#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 5.43 -0.29 1.61 0.01 -1.26 -5.03 113.70 114.18 2gsb s SER 2 Ca 0.00 -2.17 -0.12 0.00 1.31 0.00 0.00 55.95 54.97 2gsb s SER 2 Cb 0.00 -1.90 0.11 0.00 0.21 0.00 0.00 66.02 64.44 2gsb s SER 2 CO 0.00 -0.56 0.65 -0.94 0.41 0.00 0.00 173.24 172.80 2gsb s SER 3 N 1.89 -1.03 0.00 2.44 1.04 -1.26 -5.11 113.70 111.67 2gsb s SER 3 Ca 0.09 1.52 0.00 0.00 0.48 0.00 0.00 55.95 58.04 2gsb s SER 3 Cb -0.23 1.90 0.00 0.00 0.10 0.00 0.00 66.02 67.79 2gsb s SER 3 CO -0.03 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.57 2gsb n GLY 4 N 5.01 0.88 3.79 7.32 0.00 -1.26 -5.11 105.19 115.83 2gsb n GLY 4 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.79 2gsb n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gsb s SER 5 N -1.00 -0.31 0.11 1.61 1.04 -1.26 -5.06 113.70 108.84 2gsb s SER 5 Ca 0.00 -0.51 -0.15 0.00 0.48 0.00 0.00 55.95 55.77 2gsb s SER 5 Cb 0.00 0.71 -0.05 0.00 0.10 0.00 0.00 66.02 66.77 2gsb s SER 5 CO 0.00 -1.28 1.49 0.77 0.98 0.00 0.00 173.24 175.20 2gsb h SER 6 N 2.00 0.72 -2.98 7.02 4.64 -2.07 -3.42 113.55 119.46 2gsb h SER 6 Ca -0.21 -0.39 -0.57 0.00 -0.47 0.00 0.00 61.79 60.15 2gsb h SER 6 Cb 1.26 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 63.11 2gsb h SER 6 CO 0.25 0.95 0.99 -0.83 -0.87 0.00 0.00 176.83 177.33 2gsb s GLY 7 N -3.50 1.42 -0.23 -0.77 0.00 -1.26 -4.99 107.32 97.98 2gsb s GLY 7 Ca -0.13 0.30 -0.19 0.00 0.00 0.00 0.00 44.72 44.70 2gsb s GLY 7 CO 0.81 2.68 0.57 0.50 0.00 0.00 0.00 173.10 177.65 2gsb s ARG 8 N 4.12 4.13 0.28 2.90 3.00 -1.26 -5.07 118.95 127.06 2gsb s ARG 8 Ca 0.60 0.46 0.04 0.00 0.00 0.00 0.00 55.73 56.83 2gsb s ARG 8 Cb -0.20 -3.62 -0.03 0.00 0.00 0.00 0.00 34.95 31.10 2gsb s ARG 8 CO 0.23 -0.30 0.43 -1.83 0.00 0.00 0.00 175.30 173.83 2gsb s GLU 9 N 2.12 3.39 -0.06 3.54 1.03 -1.26 -5.02 118.70 122.44 2gsb s GLU 9 Ca 0.24 -0.70 -0.31 0.00 0.03 0.00 0.00 54.97 54.24 2gsb s GLU 9 Cb -0.16 -2.82 -0.09 0.00 -0.80 0.00 0.00 34.13 30.26 2gsb s GLU 9 CO 0.09 0.29 2.01 -0.85 -1.33 0.00 0.00 175.26 175.48 2gsb n GLU 10 N -1.55 2.45 -4.08 -4.83 0.28 -1.26 -4.97 120.64 106.68 2gsb n GLU 10 Ca -0.07 0.86 -0.28 0.00 -0.16 0.00 0.00 57.16 57.51 2gsb n GLU 10 Cb 0.57 -2.94 -0.06 0.00 1.43 0.00 0.00 31.44 30.43 2gsb n GLU 10 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2gsb s ASP 11 N 5.27 5.40 0.06 -1.84 1.01 -1.26 -5.04 116.67 120.27 2gsb s ASP 11 Ca 0.93 -0.11 -0.19 0.00 0.71 0.00 0.00 52.55 53.90 2gsb s ASP 11 Cb -0.50 -1.39 -0.13 0.00 1.01 0.00 0.00 42.92 41.91 2gsb s ASP 11 CO 0.43 0.13 1.37 1.55 0.21 0.00 0.00 175.17 178.86 2gsb h PRO 12 N 2.93 0.46 -0.98 8.23 0.13 -1.98 -2.68 132.00 138.11 2gsb h PRO 12 Ca -0.47 -0.24 0.19 0.00 -0.87 0.00 0.00 66.00 64.60 2gsb h PRO 12 Cb 1.18 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 2gsb h PRO 12 CO 0.63 0.81 0.61 1.25 -0.23 0.00 0.00 178.00 181.08 2gsb h HIS 13 N 0.13 0.95 0.00 1.56 2.76 -1.99 0.60 115.15 119.16 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 0.73 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.40 2gsb h HIS 13 CO 0.08 0.24 -0.16 -0.85 -1.30 0.00 0.00 177.93 175.93 2gsb n GLU 14 N -4.68 0.12 0.17 5.26 0.28 -1.20 -3.42 120.64 117.17 2gsb n GLU 14 Ca 0.22 0.08 0.11 0.00 -0.16 0.00 0.00 57.16 57.41 2gsb n GLU 14 Cb 0.59 -1.62 0.09 0.00 1.43 0.00 0.00 31.44 31.93 2gsb n GLU 14 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 2gsb h GLY 15 N 4.78 0.00 -5.21 -1.84 0.00 0.55 -3.47 103.07 97.88 2gsb h GLY 15 Ca 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.67 2gsb h GLY 15 CO 0.00 0.00 0.35 0.28 0.00 0.00 0.00 176.54 177.17 2gsb n LYS 16 N -2.94 1.16 0.23 4.80 4.76 -0.83 -4.84 118.16 120.50 2gsb n LYS 16 Ca 0.02 0.42 0.09 0.00 -2.87 0.00 0.00 58.31 55.97 2gsb n LYS 16 Cb 0.55 -1.97 0.55 0.00 -1.84 0.00 0.00 35.03 32.32 