#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 0.48 -0.12 -0.52 0.23 -0.53 -1.11 119.30 117.73 1gd0 s MET 2 Ca 0.00 -0.10 0.02 0.00 -1.03 0.00 0.00 55.69 54.58 1gd0 s MET 2 Cb 0.00 -0.51 0.01 0.00 -1.53 0.00 0.00 34.83 32.80 1gd0 s MET 2 CO 0.00 0.01 -0.18 0.12 -2.03 0.00 0.00 175.02 172.94 1gd0 s PHE 3 N 0.38 2.22 -0.06 3.16 5.36 -0.35 -1.12 117.98 127.56 1gd0 s PHE 3 Ca -0.04 -1.06 0.05 0.00 -0.96 0.00 0.00 56.93 54.91 1gd0 s PHE 3 Cb -0.08 -1.56 -0.02 0.00 -0.34 0.00 0.00 43.02 41.03 1gd0 s PHE 3 CO -0.00 -0.52 -0.20 0.42 -1.46 0.00 0.00 175.22 173.46 1gd0 s ILE 4 N 0.90 2.52 -0.11 3.12 -1.09 -0.31 -1.32 121.20 124.90 1gd0 s ILE 4 Ca -0.07 -0.90 0.00 0.00 -2.23 0.00 0.00 60.65 57.44 1gd0 s ILE 4 Cb -0.15 -1.96 0.02 0.00 -1.58 0.00 0.00 42.46 38.79 1gd0 s ILE 4 CO -0.01 0.57 -0.10 -0.69 -1.23 0.00 0.00 174.94 173.48 1gd0 s VAL 5 N -0.30 1.15 -0.15 2.92 1.01 -0.30 -1.36 120.40 123.37 1gd0 s VAL 5 Ca 0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1gd0 s VAL 5 Cb -0.13 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 1gd0 s VAL 5 CO 0.03 0.38 -0.05 0.20 0.00 0.00 0.00 175.10 175.66 1gd0 s ASN 6 N 1.51 4.66 0.04 3.32 0.01 -0.13 -0.49 114.94 123.87 1gd0 s ASN 6 Ca 0.02 -0.16 -0.12 0.00 -0.71 0.00 0.00 52.86 51.90 1gd0 s ASN 6 Cb -0.13 -1.73 0.01 0.00 0.41 0.00 0.00 41.25 39.81 1gd0 s ASN 6 CO -0.07 0.18 0.25 0.28 -1.51 0.00 0.00 177.10 176.23 1gd0 s THR 7 N 0.31 0.10 -2.24 1.60 -1.32 -0.10 -1.27 115.64 112.70 1gd0 s THR 7 Ca -0.05 -0.80 0.28 0.00 -1.21 0.00 0.00 61.69 59.91 1gd0 s THR 7 Cb -0.14 -0.95 0.49 0.00 -1.51 0.00 0.00 72.50 70.39 1gd0 s THR 7 CO 0.03 -0.44 1.73 -0.46 -2.21 0.00 0.00 174.62 173.28 1gd0 n ASN 8 N 0.59 1.25 -4.77 8.08 6.94 -1.23 -1.36 115.26 124.75 1gd0 n ASN 8 Ca -0.18 -1.27 -0.41 0.00 -0.02 0.00 0.00 54.58 52.70 1gd0 n ASN 8 Cb 0.59 0.03 -0.01 0.00 -2.36 0.00 0.00 39.78 38.03 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 -2.15 2.40 0.65 3.53 1.01 -1.26 -4.26 120.40 120.32 1gd0 s VAL 9 Ca 0.35 0.40 -0.17 0.00 0.00 0.00 0.00 61.98 62.56 1gd0 s VAL 9 Cb 0.21 -3.25 -0.00 0.00 0.00 0.00 0.00 36.38 33.33 1gd0 s VAL 9 CO 0.39 0.09 1.18 -2.84 0.00 0.00 0.00 175.10 173.92 1gd0 s PRO 10 N -1.97 2.66 0.34 2.72 0.02 -1.26 -0.97 135.00 136.53 1gd0 s PRO 10 Ca 0.51 1.69 0.03 0.00 0.02 0.00 0.00 61.00 63.26 1gd0 s PRO 10 Cb -0.43 -1.90 0.65 0.00 0.02 0.00 0.00 34.50 32.84 1gd0 s PRO 10 CO 0.57 -1.42 1.96 -0.09 -0.33 0.00 0.00 177.00 177.69 1gd0 h ARG 11 N 0.29 0.85 -0.05 5.54 2.43 -1.93 -1.16 114.38 120.34 1gd0 h ARG 11 Ca -0.49 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 58.65 1gd0 h ARG 11 Cb 1.28 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1gd0 h ARG 11 CO 0.53 0.56 0.07 0.00 -1.51 0.00 0.00 179.97 179.62 1gd0 h ALA 12 N 1.57 1.54 -0.01 2.80 0.00 -2.03 -1.11 119.26 122.03 1gd0 h ALA 12 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1gd0 h ALA 12 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1gd0 h ALA 12 CO -0.10 -0.10 -0.04 0.43 0.00 0.00 0.00 179.25 179.44 1gd0 n SER 13 N -3.72 0.90 -4.66 0.00 7.64 -0.44 -4.78 113.62 108.56 1gd0 n SER 13 Ca -0.02 -1.15 -0.42 0.00 1.01 0.00 0.00 58.87 58.29 1gd0 n SER 13 Cb 0.16 -0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.32 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 -2.13 4.83 0.48 0.44 1.01 -0.42 -4.76 120.40 119.85 1gd0 s VAL 14 Ca 0.38 1.72 -0.19 0.00 0.00 0.00 0.00 61.98 63.89 1gd0 s VAL 14 Cb 0.21 -4.18 -0.09 0.00 0.00 0.00 0.00 36.38 32.32 1gd0 s VAL 14 CO 0.39 -0.03 0.99 -2.16 0.00 0.00 0.00 175.10 174.28 1gd0 s PRO 15 N 2.47 3.98 0.29 2.72 0.04 -1.26 -4.98 135.00 138.26 1gd0 s PRO 15 Ca 0.39 1.11 -0.30 0.00 0.04 0.00 0.00 61.00 62.25 1gd0 s PRO 15 Cb -0.16 -2.14 -0.12 0.00 0.04 0.00 0.00 34.50 32.12 1gd0 s PRO 15 