#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gsn n GLY 3 N 0.00 1.32 3.32 3.17 0.00 -1.26 -5.06 105.19 106.68 3gsn n GLY 3 Ca 0.00 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 3gsn n GLY 3 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gsn s VAL 4 N -1.00 4.70 0.01 1.61 1.01 -1.26 -3.95 120.40 121.51 3gsn s VAL 4 Ca 0.00 -1.29 -0.23 0.00 0.00 0.00 0.00 61.98 60.47 3gsn s VAL 4 Cb 0.00 -3.86 -0.05 0.00 0.00 0.00 0.00 36.38 32.47 3gsn s VAL 4 CO 0.00 -0.57 0.68 0.28 0.00 0.00 0.00 175.10 175.49 3gsn s THR 5 N 1.52 4.84 -0.04 3.92 -1.32 0.21 -3.80 115.64 120.98 3gsn s THR 5 Ca 0.04 1.43 -0.01 0.00 -1.21 0.00 0.00 61.69 61.93 3gsn s THR 5 Cb -0.24 -4.02 0.03 0.00 -1.51 0.00 0.00 72.50 66.76 3gsn s THR 5 CO 0.04 0.38 0.06 -1.58 -2.21 0.00 0.00 174.62 171.30 3gsn s GLN 6 N -0.05 -0.06 0.01 7.08 0.74 -1.26 -0.36 119.66 125.76 3gsn s GLN 6 Ca 0.35 0.32 0.02 0.00 0.05 0.00 0.00 55.36 56.10 3gsn s GLN 6 Cb -0.19 -0.40 -0.01 0.00 1.10 0.00 0.00 33.01 33.51 3gsn s GLN 6 CO 0.20 -0.27 -0.06 0.95 -0.55 0.00 0.00 175.29 175.56 3gsn s THR 7 N 1.77 0.48 0.52 -0.34 -4.23 0.17 -4.57 115.64 109.43 3gsn s THR 7 Ca -0.00 -0.42 0.03 0.00 -1.18 0.00 0.00 61.69 60.12 3gsn s THR 7 Cb -0.12 -0.43 0.03 0.00 1.34 0.00 0.00 72.50 73.31 3gsn s THR 7 CO -0.03 0.02 0.73 -2.16 -0.54 0.00 0.00 174.62 172.64 3gsn s PRO 8 N -0.43 2.59 -0.05 3.99 0.04 -1.26 -0.49 135.00 139.39 3gsn s PRO 8 Ca -0.00 -0.92 -0.26 0.00 0.04 0.00 0.00 61.00 59.86 3gsn s PRO 8 Cb -0.04 -2.55 -0.22 0.00 0.04 0.00 0.00 34.50 31.73 3gsn s PRO 8 CO -0.00 -0.62 1.10 0.87 0.04 0.00 0.00 177.00 178.39 3gsn h LYS 9 N 0.20 0.07 -5.77 4.56 1.57 -1.84 -3.41 116.57 111.94 3gsn h LYS 9 Ca -0.41 -0.05 -0.49 0.00 -1.87 0.00 0.00 60.65 57.83 3gsn h LYS 9 Cb 1.29 0.01 -0.19 0.00 0.08 0.00 0.00 32.23 33.43 3gsn h LYS 9 CO 0.50 0.72 -0.78 -0.06 -0.57 0.00 0.00 179.45 179.26 3gsn s PHE 10 N -3.53 1.66 -0.28 -1.35 0.08 -1.26 -0.16 117.98 113.14 3gsn s PHE 10 Ca -0.16 -0.49 -0.21 0.00 0.12 0.00 0.00 56.93 56.18 3gsn s PHE 10 Cb 0.01 -0.85 0.12 0.00 -0.57 0.00 0.00 43.02 41.73 3gsn s PHE 10 CO 0.70 0.25 0.95 -1.14 -0.10 0.00 0.00 175.22 175.87 3gsn s GLN 11 N -2.63 0.51 0.05 0.44 2.00 -0.87 -4.94 119.66 114.22 3gsn s GLN 11 Ca 0.12 0.72 0.07 0.00 -2.00 0.00 0.00 55.36 54.27 3gsn s GLN 11 Cb -0.06 0.18 -0.03 0.00 0.80 0.00 0.00 33.01 33.90 3gsn s GLN 11 CO 0.05 -0.08 -0.17 0.08 -0.50 0.00 0.00 175.29 174.67 3gsn s VAL 12 N 0.80 2.85 0.01 1.34 1.01 -1.26 -1.87 120.40 123.27 3gsn s VAL 12 Ca -0.03 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 60.74 3gsn s VAL 12 Cb -0.05 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 3gsn s VAL 12 CO -0.10 0.30 -0.02 -0.76 0.00 0.00 0.00 175.10 174.51 3gsn s LEU 13 N -1.55 2.08 -0.12 3.92 1.43 -0.18 -4.97 118.68 119.29 3gsn s LEU 13 Ca 0.15 -0.19 -0.21 0.00 -1.03 0.00 0.00 54.13 52.86 3gsn s LEU 13 Cb -0.11 -0.04 -0.04 0.00 0.03 0.00 0.00 46.19 46.04 3gsn s LEU 13 CO 0.06 -0.08 0.61 -0.75 0.23 0.00 0.00 176.35 176.42 3gsn s LYS 14 N -0.51 4.34 0.12 1.70 2.20 -1.26 -0.80 119.74 125.53 3gsn s LYS 14 Ca -0.04 0.66 -0.31 0.00 -0.36 0.00 0.00 55.97 55.92 3gsn s LYS 14 Cb -0.04 -3.48 -0.17 0.00 -1.51 0.00 0.00 37.83 32.63 3gsn s LYS 14 CO -0.00 0.01 0.69 2.41 -0.36 0.00 0.00 175.35 178.10 3gsn n THR 15 N 3.99 1.20 0.00 3.43 -1.04 -0.64 -1.10 114.28 120.12 3gsn n THR 15 Ca -0.03 -0.30 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 3gsn n THR 15 Cb 0.51 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.02 3gsn n THR 15 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3gsn n GLY 16 N 1.73 2.52 3.77 3.41 0.00 0.26 -4.91 105.19 111.98 3gsn n GLY 16 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 3gsn n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gsn s GLN 17 N -0.48 3.89 0.32 1.61 -0.21 -0.26 -4.03 119.66 120.51 3gsn s GLN 17 Ca 0.00 1.73 0.07 0.00 0.02 0.00 0.00 55.36 57.18 3gsn s GLN 17 Cb 0.00 -2.48 -0.02 0.00 1.00 0.00 0.00 33.01 31.51 3gsn s GLN 17 CO 0.00 -0.43 0.36 -1.54 -2.12 0.00 0.00 175.29 171.56 3gsn s SER 18 N -1.36 5.63 -0.07 5.90 1.04 -1.26 -1.30 113.70 122.28 3gsn s SER 18 Ca 0.61 -0.33 -0.30 0.00 0.48 0.00 0.00 55.95 56.42 3gsn s SER 18 Cb -0.28 -1.15 0.10 0.00 0.10 0.00 0.00 66.02 64.79 3gsn s SER 18 CO 0.34 -0.35 0.83 -0.32 0.98 0.00 0.00 173.24 174.72 3gsn s MET 19 N -4.06 0.86 -0.23 4.02 1.75 -1.15 -4.97 119.30 115.53 3gsn s MET 19 Ca 0.42 0.08 -0.05 0.00 -1.25 0.00 0.00 55.69 54.88 3gsn s MET 19 Cb -0.08 0.40 -0.01 0.00 2.84 0.00 0.00 34.83 37.98 3gsn s MET 19 CO 0.28 -0.30 -0.01 0.99 -0.65 0.00 0.00 175.02 175.34 3gsn s THR 20 N -1.64 3.68 -0.26 10.11 2.01 -1.26 0.96 115.64 129.24 3gsn s THR 20 Ca -0.04 -0.40 -0.20 0.00 0.31 0.00 0.00 61.69 61.36 3gsn s THR 20 Cb -0.00 -2.69 -0.02 0.00 0.01 0.00 0.00 72.50 69.79 3gsn s THR 20 CO 0.02 0.39 0.63 -0.76 -0.69 0.00 0.00 174.62 174.21 3gsn s LEU 21 N 1.52 4.07 -0.15 4.42 1.02 0.44 -4.85 118.68 125.15 3gsn s LEU 21 Ca 0.06 0.66 -0.18 0.00 0.02 0.00 0.00 54.13 54.69 3gsn s LEU 21 Cb -0.15 -2.85 -0.04 0.00 0.02 0.00 0.00 46.19 43.18 3gsn s LEU 21 CO -0.01 -0.39 0.49 -1.10 0.02 0.00 0.00 176.35 175.36 3gsn s GLN 22 N 2.52 4.29 -0.01 1.70 -1.52 0.36 0.11 119.66 127.11 3gsn s GLN 22 Ca 0.26 0.44 0.01 0.00 -1.95 0.00 0.00 55.36 54.12 3gsn s GLN 22 Cb -0.15 -3.48 0.00 0.00 -0.22 0.00 0.00 33.01 29.16 3gsn s GLN 22 CO 0.09 0.04 -0.03 0.00 -0.25 0.00 0.00 175.29 175.15 3gsn s ALA 24 N 0.13 0.06 0.26 0.00 0.00 0.51 -1.78 121.76 120.94 3gsn s ALA 24 Ca -0.01 -0.19 0.08 0.00 0.00 0.00 0.00 51.96 51.83 3gsn s ALA 24 Cb -0.04 0.04 -0.05 0.00 0.00 0.00 0.00 23.12 23.07 3gsn s ALA 24 CO -0.00 -0.04 -0.10 1.14 0.00 0.00 0.00 175.76 176.75 3gsn s GLN 25 N -0.45 1.51 -0.14 0.00 -2.07 0.07 -0.62 119.66 117.96 3gsn s GLN 25 Ca -0.05 -1.73 0.20 0.00 -1.82 0.00 0.00 55.36 51.97 3gsn s GLN 25 Cb -0.03 -1.24 0.45 0.00 -1.09 0.00 0.00 33.01 31.10 3gsn s GLN 25 CO -0.00 0.12 1.17 -0.40 -1.32 0.00 0.00 175.29 174.85 3gsn n ASP 26 N -0.53 1.73 -0.13 12.60 5.75 -1.25 -4.54 116.55 130.17 3gsn n ASP 26 Ca -0.06 -2.57 0.01 0.00 -0.01 0.00 0.00 54.79 52.16 3gsn n ASP 26 Cb 0.62 -0.40 0.03 0.00 -1.03 0.00 0.00 41.12 40.34 3gsn n ASP 26 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 3gsn n MET 27 N -0.23 1.60 -2.07 0.11 2.81 -1.26 -4.99 117.12 113.09 3gsn n MET 27 Ca 0.13 -1.26 -0.16 0.00 -1.81 0.00 0.00 57.70 54.61 3gsn n MET 27 Cb 0.95 -1.06 -0.02 0.00 -0.71 0.00 0.00 33.22 32.38 3gsn n MET 27 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3gsn n ASN 28 N -0.12 -4.80 -4.69 7.83 3.02 -1.26 -4.97 115.26 110.27 3gsn n ASN 28 Ca 0.02 0.10 -0.42 0.00 -0.03 0.00 0.00 54.58 54.25 3gsn n ASN 28 Cb 0.20 -3.86 -0.03 0.00 -0.61 0.00 0.00 39.78 35.49 3gsn n ASN 28 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3gsn s HIS 29 N -2.74 2.85 -0.01 3.10 3.76 -1.26 -4.92 115.29 116.07 3gsn s HIS 29 Ca 0.00 0.81 -0.18 0.00 -0.15 0.00 0.00 55.06 55.53 3gsn s HIS 29 Cb 0.00 -3.67 -0.10 0.00 1.11 0.00 0.00 32.58 29.92 3gsn s HIS 29 CO 0.00 -2.49 0.86 0.93 -0.85 0.00 0.00 174.74 173.19 3gsn h GLU 30 N 7.81 -0.64 -6.52 1.40 5.08 -1.46 -3.45 114.58 116.81 3gsn h GLU 30 Ca -0.38 0.04 -0.53 0.00 -1.00 0.00 0.00 59.36 57.49 3gsn h GLU 30 Cb 1.18 0.14 0.02 0.00 0.50 0.00 0.00 28.75 30.60 3gsn h GLU 30 CO 0.90 -0.42 0.76 -0.47 -1.00 0.00 0.00 179.01 178.78 3gsn s TYR 31 N -3.80 3.13 0.00 4.33 6.14 -1.09 -3.92 117.35 122.15 3gsn s TYR 31 Ca -0.10 0.88 0.00 0.00 0.64 0.00 0.00 57.07 58.50 3gsn s TYR 31 Cb 0.01 -3.71 -0.00 0.00 0.42 0.00 0.00 41.96 38.68 3gsn s TYR 31 CO 0.29 -2.52 -0.01 -1.64 0.64 0.00 0.00 175.55 172.31 3gsn s MET 32 N 1.40 0.09 0.06 4.97 -1.94 0.11 -1.63 119.30 122.35 3gsn s MET 32 Ca 0.65 -0.14 -0.14 0.00 -1.71 0.00 0.00 55.69 54.36 3gsn s MET 32 Cb -0.36 -0.01 0.02 0.00 2.01 0.00 0.00 34.83 36.49 3gsn s MET 32 CO 0.30 -0.00 0.31 -1.54 -0.01 0.00 0.00 175.02 174.08 3gsn s SER 33 N -0.30 -0.13 -0.17 3.03 1.04 0.67 0.75 113.70 118.59 3gsn s SER 33 Ca -0.03 -0.24 -0.01 0.00 0.48 0.00 0.00 55.95 56.15 3gsn s SER 33 Cb -0.02 0.38 -0.00 0.00 0.10 0.00 