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 2.94 0.71 0.00 -0.18 2.10 -1.90 -2.33 117.51 118.85 2gsb h ILE 17 Ca -0.45 -0.92 0.00 0.00 1.08 0.00 0.00 64.86 64.57 2gsb h ILE 17 Cb 1.34 1.58 0.00 0.00 -1.09 0.00 0.00 36.82 38.65 2gsb h ILE 17 CO 0.73 0.21 -0.57 4.11 -1.08 0.00 0.00 178.15 181.56 2gsb h TRP 18 N 0.00 0.00 -3.90 2.19 5.08 -1.89 -3.36 115.95 114.07 2gsb h TRP 18 Ca -0.00 0.00 -0.46 0.00 1.08 0.00 0.00 58.89 59.50 2gsb h TRP 18 Cb 0.56 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.70 2gsb h TRP 18 CO 0.00 0.00 0.25 0.12 -1.28 0.00 0.00 178.44 177.53 2gsb s PHE 19 N -3.25 3.39 -0.02 0.12 5.36 -0.88 -1.77 117.98 120.93 2gsb s PHE 19 Ca 0.04 1.49 0.00 0.00 -0.96 0.00 0.00 56.93 57.50 2gsb s PHE 19 Cb 0.10 -2.74 0.03 0.00 -0.34 0.00 0.00 43.02 40.06 2gsb s PHE 19 CO 0.73 0.02 0.02 -1.01 -1.46 0.00 0.00 175.22 173.51 2gsb s HIS 20 N -2.01 0.15 0.00 10.12 3.76 -1.10 -4.86 115.29 121.34 2gsb s HIS 20 Ca 0.57 0.07 0.00 0.00 -0.15 0.00 0.00 55.06 55.55 2gsb s HIS 20 Cb -0.11 -0.29 0.00 0.00 1.11 0.00 0.00 32.58 33.29 2gsb s HIS 20 CO 0.16 -0.10 0.00 0.41 -0.85 0.00 0.00 174.74 174.36 2gsb n GLY 21 N 4.08 0.00 0.17 -2.22 0.00 -1.26 -4.63 105.19 101.33 2gsb n GLY 21 Ca -0.26 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 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 0.51 0.00 1.61 1.79 -1.98 -3.45 116.57 115.04 2gsb h LYS 22 Ca 0.00 -0.25 -0.20 0.00 -2.18 0.00 0.00 60.65 58.02 2gsb h LYS 22 Cb 0.18 -0.00 0.11 0.00 -1.58 0.00 0.00 32.23 30.94 2gsb h LYS 22 CO 0.00 0.82 -0.02 0.44 -1.08 0.00 0.00 179.45 179.60 2gsb n ILE 23 N -4.46 0.00 -4.57 1.86 -5.35 -1.26 -5.08 119.36 100.51 2gsb n ILE 23 Ca -0.05 -0.12 -0.26 0.00 -0.27 0.00 0.00 62.75 62.05 2gsb n ILE 23 Cb 0.38 -0.80 -0.10 0.00 -1.74 0.00 0.00 39.64 37.38 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 -2.81 3.32 0.08 7.28 0.15 -1.26 -5.02 113.70 115.44 2gsb s SER 24 Ca 0.36 -1.42 -0.29 0.00 0.70 0.00 0.00 55.95 55.31 2gsb s SER 24 Cb -0.05 -0.15 -0.16 0.00 -1.71 0.00 0.00 66.02 63.95 2gsb s SER 24 CO 0.29 -0.57 1.66 0.50 1.20 0.00 0.00 173.24 176.32 2gsb h LYS 25 N 1.85 -0.56 -0.30 5.44 3.64 -1.98 -1.08 116.57 123.58 2gsb h LYS 25 Ca -0.42 0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.05 2gsb h LYS 25 Cb 1.25 0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 33.14 2gsb h LYS 25 CO 0.75 -0.37 -0.08 1.96 -2.27 0.00 0.00 179.45 179.43 2gsb h GLN 26 N -0.58 -0.01 0.34 1.90 4.20 -2.02 -2.82 115.11 116.12 2gsb h GLN 26 Ca -0.04 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 2gsb h GLN 26 Cb 0.48 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.23 2gsb h GLN 26 CO 0.05 -0.01 -0.47 0.93 -0.67 0.00 0.00 178.83 178.66 2gsb h GLU 27 N -0.01 -0.82 -0.69 1.46 4.39 -1.94 -2.25 114.58 114.72 2gsb h GLU 27 Ca 0.14 0.06 0.21 0.00 0.34 0.00 0.00 59.36 60.11 2gsb h GLU 27 Cb 0.23 0.19 -0.13 0.00 -0.10 0.00 0.00 28.75 28.94 2gsb h GLU 27 CO -0.31 -0.55 0.08 0.00 -1.16 0.00 0.00 179.01 177.07 2gsb n ALA 28 N -2.82 0.41 0.09 3.43 0.00 -0.42 0.16 120.51 121.36 2gsb n ALA 28 Ca -0.10 0.73 -0.13 0.00 0.00 0.00 0.00 53.44 53.94 2gsb n ALA 28 Cb 0.42 -0.57 -0.07 0.00 0.00 0.00 0.00 19.45 19.24 2gsb n ALA 28 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2gsb h TYR 29 N 0.00 -0.18 -0.39 0.00 0.05 -1.34 -1.96 116.97 113.15 2gsb h TYR 29 Ca 0.45 -0.00 -0.04 0.00 0.05 0.00 0.00 58.73 59.18 2gsb h TYR 29 Cb 0.98 0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.77 2gsb h TYR 29 CO -0.29 -0.11 0.08 -0.97 -1.05 0.00 0.00 178.16 175.82 2gsb h ASN 30 N -0.16 0.61 0.02 3.88 -1.24 0.16 -3.05 115.58 115.80 2gsb h ASN 30 Ca -0.00 -0.25 0.01 0.00 0.71 0.00 0.00 56.30 56.77 2gsb h ASN 30 Cb 0.15 -0.16 -0.03 0.00 0.73 0.00 0.00 38.32 39.01 2gsb h ASN 30 CO -0.01 0.71 -0.26 -0.07 -1.29 0.00 0.00 177.43 176.51 2gsb h