#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gx3 s MET 3 N 0.00 2.69 -0.44 0.00 1.75 -1.26 -5.11 119.30 116.94 1gx3 s MET 3 Ca 0.00 -0.65 -0.26 0.00 -1.25 0.00 0.00 55.69 53.53 1gx3 s MET 3 Cb 0.00 -2.48 0.02 0.00 2.84 0.00 0.00 34.83 35.22 1gx3 s MET 3 CO 0.00 0.58 0.95 0.34 -0.65 0.00 0.00 175.02 176.24 1gx3 s ASP 4 N -0.62 6.56 0.00 1.11 3.68 -1.26 -4.89 116.67 121.25 1gx3 s ASP 4 Ca 0.09 0.29 0.24 0.00 2.13 0.00 0.00 52.55 55.29 1gx3 s ASP 4 Cb -0.11 -2.46 0.22 0.00 -1.45 0.00 0.00 42.92 39.11 1gx3 s ASP 4 CO 0.01 -1.01 1.23 0.18 0.13 0.00 0.00 175.17 175.71 1gx3 n LEU 5 N 7.12 1.81 -0.10 -1.34 4.77 -1.26 -4.60 117.00 123.40 1gx3 n LEU 5 Ca 0.07 -0.64 -0.06 0.00 -0.03 0.00 0.00 56.01 55.35 1gx3 n LEU 5 Cb 0.48 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.55 1gx3 n LEU 5 CO 0.63 0.33 0.77 1.23 -1.33 0.00 0.00 177.39 179.03 1gx3 h GLY 6 N 4.86 0.19 0.35 -0.72 0.00 -1.99 0.96 103.07 106.72 1gx3 h GLY 6 Ca 0.00 0.16 0.08 0.00 0.00 0.00 0.00 47.33 47.57 1gx3 h GLY 6 CO 0.00 -0.16 0.04 -1.33 0.00 0.00 0.00 176.54 175.09 1gx3 h GLY 7 N -0.05 0.48 0.92 4.60 0.00 -2.00 -0.79 103.07 106.22 1gx3 h GLY 7 Ca 0.17 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 1gx3 h GLY 7 CO -0.39 -0.09 0.12 -1.82 0.00 0.00 0.00 176.54 174.36 1gx3 h TYR 8 N 0.16 0.44 -0.35 5.60 3.20 -1.57 -0.80 116.97 123.63 1gx3 h TYR 8 Ca 0.22 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 1gx3 h TYR 8 Cb 0.30 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1gx3 h TYR 8 CO -0.25 0.42 0.21 -0.07 -1.64 0.00 0.00 178.16 176.83 1gx3 h LEU 9 N 0.32 0.43 -0.55 2.82 3.38 -0.60 -1.59 115.31 119.52 1gx3 h LEU 9 Ca 0.10 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.05 1gx3 h LEU 9 Cb 0.17 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1gx3 h LEU 9 CO -0.01 0.35 0.31 0.74 0.09 0.00 0.00 178.44 179.92 1gx3 h THR 10 N 0.46 1.00 -0.93 0.22 2.02 -1.06 -0.65 112.91 113.97 1gx3 h THR 10 Ca 0.13 -0.20 0.16 0.00 0.77 0.00 0.00 66.41 67.27 1gx3 h THR 10 Cb 0.01 0.35 -0.10 0.00 -1.74 0.00 0.00 68.15 66.67 1gx3 h THR 10 CO -0.02 0.11 0.53 -0.09 0.37 0.00 0.00 175.52 176.42 1gx3 h ARG 11 N 0.59 0.71 -0.48 6.66 9.65 -0.46 -1.84 114.38 129.21 1gx3 h ARG 11 Ca 0.24 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.07 1gx3 h ARG 11 Cb 0.10 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 1gx3 h ARG 11 CO -0.14 0.47 0.00 0.44 2.80 0.00 0.00 179.97 183.54 1gx3 n ILE 12 N -4.80 0.63 -1.81 1.20 -5.35 -0.66 -4.86 119.36 103.71 1gx3 n ILE 12 Ca 0.20 -0.80 -0.04 0.00 -0.27 0.00 0.00 62.75 61.84 1gx3 n ILE 12 Cb 0.48 0.82 -0.01 0.00 -1.74 0.00 0.00 39.64 39.19 1gx3 n ILE 12 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1gx3 n GLY 13 N 1.54 0.34 3.75 3.28 0.00 -0.52 -4.65 105.19 108.93 1gx3 n GLY 13 Ca 0.21 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 1gx3 n GLY 13 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gx3 s LEU 14 N -1.11 3.70 -0.10 0.99 1.43 -0.36 -5.01 118.68 118.22 1gx3 s LEU 14 Ca 0.00 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.05 1gx3 s LEU 14 Cb 0.00 -2.38 -0.00 0.00 0.03 0.00 0.00 46.19 43.83 1gx3 s LEU 14 CO 0.00 0.15 -0.22 1.51 0.23 0.00 0.00 176.35 178.01 1gx3 s ASP 15 N -2.54 3.23 0.00 2.29 -4.77 -1.26 -3.90 116.67 109.72 1gx3 s ASP 15 Ca 0.29 -0.52 0.00 0.00 -3.30 0.00 0.00 52.55 49.02 1gx3 s ASP 15 Cb -0.12 -1.38 0.00 0.00 -1.09 0.00 0.00 42.92 40.33 1gx3 s ASP 15 CO 0.21 0.17 0.00 0.61 0.70 0.00 0.00 175.17 176.86 1gx3 n GLY 16 N 3.46 -2.03 3.66 2.12 0.00 -1.26 -4.82 105.19 106.32 1gx3 n GLY 16 Ca -0.19 -1.49 -0.40 0.00 0.00 0.00 0.00 46.02 43.94 1gx3 n GLY 16 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1gx3 s ARG 17 N -3.12 4.21 0.70 1.61 1.70 -1.26 -5.03 118.95 117.75 1gx3 s ARG 17 Ca 0.00 0.69 -0.12 0.00 -0.47 0.00 0.00 55.73 55.83 1gx3 s ARG 17 Cb 0.00 -3.59 0.01 0.00 -0.57 0.00 0.00 34.95 30.80 1gx3 s ARG 17 CO 0.00 -0.29 1.07 -1.25 -1.08 0.00 0.00 175.30 173.75 1gx3 s PRO 18 N 2.06 2.82 0.49 3.89 0.04 -1.26 -5.04 135.00 138.01 1gx3 s PRO 18 Ca 0.30 1.06 -0.19 0.00 0.04 0.00 0.00 61.00 62.22 1gx3 s PRO 18 Cb -0.16 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.33 1gx3 s PRO 18 CO 0.10 -1.20 1.00 1.03 0.04 0.00 0.00 177.00 177.97 1gx3 s ARG 19 N -4.83 3.91 -1.27 4.56 0.52 -1.26 -4.98 118.95 115.60 1gx3 s ARG 19 Ca 0.60 1.14 -0.18 0.00 -0.52 0.00 0.00 55.73 56.76 1gx3 s ARG 19 Cb -0.15 -2.13 0.01 0.00 0.52 0.00 0.00 34.95 33.20 1gx3 s ARG 19 CO 0.52 -0.31 1.93 -0.35 0.02 0.00 0.00 175.30 177.11 1gx3 n PRO 20 N -1.21 2.66 -4.56 3.54 -0.04 -1.26 -4.60 135.00 129.54 1gx3 n PRO 20 Ca 0.08 -2.80 -0.26 0.00 -0.04 0.00 0.00 63.50 60.48 1gx3 n PRO 20 Cb 0.53 -3.41 -0.09 0.00 -0.04 0.00 0.00 33.50 30.50 1gx3 n PRO 20 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1gx3 s ASP 21 N 4.35 3.04 0.20 3.54 1.47 -1.26 -4.22 116.67 123.79 1gx3 s ASP 21 Ca 0.55 -1.59 -0.11 0.00 1.18 0.00 0.00 52.55 52.57 1gx3 s ASP 21 Cb 0.07 0.34 0.18 0.00 -0.34 0.00 0.00 42.92 43.17 1gx3 s ASP 21 CO 0.04 -0.82 1.82 0.25 0.68 0.00 0.00 175.17 177.14 1gx3 h LEU 22 N 1.76 0.60 -0.43 2.11 5.85 -1.97 -1.21 115.31 122.02 1gx3 h LEU 22 Ca -0.39 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.37 1gx3 h LEU 22 Cb 1.27 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 1gx3 h LEU 22 CO 0.64 0.41 0.24 1.23 -0.34 0.00 0.00 178.44 180.62 1gx3 h GLY 23 N 0.73 0.60 1.01 3.75 0.00 -1.97 -1.34 103.07 105.85 1gx3 h GLY 23 Ca 0.26 -0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.42 1gx3 h GLY 23 CO -0.13 0.14 0.49 -0.84 0.00 0.00 0.00 176.54 176.21 1gx3 h THR 24 N 0.48 1.19 -0.68 4.70 2.02 -1.73 -0.73 112.91 118.16 1gx3 h THR 24 Ca 0.18 -0.35 0.04 0.00 0.77 0.00 0.00 66.41 67.05 1gx3 h THR 24 Cb 0.05 0.10 -0.05 0.00 -1.74 0.00 0.00 68.15 66.50 1gx3 h THR 24 CO -0.10 0.19 0.42 0.25 0.37 0.00 0.00 175.52 176.64 1gx3 h LEU 25 N 1.01 0.66 -0.53 2.58 5.85 -0.70 0.17 115.31 124.36 1gx3 h LEU 25 Ca 0.27 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.92 1gx3 h LEU 25 Cb -0.12 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 1gx3 h LEU 25 CO -0.06 0.45 0.01 0.45 -0.34 0.00 0.00 178.44 178.95 1gx3 h HIS 26 N 0.80 1.01 -0.21 1.25 3.86 -0.83 -1.61 115.15 119.42 1gx3 h HIS 26 Ca 0.28 -0.17 -0.06 0.00 -1.16 0.00 0.00 60.37 59.26 1gx3 h HIS 26 Cb 0.07 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.27 1gx3 h HIS 26 CO -0.05 0.93 -0.11 0.00 0.86 0.00 0.00 177.93 179.56 1gx3 h ALA 27 N 0.95 0.29 -0.24 2.45 0.00 -0.59 -1.15 119.26 120.97 1gx3 h ALA 27 Ca 0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1gx3 h ALA 27 Cb 0.52 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1gx3 h ALA 27 CO 0.03 0.14 0.10 0.82 0.00 0.00 0.00 179.25 180.33 1gx3 h ILE 28 N 0.14 1.17 -0.60 0.00 2.04 -0.61 -0.88 117.51 118.77 1gx3 h ILE 28 Ca 0.04 -0.51 0.07 0.00 1.00 0.00 0.00 64.86 65.46 1gx3 h ILE 28 Cb 0.61 1.06 -0.06 0.00 -0.74 0.00 0.00 36.82 37.69 1gx3 h ILE 28 CO 0.03 0.17 0.29 0.58 0.00 0.00 0.00 178.15 179.22 1gx3 h VAL 29 N 0.24 0.90 -0.37 1.67 2.07 -1.20 0.83 116.25 120.39 1gx3 h VAL 29 Ca 0.08 -0.18 -0.08 0.00 0.82 0.00 0.00 66.70 67.33 1gx3 h VAL 29 Cb 0.17 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1gx3 h VAL 29 CO -0.01 0.10 -0.09 0.00 0.02 0.00 0.00 177.57 177.60 1gx3 h ALA 30 N 1.35 0.51 -0.44 1.67 0.00 -1.03 -0.86 119.26 120.46 1gx3 h ALA 30 Ca 0.28 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1gx3 h ALA 30 Cb 0.24 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1gx3 h ALA 30 CO -0.21 0.37 0.02 0.00 0.00 0.00 0.00 179.25 179.42 1gx3 h ALA 31 N 0.83 0.59 -0.07 0.00 0.00 -0.78 -2.62 119.26 117.21 1gx3 h ALA 31 Ca 0.10 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1gx3 h ALA 31 Cb 0.60 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1gx3 h ALA 31 CO 0.04 0.36 0.04 1.25 0.00 0.00 0.00 179.25 180.93 1gx3 h HIS 32 N 0.61 0.09 -0.87 0.00 6.17 -0.80 -1.80 115.15 118.54 1gx3 h HIS 32 Ca 0.13 -0.00 0.19 0.00 0.71 0.00 0.00 60.37 61.40 1gx3 h HIS 32 Cb 0.46 -0.03 -0.11 0.00 2.52 0.00 0.00 27.41 30.25 1gx3 h HIS 32 CO 0.03 0.13 0.40 -0.91 0.71 0.00 0.00 177.93 178.29 1gx3 h ASN 33 N 0.03 0.38 0.94 3.26 2.35 -1.02 -1.87 115.58 119.66 1gx3 h ASN 33 Ca 0.02 0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1gx3 h ASN 33 Cb 0.07 0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1gx3 h ASN 33 CO -0.00 0.07 -0.75 0.08 -1.65 0.00 0.00 177.43 175.18 1gx3 h ARG 34 N 0.47 0.00 0.01 0.81 0.11 -1.12 -2.68 114.38 111.98 1gx3 h ARG 34 Ca 0.52 0.00 -0.38 0.00 0.10 0.00 0.00 59.98 60.22 1gx3 h ARG 34 Cb 0.90 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.92 1gx3 h ARG 34 CO -0.47 0.00 -2.39 0.43 0.10 0.00 0.00 179.97 177.64 1gx3 n SER 35 N -2.35 1.32 -4.03 0.08 7.64 -0.70 -4.83 113.62 110.76 1gx3 n SER 35 Ca 0.02 -0.05 -0.31 0.00 1.01 0.00 0.00 58.87 59.53 1gx3 n SER 35 Cb 0.48 0.02 -0.15 0.00 -1.01 0.00 0.00 64.21 63.55 1gx3 n SER 35 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1gx3 s ILE 36 N -2.52 2.07 0.64 0.44 1.01 -0.75 -4.98 121.20 117.12 1gx3 s ILE 36 Ca -0.25 -1.76 -0.13 0.00 0.00 0.00 0.00 60.65 58.51 1gx3 s ILE 36 Cb 0.08 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 40.23 1gx3 s ILE 36 CO 0.69 -0.21 1.05 -2.16 0.00 0.00 0.00 174.94 174.32 1gx3 s PRO 37 N 1.10 3.17 0.08 2.79 0.04 -1.26 -4.75 135.00 136.18 1gx3 s PRO 37 Ca -0.03 1.05 