#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 2.59 0.35 0.00 -0.85 -1.26 -5.08 117.35 113.09 3abk s TYR 3 Ca 0.00 -0.58 -0.28 0.00 -0.52 0.00 0.00 57.07 55.69 3abk s TYR 3 Cb 0.00 -2.01 -0.10 0.00 0.38 0.00 0.00 41.96 40.23 3abk s TYR 3 CO 0.00 0.08 1.30 -2.14 -1.52 0.00 0.00 175.55 173.27 3abk s PRO 4 N -3.98 4.27 -1.48 -3.49 0.02 -1.26 -2.50 135.00 126.58 3abk s PRO 4 Ca 0.42 2.19 -0.01 0.00 0.02 0.00 0.00 61.00 63.62 3abk s PRO 4 Cb 0.02 -3.00 0.01 0.00 0.02 0.00 0.00 34.50 31.55 3abk s PRO 4 CO 0.24 -0.25 0.11 -1.33 -0.33 0.00 0.00 177.00 175.44 3abk n MET 5 N 0.64 -2.40 -2.16 5.54 2.81 -1.26 -4.96 117.12 115.34 3abk n MET 5 Ca 0.01 0.83 -0.42 0.00 -1.81 0.00 0.00 57.70 56.31 3abk n MET 5 Cb 0.42 -5.50 -0.03 0.00 -0.71 0.00 0.00 33.22 27.40 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 -5.19 4.34 -0.14 0.03 0.74 -1.04 -4.94 119.66 113.47 3abk s GLN 6 Ca 0.06 2.12 0.05 0.00 0.05 0.00 0.00 55.36 57.64 3abk s GLN 6 Cb -0.03 -3.19 -0.23 0.00 1.10 0.00 0.00 33.01 30.66 3abk s GLN 6 CO 0.08 -0.34 0.29 1.28 -0.55 0.00 0.00 175.29 176.06 3abk n LEU 7 N 2.87 1.72 0.00 3.68 4.77 -1.26 -5.05 117.00 123.73 3abk n LEU 7 Ca 0.08 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 3abk n LEU 7 Cb 0.42 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3abk n LEU 7 CO 0.59 0.67 0.00 0.61 -1.33 0.00 0.00 177.39 177.93 3abk n GLY 8 N 1.87 5.82 3.79 -0.72 0.00 -1.26 -5.12 105.19 109.57 3abk n GLY 8 Ca -0.30 -1.78 -0.33 0.00 0.00 0.00 0.00 46.02 43.61 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 1.50 2.90 0.70 1.61 0.40 -1.26 -4.99 117.98 118.84 3abk s PHE 9 Ca 0.00 1.53 -0.16 0.00 -0.60 0.00 0.00 56.93 57.70 3abk s PHE 9 Cb 0.00 -3.07 0.02 0.00 0.51 0.00 0.00 43.02 40.48 3abk s PHE 9 CO 0.00 -1.21 1.25 -0.65 0.70 0.00 0.00 175.22 175.31 3abk s GLN 10 N -3.87 2.26 0.32 0.44 -0.21 -1.26 -4.91 119.66 112.43 3abk s GLN 10 Ca 0.66 1.91 -0.29 0.00 0.02 0.00 0.00 55.36 57.66 3abk s GLN 10 Cb -0.18 -1.83 -0.12 0.00 1.00 0.00 0.00 33.01 31.88 3abk s GLN 10 CO 0.34 -1.78 1.37 -0.25 -2.12 0.00 0.00 175.29 172.85 3abk n ASP 11 N -2.41 3.03 -4.74 5.90 10.43 -1.26 -4.86 116.55 122.64 3abk n ASP 11 Ca 0.15 1.19 -0.41 0.00 2.57 0.00 0.00 54.79 58.29 3abk n ASP 11 Cb 0.49 -1.50 -0.05 0.00 1.84 0.00 0.00 41.12 41.90 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 -0.77 3.34 -0.48 2.24 0.00 -1.26 -4.74 121.76 120.08 3abk s ALA 12 Ca 0.58 0.70 0.12 0.00 0.00 0.00 0.00 51.96 53.37 3abk s ALA 12 Cb -0.56 -3.28 -0.14 0.00 0.00 0.00 0.00 23.12 19.14 3abk s ALA 12 CO 0.58 -0.01 0.47 2.41 0.00 0.00 0.00 175.76 179.21 3abk n THR 13 N 1.99 0.00 -4.31 0.00 -1.04 -0.11 -4.87 114.28 105.93 3abk n THR 13 Ca 0.00 -0.23 -0.19 0.00 -2.04 0.00 0.00 64.05 61.59 3abk n THR 13 Cb 0.47 0.88 -0.11 0.00 -1.82 0.00 0.00 70.33 69.75 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 -2.33 2.46 0.43 8.00 1.04 -1.25 -1.07 113.70 120.96 3abk s SER 14 Ca 0.03 -0.92 0.12 0.00 0.48 0.00 0.00 55.95 55.66 3abk s SER 14 Cb 0.09 -0.12 0.98 0.00 0.10 0.00 0.00 66.02 67.06 3abk s SER 14 CO 0.49 -0.12 2.01 -0.65 0.98 0.00 0.00 173.24 175.95 3abk h PRO 15 N 3.03 0.44 0.06 4.02 0.11 -1.94 -1.79 132.00 135.92 3abk h PRO 15 Ca -0.40 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 3abk h PRO 15 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3abk h PRO 15 CO 0.55 0.29 -0.03 0.82 -0.21 0.00 0.00 178.00 179.43 3abk h ILE 16 N 0.45 1.04 -0.96 4.15 1.08 -1.93 -1.56 117.51 119.79 3abk h ILE 16 Ca 0.23 -0.33 0.14 0.00 -0.39 0.00 0.00 64.86 64.52 3abk h ILE 16 Cb 0.35 1.26 -0.09 0.00 -3.07 0.00 0.00 36.82 35.27 3abk h ILE 16 CO -0.06 0.08 0.58 -0.03 -0.69 0.00 0.00 178.15 178.03 3abk h MET 17 N -0.22 0.82 -0.78 2.37 4.05 -1.69 -1.32 114.93 118.16 3abk h MET 17 Ca -0.01 -0.05 0.05 0.00 -0.28 0.00 0.00 59.70 59.41 3abk h MET 17 Cb 0.20 -0.18 -0.05 0.00 -0.80 0.00 0.00 31.60 30.76 3abk h MET 17 CO 0.01 0.54 0.48 1.49 0.23 0.00 0.00 176.91 179.66 3abk h GLU 18 N 0.84 0.87 -0.54 0.39 4.81 -1.14 -1.24 114.58 118.57 3abk h GLU 18 Ca 0.51 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.69 3abk h GLU 18 Cb 0.62 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 3abk h GLU 18 CO -0.32 0.58 0.36 0.93 -0.73 0.00 0.00 179.01 179.83 3abk h GLU 19 N 0.90 0.71 -0.90 1.92 4.39 -0.24 -2.13 114.58 119.22 3abk h GLU 19 Ca 0.33 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 60.00 3abk h GLU 19 Cb 0.12 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 28.57 3abk h GLU 19 CO -0.15 0.47 0.60 -0.07 -1.16 0.00 0.00 179.01 178.70 3abk h LEU 20 N 0.73 1.03 -0.33 1.33 3.38 -0.90 -1.10 115.31 119.46 3abk h LEU 20 Ca 0.20 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3abk h LEU 20 Cb -0.08 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 3abk h LEU 20 CO -0.04 0.74 0.21 -0.07 0.09 0.00 0.00 178.44 179.36 3abk h LEU 21 N 1.22 0.39 -0.91 1.67 3.38 -0.59 0.48 115.31 120.94 3abk h LEU 21 Ca 0.33 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.16 3abk h LEU 21 Cb -0.12 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3abk h LEU 21 CO -0.08 0.31 -0.37 0.45 0.09 0.00 0.00 178.44 178.84 3abk h HIS 22 N 0.43 0.40 -0.19 1.13 3.86 -1.23 -0.59 115.15 118.96 3abk h HIS 22 Ca 0.12 -0.10 -0.04 0.00 -1.16 0.00 0.00 60.37 59.19 3abk h HIS 22 Cb -0.02 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.35 3abk h HIS 22 CO -0.05 0.67 -0.03 0.35 0.86 0.00 0.00 177.93 179.74 3abk h PHE 23 N 0.29 0.40 -0.56 2.45 3.04 -0.90 -2.01 116.94 119.65 3abk h PHE 23 Ca 0.03 -0.08 0.01 0.00 3.98 0.00 0.00 57.97 61.91 3abk h PHE 23 Cb 0.78 -0.10 -0.03 0.00 2.56 0.00 0.00 35.95 39.17 3abk h PHE 23 CO 0.02 0.59 0.37 1.25 -2.02 0.00 0.00 178.31 178.52 3abk h HIS 24 N 0.09 0.69 -0.66 0.41 2.76 0.18 -1.25 115.15 117.37 3abk h HIS 24 Ca 0.05 0.02 0.14 0.00 -2.20 0.00 0.00 60.37 58.38 3abk h HIS 24 Cb 0.45 -0.23 -0.11 0.00 1.55 0.00 0.00 27.41 29.06 3abk h HIS 24 CO 0.04 0.44 0.06 -0.44 -1.30 0.00 0.00 177.93 176.73 3abk h ASP 25 N 0.75 -0.19 -0.05 3.26 3.32 -0.95 0.15 116.42 122.71 3abk h ASP 25 Ca 0.20 0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.41 3abk h ASP 25 Cb -0.08 0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 3abk h ASP 25 CO -0.05 -0.10 0.03 -0.74 -1.72 0.00 0.00 179.24 176.67 3abk h HIS 26 N 0.16 0.07 -0.36 4.55 -0.00 -0.83 -2.19 115.15 116.54 3abk h HIS 26 Ca 0.36 -0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.64 3abk h HIS 26 Cb 0.59 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.97 3abk h HIS 26 CO -0.34 0.11 -0.13 1.15 -0.00 0.00 0.00 177.93 178.73 3abk h THR 27 N 0.01 1.28 -0.72 6.26 2.02 -0.97 -2.98 112.91 117.81 3abk h THR 27 Ca 0.02 -1.22 -0.00 0.00 0.77 0.00 0.00 66.41 65.97 3abk h THR 27 Cb 0.06 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 3abk h THR 27 CO -0.00 0.40 0.44 0.25 0.37 0.00 0.00 175.52 176.98 3abk h LEU 28 N 0.52 0.85 0.12 2.58 5.85 -0.67 0.18 115.31 124.74 3abk h LEU 28 Ca 0.09 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.79 3abk h LEU 28 Cb 0.65 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 3abk h LEU 28 CO 0.04 0.64 -0.39 -0.03 -0.34 0.00 0.00 178.44 178.37 3abk h MET 29 N 0.99 -0.60 -0.67 1.25 4.05 -1.29 0.20 114.93 118.85 3abk h MET 29 Ca 0.26 0.04 0.11 0.00 -0.28 0.00 0.00 59.70 59.83 3abk h MET 29 Cb -0.06 0.14 -0.08 0.00 -0.80 0.00 0.00 31.60 30.79 3abk h MET 29 CO -0.05 -0.40 0.25 0.82 0.23 0.00 0.00 176.91 177.75 3abk h ILE 30 N -0.62 0.71 -0.44 1.77 2.04 -1.30 -0.02 117.51 119.65 3abk h ILE 30 Ca 0.03 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.76 3abk h ILE 30 Cb 0.65 