0.00 66.02 66.47 3gsn s SER 33 CO -0.00 -0.66 -0.12 0.26 0.98 0.00 0.00 173.24 173.70 3gsn s TRP 34 N -2.83 2.84 0.12 5.02 0.52 -0.80 -0.67 118.94 123.16 3gsn s TRP 34 Ca -0.03 -0.97 0.08 0.00 0.02 0.00 0.00 56.10 55.20 3gsn s TRP 34 Cb 0.00 -1.95 -0.04 0.00 -1.15 0.00 0.00 33.47 30.33 3gsn s TRP 34 CO -0.05 -0.46 -0.11 0.71 0.02 0.00 0.00 176.95 177.05 3gsn s TYR 35 N 0.94 2.68 0.38 -1.98 1.51 -0.66 0.18 117.35 120.40 3gsn s TYR 35 Ca -0.02 -0.19 0.08 0.00 -1.01 0.00 0.00 57.07 55.92 3gsn s TYR 35 Cb -0.15 -1.38 -0.02 0.00 -0.11 0.00 0.00 41.96 40.29 3gsn s TYR 35 CO -0.01 0.44 0.34 -0.98 -1.11 0.00 0.00 175.55 174.22 3gsn s ARG 36 N -2.33 2.62 -0.09 -0.62 1.70 -0.20 -1.15 118.95 118.88 3gsn s ARG 36 Ca 0.21 -1.43 -0.00 0.00 -0.47 0.00 0.00 55.73 54.04 3gsn s ARG 36 Cb -0.10 -2.42 0.02 0.00 -0.57 0.00 0.00 34.95 31.88 3gsn s ARG 36 CO 0.13 -0.06 -0.05 -1.14 -1.08 0.00 0.00 175.30 173.10 3gsn s GLN 37 N -4.07 1.19 -0.09 3.89 2.00 0.12 -2.25 119.66 120.46 3gsn s GLN 37 Ca 0.45 -0.14 -0.04 0.00 -2.00 0.00 0.00 55.36 53.63 3gsn s GLN 37 Cb -0.04 -1.31 0.05 0.00 0.80 0.00 0.00 33.01 32.50 3gsn s GLN 37 CO 0.27 -0.24 0.18 -0.51 -0.50 0.00 0.00 175.29 174.50 3gsn s ASP 38 N 1.63 0.38 0.19 6.67 1.11 -1.21 -2.79 116.67 122.65 3gsn s ASP 38 Ca 0.02 0.39 -0.31 0.00 0.18 0.00 0.00 52.55 52.83 3gsn s ASP 38 Cb -0.13 0.34 -0.16 0.00 1.07 0.00 0.00 42.92 44.04 3gsn s ASP 38 CO -0.06 -0.21 0.84 -2.65 1.18 0.00 0.00 175.17 174.27 3gsn n PRO 39 N 4.96 0.54 0.00 8.23 -0.02 -1.26 -2.43 135.00 145.02 3gsn n PRO 39 Ca -0.12 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 3gsn n PRO 39 Cb 0.51 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 3gsn n PRO 39 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gsn n GLY 40 N 1.76 3.03 0.01 -1.23 0.00 -1.26 -4.74 105.19 102.77 3gsn n GLY 40 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3gsn n GLY 40 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3gsn n MET 41 N -0.25 2.21 0.00 1.61 2.81 -1.02 -5.10 117.12 117.39 3gsn n MET 41 Ca 0.00 -0.32 0.00 0.00 -1.81 0.00 0.00 57.70 55.57 3gsn n MET 41 Cb 0.00 -0.81 0.00 0.00 -0.71 0.00 0.00 33.22 31.70 3gsn n MET 41 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gsn n GLY 42 N 0.43 3.06 3.61 3.03 0.00 -1.19 -4.45 105.19 109.68 3gsn n GLY 42 Ca 0.00 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3gsn n GLY 42 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gsn s LEU 43 N 0.00 4.12 -0.08 0.99 1.43 -1.26 -3.36 118.68 120.51 3gsn s LEU 43 Ca 0.00 0.55 0.02 0.00 -1.03 0.00 0.00 54.13 53.67 3gsn s LEU 43 Cb 0.00 -2.97 -0.02 0.00 0.03 0.00 0.00 46.19 43.23 3gsn s LEU 43 CO 0.00 -0.57 -0.14 -0.13 0.23 0.00 0.00 176.35 175.74 3gsn s ARG 44 N 2.82 2.87 0.15 1.70 0.52 -0.95 -4.96 118.95 121.09 3gsn s ARG 44 Ca 0.29 -0.69 -0.30 0.00 -0.52 0.00 0.00 55.73 54.51 3gsn s ARG 44 Cb -0.14 -2.48 -0.07 0.00 0.52 0.00 0.00 34.95 32.78 3gsn s ARG 44 CO 0.12 0.45 1.00 -1.17 0.02 0.00 0.00 175.30 175.73 3gsn s LEU 45 N -0.28 4.51 0.00 2.53 2.96 -1.26 -1.03 118.68 126.11 3gsn s LEU 45 Ca 0.02 1.90 0.00 0.00 -0.22 0.00 0.00 54.13 55.83 3gsn s LEU 45 Cb -0.13 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.97 3gsn s LEU 45 CO 0.03 -0.09 0.00 -0.38 -1.32 0.00 0.00 176.35 174.59 3gsn n ILE 46 N 2.52 0.00 -4.77 6.68 5.41 0.13 0.10 119.36 129.42 3gsn n ILE 46 Ca 0.02 0.00 -0.24 0.00 1.00 0.00 0.00 62.75 63.53 3gsn n ILE 46 Cb 0.48 -0.74 -0.15 0.00 -0.71 0.00 0.00 39.64 38.52 3gsn n ILE 46 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 3gsn s HIS 47 N 0.00 1.47 0.34 1.39 3.76 -1.24 0.18 115.29 121.19 3gsn s HIS 47 Ca 0.00 -0.29 0.09 0.00 -0.15 0.00 0.00 55.06 54.72 3gsn s HIS 47 Cb 0.00 -0.95 -0.06 0.00 1.11 0.00 0.00 32.58 32.68 3gsn s HIS 47 CO 0.00 -0.03 -0.08 1.52 -0.85 0.00 0.00 174.74 175.30 3gsn s TYR 48 N -0.36 2.42 -0.07 1.40 1.13 -0.08 -1.90 117.35 119.90 3gsn s TYR 48 Ca 0.06 -0.49 -0.03 0.00 -1.41 0.00 0.00 57.07 55.20 3gsn s TYR 48 Cb -0.07 -1.39 0.04 0.00 -1.10 0.00 0.00 41.96 39.44 3gsn s TYR 48 CO -0.00 0.57 0.13 0.45 -2.51 0.00 0.00 175.55 174.19 3gsn s SER 49 N -3.62 0.64 0.00 -0.18 0.15 0.23 -1.25 113.70 109.66 3gsn s SER 49 Ca 0.33 0.26 0.25 0.00 0.70 0.00 0.00 55.95 57.48 3gsn s SER 49 Cb 0.02 0.16 0.42 0.00 -1.71 0.00 0.00 66.02 64.91 3gsn s SER 49 CO 0.17 -0.22 1.36 1.33 1.20 0.00 0.00 173.24 177.07 3gsn n VAL 50 N 5.06 0.00 0.00 4.45 0.24 -1.25 0.05 118.33 126.88 3gsn n VAL 50 Ca -0.09 -0.17 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 3gsn n VAL 50 Cb 0.50 0.74 0.00 0.00 -1.47 0.00 0.00 33.84 33.61 3gsn n VAL 50 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3gsn n GLY 51 N 1.38 0.05 3.63 7.63 0.00 -1.25 -4.33 105.19 112.31 3gsn n GLY 51 Ca 0.10 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.63 3gsn n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gsn s ALA 52 N -2.00 3.31 0.00 4.61 0.00 -1.26 -2.17 121.76 124.25 3gsn s ALA 52 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 51.96 52.58 3gsn s ALA 52 Cb 0.00 -3.85 0.00 0.00 0.00 0.00 0.00 23.12 19.27 3gsn s ALA 52 CO 0.00 -1.89 0.00 0.41 0.00 0.00 0.00 175.76 174.28 3gsn n GLY 53 N 4.63 2.76 3.53 0.00 0.00 0.22 -4.96 105.19 111.36 3gsn n GLY 53 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 3gsn n GLY 53 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gsn s ILE 54 N -2.57 4.59 0.03 -0.61 1.01 -0.92 -4.94 121.20 117.79 3gsn s ILE 54 Ca 0.00 -0.09 0.06 0.00 0.00 0.00 0.00 60.65 60.63 3gsn s ILE 54 Cb 0.00 -3.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.32 3gsn s ILE 54 CO 0.00 0.37 -0.18 -0.89 0.00 0.00 0.00 174.94 174.24 3gsn s THR 55 N 1.20 1.47 -0.03 2.92 2.01 -1.26 -3.77 115.64 118.18 3gsn s THR 55 Ca 0.05 -1.08 -0.10 0.00 0.31 0.00 0.00 61.69 60.87 3gsn s THR 55 Cb -0.14 -1.28 0.02 0.00 0.01 0.00 0.00 72.50 71.10 3gsn s THR 55 CO 0.04 0.17 0.22 -1.81 -0.69 0.00 0.00 174.62 172.56 3gsn s ASP 56 N -1.06 -0.13 0.71 3.53 -0.00 -0.38 -5.02 116.67 114.31 3gsn s ASP 56 Ca 0.06 0.11 -0.11 0.00 -0.00 0.00 0.00 52.55 52.61 3gsn s ASP 56 Cb -0.08 0.33 0.01 0.00 -0.00 0.00 0.00 42.92 43.18 3gsn s ASP 56 CO 0.01 -0.30 1.06 -1.10 -0.00 0.00 0.00 175.17 174.85 3gsn s GLN 57 N -0.88 2.86 0.00 8.23 -0.21 -1.26 -0.90 119.66 127.50 3gsn s GLN 57 Ca -0.10 0.90 0.00 0.00 0.02 0.00 0.00 55.36 56.18 3gsn s GLN 57 Cb -0.05 -1.99 0.00 0.00 1.00 0.00 0.00 33.01 31.98 3gsn s GLN 57 CO 0.02 -1.14 0.00 0.41 -2.12 0.00 0.00 175.29 172.46 3gsn n GLY 58 N -2.06 6.48 0.18 3.09 0.00 0.13 -4.59 105.19 108.42 3gsn n GLY 58 Ca 0.07 -1.86 -0.08 0.00 0.00 0.00 0.00 46.02 44.15 3gsn n GLY 58 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3gsn h GLU 59 N 0.00 0.53 -2.09 1.61 4.81 -1.16 -3.38 114.58 114.90 3gsn h GLU 59 Ca 0.00 -0.05 -0.55 0.00 -0.13 0.00 0.00 59.36 58.64 3gsn h GLU 59 Cb 0.00 -0.11 -0.40 0.00 0.63 0.00 0.00 28.75 28.86 3gsn h GLU 59 CO 0.00 0.39 -0.96 1.33 -0.73 0.00 0.00 179.01 179.05 3gsn n VAL 60 N -4.78 0.76 0.38 0.32 0.24 0.11 -4.91 118.33 110.45 3gsn n VAL 60 Ca 0.00 -4.72 0.12 0.00 -2.04 0.00 0.00 64.34 57.70 3gsn n VAL 60 Cb 0.05 -1.32 0.17 0.00 -1.47 0.00 0.00 33.84 31.27 3gsn n VAL 60 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3gsn h PRO 61 N 3.50 0.00 -6.21 7.34 0.13 -1.74 -3.42 132.00 131.60 3gsn h PRO 61 Ca 0.11 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.58 3gsn h PRO 61 Cb 0.80 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.94 3gsn h PRO 61 CO 0.61 0.00 1.03 -1.71 -0.23 0.00 0.00 178.00 177.70 3gsn n ASN 62 N -2.51 2.99 0.00 1.44 2.85 -1.26 -2.35 115.26 116.42 3gsn n ASN 62 Ca 0.03 1.01 0.00 0.00 -0.11 0.00 0.00 54.58 55.51 3gsn n ASN 62 Cb 0.49 -1.27 0.00 0.00 1.24 0.00 0.00 39.78 40.24 3gsn n ASN 62 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3gsn n GLY 63 N 4.36 3.13 3.65 8.20 0.00 -1.26 -5.04 105.19 118.24 3gsn n GLY 63 Ca 0.25 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 3gsn n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gsn s TYR 64 N -2.61 2.91 0.26 1.61 2.02 -0.99 -2.95 117.35 117.60 3gsn s TYR 64 Ca 0.00 -0.07 0.01 