#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxb s ASN 2 N 0.00 5.13 0.13 6.12 3.84 -1.26 -5.00 114.94 123.91 1gxb s ASN 2 Ca 0.00 -1.01 -0.26 0.00 0.21 0.00 0.00 52.86 51.80 1gxb s ASN 2 Cb 0.00 -1.84 -0.03 0.00 -0.55 0.00 0.00 41.25 38.83 1gxb s ASN 2 CO 0.00 -0.26 1.61 0.40 -2.79 0.00 0.00 177.10 176.06 1gxb h ILE 3 N 6.12 0.29 -0.96 -5.21 1.08 -2.02 -2.04 117.51 114.76 1gxb h ILE 3 Ca -0.26 0.00 0.18 0.00 -0.39 0.00 0.00 64.86 64.39 1gxb h ILE 3 Cb 1.09 0.29 -0.09 0.00 -3.07 0.00 0.00 36.82 35.05 1gxb h ILE 3 CO 0.59 0.00 0.61 0.78 -0.69 0.00 0.00 178.15 179.44 1gxb h ASN 4 N -0.42 0.67 0.65 1.72 2.35 -1.98 0.51 115.58 119.09 1gxb h ASN 4 Ca 0.09 0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 1gxb h ASN 4 Cb 0.55 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1gxb h ASN 4 CO -0.33 0.27 -0.34 -0.33 -1.65 0.00 0.00 177.43 175.05 1gxb h GLU 5 N 0.67 -0.89 -0.16 0.81 5.08 -1.81 -1.99 114.58 116.29 1gxb h GLU 5 Ca 0.52 0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.99 1gxb h GLU 5 Cb 0.92 0.20 -0.07 0.00 0.50 0.00 0.00 28.75 30.31 1gxb h GLU 5 CO -0.28 -0.59 -0.33 0.82 -1.00 0.00 0.00 179.01 177.62 1gxb h ILE 6 N -0.92 0.26 -0.44 3.13 1.08 -0.48 0.57 117.51 120.71 1gxb h ILE 6 Ca -0.09 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.48 1gxb h ILE 6 Cb 0.72 0.26 -0.09 0.00 -3.07 0.00 0.00 36.82 34.64 1gxb h ILE 6 CO 0.12 0.00 -0.22 0.25 -0.69 0.00 0.00 178.15 177.62 1gxb h LEU 7 N -0.39 -0.75 -0.80 1.44 5.85 -0.03 0.29 115.31 120.92 1gxb h LEU 7 Ca 0.10 0.17 0.01 0.00 0.84 0.00 0.00 57.88 59.00 1gxb h LEU 7 Cb 0.55 0.40 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 1gxb h LEU 7 CO -0.38 -0.24 0.53 0.11 -0.34 0.00 0.00 178.44 178.11 1gxb h LYS 8 N -0.13 1.04 -0.42 1.25 1.57 -0.72 0.12 116.57 119.27 1gxb h LYS 8 Ca 0.21 -0.06 0.04 0.00 -1.87 0.00 0.00 60.65 58.97 1gxb h LYS 8 Cb 0.46 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 1gxb h LYS 8 CO -0.52 0.69 0.19 -0.22 -0.57 0.00 0.00 179.45 179.01 1gxb h LYS 9 N 1.07 0.38 -0.42 3.15 3.64 0.14 -0.66 116.57 123.86 1gxb h LYS 9 Ca 0.30 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.61 1gxb h LYS 9 Cb -0.10 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 1gxb h LYS 9 CO -0.07 0.25 0.08 -0.07 -2.27 0.00 0.00 179.45 177.36 1gxb h LEU 10 N 0.39 0.65 -1.03 5.20 3.38 0.36 -1.95 115.31 122.30 1gxb h LEU 10 Ca 0.19 -0.25 0.07 0.00 0.09 0.00 0.00 57.88 57.98 1gxb h LEU 10 Cb 0.12 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.64 1gxb h LEU 10 CO -0.15 0.73 0.64 0.40 0.09 0.00 0.00 178.44 180.15 1gxb h ILE 11 N 0.54 1.07 0.00 1.22 1.08 -0.36 0.68 117.51 121.75 1gxb h ILE 11 Ca 0.13 -0.39 0.00 0.00 -0.39 0.00 0.00 64.86 64.21 1gxb h ILE 11 Cb 0.35 -0.17 0.00 0.00 -3.07 0.00 0.00 36.82 33.93 1gxb h ILE 11 CO 0.01 0.21 0.00 0.59 -0.69 0.00 0.00 178.15 178.26 1gxb n ASN 12 N -4.51 0.00 -3.59 1.72 3.02 -0.30 -4.86 115.26 106.75 1gxb n ASN 12 Ca 0.15 -1.34 -0.22 0.00 -0.03 0.00 0.00 54.58 53.15 1gxb n ASN 12 Cb 0.20 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.44 1gxb n ASN 12 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1gxb n LYS 13 N -0.61 -6.58 -3.90 3.52 5.02 0.24 -5.00 118.16 110.84 1gxb n LYS 13 Ca 0.04 0.77 -0.35 0.00 -2.02 0.00 0.00 58.31 56.75 1gxb n LYS 13 Cb 0.02 -5.70 -0.14 0.00 -0.02 0.00 0.00 35.03 29.19 1gxb n LYS 13 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1gxb s SER 14 N -3.92 4.53 0.60 4.39 0.01 -0.77 -5.02 113.70 113.51 1gxb s SER 14 Ca 0.26 -0.33 -0.19 0.00 1.31 0.00 0.00 55.95 56.99 1gxb s SER 14 Cb -0.12 -1.79 -0.03 0.00 0.21 0.00 0.00 66.02 64.30 1gxb s SER 14 CO 0.76 -0.01 1.27 -1.81 0.41 0.00 0.00 173.24 173.85 1gxb s ASP 15 N 1.45 5.02 0.65 2.44 1.01 -1.26 -4.39 116.67 121.58 1gxb s ASP 15 Ca 0.05 2.55 -0.01 0.00 0.71 0.00 0.00 52.55 55.86 1gxb s ASP 15 Cb -0.14 -2.61 0.08 0.00 1.01 0.00 0.00 42.92 41.25 1gxb s ASP 15 CO -0.01 -1.72 0.91 -0.76 0.21 0.00 0.00 175.17 173.80 1gxb s LEU 16 N -4.03 3.07 0.09 1.23 1.43 -1.26 -5.08 118.68 114.13 1gxb s LEU 16 Ca 0.78 -0.11 -0.03 0.00 -1.03 0.00 0.00 54.13 53.73 1gxb s LEU 16 Cb -0.35 -2.49 -0.05 0.00 0.03 0.00 0.00 46.19 43.33 1gxb s LEU 16 CO 0.39 -1.55 0.29 -1.61 0.23 0.00 0.00 176.35 174.10 1gxb s GLU 17 N -5.01 3.54 0.36 1.70 0.41 -1.26 -4.64 118.70 113.80 1gxb s GLU 17 Ca 0.62 -0.23 0.17 0.00 -0.41 0.00 0.00 54.97 55.12 1gxb s GLU 17 Cb -0.08 -2.97 1.16 0.00 -1.78 0.00 0.00 34.13 30.47 1gxb s GLU 17 CO 0.42 0.56 1.65 0.82 -0.49 0.00 0.00 175.26 178.22 1gxb h ILE 18 N 2.23 0.24 -0.07 -1.63 2.04 -1.98 0.39 117.51 118.73 1gxb h ILE 18 Ca -0.46 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.28 1gxb h ILE 18 Cb 1.17 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1gxb h ILE 18 CO 0.73 0.05 -0.07 0.78 0.00 0.00 0.00 178.15 179.63 1gxb h ASN 19 N 0.25 0.19 0.19 1.72 4.21 -1.93 -0.27 115.58 119.95 1gxb h ASN 19 Ca 0.76 -0.49 0.01 0.00 1.21 0.00 0.00 56.30 57.79 1gxb h ASN 19 Cb 1.84 -0.05 -0.04 0.00 -1.12 0.00 0.00 38.32 38.95 1gxb h ASN 19 CO -0.60 0.64 -0.47 -0.33 -1.29 0.00 0.00 177.43 175.38 1gxb h GLU 20 N -0.25 -0.72 -0.52 0.81 5.08 -0.74 -0.08 114.58 118.15 1gxb h GLU 20 Ca 0.01 0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.53 1gxb h GLU 20 Cb 0.59 0.16 -0.10 0.00 0.50 0.00 0.00 28.75 29.90 1gxb h GLU 20 CO 0.02 -0.48 -0.14 0.00 -1.00 0.00 0.00 179.01 177.41 1gxb h ALA 21 N -0.41 0.32 -0.62 3.43 0.00 -0.76 -0.41 119.26 120.81 1gxb h ALA 21 Ca -0.00 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1gxb h ALA 21 Cb 0.74 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 1gxb h ALA 21 CO -0.22 -0.45 0.38 1.49 0.00 0.00 0.00 179.25 180.45 1gxb h GLU 22 N -0.01 0.83 -0.39 0.00 4.81 -0.54 0.25 114.58 119.53 1gxb h GLU 22 Ca 0.25 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.37 1gxb h GLU 22 Cb 0.39 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1gxb h GLU 22 CO -0.54 0.58 0.06 0.93 -0.73 0.00 0.00 179.01 179.31 1gxb h GLU 23 N 0.84 0.65 -0.43 1.92 4.39 -0.21 -0.21 114.58 121.52 1gxb h GLU 23 Ca 0.22 -0.18 0.04 0.00 0.34 0.00 0.00 59.36 59.78 1gxb h GLU 23 Cb -0.05 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.49 1gxb h GLU 23 CO -0.04 0.70 0.21 1.25 -1.16 0.00 0.00 179.01 179.97 1gxb h LEU 24 N 0.49 0.31 0.14 1.33 5.85 -0.87 -0.89 115.31 121.66 1gxb h LEU 24 Ca 0.12 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1gxb h LEU 24 Cb 0.37 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1gxb h LEU 24 CO 0.01 0.22 -0.07 0.00 -0.34 0.00 0.00 178.44 178.26 1gxb h ALA 25 N 1.23 -0.18 -0.57 1.25 0.00 -0.72 -1.01 119.26 119.26 1gxb h ALA 25 Ca 0.19 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.16 1gxb h ALA 25 Cb 0.10 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 1gxb h ALA 25 CO -0.14 -0.58 -0.01 0.87 0.00 0.00 0.00 179.25 179.38 1gxb h LYS 26 N -0.22 0.10 0.34 0.00 1.57 -0.67 0.25 116.57 117.95 1gxb h LYS 26 Ca -0.02 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1gxb h LYS 26 Cb 0.17 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1gxb h LYS 26 CO 0.03 0.07 -0.32 0.00 -0.57 0.00 0.00 179.45 178.66 1gxb h ALA 27 N 1.52 -0.69 -0.37 3.86 0.00 -0.85 0.17 119.26 122.89 1gxb h ALA 27 Ca 0.29 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.14 1gxb h ALA 27 Cb 0.46 0.45 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 1gxb h ALA 27 CO -0.49 -0.92 0.10 0.82 0.00 0.00 0.00 179.25 178.76 1gxb h ILE 28 N -0.68 0.85 -0.38 0.00 2.04 -0.43 -0.85 117.51 118.06 1gxb h ILE 28 Ca -0.02 -0.08 -0.07 0.00 1.00 0.00 0.00 64.86 65.69 1gxb h ILE 28 Cb 0.61 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 1gxb h ILE 28 CO -0.05 0.04 -0.06 0.40 0.00 0.00 0.00 178.15 178.49 1gxb h ILE 29 N 0.24 1.23 0.00 -0.67 2.04 -0.34 -0.94 117.51 119.07 1gxb h ILE 29 Ca 0.17 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1gxb h ILE 29 Cb 0.18 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1gxb h ILE 29 CO -0.21 0.34 0.00 0.54 0.00 0.00 0.00 178.15 178.82 1gxb n ARG 30 N -4.22 0.48 -2.30 2.37 1.74 0.57 -4.60 116.66 110.70 1gxb n ARG 30 Ca 0.02 0.04 -0.10 0.00 -0.77 0.00 0.00 57.85 57.03 1gxb n ARG 30 Cb 0.30 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1gxb n ARG 30 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gxb n GLY 31 N 0.73 -0.00 0.64 -0.13 0.00 -0.36 -4.92 105.19 101.15 1gxb n GLY 31 Ca 0.14 -0.44 0.12 0.00 0.00 0.00 0.00 46.02 45.85 1gxb n GLY 31 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1gxb n GLU 32 N -2.05 1.72 -4.91 1.61 1.02 -0.40 -4.85 120.64 112.78 1gxb n GLU 32 Ca -0.10 -1.29 -0.33 0.00 -0.02 0.00 0.00 57.16 55.42 1gxb n GLU 32 Cb 0.58 -1.47 -0.14 0.00 -0.02 0.00 0.00 31.44 30.38 1gxb n GLU 32 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1gxb s VAL 33 N -2.17 2.86 0.46 2.62 1.01 -1.25 -4.97 120.40 118.96 1gxb s VAL 33 Ca 0.28 -0.76 -0.24 0.00 0.00 0.00 0.00 61.98 61.26 1gxb s VAL 33 Cb 0.20 -2.15 -0.08 0.00 0.00 0.00 0.00 36.38 34.34 1gxb s VAL 33 CO 0.40 0.55 1.30 -2.65 0.00 0.00 0.00 175.10 174.70 1gxb n PRO 34 N 3.05 1.90 -0.34 2.72 -0.02 -1.26 -4.75 135.00 136.29 1gxb n PRO 34 Ca -0.18 0.68 0.15 0.00 -2.02 0.00 0.00 63.50 62.13 1gxb n PRO 34 Cb 0.52 -2.46 0.35 0.00 -0.02 0.00 0.00 33.50 31.90 1gxb n PRO 34 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1gxb h GLU 35 N 1.93 0.63 -0.64 -0.52 5.08 -1.98 0.38 114.58 119.46 1gxb h GLU 35 Ca -0.49 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1gxb h GLU 35 Cb 1.29 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 1gxb h GLU 35 CO 0.59 0.41 0.42 0.82 -1.00 0.00 0.00 179.01 180.25 1gxb h ILE 36 N 0.64 1.17 0.16 3.13 2.04 -1.99 -0.51 117.51 122.14 1gxb h ILE 36 Ca 0.60 -0.31 -0.30 0.00 1.00 0.00 0.00 64.86 65.85 1gxb h ILE 36 Cb 1.06 0.23 0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1gxb h ILE 36 CO -0.44 0.16 -1.30 -0.07 0.00 0.00 0.00 178.15 176.51 1gxb h LEU 37 N 0.86 0.73 -0.26 1.44 3.38 -1.31 -2.39 115.31 117.77 1gxb h LEU 37 Ca 0.23 -0.73 -0.00 0.00 0.09 0.00 0.00 57.88 57.47 1gxb h LEU 37 Cb -0.09 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 1gxb h LEU 37 CO -0.05 1.55 0.15 0.58 0.09 0.00 0.00 178.44 180.77 1gxb h VAL 38 N 0.18 1.09 -0.19 1.22 2.07 -1.10 0.36 116.25 119.88 1gxb h VAL 38 Ca -0.19 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 67.15 1gxb h VAL 38 Cb 1.98 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 1gxb h VAL 38 CO 0.24 0.09 -0.09 -1.28 0.02 0.00 0.00 177.57 176.55 1gxb h SER 39 N 0.32 -0.29 -0.66 0.57 0.87 -1.14 0.75 113.55 113.97 1gxb h SER 39 Ca 0.09 0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.69 1gxb h SER 39 Cb 0.02 0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.11 1gxb h SER 39 CO -0.02 -0.11 0.27 0.00 -0.53 0.00 0.00 176.83 176.44 1gxb h ALA 40 N 1.12 0.86 -0.30 6.23 0.00 -0.99 -1.35 119.26 124.83 1gxb h ALA 40 Ca 0.10 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1gxb h ALA 40 Cb 0.21 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1gxb h ALA 40 CO -0.23 0.48 -0.00 0.82 0.00 0.00 0.00 179.25 180.31 1gxb h ILE 41 N 0.94 1.26 -0.32 0.00 2.04 0.22 -0.28 117.51 121.37 1gxb h ILE 41 Ca 0.22 -0.95 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 1gxb h ILE 41 Cb 0.20 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1gxb h ILE 41 CO -0.02 0.31 0.15 -0.07 0.00 0.00 0.00 178.15 178.52 1gxb h LEU 42 N 0.32 0.42 -0.38 1.44 3.38 -0.77 0.29 115.31 120.01 1gxb h LEU 42 Ca 0.08 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1gxb h LEU 42 Cb 0.44 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1gxb h LEU 42 CO 0.02 0.44 0.23 0.58 0.09 0.00 0.00 178.44 179.80 1gxb h VAL 43 N 0.38 1.06 -0.35 1.22 2.07 -1.14 0.17 116.25 119.66 1gxb h VAL 43 Ca 0.11 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1gxb h VAL 43 Cb 0.13 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1gxb h VAL 43 CO -0.01 0.09 0.15 0.00 0.02 0.00 0.00 177.57 177.81 1gxb h ALA 44 N 1.16 0.46 -0.65 1.67 0.00 -0.81 -0.57 119.26 120.51 1gxb h ALA 44 Ca 0.15 