#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gsb s SER 2 N 0.00 4.81 -0.03 1.61 0.01 -1.26 -5.05 113.70 113.79 2gsb s SER 2 Ca 0.00 -3.13 -0.15 0.00 1.31 0.00 0.00 55.95 53.98 2gsb s SER 2 Cb 0.00 -1.73 0.03 0.00 0.21 0.00 0.00 66.02 64.52 2gsb s SER 2 CO 0.00 -0.25 0.32 -0.94 0.41 0.00 0.00 173.24 172.78 2gsb s SER 3 N -0.12 -0.22 -1.16 2.44 1.04 -1.26 -5.09 113.70 109.33 2gsb s SER 3 Ca 0.19 0.18 -0.16 0.00 0.48 0.00 0.00 55.95 56.64 2gsb s SER 3 Cb -0.20 0.37 0.14 0.00 0.10 0.00 0.00 66.02 66.44 2gsb s SER 3 CO -0.04 -0.41 1.42 -0.83 0.98 0.00 0.00 173.24 174.36 2gsb s GLY 4 N -1.12 2.16 -1.14 7.32 0.00 -1.26 -4.61 107.32 108.68 2gsb s GLY 4 Ca -0.12 -3.14 -0.02 0.00 0.00 0.00 0.00 44.72 41.45 2gsb s GLY 4 CO 0.04 2.17 0.04 1.44 0.00 0.00 0.00 173.10 176.79 2gsb n SER 5 N 6.36 0.49 -4.59 1.64 7.64 -1.26 -4.87 113.62 119.02 2gsb n SER 5 Ca 0.36 -0.92 -0.34 0.00 1.01 0.00 0.00 58.87 58.98 2gsb n SER 5 Cb 0.45 -1.14 -0.10 0.00 -1.01 0.00 0.00 64.21 62.40 2gsb n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2gsb s SER 6 N -3.86 5.41 0.00 6.43 0.01 -1.26 -5.00 113.70 115.43 2gsb s SER 6 Ca 0.06 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.34 2gsb s SER 6 Cb -0.04 -1.92 0.00 0.00 0.21 0.00 0.00 66.02 64.28 2gsb s SER 6 CO 0.72 0.17 0.00 0.61 0.41 0.00 0.00 173.24 175.14 2gsb n GLY 7 N 3.58 -0.41 3.67 3.44 0.00 -1.26 -5.07 105.19 109.15 2gsb n GLY 7 Ca -0.17 0.66 -0.38 0.00 0.00 0.00 0.00 46.02 46.13 2gsb n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gsb s ARG 8 N 0.00 4.17 0.18 1.61 3.00 -1.26 -5.07 118.95 121.57 2gsb s ARG 8 Ca 0.00 0.14 0.02 0.00 0.00 0.00 0.00 55.73 55.89 2gsb s ARG 8 Cb 0.00 -3.53 -0.05 0.00 0.00 0.00 0.00 34.95 31.37 2gsb s ARG 8 CO 0.00 -0.01 0.00 -1.21 0.00 0.00 0.00 175.30 174.08 2gsb s GLU 9 N 1.24 1.12 -0.48 3.54 0.41 -1.26 -5.05 118.70 118.22 2gsb s GLU 9 Ca 0.17 -1.54 0.03 0.00 -0.41 0.00 0.00 54.97 53.23 2gsb s GLU 9 Cb -0.14 -0.28 0.56 0.00 -1.78 0.00 0.00 34.13 32.49 2gsb s GLU 9 CO 0.07 -0.13 1.83 0.39 -0.49 0.00 0.00 175.26 176.93 2gsb n GLU 10 N -0.25 2.39 -2.47 1.61 1.02 -1.26 -5.00 120.64 116.68 2gsb n GLU 10 Ca -0.06 -3.20 -0.35 0.00 -0.02 0.00 0.00 57.16 53.53 2gsb n GLU 10 Cb 0.63 -2.16 -0.03 0.00 -0.02 0.00 0.00 31.44 29.87 2gsb n GLU 10 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2gsb s ASP 11 N -1.82 6.23 0.14 1.62 1.01 -1.26 -4.97 116.67 117.62 2gsb s ASP 11 Ca 0.57 2.01 -0.11 0.00 0.71 0.00 0.00 52.55 55.73 2gsb s ASP 11 Cb 0.47 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.79 2gsb s ASP 11 CO 0.05 -0.86 1.48 1.55 0.21 0.00 0.00 175.17 177.60 2gsb h PRO 12 N 1.59 0.95 -0.63 8.23 0.13 -2.05 -3.08 132.00 137.14 2gsb h PRO 12 Ca -0.49 -0.50 0.09 0.00 -0.87 0.00 0.00 66.00 64.23 2gsb h PRO 12 Cb 1.23 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.34 2gsb h PRO 12 CO 0.59 1.16 0.42 1.25 -0.23 0.00 0.00 178.00 181.19 2gsb h HIS 13 N 0.77 0.53 -1.37 1.56 2.76 -2.01 -3.36 115.15 114.03 2gsb h HIS 13 Ca 0.06 0.01 -0.58 0.00 -2.20 0.00 0.00 60.37 57.67 2gsb h HIS 13 Cb 0.97 -0.17 -0.09 0.00 1.55 0.00 0.00 27.41 29.67 2gsb h HIS 13 CO 0.06 0.26 1.39 -1.21 -1.30 0.00 0.00 177.93 177.13 2gsb s GLU 14 N -5.47 3.48 0.00 5.26 2.02 -1.16 -3.32 118.70 119.50 2gsb s GLU 14 Ca -0.08 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.00 2gsb s GLU 14 Cb 0.20 -5.09 0.00 0.00 0.10 0.00 0.00 34.13 29.33 2gsb s GLU 14 CO 0.76 -2.23 0.00 0.41 0.02 0.00 0.00 175.26 174.22 2gsb n GLY 15 N 6.56 0.51 3.36 -1.39 0.00 -1.26 -4.83 105.19 108.15 2gsb n GLY 15 Ca 0.27 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.93 2gsb n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2gsb n LYS 16 N 0.00 0.10 0.11 1.61 4.76 -1.21 -4.92 118.16 118.61 2gsb n LYS 16 Ca 0.00 0.07 -0.22 0.00 -2.87 0.00 0.00 58.31 55.29 2gsb n LYS 16 Cb 0.00 -1.63 -0.15 0.00 -1.84 0.00 0.00 35.03 31.41 2gsb n LYS 16 