#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 4.65 -0.13 1.61 1.04 -1.26 -5.05 113.70 114.57 2gsb s SER 2 Ca 0.00 -2.65 -0.04 0.00 0.48 0.00 0.00 55.95 53.74 2gsb s SER 2 Cb 0.00 -1.68 0.06 0.00 0.10 0.00 0.00 66.02 64.49 2gsb s SER 2 CO 0.00 -0.32 0.11 -0.94 0.98 0.00 0.00 173.24 173.07 2gsb s SER 3 N 0.38 1.74 0.00 7.02 1.04 -1.26 -4.89 113.70 117.74 2gsb s SER 3 Ca 0.14 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.29 2gsb s SER 3 Cb -0.23 -0.08 0.00 0.00 0.10 0.00 0.00 66.02 65.81 2gsb s SER 3 CO -0.03 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.49 2gsb n GLY 4 N 5.29 4.17 3.16 7.32 0.00 -1.26 -5.11 105.19 118.76 2gsb n GLY 4 Ca -0.06 -0.67 -0.50 0.00 0.00 0.00 0.00 46.02 44.80 2gsb n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2gsb n SER 5 N 0.00 -0.41 -4.37 1.61 2.88 -1.26 -4.93 113.62 107.14 2gsb n SER 5 Ca 0.00 1.05 -0.34 0.00 -1.33 0.00 0.00 58.87 58.25 2gsb n SER 5 Cb 0.00 -0.85 -0.14 0.00 -0.75 0.00 0.00 64.21 62.47 2gsb n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2gsb s SER 6 N -0.32 4.28 -0.05 -3.46 0.15 -1.26 -4.90 113.70 108.13 2gsb s SER 6 Ca 0.74 -0.31 -0.04 0.00 0.70 0.00 0.00 55.95 57.04 2gsb s SER 6 Cb -1.05 -1.70 0.02 0.00 -1.71 0.00 0.00 66.02 61.58 2gsb s SER 6 CO 0.52 0.09 0.08 0.61 1.20 0.00 0.00 173.24 175.74 2gsb n GLY 7 N 4.02 -4.03 3.53 9.45 0.00 -1.26 -4.75 105.19 112.16 2gsb n GLY 7 Ca -0.18 0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2gsb n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gsb n ARG 8 N 0.76 0.64 -4.01 1.61 1.74 -1.26 -4.90 116.66 111.24 2gsb n ARG 8 Ca -0.13 -0.04 -0.26 0.00 -0.77 0.00 0.00 57.85 56.64 2gsb n ARG 8 Cb 0.21 -2.73 -0.03 0.00 -1.02 0.00 0.00 32.46 28.88 2gsb n ARG 8 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2gsb s GLU 9 N 8.54 2.27 0.07 5.56 2.02 -1.26 -5.15 118.70 130.74 2gsb s GLU 9 Ca 1.12 -1.99 0.09 0.00 0.02 0.00 0.00 54.97 54.20 2gsb s GLU 9 Cb -0.56 -2.03 -0.03 0.00 0.10 0.00 0.00 34.13 31.61 2gsb s GLU 9 CO 0.34 -0.46 -0.23 -1.21 0.02 0.00 0.00 175.26 173.72 2gsb s GLU 10 N -4.15 1.42 0.07 1.61 2.02 -1.26 -5.15 118.70 113.27 2gsb s GLU 10 Ca 0.33 -1.09 0.04 0.00 0.02 0.00 0.00 54.97 54.27 2gsb s GLU 10 Cb -0.01 -1.65 -0.04 0.00 0.10 0.00 0.00 34.13 32.53 2gsb s GLU 10 CO 0.20 0.41 -0.00 -0.51 0.02 0.00 0.00 175.26 175.37 2gsb s ASP 11 N -1.49 5.03 0.06 -0.19 1.01 -1.26 -5.04 116.67 114.78 2gsb s ASP 11 Ca 0.09 -0.15 -0.18 0.00 0.71 0.00 0.00 52.55 53.02 2gsb s ASP 11 Cb -0.10 -1.22 -0.12 0.00 1.01 0.00 0.00 42.92 42.50 2gsb s ASP 11 CO 0.03 0.20 1.37 1.55 0.21 0.00 0.00 175.17 178.53 2gsb h PRO 12 N 3.62 0.49 -0.98 8.23 0.13 -2.01 0.49 132.00 141.96 2gsb h PRO 12 Ca -0.48 -0.26 0.05 0.00 -0.87 0.00 0.00 66.00 64.45 2gsb h PRO 12 Cb 1.17 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 2gsb h PRO 12 CO 0.59 0.83 0.63 1.25 -0.23 0.00 0.00 178.00 181.08 2gsb h HIS 13 N 0.16 1.18 -0.01 1.56 2.76 -1.99 -0.55 115.15 118.26 2gsb h HIS 13 Ca 0.03 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 2gsb h HIS 13 Cb 0.74 -0.39 0.00 0.00 1.55 0.00 0.00 27.41 29.31 2gsb h HIS 13 CO 0.08 0.64 -0.25 -0.85 -1.30 0.00 0.00 177.93 176.25 2gsb n GLU 14 N -4.49 0.88 0.00 5.26 -0.00 -1.21 -3.76 120.64 117.32 2gsb n GLU 14 Ca 0.14 -0.52 0.12 0.00 -0.00 0.00 0.00 57.16 56.89 2gsb n GLU 14 Cb 0.14 -1.49 0.18 0.00 -0.00 0.00 0.00 31.44 30.28 2gsb n GLU 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2gsb n GLY 15 N 1.34 -1.08 3.53 -1.84 0.00 0.16 -4.93 105.19 102.37 2gsb n GLY 15 Ca 0.12 -0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.35 -0.01 0.02 1.61 4.76 -0.89 -4.94 118.16 117.36 2gsb n LYS 16 Ca 0.06 0.06 -0.13 0.00 -2.87 0.00 0.00 58.31 55.43 2gsb n LYS 16 Cb 0.34 -2.07 -0.14 0.00 -1.84 0.00 0.00 35.03 31.32 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 -1.09 1.04 0.00 -0.18 2.10 -1.92 -3.32 117.51 114.14 2gsb h ILE 17 Ca -0.45 -2.78 0.00 0.00 1.08 0.00 0.00 64.86 62.71 2gsb h ILE 17 Cb 1.30 2.62 0.00 0.00 -1.09 0.00 0.00 36.82 39.65 2gsb h ILE 17 CO 0.40 0.73 0.00 4.11 -1.08 0.00 0.00 178.15 182.32 2gsb h TRP 18 N 0.04 0.00 -4.03 2.19 5.08 -1.93 -3.41 115.95 113.89 2gsb h TRP 18 Ca -0.25 0.00 -0.48 0.00 1.08 0.00 0.00 58.89 59.24 2gsb h TRP 18 Cb 1.99 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 28.16 2gsb h TRP 18 CO 0.03 0.00 0.29 0.12 -1.28 0.00 0.00 178.44 177.60 2gsb s PHE 19 N -3.31 3.47 -0.24 0.12 5.36 -1.25 -1.07 117.98 121.06 2gsb s PHE 19 Ca 0.06 1.31 -0.03 0.00 -0.96 0.00 0.00 56.93 57.31 2gsb s PHE 19 Cb 0.06 -2.67 0.13 0.00 -0.34 0.00 0.00 43.02 40.20 2gsb s PHE 19 CO 0.64 -0.30 0.39 -1.01 -1.46 0.00 0.00 175.22 173.48 2gsb s HIS 20 N -2.57 -0.84 0.00 10.12 3.76 -0.11 -4.86 115.29 120.78 2gsb s HIS 20 Ca 0.56 0.97 0.00 0.00 -0.15 0.00 0.00 55.06 56.44 2gsb s HIS 20 Cb -0.10 0.08 0.00 0.00 1.11 0.00 0.00 32.58 33.67 2gsb s HIS 20 CO 0.33 -0.68 0.00 0.41 -0.85 0.00 0.00 174.74 173.94 2gsb n GLY 21 N 5.37 0.47 0.09 -2.22 0.00 -1.26 -4.41 105.19 103.23 2gsb n GLY 21 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.07 -6.80 1.61 1.79 -1.97 -3.47 116.57 107.66 2gsb h LYS 22 Ca 0.00 0.01 -0.36 0.00 -2.18 0.00 0.00 60.65 58.12 2gsb h LYS 22 Cb 0.00 0.02 0.20 0.00 -1.58 0.00 0.00 32.23 30.87 2gsb h LYS 22 CO 0.00 0.44 -0.21 0.44 -1.08 0.00 0.00 179.45 179.04 2gsb n ILE 23 N -4.77 0.00 -3.91 1.86 -5.35 -1.26 -5.05 119.36 100.88 2gsb n ILE 23 Ca -0.06 -0.12 -0.26 0.00 -0.27 0.00 0.00 62.75 62.04 2gsb n ILE 23 Cb 0.27 -0.89 -0.02 0.00 -1.74 0.00 0.00 39.64 37.26 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 -2.70 4.63 0.44 7.28 0.15 -1.26 -4.99 113.70 117.25 2gsb s SER 24 Ca 0.62 -1.20 0.16 0.00 0.70 0.00 0.00 55.95 56.23 2gsb s SER 24 Cb -0.14 0.23 1.00 0.00 -1.71 0.00 0.00 66.02 65.41 2gsb s SER 24 CO 0.55 -1.00 1.96 0.50 1.20 0.00 0.00 173.24 176.45 2gsb h LYS 25 N 0.87 0.00 0.10 5.44 3.64 -2.00 -2.17 116.57 122.45 2gsb h LYS 25 Ca -0.38 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 58.79 2gsb h LYS 25 Cb 1.29 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.14 2gsb h LYS 25 CO 0.59 0.23 -0.87 1.96 -2.27 0.00 0.00 179.45 179.09 2gsb h GLN 26 N 0.00 0.41 -0.99 1.90 1.08 -2.02 -3.31 115.11 112.18 2gsb h GLN 26 Ca -0.00 -0.58 0.01 0.00 -1.45 0.00 0.00 58.65 56.63 2gsb h GLN 26 Cb 0.43 0.20 -0.05 0.00 -0.05 0.00 0.00 27.48 28.00 2gsb h GLN 26 CO 0.03 1.24 0.65 0.93 -0.95 0.00 0.00 178.83 180.73 2gsb h GLU 27 N -0.14 1.31 -0.73 1.46 3.07 -1.90 -1.90 114.58 115.74 2gsb h GLU 27 Ca -0.14 -0.08 0.13 0.00 -0.50 0.00 0.00 59.36 58.77 2gsb h GLU 27 Cb 1.63 -0.29 -0.05 0.00 -0.84 0.00 0.00 28.75 29.20 2gsb h GLU 27 CO 0.17 0.87 0.49 0.00 -1.40 0.00 0.00 179.01 179.14 2gsb h ALA 28 N 1.36 2.04 0.27 3.43 0.00 -1.48 0.19 119.26 125.07 2gsb h ALA 28 Ca 0.36 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 2gsb h ALA 28 Cb -0.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2gsb h ALA 28 CO -0.08 -0.23 -0.13 1.88 0.00 0.00 0.00 179.25 180.70 2gsb h TYR 29 N 0.46 -0.33 -0.50 0.00 0.05 -1.43 -2.44 116.97 112.79 2gsb h TYR 29 Ca 0.35 -0.01 -0.09 0.00 0.05 0.00 0.00 58.73 59.04 2gsb h TYR 29 Cb 0.74 0.11 -0.02 0.00 1.01 0.00 0.00 36.73 38.57 2gsb h TYR 29 CO -0.00 -0.09 -0.04 -0.91 -1.05 0.00 0.00 178.16 176.06 2gsb h ASN 30 N -0.53 0.90 -0.05 3.88 4.21 -1.37 -2.86 115.58 119.76 2gsb h ASN 30 Ca -0.04 -0.33 0.03 0.00 1.21 0.00 0.00 56.30 57.18 2gsb h ASN 30 Cb 0.39 -0.24 -0.06 0.00 -1.12 0.00 0.00 38.32 37.29 2gsb h ASN 30 CO 0.06 1.01 -0.49 -0.07 -1.29 0.00 0.00 177.43 176.66 2gsb h LEU 31 N 0.77 -1.52 -0.63 1.61 3.38 -0.61 1.85 115.31 120.16 2gsb h LEU 31 Ca 0.14 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2gsb