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.06 1gxb h ALA 44 Cb -0.02 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.54 1gxb h ALA 44 CO -0.05 0.05 0.18 1.25 0.00 0.00 0.00 179.25 180.67 1gxb h LEU 45 N 0.43 0.08 -0.24 0.00 5.85 0.07 0.47 115.31 121.98 1gxb h LEU 45 Ca 0.12 0.11 -0.12 0.00 0.84 0.00 0.00 57.88 58.84 1gxb h LEU 45 Cb 0.16 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 1gxb h LEU 45 CO -0.01 0.03 -0.31 -0.09 -0.34 0.00 0.00 178.44 177.73 1gxb h ARG 46 N 0.31 0.63 0.00 1.25 2.43 -0.48 -1.66 114.38 116.85 1gxb h ARG 46 Ca 0.35 -0.36 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 1gxb h ARG 46 Cb 0.53 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1gxb h ARG 46 CO -0.41 0.96 -0.30 0.52 -1.51 0.00 0.00 179.97 179.24 1gxb h MET 47 N 0.33 0.00 0.10 0.20 2.86 -0.56 -2.51 114.93 115.35 1gxb h MET 47 Ca 0.03 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.39 1gxb h MET 47 Cb 0.88 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.56 1gxb h MET 47 CO 0.07 0.30 -1.18 -0.22 1.06 0.00 0.00 176.91 176.94 1gxb h LYS 48 N 0.00 0.49 0.00 1.72 3.64 -0.90 -3.50 116.57 118.03 1gxb h LYS 48 Ca -0.00 -0.66 0.00 0.00 -1.27 0.00 0.00 60.65 58.72 1gxb h LYS 48 Cb 0.65 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 1gxb h LYS 48 CO 0.04 1.28 0.00 0.41 -2.27 0.00 0.00 179.45 178.91 1gxb n GLY 49 N 1.31 0.81 3.71 5.01 0.00 -0.64 -5.02 105.19 110.37 1gxb n GLY 49 Ca -0.11 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 1gxb n GLY 49 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1gxb n GLU 50 N 2.36 1.90 -3.92 1.61 0.00 -1.16 -4.97 120.64 116.47 1gxb n GLU 50 Ca 0.00 0.68 -0.22 0.00 0.00 0.00 0.00 57.16 57.62 1gxb n GLU 50 Cb 0.00 -2.41 -0.05 0.00 0.00 0.00 0.00 31.44 28.98 1gxb n GLU 50 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 1gxb s SER 51 N -0.58 5.07 0.18 -1.84 1.04 -1.26 -4.97 113.70 111.32 1gxb s SER 51 Ca 0.62 -0.60 -0.21 0.00 0.48 0.00 0.00 55.95 56.24 1gxb s SER 51 Cb -0.49 -0.88 0.10 0.00 0.10 0.00 0.00 66.02 64.85 1gxb s SER 51 CO 0.57 -0.34 1.60 0.50 0.98 0.00 0.00 173.24 176.56 1gxb h LYS 52 N 1.35 -0.19 -0.92 4.02 3.64 -1.95 -0.42 116.57 122.11 1gxb h LYS 52 Ca -0.44 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.02 1gxb h LYS 52 Cb 1.25 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 33.05 1gxb h LYS 52 CO 0.60 -0.12 0.60 -0.91 -2.27 0.00 0.00 179.45 177.35 1gxb h ASN 53 N -0.19 0.92 -0.42 4.20 2.35 -1.96 0.13 115.58 120.62 1gxb h ASN 53 Ca 0.20 0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.82 1gxb h ASN 53 Cb 0.52 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 1gxb h ASN 53 CO -0.57 0.59 -0.27 -0.33 -1.65 0.00 0.00 177.43 175.20 1gxb h GLU 54 N 1.05 0.92 -0.29 0.81 5.08 -1.52 0.34 114.58 120.96 1gxb h GLU 54 Ca 0.40 -0.43 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1gxb h GLU 54 Cb 0.20 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1gxb h GLU 54 CO -0.15 1.09 0.19 0.82 -1.00 0.00 0.00 179.01 179.95 1gxb h ILE 55 N 0.74 1.09 -0.39 3.13 1.08 -0.20 -0.36 117.51 122.60 1gxb h ILE 55 Ca 0.08 -0.19 -0.02 0.00 -0.39 0.00 0.00 64.86 64.34 1gxb h ILE 55 Cb 0.85 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 35.28 1gxb h ILE 55 CO 0.07 0.09 0.16 0.58 -0.69 0.00 0.00 178.15 178.36 1gxb h VAL 56 N 0.39 1.19 -0.06 1.67 2.07 -0.51 0.12 116.25 121.12 1gxb h VAL 56 Ca 0.11 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.04 1gxb h VAL 56 Cb -0.02 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1gxb h VAL 56 CO -0.02 0.22 -0.03 1.23 0.02 0.00 0.00 177.57 178.98 1gxb h GLY 57 N 0.49 0.03 0.98 2.17 0.00 -0.01 0.55 103.07 107.28 1gxb h GLY 57 Ca 0.13 0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.47 1gxb h GLY 57 CO -0.01 -0.04 0.21 0.74 0.00 0.00 0.00 176.54 177.44 1gxb h PHE 58 N -0.03 0.82 -0.32 5.60 -1.00 -0.91 -0.76 116.94 120.35 1gxb h PHE 58 Ca 0.04 -0.06 0.05 0.00 2.81 0.00 0.00 57.97 60.80 1gxb h PHE 58 Cb 0.08 -0.25 -0.05 0.00 3.61 0.00 0.00 35.95 39.35 1gxb h PHE 58 CO -0.14 0.68 0.03 0.00 -1.61 0.00 0.00 178.31 177.27 1gxb h ALA 59 N 1.06 0.31 -0.61 2.45 0.00 -0.34 -0.18 119.26 121.94 1gxb h ALA 59 Ca 0.18 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1gxb h ALA 59 Cb 0.21 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1gxb h ALA 59 CO -0.01 -0.38 0.35 0.00 0.00 0.00 0.00 179.25 179.21 1gxb h ARG 60 N 0.13 0.84 -0.63 0.00 3.08 -0.62 -1.31 114.38 115.88 1gxb h ARG 60 Ca 0.15 -0.09 0.04 0.00 0.07 0.00 0.00 59.98 60.16 1gxb h ARG 60 Cb 0.19 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.02 1gxb h ARG 60 CO -0.23 0.62 0.36 0.00 -1.07 0.00 0.00 179.97 179.66 1gxb h ALA 61 N 1.17 0.83 0.66 0.04 0.00 -0.57 -1.49 119.26 119.89 1gxb h ALA 61 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1gxb h ALA 61 Cb 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1gxb h ALA 61 CO -0.04 0.07 -0.42 0.52 0.00 0.00 0.00 179.25 179.38 1gxb h MET 62 N 0.69 -0.99 -0.26 0.00 2.86 -0.50 -2.89 114.93 113.85 1gxb h MET 62 Ca 0.27 0.07 0.06 0.00 -2.06 0.00 0.00 59.70 58.04 1gxb h MET 62 Cb 0.11 0.22 -0.07 0.00 0.06 0.00 0.00 31.60 31.92 1gxb h MET 62 CO -0.14 -0.66 -0.20 0.00 1.06 0.00 0.00 176.91 176.97 1gxb h ARG 63 N -1.03 -0.18 -1.10 1.72 3.08 -1.10 -0.22 114.38 115.55 1gxb h ARG 63 Ca -0.08 0.01 0.31 0.00 0.07 0.00 0.00 59.98 60.29 1gxb h ARG 63 Cb 0.84 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.87 1gxb h ARG 63 CO 0.07 -0.12 0.77 1.49 -1.07 0.00 0.00 179.97 181.11 1gxb h GLU 64 N -0.19 0.12 -0.02 0.04 4.81 -1.20 0.09 114.58 118.24 1gxb h GLU 64 Ca 0.14 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1gxb h GLU 64 Cb 0.40 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.76 1gxb h GLU 64 CO -0.37 0.08 -0.22 1.28 -0.73 0.00 0.00 179.01 179.05 1gxb n LEU 65 N -4.33 1.98 -4.84 1.64 4.77 -0.24 -4.98 117.00 111.00 1gxb n LEU 65 Ca 0.25 -0.85 -0.31 0.00 -0.03 0.00 0.00 56.01 55.06 1gxb n LEU 65 Cb 1.10 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 42.21 1gxb n LEU 65 CO 0.36 0.36 0.71 0.00 -1.33 0.00 0.00 177.39 177.49 1gxb s ALA 66 N -1.79 2.89 -0.00 -1.18 0.00 0.02 -4.77 121.76 116.92 1gxb s ALA 66 Ca 0.17 0.03 -0.27 0.00 0.00 0.00 0.00 51.96 51.88 1gxb s ALA 66 Cb 0.14 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 1gxb s ALA 66 CO 0.35 -0.91 0.85 0.42 0.00 0.00 0.00 175.76 176.46 1gxb s ILE 67 N -3.06 4.87 0.20 0.00 1.01 0.07 -5.01 121.20 119.28 1gxb s ILE 67 Ca 0.57 1.78 0.11 0.00 0.00 0.00 0.00 60.65 63.11 1gxb s ILE 67 Cb -0.13 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 1gxb s ILE 67 CO 0.52 0.24 -0.23 -0.54 0.00 0.00 0.00 174.94 174.94 1gxb s LYS 68 N 0.65 1.57 0.13 2.79 1.02 -1.26 -4.74 119.74 119.89 1gxb s LYS 68 Ca 0.44 -1.54 0.04 0.00 0.02 0.00 0.00 55.97 54.93 1gxb s LYS 68 Cb -0.20 -1.85 -0.04 0.00 -0.52 0.00 0.00 37.83 35.21 1gxb s LYS 68 CO 0.24 0.39 -0.10 0.96 -0.92 0.00 0.00 175.35 175.93 1gxb s ILE 69 N -1.78 1.04 -0.30 2.17 -4.36 0.59 -5.02 121.20 113.54 1gxb s ILE 69 Ca 0.22 -1.93 -0.05 0.00 -0.26 0.00 0.00 60.65 58.64 1gxb s ILE 69 Cb -0.08 -1.69 0.03 0.00 1.25 0.00 0.00 42.46 41.97 1gxb s ILE 69 CO 0.11 -0.71 0.05 -0.62 0.24 0.00 0.00 174.94 174.01 1gxb s ASP 70 N -2.95 5.01 -0.42 4.36 3.68 -1.26 -4.03 116.67 121.07 1gxb s ASP 70 Ca 0.13 -0.98 0.09 0.00 2.13 0.00 0.00 52.55 53.91 1gxb s ASP 70 Cb 0.01 -1.81 0.37 0.00 -1.45 0.00 0.00 42.92 40.04 1gxb s ASP 70 CO -0.00 -0.24 1.19 0.52 0.13 0.00 0.00 175.17 176.77 1gxb n VAL 71 N 4.77 0.06 0.33 1.11 0.31 -1.05 -4.99 118.33 118.88 1gxb n VAL 71 Ca -0.14 -1.82 0.21 0.00 -0.01 0.00 0.00 64.34 62.58 1gxb n VAL 71 Cb 0.46 1.09 1.11 0.00 -0.91 0.00 0.00 33.84 35.59 1gxb n VAL 71 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1gxb h PRO 72 N 2.53 0.00 0.00 5.55 0.13 -1.81 0.12 132.00 138.53 1gxb h PRO 72 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1gxb h PRO 72 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1gxb h PRO 72 CO 0.09 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.13 1gxb n ASN 73 N -3.10 0.00 -4.89 1.44 6.94 -1.26 -1.33 115.26 113.06 1gxb n ASN 73 Ca -0.03 0.10 -0.30 0.00 -0.02 0.00 0.00 54.58 54.34 1gxb n ASN 73 Cb 0.15 -0.34 0.06 0.00 -2.36 0.00 0.00 39.78 37.29 1gxb n ASN 73 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1gxb s ALA 74 N -2.68 2.83 0.15 -2.53 0.00 0.03 -4.67 121.76 114.88 1gxb s ALA 74 Ca 0.18 -0.45 0.08 0.00 0.00 0.00 0.00 51.96 51.78 1gxb s ALA 74 Cb 0.15 -3.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.23 1gxb s ALA 74 CO 0.35 -1.30 -0.18 -1.50 0.00 0.00 0.00 175.76 173.13 1gxb s ILE 75 N -3.42 1.74 0.02 0.00 2.07 -0.57 -3.19 121.20 117.86 1gxb s ILE 75 Ca 0.59 -1.82 0.02 0.00 -1.41 0.00 0.00 60.65 58.03 1gxb s ILE 75 Cb -0.11 -1.75 -0.02 0.00 0.13 0.00 0.00 42.46 40.71 1gxb s ILE 75 CO 0.51 -0.28 -0.06 -0.62 -1.91 0.00 0.00 174.94 172.58 1gxb s ASP 76 N -2.50 0.66 -0.53 4.50 2.15 -1.06 -1.51 116.67 118.39 1gxb s ASP 76 Ca 0.13 -0.39 0.01 0.00 0.43 0.00 0.00 52.55 52.73 1gxb s ASP 76 Cb -0.06 0.01 0.14 0.00 -0.30 0.00 0.00 42.92 42.71 1gxb s ASP 76 CO 0.06 -0.13 0.29 0.42 -0.17 0.00 0.00 175.17 175.63 1gxb s THR 77 N -0.98 2.97 0.10 1.71 -4.23 -1.26 -0.77 115.64 113.18 1gxb s THR 77 Ca -0.07 -3.00 0.04 0.00 -1.18 0.00 0.00 61.69 57.47 1gxb s THR 77 Cb -0.07 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.70 1gxb s THR 77 CO 0.00 -0.79 0.07 0.00 -0.54 0.00 0.00 174.62 173.35 1gxb s ALA 78 N 0.02 3.50 -0.11 3.99 0.00 0.14 -4.78 121.76 124.53 1gxb s ALA 78 Ca 0.16 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 51.07 1gxb s ALA 78 Cb -0.23 -1.36 -0.00 0.00 0.00 0.00 0.00 23.12 21.53 1gxb s ALA 78 CO -0.02 0.69 -0.21 0.20 0.00 0.00 0.00 175.76 176.41 1gxb s GLY 79 N -2.50 1.38 0.18 0.00 0.00 -1.26 -1.03 107.32 104.09 1gxb s GLY 79 Ca 0.29 -0.96 0.12 0.00 0.00 0.00 0.00 44.72 44.17 1gxb s GLY 79 CO 0.21 -0.28 1.36 -0.37 0.00 0.00 0.00 173.10 174.02 1gxb n THR 80 N 3.55 1.41 -0.86 0.90 5.66 0.17 -4.82 114.28 120.29 1gxb n THR 80 Ca -0.19 0.64 0.00 0.00 -3.05 0.00 0.00 64.05 61.45 1gxb n THR 80 Cb 0.53 -1.64 0.00 0.00 -1.55 0.00 0.00 70.33 67.67 1gxb n THR 80 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1gxb n GLY 81 N -1.38 -2.33 0.00 1.09 0.00 -1.26 -4.59 105.19 96.72 1gxb n GLY 81 Ca -0.01 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1gxb n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gxb n GLY 82 N -0.72 -0.36 2.33 -0.02 0.00 -1.26 -4.24 105.19 100.91 1gxb n GLY 82 Ca 0.00 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.49 1gxb n GLY 82 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gxb n ASP 83 N 0.00 7.40 -0.18 1.61 8.00 -1.26 -4.93 116.55 127.18 1gxb n ASP 83 Ca 0.00 -3.63 0.00 0.00 0.71 0.00 0.00 54.79 51.87 1gxb n ASP 83 Cb 0.00 -1.02 0.00 0.00 -0.02 0.00 0.00 41.12 40.08 1gxb n ASP 83 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gxb n GLY 84 N -0.55 -3.01 1.21 0.44 0.00 -1.26 -4.91 105.19 97.11 1gxb n GLY 84 Ca 0.55 -0.90 0.03 0.00 0.00 0.00 0.00 46.02 45.70 1gxb n GLY 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gxb n LEU 85 N 0.00 4.47 -3.04 0.99 7.99 -1.26 -4.92 117.00 121.22 1gxb n LEU 85 Ca 0.00 -3.21 -0.22 0.00 -0.01 0.00 0.00 56.01 52.56 1gxb n LEU 85 Cb 0.00 -0.61 0.04 0.00 -0.11 0.00 0.00 43.42 42.74 1gxb n LEU 85 CO 0.00 0.82 0.04 0.61 -1.51 0.00 0.00 177.39 177.34 1gxb n GLY 86 N -0.52 -0.50 3.40 -0.72 0.00 -1.26 -4.62 105.19 100.96 1gxb n GLY 86 Ca 0.28 0.13 -0.31 0.00 0.00 0.00 0.00 46.02 46.12 1gxb n GLY 86 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1gxb n THR 87 N -4.57 0.00 -2.33 2.61 5.66 -1.26 -2.01 114.28 112.37 1gxb n THR 87 Ca -0.09 -0.27 -0.35 0.00 -3.05 0.00 0.00 64.05 60.28 1gxb n THR 87 Cb 0.61 -0.74 -0.01 0.00 -1.55 0.00 0.00 70.33 68.65 1gxb n THR 87 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1gxb s VAL 88 N -2.36 3.32 -1.21 1.08 0.11 -0.05 -4.56 120.40 116.73 1gxb s VAL 88 Ca 0.60 0.83 -0.14 0.00 -2.93 0.00 0.00 61.98 60.34 1gxb s VAL 88 Cb -0.18 -3.33 -0.06 0.00 -1.53 