0.00 0.04 0.00 0.00 34.50 31.20 3abk s PRO 145 CO 0.04 -0.14 1.07 0.00 0.04 0.00 0.00 177.00 178.01 3abk s MET 146 N 0.13 3.17 -1.47 4.56 0.23 0.23 -4.09 119.30 122.07 3abk s MET 146 Ca 0.55 1.23 -0.08 0.00 -1.03 0.00 0.00 55.69 56.36 3abk s MET 146 Cb -0.32 -2.01 0.03 0.00 -1.53 0.00 0.00 34.83 31.00 3abk s MET 146 CO 0.34 -0.93 0.77 0.39 -2.03 0.00 0.00 175.02 173.56 3abk n GLU 147 N -2.19 -5.38 -3.94 3.16 1.02 0.05 -4.76 120.64 108.61 3abk n GLU 147 Ca 0.09 0.77 -0.12 0.00 -0.02 0.00 0.00 57.16 57.88 3abk n GLU 147 Cb 0.53 -5.65 -0.13 0.00 -0.02 0.00 0.00 31.44 26.16 3abk n GLU 147 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 3abk s MET 148 N -6.03 0.14 -0.20 3.49 -1.94 -1.26 -5.01 119.30 108.48 3abk s MET 148 Ca 0.44 -0.16 -0.25 0.00 -1.71 0.00 0.00 55.69 54.01 3abk s MET 148 Cb -0.21 -0.05 -0.01 0.00 2.01 0.00 0.00 34.83 36.57 3abk s MET 148 CO 0.54 0.01 0.81 0.99 -0.01 0.00 0.00 175.02 177.36 3abk s THR 149 N -0.32 4.87 -0.04 2.05 2.01 -1.26 -4.42 115.64 118.53 3abk s THR 149 Ca -0.03 1.56 0.05 0.00 0.31 0.00 0.00 61.69 63.59 3abk s THR 149 Cb -0.02 -4.11 -0.02 0.00 0.01 0.00 0.00 72.50 68.36 3abk s THR 149 CO -0.00 -0.01 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.09 3abk s ILE 150 N 2.43 2.57 -0.26 1.82 1.01 0.63 -0.83 121.20 128.56 3abk s ILE 150 Ca 0.36 -0.90 -0.16 0.00 0.00 0.00 0.00 60.65 59.95 3abk s ILE 150 Cb -0.16 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.31 3abk s ILE 150 CO 0.10 0.58 0.40 -0.60 0.00 0.00 0.00 174.94 175.42 3abk s ARG 151 N -0.59 4.04 -0.17 2.79 3.52 -0.43 -0.76 118.95 127.34 3abk s ARG 151 Ca 0.09 0.10 -0.08 0.00 -0.13 0.00 0.00 55.73 55.71 3abk s ARG 151 Cb -0.11 -3.65 -0.04 0.00 -1.56 0.00 0.00 34.95 29.59 3abk s ARG 151 CO 0.00 -0.28 0.11 -1.64 -0.81 0.00 0.00 175.30 172.69 3abk s MET 152 N 2.07 3.86 -0.08 5.12 -1.94 0.41 -1.50 119.30 127.25 3abk s MET 152 Ca 0.16 -0.23 0.04 0.00 -1.71 0.00 0.00 55.69 53.95 3abk s MET 152 Cb -0.16 -3.28 -0.01 0.00 2.01 0.00 0.00 34.83 33.39 3abk s MET 152 CO 0.10 0.46 -0.19 -0.51 -0.01 0.00 0.00 175.02 174.86 3abk s LEU 153 N -0.12 2.39 -0.06 -0.03 1.43 -0.42 -0.68 118.68 121.18 3abk s LEU 153 Ca 0.09 -0.40 0.04 0.00 -1.03 0.00 0.00 54.13 52.83 3abk s LEU 153 Cb -0.12 -1.48 0.00 0.00 0.03 0.00 0.00 46.19 44.63 3abk s LEU 153 CO 0.00 0.23 -0.18 -0.69 0.23 0.00 0.00 176.35 175.95 3abk s VAL 154 N -0.06 1.50 0.00 -1.59 1.01 0.82 -1.28 120.40 120.81 3abk s VAL 154 Ca -0.05 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.20 3abk s VAL 154 Cb -0.14 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 34.93 3abk s VAL 154 CO 0.04 0.43 0.00 -0.24 0.00 0.00 0.00 175.10 175.34 3abk n SER 155 N 3.40 0.00 -3.84 3.32 2.88 -0.14 -1.14 113.62 118.10 3abk n SER 155 Ca -0.20 -0.85 -0.11 0.00 -1.33 0.00 0.00 58.87 56.38 3abk n SER 155 Cb 0.53 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.89 3abk n SER 155 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3abk s SER 156 N -0.61 -0.01 -0.08 -3.46 0.15 -1.25 -0.68 113.70 107.76 3abk s SER 156 Ca 0.00 -0.20 0.15 0.00 0.70 0.00 0.00 55.95 56.60 3abk s SER 156 Cb 0.00 0.25 0.51 0.00 -1.71 0.00 0.00 66.02 65.08 3abk s SER 156 CO 0.00 -0.45 1.43 -0.62 1.20 0.00 0.00 173.24 174.81 3abk n GLU 157 N 1.16 3.16 0.00 5.44 1.02 -0.27 -4.02 120.64 127.14 3abk n GLU 157 Ca -0.21 -2.55 0.00 0.00 -0.02 0.00 0.00 57.16 54.37 3abk n GLU 157 Cb 0.57 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 3abk n GLU 157 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3abk n ASP 158 N 0.53 0.00 -3.40 1.62 5.68 -1.26 -5.05 116.55 114.66 3abk n ASP 158 Ca 0.19 0.00 -0.11 0.00 -0.50 0.00 0.00 54.79 54.37 3abk n ASP 158 Cb 0.70 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.74 3abk n ASP 158 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 3abk n VAL 159 N 0.00 0.00 -2.06 2.12 0.24 -1.26 -4.52 118.33 112.85 3abk n VAL 159 Ca 0.00 -0.89 -0.34 0.00 -2.04 0.00 0.00 64.34 61.08 3abk n VAL 159 Cb 0.00 -1.00 0.02 0.00 -1.47 0.00 0.00 33.84 31.39 3abk n VAL 159 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3abk s LEU 160 N 0.00 3.57 0.00 1.34 1.43 -1.26 -4.54 118.68 119.22 3abk s LEU 160 Ca 0.34 1.99 0.04 0.00 -1.03 0.00 0.00 54.13 55.46 3abk s LEU 160 Cb -0.02 -4.56 -0.01 0.00 0.03 0.00 0.00 46.19 41.63 3abk s LEU 160 CO 0.22 -1.30 0.14 1.41 0.23 0.00 0.00 176.35 177.06 3abk n HIS 161 N -1.84 -0.41 -3.70 0.29 8.25 -0.19 -4.43 115.22 113.18 3abk n HIS 161 Ca 0.10 -1.34 -0.11 0.00 -0.26 0.00 0.00 57.72 56.10 3abk n HIS 161 Cb 0.52 0.15 -0.10 0.00 1.12 0.00 0.00 29.99 31.68 3abk n HIS 161 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3abk s SER 162 N -2.12 -0.52 -0.27 0.41 0.15 -1.26 0.06 113.70 110.15 3abk s SER 162 Ca 0.19 0.93 -0.13 0.00 0.70 0.00 0.00 55.95 57.64 3abk s SER 162 Cb 0.01 0.87 -0.04 0.00 -1.71 0.00 0.00 66.02 65.15 3abk s SER 162 CO 0.13 -0.18 0.30 0.86 1.20 0.00 0.00 173.24 175.56 3abk s TRP 163 N 0.90 3.24 -0.01 3.44 -0.00 0.75 -1.37 118.94 125.89 3abk s TRP 163 Ca -0.05 0.29 0.03 0.00 -0.00 0.00 0.00 56.10 56.37 3abk s TRP 163 Cb -0.06 -2.50 -0.01 0.00 -0.00 0.00 0.00 33.47 30.90 3abk s TRP 163 CO -0.07 -0.21 -0.10 0.00 -0.00 0.00 0.00 176.95 176.57 3abk s ALA 164 N 1.95 0.82 -0.32 5.86 0.00 -1.26 -0.66 121.76 128.15 3abk s ALA 164 Ca 0.12 -0.42 -0.01 0.00 0.00 0.00 0.00 51.96 51.65 3abk s ALA 164 Cb -0.16 -0.21 0.11 0.00 0.00 0.00 0.00 23.12 22.86 3abk s ALA 164 CO 0.10 0.20 0.13 0.08 0.00 0.00 0.00 175.76 176.27 3abk s VAL 165 N -0.23 0.76 0.32 0.00 1.01 0.28 -3.62 