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 3abk h ILE 30 CO -0.23 0.08 0.28 0.58 0.00 0.00 0.00 178.15 178.85 3abk h VAL 31 N 0.41 1.07 -0.34 1.67 2.07 -0.15 -1.45 116.25 119.54 3abk h VAL 31 Ca 0.35 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.63 3abk h VAL 31 Cb 0.48 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 3abk h VAL 31 CO -0.35 0.10 0.03 -0.26 0.02 0.00 0.00 177.57 177.11 3abk h PHE 32 N 0.56 0.62 -0.64 1.57 0.05 -0.43 -1.73 116.94 116.94 3abk h PHE 32 Ca 0.17 -0.10 0.07 0.00 3.82 0.00 0.00 57.97 61.94 3abk h PHE 32 Cb -0.02 -0.17 -0.06 0.00 2.00 0.00 0.00 35.95 37.70 3abk h PHE 32 CO -0.06 0.67 0.32 -0.07 -0.18 0.00 0.00 178.31 178.99 3abk h LEU 33 N 0.40 0.43 -0.00 1.54 4.07 -0.84 0.93 115.31 121.83 3abk h LEU 33 Ca 0.10 0.05 -0.01 0.00 0.08 0.00 0.00 57.88 58.10 3abk h LEU 33 Cb 0.40 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.11 3abk h LEU 33 CO 0.01 0.27 -0.03 0.40 -1.08 0.00 0.00 178.44 178.01 3abk h ILE 34 N 0.58 1.56 0.00 1.22 2.04 -1.17 0.20 117.51 121.94 3abk h ILE 34 Ca 0.30 -1.68 -0.06 0.00 1.00 0.00 0.00 64.86 64.42 3abk h ILE 34 Cb 0.26 2.69 -0.01 0.00 -0.74 0.00 0.00 36.82 39.02 3abk h ILE 34 CO -0.22 0.44 -0.29 0.77 0.00 0.00 0.00 178.15 178.85 3abk h SER 35 N -0.67 0.00 0.96 1.72 4.64 -1.30 -1.42 113.55 117.48 3abk h SER 35 Ca -0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 3abk h SER 35 Cb 0.74 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.80 3abk h SER 35 CO 0.01 0.29 -1.10 0.77 -0.87 0.00 0.00 176.83 175.93 3abk h SER 36 N 0.00 0.00 -0.67 4.97 4.64 -0.64 -1.18 113.55 120.66 3abk h SER 36 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3abk h SER 36 Cb 0.58 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.64 3abk h SER 36 CO 0.04 0.82 0.25 0.25 -0.87 0.00 0.00 176.83 177.32 3abk h LEU 37 N 0.00 0.96 -0.25 5.97 5.85 -0.34 0.16 115.31 127.66 3abk h LEU 37 Ca -0.09 -0.15 -0.13 0.00 0.84 0.00 0.00 57.88 58.35 3abk h LEU 37 Cb 1.71 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 42.48 3abk h LEU 37 CO 0.09 0.88 -0.34 0.58 -0.34 0.00 0.00 178.44 179.31 3abk h VAL 38 N 1.02 1.31 -0.31 1.05 2.07 -1.18 0.33 116.25 120.55 3abk h VAL 38 Ca 0.23 -1.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.22 3abk h VAL 38 Cb 0.23 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 3abk h VAL 38 CO -0.02 0.48 0.17 0.25 0.02 0.00 0.00 177.57 178.48 3abk h LEU 39 N 0.40 0.38 0.04 2.57 5.85 -0.94 -0.85 115.31 122.75 3abk h LEU 39 Ca 0.03 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.70 3abk h LEU 39 Cb 0.92 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 3abk h LEU 39 CO 0.08 0.34 -0.28 0.22 -0.34 0.00 0.00 178.44 178.46 3abk h TYR 40 N 0.38 -0.76 -0.90 1.25 3.20 -0.64 -1.47 116.97 118.03 3abk h TYR 40 Ca 0.11 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.06 3abk h TYR 40 Cb 0.04 0.33 -0.06 0.00 1.54 0.00 0.00 36.73 38.58 3abk h TYR 40 CO -0.03 -0.38 0.57 0.82 -1.64 0.00 0.00 178.16 177.50 3abk h ILE 41 N -0.45 1.06 -0.11 1.81 2.04 -0.74 0.15 117.51 121.27 3abk h ILE 41 Ca 0.05 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.60 3abk h ILE 41 Cb 0.51 -0.07 -0.06 0.00 -0.74 0.00 0.00 36.82 36.46 3abk h ILE 41 CO -0.21 0.19 -0.32 0.40 0.00 0.00 0.00 178.15 178.21 3abk h ILE 42 N 1.04 0.30 -0.57 -0.67 2.04 -0.93 -0.05 117.51 118.67 3abk h ILE 42 Ca 0.39 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.24 3abk h ILE 42 Cb 0.17 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.52 3abk h ILE 42 CO -0.17 0.00 0.28 0.77 0.00 0.00 0.00 178.15 179.03 3abk h SER 43 N -0.40 0.71 -0.86 1.72 4.64 0.10 -2.13 113.55 117.31 3abk h SER 43 Ca 0.09 -0.06 0.01 0.00 -0.47 0.00 0.00 61.79 61.36 3abk h SER 43 Cb 0.54 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.41 3abk h SER 43 CO -0.33 0.59 0.57 0.25 -0.87 0.00 0.00 176.83 177.04 3abk h LEU 44 N 0.79 0.99 -0.68 5.97 5.85 0.37 -2.83 115.31 125.78 3abk h LEU 44 Ca 0.20 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.78 3abk h LEU 44 Cb 0.07 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 3abk h LEU 44 CO -0.03 0.72 -0.52 0.24 -0.34 0.00 0.00 178.44 178.51 3abk h MET 45 N 1.17 0.00 -0.21 1.25 2.86 -0.38 -3.22 114.93 116.39 3abk h MET 45 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 3abk h MET 45 Cb -0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.53 3abk h MET 45 CO -0.07 0.52 0.00 1.28 1.06 0.00 0.00 176.91 179.71 3abk n LEU 46 N -3.56 3.13 -1.19 1.22 4.77 -1.06 -4.49 117.00 115.82 3abk n LEU 46 Ca -0.00 -1.21 -0.06 0.00 -0.03 0.00 0.00 56.01 54.70 3abk n LEU 46 Cb 0.61 -0.13 0.15 0.00 -2.33 0.00 0.00 43.42 41.72 3abk n LEU 46 CO 0.40 0.61 0.43 0.35 -1.33 0.00 0.00 177.39 177.84 3abk n THR 47 N 1.34 2.43 -3.99 -5.08 -2.24 -1.12 -4.99 114.28 100.63 3abk n THR 47 Ca 0.17 -3.40 -0.13 0.00 -2.27 0.00 0.00 64.05 58.42 3abk n THR 47 Cb 0.58 -0.54 -0.14 0.00 -2.10 0.00 0.00 70.33 68.13 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 -3.68 0.19 -0.87 4.28 -1.32 -1.26 -5.00 115.64 107.97 3abk s THR 48 Ca 0.44 -0.23 0.28 0.00 -1.21 0.00 0.00 61.69 60.96 3abk s THR 48 Cb 0.40 -0.19 0.26 0.00 -1.51 0.00 0.00 72.50 71.46 3abk s THR 48 CO -0.02 -0.03 1.85 0.29 -2.21 0.00 0.00 174.62 174.50 3abk n LYS 49 N 2.79 0.13 -1.92 7.08 4.76 -1.26 -4.90 118.16 124.83 3abk n LYS 49 Ca -0.14 0.10 -0.40 0.00 -2.87 0.00 0.00 58.31 55.01 3abk n LYS 49 Cb 0.59 -1.65 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 3abk n LYS 49 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3abk s LEU 50 N -3.75 4.20 0.16 -0.35 1.43 -1.26 -5.04 118.68 114.08 3abk s LEU 50 Ca 0.12 2.82 0.09 0.00 -1.03 0.00 0.00 54.13 56.13 3abk s LEU 50 Cb 0.16 -3.87 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 3abk s LEU 50 CO 0.56 -0.97 -0.19 0.42 0.23 0.00 0.00 176.35 176.40 3abk s THR 51 N -1.21 1.88 -0.29 5.49 -4.23 -1.26 -5.10 115.64 110.92 3abk s THR 51 Ca 0.58 -1.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.18 3abk s THR 51 Cb -0.42 -1.86 0.15 0.00 1.34 0.00 0.00 72.50 71.71 3abk s THR 51 CO 0.54 -0.28 0.35 -2.28 -0.54 0.00 0.00 174.62 172.42 3abk s HIS 52 N -1.95 -0.73 -0.51 3.99 5.04 -1.26 -5.04 115.29 114.83 3abk s HIS 52 Ca 0.16 0.11 0.05 0.00 -1.54 0.00 0.00 55.06 53.84 3abk s HIS 52 Cb -0.06 -0.30 0.01 0.00 0.04 0.00 0.00 32.58 32.27 3abk s HIS 52 CO 0.07 -0.94 0.50 0.25 -2.34 0.00 0.00 174.74 172.28 3abk n THR 53 N 5.33 0.00 -1.41 0.89 -2.24 -1.26 -5.00 114.28 110.60 3abk n THR 53 Ca -0.01 -0.46 -0.29 0.00 -2.27 0.00 0.00 64.05 61.02 3abk n THR 53 Cb 0.48 1.07 0.14 0.00 -2.10 0.00 0.00 70.33 69.92 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 -0.81 3.48 -0.03 3.42 1.04 -1.26 -4.94 113.70 114.60 3abk s SER 54 Ca 0.05 1.16 -0.36 0.00 0.48 0.00 0.00 55.95 57.28 3abk s SER 54 Cb 0.04 -1.80 -0.14 0.00 0.10 0.00 0.00 66.02 64.22 3abk s SER 54 CO 0.11 -2.59 1.69 0.41 0.98 0.00 0.00 173.24 173.84 3abk n THR 55 N -3.82 0.28 -3.88 2.02 -1.04 -1.26 -4.99 114.28 101.59 3abk n THR 55 Ca 0.06 -0.05 -0.37 0.00 -2.04 0.00 0.00 64.05 61.66 3abk n THR 55 Cb 0.58 -1.50 -0.07 0.00 -1.82 0.00 0.00 70.33 67.52 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 2.53 3.54 -0.22 -2.82 1.00 -1.26 -5.08 119.30 117.00 3abk s MET 56 Ca 0.89 -0.16 -0.26 0.00 0.00 0.00 0.00 55.69 56.15 3abk s MET 56 Cb -0.80 -3.21 -0.00 0.00 0.00 0.00 0.00 34.83 30.82 3abk s MET 56 CO 0.50 0.69 0.91 0.34 0.00 0.00 0.00 175.02 177.46 3abk s ASP 57 N -0.79 6.96 0.20 3.03 2.15 -1.26 -4.95 116.67 122.01 3abk s ASP 57 Ca 0.14 1.19 0.23 0.00 0.43 0.00 0.00 52.55 54.54 3abk s ASP 57 Cb -0.12 -2.48 0.05 0.00 -0.30 0.00 0.00 42.92 40.07 3abk s ASP 