0.00 0.00 36.38 31.28 1gxb s VAL 88 CO 0.65 -0.18 2.29 -0.46 -3.33 0.00 0.00 175.10 174.08 1gxb n ASN 89 N -1.21 4.80 -0.17 3.54 2.04 -1.26 -4.77 115.26 118.23 1gxb n ASN 89 Ca 0.11 -2.64 -0.02 0.00 -0.44 0.00 0.00 54.58 51.59 1gxb n ASN 89 Cb 0.51 -1.39 0.06 0.00 -2.53 0.00 0.00 39.78 36.43 1gxb n ASN 89 CO 0.00 0.00 0.00 -0.37 -0.44 0.00 0.00 177.26 176.45 1gxb h VAL 90 N 3.79 0.52 -0.85 3.53 -1.51 -1.97 -2.28 116.25 117.47 1gxb h VAL 90 Ca 0.58 -0.02 0.21 0.00 -1.23 0.00 0.00 66.70 66.25 1gxb h VAL 90 Cb 0.47 0.46 -0.15 0.00 -2.13 0.00 0.00 31.29 29.94 1gxb h VAL 90 CO 1.80 0.01 0.01 0.28 -1.23 0.00 0.00 177.57 178.44 1gxb h SER 91 N 0.05 -0.41 0.11 4.19 0.02 -1.88 0.78 113.55 116.40 1gxb h SER 91 Ca 0.26 0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 61.44 1gxb h SER 91 Cb 0.41 0.40 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1gxb h SER 91 CO -0.50 -0.24 -0.05 0.74 -1.14 0.00 0.00 176.83 175.63 1gxb h THR 92 N 0.07 1.07 -0.42 -2.27 2.02 -1.72 0.14 112.91 111.80 1gxb h THR 92 Ca 0.48 -0.71 0.06 0.00 0.77 0.00 0.00 66.41 67.01 1gxb h THR 92 Cb 0.90 1.52 -0.06 0.00 -1.74 0.00 0.00 68.15 68.77 1gxb h THR 92 CO -0.77 0.17 0.09 0.00 0.37 0.00 0.00 175.52 175.38 1gxb h ALA 93 N 0.36 0.47 -0.18 6.16 0.00 -0.99 -0.46 119.26 124.62 1gxb h ALA 93 Ca -0.01 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1gxb h ALA 93 Cb 0.39 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1gxb h ALA 93 CO 0.02 -0.31 0.08 1.03 0.00 0.00 0.00 179.25 180.08 1gxb h SER 94 N 0.23 0.22 0.23 0.00 0.87 0.62 -1.15 113.55 114.57 1gxb h SER 94 Ca 0.20 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.68 1gxb h SER 94 Cb 0.24 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 1gxb h SER 94 CO -0.26 0.20 -0.29 0.00 -0.53 0.00 0.00 176.83 175.94 1gxb h ALA 95 N 1.84 1.41 -0.29 6.23 0.00 0.97 -2.62 119.26 126.80 1gxb h ALA 95 Ca 0.06 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1gxb h ALA 95 Cb 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1gxb h ALA 95 CO -0.01 0.43 -0.08 0.82 0.00 0.00 0.00 179.25 180.41 1gxb h ILE 96 N 0.09 1.28 -0.69 0.00 2.04 -0.77 -2.09 117.51 117.37 1gxb h ILE 96 Ca 0.01 -1.13 -0.04 0.00 1.00 0.00 0.00 64.86 64.71 1gxb h ILE 96 Cb 0.57 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 1gxb h ILE 96 CO 0.04 0.36 0.29 -0.07 0.00 0.00 0.00 178.15 178.77 1gxb h LEU 97 N 0.33 0.92 -1.31 1.44 3.38 -1.40 -2.56 115.31 116.12 1gxb h LEU 97 Ca 0.07 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1gxb h LEU 97 Cb 0.57 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1gxb h LEU 97 CO 0.03 0.81 -0.07 -0.07 0.09 0.00 0.00 178.44 179.23 1gxb h LEU 98 N 1.00 0.36 -2.52 1.67 3.38 -1.29 -2.50 115.31 115.40 1gxb h LEU 98 Ca 0.24 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1gxb h LEU 98 Cb 0.17 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1gxb h LEU 98 CO -0.02 0.48 0.00 0.77 0.09 0.00 0.00 178.44 179.75 1gxb h SER 99 N 0.36 0.00 0.29 -0.43 4.64 -0.94 -0.07 113.55 117.40 1gxb h SER 99 Ca 0.08 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.30 1gxb h SER 99 Cb 0.36 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1gxb h SER 99 CO 0.02 0.00 -0.41 -0.07 -0.87 0.00 0.00 176.83 175.50 1gxb h LEU 100 N 0.00 0.17 -2.32 5.97 4.07 -1.53 -3.29 115.31 118.37 1gxb h LEU 100 Ca 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.89 1gxb h LEU 100 Cb 0.12 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 41.81 1gxb h LEU 100 CO 0.00 0.56 0.00 1.33 -1.08 0.00 0.00 178.44 179.25 1gxb n VAL 101 N -4.03 0.67 -3.64 1.22 0.24 -0.41 -5.06 118.33 107.31 1gxb n VAL 101 Ca -0.02 -0.82 -0.03 0.00 -2.04 0.00 0.00 64.34 61.44 1gxb n VAL 101 Cb 0.46 0.68 -0.06 0.00 -1.47 0.00 0.00 33.84 33.45 1gxb n VAL 101 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1gxb s ASN 102 N -0.67 -0.09 0.25 -1.34 3.84 -0.17 -5.12 114.94 111.64 1gxb s ASN 102 Ca 0.00 0.15 -0.31 0.00 0.21 0.00 0.00 52.86 52.91 1gxb s ASN 102 Cb 0.00 0.14 -0.13 0.00 -0.55 0.00 0.00 41.25 40.72 1gxb s ASN 102 CO 0.00 -0.05 1.54 -0.81 -2.79 0.00 0.00 177.10 174.99 1gxb n PRO 103 N 1.22 2.42 -4.20 0.43 -0.04 -1.26 -3.70 135.00 129.87 1gxb n PRO 103 Ca -0.07 0.86 -0.32 0.00 -0.04 0.00 0.00 63.50 63.93 1gxb n PRO 103 Cb 0.58 -2.61 -0.16 0.00 -0.04 0.00 0.00 33.50 31.27 1gxb n PRO 103 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1gxb s VAL 104 N 0.20 1.97 -0.66 0.52 1.01 0.10 -1.51 120.40 122.04 1gxb s VAL 104 Ca 0.68 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.76 1gxb s VAL 104 Cb -0.57 -1.79 0.17 0.00 0.00 0.00 0.00 36.38 34.19 1gxb s VAL 104 CO 0.46 0.53 0.46 0.00 0.00 0.00 0.00 175.10 176.55 1gxb s ALA 105 N 1.24 3.66 -0.34 5.51 0.00 -0.57 -0.54 121.76 130.72 1gxb s ALA 105 Ca 0.03 -3.43 -0.28 0.00 0.00 0.00 0.00 51.96 48.28 1gxb s ALA 105 Cb -0.13 -2.54 0.02 0.00 0.00 0.00 0.00 23.12 20.46 1gxb s ALA 105 CO -0.11 -2.10 1.03 0.21 0.00 0.00 0.00 175.76 174.79 1gxb s LYS 106 N -0.47 3.98 0.23 0.00 2.47 -0.51 -4.39 119.74 121.05 1gxb s LYS 106 Ca 0.19 0.89 -0.20 0.00 -1.56 0.00 0.00 55.97 55.29 1gxb s LYS 106 Cb -0.18 -3.77 -0.08 0.00 -1.46 0.00 0.00 37.83 32.34 1gxb s LYS 106 CO -0.05 -0.94 0.74 -1.58 0.16 0.00 0.00 175.35 173.67 1gxb s HIS 107 N 3.65 3.65 0.03 4.03 5.65 -1.26 -0.01 115.29 131.03 1gxb s HIS 107 Ca 0.43 1.41 -0.29 0.00 0.25 0.00 0.00 55.06 56.86 1gxb s HIS 107 Cb -0.12 -2.64 0.10 0.00 -1.18 0.00 0.00 32.58 28.75 1gxb s HIS 107 CO 0.17 0.33 1.18 0.20 -0.65 0.00 0.00 174.74 175.97 1gxb s GLY 108 N -1.65 -0.36 0.28 1.59 0.00 -0.74 -4.90 107.32 101.55 1gxb s GLY 108 Ca 0.43 0.53 -0.07 0.00 0.00 0.00 0.00 44.72 45.62 1gxb s GLY 108 CO 0.21 0.09 0.42 0.21 0.00 0.00 0.00 173.10 174.03 1gxb s ASN 109 N -2.95 0.33 0.08 1.64 3.84 -1.26 -0.25 114.94 116.36 1gxb s ASN 109 Ca 0.13 -1.22 0.00 0.00 0.21 0.00 0.00 52.86 51.98 1gxb s ASN 109 Cb 0.03 0.58 0.00 0.00 -0.55 0.00 0.00 41.25 41.31 1gxb s ASN 109 CO -0.02 -1.15 0.00 0.54 -2.79 0.00 0.00 177.10 173.68 1gxb n ARG 110 N -0.43 0.90 -3.56 0.43 1.74 -1.26 -2.54 116.66 111.93 1gxb n ARG 110 Ca -0.00 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 1gxb n ARG 110 Cb 0.62 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 32.00 1gxb n ARG 110 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1gxb s ALA 111 N -3.65 -1.81 -0.63 7.54 0.00 -1.26 -4.66 121.76 117.29 1gxb s ALA 111 Ca 0.00 1.57 0.24 0.00 0.00 0.00 0.00 51.96 53.77 1gxb s ALA 111 Cb 0.00 -0.49 0.27 0.00 0.00 0.00 0.00 23.12 22.91 1gxb s ALA 111 CO 0.00 -0.34 1.25 1.33 0.00 0.00 0.00 175.76 177.99 1gxb n VAL 112 N 1.40 0.32 -2.87 0.00 0.24 -1.26 -4.63 118.33 111.53 1gxb n VAL 112 Ca -0.16 -0.27 -0.43 0.00 -2.04 0.00 0.00 64.34 61.43 1gxb n VAL 112 Cb 0.57 -0.06 -0.02 0.00 -1.47 0.00 0.00 33.84 32.86 1gxb n VAL 112 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1gxb s SER 113 N -4.17 6.74 0.43 -1.34 0.01 -1.26 -4.86 113.70 109.25 1gxb s SER 113 Ca 0.05 -2.25 0.00 0.00 1.31 0.00 0.00 55.95 55.06 1gxb s SER 113 Cb 0.14 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1gxb s SER 113 CO 0.74 -1.04 0.00 0.61 0.41 0.00 0.00 173.24 173.96 1gxb n GLY 114 N 5.29 1.25 2.10 3.44 0.00 -1.26 -3.14 105.19 112.88 1gxb n GLY 114 Ca 0.30 0.26 -0.01 0.00 0.00 0.00 0.00 46.02 46.57 1gxb n GLY 114 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gxb n LYS 115 N 0.00 0.66 -0.79 1.61 4.76 -1.26 -4.98 118.16 118.15 1gxb n LYS 115 Ca 0.00 -0.62 0.06 0.00 -2.87 0.00 0.00 58.31 54.88 1gxb n LYS 115 Cb 0.00 0.19 0.35 0.00 -1.84 0.00 0.00 35.03 33.73 1gxb n LYS 115 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1gxb n SER 116 N -0.74 5.11 -4.78 4.39 3.41 -1.19 -2.47 113.62 117.36 1gxb n SER 116 Ca -0.09 -2.82 -0.39 0.00 -0.26 0.00 0.00 58.87 55.31 1gxb n SER 116 Cb 0.69 -0.67 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 1gxb n SER 116 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1gxb s GLY 117 N -0.68 2.91 0.46 5.00 0.00 -1.26 -4.78 107.32 108.97 1gxb s GLY 117 Ca 0.47 0.39 0.20 0.00 0.00 0.00 0.00 44.72 45.78 1gxb s GLY 117 CO 0.14 0.88 1.92 1.48 0.00 0.00 0.00 173.10 177.53 1gxb h SER 118 N 4.15 0.26 0.22 1.64 4.64 -1.87 0.34 113.55 122.94 1gxb h SER 118 Ca -0.47 0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 60.76 1gxb h SER 118 Cb 1.20 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 1gxb h SER 118 CO 0.66 0.13 -0.41 0.00 -0.87 0.00 0.00 176.83 176.34 1gxb h ALA 119 N 1.65 1.10 -0.08 5.18 0.00 -1.83 -2.02 119.26 123.26 1gxb h ALA 119 Ca 0.36 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1gxb h ALA 119 Cb 1.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1gxb h ALA 119 CO -0.09 0.59 -0.21 -0.44 0.00 0.00 0.00 179.25 179.10 1gxb h ASP 120 N 0.21 0.33 -0.01 0.00 3.32 -0.60 -0.65 116.42 119.01 1gxb h ASP 120 Ca 0.02 -0.59 0.03 0.00 0.02 0.00 0.00 57.03 56.50 1gxb h ASP 120 Cb 0.82 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.24 1gxb h ASP 120 CO 0.06 0.86 -0.15 0.58 -1.72 0.00 0.00 179.24 178.87 1gxb h VAL 121 N -0.19 0.62 -0.84 -1.35 2.07 -1.19 0.43 116.25 115.80 1gxb h VAL 121 Ca -0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1gxb h VAL 121 Cb 0.82 0.62 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 1gxb h VAL 121 CO 0.05 0.00 0.53 -0.07 0.02 0.00 0.00 177.57 178.10 1gxb h LEU 122 N -0.25 0.88 -0.96 2.57 3.38 -1.40 -0.03 115.31 119.49 1gxb h LEU 122 Ca 0.05 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1gxb h LEU 122 Cb 0.32 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1gxb h LEU 122 CO -0.16 0.60 0.35 -0.08 0.09 0.00 0.00 178.44 179.24 1gxb h GLU 123 N 1.03 1.09 -0.50 1.13 4.81 -0.29 -0.55 114.58 121.31 1gxb h GLU 123 Ca 0.34 -0.16 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 1gxb h GLU 123 Cb 0.04 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 1gxb h GLU 123 CO -0.13 0.85 0.13 0.00 -0.73 0.00 0.00 179.01 179.13 1gxb h ALA 124 N 1.30 0.65 0.00 2.92 0.00 0.14 -2.31 119.26 121.97 1gxb h ALA 124 Ca 0.26 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1gxb h ALA 124 Cb 0.13 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1gxb h ALA 124 CO -0.03 0.34 0.00 1.28 0.00 0.00 0.00 179.25 180.84 1gxb n LEU 125 N -4.47 0.14 0.00 0.00 7.99 -0.18 -4.73 117.00 115.75 1gxb n LEU 125 Ca 0.01 0.55 0.00 0.00 -0.01 0.00 0.00 56.01 56.56 1gxb n LEU 125 Cb 0.22 -0.54 0.00 0.00 -0.11 0.00 0.00 43.42 42.99 1gxb n LEU 125 CO 0.39 -0.42 0.00 0.61 -1.51 0.00 0.00 177.39 176.46 1gxb n GLY 126 N -0.52 0.78 3.77 -0.72 0.00 -0.87 -2.87 105.19 104.76 1gxb n GLY 126 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1gxb n GLY 126 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1gxb s TYR 127 N -2.00 2.82 -0.82 1.61 5.04 -0.25 0.28 117.35 124.03 1gxb s TYR 127 Ca 0.00 1.42 -0.17 0.00 -2.44 0.00 0.00 57.07 55.88 1gxb s TYR 127 Cb 0.00 -3.64 0.15 0.00 0.35 0.00 0.00 41.96 38.82 1gxb s TYR 127 CO 0.00 -2.03 0.93 1.21 -1.34 0.00 0.00 175.55 174.32 1gxb s ASN 128 N -0.80 6.57 0.00 4.32 3.84 -0.86 -4.20 114.94 123.81 1gxb s ASN 128 Ca 0.58 -2.08 0.00 0.00 0.21 0.00 0.00 52.86 51.56 1gxb s ASN 128 Cb -0.37 -2.32 0.00 0.00 -0.55 0.00 0.00 41.25 38.00 1gxb s ASN 128 CO 0.48 -0.94 0.96 2.30 -2.79 0.00 0.00 177.10 177.11 1gxb n ILE 129 N 5.06 1.86 -3.41 -5.21 -5.35 -1.26 -4.22 119.36 106.83 1gxb n ILE 129 Ca 0.13 0.48 -0.44 0.00 -0.27 0.00 0.00 62.75 62.65 1gxb n ILE 129 Cb 0.47 -1.48 -0.06 0.00 -1.74 0.00 0.00 39.64 36.84 1gxb n ILE 129 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1gxb s ILE 130 N -2.93 4.90 -0.28 7.28 1.01 -1.26 -4.23 121.20 125.69 1gxb s ILE 130 Ca 0.00 -1.84 -0.04 0.00 0.00 0.00 0.00 60.65 58.78 1gxb s ILE 130 Cb 0.00 -4.15 0.03 0.00 0.01 0.00 0.00 42.46 38.35 1gxb s ILE 130 CO 0.00 -0.87 0.01 -0.69 0.00 0.00 0.00 174.94 173.39 1gxb s VAL 131 N 1.19 3.32 0.49 2.92 1.01 -1.26 -5.09 120.40 122.97 1gxb s VAL 131 Ca 0.07 -1.02 -0.24 0.00 0.00 0.00 0.00 61.98 60.79 1gxb s VAL 131 Cb -0.25 -2.77 -0.07 0.00 0.00 0.00 0.00 36.38 33.30 1gxb s VAL 131 CO -0.01 0.05 1.42 -2.65 0.00 0.00 0.00 175.10 173.91 1gxb n PRO 132 N 4.73 2.06 -0.32 2.72 -0.02 -1.26 -4.67 135.00 138.24 1gxb n PRO 132 Ca -0.15 0.74 0.19 0.00 -2.02 0.00 0.00 63.50 62.26 1gxb n PRO 132 Cb 0.46 -2.62 0.39 0.00 -0.02 0.00 0.00 33.50 31.70 1gxb n PRO 132 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1gxb h PRO 133 N 1.97 0.22 0.04 0.52 0.13 -1.98 0.18 132.00 133.08 1gxb h PRO 133 Ca -0.51 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1gxb h PRO 133 Cb 1.28 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1gxb h PRO 133 CO 0.59 0.15 -0.02 1.05 -0.23 0.00 0.00 178.00 179.55 1gxb h GLU 134 N 0.23 -0.05 0.00 0.86 9.09 -1.97 -2.63 114.58 120.12 1gxb h GLU 134 Ca 0.65 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 60.01 1gxb h GLU 134 Cb 1.43 0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 28.53 1gxb h GLU 134 CO -0.66 0.17 -0.24 -0.09 0.05 0.00 0.00 179.01 178.24 1gxb h ARG 135 N -0.26 0.00 0.32 1.06 2.43 -1.67 -3.02 114.38 113.24 1gxb h ARG 135 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1gxb h ARG 135 Cb 0.