120.40 118.92 3abk s VAL 165 Ca 0.04 -1.47 0.04 0.00 0.00 0.00 0.00 61.98 60.59 3abk s VAL 165 Cb -0.04 -1.58 0.29 0.00 0.00 0.00 0.00 36.38 35.06 3abk s VAL 165 CO -0.00 -0.73 1.90 -0.65 0.00 0.00 0.00 175.10 175.61 3abk h PRO 166 N 7.91 0.87 0.00 2.72 0.11 -1.77 -2.04 132.00 139.81 3abk h PRO 166 Ca -0.12 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3abk h PRO 166 Cb 1.00 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.91 3abk h PRO 166 CO 0.46 0.58 0.00 -1.13 -0.21 0.00 0.00 178.00 177.69 3abk n SER 167 N -4.52 0.50 -0.85 -2.05 3.41 -1.26 -1.51 113.62 107.33 3abk n SER 167 Ca 0.15 0.58 0.11 0.00 -0.26 0.00 0.00 58.87 59.45 3abk n SER 167 Cb 0.29 -0.70 0.09 0.00 -0.26 0.00 0.00 64.21 63.63 3abk n SER 167 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3abk n LEU 168 N -2.00 2.77 -0.30 1.04 4.77 -0.86 -1.52 117.00 120.90 3abk n LEU 168 Ca 0.04 -0.99 -0.01 0.00 -0.03 0.00 0.00 56.01 55.02 3abk n LEU 168 Cb 0.30 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 3abk n LEU 168 CO 0.23 0.47 -0.01 0.61 -1.33 0.00 0.00 177.39 177.37 3abk n GLY 169 N 1.24 0.44 3.43 -0.72 0.00 -0.57 -4.53 105.19 104.49 3abk n GLY 169 Ca 0.13 -0.78 -0.33 0.00 0.00 0.00 0.00 46.02 45.04 3abk n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abk s LEU 170 N -0.66 2.68 -0.29 0.99 1.43 -0.82 -4.98 118.68 117.02 3abk s LEU 170 Ca 0.01 -0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 52.74 3abk s LEU 170 Cb -0.00 -1.56 0.11 0.00 0.03 0.00 0.00 46.19 44.77 3abk s LEU 170 CO 0.01 0.29 0.66 -0.75 0.23 0.00 0.00 176.35 176.79 3abk s LYS 171 N -0.38 0.61 -0.06 1.70 2.20 -1.26 -0.56 119.74 122.00 3abk s LYS 171 Ca 0.04 1.38 -0.02 0.00 -0.36 0.00 0.00 55.97 57.01 3abk s LYS 171 Cb -0.12 0.65 0.04 0.00 -1.51 0.00 0.00 37.83 36.89 3abk s LYS 171 CO 0.02 -0.19 0.11 0.99 -0.36 0.00 0.00 175.35 175.93 3abk s THR 172 N 2.52 -0.11 0.64 3.43 2.01 0.16 -4.95 115.64 119.35 3abk s THR 172 Ca -0.07 0.26 -0.17 0.00 0.31 0.00 0.00 61.69 62.02 3abk s THR 172 Cb -0.10 -0.21 -0.01 0.00 0.01 0.00 0.00 72.50 72.20 3abk s THR 172 CO -0.19 0.11 1.17 -1.81 -0.69 0.00 0.00 174.62 173.20 3abk s ASP 173 N 1.51 4.96 -0.30 3.53 1.01 -1.26 -0.18 116.67 125.95 3abk s ASP 173 Ca -0.05 2.24 -0.01 0.00 0.71 0.00 0.00 52.55 55.45 3abk s ASP 173 Cb -0.12 -2.58 0.06 0.00 1.01 0.00 0.00 42.92 41.28 3abk s ASP 173 CO -0.05 -1.74 -0.01 0.00 0.21 0.00 0.00 175.17 173.58 3abk s ALA 174 N -1.93 2.78 -0.12 5.23 0.00 0.11 -4.75 121.76 123.07 3abk s ALA 174 Ca 0.73 -1.81 0.03 0.00 0.00 0.00 0.00 51.96 50.90 3abk s ALA 174 Cb -0.26 -1.88 0.01 0.00 0.00 0.00 0.00 23.12 20.98 3abk s ALA 174 CO 0.38 -1.29 -0.21 0.42 0.00 0.00 0.00 175.76 175.06 3abk s ILE 175 N 1.21 1.92 0.37 0.00 1.01 -1.26 -1.03 121.20 123.43 3abk s ILE 