#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bgq n GLN 10 N 0.00 2.07 -2.46 1.61 10.64 -1.26 -4.67 117.38 123.31 2bgq n GLN 10 Ca 0.00 -1.23 -0.20 0.00 -1.83 0.00 0.00 57.00 53.74 2bgq n GLN 10 Cb 0.00 -1.65 -0.01 0.00 -0.86 0.00 0.00 30.24 27.72 2bgq n GLN 10 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2bgq n GLY 11 N 0.06 -0.50 0.82 2.61 0.00 -1.26 -4.78 105.19 102.14 2bgq n GLY 11 Ca 0.17 0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.30 2bgq n GLY 11 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bgq n GLU 12 N -3.05 1.84 -2.76 1.61 -0.58 -1.26 -4.69 120.64 111.74 2bgq n GLU 12 Ca -0.22 -1.77 -0.42 0.00 -0.42 0.00 0.00 57.16 54.33 2bgq n GLU 12 Cb 0.67 -1.38 -0.03 0.00 -0.57 0.00 0.00 31.44 30.13 2bgq n GLU 12 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 2bgq s GLN 13 N -1.51 4.33 0.00 3.49 0.74 -1.26 -4.93 119.66 120.52 2bgq s GLN 13 Ca 0.25 1.23 0.29 0.00 0.05 0.00 0.00 55.36 57.18 2bgq s GLN 13 Cb 0.17 -3.58 1.29 0.00 1.10 0.00 0.00 33.01 31.99 2bgq s GLN 13 CO 0.25 -0.40 1.88 -0.40 -0.55 0.00 0.00 175.29 176.07 2bgq n ASP 14 N 5.45 0.89 -3.68 6.67 5.75 -1.26 -4.78 116.55 125.59 2bgq n ASP 14 Ca 0.08 -1.17 -0.08 0.00 -0.01 0.00 0.00 54.79 53.60 2bgq n ASP 14 Cb 0.48 -0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.55 2bgq n ASP 14 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2bgq s HIS 15 N -2.11 -0.31 0.01 2.11 -3.43 -1.26 -1.28 115.29 109.02 2bgq s HIS 15 Ca 0.38 -0.03 0.05 0.00 -0.80 0.00 0.00 55.06 54.66 2bgq s HIS 15 Cb 0.21 0.64 -0.02 0.00 -1.43 0.00 0.00 32.58 31.99 2bgq s HIS 15 CO 0.38 -1.03 -0.15 -0.06 -2.00 0.00 0.00 174.74 171.88 2bgq s PHE 16 N -3.76 1.31 -0.31 0.38 0.40 0.90 -4.76 117.98 112.13 2bgq s PHE 16 Ca 0.07 -0.29 -0.16 0.00 -0.60 0.00 0.00 56.93 55.95 2bgq s PHE 16 Cb -0.04 -0.81 -0.02 0.00 0.51 0.00 0.00 43.02 42.66 2bgq s PHE 16 CO -0.01 0.01 0.41 0.08 0.70 0.00 0.00 175.22 176.41 2bgq s VAL 17 N -0.56 5.13 0.87 -0.44 1.01 -1.26 0.56 120.40 125.71 2bgq s VAL 17 Ca 0.04 0.37 -0.12 0.00 0.00 0.00 0.00 61.98 62.27 2bgq s VAL 17 Cb -0.07 -3.81 0.12 0.00 0.00 0.00 0.00 36.38 32.62 2bgq s VAL 17 CO 0.00 -0.01 1.11 -0.76 0.00 0.00 0.00 175.10 175.44 2bgq s LEU 18 N 2.14 2.23 0.57 3.92 1.43 0.81 -4.81 118.68 124.97 2bgq s LEU 18 Ca 0.15 1.19 0.28 0.00 -1.03 0.00 0.00 54.13 54.72 2bgq s LEU 18 Cb -0.16 -3.62 1.52 0.00 0.03 0.00 0.00 46.19 43.96 2bgq s LEU 18 CO 0.11 -2.39 2.00 0.50 0.23 0.00 0.00 176.35 176.80 2bgq h LYS 19 N -1.38 0.00 0.00 1.70 1.63 -1.86 0.97 116.57 117.63 2bgq h LYS 19 Ca -0.49 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.31 2bgq h LYS 19 Cb 1.30 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.93 2bgq h LYS 19 CO 0.60 0.00 -0.11 -1.13 -3.45 0.00 0.00 179.45 175.36 2bgq n SER 20 N -3.92 0.68 0.00 4.20 3.41 -1.26 -4.92 113.62 111.81 2bgq n SER 20 Ca 0.06 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 2bgq n SER 20 Cb 0.52 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 2bgq n SER 20 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bgq n GLY 21 N 1.35 2.66 3.77 5.00 0.00 0.34 -5.06 105.19 113.24 2bgq n GLY 21 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2bgq n GLY 21 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bgq s HIS 22 N -2.65 2.93 -0.06 1.61 3.76 -1.26 -4.47 115.29 115.15 2bgq s HIS 22 Ca 0.00 1.26 -0.24 0.00 -0.15 0.00 0.00 55.06 55.93 2bgq s HIS 22 Cb 0.00 -3.80 -0.04 0.00 1.11 0.00 0.00 32.58 29.86 2bgq s HIS 22 CO 0.00 -2.33 0.72 0.00 -0.85 0.00 0.00 174.74 172.28 2bgq s ALA 23 N -0.86 3.33 -0.15 -1.40 0.00 -1.26 -0.14 121.76 121.27 2bgq s ALA 23 Ca 0.52 0.17 0.02 0.00 0.00 0.00 0.00 51.96 52.67 2bgq s ALA 23 Cb -0.42 -2.98 0.01 0.00 0.00 0.00 0.00 23.12 19.73 2bgq s ALA 23 CO 0.53 -0.10 -0.21 1.41 0.00 0.00 0.00 175.76 177.39 2bgq s MET 24 N 0.77 2.99 0.22 0.00 0.00 0.19 -4.94 119.30 118.52 2bgq s MET 24 Ca 0.39 -0.84 -0.32 0.00 0.00 0.00 0.00 55.69 54.92 2bgq s MET 24 Cb -0.18 -2.46 -0.13 0.00 0.00 0.00 0.00 34.83 32.05 2bgq s MET 24 CO 0.19 -0.08 1.53 -2.30 0.00 0.00 0.00 175.02 174.36 2bgq n PRO 25 N 4.26 2.25 -0.33 4.11 -0.02 -1.26 -0.07 135.00 143.94 2bgq n PRO 25 Ca -0.20 0.81 0.03 0.00 -2.02 0.00 0.00 63.50 62.11 2bgq n PRO 25 Cb 0.51 -2.54 0.17 0.00 -0.02 0.00 0.00 33.50 31.62 2bgq n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bgq h ALA 26 N 5.18 1.29 -3.30 3.55 0.00 -1.48 -3.41 119.26 121.09 2bgq h ALA 26 Ca -0.45 0.01 -0.64 0.00 0.00 0.00 0.00 54.91 53.82 2bgq h ALA 26 Cb 1.25 -0.22 -0.24 0.00 0.00 0.00 0.00 17.79 18.59 2bgq h ALA 26 CO 0.83 0.25 -0.70 0.08 0.00 0.00 0.00 179.25 179.71 2bgq s VAL 27 N -6.03 3.57 0.08 0.00 1.01 -1.26 -0.29 120.40 117.48 2bgq s VAL 27 Ca -0.12 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.45 2bgq s VAL 27 Cb 0.20 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 2bgq s VAL 27 CO 0.80 0.50 -0.17 -0.83 0.00 0.00 0.00 175.10 175.40 2bgq s GLY 28 N 0.39 1.01 -0.28 4.51 0.00 -0.72 -4.24 107.32 107.98 2bgq s GLY 28 Ca -0.06 -1.10 -0.29 0.00 0.00 0.00 0.00 44.72 43.26 2bgq s GLY 28 CO 0.04 -1.12 1.12 -2.27 0.00 0.00 0.00 173.10 170.86 2bgq s LEU 29 N -1.82 3.99 0.30 0.66 2.96 0.20 -3.45 118.68 121.52 2bgq s LEU 29 Ca 0.01 1.22 -0.25 0.00 -0.22 0.00 0.00 54.13 54.89 2bgq s LEU 29 Cb -0.10 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.95 2bgq s LEU 29 CO 0.03 -0.84 0.90 -0.83 -1.32 0.00 0.00 176.35 174.29 2bgq s GLY 30 N 1.73 2.80 0.00 7.98 0.00 -1.12 -0.15 107.32 118.55 2bgq s GLY 30 Ca 0.47 0.47 0.07 0.00 0.00 0.00 0.00 44.72 45.73 2bgq s GLY 30 CO 0.14 0.91 0.81 -1.30 0.00 0.00 0.00 173.10 173.65 2bgq n THR 31 N 0.69 0.22 0.00 0.90 -2.24 -0.60 -4.52 114.28 108.72 2bgq n THR 31 Ca 0.01 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2bgq n THR 31 Cb 0.50 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 2bgq n THR 31 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 2bgq n TRP 32 N 0.31 0.00 0.00 4.78 -0.00 -1.26 -5.00 117.44 116.27 2bgq n TRP 32 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.55 2bgq n TRP 32 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.52 2bgq n TRP 32 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 177.69 174.22 2bgq n ASP 37 N 0.00 0.00 -0.28 5.87 4.64 -1.26 -5.00 116.55 120.52 2bgq n ASP 37 Ca 0.00 0.00 -0.06 0.00 -1.38 0.00 0.00 54.79 53.35 2bgq n ASP 37 Cb 0.00 0.00 0.06 0.00 -1.04 0.00 0.00 41.12 40.14 2bgq n ASP 37 CO 0.00 0.00 0.00 0.74 -0.82 0.00 0.00 177.20 177.12 2bgq h THR 38 N 0.00 1.26 0.44 5.18 2.02 -1.96 -2.31 112.91 117.54 2bgq h THR 38 Ca 0.00 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 2bgq h THR 38 Cb 0.00 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 66.76 2bgq h THR 38 CO 0.00 0.33 -0.36 0.00 0.37 0.00 0.00 175.52 175.86 2bgq h ALA 39 N 1.15 -0.83 0.01 6.16 0.00 -1.93 -0.04 119.26 123.77 2bgq h ALA 39 Ca 0.25 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2bgq h ALA 39 Cb 0.23 0.49 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 2bgq h ALA 39 CO -0.02 -1.00 -0.23 1.25 0.00 0.00 0.00 179.25 179.26 2bgq h HIS 40 N -0.80 -0.61 -0.37 0.00 6.17 -1.89 -0.25 115.15 117.39 2bgq h HIS 40 Ca -0.04 0.02 0.08 0.00 0.71 0.00 0.00 60.37 61.14 2bgq h HIS 40 Cb 0.69 0.27 -0.08 0.00 2.52 0.00 0.00 27.41 30.81 2bgq h HIS 40 CO -0.17 -0.32 -0.20 1.03 0.71 0.00 0.00 177.93 178.98 2bgq h SER 41 N -0.36 -0.68 0.11 3.26 0.87 -1.27 0.23 113.55 115.70 2bgq h SER 41 Ca 0.06 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.76 2bgq h SER 41 Cb 0.44 0.36 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 2bgq h SER 41 CO -0.20 -0.23 -0.05 0.58 -0.53 0.00 0.00 176.83 176.39 2bgq h VAL 42 N -0.14 0.91 -0.25 2.23 2.07 -0.66 0.20 116.25 120.61 2bgq h VAL 42 Ca 0.18 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.69 2bgq h VAL 42 Cb 0.42 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 2bgq h VAL 42 CO -0.45 0.02 -0.09 -0.09 0.02 0.00 0.00 177.57 176.98 2bgq h ARG 43 N -0.18 -0.04 -0.50 1.57 2.43 -0.65 -2.25 114.38 114.77 2bgq h ARG 43 Ca -0.01 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 2bgq h ARG 43 Cb 0.14 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 2bgq h ARG 43 CO 0.02 -0.03 -0.09 1.15 -1.51 0.00 0.00 179.97 179.51 2bgq h THR 44 N -0.04 1.27 -0.12 0.20 2.02 -0.40 -1.07 112.91 114.77 2bgq h THR 44 Ca 0.13 -1.23 -0.01 0.00 0.77 0.00 0.00 66.41 66.07 2bgq h THR 44 Cb 0.23 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 2bgq h THR 44 CO -0.28 0.43 0.03 0.00 0.37 0.00 0.00 175.52 176.07 2bgq h ALA 45 N 0.90 1.82 0.07 6.16 0.00 -0.37 0.13 119.26 127.98 2bgq h ALA 45 Ca 0.13 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 2bgq h ALA 45 Cb 0.65 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2bgq h ALA 45 CO 0.04 0.14 -1.02 0.82 0.00 0.00 0.00 179.25 179.24 2bgq h ILE 46 N 0.17 1.22 0.00 0.00 2.04 -1.18 0.21 117.51 119.97 2bgq h ILE 46 Ca 0.04 -2.36 -0.06 0.00 1.00 0.00 0.00 64.86 63.48 2bgq h ILE 46 Cb 0.07 2.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.96 2bgq h ILE 46 CO -0.00 0.60 -0.29 0.71 0.00 0.00 0.00 178.15 179.17 2bgq h THR 47 N -0.60 0.47 0.00 -0.27 1.35 -1.13 -3.17 112.91 109.56 2bgq h THR 47 Ca -0.23 -1.66 -0.07 0.00 -0.55 0.00 0.00 66.41 63.90 2bgq h THR 47 Cb 1.50 2.22 -0.01 0.00 -1.73 0.00 0.00 68.15 70.13 2bgq h THR 47 CO 0.00 0.27 -1.25 -0.62 -0.25 0.00 0.00 175.52 173.67 2bgq n GLU 48 N -3.16 0.58 0.17 4.72 1.02 0.44 -4.70 120.64 119.70 2bgq n GLU 48 Ca 0.03 0.02 0.09 0.00 -0.02 0.00 0.00 57.16 57.28 2bgq n GLU 48 Cb 0.64 -1.09 0.09 0.00 -0.02 0.00 0.00 31.44 31.06 2bgq n GLU 48 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bgq h ALA 49 N 0.02 0.80 0.00 0.62 0.00 -1.31 -3.48 119.26 115.91 2bgq h ALA 49 Ca -0.10 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2bgq h ALA 49 Cb 1.