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1gxb h ARG 135 CO 0.01 0.24 -0.16 0.00 -1.51 0.00 0.00 179.97 178.55 1gxb h ALA 136 N 1.76 -0.43 -0.80 2.80 0.00 -0.41 0.11 119.26 122.29 1gxb h ALA 136 Ca -0.00 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 54.92 1gxb h ALA 136 Cb 0.77 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.66 1gxb h ALA 136 CO 0.03 -0.74 0.43 -0.22 0.00 0.00 0.00 179.25 178.74 1gxb h LYS 137 N -0.43 0.67 0.69 0.00 1.63 -1.37 -1.90 116.57 115.85 1gxb h LYS 137 Ca -0.04 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.69 1gxb h LYS 137 Cb 0.34 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.81 1gxb h LYS 137 CO 0.07 0.45 -0.47 1.49 -3.45 0.00 0.00 179.45 177.54 1gxb h GLU 138 N 0.69 -1.05 -0.97 1.90 4.57 -1.32 -2.88 114.58 115.52 1gxb h GLU 138 Ca 0.40 0.07 0.21 0.00 -1.18 0.00 0.00 59.36 58.86 1gxb h GLU 138 Cb 0.43 0.24 -0.12 0.00 -0.16 0.00 0.00 28.75 29.15 1gxb h GLU 138 CO -0.28 -0.70 0.56 -0.07 -1.18 0.00 0.00 179.01 177.34 1gxb h LEU 139 N -1.09 0.65 -1.24 1.64 3.38 -0.58 0.99 115.31 119.06 1gxb h LEU 139 Ca -0.09 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1gxb h LEU 139 Cb 0.89 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 1gxb h LEU 139 CO 0.06 0.16 0.42 0.58 0.09 0.00 0.00 178.44 179.76 1gxb h VAL 140 N 0.63 1.19 0.09 1.22 2.07 -1.17 0.39 116.25 120.66 1gxb h VAL 140 Ca 0.59 -0.42 -0.26 0.00 0.82 0.00 0.00 66.70 67.44 1gxb h VAL 140 Cb 1.04 0.21 0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1gxb h VAL 140 CO -0.44 0.20 -1.05 0.78 0.02 0.00 0.00 177.57 177.08 1gxb h ASN 141 N 0.96 0.78 0.82 0.57 2.35 -0.73 0.51 115.58 120.84 1gxb h ASN 141 Ca 0.25 -0.82 -0.08 0.00 -0.55 0.00 0.00 56.30 55.10 1gxb h ASN 141 Cb -0.04 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.07 1gxb h ASN 141 CO -0.05 1.51 -0.39 0.11 -1.65 0.00 0.00 177.43 176.96 1gxb h LYS 142 N 0.15 0.00 0.00 0.81 1.79 -0.54 -3.37 116.57 115.41 1gxb h LYS 142 Ca -0.16 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 1gxb h LYS 142 Cb 1.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.40 1gxb h LYS 142 CO 0.20 0.39 0.00 0.25 -1.08 0.00 0.00 179.45 179.22 1gxb n THR 143 N -3.56 0.00 -1.16 -0.16 -2.24 0.13 -5.03 114.28 102.26 1gxb n THR 143 Ca -0.00 -0.07 -0.05 0.00 -2.27 0.00 0.00 64.05 61.65 1gxb n THR 143 Cb 0.52 1.45 -0.02 0.00 -2.10 0.00 0.00 70.33 70.17 1gxb n THR 143 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1gxb n ASN 144 N -0.07 -3.99 -3.68 3.42 4.05 0.18 -4.91 115.26 110.25 1gxb n ASN 144 Ca 0.00 0.13 -0.14 0.00 0.45 0.00 0.00 54.58 55.02 1gxb n ASN 144 Cb 0.11 -1.97 -0.08 0.00 1.23 0.00 0.00 39.78 39.06 1gxb n ASN 144 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 1gxb s PHE 145 N -2.09 -0.50 -0.08 1.20 5.36 -1.25 0.03 117.98 120.65 1gxb s PHE 145 Ca 0.00 1.09 -0.24 0.00 -0.96 0.00 0.00 56.93 56.82 1gxb s PHE 145 Cb 0.00 0.21 0.05 0.00 -0.34 0.00 0.00 43.02 42.94 1gxb s PHE 145 CO 0.00 -0.36 0.55 0.54 -1.46 0.00 0.00 175.22 174.49 1gxb s VAL 146 N -0.34 0.02 -0.22 3.12 0.11 0.30 -3.97 120.40 119.42 1gxb s VAL 146 Ca -0.05 -0.13 -0.06 0.00 -2.93 0.00 0.00 61.98 58.81 1gxb s VAL 146 Cb -0.03 -0.84 -0.03 0.00 -1.53 0.00 0.00 36.38 33.95 1gxb s VAL 146 CO 0.03 -0.07 0.03 0.12 -3.33 0.00 0.00 175.10 171.88 1gxb s PHE 147 N -0.83 3.07 -0.50 1.54 5.36 -1.26 -1.42 117.98 123.93 1gxb s PHE 147 Ca -0.09 -0.44 -0.16 0.00 -0.96 0.00 0.00 56.93 55.28 1gxb s PHE 147 Cb -0.03 -2.16 0.09 0.00 -0.34 0.00 0.00 43.02 40.59 1gxb s PHE 147 CO 0.06 -0.29 0.46 -0.51 -1.46 0.00 0.00 175.22 173.48 1gxb s LEU 148 N 1.27 5.75 -0.39 6.12 1.43 0.98 -4.61 118.68 129.23 1gxb s LEU 148 Ca 0.04 -1.45 -0.29 0.00 -1.03 0.00 0.00 54.13 51.41 1gxb s LEU 148 Cb -0.15 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.86 1gxb s LEU 148 CO 0.02 -0.76 1.55 0.12 0.23 0.00 0.00 176.35 177.51 1gxb s PHE 149 N 1.75 2.19 0.27 0.29 5.99 -1.26 -1.78 117.98 125.43 1gxb s PHE 149 Ca 0.05 0.65 -0.05 0.00 0.00 0.00 0.00 56.93 57.57 1gxb s PHE 149 Cb -0.26 -4.25 0.51 0.00 0.00 0.00 0.00 43.02 39.02 1gxb s PHE 149 CO 0.06 -2.32 1.60 0.00 -0.00 0.00 0.00 175.22 174.55 1gxb h ALA 150 N 11.47 0.82 -0.03 11.12 0.00 -1.01 0.22 119.26 141.85 1gxb h ALA 150 Ca -0.30 0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1gxb h ALA 150 Cb 1.13 0.57 -0.00 0.00 0.00 0.00 0.00 17.79 19.48 1gxb h ALA 150 CO 1.07 -0.45 -0.02 1.96 0.00 0.00 0.00 179.25 181.81 1gxb h GLN 151 N 0.04 0.04 0.13 0.00 4.20 -1.85 -0.69 115.11 116.98 1gxb h GLN 151 Ca 0.47 -0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.87 1gxb h GLN 151 Cb 0.85 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.61 1gxb h GLN 151 CO -0.84 0.06 -1.57 -0.92 -0.67 0.00 0.00 178.83 174.90 1gxb h TYR 152 N 0.04 0.49 -0.00 2.96 3.20 -0.99 -3.30 116.97 119.37 1gxb h TYR 152 Ca 0.01 -0.36 0.00 0.00 3.14 0.00 0.00 58.73 61.52 1gxb h TYR 152 Cb 0.06 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.31 1gxb h TYR 152 CO 0.00 1.42 -0.45 0.66 -1.64 0.00 0.00 178.16 178.16 1gxb n TYR 153 N -3.47 0.00 -3.04 -3.82 4.02 -0.82 -4.16 117.16 105.87 1gxb n TYR 153 Ca -0.18 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.47 1gxb n TYR 153 Cb 1.05 -0.16 -0.04 0.00 -0.02 0.00 0.00 39.34 40.17 1gxb n TYR 153 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1gxb n HIS 154 N -1.08 2.91 0.26 -0.72 8.25 -0.28 -0.76 115.22 123.81 1gxb n HIS 154 Ca 0.08 -3.95 0.12 0.00 -0.26 0.00 0.00 57.72 53.71 1gxb n HIS 154 Cb 0.35 -0.47 0.72 0.00 1.12 0.00 0.00 29.99 31.70 1gxb n HIS 154 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1gxb h PRO 155 N 3.08 0.00 -0.07 -0.41 0.13 -1.72 -2.19 132.00 130.82 1gxb h PRO 155 Ca 0.12 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.24 1gxb h PRO 155 Cb 0.64 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.77 1gxb h PRO 155 CO 0.73 0.11 -0.04 0.00 -0.23 0.00 0.00 178.00 178.57 1gxb h ALA 156 N 1.89 1.81 -0.90 -0.56 0.00 -1.89 -2.81 119.26 116.80 1gxb h ALA 156 Ca -0.00 -0.08 0.24 0.00 0.00 0.00 0.00 54.91 55.07 1gxb h ALA 156 Cb 0.27 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 1gxb h ALA 156 CO 0.01 0.15 0.63 0.52 0.00 0.00 0.00 179.25 180.56 1gxb h MET 157 N 0.10 0.11 -1.22 0.00 2.86 -1.65 -2.51 114.93 112.61 1gxb h MET 157 Ca 0.02 -0.01 0.35 0.00 -2.06 0.00 0.00 59.70 58.01 1gxb h MET 157 Cb 0.14 -0.03 -0.08 0.00 0.06 0.00 0.00 31.60 31.70 1gxb h MET 157 CO 0.01 0.07 0.84 1.57 1.06 0.00 0.00 176.91 180.46 1gxb h LYS 158 N 0.11 0.13 0.00 1.72 2.10 -1.70 0.87 116.57 119.81 1gxb h LYS 158 Ca 0.44 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 1gxb h LYS 158 Cb 1.56 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.86 1gxb h LYS 158 CO -0.06 0.08 0.00 0.09 -2.00 0.00 0.00 179.45 177.56 1gxb n ASN 159 N -4.37 0.65 -0.17 7.07 3.02 -0.95 -1.97 115.26 118.54 1gxb n ASN 159 Ca 0.29 0.71 0.04 0.00 -0.03 0.00 0.00 54.58 55.59 1gxb n ASN 159 Cb 1.22 -0.83 -0.00 0.00 -0.61 0.00 0.00 39.78 39.56 1gxb n ASN 159 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1gxb n VAL 160 N -2.27 0.00 0.09 2.41 0.31 0.28 -4.74 118.33 114.40 1gxb n VAL 160 Ca 0.01 -0.41 -0.13 0.00 -0.01 0.00 0.00 64.34 63.79 1gxb n VAL 160 Cb 0.15 1.09 -0.08 0.00 -0.91 0.00 0.00 33.84 34.09 1gxb n VAL 160 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1gxb h ALA 161 N 1.36 -0.92 -0.69 3.52 0.00 -1.18 -0.54 119.26 120.81 1gxb h ALA 161 Ca 0.00 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 54.97 1gxb h ALA 161 Cb 0.26 0.83 -0.11 0.00 0.00 0.00 0.00 17.79 18.77 1gxb h ALA 161 CO 0.00 -1.03 0.06 -0.97 0.00 0.00 0.00 179.25 177.32 1gxb h ASN 162 N -0.61 -0.19 0.24 0.00 -0.00 -1.85 0.30 115.58 113.46 1gxb h ASN 162 Ca -0.00 0.16 -0.01 0.00 -0.00 0.00 0.00 56.30 56.45 1gxb h ASN 162 Cb 0.62 0.26 0.00 0.00 -0.00 0.00 0.00 38.32 39.21 1gxb h ASN 162 CO -0.25 -0.10 -0.11 0.58 -0.00 0.00 0.00 177.43 177.55 1gxb h VAL 163 N 0.17 0.81 -0.45 2.57 2.07 -1.82 0.99 116.25 120.59 1gxb h VAL 163 Ca 0.38 -0.30 0.07 0.00 0.82 0.00 0.00 66.70 67.67 1gxb h VAL 163 Cb 0.64 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.34 1gxb h VAL 163 CO -0.55 0.07 0.09 0.03 0.02 0.00 0.00 177.57 177.22 1gxb h ARG 164 N -0.47 0.22 0.20 1.57 3.08 -0.14 0.15 114.38 118.99 1gxb h ARG 164 Ca -0.03 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 1gxb h ARG 164 Cb 0.35 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1gxb h ARG 164 CO 0.05 0.14 -0.10 -0.22 -1.07 0.00 0.00 179.97 178.78 1gxb h LYS 165 N 0.22 -0.26 -0.61 0.04 3.64 -0.34 -1.76 116.57 117.50 1gxb h LYS 165 Ca 0.22 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.64 1gxb h LYS 165 Cb 0.28 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.12 1gxb h LYS 165 CO -0.29 -0.07 0.38 1.15 -2.27 0.00 0.00 179.45 178.36 1gxb h THR 166 N -0.42 1.09 -0.19 1.00 2.02 -0.46 -2.75 112.91 113.20 1gxb h THR 166 Ca -0.03 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 1gxb h THR 166 Cb 0.32 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1gxb h THR 166 CO 0.05 0.14 0.11 -0.07 0.37 0.00 0.00 175.52 176.12 1gxb h LEU 167 N 0.76 0.23 -1.41 2.58 3.38 -0.69 -3.47 115.31 116.69 1gxb h LEU 167 Ca 0.24 -0.06 -0.30 0.00 0.09 0.00 0.00 57.88 57.85 1gxb h LEU 167 Cb -0.00 -0.06 0.13 0.00 0.09 0.00 0.00 40.66 40.82 1gxb h LEU 167 CO -0.09 0.22 -0.62 0.61 0.09 0.00 0.00 178.44 178.64 1gxb n GLY 168 N -1.01 -0.27 3.52 0.83 0.00 -0.67 -5.02 105.19 102.57 1gxb n GLY 168 Ca -0.04 0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1gxb n GLY 168 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1gxb s ILE 169 N -3.29 0.01 -0.10 -0.61 -4.36 -1.26 -5.13 121.20 106.45 1gxb s ILE 169 Ca 0.18 -1.44 -0.30 0.00 -0.26 0.00 0.00 60.65 58.84 1gxb s ILE 169 Cb -0.08 -2.16 -0.03 0.00 1.25 0.00 0.00 42.46 41.44 1gxb s ILE 169 CO 0.62 -0.04 1.39 -0.13 0.24 0.00 0.00 174.94 177.02 1gxb s ARG 170 N -4.02 4.23 0.42 0.37 1.81 -1.26 -5.01 118.95 115.49 1gxb s ARG 170 Ca 0.23 1.86 0.02 0.00 -1.72 0.00 0.00 55.73 56.11 1gxb s ARG 170 Cb 0.01 -3.78 0.02 0.00 -0.45 0.00 0.00 34.95 30.74 1gxb s ARG 170 CO 0.08 -0.71 0.15 0.25 -0.68 0.00 0.00 175.30 174.39 1gxb n THR 171 N 5.24 0.00 0.24 0.02 -2.24 -1.26 -4.94 114.28 111.35 1gxb n THR 171 Ca 0.15 -1.83 0.08 0.00 -2.27 0.00 0.00 64.05 60.18 1gxb n THR 171 Cb 0.44 0.15 0.60 0.00 -2.10 0.00 0.00 70.33 69.42 1gxb n THR 171 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1gxb h ILE 172 N 0.94 0.89 0.00 2.28 2.10 -1.95 -2.70 117.51 119.08 1gxb h ILE 172 Ca -0.31 -0.59 -0.04 0.00 1.08 0.00 0.00 64.86 65.00 1gxb h ILE 172 Cb 1.01 1.34 -0.01 0.00 -1.09 0.00 0.00 36.82 38.08 1gxb h ILE 172 CO 0.50 0.16 -0.20 -0.26 -1.08 0.00 0.00 178.15 177.26 1gxb h PHE 173 N 0.00 0.00 0.00 2.19 -1.00 -1.99 -2.61 116.94 113.53 1gxb h PHE 173 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1gxb h PHE 173 Cb 0.33 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.89 1gxb h PHE 173 CO 0.00 0.20 0.00 -0.91 -1.61 0.00 0.00 178.31 175.99 1gxb h ASN 174 N 0.00 0.00 -0.26 2.17 2.35 -1.85 -2.27 115.58 115.73 1gxb h ASN 174 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1gxb h ASN 174 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1gxb h ASN 174 CO 0.03 0.00 0.00 2.30 -1.65 0.00 0.00 177.43 178.11 1gxb n ILE 175 N -3.04 2.13 -0.10 2.81 -5.35 -0.98 -4.55 119.36 110.27 1gxb n ILE 175 Ca -0.01 -1.80 -0.11 0.00 -0.27 0.00 0.00 62.75 60.55 1gxb n ILE 175 Cb 0.17 -0.17 -0.13 0.00 -1.74 0.00 0.00 39.64 37.77 1gxb n ILE 175 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1gxb n LEU 176 N -0.44 1.05 -0.06 7.28 4.77 -0.85 -4.70 117.00 124.04 1gxb n LEU 176 Ca 0.20 -0.04 -0.02 0.00 -0.03 0.00 0.00 56.01 56.12 1gxb n LEU 176 Cb 0.83 0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.91 1gxb n LEU 176 CO 0.14 0.60 0.32 0.61 -1.33 0.00 0.00 177.39 177.72 1gxb n GLY 177 N 2.07 -1.93 0.31 -0.72 0.00 -1.25 -0.21 105.19 103.46 1gxb n GLY 177 Ca -0.33 0.46 0.18 0.00 0.00 0.00 0.00 46.02 46.33 1gxb n GLY 177 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gxb h PRO 178 N 0.00 0.00 -0.20 1.61 0.13 -1.88 -0.22 132.00 131.45 1gxb h PRO 178 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1gxb h PRO 178 Cb 0.