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2gsb h ILE 17 N -0.67 1.19 0.00 -0.18 2.10 -1.94 -3.28 117.51 114.74 2gsb h ILE 17 Ca -0.44 -2.71 0.00 0.00 1.08 0.00 0.00 64.86 62.79 2gsb h ILE 17 Cb 1.34 2.91 0.00 0.00 -1.09 0.00 0.00 36.82 39.98 2gsb h ILE 17 CO 0.38 0.84 0.00 4.11 -1.08 0.00 0.00 178.15 182.40 2gsb h TRP 18 N 0.12 0.00 -3.68 2.19 5.08 -1.91 -3.41 115.95 114.33 2gsb h TRP 18 Ca -0.27 0.00 -0.50 0.00 1.08 0.00 0.00 58.89 59.20 2gsb h TRP 18 Cb 2.11 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 28.24 2gsb h TRP 18 CO 0.10 0.00 0.25 0.12 -1.28 0.00 0.00 178.44 177.64 2gsb s PHE 19 N -3.33 3.84 -0.19 0.12 5.36 -1.24 -0.76 117.98 121.78 2gsb s PHE 19 Ca 0.06 1.71 -0.05 0.00 -0.96 0.00 0.00 56.93 57.68 2gsb s PHE 19 Cb 0.09 -2.84 0.07 0.00 -0.34 0.00 0.00 43.02 40.00 2gsb s PHE 19 CO 0.53 0.40 0.10 -1.01 -1.46 0.00 0.00 175.22 173.78 2gsb s HIS 20 N -1.33 0.20 0.00 10.12 3.76 -0.76 -4.86 115.29 122.42 2gsb s HIS 20 Ca 0.42 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.95 2gsb s HIS 20 Cb -0.22 -0.71 0.00 0.00 1.11 0.00 0.00 32.58 32.76 2gsb s HIS 20 CO 0.26 -0.56 0.00 0.41 -0.85 0.00 0.00 174.74 174.00 2gsb n GLY 21 N 5.28 0.10 0.11 -2.22 0.00 -1.26 -4.29 105.19 102.91 2gsb n GLY 21 Ca -0.07 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 2gsb n GLY 21 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gsb h LYS 22 N 0.00 0.26 0.00 1.61 1.57 -2.00 -3.46 116.57 114.55 2gsb h LYS 22 Ca 0.00 -0.34 -0.24 0.00 -1.87 0.00 0.00 60.65 58.20 2gsb h LYS 22 Cb 0.00 0.11 0.12 0.00 0.08 0.00 0.00 32.23 32.55 2gsb h LYS 22 CO 0.00 1.09 0.01 0.44 -0.57 0.00 0.00 179.45 180.42 2gsb n ILE 23 N -4.31 0.00 -4.38 1.86 -5.35 -1.26 -5.08 119.36 100.84 2gsb n ILE 23 Ca -0.11 -0.19 -0.31 0.00 -0.27 0.00 0.00 62.75 61.87 2gsb n ILE 23 Cb 0.65 -0.96 -0.04 0.00 -1.74 0.00 0.00 39.64 37.56 2gsb n ILE 23 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2gsb s SER 24 N -3.09 4.37 0.05 7.28 0.15 -1.26 -5.02 113.70 116.18 2gsb s SER 24 Ca 0.42 -1.51 -0.21 0.00 0.70 0.00 0.00 55.95 55.36 2gsb s SER 24 Cb -0.05 0.59 -0.13 0.00 -1.71 0.00 0.00 66.02 64.72 2gsb s SER 24 CO 0.34 -1.02 1.45 0.50 1.20 0.00 0.00 173.24 175.70 2gsb h LYS 25 N 1.02 0.29 -0.24 5.44 3.64 -1.98 -2.20 116.57 122.54 2gsb h LYS 25 Ca -0.40 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 58.88 2gsb h LYS 25 Cb 1.32 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.10 2gsb h LYS 25 CO 0.66 0.56 0.14 1.96 -2.27 0.00 0.00 179.45 180.50 2gsb h GLN 26 N -0.00 0.29 -0.17 1.90 4.20 -2.01 -2.89 115.11 116.42 2gsb h GLN 26 Ca 0.04 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.77 2gsb h GLN 26 Cb 0.45 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 2gsb h GLN 26 CO 0.01 0.19 -0.04 0.93 -0.67 0.00 0.00 178.83 179.25 2gsb h GLU 27 N 0.30 0.00 -0.98 1.46 4.39 -1.96 -2.04 114.58 115.74 2gsb h GLU 27 Ca 0.09 -0.00 0.34 0.00 0.34 0.00 0.00 59.36 60.13 2gsb h GLU 27 Cb -0.01 -0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 28.48 2gsb h GLU 27 CO -0.04 0.00 0.47 0.00 -1.16 0.00 0.00 179.01 178.28 2gsb h ALA 28 N 1.17 1.87 0.81 3.43 0.00 -1.18 0.21 119.26 125.58 2gsb h ALA 28 Ca 0.08 0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 2gsb h ALA 28 Cb 0.13 0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.20 2gsb h ALA 28 CO -0.18 -0.69 -0.39 1.88 0.00 0.00 0.00 179.25 179.87 2gsb h TYR 29 N 0.17 -1.01 -0.97 0.00 0.05 -1.31 -1.53 116.97 112.36 2gsb h TYR 29 Ca 0.74 -0.02 0.14 0.00 0.05 0.00 0.00 58.73 59.64 2gsb h TYR 29 Cb 1.76 0.33 -0.09 0.00 1.01 0.00 0.00 36.73 39.75 2gsb h TYR 29 CO -0.09 -0.63 0.61 -0.91 -1.05 0.00 0.00 178.16 176.10 2gsb h ASN 30 N -1.21 0.82 0.94 3.88 4.21 -1.02 -0.74 115.58 122.46 2gsb h ASN 30 Ca -0.11 0.06 -0.05 0.00 1.21 0.00 0.00 56.30 57.41 2gsb h ASN 30 Cb 0.84 -0.10 0.01 0.00 -1.12 0.00 0.00 38.32 37.94 2gsb h ASN 30 CO 0.18 0.40 -0.48 -0.07 -1.29 0.00 0.00 177.43 176.17 2gsb h LEU 31 N 0.85 -1.16 0.00 1.61 3.38 -0.56 0.29 115.31 119.73 2gsb h LEU 31 Ca 0.50 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.52 2gsb h LEU 31 Cb 0.66 0.31 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2gsb h LEU 31 CO -0.27 -0.80 0.00 0.18 0.09 0.00 0.00 178.44 177.64 2gsb n LEU 32 N -5.58 0.00 -0.03 1.67 4.77 -0.59 -0.21 117.00 117.04 2gsb n LEU 32 Ca -0.16 0.41 0.02 0.00 -0.03 0.00 0.00 56.01 56.25 2gsb n LEU 32 Cb 0.52 -0.41 -0.14 0.00 -2.33 0.00 0.00 43.42 41.05 2gsb n LEU 32 CO 0.39 -0.34 -0.79 0.23 -1.33 0.00 0.00 177.39 175.55 2gsb n MET 33 N -1.41 0.66 0.00 3.23 2.81 -0.32 -3.75 117.12 118.34 2gsb n MET 33 Ca 0.02 -0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 2gsb n MET 33 Cb 0.06 -1.58 0.00 0.00 -0.71 0.00 0.00 33.22 30.98 2gsb n MET 33 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2gsb n THR 34 N -2.55 0.00 0.27 2.03 -2.24 0.94 -4.75 114.28 107.98 2gsb n THR 34 Ca -0.15 0.12 0.13 0.00 -2.27 0.00 0.00 64.05 61.89 2gsb n THR 34 Cb 0.82 -1.00 0.74 0.00 -2.10 0.00 0.00 70.33 68.78 2gsb n THR 34 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2gsb h VAL 35 N 0.00 0.51 -4.78 2.28 -1.51 -1.06 -3.44 116.25 108.26 2gsb h VAL 35 Ca 0.00 -0.52 -0.31 0.00 -1.23 0.00 0.00 66.70 64.64 2gsb h VAL 35 Cb 0.00 1.35 0.06 0.00 -2.13 0.00 0.00 31.29 30.57 2gsb h VAL 35 CO 0.00 0.11 0.08 0.61 -1.23 0.00 0.00 177.57 177.14 2gsb n GLY 36 N -0.64 0.66 3.57 5.19 0.00 0.71 -4.88 105.19 109.80 2gsb n GLY 36 Ca -0.02 -2.00 -0.10 0.00 0.00 0.00 0.00 46.02 43.91 2gsb n GLY 36 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2gsb s GLN 37 N -4.22 1.44 0.63 1.61 0.74 -1.25 -4.65 119.66 113.96 2gsb s GLN 37 Ca 0.45 -0.83 0.18 0.00 0.05 0.00 0.00 55.36 55.21 2gsb s GLN 37 Cb -0.03 0.55 0.76 0.00 1.10 0.00 0.00 33.01 35.40 2gsb s GLN 37 CO 0.30 -0.62 1.35 0.28 -0.55 0.00 0.00 175.29 176.04 2gsb h VAL 38 N 2.13 0.05 -1.32 1.34 2.07 -1.88 0.81 116.25 119.45 2gsb h VAL 38 Ca -0.28 0.00 -0.63 0.00 0.82 0.00 0.00 66.70 66.61 2gsb h VAL 38 Cb 1.27 0.16 -0.37 0.00 -1.52 0.00 0.00 31.29 30.83 2gsb h VAL 38 CO 0.35 0.00 -0.09 0.00 0.02 0.00 0.00 177.57 177.85 2gsb s SER 40 N -2.73 0.27 0.25 0.00 0.01 0.28 -3.12 113.70 108.65 2gsb s SER 40 Ca 0.53 -0.02 0.05 0.00 1.31 0.00 0.00 55.95 57.81 2gsb s SER 40 Cb 0.43 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 66.51 2gsb s SER 40 CO -0.14 -0.03 -0.03 0.72 0.41 0.00 0.00 173.24 174.16 2gsb s PHE 41 N 0.44 1.71 -0.28 2.43 -0.12 -1.24 -3.10 117.98 117.81 2gsb s PHE 41 Ca -0.04 -0.82 -0.23 0.00 -0.05 0.00 0.00 56.93 55.79 2gsb s PHE 41 Cb -0.06 -0.98 0.10 0.00 -0.63 0.00 0.00 43.02 41.44 2gsb s PHE 41 CO -0.01 0.11 0.87 -0.48 -0.05 0.00 0.00 175.22 175.66 2gsb s LEU 42 N -3.36 -0.62 0.20 -1.99 0.05 -1.06 -1.96 118.68 109.94 2gsb s LEU 42 Ca 0.28 1.16 -0.07 0.00 0.05 0.00 0.00 54.13 55.55 2gsb s LEU 42 Cb 0.05 2.15 -0.06 0.00 -2.05 0.00 0.00 46.19 46.27 2gsb s LEU 42 CO 0.10 -0.20 0.48 -0.69 -0.55 0.00 0.00 176.35 175.49 2gsb s VAL 43 N 0.53 5.05 -0.22 1.48 1.01 0.06 -1.57 120.40 126.74 2gsb s VAL 43 Ca -0.00 0.21 -0.20 0.00 0.00 0.00 0.00 61.98 61.98 2gsb s VAL 43 Cb -0.05 -3.64 0.06 0.00 0.00 0.00 0.00 36.38 32.75 2gsb s VAL 43 CO -0.06 -0.07 0.58 -0.60 0.00 0.00 0.00 175.10 174.95 2gsb s ARG 44 N -2.88 0.67 0.07 2.72 3.52 -1.06 -1.84 118.95 120.16 2gsb s ARG 44 Ca 0.44 0.81 -0.31 0.00 -0.13 0.00 0.00 55.73 56.55 2gsb s ARG 44 Cb -0.11 0.32 -0.07 0.00 -1.56 0.00 0.00 34.95 33.52 2gsb s ARG 44 CO 0.24 -0.08 1.39 -1.25 -0.81 0.00 0.00 175.30 174.79 2gsb s PRO 45 N 0.36 4.31 -0.14 5.12 0.04 -1.26 -1.79 135.00 141.64 2gsb s PRO 45 Ca -0.00 2.03 -0.35 0.00 0.04 0.00 0.00 61.00 62.71 2gsb s PRO 45 Cb -0.04 -3.37 -0.12 0.00 0.04 0.00 0.00 34.50 31.00 2gsb s PRO 45 CO 0.00 -0.48 1.87 0.45 0.04 0.00 0.00 177.00 178.88 2gsb n SER 46 N 4.47 3.20 -0.03 6.66 2.88 -0.60 -4.85 113.62 125.35 