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 1gx3 s PRO 37 Cb -0.19 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.27 1gx3 s PRO 37 CO -0.07 -0.92 1.05 0.12 0.04 0.00 0.00 177.00 177.22 1gx3 s PHE 38 N -2.78 3.64 -0.02 0.56 5.36 0.57 -2.58 117.98 122.74 1gx3 s PHE 38 Ca 0.60 1.63 -0.29 0.00 -0.96 0.00 0.00 56.93 57.90 1gx3 s PHE 38 Cb -0.14 -3.20 0.08 0.00 -0.34 0.00 0.00 43.02 39.41 1gx3 s PHE 38 CO 0.46 -0.34 0.70 -1.83 -1.46 0.00 0.00 175.22 172.75 1gx3 s GLU 39 N 0.41 1.05 -0.18 10.12 -1.05 0.00 -0.80 118.70 128.26 1gx3 s GLU 39 Ca 0.51 0.11 0.15 0.00 -0.15 0.00 0.00 54.97 55.59 1gx3 s GLU 39 Cb -0.25 0.49 0.44 0.00 -0.44 0.00 0.00 34.13 34.37 1gx3 s GLU 39 CO 0.30 -0.36 1.19 0.27 0.95 0.00 0.00 175.26 177.61 1gx3 n ASN 40 N 0.64 2.19 -0.22 0.83 6.94 -1.16 -2.95 115.26 121.53 1gx3 n ASN 40 Ca -0.18 -3.19 0.13 0.00 -0.02 0.00 0.00 54.58 51.33 1gx3 n ASN 40 Cb 0.59 -0.43 0.43 0.00 -2.36 0.00 0.00 39.78 38.01 1gx3 n ASN 40 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1gx3 h LEU 41 N 1.44 0.54 0.87 -4.53 3.38 -1.92 -1.63 115.31 113.45 1gx3 h LEU 41 Ca 0.00 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1gx3 h LEU 41 Cb 1.36 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 42.05 1gx3 h LEU 41 CO 0.20 0.28 -0.42 0.44 0.09 0.00 0.00 178.44 179.04 1gx3 h ASP 42 N 0.57 -0.99 0.06 -0.43 5.19 -1.89 -1.82 116.42 117.12 1gx3 h ASP 42 Ca 0.41 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.84 1gx3 h ASP 42 Cb 0.77 0.26 -0.00 0.00 0.18 0.00 0.00 39.33 40.53 1gx3 h ASP 42 CO -0.17 -0.66 -0.06 -0.65 -3.12 0.00 0.00 179.24 174.59 1gx3 h PRO 43 N -1.26 0.00 -0.69 3.56 0.11 -1.37 0.71 132.00 133.07 1gx3 h PRO 43 Ca -0.12 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.99 1gx3 h PRO 43 Cb 0.90 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 1gx3 h PRO 43 CO 0.20 0.06 0.41 1.25 -0.21 0.00 0.00 178.00 179.70 1gx3 h LEU 44 N 0.00 0.84 -0.41 2.35 5.85 -1.11 -1.93 115.31 120.90 1gx3 h LEU 44 Ca -0.00 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1gx3 h LEU 44 Cb 0.10 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 40.92 1gx3 h LEU 44 CO 0.01 0.66 0.00 0.18 -0.34 0.00 0.00 178.44 178.95 1gx3 n LEU 45 N -4.54 0.60 -0.06 2.25 4.77 -0.70 -4.92 117.00 114.39 1gx3 n LEU 45 Ca 0.06 -0.28 -0.01 0.00 -0.03 0.00 0.00 56.01 55.75 1gx3 n LEU 45 Cb 0.06 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1gx3 n LEU 45 CO 0.37 0.14 -0.01 0.61 -1.33 0.00 0.00 177.39 177.17 1gx3 n GLY 46 N 0.77 0.44 3.42 -0.72 0.00 -0.73 -5.02 105.19 103.35 1gx3 n GLY 46 Ca 0.08 -1.06 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1gx3 n GLY 46 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gx3 s ILE 47 N -2.03 4.89 0.79 -0.61 1.01 0.16 -4.99 121.20 120.42 1gx3 s ILE 47 Ca 0.00 -0.73 -0.13 0.00 0.00 0.00 0.00 60.65 59.79 1gx3 s ILE 47 Cb 0.00 -3.71 0.07 0.00 0.01 0.00 0.00 42.46 38.83 1gx3 s ILE 47 CO 0.00 -0.25 1.16 -2.84 0.00 0.00 0.00 174.94 173.02 1gx3 s PRO 48 N 1.62 1.82 -0.71 2.79 0.02 -1.26 -2.65 135.00 136.63 1gx3 s PRO 48 Ca 0.04 1.58 -0.09 0.00 0.02 0.00 0.00 61.00 62.55 1gx3 s PRO 48 Cb -0.19 -1.81 0.18 0.00 0.02 0.00 0.00 34.50 32.70 1gx3 s PRO 48 CO 0.08 -2.04 0.58 0.08 -0.33 0.00 0.00 177.00 175.38 1gx3 s VAL 49 N -2.37 4.65 -0.14 3.83 1.01 -1.26 -4.89 120.40 121.24 1gx3 s VAL 49 Ca 0.69 -2.63 0.12 0.00 0.00 0.00 0.00 61.98 60.17 1gx3 s VAL 49 Cb -0.25 -3.94 -0.17 0.00 0.00 0.00 0.00 36.38 32.02 1gx3 s VAL 49 CO 0.51 -0.94 0.05 0.00 0.00 0.00 0.00 175.10 174.72 1gx3 n ALA 50 N 3.84 1.67 -3.25 5.51 0.00 -1.26 -3.75 120.51 123.27 1gx3 n ALA 50 Ca 0.09 -0.91 -0.37 0.00 0.00 0.00 0.00 53.44 52.25 1gx3 n ALA 50 Cb 0.42 -0.05 -0.13 0.00 0.00 0.00 0.00 19.45 19.69 1gx3 n ALA 50 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1gx3 s ASP 51 N -4.70 4.95 -0.24 0.00 -1.08 -1.26 -4.83 116.67 109.52 1gx3 s ASP 51 Ca -0.07 -0.60 0.13 0.00 -0.52 0.00 0.00 52.55 51.50 1gx3 s ASP 51 Cb 0.04 -1.85 0.54 0.00 -1.46 0.00 0.00 42.92 40.19 1gx3 s ASP 51 CO 0.57 -0.14 1.47 0.18 0.52 0.00 0.00 175.17 177.78 1gx3 n LEU 52 N 4.85 4.17 -4.74 -1.34 4.77 -1.26 -4.67 117.00 118.79 1gx3 n LEU 52 Ca -0.15 -3.33 -0.33 0.00 -0.03 0.00 0.00 56.01 52.17 1gx3 n LEU 52 Cb 0.49 -0.60 0.08 0.00 -2.33 0.00 0.00 43.42 41.06 1gx3 n LEU 52 CO 0.31 0.91 0.76 -0.94 -1.33 0.00 0.00 177.39 177.09 1gx3 s SER 53 N -2.10 4.47 0.23 -1.43 1.04 -1.26 -4.86 113.70 109.79 1gx3 s SER 53 Ca 0.44 2.17 -0.08 0.00 0.48 0.00 0.00 55.95 58.97 1gx3 s SER 53 Cb 0.37 -2.57 0.20 0.00 0.10 0.00 0.00 66.02 64.13 1gx3 s SER 53 CO 0.06 -2.07 1.86 0.00 0.98 0.00 0.00 173.24 174.08 1gx3 h ALA 54 N -0.34 1.13 -0.42 5.32 0.00 -1.94 -1.81 119.26 121.20 1gx3 h ALA 54 Ca -0.47 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.39 1gx3 h ALA 54 Cb 1.27 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 1gx3 h ALA 54 CO 0.51 0.61 0.12 0.93 0.00 0.00 0.00 179.25 181.42 1gx3 h GLU 55 N 1.22 0.26 -0.33 0.00 3.07 -1.98 -1.17 114.58 115.65 1gx3 h GLU 55 Ca 0.31 -0.02 -0.14 0.00 -0.50 0.00 0.00 59.36 59.02 1gx3 h GLU 55 Cb -0.02 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 27.83 1gx3 h GLU 55 CO -0.06 0.18 -0.35 0.00 -1.40 0.00 0.00 179.01 177.38 1gx3 h ALA 56 N 1.29 0.48 -0.18 3.43 0.00 -1.81 -2.14 119.26 120.33 1gx3 h ALA 56 Ca 0.20 -0.43 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 1gx3 h ALA 56 Cb 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1gx3 h ALA 56 CO -0.23 0.55 -0.45 -0.07 0.00 0.00 0.00 179.25 179.06 1gx3 h LEU 57 N 0.59 0.71 -0.64 0.00 3.38 -1.08 -2.08 115.31 116.18 1gx3 h LEU 57 Ca 0.05 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1gx3 h LEU 57 Cb 0.94 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1gx3 h LEU 57 CO 0.09 1.15 0.41 -0.26 0.09 0.00 0.00 178.44 179.92 1gx3 h PHE 58 N 0.29 0.81 -0.42 1.13 -1.00 -1.29 -1.23 116.94 115.23 1gx3 h PHE 58 Ca -0.01 0.01 0.03 0.00 2.81 0.00 0.00 57.97 60.81 1gx3 h PHE 58 Cb 1.06 -0.27 -0.03 0.00 3.61 0.00 0.00 35.95 40.32 1gx3 h PHE 58 CO 0.09 0.52 0.22 0.00 -1.61 0.00 0.00 178.31 177.54 1gx3 h ALA 59 N 1.22 0.52 0.14 2.45 0.00 -1.25 -1.73 119.26 120.63 1gx3 h ALA 59 Ca 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1gx3 h ALA 59 Cb -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1gx3 h ALA 59 CO -0.05 -0.13 -0.07 -0.22 0.00 0.00 0.00 179.25 178.79 1gx3 h LYS 60 N 0.45 -0.19 0.00 0.00 3.64 -1.27 -0.20 116.57 119.01 1gx3 h LYS 60 Ca 0.17 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.50 1gx3 h LYS 60 Cb 0.06 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1gx3 h LYS 60 CO -0.11 0.03 -0.30 -0.07 -2.27 0.00 0.00 179.45 176.74 1gx3 h LEU 61 N -1.02 0.00 0.00 5.20 4.07 -1.30 -2.77 115.31 119.50 1gx3 h LEU 61 Ca -0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.94 1gx3 h LEU 61 Cb 0.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.05 1gx3 h LEU 61 CO 0.03 0.30 -0.02 0.52 -1.08 0.00 0.00 178.44 178.19 1gx3 n VAL 62 N -3.32 0.04 -0.03 1.22 0.31 -0.72 -4.32 118.33 111.50 1gx3 n VAL 62 Ca 0.01 0.43 -0.05 0.00 -0.01 0.00 0.00 64.34 64.73 1gx3 n VAL 62 Cb 0.53 -1.46 0.17 0.00 -0.91 0.00 0.00 33.84 32.17 1gx3 n VAL 62 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1gx3 h ASP 63 N -0.02 0.61 0.05 4.52 3.32 -1.24 -2.87 116.42 120.79 1gx3 h ASP 63 Ca 0.00 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1gx3 h ASP 63 Cb 0.02 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.41 1gx3 h ASP 63 CO 0.00 0.81 -0.17 0.54 -1.72 0.00 0.00 179.24 178.70 1gx3 n ARG 64 N -4.14 1.49 -3.44 3.56 1.74 -0.10 -4.94 116.66 110.83 1gx3 n ARG 64 Ca 0.00 -1.05 -0.25 0.00 -0.77 0.00 0.00 57.85 55.79 1gx3 n ARG 64 Cb 0.39 -1.48 0.04 0.00 -1.02 0.00 0.00 32.46 30.40 1gx3 n ARG 64 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1gx3 n ARG 65 N 0.16 -5.90 -3.01 5.56 1.74 -1.08 -4.65 116.66 109.48 1gx3 n ARG 65 Ca 0.14 0.77 -0.19 0.00 -0.77 0.00 0.00 57.85 57.80 1gx3 n ARG 65 Cb 0.43 -5.69 0.01 0.00 -1.02 0.00 0.00 32.46 26.19 1gx3 n ARG 65 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1gx3 s ARG 66 N -6.13 2.84 0.00 5.56 1.81 -1.05 -2.11 118.95 119.86 1gx3 s ARG 66 Ca 0.49 -1.00 0.00 0.00 -1.72 0.00 0.00 55.73 53.50 1gx3 s ARG 66 Cb -0.23 -2.68 0.00 0.00 -0.45 0.00 0.00 34.95 31.59 1gx3 s ARG 66 CO 0.60 -0.31 0.00 0.41 -0.68 0.00 0.00 175.30 175.32 1gx3 n GLY 67 N -1.95 1.78 1.99 -3.53 0.00 -1.26 -4.31 105.19 97.90 1gx3 n GLY 67 Ca 0.06 -2.03 -0.01 0.00 0.00 0.00 0.00 46.02 44.03 1gx3 n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gx3 n GLY 68 N 5.00 0.89 0.00 -0.02 0.00 -1.06 -4.75 105.19 105.25 1gx3 n GLY 68 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1gx3 n GLY 68 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1gx3 n TYR 69 N -0.38 -1.02 -0.02 1.61 -0.00 -1.15 -0.82 117.16 115.37 1gx3 n TYR 69 Ca -0.01 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.81 1gx3 n TYR 69 Cb 0.30 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.61 1gx3 n TYR 69 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1gx3 h TYR 71 N -0.09 0.00 -0.02 0.00 -1.99 -1.88 -0.84 116.97 112.15 1gx3 h TYR 71 Ca 0.10 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.77 1gx3 h TYR 71 Cb 0.24 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.97 1gx3 h TYR 71 CO -0.25 0.00 -0.20 0.93 -0.00 0.00 0.00 178.16 178.64 1gx3 h GLU 72 N 0.00 0.18 0.64 4.88 5.08 -1.66 -1.93 114.58 121.77 1gx3 