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2bgq h ALA 49 CO -0.01 0.17 0.00 0.41 0.00 0.00 0.00 179.25 179.81 2bgq n GLY 50 N 1.16 0.79 3.76 0.00 0.00 -0.79 -4.97 105.19 105.14 2bgq n GLY 50 Ca 0.02 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 2bgq n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bgq s TYR 51 N -2.00 2.48 0.00 1.61 1.51 0.66 -4.93 117.35 116.68 2bgq s TYR 51 Ca 0.00 1.47 0.00 0.00 -1.01 0.00 0.00 57.07 57.53 2bgq s TYR 51 Cb 0.00 -3.57 0.00 0.00 -0.11 0.00 0.00 41.96 38.28 2bgq s TYR 51 CO 0.00 -2.28 0.11 0.54 -1.11 0.00 0.00 175.55 172.81 2bgq n ARG 52 N -1.10 -0.02 -3.97 -0.62 5.12 -1.26 -4.39 116.66 110.42 2bgq n ARG 52 Ca 0.11 -0.11 -0.27 0.00 -1.93 0.00 0.00 57.85 55.65 2bgq n ARG 52 Cb 0.48 -0.52 -0.17 0.00 -1.16 0.00 0.00 32.46 31.08 2bgq n ARG 52 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2bgq s HIS 53 N -0.01 1.59 -0.13 -1.55 2.46 -1.26 0.12 115.29 116.51 2bgq s HIS 53 Ca 0.00 -0.80 0.02 0.00 0.47 0.00 0.00 55.06 54.74 2bgq s HIS 53 Cb 0.00 -1.28 0.01 0.00 -0.13 0.00 0.00 32.58 31.18 2bgq s HIS 53 CO 0.00 -0.52 -0.18 0.08 -2.47 0.00 0.00 174.74 171.65 2bgq s VAL 54 N 1.60 1.78 -0.17 0.89 1.01 0.04 0.62 120.40 126.16 2bgq s VAL 54 Ca 0.04 -0.80 -0.07 0.00 0.00 0.00 0.00 61.98 61.15 2bgq s VAL 54 Cb -0.13 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 2bgq s VAL 54 CO -0.08 0.49 0.04 -0.62 0.00 0.00 0.00 175.10 174.94 2bgq s ASP 55 N 1.04 5.49 0.11 3.32 2.15 0.79 -1.45 116.67 128.11 2bgq s ASP 55 Ca -0.04 0.05 0.00 0.00 0.43 0.00 0.00 52.55 53.00 2bgq s ASP 55 Cb -0.15 -1.92 -0.00 0.00 -0.30 0.00 0.00 42.92 40.55 2bgq s ASP 55 CO -0.05 0.18 0.13 1.07 -0.17 0.00 0.00 175.17 176.34 2bgq n THR 56 N 3.47 0.00 -3.60 1.71 5.66 -0.54 -1.56 114.28 119.42 2bgq n THR 56 Ca -0.17 -0.62 -0.13 0.00 -3.05 0.00 0.00 64.05 60.08 2bgq n THR 56 Cb 0.52 0.35 -0.07 0.00 -1.55 0.00 0.00 70.33 69.59 2bgq n THR 56 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bgq s ALA 57 N -2.09 -1.85 0.31 1.79 0.00 -1.26 -3.62 121.76 115.03 2bgq s ALA 57 Ca 0.10 1.78 -0.01 0.00 0.00 0.00 0.00 51.96 53.83 2bgq s ALA 57 Cb -0.00 -0.95 0.49 0.00 0.00 0.00 0.00 23.12 22.66 2bgq s ALA 57 CO 0.07 -0.31 1.98 0.00 0.00 0.00 0.00 175.76 177.50 2bgq h ALA 58 N 4.04 1.44 -0.55 0.00 0.00 -1.94 -2.62 119.26 119.64 2bgq h ALA 58 Ca -0.27 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.62 2bgq h ALA 58 Cb 1.16 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2bgq h ALA 58 CO 0.17 0.52 0.36 1.49 0.00 0.00 0.00 179.25 181.79 2bgq h GLU 59 N 1.05 0.60 -0.18 0.00 4.22 -1.96 -1.83 114.58 116.48 2bgq h GLU 59 Ca 0.28 -0.04 -0.04 0.00 0.08 0.00 0.00 59.36 59.65 2bgq h GLU 59 Cb -0.12 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 28.98 2bgq h GLU 59 CO -0.06 0.40 -0.05 1.88 -2.18 0.00 0.00 179.01 179.00 2bgq h TYR 60 N 0.62 0.27 0.00 0.92 0.05 -1.85 -3.46 116.97 113.51 2bgq h TYR 60 Ca 0.22 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.98 2bgq h TYR 60 Cb 0.12 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 37.78 2bgq h TYR 60 CO -0.00 0.33 0.00 0.41 -1.05 0.00 0.00 178.16 177.85 2bgq n GLY 61 N -1.04 0.49 0.00 3.88 0.00 -0.69 -4.95 105.19 102.88 2bgq n GLY 61 Ca -0.00 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2bgq n GLY 61 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bgq n VAL 62 N -3.45 0.62 -0.32 1.61 0.24 -1.26 -4.77 118.33 111.00 2bgq n VAL 62 Ca 0.00 -0.73 0.03 0.00 -2.04 0.00 0.00 64.34 61.60 2bgq n VAL 62 Cb 0.30 0.74 0.17 0.00 -1.47 0.00 0.00 33.84 33.57 2bgq n VAL 62 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2bgq h GLU 63 N 0.00 0.89 -0.47 7.34 5.08 -1.89 0.50 114.58 126.03 2bgq h GLU 63 Ca 0.00 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.39 2bgq h GLU 63 Cb 0.45 -0.20 -0.07 0.00 0.50 0.00 0.00 28.75 29.43 2bgq h GLU 63 CO 0.00 0.59 0.09 -0.22 -1.00 0.00 0.00 179.01 178.46 2bgq h LYS 64 N 0.91 0.21 -0.56 2.33 3.64 -1.86 0.55 116.57 121.79 2bgq h LYS 64 Ca 0.41 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.68 2bgq h LYS 64 Cb 0.31 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 2bgq h LYS 64 CO -0.22 0.14 -0.04 0.93 -2.27 0.00 0.00 179.45 177.99 2bgq h GLU 65 N 0.22 1.02 -0.77 1.90 4.39 -1.54 -2.02 114.58 117.78 2bgq h GLU 65 Ca 0.23 -0.35 0.00 0.00 0.34 0.00 0.00 59.36 59.59 2bgq h GLU 65 Cb 0.31 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 2bgq h GLU 65 CO -0.31 1.03 0.49 0.28 -1.16 0.00 0.00 179.01 179.34 2bgq h VAL 66 N 0.91 1.21 -0.65 3.13 2.07 0.33 0.24 116.25 123.50 2bgq h VAL 66 Ca 0.15 -0.43 0.04 0.00 0.82 0.00 0.00 66.70 67.29 2bgq h VAL 66 Cb 0.60 0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 30.43 2bgq h VAL 66 CO 0.04 0.21 0.38 1.23 0.02 0.00 0.00 177.57 179.45 2bgq h GLY 67 N 1.06 0.93 1.01 2.17 0.00 0.33 0.30 103.07 108.87 2bgq h GLY 67 Ca 0.28 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2bgq h GLY 67 CO -0.06 0.20 0.28 0.50 0.00 0.00 0.00 176.54 177.47 2bgq h LYS 68 N 0.72 0.99 -0.56 4.80 1.57 -0.63 0.97 116.57 124.42 2bgq h LYS 68 Ca 0.28 -0.17 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 2bgq h LYS 68 Cb 0.11 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2bgq h LYS 68 CO -0.14 0.81 0.08 0.78 -0.57 0.00 0.00 179.45 180.41 2bgq h GLY 69 N 0.94 0.97 1.05 3.86 0.00 -0.10 -2.36 103.07 107.42 2bgq h GLY 69 Ca 0.22 -0.61 -0.13 0.00 0.00 0.00 0.00 47.33 46.81 2bgq h GLY 69 CO -0.02 0.57 -0.28 1.41 0.00 0.00 0.00 176.54 178.22 2bgq h LEU 70 N 0.85 0.88 -0.29 3.11 3.38 0.13 -2.72 115.31 120.66 2bgq h LEU 70 Ca 0.17 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 2bgq h LEU 70 Cb 0.39 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2bgq h LEU 70 CO 0.01 1.14 0.17 0.50 0.09 0.00 0.00 178.44 180.35 2bgq h LYS 71 N 0.64 0.40 -0.47 1.13 3.64 -0.68 -1.58 116.57 119.65 2bgq h LYS 71 Ca 0.07 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 2bgq h LYS 71 Cb 0.86 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.57 2bgq h LYS 71 CO 0.07 0.32 0.30 0.00 -2.27 0.00 0.00 179.45 177.87 2bgq h ALA 72 N 1.05 0.60 -0.40 5.00 0.00 -1.44 0.13 119.26 124.20 2bgq h ALA 72 Ca 0.10 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2bgq h ALA 72 Cb 0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2bgq h ALA 72 CO -0.02 0.01 0.04 0.00 0.00 0.00 0.00 179.25 179.29 2bgq h ALA 73 N 1.19 1.34 -0.07 0.00 0.00 -1.27 -1.05 119.26 119.40 2bgq h ALA 73 Ca 0.18 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2bgq h ALA 73 Cb -0.04 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.59 2bgq h ALA 73 CO -0.06 0.46 -0.45 0.52 0.00 0.00 0.00 179.25 179.72 2bgq h MET 74 N 0.58 0.43 0.00 0.00 2.07 -0.81 -2.48 114.93 114.72 2bgq h MET 74 Ca 0.13 -0.37 0.00 0.00 -2.07 0.00 0.00 59.70 57.39 2bgq h MET 74 Cb 0.30 0.08 0.00 0.00 -1.87 0.00 0.00 31.60 30.12 2bgq h MET 74 CO 0.01 1.01 0.00 0.93 1.07 0.00 0.00 176.91 179.92 2bgq h GLU 75 N -0.03 0.00 -0.26 1.72 5.08 -0.52 0.09 114.58 120.66 2bgq h GLU 75 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2bgq h GLU 75 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2bgq h GLU 75 CO 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.10 2bgq n ALA 76 N -1.84 2.48 0.00 3.43 0.00 -0.42 -4.91 120.51 119.25 2bgq n ALA 76 Ca -0.01 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.85 2bgq n ALA 76 Cb 0.11 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2bgq n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bgq n GLY 77 N 1.11 1.14 3.67 0.00 0.00 0.02 -5.05 105.19 106.08 2bgq n GLY 77 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 2bgq n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bgq s ILE 78 N -2.07 4.70 0.29 -0.61 -1.09 -0.96 -5.01 121.20 116.45 2bgq s ILE 78 Ca 0.00 2.02 -0.29 0.00 -2.23 0.00 0.00 60.65 60.14 2bgq s ILE 78 Cb 0.00 -4.30 -0.10 0.00 -1.58 0.00 0.00 42.46 36.48 2bgq s ILE 78 CO 0.00 -0.10 1.18 -1.81 -1.23 0.00 0.00 174.94 172.98 2bgq s ASP 79 N 1.18 7.08 0.20 3.58 -0.00 -1.26 -4.20 116.67 123.26 2bgq s ASP 79 Ca 0.46 2.41 -0.10 0.00 -0.00 0.00 0.00 52.55 55.32 2bgq s ASP 79 Cb -0.17 -2.63 0.26 0.00 -0.00 0.00 0.00 42.92 40.38 2bgq s ASP 79 CO 0.11 -0.30 1.74 -0.09 -0.00 0.00 0.00 175.17 176.63 2bgq h ARG 80 N 3.82 0.37 0.00 8.23 9.65 -1.94 0.24 114.38 134.74 2bgq h ARG 80 Ca -0.47 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 2bgq h ARG 80 Cb 1.22 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.71 2bgq h ARG 80 CO 0.67 0.25 0.00 1.57 2.80 0.00 0.00 179.97 185.26 2bgq h LYS 81 N 0.38 0.00 -0.01 0.20 2.10 -2.03 0.23 116.57 117.43 2bgq h LYS 81 Ca 0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.94 2bgq h LYS 81 Cb 0.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 2bgq h LYS 81 CO -0.30 0.00 -0.18 -0.25 -2.00 0.00 0.00 179.45 176.72 2bgq n ASP 82 N -2.62 1.52 -4.77 7.07 8.00 0.06 -4.88 116.55 120.93 2bgq n ASP 82 Ca -0.02 -1.29 -0.32 0.00 0.71 0.00 0.00 54.79 53.87 2bgq n ASP 82 Cb 0.07 0.12 -0.07 0.00 -0.02 0.00 0.00 41.12 41.22 2bgq n ASP 82 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2bgq s LEU 83 N -2.28 3.84 -0.25 0.64 1.43 0.07 -4.83 118.68 117.29 2bgq s LEU 83 Ca 0.28 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 2bgq s LEU 83 Cb 0.20 -2.33 0.05 0.00 0.03 0.00 0.00 46.19 44.13 2bgq s LEU 83 CO 0.44 0.24 -0.12 0.12 0.23 0.00 0.00 176.35 177.26 2bgq s PHE 84 N -1.25 3.16 -0.10 0.29 5.36 0.33 -4.97 117.98 120.80 2bgq s PHE 84 Ca 0.25 -2.14 0.01 0.00 -0.96 0.00 0.00 56.93 54.09 2bgq s PHE 84 Cb -0.12 -1.94 -0.02 0.00 -0.34 0.00 0.00 43.02 40.60 2bgq s PHE 84 CO 0.17 -0.86 -0.12 0.08 -1.46 0.00 0.00 175.22 173.03 2bgq s VAL 85 N 1.15 3.20 0.03 3.12 1.01 -1.26 -0.78 120.40 126.87 2bgq s VAL 85 Ca -0.06 -0.64 0.07 0.00 0.00 0.00 0.00 61.98 61.36 2bgq s VAL 85 Cb -0.18 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 2bgq s VAL 85 CO -0.06 0.55 -0.22 -0.89 0.00 0.00 0.00 175.10 174.48 2bgq s THR 86 N -0.12 1.74 0.23 3.92 2.01 -0.53 -1.55 115.64 121.34 2bgq s THR 86 Ca -0.01 -1.16 -0.01 0.00 0.31 0.00 0.00 61.69 60.82 2bgq s THR 86 Cb -0.14 -1.49 -0.03 0.00 0.01 0.00 0.00 72.50 70.85 2bgq s THR 86 CO 0.03 0.29 0.20 -0.55 -0.69 0.00 0.00 174.62 173.90 2bgq s SER 87 N -1.04 0.39 0.01 3.53 0.15 -0.28 -1.46 113.70 115.00 2bgq s SER 87 Ca 0.08 -1.41 0.01 0.00 0.70 0.00 0.00 55.95 55.33 2bgq s SER 87 Cb -0.09 0.44 -0.01 0.00 -1.71 0.00 0.00 66.02 64.65 2bgq s SER 87 CO 0.01 -0.92 -0.03 -0.54 1.20 0.00 0.00 173.24 172.96 2bgq s LYS 88 N -4.00 0.26 -0.09 5.44 1.02 -1.24 -0.83 119.74 120.31 2bgq s LYS 88 Ca 0.37 -0.28 -0.20 0.00 0.02 0.00 0.00 55.97 55.89 2bgq s LYS 88 Cb 0.05 -0.15 -0.04 0.00 -0.52 0.00 0.00 37.83 37.18 2bgq s LYS 88 CO 0.14 0.03 0.56 -1.50 -0.92 0.00 0.00 175.35 173.66 2bgq s ILE 89 N -0.51 5.13 0.48 2.17 2.07 -0.58 -3.17 121.20 126.79 2bgq s ILE 89 Ca -0.04 1.13 -0.14 0.00 -1.41 0.00 0.00 60.65 60.19 2bgq s ILE 89 Cb -0.04 -3.90 -0.07 0.00 0.13 0.00 0.00 42.46 38.58 2bgq s ILE 89 CO -0.00 0.31 0.91 