2gsb n SER 46 Ca 0.12 0.97 -0.03 0.00 -1.33 0.00 0.00 58.87 58.60 2gsb n SER 46 Cb 0.43 -1.32 0.21 0.00 -0.75 0.00 0.00 64.21 62.78 2gsb n SER 46 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2gsb h ASP 47 N 8.97 0.59 0.41 -3.46 3.58 -1.91 -3.27 116.42 121.32 2gsb h ASP 47 Ca -0.47 -0.15 -0.02 0.00 0.42 0.00 0.00 57.03 56.80 2gsb h ASP 47 Cb 1.28 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.18 2gsb h ASP 47 CO 0.95 0.72 -0.20 0.78 -2.88 0.00 0.00 179.24 178.62 2gsb h ASN 48 N 0.56 -0.47 -3.81 2.28 -0.26 -2.00 -3.42 115.58 108.46 2gsb h ASN 48 Ca 0.10 0.02 -0.63 0.00 -0.56 0.00 0.00 56.30 55.23 2gsb h ASN 48 Cb 0.50 0.12 -0.16 0.00 -1.06 0.00 0.00 38.32 37.72 2gsb h ASN 48 CO 0.03 -0.24 -0.48 -0.89 -1.06 0.00 0.00 177.43 174.79 2gsb s THR 49 N -3.67 5.30 -0.37 2.81 2.01 -1.23 -5.04 115.64 115.45 2gsb s THR 49 Ca -0.08 0.23 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 2gsb s THR 49 Cb 0.01 -3.55 -0.01 0.00 0.01 0.00 0.00 72.50 68.96 2gsb s THR 49 CO 0.24 0.26 1.71 -2.16 -0.69 0.00 0.00 174.62 173.98 2gsb s PRO 50 N 1.65 3.35 0.00 4.92 0.04 -1.26 -3.02 135.00 140.69 2gsb s PRO 50 Ca 0.08 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.38 2gsb s PRO 50 Cb -0.15 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.22 2gsb s PRO 50 CO 0.10 -1.84 0.00 0.41 0.04 0.00 0.00 177.00 175.71 2gsb n GLY 51 N 5.36 3.64 3.48 0.56 0.00 -1.26 -5.10 105.19 111.86 2gsb n GLY 51 Ca 0.21 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.93 2gsb n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gsb s ASP 52 N 0.00 0.68 0.17 1.61 2.15 -1.17 -4.85 116.67 115.27 2gsb s ASP 52 Ca 0.00 1.27 -0.05 0.00 0.43 0.00 0.00 52.55 54.20 2gsb s ASP 52 Cb 0.00 -1.96 -0.03 0.00 -0.30 0.00 0.00 42.92 40.64 2gsb s ASP 52 CO 0.00 -4.35 0.20 -0.31 -0.17 0.00 0.00 175.17 170.54 2gsb s TYR 53 N -2.51 0.72 -0.26 -5.34 2.02 -1.07 -1.56 117.35 109.34 2gsb s TYR 53 Ca 0.68 -1.05 -0.18 0.00 -0.37 0.00 0.00 57.07 56.15 2gsb s TYR 53 Cb -0.21 -0.28 0.07 0.00 -0.40 0.00 0.00 41.96 41.14 2gsb s TYR 53 CO 0.62 -0.67 0.67 0.45 -1.57 0.00 0.00 175.55 175.04 2gsb s SER 54 N -3.05 -0.83 0.35 2.29 0.15 -0.74 -2.28 113.70 109.59 2gsb s SER 54 Ca 0.25 1.42 -0.12 0.00 0.70 0.00 0.00 55.95 58.20 2gsb s SER 54 Cb 0.05 1.35 -0.07 0.00 -1.71 0.00 0.00 66.02 65.63 2gsb s SER 54 CO 0.05 -0.24 0.73 -0.22 1.20 0.00 0.00 173.24 174.76 2gsb s LEU 55 N 1.16 3.96 -0.28 3.45 2.96 -0.69 -2.55 118.68 126.69 2gsb s LEU 55 Ca -0.06 1.15 -0.01 0.00 -0.22 0.00 0.00 54.13 54.98 2gsb s LEU 55 Cb -0.05 -3.98 0.09 0.00 0.50 0.00 0.00 46.19 42.74 2gsb s LEU 55 CO -0.12 -0.29 0.07 -0.31 -1.32 0.00 0.00 176.35 174.39 2gsb s TYR 56 N -2.16 1.67 0.05 5.38 1.51 -0.61 -1.90 117.35 121.29 2gsb s TYR 56 Ca 0.52 -1.58 0.06 0.00 -1.01 0.00 0.00 57.07 55.06 2gsb s TYR 56 Cb -0.10 -1.58 -0.03 0.00 -0.11 0.00 0.00 41.96 40.13 2gsb s TYR 56 CO 0.25 -0.82 -0.14 0.12 -1.11 0.00 0.00 175.55 173.85 2gsb s PHE 57 N 1.63 2.65 -0.05 2.71 5.36 -1.22 -2.57 117.98 126.50 2gsb s PHE 57 Ca 0.06 -0.20 -0.14 0.00 -0.96 0.00 0.00 56.93 55.70 2gsb s PHE 57 Cb -0.17 -1.48 -0.05 0.00 -0.34 0.00 0.00 43.02 40.98 2gsb s PHE 57 CO -0.20 0.32 0.35 0.50 -1.46 0.00 0.00 175.22 174.73 2gsb s ARG 58 N -1.63 3.91 0.07 10.12 6.06 -1.18 0.08 118.95 136.38 2gsb s ARG 58 Ca 0.17 0.28 0.02 0.00 -2.50 0.00 0.00 55.73 53.70 2gsb s ARG 58 Cb -0.11 -3.26 -0.03 0.00 0.06 0.00 0.00 34.95 31.61 2gsb s ARG 58 CO 0.08 0.61 -0.07 0.95 -2.50 0.00 0.00 175.30 174.36 2gsb s THR 59 N -0.74 0.65 0.43 4.11 -4.23 -1.26 -4.33 115.64 110.27 2gsb s THR 59 Ca 0.21 -1.56 0.28 0.00 -1.18 0.00 0.00 61.69 59.44 2gsb s THR 59 Cb -0.15 -1.21 0.46 0.00 1.34 0.00 0.00 72.50 72.94 2gsb s THR 59 CO 0.10 -0.64 1.64 0.78 -0.54 0.00 0.00 174.62 175.96 2gsb h ASN 60 N 3.65 0.28 0.00 3.99 2.35 -1.99 -2.61 115.58 121.26 2gsb h ASN 60 Ca -0.36 0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.53 