h GLU 72 Ca -0.00 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.17 1gx3 h GLU 72 Cb 0.00 0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.30 1gx3 h GLU 72 CO 0.00 0.85 -0.31 0.45 -1.00 0.00 0.00 179.01 179.01 1gx3 h HIS 73 N -0.44 -0.79 -0.00 4.33 3.86 -0.88 -0.75 115.15 120.47 1gx3 h HIS 73 Ca -0.02 -0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.05 1gx3 h HIS 73 Cb 0.91 0.26 -0.02 0.00 1.06 0.00 0.00 27.41 29.62 1gx3 h HIS 73 CO 0.16 -0.46 -0.57 -0.91 0.86 0.00 0.00 177.93 177.01 1gx3 h ASN 74 N -0.99 0.01 0.09 2.45 2.35 -1.32 -0.45 115.58 117.72 1gx3 h ASN 74 Ca -0.09 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1gx3 h ASN 74 Cb 0.69 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.06 1gx3 h ASN 74 CO 0.14 0.58 -0.04 1.23 -1.65 0.00 0.00 177.43 177.69 1gx3 h GLY 75 N 1.71 -0.13 0.69 2.83 0.00 -1.31 -0.30 103.07 106.56 1gx3 h GLY 75 Ca -0.01 0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.38 1gx3 h GLY 75 CO 0.08 -0.05 -0.21 -2.00 0.00 0.00 0.00 176.54 174.36 1gx3 h LEU 76 N -0.26 -0.58 -1.35 3.11 5.85 -0.92 -2.22 115.31 118.93 1gx3 h LEU 76 Ca -0.01 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.77 1gx3 h LEU 76 Cb 0.22 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1gx3 h LEU 76 CO 0.02 -0.31 0.42 0.25 -0.34 0.00 0.00 178.44 178.49 1gx3 h LEU 77 N -0.43 0.75 -0.21 2.25 5.85 -1.06 -1.16 115.31 121.30 1gx3 h LEU 77 Ca 0.01 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1gx3 h LEU 77 Cb 0.43 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1gx3 h LEU 77 CO -0.08 0.55 0.13 1.23 -0.34 0.00 0.00 178.44 179.92 1gx3 h GLY 78 N 0.89 0.30 1.01 3.75 0.00 -0.68 0.19 103.07 108.52 1gx3 h GLY 78 Ca 0.24 -0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.45 1gx3 h GLY 78 CO -0.05 0.12 0.55 -0.97 0.00 0.00 0.00 176.54 176.18 1gx3 h TYR 79 N 0.27 1.04 -0.07 5.60 0.99 -0.98 -2.10 116.97 121.73 1gx3 h TYR 79 Ca 0.08 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.82 1gx3 h TYR 79 Cb 0.00 -0.35 -0.00 0.00 1.00 0.00 0.00 36.73 37.38 1gx3 h TYR 79 CO -0.05 0.66 0.02 0.28 -0.00 0.00 0.00 178.16 179.06 1gx3 h VAL 80 N 1.12 1.18 -0.81 -2.88 2.07 -0.67 -2.00 116.25 114.26 1gx3 h VAL 80 Ca 0.30 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.27 1gx3 h VAL 80 Cb -0.13 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1gx3 h VAL 80 CO -0.07 0.16 0.53 -0.07 0.02 0.00 0.00 177.57 178.15 1gx3 h LEU 81 N -0.10 0.94 -0.19 2.57 3.38 -0.92 -0.71 115.31 120.28 1gx3 h LEU 81 Ca 0.02 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1gx3 h LEU 81 Cb 0.23 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1gx3 h LEU 81 CO -0.00 0.69 0.09 -0.33 0.09 0.00 0.00 178.44 178.98 1gx3 h GLU 82 N 1.11 0.28 -0.02 1.13 5.08 -1.37 -1.41 114.58 119.38 1gx3 h GLU 82 Ca 0.30 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.58 1gx3 h GLU 82 Cb -0.12 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1gx3 h GLU 82 CO -0.06 0.31 -0.15 1.49 -1.00 0.00 0.00 179.01 179.59 1gx3 h GLU 83 N 0.18 0.03 0.00 2.33 4.57 -0.74 -1.41 114.58 119.53 1gx3 h GLU 83 Ca 0.07 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1gx3 h GLU 83 Cb 0.13 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1gx3 h GLU 83 CO -0.01 0.18 -0.10 -0.07 -1.18 0.00 0.00 179.01 177.84 1gx3 h LEU 84 N 0.03 0.00 0.00 1.64 3.38 -0.71 -3.48 115.31 116.17 1gx3 h LEU 84 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1gx3 h LEU 84 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1gx3 h LEU 84 CO 0.02 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.18 1gx3 n GLY 85 N 1.29 1.22 3.90 0.83 0.00 -0.53 -4.14 105.19 107.75 1gx3 n GLY 85 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 1gx3 n GLY 85 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gx3 s PHE 86 N -2.00 3.23 -0.14 1.61 0.40 -0.61 -4.67 117.98 115.80 1gx3 s PHE 86 Ca 0.00 0.89 -0.02 0.00 -0.60 0.00 0.00 56.93 57.20 1gx3 s PHE 86 Cb 0.00 -3.08 -0.02 0.00 0.51 0.00 0.00 43.02 40.43 1gx3 s PHE 86 CO 0.00 -1.22 -0.09 -2.00 0.70 0.00 0.00 175.22 172.61 1gx3 s GLU 87 N -5.32 3.48 -0.05 0.44 -6.30 -0.56 -4.27 118.70 106.12 1gx3 s GLU 87 Ca 0.58 -0.61 0.02 0.00 -2.50 0.00 0.00 54.97 52.47 1gx3 s GLU 87 Cb -0.11 -2.75 0.01 0.00 0.00 0.00 0.00 34.13 31.28 1gx3 s GLU 87 CO 0.50 0.25 -0.11 0.08 0.02 0.00 0.00 175.26 176.00 1gx3 s VAL 88 N 0.30 0.97 -0.07 3.70 1.01 -1.26 -2.18 120.40 122.88 1gx3 s VAL 88 Ca -0.07 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.52 1gx3 s VAL 88 Cb -0.15 -0.88 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 1gx3 s VAL 88 CO 0.04 0.31 -0.15 -1.61 0.00 0.00 0.00 175.10 173.69 1gx3 s GLU 89 N 0.47 2.72 -0.15 2.72 2.02 0.04 -4.97 118.70 121.55 1gx3 s GLU 89 Ca -0.09 -0.71 -0.17 0.00 0.02 0.00 0.00 54.97 54.02 1gx3 s GLU 89 Cb -0.13 -2.43 -0.04 0.00 0.10 0.00 0.00 34.13 31.64 1gx3 s GLU 89 CO 0.02 0.51 0.44 1.03 0.02 0.00 0.00 175.26 177.28 1gx3 s ARG 90 N -0.43 4.28 0.11 1.61 3.00 -1.26 -0.41 118.95 125.86 1gx3 s ARG 90 Ca 0.05 0.35 0.07 0.00 0.00 0.00 0.00 55.73 56.20 1gx3 s ARG 90 Cb -0.12 -3.47 -0.04 0.00 0.00 0.00 0.00 34.95 31.32 1gx3 s ARG 90 CO 0.02 0.09 -0.10 -0.51 0.00 0.00 0.00 175.30 174.80 1gx3 s LEU 91 N 0.87 3.04 0.16 2.53 1.43 0.12 -0.40 118.68 126.43 1gx3 s LEU 91 Ca 0.23 -0.41 0.08 0.00 -1.03 0.00 0.00 54.13 53.01 1gx3 s LEU 91 Cb -0.15 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1gx3 s LEU 91 CO 0.09 0.17 -0.09 -0.94 0.23 0.00 0.00 176.35 175.81 1gx3 s SER 92 N -2.29 4.33 0.17 2.29 1.04 -1.26 -0.79 113.70 117.19 1gx3 s SER 92 Ca 0.22 -0.52 -0.03 0.00 0.48 0.00 0.00 55.95 56.10 1gx3 s SER 92 Cb -0.11 -0.77 -0.03 0.00 0.10 0.00 0.00 66.02 65.21 1gx3 s SER 92 CO 0.14 0.12 0.16 -0.83 0.98 0.00 0.00 173.24 173.81 1gx3 s GLY 93 N -2.69 1.04 -0.14 7.32 0.00 0.41 -3.87 107.32 109.39 1gx3 s GLY 93 Ca 0.24 -1.42 -0.02 0.00 0.00 0.00 0.00 44.72 43.52 1gx3 s GLY 93 CO 0.15 -1.23 -0.07 0.50 0.00 0.00 0.00 173.10 172.45 1gx3 s ARG 94 N -4.08 3.51 -0.13 2.90 0.52 0.11 -1.57 118.95 120.21 1gx3 s ARG 94 Ca 0.29 -0.58 -0.24 0.00 -0.52 0.00 0.00 55.73 54.68 1gx3 s ARG 94 Cb 0.06 -2.79 -0.03 0.00 0.52 0.00 0.00 34.95 32.71 1gx3 s ARG 94 CO 0.06 0.26 0.75 0.08 0.02 0.00 0.00 175.30 176.48 1gx3 s VAL 95 N 0.28 4.97 -0.15 3.52 1.01 -1.26 -0.79 120.40 127.97 1gx3 s VAL 95 Ca -0.06 1.50 0.02 0.00 0.00 0.00 0.00 61.98 63.45 1gx3 s VAL 95 Cb -0.15 -4.08 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 1gx3 s VAL 95 CO 0.04 0.13 0.21 1.33 0.00 0.00 0.00 175.10 176.82 1gx3 n VAL 96 N 4.31 0.00 -1.41 2.92 0.24 -0.84 -4.80 118.33 118.75 1gx3 n VAL 96 Ca 0.01 -0.46 -0.62 0.00 -2.04 0.00 0.00 64.34 61.23 1gx3 n VAL 96 Cb 0.50 1.01 -0.11 0.00 -1.47 0.00 0.00 33.84 33.77 1gx3 n VAL 96 CO 0.00 0.00 0.00 1.87 -2.14 0.00 0.00 176.83 176.56 1gx3 n TRP 97 N -0.75 1.36 -1.69 6.34 -0.00 -0.90 -1.34 117.44 120.46 1gx3 n TRP 97 Ca 0.01 0.88 -0.15 0.00 -0.00 0.00 0.00 57.50 58.24 1gx3 n TRP 97 Cb 0.04 -2.27 -0.05 0.00 -0.00 0.00 0.00 31.31 29.03 1gx3 n TRP 97 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 177.69 176.36 1gx3 n MET 98 N 6.39 -1.11 -3.17 5.87 2.81 -1.26 -4.99 117.12 121.66 1gx3 n MET 98 Ca 0.47 0.95 -0.39 0.00 -1.81 0.00 0.00 57.70 56.93 1gx3 n MET 98 Cb -0.04 -5.16 -0.06 0.00 -0.71 0.00 0.00 33.22 27.25 1gx3 n MET 98 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1gx3 s ARG 99 N -3.72 4.35 1.07 0.03 0.52 -0.45 -5.02 118.95 115.72 1gx3 s ARG 99 Ca 0.00 0.80 -0.17 0.00 -0.52 0.00 0.00 55.73 55.84 1gx3 s ARG 99 Cb 0.00 -3.34 0.07 0.00 0.52 0.00 0.00 34.95 32.20 1gx3 s ARG 99 CO 0.00 0.37 0.06 0.00 0.02 0.00 0.00 175.30 175.75 1gx3 n ALA 100 N 2.67 -3.80 -1.82 2.13 0.00 -1.26 -4.91 120.51 113.52 1gx3 n ALA 100 Ca -0.06 -1.09 -0.33 0.00 0.00 0.00 0.00 53.44 51.96 1gx3 n ALA 100 Cb 0.51 -1.57 -0.05 0.00 0.00 0.00 0.00 19.45 18.34 1gx3 n ALA 100 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1gx3 s ASP 101 N -1.85 6.74 0.00 0.00 2.15 -1.26 -3.32 116.67 119.13 1gx3 s ASP 101 Ca 0.55 1.70 0.00 0.00 0.43 0.00 0.00 52.55 55.23 1gx3 s ASP 101 Cb -0.14 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 1gx3 s ASP 101 CO 0.67 -0.50 0.00 0.47 -0.17 0.00 0.00 175.17 175.64 1gx3 n ASP 102 N -0.96 -0.52 -4.68 -0.34 8.00 -1.26 -4.96 116.55 111.84 1gx3 n ASP 102 Ca 0.07 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.25 1gx3 n ASP 102 Cb 0.54 -1.86 0.15 0.00 -0.02 0.00 0.00 41.12 39.93 1gx3 n ASP 102 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gx3 s ALA 103 N -1.81 1.59 0.83 2.24 0.00 -1.21 -4.96 121.76 118.44 1gx3 s ALA 103 Ca 0.00 0.68 -0.10 0.00 0.00 0.00 0.00 51.96 52.54 1gx3 s ALA 103 Cb 0.00 -3.47 0.09 0.00 0.00 0.00 0.00 23.12 19.74 1gx3 s ALA 103 CO 0.00 -2.61 1.11 -2.14 0.00 0.00 0.00 175.76 172.12 1gx3 s PRO 104 N -4.47 1.78 0.14 0.00 0.02 -1.26 -4.93 135.00 126.28 1gx3 s PRO 104 Ca 0.69 1.31 -0.33 0.00 0.02 0.00 0.00 61.00 62.70 1gx3 s PRO 104 Cb -0.25 -1.83 -0.12 0.00 0.02 0.00 0.00 34.50 32.31 1gx3 s PRO 104 CO 0.55 -2.02 1.70 -0.11 -0.33 0.00 0.00 177.00 176.80 1gx3 n LEU 105 N -3.80 3.57 -4.85 -5.54 7.94 -1.26 -4.98 117.00 108.09 1gx3 n LEU 105 Ca 0.10 1.05 -0.31 0.00 -1.11 0.00 0.00 56.01 55.74 1gx3 n LEU 105 Cb 0.53 -1.49 0.02 0.00 0.53 0.00 0.00 43.42 43.02 1gx3 n LEU 105 CO 0.52 -0.04 0.71 -2.84 -1.11 0.00 0.00 177.39 174.63 1gx3 s PRO 106 N 1.69 3.35 0.80 1.96 0.02 -1.26 -5.03 135.00 136.53 