CO 0.11 -0.25 1.42 -0.25 0.04 0.00 0.00 177.00 178.07 1gd0 n ASP 16 N -1.14 3.10 0.00 6.66 10.43 -1.26 -1.98 116.55 132.36 1gd0 n ASP 16 Ca 0.07 1.17 0.00 0.00 2.57 0.00 0.00 54.79 58.60 1gd0 n ASP 16 Cb 0.54 -1.50 0.00 0.00 1.84 0.00 0.00 41.12 42.00 1gd0 n ASP 16 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1gd0 n GLY 17 N 1.62 0.52 0.10 0.44 0.00 -1.26 -4.99 105.19 101.62 1gd0 n GLY 17 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 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 0.23 -0.73 1.61 3.57 -1.78 -0.16 116.94 119.69 1gd0 h PHE 18 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1gd0 h PHE 18 Cb 0.00 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 1gd0 h PHE 18 CO 0.00 0.19 0.40 -0.07 -2.23 0.00 0.00 178.31 176.59 1gd0 h LEU 19 N 0.22 0.90 -0.54 0.59 3.38 -1.94 -1.35 115.31 116.56 1gd0 h LEU 19 Ca 0.06 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1gd0 h LEU 19 Cb 0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1gd0 h LEU 19 CO -0.01 0.72 -0.22 0.28 0.09 0.00 0.00 178.44 179.30 1gd0 h SER 20 N 1.01 0.96 -0.45 -0.43 0.02 -1.88 -1.13 113.55 111.66 1gd0 h SER 20 Ca 0.26 -0.36 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 1gd0 h SER 20 Cb 0.02 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 1gd0 h SER 20 CO -0.04 1.14 0.14 -0.08 -1.14 0.00 0.00 176.83 176.85 1gd0 h GLU 21 N 0.81 0.70 -0.47 3.45 4.81 -0.66 -0.26 114.58 122.96 1gd0 h GLU 21 Ca 0.11 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1gd0 h GLU 21 Cb 0.79 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 1gd0 h GLU 21 CO 0.07 0.67 0.21 -0.07 -0.73 0.00 0.00 179.01 179.16 1gd0 h LEU 22 N 0.59 0.64 0.09 1.64 3.38 -1.14 0.09 115.31 120.59 1gd0 h LEU 22 Ca 0.15 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1gd0 h LEU 22 Cb 0.26 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1gd0 h LEU 22 CO -0.00 0.61 -0.11 0.74 0.09 0.00 0.00 178.44 179.77 1gd0 h THR 23 N 0.62 0.74 -0.40 0.22 2.02 -0.95 -0.65 112.91 114.52 1gd0 h THR 23 Ca 0.16 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.30 1gd0 h THR 23 Cb 0.16 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1gd0 h THR 23 CO -0.02 0.00 0.11 1.56 0.37 0.00 0.00 175.52 177.55 1gd0 h GLN 24 N -0.23 0.63 -0.15 6.66 4.20 -0.92 -1.51 115.11 123.79 1gd0 h GLN 24 Ca 0.01 -0.14 -0.11 0.00 0.06 0.00 0.00 58.65 58.47 1gd0 h GLN 24 Cb 0.24 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1gd0 h GLN 24 CO -0.05 0.64 -0.38 1.96 -0.67 0.00 0.00 178.83 180.33 1gd0 h GLN 25 N 0.51 0.32 -0.08 1.46 1.08 -0.93 -1.97 115.11 115.49 1gd0 h GLN 25 Ca 0.13 -0.15 -0.16 0.00 -1.45 0.00 0.00 58.65 57.02 1gd0 h GLN 25 Cb 0.28 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 1gd0 h GLN 25 CO -0.00 0.66 -0.63 -0.07 -0.95 0.00 0.00 178.83 177.84 1gd0 h LEU 26 N 0.27 0.35 -0.12 1.46 3.38 -0.99 -0.57 115.31 119.09 1gd0 h LEU 26 Ca 0.03 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1gd0 h LEU 26 Cb 0.80 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1gd0 h LEU 26 CO 0.06 0.88 0.06 0.00 0.09 0.00 0.00 178.44 179.54 1gd0 h ALA 27 N 1.12 0.16 -0.38 1.53 0.00 -1.01 -0.51 119.26 120.17 1gd0 h ALA 27 Ca -0.01 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1gd0 h ALA 27 Cb 1.15 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1gd0 h ALA 27 CO 0.10 -0.28 0.22 0.37 0.00 0.00 0.00 179.25 179.66 1gd0 h GLN 28 N 0.07 0.44 -0.34 0.00 5.75 -1.21 -0.85 115.11 118.96 1gd0 h GLN 28 Ca 0.04 -0.03 -0.06 0.00 -0.15 0.00 0.00 58.65 58.45 1gd0 h GLN 28 Cb 0.12 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.56 1gd0 h GLN 28 CO -0.01 0.29 -0.04 0.00 -2.65 0.00 0.00 178.83 176.42 1gd0 h ALA 29 N 1.17 0.47 0.00 3.38 0.00 -0.90 -3.25 119.26 120.13 1gd0 h ALA 29 Ca 0.15 