#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gd0 s MET 2 N 0.00 0.80 -0.09 -0.52 0.23 -0.55 -0.78 119.30 118.39 1gd0 s MET 2 Ca 0.00 -0.23 0.02 0.00 -1.03 0.00 0.00 55.69 54.45 1gd0 s MET 2 Cb 0.00 -0.77 0.01 0.00 -1.53 0.00 0.00 34.83 32.54 1gd0 s MET 2 CO 0.00 0.07 -0.16 0.12 -2.03 0.00 0.00 175.02 173.02 1gd0 s PHE 3 N 0.28 1.89 -0.05 3.16 5.36 -0.21 -1.17 117.98 127.24 1gd0 s PHE 3 Ca -0.04 -0.81 0.06 0.00 -0.96 0.00 0.00 56.93 55.19 1gd0 s PHE 3 Cb -0.08 -1.35 -0.01 0.00 -0.34 0.00 0.00 43.02 41.24 1gd0 s PHE 3 CO 0.00 -0.40 -0.25 0.42 -1.46 0.00 0.00 175.22 173.54 1gd0 s ILE 4 N 0.77 2.03 -0.16 3.12 -1.09 -0.43 -1.52 121.20 123.91 1gd0 s ILE 4 Ca -0.12 -1.06 0.00 0.00 -2.23 0.00 0.00 60.65 57.25 1gd0 s ILE 4 Cb -0.16 -1.71 0.03 0.00 -1.58 0.00 0.00 42.46 39.04 1gd0 s ILE 4 CO 0.02 0.56 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.48 1gd0 s VAL 5 N -0.20 1.52 -0.18 2.92 1.01 -0.41 -1.48 120.40 123.57 1gd0 s VAL 5 Ca -0.02 -0.68 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 1gd0 s VAL 5 Cb -0.13 -1.48 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 1gd0 s VAL 5 CO 0.03 0.37 -0.03 0.20 0.00 0.00 0.00 175.10 175.67 1gd0 s ASN 6 N 1.49 4.67 0.08 3.32 0.01 0.02 -0.24 114.94 124.29 1gd0 s ASN 6 Ca 0.03 -0.22 -0.08 0.00 -0.71 0.00 0.00 52.86 51.89 1gd0 s ASN 6 Cb -0.14 -1.78 -0.01 0.00 0.41 0.00 0.00 41.25 39.74 1gd0 s ASN 6 CO -0.10 0.09 0.16 0.28 -1.51 0.00 0.00 177.10 176.02 1gd0 s THR 7 N 0.83 0.15 -2.22 1.60 -1.32 -0.05 -0.82 115.64 113.81 1gd0 s THR 7 Ca -0.00 -1.23 0.27 0.00 -1.21 0.00 0.00 61.69 59.51 1gd0 s THR 7 Cb -0.14 -1.31 0.40 0.00 -1.51 0.00 0.00 72.50 69.93 1gd0 s THR 7 CO 0.02 -0.68 1.62 -0.46 -2.21 0.00 0.00 174.62 172.91 1gd0 n ASN 8 N 0.05 1.43 -4.77 8.08 6.94 -1.24 -1.42 115.26 124.33 1gd0 n ASN 8 Ca -0.15 -1.29 -0.41 0.00 -0.02 0.00 0.00 54.58 52.71 1gd0 n ASN 8 Cb 0.62 0.07 -0.01 0.00 -2.36 0.00 0.00 39.78 38.10 1gd0 n ASN 8 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1gd0 s VAL 9 N -2.21 2.50 0.61 3.53 1.01 -1.26 -4.23 120.40 120.34 1gd0 s VAL 9 Ca 0.31 0.49 -0.18 0.00 0.00 0.00 0.00 61.98 62.61 1gd0 s VAL 9 Cb 0.20 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 1gd0 s VAL 9 CO 0.41 0.11 1.17 -2.16 0.00 0.00 0.00 175.10 174.63 1gd0 s PRO 10 N -1.96 2.94 0.31 2.72 0.05 -1.26 -0.91 135.00 136.89 1gd0 s PRO 10 Ca 0.51 1.67 0.04 0.00 0.05 0.00 0.00 61.00 63.28 1gd0 s PRO 10 Cb -0.41 -1.94 0.66 0.00 0.05 0.00 0.00 34.50 32.85 1gd0 s PRO 10 CO 0.55 -1.19 1.84 -0.09 0.05 0.00 0.00 177.00 178.16 1gd0 h ARG 11 N 0.67 0.85 0.00 4.56 2.43 -1.93 0.50 114.38 121.46 1gd0 h ARG 11 Ca -0.49 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.62 1gd0 h ARG 11 Cb 1.28 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1gd0 h ARG 11 CO 0.55 0.56 -0.03 0.00 -1.51 0.00 0.00 179.97 179.54 1gd0 h ALA 12 N 1.57 1.20 -0.01 2.80 0.00 -2.03 -1.54 119.26 121.25 1gd0 h ALA 12 Ca 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1gd0 h ALA 12 Cb 0.61 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1gd0 h ALA 12 CO -0.26 0.03 -0.11 0.43 0.00 0.00 0.00 179.25 179.35 1gd0 n SER 13 N -3.41 0.86 -4.58 0.00 7.64 0.16 -4.73 113.62 109.57 1gd0 n SER 13 Ca -0.02 -0.97 -0.42 0.00 1.01 0.00 0.00 58.87 58.47 1gd0 n SER 13 Cb 0.14 0.01 -0.05 0.00 -1.01 0.00 0.00 64.21 63.30 1gd0 n SER 13 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1gd0 s VAL 14 N -2.30 4.75 0.66 0.44 1.01 -0.58 -4.71 120.40 119.67 1gd0 s VAL 14 Ca 0.32 0.85 -0.16 0.00 0.00 0.00 0.00 61.98 62.99 1gd0 s VAL 14 Cb 0.20 -4.19 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 1gd0 s VAL 14 CO 0.44 -0.42 1.18 -2.16 0.00 0.00 0.00 175.10 174.13 1gd0 s PRO 15 N 3.05 2.65 0.36 2.72 0.04 -1.26 -4.95 135.00 137.61 1gd0 s PRO 15 Ca 0.31 1.67 -0.28 0.00 0.04 0.00 0.00 61.00 62.74 1gd0 s PRO 15 Cb -0.13 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.40 1gd0 