2gsb h ASN 60 Cb 1.18 0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.67 2gsb h ASN 60 CO 0.54 -0.15 0.00 -0.62 -1.65 0.00 0.00 177.43 175.55 2gsb n GLU 61 N -4.71 0.00 -3.54 0.81 -0.58 -1.26 -5.04 120.64 106.31 2gsb n GLU 61 Ca 0.35 0.36 -0.12 0.00 -0.42 0.00 0.00 57.16 57.33 2gsb n GLU 61 Cb 1.33 -0.94 -0.05 0.00 -0.57 0.00 0.00 31.44 31.22 2gsb n GLU 61 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2gsb s ASN 62 N -2.36 -0.45 -0.22 1.62 2.20 -0.98 -5.12 114.94 109.62 2gsb s ASN 62 Ca 0.00 0.40 -0.40 0.00 -0.94 0.00 0.00 52.86 51.92 2gsb s ASN 62 Cb 0.00 0.39 -0.17 0.00 -2.00 0.00 0.00 41.25 39.48 2gsb s ASN 62 CO 0.00 -0.49 1.62 -0.38 -2.94 0.00 0.00 177.10 174.91 2gsb n ILE 63 N 0.56 0.20 -2.55 0.54 5.41 -1.26 -4.00 119.36 118.25 2gsb n ILE 63 Ca -0.13 -0.04 -0.24 0.00 1.00 0.00 0.00 62.75 63.35 2gsb n ILE 63 Cb 0.59 -1.01 0.13 0.00 -0.71 0.00 0.00 39.64 38.64 2gsb n ILE 63 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2gsb s GLN 64 N 2.71 1.45 -0.13 0.38 -0.21 0.11 -4.94 119.66 119.03 2gsb s GLN 64 Ca 0.96 -1.14 -0.07 0.00 0.02 0.00 0.00 55.36 55.13 2gsb s GLN 64 Cb -1.11 -2.28 0.05 0.00 1.00 0.00 0.00 33.01 30.68 2gsb s GLN 64 CO 0.63 -1.64 0.31 1.03 -2.12 0.00 0.00 175.29 173.51 2gsb s ARG 65 N -5.25 0.27 -0.03 2.91 0.52 -1.26 -3.40 118.95 112.71 2gsb s ARG 65 Ca 0.68 0.66 0.01 0.00 -0.52 0.00 0.00 55.73 56.56 2gsb s ARG 65 Cb -0.04 -0.06 -0.03 0.00 0.52 0.00 0.00 34.95 35.33 2gsb s ARG 65 CO 0.46 -0.18 -0.04 -0.06 0.02 0.00 0.00 175.30 175.50 2gsb s PHE 66 N 1.46 2.99 -0.14 -0.53 0.40 -0.80 -4.93 117.98 116.44 2gsb s PHE 66 Ca -0.08 0.04 -0.14 0.00 -0.60 0.00 0.00 56.93 56.15 2gsb s PHE 66 Cb -0.10 -1.68 -0.05 0.00 0.51 0.00 0.00 43.02 41.71 2gsb s PHE 66 CO -0.10 0.40 0.33 0.15 0.70 0.00 0.00 175.22 176.70 2gsb s LYS 67 N -1.24 4.23 -0.29 0.44 -0.14 -1.26 -1.70 119.74 119.78 2gsb s LYS 67 Ca 0.16 0.16 -0.01 0.00 -1.36 0.00 0.00 55.97 54.93 2gsb s LYS 67 Cb -0.11 -3.41 0.09 0.00 -1.68 0.00 0.00 37.83 32.72 2gsb s LYS 67 CO 0.06 0.26 0.08 0.42 -0.76 0.00 0.00 175.35 175.41 2gsb s ILE 68 N 0.37 0.86 -0.09 2.17 1.01 -0.97 -4.30 121.20 120.25 2gsb s ILE 68 Ca 0.18 -1.25 -0.14 0.00 0.00 0.00 0.00 60.65 59.44 2gsb s ILE 68 Cb -0.13 -1.57 -0.05 0.00 0.01 0.00 0.00 42.46 40.71 2gsb s ILE 68 CO 0.05 -0.57 0.35 0.00 0.00 0.00 0.00 174.94 174.77 2gsb s PRO 70 N -0.24 4.05 0.07 0.00 0.04 -1.26 -0.98 135.00 136.68 2gsb s PRO 70 Ca 0.20 1.89 0.04 0.00 0.04 0.00 0.00 61.00 63.17 2gsb s PRO 70 Cb -0.15 -2.70 -0.04 0.00 0.04 0.00 0.00 34.50 31.66 2gsb s PRO 70 CO 0.08 -0.34 -0.01 0.95 0.04 0.00 0.00 177.00 177.72 2gsb s THR 71 N -1.38 3.96 -1.29 1.26 -4.23 -0.01 -4.86 115.64 109.09 2gsb s THR 71 Ca 0.57 -0.92 0.15 0.00 -1.18 0.00 0.00 61.69 60.30 2gsb s THR 71 Cb -0.32 -2.85 0.21 0.00 1.34 0.00 0.00 72.50 70.89 2gsb s THR 71 CO 0.40 0.19 1.42 -0.81 -0.54 0.00 0.00 174.62 175.28 2gsb n PRO 72 N 0.82 0.14 -1.16 3.99 -0.04 -1.26 -3.08 135.00 134.41 2gsb n PRO 72 Ca -0.12 0.18 -0.28 0.00 -0.04 0.00 0.00 63.50 63.25 2gsb n PRO 72 Cb 0.52 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.56 2gsb n PRO 72 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2gsb n ASN 73 N -1.35 6.85 -4.14 3.54 4.13 -1.26 -4.85 115.26 118.18 2gsb n ASN 73 Ca 0.06 -3.51 -0.35 0.00 1.68 0.00 0.00 54.58 52.46 2gsb n ASN 73 Cb 0.13 -0.98 -0.01 0.00 -1.54 0.00 0.00 39.78 37.38 2gsb n ASN 73 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2gsb n ASN 74 N -0.52 -3.69 -2.16 6.41 5.15 -1.18 -4.92 115.26 114.35 2gsb n ASN 74 Ca 0.51 -0.95 -0.10 0.00 -0.60 0.00 0.00 54.58 53.45 2gsb n ASN 74 Cb 0.73 -3.07 -0.03 0.00 -0.53 0.00 0.00 39.78 36.88 2gsb n ASN 74 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gsb n GLN 75 N -4.47 0.27 -4.18 1.20 6.02 -1.23 -4.87 117.38 110.11 2gsb n GLN 75 Ca 0.06 -1.71 -0.16 0.00 -0.01 0.00 0.00 57.00 55.19 2gsb n GLN 75 Cb 0.50 1.47 -0.11 