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1gd0 h ALA 29 Cb 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1gd0 h ALA 29 CO -0.08 0.27 -0.50 1.79 0.00 0.00 0.00 179.25 180.73 1gd0 h THR 30 N 0.43 0.00 0.00 0.00 1.35 -1.09 -3.48 112.91 110.12 1gd0 h THR 30 Ca 0.09 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 1gd0 h THR 30 Cb 0.52 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 1gd0 h THR 30 CO 0.03 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 1gd0 n GLY 31 N 1.30 0.63 3.87 5.82 0.00 -0.33 -4.96 105.19 111.53 1gd0 n GLY 31 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.21 3.82 0.33 1.61 -0.14 -1.21 -5.04 119.74 118.90 1gd0 s LYS 32 Ca 0.00 0.30 -0.29 0.00 -1.36 0.00 0.00 55.97 54.62 1gd0 s LYS 32 Cb 0.00 -2.65 -0.12 0.00 -1.68 0.00 0.00 37.83 33.38 1gd0 s LYS 32 CO 0.00 0.32 1.52 -2.30 -0.76 0.00 0.00 175.35 174.12 1gd0 n PRO 33 N -0.10 2.62 0.20 -1.68 -0.02 -1.26 -4.58 135.00 130.17 1gd0 n PRO 33 Ca 0.00 0.92 0.13 0.00 -2.02 0.00 0.00 63.50 62.54 1gd0 n PRO 33 Cb 0.52 -2.66 0.73 0.00 -0.02 0.00 0.00 33.50 32.07 1gd0 n PRO 33 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1gd0 h PRO 34 N 3.76 0.00 0.00 0.52 0.13 -1.91 -0.78 132.00 133.72 1gd0 h PRO 34 Ca -0.48 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1gd0 h PRO 34 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1gd0 h PRO 34 CO 0.71 0.00 -0.00 1.96 -0.23 0.00 0.00 178.00 180.44 1gd0 h GLN 35 N 0.00 0.00 -0.46 0.86 7.50 -1.98 -1.83 115.11 119.21 1gd0 h GLN 35 Ca 0.07 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.22 1gd0 h GLN 35 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.84 1gd0 h GLN 35 CO -0.00 0.00 0.00 0.66 -1.50 0.00 0.00 178.83 177.99 1gd0 n TYR 36 N -3.12 0.61 -3.48 2.96 4.01 -0.30 -4.94 117.16 112.90 1gd0 n TYR 36 Ca -0.03 -0.40 -0.37 0.00 -0.16 0.00 0.00 57.90 56.94 1gd0 n TYR 36 Cb 0.09 -0.01 -0.08 0.00 -0.31 0.00 0.00 39.34 39.03 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 -1.10 5.26 0.02 -0.72 -1.09 -0.69 -1.90 121.20 120.98 1gd0 s ILE 37 Ca 0.35 0.58 0.07 0.00 -2.23 0.00 0.00 60.65 59.42 1gd0 s ILE 37 Cb 0.19 -3.66 -0.03 0.00 -1.58 0.00 0.00 42.46 37.37 1gd0 s ILE 37 CO 0.25 0.31 -0.20 0.00 -1.23 0.00 0.00 174.94 174.08 1gd0 s ALA 38 N 0.96 2.51 0.02 9.38 0.00 -0.27 -4.98 121.76 129.40 1gd0 s ALA 38 Ca 0.17 -1.17 0.02 0.00 0.00 0.00 0.00 51.96 50.98 1gd0 s ALA 38 Cb -0.14 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.25 1gd0 s ALA 38 CO 0.06 0.56 -0.07 0.14 0.00 0.00 0.00 175.76 176.45 1gd0 s VAL 39 N -0.85 0.54 -0.05 0.00 -7.23 -1.26 -1.21 120.40 110.34 1gd0 s VAL 39 Ca 0.13 -0.74 -0.02 0.00 -1.81 0.00 0.00 61.98 59.54 1gd0 s VAL 39 Cb -0.10 -0.55 0.03 0.00 0.56 0.00 0.00 36.38 36.33 1gd0 s VAL 39 CO 0.04 -0.15 0.09 -2.28 -0.31 0.00 0.00 175.10 172.48 1gd0 s HIS 40 N -0.84 -0.02 -0.15 2.82 5.04 -0.44 -4.97 115.29 116.73 1gd0 s HIS 40 Ca -0.04 0.34 0.00 0.00 -1.54 0.00 0.00 55.06 53.82 1gd0 s HIS 40 Cb -0.07 -0.35 -0.00 0.00 0.04 0.00 0.00 32.58 32.20 1gd0 s HIS 40 CO 0.00 -0.19 -0.16 0.08 -2.34 0.00 0.00 174.74 172.14 1gd0 s VAL 41 N 1.90 2.67 -0.40 0.89 1.01 -1.26 -1.15 120.40 124.06 1gd0 s VAL 41 Ca 0.01 -0.77 0.04 0.00 0.00 0.00 0.00 61.98 61.25 1gd0 s VAL 41 Cb -0.12 -2.12 0.11 0.00 0.00 0.00 0.00 36.38 34.25 1gd0 s VAL 41 CO -0.04 0.52 0.12 -0.69 0.00 0.00 0.00 175.10 175.01 1gd0 s VAL 42 N 0.71 2.29 0.78 2.92 1.01 0.36 -4.99 120.40 123.48 1gd0 s VAL 42 Ca -0.07 -2.61 -0.03 0.00 0.00 0.00 0.00 61.98 59.27 1gd0 s VAL 42 Cb -0.16 -2.66 0.16 0.00 0.00 0.00 0.00 36.38 33.73 1gd0 s VAL 42 CO 0.02 -0.67 1.07 -2.16 0.00 0.00 0.00 175.10 173.36 1gd0 s PRO 43 N 0.55 1.35 -2.00 2.72 0.04 -1.26 -0.93 135.00 135.48 1gd0 s PRO 43 Ca 0.13 -1.15 0.00 0.00 0.04 0.00 0.00 61.00 60.02 1gd0 s PRO 43 Cb -0.21 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1gd0 s PRO 43 CO -0.06 -1.72 0.00 -0.25 0.04 0.00 0.00 177.00 175.01 1gd0 n ASP 44 N -3.03 -5.75 -4.85 6.66 8.00 -0.14 -4.85 116.55 112.58 1gd0 n ASP 44 Ca 0.17 0.23 -0.32 0.00 0.71 0.00 0.00 54.79 55.59 1gd0 n ASP 44 Cb 0.61 -4.91 -0.02 0.00 -0.02 0.00 0.00 41.12 36.78 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 -4.45 3.83 -0.69 -1.24 -1.52 -0.47 -4.94 119.66 110.19 1gd0 s GLN 45 Ca 0.00 0.84 -0.21 0.00 -1.95 0.00 0.00 55.36 54.04 1gd0 s GLN 45 Cb 0.00 -2.15 0.09 0.00 -0.22 0.00 0.00 33.01 30.73 1gd0 s GLN 45 CO 0.00 -0.33 0.92 -1.17 -0.25 0.00 0.00 175.29 174.46 1gd0 s LEU 46 N -4.36 4.77 0.09 2.90 2.96 -1.26 -4.17 118.68 119.61 1gd0 s LEU 46 Ca 0.57 -1.28 -0.05 0.00 -0.22 0.00 0.00 54.13 53.14 1gd0 s LEU 46 Cb -0.10 -2.38 -0.02 0.00 0.50 0.00 0.00 46.19 44.19 1gd0 s LEU 46 CO 0.38 -1.29 0.12 0.00 -1.32 0.00 0.00 176.35 174.23 1gd0 s MET 47 N 3.46 0.83 0.02 1.98 0.23 -1.26 -5.07 119.30 119.49 1gd0 s MET 47 Ca 0.21 -1.13 0.00 0.00 -1.03 0.00 0.00 55.69 53.75 1gd0 s MET 47 Cb -0.17 0.30 -0.02 0.00 -1.53 0.00 0.00 34.83 33.41 1gd0 s MET 47 CO 0.06 -0.24 -0.04 0.00 -2.03 0.00 0.00 175.02 172.77 1gd0 s ALA 48 N -3.92 0.19 -0.11 3.16 0.00 -1.26 -4.61 121.76 115.21 1gd0 s ALA 48 Ca 0.10 -0.60 -0.01 0.00 0.00 0.00 0.00 51.96 51.45 1gd0 s ALA 48 Cb 0.06 0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.34 1gd0 s ALA 48 CO -0.08 -0.13 -0.04 0.12 0.00 0.00 0.00 175.76 175.64 1gd0 s PHE 49 N -1.39 1.18 -1.35 0.00 2.19 -0.47 -4.69 117.98 113.44 1gd0 s PHE 49 Ca -0.14 -0.59 0.00 0.00 0.33 0.00 0.00 56.93 56.53 1gd0 s PHE 49 Cb -0.10 -1.07 0.00 0.00 -1.31 0.00 0.00 43.02 40.54 1gd0 s PHE 49 CO -0.01 -0.47 0.00 0.41 1.83 0.00 0.00 175.22 176.98 1gd0 n GLY 50 N 5.02 0.79 2.88 13.12 0.00 -1.26 -2.33 105.19 123.40 1gd0 n GLY 50 Ca -0.10 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.18 0.88 3.65 -0.02 0.00 -1.26 -5.02 105.19 102.24 1gd0 n GLY 51 Ca -0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.80 4.90 -0.25 1.61 0.15 -0.99 -5.03 113.70 111.29 1gd0 s SER 52 Ca 0.00 -0.12 0.13 0.00 0.70 0.00 0.00 55.95 56.66 1gd0 s SER 52 Cb 0.00 -1.19 0.74 0.00 -1.71 0.00 0.00 66.02 63.87 1gd0 s SER 52 CO 0.00 0.24 1.70 -1.20 1.20 0.00 0.00 173.24 175.19 1gd0 n SER 53 N 1.15 5.10 -4.67 5.45 7.64 -1.26 -1.37 113.62 125.65 1gd0 n SER 53 Ca -0.14 -3.05 -0.30 0.00 1.01 0.00 0.00 58.87 56.39 1gd0 n SER 53 Cb 0.52 -0.68 0.16 0.00 -1.01 0.00 0.00 64.21 63.21 1gd0 n SER 53 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1gd0 s GLU 54 N -2.86 0.83 0.11 1.43 0.41 -1.26 -4.87 118.70 112.49 1gd0 s GLU 54 Ca 0.52 0.93 -0.36 0.00 -0.41 0.00 0.00 54.97 55.66 1gd0 s GLU 54 Cb 0.41 -1.75 -0.17 0.00 -1.78 0.00 0.00 34.13 30.84 1gd0 s GLU 54 CO 0.14 -2.56 1.19 -2.30 -0.49 0.00 0.00 175.26 171.23 1gd0 n PRO 55 N -4.12 0.88 -3.94 0.39 -0.02 -1.26 -4.84 135.00 122.09 1gd0 n PRO 55 Ca 0.07 0.32 -0.09 0.00 -2.02 0.00 0.00 63.50 61.78 1gd0 n PRO 55 Cb 0.55 -1.85 -0.04 0.00 -0.02 0.00 0.00 33.50 32.14 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 -3.83 -0.81 -0.15 0.00 0.00 -0.63 -3.57 121.76 112.77 1gd0 s ALA 57 Ca 0.18 0.90 0.02 0.00 0.00 0.00 0.00 51.96 53.06 1gd0 s ALA 57 Cb -0.03 -0.51 0.01 0.00 0.00 0.00 0.00 23.12 22.60 1gd0 s ALA 57 CO 0.09 -0.16 -0.21 -0.51 0.00 0.00 0.00 175.76 174.97 1gd0 s LEU 58 N 0.09 2.10 0.31 0.00 1.43 -0.40 -1.55 118.68 120.66 1gd0 s LEU 58 Ca -0.01 -0.61 0.03 0.00 -1.03 0.00 0.00 54.13 52.51 1gd0 s LEU 58 Cb -0.02 -1.44 -0.05 0.00 0.03 0.00 0.00 46.19 44.70 1gd0 s LEU 58 CO 0.01 0.05 0.09 0.00 0.23 0.00 0.00 176.35 176.72 1gd0 s SER 60 N -3.42 -0.17 -0.11 0.00 1.04 -0.46 -0.94 113.70 109.64 1gd0 s SER 60 Ca 0.36 0.14 -0.00 0.00 0.48 0.00 0.00 55.95 56.93 1gd0 s SER 60 