#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 3.84 0.03 0.00 1.00 -1.26 -5.07 119.30 117.84 1gx3 s MET 3 Ca 0.00 0.29 -0.11 0.00 0.00 0.00 0.00 55.69 55.87 1gx3 s MET 3 Cb 0.00 -2.95 -0.04 0.00 0.00 0.00 0.00 34.83 31.84 1gx3 s MET 3 CO 0.00 0.51 1.17 0.22 0.00 0.00 0.00 175.02 176.92 1gx3 h ASP 4 N 3.56 -0.50 0.00 3.03 1.82 -2.04 -3.46 116.42 118.82 1gx3 h ASP 4 Ca -0.49 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.21 1gx3 h ASP 4 Cb 1.19 0.19 0.00 0.00 0.68 0.00 0.00 39.33 41.39 1gx3 h ASP 4 CO 0.67 -0.17 0.00 0.18 -1.61 0.00 0.00 179.24 178.31 1gx3 n LEU 5 N -3.39 0.00 -0.02 2.28 4.77 -1.26 -4.87 117.00 114.51 1gx3 n LEU 5 Ca -0.03 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.87 1gx3 n LEU 5 Cb 0.13 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 1gx3 n LEU 5 CO 0.04 0.00 0.81 1.23 -1.33 0.00 0.00 177.39 178.14 1gx3 h GLY 6 N 0.00 0.07 2.00 -0.72 0.00 -1.98 -2.25 103.07 100.19 1gx3 h GLY 6 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.41 1gx3 h GLY 6 CO 0.00 -0.10 -0.11 -1.33 0.00 0.00 0.00 176.54 175.01 1gx3 h GLY 7 N -0.06 0.00 0.45 4.60 0.00 -1.96 -2.30 103.07 103.80 1gx3 h GLY 7 Ca 0.09 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.40 1gx3 h GLY 7 CO -0.21 0.00 -0.08 -1.82 0.00 0.00 0.00 176.54 174.43 1gx3 h TYR 8 N 0.00 0.13 -0.68 5.60 3.20 -1.78 -1.34 116.97 122.09 1gx3 h TYR 8 Ca -0.00 -0.05 0.03 0.00 3.14 0.00 0.00 58.73 61.85 1gx3 h TYR 8 Cb 0.22 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 1gx3 h TYR 8 CO 0.00 0.71 0.45 -0.07 -1.64 0.00 0.00 178.16 177.62 1gx3 h LEU 9 N -0.50 0.71 -0.25 2.82 3.38 -1.31 -0.91 115.31 119.25 1gx3 h LEU 9 Ca -0.00 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1gx3 h LEU 9 Cb 0.72 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1gx3 h LEU 9 CO 0.02 0.49 0.02 0.74 0.09 0.00 0.00 178.44 179.80 1gx3 h THR 10 N 0.82 1.24 -0.54 0.22 2.02 -1.39 0.28 112.91 115.56 1gx3 h THR 10 Ca 0.27 -0.82 0.08 0.00 0.77 0.00 0.00 66.41 66.71 1gx3 h THR 10 Cb 0.06 1.30 -0.06 0.00 -1.74 0.00 0.00 68.15 67.71 1gx3 h THR 10 CO -0.08 0.26 0.20 -0.09 0.37 0.00 0.00 175.52 176.18 1gx3 h ARG 11 N 0.21 0.37 -0.33 6.66 9.65 -0.02 0.16 114.38 131.09 1gx3 h ARG 11 Ca 0.07 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 1gx3 h ARG 11 Cb 0.36 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.86 1gx3 h ARG 11 CO 0.01 0.25 0.00 0.44 2.80 0.00 0.00 179.97 183.46 1gx3 n ILE 12 N -5.00 0.44 -1.89 1.20 -5.35 -0.51 -4.83 119.36 103.42 1gx3 n ILE 12 Ca 0.07 -0.47 -0.10 0.00 -0.27 0.00 0.00 62.75 61.98 1gx3 n ILE 12 Cb 0.23 0.29 -0.02 0.00 -1.74 0.00 0.00 39.64 38.40 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 1.12 0.34 3.94 3.28 0.00 0.04 -4.71 105.19 109.20 1gx3 n GLY 13 Ca 0.14 -0.52 -0.20 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.56 3.37 0.16 0.99 1.43 0.93 -5.00 118.68 117.99 1gx3 s LEU 14 Ca 0.00 -0.71 -0.01 0.00 -1.03 0.00 0.00 54.13 52.37 1gx3 s LEU 14 Cb 0.00 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1gx3 s LEU 14 CO 0.00 -0.81 0.10 1.51 0.23 0.00 0.00 176.35 177.38 1gx3 s ASP 15 N -4.27 0.23 0.79 2.29 -4.77 -1.26 -4.11 116.67 105.57 1gx3 s ASP 15 Ca 0.50 -1.27 0.00 0.00 -3.30 0.00 0.00 52.55 48.48 1gx3 s ASP 15 Cb -0.05 0.34 0.00 0.00 -1.09 0.00 0.00 42.92 42.12 1gx3 s ASP 15 CO 0.30 -0.79 0.00 0.61 0.70 0.00 0.00 175.17 175.99 1gx3 n GLY 16 N -0.18 0.15 3.13 2.12 0.00 -1.26 -4.68 105.19 104.47 1gx3 n GLY 16 Ca -0.02 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 1gx3 n GLY 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gx3 s ARG 17 N 0.00 2.93 0.00 1.61 1.81 -1.26 -5.03 118.95 119.01 1gx3 s ARG 17 Ca 0.00 -0.81 0.00 0.00 -1.72 0.00 0.00 55.73 53.20 1gx3 s ARG 17 Cb 0.00 -2.47 0.00 0.00 -0.45 0.00 0.00 34.95 32.03 1gx3 s ARG 17 CO 0.00 -0.14 0.00 -2.30 -0.68 0.00 0.00 175.30 172.18 1gx3 n PRO 18 N 4.42 2.36 -3.64 3.54 -0.02 -1.26 -5.08 135.00 135.31 1gx3 n PRO 18 Ca -0.20 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.23 1gx3 n PRO 18 Cb 0.51 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.93 1gx3 n PRO 18 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1gx3 s ARG 19 N 0.00 0.65 0.00 -0.52 3.52 -1.26 -5.07 118.95 116.27 1gx3 s ARG 19 Ca 0.00 1.30 -0.17 0.00 -0.13 0.00 0.00 55.73 56.73 1gx3 s ARG 19 Cb 0.00 0.40 -0.21 0.00 -1.56 0.00 0.00 34.95 33.58 1gx3 s ARG 19 CO 0.00 -0.17 1.12 -2.30 -0.81 0.00 0.00 175.30 173.14 1gx3 n PRO 20 N 4.74 0.00 -3.95 5.12 -0.02 -1.26 -4.51 135.00 135.11 1gx3 n PRO 20 Ca -0.17 -0.59 -0.09 0.00 -2.02 0.00 0.00 63.50 60.62 1gx3 n PRO 20 Cb 0.55 -1.90 -0.07 0.00 -0.02 0.00 0.00 33.50 32.06 1gx3 n PRO 20 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1gx3 s ASP 21 N 5.27 0.03 0.08 2.55 1.47 -1.26 -4.16 116.67 120.66 1gx3 s ASP 21 Ca 0.38 -0.85 -0.19 0.00 1.18 0.00 0.00 52.55 53.07 1gx3 s ASP 21 Cb 0.08 0.44 -0.06 0.00 -0.34 0.00 0.00 42.92 43.04 1gx3 s ASP 21 CO 0.19 -0.89 1.32 0.25 0.68 0.00 0.00 175.17 176.72 1gx3 h LEU 22 N 2.54 -1.16 -0.72 2.11 5.85 -1.88 -1.61 115.31 120.45 1gx3 h LEU 22 Ca -0.32 0.16 0.08 0.00 0.84 0.00 0.00 57.88 58.64 1gx3 h LEU 22 Cb 1.23 0.49 -0.10 0.00 0.37 0.00 0.00 40.66 42.65 1gx3 h LEU 22 CO 0.48 -0.21 -0.38 0.61 -0.34 0.00 0.00 178.44 178.60 1gx3 n GLY 23 N -1.20 -1.75 0.16 3.75 0.00 -1.26 0.95 105.19 105.85 1gx3 n GLY 23 Ca -0.01 0.84 -0.08 0.00 0.00 0.00 0.00 46.02 46.76 1gx3 n GLY 23 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1gx3 h THR 24 N 0.00 1.10 -0.63 2.61 2.02 -1.64 -1.90 112.91 114.46 1gx3 h THR 24 Ca 0.16 -0.18 0.12 0.00 0.77 0.00 0.00 66.41 67.27 1gx3 h THR 24 Cb 0.34 0.57 -0.12 0.00 -1.74 0.00 0.00 68.15 67.20 1gx3 h THR 24 CO -0.69 0.09 -0.26 0.25 0.37 0.00 0.00 175.52 175.29 1gx3 h LEU 25 N 0.49 -0.91 -0.18 2.58 5.85 0.15 0.33 115.31 123.62 1gx3 h LEU 25 Ca 0.13 0.22 0.03 0.00 0.84 0.00 0.00 57.88 59.10 1gx3 h LEU 25 Cb -0.05 0.50 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1gx3 h LEU 25 CO -0.03 -0.27 -0.02 0.45 -0.34 0.00 0.00 178.44 178.23 1gx3 h HIS 26 N -0.09 -0.05 -0.23 1.25 3.86 -1.05 -1.09 115.15 117.75 1gx3 h HIS 26 Ca 0.28 0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.56 1gx3 h HIS 26 Cb 0.53 0.05 -0.07 0.00 1.06 0.00 0.00 27.41 28.98 1gx3 h HIS 26 CO -0.60 -0.05 -0.24 0.00 0.86 0.00 0.00 177.93 177.90 1gx3 h ALA 27 N 1.16 -0.14 -0.71 2.45 0.00 0.28 -1.23 119.26 121.07 1gx3 h ALA 27 Ca 0.08 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1gx3 h ALA 27 Cb 0.12 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1gx3 h ALA 27 CO -0.16 -0.67 0.41 0.82 0.00 0.00 0.00 179.25 179.64 1gx3 h ILE 28 N -0.26 1.21 -0.56 0.00 2.04 -0.08 -0.59 117.51 119.28 1gx3 h ILE 28 Ca 0.13 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 1gx3 h ILE 28 Cb 0.46 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 1gx3 h ILE 28 CO -0.38 0.23 0.23 0.58 0.00 0.00 0.00 178.15 178.81 1gx3 h VAL 29 N 0.98 1.22 -0.16 1.67 2.07 -0.90 0.26 116.25 121.38 1gx3 h VAL 29 Ca 0.25 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 1gx3 h VAL 29 Cb 0.01 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1gx3 h VAL 29 CO -0.04 0.26 0.06 0.00 0.02 0.00 0.00 177.57 177.87 1gx3 h ALA 30 N 1.08 0.21 0.17 1.67 0.00 -0.95 -0.91 119.26 120.53 1gx3 h ALA 30 Ca 0.19 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1gx3 h ALA 30 Cb 0.19 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1gx3 h ALA 30 CO -0.02 -0.18 -0.13 0.00 0.00 0.00 0.00 179.25 178.92 1gx3 h ALA 31 N 0.88 -0.28 -0.45 0.00 0.00 -0.80 -2.84 119.26 115.77 1gx3 h ALA 31 Ca 0.05 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1gx3 h ALA 31 Cb 0.20 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.08 1gx3 h ALA 31 CO -0.00 -0.67 -0.11 1.25 0.00 0.00 0.00 179.25 179.71 1gx3 h HIS 32 N -0.31 -0.24 -0.59 0.00 6.17 -0.43 -1.45 115.15 118.30 1gx3 h HIS 32 Ca -0.01 0.04 0.12 0.00 0.71 0.00 0.00 60.37 61.24 1gx3 h HIS 32 Cb 0.28 0.18 -0.10 0.00 2.52 0.00 0.00 27.41 30.29 1gx3 h HIS 32 CO -0.11 -0.19 -0.00 -0.91 0.71 0.00 0.00 177.93 177.42 1gx3 h ASN 33 N -0.00 -0.26 1.33 3.26 2.35 -0.94 -1.51 115.58 119.81 1gx3 h ASN 33 Ca 0.22 0.15 0.00 0.00 -0.55 0.00 0.00 56.30 56.11 1gx3 h ASN 33 Cb 0.33 0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.96 1gx3 h ASN 33 CO -0.47 -0.11 -0.45 0.08 -1.65 0.00 0.00 177.43 174.84 1gx3 h ARG 34 N 0.12 0.00 0.04 0.81 0.11 -1.28 -3.17 114.38 111.01 1gx3 h ARG 34 Ca 0.31 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 60.07 1gx3 h ARG 34 Cb 0.49 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.53 1gx3 h ARG 34 CO -0.51 0.00 -1.77 0.43 0.10 0.00 0.00 179.97 178.23 1gx3 n SER 35 N -2.58 1.97 -4.25 0.08 7.64 -0.57 -4.88 113.62 111.02 1gx3 n SER 35 Ca 0.03 0.30 -0.35 0.00 1.01 0.00 0.00 58.87 59.86 1gx3 n SER 35 Cb 0.50 -0.87 -0.14 0.00 -1.01 0.00 0.00 64.21 62.68 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 -2.46 3.07 0.46 0.44 1.01 -0.64 -5.00 121.20 118.09 1gx3 s ILE 36 Ca -0.28 -0.72 -0.13 0.00 0.00 0.00 0.00 60.65 59.52 1gx3 s ILE 36 Cb 0.08 -2.44 -0.07 0.00 0.01 0.00 0.00 42.46 40.03 1gx3 s ILE 36 CO 0.64 0.36 0.88 -2.16 0.00 