57 CO 0.03 -0.54 1.09 0.00 -0.17 0.00 0.00 175.17 175.58 3abk h ALA 58 N 7.51 0.52 -1.61 3.66 0.00 -2.02 -3.45 119.26 123.88 3abk h ALA 58 Ca -0.23 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 53.95 3abk h ALA 58 Cb 1.09 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.71 3abk h ALA 58 CO 0.90 0.00 1.43 1.14 0.00 0.00 0.00 179.25 182.72 3abk s GLN 59 N -3.34 4.07 0.00 0.00 -2.07 -1.26 -1.88 119.66 115.19 3abk s GLN 59 Ca 0.01 -2.51 0.00 0.00 -1.82 0.00 0.00 55.36 51.03 3abk s GLN 59 Cb 0.10 -5.11 0.00 0.00 -1.09 0.00 0.00 33.01 26.91 3abk s GLN 59 CO 0.78 -1.82 0.00 -0.85 -1.32 0.00 0.00 175.29 172.08 3abk n GLU 60 N 5.93 0.00 0.05 9.60 -0.00 -1.26 -4.82 120.64 130.14 3abk n GLU 60 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.54 3abk n GLU 60 Cb 0.43 0.00 0.31 0.00 -0.00 0.00 0.00 31.44 32.19 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 1.20 -0.28 3.84 3.04 -1.84 -3.16 116.25 119.05 3abk h VAL 61 Ca 0.00 -0.89 -0.10 0.00 -1.01 0.00 0.00 66.70 64.70 3abk h VAL 61 Cb 0.00 1.14 -0.01 0.00 -2.01 0.00 0.00 31.29 30.40 3abk h VAL 61 CO 0.00 0.29 -0.26 -0.33 -1.01 0.00 0.00 177.57 176.25 3abk h GLU 62 N 0.37 0.55 -0.45 4.17 5.08 -1.69 -1.80 114.58 120.81 3abk h GLU 62 Ca 0.07 -0.22 0.09 0.00 -1.00 0.00 0.00 59.36 58.31 3abk h GLU 62 Cb 0.42 -0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.55 3abk h GLU 62 CO 0.02 0.76 -0.21 1.15 -1.00 0.00 0.00 179.01 179.74 3abk h THR 63 N 0.48 0.38 -0.44 1.13 2.02 -1.84 -2.03 112.91 112.61 3abk h THR 63 Ca 0.07 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.28 3abk h THR 63 Cb 0.71 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.47 3abk h THR 63 CO 0.05 0.00 0.22 0.40 0.37 0.00 0.00 175.52 176.57 3abk h ILE 64 N -0.11 0.97 -0.29 3.11 2.04 -1.32 0.20 117.51 122.10 3abk h ILE 64 Ca 0.21 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.92 3abk h ILE 64 Cb 0.45 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3abk h ILE 64 CO -0.52 0.08 0.00 -2.67 0.00 0.00 0.00 178.15 175.04 3abk n TRP 65 N -4.91 0.40 -0.05 1.37 2.14 -0.84 -1.38 117.44 114.17 3abk n TRP 65 Ca 0.03 -0.20 -0.11 0.00 2.07 0.00 0.00 57.50 59.29 3abk n TRP 65 Cb 0.11 -0.01 -0.04 0.00 -0.81 0.00 0.00 31.31 30.57 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 0.83 -0.19 -1.67 -1.04 -0.78 -4.51 114.28 107.27 3abk n THR 66 Ca 0.10 -0.06 -0.08 0.00 -2.04 0.00 0.00 64.05 61.96 3abk n THR 66 Cb 0.26 -1.73 0.02 0.00 -1.82 0.00 0.00 70.33 67.06 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 -0.44 1.24 0.01 12.58 1.08 -0.97 -2.35 117.51 128.65 3abk h ILE 67 Ca -0.24 -0.82 -0.00 0.00 -0.39 0.00 0.00 64.86 63.41 3abk h ILE 67 Cb 1.08 0.74 0.00 0.00 -3.07 0.00 0.00 36.82 35.57 3abk h ILE 67 CO -0.15 0.30 -0.00 0.25 -0.69 0.00 0.00 178.15 177.86 3abk h LEU 68 N 0.76 -0.01 -1.11 1.44 5.85 -1.44 -1.33 115.31 119.47 3abk h LEU 68 Ca 0.17 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.71 3abk h LEU 68 Cb 0.30 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.27 3abk h LEU 68 CO -0.00 0.23 0.60 -0.65 -0.34 0.00 0.00 178.44 178.28 3abk h PRO 69 N -0.25 1.08 -0.36 5.25 0.11 -1.75 -0.70 132.00 135.37 3abk h PRO 69 Ca -0.00 -0.07 0.05 0.00 0.11 0.00 0.00 66.00 66.09 3abk h PRO 69 Cb 0.25 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 31.07 3abk h PRO 69 CO 0.00 0.72 0.10 0.00 -0.21 0.00 0.00 178.00 178.61 3abk h ALA 70 N 1.48 0.40 -0.66 -0.75 0.00 -1.26 0.27 119.26 118.74 3abk h ALA 70 Ca 0.38 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.29 3abk h ALA 70 Cb 0.10 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3abk h ALA 70 CO -0.13 -0.30 0.20 0.82 0.00 0.00 0.00 179.25 179.84 3abk h ILE 71 N 0.23 1.25 -0.69 0.00 2.04 -0.74 -2.10 117.51 117.50 3abk h ILE 71 Ca 0.17 -0.87 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 3abk h ILE 71 Cb 0.17 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 3abk h ILE 71 CO -0.20 0.34 0.43 0.40 0.00 0.00 0.00 178.15 179.12 3abk h ILE 72 N 0.96 1.19 -0.11 -0.67 2.04 -0.50 -1.75 117.51 118.68 3abk h ILE 72 Ca 0.21 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 3abk h ILE 72 Cb 0.30 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 3abk h ILE 72 CO -0.01 0.20 0.06 -0.07 0.00 0.00 0.00 178.15 178.33 3abk h LEU 73 N 0.94 0.14 -1.05 1.44 3.38 -0.75 -1.54 115.31 117.87 3abk h LEU 73 Ca 0.25 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.21 3abk h LEU 73 Cb -0.06 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 40.59 3abk h LEU 73 CO -0.05 0.20 0.63 0.40 0.09 0.00 0.00 178.44 179.71 3abk h ILE 74 N 0.07 1.03 0.00 1.22 2.04 -1.18 0.67 117.51 121.36 3abk h ILE 74 Ca 0.04 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.53 3abk h ILE 74 Cb 0.09 -0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.02 3abk h ILE 74 CO -0.01 0.20 0.00 -0.07 0.00 0.00 0.00 178.15 178.27 3abk h LEU 75 N 1.08 0.00 0.08 1.44 4.07 -0.49 0.11 115.31 121.61 3abk h LEU 75 Ca 0.44 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 58.23 3abk h LEU 75 Cb 0.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.02 3abk h LEU 75 CO -0.19 0.00 -0.87 0.40 -1.08 0.00 0.00 178.44 176.69 3abk h ILE 76 N 0.00 1.35 -0.75 1.22 2.04 -0.63 -3.40 117.51 117.34 3abk h ILE 76 Ca 0.00 -2.40 -0.04 0.00 1.00 0.00 0.00 64.86 63.42 3abk h ILE 76 Cb 0.49 2.96 -0.03 0.00 -0.74 0.00 0.00 36.82 39.50 3abk h ILE 76 CO 0.00 0.63 0.31 0.00 0.00 0.00 0.00 178.15 179.10 3abk h ALA 77 N -0.05 0.97 0.50 1.87 0.00 -0.54 -2.44 119.26 119.57 3abk h ALA 77 Ca -0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 3abk h ALA 77 Cb 1.49 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 3abk h ALA 77 CO 0.04 0.58 -0.39 -0.07 0.00 0.00 0.00 179.25 179.41 3abk h LEU 78 N 1.07 -1.02 -1.35 0.00 4.07 -1.00 -0.65 115.31 116.43 3abk h LEU 78 Ca 0.25 0.07 -0.03 0.00 0.08 0.00 0.00 57.88 58.26 3abk h LEU 78 Cb 0.19 0.32 -0.02 0.00 1.08 0.00 0.00 40.66 42.23 3abk h LEU 78 CO -0.02 -0.57 0.12 1.55 -1.08 0.00 0.00 178.44 178.44 3abk h PRO 79 N -0.87 0.56 0.24 1.13 0.13 -1.77 -2.56 132.00 128.85 3abk h PRO 79 Ca -0.05 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 64.98 3abk h PRO 79 Cb 0.74 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.78 3abk h PRO 79 CO 0.00 0.49 -0.11 1.03 -0.23 0.00 0.00 178.00 179.18 3abk h SER 80 N 0.55 -0.27 0.09 1.44 0.87 -1.12 -2.36 113.55 112.75 3abk h SER 80 Ca 0.13 -0.08 -0.09 0.00 -1.23 0.00 0.00 61.79 60.52 3abk h SER 80 Cb 0.17 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 3abk h SER 80 CO -0.01 -0.09 -0.29 -0.07 -0.53 0.00 0.00 176.83 175.84 3abk h LEU 81 N -0.45 0.32 -1.08 2.23 3.38 -1.17 -2.18 115.31 116.36 3abk h LEU 81 Ca -0.03 -0.11 0.08 0.00 0.09 0.00 0.00 57.88 57.91 3abk h LEU 81 Cb 0.34 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 3abk h LEU 81 CO 0.05 0.61 0.62 -0.09 0.09 0.00 0.00 178.44 179.72 3abk h ARG 82 N 0.28 1.04 -0.13 1.13 2.43 -1.23 0.04 114.38 117.94 3abk h ARG 82 Ca 0.04 -0.06 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 3abk h ARG 82 Cb 0.66 -0.23 0.01 0.00 -0.42 0.00 0.00 29.97 29.98 3abk h ARG 82 CO 0.05 0.69 -0.79 0.82 -1.51 0.00 0.00 179.97 179.23 3abk h ILE 83 N 1.07 1.30 -0.30 1.20 2.04 -0.95 -1.63 117.51 120.23 3abk h ILE 83 Ca 0.43 -2.04 0.06 0.00 1.00 0.00 0.00 64.86 64.31 3abk h ILE 83 Cb 0.25 2.04 -0.06 0.00 -0.74 0.00 0.00 36.82 38.32 3abk h ILE 83 CO -0.18 0.64 -0.07 0.25 0.00 0.00 0.00 178.15 178.79 3abk h LEU 84 N 0.47 -0.27 0.02 1.44 5.85 -0.70 0.86 115.31 122.98 3abk h LEU 84 Ca -0.05 0.09 -0.23 0.00 0.84 0.00 0.00 57.88 58.53 3abk h LEU 84 Cb 1.40 0.18 0.02 0.00 0.37 0.00 