0.00 -0.37 0.00 0.00 57.07 56.64 3gsn s TYR 64 Cb 0.00 -1.50 -0.05 0.00 -0.40 0.00 0.00 41.96 40.01 3gsn s TYR 64 CO 0.00 0.47 0.12 0.54 -1.57 0.00 0.00 175.55 175.11 3gsn s ASN 65 N -2.30 1.06 0.26 2.29 6.03 -0.70 -4.96 114.94 116.61 3gsn s ASN 65 Ca 0.25 -1.43 -0.09 0.00 -1.03 0.00 0.00 52.86 50.56 3gsn s ASN 65 Cb -0.11 0.26 -0.01 0.00 -3.03 0.00 0.00 41.25 38.36 3gsn s ASN 65 CO 0.17 -0.79 0.43 0.68 -2.03 0.00 0.00 177.10 175.56 3gsn s VAL 66 N -3.80 0.00 0.15 3.54 -7.23 -1.26 -1.27 120.40 110.52 3gsn s VAL 66 Ca 0.38 -1.52 0.01 0.00 -1.81 0.00 0.00 61.98 59.03 3gsn s VAL 66 Cb 0.07 -2.34 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 3gsn s VAL 66 CO 0.14 0.00 0.02 -0.94 -0.31 0.00 0.00 175.10 174.02 3gsn s SER 67 N -3.08 0.81 -0.44 4.85 1.04 -1.23 -5.03 113.70 110.62 3gsn s SER 67 Ca 0.26 -1.18 0.07 0.00 0.48 0.00 0.00 55.95 55.59 3gsn s SER 67 Cb 0.00 0.19 0.28 0.00 0.10 0.00 0.00 66.02 66.59 3gsn s SER 67 CO 0.12 -0.64 0.81 -1.14 0.98 0.00 0.00 173.24 173.37 3gsn n ARG 68 N -0.17 0.84 0.07 4.02 3.00 -1.26 -3.90 116.66 119.27 3gsn n ARG 68 Ca -0.06 -2.44 0.12 0.00 -0.00 0.00 0.00 57.85 55.47 3gsn n ARG 68 Cb 0.63 -1.35 0.46 0.00 0.00 0.00 0.00 32.46 32.21 3gsn n ARG 68 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 3gsn n SER 69 N 1.11 0.50 -4.22 6.15 3.41 -1.26 0.69 113.62 119.99 3gsn n SER 69 Ca 0.14 0.57 -0.13 0.00 -0.26 0.00 0.00 58.87 59.20 3gsn n SER 69 Cb 0.62 -0.70 -0.10 0.00 -0.26 0.00 0.00 64.21 63.77 3gsn n SER 69 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3gsn s THR 70 N -3.12 0.50 0.38 6.66 -4.23 -1.26 -4.66 115.64 109.92 3gsn s THR 70 Ca 0.09 -1.96 0.09 0.00 -1.18 0.00 0.00 61.69 58.74 3gsn s THR 70 Cb 0.13 -2.15 0.14 0.00 1.34 0.00 0.00 72.50 71.96 3gsn s THR 70 CO 0.49 -0.43 1.89 0.74 -0.54 0.00 0.00 174.62 176.77 3gsn h THR 71 N 2.71 1.20 0.21 3.99 2.02 -1.94 -3.34 112.91 117.76 3gsn h THR 71 Ca -0.36 -0.89 -0.32 0.00 0.77 0.00 0.00 66.41 65.61 3gsn h THR 71 Cb 1.21 1.29 0.03 0.00 -1.74 0.00 0.00 68.15 68.93 3gsn h THR 71 CO 0.61 0.27 -1.46 -0.33 0.37 0.00 0.00 175.52 174.99 3gsn h GLU 72 N 0.21 0.45 -6.43 6.66 3.07 -1.91 -3.45 114.58 113.18 3gsn h GLU 72 Ca 0.04 -0.77 -0.67 0.00 -0.50 0.00 0.00 59.36 57.46 3gsn h GLU 72 Cb 0.44 0.29 -0.18 0.00 -0.84 0.00 0.00 28.75 28.46 3gsn h GLU 72 CO 0.03 1.37 -0.73 -0.51 -1.40 0.00 0.00 179.01 177.76 3gsn s ASP 73 N -7.39 4.39 -0.43 1.42 1.01 -1.25 -0.75 116.67 113.68 3gsn s ASP 73 Ca -0.12 -0.27 0.06 0.00 0.71 0.00 0.00 52.55 52.93 3gsn s ASP 73 Cb 0.04 -0.91 0.21 0.00 1.01 0.00 0.00 42.92 43.27 3gsn s ASP 73 CO 0.89 0.24 0.54 0.33 0.21 0.00 0.00 175.17 177.38 3gsn n PHE 74 N 1.29 -1.42 -2.17 4.23 7.35 -0.74 -4.61 117.46 121.39 3gsn n PHE 74 Ca -0.15 -2.94 -0.42 0.00 -0.76 0.00 0.00 57.45 53.18 3gsn n PHE 74 Cb 0.52 0.36 -0.03 0.00 0.35 0.00 0.00 39.48 40.69 3gsn n PHE 74 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 3gsn s PRO 75 N -0.23 4.32 -0.49 -7.13 0.04 -1.25 -4.29 135.00 125.97 3gsn s PRO 75 Ca 0.33 2.08 -0.17 0.00 0.04 0.00 0.00 61.00 63.28 3gsn s PRO 75 Cb 0.11 -3.25 0.07 0.00 0.04 0.00 0.00 34.50 31.47 3gsn s PRO 75 CO -0.15 -0.44 0.48 -1.17 0.04 0.00 0.00 177.00 175.76 3gsn s LEU 76 N 1.11 5.40 -0.22 -3.56 2.96 0.12 -3.55 118.68 120.94 3gsn s LEU 76 Ca 0.65 -1.20 -0.14 0.00 -0.22 0.00 0.00 54.13 53.22 3gsn s LEU 76 Cb -0.37 -2.28 -0.04 0.00 0.50 0.00 0.00 46.19 44.00 3gsn s LEU 76 CO 0.30 -0.75 0.33 -0.60 -1.32 0.00 0.00 176.35 174.31 3gsn s ARG 77 N 2.01 4.12 -0.99 1.98 6.06 -0.40 0.17 118.95 131.89 3gsn s ARG 77 Ca 0.08 0.04 -0.16 0.00 -2.50 0.00 0.00 55.73 53.19 3gsn s ARG 77 Cb -0.23 -3.56 0.16 0.00 0.06 0.00 0.00 34.95 31.39 3gsn s ARG 77 CO 0.08 -0.05 1.14 -0.51 -2.50 0.00 0.00 175.30 173.46 3gsn s LEU 78 N 1.37 5.41 0.00 -0.88 1.02 0.27 -1.72 118.68 124.15 3gsn s LEU 78 Ca 0.15 -2.46 0.00 0.00 0.02 0.00 0.00 54.13 51.85 3gsn s LEU 78 Cb -0.15 -2.36 0.00 0.00 0.02 0.00 0.00 46.19 43.71 3gsn s LEU 78 CO 0.07 -0.87 0.39 0.18 0.02 0.00 0.00 176.35 176.15 3gsn n LEU 79 N 5.69 0.00 -3.58 1.79 4.77 -1.15 -2.91 117.00 121.61 3gsn n LEU 79 Ca 0.25 0.39 -0.29 0.00 -0.03 0.00 0.00 56.01 56.34 3gsn n LEU 79 Cb 0.47 -0.14 -0.15 0.00 -2.33 0.00 0.00 43.42 41.26 3gsn n LEU 79 CO 0.50 -0.14 -0.33 -0.55 -1.33 0.00 0.00 177.39 175.54 3gsn s SER 80 N -2.35 3.44 -0.06 -1.43 0.15 -1.26 -3.98 113.70 108.21 3gsn s SER 80 Ca 0.00 -1.24 -0.32 0.00 0.70 0.00 0.00 55.95 55.09 3gsn s SER 80 Cb 0.00 -0.41 -0.10 0.00 -1.71 0.00 0.00 66.02 63.80 3gsn s SER 80 CO 0.00 -0.42 1.95 0.00 1.20 0.00 0.00 173.24 175.97 3gsn n ALA 81 N 5.20 1.19 -2.89 5.45 0.00 -0.42 -4.66 120.51 124.38 3gsn n ALA 81 Ca -0.06 0.21 -0.29 0.00 0.00 0.00 0.00 53.44 53.30 3gsn n ALA 81 Cb 0.43 -2.60 -0.04 0.00 0.00 0.00 0.00 19.45 17.24 3gsn n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gsn s ALA 82 N 4.60 3.89 -1.28 0.00 0.00 -1.26 0.93 121.76 128.64 3gsn s ALA 82 Ca 0.93 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.97 3gsn s ALA 82 Cb -0.58 -1.71 0.15 0.00 0.00 0.00 0.00 23.12 20.97 3gsn s ALA 82 CO 0.47 0.72 0.98 -2.30 0.00 0.00 0.00 175.76 175.63 3gsn n PRO 83 N 0.07 0.03 0.00 0.00 -0.02 -1.26 0.21 135.00 134.03 3gsn n PRO 83 Ca -0.06 0.32 0.13 0.00 -2.02 0.00 0.00 63.50 61.87 3gsn n PRO 83 Cb 0.52 -1.50 0.31 0.00 -0.02 0.00 0.00 33.50 32.81 3gsn n PRO 83 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3gsn n SER 84 N -1.36 1.98 -0.42 2.55 3.41 -1.26 -3.71 113.62 114.81 3gsn n SER 84 Ca 0.01 -1.58 0.12 0.00 -0.26 0.00 0.00 58.87 57.17 3gsn n SER 84 Cb 0.03 0.07 0.51 0.00 -0.26 0.00 0.00 64.21 64.56 3gsn n SER 84 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gsn n GLN 85 N 0.42 1.56 -1.94 4.33 6.02 0.13 -4.86 117.38 123.04 3gsn n GLN 85 Ca 0.15 -0.83 -0.42 0.00 -0.01 0.00 0.00 57.00 55.90 3gsn n GLN 85 Cb 0.45 -1.43 -0.03 0.00 1.02 0.00 0.00 30.24 30.25 3gsn n GLN 85 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3gsn s THR 86 N -1.92 2.59 -0.27 5.09 2.01 -1.24 -4.83 115.64 117.07 3gsn s THR 86 Ca 0.36 0.44 0.00 0.00 0.31 0.00 0.00 61.69 62.80 3gsn s THR 86 Cb 0.19 -3.28 0.00 0.00 0.01 0.00 0.00 72.50 69.41 3gsn s THR 86 CO 0.30 0.05 0.00 -0.24 -0.69 0.00 0.00 174.62 174.04 3gsn n SER 87 N 3.36 0.00 -4.31 3.53 2.88 -0.08 -5.00 113.62 114.00 3gsn n SER 87 Ca 0.11 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.32 3gsn n SER 87 Cb 0.39 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.70 3gsn n SER 87 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3gsn s VAL 88 N -2.20 2.87 0.06 2.46 1.01 -1.12 -0.42 120.40 123.06 3gsn s VAL 88 Ca 0.00 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.30 3gsn s VAL 88 Cb 0.00 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 3gsn s VAL 88 CO 0.00 0.51 0.04 -0.31 0.00 0.00 0.00 175.10 175.35 3gsn s TYR 89 N 0.67 3.13 0.02 5.22 1.51 0.32 0.16 117.35 128.38 3gsn s TYR 89 Ca -0.07 0.06 0.03 0.00 -1.01 0.00 0.00 57.07 56.08 3gsn s TYR 89 Cb -0.16 -1.62 -0.01 0.00 -0.11 0.00 0.00 41.96 40.06 3gsn s TYR 89 CO 0.02 0.50 -0.09 -0.06 -1.11 0.00 0.00 175.55 174.82 3gsn s PHE 90 N -1.29 0.76 -0.21 2.71 0.08 -0.30 -1.22 117.98 118.51 3gsn s PHE 90 Ca 0.26 -0.28 -0.01 0.00 0.12 0.00 0.00 56.93 57.03 3gsn s PHE 90 Cb -0.12 -0.46 0.02 0.00 -0.57 0.00 0.00 43.02 41.88 3gsn s PHE 90 CO 0.18 -0.02 -0.13 0.00 -0.10 0.00 0.00 175.22 175.15 3gsn s ALA 92 N 1.34 2.02 0.23 0.00 0.00 0.16 0.26 121.76 125.77 3gsn s ALA 92 Ca 0.04 -1.18 0.03 0.00 0.00 0.00 0.00 51.96 50.85 3gsn s ALA 92 Cb -0.14 -0.41 -0.05 0.00 0.00 0.00 0.00 23.12 22.52 3gsn s ALA 92 CO -0.09 0.47 0.01 -1.54 0.00 0.00 0.00 175.76 174.61 3gsn s SER 93 N -1.23 1.73 -0.08 0.00 1.04 -1.17 -0.24 113.70 113.75 3gsn s SER 93 Ca 0.10 -1.24 -0.22 0.00 0.48 0.00 0.00 55.95 55.07 3gsn s SER 93 Cb -0.09 0.03 0.05 0.00 0.10 0.00 0.00 66.02 66.11 3gsn s SER 93 CO 0.02 -0.55 0.50 -0.94 0.98 0.00 0.00 173.24 173.25 3gsn s SER 94 N -3.30 -0.45 0.15 7.02 1.04 -0.65 -2.06 113.70 115.45 3gsn s SER 94 Ca 0.29 0.57 -0.17 0.00 0.48 0.00 0.00 55.95 57.13 3gsn s SER 94 Cb 0.06 0.60 0.03 0.00 0.10 0.00 0.00 66.02 66.81 3gsn s SER 