#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g1h s PHE 4 N 0.00 2.21 0.21 1.08 -0.12 -1.26 -0.72 117.98 119.38 2g1h s PHE 4 Ca 0.00 -0.36 0.10 0.00 -0.05 0.00 0.00 56.93 56.62 2g1h s PHE 4 Cb 0.00 -0.98 -0.05 0.00 -0.63 0.00 0.00 43.02 41.37 2g1h s PHE 4 CO 0.00 0.65 -0.20 0.00 -0.05 0.00 0.00 175.22 175.62 2g1h s ALA 5 N -2.48 2.36 -0.19 1.99 0.00 -0.20 -0.82 121.76 122.42 2g1h s ALA 5 Ca 0.28 -1.67 -0.10 0.00 0.00 0.00 0.00 51.96 50.48 2g1h s ALA 5 Cb -0.05 -0.23 -0.05 0.00 0.00 0.00 0.00 23.12 22.79 2g1h s ALA 5 CO 0.13 0.28 0.12 -0.06 0.00 0.00 0.00 175.76 176.23 2g1h s PHE 6 N -2.21 3.39 0.01 0.00 0.40 -0.76 -1.20 117.98 117.61 2g1h s PHE 6 Ca 0.22 0.30 0.08 0.00 -0.60 0.00 0.00 56.93 56.93 2g1h s PHE 6 Cb -0.05 -2.14 -0.02 0.00 0.51 0.00 0.00 43.02 41.31 2g1h s PHE 6 CO 0.10 0.29 -0.24 0.14 0.70 0.00 0.00 175.22 176.20 2g1h s VAL 7 N 0.31 2.25 -0.15 -0.44 -7.23 -0.13 -2.08 120.40 112.94 2g1h s VAL 7 Ca 0.08 -1.19 0.01 0.00 -1.81 0.00 0.00 61.98 59.07 2g1h s VAL 7 Cb -0.11 -1.84 0.02 0.00 0.56 0.00 0.00 36.38 35.01 2g1h s VAL 7 CO -0.02 0.48 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.71 2g1h s PHE 8 N -0.72 2.45 0.74 2.82 0.40 -0.63 -0.53 117.98 122.51 2g1h s PHE 8 Ca 0.11 -1.33 -0.12 0.00 -0.60 0.00 0.00 56.93 55.00 2g1h s PHE 8 Cb -0.10 -1.72 0.04 0.00 0.51 0.00 0.00 43.02 41.75 2g1h s PHE 8 CO 0.01 -0.66 1.13 -1.25 0.70 0.00 0.00 175.22 175.14 2g1h s PRO 9 N 1.16 2.53 0.00 0.24 0.04 -1.26 -0.76 135.00 136.95 2g1h s PRO 9 Ca -0.00 0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.37 2g1h s PRO 9 Cb -0.14 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2g1h s PRO 9 CO -0.07 -1.24 0.00 0.41 0.04 0.00 0.00 177.00 176.14 2g1h n GLY 10 N -3.12 7.41 3.55 0.56 0.00 -1.22 -3.57 105.19 108.79 2g1h n GLY 10 Ca 0.07 -1.96 -0.46 0.00 0.00 0.00 0.00 46.02 43.67 2g1h n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2g1h n GLN 11 N 0.00 1.01 0.00 1.61 -0.06 -1.26 -2.44 117.38 116.25 2g1h n GLN 11 Ca 0.00 0.36 0.00 0.00 -2.00 0.00 0.00 57.00 55.36 2g1h n GLN 11 Cb 0.00 -1.68 0.00 0.00 -4.06 0.00 0.00 30.24 24.50 2g1h n GLN 11 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2g1h n GLY 12 N 1.55 2.84 0.01 1.69 0.00 -1.26 -4.92 105.19 105.10 2g1h n GLY 12 Ca 0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2g1h n GLY 12 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2g1h n SER 13 N 0.00 0.59 -4.78 1.61 7.64 -1.02 -4.90 113.62 112.76 2g1h n SER 13 Ca 0.00 -0.33 -0.36 0.00 1.01 0.00 0.00 58.87 59.19 2g1h n SER 13 Cb 0.00 0.39 -0.02 0.00 -1.01 0.00 0.00 64.21 63.57 2g1h n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2g1h s GLN 14 N -3.03 3.76 0.00 1.43 0.00 -1.26 -4.15 119.66 116.42 2g1h s GLN 14 Ca 0.10 1.64 -0.11 0.00 -0.00 0.00 0.00 55.36 56.98 2g1h s GLN 14 Cb 0.17 -2.31 0.01 0.00 0.00 0.00 0.00 33.01 30.88 2g1h s GLN 14 CO 0.73 -0.51 0.23 0.95 0.00 0.00 0.00 175.29 176.69 2g1h s THR 15 N -1.67 0.07 0.19 3.63 -4.23 -1.26 -5.07 115.64 107.31 2g1h s THR 15 Ca 0.65 -0.62 -0.32 0.00 -1.18 0.00 0.00 61.69 60.22 2g1h s THR 15 Cb -0.25 -0.60 -0.11 0.00 1.34 0.00 0.00 72.50 72.88 2g1h s THR 15 CO 0.30 -0.34 1.69 -0.69 -0.54 0.00 0.00 174.62 175.04 2g1h s VAL 16 N -1.56 2.19 0.00 2.29 1.01 -1.26 -1.85 120.40 121.21 2g1h s VAL 16 Ca -0.13 0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.98 2g1h s VAL 16 Cb -0.05 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.24 2g1h s VAL 16 CO 0.02 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2g1h n GLY 17 N 3.93 0.65 3.76 4.51 0.00 0.10 -4.99 105.19 113.16 2g1h n GLY 17 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 2g1h n GLY 17 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2g1h s MET 18 N -0.71 3.51 0.00 1.61 0.00 -0.77 -2.22 119.30 120.71 2g1h s MET 18 Ca 0.00 2.21 0.00 0.00 0.00 0.00 0.00 55.69 57.90 2g1h s MET 18 Cb 0.00 -2.47 0.00 0.00 0.00 0.00 0.00 34.83 32.36 2g1h s MET 18 CO 0.00 -0.88 0.00 1.28 0.00 0.00 0.00 175.02 175.42 2g1h n LEU 19 N -0.53 0.50 -0.07 0.18 4.77 -1.26 -4.89 117.00 115.70 2g1h n LEU 19 Ca 0.07 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.98 2g1h n LEU 19 Cb 0.44 -1.25 -0.01 0.00 -2.33 0.00 0.00 43.42 40.27 2g1h n LEU 19 CO 0.54 -0.42 0.84 0.00 -1.33 0.00 0.00 177.39 177.02 2g1h h ALA 20 N 0.00 0.21 -0.54 -1.18 0.00 -1.81 -0.49 119.26 115.46 2g1h h ALA 20 Ca 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2g1h h ALA 20 Cb 0.33 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2g1h h ALA 20 CO 0.00 -0.44 0.18 -0.44 0.00 0.00 0.00 179.25 178.55 2g1h h ASP 21 N 0.05 0.77 -0.86 0.00 3.32 -1.90 -2.18 116.42 115.62 2g1h h ASP 21 Ca 0.13 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 2g1h h ASP 21 Cb 0.18 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.49 2g1h h ASP 21 CO -0.24 0.76 0.53 -0.03 -1.72 0.00 0.00 179.24 178.54 2g1h h MET 22 N 0.74 1.15 -0.36 3.56 4.05 -1.69 -2.30 114.93 120.08 2g1h h MET 22 Ca 0.17 -0.10 -0.07 0.00 -0.28 0.00 0.00 59.70 59.42 2g1h h MET 22 Cb 0.26 -0.25 -0.02 0.00 -0.80 0.00 0.00 31.60 30.80 2g1h h MET 22 CO -0.01 0.80 -0.09 0.00 0.23 0.00 0.00 176.91 177.84 2g1h h ALA 23 N 1.29 1.17 0.00 0.39 0.00 -0.80 0.13 119.26 121.44 2g1h h ALA 23 Ca 0.31 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2g1h h ALA 23 Cb -0.07 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2g1h h ALA 23 CO -0.06 0.53 -0.13 0.00 0.00 0.00 0.00 179.25 179.59 2g1h h ALA 24 N 1.34 1.09 0.00 0.00 0.00 -0.87 -2.95 119.26 117.88 2g1h h ALA 24 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2g1h h ALA 24 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2g1h h ALA 24 CO 0.03 0.16 -1.73 0.43 0.00 0.00 0.00 179.25 178.13 2g1h n SER 25 N -3.37 0.22 -3.50 0.00 7.64 -0.61 -4.88 113.62 109.13 2g1h n SER 25 Ca -0.01 0.04 -0.25 0.00 1.01 0.00 0.00 58.87 59.66 2g1h n SER 25 Cb 0.32 1.61 -0.13 0.00 -1.01 0.00 0.00 64.21 65.00 2g1h n SER 25 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2g1h s TYR 26 N -3.46 0.03 0.60 1.43 2.02 0.34 -5.01 117.35 113.31 2g1h s TYR 26 Ca -0.06 -0.57 0.28 0.00 -0.37 0.00 0.00 57.07 56.35 2g1h s TYR 26 Cb 0.13 -0.72 1.47 0.00 -0.40 0.00 0.00 41.96 42.43 2g1h s TYR 26 CO 0.88 -0.83 1.87 -1.35 -1.57 0.00 0.00 175.55 174.55 2g1h h PRO 27 N 8.36 0.00 0.00 -1.71 0.11 -1.85 -2.05 132.00 134.86 2g1h h PRO 27 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2g1h h PRO 27 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2g1h h PRO 27 CO 0.39 0.00 0.00 0.97 -0.21 0.00 0.00 178.00 179.15 2g1h h ILE 28 N 0.00 0.00 0.35 4.15 2.10 -1.94 -2.61 117.51 119.56 2g1h h ILE 28 Ca 0.18 -0.24 -0.02 0.00 1.08 0.00 0.00 64.86 65.86 2g1h h ILE 28 Cb 1.15 1.04 0.00 0.00 -1.09 0.00 0.00 36.82 37.93 2g1h h ILE 28 CO -0.00 0.00 -0.17 0.58 -1.08 0.00 0.00 178.15 177.48 2g1h h VAL 29 N 0.00 0.60 0.00 2.19 2.07 -1.67 -0.37 116.25 119.07 2g1h h VAL 29 Ca 0.00 -0.56 -0.10 0.00 0.82 0.00 0.00 66.70 66.86 2g1h h VAL 29 Cb 0.29 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2g1h h VAL 29 CO 0.00 0.10 -0.47 -0.33 0.02 0.00 0.00 177.57 176.89 2g1h h GLU 30 N -0.82 0.00 -0.82 1.57 5.08 -1.72 -1.07 114.58 116.80 2g1h h GLU 30 Ca -0.05 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 2g1h h GLU 30 Cb 0.53 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 2g1h h GLU 30 CO 0.08 0.47 0.37 0.93 -1.00 0.00 0.00 179.01 179.86 2g1h h GLU 31 N 0.00 1.20 -0.40 2.33 5.08 -1.44 0.45 114.58 121.80 2g1h h GLU 31 Ca -0.00 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 2g1h h GLU 31 Cb 0.84 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 2g1h h GLU 31 CO 0.06 0.94 0.12 1.15 -1.00 0.00 0.00 179.01 180.28 2g1h h THR 32 N 1.18 1.22 0.00 1.13 2.02 -0.54 -2.47 112.91 115.45 2g1h h THR 32 Ca 0.28 -0.72 -0.05 0.00 0.77 0.00 0.00 66.41 66.69 2g1h h THR 32 Cb 0.15 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 2g1h h THR 32 CO -0.03 0.25 -0.24 -0.26 0.37 0.00 0.00 175.52 175.61 2g1h h PHE 33 N 0.49 0.00 -0.29 3.16 -1.00 -0.91 -2.45 116.94 115.95 2g1h h PHE 33 Ca 0.13 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.78 2g1h h PHE 33 Cb 0.27 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.82 2g1h h PHE 33 CO 0.01 0.24 -0.33 0.00 -1.61 0.00 0.00 178.31 176.62 2g1h h ALA 34 N 1.76 0.88 -0.21 2.45 0.00 -0.64 -0.15 119.26 123.36 2g1h h ALA 34 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2g1h h ALA 34 Cb 0.46 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2g1h h ALA 34 CO 0.03 0.63 0.13 0.93 0.00 0.00 0.00 179.25 180.98 2g1h h GLU 35 N 0.53 0.28 -0.29 0.00 5.08 -1.00 -1.87 114.58 117.30 2g1h h GLU 35 Ca 0.06 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2g1h h GLU 35 Cb 0.83 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 2g1h h GLU 35 CO 0.07 0.20 0.16 0.00 -1.00 0.00 0.00 179.01 178.44 2g1h h ALA 36 N 1.06 0.37 -0.27 3.43 0.00 -1.27 -2.56 119.26 120.03 2g1h h ALA 36 Ca 0.08 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2g1h h ALA 36 Cb -0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2g1h h ALA 36 CO -0.02 -0.11 -0.13 0.77 0.00 0.00 0.00 179.25 179.77 2g1h h SER 37 N 0.36 0.44 -0.61 0.00 0.02 -0.94 0.20 113.55 113.03 2g1h h SER 37 Ca 0.10 -0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 2g1h h SER 37 Cb 0.05 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2g1h h SER 37 CO -0.02 0.60 0.27 0.00 -1.14 0.00 0.00 176.83 176.54 2g1h h ALA 38 N 1.45 1.27 -0.00 3.77 0.00 -1.14 0.16 119.26 124.76 2g1h h ALA 38 Ca 0.08 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 2g1h h ALA 38 Cb 0.48 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2g1h h ALA 38 CO 0.03 0.54 -0.57 0.00 0.00 0.00 0.00 179.25 179.25 2g1h h ALA 39 N 1.38 1.06 0.01 0.00 0.00 -0.73 -3.31 119.26 117.66 2g1h h ALA 39 Ca 0.22 -0.52 -0.30 0.00 0.00 0.00 0.00 54.91 54.32 2g1h h ALA 39 Cb 0.16 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2g1h h ALA 39 CO -0.02 0.71 -1.72 1.28 0.00 0.00 0.00 179.25 179.50 2g1h n LEU 40 N -3.87 0.97 0.00 0.00 4.77 -0.09 -4.90 117.00 113.88 2g1h n LEU 40 Ca -0.01 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2g1h n LEU 40 Cb 0.57 0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 2g1h n LEU 40 CO 0.41 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 2g1h n GLY 41 N 1.58 0.59 3.60 -0.72 0.00 0.50 -5.06 105.19 105.68 2g1h n GLY 41 Ca -0.18 -0.59 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 2g1h n GLY 41 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2g1h s TYR 