0.00 1.02 0.00 0.00 30.24 33.12 2gsb n GLN 75 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2gsb s PHE 76 N -3.06 1.14 -0.17 1.08 0.40 -1.21 -0.83 117.98 115.34 2gsb s PHE 76 Ca 0.20 -0.59 -0.00 0.00 -0.60 0.00 0.00 56.93 55.93 2gsb s PHE 76 Cb 0.01 -0.62 0.00 0.00 0.51 0.00 0.00 43.02 42.91 2gsb s PHE 76 CO 0.14 0.04 -0.14 -1.64 0.70 0.00 0.00 175.22 174.32 2gsb s MET 77 N -2.53 3.21 -0.39 0.44 -1.94 -0.15 -2.73 119.30 115.21 2gsb s MET 77 Ca 0.04 -0.74 0.01 0.00 -1.71 0.00 0.00 55.69 53.30 2gsb s MET 77 Cb -0.05 -2.70 0.14 0.00 2.01 0.00 0.00 34.83 34.23 2gsb s MET 77 CO 0.01 -0.07 0.22 1.41 -0.01 0.00 0.00 175.02 176.58 2gsb s MET 78 N 1.03 0.92 0.00 2.03 0.00 -1.14 -2.20 119.30 119.95 2gsb s MET 78 Ca -0.01 -1.64 0.00 0.00 0.00 0.00 0.00 55.69 54.04 2gsb s MET 78 Cb -0.15 -1.85 0.00 0.00 0.00 0.00 0.00 34.83 32.83 2gsb s MET 78 CO -0.03 -1.17 0.00 0.41 0.00 0.00 0.00 175.02 174.23 2gsb n GLY 79 N 3.85 0.49 2.43 2.11 0.00 -1.26 -4.00 105.19 108.80 2gsb n GLY 79 Ca 0.09 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 2gsb n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gsb n GLY 80 N -0.76 -0.10 3.35 -0.02 0.00 -1.26 -4.98 105.19 101.41 2gsb n GLY 80 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2gsb n GLY 80 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gsb s ARG 81 N -4.85 1.32 -0.16 1.61 0.52 -1.26 -5.14 118.95 111.00 2gsb s ARG 81 Ca 0.00 -1.53 0.02 0.00 -0.52 0.00 0.00 55.73 53.70 2gsb s ARG 81 Cb 0.00 -1.23 0.02 0.00 0.52 0.00 0.00 34.95 34.26 2gsb s ARG 81 CO 0.00 0.22 -0.21 0.71 0.02 0.00 0.00 175.30 176.04 2gsb s TYR 82 N -2.59 2.73 0.28 -0.53 2.02 -1.26 -2.87 117.35 115.12 2gsb s TYR 82 Ca 0.20 -1.51 0.09 0.00 -0.37 0.00 0.00 57.07 55.48 2gsb s TYR 82 Cb -0.03 -1.87 -0.05 0.00 -0.40 0.00 0.00 41.96 39.60 2gsb s TYR 82 CO 0.07 -0.72 -0.12 0.71 -1.57 0.00 0.00 175.55 173.92 2gsb s TYR 83 N 1.08 2.09 0.01 2.71 1.51 -1.11 -5.03 117.35 118.61 2gsb s TYR 83 Ca -0.00 -0.53 -0.25 0.00 -1.01 0.00 0.00 57.07 55.28 2gsb s TYR 83 Cb -0.14 -1.07 -0.17 0.00 -0.11 0.00 0.00 41.96 40.47 2gsb s TYR 83 CO -0.08 0.48 1.29 -2.95 -1.11 0.00 0.00 175.55 173.19 2gsb h ASN 84 N 2.28 -0.30 -5.00 2.29 -1.07 -1.92 -3.21 115.58 108.65 2gsb h ASN 84 Ca -0.40 -0.19 -0.08 0.00 0.07 0.00 0.00 56.30 55.70 2gsb h ASN 84 Cb 1.24 0.08 -0.19 0.00 -2.07 0.00 0.00 38.32 37.38 2gsb h ASN 84 CO 0.65 0.05 0.00 -0.94 0.07 0.00 0.00 177.43 177.25 2gsb s SER 85 N -5.13 -0.45 0.13 6.14 1.04 -1.26 -4.53 113.70 109.63 2gsb s SER 85 Ca -0.14 0.39 -0.25 0.00 0.48 0.00 0.00 55.95 56.43 2gsb s SER 85 Cb 0.02 0.45 -0.06 0.00 0.10 0.00 0.00 66.02 66.54 2gsb s SER 85 CO 0.57 -0.58 1.38 -0.38 0.98 0.00 0.00 173.24 175.21 2gsb n ILE 86 N 0.92 -0.54 -0.29 -1.02 5.41 -1.26 0.37 119.36 122.95 2gsb n ILE 86 Ca -0.20 2.16 0.22 0.00 1.00 0.00 0.00 62.75 65.93 2gsb n ILE 86 Cb 0.57 -2.69 0.41 0.00 -0.71 0.00 0.00 39.64 37.22 2gsb n ILE 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2gsb n GLY 87 N -1.20 -0.90 0.08 7.39 0.00 -1.26 0.63 105.19 109.94 2gsb n GLY 87 Ca 0.02 0.78 -0.13 0.00 0.00 0.00 0.00 46.02 46.69 2gsb n GLY 87 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2gsb h ASP 88 N 0.00 -0.07 -1.55 1.61 3.58 -0.50 -2.72 116.42 116.77 2gsb h ASP 88 Ca 0.66 -0.22 0.45 0.00 0.42 0.00 0.00 57.03 58.34 2gsb h ASP 88 Cb 1.60 0.02 -0.06 0.00 1.72 0.00 0.00 39.33 42.60 2gsb h ASP 88 CO -0.74 0.18 1.20 0.40 -2.88 0.00 0.00 179.24 177.39 2gsb h ILE 89 N -0.32 0.13 0.03 2.25 2.04 0.60 0.68 117.51 122.92 2gsb h ILE 89 Ca -0.01 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.73 2gsb h ILE 89 Cb 0.28 0.14 0.01 0.00 -0.74 0.00 0.00 36.82 36.51 2gsb h ILE 89 CO 0.01 0.00 -0.47 0.40 0.00 0.00 0.00 178.15 178.09 2gsb h ILE 90 N 0.00 1.52 -0.43 -0.67 5.03 -1.28 -2.74 117.51 118.94 2gsb h ILE 90 Ca 0.74 -2.16 0.05 0.00 -0.12 0.00 0.00 64.86 63.37 2gsb h ILE 90 Cb 3.13 2.86 -0.02 