175 Ca -0.05 -0.91 -0.28 0.00 0.00 0.00 0.00 60.65 59.41 3abk s ILE 175 Cb -0.20 -1.70 -0.11 0.00 0.01 0.00 0.00 42.46 40.47 3abk s ILE 175 CO -0.02 0.52 1.46 -2.16 0.00 0.00 0.00 174.94 174.74 3abk s PRO 176 N 0.74 4.12 0.00 2.79 0.04 -1.26 -2.17 135.00 139.26 3abk s PRO 176 Ca -0.10 2.51 0.00 0.00 0.04 0.00 0.00 61.00 63.45 3abk s PRO 176 Cb -0.16 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.42 3abk s PRO 176 CO 0.01 -0.50 0.00 0.41 0.04 0.00 0.00 177.00 176.96 3abk n GLY 177 N 0.51 0.73 2.98 0.56 0.00 -1.26 -4.95 105.19 103.75 3abk n GLY 177 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 3abk n GLY 177 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3abk s ARG 178 N -0.17 0.34 -0.34 1.61 3.52 -0.92 -5.12 118.95 117.87 3abk s ARG 178 Ca 0.00 -0.42 0.03 0.00 -0.13 0.00 0.00 55.73 55.22 3abk s ARG 178 Cb 0.00 -0.17 0.10 0.00 -1.56 0.00 0.00 34.95 33.32 3abk s ARG 178 CO 0.00 0.03 0.05 -1.17 -0.81 0.00 0.00 175.30 173.41 3abk s LEU 179 N -0.84 4.49 0.19 -0.88 2.96 -1.26 -4.50 118.68 118.83 3abk s LEU 179 Ca -0.06 -2.10 -0.05 0.00 -0.22 0.00 0.00 54.13 51.70 3abk s LEU 179 Cb -0.06 -1.55 -0.06 0.00 0.50 0.00 0.00 46.19 45.03 3abk s LEU 179 CO -0.00 -0.38 0.44 0.20 -1.32 0.00 0.00 176.35 175.29 3abk s ASN 180 N 0.98 6.49 0.05 3.68 0.01 -0.29 -4.79 114.94 121.08 3abk s ASN 180 Ca 0.11 0.65 0.09 0.00 -0.71 0.00 0.00 52.86 52.99 3abk s ASN 180 Cb -0.19 -2.11 -0.03 0.00 0.41 0.00 0.00 41.25 39.33 3abk s ASN 180 CO -0.10 -0.03 -0.24 -1.58 -1.51 0.00 0.00 177.10 173.65 3abk s GLN 181 N -2.92 1.83 0.23 -0.60 0.74 -1.26 -0.12 119.66 117.55 3abk s GLN 181 Ca 0.42 -1.10 -0.10 0.00 0.05 0.00 0.00 55.36 54.63 3abk s GLN 181 Cb -0.12 -2.03 -0.01 0.00 1.10 0.00 0.00 33.01 31.95 3abk s GLN 181 CO 0.25 0.51 0.39 -0.08 -0.55 0.00 0.00 175.29 175.82 3abk s THR 182 N -0.87 0.01 0.11 -0.34 -1.32 0.14 -5.01 115.64 108.36 3abk s THR 182 Ca 0.13 -1.51 0.06 0.00 -1.21 0.00 0.00 61.69 59.16 3abk s THR 182 Cb -0.10 -2.21 -0.04 0.00 -1.51 0.00 0.00 72.50 68.65 3abk s THR 182 CO 0.03 -0.04 -0.15 0.42 -2.21 0.00 0.00 174.62 172.68 3abk s THR 183 N -4.04 1.38 -0.01 5.08 -4.23 -1.26 -0.44 115.64 112.12 3abk s THR 183 Ca 0.25 -1.64 -0.00 0.00 -1.18 0.00 0.00 61.69 59.11 3abk s THR 183 Cb 0.01 -1.48 0.01 0.00 1.34 0.00 0.00 72.50 72.38 3abk s THR 183 CO 0.08 -0.33 0.01 -0.22 -0.54 0.00 0.00 174.62 173.62 3abk s LEU 184 N -2.29 1.65 -0.19 4.79 0.20 0.06 -4.92 118.68 117.97 3abk s LEU 184 Ca 0.07 0.02 -0.04 0.00 0.69 0.00 0.00 54.13 54.87 3abk s LEU 184 Cb -0.06 -0.02 0.10 0.00 -0.43 0.00 0.00 46.19 45.78 3abk s LEU 184 CO 0.03 -0.05 0.29 -0.32 -0.29 0.00 0.00 176.35 176.02 3abk s MET 185 N 0.40 0.23 -0.13 1.98 1.75 -1.26 -0.27 119.30 122.01 3abk s MET 185 Ca -0.03 0.53 -0.14 0.00 -1.25 