h LEU 31 Cb 0.58 0.59 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2gsb h LEU 31 CO 0.03 -0.48 0.00 0.18 0.09 0.00 0.00 178.44 178.26 2gsb n LEU 32 N -5.45 0.32 -0.00 1.67 4.77 -0.92 0.44 117.00 117.82 2gsb n LEU 32 Ca -0.06 0.62 0.08 0.00 -0.03 0.00 0.00 56.01 56.62 2gsb n LEU 32 Cb 0.38 -0.63 -0.09 0.00 -2.33 0.00 0.00 43.42 40.75 2gsb n LEU 32 CO 0.12 -0.63 -0.08 0.23 -1.33 0.00 0.00 177.39 175.71 2gsb n MET 33 N -1.90 1.58 0.01 3.23 2.81 0.12 -3.91 117.12 119.05 2gsb n MET 33 Ca 0.00 -0.01 -0.02 0.00 -1.81 0.00 0.00 57.70 55.87 2gsb n MET 33 Cb 0.08 -1.27 -0.01 0.00 -0.71 0.00 0.00 33.22 31.32 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 -1.42 0.84 0.11 2.03 -2.24 0.59 -4.80 114.28 109.38 2gsb n THR 34 Ca 0.03 0.26 0.05 0.00 -2.27 0.00 0.00 64.05 62.12 2gsb n THR 34 Cb 0.26 -1.56 0.01 0.00 -2.10 0.00 0.00 70.33 66.94 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 -0.18 0.43 -3.05 2.28 -1.51 -0.20 -3.46 116.25 110.56 2gsb h VAL 35 Ca 0.00 -1.69 -0.52 0.00 -1.23 0.00 0.00 66.70 63.25 2gsb h VAL 35 Cb 0.18 2.03 -0.01 0.00 -2.13 0.00 0.00 31.29 31.36 2gsb h VAL 35 CO 0.00 0.24 -0.21 -0.83 -1.23 0.00 0.00 177.57 175.54 2gsb s GLY 36 N -4.51 1.81 0.30 5.19 0.00 0.52 -4.90 107.32 105.72 2gsb s GLY 36 Ca 0.01 -0.68 0.01 0.00 0.00 0.00 0.00 44.72 44.07 2gsb s GLY 36 CO 0.76 -0.59 0.09 -1.06 0.00 0.00 0.00 173.10 172.30 2gsb n GLN 37 N -0.88 1.20 0.00 2.90 1.13 -1.26 -4.29 117.38 116.18 2gsb n GLN 37 Ca -0.03 -2.05 0.04 0.00 -1.94 0.00 0.00 57.00 53.02 2gsb n GLN 37 Cb 0.54 0.43 0.19 0.00 0.11 0.00 0.00 30.24 31.51 2gsb n GLN 37 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2gsb n VAL 38 N -0.91 0.85 -2.39 5.09 0.31 -1.26 -2.06 118.33 117.96 2gsb n VAL 38 Ca -0.08 0.21 -0.14 0.00 -0.01 0.00 0.00 64.34 64.32 2gsb n VAL 38 Cb 0.36 -1.09 0.03 0.00 -0.91 0.00 0.00 33.84 32.24 2gsb n VAL 38 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gsb s SER 40 N -3.66 1.14 0.34 0.00 0.15 -0.87 -3.05 113.70 107.75 2gsb s SER 40 Ca 0.40 -0.61 -0.02 0.00 0.70 0.00 0.00 55.95 56.43 2gsb s SER 40 Cb 0.38 0.01 0.01 0.00 -1.71 0.00 0.00 66.02 64.71 2gsb s SER 40 CO -0.00 -0.18 0.47 2.22 1.20 0.00 0.00 173.24 176.95 2gsb n PHE 41 N 1.28 -1.41 -3.82 3.44 -1.74 -1.24 -2.92 117.46 111.05 2gsb n PHE 41 Ca -0.21 -2.29 -0.06 0.00 -0.56 0.00 0.00 57.45 54.33 2gsb n PHE 41 Cb 0.55 0.53 -0.01 0.00 1.52 0.00 0.00 39.48 42.07 2gsb n PHE 41 CO 0.00 0.00 0.00 -0.48 -0.56 0.00 0.00 176.76 175.72 2gsb s LEU 42 N 0.00 -0.19 -0.02 5.98 0.05 -1.03 -0.88 118.68 122.58 2gsb s LEU 42 Ca 0.28 -0.60 0.04 0.00 0.05 0.00 0.00 54.13 53.91 2gsb s LEU 42 Cb -0.01 2.52 -0.01 0.00 -2.05 0.00 0.00 46.19 46.64 2gsb s LEU 42 CO 0.20 -1.21 -0.14 -0.69 -0.55 0.00 0.00 176.35 173.96 2gsb s VAL 43 N -3.46 1.14 0.00 1.48 1.01 -0.23 -2.60 120.40 117.74 2gsb s VAL 43 Ca 0.12 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.46 2gsb s VAL 43 Cb -0.04 -0.96 -0.00 0.00 0.00 0.00 0.00 36.38 35.38 2gsb s VAL 43 CO 0.06 0.33 0.08 -0.13 0.00 0.00 0.00 175.10 175.43 2gsb s ARG 44 N -0.23 0.38 -0.06 2.72 0.52 -1.03 -0.94 118.95 120.31 2gsb s ARG 44 Ca 0.03 -0.39 -0.30 0.00 -0.52 0.00 0.00 55.73 54.55 2gsb s ARG 44 Cb -0.07 0.15 -0.05 0.00 0.52 0.00 0.00 34.95 35.51 2gsb s ARG 44 CO -0.00 -0.08 1.50 -1.25 0.02 0.00 0.00 175.30 175.49 2gsb s PRO 45 N -1.22 4.22 0.67 3.54 0.04 -1.26 -1.69 135.00 139.30 2gsb s PRO 45 Ca -0.13 2.02 -0.15 0.00 0.04 0.00 0.00 61.00 62.77 2gsb s PRO 45 Cb -0.07 -3.81 0.01 0.00 0.04 0.00 0.00 34.50 30.66 2gsb s PRO 45 CO 0.01 -0.74 1.13 0.45 0.04 0.00 0.00 177.00 177.89 2gsb s SER 46 N 2.61 4.91 -0.09 6.66 0.15 0.16 -4.91 113.70 123.19 2gsb s SER 46 Ca 0.67 2.08 0.00 0.00 0.70 0.00 0.00 55.95 59.40 2gsb s SER 46 Cb -0.30 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.39 