1gx3 s PRO 106 Ca 0.80 0.84 -0.11 0.00 0.02 0.00 0.00 61.00 62.56 1gx3 s PRO 106 Cb -0.59 -2.05 0.07 0.00 0.02 0.00 0.00 34.50 31.95 1gx3 s PRO 106 CO 0.38 -0.77 1.09 0.00 -0.33 0.00 0.00 177.00 177.37 1gx3 s ALA 107 N -3.10 2.12 -0.56 -1.55 0.00 -1.26 -4.90 121.76 112.52 1gx3 s ALA 107 Ca 0.56 0.17 -0.28 0.00 0.00 0.00 0.00 51.96 52.42 1gx3 s ALA 107 Cb -0.12 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.77 1gx3 s ALA 107 CO 0.53 -1.87 1.40 -0.65 0.00 0.00 0.00 175.76 175.17 1gx3 s GLN 108 N -4.92 3.33 0.00 0.00 -0.21 -1.26 -4.34 119.66 112.25 1gx3 s GLN 108 Ca 0.61 0.46 0.00 0.00 0.02 0.00 0.00 55.36 56.46 1gx3 s GLN 108 Cb -0.17 -4.11 0.00 0.00 1.00 0.00 0.00 33.01 29.73 1gx3 s GLN 108 CO 0.56 -1.91 0.56 0.25 -2.12 0.00 0.00 175.29 172.64 1gx3 n THR 109 N 6.86 0.31 -4.90 -0.19 -2.24 -0.61 -4.82 114.28 108.68 1gx3 n THR 109 Ca 0.12 -0.48 -0.28 0.00 -2.27 0.00 0.00 64.05 61.15 1gx3 n THR 109 Cb 0.49 1.03 -0.15 0.00 -2.10 0.00 0.00 70.33 69.60 1gx3 n THR 109 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1gx3 s HIS 110 N -0.31 2.04 -0.10 4.78 5.65 -0.84 -4.91 115.29 121.60 1gx3 s HIS 110 Ca 0.00 -0.39 0.03 0.00 0.25 0.00 0.00 55.06 54.95 1gx3 s HIS 110 Cb 0.00 -1.26 0.01 0.00 -1.18 0.00 0.00 32.58 30.15 1gx3 s HIS 110 CO 0.00 0.05 -0.20 1.21 -0.65 0.00 0.00 174.74 175.16 1gx3 s ASN 111 N -0.95 2.69 0.35 9.88 3.04 -1.26 -0.44 114.94 128.25 1gx3 s ASN 111 Ca 0.09 -0.49 0.04 0.00 0.04 0.00 0.00 52.86 52.54 1gx3 s ASN 111 Cb -0.09 -1.23 -0.04 0.00 -1.54 0.00 0.00 41.25 38.35 1gx3 s ASN 111 CO 0.01 0.10 0.13 0.68 -3.04 0.00 0.00 177.10 174.98 1gx3 s VAL 112 N 0.58 0.60 0.03 -5.21 -7.23 0.03 -4.75 120.40 104.45 1gx3 s VAL 112 Ca -0.14 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.11 1gx3 s VAL 112 Cb -0.17 -2.50 -0.03 0.00 0.56 0.00 0.00 36.38 34.25 1gx3 s VAL 112 CO 0.05 0.00 -0.24 -0.76 -0.31 0.00 0.00 175.10 173.84 1gx3 s LEU 113 N -3.49 2.14 -0.23 1.32 1.43 -0.45 -0.70 118.68 118.69 1gx3 s LEU 113 Ca 0.31 -0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 52.87 1gx3 s LEU 113 Cb 0.05 -1.17 0.02 0.00 0.03 0.00 0.00 46.19 45.11 1gx3 s LEU 113 CO 0.16 0.24 -0.09 -0.55 0.23 0.00 0.00 176.35 176.33 1gx3 s SER 114 N -1.06 4.03 -0.02 2.29 0.15 0.46 -1.56 113.70 117.99 1gx3 s SER 114 Ca 0.10 -0.76 0.06 0.00 0.70 0.00 0.00 55.95 56.04 1gx3 s SER 114 Cb -0.09 -1.62 -0.01 0.00 -1.71 0.00 0.00 66.02 62.58 1gx3 s SER 114 CO 0.01 -0.08 -0.19 -0.69 1.20 0.00 0.00 173.24 173.49 1gx3 s VAL 115 N 1.33 1.53 -0.20 4.45 1.01 0.34 -0.78 120.40 128.09 1gx3 s VAL 115 Ca 0.02 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.15 1gx3 s VAL 115 Cb -0.15 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1gx3 s VAL 115 CO -0.06 0.43 -0.08 0.00 0.00 0.00 0.00 175.10 175.39 1gx3 s ALA 116 N -0.38 2.72 -0.17 5.51 0.00 -0.93 0.30 121.76 128.82 1gx3 s ALA 116 Ca 0.06 -1.12 -0.26 0.00 0.00 0.00 0.00 51.96 50.64 1gx3 s ALA 116 Cb -0.08 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 1gx3 s ALA 116 CO -0.00 -0.28 0.87 0.08 0.00 0.00 0.00 175.76 176.42 1gx3 s VAL 117 N 1.22 4.85 0.09 0.00 1.01 -1.26 -1.50 120.40 124.81 1gx3 s VAL 117 Ca 0.02 1.71 -0.33 0.00 0.00 0.00 0.00 61.98 63.39 1gx3 s VAL 117 Cb -0.14 -4.17 -0.12 0.00 0.00 0.00 0.00 36.38 31.94 1gx3 s VAL 117 CO -0.03 0.01 1.74 -2.65 0.00 0.00 0.00 175.10 174.17 1gx3 n PRO 118 N 5.30 2.39 0.00 2.72 -0.02 -1.26 -0.62 135.00 143.51 1gx3 n PRO 118 Ca 0.06 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 1gx3 n PRO 118 Cb 0.49 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 1gx3 n PRO 118 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gx3 n GLY 119 N 3.94 3.20 3.78 -1.23 0.00 -1.26 -4.96 105.19 108.65 1gx3 n GLY 119 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1gx3 n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gx3 s ALA 120 N -2.09 3.66 0.59 4.61 0.00 0.20 -5.08 121.76 123.65 1gx3 s ALA 120 Ca 0.00 -0.70 -0.19 0.00 0.00 0.00 0.00 51.96 51.08 1gx3 s ALA 120 Cb 0.00 -1.90 -0.04 0.00 0.00 0.00 0.00 23.12 21.18 1gx3 s ALA 120 CO 0.00 0.47 1.17 -0.51 0.00 0.00 0.00 175.76 176.89 1gx3 s ASP 121 N -0.55 5.34 0.00 0.00 1.01 -1.26 -4.45 116.67 116.76 1gx3 s ASP 121 Ca 0.12 2.28 0.00 0.00 0.71 0.00 0.00 52.55 55.66 1gx3 s ASP 121 Cb -0.12 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1gx3 s ASP 121 CO 0.02 -1.49 0.00 0.61 0.21 0.00 0.00 175.17 174.52 1gx3 n GLY 122 N 0.30 -1.82 3.05 0.21 0.00 -1.26 -4.92 105.19 100.75 1gx3 n GLY 122 Ca 0.13 -1.40 -0.08 0.00 0.00 0.00 0.00 46.02 44.67 1gx3 n GLY 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gx3 s ARG 123 N 0.00 0.49 -0.16 1.61 0.52 -1.26 -4.63 118.95 115.53 1gx3 s ARG 123 Ca 0.00 -0.94 0.01 0.00 -0.52 0.00 0.00 55.73 54.29 1gx3 s ARG 123 Cb 0.00 0.17 0.01 0.00 0.52 0.00 0.00 34.95 35.65 1gx3 s ARG 123 CO 0.00 -0.09 -0.19 0.71 0.02 0.00 0.00 175.30 175.75 1gx3 s TYR 124 N -2.84 2.74 -0.18 -0.53 1.51 0.87 0.31 117.35 119.23 1gx3 s TYR 124 Ca -0.03 -1.30 -0.29 0.00 -1.01 0.00 0.00 57.07 54.43 1gx3 s TYR 124 Cb 0.00 -1.87 -0.01 0.00 -0.11 0.00 0.00 41.96 39.97 1gx3 s TYR 124 CO -0.06 -0.61 1.18 -1.17 -1.11 0.00 0.00 175.55 173.78 1gx3 s LEU 125 N 0.95 4.16 -0.07 -1.29 2.96 -0.66 0.13 118.68 124.86 1gx3 s LEU 125 Ca -0.03 1.60 0.02 0.00 -0.22 0.00 0.00 54.13 55.49 1gx3 s LEU 125 Cb -0.15 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.02 1gx3 s LEU 125 CO -0.04 -0.71 -0.11 -0.69 -1.32 0.00 0.00 176.35 173.48 1gx3 s VAL 126 N 3.27 1.09 -0.28 1.68 1.01 -0.60 -2.21 120.40 124.35 1gx3 s VAL 126 Ca 0.51 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1gx3 s VAL 126 Cb -0.20 -1.01 0.15 0.00 0.00 0.00 0.00 36.38 35.32 1gx3 s VAL 126 CO 0.12 0.35 0.37 -0.62 0.00 0.00 0.00 175.10 175.33 1gx3 s ASP 127 N 0.77 0.71 -0.05 3.32 2.15 -1.26 -1.35 116.67 120.96 1gx3 s ASP 127 Ca -0.13 -0.40 0.21 0.00 0.43 0.00 0.00 52.55 52.66 1gx3 s ASP 127 Cb -0.15 0.95 0.69 0.00 -0.30 0.00 0.00 42.92 44.10 1gx3 s ASP 127 CO 0.02 -0.36 1.59 1.33 -0.17 0.00 0.00 175.17 177.59 1gx3 n VAL 128 N 5.34 1.40 -0.08 1.11 0.24 -1.26 -3.15 118.33 121.93 1gx3 n VAL 128 Ca -0.01 -1.09 0.01 0.00 -2.04 0.00 0.00 64.34 61.21 1gx3 n VAL 128 Cb 0.49 0.33 0.01 0.00 -1.47 0.00 0.00 33.84 33.19 1gx3 n VAL 128 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gx3 n GLY 129 N 1.43 3.04 0.28 7.63 0.00 -1.26 -4.67 105.19 111.63 1gx3 n GLY 129 Ca 0.25 -0.07 0.15 0.00 0.00 0.00 0.00 46.02 46.35 1gx3 n GLY 129 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1gx3 n PHE 130 N -0.55 0.00 -0.87 1.61 7.35 -1.26 -3.15 117.46 120.59 1gx3 n PHE 130 Ca 0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 1gx3 n PHE 130 Cb 0.28 -0.02 0.00 0.00 0.35 0.00 0.00 39.48 40.09 1gx3 n PHE 130 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1gx3 n GLY 131 N 1.13 0.41 0.33 7.13 0.00 -1.26 -4.45 105.19 108.48 1gx3 n GLY 131 Ca 0.20 -1.58 0.04 0.00 0.00 0.00 0.00 46.02 44.69 1gx3 n GLY 131 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1gx3 h GLY 132 N 0.00 1.44 -3.64 -0.02 0.00 -1.91 -2.09 103.07 96.84 1gx3 h GLY 132 Ca 0.00 -0.37 -0.23 0.00 0.00 0.00 0.00 47.33 46.73 1gx3 h GLY 132 CO 0.00 0.16 0.29 -0.18 0.00 0.00 0.00 176.54 176.81 1gx3 n GLN 133 N -4.68 3.54 -2.10 4.80 -0.06 -1.26 -4.77 117.38 112.86 1gx3 n GLN 133 Ca 0.16 -2.92 -0.37 0.00 -2.00 0.00 0.00 57.00 51.87 1gx3 n GLN 133 Cb 0.30 -2.18 0.01 0.00 -4.06 0.00 0.00 30.24 24.31 1gx3 n GLN 133 CO 0.00 0.00 0.00 -0.08 -0.20 0.00 0.00 177.06 176.78 1gx3 s THR 134 N -2.87 2.79 0.07 1.69 -1.32 -0.79 -4.93 115.64 110.27 1gx3 s THR 134 Ca 0.53 0.54 -0.35 0.00 -1.21 0.00 0.00 61.69 61.20 1gx3 s THR 134 Cb 0.42 -3.25 -0.15 0.00 -1.51 0.00 0.00 72.50 68.01 1gx3 s THR 134 CO 0.13 -0.05 1.56 0.18 -2.21 0.00 0.00 174.62 174.22 1gx3 n LEU 135 N -1.04 2.63 -0.48 9.08 4.77 -1.19 -4.82 117.00 125.95 1gx3 n LEU 135 Ca 0.10 1.08 0.09 0.00 -0.03 0.00 0.00 56.01 57.25 1gx3 n LEU 135 Cb 0.48 -1.32 0.01 0.00 -2.33 0.00 0.00 43.42 40.27 1gx3 n LEU 135 CO 0.47 -0.50 0.33 0.35 -1.33 0.00 0.00 177.39 176.70 1gx3 n THR 136 N 3.48 0.00 -3.97 -5.08 -2.24 -1.26 -4.54 114.28 100.67 1gx3 n THR 136 Ca 0.19 -0.35 -0.08 0.00 -2.27 0.00 0.00 64.05 61.54 1gx3 n THR 136 Cb 0.24 1.25 -0.09 0.00 -2.10 0.00 0.00 70.33 69.64 1gx3 n THR 136 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1gx3 s SER 137 N -2.00 0.28 -0.01 3.42 0.01 -1.26 -4.41 113.70 109.72 1gx3 s SER 137 Ca 0.16 -0.76 -0.30 0.00 1.31 0.00 0.00 55.95 56.36 1gx3 s SER 137 Cb 0.15 0.26 -0.04 0.00 0.21 0.00 0.00 66.02 66.60 1gx3 s SER 137 CO 0.42 -0.62 1.09 -2.16 0.41 0.00 0.00 173.24 172.38 1gx3 s PRO 138 N -3.58 4.46 0.28 12.44 0.04 -1.26 -4.82 135.00 142.57 1gx3 s PRO 138 Ca 0.03 1.57 0.09 0.00 0.04 0.00 0.00 61.00 62.74 1gx3 s PRO 138 Cb 0.05 -3.46 -0.04 0.00 0.04 0.00 0.00 34.50 31.08 1gx3 s PRO 138 CO -0.09 -0.23 0.02 0.96 0.04 0.00 0.00 177.00 177.70 1gx3 s ILE 139 N 1.41 3.30 0.27 0.56 -4.36 -0.94 -4.98 121.20 116.46 1gx3 s ILE 139 Ca 0.54 -1.89 -0.29 0.00 -0.26 0.00 0.00 60.65 58.75 1gx3 s ILE 139 Cb -0.24 -2.85 -0.09 0.00 1.25 0.00 0.00 42.46 40.52 1gx3 s ILE 139 CO 0.26 -0.33 1.17 -0.13 0.24 0.00 0.00 174.94 176.15 1gx3 s ARG 140 N -3.70 4.54 -1.16 0.37 0.52 -1.26 -1.66 118.95 116.59 1gx3 s ARG 140 Ca 0.33 1.92 -0.13 0.00 -0.52 0.00 0.00 55.73 57.34 1gx3 s ARG 140 Cb -0.05 -3.17 0.20 0.00 0.52 0.00 0.00 34.95 32.45 1gx3 s ARG 140 CO 0.20 0.05 1.31 -1.17 