0.00 0.00 55.69 54.79 3abk s MET 185 Cb -0.05 -0.52 -0.05 0.00 2.84 0.00 0.00 34.83 37.06 3abk s MET 185 CO -0.01 -0.50 0.33 0.45 -0.65 0.00 0.00 175.02 174.64 3abk s SER 186 N 2.44 6.54 0.00 1.11 0.15 -1.26 -4.44 113.70 118.23 3abk s SER 186 Ca 0.06 0.63 0.22 0.00 0.70 0.00 0.00 55.95 57.56 3abk s SER 186 Cb -0.14 -2.20 0.99 0.00 -1.71 0.00 0.00 66.02 62.96 3abk s SER 186 CO -0.12 0.14 1.72 -1.20 1.20 0.00 0.00 173.24 174.98 3abk n SER 187 N 3.22 0.00 -3.85 5.45 7.64 0.16 -0.77 113.62 125.46 3abk n SER 187 Ca -0.12 0.38 -0.12 0.00 1.01 0.00 0.00 58.87 60.03 3abk n SER 187 Cb 0.52 -0.45 -0.10 0.00 -1.01 0.00 0.00 64.21 63.16 3abk n SER 187 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3abk s ARG 188 N -2.91 0.45 1.05 1.43 0.52 -1.26 -4.82 118.95 113.41 3abk s ARG 188 Ca 0.13 -0.27 -0.15 0.00 -0.52 0.00 0.00 55.73 54.92 3abk s ARG 188 Cb 0.15 0.19 0.21 0.00 0.52 0.00 0.00 34.95 36.02 3abk s ARG 188 CO 0.39 -0.10 1.12 -1.25 0.02 0.00 0.00 175.30 175.48 3abk s PRO 189 N -1.12 0.01 0.00 3.54 0.04 -1.26 -4.85 135.00 131.36 3abk s PRO 189 Ca -0.12 0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.14 3abk s PRO 189 Cb -0.06 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.76 3abk s PRO 189 CO 0.02 -2.95 0.00 0.41 0.04 0.00 0.00 177.00 174.52 3abk n GLY 190 N -1.42 0.90 3.21 0.56 0.00 -0.70 -4.92 105.19 102.81 3abk n GLY 190 Ca 0.08 -1.96 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 3abk n GLY 190 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abk s LEU 191 N 0.00 2.34 -0.09 0.99 1.43 -1.26 -1.04 118.68 121.05 3abk s LEU 191 Ca 0.00 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.58 3abk s LEU 191 Cb 0.00 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.70 3abk s LEU 191 CO 0.00 0.05 -0.17 -0.31 0.23 0.00 0.00 176.35 176.15 3abk s TYR 192 N 1.00 1.99 0.14 0.29 1.51 -0.47 -4.95 117.35 116.86 3abk s TYR 192 Ca -0.02 -0.85 0.06 0.00 -1.01 0.00 0.00 57.07 55.25 3abk s TYR 192 Cb -0.15 -1.40 -0.04 0.00 -0.11 0.00 0.00 41.96 40.26 3abk s TYR 192 CO -0.04 -0.40 0.03 0.71 -1.11 0.00 0.00 175.55 174.74 3abk s TYR 193 N 0.69 2.98 0.33 2.71 2.02 -1.26 -0.14 117.35 124.68 3abk s TYR 193 Ca -0.13 -0.06 -0.14 0.00 -0.37 0.00 0.00 57.07 56.37 3abk s TYR 193 Cb -0.16 -1.48 0.03 0.00 -0.40 0.00 0.00 41.96 39.95 3abk s TYR 193 CO 0.03 0.50 0.66 0.20 -1.57 0.00 0.00 175.55 175.38 3abk s GLY 194 N -2.72 0.50 0.05 0.71 0.00 0.55 -4.07 107.32 102.34 3abk s GLY 194 Ca 0.28 -0.81 -0.01 0.00 0.00 0.00 0.00 44.72 44.17 3abk s GLY 194 CO 0.20 -0.44 -0.02 1.20 0.00 0.00 0.00 173.10 174.04 3abk s GLN 195 N -3.11 0.58 0.23 2.90 -0.21 -1.24 -0.30 119.66 118.51 3abk s GLN 195 Ca 0.18 -1.11 -0.31 0.00 0.02 0.00 0.00 55.36 54.14 3abk s GLN 195 Cb -0.04 0.20 -0.11 0.00 