0.00 0.00 174.94 174.66 1gx3 s PRO 37 N 1.41 3.84 0.06 2.79 0.04 -1.26 -4.72 135.00 137.16 1gx3 s PRO 37 Ca 0.04 0.69 -0.30 0.00 0.04 0.00 0.00 61.00 61.47 1gx3 s PRO 37 Cb -0.15 -2.26 -0.05 0.00 0.04 0.00 0.00 34.50 32.08 1gx3 s PRO 37 CO -0.05 -0.17 1.10 0.12 0.04 0.00 0.00 177.00 178.04 1gx3 s PHE 38 N -2.53 3.56 -0.02 0.56 5.36 0.30 -2.61 117.98 122.61 1gx3 s PHE 38 Ca 0.55 1.51 -0.29 0.00 -0.96 0.00 0.00 56.93 57.74 1gx3 s PHE 38 Cb -0.10 -3.27 0.08 0.00 -0.34 0.00 0.00 43.02 39.38 1gx3 s PHE 38 CO 0.33 -0.66 0.71 -1.83 -1.46 0.00 0.00 175.22 172.31 1gx3 s GLU 39 N 0.76 1.04 -0.20 10.12 -1.05 -0.35 -0.78 118.70 128.24 1gx3 s GLU 39 Ca 0.54 0.07 0.14 0.00 -0.15 0.00 0.00 54.97 55.58 1gx3 s GLU 39 Cb -0.26 0.49 0.45 0.00 -0.44 0.00 0.00 34.13 34.36 1gx3 s GLU 39 CO 0.30 -0.36 1.19 0.27 0.95 0.00 0.00 175.26 177.60 1gx3 n ASN 40 N 0.57 2.51 -0.29 0.83 6.94 -1.13 -2.88 115.26 121.80 1gx3 n ASN 40 Ca -0.17 -3.22 0.04 0.00 -0.02 0.00 0.00 54.58 51.21 1gx3 n ASN 40 Cb 0.59 -0.42 0.25 0.00 -2.36 0.00 0.00 39.78 37.83 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 1.59 0.89 0.58 -4.53 3.38 -1.93 -1.75 115.31 113.54 1gx3 h LEU 41 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1gx3 h LEU 41 Cb 1.37 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1gx3 h LEU 41 CO 0.27 0.58 -0.44 0.44 0.09 0.00 0.00 178.44 179.38 1gx3 h ASP 42 N 1.02 -1.14 -0.52 -0.43 5.19 -1.89 -1.83 116.42 116.81 1gx3 h ASP 42 Ca 0.38 0.08 0.04 0.00 -0.62 0.00 0.00 57.03 56.91 1gx3 h ASP 42 Cb 0.19 0.35 -0.04 0.00 0.18 0.00 0.00 39.33 40.01 1gx3 h ASP 42 CO -0.14 -0.63 0.28 -0.65 -3.12 0.00 0.00 179.24 174.98 1gx3 h PRO 43 N -0.98 0.53 -0.97 3.56 0.11 -1.43 -0.00 132.00 132.82 1gx3 h PRO 43 Ca -0.08 -0.03 0.23 0.00 0.11 0.00 0.00 66.00 66.23 1gx3 h PRO 43 Cb 0.81 -0.12 -0.08 0.00 0.11 0.00 0.00 31.00 31.72 1gx3 h PRO 43 CO 0.03 0.35 0.64 1.25 -0.21 0.00 0.00 178.00 180.05 1gx3 h LEU 44 N 0.54 0.42 -3.39 2.35 5.85 -1.26 -0.74 115.31 119.09 1gx3 h LEU 44 Ca 0.22 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.00 1gx3 h LEU 44 Cb 0.11 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1gx3 h LEU 44 CO -0.14 0.13 0.00 0.18 -0.34 0.00 0.00 178.44 178.27 1gx3 n LEU 45 N -4.55 5.32 0.00 2.25 4.77 -0.67 -4.92 117.00 119.20 1gx3 n LEU 45 Ca 0.22 -2.74 0.00 0.00 -0.03 0.00 0.00 56.01 53.46 1gx3 n LEU 45 Cb 0.78 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1gx3 n LEU 45 CO 0.29 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 1gx3 n GLY 46 N 0.81 0.44 3.27 -0.72 0.00 -0.28 -5.01 105.19 103.70 1gx3 n GLY 46 Ca 0.27 -0.92 -0.38 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.00 3.85 0.52 -0.61 1.01 -0.10 -4.99 121.20 118.88 1gx3 s ILE 47 Ca 0.00 -1.19 -0.22 0.00 0.00 0.00 0.00 60.65 59.24 1gx3 s ILE 47 Cb 0.00 -3.22 -0.06 0.00 0.01 0.00 0.00 42.46 39.19 1gx3 s ILE 47 CO 0.00 -0.24 1.33 -2.84 0.00 0.00 0.00 174.94 173.18 1gx3 s PRO 48 N 1.40 3.30 -0.93 2.79 0.02 -1.26 -2.33 135.00 137.99 1gx3 s PRO 48 Ca -0.01 2.17 -0.13 0.00 0.02 0.00 0.00 61.00 63.05 1gx3 s PRO 48 Cb -0.20 -2.32 0.23 0.00 0.02 0.00 0.00 34.50 32.23 1gx3 s PRO 48 CO 0.03 -1.04 0.91 0.08 -0.33 0.00 0.00 177.00 176.64 1gx3 s VAL 49 N -1.34 5.68 -0.20 3.83 1.01 -1.26 -4.84 120.40 123.27 1gx3 s VAL 49 Ca 0.69 -2.72 0.15 0.00 0.00 0.00 0.00 61.98 60.10 1gx3 s VAL 49 Cb -0.39 -4.54 -0.23 0.00 0.00 0.00 0.00 36.38 31.23 1gx3 s VAL 49 CO 0.46 -1.12 0.03 0.00 0.00 0.00 0.00 175.10 174.47 1gx3 n ALA 50 N 3.75 1.51 -2.94 5.51 0.00 -1.26 -3.81 120.51 123.28 1gx3 n ALA 50 Ca 0.18 -1.26 -0.39 0.00 0.00 0.00 0.00 53.44 51.96 1gx3 n ALA 50 Cb 0.45 -0.15 -0.12 0.00 0.00 0.00 0.00 19.45 19.63 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 -5.55 5.56 -0.33 0.00 -1.08 -1.26 -4.81 116.67 109.19 1gx3 s ASP 51 Ca -0.13 -0.91 0.09 0.00 -0.52 0.00 0.00 52.55 51.08 1gx3 s ASP 51 Cb 0.06 -1.98 0.67 0.00 -1.46 0.00 0.00 42.92 40.21 1gx3 s ASP 51 CO 0.77 -0.32 1.74 0.18 0.52 0.00 0.00 175.17 178.06 1gx3 n LEU 52 N 4.95 5.68 -4.79 -1.34 4.77 -1.26 -4.61 117.00 120.39 1gx3 n LEU 52 Ca -0.13 -3.39 -0.33 0.00 -0.03 0.00 0.00 56.01 52.13 1gx3 n LEU 52 Cb 0.47 -0.73 0.02 0.00 -2.33 0.00 0.00 43.42 40.84 1gx3 n LEU 52 CO 0.35 0.93 0.73 -0.94 -1.33 0.00 0.00 177.39 177.12 1gx3 s SER 53 N -1.46 5.64 0.19 -1.43 1.04 -1.26 -4.84 113.70 111.57 1gx3 s SER 53 Ca 0.52 1.89 -0.14 0.00 0.48 0.00 0.00 55.95 58.71 1gx3 s SER 53 Cb 0.43 -2.54 0.18 0.00 0.10 0.00 0.00 66.02 64.19 1gx3 s SER 53 CO 0.10 -1.26 1.67 0.00 0.98 0.00 0.00 173.24 174.73 1gx3 h ALA 54 N 0.45 0.44 -0.07 5.32 0.00 -1.93 0.94 119.26 124.41 1gx3 h ALA 54 Ca -0.47 0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.64 1gx3 h ALA 54 Cb 1.23 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 19.25 1gx3 h ALA 54 CO 0.57 -0.40 -0.32 0.93 0.00 0.00 0.00 179.25 180.02 1gx3 h GLU 55 N 0.08 -0.42 -0.10 0.00 3.07 -1.98 0.20 114.58 115.44 1gx3 h GLU 55 Ca 0.25 0.03 0.03 0.00 -0.50 0.00 0.00 59.36 59.17 1gx3 h GLU 55 Cb 0.38 0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.35 1gx3 h GLU 55 CO -0.44 -0.28 -0.10 0.00 -1.40 0.00 0.00 179.01 176.79 1gx3 h ALA 56 N 0.34 -0.02 0.08 3.43 0.00 -1.76 -1.29 119.26 120.05 1gx3 h ALA 56 Ca 0.08 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1gx3 h ALA 56 Cb 0.55 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1gx3 h ALA 56 CO -0.31 -0.56 -0.04 -0.07 0.00 0.00 0.00 179.25 178.27 1gx3 h LEU 57 N -0.12 -0.10 -0.37 0.00 3.38 0.55 -2.50 115.31 116.15 1gx3 h LEU 57 Ca 0.07 -0.19 0.08 0.00 0.09 0.00 0.00 57.88 57.93 1gx3 h LEU 57 Cb 0.23 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 1gx3 h LEU 57 CO -0.18 0.14 -0.12 -0.26 0.09 0.00 0.00 178.44 178.11 1gx3 h PHE 58 N -0.33 -0.26 -0.45 1.13 -1.00 -0.65 0.21 116.94 115.59 1gx3 h PHE 58 Ca -0.01 0.04 0.08 0.00 2.81 0.00 0.00 57.97 60.89 1gx3 h PHE 58 Cb 0.28 0.17 -0.07 0.00 3.61 0.00 0.00 35.95 39.94 1gx3 h PHE 58 CO -0.00 -0.19 -0.00 0.00 -1.61 0.00 0.00 178.31 176.51 1gx3 h ALA 59 N 1.32 0.42 0.03 2.45 0.00 -1.09 0.14 119.26 122.52 1gx3 h ALA 59 Ca 0.18 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 1gx3 h ALA 59 Cb 0.31 0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.33 1gx3 h ALA 59 CO -0.40 -0.39 -0.28 -0.22 0.00 0.00 0.00 179.25 177.96 1gx3 h LYS 60 N 0.11 0.13 0.00 0.00 3.64 -0.92 -1.21 116.57 118.32 1gx3 h LYS 60 Ca 0.22 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1gx3 h LYS 60 Cb 0.33 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1gx3 h LYS 60 CO -0.37 1.02 -0.46 -0.07 -2.27 0.00 0.00 179.45 177.30 1gx3 h LEU 61 N -0.68 0.00 0.00 5.20 4.07 -0.56 -1.83 115.31 121.51 1gx3 h LEU 61 Ca -0.04 -0.07 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 1gx3 h LEU 61 Cb 1.15 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.88 1gx3 h LEU 61 CO 0.05 0.03 -1.09 0.52 -1.08 0.00 0.00 178.44 176.88 1gx3 n VAL 62 N -2.53 0.09 -0.01 1.22 0.31 -0.03 -4.35 118.33 113.03 1gx3 n VAL 62 Ca 0.03 -0.04 -0.21 0.00 -0.01 0.00 0.00 64.34 64.11 1gx3 n VAL 62 Cb 0.49 -0.60 -0.14 0.00 -0.91 0.00 0.00 33.84 32.68 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 0.00 0.34 -0.49 4.52 3.32 -1.28 -3.35 116.42 119.48 1gx3 h ASP 63 Ca -0.03 -0.83 0.00 0.00 0.02 0.00 0.00 57.03 56.19 1gx3 h ASP 63 Cb 1.06 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.50 1gx3 h ASP 63 CO -0.00 1.65 0.00 0.54 -1.72 0.00 0.00 179.24 179.71 1gx3 n ARG 64 N -3.90 2.16 -4.05 3.56 1.74 -0.46 -4.94 116.66 110.78 1gx3 n ARG 64 Ca -0.27 -1.80 -0.31 0.00 -0.77 0.00 0.00 57.85 54.69 1gx3 n ARG 64 Cb 0.90 -1.40 -0.01 0.00 -1.02 0.00 0.00 32.46 30.94 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 0.97 -4.01 -3.08 5.56 5.12 -1.24 -4.75 116.66 115.22 1gx3 n ARG 65 Ca 0.17 0.46 -0.18 0.00 -1.93 0.00 0.00 57.85 56.37 1gx3 n ARG 65 Cb 0.43 -5.10 0.01 0.00 -1.16 0.00 0.00 32.46 26.63 1gx3 n ARG 65 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1gx3 s ARG 66 N -6.71 2.77 0.00 5.56 1.81 -0.69 -3.44 118.95 118.25 1gx3 s ARG 66 Ca 0.52 -1.30 0.00 0.00 -1.72 0.00 0.00 55.73 53.24 1gx3 s ARG 66 Cb -0.28 -2.71 0.00 0.00 -0.45 0.00 0.00 34.95 31.52 1gx3 s ARG 66 CO 0.88 -0.29 0.00 0.41 -0.68 0.00 0.00 175.30 175.63 1gx3 n GLY 67 N -1.83 2.53 2.95 -3.53 0.00 -1.26 -4.41 105.19 99.63 1gx3 n GLY 67 Ca 0.08 -2.14 -0.04 0.00 0.00 0.00 0.00 46.02 43.91 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 0.93 0.00 -0.02 0.00 -1.07 -4.77 105.19 105.26 1gx3 n GLY 68 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.50 -1.49 -0.13 1.61 -0.00 -1.14 -1.21 117.16 114.29 1gx3 n TYR 69 Ca -0.04 0.00 -0.05 0.00 -0.00 0.00 0.00 57.90 57.81 1gx3 n TYR 69 Cb 0.45 0.00 0.03 0.00 -0.00 0.00 0.00 39.34 39.83 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 0.35 0.38 -0.01 0.00 -1.99 -1.88 -1.54 116.97 112.28 1gx3 h TYR 71 Ca 0.19 -0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.89 1gx3 h TYR 71 Cb 0.16 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 38.77 1gx3 h TYR 71 CO -0.14 0.35 -0.06 0.93 -0.00 0.00 0.00 178.16 179.24 1gx3 h GLU 72 N 0.38 0.05 0.69 4.88 5.08 -1.54 -1.93 114.58 122.19 1gx3 h GLU 72 Ca 0.09 