94 CO 0.09 -0.44 1.76 1.55 0.98 0.00 0.00 173.24 177.19 3gsn h PRO 95 N 3.94 0.29 -4.98 4.02 0.13 -1.87 -2.87 132.00 130.66 3gsn h PRO 95 Ca -0.28 -0.02 -0.64 0.00 -0.87 0.00 0.00 66.00 64.19 3gsn h PRO 95 Cb 1.16 -0.07 -0.34 0.00 0.13 0.00 0.00 31.00 31.88 3gsn h PRO 95 CO 0.34 0.19 -0.85 0.14 -0.23 0.00 0.00 178.00 177.58 3gsn s VAL 96 N -6.16 1.83 0.45 1.56 -7.23 -1.26 -2.45 120.40 107.13 3gsn s VAL 96 Ca -0.13 -0.83 -0.25 0.00 -1.81 0.00 0.00 61.98 58.96 3gsn s VAL 96 Cb 0.11 -1.64 -0.08 0.00 0.56 0.00 0.00 36.38 35.33 3gsn s VAL 96 CO 0.71 0.50 1.37 -0.89 -0.31 0.00 0.00 175.10 176.48 3gsn s THR 97 N 1.00 2.30 0.00 5.32 2.01 -1.26 -1.76 115.64 123.25 3gsn s THR 97 Ca -0.04 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.22 3gsn s THR 97 Cb -0.15 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.21 3gsn s THR 97 CO -0.04 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.53 3gsn n GLY 98 N 0.62 0.30 3.98 4.40 0.00 -1.26 -4.97 105.19 108.26 3gsn n GLY 98 Ca 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 3gsn n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gsn s GLY 99 N -2.00 1.76 -0.00 -0.02 0.00 -0.72 -5.04 107.32 101.30 3gsn s GLY 99 Ca 0.00 -1.54 0.17 0.00 0.00 0.00 0.00 44.72 43.35 3gsn s GLY 99 CO 0.00 -0.98 0.72 0.29 0.00 0.00 0.00 173.10 173.13 3gsn n ILE 100 N -2.93 0.00 -1.24 0.90 -5.35 -1.26 -4.99 119.36 104.49 3gsn n ILE 100 Ca 0.14 -0.10 -0.39 0.00 -0.27 0.00 0.00 62.75 62.12 3gsn n ILE 100 Cb 0.60 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.48 3gsn n ILE 100 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3gsn n TYR 101 N -1.43 -2.44 -2.01 4.28 4.01 -1.26 -4.95 117.16 113.36 3gsn n TYR 101 Ca 0.03 0.52 -0.32 0.00 -0.16 0.00 0.00 57.90 57.98 3gsn n TYR 101 Cb 0.27 -1.68 0.00 0.00 -0.31 0.00 0.00 39.34 37.62 3gsn n TYR 101 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3gsn s GLY 102 N -0.97 1.90 -0.18 2.72 0.00 -1.26 -4.97 107.32 104.55 3gsn s GLY 102 Ca 0.56 0.15 -0.24 0.00 0.00 0.00 0.00 44.72 45.19 3gsn s GLY 102 CO 0.63 0.44 0.79 -0.19 0.00 0.00 0.00 173.10 174.76 3gsn s TYR 103 N -2.81 3.40 -0.36 1.90 1.51 -1.26 -4.75 117.35 114.99 3gsn s TYR 103 Ca 0.59 1.17 -0.24 0.00 -1.01 0.00 0.00 57.07 57.58 3gsn s TYR 103 Cb -0.12 -2.97 0.01 0.00 -0.11 0.00 0.00 41.96 38.76 3gsn s TYR 103 CO 0.43 -0.25 0.83 -0.08 -1.11 0.00 0.00 175.55 175.38 3gsn s THR 104 N 2.18 4.69 0.25 -0.71 -1.32 -0.87 -4.91 115.64 114.96 3gsn s THR 104 Ca 0.36 1.03 -0.15 0.00 -1.21 0.00 0.00 61.69 61.72 3gsn s THR 104 Cb -0.16 -4.24 -0.08 0.00 -1.51 0.00 0.00 72.50 66.50 3gsn s THR 104 CO 0.11 -0.44 0.66 -0.36 -2.21 0.00 0.00 174.62 172.38 3gsn s PHE 105 N 3.20 3.48 1.18 9.09 0.40 -1.26 -3.04 117.98 131.03 3gsn s PHE 105 Ca 0.34 1.15 -0.18 0.00 -0.60 0.00 0.00 56.93 57.65 3gsn s PHE 105 Cb -0.13 -2.47 0.27 0.00 0.51 0.00 0.00 43.02 41.21 3gsn s PHE 105 CO 0.17 0.24 1.08 0.20 0.70 0.00 0.00 175.22 177.61 3gsn s GLY 106 N -2.07 1.55 0.24 4.36 0.00 0.14 -4.66 107.32 106.89 3gsn s GLY 106 Ca 0.48 -0.74 -0.06 0.00 0.00 0.00 0.00 44.72 44.39 3gsn s GLY 106 CO 0.19 0.08 1.86 0.23 0.00 0.00 0.00 173.10 175.47 3gsn h SER 107 N -2.53 1.12 -0.97 1.64 0.87 -1.87 -3.44 113.55 108.36 3gsn h SER 107 Ca -0.48 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 59.98 3gsn h SER 107 Cb 1.31 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 3gsn h SER 107 CO 0.40 0.89 0.00 0.61 -0.53 0.00 0.00 176.83 178.20 3gsn n GLY 108 N -1.15 2.20 3.11 5.77 0.00 -1.26 -5.07 105.19 108.79 3gsn n GLY 108 Ca 0.10 -1.60 -0.24 0.00 0.00 0.00 0.00 46.02 44.27 3gsn n GLY 108 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gsn s THR 109 N -1.19 1.25 -0.27 2.61 -4.23 -0.36 -4.72 115.64 108.73 3gsn s THR 109 Ca 0.00 -0.64 -0.13 0.00 -1.18 0.00 0.00 61.69 59.73 3gsn s THR 109 Cb 0.00 -1.06 -0.04 0.00 1.34 0.00 0.00 72.50 72.74 3gsn s THR 109 CO 0.00 0.36 0.30 -0.13 -0.54 0.00 0.00 174.62 174.61 3gsn s ARG 110 N -0.12 4.01 -0.15 3.99 0.52 0.78 -0.52 118.95 127.46 3gsn s ARG 110 Ca 0.01 -0.08 0.02 0.00 -0.52 0.00 0.00 55.73 55.16 3gsn s ARG 110 Cb -0.09 -3.64 0.01 0.00 0.52 0.00 0.00 34.95 31.76 3gsn s ARG 110 CO 0.01 -0.21 -0.21 -1.17 0.02 0.00 0.00 175.30 173.74 3gsn s LEU 111 N 1.85 2.09 -0.13 2.53 2.96 0.44 -2.06 118.68 126.36 3gsn s LEU 111 Ca 0.12 -0.61 0.02 0.00 -0.22 0.00 0.00 54.13 53.44 3gsn s LEU 111 Cb -0.16 -1.43 -0.00 0.00 0.50 0.00 0.00 46.19 45.10 3gsn s LEU 111 CO 0.10 0.05 -0.19 0.42 -1.32 0.00 0.00 176.35 175.41 3gsn s THR 112 N 0.99 2.46 -0.40 3.68 -4.23 -0.78 -0.90 115.64 116.45 3gsn s THR 112 Ca -0.03 -0.86 -0.09 0.00 -1.18 0.00 0.00 61.69 59.53 3gsn s THR 112 Cb -0.15 -2.00 0.07 0.00 1.34 0.00 0.00 72.50 71.77 3gsn s THR 112 CO -0.06 0.54 0.23 -0.69 -0.54 0.00 0.00 174.62 174.10 3gsn s VAL 113 N 0.54 4.14 0.12 2.29 1.01 -1.26 -1.01 120.40 126.23 3gsn s VAL 113 Ca -0.12 -1.35 0.03 0.00 0.00 0.00 0.00 61.98 60.54 3gsn s VAL 113 Cb -0.16 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 3gsn s VAL 113 CO 0.04 -0.45 0.16 0.68 0.00 0.00 0.00 175.10 175.53 3gsn s VAL 114 N 1.42 4.81 0.02 2.92 -7.23 0.02 -4.62 120.40 117.74 3gsn s VAL 114 Ca 0.02 -0.80 -0.13 0.00 -1.81 0.00 0.00 61.98 59.26 3gsn s VAL 114 Cb -0.22 -3.40 -0.07 0.00 0.56 0.00 0.00 36.38 33.25 3gsn s VAL 114 CO 0.02 0.00 1.20 -0.08 -0.31 0.00 0.00 175.10 175.94 3gsn h GLU 115 N 2.73 -0.43 -6.04 4.82 4.57 -1.97 -1.70 114.58 116.56 3gsn h GLU 115 Ca -0.47 0.03 -0.68 0.00 -1.18 0.00 0.00 59.36 57.06 3gsn h GLU 115 Cb 1.18 0.10 -0.26 0.00 -0.16 0.00 0.00 28.75 29.61 3gsn h GLU 115 CO 0.67 -0.29 -0.79 0.34 -1.18 0.00 0.00 179.01 177.76 3gsn s ASP 116 N -2.78 3.83 0.00 1.04 -1.08 -1.26 -3.88 116.67 112.54 3gsn s ASP 116 Ca -0.07 -0.29 0.00 0.00 -0.52 0.00 0.00 52.55 51.67 3gsn s ASP 116 Cb 0.01 -1.01 0.00 0.00 -1.46 0.00 0.00 42.92 40.46 3gsn s ASP 116 CO 0.21 0.28 0.94 0.18 0.52 0.00 0.00 175.17 177.31 3gsn n LEU 117 N 2.71 0.00 0.01 -1.34 4.77 -1.26 -1.05 117.00 120.83 3gsn n LEU 117 Ca -0.17 0.45 0.23 0.00 -0.03 0.00 0.00 56.01 56.48 3gsn n LEU 117 Cb 0.52 -0.45 0.70 0.00 -2.33 0.00 0.00 43.42 41.87 3gsn n LEU 117 CO 0.27 -0.45 1.21 -1.13 -1.33 0.00 0.00 177.39 175.96 3gsn h ASN 118 N 0.00 0.00 0.34 -1.43 -0.00 -1.95 -2.50 115.58 110.04 3gsn h ASN 118 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 3gsn h ASN 118 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.40 3gsn h ASN 118 CO 0.00 0.00 -0.02 0.29 -0.00 0.00 0.00 177.43 177.70 3gsn n LYS 119 N -3.70 0.68 -3.12 6.67 5.02 -0.22 -4.85 118.16 118.64 3gsn n LYS 119 Ca 0.11 -0.07 -0.40 0.00 -2.02 0.00 0.00 58.31 55.93 3gsn n LYS 119 Cb 0.81 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 34.26 3gsn n LYS 119 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3gsn s VAL 120 N -2.37 5.02 -0.04 -0.18 1.01 -0.94 -4.75 120.40 118.16 3gsn s VAL 120 Ca 0.35 1.19 0.04 0.00 0.00 0.00 0.00 61.98 63.56 3gsn s VAL 120 Cb 0.21 -3.95 -0.00 0.00 0.00 0.00 0.00 36.38 32.64 3gsn s VAL 120 CO 0.43 0.12 -0.16 -0.36 0.00 0.00 0.00 175.10 175.13 3gsn s PHE 121 N 1.85 1.60 0.73 5.22 0.40 -0.21 -4.76 117.98 122.81 3gsn s PHE 121 Ca 0.29 -0.44 -0.11 0.00 -0.60 0.00 0.00 56.93 56.07 3gsn s PHE 121 Cb -0.16 -1.08 0.03 0.00 0.51 0.00 0.00 43.02 42.32 3gsn s PHE 121 CO 0.11 -0.15 1.08 -1.25 0.70 0.00 0.00 175.22 175.70 3gsn s PRO 122 N 0.03 2.63 0.68 0.24 0.04 -1.26 -1.13 135.00 136.23 3gsn s PRO 122 Ca -0.03 0.75 -0.00 0.00 0.04 0.00 0.00 61.00 61.75 3gsn s PRO 122 Cb -0.11 -1.97 0.10 0.00 0.04 0.00 0.00 34.50 32.56 3gsn s PRO 122 CO 0.02 -1.26 0.94 -1.25 0.04 0.00 0.00 177.00 175.49 3gsn s PRO 123 N -5.14 1.92 -0.33 0.56 0.04 -1.26 -4.40 135.00 126.38 3gsn s PRO 123 Ca 0.59 -1.00 0.01 0.00 0.04 0.00 0.00 61.00 60.64 3gsn s PRO 123 Cb -0.14 -2.36 0.10 0.00 0.04 0.00 0.00 34.50 32.14 3gsn s PRO 123 CO 0.54 -1.26 0.10 -1.21 0.04 0.00 0.00 177.00 175.22 3gsn s GLU 124 N -5.05 0.93 -0.01 4.56 2.02 -0.82 -4.92 118.70 115.41 3gsn s GLU 124 Ca 0.64 -1.34 -0.27 0.00 0.02 0.00 0.00 54.97 54.02 3gsn s GLU 124 Cb -0.07 -2.28 -0.04 0.00 0.10 0.00 0.00 34.13 31.84 3gsn s GLU 124 CO 