1.00 0.00 0.00 33.01 34.07 3abk s GLN 195 CO 0.12 -0.11 1.54 0.00 -2.12 0.00 0.00 175.29 174.72 3abk n SER 197 N 2.98 2.14 -3.67 0.00 7.64 -0.47 -4.88 113.62 117.37 3abk n SER 197 Ca 0.10 -3.88 -0.10 0.00 1.01 0.00 0.00 58.87 56.00 3abk n SER 197 Cb 0.39 -0.52 -0.10 0.00 -1.01 0.00 0.00 64.21 62.96 3abk n SER 197 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3abk s GLU 198 N -3.28 0.30 0.17 1.43 2.56 -1.26 -4.62 118.70 113.99 3abk s GLU 198 Ca 0.40 0.92 -0.34 0.00 0.00 0.00 0.00 54.97 55.96 3abk s GLU 198 Cb 0.38 0.18 -0.14 0.00 2.00 0.00 0.00 34.13 36.55 3abk s GLU 198 CO -0.05 -0.23 1.51 1.51 -0.56 0.00 0.00 175.26 177.43 3abk n ILE 199 N 5.11 0.19 -2.13 -3.70 3.06 -1.26 -4.42 119.36 116.21 3abk n ILE 199 Ca -0.12 -0.05 0.00 0.00 -2.50 0.00 0.00 62.75 60.09 3abk n ILE 199 Cb 0.51 -1.43 -0.00 0.00 0.54 0.00 0.00 39.64 39.26 3abk n ILE 199 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3abk n GLY 201 N 0.13 0.41 0.33 0.00 0.00 -1.26 -4.80 105.19 100.00 3abk n GLY 201 Ca -0.01 -2.28 0.18 0.00 0.00 0.00 0.00 46.02 43.91 3abk n GLY 201 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3abk h SER 202 N 0.00 0.00 -0.19 1.61 4.64 -2.04 -2.92 113.55 114.65 3abk h SER 202 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 3abk h SER 202 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 3abk h SER 202 CO 0.00 0.00 -0.11 0.59 -0.87 0.00 0.00 176.83 176.44 3abk n ASN 203 N -3.54 2.69 -0.34 4.97 3.02 -1.26 -4.60 115.26 116.20 3abk n ASN 203 Ca -0.01 -3.44 0.18 0.00 -0.03 0.00 0.00 54.58 51.28 3abk n ASN 203 Cb 0.23 -0.55 0.40 0.00 -0.61 0.00 0.00 39.78 39.25 3abk n ASN 203 CO 0.00 0.00 0.00 -0.74 -2.62 0.00 0.00 177.26 173.90 3abk h HIS 204 N 0.98 0.95 0.00 3.10 -0.00 -1.83 0.16 115.15 118.51 3abk h HIS 204 Ca 0.08 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.48 3abk h HIS 204 Cb 1.35 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 28.48 3abk h HIS 204 CO 0.61 0.09 0.00 0.43 -0.00 0.00 0.00 177.93 179.07 3abk n SER 205 N -4.81 0.00 -2.44 3.26 7.64 -1.26 -4.11 113.62 111.90 3abk n SER 205 Ca 0.26 0.30 -0.17 0.00 1.01 0.00 0.00 58.87 60.26 3abk n SER 205 Cb 0.75 -0.42 0.02 0.00 -1.01 0.00 0.00 64.21 63.55 3abk n SER 205 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3abk n PHE 206 N -1.42 2.35 -3.12 1.43 0.99 0.04 -4.83 117.46 112.91 3abk n PHE 206 Ca 0.07 -2.57 -0.21 0.00 -0.00 0.00 0.00 57.45 54.74 3abk n PHE 206 Cb 0.23 -0.25 -0.05 0.00 -1.00 0.00 0.00 39.48 38.41 3abk n PHE 206 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3abk n MET 207 N -0.50 0.71 -1.82 -1.08 0.00 -1.25 -4.52 117.12 108.66 3abk n MET 207 Ca 0.29 -2.96 -0.29 0.00 0.00 0.00 0.00 57.70 54.73 3abk n MET 207 Cb 0.82 -1.27 0.10 0.00 0.00 0.00 0.00 33.22 32.87 3abk n