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1gx3 h GLU 72 Cb 0.16 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1gx3 h GLU 72 CO -0.00 0.75 -0.40 0.45 -1.00 0.00 0.00 179.01 178.81 1gx3 h HIS 73 N -0.63 -1.06 0.00 4.33 3.86 -0.94 0.52 115.15 121.23 1gx3 h HIS 73 Ca -0.01 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1gx3 h HIS 73 Cb 0.76 0.37 0.00 0.00 1.06 0.00 0.00 27.41 29.61 1gx3 h HIS 73 CO 0.17 -0.61 0.00 -0.91 0.86 0.00 0.00 177.93 177.45 1gx3 h ASN 74 N -1.01 0.00 0.19 2.45 2.35 -1.46 -0.42 115.58 117.68 1gx3 h ASN 74 Ca -0.09 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 1gx3 h ASN 74 Cb 0.80 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.17 1gx3 h ASN 74 CO 0.11 0.00 -0.09 1.23 -1.65 0.00 0.00 177.43 177.03 1gx3 h GLY 75 N 2.59 -0.26 0.44 2.83 0.00 -1.05 -1.74 103.07 105.88 1gx3 h GLY 75 Ca 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 1gx3 h GLY 75 CO 0.00 -0.10 -0.44 -2.00 0.00 0.00 0.00 176.54 174.01 1gx3 h LEU 76 N -0.70 -1.20 -1.16 3.11 5.85 0.28 -2.73 115.31 118.75 1gx3 h LEU 76 Ca -0.03 0.10 0.19 0.00 0.84 0.00 0.00 57.88 58.98 1gx3 h LEU 76 Cb 0.49 0.39 -0.09 0.00 0.37 0.00 0.00 40.66 41.82 1gx3 h LEU 76 CO 0.04 -0.58 0.61 0.25 -0.34 0.00 0.00 178.44 178.43 1gx3 h LEU 77 N -0.88 0.68 -0.58 2.25 5.85 -1.19 -1.64 115.31 119.80 1gx3 h LEU 77 Ca -0.06 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.76 1gx3 h LEU 77 Cb 0.76 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 1gx3 h LEU 77 CO -0.05 0.25 0.36 1.23 -0.34 0.00 0.00 178.44 179.89 1gx3 h GLY 78 N 0.66 0.82 0.78 3.75 0.00 -1.07 0.14 103.07 108.16 1gx3 h GLY 78 Ca 0.55 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.60 1gx3 h GLY 78 CO -0.31 0.24 -0.04 -0.97 0.00 0.00 0.00 176.54 175.46 1gx3 h TYR 79 N 0.72 -0.11 0.09 5.60 -1.99 -1.07 -1.89 116.97 118.32 1gx3 h TYR 79 Ca 0.23 -0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.97 1gx3 h TYR 79 Cb -0.01 0.04 -0.05 0.00 2.00 0.00 0.00 36.73 38.71 1gx3 h TYR 79 CO -0.05 0.13 -0.52 0.28 -0.00 0.00 0.00 178.16 178.00 1gx3 h VAL 80 N -0.34 0.02 -0.69 -2.88 2.07 -0.88 0.21 116.25 113.77 1gx3 h VAL 80 Ca -0.01 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.64 1gx3 h VAL 80 Cb 0.28 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.03 1gx3 h VAL 80 CO 0.02 0.00 0.46 -0.07 0.02 0.00 0.00 177.57 178.00 1gx3 h LEU 81 N -0.72 0.38 0.07 2.57 3.38 -0.77 -1.57 115.31 118.65 1gx3 h LEU 81 Ca 0.00 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1gx3 h LEU 81 Cb 0.74 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1gx3 h LEU 81 CO -0.30 0.21 -0.04 -0.33 0.09 0.00 0.00 178.44 178.07 1gx3 h GLU 82 N 0.41 -0.10 0.00 1.13 5.08 -0.19 -1.63 114.58 119.28 1gx3 h GLU 82 Ca 0.33 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 1gx3 h GLU 82 Cb 0.72 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1gx3 h GLU 82 CO -0.10 0.28 0.00 -1.91 -1.00 0.00 0.00 179.01 176.28 1gx3 n GLU 83 N -4.96 0.20 0.00 2.33 4.07 0.55 -0.44 120.64 122.40 1gx3 n GLU 83 Ca -0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 1gx3 n GLU 83 Cb 0.22 -1.28 0.00 0.00 -0.06 0.00 0.00 31.44 30.32 1gx3 n GLU 83 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1gx3 n LEU 84 N -0.78 1.06 0.00 4.31 4.77 -0.97 -4.94 117.00 120.46 1gx3 n LEU 84 Ca 0.03 -1.06 0.00 0.00 -0.03 0.00 0.00 56.01 54.95 1gx3 n LEU 84 Cb 0.01 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1gx3 n LEU 84 CO 0.02 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 1gx3 n GLY 85 N -0.04 0.98 3.87 -0.72 0.00 0.42 -4.29 105.19 105.40 1gx3 n GLY 85 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 3.45 -0.30 1.61 0.40 -0.65 -4.83 117.98 115.67 1gx3 s PHE 86 Ca 0.00 1.06 -0.18 0.00 -0.60 0.00 0.00 56.93 57.21 1gx3 s PHE 86 Cb 0.00 -2.44 -0.02 0.00 0.51 0.00 0.00 43.02 41.07 1gx3 s PHE 86 CO 0.00 -0.05 0.51 -2.00 0.70 0.00 0.00 175.22 174.37 1gx3 s GLU 87 N -3.67 3.89 -0.16 0.44 -6.30 -1.10 -4.39 118.70 107.41 1gx3 s GLU 87 Ca 0.51 0.12 -0.02 0.00 -2.50 0.00 0.00 54.97 53.08 1gx3 s GLU 87 Cb -0.10 -3.71 -0.02 0.00 0.00 0.00 0.00 34.13 30.29 1gx3 s GLU 87 CO 0.29 -0.46 -0.07 0.08 0.02 0.00 0.00 175.26 175.11 1gx3 s VAL 88 N 2.34 3.48 -0.12 3.70 1.01 -1.26 0.11 120.40 129.66 1gx3 s VAL 88 Ca 0.20 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.69 1gx3 s VAL 88 Cb -0.15 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 1gx3 s VAL 88 CO 0.11 0.49 -0.17 -1.61 0.00 0.00 0.00 175.10 173.92 1gx3 s GLU 89 N 0.54 3.26 -0.10 2.72 2.02 0.05 -4.97 118.70 122.22 1gx3 s GLU 89 Ca -0.05 -0.76 -0.22 0.00 0.02 0.00 0.00 54.97 53.96 1gx3 s GLU 89 Cb -0.15 -2.51 -0.04 0.00 0.10 0.00 0.00 34.13 31.53 1gx3 s GLU 89 CO 0.03 0.19 0.65 1.03 0.02 0.00 0.00 175.26 177.18 1gx3 s ARG 90 N 0.38 4.38 0.26 1.61 3.00 -1.26 -0.32 118.95 127.00 1gx3 s ARG 90 Ca -0.13 0.76 0.11 0.00 0.00 0.00 0.00 55.73 56.46 1gx3 s ARG 90 Cb -0.17 -3.47 -0.05 0.00 0.00 0.00 0.00 34.95 31.27 1gx3 s ARG 90 CO 0.06 0.02 -0.15 -0.51 0.00 0.00 0.00 175.30 174.73 1gx3 s LEU 91 N 0.98 2.76 0.20 2.53 1.43 0.47 -0.91 118.68 126.13 1gx3 s LEU 91 Ca 0.34 -0.88 0.10 0.00 -1.03 0.00 0.00 54.13 52.65 1gx3 s LEU 91 Cb -0.17 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 44.70 1gx3 s LEU 91 CO 0.15 0.04 -0.20 -0.94 0.23 0.00 0.00 176.35 175.64 1gx3 s SER 92 N -3.43 3.05 0.32 2.29 1.04 -1.26 -1.23 113.70 114.48 1gx3 s SER 92 Ca 0.29 -0.92 -0.13 0.00 0.48 0.00 0.00 55.95 55.68 1gx3 s SER 92 Cb -0.06 -0.21 0.02 0.00 0.10 0.00 0.00 66.02 65.87 1gx3 s SER 92 CO 0.16 0.00 0.62 -0.83 0.98 0.00 0.00 173.24 174.17 1gx3 s GLY 93 N -2.92 0.61 -0.10 7.32 0.00 -0.67 -3.81 107.32 107.74 1gx3 s GLY 93 Ca 0.21 -0.90 0.02 0.00 0.00 0.00 0.00 44.72 44.05 1gx3 s GLY 93 CO 0.09 -0.53 -0.17 0.50 0.00 0.00 0.00 173.10 172.99 1gx3 s ARG 94 N -3.22 3.09 -0.17 2.90 0.52 0.19 -2.13 118.95 120.13 1gx3 s ARG 94 Ca 0.20 -0.75 -0.23 0.00 -0.52 0.00 0.00 55.73 54.43 1gx3 s ARG 94 Cb -0.03 -2.47 -0.02 0.00 0.52 0.00 0.00 34.95 32.95 1gx3 s ARG 94 CO 0.12 0.29 0.73 0.08 0.02 0.00 0.00 175.30 176.53 1gx3 s VAL 95 N 0.13 4.96 -0.44 3.52 1.01 -1.26 0.10 120.40 128.43 1gx3 s VAL 95 Ca -0.09 1.41 0.04 0.00 0.00 0.00 0.00 61.98 63.34 1gx3 s VAL 95 Cb -0.15 -4.04 0.02 0.00 0.00 0.00 0.00 36.38 32.21 1gx3 s VAL 95 CO 0.05 0.09 0.56 1.33 0.00 0.00 0.00 175.10 177.14 1gx3 n VAL 96 N 4.61 0.00 -1.72 2.92 0.24 -0.02 -4.81 118.33 119.56 1gx3 n VAL 96 Ca 0.01 -0.49 -0.61 0.00 -2.04 0.00 0.00 64.34 61.21 1gx3 n VAL 96 Cb 0.49 1.07 -0.08 0.00 -1.47 0.00 0.00 33.84 33.85 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 0.06 1.94 -1.47 6.34 -0.00 -0.42 -0.53 117.44 123.36 1gx3 n TRP 97 Ca 0.02 0.75 -0.15 0.00 -0.00 0.00 0.00 57.50 58.12 1gx3 n TRP 97 Cb 0.09 -2.38 -0.06 0.00 -0.00 0.00 0.00 31.31 28.96 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 4.99 -1.35 -2.70 5.87 2.81 -1.26 -4.95 117.12 120.52 1gx3 n MET 98 Ca 0.29 0.90 -0.40 0.00 -1.81 0.00 0.00 57.70 56.68 1gx3 n MET 98 Cb 0.06 -5.19 -0.06 0.00 -0.71 0.00 0.00 33.22 27.33 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 -3.33 4.78 0.65 0.03 0.52 0.31 -5.00 118.95 116.91 1gx3 s ARG 99 Ca 0.00 1.53 -0.17 0.00 -0.52 0.00 0.00 55.73 56.56 1gx3 s ARG 99 Cb 0.00 -3.20 -0.10 0.00 0.52 0.00 0.00 34.95 32.17 1gx3 s ARG 99 CO 0.00 0.43 0.11 0.00 0.02 0.00 0.00 175.30 175.86 1gx3 n ALA 100 N 1.31 -2.55 -1.77 2.13 0.00 -1.26 -4.86 120.51 113.51 1gx3 n ALA 100 Ca -0.01 -0.19 -0.40 0.00 0.00 0.00 0.00 53.44 52.83 1gx3 n ALA 100 Cb 0.47 -1.59 -0.01 0.00 0.00 0.00 0.00 19.45 18.31 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 -1.18 6.61 -1.46 0.00 2.15 -1.26 -2.77 116.67 118.75 1gx3 s ASP 101 Ca 0.60 2.69 -0.08 0.00 0.43 0.00 0.00 52.55 56.18 1gx3 s ASP 101 Cb -0.40 -2.65 0.06 0.00 -0.30 0.00 0.00 42.92 39.63 1gx3 s ASP 101 CO 0.64 -0.65 0.81 0.47 -0.17 0.00 0.00 175.17 176.27 1gx3 n ASP 102 N 0.56 -3.00 -4.94 -0.34 8.00 -1.26 -4.97 116.55 110.60 1gx3 n ASP 102 Ca 0.01 -0.84 -0.25 0.00 0.71 0.00 0.00 54.79 54.43 1gx3 n ASP 102 Cb 0.42 -3.74 0.06 0.00 -0.02 0.00 0.00 41.12 37.85 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 -3.50 3.35 0.52 2.24 0.00 -1.11 -5.03 121.76 118.23 1gx3 s ALA 103 Ca 0.39 -1.04 -0.23 0.00 0.00 0.00 0.00 51.96 51.08 1gx3 s ALA 103 Cb -0.20 -2.46 -0.06 0.00 0.00 0.00 0.00 23.12 20.41 1gx3 s ALA 103 CO 0.84 -1.16 1.36 -2.14 0.00 0.00 0.00 175.76 174.66 1gx3 s PRO 104 N -5.12 3.32 0.05 0.00 0.02 -1.26 -4.87 135.00 127.13 1gx3 s PRO 104 Ca 0.59 2.25 -0.36 0.00 0.02 0.00 0.00 61.00 63.50 1gx3 s PRO 104 Cb -0.11 -2.37 -0.16 0.00 0.02 0.00 0.00 34.50 31.89 1gx3 s PRO 104 CO 0.43 -1.05 1.47 -0.11 -0.33 0.00 0.00 177.00 177.41 1gx3 n LEU 105 N -0.78 2.17 -4.83 -5.54 7.94 -1.26 -4.94 117.00 109.75 1gx3 n LEU 105 Ca 0.09 1.10 -0.32 0.00 -1.11 0.00 0.00 56.01 55.77 1gx3 n LEU 105 Cb 0.44 -1.25 0.00 0.00 0.53 0.00 0.00 43.42 43.15 1gx3 n LEU 105 CO 0.54 -0.74 0.70 -2.84 -1.11 0.00 0.00 177.39 173.94 1gx3 s PRO 106 N 1.14 3.51 0.88 1.96 0.02 -1.26 -5.04 135.00 136.21 1gx3 s PRO 106 Ca 0.85 0.99 -0.10 0.00 0.02 0.00 0.00 61.00 62.76 1gx3 s PRO 106 Cb -0.89 -2.07 0.12 0.00 