0.43 -0.99 0.83 0.08 0.02 0.00 0.00 175.26 175.63 3gsn s VAL 125 N 1.34 4.88 -0.02 2.63 1.01 -1.26 -3.16 120.40 125.82 3gsn s VAL 125 Ca 0.11 1.75 -0.02 0.00 0.00 0.00 0.00 61.98 63.82 3gsn s VAL 125 Cb -0.18 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.02 3gsn s VAL 125 CO -0.19 0.25 0.04 0.00 0.00 0.00 0.00 175.10 175.20 3gsn s ALA 126 N 0.65 -0.11 0.18 5.51 0.00 -0.26 -4.31 121.76 123.42 3gsn s ALA 126 Ca 0.44 0.09 0.06 0.00 0.00 0.00 0.00 51.96 52.55 3gsn s ALA 126 Cb -0.20 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 3gsn s ALA 126 CO 0.24 -0.03 0.07 0.08 0.00 0.00 0.00 175.76 176.12 3gsn s VAL 127 N -0.07 4.10 -0.06 0.00 1.01 -1.26 -0.03 120.40 124.09 3gsn s VAL 127 Ca -0.01 -1.28 -0.01 0.00 0.00 0.00 0.00 61.98 60.67 3gsn s VAL 127 Cb -0.01 -3.09 0.03 0.00 0.00 0.00 0.00 36.38 33.31 3gsn s VAL 127 CO 0.00 -0.13 0.02 -0.36 0.00 0.00 0.00 175.10 174.63 3gsn s PHE 128 N -1.78 0.47 0.31 5.22 0.40 -0.16 -4.96 117.98 117.47 3gsn s PHE 128 Ca 0.29 -0.03 -0.29 0.00 -0.60 0.00 0.00 56.93 56.30 3gsn s PHE 128 Cb -0.09 -0.68 -0.11 0.00 0.51 0.00 0.00 43.02 42.65 3gsn s PHE 128 CO 0.21 -0.27 1.48 -1.21 0.70 0.00 0.00 175.22 176.13 3gsn s GLU 129 N 1.97 4.19 0.30 0.44 8.01 -1.26 -2.67 118.70 129.67 3gsn s GLU 129 Ca 0.04 2.46 -0.27 0.00 0.01 0.00 0.00 54.97 57.21 3gsn s GLU 129 Cb -0.12 -3.03 -0.14 0.00 -4.31 0.00 0.00 34.13 26.52 3gsn s GLU 129 CO -0.04 -0.49 0.89 -2.30 0.01 0.00 0.00 175.26 173.33 3gsn n PRO 130 N 1.50 1.07 -1.70 0.39 -0.02 -1.18 -4.81 135.00 130.26 3gsn n PRO 130 Ca 0.04 0.38 -0.42 0.00 -2.02 0.00 0.00 63.50 61.48 3gsn n PRO 130 Cb 0.39 -1.70 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 3gsn n PRO 130 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3gsn s SER 131 N -0.68 6.04 0.00 2.55 0.15 -1.26 -4.81 113.70 115.69 3gsn s SER 131 Ca 0.60 2.24 0.01 0.00 0.70 0.00 0.00 55.95 59.50 3gsn s SER 131 Cb -0.71 -2.52 0.05 0.00 -1.71 0.00 0.00 66.02 61.13 3gsn s SER 131 CO 0.59 -1.44 0.29 -0.62 1.20 0.00 0.00 173.24 173.26 3gsn n GLU 132 N 8.04 0.07 0.00 5.44 -0.58 -1.26 0.32 120.64 132.67 3gsn n GLU 132 Ca 0.24 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.98 3gsn n GLU 132 Cb 0.43 -1.20 0.00 0.00 -0.57 0.00 0.00 31.44 30.10 3gsn n GLU 132 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3gsn n ALA 133 N -0.70 1.95 0.00 0.62 0.00 -1.26 -4.30 120.51 116.83 3gsn n ALA 133 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 3gsn n ALA 133 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.40 3gsn n ALA 133 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3gsn h GLU 134 N 0.00 0.70 -0.64 0.00 4.81 -0.45 -2.99 114.58 116.01 3gsn h GLU 134 Ca 0.00 -0.60 -0.07 0.00 -0.13 0.00 0.00 59.36 58.56 3gsn h GLU 134 Cb 0.00 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 3gsn h GLU 134 CO 0.00 1.21 0.11 0.82 -0.73 0.00 0.00 179.01 180.42 3gsn h ILE 135 N 0.46 1.26 -0.00 2.32 5.03 -1.57 -2.34 117.51 122.67 3gsn h ILE 135 Ca -0.06 -1.00 0.00 0.00 -0.12 0.00 0.00 64.86 63.68 3gsn h ILE 135 Cb 1.44 0.64 0.00 0.00 -3.03 0.00 0.00 36.82 35.87 3gsn h ILE 135 CO 0.16 0.37 0.00 -0.24 -0.68 0.00 0.00 178.15 177.77 3gsn n SER 136 N -4.22 0.06 0.00 1.72 2.88 -1.20 -2.46 113.62 110.39 3gsn n SER 136 Ca 0.04 -2.00 0.00 0.00 -1.33 0.00 0.00 58.87 55.58 3gsn n SER 136 Cb 0.28 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 3gsn n SER 136 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 3gsn n HIS 137 N -0.47 0.00 -0.67 0.66 -0.00 -0.95 -4.91 115.22 108.89 3gsn n HIS 137 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 3gsn n HIS 137 Cb 0.01 0.04 0.00 0.00 -0.00 0.00 0.00 29.99 30.04 3gsn n HIS 137 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 3gsn n THR 138 N -2.67 0.00 -2.91 3.57 -2.24 -0.93 -5.03 114.28 104.08 3gsn n THR 138 Ca 0.00 -0.11 -0.09 0.00 -2.27 0.00 0.00 64.05 61.58 3gsn n THR 138 Cb 0.43 1.67 0.03 0.00 -2.10 0.00 0.00 70.33 70.36 3gsn n THR 138 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gsn n GLN 139 N -0.03 -3.06 -4.27 -0.78 1.13 -1.03 -5.03 117.38 104.30 3gsn n GLN 139 Ca 0.00 0.33 -0.17 0.00 -1.94 0.00 0.00 57.00 55.21 3gsn n GLN 139 Cb 0.17 -3.84 -0.14 0.00 0.11 0.00 0.00 30.24 26.54 3gsn n GLN 139 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3gsn s LYS 140 N -5.49 0.66 -0.04 -1.09 1.02 -1.26 -2.75 119.74 110.81 3gsn s LYS 140 Ca 0.22 -0.42 0.01 0.00 0.02 0.00 0.00 55.97 55.80 3gsn s LYS 140 Cb -0.10 -0.62 -0.03 0.00 -0.52 0.00 0.00 37.83 36.56 3gsn s LYS 140 CO 0.28 0.16 -0.03 0.00 -0.92 0.00 0.00 175.35 174.84 3gsn s ALA 141 N -0.46 3.14 -0.10 5.17 0.00 0.82 -3.58 121.76 126.75 3gsn s ALA 141 Ca 0.01 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 3gsn s ALA 141 Cb -0.05 -1.29 0.03 0.00 0.00 0.00 0.00 23.12 21.81 3gsn s ALA 141 CO 0.00 0.61 -0.02 0.99 0.00 0.00 0.00 175.76 177.34 3gsn s THR 142 N -0.95 0.57 -0.15 0.00 2.01 -1.26 -0.50 115.64 115.37 3gsn s THR 142 Ca 0.16 -0.06 -0.09 0.00 0.31 0.00 0.00 61.69 62.01 3gsn s THR 142 Cb -0.11 -0.73 -0.04 0.00 0.01 0.00 0.00 72.50 71.63 3gsn s THR 142 CO 0.06 0.24 0.15 -0.76 -0.69 0.00 0.00 174.62 173.62 3gsn s LEU 143 N 1.89 4.32 -0.18 4.42 1.02 0.23 -3.07 118.68 127.31 3gsn s LEU 143 Ca 0.04 0.41 -0.00 0.00 0.02 0.00 0.00 54.13 54.60 3gsn s LEU 143 Cb -0.13 -2.11 0.01 0.00 0.02 0.00 0.00 46.19 43.98 3gsn s LEU 143 CO -0.06 0.31 -0.15 -0.69 0.02 0.00 0.00 176.35 175.78 3gsn s VAL 144 N -0.48 2.56 -0.15 -1.59 1.01 -1.09 0.13 120.40 120.79 3gsn s VAL 144 Ca 0.13 -0.79 -0.08 0.00 0.00 0.00 0.00 61.98 61.24 3gsn s VAL 144 Cb -0.12 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 3gsn s VAL 144 CO 0.02 0.51 0.13 0.00 0.00 0.00 0.00 175.10 175.76 3gsn s LEU 146 N -0.52 0.72 -0.15 0.00 2.96 0.96 -1.29 118.68 121.35 3gsn s LEU 146 Ca 0.12 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.46 3gsn s LEU 146 Cb -0.12 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.11 3gsn s LEU 146 CO 0.02 -0.29 0.07 0.00 -1.32 0.00 0.00 176.35 174.83 3gsn s ALA 147 N 1.99 3.50 0.18 5.97 0.00 0.60 -1.10 121.76 132.89 3gsn s ALA 147 Ca 0.02 -0.73 -0.01 0.00 0.00 0.00 0.00 51.96 51.24 3gsn s ALA 147 Cb -0.15 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.05 3gsn s ALA 147 CO -0.07 0.34 0.09 0.95 0.00 0.00 0.00 175.76 177.06 3gsn s THR 148 N -0.13 0.14 -1.21 0.00 -4.23 -1.19 -1.02 115.64 108.00 3gsn s THR 148 Ca 0.07 -1.96 -0.01 0.00 -1.18 0.00 0.00 61.69 58.61 3gsn s THR 148 Cb -0.12 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.42 3gsn s THR 148 CO 0.01 -0.22 1.01 0.61 -0.54 0.00 0.00 174.62 175.49 3gsn n GLY 149 N -0.21 -0.37 3.42 3.99 0.00 -0.62 -1.95 105.19 109.44 3gsn n GLY 149 Ca -0.02 0.11 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 3gsn n GLY 149 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3gsn s PHE 150 N -3.35 2.15 -0.28 1.61 -0.71 -1.19 -4.46 117.98 111.75 3gsn s PHE 150 Ca 0.06 -0.39 -0.18 0.00 -1.04 0.00 0.00 56.93 55.38 3gsn s PHE 150 Cb -0.03 -1.00 0.09 0.00 -1.21 0.00 0.00 43.02 40.88 3gsn s PHE 150 CO 0.72 0.55 0.77 0.12 -1.34 0.00 0.00 175.22 176.04 3gsn s PHE 151 N -2.25 -0.89 0.95 3.49 2.19 -0.28 -0.47 117.98 120.71 3gsn s PHE 151 Ca 0.24 1.86 -0.14 0.00 0.33 0.00 0.00 56.93 59.23 3gsn s PHE 151 Cb -0.05 0.50 0.21 0.00 -1.31 0.00 0.00 43.02 42.37 3gsn s PHE 151 CO 0.11 -0.44 1.29 -1.25 1.83 0.00 0.00 175.22 176.76 3gsn s PRO 152 N 1.26 0.57 -0.55 10.12 0.04 -1.26 -1.05 135.00 144.12 3gsn s PRO 152 Ca -0.07 -0.68 -0.05 0.00 0.04 0.00 0.00 61.00 60.23 3gsn s PRO 152 Cb -0.05 -1.92 -0.12 0.00 0.04 0.00 0.00 34.50 32.45 3gsn s PRO 152 CO -0.14 -2.40 2.42 -0.40 0.04 0.00 0.00 177.00 176.51 3gsn n ASP 153 N -3.68 4.64 -4.09 6.66 5.75 -1.26 -4.78 116.55 119.80 3gsn n ASP 153 Ca 0.17 -2.26 -0.35 0.00 -0.01 0.00 0.00 54.79 52.34 3gsn n ASP 153 Cb 0.59 -1.07 -0.12 0.00 -1.03 0.00 0.00 41.12 39.50 3gsn n ASP 153 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 3gsn s HIS 154 N 2.44 3.55 0.13 2.11 3.76 -1.26 -4.85 115.29 121.17 3gsn s HIS 154 Ca 0.45 -2.63 -0.14 0.00 -0.15 0.00 0.00 55.06 52.59 3gsn s HIS 154 Cb 