LEU 31 N 0.49 -0.79 -1.41 0.34 3.38 -0.39 0.35 115.31 117.28 2gsb h LEU 31 Ca 0.12 0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.19 2gsb h LEU 31 Cb 0.35 0.30 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 2gsb h LEU 31 CO 0.01 -0.26 0.54 -0.07 0.09 0.00 0.00 178.44 178.75 2gsb h LEU 32 N -0.34 0.00 0.00 1.67 3.38 -1.41 1.13 115.31 119.75 2gsb h LEU 32 Ca 0.00 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.71 2gsb h LEU 32 Cb 0.35 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 2gsb h LEU 32 CO -0.16 0.00 -1.57 0.24 0.09 0.00 0.00 178.44 177.03 2gsb h MET 33 N 0.00 0.00 0.00 1.13 2.86 -0.60 -3.29 114.93 115.03 2gsb h MET 33 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2gsb h MET 33 Cb 1.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.76 2gsb h MET 33 CO -0.00 0.50 0.00 0.25 1.06 0.00 0.00 176.91 178.72 2gsb n THR 34 N -3.05 0.00 -0.23 2.22 -2.24 0.35 -4.77 114.28 106.57 2gsb n THR 34 Ca -0.14 0.19 -0.07 0.00 -2.27 0.00 0.00 64.05 61.77 2gsb n THR 34 Cb 1.00 -1.14 0.04 0.00 -2.10 0.00 0.00 70.33 68.13 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 1.22 -3.91 2.28 -1.51 -0.68 -3.44 116.25 110.21 2gsb h VAL 35 Ca 0.00 -0.62 -0.49 0.00 -1.23 0.00 0.00 66.70 64.36 2gsb h VAL 35 Cb 0.00 0.45 0.06 0.00 -2.13 0.00 0.00 31.29 29.67 2gsb h VAL 35 CO 0.00 0.25 0.25 -0.83 -1.23 0.00 0.00 177.57 176.01 2gsb s GLY 36 N -3.08 1.60 0.44 5.19 0.00 -0.14 -4.96 107.32 106.37 2gsb s GLY 36 Ca -0.13 -0.52 0.03 0.00 0.00 0.00 0.00 44.72 44.10 2gsb s GLY 36 CO 0.79 -0.24 0.04 1.62 0.00 0.00 0.00 173.10 175.32 2gsb s GLN 37 N -5.06 2.00 0.39 2.90 2.00 -1.24 -4.24 119.66 116.40 2gsb s GLN 37 Ca 0.54 -2.21 0.17 0.00 -2.00 0.00 0.00 55.36 51.86 2gsb s GLN 37 Cb -0.11 -1.22 0.90 0.00 0.80 0.00 0.00 33.01 33.39 2gsb s GLN 37 CO 0.48 -0.30 1.43 0.28 -0.50 0.00 0.00 175.29 176.68 2gsb h VAL 38 N 1.67 0.00 -0.63 1.34 2.07 -1.85 0.28 116.25 119.12 2gsb h VAL 38 Ca -0.41 0.00 -0.45 0.00 0.82 0.00 0.00 66.70 66.65 2gsb h VAL 38 Cb 1.28 0.37 -0.33 0.00 -1.52 0.00 0.00 31.29 31.08 2gsb h VAL 38 CO 0.70 0.00 -0.58 0.00 0.02 0.00 0.00 177.57 177.71 2gsb s SER 40 N -3.33 1.50 0.37 0.00 0.01 0.97 -2.80 113.70 110.43 2gsb s SER 40 Ca 0.50 -0.24 0.04 0.00 1.31 0.00 0.00 55.95 57.56 2gsb s SER 40 Cb 0.41 -0.44 -0.03 0.00 0.21 0.00 0.00 66.02 66.17 2gsb s SER 40 CO 0.02 0.08 0.15 0.72 0.41 0.00 0.00 173.24 174.62 2gsb s PHE 41 N 0.22 1.75 -0.15 2.43 -0.71 -1.26 -3.20 117.98 117.07 2gsb s PHE 41 Ca -0.05 -1.32 -0.30 0.00 -1.04 0.00 0.00 56.93 54.22 2gsb s PHE 41 Cb -0.10 -1.05 0.12 0.00 -1.21 0.00 0.00 43.02 40.78 2gsb s PHE 41 CO 0.01 -0.39 0.96 -0.48 -1.34 0.00 0.00 175.22 173.98 2gsb s LEU 42 N -3.52 -0.41 -0.20 -1.99 0.05 -0.66 -1.51 118.68 110.44 2gsb s LEU 42 Ca 0.29 0.46 -0.08 0.00 0.05 0.00 0.00 54.13 54.85 2gsb s LEU 42 Cb 0.03 1.95 -0.04 0.00 -2.05 0.00 0.00 46.19 46.08 2gsb s LEU 42 CO 0.17 -0.37 0.08 -0.69 -0.55 0.00 0.00 176.35 174.99 2gsb s VAL 43 N -1.08 4.88 -0.00 1.48 1.01 -0.73 -1.89 120.40 124.07 2gsb s VAL 43 Ca -0.03 0.00 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2gsb s VAL 43 Cb -0.01 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 2gsb s VAL 43 CO 0.03 0.44 -0.07 -0.60 0.00 0.00 0.00 175.10 174.89 2gsb s ARG 44 N 0.53 0.58 0.41 2.72 3.52 -1.11 -2.72 118.95 122.87 2gsb s ARG 44 Ca 0.04 -0.26 -0.25 0.00 -0.13 0.00 0.00 55.73 55.13 2gsb s ARG 44 Cb -0.13 -0.55 -0.08 0.00 -1.56 0.00 0.00 34.95 32.63 2gsb s ARG 44 CO 0.01 0.15 1.18 -1.25 -0.81 0.00 0.00 175.30 174.58 2gsb s PRO 45 N -0.19 3.99 0.08 5.12 0.04 -1.26 -2.18 135.00 140.61 2gsb s PRO 45 Ca 0.03 1.87 -0.17 0.00 0.04 0.00 0.00 61.00 62.76 2gsb s PRO 45 Cb -0.03 -2.64 -0.07 0.00 0.04 0.00 0.00 34.50 31.80 2gsb s PRO 45 CO -0.00 -0.38 0.53 -1.12 0.04 0.00 0.00 177.00 176.07 2gsb s SER 46 N -1.12 6.96 0.64 6.66 