0.86 -1.91 0.00 0.00 174.94 175.11 2bgq s TRP 90 N 0.64 3.46 0.34 3.50 -0.11 -1.26 -2.48 118.94 123.03 2bgq s TRP 90 Ca 0.30 1.32 0.17 0.00 1.22 0.00 0.00 56.10 59.11 2bgq s TRP 90 Cb -0.16 -2.67 1.19 0.00 -1.50 0.00 0.00 33.47 30.33 2bgq s TRP 90 CO 0.13 -0.29 1.50 0.00 -4.62 0.00 0.00 176.95 173.68 2bgq h THR 92 N 0.00 0.00 -0.40 0.00 1.35 -1.86 -2.42 112.91 109.58 2bgq h THR 92 Ca 0.77 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 66.38 2bgq h THR 92 Cb 1.98 1.03 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 2bgq h THR 92 CO -0.76 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 175.10 2bgq n ASN 93 N -2.51 3.73 -3.74 5.36 3.02 0.47 -4.77 115.26 116.82 2bgq n ASN 93 Ca 0.01 -2.46 -0.42 0.00 -0.03 0.00 0.00 54.58 51.68 2bgq n ASN 93 Cb 0.21 -0.43 -0.00 0.00 -0.61 0.00 0.00 39.78 38.95 2bgq n ASN 93 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2bgq n LEU 94 N 0.33 6.99 -3.77 3.41 4.77 -0.93 -4.06 117.00 123.74 2bgq n LEU 94 Ca 0.19 -4.41 -0.13 0.00 -0.03 0.00 0.00 56.01 51.63 2bgq n LEU 94 Cb 0.70 -1.56 -0.12 0.00 -2.33 0.00 0.00 43.42 40.11 2bgq n LEU 94 CO 0.15 1.35 -0.10 0.00 -1.33 0.00 0.00 177.39 177.45 2bgq s ALA 95 N 1.70 -0.59 0.28 -1.18 0.00 -1.26 -4.65 121.76 116.05 2bgq s ALA 95 Ca 0.46 0.80 -0.08 0.00 0.00 0.00 0.00 51.96 53.13 2bgq s ALA 95 Cb 0.13 -0.48 0.45 0.00 0.00 0.00 0.00 23.12 23.22 2bgq s ALA 95 CO -0.05 -0.14 1.56 -1.35 0.00 0.00 0.00 175.76 175.78 2bgq h PRO 96 N 6.25 -0.00 0.00 0.00 0.11 -1.86 0.49 132.00 136.98 2bgq h PRO 96 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2bgq h PRO 96 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2bgq h PRO 96 CO 0.36 -0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.30 2bgq n GLU 97 N -5.62 0.08 -0.06 1.05 0.28 -1.26 -2.96 120.64 112.15 2bgq n GLU 97 Ca 0.16 0.15 0.08 0.00 -0.16 0.00 0.00 57.16 57.39 2bgq n GLU 97 Cb 0.49 -1.50 0.10 0.00 1.43 0.00 0.00 31.44 31.97 2bgq n GLU 97 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2bgq n ARG 98 N -1.44 1.64 -0.01 3.44 1.74 0.15 -4.59 116.66 117.58 2bgq n ARG 98 Ca 0.06 -1.67 -0.12 0.00 -0.77 0.00 0.00 57.85 55.34 2bgq n ARG 98 Cb 0.20 -1.34 -0.10 0.00 -1.02 0.00 0.00 32.46 30.21 2bgq n ARG 98 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2bgq h VAL 99 N 3.19 1.33 0.18 1.55 2.07 -1.41 -2.92 116.25 120.23 2bgq h VAL 99 Ca 0.00 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.00 2bgq h VAL 99 Cb 0.72 2.29 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 2bgq h VAL 99 CO 0.00 0.37 -0.15 -0.09 0.02 0.00 0.00 177.57 177.71 2bgq h ARG 100 N -0.77 -0.34 -0.25 1.57 9.65 -1.81 -2.19 114.38 120.24 2bgq h ARG 100 Ca -0.01 0.02 0.02 0.00 -1.10 0.00 0.00 59.98 58.91 2bgq h ARG 100 Cb 0.65 0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 29.29 2bgq h ARG 100 CO 0.01 -0.23 0.17 -1.35 2.80 0.00 0.00 179.97 181.37 2bgq h PRO 101 N -0.35 0.26 -0.29 0.20 0.11 -1.82 -1.27 132.00 128.84 2bgq h PRO 101 Ca -0.00 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.92 2bgq h PRO 101 Cb 0.32 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 2bgq h PRO 101 CO -0.02 0.17 -0.48 0.00 -0.21 0.00 0.00 178.00 177.46 2bgq h ALA 102 N 1.85 0.45 -0.24 -0.75 0.00 -1.28 -1.98 119.26 117.32 2bgq h ALA 102 Ca 0.10 -0.49 -0.15 0.00 0.00 0.00 0.00 54.91 54.37 2bgq h ALA 102 Cb 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2bgq h ALA 102 CO -0.02 0.62 -0.44 1.25 0.00 0.00 0.00 179.25 180.66 2bgq h LEU 103 N 0.62 0.80 -1.12 0.00 7.12 -1.03 -1.68 115.31 120.02 2bgq h LEU 103 Ca 0.02 -0.54 -0.03 0.00 0.13 0.00 0.00 57.88 57.47 2bgq h LEU 103 Cb 1.08 -0.23 -0.03 0.00 -0.53 0.00 0.00 40.66 40.95 2bgq h LEU 103 CO 0.11 1.19 0.28 -0.33 -0.13 0.00 0.00 178.44 179.56 2bgq h GLU 104 N 0.45 0.90 -0.30 1.25 5.08 -1.25 0.18 114.58 120.89 2bgq h GLU 104 Ca 0.01 -0.13 -0.11 0.00 -1.00 0.00 0.00 59.36 58.14 2bgq h GLU 104 Cb 1.04 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 2bgq h GLU 104 CO 0.10 0.71 -0.25 -0.97 -1.00 0.00 0.00 179.01 177.60 2bgq h ASN 105 N 0.89 0.60 -0.28 1.42 -1.24 -1.23 -1.25 115.58 114.48 2bgq h ASN 105 Ca 0.22 -0.21 -0.02 0.00 0.71 0.00 0.00 56.30 56.99 2bgq h ASN 105 Cb 0.13 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 2bgq h ASN 105 CO -0.02 0.84 0.09 0.74 -1.29 0.00 0.00 177.43 177.78 2bgq h THR 106 N 0.52 1.20 -0.58 -3.57 2.02 -0.22 -1.67 112.91 110.61 2bgq h THR 106 Ca 0.07 -0.62 -0.02 0.00 0.77 0.00 0.00 66.41 66.61 2bgq h THR 106 Cb 0.71 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 68.17 2bgq h THR 106 CO 0.05 0.21 0.27 -0.07 0.37 0.00 0.00 175.52 176.35 2bgq h LEU 107 N 0.29 0.74 -0.08 2.58 3.38 -0.39 -0.93 115.31 120.91 2bgq h LEU 107 Ca 0.09 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2bgq h LEU 107 Cb 0.23 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2bgq h LEU 107 CO -0.00 0.64 -0.01 0.50 0.09 0.00 0.00 178.44 179.65 2bgq h LYS 108 N 0.82 0.14 -0.47 1.13 1.63 -1.02 0.15 116.57 118.95 2bgq h LYS 108 Ca 0.20 -0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 59.88 2bgq h LYS 108 Cb 0.10 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.70 2bgq h LYS 108 CO -0.03 0.44 0.01 -0.44 -3.45 0.00 0.00 179.45 175.98 2bgq h ASP 109 N -0.17 0.73 0.75 4.20 3.32 -1.10 -2.01 116.42 122.15 2bgq h ASP 109 Ca 0.02 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2bgq h ASP 109 Cb 0.38 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2bgq h ASP 109 CO 0.01 0.80 -0.15 0.18 -1.72 0.00 0.00 179.24 178.35 2bgq n LEU 110 N -4.22 0.20 -3.64 1.55 4.77 -0.37 -3.92 117.00 111.36 2bgq n LEU 110 Ca 0.02 0.28 -0.22 0.00 -0.03 0.00 0.00 56.01 56.07 2bgq n LEU 110 Cb 0.29 -0.38 0.06 0.00 -2.33 0.00 0.00 43.42 41.07 2bgq n LEU 110 CO 0.41 0.05 0.10 0.00 -1.33 0.00 0.00 177.39 176.62 2bgq n GLN 111 N -1.42 -6.32 -4.38 3.23 6.02 0.35 -4.43 117.38 110.44 2bgq n GLN 111 Ca 0.08 0.74 -0.20 0.00 -0.01 0.00 0.00 57.00 57.61 2bgq n GLN 111 Cb 0.32 -5.62 -0.10 0.00 1.02 0.00 0.00 30.24 25.86 2bgq n GLN 111 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2bgq s LEU 112 N -6.86 2.55 0.00 1.08 1.43 -0.18 -5.00 118.68 111.70 2bgq s LEU 112 Ca 0.27 -1.06 0.21 0.00 -1.03 0.00 0.00 54.13 52.53 2bgq s LEU 112 Cb -0.13 -0.73 0.41 0.00 0.03 0.00 0.00 46.19 45.78 2bgq s LEU 112 CO 0.77 -0.18 1.36 -0.90 0.23 0.00 0.00 176.35 177.63 2bgq n ASP 113 N -0.46 3.37 -3.62 2.29 5.68 -1.26 -4.57 116.55 117.98 2bgq n ASP 113 Ca -0.07 -1.96 -0.04 0.00 -0.50 0.00 0.00 54.79 52.23 2bgq n ASP 113 Cb 0.61 -0.26 -0.03 0.00 -1.14 0.00 0.00 41.12 40.30 2bgq n ASP 113 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 2bgq s TYR 114 N -1.34 -0.09 0.27 2.11 -0.85 -1.26 -4.76 117.35 111.43 2bgq s TYR 114 Ca 0.36 0.09 0.10 0.00 -0.52 0.00 0.00 57.07 57.10 2bgq s TYR 114 Cb 0.21 0.50 -0.05 0.00 0.38 0.00 0.00 41.96 43.00 2bgq s TYR 114 CO 0.29 -0.12 -0.15 0.96 -1.52 0.00 0.00 175.55 175.01 2bgq s ILE 115 N -1.93 2.12 -0.09 -3.49 -4.36 -0.20 -5.01 121.20 108.24 2bgq s ILE 115 Ca 0.09 -2.28 -0.13 0.00 -0.26 0.00 0.00 60.65 58.07 2bgq s ILE 115 Cb -0.01 -2.30 -0.28 0.00 1.25 0.00 0.00 42.46 41.12 2bgq s ILE 115 CO -0.04 -0.41 0.54 0.44 0.24 0.00 0.00 174.94 175.70 2bgq h ASP 116 N 2.31 0.45 -3.73 4.36 3.32 -1.59 -1.76 116.42 119.77 2bgq h ASP 116 Ca -0.40 -0.89 -0.36 0.00 0.02 0.00 0.00 57.03 55.41 2bgq h ASP 116 Cb 1.24 -0.15 -0.31 0.00 0.22 0.00 0.00 39.33 40.34 2bgq h ASP 116 CO 0.63 1.72 -0.76 -0.22 -1.72 0.00 0.00 179.24 178.89 2bgq s LEU 117 N -7.38 1.70 -0.15 1.55 2.96 -0.85 0.22 118.68 116.73 2bgq s LEU 117 Ca -0.20 -0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 53.60 2bgq s LEU 117 Cb 0.05 -0.33 0.04 0.00 0.50 0.00 0.00 46.19 46.46 2bgq s LEU 117 CO 0.79 0.01 -0.01 -0.47 -1.32 0.00 0.00 176.35 175.35 2bgq s TYR 118 N 0.32 1.23 0.28 5.38 5.04 -0.14 -1.12 117.35 128.34 2bgq s TYR 118 Ca -0.04 -0.80 0.06 0.00 -2.44 0.00 0.00 57.07 53.86 2bgq s TYR 118 Cb -0.07 -1.10 -0.02 0.00 0.35 0.00 0.00 41.96 41.12 2bgq s TYR 118 CO -0.00 -0.55 0.38 -1.01 -1.34 0.00 0.00 175.55 173.03 2bgq s HIS 119 N 1.79 3.27 -0.35 4.97 3.76 -0.01 -0.85 115.29 127.87 2bgq s HIS 119 Ca 0.01 -0.11 -0.20 0.00 -0.15 0.00 0.00 55.06 54.61 2bgq s HIS 119 Cb -0.15 -1.72 -0.00 0.00 1.11 0.00 0.00 32.58 31.82 2bgq s HIS 119 CO -0.07 0.28 0.59 0.42 -0.85 0.00 0.00 174.74 175.10 2bgq s ILE 120 N -2.08 4.94 0.12 0.60 -1.09 -0.54 -1.53 121.20 121.62 2bgq s ILE 120 Ca 0.38 0.52 -0.24 0.00 -2.23 0.00 0.00 60.65 59.08 2bgq s ILE 120 Cb -0.09 -4.03 -0.06 0.00 -1.58 0.00 0.00 42.46 36.70 2bgq s ILE 120 CO 0.29 -0.26 1.67 -0.74 -1.23 0.00 0.00 174.94 174.67 2bgq h HIS 121 N 8.44 -0.40 -3.52 3.97 2.76 -1.80 -1.19 115.15 123.41 2bgq h HIS 121 Ca -0.27 0.01 -0.18 0.00 -2.20 0.00 0.00 60.37 57.73 2bgq h HIS 121 Cb 1.12 0.18 -0.25 0.00 1.55 0.00 0.00 27.41 30.01 2bgq h HIS 121 CO 0.74 -0.23 -0.57 -1.58 -1.30 0.00 0.00 177.93 174.99 2bgq s TRP 122 N -6.13 -0.04 -0.12 5.26 0.52 -1.26 -4.32 118.94 112.84 2bgq s TRP 122 Ca -0.15 0.10 -0.05 0.00 0.02 0.00 0.00 56.10 56.03 2bgq s TRP 122 Cb 0.09 -0.01 -0.17 0.00 -1.15 0.00 0.00 33.47 32.23 2bgq s TRP 122 CO 0.67 -0.14 3.36 -0.35 0.02 0.00 0.00 176.95 180.51 2bgq n PRO 123 N 2.44 2.09 -3.83 4.98 -0.04 -1.26 -4.78 135.00 134.59 2bgq n PRO 123 Ca -0.16 -1.35 -0.12 0.00 -0.04 0.00 0.00 63.50 61.83 2bgq n PRO 123 Cb 0.58 -2.02 -0.12 0.00 -0.04 0.00 0.00 33.50 31.90 2bgq n PRO 123 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2bgq s PHE 124 N 0.23 -0.10 0.01 0.54 0.40 -1.26 -4.96 117.98 112.83 2bgq s PHE 124 Ca 0.63 0.24 -0.11 0.00 -0.60 0.00 0.00 56.93 57.10 2bgq s PHE 124 Cb 0.33 0.02 -0.05 0.00 0.51 0.00 0.00 43.02 43.83 2bgq s PHE 124 CO -0.06 -0.15 0.34 0.50 0.70 0.00 0.00 175.22 176.55 2bgq s ARG 125 N -0.41 3.75 0.10 0.44 3.52 -1.25 -4.55 118.95 120.54 2bgq s ARG 125 Ca -0.05 0.19 0.08 0.00 -0.13 0.00 0.00 55.73 55.82 2bgq s ARG 125 Cb -0.03 -3.13 -0.03 0.00 -1.56 0.00 0.00 34.95 30.19 2bgq s ARG 125 CO 0.01 0.66 -0.20 -0.51 -0.81 0.00 0.00 175.30 174.45 2bgq s LEU 126 N -1.42 2.30 0.48 -0.88 1.43 -1.10 -1.10 118.68 118.38 2bgq s LEU 126 Ca 0.26 -0.68 -0.20 0.00 -1.03 0.00 0.00 54.13 52.48 2bgq s LEU 126 Cb -0.15 -0.83 -0.09 0.00 0.03 0.00 0.00 46.19 45.15 2bgq s LEU 126 CO 0.14 0.04 1.00 -0.75 0.23 0.00 0.00 176.35 177.01 2bgq s LYS 127 N -1.90 3.93 0.24 1.70 2.20 0.91 -4.12 119.74 122.70 2bgq s LYS 127 Ca 0.05 1.22 -0.30 0.00 -0.36 0.00 0.00 55.97 