0.16 -3.15 0.02 0.00 1.11 0.00 0.00 32.58 30.73 3gsn s HIS 154 CO -0.02 -0.92 0.36 0.14 -0.85 0.00 0.00 174.74 173.44 3gsn s VAL 155 N 0.73 0.08 -0.05 -0.90 -7.23 -1.26 -1.03 120.40 110.74 3gsn s VAL 155 Ca 0.11 -0.82 -0.01 0.00 -1.81 0.00 0.00 61.98 59.45 3gsn s VAL 155 Cb -0.22 -1.33 0.03 0.00 0.56 0.00 0.00 36.38 35.42 3gsn s VAL 155 CO -0.04 -0.36 0.00 -1.61 -0.31 0.00 0.00 175.10 172.77 3gsn s GLU 156 N -3.84 0.49 -0.28 4.82 2.02 -0.80 -4.97 118.70 116.13 3gsn s GLU 156 Ca 0.06 0.10 -0.06 0.00 0.02 0.00 0.00 54.97 55.09 3gsn s GLU 156 Cb 0.02 -0.77 0.01 0.00 0.10 0.00 0.00 34.13 33.50 3gsn s GLU 156 CO -0.09 -0.23 0.05 -1.17 0.02 0.00 0.00 175.26 173.84 3gsn s LEU 157 N 1.57 3.71 0.46 1.80 0.20 -1.26 -2.05 118.68 123.11 3gsn s LEU 157 Ca -0.01 -0.75 0.05 0.00 0.69 0.00 0.00 54.13 54.10 3gsn s LEU 157 Cb -0.13 -1.83 -0.03 0.00 -0.43 0.00 0.00 46.19 43.77 3gsn s LEU 157 CO -0.03 -0.18 0.11 -0.94 -0.29 0.00 0.00 176.35 175.02 3gsn s SER 158 N 1.46 4.23 0.35 3.68 1.04 0.02 -4.97 113.70 119.50 3gsn s SER 158 Ca 0.02 -1.36 0.05 0.00 0.48 0.00 0.00 55.95 55.14 3gsn s SER 158 Cb -0.17 -0.02 -0.07 0.00 0.10 0.00 0.00 66.02 65.86 3gsn s SER 158 CO 0.01 -0.70 0.04 0.26 0.98 0.00 0.00 173.24 173.83 3gsn s TRP 159 N -2.74 2.11 -0.27 5.02 0.52 -1.26 -0.71 118.94 121.61 3gsn s TRP 159 Ca 0.28 -0.87 -0.02 0.00 0.02 0.00 0.00 56.10 55.51 3gsn s TRP 159 Cb 0.04 -1.41 0.16 0.00 -1.15 0.00 0.00 33.47 31.11 3gsn s TRP 159 CO 0.15 0.14 0.48 -1.58 0.02 0.00 0.00 176.95 176.16 3gsn s TRP 160 N -3.13 -1.20 -0.24 -1.98 0.52 0.36 -3.74 118.94 109.53 3gsn s TRP 160 Ca 0.36 1.23 -0.15 0.00 0.02 0.00 0.00 56.10 57.55 3gsn s TRP 160 Cb 0.09 0.27 -0.04 0.00 -1.15 0.00 0.00 33.47 32.64 3gsn s TRP 160 CO 0.16 -0.81 0.38 0.08 0.02 0.00 0.00 176.95 176.79 3gsn s VAL 161 N 2.69 5.19 0.00 4.03 1.01 -0.45 -1.25 120.40 131.62 3gsn s VAL 161 Ca 0.16 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.78 3gsn s VAL 161 Cb -0.15 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.52 3gsn s VAL 161 CO -0.19 0.21 0.00 0.59 0.00 0.00 0.00 175.10 175.71 3gsn n ASN 162 N 4.89 0.00 0.00 3.32 3.02 -0.37 -0.32 115.26 125.80 3gsn n ASN 162 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 3gsn n ASN 162 Cb 0.51 -0.80 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 3gsn n ASN 162 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gsn n GLY 163 N -1.23 -0.87 3.68 7.41 0.00 -1.26 -4.95 105.19 107.97 3gsn n GLY 163 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3gsn n GLY 163 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gsn s LYS 164 N 0.00 3.08 -0.57 1.61 3.01 0.57 -5.05 119.74 122.38 3gsn s LYS 164 Ca 0.00 -0.40 -0.28 0.00 -1.01 0.00 0.00 55.97 54.28 3gsn s LYS 164 Cb 0.00 -2.83 0.02 0.00 -1.01 0.00 0.00 37.83 34.00 3gsn s LYS 164 CO 0.00 0.66 1.38 -2.00 0.51 0.00 0.00 175.35 175.90 3gsn s GLU 165 N -0.76 3.32 0.08 1.68 2.12 -1.26 -1.34 118.70 122.55 3gsn s GLU 165 Ca 0.12 0.40 -0.13 0.00 0.36 0.00 0.00 54.97 55.71 3gsn s GLU 165 Cb -0.12 -4.11 -0.06 0.00 0.26 0.00 0.00 34.13 30.10 3gsn s GLU 165 CO 0.02 -1.92 0.46 0.14 -0.54 0.00 0.00 175.26 173.43 3gsn s VAL 166 N 5.92 4.97 -0.05 3.70 -7.23 -1.24 -4.95 120.40 121.52 3gsn s VAL 166 Ca 0.50 0.73 0.02 0.00 -1.81 0.00 0.00 61.98 61.43 3gsn s VAL 166 Cb -0.10 -3.71 -0.03 0.00 0.56 0.00 0.00 36.38 33.10 3gsn s VAL 166 CO 0.25 0.37 0.07 1.41 -0.31 0.00 0.00 175.10 176.88 3gsn n HIS 167 N 1.16 0.00 -2.15 2.82 -0.00 -1.26 -4.56 115.22 111.23 3gsn n HIS 167 Ca -0.09 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.20 3gsn n HIS 167 Cb 0.52 -0.03 -0.02 0.00 -0.00 0.00 0.00 29.99 30.46 3gsn n HIS 167 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 3gsn s SER 168 N -1.74 6.41 0.00 0.41 0.01 -1.26 -3.14 113.70 114.39 3gsn s SER 168 Ca -0.00 1.57 0.00 0.00 1.31 0.00 0.00 55.95 58.83 3gsn s SER 168 Cb 0.01 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.71 3gsn s SER 168 CO 0.09 -1.24 0.00 0.61 0.41 0.00 0.00 173.24 173.11 3gsn n GLY 169 N 4.63 1.24 3.76 3.44 0.00 -1.26 -4.93 105.19 112.07 3gsn n GLY 169 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3gsn n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gsn s VAL 170 N -2.73 4.21 -0.37 1.61 1.01 -1.19 -3.46 120.40 119.49 3gsn s VAL 170 Ca 0.00 1.93 0.00 0.00 0.00 0.00 0.00 61.98 63.91 3gsn s VAL 170 Cb 0.00 -4.25 0.14 0.00 0.00 0.00 0.00 36.38 32.27 3gsn s VAL 170 CO 0.00 0.51 0.21 -0.94 0.00 0.00 0.00 175.10 174.88 3gsn s SER 171 N -1.13 3.15 0.96 3.32 1.04 -0.86 -5.02 113.70 115.16 3gsn s SER 171 Ca 0.39 -2.23 -0.14 0.00 0.48 0.00 0.00 55.95 54.46 3gsn s SER 171 Cb -0.25 -0.54 0.17 0.00 0.10 0.00 0.00 66.02 65.50 3gsn s SER 171 CO 0.30 -0.31 1.16 -0.89 0.98 0.00 0.00 173.24 174.47 3gsn s THR 172 N 0.98 1.95 0.33 2.02 2.01 -1.26 -2.95 115.64 118.71 3gsn s THR 172 Ca 0.17 0.00 -0.22 0.00 0.31 0.00 0.00 61.69 61.95 3gsn s THR 172 Cb -0.23 -2.74 -0.10 0.00 0.01 0.00 0.00 72.50 69.44 3gsn s THR 172 CO -0.01 0.00 0.87 -1.81 -0.69 0.00 0.00 174.62 172.98 3gsn s ASP 173 N -4.10 7.10 0.19 3.53 1.01 -0.70 -4.95 116.67 118.75 3gsn s ASP 173 Ca 0.66 1.64 -0.07 0.00 0.71 0.00 0.00 52.55 55.49 3gsn s ASP 173 Cb -0.13 -2.51 0.10 0.00 1.01 0.00 0.00 42.92 41.39 3gsn s ASP 173 CO 0.54 -0.15 1.58 -0.65 0.21 0.00 0.00 175.17 176.70 3gsn h PRO 174 N 2.76 0.86 -2.99 8.23 0.11 -1.96 -3.46 132.00 135.54 3gsn h PRO 174 Ca -0.48 -0.37 -0.14 0.00 0.11 0.00 0.00 66.00 65.13 3gsn h PRO 174 Cb 1.19 -0.03 -0.23 0.00 0.11 0.00 0.00 31.00 32.04 3gsn h PRO 174 CO 0.64 1.01 -0.32 1.14 -0.21 0.00 0.00 178.00 180.26 3gsn s GLN 175 N -4.59 0.47 0.53 1.05 -2.07 -1.26 -5.14 119.66 108.65 3gsn s GLN 175 Ca -0.10 0.22 -0.22 0.00 -1.82 0.00 0.00 55.36 53.44 3gsn s GLN 175 Cb 0.13 0.22 -0.06 0.00 -1.09 0.00 0.00 33.01 32.21 3gsn s GLN 175 CO 0.85 -0.09 1.33 -2.30 -1.32 0.00 0.00 175.29 173.76 3gsn n PRO 176 N 2.35 1.70 -5.15 9.60 -0.02 -1.26 -4.97 135.00 137.25 3gsn n PRO 176 Ca -0.16 0.62 -0.32 0.00 -2.02 0.00 0.00 63.50 61.63 3gsn n PRO 176 Cb 0.57 -2.54 -0.15 0.00 -0.02 0.00 0.00 33.50 31.36 3gsn n PRO 176 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3gsn s LEU 177 N -3.15 2.31 0.31 2.45 1.43 -0.40 -4.83 118.68 116.80 3gsn s LEU 177 Ca 0.70 -0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 53.14 3gsn s LEU 177 Cb -0.43 -1.42 -0.11 0.00 0.03 0.00 0.00 46.19 44.26 3gsn s LEU 177 CO 0.50 0.33 1.58 0.29 0.23 0.00 0.00 176.35 179.28 3gsn n LYS 178 N 2.40 2.72 -0.27 1.70 5.02 -1.26 0.41 118.16 128.88 3gsn n LYS 178 Ca -0.16 0.96 -0.01 0.00 -2.02 0.00 0.00 58.31 57.08 3gsn n LYS 178 Cb 0.51 -2.74 0.12 0.00 -0.02 0.00 0.00 35.03 32.90 3gsn n LYS 178 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3gsn h GLU 179 N 4.44 0.80 -2.67 1.97 5.08 -1.04 -3.39 114.58 119.78 3gsn h GLU 179 Ca -0.48 -0.05 -0.28 0.00 -1.00 0.00 0.00 59.36 57.55 3gsn h GLU 179 Cb 1.23 -0.18 -0.35 0.00 0.50 0.00 0.00 28.75 29.95 3gsn h GLU 179 CO 0.76 0.53 -0.60 -0.65 -1.00 0.00 0.00 179.01 178.05 3gsn s GLN 180 N -6.08 0.16 0.00 2.33 1.11 -1.26 -5.03 119.66 110.89 3gsn s GLN 180 Ca -0.13 0.40 0.00 0.00 0.01 0.00 0.00 55.36 55.64 3gsn s GLN 180 Cb 0.17 -0.76 0.00 0.00 -1.01 0.00 0.00 33.01 31.41 3gsn s GLN 180 CO 0.77 -0.51 0.00 -2.30 0.01 0.00 0.00 175.29 173.26 3gsn n PRO 181 N 5.33 0.00 -3.43 2.91 -0.02 -1.26 -3.91 135.00 134.62 3gsn n PRO 181 Ca -0.05 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.22 3gsn n PRO 181 Cb 0.50 -1.27 -0.11 0.00 -0.02 0.00 0.00 33.50 32.60 3gsn n PRO 181 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gsn s ALA 182 N 0.48 -0.15 -0.30 3.55 0.00 -1.26 -4.90 121.76 119.18 3gsn s ALA 182 Ca 0.00 -0.67 -0.15 0.00 0.00 0.00 0.00 51.96 51.14 3gsn s ALA 182 Cb 0.00 -1.74 0.18 0.00 0.00 0.00 0.00 23.12 21.56 3gsn s ALA 182 CO 0.00 -1.79 1.15 -1.17 0.00 0.00 0.00 175.76 173.95 3gsn s LEU 183 N 2.09 -0.09 0.00 0.00 0.20 -1.25 -4.82 118.68 114.81 3gsn s LEU 183 Ca 0.11 -0.01 0.00 0.00 0.69 0.00 0.00 54.13 54.92 3gsn s LEU 183 Cb -0.15 0.71 0.00 0.00 -0.43 0.00 0.00 46.19 46.32 3gsn s LEU 183 CO -0.27 -0.01 0.00 -3.20 -0.29 