0.02 0.00 0.00 175.30 175.71 1gx3 s LEU 141 N -1.27 5.48 -0.28 2.53 1.98 0.92 -4.68 118.68 123.37 1gx3 s LEU 141 Ca 0.47 -3.14 -0.11 0.00 -2.89 0.00 0.00 54.13 48.46 1gx3 s LEU 141 Cb -0.34 -2.34 0.11 0.00 0.66 0.00 0.00 46.19 44.28 1gx3 s LEU 141 CO 0.43 -0.61 0.63 -0.70 -1.89 0.00 0.00 176.35 174.21 1gx3 s GLU 142 N 0.72 0.59 0.27 1.98 2.12 -1.26 -4.44 118.70 118.68 1gx3 s GLU 142 Ca 0.38 1.33 -0.25 0.00 0.36 0.00 0.00 54.97 56.80 1gx3 s GLU 142 Cb -0.05 0.59 -0.09 0.00 0.26 0.00 0.00 34.13 34.84 1gx3 s GLU 142 CO -0.03 -0.19 0.88 0.00 -0.54 0.00 0.00 175.26 175.38 1gx3 s ALA 143 N 2.46 3.30 0.00 6.30 0.00 -1.26 -4.55 121.76 128.01 1gx3 s ALA 143 Ca -0.07 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1gx3 s ALA 143 Cb -0.10 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1gx3 s ALA 143 CO -0.19 0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.21 1gx3 n GLY 144 N 0.83 2.30 3.74 0.00 0.00 0.30 -4.97 105.19 107.39 1gx3 n GLY 144 Ca -0.00 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 1gx3 n GLY 144 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gx3 s PRO 145 N 0.00 4.53 0.41 1.61 0.04 -1.26 -4.86 135.00 135.46 1gx3 s PRO 145 Ca 0.00 1.81 -0.26 0.00 0.04 0.00 0.00 61.00 62.59 1gx3 s PRO 145 Cb 0.00 -3.26 -0.09 0.00 0.04 0.00 0.00 34.50 31.20 1gx3 s PRO 145 CO 0.00 -0.03 1.30 0.08 0.04 0.00 0.00 177.00 178.39 1gx3 s VAL 146 N -0.10 2.61 -0.09 -0.36 1.01 -1.26 -4.67 120.40 117.55 1gx3 s VAL 146 Ca 0.52 0.55 0.00 0.00 0.00 0.00 0.00 61.98 63.05 1gx3 s VAL 146 Cb -0.31 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 32.77 1gx3 s VAL 146 CO 0.36 0.08 -0.07 -1.10 0.00 0.00 0.00 175.10 174.36 1gx3 s GLN 147 N -2.25 1.35 0.17 2.72 -0.21 -1.17 -5.09 119.66 115.19 1gx3 s GLN 147 Ca 0.57 -0.22 -0.29 0.00 0.02 0.00 0.00 55.36 55.44 1gx3 s GLN 147 Cb -0.38 -1.36 -0.08 0.00 1.00 0.00 0.00 33.01 32.20 1gx3 s GLN 147 CO 0.49 -0.17 0.90 -1.14 -2.12 0.00 0.00 175.29 173.25 1gx3 s GLN 148 N 1.38 4.73 0.49 2.91 2.00 -1.26 -2.74 119.66 127.17 1gx3 s GLN 148 Ca -0.02 1.38 0.05 0.00 -2.00 0.00 0.00 55.36 54.78 1gx3 s GLN 148 Cb -0.14 -3.31 0.05 0.00 0.80 0.00 0.00 33.01 30.42 1gx3 s GLN 148 CO -0.04 0.42 0.45 0.25 -0.50 0.00 0.00 175.29 175.87 1gx3 n THR 149 N 1.98 0.00 0.16 -0.34 -2.24 -1.24 -4.99 114.28 107.61 1gx3 n THR 149 Ca -0.02 -1.86 0.12 0.00 -2.27 0.00 0.00 64.05 60.03 1gx3 n THR 149 Cb 0.48 -0.21 0.65 0.00 -2.10 0.00 0.00 70.33 69.15 1gx3 n THR 149 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1gx3 h ARG 150 N 0.00 0.02 0.00 -0.78 3.08 -1.96 -3.41 114.38 111.33 1gx3 h ARG 150 Ca -0.29 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1gx3 h ARG 150 Cb 1.11 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1gx3 h ARG 150 CO 0.44 0.01 0.00 0.72 -1.07 0.00 0.00 179.97 180.07 1gx3 n HIS 151 N -4.48 0.00 -1.83 3.04 8.25 -1.26 -5.01 115.22 113.93 1gx3 n HIS 151 Ca 0.02 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.17 1gx3 n HIS 151 Cb 0.27 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.40 1gx3 n HIS 151 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1gx3 s GLU 152 N 2.91 3.36 0.51 -0.41 8.01 -1.26 -5.05 118.70 126.76 1gx3 s GLU 152 Ca 0.00 0.72 -0.21 0.00 0.01 0.00 0.00 54.97 55.50 1gx3 s GLU 152 Cb 0.00 -2.06 -0.07 0.00 -4.31 0.00 0.00 34.13 27.70 1gx3 s GLU 152 CO 0.00 -0.74 1.14 -2.14 0.01 0.00 0.00 175.26 173.53 1gx3 s PRO 153 N -5.19 3.53 0.15 0.39 0.02 -1.26 -3.63 135.00 129.00 1gx3 s PRO 153 Ca 0.56 1.66 0.05 0.00 0.02 0.00 0.00 61.00 63.30 1gx3 s PRO 153 Cb -0.11 -2.16 -0.04 0.00 0.02 0.00 0.00 34.50 32.20 1gx3 s PRO 153 CO 0.54 -0.72 -0.12 0.71 -0.33 0.00 0.00 177.00 177.08 1gx3 s TYR 154 N -1.69 1.39 -0.09 6.54 1.51 -1.11 0.12 117.35 124.01 1gx3 s TYR 154 Ca 0.69 -0.67 -0.04 0.00 -1.01 0.00 0.00 57.07 56.04 1gx3 s TYR 154 Cb -0.25 -0.69 0.04 0.00 -0.11 0.00 0.00 41.96 40.95 1gx3 s TYR 154 CO 0.29 0.16 0.21 0.50 -1.11 0.00 0.00 175.55 175.60 1gx3 s ARG 155 N -3.44 0.15 -0.15 -0.62 3.52 -0.58 -3.02 118.95 114.82 1gx3 s ARG 155 Ca 0.16 0.48 -0.14 0.00 -0.13 0.00 0.00 55.73 56.10 1gx3 s ARG 155 Cb -0.00 -0.15 -0.05 0.00 -1.56 0.00 0.00 34.95 33.20 1gx3 s ARG 155 CO 0.02 -0.18 0.31 -0.51 -0.81 0.00 0.00 175.30 174.14 1gx3 s LEU 156 N 1.33 4.26 0.26 -0.88 1.43 -1.26 0.02 118.68 123.84 1gx3 s LEU 156 Ca -0.08 0.55 0.04 0.00 -1.03 0.00 0.00 54.13 53.60 1gx3 s LEU 156 Cb -0.11 -2.40 -0.06 0.00 0.03 0.00 0.00 46.19 43.66 1gx3 s LEU 156 CO -0.07 0.11 0.01 0.42 0.23 0.00 0.00 176.35 177.04 1gx3 s THR 157 N 0.37 1.11 0.05 5.49 -4.23 -0.40 -0.54 115.64 117.50 1gx3 s THR 157 Ca 0.17 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 1gx3 s THR 157 Cb -0.13 -2.47 -0.03 0.00 1.34 0.00 0.00 72.50 71.20 1gx3 s THR 157 CO 0.05 -0.23 -0.05 -0.60 -0.54 0.00 0.00 174.62 173.25 1gx3 s ARG 158 N -3.86 0.56 -0.37 3.99 3.52 -1.26 0.17 118.95 121.69 1gx3 s ARG 158 Ca 0.31 -0.98 0.02 0.00 -0.13 0.00 0.00 55.73 54.94 1gx3 s ARG 158 Cb 0.06 -0.01 0.15 0.00 -1.56 0.00 0.00 34.95 33.60 1gx3 s ARG 158 CO 0.11 -0.04 0.29 -1.01 -0.81 0.00 0.00 175.30 173.83 1gx3 s HIS 159 N -2.67 0.48 -0.24 5.12 3.76 0.23 -4.98 115.29 116.99 1gx3 s HIS 159 Ca -0.02 -1.54 -0.18 0.00 -0.15 0.00 0.00 55.06 53.18 1gx3 s HIS 159 Cb -0.01 -0.75 0.03 0.00 1.11 0.00 0.00 32.58 32.95 1gx3 s HIS 159 CO -0.04 -0.88 0.32 0.41 -0.85 0.00 0.00 174.74 173.70 1gx3 n GLY 160 N 3.83 -0.33 4.87 -2.22 0.00 -1.26 -1.81 105.19 108.27 1gx3 n GLY 160 Ca 0.15 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.78 1gx3 n GLY 160 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gx3 n ASP 161 N 0.53 0.00 -4.57 1.61 8.00 -1.26 -4.88 116.55 115.98 1gx3 n ASP 161 Ca -0.03 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.05 1gx3 n ASP 161 Cb 0.54 -1.08 -0.03 0.00 -0.02 0.00 0.00 41.12 40.54 1gx3 n ASP 161 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1gx3 s ASP 162 N -1.54 6.38 0.16 -2.24 1.11 -0.75 -4.19 116.67 115.59 1gx3 s ASP 162 Ca 0.00 -0.05 -0.00 0.00 0.18 0.00 0.00 52.55 52.68 1gx3 s ASP 162 Cb 0.00 -2.55 -0.04 0.00 1.07 0.00 0.00 42.92 41.40 1gx3 s ASP 162 CO 0.00 -1.55 0.34 -1.00 1.18 0.00 0.00 175.17 174.14 1gx3 s HIS 163 N 5.08 3.49 -0.05 4.23 3.76 0.58 -0.60 115.29 131.78 1gx3 s HIS 163 Ca 0.40 0.30 0.02 0.00 -0.15 0.00 0.00 55.06 55.63 1gx3 s HIS 163 Cb -0.08 -1.81 0.01 0.00 1.11 0.00 0.00 32.58 31.81 1gx3 s HIS 163 CO 0.23 0.45 -0.10 0.99 -0.85 0.00 0.00 174.74 175.46 1gx3 s THR 164 N -1.76 0.92 -0.16 1.30 2.01 0.13 -1.27 115.64 116.81 1gx3 s THR 164 Ca 0.37 -0.38 -0.08 0.00 0.31 0.00 0.00 61.69 61.91 1gx3 s THR 164 Cb -0.11 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.50 1gx3 s THR 164 CO 0.28 0.30 0.11 -0.22 -0.69 0.00 0.00 174.62 174.40 1gx3 s LEU 165 N 0.54 4.12 0.20 4.42 2.96 -0.58 -1.27 118.68 129.08 1gx3 s LEU 165 Ca -0.10 0.27 0.04 0.00 -0.22 0.00 0.00 54.13 54.12 1gx3 s LEU 165 Cb -0.13 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 1gx3 s LEU 165 CO 0.02 0.28 -0.05 0.00 -1.32 0.00 0.00 176.35 175.28 1gx3 s ALA 166 N -0.25 1.74 -0.01 5.97 0.00 0.10 0.58 121.76 129.89 1gx3 s ALA 166 Ca 0.10 -1.68 0.03 0.00 0.00 0.00 0.00 51.96 50.41 1gx3 s ALA 166 Cb -0.12 0.29 -0.01 0.00 0.00 0.00 0.00 23.12 23.29 1gx3 s ALA 166 CO 0.01 -0.17 -0.10 0.00 0.00 0.00 0.00 175.76 175.50 1gx3 s ALA 167 N -3.34 0.81 -0.51 0.00 0.00 0.20 -1.52 121.76 117.40 1gx3 s ALA 167 Ca 0.24 -0.43 -0.22 0.00 0.00 0.00 0.00 51.96 51.56 1gx3 s ALA 167 Cb 0.04 -0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.00 1gx3 s ALA 167 CO 0.06 0.20 0.76 1.14 0.00 0.00 0.00 175.76 177.92 1gx3 s GLN 168 N -0.26 3.25 -0.38 0.00 -2.07 0.32 0.12 119.66 120.64 1gx3 s GLN 168 Ca 0.04 -0.51 -0.08 0.00 -1.82 0.00 0.00 55.36 52.98 1gx3 s GLN 168 Cb -0.04 -4.05 0.06 0.00 -1.09 0.00 0.00 33.01 27.89 1gx3 s GLN 168 CO -0.00 -1.29 0.18 0.08 -1.32 0.00 0.00 175.29 172.94 1gx3 s VAL 169 N 3.22 4.03 -1.11 3.63 1.01 0.38 -4.43 120.40 127.13 1gx3 s VAL 169 Ca 0.23 -1.26 -0.19 0.00 0.00 0.00 0.00 61.98 60.76 1gx3 s VAL 169 Cb -0.15 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 1gx3 s VAL 169 CO 0.17 -0.35 0.80 0.54 0.00 0.00 0.00 175.10 176.26 1gx3 n ARG 170 N 4.86 -1.29 0.00 2.72 1.74 -1.26 -2.64 116.66 120.80 1gx3 n ARG 170 Ca -0.11 0.52 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 1gx3 n ARG 170 Cb 0.44 -4.23 0.00 0.00 -1.02 0.00 0.00 32.46 27.65 1gx3 n ARG 170 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gx3 n GLY 171 N -1.65 2.91 3.32 -0.13 0.00 -1.26 -5.02 105.19 103.35 1gx3 n GLY 171 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1gx3 n GLY 171 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gx3 s GLU 172 N -0.09 3.36 0.17 1.61 2.02 -1.08 -5.09 118.70 119.61 1gx3 s GLU 172 Ca 0.00 -0.66 -0.30 0.00 0.02 0.00 0.00 54.97 54.03 1gx3 s GLU 172 Cb 0.00 -2.85 -0.09 0.00 0.10 0.00 0.00 34.13 31.29 1gx3 s GLU 172 CO 0.00 -0.05 1.34 -1.58 0.02 0.00 0.00 175.26 174.99 1gx3 s TRP 173 N 1.06 3.24 -0.15 1.61 0.52 -1.26 -0.47 118.94 123.49 1gx3 s TRP 173 Ca 0.00 1.12 -0.04 0.00 0.02 0.00 0.00 56.10 57.21 1gx3 s TRP 173 Cb -0.15 -3.64 0.05 0.00 -1.15 0.00 0.00 33.47 28.59 1gx3 s TRP 173 CO -0.01 -2.09 0.07 -0.65 0.02 0.00 0.00 176.95 174.29 1gx3 s GLN 174 N 0.26 0.16 0.45 4.98 -0.21 0.12 -4.91 119.66 120.52 1gx3 s GLN 174 Ca 0.59 -0.06 -0.24 0.00 0.02 0.00 0.00 55.36 55.66 1gx3 s GLN 174 Cb -0.37 -1.66 -0.09 0.00 1.00 0.00 0.00 33.01 