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.19 1gxb h PRO 178 CO -0.14 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 178.91 1gxb n LEU 179 N -2.88 2.46 -2.33 1.56 4.77 0.70 -4.27 117.00 117.02 1gxb n LEU 179 Ca -0.02 -0.98 -0.17 0.00 -0.03 0.00 0.00 56.01 54.80 1gxb n LEU 179 Cb 0.18 -0.12 0.03 0.00 -2.33 0.00 0.00 43.42 41.17 1gxb n LEU 179 CO 0.16 0.49 0.11 0.35 -1.33 0.00 0.00 177.39 177.18 1gxb n THR 180 N 0.86 2.09 -1.68 -5.08 -2.24 -0.09 -4.97 114.28 103.16 1gxb n THR 180 Ca 0.17 -3.87 -0.42 0.00 -2.27 0.00 0.00 64.05 57.66 1gxb n THR 180 Cb 0.47 -0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 68.29 1gxb n THR 180 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1gxb s ASN 181 N -3.63 6.04 0.08 3.42 2.47 -1.25 -4.85 114.94 117.22 1gxb s ASN 181 Ca 0.43 2.27 0.04 0.00 0.42 0.00 0.00 52.86 56.02 1gxb s ASN 181 Cb 0.39 -2.52 0.21 0.00 -1.45 0.00 0.00 41.25 37.87 1gxb s ASN 181 CO -0.01 -1.44 1.01 -2.65 -3.72 0.00 0.00 177.10 170.30 1gxb n PRO 182 N 8.04 0.03 0.00 0.43 -0.02 -1.26 0.24 135.00 142.46 1gxb n PRO 182 Ca 0.24 0.43 0.10 0.00 -2.02 0.00 0.00 63.50 62.25 1gxb n PRO 182 Cb 0.43 -1.72 0.05 0.00 -0.02 0.00 0.00 33.50 32.25 1gxb n PRO 182 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gxb n ALA 183 N -1.44 2.78 -1.13 3.55 0.00 -1.26 -0.30 120.51 122.71 1gxb n ALA 183 Ca -0.00 -0.64 -0.05 0.00 0.00 0.00 0.00 53.44 52.75 1gxb n ALA 183 Cb 0.14 -0.68 -0.02 0.00 0.00 0.00 0.00 19.45 18.88 1gxb n ALA 183 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1gxb n ASN 184 N 0.72 -4.70 -2.17 0.00 4.05 0.14 -2.53 115.26 110.77 1gxb n ASN 184 Ca 0.11 0.11 -0.29 0.00 0.45 0.00 0.00 54.58 54.96 1gxb n ASN 184 Cb 0.47 -2.61 -0.04 0.00 1.23 0.00 0.00 39.78 38.83 1gxb n ASN 184 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1gxb n ALA 185 N 1.09 -1.53 0.11 5.20 0.00 -1.26 -4.60 120.51 119.52 1gxb n ALA 185 Ca -0.05 0.27 0.10 0.00 0.00 0.00 0.00 53.44 53.76 1gxb n ALA 185 Cb 0.34 -0.86 0.02 0.00 0.00 0.00 0.00 19.45 18.95 1gxb n ALA 185 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1gxb h LYS 186 N 1.75 0.00 -6.30 0.00 1.79 -1.27 -3.46 116.57 109.09 1gxb h LYS 186 Ca -0.23 0.00 -0.68 0.00 -2.18 0.00 0.00 60.65 57.56 1gxb h LYS 186 Cb 0.67 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 31.14 1gxb h LYS 186 CO 0.36 0.05 -0.71 0.71 -1.08 0.00 0.00 179.45 178.78 1gxb s TYR 187 N -3.27 2.86 -0.28 -1.35 1.51 -1.19 -2.17 117.35 113.46 1gxb s TYR 187 Ca 0.00 -0.05 -0.23 0.00 -1.01 0.00 0.00 57.07 55.79 1gxb s TYR 187 Cb 0.09 -1.61 0.09 0.00 -0.11 0.00 0.00 41.96 40.42 1gxb s TYR 187 CO 0.77 0.35 0.81 -1.14 -1.11 0.00 0.00 175.55 175.24 1gxb s GLN 188 N -1.33 0.69 -0.25 -0.62 2.00 -0.87 -2.56 119.66 116.72 1gxb s GLN 188 Ca 0.16 0.91 -0.04 0.00 -2.00 0.00 0.00 55.36 54.40 1gxb s GLN 188 Cb -0.11 0.29 0.01 0.00 0.80 0.00 0.00 33.01 34.00 1gxb s GLN 188 CO 0.06 -0.10 -0.01 -1.17 -0.50 0.00 0.00 175.29 173.57 1gxb s LEU 189 N 0.67 3.26 -0.16 3.68 2.96 0.05 -0.46 118.68 128.68 1gxb s LEU 189 Ca -0.02 -0.64 0.02 0.00 -0.22 0.00 0.00 54.13 53.27 1gxb s LEU 189 Cb -0.05 -1.75 0.02 0.00 0.50 0.00 0.00 46.19 44.90 1gxb s LEU 189 CO -0.06 -0.10 -0.20 -0.32 -1.32 0.00 0.00 176.35 174.34 1gxb s MET 190 N 1.43 2.90 -0.24 1.98 -2.45 0.15 0.29 119.30 123.36 1gxb s MET 190 Ca 0.03 -0.80 -0.09 0.00 -1.25 0.00 0.00 55.69 53.58 1gxb s MET 190 Cb -0.16 -2.43 -0.04 0.00 1.25 0.00 0.00 34.83 33.45 1gxb s MET 190 CO -0.02 -0.12 0.11 0.20 1.05 0.00 0.00 175.02 176.24 1gxb s GLY 191 N 1.07 1.86 0.05 2.11 0.00 -0.20 0.11 107.32 112.32 1gxb s GLY 191 Ca -0.01 -1.03 -0.06 0.00 0.00 0.00 0.00 44.72 43.62 1gxb s GLY 191 CO -0.07 0.46 0.31 -1.34 0.00 0.00 0.00 173.10 172.46 1gxb s VAL 192 N 1.37 5.24 -0.73 1.40 -7.23 0.13 0.46 120.40 121.05 1gxb s VAL 192 Ca 0.06 0.16 0.21 0.00 -1.81 0.00 0.00 61.98 60.61 1gxb s VAL 192 Cb -0.15 -3.60 0.21 0.00 0.56 0.00 0.00 36.38 33.40 1gxb s VAL 192 CO 0.05 0.27 1.66 0.33 -0.31 0.00 0.00 175.10 177.10 1gxb n PHE 193 N 0.83 0.49 -3.76 2.82 7.35 -1.26 -3.97 117.46 119.96 1gxb n PHE 193 Ca -0.08 0.18 -0.13 0.00 -0.76 0.00 0.00 57.45 56.66 1gxb n PHE 193 Cb 0.52 -0.79 -0.09 0.00 0.35 0.00 0.00 39.48 39.47 1gxb n PHE 193 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 1gxb s SER 194 N -3.76 -0.25 0.56 -2.13 1.04 -1.26 -4.57 113.70 103.32 1gxb s SER 194 Ca 0.07 0.30 0.33 0.00 0.48 0.00 0.00 55.95 57.13 1gxb s SER 194 Cb 0.11 0.45 1.48 0.00 0.10 0.00 0.00 66.02 68.16 1gxb s SER 194 CO 0.39 -0.32 1.81 0.11 0.98 0.00 0.00 173.24 176.21 1gxb h LYS 195 N 4.54 0.00 0.00 4.02 1.57 -1.95 -2.90 116.57 121.84 1gxb h LYS 195 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1gxb h LYS 195 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1gxb h LYS 195 CO 0.36 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.99 1gxb n ASP 196 N -4.04 0.00 -0.35 0.86 10.43 -1.26 -3.34 116.55 118.86 1gxb n ASP 196 Ca 0.20 0.31 0.29 0.00 2.57 0.00 0.00 54.79 58.16 1gxb n ASP 196 Cb 1.08 0.00 0.48 0.00 1.84 0.00 0.00 41.12 44.51 1gxb n ASP 196 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 1gxb n HIS 197 N -0.35 0.38 -0.37 1.24 8.25 -1.14 -0.43 115.22 122.81 1gxb n HIS 197 Ca 0.00 0.39 0.01 0.00 -0.26 0.00 0.00 57.72 57.85 1gxb n HIS 197 Cb 0.00 -0.77 0.07 0.00 1.12 0.00 0.00 29.99 30.41 1gxb n HIS 197 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1gxb h LEU 198 N 0.00 -1.27 0.30 2.41 5.85 -1.51 0.61 115.31 121.70 1gxb h LEU 198 Ca 0.60 0.30 -0.01 0.00 0.84 0.00 0.00 57.88 59.61 1gxb h LEU 198 Cb 2.04 0.70 0.00 0.00 0.37 0.00 0.00 40.66 43.77 1gxb h LEU 198 CO -0.26 -0.30 -0.15 -0.78 -0.34 0.00 0.00 178.44 176.62 1gxb h ASP 199 N -0.01 -0.35 -0.30 1.25 1.82 -0.88 -2.35 116.42 115.61 1gxb h ASP 199 Ca 0.38 -0.18 0.03 0.00 -0.39 0.00 0.00 57.03 56.86 1gxb h ASP 199 Cb 0.63 0.09 -0.04 0.00 0.68 0.00 0.00 39.33 40.69 1gxb h ASP 199 CO -0.98 0.11 -0.25 0.25 -1.61 0.00 0.00 179.24 176.76 1gxb h LEU 200 N -0.93 -0.88 -1.96 2.28 5.85 -1.32 -0.66 115.31 117.69 1gxb h LEU 200 Ca -0.04 0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.85 1gxb h LEU 200 Cb 0.51 0.38 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 1gxb h LEU 200 CO 0.07 -0.14 0.14 -0.07 -0.34 0.00 0.00 178.44 178.09 1gxb h LEU 201 N -0.10 0.05 0.17 2.25 3.38 0.05 -0.22 115.31 120.89 1gxb h LEU 201 Ca 0.05 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1gxb h LEU 201 Cb 0.23 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1gxb h LEU 201 CO -0.33 0.03 -0.08 0.77 0.09 0.00 0.00 178.44 178.92 1gxb h SER 202 N 0.06 -0.19 -0.91 -0.43 4.64 -0.63 0.28 113.55 116.37 1gxb h SER 202 Ca 0.09 -0.23 0.05 0.00 -0.47 0.00 0.00 61.79 61.23 1gxb h SER 202 Cb 0.29 0.05 -0.06 0.00 -0.31 0.00 0.00 62.40 62.37 1gxb h SER 202 CO -0.01 0.14 0.60 0.11 -0.87 0.00 0.00 176.83 176.80 1gxb h LYS 203 N -0.54 1.07 -0.02 4.77 1.57 -0.58 0.49 116.57 123.33 1gxb h LYS 203 Ca -0.02 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1gxb h LYS 203 Cb 0.41 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.48 1gxb h LYS 203 CO 0.04 0.71 0.01 0.77 -0.57 0.00 0.00 179.45 180.41 1gxb h SER 204 N 1.10 0.03 -0.44 0.86 0.02 -0.86 -2.74 113.55 111.52 1gxb h SER 204 Ca 0.38 -0.13 0.02 0.00 -0.84 0.00 0.00 61.79 61.21 1gxb h SER 204 Cb 0.09 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 1gxb h SER 204 CO -0.13 0.16 0.29 0.00 -1.14 0.00 0.00 176.83 176.01 1gxb h ALA 205 N 0.88 1.76 -0.00 3.77 0.00 0.49 -1.87 119.26 124.29 1gxb h ALA 205 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1gxb h ALA 205 Cb 0.13 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1gxb h ALA 205 CO -0.00 0.20 0.20 -0.92 0.00 0.00 0.00 179.25 178.73 1gxb h TYR 206 N 0.53 0.00 -0.10 0.00 3.20 -0.61 -0.24 116.97 119.75 1gxb h TYR 206 Ca 0.17 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.04 1gxb h TYR 206 Cb 0.04 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.31 1gxb h TYR 206 CO -0.00 0.00 0.00 0.39 -1.64 0.00 0.00 178.16 176.91 1gxb n GLU 207 N -2.97 1.21 -0.29 1.82 1.02 -0.71 -4.42 120.64 116.31 1gxb n GLU 207 Ca -0.02 -1.45 0.08 0.00 -0.02 0.00 0.00 57.16 55.75 1gxb n GLU 207 Cb 0.26 -1.26 0.23 0.00 -0.02 0.00 0.00 31.44 30.65 1gxb n GLU 207 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1gxb n LEU 208 N 0.71 2.87 -2.64 -4.62 7.99 -0.10 -4.99 117.00 116.22 1gxb n LEU 208 Ca 0.09 -1.44 -0.04 0.00 -0.01 0.00 0.00 56.01 54.61 1gxb n LEU 208 Cb 0.35 -0.37 0.01 0.00 -0.11 0.00 0.00 43.42 43.30 1gxb n LEU 208 CO 0.08 0.67 -0.15 -0.67 -1.51 0.00 0.00 177.39 175.81 1gxb n ASP 209 N 0.95 -7.30 -4.21 -1.43 2.03 -1.25 -5.06 116.55 100.27 1gxb n ASP 209 Ca 0.17 0.80 -0.22 0.00 0.52 0.00 0.00 54.79 56.07 1gxb n ASP 209 Cb 0.47 -4.87 -0.13 0.00 -0.72 0.00 0.00 41.12 35.87 1gxb n ASP 209 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1gxb s PHE 210 N -2.03 1.48 -0.07 -0.67 0.40 -1.26 -4.99 117.98 110.85 1gxb s PHE 210 Ca 0.13 -0.40 -0.22 0.00 -0.60 0.00 0.00 56.93 55.84 1gxb s PHE 210 Cb -0.04 -0.85 -0.17 0.00 0.51 0.00 0.00 43.02 42.48 1gxb s PHE 210 CO 0.69 0.10 0.85 -0.91 0.70 0.00 0.00 175.22 176.64 1gxb h ASN 211 N 4.51 -0.11 -2.49 1.36 4.21 -1.76 -3.35 115.58 117.94 1gxb h ASN 211 Ca -0.42 -0.46 0.03 0.00 1.21 0.00 0.00 56.30 56.66 1gxb h ASN 211 Cb 1.18 0.03 -0.21 0.00 -1.12 0.00 0.00 38.32 38.19 1gxb h ASN 211 CO 0.42 0.51 -0.11 -0.75 -1.29 0.00 0.00 177.43 176.21 1gxb s LYS 212 N -3.18 0.59 -0.03 0.81 2.20 -1.05 -3.96 119.74 115.12 1gxb s LYS 212 Ca -0.13 1.29 0.01 0.00 -0.36 0.00 0.00 55.97 56.78 1gxb s LYS 212 Cb -0.00 0.50 0.02 0.00 -1.51 0.00 0.00 37.83 36.83 1gxb s LYS 212 CO 0.51 -0.18 -0.05 -1.50 -0.36 0.00 0.00 175.35 173.76 1gxb s ILE 213 N 2.31 0.57 -0.26 5.43 2.07 -0.77 -2.05 121.20 128.50 1gxb s ILE 213 Ca -0.07 -0.18 -0.02 0.00 -1.41 0.00 0.00 60.65 58.97 1gxb s ILE 213 Cb -0.09 -0.56 0.03 0.00 0.13 0.00 0.00 42.46 41.97 1gxb s ILE 213 CO -0.18 0.21 -0.05 -0.63 -1.91 0.00 0.00 174.94 172.38 1gxb s ILE 214 N 0.63 2.91 0.10 2.00 1.01 0.39 -1.26 121.20 126.98 1gxb s ILE 214 Ca -0.09 -1.07 -0.16 0.00 0.00 0.00 0.00 60.65 59.34 1gxb s ILE 214 Cb -0.12 -2.50 -0.07 0.00 0.01 0.00 0.00 42.46 39.78 1gxb s ILE 214 CO 0.00 0.16 0.54 -0.76 0.00 0.00 0.00 174.94 174.88 1gxb s LEU 215 N 1.32 4.42 -0.01 2.97 1.02 -0.60 0.29 118.68 128.09 1gxb s LEU 215 Ca -0.01 1.12 -0.07 0.00 0.02 0.00 0.00 54.13 55.20 1gxb s LEU 215 Cb -0.17 -3.06 0.00 0.00 0.02 0.00 0.00 46.19 42.99 1gxb s LEU 215 CO -0.04 0.19 0.14 0.68 0.02 0.00 0.00 176.35 177.34 1gxb s VAL 216 N -1.30 0.06 -0.06 -1.59 -7.23 0.12 -0.97 120.40 109.43 1gxb s VAL 216 Ca 0.33 -0.53 0.00 0.00 -1.81 0.00 0.00 61.98 59.97 1gxb s VAL 216 Cb -0.17 -0.38 0.02 0.00 0.56 0.00 0.00 36.38 36.42 1gxb s VAL 216 CO 0.18 -0.29 -0.03 -0.47 -0.31 0.00 0.00 175.10 174.18 1gxb s TYR 217 N -1.03 0.77 