s PRO 15 CO 0.17 -1.42 1.36 -0.51 0.04 0.00 0.00 177.00 176.63 1gd0 s ASP 16 N -2.02 6.57 0.00 6.66 -0.00 -1.26 -1.97 116.67 124.64 1gd0 s ASP 16 Ca 0.73 2.79 0.00 0.00 -0.00 0.00 0.00 52.55 56.07 1gd0 s ASP 16 Cb -0.27 -2.65 0.00 0.00 -0.00 0.00 0.00 42.92 40.00 1gd0 s ASP 16 CO 0.39 -0.69 0.00 0.61 -0.00 0.00 0.00 175.17 175.48 1gd0 n GLY 17 N 0.68 1.29 0.21 0.21 0.00 -1.26 -4.95 105.19 101.37 1gd0 n GLY 17 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 1gd0 n GLY 17 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1gd0 h PHE 18 N 0.00 0.57 -0.83 1.61 3.57 -1.76 0.22 116.94 120.32 1gd0 h PHE 18 Ca 0.00 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1gd0 h PHE 18 Cb 0.00 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.52 1gd0 h PHE 18 CO 0.00 0.33 0.38 -0.07 -2.23 0.00 0.00 178.31 176.72 1gd0 h LEU 19 N 0.61 1.09 -0.53 0.59 3.38 -1.92 -1.19 115.31 117.34 1gd0 h LEU 19 Ca 0.21 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 1gd0 h LEU 19 Cb 0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1gd0 h LEU 19 CO -0.09 0.93 -0.12 0.28 0.09 0.00 0.00 178.44 179.52 1gd0 h SER 20 N 1.18 1.02 -0.46 -0.43 0.02 -1.87 -0.95 113.55 112.06 1gd0 h SER 20 Ca 0.28 -0.36 -0.03 0.00 -0.84 0.00 0.00 61.79 60.84 1gd0 h SER 20 Cb 0.14 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 1gd0 h SER 20 CO -0.03 1.14 0.15 -0.08 -1.14 0.00 0.00 176.83 176.87 1gd0 h GLU 21 N 0.89 0.70 -0.76 3.45 4.81 -0.62 -0.83 114.58 122.22 1gd0 h GLU 21 Ca 0.13 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1gd0 h GLU 21 Cb 0.69 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.93 1gd0 h GLU 21 CO 0.05 0.67 0.39 -0.07 -0.73 0.00 0.00 179.01 179.32 1gd0 h LEU 22 N 0.60 0.97 -0.05 1.64 3.38 -1.08 -0.58 115.31 120.19 1gd0 h LEU 22 Ca 0.15 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.01 1gd0 h LEU 22 Cb 0.25 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1gd0 h LEU 22 CO -0.01 0.81 0.00 0.74 0.09 0.00 0.00 178.44 180.07 1gd0 h THR 23 N 1.06 0.97 -0.21 0.22 2.02 -0.79 -0.12 112.91 116.06 1gd0 h THR 23 Ca 0.26 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.42 1gd0 h THR 23 Cb 0.07 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1gd0 h THR 23 CO -0.04 0.00 0.08 1.56 0.37 0.00 0.00 175.52 177.49 1gd0 h GLN 24 N 0.02 0.32 -0.62 6.66 4.20 -0.94 -0.88 115.11 123.87 1gd0 h GLN 24 Ca 0.02 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.61 1gd0 h GLN 24 Cb 0.02 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 1gd0 h GLN 24 CO -0.03 0.39 0.15 1.96 -0.67 0.00 0.00 178.83 180.62 1gd0 h GLN 25 N 0.18 0.98 -0.13 1.46 1.08 -1.03 -1.85 115.11 115.80 1gd0 h GLN 25 Ca 0.07 -0.22 -0.16 0.00 -1.45 0.00 0.00 58.65 56.89 1gd0 h GLN 25 Cb 0.19 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 1gd0 h GLN 25 CO -0.00 0.87 -0.59 -0.07 -0.95 0.00 0.00 178.83 178.09 1gd0 h LEU 26 N 0.94 0.49 -0.48 1.46 3.38 -0.90 -0.85 115.31 119.35 1gd0 h LEU 26 Ca 0.20 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1gd0 h LEU 26 Cb 0.34 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1gd0 h LEU 26 CO 0.00 0.97 0.24 0.00 0.09 0.00 0.00 178.44 179.75 1gd0 h ALA 27 N 1.03 0.62 -0.22 1.53 0.00 -0.85 -0.98 119.26 120.39 1gd0 h ALA 27 Ca -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1gd0 h ALA 27 Cb 1.13 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1gd0 h ALA 27 CO 0.10 0.17 0.12 0.37 0.00 0.00 0.00 179.25 180.02 1gd0 h GLN 28 N 0.64 0.30 -0.58 0.00 4.15 -1.18 -0.63 115.11 117.82 1gd0 h GLN 28 Ca 0.17 -0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.47 1gd0 h GLN 28 Cb 0.10 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 1gd0 h GLN 28 CO -0.02 0.27 0.02 0.00 -1.93 0.00 0.00 178.83 177.17 1gd0 h ALA 29 N 1.01 0.94 0.00 3.38 0.00 -0.94 -3.23 119.26 120.43 1gd0 h ALA 29 Ca 0.08 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1gd0 h ALA 