MET 207 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 3abk s PRO 208 N -0.82 1.81 -0.07 3.17 0.04 -1.26 -3.30 135.00 134.57 3abk s PRO 208 Ca 0.34 0.16 0.03 0.00 0.04 0.00 0.00 61.00 61.58 3abk s PRO 208 Cb 0.18 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.79 3abk s PRO 208 CO -0.14 -1.71 -0.18 0.42 0.04 0.00 0.00 177.00 175.43 3abk s ILE 209 N -3.51 1.57 -0.10 0.56 1.01 0.60 -4.80 121.20 116.53 3abk s ILE 209 Ca 0.62 -0.75 -0.00 0.00 0.00 0.00 0.00 60.65 60.52 3abk s ILE 209 Cb -0.12 -1.38 0.02 0.00 0.01 0.00 0.00 42.46 41.00 3abk s ILE 209 CO 0.50 0.45 -0.08 -0.69 0.00 0.00 0.00 174.94 175.12 3abk s VAL 210 N 0.39 0.99 -0.06 2.92 1.01 -1.26 -0.33 120.40 124.06 3abk s VAL 210 Ca -0.14 -0.29 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 3abk s VAL 210 Cb -0.16 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.17 3abk s VAL 210 CO 0.05 0.36 0.27 -0.76 0.00 0.00 0.00 175.10 175.02 3abk s LEU 211 N 1.56 4.43 -0.25 3.92 1.43 0.80 -0.73 118.68 129.84 3abk s LEU 211 Ca 0.02 0.70 0.03 0.00 -1.03 0.00 0.00 54.13 53.84 3abk s LEU 211 Cb -0.13 -2.33 0.06 0.00 0.03 0.00 0.00 46.19 43.81 3abk s LEU 211 CO -0.06 0.36 -0.11 -0.70 0.23 0.00 0.00 176.35 176.07 3abk s GLU 212 N -1.09 2.25 -0.22 1.70 2.12 0.24 -1.36 118.70 122.34 3abk s GLU 212 Ca 0.20 -1.25 -0.07 0.00 0.36 0.00 0.00 54.97 54.21 3abk s GLU 212 Cb -0.14 -2.81 -0.03 0.00 0.26 0.00 0.00 34.13 31.40 3abk s GLU 212 CO 0.09 -0.53 0.06 -0.51 -0.54 0.00 0.00 175.26 173.82 3abk s LEU 213 N 1.16 3.54 0.20 2.70 2.01 -0.20 -0.20 118.68 127.88 3abk s LEU 213 Ca -0.07 -0.11 -0.09 0.00 0.01 0.00 0.00 54.13 53.87 3abk s LEU 213 Cb -0.19 -1.92 -0.01 0.00 0.01 0.00 0.00 46.19 44.08 3abk s LEU 213 CO -0.06 0.05 0.34 0.68 1.01 0.00 0.00 176.35 178.37 3abk s VAL 214 N 1.08 0.03 0.60 -1.59 -7.23 -0.57 -1.72 120.40 111.01 3abk s VAL 214 Ca 0.04 -1.47 -0.20 0.00 -1.81 0.00 0.00 61.98 58.54 3abk s VAL 214 Cb -0.14 -2.07 -0.03 0.00 0.56 0.00 0.00 36.38 34.70 3abk s VAL 214 CO 0.03 -0.14 1.31 -2.84 -0.31 0.00 0.00 175.10 173.15 3abk s PRO 215 N -4.01 2.83 0.33 4.82 0.02 -1.26 -0.60 135.00 137.11 3abk s PRO 215 Ca 0.22 2.11 0.11 0.00 0.02 0.00 0.00 61.00 63.45 3abk s PRO 215 Cb 0.02 -2.01 0.93 0.00 0.02 0.00 0.00 34.50 33.46 3abk s PRO 215 CO 0.05 -1.40 1.72 1.25 -0.33 0.00 0.00 177.00 178.29 3abk h LEU 216 N 0.94 0.64 -1.04 -5.54 5.85 -1.92 -1.22 115.31 113.02 3abk h LEU 216 Ca -0.51 0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.27 3abk h LEU 216 Cb 1.32 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 3abk h LEU 216 CO 0.55 0.07 -0.19 0.11 -0.34 0.00 0.00 178.44 178.63 3abk h LYS 217 N 0.54 0.46 -0.48 1.25 1.79 -1.99 0.30 116.57 118.43 3abk h LYS 217 Ca 0.66 -0.15 -0.09 0.00 -2.18 0.00 0.00 60.65 58.89 