0.00 40.66 42.63 3abk h LEU 84 CO 0.15 -0.09 -0.90 1.88 -0.34 0.00 0.00 178.44 179.14 3abk h TYR 85 N 0.01 0.87 -0.65 1.25 -1.99 -0.90 -2.42 116.97 113.14 3abk h TYR 85 Ca 0.14 -0.49 0.10 0.00 2.00 0.00 0.00 58.73 60.49 3abk h TYR 85 Cb 0.22 -0.09 -0.12 0.00 2.00 0.00 0.00 36.73 38.74 3abk h TYR 85 CO -0.28 1.32 -0.40 0.52 -0.00 0.00 0.00 178.16 179.32 3abk h MET 86 N 0.17 -0.16 -0.77 4.88 2.86 -1.24 -0.33 114.93 120.34 3abk h MET 86 Ca -0.12 0.01 0.16 0.00 -2.06 0.00 0.00 59.70 57.69 3abk h MET 86 Cb 1.59 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 33.23 3abk h MET 86 CO 0.18 -0.11 0.52 0.52 1.06 0.00 0.00 176.91 179.07 3abk h MET 87 N -0.17 0.37 0.00 1.72 2.86 -0.69 -2.29 114.93 116.72 3abk h MET 87 Ca 0.22 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 3abk h MET 87 Cb 0.56 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.14 3abk h MET 87 CO -0.74 0.24 -0.07 0.22 1.06 0.00 0.00 176.91 177.63 3abk h ASP 88 N 0.38 0.00 -2.85 1.22 1.82 -0.58 -3.48 116.42 112.92 3abk h ASP 88 Ca 0.38 -0.01 -0.59 0.00 -0.39 0.00 0.00 57.03 56.42 3abk h ASP 88 Cb 0.93 0.00 0.11 0.00 0.68 0.00 0.00 39.33 41.06 3abk h ASP 88 CO -0.12 0.01 0.26 -0.62 -1.61 0.00 0.00 179.24 177.16 3abk n GLU 89 N -2.52 1.62 -1.68 0.28 1.02 -0.67 -4.88 120.64 113.80 3abk n GLU 89 Ca 0.05 0.57 -0.47 0.00 -0.02 0.00 0.00 57.16 57.28 3abk n GLU 89 Cb 0.47 -2.04 -0.04 0.00 -0.02 0.00 0.00 31.44 29.80 3abk n GLU 89 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3abk n ILE 90 N 0.15 0.41 -0.10 -3.67 5.41 -1.26 -4.90 119.36 115.40 3abk n ILE 90 Ca 0.08 -0.07 -0.18 0.00 1.00 0.00 0.00 62.75 63.57 3abk n ILE 90 Cb 0.34 -1.79 -0.13 0.00 -0.71 0.00 0.00 39.64 37.36 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 5.66 1.94 -3.51 4.38 3.02 -1.26 -5.05 115.26 120.43 3abk n ASN 91 Ca 0.21 -0.06 -0.16 0.00 -0.03 0.00 0.00 54.58 54.54 3abk n ASN 91 Cb 0.30 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 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 -3.29 -5.95 -4.76 6.41 3.02 -1.26 -5.02 115.26 104.41 3abk n ASN 92 Ca -0.42 -0.60 -0.32 0.00 -0.03 0.00 0.00 54.58 53.21 3abk n ASN 92 Cb 1.01 -2.99 0.08 0.00 -0.61 0.00 0.00 39.78 37.27 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 -4.14 2.37 0.00 3.52 0.04 -1.26 -4.89 135.00 130.64 3abk s PRO 93 Ca 0.02 1.31 0.20 0.00 0.04 0.00 0.00 61.00 62.56 3abk s PRO 93 Cb -0.00 -1.90 -0.19 0.00 0.04 0.00 0.00 34.50 32.45 3abk s PRO 93 CO 0.84 -1.57 0.86 -1.13 0.04 0.00 0.00 177.00 176.04 3abk n SER 94 N -3.11 1.05 -3.86 6.66 3.41 -0.41 -4.93 113.62 112.42 3abk n SER 94 Ca 0.10 -1.02 -0.12 0.00 -0.26 0.00 0.00 58.87 57.57 3abk n SER 94 Cb 0.52 0.94 -0.13 0.00 -0.26 0.00 0.00 64.21 65.28 3abk n SER 94 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3abk s LEU 95 N -2.86 1.77 -0.13 1.04 2.96 -1.25 -5.07 118.68 115.14 3abk s LEU 95 Ca 0.09 0.06 0.02 0.00 -0.22 0.00 0.00 54.13 54.07 3abk s LEU 95 Cb 0.15 0.26 0.00 0.00 0.50 0.00 0.00 46.19 47.10 3abk s LEU 95 CO 0.77 -0.07 -0.21 -0.89 -1.32 0.00 0.00 176.35 174.63 3abk s THR 96 N -0.20 2.23 0.02 3.68 2.01 -1.26 -0.56 115.64 121.55 3abk s THR 96 Ca -0.03 -0.93 0.07 0.00 0.31 0.00 0.00 61.69 61.11 3abk s THR 96 Cb -0.02 -1.90 -0.03 0.00 0.01 0.00 0.00 72.50 70.57 3abk s THR 96 CO 0.00 0.54 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.58 3abk s VAL 97 N 0.68 2.59 0.03 3.82 1.01 0.19 -4.40 120.40 124.31 3abk s VAL 97 Ca -0.10 -1.13 0.03 0.00 0.00 0.00 0.00 61.98 60.78 3abk s VAL 97 Cb -0.16 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 3abk s VAL 97 CO 0.01 0.43 -0.01 -0.54 0.00 0.00 0.00 175.10 174.99 3abk s LYS 98 N -1.14 2.66 -0.02 2.72 1.02 -0.64 -0.82 119.74 123.52 3abk s LYS 98 Ca 0.13 -0.71 0.04 0.00 0.02 0.00 0.00 55.97 55.45 3abk s LYS 98 Cb -0.10 -2.60 -0.01 0.00 -0.52 0.00 0.00 37.83 34.61 3abk s LYS 98 CO 0.03 0.59 -0.13 -0.08 -0.92 0.00 0.00 175.35 174.84 3abk s THR 99 N -1.14 1.09 -0.10 2.17 -1.32 -0.19 -1.27 115.64 114.88 3abk s THR 99 Ca 0.21 -0.56 0.04 0.00 -1.21 0.00 0.00 61.69 60.17 3abk s THR 99 Cb -0.11 -0.93 -0.00 0.00 -1.51 0.00 0.00 72.50 69.95 3abk s THR 99 CO 0.12 0.32 -0.23 -0.04 -2.21 0.00 0.00 174.62 172.58 3abk s MET 100 N -0.10 3.00 0.22 7.08 -1.94 0.53 -1.44 119.30 126.64 3abk s MET 100 Ca 0.01 -0.86 -0.30 0.00 -1.71 0.00 0.00 55.69 52.84 3abk s MET 100 Cb -0.08 -2.32 -0.08 0.00 2.01 0.00 0.00 34.83 34.36 3abk s MET 100 CO 0.00 0.23 0.98 0.20 -0.01 0.00 0.00 175.02 176.42 3abk s GLY 101 N 0.23 3.07 0.15 -0.03 0.00 -0.05 -1.00 107.32 109.69 3abk s GLY 101 Ca -0.15 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.25 3abk s GLY 101 CO 0.07 1.32 0.03 0.30 0.00 0.00 0.00 173.10 174.83 3abk s HIS 102 N -0.91 1.03 -0.53 1.90 3.76 -0.03 -1.26 115.29 119.24 3abk s HIS 102 Ca 0.43 -1.14 -0.26 0.00 -0.15 0.00 0.00 55.06 53.95 3abk s HIS 102 Cb -0.27 -0.58 0.03 0.00 1.11 0.00 0.00 32.58 32.87 3abk s HIS 102 CO 0.33 -0.38 1.01 -0.65 -0.85 0.00 0.00 174.74 174.20 3abk s GLN 103 N -3.99 3.45 -0.33 1.40 -0.21 -1.26 -1.34 119.66 117.37 3abk s GLN 103 Ca 0.24 0.01 0.00 0.00 0.02 0.00 0.00 55.36 55.63 3abk s GLN 103 Cb 0.07 -4.00 0.11 0.00 1.00 0.00 0.00 33.01 30.18 3abk s GLN 103 CO 0.03 -1.46 0.12 -1.58 -2.12 0.00 0.00 175.29 170.28 3abk s TRP 104 N 4.16 1.89 0.00 0.91 0.51 -1.26 -5.13 118.94 120.02 3abk s TRP 104 Ca 0.36 -1.93 0.00 0.00 -2.12 0.00 0.00 56.10 52.41 3abk s TRP 104 Cb -0.10 -1.82 0.00 0.00 -0.81 0.00 0.00 33.47 30.74 3abk s TRP 104 CO 0.23 -0.87 0.00 2.48 -0.51 0.00 0.00 176.95 178.28 3abk n TYR 105 N 4.59 0.00 -4.28 -1.98 4.11 -0.45 -4.72 117.16 114.44 3abk n TYR 105 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.90 57.60 3abk n TYR 105 Cb 0.41 0.00 -0.09 0.00 -0.00 0.00 0.00 39.34 39.65 3abk n TYR 105 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.86 175.28 3abk s TRP 106 N -2.00 2.86 0.09 -3.48 0.52 -1.06 -0.85 118.94 115.02 3abk s TRP 106 Ca 0.00 -0.08 0.08 0.00 0.02 0.00 0.00 56.10 56.12 3abk s TRP 106 Cb 0.00 -1.52 -0.04 0.00 -1.15 0.00 0.00 33.47 30.76 3abk s TRP 106 CO 0.00 0.42 -0.17 -1.54 0.02 0.00 0.00 176.95 175.69 3abk s SER 107 N -1.97 3.95 0.17 2.95 1.04 -0.17 0.42 113.70 120.10 3abk s SER 107 Ca 0.21 -0.48 0.11 0.00 0.48 0.00 0.00 55.95 56.27 3abk s SER 107 Cb -0.11 -0.62 -0.04 0.00 0.10 0.00 0.00 66.02 65.34 3abk s SER 107 CO 0.13 0.21 -0.24 -0.31 0.98 0.00 0.00 173.24 174.00 3abk s TYR 108 N -1.08 2.26 -0.05 5.02 2.02 -0.40 -0.35 117.35 124.77 3abk s TYR 108 Ca 0.17 -0.37 -0.02 0.00 -0.37 0.00 0.00 57.07 56.48 3abk s TYR 108 Cb -0.11 -1.15 0.04 0.00 -0.40 0.00 0.00 41.96 40.34 3abk s TYR 108 CO 0.09 0.44 0.09 -1.21 -1.57 0.00 0.00 175.55 173.39 3abk s GLU 109 N -2.51 -0.03 -0.33 -0.62 2.02 -0.40 -1.86 118.70 114.98 3abk s GLU 109 Ca 0.18 0.41 0.00 0.00 0.02 0.00 0.00 54.97 55.59 3abk s GLU 109 Cb -0.08 -0.40 0.08 0.00 0.10 0.00 0.00 34.13 33.82 3abk s GLU 109 CO 0.09 -0.30 0.04 0.71 0.02 0.00 0.00 175.26 175.82 3abk s TYR 110 N 2.04 3.45 -0.03 1.61 2.02 0.15 -1.61 117.35 124.98 3abk s TYR 110 Ca 0.02 -2.32 0.04 0.00 -0.37 0.00 0.00 57.07 54.45 3abk s TYR 110 Cb -0.12 -2.52 0.06 0.00 -0.40 0.00 0.00 41.96 38.99 3abk s TYR 110 CO -0.04 -0.89 0.90 0.25 -1.57 0.00 0.00 175.55 174.21 3abk n THR 111 N 4.50 0.78 -0.35 -0.71 -2.24 -1.25 -1.52 114.28 113.50 3abk n THR 111 Ca -0.07 -0.86 0.05 0.00 -2.27 0.00 0.00 64.05 60.89 3abk n THR 111 Cb 0.42 0.46 0.22 0.00 -2.10 0.00 0.00 70.33 69.34 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 0.00 0.96 0.00 3.42 3.32 -1.93 -3.41 116.42 118.77 3abk h ASP 112 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3abk h ASP 112 Cb 0.89 