29 Cb 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1gd0 h ALA 29 CO -0.01 0.64 -1.05 0.25 0.00 0.00 0.00 179.25 179.07 1gd0 n THR 30 N -4.19 0.54 -0.87 0.00 -2.24 -0.39 -4.96 114.28 102.16 1gd0 n THR 30 Ca 0.03 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 1gd0 n THR 30 Cb 0.32 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 1gd0 n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gd0 n GLY 31 N 1.20 0.91 3.84 3.38 0.00 -0.25 -4.98 105.19 109.30 1gd0 n GLY 31 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1gd0 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gd0 s LYS 32 N -0.13 4.11 0.41 1.61 -0.14 -1.21 -5.02 119.74 119.37 1gd0 s LYS 32 Ca 0.00 0.81 -0.26 0.00 -1.36 0.00 0.00 55.97 55.16 1gd0 s LYS 32 Cb 0.00 -2.47 -0.09 0.00 -1.68 0.00 0.00 37.83 33.60 1gd0 s LYS 32 CO 0.00 0.16 1.33 -1.25 -0.76 0.00 0.00 175.35 174.83 1gd0 s PRO 33 N -2.83 3.93 0.57 -1.68 0.04 -1.26 -4.57 135.00 129.20 1gd0 s PRO 33 Ca 0.54 2.21 0.26 0.00 0.04 0.00 0.00 61.00 64.04 1gd0 s PRO 33 Cb -0.11 -2.75 1.56 0.00 0.04 0.00 0.00 34.50 33.24 1gd0 s PRO 33 CO 0.17 -0.54 2.11 -1.00 0.04 0.00 0.00 177.00 177.78 1gd0 h PRO 34 N 2.64 0.00 0.00 0.56 0.13 -1.91 -0.35 132.00 133.06 1gd0 h PRO 34 Ca -0.50 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1gd0 h PRO 34 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1gd0 h PRO 34 CO 0.62 0.00 -0.01 1.96 -0.23 0.00 0.00 178.00 180.35 1gd0 h GLN 35 N 0.00 0.00 -0.38 0.86 7.50 -1.98 -1.79 115.11 119.32 1gd0 h GLN 35 Ca 0.09 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.24 1gd0 h GLN 35 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.96 1gd0 h GLN 35 CO -0.00 0.01 0.00 0.66 -1.50 0.00 0.00 178.83 178.00 1gd0 n TYR 36 N -3.33 0.49 -3.43 2.96 4.01 -0.14 -4.94 117.16 112.78 1gd0 n TYR 36 Ca -0.03 -0.31 -0.37 0.00 -0.16 0.00 0.00 57.90 57.03 1gd0 n TYR 36 Cb 0.09 -0.01 -0.07 0.00 -0.31 0.00 0.00 39.34 39.05 1gd0 n TYR 36 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1gd0 s ILE 37 N -1.22 5.24 -0.04 -0.72 -1.09 -0.68 -1.88 121.20 120.81 1gd0 s ILE 37 Ca 0.33 0.70 0.06 0.00 -2.23 0.00 0.00 60.65 59.51 1gd0 s ILE 37 Cb 0.19 -3.71 -0.02 0.00 -1.58 0.00 0.00 42.46 37.33 1gd0 s ILE 37 CO 0.26 0.33 -0.20 0.00 -1.23 0.00 0.00 174.94 174.09 1gd0 s ALA 38 N 0.79 2.40 0.02 9.38 0.00 0.04 -4.98 121.76 129.41 1gd0 s ALA 38 Ca 0.20 -1.05 0.03 0.00 0.00 0.00 0.00 51.96 51.14 1gd0 s ALA 38 Cb -0.14 -0.76 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 1gd0 s ALA 38 CO 0.07 0.53 -0.10 0.08 0.00 0.00 0.00 175.76 176.34 1gd0 s VAL 39 N -0.60 0.74 -0.07 0.00 1.01 -1.26 -1.05 120.40 119.16 1gd0 s VAL 39 Ca 0.09 -0.74 -0.03 0.00 0.00 0.00 0.00 61.98 61.30 1gd0 s VAL 39 Cb -0.11 -0.69 0.04 0.00 0.00 0.00 0.00 36.38 35.63 1gd0 s VAL 39 CO 0.00 -0.04 0.13 -2.28 0.00 0.00 0.00 175.10 172.92 1gd0 s HIS 40 N -0.72 -0.12 -0.12 5.22 5.04 -0.57 -4.98 115.29 119.04 1gd0 s HIS 40 Ca -0.01 0.51 0.02 0.00 -1.54 0.00 0.00 55.06 54.03 1gd0 s HIS 40 Cb -0.06 -0.28 -0.01 0.00 0.04 0.00 0.00 32.58 32.27 1gd0 s HIS 40 CO 0.00 -0.23 -0.18 0.08 -2.34 0.00 0.00 174.74 172.07 1gd0 s VAL 41 N 2.06 2.58 -0.41 0.89 1.01 -1.26 -1.29 120.40 123.99 1gd0 s VAL 41 Ca 0.01 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.20 1gd0 s VAL 41 Cb -0.12 -2.05 0.11 0.00 0.00 0.00 0.00 36.38 34.33 1gd0 s VAL 41 CO -0.05 0.54 0.15 -0.69 0.00 0.00 0.00 175.10 175.05 1gd0 s VAL 42 N 0.40 2.09 0.82 2.92 1.01 0.67 -4.98 120.40 123.33 1gd0 s VAL 42 Ca -0.14 -2.57 -0.06 0.00 0.00 0.00 0.00 61.98 59.21 1gd0 s VAL 42 Cb -0.17 -2.51 0.17 0.00 0.00 0.00 0.00 36.38 33.88 1gd0 s VAL 42 CO 0.06 -0.71 1.13 -2.16 0.00 0.00 0.00 175.10 173.42 1gd0 s PRO 43 N 0.53 1.16 -1.60 2.72 0.04 -1.26 -0.87 135.00 135.72 1gd0 s PRO 43 Ca 0.14 -1.01 -0.01 0.00 0.04 0.00 0.00 61.00 60.16 1gd0 s PRO 43 Cb -0.22 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.16 1gd0 s PRO 43 