0.00 -3.03 0.00 0.00 36.82 39.75 2gsb h ILE 90 CO -0.01 0.60 0.29 -0.78 -0.68 0.00 0.00 178.15 177.58 2gsb h ASP 91 N -0.38 0.34 0.24 1.72 3.58 0.41 0.74 116.42 123.08 2gsb h ASP 91 Ca -0.07 -0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.16 2gsb h ASP 91 Cb 1.25 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 42.23 2gsb h ASP 91 CO 0.09 0.23 -0.90 -0.74 -2.88 0.00 0.00 179.24 175.04 2gsb h HIS 92 N 0.39 0.69 0.00 0.28 2.76 -1.36 -3.20 115.15 114.71 2gsb h HIS 92 Ca 0.18 -0.36 -0.11 0.00 -2.20 0.00 0.00 60.37 57.89 2gsb h HIS 92 Cb 0.23 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.09 2gsb h HIS 92 CO -0.00 1.17 -0.53 1.88 -1.30 0.00 0.00 177.93 179.14 2gsb h TYR 93 N 0.28 0.00 0.00 5.26 0.05 -0.97 -2.43 116.97 119.17 2gsb h TYR 93 Ca -0.07 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.71 2gsb h TYR 93 Cb 1.53 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.27 2gsb h TYR 93 CO 0.06 0.53 0.10 0.54 -1.05 0.00 0.00 178.16 178.35 2gsb n ARG 94 N -3.57 0.09 0.00 4.88 1.74 0.15 -1.25 116.66 118.70 2gsb n ARG 94 Ca -0.00 0.57 0.00 0.00 -0.77 0.00 0.00 57.85 57.65 2gsb n ARG 94 Cb 0.61 -1.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 2gsb n ARG 94 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2gsb n LYS 95 N -2.00 1.84 -4.46 5.56 4.01 -1.13 -4.82 118.16 117.15 2gsb n LYS 95 Ca -0.01 0.00 -0.31 0.00 -0.51 0.00 0.00 58.31 57.48 2gsb n LYS 95 Cb 0.12 -0.84 -0.11 0.00 -0.51 0.00 0.00 35.03 33.69 2gsb n LYS 95 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 2gsb s GLU 96 N -1.60 2.35 -0.52 1.97 2.56 -0.38 -5.06 118.70 118.02 2gsb s GLU 96 Ca 0.00 -0.85 -0.27 0.00 0.00 0.00 0.00 54.97 53.85 2gsb s GLU 96 Cb 0.00 -2.38 -0.01 0.00 2.00 0.00 0.00 34.13 33.73 2gsb s GLU 96 CO 0.00 0.57 1.76 -0.65 -0.56 0.00 0.00 175.26 176.37 2gsb s GLN 97 N -1.59 2.96 0.53 4.30 -0.21 -1.26 -4.57 119.66 119.82 2gsb s GLN 97 Ca 0.17 0.82 0.29 0.00 0.02 0.00 0.00 55.36 56.67 2gsb s GLN 97 Cb -0.11 -4.28 1.44 0.00 1.00 0.00 0.00 33.01 31.06 2gsb s GLN 97 CO 0.08 -2.33 2.05 0.97 -2.12 0.00 0.00 175.29 173.94 2gsb h ILE 98 N 6.77 0.43 -1.35 1.08 2.10 -1.73 -3.45 117.51 121.37 2gsb h ILE 98 Ca -0.28 -0.58 -0.63 0.00 1.08 0.00 0.00 64.86 64.45 2gsb h ILE 98 Cb 1.15 1.41 -0.13 0.00 -1.09 0.00 0.00 36.82 38.16 2gsb h ILE 98 CO 1.16 0.11 -0.56 -0.69 -1.08 0.00 0.00 178.15 177.08 2gsb s VAL 99 N -4.02 1.49 0.42 2.19 1.01 -1.25 -4.98 120.40 115.25 2gsb s VAL 99 Ca -0.02 -2.00 0.35 0.00 0.00 0.00 0.00 61.98 60.31 2gsb s VAL 99 Cb 0.12 -2.61 0.52 0.00 0.00 0.00 0.00 36.38 34.42 2gsb s VAL 99 CO 0.57 0.00 1.29 -1.84 0.00 0.00 0.00 175.10 175.12 2gsb n GLU 100 N -1.05 -0.01 -2.67 2.72 0.28 -1.26 -3.25 120.64 115.39 2gsb n GLU 100 Ca -0.10 0.96 -0.04 0.00 -0.16 0.00 0.00 57.16 57.82 2gsb n GLU 100 Cb 0.67 -2.06 0.07 0.00 1.43 0.00 0.00 31.44 31.55 2gsb n GLU 100 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2gsb n GLY 101 N -1.61 -0.92 3.09 -1.84 0.00 -1.26 -5.09 105.19 97.55 2gsb n GLY 101 Ca 0.35 0.46 -0.07 0.00 0.00 0.00 0.00 46.02 46.76 2gsb n GLY 101 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gsb s TYR 102 N 0.07 0.52 0.11 1.61 1.51 -1.20 -5.08 117.35 114.89 2gsb s TYR 102 Ca 0.15 -1.02 0.08 0.00 -1.01 0.00 0.00 57.07 55.27 2gsb s TYR 102 Cb 0.23 -0.38 -0.04 0.00 -0.11 0.00 0.00 41.96 41.66 2gsb s TYR 102 CO -0.12 -0.35 -0.19 0.71 -1.11 0.00 0.00 175.55 174.49 2gsb s TYR 103 N -3.71 1.69 -0.53 2.71 2.02 -1.26 -2.41 117.35 115.85 2gsb s TYR 103 Ca 0.06 -0.45 -0.26 0.00 -0.37 0.00 0.00 57.07 56.05 2gsb s TYR 103 Cb 0.06 -0.91 0.03 0.00 -0.40 0.00 0.00 41.96 40.75 2gsb s TYR 103 CO -0.09 0.21 1.03 -0.51 -1.57 0.00 0.00 175.55 174.62 2gsb s LEU 104 N -2.11 3.84 0.00 -1.29 1.43 -1.26 -4.91 118.68 114.39 2gsb s LEU 104 Ca 0.08 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 2gsb s LEU 104 Cb -0.09 -3.08 0.00 0.00 0.03 0.00 0.00 46.19 43.06 