42 N -2.00 0.30 -0.83 1.61 -0.85 -1.17 -5.07 117.35 109.34 2g1h s TYR 42 Ca 0.00 -0.67 -0.23 0.00 -0.52 0.00 0.00 57.07 55.65 2g1h s TYR 42 Cb 0.00 0.23 0.07 0.00 0.38 0.00 0.00 41.96 42.64 2g1h s TYR 42 CO 0.00 -1.00 1.19 0.34 -1.52 0.00 0.00 175.55 174.56 2g1h s ASP 43 N -3.00 6.36 0.18 -0.18 -1.08 -1.26 -4.36 116.67 113.33 2g1h s ASP 43 Ca 0.21 -1.25 -0.09 0.00 -0.52 0.00 0.00 52.55 50.91 2g1h s ASP 43 Cb -0.01 -2.48 0.07 0.00 -1.46 0.00 0.00 42.92 39.04 2g1h s ASP 43 CO 0.08 -1.45 1.60 0.25 0.52 0.00 0.00 175.17 176.17 2g1h h LEU 44 N 11.83 1.00 -0.32 -1.34 5.85 -1.90 -2.13 115.31 128.30 2g1h h LEU 44 Ca -0.06 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.36 2g1h h LEU 44 Cb 1.04 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.76 2g1h h LEU 44 CO 1.24 1.12 0.10 -0.25 -0.34 0.00 0.00 178.44 180.32 2g1h h TRP 45 N 0.88 0.18 -0.74 1.25 2.91 -1.89 -1.20 115.95 117.34 2g1h h TRP 45 Ca 0.13 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.15 2g1h h TRP 45 Cb 0.69 -0.03 -0.03 0.00 -0.51 0.00 0.00 29.16 29.27 2g1h h TRP 45 CO 0.05 0.07 0.39 0.00 -1.03 0.00 0.00 178.44 177.92 2g1h h ALA 46 N 1.21 0.95 -0.45 2.65 0.00 -1.91 -0.29 119.26 121.43 2g1h h ALA 46 Ca 0.15 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.01 2g1h h ALA 46 Cb 0.13 -0.30 -0.07 0.00 0.00 0.00 0.00 17.79 17.55 2g1h h ALA 46 CO -0.16 0.49 -0.01 1.25 0.00 0.00 0.00 179.25 180.82 2g1h h LEU 47 N 1.03 -0.20 -1.14 0.00 5.85 -0.97 0.16 115.31 120.04 2g1h h LEU 47 Ca 0.26 0.11 -0.09 0.00 0.84 0.00 0.00 57.88 59.00 2g1h h LEU 47 Cb 0.07 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2g1h h LEU 47 CO -0.04 -0.06 -0.43 0.71 -0.34 0.00 0.00 178.44 178.28 2g1h h THR 48 N 0.10 1.31 0.00 1.05 1.35 0.01 -0.04 112.91 116.69 2g1h h THR 48 Ca 0.22 -1.48 -0.28 0.00 -0.55 0.00 0.00 66.41 64.32 2g1h h THR 48 Cb 0.33 1.80 -0.05 0.00 -1.73 0.00 0.00 68.15 68.50 2g1h h THR 48 CO -0.38 0.42 -1.68 0.00 -0.25 0.00 0.00 175.52 173.64 2g1h n GLN 49 N -4.02 0.63 -0.01 4.72 1.13 -0.25 0.03 117.38 119.61 2g1h n GLN 49 Ca -0.02 0.29 0.02 0.00 -1.94 0.00 0.00 57.00 55.36 2g1h n GLN 49 Cb 0.46 -1.79 -0.07 0.00 0.11 0.00 0.00 30.24 28.94 2g1h n GLN 49 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2g1h n GLN 50 N -3.02 0.85 0.00 -1.09 6.02 0.50 -4.06 117.38 116.58 2g1h n GLN 50 Ca -0.16 -0.06 0.00 0.00 -0.01 0.00 0.00 57.00 56.77 2g1h n GLN 50 Cb 1.03 -1.21 0.00 0.00 1.02 0.00 0.00 30.24 31.08 2g1h n GLN 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2g1h n GLY 51 N 2.12 1.83 3.74 1.08 0.00 -0.03 -4.78 105.19 109.14 2g1h n GLY 51 Ca -0.04 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.10 2g1h n GLY 51 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2g1h s PRO 52 N 0.00 1.04 0.39 1.61 0.04 -1.26 -4.76 135.00 132.07 2g1h s PRO 52 Ca 0.00 0.48 0.14 0.00 0.04 0.00 0.00 61.00 61.66 2g1h s PRO 52 Cb 0.00 -1.81 0.97 0.00 0.04 0.00 0.00 34.50 33.70 2g1h s PRO 52 CO 0.00 -2.30 1.87 0.00 0.04 0.00 0.00 177.00 176.60 2g1h h ALA 53 N -1.58 2.03 -0.20 8.56 0.00 -1.94 -0.93 119.26 125.19 2g1h h ALA 53 Ca -0.51 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 2g1h h ALA 53 Cb 1.32 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2g1h h ALA 53 CO 0.59 -0.29 -0.32 1.49 0.00 0.00 0.00 179.25 180.72 2g1h h GLU 54 N 0.52 0.41 -0.17 0.00 4.81 -1.98 -0.10 114.58 118.07 2g1h h GLU 54 Ca 0.45 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 59.43 2g1h h GLU 54 Cb 0.94 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.30 2g1h h GLU 54 CO -0.19 0.68 -0.21 0.93 -0.73 0.00 0.00 179.01 179.50 2g1h h GLU 55 N 0.36 0.45 0.00 1.92 4.39 -1.54 -3.16 114.58 116.99 2g1h h GLU 55 Ca 0.05 -0.25 -0.01 0.00 0.34 0.00 0.00 59.36 59.49 2g1h h GLU 55 Cb 0.73 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.40 2g1h h GLU 55 CO 0.06 0.83 -0.04 1.25 -1.16 0.00 0.00 179.01 179.94 2g1h h LEU 56 N 0.09 0.00 -0.50 1.33 5.85 -0.93 -2.72 115.31 118.42 2g1h h LEU 56 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2g1h h LEU 56 Cb 0.77 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.80 2g1h h LEU 56 CO 0.05 0.04 -0.48 0.59 -0.34 0.00 0.00 178.44 178.30 2g1h n ASN 57 N -3.35 1.26 -4.68 1.25 3.02 -0.11 -3.41 115.26 109.23 2g1h n ASN 57 Ca -0.02 -1.01 -0.42 0.00 -0.03 0.00 0.00 54.58 53.10 2g1h n ASN 57 Cb 0.18 0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 39.72 2g1h n ASN 57 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2g1h s LYS 58 N -2.65 4.31 0.33 3.52 1.02 -1.03 -4.81 119.74 120.44 2g1h s LYS 58 Ca 0.18 1.80 0.13 0.00 0.02 0.00 0.00 55.97 58.10 2g1h s LYS 58 Cb 0.18 -3.59 0.58 0.00 -0.52 0.00 0.00 37.83 34.48 2g1h s LYS 58 CO 0.62 -0.53 1.73 0.00 -0.92 0.00 0.00 175.35 176.25 2g1h h THR 59 N 5.03 1.29 0.00 2.17 1.03 -1.89 0.46 112.91 121.01 2g1h h THR 59 Ca -0.35 -1.64 0.00 0.00 -0.01 0.00 0.00 66.41 64.41 2g1h h THR 59 Cb 1.16 1.90 0.00 0.00 -1.07 0.00 0.00 68.15 70.14 2g1h h THR 59 CO 0.90 0.46 0.00 -2.67 -0.01 0.00 0.00 175.52 174.20 2g1h n TRP 60 N -3.91 0.06 -0.09 0.00 2.14 -1.26 -1.27 117.44 113.10 2g1h n TRP 60 Ca -0.01 0.02 -0.11 0.00 2.07 0.00 0.00 57.50 59.47 2g1h n TRP 60 Cb 0.50 -0.53 -0.10 0.00 -0.81 0.00 0.00 31.31 30.37 2g1h n TRP 60 CO 0.00 0.00 0.00 1.04 2.07 0.00 0.00 177.69 180.80 2g1h n GLN 61 N -1.55 0.93 -0.25 -2.67 6.02 0.11 -4.51 117.38 115.46 2g1h n GLN 61 Ca 0.04 0.06 0.02 0.00 -0.01 0.00 0.00 57.00 57.12 2g1h n GLN 61 Cb 0.22 -1.38 0.15 0.00 1.02 0.00 0.00 30.24 30.25 2g1h n GLN 61 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2g1h h THR 62 N 0.00 0.83 0.14 5.09 2.02 -0.11 -2.28 112.91 118.61 2g1h h THR 62 Ca -0.42 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 2g1h h THR 62 Cb 1.77 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 2g1h h THR 62 CO -0.03 0.11 -0.07 1.56 0.37 0.00 0.00 175.52 177.46 2g1h h GLN 63 N 0.60 -0.18 -0.45 6.66 4.20 -1.42 0.14 115.11 124.65 2g1h h GLN 63 Ca 0.36 0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.09 2g1h h GLN 63 Cb 0.40 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 2g1h h GLN 63 CO -0.28 0.17 0.30 -1.00 -0.67 0.00 0.00 178.83 177.34 2g1h h PRO 64 N -0.56 0.60 -0.44 1.46 0.13 -1.78 -0.66 132.00 130.74 2g1h h PRO 64 Ca -0.02 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 2g1h h PRO 64 Cb 0.44 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.41 2g1h h PRO 64 CO 0.03 0.40 0.22 0.00 -0.23 0.00 0.00 178.00 178.42 2g1h h ALA 65 N 1.71 0.57 -0.16 -0.56 0.00 -0.87 -1.20 119.26 118.75 2g1h h ALA 65 Ca 0.17 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 2g1h h ALA 65 Cb -0.07 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2g1h h ALA 65 CO -0.04 0.11 -0.38 -0.07 0.00 0.00 0.00 179.25 178.88 2g1h h LEU 66 N 0.57 0.62 -0.62 0.00 3.38 -0.46 -1.41 115.31 117.39 2g1h h LEU 66 Ca 0.15 -0.57 0.04 0.00 0.09 0.00 0.00 57.88 57.59 2g1h h LEU 66 Cb 0.10 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2g1h h LEU 66 CO -0.02 1.08 0.37 0.25 0.09 0.00 0.00 178.44 180.20 2g1h h LEU 67 N 0.19 0.59 -0.20 1.67 5.85 -1.09 -1.12 115.31 121.19 2g1h h LEU 67 Ca -0.00 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 2g1h h LEU 67 Cb 0.99 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 2g1h h LEU 67 CO 0.08 0.40 0.00 0.74 -0.34 0.00 0.00 178.44 179.33 2g1h h THR 68 N 0.71 1.25 -0.52 1.05 2.02 -1.16 -0.86 112.91 115.42 2g1h h THR 68 Ca 0.26 -0.87 0.09 0.00 0.77 0.00 0.00 66.41 66.66 2g1h h THR 68 Cb 0.07 1.42 -0.07 0.00 -1.74 0.00 0.00 68.15 67.83 2g1h h THR 68 CO -0.13 0.26 0.10 0.00 0.37 0.00 0.00 175.52 176.13 2g1h h ALA 69 N 0.79 0.58 -0.46 6.16 0.00 -1.05 0.83 119.26 126.13 2g1h h ALA 69 Ca 0.06 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 2g1h h ALA 69 Cb 0.39 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2g1h h ALA 69 CO 0.01 -0.31 -0.07 0.77 0.00 0.00 0.00 179.25 179.65 2g1h h SER 70 N 0.23 0.85 -0.26 0.00 0.02 -0.98 -1.64 113.55 111.77 2g1h h SER 70 Ca 0.26 -0.34 -0.11 0.00 -0.84 0.00 0.00 61.79 60.76 2g1h h SER 70 Cb 0.36 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 2g1h h SER 70 CO -0.35 0.99 -0.22 0.58 -1.14 0.00 0.00 176.83 176.70 2g1h h VAL 71 N 0.69 1.27 -0.58 2.27 2.07 -0.88 -0.85 116.25 120.24 2g1h h VAL 71 Ca 0.12 -1.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 2g1h h VAL 71 Cb 0.60 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 2g1h h VAL 71 CO 0.04 0.44 0.30 0.00 0.02 0.00 0.00 177.57 178.37 2g1h h ALA 72 N 1.12 0.75 -0.58 1.67 0.00 -0.61 0.51 119.26 122.12 2g1h h ALA 72 Ca 0.09 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2g1h h ALA 72 Cb 0.71 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2g1h h ALA 72 CO 0.05 0.29 0.07 -0.07 0.00 0.00 0.00 179.25 179.59 2g1h h LEU 73 N 0.79 0.94 -0.81 0.00 3.38 -0.98 -1.16 115.31 117.47 2g1h h LEU 73 Ca 0.20 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2g1h h LEU 73 Cb 0.07 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 2g1h h LEU 73 CO -0.03 0.98 0.52 0.22 0.09 0.00 0.00 178.44 180.22 2g1h h TYR 74 N 0.87 1.05 -0.53 1.13 3.20 -0.85 -1.72 116.97 120.12 2g1h h TYR 74 Ca 0.17 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 2g1h h TYR 74 Cb 0.46 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 2g1h h TYR 74 CO 0.03 0.68 0.04 0.00 -1.64 0.00 0.00 178.16 177.27 2g1h h ARG 75 N 1.11 0.87 0.22 1.82 3.08 -0.44 -1.18 114.38 119.86 2g1h h ARG 75 Ca 0.30 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2g1h h ARG 75 Cb -0.09 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.86 2g1h h ARG 75 CO -0.06 0.85 -0.11 0.28 -1.07 0.00 0.00 179.97 179.86 2g1h h VAL 76 N 0.82 0.81 -0.63 2.04 2.07 -0.86 0.25 116.25 120.75 2g1h h VAL 76 Ca 0.16 -0.12 0.12 0.00 0.82 0.00 0.00 66.70 67.68 2g1h h VAL 76 Cb 0.44 0.88 -0.12 0.00 -1.52 0.00 0.00 31.29 30.97 2g1h h VAL 76 CO 0.02 0.03 -0.18 -0.25 0.02 0.00 0.00 177.57 177.20 2g1h h TRP 77 N -0.36 -0.41 -0.23 1.57 2.91 -1.07 -0.86 115.95 117.50 2g1h h TRP 77 Ca -0.03 0.06 -0.10 0.00 1.13 0.00 0.00 58.89 59.95 2g1h h TRP 77 Cb 0.27 0.28 -0.00 0.00 -0.51 0.00 0.00 29.16 29.20 2g1h h TRP 77 CO -0.04 -0.29 -0.25 1.96 -1.03 0.00 0.00 178.44 178.78 2g1h h GLN 78 N -0.02 0.58 -0.80 2.65 4.20 -1.03 0.13 115.11 120.83 2g1h h GLN 78 Ca 0.30 -0.32 0.05 0.00 0.06 0.00 0.00 58.65 58.74 2g1h h GLN 78 Cb 0.48 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.22 2g1h h GLN 78 CO -0.66 0.91 0.52 0.37 -0.67 0.00 0.00 178.83 179.31 2g1h h GLN 79 N 0.28 0.89 -0.35 1.46 4.15 -0.53 -1.62 