CO -0.06 -1.89 0.06 -0.25 0.04 0.00 0.00 177.00 174.90 1gd0 n ASP 44 N -3.20 -5.48 -4.86 6.66 8.00 -0.08 -4.85 116.55 112.74 1gd0 n ASP 44 Ca 0.17 -0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.35 1gd0 n ASP 44 Cb 0.60 -4.56 -0.05 0.00 -0.02 0.00 0.00 41.12 37.10 1gd0 n ASP 44 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1gd0 s GLN 45 N -5.12 3.90 -0.58 -1.24 -1.52 -0.51 -4.96 119.66 109.63 1gd0 s GLN 45 Ca 0.03 0.60 -0.22 0.00 -1.95 0.00 0.00 55.36 53.82 1gd0 s GLN 45 Cb -0.02 -2.39 0.06 0.00 -0.22 0.00 0.00 33.01 30.45 1gd0 s GLN 45 CO 0.04 0.04 0.85 -1.17 -0.25 0.00 0.00 175.29 174.80 1gd0 s LEU 46 N -3.46 4.56 0.11 2.90 2.96 -1.26 -4.16 118.68 120.34 1gd0 s LEU 46 Ca 0.53 -0.84 -0.06 0.00 -0.22 0.00 0.00 54.13 53.54 1gd0 s LEU 46 Cb -0.10 -2.53 -0.02 0.00 0.50 0.00 0.00 46.19 44.04 1gd0 s LEU 46 CO 0.25 -1.21 0.15 -0.04 -1.32 0.00 0.00 176.35 174.17 1gd0 s MET 47 N 3.52 0.92 0.01 1.98 -1.94 -1.26 -5.07 119.30 117.46 1gd0 s MET 47 Ca 0.21 -1.19 -0.08 0.00 -1.71 0.00 0.00 55.69 52.93 1gd0 s MET 47 Cb -0.17 0.31 0.00 0.00 2.01 0.00 0.00 34.83 36.98 1gd0 s MET 47 CO 0.13 -0.28 0.15 0.00 -0.01 0.00 0.00 175.02 175.01 1gd0 s ALA 48 N -3.95 -0.33 -0.14 3.03 0.00 -1.26 -4.55 121.76 114.55 1gd0 s ALA 48 Ca 0.14 -0.18 -0.02 0.00 0.00 0.00 0.00 51.96 51.90 1gd0 s ALA 48 Cb 0.06 0.15 0.05 0.00 0.00 0.00 0.00 23.12 23.38 1gd0 s ALA 48 CO -0.04 -0.25 0.02 0.12 0.00 0.00 0.00 175.76 175.60 1gd0 s PHE 49 N -1.73 0.86 -1.36 0.00 2.19 -0.43 -4.73 117.98 112.79 1gd0 s PHE 49 Ca -0.12 -0.55 0.00 0.00 0.33 0.00 0.00 56.93 56.59 1gd0 s PHE 49 Cb -0.06 -0.93 0.00 0.00 -1.31 0.00 0.00 43.02 40.72 1gd0 s PHE 49 CO 0.00 -0.49 0.00 0.41 1.83 0.00 0.00 175.22 176.97 1gd0 n GLY 50 N 5.09 1.23 1.59 13.12 0.00 -1.26 -2.31 105.19 122.66 1gd0 n GLY 50 Ca -0.08 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1gd0 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gd0 n GLY 51 N -1.35 0.77 3.56 -0.02 0.00 -1.26 -5.05 105.19 101.83 1gd0 n GLY 51 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 1gd0 n GLY 51 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gd0 s SER 52 N -2.88 4.41 -0.24 1.61 0.15 -0.98 -5.02 113.70 110.75 1gd0 s SER 52 Ca 0.00 -0.20 0.14 0.00 0.70 0.00 0.00 55.95 56.59 1gd0 s SER 52 Cb 0.00 -0.97 0.76 0.00 -1.71 0.00 0.00 66.02 64.10 1gd0 s SER 52 CO 0.00 0.29 1.70 -1.54 1.20 0.00 0.00 173.24 174.88 1gd0 n SER 53 N 1.66 5.26 -4.60 5.45 3.41 -1.26 -1.31 113.62 122.22 1gd0 n SER 53 Ca -0.16 -3.00 -0.29 0.00 -0.26 0.00 0.00 58.87 55.16 1gd0 n SER 53 Cb 0.52 -0.67 0.20 0.00 -0.26 0.00 0.00 64.21 64.00 1gd0 n SER 53 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1gd0 s GLU 54 N -2.82 0.16 0.21 4.33 0.41 -1.26 -4.85 118.70 114.87 1gd0 s GLU 54 Ca 0.52 0.98 -0.32 0.00 -0.41 0.00 0.00 54.97 55.75 1gd0 s GLU 54 Cb 0.41 -1.67 -0.15 0.00 -1.78 0.00 0.00 34.13 30.94 1gd0 s GLU 54 CO 0.14 -3.04 1.25 -2.30 -0.49 0.00 0.00 175.26 170.82 1gd0 n PRO 55 N -4.46 1.56 -3.94 0.39 -0.02 -1.26 -4.86 135.00 122.41 1gd0 n PRO 55 Ca 0.06 0.55 -0.08 0.00 -2.02 0.00 0.00 63.50 62.01 1gd0 n PRO 55 Cb 0.54 -2.11 -0.04 0.00 -0.02 0.00 0.00 33.50 31.88 1gd0 n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gd0 s ALA 57 N -3.95 -0.85 -0.14 0.00 0.00 -0.56 -3.63 121.76 112.62 1gd0 s ALA 57 Ca 0.18 0.83 0.02 0.00 0.00 0.00 0.00 51.96 52.98 1gd0 s ALA 57 Cb -0.03 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.69 1gd0 s ALA 57 CO 0.08 -0.19 -0.19 -0.51 0.00 0.00 0.00 175.76 174.95 1gd0 s LEU 58 N -0.19 1.97 0.26 0.00 1.43 -0.00 -1.67 118.68 120.48 1gd0 s LEU 58 Ca -0.03 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.53 1gd0 s LEU 58 Cb -0.03 -1.34 -0.05 0.00 0.03 0.00 0.00 46.19 44.79 1gd0 s LEU 58 CO 0.01 0.03 0.05 0.00 0.23 0.00 0.00 176.35 176.67 1gd0 s SER 60 N -3.35 -0.11 -0.13 0.00 1.04 -0.55 -0.67 113.70 109.94 1gd0 s SER 60 Ca 0.34 0.10 -0.00 0.00 0.48 