56.58 2bgq s LYS 127 Cb -0.10 -2.12 -0.11 0.00 -1.51 0.00 0.00 37.83 33.99 2bgq s LYS 127 CO 0.04 -0.30 1.55 -0.51 -0.36 0.00 0.00 175.35 175.77 2bgq s ASP 128 N -2.23 6.51 -0.33 1.43 1.01 -1.26 -2.51 116.67 119.30 2bgq s ASP 128 Ca 0.64 2.77 -0.01 0.00 0.71 0.00 0.00 52.55 56.67 2bgq s ASP 128 Cb -0.13 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.18 2bgq s ASP 128 CO 0.20 -0.83 0.12 0.61 0.21 0.00 0.00 175.17 175.48 2bgq n GLY 129 N 2.68 0.41 3.86 0.21 0.00 -1.26 -5.04 105.19 106.05 2bgq n GLY 129 Ca 0.10 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 2bgq n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bgq s ALA 130 N -2.62 3.15 0.43 4.61 0.00 -1.04 -5.09 121.76 121.20 2bgq s ALA 130 Ca 0.06 -0.04 0.08 0.00 0.00 0.00 0.00 51.96 52.06 2bgq s ALA 130 Cb -0.03 -3.00 0.01 0.00 0.00 0.00 0.00 23.12 20.11 2bgq s ALA 130 CO 0.07 -0.39 0.53 -1.01 0.00 0.00 0.00 175.76 174.97 2bgq s HIS 131 N -2.81 2.67 -0.23 0.00 3.76 -1.26 -5.05 115.29 112.37 2bgq s HIS 131 Ca 0.55 -0.45 -0.00 0.00 -0.15 0.00 0.00 55.06 55.01 2bgq s HIS 131 Cb -0.10 -2.31 0.07 0.00 1.11 0.00 0.00 32.58 31.34 2bgq s HIS 131 CO 0.41 -0.40 -0.01 -1.64 -0.85 0.00 0.00 174.74 172.26 2bgq s MET 132 N -4.31 1.22 0.96 1.40 -1.94 -1.26 -2.04 119.30 113.31 2bgq s MET 132 Ca 0.53 -0.85 -0.11 0.00 -1.71 0.00 0.00 55.69 53.55 2bgq s MET 132 Cb -0.08 -2.40 0.17 0.00 2.01 0.00 0.00 34.83 34.53 2bgq s MET 132 CO 0.32 -0.66 1.10 -1.25 -0.01 0.00 0.00 175.02 174.51 2bgq s PRO 133 N 1.55 0.72 0.16 2.03 0.04 -0.99 -4.96 135.00 133.54 2bgq s PRO 133 Ca -0.02 1.15 -0.30 0.00 0.04 0.00 0.00 61.00 61.87 2bgq s PRO 133 Cb -0.18 -1.72 -0.07 0.00 0.04 0.00 0.00 34.50 32.57 2bgq s PRO 133 CO -0.09 -2.71 1.08 -1.25 0.04 0.00 0.00 177.00 174.08 2bgq s PRO 134 N -4.70 4.60 0.88 0.56 0.04 -0.87 -4.97 135.00 130.54 2bgq s PRO 134 Ca 0.66 1.68 -0.13 0.00 0.04 0.00 0.00 61.00 63.24 2bgq s PRO 134 Cb -0.21 -3.30 0.13 0.00 0.04 0.00 0.00 34.50 31.15 2bgq s PRO 134 CO 0.59 0.07 1.21 -1.21 0.04 0.00 0.00 177.00 177.71 2bgq s GLU 135 N -0.22 1.39 0.15 4.56 0.41 -1.26 -4.66 118.70 119.07 2bgq s GLU 135 Ca 0.50 -0.01 -0.31 0.00 -0.41 0.00 0.00 54.97 54.73 2bgq s GLU 135 Cb -0.28 -1.90 -0.09 0.00 -1.78 0.00 0.00 34.13 30.08 2bgq s GLU 135 CO 0.34 -1.97 1.47 0.00 -0.49 0.00 0.00 175.26 174.61 2bgq s ALA 136 N -3.60 3.68 0.00 5.21 0.00 -1.26 -2.60 121.76 123.18 2bgq s ALA 136 Ca 0.66 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.87 2bgq s ALA 136 Cb -0.10 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.45 2bgq s ALA 136 CO 0.51 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2bgq n GLY 137 N 3.48 0.79 0.06 0.00 0.00 -1.26 -4.95 105.19 103.31 2bgq n GLY 137 Ca 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.11 2bgq n GLY 137 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bgq n GLU 138 N -2.23 0.94 -3.10 1.61 1.02 -1.07 -4.76 120.64 113.05 2bgq n GLU 138 Ca 0.00 -0.06 -0.45 0.00 -0.02 0.00 0.00 57.16 56.63 2bgq n GLU 138 Cb 0.00 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 29.93 2bgq n GLU 138 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2bgq s VAL 139 N -2.71 4.94 0.91 2.62 1.01 -1.26 -0.06 120.40 125.85 2bgq s VAL 139 Ca -0.08 -1.41 -0.14 0.00 0.00 0.00 0.00 61.98 60.34 2bgq s VAL 139 Cb 0.07 -4.57 0.15 0.00 0.00 0.00 0.00 36.38 32.04 2bgq s VAL 139 CO 0.75 -1.22 1.21 -0.76 0.00 0.00 0.00 175.10 175.08 2bgq s LEU 140 N 2.23 2.29 0.35 3.92 1.43 -0.26 -4.73 118.68 123.90 2bgq s LEU 140 Ca 0.18 0.66 -0.27 0.00 -1.03 0.00 0.00 54.13 53.68 2bgq s LEU 140 Cb -0.16 -2.91 -0.09 0.00 0.03 0.00 0.00 46.19 43.05 2bgq s LEU 140 CO -0.01 -2.51 1.15 -0.70 0.23 0.00 0.00 176.35 174.52 2bgq s GLU 141 N -5.58 4.29 -0.33 1.70 2.56 -1.26 -3.88 118.70 116.20 2bgq s GLU 141 Ca 0.67 1.85 -0.04 0.00 0.00 0.00 0.00 54.97 57.45 2bgq s GLU 141 Cb -0.10 -2.87 0.05 0.00 2.00 0.00 0.00 34.13 33.21 2bgq s GLU 141 CO 0.52 -0.12 0.08 0.12 -0.56 0.00 0.00 175.26 175.30 2bgq s PHE 142 N -1.32 3.31 -1.28 5.30 5.36 -1.26 -4.69 117.98 123.39 2bgq s PHE 142 Ca 0.52 -1.76 -0.17 0.00 -0.96 0.00 0.00 56.93 54.57 2bgq s PHE 142 Cb -0.31 -2.35 -0.00 0.00 -0.34 0.00 0.00 43.02 40.01 2bgq s PHE 142 CO 0.40 -0.80 2.05 -3.47 -1.46 0.00 0.00 175.22 171.95 2bgq n ASP 143 N 4.70 3.77 -0.29 6.13 2.03 -1.26 -4.75 116.55 126.88 2bgq n ASP 143 Ca -0.11 -2.82 0.07 0.00 0.52 0.00 0.00 54.79 52.45 2bgq n ASP 143 Cb 0.44 -1.58 0.22 0.00 -0.72 0.00 0.00 41.12 39.48 2bgq n ASP 143 CO 0.00 0.00 0.00 -0.03 -1.92 0.00 0.00 177.20 175.25 2bgq h MET 144 N 6.92 0.55 -0.33 -0.67 1.85 -1.94 -0.37 114.93 120.95 2bgq h MET 144 Ca 0.49 -0.03 -0.04 0.00 -0.61 0.00 0.00 59.70 59.51 2bgq h MET 144 Cb 0.71 -0.12 -0.01 0.00 0.43 0.00 0.00 31.60 32.60 2bgq h MET 144 CO 1.78 0.36 0.06 0.93 -0.40 0.00 0.00 176.91 179.64 2bgq h GLU 145 N 0.57 0.54 -0.47 0.39 3.07 -1.96 -0.50 114.58 116.21 2bgq h GLU 145 Ca 0.46 -0.14 -0.08 0.00 -0.50 0.00 0.00 59.36 59.10 2bgq h GLU 145 Cb 0.68 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.51 2bgq h GLU 145 CO -0.38 0.62 -0.03 0.78 -1.40 0.00 0.00 179.01 178.60 2bgq h GLY 146 N 0.37 0.87 0.83 -3.84 0.00 -1.76 -1.31 103.07 98.24 2bgq h GLY 146 Ca 0.10 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.72 2bgq h GLY 146 CO 0.01 0.56 -0.31 -2.08 0.00 0.00 0.00 176.54 174.71 2bgq h VAL 147 N 0.75 1.35 -0.80 4.60 2.07 -1.00 -2.99 116.25 120.24 2bgq h VAL 147 Ca 0.14 -1.57 -0.04 0.00 0.82 0.00 0.00 66.70 66.05 2bgq h VAL 147 Cb 0.50 1.97 -0.04 0.00 -1.52 0.00 0.00 31.29 32.20 2bgq h VAL 147 CO 0.03 0.47 0.34 -0.25 0.02 0.00 0.00 177.57 178.17 2bgq h TRP 148 N 0.12 1.19 -0.56 1.57 2.91 -1.00 -0.87 115.95 119.31 2bgq h TRP 148 Ca 0.00 -0.08 0.10 0.00 1.13 0.00 0.00 58.89 60.04 2bgq h TRP 148 Cb 0.91 -0.36 -0.08 0.00 -0.51 0.00 0.00 29.16 29.12 2bgq h TRP 148 CO 0.10 0.89 0.13 -0.22 -1.03 0.00 0.00 178.44 178.31 2bgq h LYS 149 N 1.15 0.27 0.00 2.65 1.63 -1.23 0.32 116.57 121.36 2bgq h LYS 149 Ca 0.27 -0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.99 2bgq h LYS 149 Cb 0.18 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.75 2bgq h LYS 149 CO -0.03 0.18 -0.29 0.93 -3.45 0.00 0.00 179.45 176.79 2bgq h GLU 150 N 0.28 0.00 -0.32 1.90 4.39 -1.22 -1.72 114.58 117.89 2bgq h GLU 150 Ca 0.29 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.87 2bgq h GLU 150 Cb 0.40 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 2bgq h GLU 150 CO -0.35 0.29 -0.23 0.52 -1.16 0.00 0.00 179.01 178.07 2bgq h MET 151 N 0.00 0.73 -0.21 2.33 2.86 0.69 -2.81 114.93 118.52 2bgq h MET 151 Ca -0.00 -0.35 -0.02 0.00 -2.06 0.00 0.00 59.70 57.26 2bgq h MET 151 Cb 0.53 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 2bgq h MET 151 CO 0.04 0.97 0.02 0.93 1.06 0.00 0.00 176.91 179.92 2bgq h GLU 152 N 0.49 0.30 0.00 1.72 5.08 0.10 -0.75 114.58 121.51 2bgq h GLU 152 Ca 0.06 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2bgq h GLU 152 Cb 0.79 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 2bgq h GLU 152 CO 0.06 0.31 -0.25 -0.91 -1.00 0.00 0.00 179.01 177.22 2bgq h ASN 153 N 0.29 0.00 -0.23 1.42 2.35 -1.09 -1.34 115.58 116.99 2bgq h ASN 153 Ca 0.07 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.68 2bgq h ASN 153 Cb 0.17 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2bgq h ASN 153 CO 0.00 0.25 -0.36 -0.07 -1.65 0.00 0.00 177.43 175.60 2bgq h LEU 154 N 0.00 0.80 -0.02 1.61 3.38 -0.91 -1.02 115.31 119.14 2bgq h LEU 154 Ca -0.00 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 2bgq h LEU 154 Cb 0.62 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 2bgq h LEU 154 CO 0.03 1.08 -0.00 0.58 0.09 0.00 0.00 178.44 180.22 2bgq h VAL 155 N 0.63 1.28 -0.89 1.22 2.07 -1.19 -2.08 116.25 117.29 2bgq h VAL 155 Ca 0.06 -0.85 0.07 0.00 0.82 0.00 0.00 66.70 66.80 2bgq h VAL 155 Cb 0.91 1.81 -0.06 0.00 -1.52 0.00 0.00 31.29 32.43 2bgq h VAL 155 CO 0.08 0.22 0.58 0.11 0.02 0.00 0.00 177.57 178.58 2bgq h LYS 156 N -0.30 0.96 0.00 1.57 1.57 -1.18 -0.55 116.57 118.64 2bgq h LYS 156 Ca 0.01 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2bgq h LYS 156 Cb 0.37 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2bgq h LYS 156 CO 0.00 0.63 0.00 -0.25 -0.57 0.00 0.00 179.45 179.27 2bgq n ASP 157 N -4.49 0.00 -0.51 0.86 8.00 -0.40 -4.90 116.55 115.11 2bgq n ASP 157 Ca 0.14 -1.20 -0.07 0.00 0.71 0.00 0.00 54.79 54.37 2bgq n ASP 157 Cb 0.21 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.28 2bgq n ASP 157 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bgq n GLY 158 N 0.79 0.84 0.11 0.44 0.00 -0.21 -4.88 105.19 102.28 2bgq n GLY 158 Ca 0.17 -0.32 0.08 0.00 0.00 0.00 0.00 46.02 45.95 2bgq n GLY 158 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bgq h LEU 159 N 0.00 0.00 -7.72 0.99 3.38 -1.60 -3.45 115.31 106.91 2bgq h LEU 159 Ca -0.14 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.40 2bgq h LEU 159 Cb 0.64 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 41.04 2bgq h LEU 159 CO 0.20 0.16 -0.78 -0.69 0.09 0.00 0.00 178.44 177.42 2bgq s VAL 160 N -3.24 0.61 0.06 1.22 1.01 -1.06 -1.03 120.40 117.96 2bgq s VAL 160 Ca -0.01 -0.13 -0.16 0.00 0.00 0.00 0.00 61.98 61.69 2bgq s VAL 160 Cb 0.09 -0.64 -0.23 0.00 0.00 0.00 0.00 36.38 35.60 2bgq s VAL 160 CO 0.79 0.25 1.17 0.11 0.00 0.00 0.00 175.10 177.43 2bgq h LYS 161 N 7.42 0.63 -3.36 2.72 1.79 -1.28 -3.33 116.57 121.16 2bgq h LYS 161 Ca -0.34 -0.67 -0.18 0.00 -2.18 0.00 0.00 60.65 57.28 2bgq h LYS 161 Cb 1.15 0.19 -0.26 0.00 -1.58 0.00 0.00 32.23 31.73 2bgq h LYS 161 CO 0.43 1.27 -0.52 -0.51 -1.08 0.00 0.00 179.45 179.03 2bgq s ASP 162 N -7.14 -0.14 0.13 0.86 1.01 0.13 -4.98 116.67 106.54 2bgq s ASP 162 Ca -0.11 0.26 0.07 0.00 0.71 0.00 0.00 52.55 53.48 2bgq s ASP 162 Cb 0.06 0.32 -0.04 0.00 1.01 0.00 0.00 42.92 44.27 2bgq s ASP 162 CO 0.89 -0.10 -0.05 0.27 0.21 0.00 0.00 175.17 176.40 2bgq s ILE 163 N -0.10 3.58 0.00 0.77 -4.36 -1.26 -0.97 121.20 118.86 2bgq s ILE 163 Ca -0.02 -1.29 0.00 0.00 -0.26 0.00 0.00 60.65 59.08 2bgq s ILE 163 Cb -0.02 -2.72 0.00 0.00 1.25 0.00 0.00 42.46 40.97 2bgq s ILE 163 CO 0.00 0.03 0.00 0.61 0.24 0.00 0.00 174.94 175.83 2bgq n GLY 164 N 0.39 2.65 3.07 6.27 0.00 -0.03 -1.38 105.19 116.17 2bgq n GLY 164 Ca -0.12 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.70 2bgq n GLY 164 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bgq s VAL 165 N -2.73 0.15 0.28 1.61 -7.23 -0.39 -1.46 120.40 110.63 2bgq s VAL 165 Ca 0.00 -1.25 0.09 0.00 -1.81 0.00 0.00 61.98 59.02 2bgq s VAL 165 Cb 0.00 -0.91 -0.05 0.00 0.56 0.00 0.00 36.38 35.98 2bgq s VAL 165 CO 0.00 -0.69 -0.14 0.00 -0.31 0.00 0.00 175.10 173.97 2bgq n ASN 167 N -0.60 -3.33 -4.85 0.00 3.02 -0.63 -4.49 115.26 104.37 2bgq n ASN 167 Ca -0.06 -1.25 -0.23 0.00 -0.03 0.00 0.00 54.58 53.01 2bgq n ASN 167 Cb 0.62 -1.92 -0.04 0.00 -0.61 0.00 0.00 39.78 37.83 2bgq n ASN 167 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2bgq s TYR 168 N -3.67 2.39 0.33 3.10 1.51 -1.26 -4.36 117.35 115.38 2bgq s TYR 168 Ca 0.40 -0.61 0.05 0.00 -1.01 0.00 0.00 57.07 55.90 2bgq s TYR 168 Cb -0.21 -2.05 -0.06 0.00 -0.11 0.00 0.00 41.96 39.53 2bgq s TYR 168 CO 0.96 -0.14 0.01 0.95 -1.11 0.00 0.00 175.55 176.22 2bgq s THR 169 N -2.59 1.49 0.15 -0.71 -4.23 -1.26 -4.99 115.64 103.50 2bgq s THR 169 Ca 0.43 -2.04 -0.14 0.00 -1.18 0.00 0.00 61.69 58.76 2bgq s THR 169 Cb -0.01 -2.72 0.04 0.00 1.34 0.00 0.00 72.50 71.15 2bgq s THR 169 CO 0.25 -0.10 1.73 0.58 -0.54 0.00 0.00 174.62 176.54 2bgq h VAL 170 N 2.11 1.19 -0.20 2.29 2.07 -1.93 0.14 116.25 121.91 2bgq h VAL 170 Ca -0.41 -0.56 0.05 0.00 0.82 0.00 0.00 66.70 66.60 2bgq h VAL 170 Cb 1.24 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 2bgq h VAL 170 CO 0.71 0.22 -0.15 0.74 0.02 0.00 0.00 177.57 179.10 2bgq h THR 171 N 0.66 0.57 -0.43 2.57 2.02 -1.96 0.24 112.91 116.57 2bgq h THR 171 Ca 0.17 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.24 2bgq h THR 171 Cb 0.13 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 2bgq h THR 171 CO -0.02 0.00 -0.16 0.11 0.37 0.00 0.00 175.52 175.82 2bgq h LYS 172 N -0.16 0.81 0.52 6.66 1.57 -1.92 -1.90 116.57 122.15 2bgq h LYS 172 Ca 0.12 -0.30 -0.03 0.00 -1.87 0.00 0.00 60.65 58.58 2bgq h LYS 172 Cb 0.34 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.60 2bgq h LYS 172 CO -0.30 0.91 -0.25 1.25 -0.57 0.00 0.00 179.45 180.50 2bgq h LEU 173 N 0.72 -0.59 -0.67 2.94 5.85 -0.06 0.18 115.31 123.69 2bgq h LEU 173 Ca 0.11 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.94 2bgq h LEU 173 Cb 0.66 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.77 2bgq h LEU 173 CO 0.05 -0.41 0.28 0.78 -0.34 0.00 0.00 178.44 178.80 2bgq h ASN 174 N -0.72 0.30 -0.45 1.25 2.35 -0.48 0.60 115.58 118.43 2bgq h ASN 174 Ca -0.07 0.08 0.04 0.00 -0.55 0.00 0.00 56.30 55.80 2bgq h ASN 174 Cb 0.55 0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.92 2bgq h ASN 174 CO 0.12 0.16 0.21 -0.09 -1.65 0.00 0.00 177.43 176.19 2bgq h ARG 175 N 0.47 0.41 -0.92 0.81 2.43 -1.05 -1.58 114.38 114.95 2bgq h ARG 175 Ca 0.34 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.57 2bgq h ARG 175 Cb 0.42 -0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 29.82 2bgq h ARG 175 CO -0.32 0.27 0.59 1.25 -1.51 0.00 0.00 179.97 180.26 2bgq h LEU 176 N 0.43 0.88 -0.39 3.80 5.85 0.12 -2.54 115.31 123.45 2bgq h LEU 176 Ca 0.20 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.78 2bgq h LEU 176 Cb 0.12 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2bgq h LEU 176 CO -0.15 0.54 -0.73 -0.07 -0.34 0.00 0.00 178.44 177.69 2bgq h LEU 177 N 0.99 0.00 0.00 2.25 3.38 -0.26 -2.40 115.31 119.27 2bgq h LEU 177 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2bgq h LEU 177 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2bgq h LEU 177 CO -0.17 0.73 0.00 -2.11 0.09 0.00 0.00 178.44 176.99 2bgq n ARG 178 N -3.53 0.30 0.00 1.13 1.85 -0.68 -3.02 116.66 112.72 2bgq n ARG 178 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2bgq n ARG 178 Cb 0.75 -1.25 0.00 0.00 -1.05 0.00 0.00 32.46 30.91 2bgq n ARG 178 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2bgq n SER 179 N -0.75 0.00 -4.71 2.89 3.41 -1.21 -5.10 113.62 108.15 2bgq n SER 179 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.23 2bgq n SER 179 Cb 0.02 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 2bgq n SER 179 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bgq s ALA 180 N 0.00 3.61 -0.07 7.33 0.00 -0.91 -4.87 121.76 126.84 2bgq s ALA 180 Ca 0.00 1.09 0.14 0.00 0.00 0.00 0.00 51.96 53.19 2bgq s ALA 180 Cb 0.00 -3.57 -0.14 0.00 0.00 0.00 0.00 23.12 19.41 2bgq s ALA 180 CO 0.00 -0.73 0.95 0.87 0.00 0.00 0.00 175.76 176.85 2bgq h LYS 181 N 7.17 0.00 -4.44 0.00 1.57 -1.91 -3.42 116.57 115.54 2bgq h LYS 181 Ca -0.41 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 57.74 2bgq h LYS 181 Cb 1.20 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 33.13 2bgq h LYS 181 CO 0.88 0.47 -0.78 0.42 -0.57 0.00 0.00 179.45 179.87 2bgq s ILE 182 N -2.82 1.69 0.62 1.86 1.01 -1.26 -5.12 121.20 117.18 2bgq s ILE 182 Ca -0.02 -1.42 -0.19 0.00 0.00 0.00 0.00 60.65 59.03 2bgq s ILE 182 Cb 0.08 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.57 2bgq s ILE 182 CO 0.81 -0.16 1.30 -2.84 0.00 0.00 0.00 174.94 174.04 2bgq s PRO 183 N 1.30 2.73 0.14 2.79 0.02 -1.26 -4.91 135.00 135.81 2bgq s PRO 183 Ca -0.04 2.08 -0.31 0.00 0.02 0.00 0.00 61.00 62.75 2bgq s PRO 183 Cb -0.19 -1.95 -0.09 0.00 0.02 0.00 0.00 34.50 32.30 2bgq s PRO 183 CO -0.07 -1.46 1.43 -1.25 -0.33 0.00 0.00 177.00 175.31 2bgq s PRO 184 N -3.27 4.30 0.19 5.54 0.04 -1.26 -4.88 135.00 135.66 2bgq s PRO 184 Ca 0.80 2.15 0.03 0.00 0.04 0.00 0.00 61.00 64.02 2bgq s PRO 184 Cb -0.37 -3.21 0.10 0.00 0.04 0.00 0.00 34.50 31.05 2bgq s PRO 184 CO 0.41 -0.46 1.45 0.00 0.04 0.00 0.00 177.00 178.44 2bgq h ALA 185 N 6.60 0.66 -3.42 8.56 0.00 -1.57 -3.44 119.26 126.64 2bgq h ALA 185 Ca -0.43 -0.65 -0.29 0.00 0.00 0.00 0.00 54.91 53.55 2bgq h ALA 185 Cb 1.21 -0.08 -0.24 0.00 0.00 0.00 0.00 17.79 18.68 2bgq h ALA 185 CO 0.86 0.84 -0.74 0.08 0.00 0.00 0.00 179.25 180.29 2bgq s VAL 186 N -3.43 0.48 -0.19 0.00 1.01 -1.26 -1.71 120.40 115.30 2bgq s VAL 186 Ca -0.03 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.19 2bgq s VAL 186 Cb 0.11 -0.50 0.04 0.00 0.00 0.00 0.00 36.38 36.03 2bgq s VAL 186 CO 0.81 -0.21 -0.09 0.00 0.00 0.00 0.00 175.10 175.61 2bgq s GLN 188 N 1.46 3.98 0.10 0.00 0.74 0.18 -1.54 119.66 124.58 2bgq s GLN 188 Ca -0.00 -0.29 0.03 0.00 0.05 0.00 0.00 55.36 55.14 2bgq s GLN 188 Cb -0.16 -3.63 -0.04 0.00 1.10 0.00 0.00 33.01 30.28 2bgq s GLN 188 CO -0.08 -0.13 -0.08 -1.64 -0.55 0.00 0.00 175.29 172.81 2bgq s MET 189 N 1.62 0.84 -0.03 1.67 -1.94 0.13 -1.61 119.30 119.98 2bgq s MET 189 Ca 0.08 -1.26 -0.30 0.00 -1.71 0.00 0.00 55.69 52.50 2bgq s MET 189 Cb -0.15 -0.33 -0.05 0.00 2.01 0.00 0.00 34.83 36.30 2bgq s MET 189 CO 0.10 0.02 1.40 -2.00 -0.01 0.00 0.00 175.02 174.53 2bgq s GLU 190 N -3.38 4.27 -0.08 2.03 2.12 -1.26 -0.47 118.70 121.92 2bgq s GLU 190 Ca 0.09 1.94 -0.07 0.00 0.36 0.00 0.00 54.97 57.28 2bgq s GLU 190 Cb 0.02 -3.64 0.02 0.00 0.26 0.00 0.00 34.13 30.78 2bgq s GLU 190 CO -0.03 -0.62 0.21 -1.64 -0.54 0.00 0.00 175.26 172.65 2bgq s MET 191 N 2.71 0.25 0.00 4.30 -1.94 -0.84 -4.74 119.30 119.05 2bgq s MET 191 Ca 0.63 0.30 0.00 0.00 -1.71 0.00 0.00 55.69 54.91 2bgq s MET 191 Cb -0.30 0.12 0.00 0.00 2.01 0.00 0.00 34.83 36.66 2bgq s MET 191 CO 0.25 -0.03 0.00 -2.39 -0.01 0.00 0.00 175.02 172.84 2bgq n HIS 192 N 2.96 0.00 -0.37 -0.03 1.44 0.12 -4.13 115.22 115.21 2bgq n HIS 192 Ca -0.13 0.00 0.30 0.00 -2.01 0.00 0.00 57.72 55.88 2bgq n HIS 192 Cb 0.59 0.00 0.60 0.00 0.12 0.00 0.00 29.99 31.29 2bgq n HIS 192 CO 0.00 0.00 0.00 -1.35 -2.81 0.00 0.00 176.34 172.18 2bgq h PRO 193 N 0.00 0.22 -0.47 -1.40 0.11 -1.86 0.12 132.00 128.72 2bgq h PRO 193 Ca 0.00 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.98 2bgq h PRO 193 Cb 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 2bgq h PRO 193 CO 0.00 0.14 -0.15 0.78 -0.21 0.00 0.00 178.00 178.56 2bgq h GLY 194 N 0.22 1.01 -7.08 -0.55 0.00 -1.87 -3.42 103.07 91.39 2bgq h GLY 194 Ca 0.67 -0.87 -0.51 0.00 0.00 0.00 0.00 47.33 46.63 2bgq h GLY 194 CO -0.28 0.79 -0.76 0.86 0.00 0.00 0.00 176.54 177.14 2bgq s TRP 195 N -4.74 0.66 -0.16 5.60 -0.11 0.42 -1.91 118.94 118.70 2bgq s TRP 195 Ca -0.12 -0.77 0.19 0.00 1.22 0.00 0.00 56.10 56.63 2bgq s TRP 195 Cb 0.12 -0.96 -0.10 0.00 -1.50 0.00 0.00 33.47 31.03 2bgq s TRP 195 CO 0.85 -0.65 0.87 1.63 -4.62 0.00 0.00 176.95 175.03 2bgq n LYS 196 N 5.15 0.62 -4.00 5.86 5.02 -1.16 -0.70 118.16 128.95 2bgq n LYS 196 Ca -0.07 0.15 -0.30 0.00 -2.02 0.00 0.00 58.31 56.07 2bgq n LYS 196 Cb 0.46 -1.79 -0.02 0.00 -0.02 0.00 0.00 35.03 33.66 2bgq n LYS 196 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2bgq n ASN 197 N -2.76 -1.37 -0.23 4.39 2.85 -1.26 -4.83 115.26 112.04 2bgq n ASN 197 Ca -0.06 -1.10 -0.00 0.00 -0.11 0.00 0.00 54.58 53.30 2bgq n ASN 197 Cb 0.71 -2.63 0.11 0.00 1.24 0.00 0.00 39.78 39.22 2bgq n ASN 197 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 2bgq h ASP 198 N -1.94 0.50 -0.15 1.20 3.32 -1.98 -2.42 116.42 114.95 2bgq h ASP 198 Ca -0.65 0.04 0.02 0.00 0.02 0.00 0.00 57.03 56.46 2bgq h ASP 198 Cb 1.38 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.84 2bgq h ASP 198 CO 0.60 0.31 -0.37 0.50 -1.72 0.00 0.00 179.24 178.57 2bgq h LYS 199 N 0.64 -0.34 0.00 3.56 3.64 -1.96 0.80 116.57 122.91 2bgq h LYS 199 Ca 0.32 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.68 2bgq h LYS 199 Cb 0.26 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2bgq h LYS 199 CO -0.22 -0.23 -0.17 0.97 -2.27 0.00 0.00 179.45 177.53 2bgq h ILE 200 N -0.35 1.12 -0.37 2.00 6.09 -1.93 -0.76 117.51 123.32 2bgq h ILE 200 Ca 0.03 -0.60 -0.04 0.00 -1.37 0.00 0.00 64.86 62.88 2bgq h ILE 200 Cb 0.44 1.32 -0.01 0.00 0.47 0.00 0.00 36.82 39.04 2bgq h ILE 200 CO -0.33 0.17 0.06 0.15 -3.07 0.00 0.00 178.15 175.13 2bgq h PHE 201 N 0.00 0.65 -0.72 2.19 3.57 -0.71 -0.34 116.94 121.58 2bgq h PHE 201 Ca -0.00 -0.09 -0.06 0.00 3.53 0.00 0.00 57.97 61.34 2bgq h PHE 201 Cb 0.31 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.84 2bgq h PHE 201 CO 0.00 0.66 0.20 0.93 -2.23 0.00 0.00 178.31 177.87 2bgq h GLU 202 N 0.45 1.13 -0.64 1.11 4.39 0.14 0.10 114.58 121.25 2bgq h GLU 202 Ca 0.11 -0.25 -0.04 0.00 0.34 0.00 0.00 59.36 59.52 2bgq h GLU 202 Cb 0.36 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.83 2bgq h GLU 202 CO 0.01 0.97 0.25 0.00 -1.16 0.00 0.00 179.01 179.08 2bgq h ALA 203 N 1.14 0.83 -0.50 3.43 0.00 -0.89 -2.11 119.26 121.16 2bgq h ALA 203 Ca 0.23 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2bgq h ALA 203 Cb 0.33 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2bgq h ALA 