115.11 119.39 2g1h h GLN 79 Ca 0.04 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.40 2g1h h GLN 79 Cb 0.81 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.30 2g1h h GLN 79 CO 0.06 0.59 0.00 1.04 -1.93 0.00 0.00 178.83 178.59 2g1h n GLN 80 N -4.47 1.82 -0.20 1.69 1.13 -0.37 -4.88 117.38 112.10 2g1h n GLN 80 Ca 0.11 -1.28 0.00 0.00 -1.94 0.00 0.00 57.00 53.90 2g1h n GLN 80 Cb 0.17 -1.28 0.00 0.00 0.11 0.00 0.00 30.24 29.25 2g1h n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g1h n GLY 81 N 1.07 0.90 3.77 1.08 0.00 -0.61 -5.05 105.19 106.34 2g1h n GLY 81 Ca 0.12 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 2g1h n GLY 81 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2g1h s GLY 82 N -2.03 2.95 0.51 -0.02 0.00 0.44 -5.00 107.32 104.17 2g1h s GLY 82 Ca 0.00 1.24 -0.18 0.00 0.00 0.00 0.00 44.72 45.77 2g1h s GLY 82 CO 0.00 1.84 1.02 0.54 0.00 0.00 0.00 173.10 176.50 2g1h s LYS 83 N -2.10 3.77 0.44 2.90 1.02 -1.26 -4.62 119.74 119.89 2g1h s LYS 83 Ca 0.54 1.19 -0.25 0.00 0.02 0.00 0.00 55.97 57.47 2g1h s LYS 83 Cb -0.38 -2.10 -0.08 0.00 -0.52 0.00 0.00 37.83 34.75 2g1h s LYS 83 CO 0.50 -0.44 1.35 0.00 -0.92 0.00 0.00 175.35 175.84 2g1h s ALA 84 N -2.29 3.17 0.78 5.17 0.00 -1.26 -5.00 121.76 122.33 2g1h s ALA 84 Ca 0.63 1.31 -0.11 0.00 0.00 0.00 0.00 51.96 53.80 2g1h s ALA 84 Cb -0.14 -3.53 0.06 0.00 0.00 0.00 0.00 23.12 19.52 2g1h s ALA 84 CO 0.26 -1.02 1.09 -1.25 0.00 0.00 0.00 175.76 174.84 2g1h s PRO 85 N -2.44 2.19 0.35 0.00 0.04 -1.26 -4.95 135.00 128.93 2g1h s PRO 85 Ca 0.61 1.16 0.13 0.00 0.04 0.00 0.00 61.00 62.94 2g1h s PRO 85 Cb -0.40 -1.89 0.64 0.00 0.04 0.00 0.00 34.50 32.89 2g1h s PRO 85 CO 0.50 -1.69 1.76 0.00 0.04 0.00 0.00 177.00 177.61 2g1h h ALA 86 N -1.16 1.20 -2.95 8.56 0.00 -1.36 -3.47 119.26 120.08 2g1h h ALA 86 Ca -0.44 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.06 2g1h h ALA 86 Cb 1.23 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.84 2g1h h ALA 86 CO 0.51 0.55 0.16 -1.64 0.00 0.00 0.00 179.25 178.82 2g1h s MET 87 N -3.94 1.31 0.08 0.00 -1.94 -1.26 -4.33 119.30 109.22 2g1h s MET 87 Ca -0.02 -0.59 0.04 0.00 -1.71 0.00 0.00 55.69 53.41 2g1h s MET 87 Cb 0.13 0.57 -0.03 0.00 2.01 0.00 0.00 34.83 37.51 2g1h s MET 87 CO 0.72 -0.57 -0.11 -1.64 -0.01 0.00 0.00 175.02 173.42 2g1h s MET 88 N -3.78 0.79 -0.01 2.03 1.00 0.02 -1.84 119.30 117.51 2g1h s MET 88 Ca 0.03 -1.03 -0.21 0.00 0.00 0.00 0.00 55.69 54.48 2g1h s MET 88 Cb -0.01 -0.58 0.04 0.00 0.00 0.00 0.00 34.83 34.28 2g1h s MET 88 CO -0.10 0.11 0.45 0.00 0.00 0.00 0.00 175.02 175.48 2g1h s ALA 89 N -1.92 -1.15 0.03 3.03 0.00 -0.88 -1.20 121.76 119.66 2g1h s ALA 89 Ca 0.01 0.63 0.01 0.00 0.00 0.00 0.00 51.96 52.60 2g1h s ALA 89 Cb -0.06 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 2g1h s ALA 89 CO 0.01 -0.35 -0.04 0.20 0.00 0.00 0.00 175.76 175.58 2g1h s GLY 90 N -1.47 0.31 -0.61 0.00 0.00 -1.26 -1.60 107.32 102.70 2g1h s GLY 90 Ca -0.11 -0.65 -0.22 0.00 0.00 0.00 0.00 44.72 43.74 2g1h s GLY 90 CO 0.04 -0.72 0.90 -1.58 0.00 0.00 0.00 173.10 171.74 2g1h s HIS 91 N -1.50 2.78 0.00 1.90 2.46 0.06 -3.23 115.29 117.76 2g1h s HIS 91 Ca -0.14 -0.43 0.00 0.00 0.47 0.00 0.00 55.06 54.96 2g1h s HIS 91 Cb -0.10 -4.12 0.00 0.00 -0.13 0.00 0.00 32.58 28.24 2g1h s HIS 91 CO -0.01 -1.46 0.00 0.45 -2.47 0.00 0.00 174.74 171.25 2g1h n SER 92 N 7.34 0.00 -0.35 9.88 2.88 -1.26 -1.68 113.62 130.43 2g1h n SER 92 Ca -0.03 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.63 2g1h n SER 92 Cb 0.46 0.00 0.31 0.00 -0.75 0.00 0.00 64.21 64.22 2g1h n SER 92 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2g1h h LEU 93 N 0.00 0.81 -2.24 2.46 7.12 -1.89 -1.48 115.31 120.09 2g1h h LEU 93 Ca 0.00 0.08 0.05 0.00 0.13 0.00 0.00 57.88 58.14 2g1h h LEU 93 Cb 0.00 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.06 2g1h h LEU 93 CO 0.00 0.32 0.21 1.23 -0.13 0.00 0.00 178.44 180.07 2g1h h GLY 94 N 0.81 0.00 1.29 3.75 0.00 -1.38 -0.17 103.07 107.38 2g1h h GLY 94 Ca 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.86 2g1h h GLY 94 CO -0.35 0.00 0.28 -2.09 0.00 0.00 0.00 176.54 174.38 2g1h h GLU 95 N 0.00 0.92 -0.44 4.80 4.81 -1.23 -0.95 114.58 122.48 2g1h h GLU 95 Ca 0.08 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 2g1h h GLU 95 Cb 0.50 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 2g1h h GLU 95 CO -0.00 0.73 0.12 1.88 -0.73 0.00 0.00 179.01 181.01 2g1h h TYR 96 N 0.91 0.72 -0.43 0.92 -1.99 -1.16 -1.58 116.97 114.35 2g1h h TYR 96 Ca 0.22 -0.08 0.06 0.00 2.00 0.00 0.00 58.73 60.92 2g1h h TYR 96 Cb 0.14 -0.21 -0.05 0.00 2.00 0.00 0.00 36.73 38.61 2g1h h TYR 96 CO 0.01 0.67 0.14 0.77 -0.00 0.00 0.00 178.16 179.75 2g1h h SER 97 N 0.57 0.14 -0.73 3.88 0.02 -1.38 -0.50 113.55 115.54 2g1h h SER 97 Ca 0.14 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.16 2g1h h SER 97 Cb 0.30 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.84 2g1h h SER 97 CO -0.00 0.11 0.47 0.00 -1.14 0.00 0.00 176.83 176.27 2g1h h ALA 98 N 1.29 0.95 -0.15 3.77 0.00 -0.96 -1.08 119.26 123.09 2g1h h ALA 98 Ca 0.20 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 2g1h h ALA 98 Cb 0.21 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2g1h h ALA 98 CO -0.22 0.29 -0.31 -0.07 0.00 0.00 0.00 179.25 178.94 2g1h h LEU 99 N 0.94 0.29 -0.24 0.00 3.38 -0.55 0.12 115.31 119.26 2g1h h LEU 99 Ca 0.29 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 2g1h h LEU 99 Cb -0.03 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2g1h h LEU 99 CO -0.09 0.60 -0.11 0.58 0.09 0.00 0.00 178.44 179.50 2g1h h VAL 100 N 0.26 1.30 0.00 1.22 2.07 -0.59 0.20 116.25 120.71 2g1h h VAL 100 Ca 0.04 -1.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.32 2g1h h VAL 100 Cb 0.68 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 2g1h h VAL 100 CO 0.05 0.37 -0.25 0.00 0.02 0.00 0.00 177.57 177.75 2g1h n ALA 102 N -2.27 2.55 -0.66 0.00 0.00 0.35 -4.92 120.51 115.57 2g1h n ALA 102 Ca -0.00 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.96 2g1h n ALA 102 Cb 0.41 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.73 2g1h n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g1h n GLY 103 N 1.14 0.63 0.11 0.00 0.00 -0.61 -0.52 105.19 105.94 2g1h n GLY 103 Ca 0.18 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 2g1h n GLY 103 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2g1h h VAL 104 N 0.00 1.29 -3.77 1.61 2.07 -0.81 -3.41 116.25 113.24 2g1h h VAL 104 Ca 0.00 -2.41 -0.68 0.00 0.82 0.00 0.00 66.70 64.43 2g1h h VAL 104 Cb 0.00 2.92 -0.28 0.00 -1.52 0.00 0.00 31.29 32.40 2g1h h VAL 104 CO 0.00 0.65 -0.83 -0.63 0.02 0.00 0.00 177.57 176.78 2g1h s ILE 105 N -2.41 2.55 0.28 4.57 1.01 -1.16 -0.58 121.20 125.47 2g1h s ILE 105 Ca -0.19 -0.88 -0.30 0.00 0.00 0.00 0.00 60.65 59.29 2g1h s ILE 105 Cb 0.02 -1.99 -0.13 0.00 0.01 0.00 0.00 42.46 40.37 2g1h s ILE 105 CO 0.75 0.56 1.43 -0.67 0.00 0.00 0.00 174.94 177.01 2g1h n ASP 106 N 3.01 3.05 -0.01 3.58 2.03 -1.26 -4.39 116.55 122.57 2g1h n ASP 106 Ca -0.18 1.16 -0.09 0.00 0.52 0.00 0.00 54.79 56.21 2g1h n ASP 106 Cb 0.52 -1.49 -0.03 0.00 -0.72 0.00 0.00 41.12 39.41 2g1h n ASP 106 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2g1h h PHE 107 N 3.92 -0.35 -0.63 -0.67 3.57 -1.99 -0.08 116.94 120.72 2g1h h PHE 107 Ca -0.46 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 60.99 2g1h h PHE 107 Cb 1.26 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 40.16 2g1h h PHE 107 CO 0.55 -0.20 0.09 0.00 -2.23 0.00 0.00 178.31 176.52 2g1h h ALA 108 N 0.94 0.84 -0.70 2.41 0.00 -1.93 -0.87 119.26 119.95 2g1h h ALA 108 Ca 0.10 -0.27 0.13 0.00 0.00 0.00 0.00 54.91 54.86 2g1h h ALA 108 Cb 0.30 -0.24 -0.09 0.00 0.00 0.00 0.00 17.79 17.77 2g1h h ALA 108 CO -0.25 0.61 0.25 -0.44 0.00 0.00 0.00 179.25 179.43 2g1h h ASP 109 N 0.96 0.22 -0.08 0.00 3.32 -1.80 -2.15 116.42 116.89 2g1h h ASP 109 Ca 0.19 0.10 -0.14 0.00 0.02 0.00 0.00 57.03 57.20 2g1h h ASP 109 Cb 0.45 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 2g1h h ASP 109 CO 0.02 0.10 -0.42 0.00 -1.72 0.00 0.00 179.24 177.21 2g1h h ALA 110 N 1.51 0.80 -0.37 3.45 0.00 -0.03 0.90 119.26 125.51 2g1h h ALA 110 Ca 0.37 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2g1h h ALA 110 Cb 0.54 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2g1h h ALA 110 CO -0.38 0.65 0.21 0.28 0.00 0.00 0.00 179.25 180.01 2g1h h VAL 111 N 0.50 1.14 -0.42 0.00 2.07 -0.85 -0.30 116.25 118.38 2g1h h VAL 111 Ca 0.04 -0.35 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 2g1h h VAL 111 Cb 0.94 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2g1h h VAL 111 CO 0.08 0.14 -0.12 0.03 0.02 0.00 0.00 177.57 177.72 2g1h h ARG 112 N 0.48 0.82 -0.43 1.57 3.08 -1.16 -2.54 114.38 116.20 2g1h h ARG 112 Ca 0.13 -0.33 0.06 0.00 0.07 0.00 0.00 59.98 59.92 2g1h h ARG 112 Cb 0.04 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 2g1h h ARG 112 CO -0.02 0.95 0.12 1.25 -1.07 0.00 0.00 179.97 181.20 2g1h h LEU 113 N 0.64 0.08 -0.01 3.04 5.85 -0.53 -2.04 115.31 122.35 2g1h h LEU 113 Ca 0.10 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 2g1h h LEU 113 Cb 0.66 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2g1h h LEU 113 CO 0.05 0.08 -0.44 -0.37 -0.34 0.00 0.00 178.44 177.42 2g1h h VAL 114 N 0.27 0.75 -0.03 1.05 -1.51 -0.99 0.57 116.25 116.35 2g1h h VAL 114 Ca 0.21 -2.06 0.01 0.00 -1.23 0.00 0.00 66.70 63.63 2g1h h VAL 114 Cb 0.23 2.37 -0.01 0.00 -2.13 0.00 0.00 31.29 31.75 2g1h h VAL 114 CO -0.24 0.43 -0.02 -0.08 -1.23 0.00 0.00 177.57 176.42 2g1h h GLU 115 N 0.00 -0.02 -0.62 5.19 4.81 -1.26 -1.11 114.58 121.58 2g1h h GLU 115 Ca -0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2g1h h GLU 115 Cb 1.33 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.69 2g1h h GLU 115 CO 0.06 -0.01 0.26 0.52 -0.73 0.00 0.00 179.01 179.11 2g1h h MET 116 N -0.02 0.91 -0.56 1.92 2.86 -1.01 -1.82 114.93 117.21 2g1h h MET 116 Ca 0.02 -0.16 0.11 0.00 -2.06 0.00 0.00 59.70 57.62 2g1h h MET 116 Cb 0.05 -0.15 -0.11 0.00 0.06 0.00 0.00 31.60 31.45 2g1h h MET 116 CO -0.05 0.76 -0.12 -0.09 1.06 0.00 0.00 176.91 178.47 2g1h h ARG 117 N 0.85 0.01 -0.81 1.72 2.43 -0.81 0.62 114.38 118.40 2g1h h ARG 117 Ca 0.21 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.33 2g1h h ARG 117 Cb 0.18 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 2g1h h ARG 117 CO -0.02 0.01 0.34 0.78 -1.51 0.00 0.00 179.97 179.57 2g1h h GLY 118 N 0.01 1.29 0.84 2.80 0.00 -0.77 -0.50 103.07 106.75 