0.01 -0.36 -4.85 113.70 121.63 2gsb s SER 46 Ca 0.58 1.16 -0.03 0.00 1.31 0.00 0.00 55.95 58.97 2gsb s SER 46 Cb -0.31 -2.32 0.05 0.00 0.21 0.00 0.00 66.02 63.65 2gsb s SER 46 CO 0.39 0.24 0.91 -1.81 0.41 0.00 0.00 173.24 173.38 2gsb s ASP 47 N -1.26 4.98 -1.41 2.44 1.01 -1.26 -4.29 116.67 116.89 2gsb s ASP 47 Ca 0.30 0.20 -0.11 0.00 0.71 0.00 0.00 52.55 53.65 2gsb s ASP 47 Cb -0.18 -0.94 0.11 0.00 1.01 0.00 0.00 42.92 42.92 2gsb s ASP 47 CO 0.18 -1.42 0.27 0.59 0.21 0.00 0.00 175.17 175.00 2gsb n ASN 48 N -2.66 -0.47 -3.80 0.27 3.02 -1.26 -4.88 115.26 105.48 2gsb n ASN 48 Ca 0.08 -1.02 -0.12 0.00 -0.03 0.00 0.00 54.58 53.49 2gsb n ASN 48 Cb 0.60 -1.29 -0.09 0.00 -0.61 0.00 0.00 39.78 38.39 2gsb n ASN 48 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2gsb s THR 49 N -3.41 0.06 -1.02 3.41 -4.23 -1.26 -5.09 115.64 104.11 2gsb s THR 49 Ca 0.37 -0.52 -0.24 0.00 -1.18 0.00 0.00 61.69 60.13 2gsb s THR 49 Cb -0.22 -0.53 -0.06 0.00 1.34 0.00 0.00 72.50 73.03 2gsb s THR 49 CO 0.82 -0.29 1.94 -2.16 -0.54 0.00 0.00 174.62 174.40 2gsb s PRO 50 N -1.24 2.53 -1.28 3.99 0.04 -1.26 -3.93 135.00 133.85 2gsb s PRO 50 Ca -0.13 -0.64 -0.10 0.00 0.04 0.00 0.00 61.00 60.17 2gsb s PRO 50 Cb -0.06 -5.13 0.08 0.00 0.04 0.00 0.00 34.50 29.42 2gsb s PRO 50 CO 0.03 -3.63 0.49 0.41 0.04 0.00 0.00 177.00 174.34 2gsb n GLY 51 N 6.43 -0.48 3.91 0.56 0.00 -1.26 -4.87 105.19 109.49 2gsb n GLY 51 Ca 0.42 0.09 -0.27 0.00 0.00 0.00 0.00 46.02 46.26 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 -2.73 5.60 0.30 1.61 2.15 -1.25 -4.70 116.67 117.64 2gsb s ASP 52 Ca 0.41 0.76 0.01 0.00 0.43 0.00 0.00 52.55 54.16 2gsb s ASP 52 Cb -0.22 -1.74 -0.02 0.00 -0.30 0.00 0.00 42.92 40.64 2gsb s ASP 52 CO 0.51 -1.08 0.32 -0.31 -0.17 0.00 0.00 175.17 174.43 2gsb s TYR 53 N -3.02 1.32 -0.23 -5.34 1.51 -1.15 -1.22 117.35 109.22 2gsb s TYR 53 Ca 0.54 -1.43 -0.21 0.00 -1.01 0.00 0.00 57.07 54.97 2gsb s TYR 53 Cb -0.11 -0.43 0.06 0.00 -0.11 0.00 0.00 41.96 41.37 2gsb s TYR 53 CO 0.46 -0.90 0.62 -1.12 -1.11 0.00 0.00 175.55 173.49 2gsb s SER 54 N -3.26 -0.67 0.07 2.29 0.01 -0.92 -2.68 113.70 108.54 2gsb s SER 54 Ca 0.36 1.26 -0.07 0.00 1.31 0.00 0.00 55.95 58.80 2gsb s SER 54 Cb 0.02 1.26 -0.05 0.00 0.21 0.00 0.00 66.02 67.46 2gsb s SER 54 CO 0.21 -0.22 0.35 -0.22 0.41 0.00 0.00 173.24 173.77 2gsb s LEU 55 N 0.48 4.34 -0.08 2.44 2.96 -1.16 -2.77 118.68 124.90 2gsb s LEU 55 Ca -0.01 0.66 0.03 0.00 -0.22 0.00 0.00 54.13 54.59 2gsb s LEU 55 Cb -0.05 -2.94 0.01 0.00 0.50 0.00 0.00 46.19 43.71 2gsb s LEU 55 CO -0.01 0.18 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.70 2gsb s TYR 56 N -1.42 2.02 -0.02 5.38 2.02 -0.79 -2.51 117.35 122.04 2gsb s TYR 56 Ca 0.33 -0.81 -0.09 0.00 -0.37 0.00 0.00 57.07 56.13 2gsb s TYR 56 Cb -0.13 -1.40 0.01 0.00 -0.40 0.00 0.00 41.96 40.04 2gsb s TYR 56 CO 0.19 -0.36 0.19 0.12 -1.57 0.00 0.00 175.55 174.12 2gsb s PHE 57 N 0.53 -0.06 0.02 2.71 5.36 -1.21 -1.65 117.98 123.68 2gsb s PHE 57 Ca -0.16 0.09 -0.03 0.00 -0.96 0.00 0.00 56.93 55.87 2gsb s PHE 57 Cb -0.17 0.01 -0.04 0.00 -0.34 0.00 0.00 43.02 42.48 2gsb s PHE 57 CO 0.06 -0.28 0.22 0.50 -1.46 0.00 0.00 175.22 174.26 2gsb s ARG 58 N -1.10 3.48 0.23 10.12 6.06 -1.19 -0.23 118.95 136.31 2gsb s ARG 58 Ca -0.12 -0.28 -0.02 0.00 -2.50 0.00 0.00 55.73 52.81 2gsb s ARG 58 Cb -0.06 -3.07 -0.03 0.00 0.06 0.00 0.00 34.95 31.85 2gsb s ARG 58 CO 0.02 0.64 0.22 0.95 -2.50 0.00 0.00 175.30 174.64 2gsb s THR 59 N -1.38 0.00 0.22 4.11 -4.23 -1.26 -4.39 115.64 108.71 2gsb s THR 59 Ca 0.30 -1.88 -0.08 0.00 -1.18 0.00 0.00 61.69 58.84 2gsb s THR 59 Cb -0.13 -2.46 0.19 0.00 1.34 0.00 0.00 72.50 71.44 2gsb s THR 59 CO 0.20 0.00 1.87 0.78 -0.54 0.00 0.00 174.62 176.93 2gsb h ASN 60 N 2.48 0.87 0.19 3.99 2.35 -1.99 -3.25 115.58 120.21 2gsb h ASN 60 Ca -0.33 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.41 