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.26 3abk h ASP 112 CO 0.00 0.58 0.00 -1.22 -1.72 0.00 0.00 179.24 176.88 3abk n TYR 113 N -4.53 -1.44 -3.50 4.55 4.01 -1.26 -5.09 117.16 109.90 3abk n TYR 113 Ca 0.16 0.25 -0.23 0.00 -0.16 0.00 0.00 57.90 57.92 3abk n TYR 113 Cb 0.25 0.33 -0.01 0.00 -0.31 0.00 0.00 39.34 39.60 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 -1.97 3.48 -1.01 -0.72 0.41 -1.26 -5.00 118.70 112.63 3abk s GLU 114 Ca 0.00 -0.41 -0.04 0.00 -0.41 0.00 0.00 54.97 54.10 3abk s GLU 114 Cb 0.00 -2.71 0.12 0.00 -1.78 0.00 0.00 34.13 29.76 3abk s GLU 114 CO 0.00 0.21 2.46 -0.25 -0.49 0.00 0.00 175.26 177.18 3abk n ASP 115 N -1.70 7.49 -4.72 -0.19 10.43 -1.26 -3.86 116.55 122.74 3abk n ASP 115 Ca -0.06 -3.22 -0.41 0.00 2.57 0.00 0.00 54.79 53.67 3abk n ASP 115 Cb 0.56 -1.30 -0.04 0.00 1.84 0.00 0.00 41.12 42.19 3abk n ASP 115 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 3abk s LEU 116 N -2.37 4.45 0.15 0.64 2.96 -0.57 -4.94 118.68 119.00 3abk s LEU 116 Ca 0.54 1.75 -0.14 0.00 -0.22 0.00 0.00 54.13 56.06 3abk s LEU 116 Cb 0.26 -3.58 0.02 0.00 0.50 0.00 0.00 46.19 43.38 3abk s LEU 116 CO -0.15 -0.15 0.39 -0.94 -1.32 0.00 0.00 176.35 174.18 3abk s SER 117 N 0.42 -0.13 0.16 3.68 1.04 -1.26 0.31 113.70 117.92 3abk s SER 117 Ca 0.49 -0.55 -0.24 0.00 0.48 0.00 0.00 55.95 56.13 3abk s SER 117 Cb -0.23 0.48 0.06 0.00 0.10 0.00 0.00 66.02 66.44 3abk s SER 117 CO 0.29 -0.92 0.70 0.72 0.98 0.00 0.00 173.24 175.02 3abk s PHE 118 N -3.88 -0.40 0.43 5.02 -0.12 -0.78 -4.99 117.98 113.28 3abk s PHE 118 Ca 0.09 0.13 -0.11 0.00 -0.05 0.00 0.00 56.93 56.99 3abk s PHE 118 Cb 0.02 0.60 -0.06 0.00 -0.63 0.00 0.00 43.02 42.94 3abk s PHE 118 CO -0.06 -0.90 0.81 -0.51 -0.05 0.00 0.00 175.22 174.51 3abk s ASP 119 N -2.77 6.51 -0.29 1.98 1.01 -1.26 -1.28 116.67 120.58 3abk s ASP 119 Ca 0.05 1.19 -0.03 0.00 0.71 0.00 0.00 52.55 54.47 3abk s ASP 119 Cb -0.02 -2.35 0.10 0.00 1.01 0.00 0.00 42.92 41.66 3abk s ASP 119 CO -0.06 -0.45 0.11 -0.55 0.21 0.00 0.00 175.17 174.42 3abk s SER 120 N -3.25 3.67 0.06 0.27 0.15 0.17 -4.48 113.70 110.29 3abk s SER 120 Ca 0.52 -1.39 0.02 0.00 0.70 0.00 0.00 55.95 55.80 3abk s SER 120 Cb -0.10 -0.58 -0.04 0.00 -1.71 0.00 0.00 66.02 63.59 3abk s SER 120 CO 0.33 -0.42 0.10 -0.31 1.20 0.00 0.00 173.24 174.14 3abk s TYR 121 N 1.88 3.26 0.35 3.44 2.02 -1.26 -2.57 117.35 124.46 3abk s TYR 121 Ca 0.08 0.13 -0.28 0.00 -0.37 0.00 0.00 57.07 56.63 3abk s TYR 121 Cb -0.17 -1.67 -0.12 0.00 -0.40 0.00 0.00 41.96 39.61 3abk s TYR 121 CO -0.29 0.54 1.43 -0.12 -1.57 0.00 0.00 175.55 175.53 3abk n MET 122 N 0.60 2.44 -2.43 -0.62 0.00 -1.26 -1.02 117.12 114.84 3abk n MET 122 Ca -0.09 0.86 -0.43 0.00 -0.00 0.00 0.00 57.70 58.04 3abk n MET 122 Cb 0.52 -2.54 -0.02 0.00 0.00 0.00 0.00 33.22 31.18 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 -0.90 4.25 0.72 1.12 -1.09 0.49 -4.77 121.20 121.01 3abk s ILE 123 Ca 0.56 1.48 -0.16 0.00 -2.23 0.00 0.00 60.65 60.30 3abk s ILE 123 Cb -0.52 -4.07 0.02 0.00 -1.58 0.00 0.00 42.46 36.32 3abk s ILE 123 CO 0.60 -0.25 1.17 -2.65 -1.23 0.00 0.00 174.94 172.58 3abk n PRO 124 N 6.84 0.63 -0.14 2.79 -0.02 -1.26 -4.62 135.00 139.23 3abk n PRO 124 Ca 0.14 0.28 0.13 0.00 -2.02 0.00 0.00 63.50 62.03 3abk n PRO 124 Cb 0.45 -2.41 0.48 0.00 -0.02 0.00 0.00 33.50 32.00 3abk n PRO 124 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3abk h THR 125 N -0.16 0.86 0.00 3.45 2.02 -1.98 0.94 112.91 118.04 3abk h THR 125 Ca -0.48 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 66.54 3abk h THR 125 Cb 1.33 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 3abk h THR 125 CO 0.49 0.09 0.00 -1.54 0.37 0.00 0.00 175.52 174.92 3abk n SER 126 N -4.48 0.52 -0.37 4.18 3.41 -1.26 -2.65 113.62 112.97 3abk n SER 126 Ca 0.12 0.58 0.06 0.00 -0.26 0.00 0.00 58.87 59.36 3abk n SER 126 Cb 0.43 -0.71 0.03 0.00 -0.26 0.00 0.00 64.21 63.70 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 -2.02 1.20 -1.65 4.33 1.02 0.30 -5.01 120.64 118.81 3abk n GLU 127 Ca 0.05 -0.95 -0.45 0.00 -0.02 0.00 0.00 57.16 55.79 3abk n GLU 127 Cb 0.33 -1.17 -0.02 0.00 -0.02 0.00 0.00 31.44 30.55 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 0.27 2.81 -4.77 -4.62 4.77 -1.05 -4.96 117.00 109.45 3abk n LEU 128 Ca 0.06 1.16 -0.37 0.00 -0.03 0.00 0.00 56.01 56.83 3abk n LEU 128 Cb 0.26 -1.39 -0.01 0.00 -2.33 0.00 0.00 43.42 39.94 3abk n LEU 128 CO 0.10 -0.72 0.81 -0.54 -1.33 0.00 0.00 177.39 175.70 3abk s LYS 129 N -0.90 3.81 0.17 3.23 1.02 -1.26 -4.93 119.74 120.87 3abk s LYS 129 Ca 0.64 1.72 -0.33 0.00 0.02 0.00 0.00 55.97 58.02 3abk s LYS 129 Cb -0.66 -2.40 -0.15 0.00 -0.52 0.00 0.00 37.83 34.09 3abk s LYS 129 CO 0.54 -0.50 1.24 -2.30 -0.92 0.00 0.00 175.35 173.41 3abk n PRO 130 N -0.47 1.34 -0.21 -1.68 -0.02 -1.26 -1.10 135.00 131.61 3abk n PRO 130 Ca 0.07 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3abk n PRO 130 Cb 0.48 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 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 2.14 2.21 3.81 -1.23 0.00 -1.26 -5.05 105.19 105.81 3abk n GLY 131 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.13 2.67 -0.28 1.61 2.02 -0.26 -5.03 118.70 119.30 3abk s GLU 132 Ca 0.00 0.94 -0.13 0.00 0.02 0.00 0.00 54.97 55.80 3abk s GLU 132 Cb 0.00 -1.96 -0.04 0.00 0.10 0.00 0.00 34.13 32.23 3abk s GLU 132 CO 0.00 -1.29 0.30 -0.51 0.02 0.00 0.00 175.26 173.78 3abk s LEU 133 N -5.66 4.07 0.31 1.80 1.43 -1.26 -4.93 118.68 114.43 3abk s LEU 133 Ca 0.59 0.13 -0.29 0.00 -1.03 0.00 0.00 54.13 53.53 3abk s LEU 133 Cb -0.15 -2.30 -0.12 0.00 0.03 0.00 0.00 46.19 43.65 3abk s LEU 133 CO 0.55 -0.15 1.48 -1.14 0.23 0.00 0.00 176.35 177.32 3abk n ARG 134 N 5.23 2.45 -0.77 1.70 0.63 -1.26 -2.18 116.66 122.47 3abk n ARG 134 Ca -0.11 0.87 0.00 0.00 -0.92 0.00 0.00 57.85 57.69 3abk n ARG 134 Cb 0.51 -2.58 0.00 0.00 0.45 0.00 0.00 32.46 30.84 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 1.56 0.73 -0.01 6.15 4.77 -1.26 -4.81 117.00 124.13 3abk n LEU 135 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3abk n LEU 135 Cb 0.36 -1.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.00 3abk n LEU 135 CO 0.63 -0.50 -0.61 0.18 -1.33 0.00 0.00 177.39 175.76 3abk n LEU 136 N 0.00 0.00 -4.82 2.23 4.77 -0.92 -4.65 117.00 113.60 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 0.13 0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.22 3abk n LEU 136 CO 0.00 0.06 0.64 -1.61 -1.33 0.00 0.00 177.39 175.15 3abk s GLU 137 N -2.25 4.21 0.30 3.23 0.41 -1.21 -4.67 118.70 118.73 3abk s GLU 137 Ca -0.02 1.09 0.09 0.00 -0.41 0.00 0.00 54.97 55.72 3abk s GLU 137 Cb 0.03 -2.19 -0.06 0.00 -1.78 0.00 0.00 34.13 30.13 3abk s GLU 137 CO 0.22 -0.03 -0.11 0.14 -0.49 0.00 0.00 175.26 174.98 3abk s VAL 138 N -2.19 2.11 0.16 2.63 -7.23 -1.26 -0.38 120.40 114.24 3abk s VAL 138 Ca 0.62 -2.23 -0.02 0.00 -1.81 0.00 0.00 61.98 58.53 3abk s VAL 138 Cb -0.09 -2.48 -0.12 0.00 0.56 0.00 0.00 36.38 34.25 3abk s VAL 138 CO 0.14 -0.30 1.40 -2.24 -0.31 0.00 0.00 175.10 173.79 3abk h ASP 139 N 2.18 0.50 -3.62 4.85 -0.00 -1.38 -3.43 116.42 115.53 3abk h ASP 139 Ca -0.41 -0.35 -0.61 0.00 -0.00 0.00 0.00 57.03 55.67 3abk h ASP 139 Cb 1.25 -0.15 -0.38 0.00 -0.00 0.00 0.00 39.33 40.04 3abk h ASP 139 CO 0.67 1.10 -0.78 0.20 -0.00 0.00 0.00 179.24 180.43 3abk s ASN 140 N -7.00 3.88 0.68 4.15 0.01 -1.26 -5.02 114.94 110.38 3abk s ASN 140 Ca -0.06 -1.22 -0.11 0.00 -0.71 0.00 0.00 52.86 50.76 3abk s ASN 140 Cb 0.10 -1.17 0.00 0.00 0.41 0.00 0.00 41.25 40.59 3abk s ASN 140 CO 0.85 -0.25 1.07 -0.13 -1.51 0.00 0.00 177.10 177.13 3abk s ARG 141 