0.04 2.82 5.04 0.54 0.20 117.35 125.72 1gxb s TYR 217 Ca -0.11 -0.23 0.08 0.00 -2.44 0.00 0.00 57.07 54.37 1gxb s TYR 217 Cb -0.06 -0.74 -0.03 0.00 0.35 0.00 0.00 41.96 41.48 1gxb s TYR 217 CO 0.01 -0.25 -0.24 0.20 -1.34 0.00 0.00 175.55 173.92 1gxb s GLY 218 N 1.29 1.29 0.57 8.97 0.00 -0.60 -0.20 107.32 118.63 1gxb s GLY 218 Ca -0.05 -1.18 -0.19 0.00 0.00 0.00 0.00 44.72 43.30 1gxb s GLY 218 CO -0.02 -1.07 1.16 -0.54 0.00 0.00 0.00 173.10 172.62 1gxb s GLU 219 N -1.16 3.18 -0.03 2.90 2.02 -0.77 0.45 118.70 125.29 1gxb s GLU 219 Ca 0.10 1.67 0.01 0.00 0.02 0.00 0.00 54.97 56.78 1gxb s GLU 219 Cb -0.10 -1.97 0.08 0.00 0.10 0.00 0.00 34.13 32.24 1gxb s GLU 219 CO 0.02 -1.00 0.66 -0.35 0.02 0.00 0.00 175.26 174.61 1gxb n PRO 220 N -1.47 1.38 0.00 0.39 -0.04 -1.26 -4.46 135.00 129.55 1gxb n PRO 220 Ca 0.12 -0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 1gxb n PRO 220 Cb 0.51 -1.55 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 1gxb n PRO 220 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1gxb n GLY 221 N 0.08 0.46 3.01 0.55 0.00 0.10 -5.15 105.19 104.24 1gxb n GLY 221 Ca 0.03 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 1gxb n GLY 221 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1gxb s ILE 222 N 0.00 0.13 0.00 -0.61 -4.36 0.17 -4.70 121.20 111.83 1gxb s ILE 222 Ca 0.00 -1.07 0.00 0.00 -0.26 0.00 0.00 60.65 59.32 1gxb s ILE 222 Cb 0.00 -0.53 0.00 0.00 1.25 0.00 0.00 42.46 43.18 1gxb s ILE 222 CO 0.00 -0.59 1.71 -0.90 0.24 0.00 0.00 174.94 175.40 1gxb n ASP 223 N 1.28 4.60 -3.53 4.36 5.75 -1.25 -1.56 116.55 126.19 1gxb n ASP 223 Ca -0.22 -2.22 -0.11 0.00 -0.01 0.00 0.00 54.79 52.23 1gxb n ASP 223 Cb 0.56 -0.96 -0.04 0.00 -1.03 0.00 0.00 41.12 39.65 1gxb n ASP 223 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1gxb s GLU 224 N 0.21 1.80 0.13 0.11 8.01 -1.26 -3.98 118.70 123.72 1gxb s GLU 224 Ca 0.00 -1.49 -0.31 0.00 0.01 0.00 0.00 54.97 53.18 1gxb s GLU 224 Cb 0.00 0.48 -0.08 0.00 -4.31 0.00 0.00 34.13 30.22 1gxb s GLU 224 CO 0.00 -0.77 1.40 0.08 0.01 0.00 0.00 175.26 175.99 1gxb s VAL 225 N -3.37 3.23 0.02 2.63 1.01 -1.26 -2.27 120.40 120.40 1gxb s VAL 225 Ca 0.25 0.89 -0.30 0.00 0.00 0.00 0.00 61.98 62.82 1gxb s VAL 225 Cb -0.01 -3.57 -0.08 0.00 0.00 0.00 0.00 36.38 32.72 1gxb s VAL 225 CO 0.14 0.07 1.87 -0.55 0.00 0.00 0.00 175.10 176.63 1gxb s SER 226 N 1.04 6.50 0.01 3.32 0.15 -1.26 -4.88 113.70 118.58 1gxb s SER 226 Ca 0.64 2.57 0.26 0.00 0.70 0.00 0.00 55.95 60.13 1gxb s SER 226 Cb -0.37 -2.54 0.74 0.00 -1.71 0.00 0.00 66.02 62.14 1gxb s SER 226 CO 0.31 -1.01 1.58 -0.81 1.20 0.00 0.00 173.24 174.51 1gxb n PRO 227 N 7.19 0.01 -0.03 5.44 -0.04 -1.26 -4.16 135.00 142.15 1gxb n PRO 227 Ca 0.19 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.63 1gxb n PRO 227 Cb 0.41 -1.51 -0.06 0.00 -0.04 0.00 0.00 33.50 32.30 1gxb n PRO 227 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1gxb n ILE 228 N -1.52 0.42 0.00 0.52 -5.35 -1.26 -0.51 119.36 111.66 1gxb n ILE 228 Ca 0.06 -0.29 0.00 0.00 -0.27 0.00 0.00 62.75 62.25 1gxb n ILE 228 Cb 0.34 -0.60 0.00 0.00 -1.74 0.00 0.00 39.64 37.64 1gxb n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1gxb n GLY 229 N 2.45 2.90 3.75 3.28 0.00 -1.26 -4.76 105.19 111.55 1gxb n GLY 229 Ca -0.10 0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 1gxb n GLY 229 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gxb s ASN 230 N 1.89 7.45 -0.08 1.61 0.01 -1.26 -0.88 114.94 123.69 1gxb s ASN 230 Ca 0.00 2.11 0.04 0.00 -0.71 0.00 0.00 52.86 54.31 1gxb s ASN 230 Cb 0.00 -2.62 -0.00 0.00 0.41 0.00 0.00 41.25 39.04 1gxb s ASN 230 CO 0.00 0.00 -0.21 -0.89 -1.51 0.00 0.00 177.10 174.49 1gxb s THR 231 N -1.17 1.83 -0.18 1.60 2.01 0.23 -1.85 115.64 118.11 1gxb s THR 231 Ca 0.43 -0.90 -0.03 0.00 0.31 0.00 0.00 61.69 61.50 1gxb s THR 231 Cb -0.29 -1.58 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 1gxb s THR 231 CO 0.37 0.51 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.38 1gxb s PHE 232 N 0.24 2.94 0.09 4.92 0.40 0.72 -0.95 117.98 126.33 1gxb s PHE 232 Ca -0.13 -0.65 0.05 0.00 -0.60 0.00 0.00 56.93 55.61 1gxb s PHE 232 Cb -0.16 -1.99 -0.03 0.00 0.51 0.00 0.00 43.02 41.35 1gxb s PHE 232 CO 0.06 -0.29 -0.14 0.00 0.70 0.00 0.00 175.22 175.55 1gxb s MET 233 N 0.83 0.89 -0.18 0.44 0.23 -0.88 -0.34 119.30 120.28 1gxb s MET 233 Ca -0.02 -1.06 0.01 0.00 -1.03 0.00 0.00 55.69 53.60 1gxb s MET 233 Cb -0.15 -0.86 0.03 0.00 -1.53 0.00 0.00 34.83 32.32 1gxb s MET 233 CO 0.01 0.18 -0.17 0.15 -2.03 0.00 0.00 175.02 173.17 1gxb s LYS 234 N -2.07 2.67 -0.38 3.16 -0.14 -0.14 -1.38 119.74 121.45 1gxb s LYS 234 Ca 0.02 -0.83 -0.17 0.00 -1.36 0.00 0.00 55.97 53.63 1gxb s LYS 234 Cb -0.08 -2.50 0.01 0.00 -1.68 0.00 0.00 37.83 33.58 1gxb s LYS 234 CO 0.02 -0.28 0.43 0.42 -0.76 0.00 0.00 175.35 175.19 1gxb s ILE 235 N 1.32 5.09 -0.16 2.17 1.01 0.16 -1.56 121.20 129.24 1gxb s ILE 235 Ca 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.53 1gxb s ILE 235 Cb -0.14 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1gxb s ILE 235 CO -0.11 -0.29 0.04 -0.69 0.00 0.00 0.00 174.94 173.89 1gxb s VAL 236 N 2.17 4.62 0.28 2.92 1.01 -0.39 -0.75 120.40 130.27 1gxb s VAL 236 Ca 0.13 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.02 1gxb s VAL 236 Cb -0.16 -3.05 -0.00 0.00 0.00 0.00 0.00 36.38 33.16 1gxb s VAL 236 CO 0.13 0.50 0.35 -1.54 0.00 0.00 0.00 175.10 174.54 1gxb n SER 237 N 3.23 -0.95 0.29 3.32 3.41 -0.13 -1.86 113.62 120.94 1gxb n SER 237 Ca -0.17 -2.63 0.16 0.00 -0.26 0.00 0.00 58.87 55.97 1gxb n SER 237 Cb 0.53 1.86 0.91 0.00 -0.26 0.00 0.00 64.21 67.25 1gxb n SER 237 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1gxb h LYS 238 N 0.00 0.00 -0.45 4.33 1.79 -1.69 -2.70 116.57 117.84 1gxb h LYS 238 Ca -0.21 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.11 1gxb h LYS 238 Cb 0.98 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.54 1gxb h LYS 238 CO 0.30 0.03 0.08 2.89 -1.08 0.00 0.00 179.45 181.67 1gxb n ARG 239 N -3.63 2.64 0.00 3.15 0.00 -1.26 -5.08 116.66 112.47 1gxb n ARG 239 Ca -0.03 -3.03 0.00 0.00 -0.00 0.00 0.00 57.85 54.79 1gxb n ARG 239 Cb 0.13 -1.94 0.00 0.00 -0.00 0.00 0.00 32.46 30.65 1gxb n ARG 239 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1gxb n GLY 240 N -0.72 0.73 3.07 2.89 0.00 -1.02 -5.05 105.19 105.10 1gxb n GLY 240 Ca 0.33 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 1gxb n GLY 240 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gxb s ILE 241 N -0.90 1.72 -0.14 -0.61 1.01 -1.26 -0.95 121.20 120.07 1gxb s ILE 241 Ca 0.00 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.88 1gxb s ILE 241 Cb 0.00 -1.57 -0.02 0.00 0.01 0.00 0.00 42.46 40.87 1gxb s ILE 241 CO 0.00 0.48 -0.07 -0.70 0.00 0.00 0.00 174.94 174.65 1gxb s GLU 242 N 1.19 3.48 0.19 2.79 2.12 0.07 -4.91 118.70 123.63 1gxb s GLU 242 Ca -0.00 -0.57 -0.19 0.00 0.36 0.00 0.00 54.97 54.56 1gxb s GLU 242 Cb -0.14 -2.79 -0.08 0.00 0.26 0.00 0.00 34.13 31.38 1gxb s GLU 242 CO -0.07 0.28 0.69 -1.21 -0.54 0.00 0.00 175.26 174.41 1gxb s GLU 243 N 0.23 4.24 -0.25 4.30 8.01 -1.26 -0.66 118.70 133.30 1gxb s GLU 243 Ca -0.05 0.83 -0.02 0.00 0.01 0.00 0.00 54.97 55.75 1gxb s GLU 243 Cb -0.14 -2.97 0.13 0.00 -4.31 0.00 0.00 34.13 26.84 1gxb s GLU 243 CO 0.04 0.45 0.35 0.08 0.01 0.00 0.00 175.26 176.19 1gxb s VAL 244 N -1.43 -0.55 0.33 2.63 1.01 -0.48 -4.96 120.40 116.95 1gxb s VAL 244 Ca 0.40 -0.16 -0.13 0.00 0.00 0.00 0.00 61.98 62.09 1gxb s VAL 244 Cb -0.17 -0.84 -0.08 0.00 0.00 0.00 0.00 36.38 35.28 1gxb s VAL 244 CO 0.21 -0.20 0.72 -0.75 0.00 0.00 0.00 175.10 175.08 1gxb s LYS 245 N 2.50 3.91 -0.00 2.72 2.20 -1.26 -2.08 119.74 127.72 1gxb s LYS 245 Ca 0.11 0.55 -0.21 0.00 -0.36 0.00 0.00 55.97 56.07 1gxb s LYS 245 Cb -0.15 -2.45 0.04 0.00 -1.51 0.00 0.00 37.83 33.76 1gxb s LYS 245 CO -0.20 0.12 0.45 -1.17 -0.36 0.00 0.00 175.35 174.20 1gxb s LEU 246 N -3.21 0.26 0.07 5.43 2.96 -0.13 -4.99 118.68 119.08 1gxb s LEU 246 Ca 0.52 0.24 0.09 0.00 -0.22 0.00 0.00 54.13 54.76 1gxb s LEU 246 Cb -0.10 1.80 -0.03 0.00 0.50 0.00 0.00 46.19 48.35 1gxb s LEU 246 CO 0.22 -0.57 -0.23 0.21 -1.32 0.00 0.00 176.35 174.66 1gxb s ASN 247 N -1.52 2.82 0.65 3.68 2.47 -1.26 0.77 114.94 122.54 1gxb s ASN 247 Ca -0.10 -0.62 0.32 0.00 0.42 0.00 0.00 52.86 52.88 1gxb s ASN 247 Cb -0.02 -0.21 1.73 0.00 -1.45 0.00 0.00 41.25 41.30 1gxb s ASN 247 CO 0.04 0.16 2.01 1.62 -3.72 0.00 0.00 177.10 177.21 1gxb h VAL 248 N 4.17 0.11 -0.00 -5.21 3.04 -1.23 0.11 116.25 117.24 1gxb h VAL 248 Ca -0.46 0.00 -0.19 0.00 -1.01 0.00 0.00 66.70 65.04 1gxb h VAL 248 Cb 1.16 0.73 -0.01 0.00 -2.01 0.00 0.00 31.29 31.16 1gxb h VAL 248 CO 0.42 0.00 -0.84 0.71 -1.01 0.00 0.00 177.57 176.85 1gxb h THR 249 N 0.00 1.50 0.00 3.17 1.35 -1.86 -3.06 112.91 114.01 1gxb h THR 249 Ca 0.04 -2.59 0.00 0.00 -0.55 0.00 0.00 66.41 63.31 1gxb h THR 249 Cb 0.61 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.46 1gxb h THR 249 CO -0.00 0.75 0.11 0.47 -0.25 0.00 0.00 175.52 176.60 1gxb n ASP 250 N -3.66 0.00 0.01 5.36 8.00 0.39 0.19 116.55 126.84 1gxb n ASP 250 Ca -0.03 0.33 0.12 0.00 0.71 0.00 0.00 54.79 55.91 1gxb n ASP 250 Cb 0.78 -0.33 0.15 0.00 -0.02 0.00 0.00 41.12 41.71 1gxb n ASP 250 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1gxb n PHE 251 N -1.31 0.06 -0.78 1.24 3.72 -1.15 -4.28 117.46 114.96 1gxb n PHE 251 Ca 0.00 0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1gxb n PHE 251 Cb 0.11 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 38.41 1gxb n PHE 251 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gxb n GLY 252 N 1.48 0.95 3.24 1.37 0.00 0.52 -4.81 105.19 107.94 1gxb n GLY 252 Ca 0.05 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 1gxb n GLY 252 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1gxb s ILE 253 N -2.00 0.64 0.03 -0.61 -4.36 -1.23 -5.09 121.20 108.58 1gxb s ILE 253 Ca 0.00 -1.98 -0.13 0.00 -0.26 0.00 0.00 60.65 58.28 1gxb s ILE 253 Cb 0.00 -2.15 -0.06 0.00 1.25 0.00 0.00 42.46 41.50 1gxb s ILE 253 CO 0.00 -0.44 0.41 -0.94 0.24 0.00 0.00 174.94 174.21 1gxb s SER 254 N -3.18 6.75 0.13 4.36 1.04 -1.26 -4.01 113.70 117.54 1gxb s SER 254 Ca 0.25 0.91 -0.31 0.00 0.48 0.00 0.00 55.95 57.28 1gxb s SER 254 Cb 0.06 -2.23 -0.18 0.00 0.10 0.00 0.00 66.02 63.78 1gxb s SER 254 CO 0.05 0.27 0.69 -2.65 0.98 0.00 0.00 173.24 172.58 1gxb n PRO 255 N 1.50 0.00 -3.29 4.02 -0.02 -1.26 -4.92 135.00 131.03 1gxb n PRO 255 Ca -0.12 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 60.98 1gxb n PRO 255 Cb 0.52 -1.15 -0.06 0.00 -0.02 0.00 0.00 33.50 32.80 1gxb n PRO 255 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1gxb s ILE 256 N -0.65 4.84 -0.30 4.25 1.01 0.34 -4.99 121.20 125.69 1gxb s ILE 256 Ca 0.72 1.16 -0.29 0.00 0.00 0.00 0.00 60.65 62.24 1gxb s ILE 256 Cb -1.03 -3.88 -0.01 0.00 0.01 0.00 0.00 42.46 37.55 1gxb s ILE 256 CO 0.55 0.51 1.54 -2.16 0.00 0.00 0.00 174.94 175.39 1gxb s PRO 257 N -0.80 3.69 0.45 2.79 0.04 -1.26 -4.41 135.00 135.50 1gxb s PRO 257 Ca 0.29 1.38 0.28 0.00 0.04 0.00 0.00 61.00 62.98 1gxb s PRO 257 Cb -0.19 -4.03 1.34 0.00 0.04 0.00 0.00 34.50 31.67 1gxb s PRO 257 CO 0.17 -1.42 1.71 0.97 0.04 0.00 0.00 177.00 178.48 1gxb h ILE 258 N 6.29 0.32 -0.98 0.56 6.09 -1.95 0.13 117.51 127.97 1gxb h ILE 258 Ca -0.31 -0.06 0.20 0.00 -1.37 0.00 0.00 64.86 63.32 1gxb h ILE 258 Cb 1.13 0.12 -0.11 0.00 0.47 0.00 0.00 36.82 38.43 1gxb h ILE 258 CO 1.03 0.03 0.57 -0.33 -3.07 0.00 0.00 178.15 176.38 1gxb h GLU 259 N 0.18 0.64 0.00 2.19 3.07 -1.99 -0.88 114.58 117.80 1gxb h GLU 259 Ca 0.70 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 59.46 1gxb h GLU 259 Cb 2.19 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 29.94 1gxb h GLU 259 CO -0.28 0.43 -0.27 0.87 -1.40 0.00 0.00 179.01 178.36 1gxb h LYS 260 N 0.66 0.00 -0.00 2.33 6.56 -1.12 -3.25 116.57 121.75 1gxb h LYS 260 Ca 0.58 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.17 1gxb h LYS 260 Cb 0.98 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.64 1gxb h