Cb 0.07 0.36 0.02 0.00 0.10 0.00 0.00 66.02 66.58 1gd0 s SER 60 CO 0.15 -0.34 -0.08 -0.22 0.98 0.00 0.00 173.24 173.73 1gd0 s LEU 61 N -0.95 1.25 -0.13 2.42 2.96 -0.30 -1.16 118.68 122.77 1gd0 s LEU 61 Ca -0.10 -0.32 -0.01 0.00 -0.22 0.00 0.00 54.13 53.48 1gd0 s LEU 61 Cb -0.05 -0.86 -0.02 0.00 0.50 0.00 0.00 46.19 45.75 1gd0 s LEU 61 CO 0.03 -0.10 -0.09 -1.00 -1.32 0.00 0.00 176.35 173.87 1gd0 s HIS 62 N 1.62 2.91 -0.03 5.38 3.76 -0.27 -0.97 115.29 127.68 1gd0 s HIS 62 Ca 0.04 -0.38 -0.13 0.00 -0.15 0.00 0.00 55.06 54.43 1gd0 s HIS 62 Cb -0.13 -1.86 0.02 0.00 1.11 0.00 0.00 32.58 31.73 1gd0 s HIS 62 CO -0.08 -0.04 0.29 0.45 -0.85 0.00 0.00 174.74 174.51 1gd0 s SER 63 N 0.13 -0.19 -0.63 1.40 0.15 -0.72 -1.45 113.70 112.40 1gd0 s SER 63 Ca -0.04 0.14 -0.23 0.00 0.70 0.00 0.00 55.95 56.52 1gd0 s SER 63 Cb -0.14 0.35 0.06 0.00 -1.71 0.00 0.00 66.02 64.58 1gd0 s SER 63 CO 0.04 -0.38 0.97 -0.63 1.20 0.00 0.00 173.24 174.44 1gd0 s ILE 64 N -1.09 4.31 0.02 6.45 1.01 -1.26 -0.61 121.20 130.02 1gd0 s ILE 64 Ca -0.11 -0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.42 1gd0 s ILE 64 Cb -0.05 -4.65 0.00 0.00 0.01 0.00 0.00 42.46 37.77 1gd0 s ILE 64 CO 0.03 -1.37 0.00 0.61 0.00 0.00 0.00 174.94 174.21 1gd0 n GLY 65 N 5.27 -2.21 2.59 6.18 0.00 -1.26 -4.95 105.19 110.81 1gd0 n GLY 65 Ca -0.02 -1.50 -0.21 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.98 -2.70 -4.52 1.61 4.76 -1.26 -4.90 118.16 110.17 1gd0 n LYS 66 Ca 0.00 0.96 -0.27 0.00 -2.87 0.00 0.00 58.31 56.13 1gd0 n LYS 66 Cb 0.03 -5.67 -0.17 0.00 -1.84 0.00 0.00 35.03 27.38 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 -3.08 1.37 0.00 -0.18 -1.09 -1.26 -4.84 121.20 112.12 1gd0 s ILE 67 Ca 0.10 -0.58 0.00 0.00 -2.23 0.00 0.00 60.65 57.94 1gd0 s ILE 67 Cb -0.04 -1.25 0.00 0.00 -1.58 0.00 0.00 42.46 39.58 1gd0 s ILE 67 CO 0.12 0.41 0.00 0.61 -1.23 0.00 0.00 174.94 174.85 1gd0 n GLY 68 N 4.07 -0.99 0.04 6.18 0.00 -1.26 -4.98 105.19 108.25 1gd0 n GLY 68 Ca -0.20 -1.01 -0.01 0.00 0.00 0.00 0.00 46.02 44.80 1gd0 n GLY 68 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1gd0 h GLY 69 N 0.00 -1.99 1.39 -0.02 0.00 -1.99 0.16 103.07 100.61 1gd0 h GLY 69 Ca 0.00 0.89 -0.17 0.00 0.00 0.00 0.00 47.33 48.04 1gd0 h GLY 69 CO 0.00 -0.73 -0.58 0.00 0.00 0.00 0.00 176.54 175.23 1gd0 h ALA 70 N -1.12 0.61 -0.65 3.60 0.00 -2.00 -2.70 119.26 117.00 1gd0 h ALA 70 Ca 0.01 -0.53 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 1gd0 h ALA 70 Cb 0.05 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1gd0 h ALA 70 CO -0.06 0.69 0.30 1.96 0.00 0.00 0.00 179.25 182.14 1gd0 h GLN 71 N 0.48 0.95 -0.17 0.00 4.20 -1.91 -1.33 115.11 117.33 1gd0 h GLN 71 Ca 0.00 -0.15 -0.09 0.00 0.06 0.00 0.00 58.65 58.47 1gd0 h GLN 71 Cb 1.15 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 1gd0 h GLN 71 CO 0.11 0.77 -0.28 -0.91 -0.67 0.00 0.00 178.83 177.85 1gd0 h ASN 72 N 0.91 0.32 -0.18 1.46 2.35 -0.62 0.12 115.58 119.93 1gd0 h ASN 72 Ca 0.22 -0.11 -0.11 0.00 -0.55 0.00 0.00 56.30 55.75 1gd0 h ASN 72 Cb 0.15 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1gd0 h ASN 72 CO -0.03 0.61 -0.27 0.03 -1.65 0.00 0.00 177.43 176.12 1gd0 h ARG 73 N 0.29 0.66 -0.42 0.81 3.08 -1.13 -0.92 114.38 116.74 1gd0 h ARG 73 Ca 0.04 -0.28 -0.11 0.00 0.07 0.00 0.00 59.98 59.71 1gd0 h ARG 73 Cb 0.65 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 1gd0 h ARG 73 CO 0.05 0.86 -0.15 1.03 -1.07 0.00 0.00 179.97 180.69 1gd0 h SER 74 N 0.57 0.87 -0.63 7.04 0.87 -0.66 -2.00 113.55 119.61 1gd0 h SER 74 Ca 0.07 -0.38 -0.05 0.00 -1.23 0.00 0.00 61.79 60.20 1gd0 h SER 74 Cb 0.76 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.45 1gd0 h SER 74 CO 0.06 1.06 0.22 1.88 -0.53 0.00 0.00 176.83 179.51 1gd0 h TYR 75 N 0.68 1.02 -0.49 2.24 