0.02 0.00 0.00 34.50 31.69 1gx3 s PRO 106 CO 0.47 -0.64 1.12 0.00 -0.33 0.00 0.00 177.00 177.62 1gx3 s ALA 107 N -2.76 1.62 -0.63 -1.55 0.00 -1.26 -4.89 121.76 112.29 1gx3 s ALA 107 Ca 0.59 0.42 -0.27 0.00 0.00 0.00 0.00 51.96 52.70 1gx3 s ALA 107 Cb -0.13 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.64 1gx3 s ALA 107 CO 0.42 -2.49 1.36 -0.65 0.00 0.00 0.00 175.76 174.39 1gx3 s GLN 108 N -4.74 3.25 0.00 0.00 -0.21 -1.26 -4.27 119.66 112.43 1gx3 s GLN 108 Ca 0.65 0.18 0.00 0.00 0.02 0.00 0.00 55.36 56.20 1gx3 s GLN 108 Cb -0.21 -4.14 0.00 0.00 1.00 0.00 0.00 33.01 29.66 1gx3 s GLN 108 CO 0.58 -2.03 0.42 0.25 -2.12 0.00 0.00 175.29 172.39 1gx3 n THR 109 N 6.68 0.11 -4.47 -0.19 -2.24 -0.98 -4.83 114.28 108.36 1gx3 n THR 109 Ca 0.09 -0.40 -0.29 0.00 -2.27 0.00 0.00 64.05 61.18 1gx3 n THR 109 Cb 0.49 1.21 -0.13 0.00 -2.10 0.00 0.00 70.33 69.80 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 -0.11 2.38 -0.06 4.78 5.65 -0.91 -4.91 115.29 122.12 1gx3 s HIS 110 Ca 0.00 -0.35 -0.00 0.00 0.25 0.00 0.00 55.06 54.96 1gx3 s HIS 110 Cb 0.00 -1.31 0.03 0.00 -1.18 0.00 0.00 32.58 30.12 1gx3 s HIS 110 CO 0.00 0.31 -0.01 1.21 -0.65 0.00 0.00 174.74 175.60 1gx3 s ASN 111 N -1.90 1.24 0.28 9.88 3.04 -1.26 -1.67 114.94 124.54 1gx3 s ASN 111 Ca 0.15 -0.09 0.02 0.00 0.04 0.00 0.00 52.86 52.97 1gx3 s ASN 111 Cb -0.10 -0.42 -0.05 0.00 -1.54 0.00 0.00 41.25 39.14 1gx3 s ASN 111 CO 0.06 -0.14 0.10 0.68 -3.04 0.00 0.00 177.10 174.77 1gx3 s VAL 112 N 1.51 0.59 -0.01 -5.21 -7.23 -0.36 -4.73 120.40 104.97 1gx3 s VAL 112 Ca -0.02 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.21 1gx3 s VAL 112 Cb -0.13 -2.62 -0.03 0.00 0.56 0.00 0.00 36.38 34.16 1gx3 s VAL 112 CO -0.03 0.00 -0.18 -0.76 -0.31 0.00 0.00 175.10 173.82 1gx3 s LEU 113 N -3.35 2.58 -0.33 1.32 1.43 0.34 -0.40 118.68 120.28 1gx3 s LEU 113 Ca 0.37 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 1gx3 s LEU 113 Cb 0.07 -1.51 0.08 0.00 0.03 0.00 0.00 46.19 44.86 1gx3 s LEU 113 CO 0.14 0.30 0.03 -0.55 0.23 0.00 0.00 176.35 176.51 1gx3 s SER 114 N -1.03 4.83 -0.15 2.29 0.15 0.57 -0.96 113.70 119.40 1gx3 s SER 114 Ca 0.13 -1.75 -0.04 0.00 0.70 0.00 0.00 55.95 54.99 1gx3 s SER 114 Cb -0.10 -1.67 -0.03 0.00 -1.71 0.00 0.00 66.02 62.50 1gx3 s SER 114 CO 0.02 -0.34 -0.00 -0.69 1.20 0.00 0.00 173.24 173.43 1gx3 s VAL 115 N 1.08 4.25 -0.24 4.45 1.01 -0.17 -0.77 120.40 130.01 1gx3 s VAL 115 Ca 0.02 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.64 1gx3 s VAL 115 Cb -0.20 -2.86 -0.05 0.00 0.00 0.00 0.00 36.38 33.27 1gx3 s VAL 115 CO -0.05 0.51 0.24 0.00 0.00 0.00 0.00 175.10 175.80 1gx3 s ALA 116 N 0.05 3.58 -0.46 5.51 0.00 0.12 -0.41 121.76 130.15 1gx3 s ALA 116 Ca 0.02 -0.83 -0.18 0.00 0.00 0.00 0.00 51.96 50.97 1gx3 s ALA 116 Cb -0.13 -2.46 0.04 0.00 0.00 0.00 0.00 23.12 20.58 1gx3 s ALA 116 CO 0.02 -0.31 0.53 0.08 0.00 0.00 0.00 175.76 176.08 1gx3 s VAL 117 N 1.32 4.99 0.22 0.00 1.01 -1.26 -2.73 120.40 123.94 1gx3 s VAL 117 Ca 0.11 -0.41 -0.32 0.00 0.00 0.00 0.00 61.98 61.36 1gx3 s VAL 117 Cb -0.14 -4.17 -0.14 0.00 0.00 0.00 0.00 36.38 31.93 1gx3 s VAL 117 CO 0.07 -0.61 1.43 -2.65 0.00 0.00 0.00 175.10 173.34 1gx3 n PRO 118 N 5.87 1.99 0.00 2.72 -0.02 -1.26 -0.44 135.00 143.86 1gx3 n PRO 118 Ca -0.07 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1gx3 n PRO 118 Cb 0.46 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 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 2.41 2.81 3.90 -1.23 0.00 -1.26 -4.70 105.19 107.12 1gx3 n GLY 119 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.66 3.95 0.01 4.61 0.00 0.42 -5.09 121.76 123.99 1gx3 s ALA 120 Ca 0.00 -0.75 -0.23 0.00 0.00 0.00 0.00 51.96 50.98 1gx3 s ALA 120 Cb 0.00 -1.90 -0.05 0.00 0.00 0.00 0.00 23.12 21.17 1gx3 s ALA 120 CO 0.00 0.75 0.71 -0.51 0.00 0.00 0.00 175.76 176.70 1gx3 s ASP 121 N -1.99 7.10 0.00 0.00 1.01 -1.26 -4.56 116.67 116.97 1gx3 s ASP 121 Ca 0.28 1.32 0.00 0.00 0.71 0.00 0.00 52.55 54.86 1gx3 s ASP 121 Cb -0.13 -2.43 0.00 0.00 1.01 0.00 0.00 42.92 41.37 1gx3 s ASP 121 CO 0.20 0.01 0.00 0.61 0.21 0.00 0.00 175.17 176.19 1gx3 n GLY 122 N 2.56 -1.80 3.37 0.21 0.00 -1.26 -4.99 105.19 103.29 1gx3 n GLY 122 Ca -0.03 -1.64 -0.23 0.00 0.00 0.00 0.00 46.02 44.12 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 1.39 -0.07 1.61 0.52 -1.26 -4.23 118.95 116.91 1gx3 s ARG 123 Ca 0.00 -1.51 0.04 0.00 -0.52 0.00 0.00 55.73 53.75 1gx3 s ARG 123 Cb 0.00 -1.46 -0.01 0.00 0.52 0.00 0.00 34.95 33.99 1gx3 s ARG 123 CO 0.00 0.29 -0.21 0.71 0.02 0.00 0.00 175.30 176.12 1gx3 s TYR 124 N -2.17 2.57 -0.09 -0.53 1.51 0.45 -0.80 117.35 118.29 1gx3 s TYR 124 Ca 0.20 -0.61 -0.30 0.00 -1.01 0.00 0.00 57.07 55.35 1gx3 s TYR 124 Cb -0.05 -1.66 -0.02 0.00 -0.11 0.00 0.00 41.96 40.12 1gx3 s TYR 124 CO 0.08 -0.14 1.17 -1.17 -1.11 0.00 0.00 175.55 174.38 1gx3 s LEU 125 N -0.16 4.25 -0.06 -1.29 2.96 0.93 -1.00 118.68 124.32 1gx3 s LEU 125 Ca -0.03 1.73 0.05 0.00 -0.22 0.00 0.00 54.13 55.66 1gx3 s LEU 125 Cb -0.14 -3.55 -0.00 0.00 0.50 0.00 0.00 46.19 42.99 1gx3 s LEU 125 CO 0.04 -0.59 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.58 1gx3 s VAL 126 N 2.42 1.70 -0.32 1.68 1.01 -0.14 -1.56 120.40 125.20 1gx3 s VAL 126 Ca 0.54 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.72 1gx3 s VAL 126 Cb -0.23 -1.45 0.19 0.00 0.00 0.00 0.00 36.38 34.89 1gx3 s VAL 126 CO 0.19 0.48 0.57 -0.62 0.00 0.00 0.00 175.10 175.72 1gx3 s ASP 127 N 0.04 -1.26 -0.05 3.32 2.15 -1.26 -0.50 116.67 119.11 1gx3 s ASP 127 Ca -0.06 -0.17 0.17 0.00 0.43 0.00 0.00 52.55 52.93 1gx3 s ASP 127 Cb -0.13 1.85 0.56 0.00 -0.30 0.00 0.00 42.92 44.90 1gx3 s ASP 127 CO 0.04 -0.28 1.48 1.33 -0.17 0.00 0.00 175.17 177.56 1gx3 n VAL 128 N 5.14 1.35 -0.44 1.11 0.24 -1.26 -3.28 118.33 121.20 1gx3 n VAL 128 Ca 0.06 -1.13 0.05 0.00 -2.04 0.00 0.00 64.34 61.28 1gx3 n VAL 128 Cb 0.54 0.33 0.14 0.00 -1.47 0.00 0.00 33.84 33.38 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 0.99 3.39 0.12 7.63 0.00 -1.26 -4.72 105.19 111.34 1gx3 n GLY 129 Ca 0.21 -0.53 0.15 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.22 0.00 -0.84 1.61 7.35 -1.26 -3.20 117.46 120.91 1gx3 n PHE 130 Ca 0.12 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.81 1gx3 n PHE 130 Cb 0.52 -0.09 0.00 0.00 0.35 0.00 0.00 39.48 40.26 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 1.15 0.77 0.36 7.13 0.00 -1.26 -4.42 105.19 108.92 1gx3 n GLY 131 Ca 0.19 -1.52 0.11 0.00 0.00 0.00 0.00 46.02 44.80 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 0.69 -2.39 -0.02 0.00 -1.91 -2.14 103.07 97.31 1gx3 h GLY 132 Ca 0.00 -0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.03 1gx3 h GLY 132 CO 0.00 0.12 0.07 -0.18 0.00 0.00 0.00 176.54 176.55 1gx3 n GLN 133 N -4.48 3.04 -2.15 4.80 -0.06 -1.26 -4.83 117.38 112.44 1gx3 n GLN 133 Ca 0.11 -3.00 -0.37 0.00 -2.00 0.00 0.00 57.00 51.73 1gx3 n GLN 133 Cb 0.36 -1.97 0.01 0.00 -4.06 0.00 0.00 30.24 24.57 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 -2.96 2.88 0.28 1.69 -1.32 -0.81 -4.95 115.64 110.45 1gx3 s THR 134 Ca 0.47 0.63 -0.29 0.00 -1.21 0.00 0.00 61.69 61.29 1gx3 s THR 134 Cb 0.39 -3.30 -0.14 0.00 -1.51 0.00 0.00 72.50 67.94 1gx3 s THR 134 CO 0.09 -0.04 1.15 0.18 -2.21 0.00 0.00 174.62 173.79 1gx3 n LEU 135 N -0.83 2.34 -0.47 9.08 4.77 -1.21 -4.91 117.00 125.77 1gx3 n LEU 135 Ca 0.09 1.17 0.09 0.00 -0.03 0.00 0.00 56.01 57.33 1gx3 n LEU 135 Cb 0.48 -1.34 0.20 0.00 -2.33 0.00 0.00 43.42 40.42 1gx3 n LEU 135 CO 0.47 -1.05 0.63 0.35 -1.33 0.00 0.00 177.39 176.46 1gx3 n THR 136 N 0.69 2.09 -3.54 -5.08 -2.24 -1.26 -4.62 114.28 100.32 1gx3 n THR 136 Ca 0.10 -2.14 -0.17 0.00 -2.27 0.00 0.00 64.05 59.56 1gx3 n THR 136 Cb 0.32 -0.25 -0.06 0.00 -2.10 0.00 0.00 70.33 68.24 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 -2.47 -0.62 0.44 3.42 0.01 -1.26 -4.43 113.70 108.79 1gx3 s SER 137 Ca 0.37 0.65 -0.21 0.00 1.31 0.00 0.00 55.95 58.07 1gx3 s SER 137 Cb 0.31 0.52 -0.10 0.00 0.21 0.00 0.00 66.02 66.97 1gx3 s SER 137 CO 0.05 -0.61 1.00 -2.84 0.41 0.00 0.00 173.24 171.25 1gx3 s PRO 138 N -1.28 4.07 0.26 12.44 0.02 -1.26 -4.88 135.00 144.38 1gx3 s PRO 138 Ca -0.11 1.28 0.07 0.00 0.02 0.00 0.00 61.00 62.27 1gx3 s PRO 138 Cb -0.00 -2.23 -0.05 0.00 0.02 0.00 0.00 34.50 32.23 1gx3 s PRO 138 CO 0.09 -0.18 -0.09 0.96 -0.33 0.00 0.00 177.00 177.44 1gx3 s ILE 139 N -1.99 1.74 0.11 2.83 -4.36 -0.60 -4.96 121.20 113.96 1gx3 s ILE 139 Ca 0.63 -2.17 -0.31 0.00 -0.26 0.00 0.00 60.65 58.54 1gx3 s ILE 139 Cb -0.14 -2.34 -0.08 0.00 1.25 0.00 0.00 42.46 41.16 1gx3 s ILE 139 CO 0.18 -0.38 1.38 -0.13 0.24 0.00 0.00 174.94 176.23 1gx3 s ARG 140 N -3.69 4.32 -1.19 0.37 0.52 -1.26 -0.05 118.95 117.98 1gx3 s ARG 140 Ca 0.28 2.06 -0.22 0.00 -0.52 0.00 0.00 55.73 57.33 1gx3 s ARG 140 Cb 0.02 -3.27 -0.06 0.00 0.52 0.00 0.00 34.95 32.15 1gx3 s ARG 140 CO 0.11 -0.44 1.90 -1.17 0.02 0.00 0.00 175.30 175.72 1gx3 s LEU 141 N 1.18 3.17 -0.18 2.53 1.98 0.02 -4.69 118.68 122.69 1gx3 s LEU 141 Ca 0.64 -1.72 -0.09 0.00 -2.89 0.00 0.00 54.13 50.07 1gx3 s LEU 141 Cb -0.36 -2.59 0.07 0.00 0.66 0.00 0.00 46.19 43.97 1gx3 s LEU 141 CO 