2gsb s LEU 104 CO 0.04 -1.27 0.11 0.29 0.23 0.00 0.00 176.35 175.76 2gsb n LYS 105 N 7.73 0.00 -3.68 1.70 4.76 -1.25 -4.71 118.16 122.71 2gsb n LYS 105 Ca 0.06 0.45 -0.14 0.00 -2.87 0.00 0.00 58.31 55.81 2gsb n LYS 105 Cb 0.48 -1.01 -0.08 0.00 -1.84 0.00 0.00 35.03 32.58 2gsb n LYS 105 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2gsb s GLU 106 N -1.13 0.68 1.07 1.97 -1.05 -1.18 -5.09 118.70 113.97 2gsb s GLU 106 Ca 0.00 0.53 -0.15 0.00 -0.15 0.00 0.00 54.97 55.20 2gsb s GLU 106 Cb 0.00 0.32 0.23 0.00 -0.44 0.00 0.00 34.13 34.24 2gsb s GLU 106 CO 0.00 -0.12 1.10 -1.25 0.95 0.00 0.00 175.26 175.94 2gsb s PRO 107 N -0.16 -0.18 -0.05 -4.83 0.04 -1.26 -3.73 135.00 124.82 2gsb s PRO 107 Ca -0.03 0.31 -0.29 0.00 0.04 0.00 0.00 61.00 61.02 2gsb s PRO 107 Cb -0.03 -1.68 -0.02 0.00 0.04 0.00 0.00 34.50 32.80 2gsb s PRO 107 CO 0.02 -3.10 0.97 0.08 0.04 0.00 0.00 177.00 175.02 2gsb s VAL 108 N -2.98 4.84 0.46 -0.36 1.01 -0.83 -4.78 120.40 117.76 2gsb s VAL 108 Ca 0.67 2.01 -0.23 0.00 0.00 0.00 0.00 61.98 64.44 2gsb s VAL 108 Cb -0.16 -4.30 -0.07 0.00 0.00 0.00 0.00 36.38 31.85 2gsb s VAL 108 CO 0.57 0.09 1.16 -2.16 0.00 0.00 0.00 175.10 174.77 2gsb s PRO 109 N 1.46 3.76 0.96 2.72 0.04 -1.26 -4.49 135.00 138.18 2gsb s PRO 109 Ca 0.49 1.77 -0.12 0.00 0.04 0.00 0.00 61.00 63.19 2gsb s PRO 109 Cb -0.20 -2.40 0.16 0.00 0.04 0.00 0.00 34.50 32.10 2gsb s PRO 109 CO 0.23 -0.55 1.09 -1.64 0.04 0.00 0.00 177.00 176.17 2gsb s MET 110 N -2.70 0.76 -0.75 4.56 -1.94 -1.26 -4.99 119.30 112.97 2gsb s MET 110 Ca 0.64 0.73 0.03 0.00 -1.71 0.00 0.00 55.69 55.38 2gsb s MET 110 Cb -0.28 -1.76 0.27 0.00 2.01 0.00 0.00 34.83 35.06 2gsb s MET 110 CO 0.35 -2.56 0.94 0.00 -0.01 0.00 0.00 175.02 173.74 2gsb n GLN 111 N -4.09 3.05 -1.40 2.03 0.00 -1.26 -5.08 117.38 110.63 2gsb n GLN 111 Ca 0.06 -4.65 -0.34 0.00 0.00 0.00 0.00 57.00 52.07 2gsb n GLN 111 Cb 0.56 -2.32 0.10 0.00 0.00 0.00 0.00 30.24 28.57 2gsb n GLN 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2gsb s ASP 112 N -2.33 4.14 -1.14 2.61 1.01 -1.26 -2.62 116.67 117.08 2gsb s ASP 112 Ca 0.38 2.36 -0.10 0.00 0.71 0.00 0.00 52.55 55.90 2gsb s ASP 112 Cb 0.13 -2.59 0.09 0.00 1.01 0.00 0.00 42.92 41.55 2gsb s ASP 112 CO 0.02 -2.30 0.39 1.67 0.21 0.00 0.00 175.17 175.16 2gsb n GLN 113 N -2.77 -2.74 -3.90 8.23 -0.06 -1.26 -4.90 117.38 109.99 2gsb n GLN 113 Ca 0.13 0.32 -0.34 0.00 -2.00 0.00 0.00 57.00 55.12 2gsb n GLN 113 Cb 0.50 -4.96 -0.13 0.00 -4.06 0.00 0.00 30.24 21.59 2gsb n GLN 113 CO 0.00 0.00 0.00 -1.12 -0.20 0.00 0.00 177.06 175.74 2gsb s SER 114 N -2.65 4.98 0.90 1.69 0.01 -1.08 -5.10 113.70 112.46 2gsb s SER 114 Ca 0.39 -1.85 -0.17 0.00 1.31 0.00 0.00 55.95 55.62 2gsb s SER 114 Cb -0.21 -1.73 -0.15 0.00 0.21 0.00 0.00 66.02 64.15 2gsb s SER 114 CO 0.47 -0.41 -0.64 0.61 0.41 0.00 0.00 173.24 173.68 2gsb n GLY 115 N 4.49 -4.32 0.18 3.44 0.00 -1.26 -4.81 105.19 102.92 2gsb n GLY 115 Ca -0.04 -0.67 0.14 0.00 0.00 0.00 0.00 46.02 45.45 2gsb n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gsb h PRO 116 N -0.81 0.00 -4.92 1.61 0.13 -1.99 -3.44 132.00 122.58 2gsb h PRO 116 Ca -0.43 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.25 2gsb h PRO 116 Cb 1.33 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.36 2gsb h PRO 116 CO 0.27 0.00 1.83 0.43 -0.23 0.00 0.00 178.00 180.30 2gsb n SER 117 N -2.53 -0.34 -4.81 1.44 7.64 -1.26 -4.85 113.62 108.90 2gsb n SER 117 Ca 0.01 -0.08 -0.30 0.00 1.01 0.00 0.00 58.87 59.51 2gsb n SER 117 Cb 0.25 -0.77 0.07 0.00 -1.01 0.00 0.00 64.21 62.75 2gsb n SER 117 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2gsb s SER 118 N 5.68 4.94 0.00 6.43 0.01 -1.26 -5.21 113.70 124.28 2gsb s SER 118 Ca 1.32 1.44 0.00 0.00 1.31 0.00 0.00 55.95 60.02 2gsb s SER 118 Cb -1.10 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 62.90 2gsb s SER 118 CO 0.51 -1.70 0.00 0.61 0.41 0.00 0.00 173.24 173.07