0.05 -0.81 -1.79 116.97 117.87 1gd0 h TYR 75 Ca 0.10 -0.09 -0.11 0.00 0.05 0.00 0.00 58.73 58.69 1gd0 h TYR 75 Cb 0.70 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 38.12 1gd0 h TYR 75 CO 0.05 0.81 -0.12 0.77 -1.05 0.00 0.00 178.16 178.62 1gd0 h SER 76 N 0.97 0.91 -0.35 3.88 0.02 -0.96 0.14 113.55 118.15 1gd0 h SER 76 Ca 0.22 -0.30 -0.03 0.00 -0.84 0.00 0.00 61.79 60.84 1gd0 h SER 76 Cb 0.26 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1gd0 h SER 76 CO -0.01 1.04 0.10 0.50 -1.14 0.00 0.00 176.83 177.32 1gd0 h LYS 77 N 0.82 0.56 0.20 3.45 3.64 -1.15 0.43 116.57 124.51 1gd0 h LYS 77 Ca 0.13 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1gd0 h LYS 77 Cb 0.66 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1gd0 h LYS 77 CO 0.05 0.59 -0.09 1.25 -2.27 0.00 0.00 179.45 178.98 1gd0 h LEU 78 N 0.42 -0.22 -0.32 5.20 5.85 -1.11 -1.47 115.31 123.66 1gd0 h LEU 78 Ca 0.11 -0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.63 1gd0 h LEU 78 Cb 0.28 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 1gd0 h LEU 78 CO -0.00 -0.06 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.70 1gd0 h LEU 79 N -0.37 0.79 -1.09 2.25 3.38 -0.69 -1.44 115.31 118.14 1gd0 h LEU 79 Ca -0.03 -0.46 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 1gd0 h LEU 79 Cb 0.29 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1gd0 h LEU 79 CO 0.04 1.08 0.31 0.00 0.09 0.00 0.00 178.44 179.96 1gd0 h GLY 81 N 1.02 0.83 1.23 0.00 0.00 -0.99 0.67 103.07 105.82 1gd0 h GLY 81 Ca 0.23 -0.31 -0.13 0.00 0.00 0.00 0.00 47.33 47.12 1gd0 h GLY 81 CO -0.03 0.30 -0.26 1.41 0.00 0.00 0.00 176.54 177.96 1gd0 h LEU 82 N 0.80 0.90 -0.83 3.11 3.38 -0.73 -0.72 115.31 121.22 1gd0 h LEU 82 Ca 0.22 -0.35 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 1gd0 h LEU 82 Cb -0.09 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1gd0 h LEU 82 CO -0.05 1.11 -0.40 -0.07 0.09 0.00 0.00 178.44 179.12 1gd0 h LEU 83 N 0.74 0.40 -0.01 1.67 3.38 -0.59 0.83 115.31 121.74 1gd0 h LEU 83 Ca 0.09 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1gd0 h LEU 83 Cb 0.81 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1gd0 h LEU 83 CO 0.07 0.77 -0.02 0.00 0.09 0.00 0.00 178.44 179.35 1gd0 h ALA 84 N 1.26 0.01 -0.46 1.53 0.00 -0.73 -1.01 119.26 119.85 1gd0 h ALA 84 Ca 0.03 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1gd0 h ALA 84 Cb 0.85 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1gd0 h ALA 84 CO 0.07 -0.18 0.09 1.49 0.00 0.00 0.00 179.25 180.72 1gd0 h GLU 85 N -0.54 0.75 0.05 0.00 4.81 -1.05 -1.77 114.58 116.83 1gd0 h GLU 85 Ca 0.00 -0.19 -0.34 0.00 -0.13 0.00 0.00 59.36 58.70 1gd0 h GLU 85 Cb 0.60 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1gd0 h GLU 85 CO 0.00 0.76 -1.98 0.54 -0.73 0.00 0.00 179.01 177.60 1gd0 n ARG 86 N -4.47 0.69 0.00 1.92 5.12 0.28 -4.46 116.66 115.73 1gd0 n ARG 86 Ca 0.01 0.23 0.05 0.00 -1.93 0.00 0.00 57.85 56.21 1gd0 n ARG 86 Cb 0.23 -1.70 0.04 0.00 -1.16 0.00 0.00 32.46 29.87 1gd0 n ARG 86 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1gd0 n LEU 87 N -3.20 1.87 -3.28 0.55 4.77 -0.44 -4.61 117.00 112.66 1gd0 n LEU 87 Ca -0.27 -0.99 -0.23 0.00 -0.03 0.00 0.00 56.01 54.49 1gd0 n LEU 87 Cb 1.06 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 42.20 1gd0 n LEU 87 CO 0.42 0.36 0.11 0.54 -1.33 0.00 0.00 177.39 177.49 1gd0 n ARG 88 N 0.57 -6.31 -3.70 3.23 5.12 -0.66 -4.96 116.66 109.94 1gd0 n ARG 88 Ca 0.06 0.88 -0.35 0.00 -1.93 0.00 0.00 57.85 56.51 1gd0 n ARG 88 Cb 0.27 -5.83 -0.08 0.00 -1.16 0.00 0.00 32.46 25.66 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 -3.25 5.40 0.22 0.55 1.01 -0.98 -4.94 121.20 119.21 1gd0 s ILE 89 Ca 0.43 0.24 -0.30 0.00 0.00 0.00 0.00 60.65 61.02 1gd0 s ILE 89 Cb -0.19 -3.49 -0.10 0.00 