31.90 1gx3 s GLN 174 CO 0.36 -0.60 1.30 -2.30 -2.12 0.00 0.00 175.29 171.92 1gx3 n PRO 175 N 5.24 1.90 -0.11 2.91 -0.02 -1.26 0.63 135.00 144.28 1gx3 n PRO 175 Ca -0.07 0.68 -0.19 0.00 -2.02 0.00 0.00 63.50 61.90 1gx3 n PRO 175 Cb 0.49 -2.44 -0.07 0.00 -0.02 0.00 0.00 33.50 31.46 1gx3 n PRO 175 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1gx3 n LEU 176 N -0.09 1.92 -3.70 2.45 4.77 0.20 -3.81 117.00 118.74 1gx3 n LEU 176 Ca 0.07 0.39 -0.07 0.00 -0.03 0.00 0.00 56.01 56.37 1gx3 n LEU 176 Cb 0.41 -0.82 -0.02 0.00 -2.33 0.00 0.00 43.42 40.66 1gx3 n LEU 176 CO 0.58 0.13 0.54 -0.72 -1.33 0.00 0.00 177.39 176.58 1gx3 s TYR 177 N -2.58 -0.27 0.17 -1.77 -0.85 -1.21 -2.00 117.35 108.84 1gx3 s TYR 177 Ca -0.31 -0.06 0.09 0.00 -0.52 0.00 0.00 57.07 56.27 1gx3 s TYR 177 Cb 0.08 0.64 -0.04 0.00 0.38 0.00 0.00 41.96 43.02 1gx3 s TYR 177 CO 0.45 -0.98 -0.12 0.95 -1.52 0.00 0.00 175.55 174.33 1gx3 s THR 178 N -3.64 3.08 0.21 -3.49 -4.23 0.03 -1.52 115.64 106.06 1gx3 s THR 178 Ca 0.08 -1.65 -0.21 0.00 -1.18 0.00 0.00 61.69 58.74 1gx3 s THR 178 Cb -0.03 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 71.35 1gx3 s THR 178 CO -0.00 -0.07 0.61 0.72 -0.54 0.00 0.00 174.62 175.34 1gx3 s PHE 179 N -1.60 -0.31 0.38 3.99 -0.12 -0.40 0.04 117.98 119.95 1gx3 s PHE 179 Ca 0.23 -0.01 0.08 0.00 -0.05 0.00 0.00 56.93 57.18 1gx3 s PHE 179 Cb -0.09 0.55 -0.06 0.00 -0.63 0.00 0.00 43.02 42.80 1gx3 s PHE 179 CO 0.14 -0.98 0.09 0.95 -0.05 0.00 0.00 175.22 175.37 1gx3 s THR 180 N -3.84 2.47 -0.45 -4.49 -4.23 -1.25 -0.30 115.64 103.54 1gx3 s THR 180 Ca 0.06 -1.84 0.08 0.00 -1.18 0.00 0.00 61.69 58.81 1gx3 s THR 180 Cb -0.02 -2.92 0.54 0.00 1.34 0.00 0.00 72.50 71.44 1gx3 s THR 180 CO -0.04 -0.10 1.40 0.35 -0.54 0.00 0.00 174.62 175.69 1gx3 n THR 181 N -1.08 1.99 -2.40 3.99 -2.24 -1.26 -4.60 114.28 108.67 1gx3 n THR 181 Ca -0.03 -1.01 -0.43 0.00 -2.27 0.00 0.00 64.05 60.31 1gx3 n THR 181 Cb 0.64 -0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 68.43 1gx3 n THR 181 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1gx3 s GLU 182 N -2.20 4.24 0.32 -0.78 2.12 -1.26 -4.97 118.70 116.17 1gx3 s GLU 182 Ca 0.37 1.69 -0.29 0.00 0.36 0.00 0.00 54.97 57.11 1gx3 s GLU 182 Cb 0.29 -3.75 -0.10 0.00 0.26 0.00 0.00 34.13 30.82 1gx3 s GLU 182 CO 0.10 -0.69 1.26 -2.14 -0.54 0.00 0.00 175.26 173.25 1gx3 s PRO 183 N 3.39 4.41 -0.06 4.30 0.02 -1.26 -4.65 135.00 141.15 1gx3 s PRO 183 Ca 0.56 2.12 0.01 0.00 0.02 0.00 0.00 61.00 63.71 1gx3 s PRO 183 Cb -0.23 -3.08 -0.03 0.00 0.02 0.00 0.00 34.50 31.18 1gx3 s PRO 183 CO 0.16 -0.11 -0.06 1.03 -0.33 0.00 0.00 177.00 177.69 1gx3 s ARG 184 N -1.74 2.75 0.59 5.54 1.81 0.46 -5.00 118.95 123.36 1gx3 s ARG 184 Ca 0.48 -0.56 -0.14 0.00 -1.72 0.00 0.00 55.73 53.79 1gx3 s ARG 184 Cb -0.38 -2.61 -0.04 0.00 -0.45 0.00 0.00 34.95 31.47 1gx3 s ARG 184 CO 0.50 0.66 1.03 -1.25 -0.68 0.00 0.00 175.30 175.56 1gx3 s PRO 185 N -0.93 3.54 0.26 3.54 0.04 -1.26 -4.58 135.00 135.60 1gx3 s PRO 185 Ca 0.13 0.97 -0.01 0.00 0.04 0.00 0.00 61.00 62.13 1gx3 s PRO 185 Cb -0.11 -2.07 0.54 0.00 0.04 0.00 0.00 34.50 32.90 1gx3 s PRO 185 CO 0.03 -0.62 1.76 -0.09 0.04 0.00 0.00 177.00 178.12 1gx3 h ARG 186 N 0.22 0.60 -0.83 4.56 2.43 -1.99 -1.62 114.38 117.75 1gx3 h ARG 186 Ca -0.46 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 58.69 1gx3 h ARG 186 Cb 1.20 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 30.57 1gx3 h ARG 186 CO 0.60 0.40 0.55 0.97 -1.51 0.00 0.00 179.97 180.97 1gx3 h ILE 187 N 0.62 1.20 -0.50 1.20 6.09 -1.99 0.55 117.51 124.68 1gx3 h ILE 187 Ca 0.47 -0.38 -0.08 0.00 -1.37 0.00 0.00 64.86 63.50 1gx3 h ILE 187 Cb 0.67 -0.00 -0.02 0.00 0.47 0.00 0.00 36.82 37.93 1gx3 h ILE 187 CO -0.37 0.20 0.00 0.44 -3.07 0.00 0.00 178.15 175.36 1gx3 h ASP 188 N 1.10 0.79 -0.44 2.19 5.19 -1.68 -1.34 116.42 122.23 1gx3 h ASP 188 Ca 0.31 -0.19 -0.11 0.00 -0.62 0.00 0.00 57.03 56.41 1gx3 h ASP 188 Cb -0.10 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.19 1gx3 h ASP 188 CO -0.07 0.86 -0.16 -0.07 -3.12 0.00 0.00 179.24 176.68 1gx3 h LEU 189 N 0.77 0.91 -1.32 1.55 3.38 -0.82 -2.76 115.31 117.02 1gx3 h LEU 189 Ca 0.15 -0.38 0.03 0.00 0.09 0.00 0.00 57.88 57.77 1gx3 h LEU 189 Cb 0.46 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1gx3 h LEU 189 CO 0.02 1.09 0.48 -0.33 0.09 0.00 0.00 178.44 179.79 1gx3 h GLU 190 N 0.73 0.86 -0.38 1.13 5.08 -0.51 0.11 114.58 121.59 1gx3 h GLU 190 Ca 0.11 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1gx3 h GLU 190 Cb 0.71 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1gx3 h GLU 190 CO 0.05 0.57 0.14 0.28 -1.00 0.00 0.00 179.01 179.05 1gx3 h VAL 191 N 0.88 1.20 -0.46 3.13 2.07 -1.11 -0.03 116.25 121.94 1gx3 h VAL 191 Ca 0.29 -0.64 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 1gx3 h VAL 191 Cb 0.06 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1gx3 h VAL 191 CO -0.08 0.23 0.13 1.23 0.02 0.00 0.00 177.57 179.09 1gx3 h GLY 192 N 0.47 0.78 1.41 2.17 0.00 -1.16 -2.45 103.07 104.28 1gx3 h GLY 192 Ca 0.13 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1gx3 h GLY 192 CO -0.01 0.44 0.06 0.23 0.00 0.00 0.00 176.54 177.27 1gx3 h SER 193 N 0.61 0.69 -0.50 0.19 0.87 -0.67 -1.45 113.55 113.29 1gx3 h SER 193 Ca 0.15 -0.14 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1gx3 h SER 193 Cb 0.30 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 1gx3 h SER 193 CO -0.00 0.72 0.32 -0.25 -0.53 0.00 0.00 176.83 177.09 1gx3 h TRP 194 N 0.70 0.60 0.42 2.24 2.91 -0.82 -1.36 115.95 120.65 1gx3 h TRP 194 Ca 0.15 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.18 1gx3 h TRP 194 Cb 0.35 -0.20 -0.01 0.00 -0.51 0.00 0.00 29.16 28.78 1gx3 h TRP 194 CO 0.02 0.36 -0.32 -0.92 -1.03 0.00 0.00 178.44 176.55 1gx3 h TYR 195 N 0.64 -0.86 0.00 2.65 3.20 -0.88 -1.43 116.97 120.29 1gx3 h TYR 195 Ca 0.19 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 1gx3 h TYR 195 Cb -0.03 0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.55 1gx3 h TYR 195 CO -0.05 -0.48 -0.16 0.28 -1.64 0.00 0.00 178.16 176.11 1gx3 h VAL 196 N -0.74 0.87 -0.01 1.81 2.07 -1.12 -0.04 116.25 119.09 1gx3 h VAL 196 Ca -0.04 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1gx3 h VAL 196 Cb 0.63 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1gx3 h VAL 196 CO -0.00 0.16 -0.45 -1.54 0.02 0.00 0.00 177.57 175.75 1gx3 n SER 197 N -3.99 1.53 0.00 0.57 3.41 -0.53 -4.44 113.62 110.17 1gx3 n SER 197 Ca -0.02 -1.20 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 1gx3 n SER 197 Cb 0.25 0.40 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 1gx3 n SER 197 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1gx3 n THR 198 N -0.44 0.00 -2.19 6.66 -2.24 -0.55 -4.58 114.28 110.94 1gx3 n THR 198 Ca 0.10 -0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.45 1gx3 n THR 198 Cb 0.41 0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.80 1gx3 n THR 198 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1gx3 s HIS 199 N -0.68 2.99 -0.23 4.78 5.04 -0.06 -4.87 115.29 122.26 1gx3 s HIS 199 Ca 0.00 0.85 0.20 0.00 -1.54 0.00 0.00 55.06 54.57 1gx3 s HIS 199 Cb 0.00 -3.68 1.12 0.00 0.04 0.00 0.00 32.58 30.05 1gx3 s HIS 199 CO 0.00 -2.48 1.63 -0.35 -2.34 0.00 0.00 174.74 171.19 1gx3 n PRO 200 N 4.81 0.13 -0.01 2.88 -0.04 -1.26 -0.39 135.00 141.13 1gx3 n PRO 200 Ca 0.13 0.63 0.13 0.00 -0.04 0.00 0.00 63.50 64.35 1gx3 n PRO 200 Cb 0.43 -1.94 0.39 0.00 -0.04 0.00 0.00 33.50 32.34 1gx3 n PRO 200 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1gx3 n GLY 201 N -1.31 0.34 3.75 0.55 0.00 -1.26 -4.70 105.19 102.57 1gx3 n GLY 201 Ca -0.01 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.08 1gx3 n GLY 201 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gx3 s SER 202 N -1.96 7.03 0.54 1.61 0.15 0.48 -4.87 113.70 116.68 1gx3 s SER 202 Ca 0.35 2.39 0.23 0.00 0.70 0.00 0.00 55.95 59.62 1gx3 s SER 202 Cb 0.21 -2.62 1.40 0.00 -1.71 0.00 0.00 66.02 63.29 1gx3 s SER 202 CO 0.32 -0.37 2.05 -0.74 1.20 0.00 0.00 173.24 175.70 1gx3 h HIS 203 N 4.37 0.00 -0.01 3.44 2.76 -1.88 0.03 115.15 123.86 1gx3 h HIS 203 Ca -0.46 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 1gx3 h HIS 203 Cb 1.22 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.18 1gx3 h HIS 203 CO 0.60 0.00 -0.24 1.19 -1.30 0.00 0.00 177.93 178.18 1gx3 n PHE 204 N -4.34 0.00 -0.08 5.26 3.01 -1.26 -3.48 117.46 116.57 1gx3 n PHE 204 Ca 0.05 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.43 1gx3 n PHE 204 Cb 0.44 -0.07 -0.13 0.00 -0.01 0.00 0.00 39.48 39.71 1gx3 n PHE 204 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1gx3 n VAL 205 N -0.26 1.12 1.59 -4.37 0.31 -0.14 -3.60 118.33 112.97 1gx3 n VAL 205 Ca 0.13 -0.67 0.14 0.00 -0.01 0.00 0.00 64.34 63.93 1gx3 n VAL 205 Cb 0.39 -0.61 0.63 0.00 -0.91 0.00 0.00 33.84 33.33 1gx3 n VAL 205 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1gx3 n THR 206 N -2.63 0.00 -3.84 2.52 -2.24 -0.42 -4.67 114.28 102.99 1gx3 n THR 206 Ca -0.27 -0.15 -0.03 0.00 -2.27 0.00 0.00 64.05 61.33 1gx3 n THR 206 Cb 1.02 0.16 0.01 0.00 -2.10 0.00 0.00 70.33 69.41 1gx3 n THR 206 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1gx3 s GLY 207 N -2.11 0.01 -0.20 3.38 0.00 -1.23 -4.81 107.32 102.36 1gx3 s GLY 207 Ca 0.38 -0.18 -0.07 0.00 0.00 0.00 0.00 44.72 44.85 1gx3 s GLY 207 CO 0.38 1.81 0.07 -2.27 0.00 0.00 0.00 173.10 173.08 1gx3 s