2gsb h ASN 60 Cb 1.25 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.42 2gsb h ASN 60 CO 0.47 0.60 -0.09 -0.08 -1.65 0.00 0.00 177.43 176.68 2gsb h GLU 61 N 1.02 -0.25 -1.29 0.81 4.57 -2.03 -3.49 114.58 113.92 2gsb h GLU 61 Ca 0.32 0.02 0.16 0.00 -1.18 0.00 0.00 59.36 58.68 2gsb h GLU 61 Cb -0.01 0.06 -0.26 0.00 -0.16 0.00 0.00 28.75 28.38 2gsb h GLU 61 CO -0.11 -0.17 0.76 0.54 -1.18 0.00 0.00 179.01 178.85 2gsb s ASN 62 N -3.93 -0.19 -0.01 1.04 2.20 -1.23 -5.13 114.94 107.68 2gsb s ASN 62 Ca -0.04 0.23 -0.39 0.00 -0.94 0.00 0.00 52.86 51.72 2gsb s ASN 62 Cb 0.00 0.19 -0.19 0.00 -2.00 0.00 0.00 41.25 39.25 2gsb s ASN 62 CO 0.11 -0.17 1.21 -0.38 -2.94 0.00 0.00 177.10 174.94 2gsb n ILE 63 N 0.75 0.01 -3.07 0.54 5.41 -1.26 -4.19 119.36 117.55 2gsb n ILE 63 Ca -0.06 -0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.48 2gsb n ILE 63 Cb 0.58 -0.32 0.01 0.00 -0.71 0.00 0.00 39.64 39.20 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 0.46 3.04 -0.05 0.38 -0.21 0.68 -4.95 119.66 119.01 2gsb s GLN 64 Ca 0.90 -0.64 -0.01 0.00 0.02 0.00 0.00 55.36 55.63 2gsb s GLN 64 Cb -1.18 -2.62 0.03 0.00 1.00 0.00 0.00 33.01 30.24 2gsb s GLN 64 CO 0.56 -0.23 0.03 0.50 -2.12 0.00 0.00 175.29 174.03 2gsb s ARG 65 N -4.48 0.26 0.25 2.91 3.52 -1.26 -3.29 118.95 116.85 2gsb s ARG 65 Ca 0.48 0.21 0.07 0.00 -0.13 0.00 0.00 55.73 56.36 2gsb s ARG 65 Cb -0.10 -0.67 -0.04 0.00 -1.56 0.00 0.00 34.95 32.59 2gsb s ARG 65 CO 0.36 -0.27 0.19 -0.06 -0.81 0.00 0.00 175.30 174.71 2gsb s PHE 66 N 1.82 3.10 -0.14 5.12 0.08 -1.04 -4.98 117.98 121.93 2gsb s PHE 66 Ca 0.01 -0.11 -0.01 0.00 0.12 0.00 0.00 56.93 56.94 2gsb s PHE 66 Cb -0.12 -1.40 -0.02 0.00 -0.57 0.00 0.00 43.02 40.91 2gsb s PHE 66 CO -0.04 0.52 -0.11 0.21 -0.10 0.00 0.00 175.22 175.71 2gsb s LYS 67 N -3.83 3.45 -0.27 0.44 2.20 -1.26 -2.97 119.74 117.51 2gsb s LYS 67 Ca 0.33 -0.64 0.01 0.00 -0.36 0.00 0.00 55.97 55.31 2gsb s LYS 67 Cb -0.08 -2.71 0.05 0.00 -1.51 0.00 0.00 37.83 33.58 2gsb s LYS 67 CO 0.25 0.20 -0.08 0.42 -0.36 0.00 0.00 175.35 175.78 2gsb s ILE 68 N 0.40 2.43 -0.16 5.43 1.01 -1.09 -4.56 121.20 124.66 2gsb s ILE 68 Ca -0.09 -1.51 -0.08 0.00 0.00 0.00 0.00 60.65 58.98 2gsb s ILE 68 Cb -0.15 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 2gsb s ILE 68 CO 0.05 -0.02 0.11 0.00 0.00 0.00 0.00 174.94 175.08 2gsb s PRO 70 N -0.23 3.36 0.08 0.00 0.04 -1.26 -0.82 135.00 136.18 2gsb s PRO 70 Ca 0.10 1.61 0.09 0.00 0.04 0.00 0.00 61.00 62.85 2gsb s PRO 70 Cb -0.12 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2gsb s PRO 70 CO 0.01 -0.84 -0.25 0.95 0.04 0.00 0.00 177.00 176.91 2gsb s THR 71 N -1.77 2.01 -1.41 1.26 -4.23 -0.99 -4.84 115.64 105.67 2gsb s THR 71 Ca 0.73 -1.50 0.15 0.00 -1.18 0.00 0.00 61.69 59.88 2gsb s THR 71 Cb -0.24 -1.76 0.25 0.00 1.34 0.00 0.00 72.50 72.09 2gsb s THR 71 CO 0.27 0.17 1.41 -0.81 -0.54 0.00 0.00 174.62 175.12 2gsb n PRO 72 N 1.39 0.20 -0.80 3.99 -0.04 -1.26 -2.66 135.00 135.81 2gsb n PRO 72 Ca -0.18 0.15 -0.08 0.00 -0.04 0.00 0.00 63.50 63.35 2gsb n PRO 72 Cb 0.53 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.69 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 -1.29 3.94 -3.72 3.54 4.13 -1.26 -4.88 115.26 115.72 2gsb n ASN 73 Ca 0.07 -2.97 -0.25 0.00 1.68 0.00 0.00 54.58 53.10 2gsb n ASN 73 Cb 0.12 -0.70 0.05 0.00 -1.54 0.00 0.00 39.78 37.71 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 -0.22 -4.74 -2.44 6.41 2.85 -1.09 -4.98 115.26 111.05 2gsb n ASN 74 Ca 0.34 -0.67 -0.12 0.00 -0.11 0.00 0.00 54.58 54.02 2gsb n ASN 74 Cb 1.19 -4.49 -0.04 0.00 1.24 0.00 0.00 39.78 37.68 2gsb n ASN 74 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2gsb n GLN 75 N -4.72 0.37 -4.21 1.20 6.02 -1.24 -4.75 117.38 110.05 2gsb n GLN 75 Ca -0.04 -1.93 -0.20 0.00 -0.01 0.00 0.00 57.00 54.82 