203 CO -0.00 0.45 0.13 0.00 0.00 0.00 0.00 179.25 179.83 2bgq h LYS 205 N 0.69 -0.39 -0.77 0.00 1.57 -0.46 0.12 116.57 117.32 2bgq h LYS 205 Ca 0.16 0.03 0.05 0.00 -1.87 0.00 0.00 60.65 59.02 2bgq h LYS 205 Cb 0.32 0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.67 2bgq h LYS 205 CO 0.00 -0.26 0.51 1.57 -0.57 0.00 0.00 179.45 180.70 2bgq h LYS 206 N -0.40 0.85 -0.17 3.15 2.10 -1.36 -1.73 116.57 119.01 2bgq h LYS 206 Ca 0.06 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 2bgq h LYS 206 Cb 0.49 -0.19 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 2bgq h LYS 206 CO -0.24 0.57 0.00 0.72 -2.00 0.00 0.00 179.45 178.50 2bgq n HIS 207 N -4.47 0.21 -1.30 0.07 8.25 -0.98 -4.92 115.22 112.08 2bgq n HIS 207 Ca 0.11 -0.11 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 2bgq n HIS 207 Cb 0.18 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.24 2bgq n HIS 207 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bgq n GLY 208 N 1.07 1.17 3.65 -1.41 0.00 -0.59 -4.98 105.19 104.10 2bgq n GLY 208 Ca 0.15 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 2bgq n GLY 208 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bgq s ILE 209 N -2.33 4.88 0.61 -0.61 1.01 -0.07 -4.76 121.20 119.92 2bgq s ILE 209 Ca 0.00 1.51 -0.18 0.00 0.00 0.00 0.00 60.65 61.98 2bgq s ILE 209 Cb 0.00 -4.09 -0.03 0.00 0.01 0.00 0.00 42.46 38.35 2bgq s ILE 209 CO 0.00 -0.01 1.17 -2.28 0.00 0.00 0.00 174.94 173.82 2bgq s HIS 210 N 2.49 2.45 -0.08 3.97 5.65 -0.69 -4.35 115.29 124.73 2bgq s HIS 210 Ca 0.34 1.54 0.05 0.00 0.25 0.00 0.00 55.06 57.24 2bgq s HIS 210 Cb -0.16 -3.39 -0.00 0.00 -1.18 0.00 0.00 32.58 27.85 2bgq s HIS 210 CO 0.09 -2.03 -0.23 -1.50 -0.65 0.00 0.00 174.74 170.42 2bgq s ILE 211 N -1.80 1.99 -0.16 0.89 1.10 -1.26 -0.90 121.20 121.06 2bgq s ILE 211 Ca 0.74 -0.99 -0.03 0.00 -0.51 0.00 0.00 60.65 59.86 2bgq s ILE 211 Cb -0.27 -1.71 -0.02 0.00 0.15 0.00 0.00 42.46 40.61 2bgq s ILE 211 CO 0.34 0.55 -0.07 -0.89 -2.11 0.00 0.00 174.94 172.76 2bgq s THR 212 N 0.19 3.54 -0.13 4.00 2.01 -0.59 -1.98 115.64 122.68 2bgq s THR 212 Ca -0.14 -0.48 -0.12 0.00 0.31 0.00 0.00 61.69 61.27 2bgq s THR 212 Cb -0.16 -2.54 -0.05 0.00 0.01 0.00 0.00 72.50 69.76 2bgq s THR 212 CO 0.07 0.49 0.26 0.00 -0.69 0.00 0.00 174.62 174.75 2bgq s ALA 213 N 0.55 3.68 0.31 7.40 0.00 -0.59 -0.69 121.76 132.42 2bgq s ALA 213 Ca -0.05 -0.49 0.11 0.00 0.00 0.00 0.00 51.96 51.53 2bgq s ALA 213 Cb -0.15 -2.28 -0.06 0.00 0.00 0.00 0.00 23.12 20.64 2bgq s ALA 213 CO 0.03 0.26 -0.12 1.52 0.00 0.00 0.00 175.76 177.44 2bgq s TYR 214 N -0.06 2.39 -1.19 0.00 -0.85 0.37 -2.38 117.35 115.63 2bgq s TYR 214 Ca 0.16 -0.40 -0.01 0.00 -0.52 0.00 0.00 57.07 56.30 2bgq s TYR 214 Cb -0.13 -1.20 -0.01 0.00 0.38 0.00 0.00 41.96 41.00 2bgq s TYR 214 CO 0.04 0.64 0.96 0.43 -1.52 0.00 0.00 175.55 176.10 2bgq n SER 215 N -0.74 -2.66 -0.17 -0.18 7.64 -1.26 -1.98 113.62 114.27 2bgq n SER 215 Ca -0.05 -0.66 0.15 0.00 1.01 0.00 0.00 58.87 59.33 2bgq n SER 215 Cb 0.61 -5.02 0.50 0.00 -1.01 0.00 0.00 64.21 59.30 2bgq n SER 215 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2bgq h PRO 216 N -1.78 0.41 -0.21 1.43 0.11 -1.85 -0.99 132.00 129.12 2bgq h PRO 216 Ca -0.60 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.49 2bgq h PRO 216 Cb 1.34 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2bgq h PRO 216 CO 0.50 0.27 0.00 1.28 -0.21 0.00 0.00 178.00 179.84 2bgq n LEU 217 N -4.48 1.77 0.00 2.35 4.77 -1.26 -4.75 117.00 115.40 2bgq n LEU 217 Ca 0.15 -0.77 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 2bgq n LEU 217 Cb 0.53 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2bgq n LEU 217 CO 0.33 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 2bgq n GLY 218 N 1.13 0.70 3.86 -0.72 0.00 -0.38 -0.58 105.19 109.21 2bgq n GLY 218 Ca 0.15 -1.11 -0.24 0.00 0.00 0.00 0.00 46.02 44.82 2bgq n GLY 218 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bgq n LYS 222 N 5.01 -3.93 -2.82 1.61 5.02 -1.26 -4.90 118.16 116.89 2bgq n LYS 222 Ca 0.00 0.49 -0.43 0.00 -2.02 0.00 0.00 58.31 56.35 2bgq n LYS 222 Cb 0.00 -4.79 -0.04 0.00 -0.02 0.00 0.00 35.03 30.18 2bgq n LYS 222 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2bgq s ASN 223 N -4.33 6.33 0.48 4.39 3.04 -1.26 -4.89 114.94 118.69 2bgq s ASN 223 Ca 0.03 -0.36 0.19 0.00 0.04 0.00 0.00 52.86 52.75 2bgq s ASN 223 Cb -0.01 -2.44 1.19 0.00 -1.54 0.00 0.00 41.25 38.44 2bgq s ASN 223 CO 0.86 -1.26 2.04 -0.07 -3.04 0.00 0.00 177.10 175.63 2bgq h LEU 224 N 11.06 0.00 -1.11 3.21 3.38 -1.20 -1.77 115.31 128.88 2bgq h LEU 224 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2bgq h LEU 224 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2bgq h LEU 224 CO 1.10 0.15 0.00 0.00 0.09 0.00 0.00 178.44 179.78 2bgq n ALA 225 N -2.44 1.16 0.11 1.53 0.00 -1.26 -0.94 120.51 118.68 2bgq n ALA 225 Ca -0.02 0.15 0.03 0.00 0.00 0.00 0.00 53.44 53.60 2bgq n ALA 225 Cb 0.22 -1.29 0.06 0.00 0.00 0.00 0.00 19.45 18.44 2bgq n ALA 225 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2bgq n HIS 226 N -2.15 0.12 -2.58 0.00 8.25 -0.67 -4.78 115.22 113.41 2bgq n HIS 226 Ca -0.01 -0.22 -0.43 0.00 -0.26 0.00 0.00 57.72 56.81 2bgq n HIS 226 Cb 0.07 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.14 2bgq n HIS 226 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2bgq s ASP 227 N -0.75 7.08 0.47 0.41 -1.08 -0.11 -4.91 116.67 117.78 2bgq s ASP 227 Ca 0.10 1.54 0.27 0.00 -0.52 0.00 0.00 52.55 53.94 2bgq s ASP 227 Cb 0.06 -2.54 1.32 0.00 -1.46 0.00 0.00 42.92 40.30 2bgq s ASP 227 CO 0.09 -0.64 1.78 1.55 0.52 0.00 0.00 175.17 178.47 2bgq h PRO 228 N 7.58 0.19 -0.26 4.34 0.13 -1.93 0.70 132.00 142.75 2bgq h PRO 228 Ca -0.25 -0.01 0.03 0.00 -0.87 0.00 0.00 66.00 64.90 2bgq h PRO 228 Cb 1.10 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 2bgq h PRO 228 CO 0.94 0.13 0.08 0.28 -0.23 0.00 0.00 178.00 179.21 2bgq h VAL 229 N 0.20 0.93 -0.28 1.56 2.07 -1.92 0.14 116.25 118.95 2bgq h VAL 229 Ca 0.59 -0.07 -0.10 0.00 0.82 0.00 0.00 66.70 67.94 2bgq h VAL 229 Cb 1.89 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 2bgq h VAL 229 CO -0.17 0.04 -0.22 0.58 0.02 0.00 0.00 177.57 177.82 2bgq h VAL 230 N 0.20 1.30 -0.68 2.57 2.07 -1.16 -3.02 116.25 117.53 2bgq h VAL 230 Ca 0.11 -1.36 0.07 0.00 0.82 0.00 0.00 66.70 66.34 2bgq h VAL 230 Cb 0.09 1.57 -0.06 0.00 -1.52 0.00 0.00 31.29 31.37 2bgq h VAL 230 CO -0.12 0.43 0.37 -0.33 0.02 0.00 0.00 177.57 177.94 2bgq h GLU 231 N 0.37 0.65 -0.73 1.57 5.08 -0.92 0.88 114.58 121.46 2bgq h GLU 231 Ca 0.05 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2bgq h GLU 231 Cb 0.77 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 2bgq h GLU 231 CO 0.06 0.43 0.38 -0.22 -1.00 0.00 0.00 179.01 178.65 2bgq h LYS 232 N 0.67 1.03 -0.30 2.33 3.64 -0.67 0.97 116.57 124.23 2bgq h LYS 232 Ca 0.31 -0.13 -0.16 0.00 -1.27 0.00 0.00 60.65 59.40 2bgq h LYS 232 Cb 0.23 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2bgq h LYS 232 CO -0.20 0.78 -0.46 0.28 -2.27 0.00 0.00 179.45 177.58 2bgq h VAL 233 N 1.03 1.29 -0.48 2.00 2.07 -1.20 -2.50 116.25 118.45 2bgq h VAL 233 Ca 0.26 -1.65 -0.08 0.00 0.82 0.00 0.00 66.70 66.05 2bgq h VAL 233 Cb 0.07 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 2bgq h VAL 233 CO -0.04 0.54 -0.03 0.00 0.02 0.00 0.00 177.57 178.05 2bgq h ALA 234 N 0.84 1.03 -0.41 1.67 0.00 -0.17 -1.64 119.26 120.59 2bgq h ALA 234 Ca 0.04 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2bgq h ALA 234 Cb 1.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2bgq h ALA 234 CO 0.10 0.60 0.00 -0.91 0.00 0.00 0.00 179.25 179.04 2bgq h ASN 235 N 0.77 0.71 -0.51 0.00 2.35 -0.73 0.45 115.58 118.62 2bgq h ASN 235 Ca 0.14 -0.31 -0.02 0.00 -0.55 0.00 0.00 56.30 55.56 2bgq h ASN 235 Cb 0.51 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.67 2bgq h ASN 235 CO 0.03 0.85 0.22 0.11 -1.65 0.00 0.00 177.43 176.98 2bgq h LYS 236 N 0.56 0.74 0.00 0.81 1.57 -1.28 -2.31 116.57 116.66 2bgq h LYS 236 Ca 0.12 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2bgq h LYS 236 Cb 0.48 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2bgq h LYS 236 CO 0.02 0.64 -0.07 1.28 -0.57 0.00 0.00 179.45 180.75 2bgq n LEU 237 N -4.57 0.74 -3.34 2.94 4.77 -0.63 -4.94 117.00 111.97 2bgq n LEU 237 Ca 0.02 0.53 -0.17 0.00 -0.03 0.00 0.00 56.01 56.36 2bgq n LEU 237 Cb 0.14 -0.32 0.09 0.00 -2.33 0.00 0.00 43.42 41.00 2bgq n LEU 237 CO 0.38 -0.15 0.11 -3.20 -1.33 0.00 0.00 177.39 173.19 2bgq n ASN 238 N -2.18 -2.15 -4.35 -1.43 5.15 0.14 -5.03 115.26 105.41 2bgq n ASN 238 Ca 0.05 -0.60 -0.18 0.00 -0.60 0.00 0.00 54.58 53.26 2bgq n ASN 238 Cb 0.42 -4.96 -0.10 0.00 -0.53 0.00 0.00 39.78 34.61 2bgq n ASN 238 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2bgq s LYS 239 N -5.33 1.46 0.44 1.20 -0.14 -0.10 -5.03 119.74 112.24 2bgq s LYS 239 Ca 0.01 -1.79 -0.12 0.00 -1.36 0.00 0.00 55.97 52.71 2bgq s LYS 239 Cb -0.01 -0.43 -0.07 0.00 -1.68 0.00 0.00 37.83 35.65 2bgq s LYS 239 CO 0.70 -0.25 0.84 0.95 -0.76 0.00 0.00 175.35 176.83 2bgq s THR 240 N -3.62 4.70 0.29 2.17 -4.23 -1.26 -4.38 115.64 109.31 2bgq s THR 240 Ca 0.37 0.81 0.03 0.00 -1.18 0.00 0.00 61.69 61.72 2bgq s THR 240 Cb 0.08 -3.73 0.28 0.00 1.34 0.00 0.00 72.50 70.48 2bgq s THR 240 CO 0.14 -0.57 1.78 -0.65 -0.54 0.00 0.00 174.62 174.78 2bgq h PRO 241 N 1.17 0.75 -0.63 3.99 0.11 -1.89 -1.12 132.00 134.38 2bgq h PRO 241 Ca -0.47 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2bgq h PRO 241 Cb 1.19 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 2bgq h PRO 241 CO 0.63 0.50 0.37 0.78 -0.21 0.00 0.00 178.00 180.07 2bgq h GLY 242 N 0.78 0.93 1.04 -0.55 0.00 -1.92 -0.20 103.07 103.15 2bgq h GLY 242 Ca 0.54 -0.40 -0.06 0.00 0.00 0.00 0.00 47.33 47.40 2bgq h GLY 242 CO -0.36 0.39 0.16 1.46 0.00 0.00 0.00 176.54 178.19 2bgq h GLN 243 N 0.86 1.05 -0.01 4.80 4.20 -1.58 -0.31 115.11 124.12 2bgq h GLN 243 Ca 0.23 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 2bgq h GLN 243 Cb -0.00 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.64 2bgq h GLN 243 CO -0.04 0.94 0.01 0.28 -0.67 0.00 0.00 178.83 179.35 2bgq h VAL 244 N 0.98 1.03 -0.66 -0.54 2.07 -1.02 0.29 116.25 118.39 2bgq h VAL 244 Ca 0.21 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.68 2bgq h VAL 244 Cb 0.37 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 2bgq h VAL 244 CO 0.00 0.02 0.44 -0.07 0.02 0.00 0.00 177.57 177.98 2bgq h LEU 245 N -0.02 0.67 0.03 2.57 3.38 -0.82 0.32 115.31 121.45 2bgq h LEU 245 Ca 0.00 -0.01 -0.27 0.00 0.09 0.00 0.00 57.88 57.69 2bgq h LEU 245 Cb 0.03 -0.15 0.02 0.00 0.09 0.00 0.00 40.66 40.65 2bgq h LEU 245 CO -0.00 0.46 -1.15 0.40 0.09 0.00 0.00 178.44 178.24 2bgq h ILE 246 N 0.78 1.34 -0.04 1.22 2.04 -0.66 -3.02 117.51 119.16 2bgq h ILE 246 Ca 0.27 -2.52 -0.09 0.00 1.00 0.00 0.00 64.86 63.51 2bgq h ILE 246 Cb 0.09 2.