N 1.39 3.04 -0.77 -0.60 0.52 -1.26 -4.66 118.95 116.61 3abk s ARG 141 Ca -0.05 0.59 -0.24 0.00 -0.52 0.00 0.00 55.73 55.51 3abk s ARG 141 Cb -0.19 -2.03 0.06 0.00 0.52 0.00 0.00 34.95 33.31 3abk s ARG 141 CO -0.07 -0.93 1.18 0.08 0.02 0.00 0.00 175.30 175.57 3abk s VAL 142 N -3.27 4.07 -0.02 3.52 1.01 0.20 -4.86 120.40 121.05 3abk s VAL 142 Ca 0.57 -0.24 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 3abk s VAL 142 Cb -0.11 -4.84 -0.03 0.00 0.00 0.00 0.00 36.38 31.39 3abk s VAL 142 CO 0.53 -1.69 1.11 -0.69 0.00 0.00 0.00 175.10 174.36 3abk s VAL 143 N 4.72 4.44 -0.02 2.92 1.01 -1.26 -0.48 120.40 131.74 3abk s VAL 143 Ca 0.32 1.75 -0.06 0.00 0.00 0.00 0.00 61.98 63.99 3abk s VAL 143 Cb -0.10 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.17 3abk s VAL 143 CO 0.07 0.07 0.12 -0.76 0.00 0.00 0.00 175.10 174.60 3abk s LEU 144 N 1.60 1.59 0.08 3.92 1.43 -0.21 -4.94 118.68 122.15 3abk s LEU 144 Ca 0.54 -0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.30 3abk s LEU 144 Cb -0.24 0.54 -0.05 0.00 0.03 0.00 0.00 46.19 46.47 3abk s LEU 144 CO 0.24 -0.23 1.11 -2.16 0.23 0.00 0.00 176.35 175.54 3abk s PRO 145 N -0.80 4.51 0.76 1.29 0.04 -1.26 -1.74 135.00 137.80 3abk s PRO 145 Ca -0.09 1.66 -0.11 0.00 0.04 0.00 0.00 61.00 62.50 3abk s PRO 145 Cb -0.05 -3.36 0.05 0.00 0.04 0.00 0.00 34.50 31.18 3abk s PRO 145 CO 0.01 -0.11 1.09 0.00 0.04 0.00 0.00 177.00 178.03 3abk s MET 146 N 0.66 2.41 -1.66 4.56 0.23 0.64 -3.95 119.30 122.19 3abk s MET 146 Ca 0.54 0.69 -0.01 0.00 -1.03 0.00 0.00 55.69 55.88 3abk s MET 146 Cb -0.27 -1.95 0.00 0.00 -1.53 0.00 0.00 34.83 31.08 3abk s MET 146 CO 0.30 -1.40 0.06 0.39 -2.03 0.00 0.00 175.02 172.34 3abk n GLU 147 N -3.29 -2.06 -4.05 3.16 1.02 0.27 -4.73 120.64 110.95 3abk n GLU 147 Ca 0.07 0.94 -0.12 0.00 -0.02 0.00 0.00 57.16 58.03 3abk n GLU 147 Cb 0.56 -5.62 -0.11 0.00 -0.02 0.00 0.00 31.44 26.25 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 -5.11 0.50 -0.19 3.49 -1.94 -1.25 -5.01 119.30 109.79 3abk s MET 148 Ca 0.03 -0.78 -0.26 0.00 -1.71 0.00 0.00 55.69 52.97 3abk s MET 148 Cb -0.01 -0.18 -0.01 0.00 2.01 0.00 0.00 34.83 36.64 3abk s MET 148 CO 0.04 0.02 0.90 0.99 -0.01 0.00 0.00 175.02 176.95 3abk s THR 149 N -1.63 4.82 -0.06 2.05 2.01 -1.26 -4.34 115.64 117.22 3abk s THR 149 Ca -0.09 1.75 0.06 0.00 0.31 0.00 0.00 61.69 63.72 3abk s THR 149 Cb -0.08 -4.19 -0.01 0.00 0.01 0.00 0.00 72.50 68.23 3abk s THR 149 CO -0.01 -0.04 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.01 3abk s ILE 150 N 2.48 2.04 -0.24 1.82 1.01 -0.13 -1.29 121.20 126.90 3abk s ILE 150 Ca 0.40 -1.05 -0.17 0.00 0.00 0.00 0.00 60.65 59.83 3abk s ILE 150 Cb -0.16 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 3abk s ILE 150 CO 0.11 0.56 0.48 -0.60 0.00 0.00 0.00 174.94 175.49 3abk s ARG 151 N -0.08 4.11 -0.18 2.79 3.52 0.27 0.08 118.95 129.47 3abk s ARG 151 Ca -0.06 0.30 -0.08 0.00 -0.13 0.00 0.00 55.73 55.76 3abk s ARG 151 Cb -0.14 -3.61 -0.04 0.00 -1.56 0.00 0.00 34.95 29.59 3abk s ARG 151 CO 0.04 -0.24 0.10 -1.64 -0.81 0.00 0.00 175.30 172.75 3abk s MET 152 N 1.94 3.95 -0.15 5.12 -1.94 -0.08 -0.64 119.30 127.50 3abk s MET 152 Ca 0.21 -0.27 0.00 0.00 -1.71 0.00 0.00 55.69 53.92 3abk s MET 152 Cb -0.15 -3.28 -0.01 0.00 2.01 0.00 0.00 34.83 33.40 3abk s MET 152 CO 0.09 0.37 -0.14 -0.51 -0.01 0.00 0.00 175.02 174.82 3abk s LEU 153 N 0.13 2.56 -0.08 -0.03 1.43 -0.00 -0.38 118.68 122.31 3abk s LEU 153 Ca 0.07 -0.42 0.05 0.00 -1.03 0.00 0.00 54.13 52.80 3abk s LEU 153 Cb -0.12 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 3abk s LEU 153 CO -0.00 0.11 -0.24 -0.69 0.23 0.00 0.00 176.35 175.75 3abk s VAL 154 N 0.69 2.05 0.00 -1.59 1.01 0.11 -1.02 120.40 121.65 3abk s VAL 154 Ca -0.07 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 60.87 3abk s VAL 154 Cb -0.16 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.47 3abk s VAL 154 CO 0.02 0.56 0.00 -0.24 0.00 0.00 0.00 175.10 175.44 3abk n SER 155 N 3.21 0.00 -3.86 3.32 2.88 -0.52 -1.12 113.62 117.52 3abk n SER 155 Ca -0.18 -0.96 -0.11 0.00 -1.33 0.00 0.00 58.87 56.28 3abk n SER 155 Cb 0.52 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.88 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 -0.91 0.01 0.00 -3.46 0.15 -1.24 -0.88 113.70 107.38 3abk s SER 156 Ca 0.00 -0.16 0.21 0.00 0.70 0.00 0.00 55.95 56.70 3abk s SER 156 Cb 0.00 0.22 0.47 0.00 -1.71 0.00 0.00 66.02 65.00 3abk s SER 156 CO 0.00 -0.35 1.41 -0.62 1.20 0.00 0.00 173.24 174.88 3abk n GLU 157 N 1.55 2.53 0.00 5.44 1.02 -0.39 -4.01 120.64 126.79 3abk n GLU 157 Ca -0.22 -2.34 0.00 0.00 -0.02 0.00 0.00 57.16 54.58 3abk n GLU 157 Cb 0.56 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 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 1.41 0.00 -3.50 1.62 5.68 -1.26 -5.05 116.55 115.45 3abk n ASP 158 Ca 0.20 0.00 -0.14 0.00 -0.50 0.00 0.00 54.79 54.35 3abk n ASP 158 Cb 0.58 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.64 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 -2.28 2.12 0.24 -1.26 -4.64 118.33 112.51 3abk n VAL 159 Ca 0.00 -0.92 -0.36 0.00 -2.04 0.00 0.00 64.34 61.02 3abk n VAL 159 Cb 0.00 -1.13 -0.01 0.00 -1.47 0.00 0.00 33.84 31.24 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 3.90 0.00 1.34 1.43 -1.26 -4.62 118.68 119.46 3abk s LEU 160 Ca 0.40 2.23 0.03 0.00 -1.03 0.00 0.00 54.13 55.76 3abk s LEU 160 Cb -0.02 -4.40 -0.01 0.00 0.03 0.00 0.00 46.19 41.79 3abk s LEU 160 CO 0.27 -1.03 0.12 1.41 0.23 0.00 0.00 176.35 177.35 3abk n HIS 161 N -0.84 -0.29 -3.69 0.29 8.25 -0.35 -4.35 115.22 114.24 3abk n HIS 161 Ca 0.09 -1.28 -0.10 0.00 -0.26 0.00 0.00 57.72 56.17 3abk n HIS 161 Cb 0.49 0.11 -0.11 0.00 1.12 0.00 0.00 29.99 31.61 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 -2.09 -0.47 -0.36 0.41 0.15 -1.26 0.37 113.70 110.46 3abk s SER 162 Ca 0.17 0.88 -0.17 0.00 0.70 0.00 0.00 55.95 57.53 3abk s SER 162 Cb 0.01 0.82 -0.00 0.00 -1.71 0.00 0.00 66.02 65.13 3abk s SER 162 CO 0.12 -0.20 0.44 0.86 1.20 0.00 0.00 173.24 175.66 3abk s TRP 163 N 1.54 3.19 -0.01 3.44 -0.00 0.02 -1.21 118.94 125.90 3abk s TRP 163 Ca -0.09 0.00 0.04 0.00 -0.00 0.00 0.00 56.10 56.06 3abk s TRP 163 Cb -0.09 -2.82 -0.01 0.00 -0.00 0.00 0.00 33.47 30.55 3abk s TRP 163 CO -0.13 -0.52 -0.13 0.00 -0.00 0.00 0.00 176.95 176.17 3abk s ALA 164 N 2.20 1.09 -0.31 5.86 0.00 -1.26 -1.87 121.76 127.47 3abk s ALA 164 Ca 0.15 -0.54 -0.02 0.00 0.00 0.00 0.00 51.96 51.54 3abk s ALA 164 Cb -0.16 -0.30 0.11 0.00 0.00 0.00 0.00 23.12 22.77 3abk s ALA 164 CO 0.13 0.25 0.15 0.08 0.00 0.00 0.00 175.76 176.37 3abk s VAL 165 N -0.22 0.21 0.27 0.00 1.01 -0.63 -3.33 120.40 117.70 3abk s VAL 165 Ca 0.03 -1.17 -0.00 0.00 0.00 0.00 0.00 61.98 60.85 3abk s VAL 165 Cb -0.06 -1.18 0.26 0.00 0.00 0.00 0.00 36.38 35.41 3abk s VAL 165 CO -0.00 -0.79 1.81 -0.65 0.00 0.00 0.00 175.10 175.47 3abk h PRO 166 N 7.96 0.84 0.00 2.72 0.11 -1.75 -2.07 132.00 139.80 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 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3abk h PRO 166 CO 0.41 0.55 0.00 0.66 -0.21 0.00 0.00 178.00 179.41 3abk h SER 167 N 0.86 0.00 -0.13 -2.05 4.64 -1.85 -0.77 113.55 114.25 3abk h SER 167 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 3abk h SER 167 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 3abk h SER 167 CO -0.29 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 175.85 3abk n LEU 168 N -2.72 2.72 -0.84 5.97 4.77 -0.81 -0.94 117.00 125.16 3abk n LEU 168 Ca 0.01 -1.00 -0.07 0.00 -0.03 0.00 0.00 56.01 54.91 3abk n LEU 168 Cb 0.26 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3abk