2gsb n GLN 75 Cb 0.57 1.43 -0.16 0.00 1.02 0.00 0.00 30.24 33.10 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 -2.68 0.79 -0.31 1.08 0.40 -0.92 -2.35 117.98 113.99 2gsb s PHE 76 Ca 0.20 -0.22 -0.17 0.00 -0.60 0.00 0.00 56.93 56.14 2gsb s PHE 76 Cb 0.01 -0.67 -0.02 0.00 0.51 0.00 0.00 43.02 42.85 2gsb s PHE 76 CO 0.14 -0.18 0.45 -1.64 0.70 0.00 0.00 175.22 174.69 2gsb s MET 77 N 0.81 3.81 -0.22 0.44 -1.94 0.00 -2.87 119.30 119.33 2gsb s MET 77 Ca -0.11 -0.05 -0.16 0.00 -1.71 0.00 0.00 55.69 53.65 2gsb s MET 77 Cb -0.14 -3.74 -0.09 0.00 2.01 0.00 0.00 34.83 32.88 2gsb s MET 77 CO 0.01 -0.47 -0.31 -0.12 -0.01 0.00 0.00 175.02 174.12 2gsb n MET 78 N 5.54 0.55 -2.88 2.03 1.56 -1.25 -1.55 117.12 121.11 2gsb n MET 78 Ca -0.06 0.28 -0.12 0.00 -0.27 0.00 0.00 57.70 57.52 2gsb n MET 78 Cb 0.50 -1.49 0.02 0.00 2.15 0.00 0.00 33.22 34.40 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 1.39 2.23 1.47 -5.12 0.00 -1.26 -4.58 105.19 99.33 2gsb n GLY 79 Ca -0.30 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.54 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 0.07 0.59 3.41 -0.02 0.00 -1.26 -5.06 105.19 102.91 2gsb n GLY 80 Ca 0.14 -0.78 -0.21 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.73 1.70 -0.11 1.61 3.00 -1.26 -5.15 118.95 117.01 2gsb s ARG 81 Ca 0.00 -1.99 -0.01 0.00 0.00 0.00 0.00 55.73 53.73 2gsb s ARG 81 Cb 0.00 -0.41 0.03 0.00 0.00 0.00 0.00 34.95 34.57 2gsb s ARG 81 CO 0.00 -0.40 -0.03 0.71 0.00 0.00 0.00 175.30 175.57 2gsb s TYR 82 N -3.43 1.14 -0.04 -0.53 2.02 -1.26 -3.91 117.35 111.34 2gsb s TYR 82 Ca 0.32 -0.55 0.07 0.00 -0.37 0.00 0.00 57.07 56.54 2gsb s TYR 82 Cb 0.05 -1.05 -0.02 0.00 -0.40 0.00 0.00 41.96 40.54 2gsb s TYR 82 CO 0.16 -0.46 -0.25 0.71 -1.57 0.00 0.00 175.55 174.15 2gsb s TYR 83 N 1.82 2.41 0.18 2.71 1.51 -1.14 -4.93 117.35 119.92 2gsb s TYR 83 Ca 0.04 -0.57 -0.25 0.00 -1.01 0.00 0.00 57.07 55.28 2gsb s TYR 83 Cb -0.13 -1.56 0.05 0.00 -0.11 0.00 0.00 41.96 40.21 2gsb s TYR 83 CO -0.07 -0.12 1.49 -1.71 -1.11 0.00 0.00 175.55 174.03 2gsb n ASN 84 N 2.71 -0.87 -3.78 2.29 5.15 -1.26 -2.17 115.26 117.33 2gsb n ASN 84 Ca -0.17 1.70 -0.13 0.00 -0.60 0.00 0.00 54.58 55.39 2gsb n ASN 84 Cb 0.52 -0.29 -0.09 0.00 -0.53 0.00 0.00 39.78 39.39 2gsb n ASN 84 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2gsb s SER 85 N -5.43 -0.14 0.16 1.20 0.15 -1.26 -4.32 113.70 104.06 2gsb s SER 85 Ca -0.12 -0.00 -0.15 0.00 0.70 0.00 0.00 55.95 56.37 2gsb s SER 85 Cb 0.14 0.29 0.13 0.00 -1.71 0.00 0.00 66.02 64.88 2gsb s SER 85 CO 0.63 -0.45 1.17 -0.38 1.20 0.00 0.00 173.24 175.41 2gsb n ILE 86 N 1.23 -0.42 -0.34 6.45 5.41 -1.26 -0.00 119.36 130.42 2gsb n ILE 86 Ca -0.21 1.77 -0.03 0.00 1.00 0.00 0.00 62.75 65.28 2gsb n ILE 86 Cb 0.56 -2.31 0.01 0.00 -0.71 0.00 0.00 39.64 37.19 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 -1.32 -1.87 0.15 7.39 0.00 -1.26 0.32 105.19 108.60 2gsb n GLY 87 Ca 0.06 0.98 -0.06 0.00 0.00 0.00 0.00 46.02 47.00 2gsb n GLY 87 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gsb h ASP 88 N 0.00 -0.33 -1.00 1.61 3.32 -0.83 -1.17 116.42 118.02 2gsb h ASP 88 Ca 0.26 0.10 0.38 0.00 0.02 0.00 0.00 57.03 57.80 2gsb h ASP 88 Cb 0.48 0.22 -0.17 0.00 0.22 0.00 0.00 39.33 40.08 2gsb h ASP 88 CO -0.84 -0.12 0.56 0.40 -1.72 0.00 0.00 179.24 177.51 2gsb h ILE 89 N -0.01 0.13 0.37 0.35 2.04 -0.02 -0.34 117.51 120.02 2gsb h ILE 89 Ca 0.16 -0.05 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 2gsb h ILE 89 Cb 0.26 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 2gsb h ILE 89 CO -0.35 0.02 -0.18 0.40 0.00 0.00 0.00 178.15 178.05 2gsb h ILE 90 N 0.14 0.00 -0.89 -0.67 5.03 -0.98 -1.24 117.51 118.90 2gsb h ILE 90 Ca 0.80 -0.17 0.26 0.00 -0.12 0.00 0.00 64.86 65.63 2gsb h ILE 90 Cb 2.01 0.00 -0.04 0.00 -3.03 0.00 0.00 36.82 35.77 2gsb h ILE 90 CO -0.70 0.00 0.90 -0.78 -0.68 0.00 0.00 178.15 176.90 2gsb h ASP 91 N -0.66 0.00 0.03 1.72 3.58 -1.08 0.12 116.42 120.12 2gsb h ASP 91 Ca -0.05 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.40 2gsb h ASP 91 Cb 0.38 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.43 2gsb h ASP 91 CO 0.08 0.00 -0.01 -0.74 -2.88 0.00 0.00 179.24 175.69 2gsb h HIS 92 N 0.00 -0.03 -0.16 0.28 2.76 -0.98 -3.31 115.15 113.71 2gsb h HIS 92 Ca 0.42 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.64 2gsb h HIS 92 Cb 2.23 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 31.19 2gsb h HIS 92 CO 0.00 0.52 0.14 1.88 -1.30 0.00 0.00 177.93 179.17 2gsb h TYR 93 N -0.97 0.00 0.00 5.26 0.05 0.41 0.63 116.97 122.34 2gsb h TYR 93 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2gsb h TYR 93 Cb 0.57 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.31 2gsb h TYR 93 CO 0.15 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.26 2gsb h ARG 94 N 0.00 0.00 0.00 4.88 3.08 -1.14 -1.14 114.38 120.07 2gsb h ARG 94 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2gsb h ARG 94 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2gsb h ARG 94 CO -0.00 0.00 -0.64 1.63 -1.07 0.00 0.00 179.97 179.89 2gsb n LYS 95 N -2.66 3.25 -3.88 0.04 5.02 0.17 -4.79 118.16 115.30 2gsb n LYS 95 Ca -0.02 -0.02 -0.27 0.00 -2.02 0.00 0.00 58.31 55.98 2gsb n LYS 95 Cb 0.08 -0.98 -0.17 0.00 -0.02 0.00 0.00 35.03 33.94 2gsb n LYS 95 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2gsb s GLU 96 N -2.00 1.39 -0.52 1.97 0.41 -0.43 -5.07 118.70 114.45 2gsb s GLU 96 Ca 0.02 -0.38 -0.40 0.00 -0.41 0.00 0.00 54.97 53.80 2gsb s GLU 96 Cb 0.06 -1.80 -0.18 0.00 -1.78 0.00 0.00 34.13 30.43 2gsb s GLU 96 CO 0.36 -0.37 2.06 0.00 -0.49 0.00 0.00 175.26 176.82 2gsb n GLN 97 N 4.92 0.00 0.28 1.61 10.64 -1.26 -4.51 117.38 129.06 2gsb n GLN 97 Ca -0.12 0.00 0.17 0.00 -1.83 0.00 0.00 57.00 55.22 2gsb n GLN 97 Cb 0.49 -1.41 0.70 0.00 -0.86 0.00 0.00 30.24 29.16 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 6.66 0.05 -4.34 -0.39 2.10 -1.65 -3.45 117.51 116.49 2gsb h ILE 98 Ca -0.09 -0.53 -0.29 0.00 1.08 0.00 0.00 64.86 65.03 2gsb h ILE 98 Cb 1.32 1.50 -0.06 0.00 -1.09 0.00 0.00 36.82 38.49 2gsb h ILE 98 CO 1.05 0.02 -0.21 0.52 -1.08 0.00 0.00 178.15 178.44 2gsb n VAL 99 N -3.12 0.00 -0.42 2.19 0.31 -1.19 -5.01 118.33 111.09 2gsb n VAL 99 Ca 0.00 -1.08 -0.02 0.00 -0.01 0.00 0.00 64.34 63.23 2gsb n VAL 99 Cb 0.30 0.25 0.01 0.00 -0.91 0.00 0.00 33.84 33.49 2gsb n VAL 99 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2gsb n GLU 100 N -0.54 1.10 0.00 5.55 0.28 -1.26 -3.99 120.64 121.78 2gsb n GLU 100 Ca -0.08 -0.20 0.00 0.00 -0.16 0.00 0.00 57.16 56.72 2gsb n GLU 100 Cb 0.29 -1.08 0.00 0.00 1.43 0.00 0.00 31.44 32.08 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 1.27 0.15 3.29 -1.84 0.00 -1.26 -5.17 105.19 101.64 2gsb n GLY 101 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.26 -0.27 0.17 1.61 1.51 -1.26 -5.11 117.35 113.74 2gsb s TYR 102 Ca 0.00 0.42 0.08 0.00 -1.01 0.00 0.00 57.07 56.56 2gsb s TYR 102 Cb 0.00 0.16 -0.04 0.00 -0.11 0.00 0.00 41.96 41.96 2gsb s TYR 102 CO 0.00 -0.44 -0.17 0.71 -1.11 0.00 0.00 175.55 174.54 2gsb s TYR 103 N -1.34 1.75 -0.65 2.71 1.51 -1.26 -2.34 117.35 117.72 2gsb s TYR 103 Ca -0.13 -0.50 -0.27 0.00 -1.01 0.00 0.00 57.07 55.16 2gsb s TYR 103 Cb -0.04 -0.86 0.02 0.00 -0.11 0.00 0.00 41.96 40.97 2gsb s TYR 103 CO 0.05 0.32 1.33 -0.51 -1.11 0.00 0.00 175.55 175.63 2gsb s LEU 104 N -2.81 3.29 0.00 -1.29 1.43 -1.26 -4.90 118.68 113.14 2gsb s LEU 104 Ca 0.17 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 2gsb s LEU 104 Cb -0.04 -2.81 0.00 0.00 0.03 0.00 0.00 46.19 43.36 2gsb s LEU 104 CO 0.06 -1.76 0.20 0.29 0.23 0.00 0.00 176.35 175.37 2gsb n LYS 105 N 8.98 0.00 -3.76 1.70 4.76 -1.23 -4.77 118.16 