2g1h h GLY 118 Ca 0.27 -0.68 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 2g1h h GLY 118 CO -0.57 0.65 0.04 0.50 0.00 0.00 0.00 176.54 177.16 2g1h h LYS 119 N 1.17 0.29 -0.78 4.80 1.57 -0.73 0.28 116.57 123.17 2g1h h LYS 119 Ca 0.27 -0.07 0.06 0.00 -1.87 0.00 0.00 60.65 59.04 2g1h h LYS 119 Cb 0.19 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.40 2g1h h LYS 119 CO -0.03 0.43 0.47 0.74 -0.57 0.00 0.00 179.45 180.50 2g1h h PHE 120 N 0.10 0.87 -0.32 -1.35 0.04 -0.69 -1.90 116.94 113.69 2g1h h PHE 120 Ca 0.06 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.83 2g1h h PHE 120 Cb 0.27 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.13 2g1h h PHE 120 CO 0.01 0.44 0.11 0.52 -0.60 0.00 0.00 178.31 178.79 2g1h h MET 121 N 0.87 0.50 -0.41 1.51 2.86 -0.95 -2.76 114.93 116.54 2g1h h MET 121 Ca 0.34 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.85 2g1h h MET 121 Cb 0.16 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 2g1h h MET 121 CO -0.17 0.53 0.16 0.37 1.06 0.00 0.00 176.91 178.85 2g1h h GLN 122 N 0.37 0.58 -0.02 1.72 5.75 -0.45 -2.59 115.11 120.47 2g1h h GLN 122 Ca 0.10 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2g1h h GLN 122 Cb 0.23 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.67 2g1h h GLN 122 CO -0.00 0.49 -0.03 -0.85 -2.65 0.00 0.00 178.83 175.79 2g1h n GLU 123 N -4.37 1.72 -0.03 1.69 0.28 -0.76 -4.47 120.64 114.70 2g1h n GLU 123 Ca 0.03 -1.11 -0.09 0.00 -0.16 0.00 0.00 57.16 55.83 2g1h n GLU 123 Cb 0.15 -1.48 -0.03 0.00 1.43 0.00 0.00 31.44 31.51 2g1h n GLU 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2g1h h ALA 124 N 4.36 0.15 -2.73 -1.84 0.00 -1.17 -3.43 119.26 114.61 2g1h h ALA 124 Ca 0.00 0.05 -0.28 0.00 0.00 0.00 0.00 54.91 54.68 2g1h h ALA 124 Cb 0.60 0.08 -0.18 0.00 0.00 0.00 0.00 17.79 18.28 2g1h h ALA 124 CO 0.00 -0.44 -0.72 0.14 0.00 0.00 0.00 179.25 178.23 2g1h s VAL 125 N -6.19 0.75 0.26 0.00 -7.23 -1.26 -4.99 120.40 101.74 2g1h s VAL 125 Ca -0.13 -1.56 -0.30 0.00 -1.81 0.00 0.00 61.98 58.18 2g1h s VAL 125 Cb 0.09 -1.23 -0.13 0.00 0.56 0.00 0.00 36.38 35.67 2g1h s VAL 125 CO 0.68 -0.59 1.34 -2.65 -0.31 0.00 0.00 175.10 173.56 2g1h n PRO 126 N 0.66 1.94 -1.53 4.82 -0.02 -1.26 -4.90 135.00 134.72 2g1h n PRO 126 Ca -0.17 0.69 -0.52 0.00 -2.02 0.00 0.00 63.50 61.48 2g1h n PRO 126 Cb 0.58 -2.30 -0.05 0.00 -0.02 0.00 0.00 33.50 31.71 2g1h n PRO 126 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2g1h n GLU 127 N 1.60 0.63 -0.13 -0.52 -0.58 -1.26 -1.10 120.64 119.28 2g1h n GLU 127 Ca 0.10 0.23 0.00 0.00 -0.42 0.00 0.00 57.16 57.07 2g1h n GLU 127 Cb 0.32 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.54 2g1h n GLU 127 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2g1h n GLY 128 N 1.91 0.76 0.14 0.62 0.00 -1.26 -4.90 105.19 102.45 2g1h n GLY 128 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 2g1h n GLY 128 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2g1h h THR 129 N 0.00 0.81 -1.64 2.61 2.02 -1.46 -3.46 112.91 111.80 2g1h h THR 129 Ca 0.00 -2.46 -0.48 0.00 0.77 0.00 0.00 66.41 64.25 2g1h h THR 129 Cb 0.00 2.65 -0.02 0.00 -1.74 0.00 0.00 68.15 69.04 2g1h h THR 129 CO 0.00 0.87 -0.38 -0.83 0.37 0.00 0.00 175.52 175.55 2g1h s GLY 130 N -5.31 1.93 0.11 2.16 0.00 -1.26 -1.17 107.32 103.79 2g1h s GLY 130 Ca -0.18 -1.73 -0.17 0.00 0.00 0.00 0.00 44.72 42.64 2g1h s GLY 130 CO 0.82 -1.59 0.41 0.00 0.00 0.00 0.00 173.10 172.74 2g1h s ALA 131 N -2.37 -0.98 0.10 3.20 0.00 -0.42 -4.41 121.76 116.88 2g1h s ALA 131 Ca 0.47 0.05 0.09 0.00 0.00 0.00 0.00 51.96 52.56 2g1h s ALA 131 Cb -0.06 0.63 -0.03 0.00 0.00 0.00 0.00 23.12 23.66 2g1h s ALA 131 CO 0.29 -0.61 -0.22 -1.64 0.00 0.00 0.00 175.76 173.57 2g1h s MET 132 N -3.54 1.20 -0.01 0.00 -1.94 -1.26 -2.30 119.30 111.45 2g1h s MET 132 Ca 0.01 -1.16 0.01 0.00 -1.71 0.00 0.00 55.69 52.84 2g1h s MET 132 Cb 0.01 -1.49 0.00 0.00 2.01 0.00 0.00 34.83 35.37 2g1h s MET 132 CO -0.10 0.35 -0.03 0.00 -0.01 0.00 0.00 175.02 175.23 2g1h s ALA 133 N -1.10 0.32 -0.27 3.03 0.00 0.23 -1.97 121.76 122.02 2g1h s ALA 133 Ca 0.08 -0.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.68 2g1h s ALA 133 Cb -0.10 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 22.89 2g1h s ALA 133 CO 0.04 0.04 0.96 0.00 0.00 0.00 0.00 175.76 176.80 2g1h s ALA 134 N 0.18 3.61 -0.27 0.00 0.00 0.38 -0.32 121.76 125.34 2g1h s ALA 134 Ca -0.02 -0.04 -0.17 0.00 0.00 0.00 0.00 51.96 51.73 2g1h s ALA 134 Cb -0.05 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2g1h s ALA 134 CO -0.00 -1.15 0.46 0.42 0.00 0.00 0.00 175.76 175.49 2g1h s ILE 135 N 3.19 5.10 -0.20 0.00 -1.09 0.19 -0.67 121.20 127.72 2g1h s ILE 135 Ca 0.40 0.73 -0.02 0.00 -2.23 0.00 0.00 60.65 59.54 2g1h s ILE 135 Cb -0.14 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 2g1h s ILE 135 CO 0.10 0.09 -0.10 -0.63 -1.23 0.00 0.00 174.94 173.16 2g1h s ILE 136 N 2.23 2.91 0.00 2.92 1.01 0.24 -2.01 121.20 128.49 2g1h s ILE 136 Ca 0.19 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 60.18 2g1h s ILE 136 Cb -0.16 -2.29 0.00 0.00 0.01 0.00 0.00 42.46 40.03 2g1h s ILE 136 CO 0.10 0.47 0.00 0.61 0.00 0.00 0.00 174.94 176.12 2g1h n GLY 137 N 4.62 0.90 3.13 6.18 0.00 -0.46 0.85 105.19 120.40 2g1h n GLY 137 Ca -0.19 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.04 2g1h n GLY 137 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2g1h s LEU 138 N -0.07 2.13 0.55 0.99 0.20 -1.26 -4.04 118.68 117.19 2g1h s LEU 138 Ca 0.00 -0.40 -0.19 0.00 0.69 0.00 0.00 54.13 54.23 2g1h s LEU 138 Cb 0.00 -0.60 -0.05 0.00 -0.43 0.00 0.00 46.19 45.10 2g1h s LEU 138 CO 0.00 0.06 1.11 1.51 -0.29 0.00 0.00 176.35 178.74 2g1h s ASP 139 N -0.93 5.74 0.29 3.68 -4.77 -1.26 -4.23 116.67 115.19 2g1h s ASP 139 Ca 0.02 2.09 0.03 0.00 -3.30 0.00 0.00 52.55 51.40 2g1h s ASP 139 Cb -0.07 -2.57 0.63 0.00 -1.09 0.00 0.00 42.92 39.82 2g1h s ASP 139 CO 0.01 -1.21 1.82 0.44 0.70 0.00 0.00 175.17 176.93 2g1h h ASP 140 N 1.05 0.87 -0.13 2.11 3.32 -2.00 -2.15 116.42 119.48 2g1h h ASP 140 Ca -0.49 0.06 -0.17 0.00 0.02 0.00 0.00 57.03 56.45 2g1h h ASP 140 Cb 1.25 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 40.70 2g1h h ASP 140 CO 0.57 0.42 -0.57 0.00 -1.72 0.00 0.00 179.24 177.93 2g1h h ALA 141 N 1.58 0.25 -0.13 3.45 0.00 -2.00 -2.36 119.26 120.05 2g1h h ALA 141 Ca 0.52 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2g1h h ALA 141 Cb 0.64 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2g1h h ALA 141 CO -0.30 0.48 0.07 0.77 0.00 0.00 0.00 179.25 180.27 2g1h h SER 142 N 0.28 0.15 -0.04 0.00 0.02 -1.77 -1.94 113.55 110.25 2g1h h SER 142 Ca -0.03 -0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.80 2g1h h SER 142 Cb 1.21 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 63.72 2g1h h SER 142 CO 0.12 0.13 -0.40 0.40 -1.14 0.00 0.00 176.83 175.93 2g1h h ILE 143 N 0.18 1.45 -0.96 3.27 2.04 -1.18 -1.30 117.51 120.99 2g1h h ILE 143 Ca 0.05 -1.88 0.05 0.00 1.00 0.00 0.00 64.86 64.08 2g1h h ILE 143 Cb 0.01 2.48 -0.06 0.00 -0.74 0.00 0.00 36.82 38.51 2g1h h ILE 143 CO -0.01 0.54 0.62 0.00 0.00 0.00 0.00 178.15 179.30 2g1h h ALA 144 N 0.37 1.31 -0.31 1.87 0.00 -1.08 0.04 119.26 121.46 2g1h h ALA 144 Ca -0.04 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2g1h h ALA 144 Cb 1.09 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2g1h h ALA 144 CO 0.08 0.44 -0.11 -0.22 0.00 0.00 0.00 179.25 179.45 2g1h h LYS 145 N 1.16 0.61 -0.96 0.00 3.64 -1.33 -0.00 116.57 119.69 2g1h h LYS 145 Ca 0.40 -0.25 0.09 0.00 -1.27 0.00 0.00 60.65 59.63 2g1h h LYS 145 Cb 0.10 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 31.82 2g1h h LYS 145 CO -0.15 0.82 0.62 0.00 -2.27 0.00 0.00 179.45 178.47 2g1h h ALA 146 N 0.78 1.52 -0.19 5.00 0.00 -0.72 -0.38 119.26 125.28 2g1h h ALA 146 Ca 0.07 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 2g1h h ALA 146 Cb 0.61 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2g1h h ALA 146 CO 0.04 0.29 -0.34 0.00 0.00 0.00 0.00 179.25 179.23 2g1h h GLU 148 N 0.23 0.04 -0.12 0.00 5.08 -0.56 -1.62 114.58 117.62 2g1h h GLU 148 Ca 0.01 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 2g1h h GLU 148 Cb 0.94 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 2g1h h GLU 148 CO 0.08 0.03 -0.19 0.93 -1.00 0.00 0.00 179.01 178.86 2g1h h GLU 149 N 0.04 0.19 0.00 2.33 5.08 -1.03 -3.03 114.58 118.17 2g1h h GLU 149 Ca 0.13 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2g1h h GLU 149 Cb 0.18 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2g1h h GLU 149 CO -0.24 0.39 -0.70 0.00 -1.00 0.00 0.00 179.01 177.45 2g1h h ALA 150 N 1.63 0.60 0.64 3.43 0.00 -0.83 -3.38 119.26 121.35 2g1h h ALA 150 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2g1h h ALA 150 Cb 0.44 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.24 2g1h h ALA 150 CO 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 179.25 178.97 2g1h h ALA 151 N 2.24 -0.86 -6.24 0.00 0.00 -1.18 -3.45 119.26 109.77 2g1h h ALA 151 Ca 0.00 -0.20 -0.46 0.00 0.00 0.00 0.00 54.91 54.25 2g1h h ALA 151 Cb 0.88 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2g1h h ALA 151 CO 0.00 -0.95 -0.78 0.39 0.00 0.00 0.00 179.25 177.91 2g1h n GLU 152 N -5.44 -5.43 -0.45 0.00 -0.58 -1.26 -1.27 120.64 106.21 2g1h n GLU 152 Ca -0.13 0.61 0.00 0.00 -0.42 0.00 0.00 57.16 57.22 2g1h n GLU 152 Cb 0.36 -5.41 0.00 0.00 -0.57 0.00 0.00 31.44 25.82 2g1h n GLU 152 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2g1h n GLY 153 N -1.68 1.72 1.72 0.62 0.00 -1.26 -5.01 105.19 101.30 2g1h n GLY 153 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 2g1h n GLY 153 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2g1h n GLN 154 N -2.00 -0.15 -4.45 1.61 6.02 -0.40 -5.10 117.38 112.91 2g1h n GLN 154 Ca 0.00 -1.06 -0.34 0.00 -0.01 0.00 0.00 57.00 55.59 2g1h n GLN 154 Cb 0.00 -0.46 -0.14 0.00 1.02 0.00 0.00 30.24 30.66 2g1h n GLN 154 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2g1h s VAL 155 N -1.78 3.15 -0.21 5.09 1.01 -1.26 -4.79 120.40 121.61 2g1h s VAL 155 Ca 0.32 -0.60 -0.17 0.00 0.00 0.00 0.00 61.98 61.52 2g1h s VAL 155 Cb -0.01 -2.36 0.06 0.00 0.00 0.00 0.00 36.38 34.06 2g1h s VAL 155 CO 0.22 0.49 0.55 0.54 0.00 0.00 0.00 175.10 176.89 2g1h s VAL 156 N 0.74 -0.00 0.16 2.92 0.11 -1.26 -0.90 120.40 122.16 2g1h s VAL 156 Ca -0.05 0.01 -0.22 0.00 -2.93 0.00 0.00 61.98 58.80 2g1h s VAL 156 Cb -0.15 -0.77 0.07 0.00 -1.53 0.00 0.00 36.38 33.99 2g1h s VAL 156 CO 0.02 0.01 0.58 -0.94 -3.33 0.00 0.00 