LYS 260 CO -0.42 0.27 -0.16 1.28 -2.06 0.00 0.00 179.45 178.35 1gxb n LEU 261 N -3.37 0.65 -4.82 2.94 4.77 -0.34 -4.83 117.00 111.99 1gxb n LEU 261 Ca 0.00 -0.07 -0.35 0.00 -0.03 0.00 0.00 56.01 55.56 1gxb n LEU 261 Cb 0.48 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.34 1gxb n LEU 261 CO 0.35 0.12 0.41 -0.63 -1.33 0.00 0.00 177.39 176.31 1gxb s ILE 262 N -2.50 4.60 0.39 -0.08 1.01 -1.20 -0.88 121.20 122.54 1gxb s ILE 262 Ca 0.27 1.19 0.04 0.00 0.00 0.00 0.00 60.65 62.15 1gxb s ILE 262 Cb 0.20 -3.80 -0.06 0.00 0.01 0.00 0.00 42.46 38.81 1gxb s ILE 262 CO 0.49 0.12 0.05 0.68 0.00 0.00 0.00 174.94 176.28 1gxb s VAL 263 N -1.62 1.32 0.00 2.92 -7.23 -0.85 -4.83 120.40 110.11 1gxb s VAL 263 Ca 0.45 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.62 1gxb s VAL 263 Cb -0.15 -2.70 0.00 0.00 0.56 0.00 0.00 36.38 34.09 1gxb s VAL 263 CO 0.20 0.00 0.28 0.59 -0.31 0.00 0.00 175.10 175.86 1gxb n ASN 264 N -0.94 0.50 -3.61 4.85 3.02 -1.26 -4.82 115.26 113.00 1gxb n ASN 264 Ca -0.06 -1.05 -0.03 0.00 -0.03 0.00 0.00 54.58 53.42 1gxb n ASN 264 Cb 0.67 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.82 1gxb n ASN 264 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1gxb s SER 265 N -0.05 -0.15 0.15 6.41 1.04 -1.26 -4.79 113.70 115.06 1gxb s SER 265 Ca 0.00 -0.11 -0.16 0.00 0.48 0.00 0.00 55.95 56.16 1gxb s SER 265 Cb 0.00 0.24 0.05 0.00 0.10 0.00 0.00 66.02 66.41 1gxb s SER 265 CO 0.00 -0.41 1.75 0.00 0.98 0.00 0.00 173.24 175.56 1gxb h ALA 266 N 2.00 0.41 -0.39 5.32 0.00 -1.85 -0.96 119.26 123.79 1gxb h ALA 266 Ca -0.21 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1gxb h ALA 266 Cb 1.20 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1gxb h ALA 266 CO 0.26 -0.27 -0.07 1.49 0.00 0.00 0.00 179.25 180.67 1gxb h GLU 267 N 0.27 0.65 -0.65 0.00 4.81 -1.91 -1.49 114.58 116.27 1gxb h GLU 267 Ca 0.16 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 59.15 1gxb h GLU 267 Cb 0.13 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1gxb h GLU 267 CO -0.16 0.72 0.17 0.22 -0.73 0.00 0.00 179.01 179.23 1gxb h ASP 268 N 0.61 0.96 -0.06 1.04 3.58 -1.77 -1.00 116.42 119.77 1gxb h ASP 268 Ca 0.11 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.37 1gxb h ASP 268 Cb 0.48 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.28 1gxb h ASP 268 CO 0.03 0.91 0.00 -1.28 -2.88 0.00 0.00 179.24 176.02 1gxb h SER 269 N 0.97 0.10 -0.26 2.28 0.87 -0.83 -2.12 113.55 114.56 1gxb h SER 269 Ca 0.21 -0.29 0.06 0.00 -1.23 0.00 0.00 61.79 60.55 1gxb h SER 269 Cb 0.32 -0.03 -0.07 0.00 -0.44 0.00 0.00 62.40 62.19 1gxb h SER 269 CO -0.00 0.36 -0.26 0.00 -0.53 0.00 0.00 176.83 176.40 1gxb h ALA 270 N 0.74 -0.15 0.10 6.23 0.00 -0.95 0.48 119.26 125.70 1gxb h ALA 270 Ca 0.02 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1gxb h ALA 270 Cb 0.31 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 1gxb h ALA 270 CO 0.00 -0.68 -0.26 0.82 0.00 0.00 0.00 179.25 179.13 1gxb h ILE 271 N -0.26 0.42 -0.88 0.00 2.04 -1.17 0.24 117.51 117.90 1gxb h ILE 271 Ca 0.14 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.17 1gxb h ILE 271 Cb 0.48 0.42 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 1gxb h ILE 271 CO -0.40 0.00 0.57 0.11 0.00 0.00 0.00 178.15 178.43 1gxb h LYS 272 N -0.46 0.52 0.35 2.37 1.57 -0.72 0.43 116.57 120.63 1gxb h LYS 272 Ca 0.04 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1gxb h LYS 272 Cb 0.50 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1gxb h LYS 272 CO -0.17 0.35 -0.17 0.82 -0.57 0.00 0.00 179.45 179.71 1gxb h ILE 273 N 0.54 0.42 -0.95 1.86 2.04 0.15 -2.34 117.51 119.23 1gxb h ILE 273 Ca 0.45 -0.72 0.10 0.00 1.00 0.00 0.00 64.86 65.69 1gxb h ILE 273 Cb 0.93 0.67 -0.07 0.00 -0.74 0.00 0.00 36.82 37.61 1gxb h ILE 273 CO -0.19 0.09 0.61 0.58 0.00 0.00 0.00 178.15 179.24 1gxb h VAL 274 N -0.98 0.99 -0.76 1.67 2.07 0.14 0.81 116.25 120.19 1gxb h VAL 274 Ca -0.05 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 1gxb h VAL 274 Cb 0.51 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.15 1gxb h VAL 274 CO 0.08 0.18 0.42 0.03 0.02 0.00 0.00 177.57 178.30 1gxb h ARG 275 N 0.99 1.06 -0.41 1.57 3.08 -0.20 -1.23 114.38 119.24 1gxb h ARG 275 Ca 0.44 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 60.33 1gxb h ARG 275 Cb 0.37 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1gxb h ARG 275 CO -0.20 0.78 0.12 0.00 -1.07 0.00 0.00 179.97 179.60 1gxb h ALA 276 N 1.22 1.43 0.00 0.04 0.00 -0.33 -0.00 119.26 121.62 1gxb h ALA 276 Ca 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1gxb h ALA 276 Cb 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1gxb h ALA 276 CO -0.04 0.42 0.00 0.74 0.00 0.00 0.00 179.25 180.37 1gxb h PHE 277 N 0.60 0.00 0.00 0.00 0.05 -0.05 -2.75 116.94 114.79 1gxb h PHE 277 Ca 0.14 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.93 1gxb h PHE 277 Cb 0.20 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.15 1gxb h PHE 277 CO 0.01 0.00 -1.56 1.28 -0.18 0.00 0.00 178.31 177.86 1gxb n LEU 278 N -2.49 0.36 0.00 1.54 4.77 -0.25 -4.64 117.00 116.29 1gxb n LEU 278 Ca 0.02 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1gxb n LEU 278 Cb 0.29 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1gxb n LEU 278 CO 0.24 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 1gxb n GLY 279 N 1.28 0.83 0.55 -0.72 0.00 -0.31 -4.95 105.19 101.87 1gxb n GLY 279 Ca -0.02 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.03 1gxb n GLY 279 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gxb n LYS 280 N -2.31 1.65 -3.26 1.61 5.02 -0.18 -4.62 118.16 116.06 1gxb n LYS 280 Ca 0.00 -1.10 -0.18 0.00 -2.02 0.00 0.00 58.31 55.01 1gxb n LYS 280 Cb 0.00 -1.48 -0.07 0.00 -0.02 0.00 0.00 35.03 33.46 1gxb n LYS 280 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1gxb s ASP 281 N -2.11 0.77 0.20 4.39 3.68 -1.22 -4.89 116.67 117.49 1gxb s ASP 281 Ca 0.32 -2.10 -0.11 0.00 2.13 0.00 0.00 52.55 52.79 1gxb s ASP 281 Cb 0.20 0.49 0.19 0.00 -1.45 0.00 0.00 42.92 42.35 1gxb s ASP 281 CO 0.37 -0.19 1.81 1.05 0.13 0.00 0.00 175.17 178.35 1gxb h GLU 282 N 6.20 0.66 -0.13 4.34 4.11 -1.92 -1.71 114.58 126.14 1gxb h GLU 282 Ca 0.12 -0.04 0.04 0.00 0.07 0.00 0.00 59.36 59.56 1gxb h GLU 282 Cb 1.02 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 30.07 1gxb h GLU 282 CO 0.22 0.44 -0.16 0.45 0.07 0.00 0.00 179.01 180.02 1gxb h HIS 283 N 0.68 -0.42 -0.59 2.06 3.86 -1.97 0.33 115.15 119.10 1gxb h HIS 283 Ca 0.27 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.43 1gxb h HIS 283 Cb 0.12 0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 1gxb h HIS 283 CO -0.07 -0.24 0.10 0.28 0.86 0.00 0.00 177.93 178.86 1gxb h VAL 284 N -0.21 1.26 -0.99 2.45 2.07 -1.85 -2.11 116.25 116.87 1gxb h VAL 284 Ca 0.09 -0.98 0.01 0.00 0.82 0.00 0.00 66.70 66.64 1gxb h VAL 284 Cb 0.34 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 1gxb h VAL 284 CO -0.25 0.36 0.64 0.00 0.02 0.00 0.00 177.57 178.35 1gxb h ALA 285 N 1.01 1.27 -0.15 1.67 0.00 -0.63 -0.19 119.26 122.25 1gxb h ALA 285 Ca 0.18 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1gxb h ALA 285 Cb 0.42 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1gxb h ALA 285 CO 0.01 0.67 -0.38 0.93 0.00 0.00 0.00 179.25 180.48 1gxb h GLU 286 N 1.35 0.31 -0.26 0.00 5.08 -0.15 -0.75 114.58 120.16 1gxb h GLU 286 Ca 0.36 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.54 1gxb h GLU 286 Cb -0.13 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1gxb h GLU 286 CO -0.08 0.65 0.02 0.35 -1.00 0.00 0.00 179.01 178.95 1gxb h PHE 287 N 0.27 0.48 -0.31 4.33 3.57 -0.66 -1.67 116.94 122.94 1gxb h PHE 287 Ca 0.03 -0.08 -0.04 0.00 3.53 0.00 0.00 57.97 61.41 1gxb h PHE 287 Cb 0.79 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 1gxb h PHE 287 CO 0.02 0.58 0.01 0.82 -2.23 0.00 0.00 178.31 177.52 1gxb h ILE 288 N 0.23 1.18 0.16 1.41 2.04 -0.75 -3.09 117.51 118.69 1gxb h ILE 288 Ca 0.07 -0.68 -0.31 0.00 1.00 0.00 0.00 64.86 64.94 1gxb h ILE 288 Cb 0.38 0.93 0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1gxb h ILE 288 CO 0.01 0.24 -1.32 0.11 0.00 0.00 0.00 178.15 177.19 1gxb h LYS 289 N 0.45 0.58 0.00 2.37 1.57 -0.91 -1.89 116.57 118.74 1gxb h LYS 289 Ca 0.10 -0.84 -0.05 0.00 -1.87 0.00 0.00 60.65 57.99 1gxb h LYS 289 Cb 0.27 0.29 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 1gxb h LYS 289 CO 0.01 1.39 -0.23 -0.84 -0.57 0.00 0.00 179.45 179.21 1gxb h ILE 290 N 0.23 0.97 0.05 1.86 3.07 -1.31 0.29 117.51 122.67 1gxb h ILE 290 Ca -0.21 -0.83 -0.00 0.00 1.55 0.00 0.00 64.86 65.37 1gxb h ILE 290 Cb 2.00 1.47 0.00 0.00 -0.27 0.00 0.00 36.82 40.02 1gxb h ILE 290 CO 0.25 0.22 -0.03 0.78 -1.05 0.00 0.00 178.15 178.32 1gxb h ASN 291 N 0.00 -0.06 -0.65 2.16 2.35 -1.58 -3.06 115.58 114.74 1gxb h ASN 291 Ca -0.00 -0.59 0.12 0.00 -0.55 0.00 0.00 56.30 55.27 1gxb h ASN 291 Cb 0.45 0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 1gxb h ASN 291 CO 0.03 0.65 0.44 0.74 -1.65 0.00 0.00 177.43 177.63 1gxb h THR 292 N -0.86 0.86 -0.19 2.81 2.02 -1.11 -0.97 112.91 115.47 1gxb h THR 292 Ca -0.01 -0.14 0.04 0.00 0.77 0.00 0.00 66.41 67.07 1gxb h THR 292 Cb 0.65 0.42 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 1gxb h THR 292 CO 0.01 0.07 -0.03 0.00 0.37 0.00 0.00 175.52 175.94 1gxb h ALA 293 N 1.68 0.14 -0.74 6.16 0.00 -0.42 0.14 119.26 126.22 1gxb h ALA 293 Ca 0.31 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.24 1gxb h ALA 293 Cb 0.65 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1gxb h ALA 293 CO -0.09 -0.46 0.27 0.28 0.00 0.00 0.00 179.25 179.25 1gxb h VAL 294 N 0.02 1.26 -0.37 0.00 2.07 -1.09 -1.84 116.25 116.29 1gxb h VAL 294 Ca 0.09 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 1gxb h VAL 294 Cb 0.13 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1gxb h VAL 294 CO -0.18 0.33 0.22 0.00 0.02 0.00 0.00 177.57 177.96 1gxb h ALA 295 N 1.14 0.47 -0.98 1.67 0.00 -0.87 -0.64 119.26 120.05 1gxb h ALA 295 Ca 0.24 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.19 1gxb h ALA 295 Cb 0.25 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 1gxb h ALA 295 CO -0.02 -0.02 0.63 -0.07 0.00 0.00 0.00 179.25 179.77 1gxb h LEU 296 N 0.48 0.94 -0.83 0.00 4.07 -0.39 0.43 115.31 120.01 1gxb h LEU 296 Ca 0.13 0.03 -0.07 0.00 0.08 0.00 0.00 57.88 58.05 1gxb h LEU 296 Cb 0.01 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.56 1gxb h LEU 296 CO -0.02 0.55 0.12 0.15 -1.08 0.00 0.00 178.44 178.15 1gxb h PHE 297 N 1.04 1.04 -0.07 1.13 3.57 -0.49 -1.61 116.94 121.55 1gxb h PHE 297 Ca 0.46 -0.12 -0.04 0.00 3.53 0.00 0.00 57.97 61.79 1gxb h PHE 297 Cb 0.36 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1gxb h PHE 297 CO -0.00 0.87 -0.15 0.00 -2.23 0.00 0.00 178.31 176.80 1gxb h ALA 298 N 1.18 1.62 -0.00 2.41 0.00 0.55 -0.90 119.26 124.11 1gxb h ALA 298 Ca 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1gxb h ALA 298 Cb 0.38 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1gxb h ALA 298 CO 0.01 0.28 -0.05 1.28 0.00 0.00 0.00 179.25 180.76 1gxb n LEU 299 N -4.30 0.32 -1.46 0.00 4.77 -0.57 -4.90 117.00 110.85 1gxb n LEU 299 Ca -0.02 0.05 -0.14 0.00 -0.03 0.00 0.00 56.01 55.88 1gxb n LEU 299 Cb 0.25 -0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 1gxb n LEU 299 CO 0.37 0.06 -0.17 0.47 -1.33 0.00 0.00 177.39 176.79 1gxb n ASP 300 N -0.99 -4.35 0.05 -1.43 8.00 -0.34 -4.88 116.55 112.61 1gxb n ASP 300 Ca 0.16 0.07 0.12 0.00 0.71 0.00 0.00 54.79 55.85 1gxb n ASP 300 Cb 0.24 -3.42 0.24 0.00 -0.02 0.00 0.00 41.12 38.17 1gxb n ASP 300 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1gxb n ARG 301 N -2.39 0.20 -4.23 -1.24 5.12 -0.76 -4.90 116.66 108.47 1gxb n ARG 301 Ca -0.16 0.07 -0.13 0.00 -1.93 0.00 0.00 57.85 55.70 1gxb n ARG 301 Cb 0.59 -1.64 -0.10 0.00 -1.16 0.00 0.00 32.46 30.15 1gxb n ARG 301 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1gxb s VAL 302 N -3.11 0.30 -0.04 1.55 -7.23 -1.26 -5.02 120.40 105.60 1gxb s VAL 302 Ca 0.08 -1.97 0.15 0.00 -1.81 0.00 0.00 