2gsb s SER 46 CO 0.25 -1.76 -0.08 -0.67 1.20 0.00 0.00 173.24 172.18 2gsb n ASP 47 N -2.46 3.05 -0.25 5.45 -0.08 -1.26 -4.45 116.55 116.55 2gsb n ASP 47 Ca 0.11 -0.03 0.04 0.00 -1.51 0.00 0.00 54.79 53.40 2gsb n ASP 47 Cb 0.52 -0.15 0.14 0.00 2.34 0.00 0.00 41.12 43.96 2gsb n ASP 47 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2gsb h ASN 48 N -0.03 -0.37 -3.19 1.67 7.08 -1.97 -3.39 115.58 115.37 2gsb h ASN 48 Ca -0.20 0.19 -0.67 0.00 -3.08 0.00 0.00 56.30 52.55 2gsb h ASN 48 Cb 1.29 0.34 -0.14 0.00 -2.08 0.00 0.00 38.32 37.73 2gsb h ASN 48 CO -0.04 -0.17 -0.59 -0.89 -2.08 0.00 0.00 177.43 173.65 2gsb s THR 49 N -6.13 4.57 -0.92 6.14 2.01 -1.26 -5.03 115.64 115.01 2gsb s THR 49 Ca -0.14 -0.14 -0.24 0.00 0.31 0.00 0.00 61.69 61.48 2gsb s THR 49 Cb 0.22 -2.96 -0.05 0.00 0.01 0.00 0.00 72.50 69.72 2gsb s THR 49 CO 0.75 0.58 1.94 -2.16 -0.69 0.00 0.00 174.62 175.05 2gsb s PRO 50 N -0.66 2.56 0.00 4.92 0.04 -1.26 -3.37 135.00 137.22 2gsb s PRO 50 Ca 0.11 -0.33 0.00 0.00 0.04 0.00 0.00 61.00 60.82 2gsb s PRO 50 Cb -0.12 -5.07 0.00 0.00 0.04 0.00 0.00 34.50 29.35 2gsb s PRO 50 CO 0.02 -3.40 0.00 0.41 0.04 0.00 0.00 177.00 174.07 2gsb n GLY 51 N 6.81 0.81 3.24 0.56 0.00 -1.26 -5.11 105.19 110.23 2gsb n GLY 51 Ca 0.40 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 2gsb n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gsb s ASP 52 N -1.83 1.06 0.21 1.61 1.11 -1.22 -4.49 116.67 113.12 2gsb s ASP 52 Ca 0.00 -1.21 0.06 0.00 0.18 0.00 0.00 52.55 51.57 2gsb s ASP 52 Cb 0.00 0.15 -0.05 0.00 1.07 0.00 0.00 42.92 44.10 2gsb s ASP 52 CO 0.00 -0.62 -0.09 -0.31 1.18 0.00 0.00 175.17 175.33 2gsb s TYR 53 N -3.74 1.59 0.03 4.23 2.02 -1.02 0.36 117.35 120.82 2gsb s TYR 53 Ca 0.26 -0.73 -0.01 0.00 -0.37 0.00 0.00 57.07 56.23 2gsb s TYR 53 Cb 0.07 -0.83 -0.02 0.00 -0.40 0.00 0.00 41.96 40.77 2gsb s TYR 53 CO 0.05 0.18 -0.01 0.45 -1.57 0.00 0.00 175.55 174.65 2gsb s SER 54 N -3.29 0.28 0.00 2.29 0.15 -0.68 -0.79 113.70 111.66 2gsb s SER 54 Ca 0.23 -0.60 0.08 0.00 0.70 0.00 0.00 55.95 56.36 2gsb s SER 54 Cb 0.02 0.14 -0.02 0.00 -1.71 0.00 0.00 66.02 64.45 2gsb s SER 54 CO 0.06 -0.38 -0.24 -0.22 1.20 0.00 0.00 173.24 173.66 2gsb s LEU 55 N -1.83 2.08 -0.15 3.45 2.96 -1.22 -2.47 118.68 121.50 2gsb s LEU 55 Ca -0.10 -0.48 0.00 0.00 -0.22 0.00 0.00 54.13 53.34 2gsb s LEU 55 Cb -0.05 -1.22 0.03 0.00 0.50 0.00 0.00 46.19 45.44 2gsb s LEU 55 CO -0.03 0.27 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.85 2gsb s TYR 56 N -0.64 2.03 0.10 5.38 1.51 -1.07 -1.85 117.35 122.82 2gsb s TYR 56 Ca 0.10 -1.17 0.09 0.00 -1.01 0.00 0.00 57.07 55.07 2gsb s TYR 56 Cb -0.09 -1.51 -0.03 0.00 -0.11 0.00 0.00 41.96 40.21 2gsb s TYR 56 CO -0.00 -0.65 -0.23 0.12 -1.11 0.00 0.00 175.55 173.69 2gsb s PHE 57 N 1.53 1.94 -0.22 2.71 5.36 -1.24 -2.47 117.98 125.58 2gsb s PHE 57 Ca 0.04 -0.40 -0.06 0.00 -0.96 0.00 0.00 56.93 55.54 2gsb s PHE 57 Cb -0.13 -1.07 -0.03 0.00 -0.34 0.00 0.00 43.02 41.45 2gsb s PHE 57 CO -0.10 0.22 0.03 0.50 -1.46 0.00 0.00 175.22 174.42 2gsb s ARG 58 N -1.83 3.62 0.54 10.12 6.06 -1.15 -1.04 118.95 135.27 2gsb s ARG 58 Ca 0.09 -0.50 0.02 0.00 -2.50 0.00 0.00 55.73 52.83 2gsb s ARG 58 Cb -0.10 -3.19 0.01 0.00 0.06 0.00 0.00 34.95 31.73 2gsb s ARG 58 CO 0.04 -0.09 0.11 0.95 -2.50 0.00 0.00 175.30 173.82 2gsb s THR 59 N 1.31 1.17 0.33 4.11 -4.23 -1.26 -3.96 115.64 113.11 2gsb s THR 59 Ca 0.04 -1.86 0.19 0.00 -1.18 0.00 0.00 61.69 58.88 2gsb s THR 59 Cb -0.15 -2.04 0.17 0.00 1.34 0.00 0.00 72.50 71.83 2gsb s THR 59 CO 0.02 0.00 1.88 0.78 -0.54 0.00 0.00 174.62 176.76 2gsb h ASN 60 N 1.13 0.00 0.00 3.99 2.35 -1.99 -3.33 115.58 117.72 2gsb h ASN 60 Ca -0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 2gsb h ASN 60 Cb 1.