175.10 171.44 2g1h s SER 157 N 0.64 -0.54 0.19 3.54 1.04 -0.83 -4.63 113.70 113.10 2g1h s SER 157 Ca -0.03 -0.03 -0.32 0.00 0.48 0.00 0.00 55.95 56.05 2g1h s SER 157 Cb -0.05 0.59 -0.11 0.00 0.10 0.00 0.00 66.02 66.55 2g1h s SER 157 CO -0.04 -0.96 1.67 -2.84 0.98 0.00 0.00 173.24 172.05 2g1h s PRO 158 N -3.76 4.16 -0.00 4.02 0.02 -1.26 -1.87 135.00 136.31 2g1h s PRO 158 Ca 0.01 2.52 0.00 0.00 0.02 0.00 0.00 61.00 63.55 2g1h s PRO 158 Cb -0.01 -3.14 -0.00 0.00 0.02 0.00 0.00 34.50 31.37 2g1h s PRO 158 CO -0.13 -0.71 0.00 1.33 -0.33 0.00 0.00 177.00 177.17 2g1h n VAL 159 N 4.04 0.00 -3.89 3.83 0.24 0.18 -4.45 118.33 118.28 2g1h n VAL 159 Ca 0.15 -0.01 -0.27 0.00 -2.04 0.00 0.00 64.34 62.18 2g1h n VAL 159 Cb 0.37 0.07 -0.17 0.00 -1.47 0.00 0.00 33.84 32.64 2g1h n VAL 159 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2g1h s ASN 160 N -2.31 2.36 -0.67 -1.34 -0.87 -0.80 -0.80 114.94 110.52 2g1h s ASN 160 Ca -0.00 -0.41 -0.19 0.00 -1.57 0.00 0.00 52.86 50.69 2g1h s ASN 160 Cb 0.00 -0.84 0.12 0.00 -0.02 0.00 0.00 41.25 40.51 2g1h s ASN 160 CO 0.01 -0.15 0.79 -0.36 -2.57 0.00 0.00 177.10 174.83 2g1h s PHE 161 N 1.70 3.07 -0.22 2.20 0.08 -0.62 -0.83 117.98 123.36 2g1h s PHE 161 Ca 0.04 -1.10 -0.02 0.00 0.12 0.00 0.00 56.93 55.96 2g1h s PHE 161 Cb -0.13 -4.06 -0.20 0.00 -0.57 0.00 0.00 43.02 38.06 2g1h s PHE 161 CO -0.08 -1.32 -0.04 0.09 -0.10 0.00 0.00 175.22 173.77 2g1h n ASN 162 N 6.23 2.02 -3.77 1.36 3.02 -0.75 -0.69 115.26 122.69 2g1h n ASN 162 Ca -0.02 0.02 -0.07 0.00 -0.03 0.00 0.00 54.58 54.48 2g1h n ASN 162 Cb 0.44 -0.60 -0.02 0.00 -0.61 0.00 0.00 39.78 39.00 2g1h n ASN 162 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2g1h s SER 163 N -6.76 -0.23 -0.29 6.41 1.04 -0.88 -4.13 113.70 108.86 2g1h s SER 163 Ca -0.31 -0.66 -0.36 0.00 0.48 0.00 0.00 55.95 55.10 2g1h s SER 163 Cb 0.09 0.74 -0.12 0.00 0.10 0.00 0.00 66.02 66.82 2g1h s SER 163 CO 0.65 -1.38 2.04 -2.65 0.98 0.00 0.00 173.24 172.87 2g1h n PRO 164 N -0.47 1.30 -0.57 4.02 -0.02 -1.26 -0.61 135.00 137.39 2g1h n PRO 164 Ca -0.04 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2g1h n PRO 164 Cb 0.59 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 2g1h n PRO 164 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2g1h n GLY 165 N 5.64 0.73 2.63 -1.23 0.00 -1.26 -4.96 105.19 106.75 2g1h n GLY 165 Ca 0.35 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.09 2g1h n GLY 165 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2g1h s GLN 166 N -0.43 0.30 -0.02 1.61 -0.21 0.22 -1.36 119.66 119.77 2g1h s GLN 166 Ca 0.00 -0.37 0.00 0.00 0.02 0.00 0.00 55.36 55.01 2g1h s GLN 166 Cb 0.00 -1.74 0.02 0.00 1.00 0.00 0.00 33.01 32.29 2g1h s GLN 166 CO 0.00 -0.78 0.01 0.08 -2.12 0.00 0.00 175.29 172.47 2g1h s VAL 167 N 2.01 0.10 -0.13 1.09 1.01 -0.85 -1.80 120.40 121.83 2g1h s VAL 167 Ca 0.04 0.11 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 2g1h s VAL 167 Cb -0.16 -0.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.97 2g1h s VAL 167 CO -0.17 0.12 0.25 -0.69 0.00 0.00 0.00 175.10 174.60 2g1h s VAL 168 N 0.92 5.32 0.24 2.92 1.01 -0.01 0.55 120.40 131.36 2g1h s VAL 168 Ca -0.09 0.46 0.09 0.00 0.00 0.00 0.00 61.98 62.44 2g1h s VAL 168 Cb -0.12 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 2g1h s VAL 168 CO -0.02 0.49 0.02 0.27 0.00 0.00 0.00 175.10 175.86 2g1h s ILE 169 N -0.21 3.64 0.21 2.22 -4.36 0.56 0.51 121.20 123.78 2g1h s ILE 169 Ca 0.16 -1.73 -0.21 0.00 -0.26 0.00 0.00 60.65 58.61 2g1h s ILE 169 Cb -0.13 -2.92 0.04 0.00 1.25 0.00 0.00 42.46 40.70 2g1h s ILE 169 CO 0.05 -0.31 0.63 0.00 0.24 0.00 0.00 174.94 175.55 2g1h s ALA 170 N -2.15 -1.32 0.00 2.27 0.00 -0.78 -0.60 121.76 119.18 2g1h s ALA 170 Ca 0.31 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.30 2g1h s ALA 170 Cb -0.07 0.87 0.00 0.00 0.00 0.00 0.00 23.12 23.92 2g1h s ALA 170 CO 0.20 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.49 2g1h n GLY 171 N -0.40 0.14 3.72 0.00 0.00 -0.97 -1.97 105.19 105.71 2g1h n GLY 171 Ca -0.11 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 2g1h n GLY 171 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2g1h n HIS 172 N 9.00 2.70 -0.29 1.61 8.25 -0.08 -1.30 115.22 135.11 2g1h n HIS 172 Ca 0.00 0.24 0.01 0.00 -0.26 0.00 0.00 57.72 57.71 2g1h n HIS 172 Cb 0.00 -2.59 0.08 0.00 1.12 0.00 0.00 29.99 28.60 2g1h n HIS 172 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2g1h h LYS 173 N 5.14 -0.03 -0.67 -0.41 3.64 -1.36 -0.23 116.57 122.65 2g1h h LYS 173 Ca -0.46 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.86 2g1h h LYS 173 Cb 1.23 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.03 2g1h h LYS 173 CO 0.82 -0.02 0.16 0.93 -2.27 0.00 0.00 179.45 179.08 2g1h h GLU 174 N -0.03 1.07 -0.18 1.90 3.07 -1.91 -1.23 114.58 117.27 2g1h h GLU 174 Ca 0.36 -0.26 -0.14 0.00 -0.50 0.00 0.00 59.36 58.83 2g1h h GLU 174 Cb 0.59 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2g1h h GLU 174 CO -0.84 0.95 -0.48 0.00 -1.40 0.00 0.00 179.01 177.25 2g1h h ALA 175 N 1.07 0.84 -0.29 3.43 0.00 -1.61 -1.78 119.26 120.92 2g1h h ALA 175 Ca 0.21 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 2g1h h ALA 175 Cb 0.37 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2g1h h ALA 175 CO 0.00 0.66 -0.19 0.28 0.00 0.00 0.00 179.25 180.00 2g1h h VAL 176 N 0.37 1.25 0.32 0.00 2.07 -0.63 0.15 116.25 119.77 2g1h h VAL 176 Ca 0.02 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 2g1h h VAL 176 Cb 0.98 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 2g1h h VAL 176 CO 0.09 0.38 -0.15 -0.33 0.02 0.00 0.00 177.57 177.58 2g1h h GLU 177 N 0.48 -0.41 -0.80 1.57 5.08 -0.96 -0.74 114.58 118.81 2g1h h GLU 177 Ca 0.08 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 2g1h h GLU 177 Cb 0.61 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.89 2g1h h GLU 177 CO 0.04 -0.27 0.48 0.00 -1.00 0.00 0.00 179.01 178.26 2g1h h ARG 178 N -0.44 0.84 -0.24 2.33 3.08 -1.06 -1.75 114.38 117.13 2g1h h ARG 178 Ca -0.04 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 59.84 2g1h h ARG 178 Cb 0.34 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 2g1h h ARG 178 CO 0.07 0.55 -0.31 0.00 -1.07 0.00 0.00 179.97 179.22 2g1h h ALA 179 N 1.39 0.36 -0.23 0.04 0.00 -0.87 -1.37 119.26 118.60 2g1h h ALA 179 Ca 0.36 -0.41 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2g1h h ALA 179 Cb 0.20 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.85 2g1h h ALA 179 CO -0.19 0.39 -0.35 0.78 0.00 0.00 0.00 179.25 179.88 2g1h h GLY 180 N 0.35 -0.45 0.60 0.00 0.00 -0.88 0.10 103.07 102.79 2g1h h GLY 180 Ca 0.03 0.44 0.08 0.00 0.00 0.00 0.00 47.33 47.87 2g1h h GLY 180 CO 0.07 -0.21 0.42 0.00 0.00 0.00 0.00 176.54 176.82 2g1h h ALA 181 N 0.46 1.04 -0.38 3.60 0.00 -1.06 -0.19 119.26 122.73 2g1h h ALA 181 Ca 0.12 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2g1h h ALA 181 Cb 0.56 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2g1h h ALA 181 CO -0.43 0.08 -0.21 0.00 0.00 0.00 0.00 179.25 178.68 2g1h h ALA 182 N 1.41 0.91 0.07 0.00 0.00 -0.77 0.20 119.26 121.07 2g1h h ALA 182 Ca 0.35 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2g1h h ALA 182 Cb 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2g1h h ALA 182 CO -0.22 0.62 -0.03 0.00 0.00 0.00 0.00 179.25 179.62 2g1h h LYS 184 N -0.14 0.06 0.00 0.00 1.79 -0.84 -0.50 116.57 116.94 2g1h h LYS 184 Ca -0.01 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2g1h h LYS 184 Cb 0.11 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.74 2g1h h LYS 184 CO 0.01 0.04 -0.15 0.00 -1.08 0.00 0.00 179.45 178.28 2g1h h ALA 185 N 1.57 1.73 -0.00 3.86 0.00 -0.18 -0.46 119.26 125.77 2g1h h ALA 185 Ca 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2g1h h ALA 185 Cb 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2g1h h ALA 185 CO -0.55 0.18 -0.17 0.00 0.00 0.00 0.00 179.25 178.71 2g1h n ALA 186 N -2.50 2.85 0.00 0.00 0.00 0.81 -4.89 120.51 116.77 2g1h n ALA 186 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2g1h n ALA 186 Cb 0.22 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2g1h n ALA 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g1h n GLY 187 N 1.35 1.54 3.77 0.00 0.00 -0.18 -5.06 105.19 106.61 2g1h n GLY 187 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2g1h n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g1h s ALA 188 N -2.00 3.55 0.13 4.61 0.00 -0.42 -4.80 121.76 122.84 2g1h s ALA 188 Ca 0.00 1.39 -0.12 0.00 0.00 0.00 0.00 51.96 53.23 2g1h s ALA 188 Cb 0.00 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 2g1h s ALA 188 CO 0.00 -0.82 1.50 -0.22 0.00 0.00 0.00 175.76 176.22 2g1h h LYS 189 N 3.54 0.87 -3.75 0.00 3.64 0.31 -3.42 116.57 117.76 2g1h h LYS 189 Ca -0.49 -0.40 -0.11 0.00 -1.27 0.00 0.00 60.65 58.38 2g1h h LYS 189 Cb 1.23 -0.01 -0.17 0.00 -0.41 0.00 0.00 32.23 32.87 2g1h h LYS 189 CO 0.67 1.04 -0.46 1.03 -2.27 0.00 0.00 179.45 179.47 2g1h s ARG 190 N -4.57 0.68 -0.42 1.90 0.52 -0.80 -4.99 118.95 111.26 2g1h s ARG 190 Ca -0.12 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.32 2g1h s ARG 190 Cb 0.11 0.27 0.13 0.00 0.52 0.00 0.00 34.95 35.98 2g1h s ARG 190 CO 0.85 -0.19 0.21 0.00 0.02 0.00 0.00 175.30 176.20 2g1h s ALA 191 N -2.95 2.20 -0.20 2.13 0.00 -1.26 -0.59 121.76 121.09 2g1h s ALA 191 Ca -0.02 -2.53 -0.22 0.00 0.00 0.00 0.00 51.96 49.20 2g1h s ALA 191 Cb 0.01 -1.88 -0.02 0.00 0.00 0.00 0.00 23.12 21.22 2g1h s ALA 191 CO -0.06 -2.00 0.66 -0.51 0.00 0.00 0.00 175.76 173.86 2g1h s LEU 192 N 0.49 4.15 0.12 0.00 1.43 0.15 -4.86 118.68 120.16 2g1h s LEU 192 Ca 0.16 0.88 -0.31 0.00 -1.03 0.00 0.00 54.13 53.84 2g1h s LEU 192 Cb -0.24 -2.95 -0.07 0.00 0.03 0.00 0.00 46.19 42.97 2g1h s LEU 192 CO -0.03 -0.30 1.31 -2.84 0.23 0.00 0.00 176.35 174.72 2g1h s PRO 193 N 1.98 4.38 0.23 1.29 0.02 -1.26 -0.47 135.00 141.17 2g1h s PRO 193 Ca 0.30 1.96 0.05 0.00 0.02 0.00 0.00 61.00 63.34 2g1h s PRO 193 Cb -0.16 -3.27 -0.03 0.00 0.02 0.00 0.00 34.50 31.06 2g1h s PRO 193 CO 0.11 -0.33 0.30 -0.51 -0.33 0.00 0.00 177.00 176.23 2g1h s LEU 194 N 0.82 4.15 -0.35 -5.54 1.02 -0.83 -4.95 118.68 113.00 2g1h s LEU 194 Ca 0.61 -0.03 -0.05 0.00 0.02 0.00 0.00 54.13 54.68 2g1h s LEU 194 Cb -0.34 -2.69 -0.05 0.00 0.02 0.00 0.00 46.19 43.12 2g1h s LEU 194 CO 0.31 -0.04 1.47 -0.81 0.02 0.00 0.00 176.35 177.30 2g1h n PRO 195 N -1.22 0.78 0.00 1.29 -0.04 -1.26 -4.67 135.00 129.88 2g1h n PRO 195 Ca -0.08 -0.93 0.00 0.00 -0.04 0.00 0.00 63.50 62.44 2g1h n PRO 195 