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 2bgq h ILE 246 CO -0.08 0.76 -0.38 0.50 0.00 0.00 0.00 178.15 178.95 2bgq h LYS 247 N 0.25 0.08 -0.45 2.37 1.63 0.18 -2.53 116.57 118.10 2bgq h LYS 247 Ca -0.15 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.62 2bgq h LYS 247 Cb 1.82 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 33.42 2bgq h LYS 247 CO 0.21 0.46 0.29 2.35 -3.45 0.00 0.00 179.45 179.31 2bgq h TRP 248 N 0.07 0.57 -0.34 1.91 7.01 -0.31 -0.30 115.95 124.55 2bgq h TRP 248 Ca 0.01 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.02 2bgq h TRP 248 Cb 0.71 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.56 2bgq h TRP 248 CO 0.00 0.37 0.23 0.00 -2.79 0.00 0.00 178.44 176.25 2bgq h ALA 249 N 1.15 0.44 -0.42 2.65 0.00 -1.34 -1.95 119.26 119.79 2bgq h ALA 249 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2bgq h ALA 249 Cb -0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2bgq h ALA 249 CO -0.03 -0.10 0.27 -0.07 0.00 0.00 0.00 179.25 179.32 2bgq h LEU 250 N 0.47 0.48 -0.30 0.00 3.38 -1.08 -0.92 115.31 117.34 2bgq h LEU 250 Ca 0.13 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2bgq h LEU 250 Cb -0.05 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2bgq h LEU 250 CO -0.03 0.36 0.00 0.00 0.09 0.00 0.00 178.44 178.86 2bgq n GLN 251 N -4.79 0.08 0.07 1.13 6.02 -0.16 -0.42 117.38 119.31 2bgq n GLN 251 Ca 0.01 0.33 0.12 0.00 -0.01 0.00 0.00 57.00 57.45 2bgq n GLN 251 Cb 0.03 -1.65 0.15 0.00 1.02 0.00 0.00 30.24 29.79 2bgq n GLN 251 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2bgq h ARG 252 N 0.00 0.00 0.00 -1.09 2.43 -0.38 -3.43 114.38 111.91 2bgq h ARG 252 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2bgq h ARG 252 Cb 0.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 2bgq h ARG 252 CO 0.00 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.87 2bgq n GLY 253 N 1.31 1.17 3.39 2.80 0.00 0.44 -5.09 105.19 109.22 2bgq n GLY 253 Ca 0.03 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 2bgq n GLY 253 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bgq s THR 254 N -2.00 2.11 0.81 2.61 -4.23 -0.94 -4.77 115.64 109.23 2bgq s THR 254 Ca 0.00 -2.04 -0.12 0.00 -1.18 0.00 0.00 61.69 58.35 2bgq s THR 254 Cb 0.00 -2.02 0.08 0.00 1.34 0.00 0.00 72.50 71.90 2bgq s THR 254 CO 0.00 -0.26 1.12 -0.94 -0.54 0.00 0.00 174.62 174.00 2bgq s SER 255 N -2.81 4.44 -0.07 3.99 1.04 -0.84 -3.91 113.70 115.54 2bgq s SER 255 Ca 0.20 1.10 -0.07 0.00 0.48 0.00 0.00 55.95 57.66 2bgq s SER 255 Cb -0.06 -1.76 0.02 0.00 0.10 0.00 0.00 66.02 64.31 2bgq s SER 255 CO 0.09 -1.98 0.20 0.54 0.98 0.00 0.00 173.24 173.07 2bgq s VAL 256 N -3.30 0.00 -0.52 5.02 0.11 0.60 -1.54 120.40 120.77 2bgq s VAL 256 Ca 0.61 -0.02 0.04 0.00 -2.93 0.00 0.00 61.98 59.67 2bgq s VAL 256 Cb -0.13 -0.29 0.14 0.00 -1.53 0.00 0.00 36.38 34.57 2bgq s VAL 256 CO 0.53 -0.01 0.29 0.27 -3.33 0.00 0.00 175.10 172.84 2bgq s ILE 257 N 0.05 2.28 0.11 7.04 -4.36 -1.00 -1.76 121.20 123.56 2bgq s ILE 257 Ca -0.01 -3.25 -0.30 0.00 -0.26 0.00 0.00 60.65 56.83 2bgq s ILE 257 Cb -0.02 -2.57 -0.06 0.00 1.25 0.00 0.00 42.46 41.06 2bgq s ILE 257 CO 0.00 -0.86 1.13 -2.16 0.24 0.00 0.00 174.94 173.30 2bgq s PRO 258 N -0.28 4.52 -0.26 0.37 0.04 -1.22 -4.34 135.00 133.82 2bgq s PRO 258 Ca 0.19 1.72 -0.18 0.00 0.04 0.00 0.00 61.00 62.77 2bgq s PRO 258 Cb -0.22 -3.32 -0.03 0.00 0.04 0.00 0.00 34.50 30.97 2bgq s PRO 258 CO -0.03 -0.08 0.50 0.15 0.04 0.00 0.00 177.00 177.59 2bgq s LYS 259 N 0.35 4.06 -0.04 4.56 1.02 -1.26 -2.79 119.74 125.64 2bgq s LYS 259 Ca 0.54 0.30 -0.18 0.00 0.02 0.00 0.00 55.97 56.64 2bgq s LYS 259 Cb -0.29 -3.65 0.04 0.00 -0.52 0.00 0.00 37.83 33.41 2bgq s LYS 259 CO 0.32 -0.35 0.40 0.45 -0.92 0.00 0.00 175.35 175.26 2bgq s SER 260 N 1.55 -0.33 0.00 2.83 0.15 -1.26 -5.04 113.70 111.60 2bgq s SER 260 Ca 0.21 0.33 0.08 0.00 0.70 0.00 0.00 55.95 57.28 2bgq s SER 260 Cb -0.16 0.45 0.02 0.00 -1.71 0.00 0.00 66.02 64.61 2bgq s SER 260 CO 0.09 -0.44 0.62 -1.20 1.20 0.00 0.00 173.24 173.52 2bgq n SER 261 N 1.44 1.25 -4.60 5.45 7.64 -1.26 -4.93 113.62 118.61 2bgq n SER 261 Ca -0.20 -1.12 -0.34 0.00 1.01 0.00 0.00 58.87 58.21 2bgq n SER 261 Cb 0.56 0.35 -0.10 0.00 -1.01 0.00 0.00 64.21 64.01 2bgq n SER 261 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2bgq s LYS 262 N -1.08 3.71 0.37 1.43 1.02 -1.26 -5.00 119.74 118.92 2bgq s LYS 262 Ca 0.08 -0.41 0.08 0.00 0.02 0.00 0.00 55.97 55.74 2bgq s LYS 262 Cb 0.07 -3.05 0.80 0.00 -0.52 0.00 0.00 37.83 35.13 2bgq s LYS 262 CO 0.18 0.34 1.93 -0.44 -0.92 0.00 0.00 175.35 176.44 2bgq h ASP 263 N 6.41 0.63 -0.07 2.83 3.45 -1.97 -0.16 116.42 127.54 2bgq h ASP 263 Ca -0.37 0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.09 2bgq h ASP 263 Cb 1.18 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 39.83 2bgq h ASP 263 CO 0.65 0.37 0.00 -0.08 -1.57 0.00 0.00 179.24 178.62 2bgq h GLU 264 N 0.70 0.13 -0.56 3.56 4.81 -1.98 0.26 114.58 121.49 2bgq h GLU 264 Ca 0.36 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.52 2bgq h GLU 264 Cb 0.46 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 2bgq h GLU 264 CO -0.13 0.39 0.25 0.00 -0.73 0.00 0.00 179.01 178.78 2bgq h ARG 265 N -0.15 0.83 -0.90 1.92 3.08 -1.88 -0.06 114.38 117.21 2bgq h ARG 265 Ca 0.02 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 59.96 2bgq h ARG 265 Cb 0.33 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 2bgq h ARG 265 CO 0.00 0.70 0.59 0.82 -1.07 0.00 0.00 179.97 181.01 2bgq h ILE 266 N 0.76 1.18 -0.35 2.04 2.04 -0.90 0.34 117.51 122.63 2bgq h ILE 266 Ca 0.19 -0.40 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 2bgq h ILE 266 Cb 0.16 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.15 2bgq h ILE 266 CO -0.02 0.21 0.01 0.50 0.00 0.00 0.00 178.15 178.85 2bgq h LYS 267 N 1.16 0.61 -0.46 2.37 3.64 0.00 -3.12 116.57 120.77 2bgq h LYS 267 Ca 0.35 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2bgq h LYS 267 Cb -0.05 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 2bgq h LYS 267 CO -0.10 0.72 0.24 0.93 -2.27 0.00 0.00 179.45 178.97 2bgq h GLU 268 N 0.42 0.66 -0.24 1.90 5.08 -0.28 -3.03 114.58 119.09 2bgq h GLU 268 Ca 0.10 -0.09 0.07 0.00 -1.00 0.00 0.00 59.36 58.45 2bgq h GLU 268 Cb 0.44 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2bgq h GLU 268 CO 0.02 0.54 0.30 -0.91 -1.00 0.00 0.00 179.01 177.96 2bgq h ASN 269 N 0.61 0.00 0.02 1.42 2.35 -0.28 0.02 115.58 119.71 2bgq h ASN 269 Ca 0.16 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2bgq h ASN 269 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2bgq h ASN 269 CO -0.02 0.00 -0.67 0.00 -1.65 0.00 0.00 177.43 175.09 2bgq n ILE 270 N -3.64 0.00 -1.41 2.81 3.06 -1.15 -4.47 119.36 114.56 2bgq n ILE 270 Ca 0.03 -0.15 -0.30 0.00 -2.50 0.00 0.00 62.75 59.83 2bgq n ILE 270 Cb 0.44 1.10 -0.07 0.00 0.54 0.00 0.00 39.64 41.65 2bgq n ILE 270 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2bgq n GLN 271 N -0.64 3.24 -0.46 9.51 1.13 -0.01 -4.44 117.38 125.70 2bgq n GLN 271 Ca 0.07 -2.19 0.05 0.00 -1.94 0.00 0.00 57.00 53.00 2bgq n GLN 271 Cb 0.41 -2.44 0.19 0.00 0.11 0.00 0.00 30.24 28.51 2bgq n GLN 271 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 2bgq n VAL 272 N 2.42 2.20 -4.42 5.09 0.24 -1.26 -5.01 118.33 117.60 2bgq n VAL 272 Ca 0.61 -2.64 -0.27 0.00 -2.04 0.00 0.00 64.34 60.00 2bgq n VAL 272 Cb 0.47 -0.26 -0.11 0.00 -1.47 0.00 0.00 33.84 32.47 2bgq n VAL 272 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2bgq s PHE 273 N -3.07 2.33 0.00 6.34 0.08 -1.26 -4.67 117.98 117.72 2bgq s PHE 273 Ca 0.38 -0.34 0.00 0.00 0.12 0.00 0.00 56.93 57.09 2bgq s PHE 273 Cb 0.35 -1.14 0.00 0.00 -0.57 0.00 0.00 43.02 41.66 2bgq s PHE 273 CO -0.00 0.52 0.00 0.41 -0.10 0.00 0.00 175.22 176.05 2bgq n GLY 274 N 0.15 0.61 3.70 4.36 0.00 -1.26 -5.02 105.19 107.73 2bgq n GLY 274 Ca -0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 2bgq n GLY 274 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2bgq s TRP 275 N -2.42 0.24 0.33 1.61 1.48 -1.26 -5.19 118.94 113.72 2bgq s TRP 275 Ca 0.00 -0.67 -0.13 0.00 -1.06 0.00 0.00 56.10 54.24 2bgq s TRP 275 Cb 0.00 0.43 0.02 0.00 -1.16 0.00 0.00 33.47 32.76 2bgq s TRP 275 CO 0.00 -1.19 0.63 -1.83 -4.06 0.00 0.00 176.95 170.50 2bgq s GLU 276 N -3.57 1.93 -0.29 3.25 -1.05 -1.26 -4.94 118.70 112.77 2bgq s GLU 276 Ca 0.19 -1.40 -0.13 0.00 -0.15 0.00 0.00 54.97 53.48 2bgq s GLU 276 Cb -0.03 0.54 -0.04 0.00 -0.44 0.00 0.00 34.13 34.17 2bgq s GLU 276 CO 0.10 -0.86 0.28 0.42 0.95 0.00 0.00 175.26 176.15 2bgq s ILE 277 N -3.15 5.25 0.38 1.83 1.01 -1.26 -5.05 121.20 120.20 2bgq s ILE 277 Ca 0.20 0.25 -0.25 0.00 0.00 0.00 0.00 60.65 60.85 2bgq s ILE 277 Cb -0.03 -3.64 -0.12 0.00 0.01 0.00 0.00 42.46 38.68 2bgq s ILE 277 CO 0.12 0.15 1.00 -2.65 0.00 0.00 0.00 174.94 173.57 2bgq n PRO 278 N 5.19 1.36 -0.33 2.79 -0.02 -1.26 -4.60 135.00 138.14 2bgq n PRO 278 Ca -0.11 0.48 0.22 0.00 -2.02 0.00 0.00 63.50 62.07 2bgq n PRO 278 Cb 0.51 -1.98 0.49 0.00 -0.02 0.00 0.00 33.50 32.50 2bgq n PRO 278 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2bgq h GLU 279 N 1.68 0.42 0.94 -0.52 4.81 -1.98 -0.68 114.58 119.25 2bgq h GLU 279 Ca -0.43 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 58.73 2bgq h GLU 279 Cb 1.34 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 30.63 2bgq h GLU 279 CO 0.58 0.27 -0.48 1.05 -0.73 0.00 0.00 179.01 179.70 2bgq h GLU 280 N 0.43 -1.26 -0.70 1.92 4.11 -1.99 0.69 114.58 117.78 2bgq h GLU 280 Ca 0.61 0.09 0.09 0.00 0.07 0.00 0.00 59.36 60.22 2bgq h GLU 280 Cb 1.46 0.29 -0.07 0.00 0.50 0.00 0.00 28.75 30.93 2bgq h GLU 280 CO -0.33 -0.84 0.34 -0.44 0.07 0.00 0.00 179.01 177.81 2bgq h ASP 281 N -1.30 0.43 -0.63 3.06 3.32 -1.66 0.86 116.42 120.49 2bgq h ASP 281 Ca -0.13 0.06 0.01 0.00 0.02 0.00 0.00 57.03 56.99 2bgq h ASP 281 Cb 1.01 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.52 2bgq h ASP 281 CO 