0.00 0.00 176.35 172.57 3gsn n ASN 184 N 4.48 0.00 -0.19 3.68 2.85 -1.26 -4.70 115.26 120.13 3gsn n ASN 184 Ca 0.08 0.00 0.10 0.00 -0.11 0.00 0.00 54.58 54.66 3gsn n ASN 184 Cb 0.61 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.55 3gsn n ASN 184 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3gsn n ASP 185 N 0.00 1.38 -4.75 1.20 9.92 -1.26 -4.98 116.55 118.05 3gsn n ASP 185 Ca 0.00 -1.19 -0.41 0.00 -0.53 0.00 0.00 54.79 52.66 3gsn n ASP 185 Cb 0.00 0.80 -0.02 0.00 -0.64 0.00 0.00 41.12 41.26 3gsn n ASP 185 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 3gsn s SER 186 N -2.79 6.64 0.64 -2.24 0.15 -1.26 -5.04 113.70 109.80 3gsn s SER 186 Ca 0.12 2.71 -0.01 0.00 0.70 0.00 0.00 55.95 59.46 3gsn s SER 186 Cb 0.17 -2.63 0.09 0.00 -1.71 0.00 0.00 66.02 61.93 3gsn s SER 186 CO 0.75 -0.69 0.58 0.54 1.20 0.00 0.00 173.24 175.62 3gsn n ARG 187 N 1.90 0.08 -4.28 5.44 3.00 -1.26 -4.82 116.66 116.71 3gsn n ARG 187 Ca 0.05 -1.46 -0.23 0.00 -0.01 0.00 0.00 57.85 56.20 3gsn n ARG 187 Cb 0.40 -0.43 -0.08 0.00 0.00 0.00 0.00 32.46 32.36 3gsn n ARG 187 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 3gsn s TYR 188 N -1.76 2.63 0.05 -1.55 2.02 0.38 -0.39 117.35 118.73 3gsn s TYR 188 Ca 0.38 -0.31 0.04 0.00 -0.37 0.00 0.00 57.07 56.80 3gsn s TYR 188 Cb -0.02 -1.33 -0.03 0.00 -0.40 0.00 0.00 41.96 40.18 3gsn s TYR 188 CO 0.25 0.54 -0.11 0.00 -1.57 0.00 0.00 175.55 174.66 3gsn s LEU 190 N -1.55 -0.52 0.18 0.00 2.96 -0.19 -1.28 118.68 118.28 3gsn s LEU 190 Ca -0.05 1.21 0.03 0.00 -0.22 0.00 0.00 54.13 55.09 3gsn s LEU 190 Cb -0.10 1.87 -0.05 0.00 0.50 0.00 0.00 46.19 48.42 3gsn s LEU 190 CO 0.01 -0.22 -0.02 -0.94 -1.32 0.00 0.00 176.35 173.86 3gsn s SER 191 N 1.50 1.50 -0.21 3.68 1.04 -1.26 -0.30 113.70 119.66 3gsn s SER 191 Ca -0.10 -1.15 -0.16 0.00 0.48 0.00 0.00 55.95 55.02 3gsn s SER 191 Cb -0.07 0.06 0.06 0.00 0.10 0.00 0.00 66.02 66.17 3gsn s SER 191 CO -0.16 -0.51 0.53 -0.55 0.98 0.00 0.00 173.24 173.53 3gsn s SER 192 N -3.21 -0.61 -0.21 7.02 0.15 -0.41 -1.72 113.70 114.72 3gsn s SER 192 Ca 0.24 1.10 -0.11 0.00 0.70 0.00 0.00 55.95 57.88 3gsn s SER 192 Cb 0.05 1.07 -0.05 0.00 -1.71 0.00 0.00 66.02 65.38 3gsn s SER 192 CO 0.04 -0.20 0.17 -0.13 1.20 0.00 0.00 173.24 174.33 3gsn s ARG 193 N 0.73 4.15 -0.37 5.44 3.00 -1.15 -0.58 118.95 130.17 3gsn s ARG 193 Ca -0.04 -0.19 -0.07 0.00 0.00 0.00 0.00 55.73 55.44 3gsn s ARG 193 Cb -0.05 -3.47 0.06 0.00 0.00 0.00 0.00 34.95 31.48 3gsn s ARG 193 CO -0.05 0.18 0.15 -1.17 0.00 0.00 0.00 175.30 174.41 3gsn s LEU 194 N 0.70 4.62 -0.36 2.53 2.96 0.35 -2.03 118.68 127.46 3gsn s LEU 194 Ca 0.09 -1.33 -0.12 0.00 -0.22 0.00 0.00 54.13 52.55 3gsn s LEU 194 Cb -0.12 -1.89 0.01 0.00 0.50 0.00 0.00 46.19 44.68 3gsn s LEU 194 CO 0.02 -0.40 0.22 -0.60 -1.32 0.00 0.00 176.35 174.26 3gsn s ARG 195 N 1.38 3.12 0.42 1.98 3.52 -1.22 0.74 118.95 128.89 3gsn s ARG 195 Ca 0.00 -0.89 0.05 0.00 -0.13 0.00 0.00 55.73 54.76 3gsn s ARG 195 Cb -0.21 -3.76 -0.05 0.00 -1.56 0.00 0.00 34.95 29.37 3gsn s ARG 195 CO 0.02 -0.59 0.03 0.14 -0.81 0.00 0.00 175.30 174.09 3gsn s VAL 196 N 1.63 1.51 0.30 7.11 -7.23 0.34 -4.78 120.40 119.28 3gsn s VAL 196 Ca 0.04 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 57.94 3gsn s VAL 196 Cb -0.18 -2.68 -0.14 0.00 0.56 0.00 0.00 36.38 33.93 3gsn s VAL 196 CO 0.08 0.00 0.85 -0.24 -0.31 0.00 0.00 175.10 175.49 3gsn n SER 197 N -1.03 0.52 -0.31 4.85 2.88 -1.26 -0.13 113.62 119.15 3gsn n SER 197 Ca -0.08 1.13 0.05 0.00 -1.33 0.00 0.00 58.87 58.63 3gsn n SER 197 Cb 0.67 -1.20 0.25 0.00 -0.75 0.00 0.00 64.21 63.17 3gsn n SER 197 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3gsn h ALA 198 N 1.62 1.53 0.00 -1.46 0.00 -1.77 -2.14 119.26 117.04 3gsn h ALA 198 Ca -0.38 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3gsn h ALA 198 Cb 1.37 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3gsn h ALA 198 CO 0.58 0.32 -0.07 -2.37 0.00 0.00 0.00 179.25 177.72 3gsn n THR 199 N -4.50 0.59 0.08 0.00 5.66 -1.26 -2.36 114.28 112.49 3gsn n THR 199 Ca 0.14 -0.30 -0.11 0.00 -3.05 0.00 0.00 64.05 60.73 3gsn n THR 199 Cb 0.22 -0.54 -0.13 0.00 -1.55 0.00 0.00 70.33 68.34 3gsn n THR 199 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 3gsn h PHE 200 N 0.00 0.22 0.00 1.09 3.57 -1.74 -2.90 116.94 117.19 3gsn h PHE 200 Ca 0.00 -0.16 -0.04 0.00 3.53 0.00 0.00 57.97 61.30 3gsn h PHE 200 Cb 0.75 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 3gsn h PHE 200 CO 0.00 1.13 -0.46 2.35 -2.23 0.00 0.00 178.31 179.11 3gsn h TRP 201 N 0.03 0.00 0.00 0.41 2.91 -1.58 -3.24 115.95 114.48 3gsn h TRP 201 Ca -0.07 0.00 -0.04 0.00 1.13 0.00 0.00 58.89 59.91 3gsn h TRP 201 Cb 1.87 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 30.51 3gsn h TRP 201 CO 0.03 0.15 -0.19 0.37 -1.03 0.00 0.00 178.44 177.77 3gsn h GLN 202 N 0.00 0.00 -6.27 2.65 5.75 -1.40 -1.33 115.11 114.51 3gsn h GLN 202 Ca -0.01 0.00 -0.54 0.00 -0.15 0.00 0.00 58.65 57.95 3gsn h GLN 202 Cb 1.13 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.63 3gsn h GLN 202 CO 0.02 0.19 1.20 1.21 -2.65 0.00 0.00 178.83 178.80 3gsn s ASN 203 N -6.84 5.86 0.00 -0.69 3.84 -1.10 -2.55 114.94 113.46 3gsn s ASN 203 Ca -0.04 0.51 0.15 0.00 0.21 0.00 0.00 52.86 53.69 3gsn s ASN 203 Cb 0.15 -2.54 0.80 0.00 -0.55 0.00 0.00 41.25 39.11 3gsn s ASN 203 CO 0.68 -1.88 1.38 -2.65 -2.79 0.00 0.00 177.10 171.84 3gsn n PRO 204 N 8.74 0.30 0.00 0.43 -0.02 -1.26 -2.87 135.00 140.32 3gsn n PRO 204 Ca 0.17 0.10 0.14 0.00 -2.02 0.00 0.00 63.50 61.88 3gsn n PRO 204 Cb 0.49 -1.50 0.56 0.00 -0.02 0.00 0.00 33.50 33.04 3gsn n PRO 204 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3gsn n ARG 205 N -1.19 0.16 -3.32 -0.52 3.00 -1.26 -4.21 116.66 109.32 3gsn n ARG 205 Ca 0.08 -0.04 -0.36 0.00 -0.00 0.00 0.00 57.85 57.54 3gsn n ARG 205 Cb 0.10 -1.50 -0.06 0.00 0.00 0.00 0.00 32.46 31.00 3gsn n ARG 205 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 3gsn s ASN 206 N -2.86 6.90 -0.53 6.15 0.02 -1.14 -4.96 114.94 118.52 3gsn s ASN 206 Ca 0.18 1.15 0.00 0.00 -1.02 0.00 0.00 52.86 53.17 3gsn s ASN 206 Cb 0.19 -2.31 0.14 0.00 0.02 0.00 0.00 41.25 39.28 3gsn s ASN 206 CO 0.55 0.14 0.30 -2.28 0.02 0.00 0.00 177.10 175.83 3gsn s HIS 207 N -1.38 3.40 0.33 2.20 5.65 -1.26 -2.27 115.29 121.95 3gsn s HIS 207 Ca 0.36 -2.87 -0.26 0.00 0.25 0.00 0.00 55.06 52.54 3gsn s HIS 207 Cb -0.16 -3.04 -0.10 0.00 -1.18 0.00 0.00 32.58 28.10 3gsn s HIS 207 CO 0.19 -0.84 0.95 -0.06 -0.65 0.00 0.00 174.74 174.33 3gsn s PHE 208 N 0.13 3.66 -0.30 3.88 0.08 0.56 -1.24 117.98 124.75 3gsn s PHE 208 Ca 0.15 1.77 -0.04 0.00 0.12 0.00 0.00 56.93 58.93 3gsn s PHE 208 Cb -0.22 -2.93 0.17 0.00 -0.57 0.00 0.00 43.02 39.46 3gsn s PHE 208 CO -0.03 0.15 0.64 0.50 -0.10 0.00 0.00 175.22 176.38 3gsn s ARG 209 N -2.10 0.56 0.06 0.44 3.52 -0.38 0.20 118.95 121.24 3gsn s ARG 209 Ca 0.51 1.13 -0.18 0.00 -0.13 0.00 0.00 55.73 57.05 3gsn s ARG 209 Cb -0.19 0.65 -0.06 0.00 -1.56 0.00 0.00 34.95 33.79 3gsn s ARG 209 CO 0.24 -0.47 0.54 0.00 -0.81 0.00 0.00 175.30 174.80 3gsn s GLN 211 N -1.09 1.01 -0.22 0.00 -2.07 0.11 -3.04 119.66 114.37 3gsn s GLN 211 Ca 0.28 -1.09 -0.02 0.00 -1.82 0.00 0.00 55.36 52.71 3gsn s GLN 211 Cb -0.19 -1.18 0.07 0.00 -1.09 0.00 0.00 33.01 30.62 3gsn s GLN 211 CO 0.18 0.27 0.04 0.08 -1.32 0.00 0.00 175.29 174.54 3gsn s VAL 212 N -1.22 0.64 -0.19 3.63 1.01 -0.87 -0.80 120.40 122.60 3gsn s VAL 212 Ca 0.03 -0.78 -0.29 0.00 0.00 0.00 0.00 61.98 60.95 3gsn s VAL 212 Cb -0.10 -1.21 -0.00 0.00 0.00 0.00 0.00 36.38 35.07 3gsn s VAL 212 CO 0.04 -0.31 1.16 -1.58 0.00 0.00 0.00 175.10 174.40 3gsn s GLN 213 N 1.79 4.24 -0.17 2.72 2.00 -0.87 -2.64 119.66 126.73 3gsn s GLN 213 Ca 0.01 1.52 -0.09 0.00 -2.00 0.00 0.00 55.36 54.81 3gsn s GLN 213 Cb -0.17 -3.71 -0.05 0.00 0.80 0.00 0.00 33.01 29.88 3gsn s GLN 213 CO -0.12 -0.67 0.12 0.12 -0.50 0.00 0.00 175.29 174.24 3gsn s PHE 214 N 3.36 3.46 -0.47 1.67 5.36 -1.02 -1.90 117.98 128.44 3gsn s PHE 214 Ca 0.50 0.37 -0.13 0.00 -0.96 0.00 0.00 56.93 56.71 3gsn s PHE 214 Cb -0.19 -2.07 0.09 0.00 -0.34 0.00 0.00 43.02 