LEU 208 N -3.29 3.70 -0.07 0.66 2.96 -1.26 -4.72 118.68 116.67 1gx3 s LEU 208 Ca 0.19 -0.01 0.02 0.00 -0.22 0.00 0.00 54.13 54.11 1gx3 s LEU 208 Cb -0.02 -1.95 0.02 0.00 0.50 0.00 0.00 46.19 44.74 1gx3 s LEU 208 CO 0.04 0.11 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.19 1gx3 s THR 209 N 0.75 0.97 -0.01 3.68 2.01 -1.26 -1.58 115.64 120.20 1gx3 s THR 209 Ca 0.03 -0.36 0.01 0.00 0.31 0.00 0.00 61.69 61.68 1gx3 s THR 209 Cb -0.13 -0.92 0.01 0.00 0.01 0.00 0.00 72.50 71.46 1gx3 s THR 209 CO 0.02 0.32 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.57 1gx3 s VAL 210 N 0.87 0.14 0.12 3.82 1.01 -0.41 -2.99 120.40 122.96 1gx3 s VAL 210 Ca -0.11 -0.03 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 1gx3 s VAL 210 Cb -0.15 -0.16 0.01 0.00 0.00 0.00 0.00 36.38 36.08 1gx3 s VAL 210 CO 0.01 0.06 0.29 0.00 0.00 0.00 0.00 175.10 175.47 1gx3 s ALA 211 N 0.23 -0.43 0.04 5.51 0.00 0.02 -0.09 121.76 127.03 1gx3 s ALA 211 Ca -0.02 -0.48 -0.27 0.00 0.00 0.00 0.00 51.96 51.19 1gx3 s ALA 211 Cb -0.04 0.64 0.07 0.00 0.00 0.00 0.00 23.12 23.79 1gx3 s ALA 211 CO -0.01 -0.60 0.62 0.54 0.00 0.00 0.00 175.76 176.32 1gx3 s VAL 212 N -3.87 0.01 -0.07 0.00 0.11 -0.96 -0.31 120.40 115.31 1gx3 s VAL 212 Ca 0.07 -0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 59.06 1gx3 s VAL 212 Cb 0.03 -0.99 0.03 0.00 -1.53 0.00 0.00 36.38 33.92 1gx3 s VAL 212 CO -0.09 -0.02 0.01 -0.69 -3.33 0.00 0.00 175.10 170.98 1gx3 s VAL 213 N -2.25 0.32 0.49 2.04 1.01 -1.01 -0.67 120.40 120.32 1gx3 s VAL 213 Ca -0.06 0.15 0.07 0.00 0.00 0.00 0.00 61.98 62.14 1gx3 s VAL 213 Cb -0.00 -0.48 0.07 0.00 0.00 0.00 0.00 36.38 35.96 1gx3 s VAL 213 CO 0.00 0.25 0.55 0.35 0.00 0.00 0.00 175.10 176.26 1gx3 n THR 214 N 5.13 0.00 -0.26 3.92 -2.24 -0.46 -2.43 114.28 117.94 1gx3 n THR 214 Ca -0.07 -1.74 0.07 0.00 -2.27 0.00 0.00 64.05 60.04 1gx3 n THR 214 Cb 0.50 -0.39 0.31 0.00 -2.10 0.00 0.00 70.33 68.65 1gx3 n THR 214 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1gx3 h ASP 215 N 0.27 0.77 0.00 3.42 5.19 -1.98 -3.15 116.42 120.94 1gx3 h ASP 215 Ca -0.26 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.17 1gx3 h ASP 215 Cb 1.07 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.44 1gx3 h ASP 215 CO 0.38 0.46 -1.31 -0.90 -3.12 0.00 0.00 179.24 174.75 1gx3 n ASP 216 N -4.51 1.04 -3.81 6.45 5.75 -1.26 -4.92 116.55 115.29 1gx3 n ASP 216 Ca 0.14 -0.38 -0.12 0.00 -0.01 0.00 0.00 54.79 54.42 1gx3 n ASP 216 Cb 0.29 1.42 -0.11 0.00 -1.03 0.00 0.00 41.12 41.69 1gx3 n ASP 216 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gx3 s ALA 217 N -2.86 -0.49 -0.26 2.12 0.00 -1.19 -4.08 121.76 115.01 1gx3 s ALA 217 Ca -0.01 0.41 -0.09 0.00 0.00 0.00 0.00 51.96 52.27 1gx3 s ALA 217 Cb 0.11 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 1gx3 s ALA 217 CO 0.67 -0.13 0.11 1.03 0.00 0.00 0.00 175.76 177.44 1gx3 s ARG 218 N -0.31 3.77 -0.20 0.00 0.52 -0.49 -1.35 118.95 120.88 1gx3 s ARG 218 Ca -0.04 -0.42 -0.07 0.00 -0.52 0.00 0.00 55.73 54.68 1gx3 s ARG 218 Cb -0.03 -3.44 -0.04 0.00 0.52 0.00 0.00 34.95 31.96 1gx3 s ARG 218 CO 0.01 -0.17 0.07 0.71 0.02 0.00 0.00 175.30 175.93 1gx3 s TYR 219 N 1.63 3.20 -0.04 -0.53 1.51 0.15 -0.88 117.35 122.40 1gx3 s TYR 219 Ca 0.06 -0.04 -0.01 0.00 -1.01 0.00 0.00 57.07 56.08 1gx3 s TYR 219 Cb -0.15 -2.12 0.03 0.00 -0.11 0.00 0.00 41.96 39.61 1gx3 s TYR 219 CO 0.06 0.03 0.03 1.21 -1.11 0.00 0.00 175.55 175.77 1gx3 s ASN 220 N 0.69 0.86 -0.17 2.29 2.47 0.24 -2.25 114.94 119.07 1gx3 s ASN 220 Ca 0.03 0.03 -0.01 0.00 0.42 0.00 0.00 52.86 53.33 1gx3 s ASN 220 Cb -0.13 -0.18 -0.00 0.00 -1.45 0.00 0.00 41.25 39.48 1gx3 s ASN 220 CO 0.02 -0.19 -0.12 -0.22 -3.72 0.00 0.00 177.10 172.86 1gx3 s LEU 221 N 1.72 2.60 -0.13 3.21 2.96 0.87 0.05 118.68 129.96 1gx3 s LEU 221 Ca -0.00 -0.44 -0.01 0.00 -0.22 0.00 0.00 54.13 53.46 1gx3 s LEU 221 Cb -0.13 -1.61 0.03 0.00 0.50 0.00 0.00 46.19 44.99 1gx3 s LEU 221 CO -0.03 0.06 -0.05 -0.60 -1.32 0.00 0.00 176.35 174.41 1gx3 s ARG 222 N 0.98 1.29 6.65 1.98 6.06 -0.16 -1.29 118.95 134.46 1gx3 s ARG 222 Ca -0.02 -0.30 0.00 0.00 -2.50 0.00 0.00 55.73 52.91 1gx3 s ARG 222 Cb -0.15 -1.67 0.00 0.00 0.06 0.00 0.00 34.95 33.19 1gx3 s ARG 222 CO -0.02 -0.36 0.00 0.41 -2.50 0.00 0.00 175.30 172.84 1gx3 n GLY 223 N 4.96 3.23 0.00 8.12 0.00 -0.62 -1.08 105.19 119.80 1gx3 n GLY 223 Ca -0.11 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 45.77 1gx3 n GLY 223 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1gx3 n ARG 224 N 14.00 0.17 -3.43 1.61 1.85 -0.54 -4.83 116.66 125.49 1gx3 n ARG 224 Ca 0.00 0.09 -0.40 0.00 -1.00 0.00 0.00 57.85 56.54 1gx3 n ARG 224 Cb 0.00 -1.50 -0.10 0.00 -1.05 0.00 0.00 32.46 29.81 1gx3 n ARG 224 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 1gx3 s ASN 225 N -2.78 6.16 -0.30 2.89 0.01 -0.24 -1.07 114.94 119.61 1gx3 s ASN 225 Ca 0.16 -0.19 -0.09 0.00 -0.71 0.00 0.00 52.86 52.03 1gx3 s ASN 225 Cb 0.15 -2.19 -0.01 0.00 0.41 0.00 0.00 41.25 39.61 1gx3 s ASN 225 CO 0.38 -0.30 0.14 -0.22 -1.51 0.00 0.00 177.10 175.60 1gx3 s LEU 226 N 1.97 4.02 -0.14 0.60 2.96 -0.09 -0.99 118.68 127.02 1gx3 s LEU 226 Ca 0.11 -0.47 0.00 0.00 -0.22 0.00 0.00 54.13 53.55 1gx3 s LEU 226 Cb -0.17 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.52 1gx3 s LEU 226 CO 0.11 -0.17 -0.14 0.00 -1.32 0.00 0.00 176.35 174.83 1gx3 s ALA 227 N 1.62 2.55 -0.14 5.97 0.00 0.11 -0.91 121.76 130.96 1gx3 s ALA 227 Ca 0.05 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.08 1gx3 s ALA 227 Cb -0.17 -1.20 0.01 0.00 0.00 0.00 0.00 23.12 21.76 1gx3 s ALA 227 CO 0.06 0.15 -0.21 0.08 0.00 0.00 0.00 175.76 175.84 1gx3 s VAL 228 N 0.52 1.95 -0.27 0.00 1.01 0.64 -0.60 120.40 123.66 1gx3 s VAL 228 Ca -0.09 -0.91 -0.08 0.00 0.00 0.00 0.00 61.98 60.89 1gx3 s VAL 228 Cb -0.16 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 1gx3 s VAL 228 CO 0.04 0.53 0.10 -1.00 0.00 0.00 0.00 175.10 174.77 1gx3 s HIS 229 N 0.88 3.13 0.26 5.22 3.76 -0.05 0.22 115.29 128.70 1gx3 s HIS 229 Ca -0.06 -0.46 0.00 0.00 -0.15 0.00 0.00 55.06 54.39 1gx3 s HIS 229 Cb -0.15 -2.28 0.00 0.00 1.11 0.00 0.00 32.58 31.26 1gx3 s HIS 229 CO -0.02 -0.38 0.01 0.54 -0.85 0.00 0.00 174.74 174.03 1gx3 n ARG 230 N 4.95 1.35 -2.51 1.40 1.74 0.41 -1.40 116.66 122.60 1gx3 n ARG 230 Ca -0.15 -1.91 -0.43 0.00 -0.77 0.00 0.00 57.85 54.58 1gx3 n ARG 230 Cb 0.51 0.50 -0.02 0.00 -1.02 0.00 0.00 32.46 32.43 1gx3 n ARG 230 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1gx3 s SER 231 N -2.46 6.51 0.00 0.55 1.04 -1.26 -3.59 113.70 114.49 1gx3 s SER 231 Ca 0.01 0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.98 1gx3 s SER 231 Cb -0.00 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1gx3 s SER 231 CO 0.00 -1.35 0.00 0.61 0.98 0.00 0.00 173.24 173.49 1gx3 n GLY 232 N 4.96 3.13 3.19 7.32 0.00 -1.26 -4.97 105.19 117.56 1gx3 n GLY 232 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 1gx3 n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gx3 s ALA 233 N -1.70 1.19 0.19 4.61 0.00 -1.24 -5.15 121.76 119.67 1gx3 s ALA 233 Ca 0.00 -1.26 0.09 0.00 0.00 0.00 0.00 51.96 50.79 1gx3 s ALA 233 Cb 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 1gx3 s ALA 233 CO 0.00 -0.05 -0.17 0.99 0.00 0.00 0.00 175.76 176.53 1gx3 s THR 234 N -2.65 1.86 0.05 0.00 2.01 -1.26 -0.45 115.64 115.20 1gx3 s THR 234 Ca 0.08 -2.07 0.05 0.00 0.31 0.00 0.00 61.69 60.06 1gx3 s THR 234 Cb -0.02 -1.96 -0.02 0.00 0.01 0.00 0.00 72.50 70.51 1gx3 s THR 234 CO 0.00 -0.42 -0.13 -1.61 -0.69 0.00 0.00 174.62 171.77 1gx3 s GLU 235 N -3.16 0.84 -0.03 4.92 2.02 0.13 -4.96 118.70 118.48 1gx3 s GLU 235 Ca 0.19 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.37 1gx3 s GLU 235 Cb -0.04 -0.84 0.03 0.00 0.10 0.00 0.00 34.13 33.38 1gx3 s GLU 235 CO 0.08 0.20 0.00 -1.01 0.02 0.00 0.00 175.26 174.54 1gx3 s HIS 236 N -1.03 0.32 -0.03 1.61 3.76 -1.26 -0.26 115.29 118.40 1gx3 s HIS 236 Ca -0.01 0.00 0.06 0.00 -0.15 0.00 0.00 55.06 54.96 1gx3 s HIS 236 Cb -0.09 -0.43 -0.01 0.00 1.11 0.00 0.00 32.58 33.16 1gx3 s HIS 236 CO 0.02 -0.14 -0.20 0.42 -0.85 0.00 0.00 174.74 173.99 1gx3 s ILE 237 N 1.10 1.58 -0.29 0.60 1.01 -0.09 -5.01 121.20 120.09 1gx3 s ILE 237 Ca -0.09 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 59.71 1gx3 s ILE 237 Cb -0.13 -1.32 0.05 0.00 0.01 0.00 0.00 42.46 41.06 1gx3 s ILE 237 CO -0.02 0.45 -0.01 -0.60 0.00 0.00 0.00 174.94 174.76 1gx3 s ARG 238 N -0.31 2.48 0.52 2.79 3.52 -1.26 -0.91 118.95 125.78 1gx3 s ARG 238 Ca 0.04 -1.23 -0.18 0.00 -0.13 0.00 0.00 55.73 54.23 1gx3 s ARG 238 Cb -0.09 -3.16 -0.07 0.00 -1.56 0.00 0.00 34.95 30.07 1gx3 s ARG 238 CO 0.00 -0.59 1.02 -0.06 -0.81 0.00 0.00 175.30 174.86 1gx3 s PHE 239 N 1.26 3.15 -0.08 5.12 2.99 -0.23 -4.98 117.98 125.21 1gx3 s PHE 239 Ca -0.05 1.53 0.14 0.00 0.00 0.00 0.00 56.93 58.56 1gx3 s PHE 239 Cb -0.19 -2.95 -0.23 0.00 0.00 0.00 0.00 43.02 39.64 1gx3 s PHE 239 CO -0.01 -0.70 0.53 -0.25 -0.00 0.00 0.00 175.22 174.78 1gx3 n ASP 240 N -1.41 0.67 -4.00 1.36 8.00 -1.26 -4.86 116.55 115.05 1gx3 n ASP 240 Ca 0.08 0.32 -0.09 0.00 0.71 0.00 0.00 54.79 55.81 1gx3 n ASP 240 Cb 0.53 0.19 -0.10 0.00 -0.02 0.00 0.00 41.12 41.72 1gx3 n ASP 240 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1gx3 s SER 241 N -5.94 0.30 0.29 -2.24 1.04 -1.26 -5.03 113.70 100.86 1gx3 s SER 241 Ca -0.06 -0.66 0.03 0.00 0.48 0.00 0.00 55.95 55.74 1gx3 s SER 241 