0.19 0.24 0.42 0.15 -1.72 0.00 0.00 179.24 178.52 2bgq h PHE 282 N 0.57 0.79 -0.66 4.55 3.57 -1.03 -0.64 116.94 124.09 2bgq h PHE 282 Ca 0.35 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.82 2bgq h PHE 282 Cb 0.38 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 2bgq h PHE 282 CO -0.12 0.49 0.21 0.87 -2.23 0.00 0.00 178.31 177.54 2bgq h LYS 283 N 0.85 1.01 0.18 1.11 1.79 0.15 -2.34 116.57 119.32 2bgq h LYS 283 Ca 0.23 -0.21 -0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2bgq h LYS 283 Cb -0.08 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.41 2bgq h LYS 283 CO -0.05 0.88 -0.20 0.28 -1.08 0.00 0.00 179.45 179.28 2bgq h VAL 284 N 0.95 0.00 -1.01 0.50 2.07 0.38 -1.07 116.25 118.07 2bgq h VAL 284 Ca 0.21 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.96 2bgq h VAL 284 Cb 0.28 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.95 2bgq h VAL 284 CO -0.01 0.00 0.63 -0.07 0.02 0.00 0.00 177.57 178.14 2bgq h LEU 285 N -0.39 0.61 -0.78 2.57 3.38 -1.36 0.41 115.31 119.76 2bgq h LEU 285 Ca -0.02 0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 2bgq h LEU 285 Cb 0.34 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 2bgq h LEU 285 CO -0.03 0.16 -0.59 0.00 0.09 0.00 0.00 178.44 178.07 2bgq n SER 287 N -3.85 1.45 -4.60 0.00 7.64 0.13 -4.76 113.62 109.62 2bgq n SER 287 Ca -0.02 -2.11 -0.42 0.00 1.01 0.00 0.00 58.87 57.34 2bgq n SER 287 Cb 0.59 -0.43 -0.06 0.00 -1.01 0.00 0.00 64.21 63.31 2bgq n SER 287 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2bgq s ILE 288 N -1.39 4.85 0.18 0.44 1.01 -1.19 -5.00 121.20 120.11 2bgq s ILE 288 Ca 0.08 1.00 -0.33 0.00 0.00 0.00 0.00 60.65 61.40 2bgq s ILE 288 Cb 0.06 -4.09 -0.15 0.00 0.01 0.00 0.00 42.46 38.29 2bgq s ILE 288 CO 0.03 -0.22 1.25 1.17 0.00 0.00 0.00 174.94 177.17 2bgq n LYS 289 N 6.08 1.42 -2.00 2.79 4.81 -1.26 -4.74 118.16 125.26 2bgq n LYS 289 Ca 0.01 0.51 -0.35 0.00 -0.87 0.00 0.00 58.31 57.62 2bgq n LYS 289 Cb 0.48 -2.06 -0.04 0.00 0.02 0.00 0.00 35.03 33.43 2bgq n LYS 289 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2bgq s ASP 290 N 0.14 5.15 0.00 3.14 1.11 -1.25 -4.54 116.67 120.41 2bgq s ASP 290 Ca 0.73 0.10 0.00 0.00 0.18 0.00 0.00 52.55 53.56 2bgq s ASP 290 Cb -0.80 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 40.65 2bgq s ASP 290 CO 0.51 -2.55 0.66 -0.62 1.18 0.00 0.00 175.17 174.35 2bgq n GLU 291 N 9.08 0.00 -2.31 8.23 1.02 -0.80 -4.95 120.64 130.91 2bgq n GLU 291 Ca 0.27 -0.39 -0.23 0.00 -0.02 0.00 0.00 57.16 56.79 2bgq n GLU 291 Cb 0.51 -0.21 0.01 0.00 -0.02 0.00 0.00 31.44 31.73 2bgq n GLU 291 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2bgq n LYS 292 N 0.00 3.25 -2.60 3.49 5.02 -1.10 -5.04 118.16 121.17 2bgq n LYS 292 Ca 0.00 -4.20 -0.43 0.00 -2.02 0.00 0.00 58.31 51.66 2bgq n LYS 292 Cb 0.57 -2.15 -0.02 0.00 -0.02 0.00 0.00 35.03 33.41 2bgq n LYS 292 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2bgq s ARG 293 N -3.56 3.78 -0.03 1.97 3.52 -1.26 -4.39 118.95 118.98 2bgq s ARG 293 Ca 0.47 0.66 -0.25 0.00 -0.13 0.00 0.00 55.73 56.47 2bgq s ARG 293 Cb 0.40 -3.88 -0.21 0.00 -1.56 0.00 0.00 34.95 29.71 2bgq s ARG 293 CO -0.06 -1.31 1.17 0.28 -0.81 0.00 0.00 175.30 174.57 2bgq h VAL 294 N 6.16 1.46 -3.45 7.11 2.07 -1.96 -3.40 116.25 124.24 2bgq h VAL 294 Ca -0.23 -1.49 -0.77 0.00 0.82 0.00 0.00 66.70 65.03 2bgq h VAL 294 Cb 1.06 2.38 -0.25 0.00 -1.52 0.00 0.00 31.29 32.97 2bgq h VAL 294 CO 1.11 0.40 -0.02 -0.76 0.02 0.00 0.00 177.57 178.33 2bgq s LEU 295 N -8.93 6.43 0.26 2.57 1.43 -1.26 -4.87 118.68 114.31 2bgq s LEU 295 Ca -0.16 -2.25 0.14 0.00 -1.03 0.00 0.00 54.13 50.83 2bgq s LEU 295 Cb 0.02 -2.22 0.03 0.00 0.03 0.00 0.00 46.19 44.05 2bgq s LEU 295 CO 0.71 -0.73 1.42 0.71 0.23 0.00 0.00 176.35 178.69 2bgq h THR 296 N 5.31 1.00 0.00 5.49 1.35 -2.00 -3.47 112.91 120.59 2bgq h THR 296 Ca -0.08 -2.40 0.00 0.00 -0.55 0.00 0.00 66.41 63.38 2bgq h THR 296 Cb 1.07 2.48 0.00 0.00 -1.73 0.00 0.00 68.15 69.97 2bgq h THR 296 CO 0.89 0.57 0.00 0.61 -0.25 0.00 0.00 175.52 177.34 2bgq n GLY 297 N 1.23 0.86 0.24 5.82 0.00 -1.26 -4.89 105.19 107.18 2bgq n GLY 297 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 2bgq n GLY 297 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bgq h GLU 298 N 3.88 0.44 -0.96 1.61 5.08 -1.94 -1.63 114.58 121.06 2bgq h GLU 298 Ca 0.00 -0.15 0.17 0.00 -1.00 0.00 0.00 59.36 58.38 2bgq h GLU 298 Cb 0.00 -0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.13 2bgq h GLU 298 CO 0.00 0.63 0.61 0.93 -1.00 0.00 0.00 179.01 180.18 2bgq h GLU 299 N 0.40 0.69 0.00 2.33 3.07 -1.91 -2.82 114.58 116.33 2bgq h GLU 299 Ca 0.07 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 2bgq h GLU 299 Cb 0.59 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 2bgq h GLU 299 CO 0.04 0.45 0.00 1.47 -1.40 0.00 0.00 179.01 179.58 2bgq n LEU 300 N -4.64 0.75 0.00 1.33 -0.00 -1.20 -2.36 117.00 110.88 2bgq n LEU 300 Ca 0.20 -0.75 0.00 0.00 -0.00 0.00 0.00 56.01 55.46 2bgq n LEU 300 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 2bgq n LEU 300 CO 0.26 0.19 -0.31 0.49 -0.00 0.00 0.00 177.39 178.02 2bgq n PHE 301 N -0.05 0.00 -3.28 1.47 3.72 -0.62 -4.19 117.46 114.51 2bgq n PHE 301 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 2bgq n PHE 301 Cb 0.13 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.62 2bgq n PHE 301 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2bgq s VAL 302 N -1.33 5.00 -0.41 -4.37 1.01 -1.07 -4.46 120.40 114.78 2bgq s VAL 302 Ca 0.00 1.11 0.04 0.00 0.00 0.00 0.00 61.98 63.13 2bgq s VAL 302 Cb 0.00 -3.87 0.17 0.00 0.00 0.00 0.00 36.38 32.68 2bgq s VAL 302 CO 0.00 0.41 0.36 0.21 0.00 0.00 0.00 175.10 176.09 2bgq s ASN 303 N -0.08 1.28 -0.33 3.32 3.84 -0.05 -4.15 114.94 118.77 2bgq s ASN 303 Ca 0.29 -2.85 -0.28 0.00 0.21 0.00 0.00 52.86 50.22 2bgq s ASN 303 Cb -0.17 -0.21 -0.30 0.00 -0.55 0.00 0.00 41.25 40.02 2bgq s ASN 303 CO 0.15 -0.17 1.73 2.29 -2.79 0.00 0.00 177.10 178.30 2bgq n LYS 304 N 2.98 0.46 0.00 0.43 0.00 -1.26 -1.52 118.16 119.24 2bgq n LYS 304 Ca 0.27 -1.33 0.00 0.00 -0.00 0.00 0.00 58.31 57.25 2bgq n LYS 304 Cb 0.48 -2.76 0.00 0.00 -0.00 0.00 0.00 35.03 32.75 2bgq n LYS 304 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 2bgq n THR 305 N 6.92 0.00 0.18 0.58 5.66 -1.26 -4.97 114.28 121.39 2bgq n THR 305 Ca 0.47 0.00 0.09 0.00 -3.05 0.00 0.00 64.05 61.56 2bgq n THR 305 Cb 0.42 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.07 2bgq n THR 305 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2bgq n HIS 306 N 0.00 0.00 -4.39 1.09 8.25 -1.12 -5.06 115.22 113.99 2bgq n HIS 306 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2bgq n HIS 306 Cb 0.00 -0.31 0.00 0.00 1.12 0.00 0.00 29.99 30.80 2bgq n HIS 306 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bgq n GLY 307 N 1.48 0.25 0.06 -1.41 0.00 -0.58 -4.81 105.19 100.18 2bgq n GLY 307 Ca -0.02 -0.90 0.06 0.00 0.00 0.00 0.00 46.02 45.16 2bgq n GLY 307 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2bgq n PRO 308 N 1.04 0.06 -3.85 1.61 -0.04 -1.26 -4.66 135.00 127.90 2bgq n PRO 308 Ca 0.00 0.47 -0.34 0.00 -0.04 0.00 0.00 63.50 63.59 2bgq n PRO 308 Cb 0.00 -1.66 -0.12 0.00 -0.04 0.00 0.00 33.50 31.68 2bgq n PRO 308 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2bgq s TYR 309 N -3.17 3.61 -0.81 0.54 1.51 -1.26 -4.96 117.35 112.80 2bgq s TYR 309 Ca 0.01 -2.65 0.07 0.00 -1.01 0.00 0.00 57.07 53.50 2bgq s TYR 309 Cb 0.05 -3.12 0.37 0.00 -0.11 0.00 0.00 41.96 39.15 2bgq s TYR 309 CO 0.15 -0.94 1.10 0.54 -1.11 0.00 0.00 175.55 175.29 2bgq n ARG 310 N 4.33 2.69 -3.62 -0.62 1.74 -1.26 -0.87 116.66 119.05 2bgq n ARG 310 Ca 0.01 -1.43 -0.02 0.00 -0.77 0.00 0.00 57.85 55.63 2bgq n ARG 310 Cb 0.41 -1.79 -0.01 0.00 -1.02 0.00 0.00 32.46 30.05 2bgq n ARG 310 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2bgq s SER 311 N -0.44 -0.13 0.26 0.55 1.04 -1.26 -4.20 113.70 109.53 2bgq s SER 311 Ca 0.25 -0.12 0.03 0.00 0.48 0.00 0.00 55.95 56.58 2bgq s SER 311 Cb 0.18 0.23 0.34 0.00 0.10 0.00 0.00 66.02 66.87 2bgq s SER 311 CO 0.08 -0.40 1.65 0.00 0.98 0.00 0.00 173.24 175.55 2bgq h ALA 312 N 2.00 0.98 -0.56 5.32 0.00 -1.91 -2.97 119.26 122.13 2bgq h ALA 312 Ca -0.22 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.24 2bgq h ALA 312 Cb 1.20 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2bgq h ALA 312 CO 0.26 0.62 0.24 0.00 0.00 0.00 0.00 179.25 180.37 2bgq h ARG 313 N 0.33 0.80 -0.31 0.00 -0.00 -1.94 -1.21 114.38 112.06 2bgq h ARG 313 Ca 0.03 -0.11 -0.10 0.00 -0.50 0.00 0.00 59.98 59.30 2bgq h ARG 313 Cb 0.85 -0.15 -0.01 0.00 0.00 0.00 0.00 29.97 30.66 2bgq h ARG 313 CO 0.07 0.64 -0.21 -0.44 0.00 0.00 0.00 179.97 180.04 2bgq h ASP 314 N 0.80 0.59 0.11 7.04 3.32 -1.91 0.61 116.42 126.97 2bgq h ASP 314 Ca 0.19 -0.19 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 2bgq h ASP 314 Cb 0.13 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2bgq h ASP 314 CO -0.02 0.80 -0.15 0.58 -1.72 0.00 0.00 179.24 178.72 2bgq h VAL 315 N 0.52 1.15 -0.43 -1.35 2.07 -1.15 -2.67 116.25 114.40 2bgq h VAL 315 Ca 0.08 -0.70 -0.24 0.00 0.82 0.00 0.00 66.70 66.66 2bgq h VAL 315 Cb 0.65 1.27 -0.15 0.00 -1.52 0.00 0.00 31.29 31.54 2bgq h VAL 315 CO 0.05 0.21 -0.07 0.79 0.02 0.00 0.00 177.57 178.56 2bgq n TRP 316 N -4.30 1.37 -2.94 1.57 7.02 -0.75 -4.97 117.44 114.45 2bgq n TRP 316 Ca -0.02 -1.74 -0.13 0.00 -1.02 0.00 0.00 57.50 54.60 2bgq n TRP 316 Cb 0.25 -0.55 -0.01 0.00 -2.42 0.00 0.00 31.31 28.59 2bgq n TRP 316 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 2bgq n ASP 317 N -1.09 -2.32 -2.10 -0.99 8.00 -0.36 -1.61 116.55 116.09 2bgq n ASP 317 Ca 0.37 0.02 -0.12 0.00 0.71 0.00 0.00 54.79 55.77 2bgq n ASP 317 Cb 1.04 -2.02 -0.02 0.00 -0.02 0.00 0.00 41.12 40.10 2bgq n ASP 317 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2bgq n HIS 318 N -3.20 -1.14 -2.33 1.24 8.25 0.20 -4.83 115.22 113.41 2bgq n HIS 318 Ca -0.02 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.14 2bgq n HIS 318 Cb 0.53 -2.56 0.01 0.00 1.12 0.00 0.00 29.99 29.09 2bgq n HIS 318 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 2bgq n GLU 319 N -2.47 3.29 0.00 -0.41 0.28 -0.63 -5.12 120.64 115.58 2bgq n GLU 319 Ca -0.13 -4.27 0.03 0.00 -0.16 0.00 0.00 57.16 52.63 2bgq n GLU 319 Cb 0.53 -2.26 0.03 0.00 1.43 0.00 0.00 31.44 31.18 2bgq n GLU 319 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06