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.69 2gsb h ASN 60 CO 0.69 0.29 -0.02 -0.08 -1.65 0.00 0.00 177.43 176.65 2gsb h GLU 61 N 0.00 0.00 -1.62 0.81 4.81 -2.01 -3.50 114.58 113.07 2gsb h GLU 61 Ca -0.00 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 2gsb h GLU 61 Cb 0.61 0.00 -0.22 0.00 0.63 0.00 0.00 28.75 29.77 2gsb h GLU 61 CO 0.04 0.00 0.54 0.54 -0.73 0.00 0.00 179.01 179.39 2gsb s ASN 62 N -3.52 -0.38 -0.01 1.04 2.20 -1.25 -5.13 114.94 107.89 2gsb s ASN 62 Ca -0.01 0.38 -0.36 0.00 -0.94 0.00 0.00 52.86 51.94 2gsb s ASN 62 Cb 0.00 0.31 -0.14 0.00 -2.00 0.00 0.00 41.25 39.42 2gsb s ASN 62 CO 0.01 -0.37 1.63 -0.38 -2.94 0.00 0.00 177.10 175.06 2gsb n ILE 63 N 0.67 0.22 -2.54 0.54 5.41 -1.26 -4.15 119.36 118.24 2gsb n ILE 63 Ca -0.10 -0.04 -0.16 0.00 1.00 0.00 0.00 62.75 63.44 2gsb n ILE 63 Cb 0.58 -1.38 0.08 0.00 -0.71 0.00 0.00 39.64 38.21 2gsb n ILE 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2gsb n GLN 64 N 4.46 0.13 -3.63 0.38 6.02 -0.20 -4.96 117.38 119.58 2gsb n GLN 64 Ca 0.21 -1.98 -0.04 0.00 -0.01 0.00 0.00 57.00 55.18 2gsb n GLN 64 Cb 0.23 -0.46 -0.06 0.00 1.02 0.00 0.00 30.24 30.97 2gsb n GLN 64 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2gsb s ARG 65 N -4.31 0.47 0.44 -1.09 3.52 -1.26 -3.73 118.95 112.99 2gsb s ARG 65 Ca 0.47 1.26 0.08 0.00 -0.13 0.00 0.00 55.73 57.42 2gsb s ARG 65 Cb -0.03 0.63 0.02 0.00 -1.56 0.00 0.00 34.95 34.01 2gsb s ARG 65 CO 0.31 -0.24 0.58 -0.06 -0.81 0.00 0.00 175.30 175.08 2gsb s PHE 66 N 2.78 2.58 -0.09 5.12 0.40 -0.77 -4.97 117.98 123.03 2gsb s PHE 66 Ca -0.03 -0.46 0.01 0.00 -0.60 0.00 0.00 56.93 55.85 2gsb s PHE 66 Cb -0.12 -2.33 0.02 0.00 0.51 0.00 0.00 43.02 41.10 2gsb s PHE 66 CO -0.17 -0.49 -0.12 -1.59 0.70 0.00 0.00 175.22 173.56 2gsb s LYS 67 N -4.37 1.83 -0.21 0.44 -2.85 -1.26 -3.46 119.74 109.87 2gsb s LYS 67 Ca 0.55 -0.42 -0.05 0.00 -1.00 0.00 0.00 55.97 55.05 2gsb s LYS 67 Cb -0.08 -1.63 -0.02 0.00 -2.06 0.00 0.00 37.83 34.04 2gsb s LYS 67 CO 0.33 -0.09 -0.01 0.42 0.10 0.00 0.00 175.35 176.10 2gsb s ILE 68 N 1.07 3.78 -0.09 3.79 1.01 0.03 -4.54 121.20 126.25 2gsb s ILE 68 Ca -0.06 -0.37 0.02 0.00 0.00 0.00 0.00 60.65 60.24 2gsb s ILE 68 Cb -0.15 -2.72 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 2gsb s ILE 68 CO -0.02 0.42 -0.16 0.00 0.00 0.00 0.00 174.94 175.18 2gsb s PRO 70 N -0.09 2.63 0.07 0.00 0.04 -1.26 0.06 135.00 136.46 2gsb s PRO 70 Ca -0.03 1.32 0.04 0.00 0.04 0.00 0.00 61.00 62.37 2gsb s PRO 70 Cb -0.14 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 2gsb s PRO 70 CO 0.04 -1.37 -0.11 0.95 0.04 0.00 0.00 177.00 176.55 2gsb s THR 71 N -2.52 0.90 -2.00 1.26 -4.23 -1.06 -4.79 115.64 103.20 2gsb s THR 71 Ca 0.65 -1.36 0.12 0.00 -1.18 0.00 0.00 61.69 59.93 2gsb s THR 71 Cb -0.19 -1.04 0.35 0.00 1.34 0.00 0.00 72.50 72.96 2gsb s THR 71 CO 0.46 -0.38 1.16 -0.81 -0.54 0.00 0.00 174.62 174.51 2gsb n PRO 72 N 1.08 0.49 -1.57 3.99 -0.04 -1.26 -3.14 135.00 134.54 2gsb n PRO 72 Ca -0.20 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.93 2gsb n PRO 72 Cb 0.55 -1.39 0.06 0.00 -0.04 0.00 0.00 33.50 32.68 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 -0.89 7.00 -4.40 3.54 3.02 -1.26 -4.90 115.26 117.36 2gsb n ASN 73 Ca 0.09 -3.78 -0.36 0.00 -0.03 0.00 0.00 54.58 50.50 2gsb n ASN 73 Cb 0.04 -0.83 -0.09 0.00 -0.61 0.00 0.00 39.78 38.29 2gsb n ASN 73 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2gsb n ASN 74 N -0.82 -0.43 -2.28 6.41 5.15 -1.19 -4.89 115.26 117.21 2gsb n ASN 74 Ca 0.57 -1.25 -0.11 0.00 -0.60 0.00 0.00 54.58 53.20 2gsb n ASN 74 Cb 0.69 -1.70 -0.04 0.00 -0.53 0.00 0.00 39.78 38.20 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 -4.35 0.26 -3.78 1.20 6.02 -1.25 -4.64 117.38 110.85 2gsb n GLN 75 Ca -0.12 -1.89 -0.19 0.00 -0.01 0.00 0.00 57.00 54.79 2gsb n GLN 75 Cb 0.59 1.59 -0.17 0.00 1.02 0.00 0.00 30.24 33.26 