3abk h LYS 217 Cb 1.31 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.90 3abk h LYS 217 CO -0.49 0.63 -0.05 1.88 -1.08 0.00 0.00 179.45 180.34 3abk h TYR 218 N 0.42 0.97 -0.13 -1.35 0.05 -1.62 -1.80 116.97 113.51 3abk h TYR 218 Ca 0.07 -0.19 -0.00 0.00 0.05 0.00 0.00 58.73 58.66 3abk h TYR 218 Cb 0.57 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 3abk h TYR 218 CO 0.02 0.93 0.08 0.35 -1.05 0.00 0.00 178.16 178.49 3abk h PHE 219 N 0.73 0.17 -0.65 4.88 3.57 -0.43 0.35 116.94 125.56 3abk h PHE 219 Ca 0.13 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.69 3abk h PHE 219 Cb 0.58 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 39.21 3abk h PHE 219 CO 0.04 0.14 0.36 0.93 -2.23 0.00 0.00 178.31 177.55 3abk h GLU 220 N 0.16 0.65 -0.27 1.11 5.08 -0.29 0.18 114.58 121.19 3abk h GLU 220 Ca 0.05 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.20 3abk h GLU 220 Cb 0.01 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 3abk h GLU 220 CO -0.01 0.43 -0.50 0.87 -1.00 0.00 0.00 179.01 178.80 3abk h LYS 221 N 0.66 0.76 -0.39 2.33 1.57 -0.90 -2.27 116.57 118.33 3abk h LYS 221 Ca 0.29 -0.45 0.03 0.00 -1.87 0.00 0.00 60.65 58.65 3abk h LYS 221 Cb 0.18 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 3abk h LYS 221 CO -0.18 1.08 0.19 2.35 -0.57 0.00 0.00 179.45 182.32 3abk h TRP 222 N 0.59 0.35 -0.12 -1.35 7.01 0.02 -0.74 115.95 121.72 3abk h TRP 222 Ca 0.02 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.08 3abk h TRP 222 Cb 1.08 -0.10 -0.04 0.00 -2.10 0.00 0.00 29.16 27.99 3abk h TRP 222 CO 0.06 0.18 -0.13 0.77 -2.79 0.00 0.00 178.44 176.53 3abk h SER 223 N 0.39 -0.41 -1.00 2.65 0.02 -0.55 -1.93 113.55 112.72 3abk h SER 223 Ca 0.16 0.08 0.08 0.00 -0.84 0.00 0.00 61.79 61.27 3abk h SER 223 Cb 0.07 0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.74 3abk h SER 223 CO -0.12 -0.18 0.65 0.00 -1.14 0.00 0.00 176.83 176.04 3abk h ALA 224 N 0.89 1.43 0.00 3.77 0.00 -1.16 -1.73 119.26 122.46 3abk h ALA 224 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3abk h ALA 224 Cb 0.29 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3abk h ALA 224 CO -0.22 0.39 0.00 -1.13 0.00 0.00 0.00 179.25 178.30 3abk n SER 225 N -4.53 0.18 -0.71 0.00 3.41 -0.30 -2.63 113.62 109.03 3abk n SER 225 Ca 0.16 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.41 3abk n SER 225 Cb 0.23 -0.57 0.34 0.00 -0.26 0.00 0.00 64.21 63.95 3abk n SER 225 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3abk n MET 226 N -1.67 1.94 0.00 4.33 2.81 -0.65 -5.09 117.12 118.79 3abk n MET 226 Ca 0.06 -1.40 0.10 0.00 -1.81 0.00 0.00 57.70 54.64 3abk n MET 226 Cb 0.32 -1.44 0.57 0.00 -0.71 0.00 0.00 33.22 31.96 3abk n MET 226 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76