0.00 0.00 55.95 56.87 1gd0 s SER 60 Cb 0.07 0.31 0.02 0.00 0.10 0.00 0.00 66.02 66.53 1gd0 s SER 60 CO 0.12 -0.26 -0.10 -0.22 0.98 0.00 0.00 173.24 173.76 1gd0 s LEU 61 N -0.75 1.40 -0.12 2.42 2.96 -0.02 -1.32 118.68 123.25 1gd0 s LEU 61 Ca -0.08 -0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 1gd0 s LEU 61 Cb -0.05 -0.98 -0.03 0.00 0.50 0.00 0.00 46.19 45.63 1gd0 s LEU 61 CO 0.01 -0.09 -0.07 -1.00 -1.32 0.00 0.00 176.35 173.88 1gd0 s HIS 62 N 1.61 2.95 -0.05 5.38 3.76 -0.31 -1.03 115.29 127.60 1gd0 s HIS 62 Ca 0.05 -0.26 -0.18 0.00 -0.15 0.00 0.00 55.06 54.52 1gd0 s HIS 62 Cb -0.13 -1.85 0.04 0.00 1.11 0.00 0.00 32.58 31.75 1gd0 s HIS 62 CO -0.09 0.05 0.40 0.45 -0.85 0.00 0.00 174.74 174.70 1gd0 s SER 63 N -0.03 -0.33 -0.76 1.40 0.15 -0.72 -1.48 113.70 111.93 1gd0 s SER 63 Ca -0.00 0.37 -0.23 0.00 0.70 0.00 0.00 55.95 56.80 1gd0 s SER 63 Cb -0.13 0.48 0.07 0.00 -1.71 0.00 0.00 66.02 64.73 1gd0 s SER 63 CO 0.03 -0.41 1.09 -0.63 1.20 0.00 0.00 173.24 174.52 1gd0 s ILE 64 N -0.96 4.27 0.00 6.45 1.01 -1.26 -0.53 121.20 130.18 1gd0 s ILE 64 Ca -0.10 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.04 1gd0 s ILE 64 Cb -0.04 -4.77 0.00 0.00 0.01 0.00 0.00 42.46 37.66 1gd0 s ILE 64 CO 0.04 -1.58 0.00 0.61 0.00 0.00 0.00 174.94 174.02 1gd0 n GLY 65 N 5.51 -2.42 2.36 6.18 0.00 -1.26 -4.95 105.19 110.61 1gd0 n GLY 65 Ca 0.06 -1.58 -0.17 0.00 0.00 0.00 0.00 46.02 44.32 1gd0 n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gd0 n LYS 66 N -0.74 -1.35 -4.56 1.61 4.76 -1.26 -4.91 118.16 111.70 1gd0 n LYS 66 Ca 0.00 0.88 -0.26 0.00 -2.87 0.00 0.00 58.31 56.06 1gd0 n LYS 66 Cb 0.00 -5.31 -0.17 0.00 -1.84 0.00 0.00 35.03 27.72 1gd0 n LYS 66 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1gd0 s ILE 67 N -2.83 1.25 -0.09 -0.18 -1.09 -1.26 -4.86 121.20 112.15 1gd0 s ILE 67 Ca 0.00 -0.53 -0.31 0.00 -2.23 0.00 0.00 60.65 57.57 1gd0 s ILE 67 Cb 0.00 -1.15 0.12 0.00 -1.58 0.00 0.00 42.46 39.85 1gd0 s ILE 67 CO 0.00 0.39 1.39 -0.83 -1.23 0.00 0.00 174.94 174.66 1gd0 s GLY 68 N 0.78 -0.31 0.10 6.18 0.00 -1.26 -4.99 107.32 107.82 1gd0 s GLY 68 Ca -0.12 0.43 -0.24 0.00 0.00 0.00 0.00 44.72 44.78 1gd0 s GLY 68 CO 0.02 4.65 1.41 -1.33 0.00 0.00 0.00 173.10 177.85 1gd0 h GLY 69 N 2.00 -1.26 1.24 0.20 0.00 -1.99 0.24 103.07 103.50 1gd0 h GLY 69 Ca -0.24 0.77 -0.19 0.00 0.00 0.00 0.00 47.33 47.67 1gd0 h GLY 69 CO 0.29 -0.27 -0.58 0.00 0.00 0.00 0.00 176.54 175.98 1gd0 h ALA 70 N -0.31 0.50 -0.77 3.60 0.00 -2.00 -2.67 119.26 117.61 1gd0 h ALA 70 Ca 0.06 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 1gd0 h ALA 70 Cb 0.43 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1gd0 h ALA 70 CO -0.48 0.69 0.27 1.96 0.00 0.00 0.00 179.25 181.69 1gd0 h GLN 71 N 0.60 1.18 -0.06 0.00 4.20 -1.89 -1.93 115.11 117.20 1gd0 h GLN 71 Ca 0.00 -0.24 -0.10 0.00 0.06 0.00 0.00 58.65 58.38 1gd0 h GLN 71 Cb 1.18 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.76 1gd0 h GLN 71 CO 0.12 0.98 -0.41 -0.91 -0.67 0.00 0.00 178.83 177.94 1gd0 h ASN 72 N 1.14 0.14 -0.54 1.46 2.35 -0.52 0.38 115.58 119.98 1gd0 h ASN 72 Ca 0.25 -0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.84 1gd0 h ASN 72 Cb 0.27 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 1gd0 h ASN 72 CO -0.01 0.54 -0.09 0.03 -1.65 0.00 0.00 177.43 176.25 1gd0 h ARG 73 N 0.11 1.02 -0.42 0.81 3.08 -1.09 -1.25 114.38 116.65 1gd0 h ARG 73 Ca 0.01 -0.37 -0.06 0.00 0.07 0.00 0.00 59.98 59.63 1gd0 h ARG 73 Cb 0.78 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.75 1gd0 h ARG 73 CO 0.06 1.06 0.03 1.03 -1.07 0.00 0.00 179.97 181.07 1gd0 h SER 74 N 0.90 0.70 -0.86 7.04 0.87 -0.87 -2.01 113.55 119.32 1gd0 h SER 74 Ca 0.14 -0.29 -0.02 0.00 -1.23 0.00 0.00 61.79 60.39 1gd0 h SER 74 Cb 0.65 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.39 1gd0 h SER 74 CO 0.05 0.82 0.47 1.88 -0.53 0.00 0.00 176.83 179.51 1gd0 h TYR 75 N 0.56 