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 -2.94 0.22 -0.26 1.08 0.40 0.36 -2.57 117.98 114.27 2gsb s PHE 76 Ca 0.22 0.10 -0.21 0.00 -0.60 0.00 0.00 56.93 56.44 2gsb s PHE 76 Cb 0.01 -0.46 -0.02 0.00 0.51 0.00 0.00 43.02 43.06 2gsb s PHE 76 CO 0.16 -0.17 0.65 -1.64 0.70 0.00 0.00 175.22 174.92 2gsb s MET 77 N 1.59 4.11 -0.09 0.44 -1.94 0.11 -2.54 119.30 120.98 2gsb s MET 77 Ca -0.02 0.58 -0.08 0.00 -1.71 0.00 0.00 55.69 54.46 2gsb s MET 77 Cb -0.13 -3.65 -0.03 0.00 2.01 0.00 0.00 34.83 33.03 2gsb s MET 77 CO -0.03 -0.44 -0.15 -0.12 -0.01 0.00 0.00 175.02 174.28 2gsb n MET 78 N 5.76 0.27 0.00 2.03 1.56 -1.25 -0.27 117.12 125.21 2gsb n MET 78 Ca 0.00 0.24 0.00 0.00 -0.27 0.00 0.00 57.70 57.67 2gsb n MET 78 Cb 0.49 -1.11 0.00 0.00 2.15 0.00 0.00 33.22 34.75 2gsb n MET 78 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2gsb n GLY 79 N 1.56 0.00 2.49 -5.12 0.00 -1.26 -4.44 105.19 98.43 2gsb n GLY 79 Ca -0.06 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.94 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 2.86 1.41 3.73 -0.02 0.00 -1.26 -5.15 105.19 106.76 2gsb n GLY 80 Ca 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 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 0.11 1.96 -0.38 1.61 1.81 -1.26 -5.13 118.95 117.68 2gsb s ARG 81 Ca 0.09 -1.36 0.03 0.00 -1.72 0.00 0.00 55.73 52.77 2gsb s ARG 81 Cb 0.36 0.57 0.11 0.00 -0.45 0.00 0.00 34.95 35.54 2gsb s ARG 81 CO -0.10 -0.88 0.12 0.71 -0.68 0.00 0.00 175.30 174.47 2gsb s TYR 82 N -3.10 2.98 -0.05 -0.53 2.02 -1.26 -3.92 117.35 113.49 2gsb s TYR 82 Ca 0.18 -2.68 -0.17 0.00 -0.37 0.00 0.00 57.07 54.02 2gsb s TYR 82 Cb -0.04 -2.51 -0.05 0.00 -0.40 0.00 0.00 41.96 38.96 2gsb s TYR 82 CO 0.12 -0.87 0.48 0.71 -1.57 0.00 0.00 175.55 174.41 2gsb s TYR 83 N 0.77 3.63 0.34 2.71 1.51 -1.05 -4.81 117.35 120.45 2gsb s TYR 83 Ca 0.13 1.00 0.14 0.00 -1.01 0.00 0.00 57.07 57.33 2gsb s TYR 83 Cb -0.21 -2.47 1.09 0.00 -0.11 0.00 0.00 41.96 40.27 2gsb s TYR 83 CO -0.09 0.38 1.66 -0.97 -1.11 0.00 0.00 175.55 175.42 2gsb h ASN 84 N 5.73 0.48 -5.13 2.29 -1.24 -1.89 0.10 115.58 115.92 2gsb h ASN 84 Ca -0.46 0.20 0.13 0.00 0.71 0.00 0.00 56.30 56.88 2gsb h ASN 84 Cb 1.20 0.15 -0.08 0.00 0.73 0.00 0.00 38.32 40.32 2gsb h ASN 84 CO 0.69 -0.16 0.39 -0.94 -1.29 0.00 0.00 177.43 176.12 2gsb s SER 85 N -4.88 -0.25 0.22 1.15 1.04 -1.26 -4.27 113.70 105.45 2gsb s SER 85 Ca -0.10 -0.39 -0.07 0.00 0.48 0.00 0.00 55.95 55.87 2gsb s SER 85 Cb 0.30 0.55 0.33 0.00 0.10 0.00 0.00 66.02 67.30 2gsb s SER 85 CO 0.79 -1.00 1.78 0.40 0.98 0.00 0.00 173.24 176.19 2gsb h ILE 86 N 2.00 0.86 -1.07 -1.02 2.04 -1.94 -1.34 117.51 117.04 2gsb h ILE 86 Ca -0.23 -0.21 0.29 0.00 1.00 0.00 0.00 64.86 65.71 2gsb h ILE 86 Cb 1.24 0.19 -0.10 0.00 -0.74 0.00 0.00 36.82 37.41 2gsb h ILE 86 CO 0.26 0.11 0.68 1.23 0.00 0.00 0.00 178.15 180.44 2gsb h GLY 87 N 0.62 1.32 1.21 5.37 0.00 -1.98 0.24 103.07 109.85 2gsb h GLY 87 Ca 0.35 -0.20 -0.19 0.00 0.00 0.00 0.00 47.33 47.28 2gsb h GLY 87 CO -0.26 -0.20 -0.61 -0.55 0.00 0.00 0.00 176.54 174.93 2gsb h ASP 88 N 0.37 0.92 -0.74 0.19 5.19 -1.65 -3.07 116.42 117.62 2gsb h ASP 88 Ca 0.63 -0.52 0.18 0.00 -0.62 0.00 0.00 57.03 56.70 2gsb h ASP 88 Cb 1.63 -0.27 -0.04 0.00 0.18 0.00 0.00 39.33 40.83 2gsb h ASP 88 CO -0.34 1.31 0.51 0.40 -3.12 0.00 0.00 179.24 178.00 2gsb h ILE 89 N 0.61 0.71 0.01 0.35 2.04 -0.40 0.14 117.51 120.96 2gsb h ILE 89 Ca -0.00 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 2gsb h ILE 89 Cb 1.22 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 2gsb h ILE 89 CO 0.13 0.04 -0.00 0.40 0.00 0.00 0.00 178.15 178.71 2gsb h ILE 90 N 0.21 0.00 -0.42 -0.67 5.03 -1.41 -1.59 117.51 118.67 2gsb h ILE 90 Ca 0.36 -0.01 0.12 0.00 -0.12 0.00 0.00 64.86 65.21 2gsb h ILE 90 Cb 1.12 0.00 -0.02 0.00 -3.03 0.00 0.00 36.82 34.90 