Cb 0.08 0.17 0.61 0.00 0.10 0.00 0.00 66.02 66.97 1gx3 s SER 241 CO 0.83 -0.46 1.84 0.00 0.98 0.00 0.00 173.24 176.42 1gx3 h ALA 242 N 3.87 1.57 -1.00 5.32 0.00 -1.91 0.15 119.26 127.27 1gx3 h ALA 242 Ca -0.33 0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.69 1gx3 h ALA 242 Cb 1.18 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.71 1gx3 h ALA 242 CO 0.52 0.17 0.64 0.00 0.00 0.00 0.00 179.25 180.58 1gx3 h ALA 243 N 1.56 1.45 -0.13 0.00 0.00 -1.96 0.10 119.26 120.28 1gx3 h ALA 243 Ca 0.50 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 55.19 1gx3 h ALA 243 Cb 0.55 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1gx3 h ALA 243 CO -0.27 0.38 -0.76 1.96 0.00 0.00 0.00 179.25 180.57 1gx3 h GLN 244 N 1.12 0.64 -0.41 0.00 4.20 -1.14 -1.67 115.11 117.86 1gx3 h GLN 244 Ca 0.45 -0.52 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 1gx3 h GLN 244 Cb 0.26 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 1gx3 h GLN 244 CO -0.19 1.14 0.24 0.28 -0.67 0.00 0.00 178.83 179.63 1gx3 h VAL 245 N 0.44 1.14 -0.78 -0.54 2.07 -0.70 -1.29 116.25 116.59 1gx3 h VAL 245 Ca -0.04 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 67.10 1gx3 h VAL 245 Cb 1.36 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 1gx3 h VAL 245 CO 0.15 0.14 0.31 -0.07 0.02 0.00 0.00 177.57 178.12 1gx3 h LEU 246 N 0.54 1.08 -0.77 2.57 4.07 -0.64 -0.28 115.31 121.88 1gx3 h LEU 246 Ca 0.15 -0.17 0.04 0.00 0.08 0.00 0.00 57.88 57.98 1gx3 h LEU 246 Cb 0.02 -0.28 -0.05 0.00 1.08 0.00 0.00 40.66 41.43 1gx3 h LEU 246 CO -0.03 0.96 0.47 -0.78 -1.08 0.00 0.00 178.44 177.99 1gx3 h ASP 247 N 1.13 0.76 -0.47 -0.43 1.82 -0.98 -1.46 116.42 116.79 1gx3 h ASP 247 Ca 0.26 0.01 0.01 0.00 -0.39 0.00 0.00 57.03 56.92 1gx3 h ASP 247 Cb 0.22 -0.15 -0.03 0.00 0.68 0.00 0.00 39.33 40.05 1gx3 h ASP 247 CO -0.02 0.51 0.30 0.00 -1.61 0.00 0.00 179.24 178.42 1gx3 h ALA 248 N 1.35 0.60 -0.61 -0.78 0.00 -0.37 0.13 119.26 119.58 1gx3 h ALA 248 Ca 0.32 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.24 1gx3 h ALA 248 Cb 0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1gx3 h ALA 248 CO -0.14 0.02 0.37 0.82 0.00 0.00 0.00 179.25 180.32 1gx3 h ILE 249 N 0.62 1.06 0.05 0.00 2.04 -0.40 0.13 117.51 121.01 1gx3 h ILE 249 Ca 0.18 -0.25 -0.10 0.00 1.00 0.00 0.00 64.86 65.69 1gx3 h ILE 249 Cb -0.05 0.28 0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1gx3 h ILE 249 CO -0.05 0.13 -0.42 0.58 0.00 0.00 0.00 178.15 178.39 1gx3 h VAL 250 N 0.72 1.59 0.00 1.67 2.07 -1.18 -1.85 116.25 119.28 1gx3 h VAL 250 Ca 0.25 -2.29 -0.35 0.00 0.82 0.00 0.00 66.70 65.12 1gx3 h VAL 250 Cb 0.04 3.09 -0.07 0.00 -1.52 0.00 0.00 31.29 32.83 1gx3 h VAL 250 CO -0.11 0.63 -2.37 0.59 0.02 0.00 0.00 177.57 176.33 1gx3 n ASN 251 N -4.37 0.02 -0.01 0.57 4.13 0.44 -2.27 115.26 113.77 1gx3 n ASN 251 Ca -0.11 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 55.93 1gx3 n ASN 251 Cb 0.63 1.03 -0.13 0.00 -1.54 0.00 0.00 39.78 39.77 1gx3 n ASN 251 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 1gx3 h ARG 252 N 0.00 0.21 -0.00 3.52 3.08 -0.93 -3.40 114.38 116.86 1gx3 h ARG 252 Ca -0.53 -0.36 0.00 0.00 0.07 0.00 0.00 59.98 59.16 1gx3 h ARG 252 Cb 2.20 0.13 0.00 0.00 0.08 0.00 0.00 29.97 32.38 1gx3 h ARG 252 CO 0.03 1.17 -0.51 1.19 -1.07 0.00 0.00 179.97 180.78 1gx3 n PHE 253 N -3.86 0.00 -1.85 3.04 3.01 -0.19 -4.98 117.46 112.63 1gx3 n PHE 253 Ca -0.29 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.04 1gx3 n PHE 253 Cb 0.92 -0.16 -0.03 0.00 -0.01 0.00 0.00 39.48 40.20 1gx3 n PHE 253 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1gx3 n GLY 254 N 1.45 0.57 3.68 1.37 0.00 -0.96 -4.75 105.19 106.54 1gx3 n GLY 254 Ca 0.07 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 1gx3 n GLY 254 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gx3 s ILE 255 N -2.59 4.83 -0.48 -0.61 1.01 -0.73 -4.94 121.20 117.70 1gx3 s ILE 255 Ca 0.00 1.84 -0.29 0.00 0.00 0.00 0.00 60.65 62.20 1gx3 s ILE 255 Cb 0.00 -4.23 0.03 0.00 0.01 0.00 0.00 42.46 38.27 1gx3 s ILE 255 CO 0.00 0.01 1.15 -0.62 0.00 0.00 0.00 174.94 175.49 1gx3 s ASP 256 N 1.12 6.61 0.00 3.58 -1.08 -0.90 -4.37 116.67 121.63 1gx3 s ASP 256 Ca 0.43 0.46 0.06 0.00 -0.52 0.00 0.00 52.55 52.98 1gx3 s ASP 256 Cb -0.17 -2.55 0.31 0.00 -1.46 0.00 0.00 42.92 39.05 1gx3 s ASP 256 CO 0.15 -1.28 1.21 0.18 0.52 0.00 0.00 175.17 175.95 1gx3 n LEU 257 N 7.93 0.18 -0.35 -1.34 4.77 -1.26 -4.33 117.00 122.59 1gx3 n LEU 257 Ca 0.12 -0.09 0.07 0.00 -0.03 0.00 0.00 56.01 56.08 1gx3 n LEU 257 Cb 0.49 -0.02 0.24 0.00 -2.33 0.00 0.00 43.42 41.80 1gx3 n LEU 257 CO 0.72 0.04 1.24 1.23 -1.33 0.00 0.00 177.39 179.29 1gx3 h GLY 258 N 5.78 1.59 0.75 -0.72 0.00 -1.90 0.11 103.07 108.68 1gx3 h GLY 258 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1gx3 h GLY 258 CO 0.00 0.19 0.00 2.09 0.00 0.00 0.00 176.54 178.82 1gx3 n ASP 259 N -4.59 0.00 -0.58 0.19 5.75 -1.26 -2.80 116.55 113.26 1gx3 n ASP 259 Ca 0.18 -1.23 0.05 0.00 -0.01 0.00 0.00 54.79 53.79 1gx3 n ASP 259 Cb 0.33 0.00 0.12 0.00 -1.03 0.00 0.00 41.12 40.55 1gx3 n ASP 259 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1gx3 n LEU 260 N -0.88 2.64 -4.77 -2.12 4.77 0.40 -5.02 117.00 112.03 1gx3 n LEU 260 Ca 0.18 -1.73 -0.40 0.00 -0.03 0.00 0.00 56.01 54.02 1gx3 n LEU 260 Cb 0.08 -0.17 0.01 0.00 -2.33 0.00 0.00 43.42 41.02 1gx3 n LEU 260 CO 0.13 0.63 1.05 0.00 -1.33 0.00 0.00 177.39 177.87 1gx3 s ALA 261 N -0.98 3.26 0.00 -1.18 0.00 -1.12 -1.79 121.76 119.95 1gx3 s ALA 261 Ca 0.20 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.58 1gx3 s ALA 261 Cb 0.11 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1gx3 s ALA 261 CO 0.15 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.21 1gx3 n GLY 262 N 0.59 2.18 3.70 0.00 0.00 -1.26 -5.03 105.19 105.38 1gx3 n GLY 262 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1gx3 n GLY 262 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gx3 s ARG 263 N -0.84 2.99 -1.09 1.61 0.52 -0.74 -5.04 118.95 116.36 1gx3 s ARG 263 Ca 0.00 -0.42 -0.19 0.00 -0.52 0.00 0.00 55.73 54.60 1gx3 s ARG 263 Cb 0.00 -2.80 0.10 0.00 0.52 0.00 0.00 34.95 32.77 1gx3 s ARG 263 CO 0.00 0.69 1.42 0.34 0.02 0.00 0.00 175.30 177.78 1gx3 s ASP 264 N -1.04 6.72 0.14 0.23 -1.08 -1.26 -4.81 116.67 115.57 1gx3 s ASP 264 Ca 0.15 -2.14 -0.16 0.00 -0.52 0.00 0.00 52.55 49.88 1gx3 s ASP 264 Cb -0.11 -2.49 0.00 0.00 -1.46 0.00 0.00 42.92 38.86 1gx3 s ASP 264 CO 0.04 -1.16 1.70 0.58 0.52 0.00 0.00 175.17 176.85 1gx3 h VAL 265 N 5.84 1.19 -0.25 1.11 2.07 -1.96 -2.97 116.25 121.28 1gx3 h VAL 265 Ca 0.27 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.26 1gx3 h VAL 265 Cb 0.96 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 1gx3 h VAL 265 CO 1.31 0.21 0.04 -0.61 0.02 0.00 0.00 177.57 178.54 1gx3 h GLN 266 N 0.53 0.13 -0.75 1.57 4.15 -1.94 -1.04 115.11 117.76 1gx3 h GLN 266 Ca 0.14 -0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.62 1gx3 h GLN 266 Cb 0.16 -0.03 -0.06 0.00 0.21 0.00 0.00 27.48 27.76 1gx3 h GLN 266 CO -0.01 0.09 0.43 0.00 -1.93 0.00 0.00 178.83 177.41 1gx3 h ALA 267 N 1.19 1.03 -0.29 3.38 0.00 -1.96 0.71 119.26 123.32 1gx3 h ALA 267 Ca 0.12 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1gx3 h ALA 267 Cb 0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1gx3 h ALA 267 CO -0.16 0.12 -0.20 -0.09 0.00 0.00 0.00 179.25 178.92 1gx3 h ARG 268 N 0.78 0.65 -0.77 0.00 9.65 -1.29 -2.13 114.38 121.27 1gx3 h ARG 268 Ca 0.34 -0.31 -0.03 0.00 -1.10 0.00 0.00 59.98 58.88 1gx3 h ARG 268 Cb 0.23 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.77 1gx3 h ARG 268 CO -0.20 0.90 0.35 0.28 2.80 0.00 0.00 179.97 184.11 1gx3 h VAL 269 N 0.40 1.24 -0.79 0.20 2.07 -0.61 -1.28 116.25 117.49 1gx3 h VAL 269 Ca 0.06 -0.71 0.17 0.00 0.82 0.00 0.00 66.70 67.05 1gx3 h VAL 269 Cb 0.74 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 30.73 1gx3 h VAL 269 CO 0.05 0.30 0.53 0.00 0.02 0.00 0.00 177.57 178.47 1gx3 h ALA 270 N 1.29 2.23 0.00 1.67 0.00 0.98 -1.03 119.26 124.40 1gx3 h ALA 270 Ca 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1gx3 h ALA 270 Cb 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1gx3 h ALA 270 CO -0.03 -0.45 -0.04 0.93 0.00 0.00 0.00 179.25 179.65 1gx3 h GLU 271 N 0.35 0.00 -0.05 0.00 5.08 -0.60 -3.27 114.58 116.08 1gx3 h GLU 271 Ca 0.39 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.74 1gx3 h GLU 271 Cb 1.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1gx3 h GLU 271 CO -0.12 0.04 -0.16 1.33 -1.00 0.00 0.00 179.01 179.10 1gx3 n VAL 272 N -3.13 2.08 -0.04 3.13 0.24 -0.41 -4.76 118.33 115.45 1gx3 n VAL 272 Ca 0.02 -2.57 0.17 0.00 -2.04 0.00 0.00 64.34 59.92 1gx3 n VAL 272 Cb 0.43 -0.25 0.61 0.00 -1.47 0.00 0.00 33.84 33.16 1gx3 n VAL 272 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1gx3 h LEU 273 N 0.56 0.16 -3.02 1.34 3.38 -1.57 -2.81 115.31 113.34 1gx3 h LEU 273 Ca 0.02 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1gx3 h LEU 273 Cb 1.09 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1gx3 h LEU 273 CO 0.05 0.09 0.00 0.47 0.09 0.00 0.00 178.44 179.14 1gx3 n ASP 274 N -4.43 2.60 -0.51 -0.43 8.00 -1.26 -1.46 116.55 119.06 1gx3 n ASP 274 Ca 0.10 -2.50 0.06 0.00 0.71 0.00 0.00 54.79 53.17 1gx3 n ASP 274 Cb 0.52 -0.26 0.05 0.00 -0.02 0.00 0.00 41.12 41.41 1gx3 n ASP 274 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16