0.01 0.00 0.00 42.46 38.69 1gd0 s ILE 89 CO 0.53 0.43 1.40 -0.44 0.00 0.00 0.00 174.94 176.87 1gd0 s SER 90 N 0.37 6.74 0.46 3.58 0.01 -1.26 -3.41 113.70 120.18 1gd0 s SER 90 Ca 0.09 2.56 0.21 0.00 1.31 0.00 0.00 55.95 60.12 1gd0 s SER 90 Cb -0.11 -2.62 1.21 0.00 0.21 0.00 0.00 66.02 64.71 1gd0 s SER 90 CO -0.01 -0.65 1.90 -0.65 0.41 0.00 0.00 173.24 174.25 1gd0 h PRO 91 N 5.35 0.25 0.00 12.44 0.11 -1.97 -0.16 132.00 148.03 1gd0 h PRO 91 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1gd0 h PRO 91 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1gd0 h PRO 91 CO 0.79 0.17 0.00 -0.40 -0.21 0.00 0.00 178.00 178.35 1gd0 n ASP 92 N -4.43 0.00 -0.75 -2.05 5.68 -1.26 -2.59 116.55 111.15 1gd0 n ASP 92 Ca 0.16 -1.74 0.06 0.00 -0.50 0.00 0.00 54.79 52.77 1gd0 n ASP 92 Cb 0.68 0.00 0.18 0.00 -1.14 0.00 0.00 41.12 40.84 1gd0 n ASP 92 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1gd0 n ARG 93 N -0.58 1.33 -4.67 0.11 1.74 -0.07 -5.01 116.66 109.51 1gd0 n ARG 93 Ca 0.03 -3.09 -0.25 0.00 -0.77 0.00 0.00 57.85 53.77 1gd0 n ARG 93 Cb 0.02 -1.35 -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 -2.71 1.24 -0.04 1.55 1.01 -1.07 -1.60 120.40 118.79 1gd0 s VAL 94 Ca 0.37 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.86 1gd0 s VAL 94 Cb 0.37 -1.12 -0.02 0.00 0.00 0.00 0.00 36.38 35.61 1gd0 s VAL 94 CO -0.09 0.38 -0.21 -0.31 0.00 0.00 0.00 175.10 174.87 1gd0 s TYR 95 N 0.55 2.51 -0.14 5.22 2.02 -0.59 -5.00 117.35 121.91 1gd0 s TYR 95 Ca -0.14 -0.35 -0.01 0.00 -0.37 0.00 0.00 57.07 56.21 1gd0 s TYR 95 Cb -0.15 -1.57 0.04 0.00 -0.40 0.00 0.00 41.96 39.88 1gd0 s TYR 95 CO 0.04 0.04 -0.03 0.42 -1.57 0.00 0.00 175.55 174.45 1gd0 s ILE 96 N -0.61 0.83 -0.16 2.71 1.01 -1.26 -0.44 121.20 123.28 1gd0 s ILE 96 Ca 0.09 -0.38 -0.20 0.00 0.00 0.00 0.00 60.65 60.16 1gd0 s ILE 96 Cb -0.11 -1.03 -0.03 0.00 0.01 0.00 0.00 42.46 41.30 1gd0 s ILE 96 CO 0.00 0.14 0.56 0.20 0.00 0.00 0.00 174.94 175.85 1gd0 s ASN 97 N 1.76 6.68 -0.14 3.58 0.01 -0.12 -4.93 114.94 121.79 1gd0 s ASN 97 Ca 0.02 0.82 -0.07 0.00 -0.71 0.00 0.00 52.86 52.92 1gd0 s ASN 97 Cb -0.14 -2.32 -0.04 0.00 0.41 0.00 0.00 41.25 39.15 1gd0 s ASN 97 CO -0.07 -0.15 0.11 -0.31 -1.51 0.00 0.00 177.10 175.17 1gd0 s TYR 98 N 1.35 3.47 -0.11 2.20 2.02 -1.26 -1.16 117.35 123.86 1gd0 s TYR 98 Ca 0.28 0.40 0.01 0.00 -0.37 0.00 0.00 57.07 57.38 1gd0 s TYR 98 Cb -0.16 -1.98 0.02 0.00 -0.40 0.00 0.00 41.96 39.44 1gd0 s TYR 98 CO 0.11 0.55 -0.12 0.71 -1.57 0.00 0.00 175.55 175.23 1gd0 s TYR 99 N -0.57 1.74 -0.55 2.71 2.02 -0.14 -4.97 117.35 117.60 1gd0 s TYR 99 Ca 0.12 -0.85 -0.19 0.00 -0.37 0.00 0.00 57.07 55.79 1gd0 s TYR 99 Cb -0.12 -1.32 0.08 0.00 -0.40 0.00 0.00 41.96 40.20 1gd0 s TYR 99 CO 0.02 -0.49 0.65 0.34 -1.57 0.00 0.00 175.55 174.49 1gd0 s ASP 100 N 1.29 6.20 0.15 2.29 -1.08 -1.26 -1.75 116.67 122.50 1gd0 s ASP 100 Ca -0.01 -1.20 -0.24 0.00 -0.52 0.00 0.00 52.55 50.58 1gd0 s ASP 100 Cb -0.14 -2.29 -0.08 0.00 -1.46 0.00 0.00 42.92 38.96 1gd0 s ASP 100 CO -0.05 -0.98 0.73 -0.04 0.52 0.00 0.00 175.17 175.34 1gd0 s MET 101 N 2.58 4.47 0.31 4.34 -1.94 0.21 -4.89 119.30 124.38 1gd0 s MET 101 Ca 0.12 1.05 -0.27 0.00 -1.71 0.00 0.00 55.69 54.88 1gd0 s MET 101 Cb -0.22 -3.24 -0.10 0.00 2.01 0.00 0.00 34.83 33.29 1gd0 s MET 101 CO 0.09 0.58 0.96 1.21 -0.01 0.00 0.00 175.02 177.84 1gd0 s ASN 102 N -1.16 7.37 0.37 3.03 3.84 -1.26 -3.98 114.94 123.14 1gd0 s ASN 102 Ca 0.34 1.89 0.10 0.00 0.21 0.00 0.00 52.86 55.41 1gd0 s ASN 102 Cb -0.22 -2.59 0.87 0.00 -0.55 0.00 0.00 41.25 38.76 1gd0 s ASN 102 CO 0.24 -0.04 1.87 0.00 -2.79 0.00 0.00 177.10 176.38 1gd0 h ALA 103 N 3.38 1.90 0.00 1.71 0.00 -1.95 0.12 119.26 124.42 1gd0 h ALA 103 Ca -0.46 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1gd0 h ALA 103 Cb 1.