0.30 -2.79 0.42 -0.70 -1.89 0.00 0.00 176.35 171.68 1gx3 s GLU 142 N 6.18 0.38 0.37 1.98 2.12 -1.26 -4.81 118.70 123.66 1gx3 s GLU 142 Ca 0.66 0.88 -0.24 0.00 0.36 0.00 0.00 54.97 56.63 1gx3 s GLU 142 Cb -0.00 0.09 -0.10 0.00 0.26 0.00 0.00 34.13 34.38 1gx3 s GLU 142 CO 0.12 -0.19 0.99 0.00 -0.54 0.00 0.00 175.26 175.64 1gx3 s ALA 143 N 1.80 3.13 0.00 6.30 0.00 -1.26 -4.42 121.76 127.31 1gx3 s ALA 143 Ca -0.07 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1gx3 s ALA 143 Cb -0.09 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1gx3 s ALA 143 CO -0.13 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.03 1gx3 n GLY 144 N 0.30 2.11 3.68 0.00 0.00 -0.03 -4.97 105.19 106.28 1gx3 n GLY 144 Ca 0.04 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 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 4.26 0.09 1.61 0.04 -1.26 -4.88 135.00 134.86 1gx3 s PRO 145 Ca 0.00 1.96 -0.31 0.00 0.04 0.00 0.00 61.00 62.70 1gx3 s PRO 145 Cb 0.00 -3.66 -0.08 0.00 0.04 0.00 0.00 34.50 30.80 1gx3 s PRO 145 CO 0.00 -0.63 1.56 0.08 0.04 0.00 0.00 177.00 178.05 1gx3 s VAL 146 N 2.77 3.07 -0.11 -0.36 1.01 -1.26 -4.59 120.40 120.92 1gx3 s VAL 146 Ca 0.64 0.63 0.02 0.00 0.00 0.00 0.00 61.98 63.27 1gx3 s VAL 146 Cb -0.31 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 1gx3 s VAL 146 CO 0.26 0.02 -0.16 -1.10 0.00 0.00 0.00 175.10 174.11 1gx3 s GLN 147 N 2.01 3.12 0.31 2.72 -0.21 0.31 -4.99 119.66 122.92 1gx3 s GLN 147 Ca 0.70 -0.74 -0.21 0.00 0.02 0.00 0.00 55.36 55.13 1gx3 s GLN 147 Cb -0.39 -2.49 -0.09 0.00 1.00 0.00 0.00 33.01 31.03 1gx3 s GLN 147 CO 0.31 0.29 0.84 -1.14 -2.12 0.00 0.00 175.29 173.46 1gx3 s GLN 148 N 0.14 4.31 0.34 2.91 2.00 -1.26 -0.64 119.66 127.45 1gx3 s GLN 148 Ca -0.08 1.02 0.03 0.00 -2.00 0.00 0.00 55.36 54.33 1gx3 s GLN 148 Cb -0.15 -2.65 -0.05 0.00 0.80 0.00 0.00 33.01 30.96 1gx3 s GLN 148 CO 0.05 0.24 0.09 0.95 -0.50 0.00 0.00 175.29 176.12 1gx3 s THR 149 N -1.75 0.84 0.39 -0.34 -4.23 -1.18 -4.89 115.64 104.47 1gx3 s THR 149 Ca 0.51 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 59.20 1gx3 s THR 149 Cb -0.15 -2.61 0.19 0.00 1.34 0.00 0.00 72.50 71.27 1gx3 s THR 149 CO 0.20 0.00 1.52 0.03 -0.54 0.00 0.00 174.62 175.82 1gx3 h ARG 150 N 2.07 0.00 0.00 3.99 3.08 -1.95 -3.39 114.38 118.17 1gx3 h ARG 150 Ca -0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.67 1gx3 h ARG 150 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1gx3 h ARG 150 CO 0.63 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 180.25 1gx3 n HIS 151 N -2.46 0.00 -2.42 3.04 8.25 -1.26 -5.04 115.22 115.33 1gx3 n HIS 151 Ca -0.01 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.19 1gx3 n HIS 151 Cb 0.44 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.58 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 1.52 2.88 0.21 -0.41 8.01 -1.26 -5.04 118.70 124.60 1gx3 s GLU 152 Ca 0.00 -0.06 -0.30 0.00 0.01 0.00 0.00 54.97 54.62 1gx3 s GLU 152 Cb 0.00 -2.29 -0.08 0.00 -4.31 0.00 0.00 34.13 27.45 1gx3 s GLU 152 CO 0.00 -0.71 1.07 -2.14 0.01 0.00 0.00 175.26 173.50 1gx3 s PRO 153 N -4.98 4.65 0.21 0.39 0.02 -1.26 -3.12 135.00 130.90 1gx3 s PRO 153 Ca 0.54 1.71 0.11 0.00 0.02 0.00 0.00 61.00 63.37 1gx3 s PRO 153 Cb -0.10 -3.25 -0.04 0.00 0.02 0.00 0.00 34.50 31.12 1gx3 s PRO 153 CO 0.45 0.18 -0.20 0.71 -0.33 0.00 0.00 177.00 177.81 1gx3 s TYR 154 N -0.64 2.38 -0.05 6.54 1.51 0.19 -0.84 117.35 126.44 1gx3 s TYR 154 Ca 0.47 -0.32 -0.03 0.00 -1.01 0.00 0.00 57.07 56.17 1gx3 s TYR 154 Cb -0.30 -1.15 0.02 0.00 -0.11 0.00 0.00 41.96 40.43 1gx3 s TYR 154 CO 0.36 0.54 0.12 0.50 -1.11 0.00 0.00 175.55 175.96 1gx3 s ARG 155 N -2.85 0.11 -0.17 -0.62 3.52 -0.24 -0.53 118.95 118.17 1gx3 s ARG 155 Ca 0.23 0.24 -0.08 0.00 -0.13 0.00 0.00 55.73 55.99 1gx3 s ARG 155 Cb -0.08 -0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.24 1gx3 s ARG 155 CO 0.12 -0.08 0.09 -0.51 -0.81 0.00 0.00 175.30 174.11 1gx3 s LEU 156 N 0.50 4.00 0.16 -0.88 1.43 -1.26 -1.69 118.68 120.95 1gx3 s LEU 156 Ca -0.04 0.19 0.09 0.00 -1.03 0.00 0.00 54.13 53.35 1gx3 s LEU 156 Cb -0.05 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1gx3 s LEU 156 CO -0.02 0.23 -0.21 0.42 0.23 0.00 0.00 176.35 177.00 1gx3 s THR 157 N 0.04 1.97 0.09 5.49 -4.23 -0.60 -0.85 115.64 117.55 1gx3 s THR 157 Ca 0.07 -1.88 0.05 0.00 -1.18 0.00 0.00 61.69 58.75 1gx3 s THR 157 Cb -0.12 -1.88 -0.03 0.00 1.34 0.00 0.00 72.50 71.81 1gx3 s THR 157 CO 0.00 -0.20 -0.14 -0.60 -0.54 0.00 0.00 174.62 173.14 1gx3 s ARG 158 N -2.58 0.91 -0.42 3.99 3.52 -1.26 -0.75 118.95 122.36 1gx3 s ARG 158 Ca 0.16 -1.08 0.05 0.00 -0.13 0.00 0.00 55.73 54.73 1gx3 s ARG 158 Cb -0.07 -0.87 0.17 0.00 -1.56 0.00 0.00 34.95 32.62 1gx3 s ARG 158 CO 0.07 0.18 0.49 -1.01 -0.81 0.00 0.00 175.30 174.22 1gx3 s HIS 159 N -1.63 -0.53 0.00 5.12 3.76 -1.03 -5.02 115.29 115.97 1gx3 s HIS 159 Ca 0.03 -0.93 0.00 0.00 -0.15 0.00 0.00 55.06 54.01 1gx3 s HIS 159 Cb -0.08 -0.24 0.00 0.00 1.11 0.00 0.00 32.58 33.37 1gx3 s HIS 159 CO 0.02 -1.04 0.00 0.41 -0.85 0.00 0.00 174.74 173.28 1gx3 n GLY 160 N 3.67 1.28 0.64 -2.22 0.00 -1.26 -2.89 105.19 104.40 1gx3 n GLY 160 Ca 0.17 -0.71 0.10 0.00 0.00 0.00 0.00 46.02 45.58 1gx3 n GLY 160 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1gx3 n ASP 161 N 6.53 2.30 -4.55 1.61 -0.08 -1.26 -4.89 116.55 116.21 1gx3 n ASP 161 Ca 0.00 -1.65 -0.39 0.00 -1.51 0.00 0.00 54.79 51.23 1gx3 n ASP 161 Cb 0.00 0.20 -0.03 0.00 2.34 0.00 0.00 41.12 43.63 1gx3 n ASP 161 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1gx3 s ASP 162 N -1.86 5.77 0.02 1.67 2.15 -1.14 -4.20 116.67 119.08 1gx3 s ASP 162 Ca 0.20 -0.17 -0.16 0.00 0.43 0.00 0.00 52.55 52.85 1gx3 s ASP 162 Cb 0.16 -2.55 -0.06 0.00 -0.30 0.00 0.00 42.92 40.17 1gx3 s ASP 162 CO 0.34 -2.08 0.45 -1.00 -0.17 0.00 0.00 175.17 172.71 1gx3 s HIS 163 N 7.23 3.74 -0.10 -5.34 3.76 0.25 -2.45 115.29 122.37 1gx3 s HIS 163 Ca 0.50 1.06 0.03 0.00 -0.15 0.00 0.00 55.06 56.50 1gx3 s HIS 163 Cb -0.10 -2.34 -0.00 0.00 1.11 0.00 0.00 32.58 31.26 1gx3 s HIS 163 CO 0.16 0.62 -0.22 0.99 -0.85 0.00 0.00 174.74 175.44 1gx3 s THR 164 N -1.11 2.23 -0.19 1.30 2.01 0.07 0.00 115.64 119.96 1gx3 s THR 164 Ca 0.26 -0.96 -0.12 0.00 0.31 0.00 0.00 61.69 61.18 1gx3 s THR 164 Cb -0.17 -1.87 -0.05 0.00 0.01 0.00 0.00 72.50 70.42 1gx3 s THR 164 CO 0.15 0.55 0.21 -0.22 -0.69 0.00 0.00 174.62 174.63 1gx3 s LEU 165 N 0.33 4.20 0.07 4.42 2.96 -0.11 -1.55 118.68 129.01 1gx3 s LEU 165 Ca -0.17 0.33 0.05 0.00 -0.22 0.00 0.00 54.13 54.11 1gx3 s LEU 165 Cb -0.18 -2.22 -0.03 0.00 0.50 0.00 0.00 46.19 44.26 1gx3 s LEU 165 CO 0.08 0.11 -0.13 0.00 -1.32 0.00 0.00 176.35 175.10 1gx3 s ALA 166 N 0.58 1.10 0.10 5.97 0.00 -0.68 0.17 121.76 129.01 1gx3 s ALA 166 Ca 0.12 -1.02 0.10 0.00 0.00 0.00 0.00 51.96 51.16 1gx3 s ALA 166 Cb -0.12 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 1gx3 s ALA 166 CO 0.02 0.10 -0.26 0.00 0.00 0.00 0.00 175.76 175.62 1gx3 s ALA 167 N -1.53 2.26 -0.46 0.00 0.00 -0.24 -1.07 121.76 120.71 1gx3 s ALA 167 Ca -0.01 -1.38 -0.22 0.00 0.00 0.00 0.00 51.96 50.35 1gx3 s ALA 167 Cb -0.09 -0.39 0.03 0.00 0.00 0.00 0.00 23.12 22.68 1gx3 s ALA 167 CO 0.02 0.51 0.74 -1.14 0.00 0.00 0.00 175.76 175.89 1gx3 s GLN 168 N -1.81 3.33 -0.22 0.00 0.74 -0.02 -1.25 119.66 120.44 1gx3 s GLN 168 Ca 0.12 -0.28 -0.02 0.00 0.05 0.00 0.00 55.36 55.23 1gx3 s GLN 168 Cb -0.10 -3.97 0.01 0.00 1.10 0.00 0.00 33.01 30.05 1gx3 s GLN 168 CO 0.05 -1.13 -0.09 0.08 -0.55 0.00 0.00 175.29 173.64 1gx3 s VAL 169 N 3.15 2.93 -1.01 1.34 1.01 -0.17 -4.47 120.40 123.18 1gx3 s VAL 169 Ca 0.26 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 61.28 1gx3 s VAL 169 Cb -0.13 -2.34 0.03 0.00 0.00 0.00 0.00 36.38 33.94 1gx3 s VAL 169 CO 0.20 0.41 0.59 0.54 0.00 0.00 0.00 175.10 176.84 1gx3 n ARG 170 N 4.73 -0.54 0.00 2.72 1.74 -1.26 -1.96 116.66 122.09 1gx3 n ARG 170 Ca -0.19 0.15 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1gx3 n ARG 170 Cb 0.50 -2.07 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 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 -1.89 2.48 3.73 -0.13 0.00 -1.26 -5.01 105.19 103.11 1gx3 n GLY 171 Ca -0.15 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 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 0.00 3.13 0.00 1.61 2.02 -0.83 -5.07 118.70 119.56 1gx3 s GLU 172 Ca 0.00 -0.33 -0.30 0.00 0.02 0.00 0.00 54.97 54.36 1gx3 s GLU 172 Cb 0.00 -2.91 -0.04 0.00 0.10 0.00 0.00 34.13 31.29 1gx3 s GLU 172 CO 0.00 0.71 1.06 -1.58 0.02 0.00 0.00 175.26 175.47 1gx3 s TRP 173 N -0.89 3.54 -0.21 1.61 0.52 -1.26 -1.00 118.94 121.25 1gx3 s TRP 173 Ca 0.13 1.54 0.00 0.00 0.02 0.00 0.00 56.10 57.79 1gx3 s TRP 173 Cb -0.12 -3.24 0.05 0.00 -1.15 0.00 0.00 33.47 29.02 1gx3 s TRP 173 CO 0.03 -0.50 -0.05 -0.65 0.02 0.00 0.00 176.95 175.80 1gx3 s GLN 174 N 1.24 1.53 0.33 4.98 -0.21 -0.38 -4.97 119.66 122.18 1gx3 s GLN 174 Ca 0.54 -0.83 -0.29 0.00 0.02 0.00 0.00 55.36 54.80 1gx3 s GLN 174 Cb -0.23 -2.41 -0.11 0.00 1.00 0.00 0.00 33.01 31.26 1gx3 s GLN 174 CO 0.27 -0.55 1.41 -2.14 -2.12 0.00 0.00 175.29 172.15 1gx3 s PRO 175 N 1.49 4.25 -0.20 2.91 0.02 -1.26 -1.08 135.00 141.13 1gx3 s PRO 175 Ca -0.04 2.37 -0.16 0.00 0.02 0.00 0.00 61.00 63.19 1gx3 s PRO 175 Cb -0.18 -3.04 -0.08 0.00 0.02 0.00 0.00 34.50 31.22 1gx3 s PRO 175 CO -0.07 -0.37 -0.27 1.28 -0.33 0.00 0.00 177.00 177.25 1gx3 n LEU 176 N 1.07 1.91 -3.46 -5.54 4.77 0.45 -3.71 117.00 112.49 1gx3 n LEU 176 Ca 0.02 0.40 -0.11 0.00 -0.03 0.00 0.00 56.01 56.29 1gx3 n LEU 176 Cb 0.40 -0.81 -0.02 0.00 -2.33 0.00 0.00 43.42 40.67 1gx3 n LEU 176 CO 0.61 -0.03 0.45 -0.72 -1.33 0.00 0.00 177.39 176.37 1gx3 s TYR 177 N -2.63 -0.49 0.21 -1.77 -0.85 -1.19 -0.84 117.35 109.79 1gx3 s TYR 177 Ca -0.29 0.28 0.08 0.00 -0.52 0.00 0.00 57.07 56.61 1gx3 s TYR 177 Cb 0.07 0.57 -0.04 0.00 0.38 0.00 0.00 41.96 42.93 1gx3 s TYR 177 CO 0.42 -0.83 0.06 0.95 -1.52 0.00 0.00 175.55 174.63 1gx3 s THR 178 N -3.67 3.90 0.04 -3.49 -4.23 0.12 -0.93 115.64 107.38 1gx3 s THR 178 Ca 0.02 -1.50 -0.27 0.00 -1.18 0.00 0.00 61.69 58.76 1gx3 s THR 178 Cb -0.01 -3.03 0.09 0.00 1.34 0.00 0.00 72.50 70.89 1gx3 s THR 178 CO -0.11 -0.23 0.78 0.72 -0.54 0.00 0.00 174.62 175.24 1gx3 s PHE 179 N -1.98 -0.43 0.33 3.99 -0.12 0.10 0.54 117.98 120.41 1gx3 s PHE 179 Ca 0.30 0.31 0.09 0.00 -0.05 0.00 0.00 56.93 57.58 1gx3 s PHE 179 Cb -0.08 0.54 -0.05 0.00 -0.63 0.00 0.00 43.02 42.79 1gx3 s PHE 179 CO 0.21 -0.65 -0.02 0.95 -0.05 0.00 0.00 175.22 175.66 1gx3 s THR 180 N -3.18 2.65 -1.19 -4.49 -4.23 -1.25 0.85 115.64 104.80 1gx3 s THR 180 Ca 0.03 -2.04 0.10 0.00 -1.18 0.00 0.00 61.69 58.60 1gx3 s THR 180 Cb -0.01 -2.74 0.43 0.00 1.34 0.00 0.00 72.50 71.52 1gx3 s THR 180 CO -0.09 -0.24 1.25 0.35 -0.54 0.00 0.00 174.62 175.36 1gx3 n THR 181 N -0.90 1.13 -2.34 3.99 -2.24 -1.26 -4.56 114.28 108.10 1gx3 n THR 181 Ca -0.05 -0.70 -0.43 0.00 -2.27 0.00 0.00 64.05 60.61 1gx3 n THR 181 Cb 0.62 -0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.74 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 -1.76 4.26 0.33 -0.78 2.12 -1.26 -4.98 118.70 116.63 1gx3 s GLU 182 Ca 0.30 1.79 -0.29 0.00 0.36 0.00 0.00 54.97 57.13 1gx3 s GLU 182 Cb 0.20 -3.71 -0.11 0.00 0.26 0.00 0.00 34.13 30.77 1gx3 s GLU 182 CO 0.13 -0.64 1.42 -2.14 -0.54 0.00 0.00 175.26 173.50 1gx3 s PRO 183 N 3.07 4.23 -0.10 4.30 0.02 -1.26 -4.63 135.00 140.63 1gx3 s PRO 183 Ca 0.59 2.40 -0.00 0.00 0.02 0.00 0.00 61.00 64.01 1gx3 s PRO 183 Cb -0.26 -3.03 -0.02 0.00 0.02 0.00 0.00 34.50 31.20 1gx3 s PRO 183 CO 0.20 -0.40 -0.09 1.03 -0.33 0.00 0.00 177.00 177.42 1gx3 s ARG 184 N -1.54 3.09 0.59 5.54 1.81 -0.09 -5.02 118.95 123.33 1gx3 s ARG 184 Ca 0.53 -0.60 -0.16 0.00 -1.72 0.00 0.00 55.73 53.78 1gx3 s ARG 184 Cb -0.43 -2.65 -0.04 0.00 -0.45 0.00 0.00 34.95 31.38 1gx3 s ARG 184 CO 0.55 0.44 1.07 -1.25 -0.68 0.00 0.00 175.30 175.43 1gx3 s PRO 185 N -0.23 3.30 0.40 3.54 0.04 -1.26 -4.65 135.00 136.14 1gx3 s PRO 185 Ca 0.02 1.27 0.12 0.00 0.04 0.00 0.00 61.00 62.44 1gx3 s PRO 185 Cb -0.13 -2.03 0.92 0.00 0.04 0.00 0.00 34.50 33.31 1gx3 s PRO 185 CO 0.03 -0.83 1.93 -0.09 0.04 0.00 0.00 177.00 178.07 1gx3 h ARG 186 N 0.53 0.54 -0.40 4.56 2.43 -1.99 -1.94 114.38 118.11 1gx3 h ARG 186 Ca -0.47 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 58.59 1gx3 h ARG 186 Cb 1.23 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 1gx3 h ARG 186 CO 0.57 0.36 -0.08 0.97 -1.51 0.00 0.00 179.97 180.28 1gx3 h ILE 187 N 0.56 1.24 -0.49 1.20 6.09 -1.99 -0.60 117.51 123.51 1gx3 h ILE 187 Ca 0.36 -1.06 -0.07 0.00 -1.37 0.00 0.00 64.86 62.73 1gx3 h ILE 187 Cb 0.63 1.03 -0.02 0.00 0.47 0.00 0.00 36.82 38.93 1gx3 h ILE 187 CO -0.13 0.36 0.05 0.44 -3.07 0.00 0.00 178.15 175.80 1gx3 h ASP 188 N 0.62 0.81 -0.62 2.19 5.19 -1.74 0.37 116.42 123.25 1gx3 h ASP 188 Ca 0.12 -0.28 -0.02 0.00 -0.62 0.00 0.00 57.03 56.22 1gx3 h ASP 188 Cb 0.51 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.77 1gx3 h ASP 188 CO 0.03 0.89 0.30 -0.07 -3.12 0.00 0.00 179.24 177.27 1gx3 h LEU 189 N 0.71 0.81 -1.28 1.55 3.38 -1.24 -2.43 115.31 116.80 1gx3 h LEU 189 Ca 0.15 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1gx3 h LEU 189 Cb 0.45 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1gx3 h LEU 189 CO 0.02 0.71 0.04 -0.33 0.09 0.00 0.00 178.44 178.96 1gx3 h GLU 190 N 0.85 0.52 -0.45 1.13 5.08 -0.66 0.24 114.58 121.28 1gx3 h GLU 190 Ca 0.21 -0.10 -0.11 0.00 -1.00 0.00 0.00 59.36 58.36 1gx3 h GLU 190 Cb 0.11 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1gx3 h GLU 190 CO -0.03 0.52 -0.15 0.28 -1.00 0.00 0.00 179.01 178.64 1gx3 h VAL 191 N 0.51 1.27 -0.46 3.13 2.07 -0.77 0.85 116.25 122.84 1gx3 h VAL 191 Ca 0.11 -1.28 -0.06 0.00 0.82 0.00 0.00 66.70 66.29 1gx3 h VAL 191 Cb 0.27 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1gx3 h VAL 191 CO 0.00 0.44 0.04 1.23 0.02 0.00 0.00 177.57 179.30 1gx3 h GLY 192 N 0.74 0.85 1.31 2.17 0.00 -0.96 -2.30 103.07 104.88 1gx3 h GLY 192 Ca 0.11 -0.60 -0.06 0.00 0.00 0.00 0.00 47.33 46.78 1gx3 h GLY 192 CO 0.05 0.55 0.09 0.23 0.00 0.00 0.00 176.54 177.47 1gx3 h SER 193 N 0.65 0.80 -0.40 0.19 0.87 -0.35 -1.29 113.55 114.02 1gx3 h SER 193 Ca 0.14 -0.16 0.07 0.00 -1.23 0.00 0.00 61.79 60.60 1gx3 h SER 193 Cb 0.44 -0.21 -0.06 0.00 -0.44 0.00 0.00 62.40 62.13 1gx3 h SER 193 CO 0.02 0.81 0.05 -0.25 -0.53 0.00 0.00 176.83 176.93 1gx3 h TRP 194 N 0.81 0.08 0.01 2.24 2.91 -0.68 -1.04 115.95 120.28 1gx3 h TRP 194 Ca 0.17 0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.22 1gx3 h TRP 194 Cb 0.35 0.03 0.00 0.00 -0.51 0.00 0.00 29.16 29.03 1gx3 h TRP 194 CO 0.02 -0.02 -0.01 -0.92 -1.03 0.00 0.00 178.44 176.48 1gx3 h TYR 195 N 0.17 -0.02 -0.07 2.65 3.20 -0.74 -1.61 116.97 120.56 1gx3 h TYR 195 Ca 0.20 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 1gx3 h TYR 195 Cb 0.25 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 1gx3 h TYR 195 CO -0.22 0.10 -0.23 0.28 -1.64 0.00 0.00 178.16 176.45 1gx3 h VAL 196 N -0.13 1.20 -0.00 1.81 2.07 -1.12 -0.51 116.25 119.57 1gx3 h VAL 196 Ca -0.00 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.59 1gx3 h VAL 196 Cb 0.12 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1gx3 h VAL 196 CO 0.00 0.27 -0.62 -1.54 0.02 0.00 0.00 177.57 175.71 1gx3 n SER 197 N -4.22 0.76 0.00 0.57 3.41 -0.41 -4.44 113.62 109.28 1gx3 n SER 197 Ca -0.02 -0.58 0.00 0.00 -0.26 0.00 0.00 58.87 58.02 1gx3 n SER 197 Cb 0.32 0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 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 -1.36 0.00 -2.29 6.66 -2.24 -0.62 -4.66 114.28 109.78 1gx3 n THR 198 Ca 0.06 -0.02 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 1gx3 n THR 198 Cb 0.34 0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 68.88 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 -1.16 3.27 0.64 4.78 5.04 -0.21 -4.88 115.29 122.77 1gx3 s HIS 199 Ca 0.00 1.08 0.38 0.00 -1.54 0.00 0.00 55.06 54.98 1gx3 s HIS 199 Cb 0.00 -3.56 2.12 0.00 0.04 0.00 0.00 32.58 31.17 1gx3 s HIS 199 CO 0.00 -1.91 2.27 -1.35 -2.34 0.00 0.00 174.74 171.42 1gx3 h PRO 200 N 6.97 0.00 -0.13 2.88 0.11 -1.96 -0.33 132.00 139.54 1gx3 h PRO 200 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1gx3 h PRO 200 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1gx3 h PRO 200 CO 0.85 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.05 1gx3 n GLY 201 N -1.19 0.51 3.73 -0.55 0.00 -1.26 -4.64 105.19 101.78 1gx3 n GLY 201 Ca -0.02 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.77 7.15 0.43 1.61 0.15 -0.14 -4.90 113.70 116.24 1gx3 s SER 202 Ca 0.34 2.08 0.25 0.00 0.70 0.00 0.00 55.95 59.33 1gx3 s SER 202 Cb 0.20 -2.59 1.28 0.00 -1.71 0.00 0.00 66.02 63.20 1gx3 s SER 202 CO 0.30 -0.35 1.71 -0.74 1.20 0.00 0.00 173.24 175.36 1gx3 h HIS 203 N 5.84 0.53 -0.03 3.44 2.76 -1.89 0.13 115.15 125.92 1gx3 h HIS 203 Ca -0.43 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 1gx3 h HIS 203 Cb 1.21 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 30.03 1gx3 h HIS 203 CO 0.64 -0.05 0.00 1.19 -1.30 0.00 0.00 177.93 178.41 1gx3 n PHE 204 N -4.59 0.04 -0.04 5.26 3.01 -1.26 -3.26 117.46 116.61 1gx3 n PHE 204 Ca 0.30 -0.02 -0.02 0.00 1.01 0.00 0.00 57.45 58.72 1gx3 n PHE 204 Cb 1.15 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 40.53 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 -0.40 0.53 0.76 -4.37 0.31 0.39 -3.41 118.33 112.14 1gx3 n VAL 205 Ca 0.19 -0.41 0.12 0.00 -0.01 0.00 0.00 64.34 64.23 1gx3 n VAL 205 Cb 0.20 -0.44 0.17 0.00 -0.91 0.00 0.00 33.84 32.87 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 -2.26 0.16 -3.88 2.52 -2.24 -0.82 -4.64 114.28 103.11 1gx3 n THR 206 Ca -0.13 -0.14 -0.09 0.00 -2.27 0.00 0.00 64.05 61.41 1gx3 n THR 206 Cb 0.70 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 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 -3.36 0.48 -0.16 3.38 0.00 -1.20 -4.80 107.32 101.66 1gx3 s GLY 207 Ca 0.08 -0.80 -0.06 0.00 0.00 0.00 0.00 44.72 43.93 1gx3 s GLY 207 CO 0.73 -0.40 0.04 -2.27 0.00 0.00 0.00 173.10 171.20 1gx3 s LEU 208 N -3.07 3.73 -0.10 0.66 2.96 -1.26 -4.73 118.68 116.87 1gx3 s LEU 208 Ca 0.18 0.08 -0.02 0.00 -0.22 0.00 0.00 54.13 54.15 1gx3 s LEU 208 Cb -0.04 -1.92 0.04 0.00 0.50 0.00 0.00 46.19 44.76 1gx3 s