#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gbl n HIS 15 N 0.00 2.65 -4.03 4.31 8.25 -1.26 -5.03 115.22 120.12 2gbl n HIS 15 Ca 0.00 -2.80 -0.14 0.00 -0.26 0.00 0.00 57.72 54.52 2gbl n HIS 15 Cb 0.00 -0.20 -0.03 0.00 1.12 0.00 0.00 29.99 30.88 2gbl n HIS 15 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2gbl n GLN 16 N -0.45 0.73 0.00 -0.41 3.00 -1.26 -5.18 117.38 113.82 2gbl n GLN 16 Ca 0.31 -2.73 0.00 0.00 -0.01 0.00 0.00 57.00 54.58 2gbl n GLN 16 Cb 0.76 2.68 0.00 0.00 0.00 0.00 0.00 30.24 33.68 2gbl n GLN 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2gbl n ALA 17 N -0.71 0.00 -2.95 -1.58 0.00 -1.26 -4.93 120.51 109.08 2gbl n ALA 17 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.98 2gbl n ALA 17 Cb 0.58 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.88 2gbl n ALA 17 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2gbl s ILE 18 N 0.00 2.56 0.33 0.00 1.09 -1.26 -4.89 121.20 119.03 2gbl s ILE 18 Ca 0.00 -0.86 -0.13 0.00 -1.10 0.00 0.00 60.65 58.56 2gbl s ILE 18 Cb 0.00 -2.01 -0.08 0.00 -1.06 0.00 0.00 42.46 39.31 2gbl s ILE 18 CO 0.00 0.55 0.72 0.00 -0.10 0.00 0.00 174.94 176.11 2gbl s ALA 19 N 0.07 3.36 0.26 9.38 0.00 -1.26 -4.95 121.76 128.62 2gbl s ALA 19 Ca -0.08 -0.06 0.11 0.00 0.00 0.00 0.00 51.96 51.92 2gbl s ALA 19 Cb -0.15 -2.71 -0.05 0.00 0.00 0.00 0.00 23.12 20.21 2gbl s ALA 19 CO 0.05 0.27 -0.11 0.15 0.00 0.00 0.00 175.76 176.12 2gbl s LYS 20 N -3.19 1.96 -0.16 0.00 1.02 -1.26 -0.65 119.74 117.46 2gbl s LYS 20 Ca 0.53 -1.56 -0.03 0.00 0.02 0.00 0.00 55.97 54.92 2gbl s LYS 20 Cb -0.10 -1.97 -0.02 0.00 -0.52 0.00 0.00 37.83 35.22 2gbl s LYS 20 CO 0.21 0.36 -0.07 1.41 -0.92 0.00 0.00 175.35 176.35 2gbl s MET 21 N -3.46 3.52 0.41 1.68 -2.45 0.14 -4.81 119.30 114.34 2gbl s MET 21 Ca 0.30 -0.59 -0.25 0.00 -1.25 0.00 0.00 55.69 53.90 2gbl s MET 21 Cb -0.06 -2.85 -0.08 0.00 1.25 0.00 0.00 34.83 33.09 2gbl s MET 21 CO 0.17 0.15 1.15 1.03 1.05 0.00 0.00 175.02 178.57 2gbl s ARG 22 N 0.58 4.03 -0.01 4.11 0.52 -1.25 -1.63 118.95 125.29 2gbl s ARG 22 Ca -0.04 1.79 0.18 0.00 -0.52 0.00 0.00 55.73 57.13 2gbl s ARG 22 Cb -0.15 -2.62 -0.24 0.00 0.52 0.00 0.00 34.95 32.46 2gbl s ARG 22 CO 0.03 -0.33 0.56 0.25 0.02 0.00 0.00 175.30 175.83 2gbl n THR 23 N -0.02 0.00 -0.95 0.02 -2.24 -1.26 -4.89 114.28 104.94 2gbl n THR 23 Ca 0.05 -0.26 -0.04 0.00 -2.27 0.00 0.00 64.05 61.53 2gbl n THR 23 Cb 0.47 0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 69.21 2gbl n THR 23 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2gbl n MET 24 N -1.78 -1.86 -2.68 -0.78 0.00 -1.26 -4.74 117.12 104.02 2gbl n MET 24 Ca -0.00 0.53 -0.43 0.00 0.00 0.00 0.00 57.70 57.80 2gbl n MET 24 Cb 0.37 -4.68 -0.02 0.00 0.00 0.00 0.00 33.22 28.90 2gbl n MET 24 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 2gbl s ILE 25 N -1.16 4.71 -0.36 2.02 1.01 -1.26 -4.92 121.20 121.25 2gbl s ILE 