1.20 -0.53 2.24 0.05 -0.83 -1.32 116.97 118.33 1gd0 h TYR 75 Ca 0.12 -0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.81 1gd0 h TYR 75 Cb 0.44 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 37.78 1gd0 h TYR 75 CO 0.03 0.83 0.09 0.77 -1.05 0.00 0.00 178.16 178.83 1gd0 h SER 76 N 1.22 0.85 -0.55 3.88 0.02 -0.99 0.28 113.55 118.26 1gd0 h SER 76 Ca 0.30 -0.26 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1gd0 h SER 76 Cb 0.04 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 1gd0 h SER 76 CO -0.05 0.89 0.17 0.50 -1.14 0.00 0.00 176.83 177.20 1gd0 h LYS 77 N 0.77 0.86 0.31 3.45 3.64 -1.12 -0.15 116.57 124.34 1gd0 h LYS 77 Ca 0.16 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1gd0 h LYS 77 Cb 0.41 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1gd0 h LYS 77 CO 0.01 0.79 -0.15 1.25 -2.27 0.00 0.00 179.45 179.08 1gd0 h LEU 78 N 0.77 -0.36 -0.39 5.20 5.85 -0.88 -1.79 115.31 123.71 1gd0 h LEU 78 Ca 0.18 -0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.69 1gd0 h LEU 78 Cb 0.29 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1gd0 h LEU 78 CO -0.00 -0.17 -0.32 -0.07 -0.34 0.00 0.00 178.44 177.54 1gd0 h LEU 79 N -0.53 0.96 -1.08 2.25 3.38 -0.40 -1.73 115.31 118.16 1gd0 h LEU 79 Ca -0.04 -0.45 -0.05 0.00 0.09 0.00 0.00 57.88 57.43 1gd0 h LEU 79 Cb 0.39 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1gd0 h LEU 79 CO 0.07 1.21 0.06 0.00 0.09 0.00 0.00 178.44 179.87 1gd0 h GLY 81 N 0.92 1.09 1.17 0.00 0.00 -1.00 -0.57 103.07 104.68 1gd0 h GLY 81 Ca 0.15 -0.58 -0.14 0.00 0.00 0.00 0.00 47.33 46.76 1gd0 h GLY 81 CO 0.01 0.55 -0.28 1.41 0.00 0.00 0.00 176.54 178.23 1gd0 h LEU 82 N 0.97 0.96 -1.05 3.11 3.38 -0.87 -1.08 115.31 120.74 1gd0 h LEU 82 Ca 0.23 -0.39 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 1gd0 h LEU 82 Cb 0.18 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1gd0 h LEU 82 CO -0.02 1.17 -0.27 -0.07 0.09 0.00 0.00 178.44 179.34 1gd0 h LEU 83 N 0.79 0.35 -0.03 1.67 3.38 -0.73 0.76 115.31 121.50 1gd0 h LEU 83 Ca 0.09 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1gd0 h LEU 83 Cb 0.85 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1gd0 h LEU 83 CO 0.07 0.62 -0.11 0.00 0.09 0.00 0.00 178.44 179.11 1gd0 h ALA 84 N 1.41 0.06 -0.05 1.53 0.00 -0.97 -1.11 119.26 120.13 1gd0 h ALA 84 Ca 0.05 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1gd0 h ALA 84 Cb 0.64 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1gd0 h ALA 84 CO 0.05 -0.04 0.01 1.49 0.00 0.00 0.00 179.25 180.76 1gd0 h GLU 85 N -0.45 0.07 0.17 0.00 4.81 -1.12 -1.90 114.58 116.17 1gd0 h GLU 85 Ca -0.01 -0.02 -0.34 0.00 -0.13 0.00 0.00 59.36 58.86 1gd0 h GLU 85 Cb 0.75 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.13 1gd0 h GLU 85 CO 0.02 0.28 -1.72 0.00 -0.73 0.00 0.00 179.01 176.86 1gd0 h ARG 86 N -0.14 0.36 -0.01 1.92 2.47 -0.96 -3.39 114.38 114.63 1gd0 h ARG 86 Ca 0.01 -0.62 0.00 0.00 -1.26 0.00 0.00 59.98 58.12 1gd0 h ARG 86 Cb 0.23 0.23 0.00 0.00 -1.65 0.00 0.00 29.97 28.78 1gd0 h ARG 86 CO 0.00 1.27 -0.08 1.28 0.56 0.00 0.00 179.97 183.00 1gd0 n LEU 87 N -3.55 1.93 -2.95 3.04 4.77 -0.48 -4.63 117.00 115.12 1gd0 n LEU 87 Ca -0.23 -0.93 -0.21 0.00 -0.03 0.00 0.00 56.01 54.61 1gd0 n LEU 87 Cb 1.07 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.21 1gd0 n LEU 87 CO 0.51 0.36 0.10 0.54 -1.33 0.00 0.00 177.39 177.56 1gd0 n ARG 88 N 0.48 -5.59 -3.94 3.23 5.12 -0.71 -4.96 116.66 110.29 1gd0 n ARG 88 Ca 0.07 0.78 -0.35 0.00 -1.93 0.00 0.00 57.85 56.43 1gd0 n ARG 88 Cb 0.32 -5.49 -0.10 0.00 -1.16 0.00 0.00 32.46 26.03 1gd0 n ARG 88 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1gd0 s ILE 89 N -3.19 4.90 0.20 0.55 1.01 -1.02 -4.92 121.20 118.74 1gd0 s ILE 89 Ca 0.38 0.01 -0.31 0.00 0.00 0.00 0.00 60.65 60.73 1gd0 s ILE 89 Cb -0.17 -3.22 -0.09 0.00 0.01 0.00 0.00 42.46 38.99 1gd0 s ILE 89 CO 0.47 0.45 1.44 -0.44 0.00 0.00 