Cb 0.57 -2.24 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 2g1h n PRO 195 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2g1h n VAL 196 N 4.94 0.00 0.00 0.52 3.14 -1.26 -4.93 118.33 120.73 2g1h n VAL 196 Ca 0.21 0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.63 2g1h n VAL 196 Cb 0.10 -0.23 0.00 0.00 -1.06 0.00 0.00 33.84 32.64 2g1h n VAL 196 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2g1h n SER 197 N 0.00 0.00 -4.48 6.55 2.88 -1.26 -4.95 113.62 112.36 2g1h n SER 197 Ca 0.00 0.00 -0.51 0.00 -1.33 0.00 0.00 58.87 57.03 2g1h n SER 197 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 2g1h n SER 197 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2g1h n VAL 198 N 0.00 0.23 -2.08 2.46 0.31 -1.26 -3.91 118.33 114.07 2g1h n VAL 198 Ca 0.00 -0.25 -0.42 0.00 -0.01 0.00 0.00 64.34 63.66 2g1h n VAL 198 Cb 0.00 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.26 2g1h n VAL 198 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2g1h n PRO 199 N 7.96 3.09 -1.87 5.55 -0.04 -1.26 -4.85 135.00 143.58 2g1h n PRO 199 Ca 0.39 -2.98 -0.36 0.00 -0.04 0.00 0.00 63.50 60.51 2g1h n PRO 199 Cb 0.24 -3.25 0.05 0.00 -0.04 0.00 0.00 33.50 30.50 2g1h n PRO 199 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2g1h s SER 200 N 2.96 4.89 -1.19 3.54 0.01 -1.26 -3.86 113.70 118.80 2g1h s SER 200 Ca 0.47 2.50 0.00 0.00 1.31 0.00 0.00 55.95 60.23 2g1h s SER 200 Cb 0.10 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2g1h s SER 200 CO -0.03 -1.80 0.00 1.41 0.41 0.00 0.00 173.24 173.22 2g1h n HIS 201 N -1.76 -0.23 -4.59 2.43 8.25 -0.77 -4.85 115.22 113.69 2g1h n HIS 201 Ca 0.15 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.33 2g1h n HIS 201 Cb 0.49 -2.43 -0.08 0.00 1.12 0.00 0.00 29.99 29.09 2g1h n HIS 201 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2g1h h ALA 203 N 1.66 1.29 0.00 0.00 0.00 -1.90 -0.34 119.26 119.96 2g1h h ALA 203 Ca -0.38 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2g1h h ALA 203 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2g1h h ALA 203 CO 0.63 -0.17 0.00 -0.07 0.00 0.00 0.00 179.25 179.64 2g1h h LEU 204 N 0.00 0.00 -1.26 0.00 3.38 -1.90 -2.01 115.31 113.51 2g1h h LEU 204 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2g1h h LEU 204 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2g1h h LEU 204 CO -0.00 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.76 2g1h n MET 205 N -2.41 1.86 -0.00 1.13 2.81 -0.14 -4.51 117.12 115.86 2g1h n MET 205 Ca 0.00 -1.26 -0.04 0.00 -1.81 0.00 0.00 57.70 54.60 2g1h n MET 205 Cb 0.15 -1.47 -0.02 0.00 -0.71 0.00 0.00 33.22 31.17 2g1h n MET 205 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 2g1h h LYS 206 N 2.95 -0.13 -0.55 0.03 3.11 -1.54 0.11 116.57 120.55 2g1h h LYS 206 Ca 0.00 0.01 0.15 0.00 -2.81 0.00 0.00 60.65 58.00 2g1h h LYS 206 Cb 0.63 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.87 2g1h h LYS 206 CO 0.00 -0.09 0.39 -1.35 -2.81 0.00 0.00 179.45 175.59 2g1h h PRO 207 N -0.14 0.06 -0.56 1.90 0.11 -1.84 1.33 132.00 132.86 2g1h h PRO 207 Ca 0.01 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 2g1h h PRO 207 Cb 0.16 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 2g1h h PRO 207 CO -0.11 0.04 0.14 0.00 -0.21 0.00 0.00 178.00 177.86 2g1h h ALA 208 N 1.73 0.74 -0.62 -0.75 0.00 -1.74 -2.84 119.26 115.77 2g1h h ALA 208 Ca 0.26 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2g1h h ALA 208 Cb 0.95 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2g1h h ALA 208 CO -0.02 0.44 0.20 0.00 0.00 0.00 0.00 179.25 179.88 2g1h h ALA 209 N 1.02 1.18 -0.33 0.00 0.00 0.43 0.45 119.26 122.02 2g1h h ALA 209 Ca 0.18 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2g1h h ALA 209 Cb 0.34 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2g1h h ALA 209 CO 0.00 0.57 -0.15 -0.44 0.00 0.00 0.00 179.25 179.24 2g1h h ASP 210 N 0.91 0.57 -0.28 0.00 3.32 -1.07 0.49 116.42 120.37 2g1h h ASP 210 Ca 0.21 -0.17 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 2g1h h ASP 210 Cb 0.25 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 2g1h h ASP 210 CO -0.01 0.74 -0.29 0.11 -1.72 0.00 0.00 179.24 178.07 2g1h h LYS 211 N 0.53 0.69 -0.91 3.56 1.57 -1.14 -3.13 116.57 117.75 2g1h h LYS 211 Ca 0.09 -0.37 0.02 0.00 -1.87 0.00 0.00 60.65 58.53 2g1h h LYS 211 Cb 0.56 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.84 2g1h h LYS 211 CO 0.04 0.98 0.59 1.25 -0.57 0.00 0.00 179.45 181.74 2g1h h LEU 212 N 0.43 1.00 -0.91 2.94 5.85 -0.46 -2.32 115.31 121.85 2g1h h LEU 212 Ca 0.04 -0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.85 2g1h h LEU 212 Cb 0.86 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 41.58 2g1h h LEU 212 CO 0.07 0.70 0.54 0.00 -0.34 0.00 0.00 178.44 179.42 2g1h h ALA 213 N 1.36 1.33 -0.66 1.25 0.00 -0.86 0.93 119.26 122.60 2g1h h ALA 213 Ca 0.35 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 2g1h h ALA 213 Cb -0.05 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2g1h h ALA 213 CO -0.10 0.16 0.12 0.28 0.00 0.00 0.00 179.25 179.71 2g1h h VAL 214 N 0.89 1.26 -0.34 0.00 2.07 -1.38 -2.02 116.25 116.72 2g1h h VAL 214 Ca 0.44 -1.01 -0.16 0.00 0.82 0.00 0.00 66.70 66.80 2g1h h VAL 214 Cb 0.41 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2g1h h VAL 214 CO -0.26 0.38 -0.40 -0.33 0.02 0.00 0.00 177.57 176.99 2g1h h GLU 215 N 1.01 0.87 -0.41 1.57 4.39 -1.12 -3.17 114.58 117.72 2g1h h GLU 215 Ca 0.20 -0.48 -0.01 0.00 0.34 0.00 0.00 59.36 59.41 2g1h h GLU 215 Cb 0.42 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.07 2g1h h GLU 215 CO 0.01 1.12 0.20 -0.07 -1.16 0.00 0.00 179.01 179.11 2g1h h LEU 216 N 0.67 0.51 -1.81 1.33 3.38 -0.57 -1.88 115.31 116.94 2g1h h LEU 216 Ca 0.05 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2g1h h LEU 216 Cb 0.99 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 2g1h h LEU 216 CO 0.10 0.43 -0.14 0.00 0.09 0.00 0.00 178.44 178.92 2g1h h ALA 217 N 1.65 1.28 0.00 1.53 0.00 -1.34 -1.63 119.26 120.75 2g1h h ALA 217 Ca 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2g1h h ALA 217 Cb 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2g1h h ALA 217 CO -0.02 0.17 0.00 1.63 0.00 0.00 0.00 179.25 181.03 2g1h n LYS 218 N -3.67 0.13 -4.26 0.00 5.02 -0.71 -4.82 118.16 109.86 2g1h n LYS 218 Ca -0.02 0.15 -0.34 0.00 -2.02 0.00 0.00 58.31 56.08 2g1h n LYS 218 Cb 0.26 -1.66 -0.10 0.00 -0.02 0.00 0.00 35.03 33.51 2g1h n LYS 218 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2g1h s ILE 219 N -3.07 4.36 0.17 -0.18 -1.09 -0.61 -5.07 121.20 115.70 2g1h s ILE 219 Ca 0.11 -0.20 -0.31 0.00 -2.23 0.00 0.00 60.65 58.02 2g1h s ILE 219 Cb 0.14 -2.90 -0.09 0.00 -1.58 0.00 0.00 42.46 38.03 2g1h s ILE 219 CO 0.52 0.53 1.49 -0.89 -1.23 0.00 0.00 174.94 175.35 2g1h s THR 220 N -0.12 2.83 -0.14 2.92 2.01 -1.26 -5.01 115.64 116.87 2g1h s THR 220 Ca 0.05 0.62 -0.01 0.00 0.31 0.00 0.00 61.69 62.65 2g1h s THR 220 Cb -0.13 -3.39 -0.01 0.00 0.01 0.00 0.00 72.50 68.98 2g1h s THR 220 CO 0.02 0.06 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.53 2g1h s PHE 221 N 0.88 2.84 0.32 4.92 0.40 -1.26 -4.57 117.98 121.50 2g1h s PHE 221 Ca 0.66 -0.67 0.07 0.00 -0.60 0.00 0.00 56.93 56.39 2g1h s PHE 221 Cb -0.41 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.22 2g1h s PHE 221 CO 0.33 -0.24 0.31 -0.80 0.70 0.00 0.00 175.22 175.53 2g1h s ASN 222 N 0.46 5.51 0.31 1.36 0.01 0.25 -4.74 114.94 118.11 2g1h s ASN 222 Ca -0.09 -0.37 -0.29 0.00 -0.71 0.00 0.00 52.86 51.41 2g1h s ASN 222 Cb -0.16 -1.14 -0.10 0.00 0.41 0.00 0.00 41.25 40.26 2g1h s ASN 222 CO 0.04 -0.30 1.36 0.00 -1.51 0.00 0.00 177.10 176.70 2g1h s ALA 223 N -2.23 3.54 0.39 0.60 0.00 -1.26 -4.40 121.76 118.40 2g1h s ALA 223 Ca 0.40 1.32 -0.26 0.00 0.00 0.00 0.00 51.96 53.41 2g1h s ALA 223 Cb -0.07 -3.52 -0.09 0.00 0.00 0.00 0.00 23.12 19.45 2g1h s ALA 223 CO 0.27 -0.72 1.24 -1.25 0.00 0.00 0.00 175.76 175.30 2g1h s PRO 224 N -1.44 4.06 0.10 0.00 0.04 -1.26 -4.56 135.00 131.93 2g1h s PRO 224 Ca 0.52 2.02 0.23 0.00 0.04 0.00 0.00 61.00 63.82 2g1h s PRO 224 Cb -0.41 -2.77 0.17 0.00 0.04 0.00 0.00 34.50 31.53 2g1h s PRO 224 CO 0.52 -0.37 1.15 0.25 0.04 0.00 0.00 177.00 178.58 2g1h n THR 225 N 0.20 0.32 -4.01 1.26 -2.24 0.32 -4.84 114.28 105.29 2g1h n THR 225 Ca 0.03 -0.31 -0.12 0.00 -2.27 0.00 0.00 64.05 61.38 2g1h n THR 225 Cb 0.45 -0.04 -0.13 0.00 -2.10 0.00 0.00 70.33 68.51 2g1h n THR 225 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2g1h s VAL 226 N -3.22 0.25 0.27 2.28 -7.23 -1.26 -5.12 120.40 106.38 2g1h s VAL 226 Ca 0.04 -0.53 -0.30 0.00 -1.81 0.00 0.00 61.98 59.37 2g1h s VAL 226 Cb 0.13 -0.29 -0.12 0.00 0.56 0.00 0.00 36.38 36.66 2g1h s VAL 226 CO 0.77 -0.18 1.60 -2.65 -0.31 0.00 0.00 175.10 174.33 2g1h n PRO 227 N 2.31 2.66 -4.04 4.82 -0.02 -1.26 -4.81 135.00 134.66 2g1h n PRO 227 Ca -0.18 0.95 -0.34 0.00 -2.02 0.00 0.00 63.50 61.92 2g1h n PRO 227 Cb 0.57 -2.73 -0.15 0.00 -0.02 0.00 0.00 33.50 31.17 2g1h n PRO 227 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2g1h s VAL 228 N 0.18 2.51 -0.31 -1.45 1.01 -1.26 -0.80 120.40 120.29 2g1h s VAL 228 Ca 0.66 -0.92 -0.28 0.00 0.00 0.00 0.00 61.98 61.44 2g1h s VAL 228 Cb -0.51 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 33.72 2g1h s VAL 228 CO 0.46 0.40 1.02 -0.69 0.00 0.00 0.00 175.10 176.29 2g1h s VAL 229 N 1.32 4.57 0.44 2.92 1.01 -0.34 -3.99 120.40 126.33 2g1h s VAL 229 Ca 0.03 1.65 -0.13 0.00 0.00 0.00 0.00 61.98 63.53 2g1h s VAL 229 Cb -0.15 -4.36 -0.07 0.00 0.00 0.00 0.00 36.38 31.80 2g1h s VAL 229 CO -0.09 -0.42 0.86 0.54 0.00 0.00 0.00 175.10 176.00 2g1h s ASN 230 N 1.61 6.59 0.23 3.32 6.03 0.04 -4.54 114.94 128.23 2g1h s ASN 230 Ca 0.43 1.33 -0.00 0.00 -1.03 0.00 0.00 52.86 53.59 2g1h s ASN 230 Cb -0.13 -2.41 0.25 0.00 -3.03 0.00 0.00 41.25 35.94 2g1h s ASN 230 CO 0.14 -0.46 1.60 0.78 -2.03 0.00 0.00 177.10 177.14 2g1h h ASN 231 N 1.22 0.53 0.17 3.54 2.35 -1.90 -1.02 115.58 120.47 2g1h h ASN 231 Ca -0.47 -0.24 -0.28 0.00 -0.55 0.00 0.00 56.30 54.76 2g1h h ASN 231 Cb 1.19 -0.15 0.02 0.00 0.05 0.00 0.00 38.32 39.42 2g1h h ASN 231 CO 0.63 0.89 -1.31 1.62 -1.65 0.00 0.00 177.43 177.61 2g1h h VAL 232 N 0.41 1.22 -0.00 2.81 3.04 -1.86 -1.38 116.25 120.48 2g1h h VAL 232 Ca 0.03 -2.53 0.00 0.00 -1.01 0.00 0.00 66.70 63.19 2g1h h VAL 232 Cb 0.91 2.95 0.00 0.00 -2.01 0.00 0.00 31.29 33.14 2g1h h VAL 232 CO 0.08 0.76 -0.30 0.47 -1.01 0.00 0.00 177.57 177.56 2g1h n ASP 233 N -3.88 0.56 -3.69 3.17 8.00 -1.25 -4.85 116.55 114.59 2g1h n ASP 233 Ca -0.20 -0.78 -0.23 0.00 0.71 0.00 0.00 54.79 54.29 2g1h n ASP 233 Cb 0.95 0.85 0.05 0.00 -0.02 0.00 0.00 41.12 42.95 2g1h n ASP 233 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2g1h n VAL 234 N -0.93 -3.86 -4.60 2.53 0.31 -0.39 -4.99 118.33 106.39 2g1h n VAL 234 Ca 0.02 -0.29 -0.26 0.00 -0.01 0.00 0.00 64.34 63.80 2g1h n VAL 234 Cb 0.13 -3.78 -0.14 0.00 -0.91 0.00 0.00 33.84 29.14 2g1h n VAL 234 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2g1h s LYS 235 N -6.09 1.41 -0.93 5.55 1.02 -1.25 -4.79 119.74 114.66 2g1h s LYS 235 Ca 0.27 -1.04 -0.15 0.00 0.02 0.00 0.00 55.97 55.08 2g1h s LYS 235 Cb -0.13 -1.59 0.20 0.00 -0.52 0.00 0.00 37.83 35.79 2g1h s LYS 235 CO 0.79 0.40 0.97 0.00 -0.92 0.00 0.00 175.35 176.59 2g1h s GLU 237 N 0.76 4.04 0.00 0.00 0.41 -1.26 -4.91 118.70 117.74 2g1h s GLU 237 Ca 0.26 1.14 0.00 0.00 -0.41 0.00 0.00 54.97 55.96 2g1h s GLU 237 Cb -0.08 -2.15 0.00 0.00 -1.78 0.00 0.00 34.13 30.12 2g1h s GLU 237 CO -0.08 -0.20 0.00 0.25 -0.49 0.00 0.00 175.26 174.74 2g1h n THR 238 N -0.97 0.00 -2.10 3.63 -2.24 -1.26 -4.74 114.28 106.60 2g1h n THR 238 Ca 0.07 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.43 2g1h n THR 238 Cb 0.54 0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.79 2g1h n THR 238 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2g1h s ASN 239 N -1.79 6.74 0.26 3.42 3.84 -1.26 -4.52 114.94 121.63 2g1h s ASN 239 Ca 0.00 2.21 -0.01 0.00 0.21 0.00 0.00 52.86 55.27 2g1h s ASN 239 Cb 0.00 -2.55 0.51 0.00 -0.55 0.00 0.00 41.25 38.66 2g1h s ASN 239 CO 0.00 -0.82 1.79 1.23 -2.79 0.00 0.00 177.10 176.51 2g1h h GLY 240 N 9.06 1.44 2.00 1.21 0.00 -1.85 0.51 103.07 115.43 2g1h h GLY 240 Ca -0.39 -0.32 -0.11 0.00 0.00 0.00 0.00 47.33 46.52 2g1h h GLY 240 CO 0.93 0.06 -0.52 -0.55 0.00 0.00 0.00 176.54 176.46 2g1h h ASP 241 N 0.77 0.00 0.21 0.19 3.32 -1.90 -2.09 116.42 116.92 2g1h h ASP 241 Ca 0.46 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.35 2g1h h ASP 241 Cb 0.54 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 2g1h h ASP 241 CO -0.31 0.52 -0.60 0.00 -1.72 0.00 0.00 179.24 177.14 2g1h h ALA 242 N 1.48 0.76 -0.05 3.45 0.00 -1.36 -2.39 119.26 121.15 2g1h h ALA 242 Ca -0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 2g1h h ALA 242 Cb 1.29 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2g1h h ALA 242 CO 0.07 0.71 -0.02 0.82 0.00 0.00 0.00 179.25 180.83 2g1h h ILE 243 N 0.29 1.33 -0.68 0.00 2.04 -0.85 -1.67 117.51 117.97 2g1h h ILE 243 Ca -0.00 -1.02 0.10 0.00 1.00 0.00 0.00 64.86 64.94 2g1h h ILE 243 Cb 1.12 1.91 -0.12 0.00 -0.74 0.00 0.00 36.82 39.00 2g1h h ILE 243 CO 0.10 0.28 -0.41 0.03 0.00 0.00 0.00 178.15 178.15 2g1h h ARG 244 N -0.29 -0.15 0.00 2.37 3.08 -1.44 -0.44 114.38 117.51 2g1h h ARG 244 Ca 0.01 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 2g1h h ARG 244 Cb 0.46 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 2g1h h ARG 244 CO 0.01 -0.10 -0.06 0.22 -1.07 0.00 0.00 179.97 178.97 2g1h h ASP 245 N -0.16 0.00 0.91 7.04 3.58 -1.28 -1.36 116.42 125.15 2g1h h ASP 245 Ca 0.22 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.56 2g1h h ASP 245 Cb 0.56 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.59 2g1h h ASP 245 CO -0.75 0.06 -0.56 0.00 -2.88 0.00 0.00 179.24 175.10 2g1h h ALA 246 N 1.94 0.84 -0.12 -0.78 0.00 -0.15 -2.06 119.26 118.93 2g1h h ALA 246 Ca -0.00 -0.51 -0.20 0.00 0.00 0.00 0.00 54.91 54.19 2g1h h ALA 246 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2g1h h ALA 246 CO 0.01 0.70 -0.75 -0.07 0.00 0.00 0.00 179.25 179.14 2g1h h LEU 247 N 0.00 0.71 0.45 0.00 3.38 -0.14 -0.36 115.31 119.36 2g1h h LEU 247 Ca -0.01 -0.46 -0.02 0.00 0.09 0.00 0.00 57.88 57.48 2g1h h LEU 247 Cb 1.17 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2g1h h LEU 247 CO 0.07 1.23 -0.21 0.58 0.09 0.00 0.00 178.44 180.20 2g1h h VAL 248 N 0.41 0.56 -0.13 1.22 2.07 -1.29 -3.03 116.25 116.07 2g1h h VAL 248 Ca -0.04 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 2g1h h VAL 248 Cb 1.35 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2g1h h VAL 248 CO 0.14 0.01 -0.12 0.03 0.02 0.00 0.00 177.57 177.65 2g1h h ARG 249 N -0.62 0.19 -1.00 1.57 3.08 -1.39 -2.03 114.38 114.18 2g1h h ARG 249 Ca -0.06 -0.04 0.21 0.00 0.07 0.00 0.00 59.98 60.16 2g1h h ARG 249 Cb 0.47 -0.03 -0.11 0.00 0.08 0.00 0.00 29.97 30.38 2g1h h ARG 249 CO 0.10 0.32 0.61 0.37 -1.07 0.00 0.00 179.97 180.30 2g1h h GLN 250 N 0.19 0.65 0.00 0.04 4.15 -0.93 -2.64 115.11 116.57 2g1h h GLN 250 Ca 0.04 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.33 2g1h h GLN 250 Cb 0.32 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 2g1h h GLN 250 CO 0.02 0.43 -0.41 1.25 -1.93 0.00 0.00 178.83 178.19 2g1h h LEU 251 N 0.67 0.00 -3.02 -2.39 5.85 -1.36 -3.05 115.31 112.02 2g1h h LEU 251 Ca 0.60 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.32 2g1h h LEU 251 Cb 1.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.08 2g1h h LEU 251 CO -0.40 0.41 0.00 0.00 -0.34 0.00 0.00 178.44 178.11 2g1h n TYR 252 N -3.90 0.18 -4.34 1.25 4.11 -1.07 -1.85 117.16 111.54 2g1h n TYR 252 Ca -0.01 -0.73 -0.18 0.00 -0.00 0.00 0.00 57.90 56.97 2g1h n TYR 252 Cb 0.46 -0.12 -0.10 0.00 -0.00 0.00 0.00 39.34 39.58 2g1h n TYR 252 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.86 176.06 2g1h s ASN 253 N -1.81 2.54 0.48 9.48 0.01 -1.02 -3.74 114.94 120.88 2g1h s ASN 253 Ca 0.20 -1.00 -0.23 0.00 -0.71 0.00 0.00 52.86 51.12 2g1h s ASN 253 Cb 0.16 -0.13 -0.07 0.00 0.41 0.00 0.00 41.25 41.62 2g1h s ASN 253 CO 0.04 -0.17 1.28 -2.16 -1.51 0.00 0.00 177.10 174.59 2g1h s PRO 254 N -3.56 3.55 -0.32 -0.60 0.04 -1.22 -4.62 135.00 128.28 2g1h s PRO 254 Ca 0.21 2.06 -0.28 0.00 0.04 0.00 0.00 61.00 63.03 2g1h s PRO 254 Cb -0.01 -2.43 0.02 0.00 0.04 0.00 0.00 34.50 32.12 2g1h s PRO 254 CO 0.06 -0.80 1.04 0.08 0.04 0.00 0.00 177.00 177.42 2g1h s VAL 255 N -1.38 4.54 -1.30 -0.36 1.01 0.02 -4.54 120.40 118.39 2g1h s VAL 255 Ca 0.65 1.66 -0.08 0.00 0.00 0.00 0.00 61.98 64.22 2g1h s VAL 255 Cb -0.36 -4.39 0.14 0.00 0.00 0.00 0.00 36.38 31.78 2g1h s VAL 255 CO 0.44 -0.46 2.11 0.00 0.00 0.00 0.00 175.10 177.19 2g1h n GLN 256 N 6.79 4.04 -0.04 2.72 1.13 -0.52 -1.58 117.38 129.93 2g1h n GLN 256 Ca 0.11 -3.48 -0.14 0.00 -1.94 0.00 0.00 57.00 51.55 2g1h n GLN 256 Cb 0.47 -2.79 -0.09 0.00 0.11 0.00 0.00 30.24 27.94 2g1h n GLN 256 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 2g1h h TRP 257 N 5.24 0.26 -0.53 1.08 2.91 -1.69 -1.65 115.95 121.58 2g1h h TRP 257 Ca 0.53 -0.10 0.10 0.00 1.13 0.00 0.00 58.89 60.56 2g1h h TRP 257 Cb 0.48 -0.05 -0.11 0.00 -0.51 0.00 0.00 29.16 28.98 2g1h h TRP 257 CO 1.41 0.73 -0.26 1.15 -1.03 0.00 0.00 178.44 180.45 2g1h h THR 258 N -0.29 0.28 0.00 2.65 2.02 -1.06 -0.68 112.91 115.83 2g1h h THR 258 Ca 0.00 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.08 2g1h h THR 258 Cb 0.72 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 2g1h h THR 258 CO 0.03 0.00 -0.51 0.11 0.37 0.00 0.00 175.52 175.52 2g1h h LYS 259 N -0.13 0.00 -0.34 6.66 1.57 -1.83 -2.05 116.57 120.45 2g1h h LYS 259 Ca 0.23 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.92 2g1h h LYS 259 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2g1h h LYS 259 CO -0.61 0.51 -0.17 0.77 -0.57 0.00 0.00 179.45 179.38 2g1h h SER 260 N 0.00 0.73 -0.71 0.86 0.02 -0.36 0.35 113.55 114.44 2g1h h SER 260 Ca -0.01 -0.41 -0.05 0.00 -0.84 0.00 0.00 61.79 60.49 2g1h h SER 260 Cb 1.00 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.30 2g1h h SER 260 CO 0.07 0.98 0.27 0.58 -1.14 0.00 0.00 176.83 177.59 2g1h h VAL 261 N 0.48 1.25 -0.67 2.27 2.07 -1.01 -1.49 116.25 119.15 2g1h h VAL 261 Ca 0.07 -0.81 -0.06 0.00 0.82 0.00 0.00 66.70 66.72 2g1h h VAL 261 Cb 0.71 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 2g1h h VAL 261 CO 0.05 0.33 0.17 -0.33 0.02 0.00 0.00 177.57 177.81 2g1h h GLU 262 N 1.06 1.05 -0.31 1.57 5.08 -1.15 -1.88 114.58 120.00 2g1h h GLU 262 Ca 0.24 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2g1h h GLU 262 Cb 0.23 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2g1h h GLU 262 CO -0.02 0.92 0.09 -0.92 -1.00 0.00 0.00 179.01 178.09 2g1h h TYR 263 N 1.00 0.51 -0.41 4.33 3.20 -0.56 -0.63 116.97 124.42 2g1h h TYR 263 Ca 0.21 -0.06 0.01 0.00 3.14 0.00 0.00 58.73 62.04 2g1h h TYR 263 Cb 0.34 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 2g1h h TYR 263 CO 0.02 0.53 0.25 0.52 -1.64 0.00 0.00 178.16 177.85 2g1h h MET 264 N 0.35 0.50 -0.62 1.82 2.86 -1.12 -1.89 114.93 116.81 2g1h h MET 264 Ca 0.10 -0.03 0.07 0.00 -2.06 0.00 0.00 59.70 57.77 2g1h h MET 264 Cb 0.26 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.75 2g1h h MET 264 CO -0.00 0.33 0.32 0.00 1.06 0.00 0.00 176.91 178.62 2g1h h ALA 265 N 1.17 0.83 0.00 6.32 0.00 -1.08 -1.19 119.26 125.31 2g1h h ALA 265 Ca 0.16 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2g1h h ALA 265 Cb -0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2g1h h ALA 265 CO -0.06 -0.04 -0.04 0.00 0.00 0.00 0.00 179.25 179.11 2g1h h ALA 266 N 1.35 1.17 -0.01 0.00 0.00 -0.56 -0.71 119.26 120.51 2g1h h ALA 266 Ca 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2g1h h ALA 266 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2g1h h ALA 266 CO -0.21 0.05 -0.03 1.04 0.00 0.00 0.00 179.25 180.11 2g1h n GLN 267 N -3.39 1.28 0.00 0.00 1.13 -0.48 -4.91 117.38 111.01 2g1h n GLN 267 Ca -0.02 -0.53 0.00 0.00 -1.94 0.00 0.00 57.00 54.51 2g1h n GLN 267 Cb 0.17 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.03 2g1h n GLN 267 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g1h n GLY 268 N 1.14 0.59 3.75 1.08 0.00 -0.27 -5.07 105.19 106.41 2g1h n GLY 268 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2g1h n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g1h s VAL 269 N -2.00 2.40 -0.02 1.61 1.01 -0.99 -4.53 120.40 117.89 2g1h s VAL 269 Ca 0.00 0.35 0.06 0.00 0.00 0.00 0.00 61.98 62.38 2g1h s VAL 269 Cb 0.00 -3.22 -0.09 0.00 0.00 0.00 0.00 36.38 33.07 2g1h s VAL 269 CO 0.00 0.06 0.11 -0.62 0.00 0.00 0.00 175.10 174.64 2g1h n GLU 270 N 2.09 0.91 -3.86 2.72 1.02 0.10 -4.42 120.64 119.21 2g1h n GLU 270 Ca 0.07 -0.04 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 2g1h n GLU 270 Cb 0.39 -1.15 -0.14 0.00 -0.02 0.00 0.00 31.44 30.52 2g1h n GLU 270 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2g1h s HIS 271 N -2.35 0.02 -0.21 -0.32 5.04 -1.14 -2.75 115.29 113.58 2g1h s HIS 271 Ca -0.02 0.03 -0.05 0.00 -1.54 0.00 0.00 55.06 53.47 2g1h s HIS 271 Cb 0.03 -0.07 -0.02 0.00 0.04 0.00 0.00 32.58 32.57 2g1h s HIS 271 CO 0.25 -0.02 -0.00 -0.51 -2.34 0.00 0.00 174.74 172.12 2g1h s LEU 272 N 0.25 3.22 -0.22 8.88 1.43 -0.43 -1.04 118.68 130.77 2g1h s LEU 272 Ca -0.02 -0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 52.73 2g1h s LEU 272 Cb -0.03 -1.82 -0.05 0.00 0.03 0.00 0.00 46.19 44.32 2g1h s LEU 272 CO -0.01 0.04 0.23 -0.31 0.23 0.00 0.00 176.35 176.54 2g1h s TYR 273 N 1.11 3.35 -0.52 0.29 2.02 -0.34 -1.62 117.35 121.64 2g1h s TYR 273 Ca 0.02 0.36 -0.24 0.00 -0.37 0.00 0.00 57.07 56.85 2g1h s TYR 273 Cb -0.14 -2.33 0.04 0.00 -0.40 0.00 0.00 41.96 39.12 2g1h s TYR 273 CO 0.01 0.08 0.88 -2.00 -1.57 0.00 0.00 175.55 172.95 2g1h s GLU 274 N 1.02 3.35 -1.14 -0.62 2.12 0.22 -0.95 118.70 122.70 2g1h s GLU 274 Ca 0.11 -0.25 -0.09 0.00 0.36 0.00 0.00 54.97 55.10 2g1h s GLU 274 Cb -0.14 -4.02 0.26 0.00 0.26 0.00 0.00 34.13 30.49 2g1h s GLU 274 CO 0.05 -1.37 1.28 0.28 -0.54 0.00 0.00 175.26 174.96 2g1h n VAL 275 N 6.16 4.65 0.00 3.70 0.31 0.31 -1.47 118.33 131.99 2g1h n VAL 275 Ca 0.02 -5.33 0.00 0.00 -0.01 0.00 0.00 64.34 59.02 2g1h n VAL 275 Cb 0.47 -2.46 0.00 0.00 -0.91 0.00 0.00 33.84 30.94 2g1h n VAL 275 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2g1h n GLY 276 N 2.67 -0.23 3.77 2.92 0.00 -1.26 -4.48 105.19 108.58 2g1h n GLY 276 Ca 0.27 -1.01 -0.33 0.00 0.00 0.00 0.00 46.02 44.96 2g1h n GLY 276 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2g1h s PRO 277 N -2.00 2.84 0.35 1.61 0.04 -1.26 -4.44 135.00 132.14 2g1h s PRO 277 Ca 0.00 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.45 2g1h s PRO 277 Cb 0.00 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.59 2g1h s PRO 277 CO 0.00 -1.22 0.00 0.41 0.04 0.00 0.00 177.00 176.23 2g1h n GLY 278 N -0.47 -2.18 1.68 0.56 0.00 -1.26 -4.75 105.19 98.77 2g1h n GLY 278 Ca 0.10 -1.48 0.02 0.00 0.00 0.00 0.00 46.02 44.67 2g1h n GLY 278 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2g1h n LYS 279 N -0.88 0.76 0.09 1.61 5.02 -1.26 -4.90 118.16 118.61 2g1h n LYS 279 Ca 0.00 -2.61 -0.13 0.00 -2.02 0.00 0.00 58.31 53.55 2g1h n LYS 279 Cb 0.03 -0.68 -0.08 0.00 -0.02 0.00 0.00 35.03 34.28 2g1h n LYS 279 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2g1h h VAL 280 N 5.62 0.94 -0.11 -0.18 2.07 -1.98 -1.84 116.25 120.76 2g1h h VAL 280 Ca -0.15 -0.74 -0.10 0.00 0.82 0.00 0.00 66.70 66.53 2g1h h VAL 280 Cb 1.62 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 2g1h h VAL 280 CO 0.13 0.16 -0.40 -0.07 0.02 0.00 0.00 177.57 177.42 2g1h h LEU 281 N -0.61 0.26 -0.38 2.57 3.38 -1.95 -2.41 115.31 116.16 2g1h h LEU 281 Ca -0.02 -0.11 0.06 0.00 0.09 0.00 0.00 57.88 57.90 2g1h h LEU 281 Cb 0.45 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.08 2g1h h LEU 281 CO 0.04 0.63 0.09 0.74 0.09 0.00 0.00 178.44 180.03 2g1h h THR 282 N 0.21 0.82 0.00 0.22 2.02 -1.91 -2.67 112.91 111.60 2g1h h THR 282 Ca 0.02 -0.07 -0.07 0.00 0.77 0.00 0.00 66.41 67.06 2g1h h THR 282 Cb 0.80 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2g1h h THR 282 CO 0.06 0.04 -0.32 1.23 0.37 0.00 0.00 175.52 176.90 2g1h h GLY 283 N 0.22 0.00 2.00 2.16 0.00 -0.86 -2.71 103.07 103.88 2g1h h GLY 283 Ca 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.44 2g1h h GLY 283 CO -0.23 0.00 -0.36 1.41 0.00 0.00 0.00 176.54 177.36 2g1h h LEU 284 N 0.00 0.00 0.09 3.11 3.38 -1.12 -3.39 115.31 117.38 2g1h h LEU 284 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2g1h h LEU 284 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2g1h h LEU 284 CO 0.04 0.36 -0.04 0.74 0.09 0.00 0.00 178.44 179.63 2g1h h THR 285 N 0.00 0.97 0.00 0.22 2.02 -1.32 -1.88 112.91 112.92 2g1h h THR 285 Ca -0.00 -0.20 -0.07 0.00 0.77 0.00 0.00 66.41 66.92 2g1h h THR 285 Cb 0.74 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 2g1h h THR 285 CO 0.05 0.05 -0.31 0.50 0.37 0.00 0.00 175.52 176.17 2g1h h LYS 286 N -0.21 0.00 0.00 6.66 3.64 -1.76 -1.09 116.57 123.82 2g1h h LYS 286 Ca -0.01 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 2g1h h LYS 286 Cb 0.17 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2g1h h LYS 286 CO 0.02 0.31 -0.34 0.00 -2.27 0.00 0.00 179.45 177.17 2g1h h ARG 287 N 0.00 0.00 0.00 1.90 3.08 -1.57 -2.99 114.38 114.80 2g1h h ARG 287 Ca -0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 2g1h h ARG 287 Cb 0.77 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 2g1h h ARG 287 CO 0.04 0.34 -0.24 0.82 -1.07 0.00 0.00 179.97 179.86 2g1h h ILE 288 N 0.00 0.94 -3.37 2.04 2.04 -0.87 -3.41 117.51 114.88 2g1h h ILE 288 Ca -0.00 -1.78 -0.54 0.00 1.00 0.00 0.00 64.86 63.53 2g1h h ILE 288 Cb 0.71 1.86 -0.39 0.00 -0.74 0.00 0.00 36.82 38.25 2g1h h ILE 288 CO 0.04 0.32 -0.77 -0.69 0.00 0.00 0.00 178.15 177.05 2g1h s VAL 289 N -2.04 0.79 -0.62 1.67 1.01 -0.49 -4.98 120.40 115.74 2g1h s VAL 289 Ca -0.14 -0.73 0.24 0.00 0.00 0.00 0.00 61.98 61.35 2g1h s VAL 289 Cb -0.00 -1.23 0.25 0.00 0.00 0.00 0.00 36.38 35.40 2g1h s VAL 289 CO 0.42 -0.17 1.73 -0.90 0.00 0.00 0.00 175.10 176.18 2g1h n ASP 290 N 4.95 0.65 -0.32 3.32 5.68 -1.13 -1.58 116.55 128.11 2g1h n ASP 290 Ca -0.10 0.62 0.12 0.00 -0.50 0.00 0.00 54.79 54.93 2g1h n ASP 290 Cb 0.46 -0.77 0.23 0.00 -1.14 0.00 0.00 41.12 39.90 2g1h n ASP 290 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2g1h n THR 291 N -2.17 0.00 -2.68 2.12 -2.24 -1.26 -4.88 114.28 103.17 2g1h n THR 291 Ca 0.04 -0.17 -0.38 0.00 -2.27 0.00 0.00 64.05 61.27 2g1h n THR 291 Cb 0.30 0.71 -0.06 0.00 -2.10 0.00 0.00 70.33 69.19 2g1h n THR 291 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2g1h s LEU 292 N -2.51 4.34 0.20 3.22 1.43 -0.61 -5.03 118.68 119.72 2g1h s LEU 292 Ca 0.22 1.95 0.08 0.00 -1.03 0.00 0.00 54.13 55.35 2g1h s LEU 292 Cb 0.19 -3.97 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 2g1h s LEU 292 CO 0.55 -0.16 -0.02 0.42 0.23 0.00 0.00 176.35 177.37 2g1h s THR 293 N -1.53 3.54 0.04 5.49 -4.23 -1.11 -4.54 115.64 113.31 2g1h s THR 293 Ca 0.51 -1.62 -0.11 0.00 -1.18 0.00 0.00 61.69 59.28 2g1h s THR 293 Cb -0.22 -2.81 0.01 0.00 1.34 0.00 0.00 72.50 70.82 2g1h s THR 293 CO 0.28 -0.20 0.25 0.00 -0.54 0.00 0.00 174.62 174.41 2g1h s ALA 294 N -1.91 -0.51 0.17 3.99 0.00 -1.26 -1.32 121.76 120.92 2g1h s ALA 294 Ca 0.28 -0.16 -0.21 0.00 0.00 0.00 0.00 51.96 51.87 2g1h s ALA 294 Cb -0.08 0.31 0.06 0.00 0.00 0.00 0.00 23.12 23.40 2g1h s ALA 294 CO 0.18 -0.39 0.57 -1.54 0.00 0.00 0.00 175.76 174.58 2g1h s SER 295 N -2.12 -0.45 0.16 0.00 1.04 -0.64 -4.96 113.70 106.72 2g1h s SER 295 Ca -0.04 -0.16 0.02 0.00 0.48 0.00 0.00 55.95 56.24 2g1h s SER 295 Cb -0.01 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.67 2g1h s SER 295 CO -0.04 -1.00 0.31 0.00 0.98 0.00 0.00 173.24 173.48 2g1h s ALA 296 N -3.79 3.94 -0.43 5.32 0.00 -1.26 -0.61 121.76 124.93 2g1h s ALA 296 Ca 0.03 -1.00 0.07 0.00 0.00 0.00 0.00 51.96 51.07 2g1h s ALA 296 Cb -0.01 -1.82 0.42 0.00 0.00 0.00 0.00 23.12 21.71 2g1h s ALA 296 CO -0.10 0.52 1.07 1.28 0.00 0.00 0.00 175.76 178.53 2g1h n LEU 297 N -0.58 4.13 -0.05 0.00 4.77 -0.54 -4.76 117.00 119.98 2g1h n LEU 297 Ca -0.07 -5.02 0.01 0.00 -0.03 0.00 0.00 56.01 50.90 2g1h n LEU 297 Cb 0.54 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 41.33 2g1h n LEU 297 CO 0.49 2.15 0.37 -0.46 -1.33 0.00 0.00 177.39 178.60 2g1h n ASN 298 N -0.39 1.50 -4.31 -1.43 2.04 -1.26 -4.66 115.26 106.76 2g1h n ASN 298 Ca 0.34 -1.44 -0.30 0.00 -0.44 0.00 0.00 54.58 52.74 2g1h n ASN 298 Cb 0.66 -0.01 -0.15 0.00 -2.53 0.00 0.00 39.78 37.75 2g1h n ASN 298 CO 0.00 0.00 0.00 -1.61 -0.44 0.00 0.00 177.26 175.21 2g1h s GLU 299 N -0.47 1.91 0.20 -3.83 0.41 -1.26 -4.56 118.70 111.10 2g1h s GLU 299 Ca 0.02 -0.98 -0.15 0.00 -0.41 0.00 0.00 54.97 53.45 2g1h s GLU 299 Cb 0.01 -1.94 0.19 0.00 -1.78 0.00 0.00 34.13 30.61 2g1h s GLU 299 CO 0.01 0.52 1.63 -1.35 -0.49 0.00 0.00 175.26 175.59 2g1h h PRO 300 N 5.20 -0.01 -0.48 0.39 0.11 -1.94 -0.58 132.00 134.69 2g1h h PRO 300 Ca -0.44 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 2g1h h PRO 300 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2g1h h PRO 300 CO 0.46 -0.01 0.26 0.66 -0.21 0.00 0.00 178.00 179.16 2g1h h SER 301 N -0.01 0.61 -0.93 -2.05 4.64 -1.98 0.22 113.55 114.04 2g1h h SER 301 Ca 0.27 -0.10 0.01 0.00 -0.47 0.00 0.00 61.79 61.50 2g1h h SER 301 Cb 0.43 -0.15 -0.05 0.00 -0.31 0.00 0.00 62.40 62.31 2g1h h SER 301 CO -0.59 0.53 0.62 0.00 -0.87 0.00 0.00 176.83 176.52 2g1h h ALA 302 N 1.10 1.18 -0.35 5.18 0.00 -1.71 0.22 119.26 124.88 2g1h h ALA 302 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2g1h h ALA 302 Cb 0.06 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2g1h h ALA 302 CO -0.03 0.58 0.21 1.98 0.00 0.00 0.00 179.25 182.00 2g1h h MET 303 N 1.27 0.48 -0.22 0.00 -1.53 -0.03 -1.39 114.93 113.51 2g1h h MET 303 Ca 0.34 -0.04 0.03 0.00 -3.44 0.00 0.00 59.70 56.59 2g1h h MET 303 Cb -0.15 -0.10 -0.03 0.00 -0.55 0.00 0.00 31.60 30.77 2g1h h MET 303 CO -0.07 0.36 0.05 0.00 0.14 0.00 0.00 176.91 177.39 2g1h h ALA 304 N 1.09 0.23 -0.38 0.39 0.00 0.01 -2.06 119.26 118.54 2g1h h ALA 304 Ca 0.13 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2g1h h ALA 304 Cb 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2g1h h ALA 304 CO -0.02 -0.37 0.11 0.00 0.00 0.00 0.00 179.25 178.96 2g1h h ALA 305 N 1.15 1.49 -0.17 0.00 0.00 -0.25 -2.18 119.26 119.31 2g1h h ALA 305 Ca 0.10 -0.14 -0.21 0.00 0.00 0.00 0.00 54.91 54.66 2g1h h ALA 305 Cb 0.09 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.72 2g1h h ALA 305 CO -0.12 0.38 -0.72 0.00 0.00 0.00 0.00 179.25 178.79 2g1h h ALA 306 N 1.59 0.40 0.00 0.00 0.00 -1.03 -3.05 119.26 117.17 2g1h h ALA 306 Ca 0.13 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2g1h h ALA 306 Cb 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2g1h h ALA 306 CO -0.01 0.70 0.00 -0.07 0.00 0.00 0.00 179.25 179.87 2g1h h LEU 307 N 0.52 0.00 -0.51 0.00 3.38 -0.81 -2.07 115.31 115.81 2g1h h LEU 307 Ca -0.03 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 2g1h h LEU 307 Cb 1.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 2g1h h LEU 307 CO 0.15 0.00 -0.43 -0.33 0.09 0.00 0.00 178.44 177.92 2g1h h GLU 308 N 0.00 0.00 0.00 1.13 5.08 -1.30 -3.49 114.58 116.00 2g1h h GLU 308 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2g1h h GLU 308 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 2g1h h GLU 308 CO 0.00 0.43 0.00 1.28 -1.00 0.00 0.00 179.01 179.72