n LEU 168 CO 0.23 0.50 -0.09 0.61 -1.33 0.00 0.00 177.39 177.31 3abk n GLY 169 N 1.34 0.07 3.52 -0.72 0.00 -0.30 -4.39 105.19 104.72 3abk n GLY 169 Ca 0.16 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.12 3.01 -0.29 0.99 1.43 -1.05 -4.93 118.68 115.72 3abk s LEU 170 Ca 0.00 -0.11 -0.13 0.00 -1.03 0.00 0.00 54.13 52.86 3abk s LEU 170 Cb 0.00 -1.65 0.11 0.00 0.03 0.00 0.00 46.19 44.67 3abk s LEU 170 CO 0.00 0.32 0.67 -0.75 0.23 0.00 0.00 176.35 176.83 3abk s LYS 171 N -0.56 0.64 -0.11 1.70 2.20 -1.26 -1.61 119.74 120.74 3abk s LYS 171 Ca 0.08 1.34 -0.03 0.00 -0.36 0.00 0.00 55.97 56.99 3abk s LYS 171 Cb -0.12 0.51 0.05 0.00 -1.51 0.00 0.00 37.83 36.76 3abk s LYS 171 CO 0.02 -0.17 0.14 0.99 -0.36 0.00 0.00 175.35 175.96 3abk s THR 172 N 2.26 -0.21 0.74 3.43 2.01 -0.78 -4.97 115.64 118.12 3abk s THR 172 Ca -0.08 0.22 -0.14 0.00 0.31 0.00 0.00 61.69 62.00 3abk s THR 172 Cb -0.08 -0.37 0.05 0.00 0.01 0.00 0.00 72.50 72.11 3abk s THR 172 CO -0.19 0.03 1.16 -1.81 -0.69 0.00 0.00 174.62 173.12 3abk s ASP 173 N 2.25 4.29 -0.27 3.53 1.11 -1.26 -0.80 116.67 125.52 3abk s ASP 173 Ca 0.04 2.18 0.02 0.00 0.18 0.00 0.00 52.55 54.96 3abk s ASP 173 Cb -0.13 -2.57 0.06 0.00 1.07 0.00 0.00 42.92 41.35 3abk s ASP 173 CO -0.07 -2.19 -0.09 0.00 1.18 0.00 0.00 175.17 174.01 3abk s ALA 174 N -2.28 2.62 -0.05 5.23 0.00 0.16 -4.76 121.76 122.69 3abk s ALA 174 Ca 0.70 -1.74 0.03 0.00 0.00 0.00 0.00 51.96 50.95 3abk s ALA 174 Cb -0.25 -1.66 0.01 0.00 0.00 0.00 0.00 23.12 21.22 3abk s ALA 174 CO 0.47 -1.18 -0.13 0.42 0.00 0.00 0.00 175.76 175.35 3abk s ILE 175 N 1.15 1.12 0.34 0.00 1.01 -1.26 -1.21 121.20 122.34 3abk s ILE 175 Ca -0.07 -0.51 -0.28 0.00 0.00 0.00 0.00 60.65 59.79 3abk s ILE 175 Cb -0.20 -0.99 -0.09 0.00 0.01 0.00 0.00 42.46 41.19 3abk s ILE 175 CO -0.04 0.34 1.17 -2.16 0.00 0.00 0.00 174.94 174.25 3abk s PRO 176 N 0.33 4.35 0.00 2.79 0.04 -1.26 -2.34 135.00 138.92 3abk s PRO 176 Ca -0.08 1.91 0.00 0.00 0.04 0.00 0.00 61.00 62.87 3abk s PRO 176 Cb -0.12 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.46 3abk s PRO 176 CO 0.02 -0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.39 3abk n GLY 177 N 0.87 1.28 3.00 0.56 0.00 -1.26 -4.97 105.19 104.67 3abk n GLY 177 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.16 0.52 -0.39 1.61 3.52 -0.99 -5.13 118.95 117.93 3abk s ARG 178 Ca 0.00 -0.38 0.02 0.00 -0.13 0.00 0.00 55.73 55.24 3abk s ARG 178 Cb 0.00 -0.45 0.11 0.00 -1.56 0.00 0.00 34.95 33.05 3abk s ARG 178 CO 0.00 0.11 0.13 -1.17 -0.81 0.00 0.00 175.30 173.56 3abk s LEU 179 N -0.56 4.81 0.07 -0.88 2.96 -1.26 -4.48 118.68 119.34 3abk s LEU 179 Ca -0.01 -2.30 -0.11 0.00 -0.22 0.00 0.00 54.13 51.50 3abk s LEU 179 Cb -0.05 -1.68 -0.06 0.00 0.50 0.00 0.00 46.19 44.91 3abk s LEU 179 CO 0.00 -0.39 0.41 0.20 -1.32 0.00 0.00 176.35 175.26 3abk s ASN 180 N 0.88 6.68 -0.02 3.68 0.01 -0.27 -4.85 114.94 121.05 3abk s ASN 180 Ca 0.12 0.84 0.07 0.00 -0.71 0.00 0.00 52.86 53.18 3abk s ASN 180 Cb -0.21 -2.20 -0.02 0.00 0.41 0.00 0.00 41.25 39.23 3abk s ASN 180 CO -0.06 0.19 -0.23 -1.58 -1.51 0.00 0.00 177.10 173.91 3abk s GLN 181 N -1.77 2.17 0.12 -0.60 0.74 -1.26 0.09 119.66 119.15 3abk s GLN 181 Ca 0.32 -0.89 -0.03 0.00 0.05 0.00 0.00 55.36 54.81 3abk s GLN 181 Cb -0.14 -2.11 -0.03 0.00 1.10 0.00 0.00 33.01 31.82 3abk s GLN 181 CO 0.17 0.57 0.09 -0.08 -0.55 0.00 0.00 175.29 175.49 3abk s THR 182 N -0.66 0.11 0.04 -0.34 -1.32 0.49 -5.01 115.64 108.96 3abk s THR 182 Ca 0.11 -1.79 0.08 0.00 -1.21 0.00 0.00 61.69 58.88 3abk s THR 182 Cb -0.10 -1.92 -0.03 0.00 -1.51 0.00 0.00 72.50 68.94 3abk s THR 182 CO -0.00 -0.51 -0.23 0.42 -2.21 0.00 0.00 174.62 172.09 3abk s THR 183 N -4.01 1.84 -0.08 5.08 -4.23 -1.26 -0.90 115.64 112.07 3abk s THR 183 Ca 0.20 -1.23 0.05 0.00 -1.18 0.00 0.00 61.69 59.52 3abk s THR 183 Cb 0.07 -1.58 -0.01 0.00 1.34 0.00 0.00 72.50 72.32 3abk s THR 183 CO -0.00 0.30 -0.24 -0.22 -0.54 0.00 0.00 174.62 173.92 3abk s LEU 184 N -1.12 2.13 -0.14 4.79 0.20 0.11 -4.93 118.68 119.72 3abk s LEU 184 Ca 0.09 -0.52 -0.04 0.00 0.69 0.00 0.00 54.13 54.35 3abk s LEU 184 Cb -0.09 -1.41 0.06 0.00 -0.43 0.00 0.00 46.19 44.32 3abk s LEU 184 CO 0.02 0.20 0.11 -0.32 -0.29 0.00 0.00 176.35 176.06 3abk s MET 185 N 0.10 0.05 -0.25 1.98 1.75 -1.26 -0.95 119.30 120.71 3abk s MET 185 Ca -0.11 0.10 -0.11 0.00 -1.25 0.00 0.00 55.69 54.32 3abk s MET 185 Cb -0.16 -1.36 -0.05 0.00 2.84 0.00 0.00 34.83 36.11 3abk s MET 185 CO 0.06 -0.57 0.17 0.45 -0.65 0.00 0.00 175.02 174.48 3abk s SER 186 N 2.18 6.09 0.19 1.11 0.15 -1.26 -4.29 113.70 117.88 3abk s SER 186 Ca 0.03 0.08 0.23 0.00 0.70 0.00 0.00 55.95 57.00 3abk s SER 186 Cb -0.15 -2.11 0.91 0.00 -1.71 0.00 0.00 66.02 62.96 3abk s SER 186 CO -0.08 0.04 1.71 -1.20 1.20 0.00 0.00 173.24 174.91 3abk n SER 187 N 4.45 0.57 -4.07 5.45 7.64 -0.24 0.97 113.62 128.40 3abk n SER 187 Ca -0.15 0.61 -0.11 0.00 1.01 0.00 0.00 58.87 60.24 3abk n SER 187 Cb 0.52 -0.74 -0.11 0.00 -1.01 0.00 0.00 64.21 62.87 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 -3.20 0.55 0.93 1.43 0.52 -1.26 -4.81 118.95 113.12 3abk s ARG 188 Ca 0.07 -0.92 -0.12 0.00 -0.52 0.00 0.00 55.73 54.24 3abk s ARG 188 Cb 0.11 -0.10 0.15 0.00 0.52 0.00 0.00 34.95 35.63 3abk s ARG 188 CO 0.44 -0.01 1.13 -1.25 0.02 0.00 0.00 175.30 175.63 3abk s PRO 189 N -2.39 0.97 0.00 3.54 0.04 -1.26 -4.81 135.00 131.09 3abk s PRO 189 Ca -0.04 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.30 3abk s PRO 189 Cb -0.04 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.68 3abk s PRO 189 CO -0.03 -2.32 0.00 0.41 0.04 0.00 0.00 177.00 175.11 3abk n GLY 190 N -2.04 1.00 3.51 0.56 0.00 -0.17 -4.91 105.19 103.15 3abk n GLY 190 Ca 0.07 -1.93 -0.34 0.00 0.00 0.00 0.00 46.02 43.82 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 3.34 -0.10 0.99 1.43 -1.26 -0.00 118.68 123.08 3abk s LEU 191 Ca 0.00 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.02 3abk s LEU 191 Cb 0.00 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.41 3abk s LEU 191 CO 0.00 0.16 -0.18 -0.31 0.23 0.00 0.00 176.35 176.25 3abk s TYR 192 N 0.44 2.08 0.13 0.29 1.51 -0.44 -4.95 117.35 116.41 3abk s TYR 192 Ca -0.02 -0.89 0.06 0.00 -1.01 0.00 0.00 57.07 55.21 3abk s TYR 192 Cb -0.14 -1.45 -0.04 0.00 -0.11 0.00 0.00 41.96 40.22 3abk s TYR 192 CO 0.02 -0.41 -0.03 0.71 -1.11 0.00 0.00 175.55 174.74 3abk s TYR 193 N 0.65 2.86 0.27 2.71 2.02 -1.26 0.25 117.35 124.85 3abk s TYR 193 Ca -0.13 -0.10 -0.11 0.00 -0.37 0.00 0.00 57.07 56.35 3abk s TYR 193 Cb -0.16 -1.45 -0.00 0.00 -0.40 0.00 0.00 41.96 39.95 3abk s TYR 193 CO 0.04 0.48 0.48 0.20 -1.57 0.00 0.00 175.55 175.18 3abk s GLY 194 N -2.52 0.69 0.06 0.71 0.00 0.13 -4.17 107.32 102.22 3abk s GLY 194 Ca 0.25 -0.99 0.01 0.00 0.00 0.00 0.00 44.72 43.99 3abk s GLY 194 CO 0.17 -0.69 -0.05 1.20 0.00 0.00 0.00 173.10 173.73 3abk s GLN 195 N -3.80 0.64 0.23 2.90 -0.21 -1.21 -0.63 119.66 117.57 3abk s GLN 195 Ca 0.24 -1.08 -0.31 0.00 0.02 0.00 0.00 55.36 54.22 3abk s GLN 195 Cb -0.01 -0.06 -0.12 0.00 1.00 0.00 0.00 33.01 33.83 3abk s GLN 195 CO 0.11 -0.03 1.67 0.00 -2.12 0.00 0.00 175.29 174.92 3abk n SER 197 N 3.52 1.97 -3.76 0.00 7.64 -0.35 -4.90 113.62 117.74 3abk n SER 197 Ca 0.14 -3.18 -0.14 0.00 1.01 0.00 0.00 58.87 56.69 3abk n SER 197 Cb 0.36 -0.43 -0.15 0.00 -1.01 0.00 0.00 64.21 62.98 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 -2.67 0.04 -0.05 1.43 2.56 -1.26 -4.67 118.70 114.08 3abk s GLU 198 Ca 0.31 0.29 -0.35 0.00 0.00 0.00 0.00 54.97 55.23 3abk s GLU 198 Cb 0.28 -0.21 -0.12 0.00 2.00 0.00 0.00 34.13 36.08 3abk s GLU 198 CO -0.00 -0.17 1.81 1.51 -0.56 0.00 0.00 175.26 177.85 3abk n ILE 199 N 4.20 0.46 -1.88 -3.70 3.06 -1.26 -4.41 119.36 115.82 3abk n ILE 199 Ca -0.27 -0.08 0.04 0.00 -2.50 0.00 0.00 62.75 59.93 3abk n ILE 199 Cb 0.51 -1.76 0.06 0.00 0.54 0.00 0.00 39.64 38.99 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 -0.31 -0.10 0.49 0.00 0.00 -1.26 -4.79 105.19 99.22 3abk n GLY 201 Ca 0.07 -2.26 0.39 0.00 0.00 0.00 0.00 46.02 44.22 3abk n GLY 201 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3abk h SER 202 N 0.00 0.21 -0.01 1.61 0.02 -2.03 -2.28 113.55 111.07 3abk h SER 202 Ca 0.00 0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3abk h SER 202 Cb 0.00 0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 3abk h SER 202 CO 0.00 -0.19 -0.05 0.59 -1.14 0.00 0.00 176.83 176.04 3abk n ASN 203 N -4.64 2.32 -0.24 3.07 5.03 -1.26 -4.60 115.26 114.93 3abk n ASN 203 Ca 0.38 -3.18 0.04 0.00 0.87 0.00 0.00 54.58 52.69 3abk n ASN 203 Cb 1.50 -0.44 0.14 0.00 -1.02 0.00 0.00 39.78 39.95 3abk n ASN 203 CO 0.00 0.00 0.00 -0.74 -1.83 0.00 0.00 177.26 174.69 3abk h HIS 204 N 0.15 -0.07 0.00 3.10 -0.00 -1.71 0.47 115.15 117.10 3abk h HIS 204 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.42 3abk h HIS 204 Cb 1.01 0.14 0.00 0.00 -0.00 0.00 0.00 27.41 28.56 3abk h HIS 204 CO 0.10 -0.22 0.01 0.77 -0.00 0.00 0.00 177.93 178.59 3abk h SER 205 N 0.10 0.00 -0.78 3.26 0.02 -1.83 -3.35 113.55 110.97 3abk h SER 205 Ca 0.38 0.00 -0.42 0.00 -0.84 0.00 0.00 61.79 60.91 3abk h SER 205 Cb 0.65 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.78 3abk h SER 205 CO -0.63 0.00 -0.97 0.49 -1.14 0.00 0.00 176.83 174.59 3abk n PHE 206 N -2.31 2.10 -3.11 3.45 0.99 0.16 -4.86 117.46 113.87 3abk n PHE 206 Ca -0.02 -2.40 -0.19 0.00 -0.00 0.00 0.00 57.45 54.85 3abk n PHE 206 Cb 0.05 -0.27 -0.05 0.00 -1.00 0.00 0.00 39.48 38.21 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 -0.55 0.49 -1.92 -1.08 0.00 -1.24 -4.58 117.12 108.24 3abk n MET 207 Ca 0.25 -2.74 -0.29 0.00 0.00 0.00 0.00 57.70 54.92 3abk n MET 207 Cb 0.85 -1.47 0.12 0.00 0.00 0.00 0.00 33.22 32.72 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 -0.04 1.49 -0.11 3.17 0.04 -1.26 -3.50 135.00 134.80 3abk s PRO 208 Ca 0.33 -0.08 0.03 0.00 0.04 0.00 0.00 61.00 61.31 3abk s PRO 208 Cb 0.10 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.73 3abk s PRO 208 CO -0.15 -1.89 -0.19 0.42 0.04 0.00 0.00 177.00 175.23 3abk s ILE 209 N -3.69 1.77 -0.12 0.56 1.01 0.20 -4.81 121.20 116.11 3abk s ILE 209 Ca 0.66 -0.82 -0.00 0.00 0.00 0.00 0.00 60.65 60.49 3abk s ILE 209 Cb -0.08 -1.57 0.02 0.00 0.01 0.00 0.00 42.46 40.84 3abk s ILE 209 CO 0.50 0.49 -0.10 -0.69 0.00 0.00 0.00 174.94 175.15 3abk s VAL 210 N 0.72 1.21 -0.12 2.92 1.01 -1.26 0.17 120.40 125.05 3abk s VAL 210 Ca -0.11 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 61.40 3abk s VAL 210 Cb -0.16 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 3abk s VAL 210 CO 0.02 0.40 0.12 -0.76 0.00 0.00 0.00 175.10 174.88 3abk s LEU 211 N 1.63 4.29 -0.33 3.92 1.43 0.14 -0.62 118.68 129.14 3abk s LEU 211 Ca 0.05 0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 53.57 3abk s LEU 211 Cb -0.13 -2.04 0.07 0.00 0.03 0.00 0.00 46.19 44.12 3abk s LEU 211 CO -0.09 0.40 0.05 -0.70 0.23 0.00 0.00 176.35 176.24 3abk s GLU 212 N -0.99 2.21 -0.24 1.70 2.12 0.37 -1.33 118.70 122.54 3abk s GLU 212 Ca 0.15 -1.47 -0.10 0.00 0.36 0.00 0.00 54.97 53.91 3abk s GLU 212 Cb -0.12 -3.26 -0.05 0.00 0.26 0.00 0.00 34.13 30.97 3abk s GLU 212 CO 0.04 -0.76 0.15 -0.51 -0.54 0.00 0.00 175.26 173.64 3abk s LEU 213 N 1.18 4.01 0.08 2.70 2.01 1.00 -1.04 118.68 128.62 3abk s LEU 213 Ca -0.01 0.06 -0.02 0.00 0.01 0.00 0.00 54.13 54.17 3abk s LEU 213 Cb -0.20 -2.08 -0.04 0.00 0.01 0.00 0.00 46.19 43.88 3abk s LEU 213 CO -0.03 0.04 0.03 0.68 1.01 0.00 0.00 176.35 178.08 3abk s VAL 214 N 1.19 0.17 0.68 -1.59 -7.23 -0.71 -1.00 120.40 111.92 3abk s VAL 214 Ca 0.07 -1.76 -0.17 0.00 -1.81 0.00 0.00 61.98 58.31 3abk s VAL 214 Cb -0.14 -1.66 0.00 0.00 0.56 0.00 0.00 36.38 35.14 3abk s VAL 214 CO 0.05 -0.79 1.14 -2.65 -0.31 0.00 0.00 175.10 172.54 3abk n PRO 215 N 0.03 0.78 -0.16 4.82 -0.02 -1.26 -0.26 135.00 138.93 3abk n PRO 215 Ca -0.11 0.32 -0.03 0.00 -2.02 0.00 0.00 63.50 61.66 3abk n PRO 215 Cb 0.62 -2.38 0.06 0.00 -0.02 0.00 0.00 33.50 31.78 3abk n PRO 215 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3abk h LEU 216 N 0.10 0.21 -0.71 2.45 5.85 -1.93 0.11 115.31 121.38 3abk h LEU 216 Ca -0.49 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.35 3abk h LEU 216 Cb 1.34 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.34 3abk h LEU 216 CO 0.50 0.15 0.40 0.50 -0.34 0.00 0.00 178.44 179.65 3abk h LYS 217 N 0.37 0.71 -0.15 1.25 3.11 -1.99 0.48 116.57 120.35 3abk h LYS 217 Ca 0.23 -0.04 -0.08 0.00 -2.81 0.00 0.00 60.65 57.95 3abk h LYS 217 Cb 0.23 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 31.29 3abk h LYS 217 CO -0.23 0.47 -0.25 1.88 -2.81 0.00 0.00 179.45 178.52 3abk h TYR 218 N 0.73 0.30 -0.35 1.91 0.05 -1.67 -1.13 116.97 116.82 3abk h TYR 218 Ca 0.32 -0.06 -0.11 0.00 0.05 0.00 0.00 58.73 58.93 3abk h TYR 218 Cb 0.20 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 3abk h TYR 218 CO -0.07 0.51 -0.21 0.35 -1.05 0.00 0.00 178.16 177.68 3abk h PHE 219 N 0.25 0.89 -0.46 4.88 3.57 0.99 -1.51 116.94 125.55 3abk h PHE 219 Ca 0.04 -0.23 0.04 0.00 3.53 0.00 0.00 57.97 61.35 3abk h PHE 219 Cb 0.58 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 3abk h PHE 219 CO 0.01 0.98 0.22 0.93 -2.23 0.00 0.00 178.31 178.22 3abk h GLU 220 N 0.55 0.42 -0.28 1.11 5.08 -0.00 0.23 114.58 121.68 3abk h GLU 220 Ca 0.07 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.47 3abk h GLU 220 Cb 0.77 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.86 3abk h GLU 220 CO 0.06 0.28 -0.14 0.87 -1.00 0.00 0.00 179.01 179.08 3abk h LYS 221 N 0.43 -0.10 -0.23 2.33 1.57 -1.10 -0.81 116.57 118.66 3abk h LYS 221 Ca 0.20 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.03 3abk h LYS 221 Cb 0.13 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 3abk h LYS 221 CO -0.16 -0.07 -0.01 2.35 -0.57 0.00 0.00 179.45 181.00 3abk h TRP 222 N -0.11 -0.02 0.15 -1.35 7.01 -1.05 0.10 115.95 120.69 3abk h TRP 222 Ca 0.15 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.18 3abk h TRP 222 Cb 0.33 0.05 -0.04 0.00 -2.10 0.00 0.00 29.16 27.40 3abk h TRP 222 CO -0.33 -0.04 -0.31 0.77 -2.79 0.00 0.00 178.44 175.73 3abk h SER 223 N 0.06 -0.88 -0.33 2.65 0.02 -0.57 -1.51 113.55 113.00 3abk h SER 223 Ca 0.11 0.10 0.07 0.00 -0.84 0.00 0.00 61.79 61.23 3abk h SER 223 Cb 0.14 0.33 -0.08 0.00 0.14 0.00 0.00 62.40 62.93 3abk h SER 223 CO -0.19 -0.41 -0.30 0.00 -1.14 0.00 0.00 176.83 174.80 3abk h ALA 224 N 0.09 -0.18 -0.40 3.77 0.00 -0.93 0.31 119.26 121.92 3abk h ALA 224 Ca 0.02 0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.14 3abk h ALA 224 Cb 0.57 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 3abk h ALA 224 CO -0.16 -0.71 0.30 0.66 0.00 0.00 0.00 179.25 179.34 3abk h SER 225 N -0.26 0.00 0.69 0.00 4.64 -0.81 0.21 113.55 118.01 3abk h SER 225 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3abk h SER 225 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3abk h SER 225 CO -0.48 0.00 -0.23 0.80 -0.87 0.00 0.00 176.83 176.05 3abk n MET 226 N -4.34 0.10 0.00 4.77 1.56 0.05 -5.10 117.12 114.16 3abk n MET 226 Ca 0.07 -0.04 0.00 0.00 -0.27 0.00 0.00 57.70 57.46 3abk n MET 226 Cb 0.49 -1.50 0.00 0.00 2.15 0.00 0.00 33.22 34.36 3abk n MET 226 CO 0.00 0.00 0.00 -0.11 -0.73 0.00 0.00 175.97 175.13