0.00 174.94 176.86 1gd0 s SER 90 N 0.45 6.71 0.56 3.58 0.01 -1.26 -3.30 113.70 120.44 1gd0 s SER 90 Ca 0.04 2.56 0.27 0.00 1.31 0.00 0.00 55.95 60.13 1gd0 s SER 90 Cb -0.12 -2.61 1.48 0.00 0.21 0.00 0.00 66.02 64.98 1gd0 s SER 90 CO 0.00 -0.69 1.98 -0.65 0.41 0.00 0.00 173.24 174.29 1gd0 h PRO 91 N 5.72 0.00 -0.07 12.44 0.11 -1.96 0.16 132.00 148.40 1gd0 h PRO 91 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1gd0 h PRO 91 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1gd0 h PRO 91 CO 0.82 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.21 1gd0 n ASP 92 N -4.03 0.42 -0.52 -2.05 5.75 -1.26 -2.69 116.55 112.17 1gd0 n ASP 92 Ca 0.08 -1.82 0.07 0.00 -0.01 0.00 0.00 54.79 53.10 1gd0 n ASP 92 Cb 0.58 -0.04 0.17 0.00 -1.03 0.00 0.00 41.12 40.80 1gd0 n ASP 92 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gd0 n ARG 93 N -0.35 1.32 -4.84 0.11 1.74 0.55 -5.01 116.66 110.19 1gd0 n ARG 93 Ca 0.07 -2.92 -0.27 0.00 -0.77 0.00 0.00 57.85 53.95 1gd0 n ARG 93 Cb 0.09 -1.42 -0.17 0.00 -1.02 0.00 0.00 32.46 29.94 1gd0 n ARG 93 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1gd0 s VAL 94 N -2.77 1.49 0.01 1.55 1.01 -1.09 -1.50 120.40 119.09 1gd0 s VAL 94 Ca 0.35 -0.70 0.08 0.00 0.00 0.00 0.00 61.98 61.71 1gd0 s VAL 94 Cb 0.33 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 1gd0 s VAL 94 CO -0.05 0.43 -0.25 -0.31 0.00 0.00 0.00 175.10 174.92 1gd0 s TYR 95 N 0.48 2.26 -0.10 5.22 2.02 -0.67 -4.99 117.35 121.57 1gd0 s TYR 95 Ca -0.15 -0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 56.12 1gd0 s TYR 95 Cb -0.16 -1.42 0.03 0.00 -0.40 0.00 0.00 41.96 40.01 1gd0 s TYR 95 CO 0.05 0.02 -0.02 0.42 -1.57 0.00 0.00 175.55 174.46 1gd0 s ILE 96 N -0.68 0.61 -0.15 2.71 1.01 -1.26 -0.60 121.20 122.85 1gd0 s ILE 96 Ca 0.10 -0.11 -0.18 0.00 0.00 0.00 0.00 60.65 60.46 1gd0 s ILE 96 Cb -0.10 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 1gd0 s ILE 96 CO 0.00 0.23 0.50 0.20 0.00 0.00 0.00 174.94 175.87 1gd0 s ASN 97 N 1.87 6.65 -0.12 3.58 0.01 0.15 -4.94 114.94 122.14 1gd0 s ASN 97 Ca 0.04 0.77 -0.06 0.00 -0.71 0.00 0.00 52.86 52.91 1gd0 s ASN 97 Cb -0.13 -2.29 -0.04 0.00 0.41 0.00 0.00 41.25 39.20 1gd0 s ASN 97 CO -0.06 -0.07 0.10 -0.31 -1.51 0.00 0.00 177.10 175.24 1gd0 s TYR 98 N 1.01 3.44 -0.10 2.20 2.02 -1.26 -0.84 117.35 123.83 1gd0 s TYR 98 Ca 0.26 0.39 0.00 0.00 -0.37 0.00 0.00 57.07 57.35 1gd0 s TYR 98 Cb -0.15 -1.93 0.02 0.00 -0.40 0.00 0.00 41.96 39.50 1gd0 s TYR 98 CO 0.10 0.58 -0.08 0.71 -1.57 0.00 0.00 175.55 175.30 1gd0 s TYR 99 N -0.76 1.39 -0.56 2.71 2.02 -0.20 -4.96 117.35 116.99 1gd0 s TYR 99 Ca 0.13 -0.64 -0.19 0.00 -0.37 0.00 0.00 57.07 56.01 1gd0 s TYR 99 Cb -0.12 -1.14 0.09 0.00 -0.40 0.00 0.00 41.96 40.39 1gd0 s TYR 99 CO 0.03 -0.43 0.67 0.34 -1.57 0.00 0.00 175.55 174.58 1gd0 s ASP 100 N 1.45 6.19 0.23 2.29 -1.08 -1.26 -1.75 116.67 122.73 1gd0 s ASP 100 Ca -0.00 -1.32 -0.25 0.00 -0.52 0.00 0.00 52.55 50.46 1gd0 s ASP 100 Cb -0.13 -2.29 -0.09 0.00 -1.46 0.00 0.00 42.92 38.95 1gd0 s ASP 100 CO -0.05 -1.03 0.83 -0.04 0.52 0.00 0.00 175.17 175.39 1gd0 s MET 101 N 2.59 4.53 0.26 4.34 -1.94 0.31 -4.88 119.30 124.52 1gd0 s MET 101 Ca 0.12 1.17 -0.28 0.00 -1.71 0.00 0.00 55.69 54.99 1gd0 s MET 101 Cb -0.23 -3.06 -0.09 0.00 2.01 0.00 0.00 34.83 33.46 1gd0 s MET 101 CO 0.07 0.45 0.92 -0.80 -0.01 0.00 0.00 175.02 175.66 1gd0 s ASN 102 N -1.39 7.50 0.36 3.03 0.01 -1.26 -4.01 114.94 119.17 1gd0 s ASN 102 Ca 0.42 1.87 0.10 0.00 -0.71 0.00 0.00 52.86 54.54 1gd0 s ASN 102 Cb -0.21 -2.59 0.85 0.00 0.41 0.00 0.00 41.25 39.72 1gd0 s ASN 102 CO 0.25 0.08 1.85 0.00 -1.51 0.00 0.00 177.10 177.77 1gd0 h ALA 103 N 3.79 1.87 0.00 0.60 0.00 -1.95 0.71 119.26 124.28 1gd0 h ALA 103 Ca -0.46 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1gd0 h ALA 103 Cb 1.