61.98 58.42 1gxb s VAL 302 Cb 0.15 -2.35 -0.22 0.00 0.56 0.00 0.00 36.38 34.51 1gxb s VAL 302 CO 0.69 -0.21 0.28 0.61 -0.31 0.00 0.00 175.10 176.16 1gxb n GLY 303 N -0.27 -0.69 3.22 2.32 0.00 -1.26 -4.80 105.19 103.71 1gxb n GLY 303 Ca -0.02 -0.33 -0.09 0.00 0.00 0.00 0.00 46.02 45.57 1gxb n GLY 303 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1gxb s ASP 304 N -3.90 0.21 0.42 1.61 -4.77 -1.26 -5.06 116.67 103.92 1gxb s ASP 304 Ca -0.06 -0.96 0.20 0.00 -3.30 0.00 0.00 52.55 48.43 1gxb s ASP 304 Cb 0.09 0.34 0.93 0.00 -1.09 0.00 0.00 42.92 43.19 1gxb s ASP 304 CO 0.61 -0.77 1.87 -0.26 0.70 0.00 0.00 175.17 177.33 1gxb h PHE 305 N 2.77 0.00 -0.27 2.11 -1.00 -1.91 -1.84 116.94 116.79 1gxb h PHE 305 Ca -0.34 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.39 1gxb h PHE 305 Cb 1.20 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.75 1gxb h PHE 305 CO 0.43 0.29 -0.05 -0.09 -1.61 0.00 0.00 178.31 177.28 1gxb h ARG 306 N 0.00 0.52 -0.38 1.51 1.12 -1.88 0.54 114.38 115.81 1gxb h ARG 306 Ca -0.00 -0.19 0.03 0.00 -1.11 0.00 0.00 59.98 58.70 1gxb h ARG 306 Cb 0.64 -0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 30.54 1gxb h ARG 306 CO 0.04 0.72 0.19 1.49 -3.11 0.00 0.00 179.97 179.30 1gxb h GLU 307 N 0.28 0.39 -0.68 0.20 4.81 -1.88 -1.20 114.58 116.49 1gxb h GLU 307 Ca 0.07 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.34 1gxb h GLU 307 Cb 0.52 -0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.75 1gxb h GLU 307 CO 0.02 0.25 0.37 0.78 -0.73 0.00 0.00 179.01 179.71 1gxb h GLY 308 N 0.40 0.99 0.97 1.92 0.00 -1.00 0.08 103.07 106.43 1gxb h GLY 308 Ca 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 1gxb h GLY 308 CO -0.11 0.14 0.21 -1.82 0.00 0.00 0.00 176.54 174.96 1gxb h TYR 309 N 0.67 0.51 0.14 5.60 3.20 -0.22 -1.19 116.97 125.68 1gxb h TYR 309 Ca 0.31 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.17 1gxb h TYR 309 Cb 0.21 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1gxb h TYR 309 CO -0.08 0.39 -0.15 0.93 -1.64 0.00 0.00 178.16 177.61 1gxb h GLU 310 N 0.47 -0.31 -0.49 1.82 5.08 -0.62 -1.95 114.58 118.58 1gxb h GLU 310 Ca 0.13 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.60 1gxb h GLU 310 Cb 0.05 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.30 1gxb h GLU 310 CO -0.02 -0.21 0.07 -0.92 -1.00 0.00 0.00 179.01 176.93 1gxb h TYR 311 N -0.33 0.10 -0.69 4.33 5.03 -0.84 -0.20 116.97 124.39 1gxb h TYR 311 Ca 0.01 0.03 0.13 0.00 2.58 0.00 0.00 58.73 61.48 1gxb h TYR 311 Cb 0.31 0.03 -0.04 0.00 1.55 0.00 0.00 36.73 38.58 1gxb h TYR 311 CO -0.14 -0.04 0.46 0.00 -1.32 0.00 0.00 178.16 177.13 1gxb h ALA 312 N 1.40 2.12 -0.62 1.82 0.00 -0.80 0.01 119.26 123.19 1gxb h ALA 312 Ca 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1gxb h ALA 312 Cb 0.34 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1gxb h ALA 312 CO -0.35 -0.30 0.35 0.22 0.00 0.00 0.00 179.25 179.18 1gxb h ASP 313 N 0.37 0.77 -0.62 0.00 1.82 -0.27 -0.00 116.42 118.49 1gxb h ASP 313 Ca 0.33 -0.08 -0.05 0.00 -0.39 0.00 0.00 57.03 56.83 1gxb h ASP 313 Cb 0.77 -0.19 -0.03 0.00 0.68 0.00 0.00 39.33 40.56 1gxb h ASP 313 CO -0.09 0.63 0.18 0.45 -1.61 0.00 0.00 179.24 178.80 1gxb h HIS 314 N 0.85 1.02 0.01 0.28 3.86 -0.88 -3.19 115.15 117.09 1gxb h HIS 314 Ca 0.22 -0.11 -0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1gxb h HIS 314 Cb 0.02 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.20 1gxb h HIS 314 CO -0.01 0.84 -0.00 -0.07 0.86 0.00 0.00 177.93 179.54 1gxb h LEU 315 N 0.90 -0.01 -1.65 2.43 3.38 -0.73 -3.11 115.31 116.53 1gxb h LEU 315 Ca 0.20 -0.15 0.22 0.00 0.09 0.00 0.00 57.88 58.24 1gxb h LEU 315 Cb 0.31 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 1gxb h LEU 315 CO -0.00 0.15 0.61 -0.29 0.09 0.00 0.00 178.44 179.00 1gxb h ILE 316 N -0.17 0.63 0.00 1.22 2.10 -1.00 0.90 117.51 121.19 1gxb h ILE 316 Ca -0.00 -0.09 -0.01 0.00 1.08 0.00 0.00 64.86 65.84 1gxb h ILE 316 Cb 0.16 0.33 -0.00 0.00 -1.09 0.00 0.00 36.82 36.22 1gxb h ILE 316 CO 0.00 0.05 -0.03 -0.33 -1.08 0.00 0.00 178.15 176.76 1gxb h GLU 317 N 0.28 0.00 -0.02 2.19 5.08 -1.56 -2.13 114.58 118.42 1gxb h GLU 317 Ca 0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1gxb h GLU 317 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1gxb h GLU 317 CO -0.13 0.03 -0.02 1.63 -1.00 0.00 0.00 179.01 179.52 1gxb n LYS 318 N -3.28 0.94 -0.15 2.33 5.02 0.28 -4.70 118.16 118.60 1gxb n LYS 318 Ca -0.02 -1.24 -0.09 0.00 -2.02 0.00 0.00 58.31 54.93 1gxb n LYS 318 Cb 0.18 -1.25 -0.00 0.00 -0.02 0.00 0.00 35.03 33.94 1gxb n LYS 318 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1gxb h SER 319 N 2.52 0.70 -0.82 4.39 0.02 -0.99 -2.42 113.55 116.95 1gxb h SER 319 Ca 0.00 -0.25 0.03 0.00 -0.84 0.00 0.00 61.79 60.73 1gxb h SER 319 Cb 0.55 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.85 1gxb h SER 319 CO 0.00 0.77 0.54 0.25 -1.14 0.00 0.00 176.83 177.25 1gxb h LEU 320 N 0.59 0.88 -0.24 5.07 5.85 -1.82 0.33 115.31 125.97 1gxb h LEU 320 Ca 0.14 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1gxb h LEU 320 Cb 0.37 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1gxb h LEU 320 CO 0.01 0.61 0.01 0.44 -0.34 0.00 0.00 178.44 179.16 1gxb h ASP 321 N 1.02 0.41 -0.54 1.25 3.32 -1.87 -0.68 116.42 119.33 1gxb h ASP 321 Ca 0.32 -0.30 0.03 0.00 0.02 0.00 0.00 57.03 57.11 1gxb h ASP 321 Cb 0.03 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.43 1gxb h ASP 321 CO -0.09 0.61 0.31 0.50 -1.72 0.00 0.00 179.24 178.85 1gxb h LYS 322 N 0.21 0.59 -0.56 3.56 1.63 -0.83 -0.81 116.57 120.36 1gxb h LYS 322 Ca 0.07 -0.04 0.04 0.00 -0.85 0.00 0.00 60.65 59.87 1gxb h LYS 322 Cb 0.39 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.85 1gxb h LYS 322 CO 0.01 0.39 0.31 1.25 -3.45 0.00 0.00 179.45 177.96 1gxb h LEU 323 N 0.61 0.47 -0.26 5.20 5.85 -0.19 -0.74 115.31 126.26 1gxb h LEU 323 Ca 0.22 0.02 0.04 0.00 0.84 0.00 0.00 57.88 59.00 1gxb h LEU 323 Cb 0.06 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1gxb h LEU 323 CO -0.12 0.33 0.04 -1.13 -0.34 0.00 0.00 178.44 177.22 1gxb h ASN 324 N 0.60 -0.01 -0.24 1.25 -0.73 -0.15 -0.77 115.58 115.53 1gxb h ASN 324 Ca 0.24 0.04 -0.06 0.00 1.87 0.00 0.00 56.30 58.39 1gxb h ASN 324 Cb 0.10 0.06 -0.02 0.00 0.27 0.00 0.00 38.32 38.74 1gxb h ASN 324 CO -0.14 0.03 -0.05 1.05 -0.37 0.00 0.00 177.43 177.95 1gxb h GLU 325 N 0.13 0.58 0.40 6.67 4.11 -0.56 -0.32 114.58 125.59 1gxb h GLU 325 Ca 0.12 -0.15 -0.02 0.00 0.07 0.00 0.00 59.36 59.38 1gxb h GLU 325 Cb 0.13 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1gxb h GLU 325 CO -0.17 0.64 -0.19 0.82 0.07 0.00 0.00 179.01 180.18 1gxb h ILE 326 N 0.55 0.60 -0.85 -1.06 2.04 -0.45 -1.93 117.51 116.41 1gxb h ILE 326 Ca 0.11 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 1gxb h ILE 326 Cb 0.42 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.20 1gxb h ILE 326 CO 0.02 0.05 0.41 0.40 0.00 0.00 0.00 178.15 179.03 1gxb h ILE 327 N -0.69 1.26 0.00 -0.67 2.04 -1.06 -2.48 117.51 115.90 1gxb h ILE 327 Ca -0.05 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.04 1gxb h ILE 327 Cb 0.50 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1gxb h ILE 327 CO 0.09 0.31 -0.19 0.77 0.00 0.00 0.00 178.15 179.13 1gxb h SER 328 N 1.21 0.00 -0.15 1.72 4.64 -0.98 -0.44 113.55 119.54 1gxb h SER 328 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 1gxb h SER 328 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1gxb h SER 328 CO -0.04 0.19 0.00 0.80 -0.87 0.00 0.00 176.83 176.91 1gxb n MET 329 N -4.09 1.93 -2.69 4.77 1.56 -0.73 -4.54 117.12 113.33 1gxb n MET 329 Ca -0.02 -1.39 -0.05 0.00 -0.27 0.00 0.00 57.70 55.97 1gxb n MET 329 Cb 0.26 -1.45 0.06 0.00 2.15 0.00 0.00 33.22 34.25 1gxb n MET 329 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 1gxb n ASN 330 N 0.63 -1.77 0.00 6.12 5.15 -0.88 -5.05 115.26 119.46 1gxb n ASN 330 Ca 0.17 -2.05 0.00 0.00 -0.60 0.00 0.00 54.58 52.10 1gxb n ASN 330 Cb 0.42 1.01 0.00 0.00 -0.53 0.00 0.00 39.78 40.68 1gxb n ASN 330 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1gxb n GLY 331 N 1.76 -0.29 3.35 8.20 0.00 -0.23 -2.03 105.19 115.96 1gxb n GLY 331 Ca 0.05 -1.57 -0.45 0.00 0.00 0.00 0.00 46.02 44.06 1gxb n GLY 331 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gxb s ASP 332 N -3.70 6.13 0.32 1.61 3.68 0.14 -4.64 116.67 120.20 1gxb s ASP 332 Ca 0.00 -1.50 -0.00 0.00 2.13 0.00 0.00 52.55 53.18 1gxb s ASP 332 Cb 0.00 -2.18 0.52 0.00 -1.45 0.00 0.00 42.92 39.82 1gxb s ASP 332 CO 0.00 -0.71 1.97 0.58 0.13 0.00 0.00 175.17 177.14 1gxb h VAL 333 N 5.82 1.17 -0.44 1.11 2.07 -1.84 -2.83 116.25 121.31 1gxb h VAL 333 Ca -0.28 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 66.91 1gxb h VAL 333 Cb 1.10 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 1gxb h VAL 333 CO 0.92 0.19 0.24 0.71 0.02 0.00 0.00 177.57 179.65 1gxb h THR 334 N 1.02 1.01 -0.73 2.57 1.35 -1.93 0.79 112.91 117.00 1gxb h THR 334 Ca 0.30 -0.17 0.14 0.00 -0.55 0.00 0.00 66.41 66.13 1gxb h THR 334 Cb -0.05 0.48 -0.05 0.00 -1.73 0.00 0.00 68.15 66.80 1gxb h THR 334 CO -0.07 0.09 0.49 0.50 -0.25 0.00 0.00 175.52 176.27 1gxb h LYS 335 N 0.49 0.41 -0.26 4.72 3.64 -1.79 0.36 116.57 124.13 1gxb h LYS 335 Ca 0.18 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 1gxb h LYS 335 Cb 0.05 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1gxb h LYS 335 CO -0.10 0.27 -0.20 1.25 -2.27 0.00 0.00 179.45 178.40 1gxb h LEU 336 N 0.42 0.63 0.05 5.20 5.85 -0.85 -2.64 115.31 123.97 1gxb h LEU 336 Ca 0.35 -0.45 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 1gxb h LEU 336 Cb 0.79 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1gxb h LEU 336 CO -0.11 0.95 -0.02 0.11 -0.34 0.00 0.00 178.44 179.02 1gxb h LYS 337 N 0.32 -0.06 -0.75 1.25 6.56 0.17 -0.39 116.57 123.68 1gxb h LYS 337 Ca 0.05 0.00 0.13 0.00 -1.06 0.00 0.00 60.65 59.78 1gxb h LYS 337 Cb 0.74 0.01 -0.05 0.00 -0.57 0.00 0.00 32.23 32.37 1gxb h LYS 337 CO 0.05 -0.01 0.50 1.79 -2.06 0.00 0.00 179.45 179.71 1gxb h THR 338 N -0.10 0.84 -0.05 -0.16 1.35 -0.61 0.58 112.91 114.76 1gxb h THR 338 Ca -0.01 -0.17 -0.13 0.00 -0.55 0.00 0.00 66.41 65.56 1gxb h THR 338 Cb 0.08 0.31 -0.01 0.00 -1.73 0.00 0.00 68.15 66.80 1gxb h THR 338 CO 0.01 0.09 -0.55 0.40 -0.25 0.00 0.00 175.52 175.21 1gxb h ILE 339 N 0.48 1.38 0.00 6.82 1.08 -0.99 -1.41 117.51 124.88 1gxb h ILE 339 Ca 0.36 -1.88 -0.11 0.00 -0.39 0.00 0.00 64.86 62.84 1gxb h ILE 339 Cb 0.73 1.97 -0.02 0.00 -3.07 0.00 0.00 36.82 36.43 1gxb h ILE 339 CO -0.12 0.55 -0.51 0.58 -0.69 0.00 0.00 178.15 177.96 1gxb h VAL 340 N 0.11 1.33 0.03 1.67 2.07 0.17 -1.89 116.25 119.74 1gxb h VAL 340 Ca -0.00 -1.77 -0.22 0.00 0.82 0.00 0.00 66.70 65.53 1gxb h VAL 340 Cb 1.01 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.73 1gxb h VAL 340 CO 0.08 0.50 -0.99 0.58 0.02 0.00 0.00 177.57 177.75 1gxb h VAL 341 N 0.00 1.57 0.00 2.57 2.07 -0.61 -3.23 116.25 118.62 1gxb h VAL 341 Ca -0.01 -2.98 -0.05 0.00 0.82 0.00 0.00 66.70 64.49 1gxb h VAL 341 Cb 0.92 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 33.38 1gxb h VAL 341 CO 0.07 0.86 -0.25 0.11 0.02 0.00 0.00 177.57 178.37 1gxb h LYS 342 N 0.06 0.00 -1.51 1.57 1.57 -1.01 -3.16 116.57 114.08 1gxb h LYS 342 Ca -0.05 0.00 -0.72 0.00 -1.87 0.00 0.00 60.65 58.01 1gxb h LYS 342 Cb 1.69 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.71 1gxb h LYS 342 CO 0.15 0.25 0.90 -1.13 -0.57 0.00 0.00 179.45 179.05 1gxb n SER 343 N -3.25 7.50 0.00 0.86 3.41 -0.73 -5.00 113.62 116.40 1gxb n SER 343 Ca 0.02 -3.81 0.00 0.00 -0.26 0.00 0.00 58.87 54.81 1gxb n SER 343 Cb 0.54 -1.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 1gxb n SER 343 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1gxb n SER 344 N -0.71 0.00 0.00 4.04 7.64 -1.20 -4.72 113.62 118.67 1gxb n SER 344 Ca 0.57 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.45 1gxb n SER 344 Cb 0.45 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 1gxb n SER 344 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64