LEU 208 CO 0.12 0.21 0.01 -0.89 -1.32 0.00 0.00 176.35 174.49 1gx3 s THR 209 N 0.12 0.38 0.02 3.68 2.01 -1.26 -1.50 115.64 119.08 1gx3 s THR 209 Ca 0.04 -0.02 0.02 0.00 0.31 0.00 0.00 61.69 62.04 1gx3 s THR 209 Cb -0.12 -0.63 -0.01 0.00 0.01 0.00 0.00 72.50 71.75 1gx3 s THR 209 CO 0.01 0.14 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.32 1gx3 s VAL 210 N 1.96 0.52 0.04 3.82 1.01 0.13 -2.84 120.40 125.05 1gx3 s VAL 210 Ca 0.04 -0.59 -0.20 0.00 0.00 0.00 0.00 61.98 61.22 1gx3 s VAL 210 Cb -0.13 -0.50 0.04 0.00 0.00 0.00 0.00 36.38 35.79 1gx3 s VAL 210 CO -0.06 -0.06 0.47 0.00 0.00 0.00 0.00 175.10 175.45 1gx3 s ALA 211 N -0.62 -1.17 -0.02 5.51 0.00 0.04 -0.30 121.76 125.19 1gx3 s ALA 211 Ca -0.02 0.47 -0.18 0.00 0.00 0.00 0.00 51.96 52.23 1gx3 s ALA 211 Cb -0.05 0.35 0.03 0.00 0.00 0.00 0.00 23.12 23.45 1gx3 s ALA 211 CO 0.00 -0.47 0.39 0.54 0.00 0.00 0.00 175.76 176.22 1gx3 s VAL 212 N -2.40 0.05 -0.17 0.00 0.11 -0.96 -0.54 120.40 116.49 1gx3 s VAL 212 Ca -0.06 -0.37 0.00 0.00 -2.93 0.00 0.00 61.98 58.62 1gx3 s VAL 212 Cb -0.01 -0.70 0.03 0.00 -1.53 0.00 0.00 36.38 34.17 1gx3 s VAL 212 CO -0.02 -0.21 -0.11 -0.69 -3.33 0.00 0.00 175.10 170.75 1gx3 s VAL 213 N -1.33 1.48 0.55 2.04 1.01 -1.20 -1.52 120.40 121.43 1gx3 s VAL 213 Ca -0.13 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1gx3 s VAL 213 Cb -0.04 -1.50 0.05 0.00 0.00 0.00 0.00 36.38 34.89 1gx3 s VAL 213 CO 0.05 0.30 0.76 0.42 0.00 0.00 0.00 175.10 176.63 1gx3 s THR 214 N 1.49 2.58 0.40 3.92 -4.23 0.21 -3.16 115.64 116.86 1gx3 s THR 214 Ca 0.02 -0.80 0.18 0.00 -1.18 0.00 0.00 61.69 59.91 1gx3 s THR 214 Cb -0.14 -2.78 0.39 0.00 1.34 0.00 0.00 72.50 71.30 1gx3 s THR 214 CO -0.09 0.00 1.80 0.44 -0.54 0.00 0.00 174.62 176.23 1gx3 h ASP 215 N 0.13 0.44 0.00 3.99 3.32 -1.98 -2.84 116.42 119.49 1gx3 h ASP 215 Ca -0.38 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.73 1gx3 h ASP 215 Cb 1.29 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1gx3 h ASP 215 CO 0.46 0.13 -1.86 0.47 -1.72 0.00 0.00 179.24 176.72 1gx3 n ASP 216 N -4.58 0.46 -3.75 6.45 8.00 -1.26 -4.98 116.55 116.89 1gx3 n ASP 216 Ca 0.23 -0.05 -0.12 0.00 0.71 0.00 0.00 54.79 55.56 1gx3 n ASP 216 Cb 0.81 1.86 -0.07 0.00 -0.02 0.00 0.00 41.12 43.70 1gx3 n ASP 216 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gx3 s ALA 217 N -3.36 -0.69 -0.23 2.24 0.00 -1.07 -4.40 121.76 114.24 1gx3 s ALA 217 Ca -0.07 0.01 -0.07 0.00 0.00 0.00 0.00 51.96 51.84 1gx3 s ALA 217 Cb 0.13 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.55 1gx3 s ALA 217 CO 0.83 -0.42 0.05 1.03 0.00 0.00 0.00 175.76 177.25 1gx3 s ARG 218 N -2.56 3.66 -0.24 0.00 0.52 -0.32 -0.62 118.95 119.39 1gx3 s ARG 218 Ca -0.05 -0.48 -0.08 0.00 -0.52 0.00 0.00 55.73 54.60 1gx3 s ARG 218 Cb -0.01 -3.25 -0.03 0.00 0.52 0.00 0.00 34.95 32.18 1gx3 s ARG 218 CO -0.03 -0.11 0.08 0.71 0.02 0.00 0.00 175.30 175.96 1gx3 s TYR 219 N 1.38 3.12 -0.17 -0.53 1.51 -0.58 -0.20 117.35 121.88 1gx3 s TYR 219 Ca 0.05 -0.29 -0.00 0.00 -1.01 0.00 0.00 57.07 55.82 1gx3 s TYR 219 Cb -0.15 -2.22 0.04 0.00 -0.11 0.00 0.00 41.96 39.53 1gx3 s TYR 219 CO 0.03 -0.25 -0.06 1.21 -1.11 0.00 0.00 175.55 175.36 1gx3 s ASN 220 N 1.40 2.97 -0.15 2.29 2.47 0.61 -2.26 114.94 122.27 1gx3 s ASN 220 Ca 0.05 -0.72 -0.04 0.00 0.42 0.00 0.00 52.86 52.57 1gx3 s ASN 220 Cb -0.15 -0.98 -0.03 0.00 -1.45 0.00 0.00 41.25 38.64 1gx3 s ASN 220 CO 0.04 -0.18 -0.01 -0.22 -3.72 0.00 0.00 177.10 173.01 1gx3 s LEU 221 N 1.58 3.43 -0.23 3.21 2.96 0.59 -0.07 118.68 130.14 1gx3 s LEU 221 Ca 0.00 -0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 53.86 1gx3 s LEU 221 Cb -0.16 -1.83 0.07 0.00 0.50 0.00 0.00 46.19 44.78 1gx3 s LEU 221 CO -0.08 0.21 0.04 -0.60 -1.32 0.00 0.00 176.35 174.61 1gx3 s ARG 222 N 0.12 0.78 7.41 1.98 6.06 -0.73 -0.69 118.95 133.88 1gx3 s ARG 222 Ca 0.01 -0.66 0.00 0.00 -2.50 0.00 0.00 55.73 52.58 1gx3 s ARG 222 Cb -0.13 -2.11 0.00 0.00 0.06 0.00 0.00 34.95 32.77 1gx3 s ARG 222 CO 0.02 -0.74 0.00 0.41 -2.50 0.00 0.00 175.30 172.50 1gx3 n GLY 223 N 4.96 2.69 0.02 8.12 0.00 -0.57 -2.31 105.19 118.11 1gx3 n GLY 223 Ca -0.07 -0.27 0.14 0.00 0.00 0.00 0.00 46.02 45.82 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 13.45 0.37 -3.57 1.61 1.85 -1.16 -4.85 116.66 124.37 1gx3 n ARG 224 Ca 0.00 -0.04 -0.40 0.00 -1.00 0.00 0.00 57.85 56.41 1gx3 n ARG 224 Cb 0.00 -1.50 -0.11 0.00 -1.05 0.00 0.00 32.46 29.80 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 -2.66 5.87 -0.15 2.89 0.01 -0.98 -0.83 114.94 119.10 1gx3 s ASN 225 Ca 0.25 -0.59 -0.05 0.00 -0.71 0.00 0.00 52.86 51.76 1gx3 s ASN 225 Cb 0.20 -2.08 -0.03 0.00 0.41 0.00 0.00 41.25 39.74 1gx3 s ASN 225 CO 0.49 -0.27 0.01 -0.22 -1.51 0.00 0.00 177.10 175.60 1gx3 s LEU 226 N 1.66 3.56 -0.11 0.60 2.96 0.58 -1.78 118.68 126.16 1gx3 s LEU 226 Ca 0.05 0.03 0.02 0.00 -0.22 0.00 0.00 54.13 54.01 1gx3 s LEU 226 Cb -0.18 -1.86 -0.01 0.00 0.50 0.00 0.00 46.19 44.64 1gx3 s LEU 226 CO 0.09 0.23 -0.18 0.00 -1.32 0.00 0.00 176.35 175.17 1gx3 s ALA 227 N 0.02 2.44 -0.24 5.97 0.00 0.89 -0.94 121.76 129.91 1gx3 s ALA 227 Ca 0.03 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 51.08 1gx3 s ALA 227 Cb -0.13 -1.02 0.05 0.00 0.00 0.00 0.00 23.12 22.02 1gx3 s ALA 227 CO 0.02 0.30 -0.14 0.08 0.00 0.00 0.00 175.76 176.02 1gx3 s VAL 228 N 0.22 2.16 -0.33 0.00 1.01 0.55 -0.29 120.40 123.73 1gx3 s VAL 228 Ca -0.11 -1.41 -0.11 0.00 0.00 0.00 0.00 61.98 60.35 1gx3 s VAL 228 Cb -0.16 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.05 1gx3 s VAL 228 CO 0.06 0.15 0.19 -1.00 0.00 0.00 0.00 175.10 174.50 1gx3 s HIS 229 N 1.17 3.20 0.17 5.22 3.76 0.72 -0.97 115.29 128.56 1gx3 s HIS 229 Ca -0.04 -0.45 0.06 0.00 -0.15 0.00 0.00 55.06 54.48 1gx3 s HIS 229 Cb -0.18 -2.41 -0.04 0.00 1.11 0.00 0.00 32.58 31.06 1gx3 s HIS 229 CO -0.07 -0.43 -0.13 1.03 -0.85 0.00 0.00 174.74 174.29 1gx3 s ARG 230 N 1.65 1.19 0.11 1.40 0.52 -0.88 -1.18 118.95 121.77 1gx3 s ARG 230 Ca 0.05 -1.50 -0.35 0.00 -0.52 0.00 0.00 55.73 53.41 1gx3 s ARG 230 Cb -0.17 -0.91 -0.15 0.00 0.52 0.00 0.00 34.95 34.24 1gx3 s ARG 230 CO 0.08 0.14 1.47 -1.13 0.02 0.00 0.00 175.30 175.88 1gx3 n SER 231 N -0.21 2.37 -1.69 0.23 3.41 -1.26 -1.30 113.62 115.18 1gx3 n SER 231 Ca -0.10 1.10 -0.17 0.00 -0.26 0.00 0.00 58.87 59.44 1gx3 n SER 231 Cb 0.60 -1.30 -0.06 0.00 -0.26 0.00 0.00 64.21 63.19 1gx3 n SER 231 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gx3 n GLY 232 N 3.01 1.18 3.15 5.00 0.00 -1.26 -4.92 105.19 111.36 1gx3 n GLY 232 Ca 0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.25 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 -2.53 -3.22 -0.23 4.61 0.00 -0.42 -5.14 121.76 114.82 1gx3 s ALA 233 Ca 0.00 1.46 -0.09 0.00 0.00 0.00 0.00 51.96 53.33 1gx3 s ALA 233 Cb 0.00 -2.50 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 1gx3 s ALA 233 CO 0.00 -1.59 0.12 0.99 0.00 0.00 0.00 175.76 175.28 1gx3 s THR 234 N 2.92 4.98 -0.09 0.00 2.01 -1.26 -2.07 115.64 122.14 1gx3 s THR 234 Ca 0.10 0.05 -0.02 0.00 0.31 0.00 0.00 61.69 62.12 1gx3 s THR 234 Cb -0.10 -3.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 1gx3 s THR 234 CO -0.17 0.36 0.02 -1.61 -0.69 0.00 0.00 174.62 172.53 1gx3 s GLU 235 N 1.08 3.02 -0.25 4.92 2.02 -0.15 -4.92 118.70 124.43 1gx3 s GLU 235 Ca 0.06 -0.39 0.01 0.00 0.02 0.00 0.00 54.97 54.67 1gx3 s GLU 235 Cb -0.14 -2.83 0.04 0.00 0.10 0.00 0.00 34.13 31.31 1gx3 s GLU 235 CO 0.04 0.71 -0.09 -1.01 0.02 0.00 0.00 175.26 174.93 1gx3 s HIS 236 N -0.91 3.15 -0.17 1.61 3.76 -1.26 -0.33 115.29 121.14 1gx3 s HIS 236 Ca 0.14 -1.94 -0.06 0.00 -0.15 0.00 0.00 55.06 53.04 1gx3 s HIS 236 Cb -0.11 -2.00 -0.04 0.00 1.11 0.00 0.00 32.58 31.54 1gx3 s HIS 236 CO 0.03 -0.82 0.04 0.42 -0.85 0.00 0.00 174.74 173.56 1gx3 s ILE 237 N 1.22 4.57 -0.21 0.60 1.01 -0.12 -4.97 121.20 123.29 1gx3 s ILE 237 Ca -0.04 -0.12 -0.03 0.00 0.00 0.00 0.00 60.65 60.47 1gx3 s ILE 237 Cb -0.18 -3.04 -0.00 0.00 0.01 0.00 0.00 42.46 39.25 1gx3 s ILE 237 CO -0.05 0.47 -0.08 -0.60 0.00 0.00 0.00 174.94 174.69 1gx3 s ARG 238 N 0.32 3.30 0.21 2.79 3.52 -1.26 -0.31 118.95 127.51 1gx3 s ARG 238 Ca 0.02 -0.67 -0.16 0.00 -0.13 0.00 0.00 55.73 54.79 1gx3 s ARG 238 Cb -0.13 -2.92 -0.08 0.00 -1.56 0.00 0.00 34.95 30.27 1gx3 s ARG 238 CO 0.01 -0.20 0.64 -0.06 -0.81 0.00 0.00 175.30 174.88 1gx3 s PHE 239 N 1.44 3.58 -0.04 5.12 0.40 -0.01 -5.00 117.98 123.47 1gx3 s PHE 239 Ca 0.06 1.19 -0.06 0.00 -0.60 0.00 0.00 56.93 57.52 1gx3 s PHE 239 Cb -0.14 -2.48 -0.03 0.00 0.51 0.00 0.00 43.02 40.88 1gx3 s PHE 239 CO -0.05 0.34 0.34 -0.44 0.70 0.00 0.00 175.22 176.10 1gx3 h ASP 240 N 3.25 -0.18 -1.70 1.36 5.19 -1.99 -3.46 116.42 118.88 1gx3 h ASP 240 Ca -0.48 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1gx3 h ASP 240 Cb 1.19 0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.75 1gx3 h ASP 240 CO 0.66 0.10 0.00 -1.54 -3.12 0.00 0.00 179.24 175.34 1gx3 n SER 241 N -3.84 0.00 -0.05 6.45 3.41 -1.26 -5.05 113.62 113.29 1gx3 n SER 241 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 1gx3 n SER 241 Cb 0.08 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.90 1gx3 n SER 