123.85 2gsb n LYS 105 Ca 0.08 0.39 -0.13 0.00 -2.87 0.00 0.00 58.31 55.78 2gsb n LYS 105 Cb 0.49 -1.00 -0.11 0.00 -1.84 0.00 0.00 35.03 32.57 2gsb n LYS 105 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2gsb s GLU 106 N -1.18 0.35 0.77 1.97 2.02 -1.12 -5.09 118.70 116.41 2gsb s GLU 106 Ca 0.00 0.47 -0.11 0.00 0.02 0.00 0.00 54.97 55.35 2gsb s GLU 106 Cb 0.00 0.12 0.05 0.00 0.10 0.00 0.00 34.13 34.41 2gsb s GLU 106 CO 0.00 -0.07 1.09 -1.25 0.02 0.00 0.00 175.26 175.06 2gsb s PRO 107 N 0.40 2.28 0.21 0.39 0.04 -1.26 -3.98 135.00 133.07 2gsb s PRO 107 Ca -0.02 1.18 -0.30 0.00 0.04 0.00 0.00 61.00 61.90 2gsb s PRO 107 Cb -0.04 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.52 2gsb s PRO 107 CO -0.02 -1.63 1.21 0.08 0.04 0.00 0.00 177.00 176.69 2gsb s VAL 108 N -2.88 3.45 0.63 -0.36 1.01 -0.57 -4.83 120.40 116.85 2gsb s VAL 108 Ca 0.61 1.25 -0.16 0.00 0.00 0.00 0.00 61.98 63.68 2gsb s VAL 108 Cb -0.17 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 2gsb s VAL 108 CO 0.55 0.21 1.11 -2.16 0.00 0.00 0.00 175.10 174.82 2gsb s PRO 109 N -0.43 2.92 0.11 2.72 0.04 -1.26 -4.21 135.00 134.88 2gsb s PRO 109 Ca 0.52 1.44 0.02 0.00 0.04 0.00 0.00 61.00 63.02 2gsb s PRO 109 Cb -0.34 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 2gsb s PRO 109 CO 0.38 -1.16 0.20 0.00 0.04 0.00 0.00 177.00 176.45 2gsb s MET 110 N -3.92 3.25 -1.15 4.56 0.23 -1.26 -5.01 119.30 116.00 2gsb s MET 110 Ca 0.68 -0.60 -0.22 0.00 -1.03 0.00 0.00 55.69 54.52 2gsb s MET 110 Cb -0.21 -2.90 -0.06 0.00 -1.53 0.00 0.00 34.83 30.13 2gsb s MET 110 CO 0.38 0.56 1.90 -0.65 -2.03 0.00 0.00 175.02 175.18 2gsb s GLN 111 N -2.79 2.71 0.16 3.16 -1.52 -1.26 -4.93 119.66 115.19 2gsb s GLN 111 Ca 0.33 -1.12 -0.32 0.00 -1.95 0.00 0.00 55.36 52.31 2gsb s GLN 111 Cb -0.12 -5.25 -0.10 0.00 -0.22 0.00 0.00 33.01 27.32 2gsb s GLN 111 CO 0.26 -3.64 1.58 0.16 -0.25 0.00 0.00 175.29 173.41 2gsb s ASP 112 N 6.44 6.57 -0.59 5.90 -4.77 -1.26 -4.95 116.67 124.01 2gsb s ASP 112 Ca 0.66 2.63 -0.19 0.00 -3.30 0.00 0.00 52.55 52.35 2gsb s ASP 112 Cb -0.01 -2.59 0.10 0.00 -1.09 0.00 0.00 42.92 39.32 2gsb s ASP 112 CO 0.10 -0.84 0.72 -1.10 0.70 0.00 0.00 175.17 174.75 2gsb s GLN 113 N 1.19 3.06 0.16 2.11 -1.52 -1.26 -5.00 119.66 118.40 2gsb s GLN 113 Ca 0.70 -1.24 -0.19 0.00 -1.95 0.00 0.00 55.36 52.68 2gsb s GLN 113 Cb -0.44 -4.25 0.04 0.00 -0.22 0.00 0.00 33.01 28.14 2gsb s GLN 113 CO 0.31 -1.54 0.51 -1.54 -0.25 0.00 0.00 175.29 172.78 2gsb s SER 114 N 3.56 -0.34 0.00 5.90 1.04 -1.26 -5.15 113.70 117.45 2gsb s SER 114 Ca 0.13 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.27 2gsb s SER 114 Cb -0.23 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.44 2gsb s SER 114 CO 0.07 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.93 2gsb n GLY 115 N -0.31 -0.46 3.76 7.32 0.00 -1.26 -4.96 105.19 109.28 2gsb n GLY 115 Ca -0.14 -1.68 -0.41 0.00 0.00 0.00 0.00 46.02 43.80 2gsb n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gsb s PRO 116 N -2.65 4.46 0.04 1.61 0.04 -1.26 -4.98 135.00 132.27 2gsb s PRO 116 Ca 0.00 2.06 -0.29 0.00 0.04 0.00 0.00 61.00 62.80 2gsb s PRO 116 Cb 0.00 -3.12 -0.16 0.00 0.04 0.00 0.00 34.50 31.26 2gsb s PRO 116 CO 0.00 -0.04 1.39 1.03 0.04 0.00 0.00 177.00 179.42 2gsb h SER 117 N 3.62 -0.89 -5.01 6.66 0.87 -2.06 -3.47 113.55 113.27 2gsb h SER 117 Ca -0.48 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.10 2gsb h SER 117 Cb 1.22 0.23 -0.11 0.00 -0.44 0.00 0.00 62.40 63.30 2gsb h SER 117 CO 0.66 -0.62 0.17 -0.44 -0.53 0.00 0.00 176.83 176.08 2gsb s SER 118 N -3.69 -0.49 0.00 6.23 0.01 -1.26 -5.26 113.70 109.24 2gsb s SER 118 Ca -0.15 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.00 2gsb s SER 118 Cb 0.02 0.60 0.00 0.00 0.21 0.00 0.00 66.02 66.84 2gsb s SER 118 CO 0.46 -0.99 0.00 0.61 0.41 0.00 0.00 173.24 173.73