2gsb h ILE 90 CO -0.07 0.00 0.53 0.44 -0.68 0.00 0.00 178.15 178.37 2gsb h ASP 91 N -0.03 0.00 0.12 1.72 3.32 -1.52 0.27 116.42 120.30 2gsb h ASP 91 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2gsb h ASP 91 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2gsb h ASP 91 CO 0.00 0.00 -0.06 -0.74 -1.72 0.00 0.00 179.24 176.73 2gsb h HIS 92 N 0.00 -0.14 -0.15 4.55 2.76 -0.77 -3.32 115.15 118.08 2gsb h HIS 92 Ca 0.20 -0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.29 2gsb h HIS 92 Cb 1.26 0.05 -0.01 0.00 1.55 0.00 0.00 27.41 30.25 2gsb h HIS 92 CO 0.00 0.31 -0.25 1.88 -1.30 0.00 0.00 177.93 178.58 2gsb h TYR 93 N -0.91 0.29 -1.40 5.26 0.05 -0.15 -2.95 116.97 117.16 2gsb h TYR 93 Ca -0.02 -0.05 0.48 0.00 0.05 0.00 0.00 58.73 59.19 2gsb h TYR 93 Cb 0.52 -0.08 -0.14 0.00 1.01 0.00 0.00 36.73 38.05 2gsb h TYR 93 CO 0.10 0.50 0.91 0.54 -1.05 0.00 0.00 178.16 179.16 2gsb n ARG 94 N -4.16 -0.03 -0.09 4.88 1.74 0.81 0.85 116.66 120.66 2gsb n ARG 94 Ca -0.01 1.24 -0.09 0.00 -0.77 0.00 0.00 57.85 58.21 2gsb n ARG 94 Cb 0.36 -2.46 -0.16 0.00 -1.02 0.00 0.00 32.46 29.19 2gsb n ARG 94 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 2gsb n LYS 95 N -4.66 0.68 -3.69 5.56 2.85 -1.13 -4.68 118.16 113.10 2gsb n LYS 95 Ca 0.40 0.02 -0.37 0.00 -1.05 0.00 0.00 58.31 57.31 2gsb n LYS 95 Cb 1.58 -1.55 -0.11 0.00 -0.65 0.00 0.00 35.03 34.30 2gsb n LYS 95 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2gsb s GLU 96 N -2.52 3.88 -0.14 -1.58 0.41 0.25 -5.04 118.70 113.95 2gsb s GLU 96 Ca -0.09 -0.36 -0.33 0.00 -0.41 0.00 0.00 54.97 53.77 2gsb s GLU 96 Cb 0.06 -3.50 -0.10 0.00 -1.78 0.00 0.00 34.13 28.81 2gsb s GLU 96 CO 0.83 -0.11 2.00 0.00 -0.49 0.00 0.00 175.26 177.49 2gsb n GLN 97 N 4.78 2.03 0.23 1.61 10.64 -1.26 -4.45 117.38 130.98 2gsb n GLN 97 Ca -0.15 0.70 0.15 0.00 -1.83 0.00 0.00 57.00 55.87 2gsb n GLN 97 Cb 0.52 -2.75 0.55 0.00 -0.86 0.00 0.00 30.24 27.70 2gsb n GLN 97 CO 0.00 0.00 0.00 0.97 -1.83 0.00 0.00 177.06 176.20 2gsb h ILE 98 N 6.03 0.00 -0.87 -0.39 2.10 -1.68 -3.45 117.51 119.25 2gsb h ILE 98 Ca -0.44 -0.54 -0.65 0.00 1.08 0.00 0.00 64.86 64.30 2gsb h ILE 98 Cb 1.27 1.50 -0.13 0.00 -1.09 0.00 0.00 36.82 38.37 2gsb h ILE 98 CO 0.96 0.00 -0.53 -0.69 -1.08 0.00 0.00 178.15 176.81 2gsb s VAL 99 N -3.50 1.27 -0.22 2.19 1.01 -1.07 -4.99 120.40 115.09 2gsb s VAL 99 Ca 0.03 -2.00 0.14 0.00 0.00 0.00 0.00 61.98 60.16 2gsb s VAL 99 Cb 0.09 -2.35 0.14 0.00 0.00 0.00 0.00 36.38 34.26 2gsb s VAL 99 CO 0.54 0.00 1.39 -1.84 0.00 0.00 0.00 175.10 175.19 2gsb n GLU 100 N -1.16 0.10 -2.65 2.72 0.28 -1.26 -3.70 120.64 114.96 2gsb n GLU 100 Ca -0.15 0.57 -0.03 0.00 -0.16 0.00 0.00 57.16 57.39 2gsb n GLU 100 Cb 0.67 -1.95 -0.02 0.00 1.43 0.00 0.00 31.44 31.57 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 -1.31 -1.17 3.42 -1.84 0.00 -1.26 -5.14 105.19 97.89 2gsb n GLY 101 Ca -0.01 0.11 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 -0.77 0.39 1.61 1.51 -1.24 -5.10 117.35 113.74 2gsb s TYR 102 Ca 0.02 1.61 0.08 0.00 -1.01 0.00 0.00 57.07 57.77 2gsb s TYR 102 Cb 0.03 0.39 -0.02 0.00 -0.11 0.00 0.00 41.96 42.25 2gsb s TYR 102 CO -0.03 -0.40 0.34 0.71 -1.11 0.00 0.00 175.55 175.06 2gsb s TYR 103 N 1.34 2.78 -0.73 2.71 1.51 -1.26 -2.12 117.35 121.58 2gsb s TYR 103 Ca -0.08 -0.42 -0.20 0.00 -1.01 0.00 0.00 57.07 55.36 2gsb s TYR 103 Cb -0.07 -2.02 0.11 0.00 -0.11 0.00 0.00 41.96 39.88 2gsb s TYR 103 CO -0.14 0.01 0.91 -0.51 -1.11 0.00 0.00 175.55 174.71 2gsb s LEU 104 N -4.07 5.10 0.00 -1.29 1.43 -1.26 -4.86 118.68 113.73 2gsb s LEU 104 Ca 0.45 -1.58 -0.12 0.00 -1.03 0.00 0.00 54.13 51.85 2gsb s LEU 104 Cb -0.04 -2.36 -0.07 0.00 0.03 0.00 0.00 46.19 43.76 2gsb s LEU 104 CO 0.27 -1.16 0.81 0.11 0.23 0.00 0.00 176.35 176.61 2gsb h LYS 105 N 9.09 -0.41 -2.30 1.70 1.57 -1.94 -3.43 