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1gd0 h ALA 103 CO 0.66 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.77 1gd0 h ALA 104 N 1.61 1.00 -0.51 0.00 0.00 -1.92 -2.73 119.26 116.70 1gd0 h ALA 104 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1gd0 h ALA 104 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1gd0 h ALA 104 CO -0.19 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.15 1gd0 n ASN 105 N -2.55 5.21 -3.92 0.00 5.03 0.42 -4.83 115.26 114.62 1gd0 n ASN 105 Ca 0.01 -2.88 -0.29 0.00 0.87 0.00 0.00 54.58 52.29 1gd0 n ASN 105 Cb 0.23 -0.64 -0.16 0.00 -1.02 0.00 0.00 39.78 38.19 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 -2.65 1.27 0.23 2.41 1.01 -1.14 -4.89 120.40 116.63 1gd0 s VAL 106 Ca 0.51 -0.78 -0.18 0.00 0.00 0.00 0.00 61.98 61.54 1gd0 s VAL 106 Cb 0.39 -1.44 -0.08 0.00 0.00 0.00 0.00 36.38 35.25 1gd0 s VAL 106 CO 0.15 0.11 0.70 -0.83 0.00 0.00 0.00 175.10 175.23 1gd0 s GLY 107 N 1.56 2.53 -0.28 4.51 0.00 -1.26 -2.38 107.32 111.99 1gd0 s GLY 107 Ca -0.00 0.08 -0.25 0.00 0.00 0.00 0.00 44.72 44.55 1gd0 s GLY 107 CO -0.08 0.39 1.05 0.86 0.00 0.00 0.00 173.10 175.33 1gd0 s TRP 108 N -1.61 -0.46 -1.36 1.90 -0.00 0.53 -4.95 118.94 112.99 1gd0 s TRP 108 Ca 0.45 1.10 -0.01 0.00 -0.00 0.00 0.00 56.10 57.64 1gd0 s TRP 108 Cb -0.15 0.37 0.00 0.00 -0.00 0.00 0.00 33.47 33.69 1gd0 s TRP 108 CO 0.20 -0.22 0.59 -1.71 -0.00 0.00 0.00 176.95 175.81 1gd0 n ASN 109 N 2.25 -0.93 0.00 5.86 4.05 -1.26 -1.64 115.26 123.59 1gd0 n ASN 109 Ca -0.13 -0.90 0.00 0.00 0.45 0.00 0.00 54.58 54.01 1gd0 n ASN 109 Cb 0.56 -3.62 0.00 0.00 1.23 0.00 0.00 39.78 37.95 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 -3.02 -2.12 0.00 1.20 3.02 -1.26 -4.89 115.26 108.19 1gd0 n ASN 110 Ca -0.29 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.26 1gd0 n ASN 110 Cb 0.68 -1.40 0.00 0.00 -0.61 0.00 0.00 39.78 38.44 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 -0.21 0.00 -2.10 6.41 2.88 -0.65 -5.19 113.62 114.75 1gd0 n SER 111 Ca 0.00 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.47 1gd0 n SER 111 Cb 0.10 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.54 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 0.81 2.46 -2.24 -1.26 -0.35 114.28 113.70 1gd0 n THR 112 Ca 0.00 -0.71 0.06 0.00 -2.27 0.00 0.00 64.05 61.13 1gd0 n THR 112 Cb 0.00 0.27 0.18 0.00 -2.10 0.00 0.00 70.33 68.69 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 -0.26 0.49 -3.37 4.78 3.72 -1.00 -4.55 117.46 117.27 1gd0 n PHE 113 Ca -0.01 -0.25 -0.46 0.00 -0.05 0.00 0.00 57.45 56.69 1gd0 n PHE 113 Cb 0.18 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 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 -1.51 3.95 -1.06 4.37 0.00 -1.21 -4.74 121.76 121.57 1gd0 s ALA 114 Ca 0.26 -3.17 0.11 0.00 0.00 0.00 0.00 51.96 49.15 1gd0 s ALA 114 Cb 0.14 -3.37 0.23 0.00 0.00 0.00 0.00 23.12 20.12 1gd0 s ALA 114 CO 0.18 -2.21 1.12 1.28 0.00 0.00 0.00 175.76 176.14 1gd0 n LEU 115 N 4.14 2.60 0.01 0.00 4.77 -1.26 -4.68 117.00 122.58 1gd0 n LEU 115 Ca 0.08 -1.69 -0.02 0.00 -0.03 0.00 0.00 56.01 54.36 1gd0 n LEU 115 Cb 0.45 -0.16 -0.10 0.00 -2.33 0.00 0.00 43.42 41.28 1gd0 n LEU 115 CO 0.37 0.61 -0.40 -0.62 -1.33 0.00 0.00 177.39 176.02 1gd0 n GLU 116 N 0.54 0.63 -4.21 3.23 4.71 -1.26 -4.94 120.64 119.33 1gd0 n GLU 116 Ca 0.10 0.20 -0.16 0.00 -0.01 0.00 0.00 57.16 57.29 1gd0 n GLU 116 Cb 0.38 -1.78 -0.14 0.00 -1.01 0.00 0.00 31.44 28.89 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 -2.87 0.66 0.00 -0.32 3.76 -1.26 -5.34 115.29 109.93 1gd0 s HIS 117 Ca -0.04 -0.21 0.00 0.00 -0.15 0.00 0.00 55.06 54.66 1gd0 s HIS 117 Cb 0.09 -0.42 0.00 0.00 1.11 0.00 0.00 32.58 33.36 1gd0 s HIS 117 CO 0.82 -0.02 0.00 -2.39 -0.85 0.00 0.00 174.74 172.30