241 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gx3 n ALA 242 N -3.00 2.12 0.02 7.33 0.00 -1.26 -4.49 120.51 121.22 1gx3 n ALA 242 Ca 0.00 -0.77 0.07 0.00 0.00 0.00 0.00 53.44 52.74 1gx3 n ALA 242 Cb 0.00 -0.35 0.49 0.00 0.00 0.00 0.00 19.45 19.59 1gx3 n ALA 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gx3 h ALA 243 N 1.22 1.87 -0.11 0.00 0.00 -1.96 -1.70 119.26 118.58 1gx3 h ALA 243 Ca -0.23 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 1gx3 h ALA 243 Cb 1.44 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1gx3 h ALA 243 CO 0.01 0.07 -0.69 1.96 0.00 0.00 0.00 179.25 180.61 1gx3 h GLN 244 N 0.41 0.49 -0.11 0.00 7.50 -1.99 -2.23 115.11 119.18 1gx3 h GLN 244 Ca 0.17 -0.37 -0.01 0.00 0.50 0.00 0.00 58.65 58.93 1gx3 h GLN 244 Cb 0.16 0.07 -0.00 0.00 0.05 0.00 0.00 27.48 27.75 1gx3 h GLN 244 CO -0.04 1.00 0.02 0.28 -1.50 0.00 0.00 178.83 178.59 1gx3 h VAL 245 N 0.34 1.21 -0.73 -0.54 2.07 -1.60 0.18 116.25 117.19 1gx3 h VAL 245 Ca -0.02 -0.65 0.11 0.00 0.82 0.00 0.00 66.70 66.95 1gx3 h VAL 245 Cb 1.26 1.44 -0.08 0.00 -1.52 0.00 0.00 31.29 32.39 1gx3 h VAL 245 CO 0.12 0.19 0.34 -0.07 0.02 0.00 0.00 177.57 178.17 1gx3 h LEU 246 N -0.04 0.41 -0.11 2.57 4.07 -1.29 1.33 115.31 122.25 1gx3 h LEU 246 Ca 0.03 0.07 0.03 0.00 0.08 0.00 0.00 57.88 58.10 1gx3 h LEU 246 Cb 0.27 0.01 -0.04 0.00 1.08 0.00 0.00 40.66 41.99 1gx3 h LEU 246 CO 0.00 0.22 -0.11 -0.78 -1.08 0.00 0.00 178.44 176.69 1gx3 h ASP 247 N 0.56 -0.35 -0.77 -0.43 1.82 -0.67 0.63 116.42 117.21 1gx3 h ASP 247 Ca 0.37 0.07 -0.02 0.00 -0.39 0.00 0.00 57.03 57.06 1gx3 h ASP 247 Cb 0.45 0.17 -0.04 0.00 0.68 0.00 0.00 39.33 40.59 1gx3 h ASP 247 CO -0.31 -0.15 0.41 0.00 -1.61 0.00 0.00 179.24 177.58 1gx3 h ALA 248 N 0.92 0.98 -0.11 -0.78 0.00 0.42 1.22 119.26 121.92 1gx3 h ALA 248 Ca 0.08 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1gx3 h ALA 248 Cb 0.25 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1gx3 h ALA 248 CO -0.19 0.51 -0.03 0.82 0.00 0.00 0.00 179.25 180.36 1gx3 h ILE 249 N 1.06 0.88 -0.07 0.00 2.04 0.30 0.04 117.51 121.77 1gx3 h ILE 249 Ca 0.27 0.00 -0.23 0.00 1.00 0.00 0.00 64.86 65.89 1gx3 h ILE 249 Cb 0.05 0.88 0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1gx3 h ILE 249 CO -0.04 0.00 -0.89 0.58 0.00 0.00 0.00 178.15 177.80 1gx3 h VAL 250 N -0.01 1.31 0.00 1.67 2.07 0.63 -1.68 116.25 120.25 1gx3 h VAL 250 Ca 0.05 -2.17 -0.13 0.00 0.82 0.00 0.00 66.70 65.28 1gx3 h VAL 250 Cb 0.09 2.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1gx3 h VAL 250 CO -0.11 0.67 -1.20 0.59 0.02 0.00 0.00 177.57 177.53 1gx3 n ASN 251 N -3.86 1.89 -0.15 0.57 5.03 0.42 -3.05 115.26 116.11 1gx3 n ASN 251 Ca -0.08 0.44 -0.11 0.00 0.87 0.00 0.00 54.58 55.69 1gx3 n ASN 251 Cb 0.80 -0.83 -0.01 0.00 -1.02 0.00 0.00 39.78 38.72 1gx3 n ASN 251 CO 0.00 0.00 0.00 0.03 -1.83 0.00 0.00 177.26 175.46 1gx3 h ARG 252 N -1.00 0.90 -0.01 3.52 3.08 -1.16 -3.29 114.38 116.42 1gx3 h ARG 252 Ca -0.19 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.48 1gx3 h ARG 252 Cb 1.02 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1gx3 h ARG 252 CO -0.12 1.02 -0.48 1.19 -1.07 0.00 0.00 179.97 180.52 1gx3 n PHE 253 N -4.21 0.00 -3.55 3.04 3.01 -0.26 -4.99 117.46 110.50 1gx3 n PHE 253 Ca -0.01 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.23 1gx3 n PHE 253 Cb 0.42 -0.02 0.08 0.00 -0.01 0.00 0.00 39.48 39.95 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 1.42 -0.49 3.61 1.37 0.00 -1.03 -4.67 105.19 105.39 1gx3 n GLY 254 Ca 0.09 0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.31 5.10 -0.62 -0.61 1.01 -0.66 -4.95 121.20 117.15 1gx3 s ILE 255 Ca 0.53 0.09 -0.28 0.00 0.00 0.00 0.00 60.65 60.99 1gx3 s ILE 255 Cb -0.23 -3.37 0.02 0.00 0.01 0.00 0.00 42.46 38.88 1gx3 s ILE 255 CO 0.71 0.35 1.33 -0.62 0.00 0.00 0.00 174.94 176.70 1gx3 s ASP 256 N 1.13 6.20 0.00 3.58 2.15 -1.22 -4.17 116.67 124.33 1gx3 s ASP 256 Ca 0.06 0.02 0.09 0.00 0.43 0.00 0.00 52.55 53.15 1gx3 s ASP 256 Cb -0.14 -2.55 0.53 0.00 -0.30 0.00 0.00 42.92 40.46 1gx3 s ASP 256 CO 0.05 -1.71 1.20 0.18 -0.17 0.00 0.00 175.17 174.71 1gx3 n LEU 257 N 9.32 0.00 0.03 -1.34 4.77 -1.26 -3.93 117.00 124.60 1gx3 n LEU 257 Ca 0.09 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 1gx3 n LEU 257 Cb 0.49 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.50 1gx3 n LEU 257 CO 0.71 0.00 0.73 1.23 -1.33 0.00 0.00 177.39 178.73 1gx3 h GLY 258 N 4.70 -0.06 -0.86 -0.72 0.00 -1.96 -2.62 103.07 101.55 1gx3 h GLY 258 Ca 0.00 0.02 0.41 0.00 0.00 0.00 0.00 47.33 47.76 1gx3 h GLY 258 CO 0.00 -0.02 1.01 -0.55 0.00 0.00 0.00 176.54 176.98 1gx3 h ASP 259 N -0.32 0.03 -0.27 0.19 3.32 -1.92 1.89 116.42 119.34 1gx3 h ASP 259 Ca -0.01 0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1gx3 h ASP 259 Cb 0.29 0.01 -0.08 0.00 0.22 0.00 0.00 39.33 39.76 1gx3 h ASP 259 CO 0.01 -0.00 0.17 0.18 -1.72 0.00 0.00 179.24 177.88 1gx3 n LEU 260 N -4.14 3.90 -4.68 1.55 4.77 -0.99 -4.89 117.00 112.52 1gx3 n LEU 260 Ca 0.31 -2.01 -0.42 0.00 -0.03 0.00 0.00 56.01 53.86 1gx3 n LEU 260 Cb 1.47 -0.59 -0.03 0.00 -2.33 0.00 0.00 43.42 41.94 1gx3 n LEU 260 CO 0.41 0.63 1.27 0.00 -1.33 0.00 0.00 177.39 178.36 1gx3 s ALA 261 N -0.98 3.64 0.00 -1.18 0.00 0.64 -2.59 121.76 121.29 1gx3 s ALA 261 Ca 0.16 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1gx3 s ALA 261 Cb 0.13 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1gx3 s ALA 261 CO 0.03 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.10 1gx3 n GLY 262 N 3.91 2.90 3.66 0.00 0.00 -1.26 -5.06 105.19 109.34 1gx3 n GLY 262 Ca 0.15 -0.82 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 1gx3 n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gx3 n ARG 263 N 0.00 1.53 -2.56 1.61 1.74 -1.07 -4.87 116.66 113.04 1gx3 n ARG 263 Ca 0.00 0.55 -0.43 0.00 -0.77 0.00 0.00 57.85 57.21 1gx3 n ARG 263 Cb 0.00 -2.25 0.00 0.00 -1.02 0.00 0.00 32.46 29.20 1gx3 n ARG 263 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1gx3 n ASP 264 N 0.03 5.36 -0.14 0.55 -0.08 -1.26 -4.78 116.55 116.22 1gx3 n ASP 264 Ca 0.09 -3.15 -0.04 0.00 -1.51 0.00 0.00 54.79 50.18 1gx3 n ASP 264 Cb 0.41 -1.45 0.02 0.00 2.34 0.00 0.00 41.12 42.44 1gx3 n ASP 264 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1gx3 h VAL 265 N 3.79 0.48 -0.38 5.18 2.07 -1.89 0.55 116.25 126.06 1gx3 h VAL 265 Ca 0.34 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.90 1gx3 h VAL 265 Cb 0.66 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 1gx3 h VAL 265 CO 1.51 0.00 0.18 -0.61 0.02 0.00 0.00 177.57 178.67 1gx3 h GLN 266 N -0.05 0.35 -0.67 1.57 4.15 -1.95 1.49 115.11 120.00 1gx3 h GLN 266 Ca 0.22 -0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.57 1gx3 h GLN 266 Cb 0.38 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.96 1gx3 h GLN 266 CO -0.49 0.23 0.23 0.00 -1.93 0.00 0.00 178.83 176.87 1gx3 h ALA 267 N 1.21 1.14 0.22 3.38 0.00 -1.69 0.74 119.26 124.26 1gx3 h ALA 267 Ca 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1gx3 h ALA 267 Cb 0.09 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1gx3 h ALA 267 CO -0.12 0.60 -0.11 -0.09 0.00 0.00 0.00 179.25 179.53 1gx3 h ARG 268 N 0.98 -0.29 -0.85 0.00 9.65 0.25 -1.18 114.38 122.95 1gx3 h ARG 268 Ca 0.22 0.02 0.09 0.00 -1.10 0.00 0.00 59.98 59.21 1gx3 h ARG 268 Cb 0.25 0.06 -0.06 0.00 -1.39 0.00 0.00 29.97 28.84 1gx3 h ARG 268 CO -0.01 0.02 0.55 0.28 2.80 0.00 0.00 179.97 183.62 1gx3 h VAL 269 N -0.61 0.99 -0.80 0.20 2.07 0.22 0.25 116.25 118.56 1gx3 h VAL 269 Ca -0.03 -0.29 0.07 0.00 0.82 0.00 0.00 66.70 67.27 1gx3 h VAL 269 Cb 0.44 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.21 1gx3 h VAL 269 CO 0.05 0.16 0.52 0.00 0.02 0.00 0.00 177.57 178.32 1gx3 h ALA 270 N 1.56 1.66 0.00 1.67 0.00 0.94 -1.25 119.26 123.84 1gx3 h ALA 270 Ca 0.39 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1gx3 h ALA 270 Cb 0.37 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1gx3 h ALA 270 CO -0.15 0.20 -0.06 0.93 0.00 0.00 0.00 179.25 180.17 1gx3 h GLU 271 N 0.83 0.00 -0.43 0.00 5.08 0.73 -3.34 114.58 117.45 1gx3 h GLU 271 Ca 0.35 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.43 1gx3 h GLU 271 Cb 0.29 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.36 1gx3 h GLU 271 CO -0.13 0.06 -0.29 1.33 -1.00 0.00 0.00 179.01 178.98 1gx3 n VAL 272 N -3.33 2.57 0.07 3.13 0.24 -0.47 -4.82 118.33 115.71 1gx3 n VAL 272 Ca -0.01 -3.27 -0.12 0.00 -2.04 0.00 0.00 64.34 58.90 1gx3 n VAL 272 Cb 0.22 -0.59 -0.07 0.00 -1.47 0.00 0.00 33.84 31.94 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 1.39 -0.14 -3.78 1.34 3.38 -1.69 -3.05 115.31 112.76 1gx3 h LEU 273 Ca 0.25 0.02 -0.35 0.00 0.09 0.00 0.00 57.88 57.89 1gx3 h LEU 273 Cb 1.42 0.05 -0.21 0.00 0.09 0.00 0.00 40.66 42.02 1gx3 h LEU 273 CO 0.50 -0.09 0.38 0.47 0.09 0.00 0.00 178.44 179.80 1gx3 n ASP 274 N -5.16 3.89 -0.77 -0.43 8.00 -1.26 -2.97 116.55 117.84 1gx3 n ASP 274 Ca -0.07 -3.49 0.10 0.00 0.71 0.00 0.00 54.79 52.03 1gx3 n ASP 274 Cb 0.09 -0.76 0.08 0.00 -0.02 0.00 0.00 41.12 40.51 1gx3 n ASP 274 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16