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1gd0 h ALA 103 CO 0.67 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.78 1gd0 h ALA 104 N 1.60 1.00 -0.53 0.00 0.00 -1.92 -2.83 119.26 116.58 1gd0 h ALA 104 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1gd0 h ALA 104 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1gd0 h ALA 104 CO -0.22 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.12 1gd0 n ASN 105 N -2.33 4.96 -3.93 0.00 5.03 0.24 -4.84 115.26 114.39 1gd0 n ASN 105 Ca 0.01 -2.75 -0.29 0.00 0.87 0.00 0.00 54.58 52.42 1gd0 n ASN 105 Cb 0.21 -0.60 -0.16 0.00 -1.02 0.00 0.00 39.78 38.20 1gd0 n ASN 105 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1gd0 s VAL 106 N -2.40 1.34 0.26 2.41 1.01 -1.10 -4.88 120.40 117.03 1gd0 s VAL 106 Ca 0.50 -0.84 -0.15 0.00 0.00 0.00 0.00 61.98 61.48 1gd0 s VAL 106 Cb 0.36 -1.50 -0.08 0.00 0.00 0.00 0.00 36.38 35.16 1gd0 s VAL 106 CO 0.17 0.10 0.68 -0.83 0.00 0.00 0.00 175.10 175.23 1gd0 s GLY 107 N 1.52 2.42 -0.28 4.51 0.00 -1.26 -2.54 107.32 111.68 1gd0 s GLY 107 Ca -0.01 0.01 -0.25 0.00 0.00 0.00 0.00 44.72 44.47 1gd0 s GLY 107 CO -0.08 0.25 1.04 0.86 0.00 0.00 0.00 173.10 175.18 1gd0 s TRP 108 N -1.77 -0.47 -1.34 1.90 -0.00 0.51 -4.94 118.94 112.84 1gd0 s TRP 108 Ca 0.48 1.13 -0.03 0.00 -0.00 0.00 0.00 56.10 57.68 1gd0 s TRP 108 Cb -0.13 0.37 -0.00 0.00 -0.00 0.00 0.00 33.47 33.71 1gd0 s TRP 108 CO 0.19 -0.22 0.55 -1.71 -0.00 0.00 0.00 176.95 175.75 1gd0 n ASN 109 N 2.22 -1.30 0.00 5.86 4.05 -1.26 -1.67 115.26 123.16 1gd0 n ASN 109 Ca -0.12 -0.96 0.00 0.00 0.45 0.00 0.00 54.58 53.94 1gd0 n ASN 109 Cb 0.56 -3.36 0.00 0.00 1.23 0.00 0.00 39.78 38.20 1gd0 n ASN 109 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1gd0 n ASN 110 N -2.96 -2.45 0.00 1.20 3.02 -1.26 -4.89 115.26 107.93 1gd0 n ASN 110 Ca -0.28 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 1gd0 n ASN 110 Cb 0.67 -1.67 0.00 0.00 -0.61 0.00 0.00 39.78 38.17 1gd0 n ASN 110 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1gd0 n SER 111 N -0.27 0.00 -2.36 6.41 2.88 -0.67 -5.19 113.62 114.42 1gd0 n SER 111 Ca 0.00 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.44 1gd0 n SER 111 Cb 0.14 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.57 1gd0 n SER 111 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1gd0 n THR 112 N 0.00 0.00 0.93 2.46 -2.24 -1.26 -0.36 114.28 113.81 1gd0 n THR 112 Ca 0.00 -0.96 0.05 0.00 -2.27 0.00 0.00 64.05 60.87 1gd0 n THR 112 Cb 0.00 0.37 0.15 0.00 -2.10 0.00 0.00 70.33 68.75 1gd0 n THR 112 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1gd0 n PHE 113 N -0.35 0.45 -3.39 4.78 3.72 -1.05 -4.55 117.46 117.07 1gd0 n PHE 113 Ca -0.02 -0.22 -0.45 0.00 -0.05 0.00 0.00 57.45 56.71 1gd0 n PHE 113 Cb 0.25 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.75 1gd0 n PHE 113 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1gd0 s ALA 114 N -1.55 3.93 -1.05 4.37 0.00 -1.23 -4.75 121.76 121.49 1gd0 s ALA 114 Ca 0.23 -3.18 0.10 0.00 0.00 0.00 0.00 51.96 49.10 1gd0 s ALA 114 Cb 0.12 -3.34 0.17 0.00 0.00 0.00 0.00 23.12 20.07 1gd0 s ALA 114 CO 0.15 -2.21 1.02 1.28 0.00 0.00 0.00 175.76 176.01 1gd0 n LEU 115 N 4.11 2.32 0.01 0.00 4.77 -1.26 -4.69 117.00 122.26 1gd0 n LEU 115 Ca 0.08 -1.49 0.01 0.00 -0.03 0.00 0.00 56.01 54.58 1gd0 n LEU 115 Cb 0.45 -0.10 -0.10 0.00 -2.33 0.00 0.00 43.42 41.34 1gd0 n LEU 115 CO 0.36 0.53 -0.44 -0.62 -1.33 0.00 0.00 177.39 175.89 1gd0 n GLU 116 N 0.49 0.63 -4.15 3.23 4.71 -1.26 -4.99 120.64 119.31 1gd0 n GLU 116 Ca 0.08 0.14 -0.13 0.00 -0.01 0.00 0.00 57.16 57.24 1gd0 n GLU 116 Cb 0.33 -1.74 -0.11 0.00 -1.01 0.00 0.00 31.44 28.91 1gd0 n GLU 116 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 1gd0 s HIS 117 N -2.96 0.93 0.00 -0.32 3.76 -1.26 -5.34 115.29 110.10 1gd0 s HIS 117 Ca -0.04 -0.68 0.00 0.00 -0.15 0.00 0.00 55.06 54.19 1gd0 s HIS 117 Cb 0.09 -0.52 0.00 0.00 1.11 0.00 0.00 32.58 33.26 1gd0 s HIS 117 CO 0.82 -0.06 0.38 0.72 -0.85 0.00 0.00 174.74 175.76