40.51 3gsn s PHE 214 CO 0.11 0.44 0.37 0.71 -1.46 0.00 0.00 175.22 175.39 3gsn s TYR 215 N -0.15 3.29 0.00 10.12 2.02 -0.20 -2.45 117.35 129.98 3gsn s TYR 215 Ca 0.10 -1.25 0.00 0.00 -0.37 0.00 0.00 57.07 55.56 3gsn s TYR 215 Cb -0.11 -3.25 0.00 0.00 -0.40 0.00 0.00 41.96 38.19 3gsn s TYR 215 CO 0.00 -0.87 0.00 0.41 -1.57 0.00 0.00 175.55 173.53 3gsn n GLY 216 N 5.10 3.87 3.79 0.71 0.00 -1.26 -4.70 105.19 112.70 3gsn n GLY 216 Ca -0.12 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 3gsn n GLY 216 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gsn s LEU 217 N 0.00 3.38 -0.06 0.99 1.43 0.21 -4.45 118.68 120.18 3gsn s LEU 217 Ca 0.00 1.86 0.04 0.00 -1.03 0.00 0.00 54.13 55.00 3gsn s LEU 217 Cb 0.00 -4.53 -0.02 0.00 0.03 0.00 0.00 46.19 41.66 3gsn s LEU 217 CO 0.00 -1.44 -0.17 -0.94 0.23 0.00 0.00 176.35 174.03 3gsn s SER 218 N -2.87 3.79 -0.83 2.29 1.04 -1.26 -2.07 113.70 113.80 3gsn s SER 218 Ca 0.64 -0.29 -0.24 0.00 0.48 0.00 0.00 55.95 56.54 3gsn s SER 218 Cb -0.18 -0.92 -0.17 0.00 0.10 0.00 0.00 66.02 64.86 3gsn s SER 218 CO 0.42 0.30 2.35 -0.62 0.98 0.00 0.00 173.24 176.67 3gsn n GLU 219 N 2.61 0.46 0.00 4.02 4.71 -1.26 -1.39 120.64 129.79 3gsn n GLU 219 Ca -0.17 -0.84 0.00 0.00 -0.01 0.00 0.00 57.16 56.14 3gsn n GLU 219 Cb 0.52 -3.43 0.00 0.00 -1.01 0.00 0.00 31.44 27.52 3gsn n GLU 219 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 3gsn n ASN 220 N 17.44 0.00 -4.80 1.62 4.05 -1.26 -5.13 115.26 127.18 3gsn n ASN 220 Ca 0.48 0.00 -0.35 0.00 0.45 0.00 0.00 54.58 55.16 3gsn n ASN 220 Cb 0.41 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 41.35 3gsn n ASN 220 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 3gsn s ASP 221 N 0.00 7.11 0.26 1.20 1.01 -0.48 -5.00 116.67 120.77 3gsn s ASP 221 Ca 0.00 1.77 -0.31 0.00 0.71 0.00 0.00 52.55 54.73 3gsn s ASP 221 Cb 0.00 -2.56 -0.11 0.00 1.01 0.00 0.00 42.92 41.25 3gsn s ASP 221 CO 0.00 -0.23 1.63 -1.61 0.21 0.00 0.00 175.17 175.17 3gsn s GLU 222 N -2.63 4.13 -0.30 8.23 0.41 -1.26 -4.95 118.70 122.32 3gsn s GLU 222 Ca 0.56 2.58 0.01 0.00 -0.41 0.00 0.00 54.97 57.71 3gsn s GLU 222 Cb -0.14 -3.05 0.09 0.00 -1.78 0.00 0.00 34.13 29.26 3gsn s GLU 222 CO 0.19 -0.67 0.06 -0.46 -0.49 0.00 0.00 175.26 173.89 3gsn s TRP 223 N 0.43 2.28 -0.24 1.61 -0.00 -1.26 -5.00 118.94 116.76 3gsn s TRP 223 Ca 0.67 -2.01 0.09 0.00 -0.00 0.00 0.00 56.10 54.85 3gsn s TRP 223 Cb -0.48 -1.97 0.44 0.00 -0.00 0.00 0.00 33.47 31.46 3gsn s TRP 223 CO 0.42 -0.87 1.22 -2.37 -0.00 0.00 0.00 176.95 175.35 3gsn n THR 224 N 4.68 2.34 -4.42 5.86 5.66 -1.26 -5.04 114.28 122.09 3gsn n THR 224 Ca -0.02 -3.57 -0.25 0.00 -3.05 0.00 0.00 64.05 57.15 3gsn n THR 224 Cb 0.43 -0.56 -0.09 0.00 -1.55 0.00 0.00 70.33 68.55 3gsn n THR 224 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3gsn s GLN 225 N -3.37 1.96 0.17 1.09 -1.52 -1.26 -5.05 119.66 111.68 3gsn s GLN 225 Ca 0.43 -1.82 0.02 0.00 -1.95 0.00 0.00 55.36 52.04 3gsn s GLN 225 Cb 0.39 -1.84 0.02 0.00 -0.22 0.00 0.00 33.01 31.36 3gsn s GLN 225 CO -0.03 0.15 1.39 -0.44 -0.25 0.00 0.00 175.29 176.11 3gsn h ASP 226 N 1.91 0.29 -4.17 5.90 3.45 -2.05 -3.46 116.42 118.29 3gsn h ASP 226 Ca -0.42 -0.23 -0.49 0.00 0.43 0.00 0.00 57.03 56.32 3gsn h ASP 226 Cb 1.25 -0.09 0.13 0.00 -0.56 0.00 0.00 39.33 40.07 3gsn h ASP 226 CO 0.68 1.01 0.29 0.00 -1.57 0.00 0.00 179.24 179.64 3gsn s ARG 227 N -3.29 1.64 0.92 3.56 1.70 -1.26 -5.01 118.95 117.21 3gsn s ARG 227 Ca -0.03 0.80 -0.12 0.00 -0.47 0.00 0.00 55.73 55.90 3gsn s ARG 227 Cb 0.10 -1.85 0.07 0.00 -0.57 0.00 0.00 34.95 32.70 3gsn s ARG 227 CO 0.83 -1.97 0.69 0.00 -1.08 0.00 0.00 175.30 173.76 3gsn n ALA 228 N -3.70 -1.84 -2.66 7.88 0.00 -1.26 -4.92 120.51 114.02 3gsn n ALA 228 Ca 0.07 -0.56 -0.42 0.00 0.00 0.00 0.00 53.44 52.53 3gsn n ALA 228 Cb 0.55 -1.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.03 3gsn n ALA 228 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3gsn s LYS 229 N -3.92 4.40 -1.49 0.00 2.20 -1.26 -4.93 119.74 114.73 3gsn s LYS 229 Ca 0.61 1.43 -0.11 0.00 -0.36 0.00 0.00 55.97 57.54 3gsn s LYS 229 Cb -0.23 -3.55 -0.05 0.00 -1.51 0.00 0.00 37.83 32.49 3gsn s LYS 229 CO 0.63 -0.35 2.63 -0.35 -0.36 0.00 0.00 175.35 177.55 3gsn n PRO 230 N 5.11 3.23 -1.32 4.03 -0.04 -1.26 -4.94 135.00 139.81 3gsn n PRO 230 Ca 0.09 -2.27 -0.30 0.00 -0.04 0.00 0.00 63.50 60.98 3gsn n PRO 230 Cb 0.48 -2.95 0.23 0.00 -0.04 0.00 0.00 33.50 31.23 3gsn n PRO 230 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3gsn s VAL 231 N 2.70 1.68 -0.06 0.52 -7.23 -1.26 -0.62 120.40 116.13 3gsn s VAL 231 Ca 0.60 0.00 -0.30 0.00 -1.81 0.00 0.00 61.98 60.47 3gsn s VAL 231 Cb 0.16 -2.64 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 3gsn s VAL 231 CO -0.06 0.00 1.33 -0.89 -0.31 0.00 0.00 175.10 175.17 3gsn s THR 232 N -3.28 3.99 -0.09 5.32 2.01 -0.88 -4.28 115.64 118.43 3gsn s THR 232 Ca 0.73 1.30 -0.30 0.00 0.31 0.00 0.00 61.69 63.73 3gsn s THR 232 Cb -0.07 -3.84 0.11 0.00 0.01 0.00 0.00 72.50 68.71 3gsn s THR 232 CO 0.55 -0.04 0.91 0.00 -0.69 0.00 0.00 174.62 175.36 3gsn s GLN 233 N 2.73 0.74 0.40 4.92 0.00 -1.03 -4.95 119.66 122.48 3gsn s GLN 233 Ca 0.60 0.00 -0.13 0.00 -0.00 0.00 0.00 55.36 55.84 3gsn s GLN 233 Cb -0.27 0.35 -0.07 0.00 0.00 0.00 0.00 33.01 33.01 3gsn s GLN 233 CO 0.23 -0.27 0.80 0.42 0.00 0.00 0.00 175.29 176.47 3gsn s ILE 234 N -1.83 4.72 -0.09 3.63 -1.09 -1.26 -2.42 121.20 122.85 3gsn s ILE 234 Ca -0.01 0.80 -0.05 0.00 -2.23 0.00 0.00 60.65 59.16 3gsn s ILE 234 Cb -0.01 -3.70 0.04 0.00 -1.58 0.00 0.00 42.46 37.21 3gsn s ILE 234 CO -0.01 -0.46 0.21 -0.69 -1.23 0.00 0.00 174.94 172.76 3gsn s VAL 235 N -2.32 -0.04 -0.04 2.92 1.01 -1.08 -4.99 120.40 115.87 3gsn s VAL 235 Ca 0.53 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.66 3gsn s VAL 235 Cb -0.10 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 35.96 3gsn s VAL 235 CO 0.28 0.05 -0.08 -0.44 0.00 0.00 0.00 175.10 174.91 3gsn s SER 236 N 1.04 1.24 -0.27 3.32 0.01 -1.26 -2.04 113.70 115.74 3gsn s SER 236 Ca -0.08 -0.19 -0.08 0.00 1.31 0.00 0.00 55.95 56.91 3gsn s SER 236 Cb -0.09 -0.48 -0.02 0.00 0.21 0.00 0.00 66.02 65.64 3gsn s SER 236 CO -0.06 0.02 0.09 0.00 0.41 0.00 0.00 173.24 173.70 3gsn s ALA 237 N 0.53 3.17 0.32 1.44 0.00 -1.17 -4.95 121.76 121.10 3gsn s ALA 237 Ca -0.09 -1.24 0.08 0.00 0.00 0.00 0.00 51.96 50.71 3gsn s ALA 237 Cb -0.12 -2.16 -0.03 0.00 0.00 0.00 0.00 23.12 20.81 3gsn s ALA 237 CO 0.01 -0.65 0.21 -1.83 0.00 0.00 0.00 175.76 173.51 3gsn s GLU 238 N 1.60 2.63 0.22 0.00 -1.05 -1.26 -3.02 118.70 117.81 3gsn s GLU 238 Ca 0.05 -1.33 -0.19 0.00 -0.15 0.00 0.00 54.97 53.36 3gsn s GLU 238 Cb -0.16 -2.39 0.03 0.00 -0.44 0.00 0.00 34.13 31.17 3gsn s GLU 238 CO 0.04 0.17 0.57 0.00 0.95 0.00 0.00 175.26 176.99 3gsn s ALA 239 N -2.31 -1.02 0.07 -0.84 0.00 0.13 -4.90 121.76 112.89 3gsn s ALA 239 Ca 0.38 -0.22 0.06 0.00 0.00 0.00 0.00 51.96 52.18 3gsn s ALA 239 Cb -0.05 0.88 -0.03 0.00 0.00 0.00 0.00 23.12 23.91 3gsn s ALA 239 CO 0.25 -0.86 -0.17 -1.58 0.00 0.00 0.00 175.76 173.40 3gsn s TRP 240 N -3.88 1.44 1.26 0.00 0.52 -1.26 -0.32 118.94 116.70 3gsn s TRP 240 Ca 0.10 -0.41 -0.16 0.00 0.02 0.00 0.00 56.10 55.65 3gsn s TRP 240 Cb -0.02 -0.82 0.32 0.00 -1.15 0.00 0.00 33.47 31.80 3gsn s TRP 240 CO -0.01 0.09 0.99 0.20 0.02 0.00 0.00 176.95 178.25 3gsn s GLY 241 N -1.55 1.50 -0.29 0.98 0.00 -0.96 -4.97 107.32 102.02 3gsn s GLY 241 Ca 0.02 -0.35 -0.18 0.00 0.00 0.00 0.00 44.72 44.22 3gsn s GLY 241 CO 0.02 0.48 1.07 1.09 0.00 0.00 0.00 173.10 175.77 3gsn s ARG 242 N -4.60 0.30 -0.34 2.90 1.70 -0.50 -4.32 118.95 114.08 3gsn s ARG 242 Ca 0.69 0.49 0.07 0.00 -0.47 0.00 0.00 55.73 56.50 3gsn s ARG 242 Cb -0.22 0.08 0.50 0.00 -0.57 0.00 0.00 34.95 34.74 3gsn s ARG 242 CO 0.63 -0.06 1.51 0.00 -1.08 0.00 0.00 175.30 176.30 3gsn n ALA 243 N 3.23 4.75 0.99 7.88 0.00 -1.06 -4.45 120.51 131.85 3gsn n ALA 243 Ca -0.17 -3.29 0.12 0.00 0.00 0.00 0.00 53.44 50.10 3gsn n ALA 243 Cb 0.57 -0.82 0.10 0.00 0.00 0.00 0.00 19.45 19.30 3gsn n ALA 243 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10