116.57 120.85 2gsb h LYS 105 Ca -0.13 0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 2gsb h LYS 105 Cb 1.06 0.09 -0.21 0.00 0.08 0.00 0.00 32.23 33.25 2gsb h LYS 105 CO 1.10 -0.28 0.01 -1.83 -0.57 0.00 0.00 179.45 177.89 2gsb s GLU 106 N -3.30 0.80 1.14 3.15 -1.05 -1.17 -5.09 118.70 113.18 2gsb s GLU 106 Ca -0.06 0.55 -0.17 0.00 -0.15 0.00 0.00 54.97 55.14 2gsb s GLU 106 Cb 0.01 0.38 0.26 0.00 -0.44 0.00 0.00 34.13 34.33 2gsb s GLU 106 CO 0.19 -0.16 1.10 -1.25 0.95 0.00 0.00 175.26 176.09 2gsb s PRO 107 N -0.30 -0.71 -0.14 -4.83 0.04 -1.26 -3.60 135.00 124.21 2gsb s PRO 107 Ca -0.05 0.12 -0.22 0.00 0.04 0.00 0.00 61.00 60.90 2gsb s PRO 107 Cb -0.03 -1.64 -0.03 0.00 0.04 0.00 0.00 34.50 32.84 2gsb s PRO 107 CO 0.04 -3.41 0.65 0.08 0.04 0.00 0.00 177.00 174.39 2gsb s VAL 108 N -2.99 5.04 1.09 -0.36 1.01 -0.06 -4.73 120.40 119.40 2gsb s VAL 108 Ca 0.69 1.27 -0.15 0.00 0.00 0.00 0.00 61.98 63.79 2gsb s VAL 108 Cb -0.13 -3.97 0.24 0.00 0.00 0.00 0.00 36.38 32.52 2gsb s VAL 108 CO 0.57 0.19 1.10 -2.16 0.00 0.00 0.00 175.10 174.79 2gsb s PRO 109 N 1.35 -0.34 0.40 2.72 0.04 -1.26 -4.38 135.00 133.52 2gsb s PRO 109 Ca 0.32 0.24 -0.02 0.00 0.04 0.00 0.00 61.00 61.58 2gsb s PRO 109 Cb -0.16 -1.67 0.08 0.00 0.04 0.00 0.00 34.50 32.79 2gsb s PRO 109 CO 0.13 -3.19 0.55 -1.33 0.04 0.00 0.00 177.00 173.20 2gsb n MET 110 N -4.45 0.04 -3.03 4.56 2.81 -1.26 -5.03 117.12 110.75 2gsb n MET 110 Ca 0.08 -1.30 -0.32 0.00 -1.81 0.00 0.00 57.70 54.35 2gsb n MET 110 Cb 0.58 -0.42 -0.03 0.00 -0.71 0.00 0.00 33.22 32.64 2gsb n MET 110 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2gsb n GLN 111 N -2.05 3.69 -2.28 0.03 3.00 -1.26 -5.06 117.38 113.44 2gsb n GLN 111 Ca 0.08 -4.72 -0.35 0.00 -0.01 0.00 0.00 57.00 52.00 2gsb n GLN 111 Cb 0.30 -2.34 -0.00 0.00 0.00 0.00 0.00 30.24 28.20 2gsb n GLN 111 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2gsb s ASP 112 N -2.50 5.81 -0.57 1.08 2.15 -1.26 -4.92 116.67 116.47 2gsb s ASP 112 Ca 0.41 2.11 -0.27 0.00 0.43 0.00 0.00 52.55 55.24 2gsb s ASP 112 Cb 0.19 -2.57 -0.02 0.00 -0.30 0.00 0.00 42.92 40.21 2gsb s ASP 112 CO -0.06 -1.16 1.86 -1.58 -0.17 0.00 0.00 175.17 174.07 2gsb s GLN 113 N -3.34 2.72 0.45 4.34 2.00 -1.26 -4.97 119.66 119.60 2gsb s GLN 113 Ca 0.71 0.76 -0.17 0.00 -2.00 0.00 0.00 55.36 54.65 2gsb s GLN 113 Cb -0.22 -4.36 -0.09 0.00 0.80 0.00 0.00 33.01 29.14 2gsb s GLN 113 CO 0.27 -2.61 0.92 -1.12 -0.50 0.00 0.00 175.29 172.24 2gsb s SER 114 N 7.91 6.76 0.36 6.67 0.01 -1.26 -4.88 113.70 129.27 2gsb s SER 114 Ca 0.70 1.54 0.00 0.00 1.31 0.00 0.00 55.95 59.49 2gsb s SER 114 Cb -0.14 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.60 2gsb s SER 114 CO 0.23 -0.43 0.00 0.61 0.41 0.00 0.00 173.24 174.06 2gsb n GLY 115 N -1.02 -3.90 0.00 3.44 0.00 -1.26 -5.00 105.19 97.44 2gsb n GLY 115 Ca 0.06 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.16 2gsb n GLY 115 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2gsb n PRO 116 N -1.44 -0.20 -3.89 1.61 -0.04 -1.26 -5.01 135.00 124.77 2gsb n PRO 116 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 2gsb n PRO 116 Cb 0.12 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.46 2gsb n PRO 116 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2gsb s SER 117 N -1.51 4.79 -0.23 3.54 1.04 -1.26 -5.03 113.70 115.04 2gsb s SER 117 Ca 0.00 -3.63 -0.09 0.00 0.48 0.00 0.00 55.95 52.71 2gsb s SER 117 Cb 0.00 -1.66 0.10 0.00 0.10 0.00 0.00 66.02 64.56 2gsb s SER 117 CO 0.00 -0.13 0.50 -0.44 0.98 0.00 0.00 173.24 174.15 2gsb s SER 118 N -1.06 -0.59 0.00 7.02 0.01 -1.26 -5.35 113.70 112.48 2gsb s SER 118 Ca 0.23 1.19 0.00 0.00 1.31 0.00 0.00 55.95 58.68 2gsb s SER 118 Cb -0.10 1.59 0.00 0.00 0.21 0.00 0.00 66.02 67.72 2gsb s SER 118 CO -0.12 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 173.91