25 Ca 0.00 2.01 -0.40 0.00 0.00 0.00 0.00 60.65 62.26 2gbl s ILE 25 Cb 0.00 -4.30 -0.15 0.00 0.01 0.00 0.00 42.46 38.01 2gbl s ILE 25 CO 0.00 -0.13 1.92 1.21 0.00 0.00 0.00 174.94 177.94 2gbl n GLU 26 N 5.95 0.84 0.00 2.79 0.00 -1.26 -1.70 120.64 127.25 2gbl n GLU 26 Ca 0.11 0.28 0.00 0.00 0.00 0.00 0.00 57.16 57.55 2gbl n GLU 26 Cb 0.47 -2.04 0.00 0.00 0.00 0.00 0.00 31.44 29.86 2gbl n GLU 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2gbl n GLY 27 N 5.37 2.72 0.38 8.31 0.00 -1.26 -1.92 105.19 118.79 2gbl n GLY 27 Ca 0.36 -0.66 0.21 0.00 0.00 0.00 0.00 46.02 45.93 2gbl n GLY 27 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2gbl h PHE 28 N 0.00 0.80 0.00 1.61 3.57 -1.61 0.20 116.94 121.51 2gbl h PHE 28 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2gbl h PHE 28 Cb 0.00 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.51 2gbl h PHE 28 CO 0.00 0.05 0.00 -0.44 -2.23 0.00 0.00 178.31 175.69 2gbl h ASP 29 N 0.46 0.00 0.10 0.41 3.32 -1.89 -1.00 116.42 117.82 2gbl h ASP 29 Ca 0.63 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.54 2gbl h ASP 29 Cb 1.44 0.00 0.02 0.00 0.22 0.00 0.00 39.33 41.00 2gbl h ASP 29 CO -0.38 0.00 -0.60 0.44 -1.72 0.00 0.00 179.24 176.99 2gbl h ASP 30 N 0.00 0.35 -0.93 6.45 3.32 -0.96 0.15 116.42 124.79 2gbl h ASP 30 Ca 0.00 -0.96 0.05 0.00 0.02 0.00 0.00 57.03 56.13 2gbl h ASP 30 Cb 0.54 -0.11 -0.06 0.00 0.22 0.00 0.00 39.33 39.92 2gbl h ASP 30 CO 0.00 1.29 0.61 0.40 -1.72 0.00 0.00 179.24 179.82 2gbl h ILE 31 N -0.53 1.13 -0.48 0.35 2.04 -1.13 -2.36 117.51 116.53 2gbl h ILE 31 Ca -0.10 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2gbl h ILE 31 Cb 1.47 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 2gbl h ILE 31 CO 0.11 0.21 0.00 -1.54 0.00 0.00 0.00 178.15 176.93 2gbl n SER 32 N -4.46 4.14 -4.15 1.72 3.41 -0.41 0.46 113.62 114.34 2gbl n SER 32 Ca 0.13 -2.49 -0.31 0.00 -0.26 0.00 0.00 58.87 55.94 2gbl n SER 32 Cb 0.14 -0.56 -0.04 0.00 -0.26 0.00 0.00 64.21 63.48 2gbl n SER 32 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2gbl n HIS 33 N 0.69 -1.59 0.00 7.33 8.25 -0.89 -3.09 115.22 125.92 2gbl n HIS 33 Ca 0.21 0.74 0.00 0.00 -0.26 0.00 0.00 57.72 58.40 2gbl n HIS 33 Cb 0.82 -3.20 0.00 0.00 1.12 0.00 0.00 29.99 28.74 2gbl n HIS 33 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gbl n GLY 34 N -1.83 1.74 0.00 -1.41 0.00 0.51 -5.00 105.19 99.19 2gbl n GLY 34 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2gbl n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gbl n GLY 35 N 0.00 -0.08 3.76 -0.02 0.00 -1.18 -3.84 105.19 103.84 2gbl n GLY 35 Ca 0.00 -2.28 -0.37 0.00 0.00 0.00 0.00 46.02 43.37 2gbl n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gbl s LEU 36 N 0.00 3.95 0.01 0.99 1.43 -0.65 -4.52 118.68 119.89 2gbl s LEU 36 Ca 0.00 2.47 -0.30 0.00 -1.03 0.00 0.00 54.13 55.27 2gbl s LEU 36 Cb 0.00 -4.26 -0.05 0.00 0.03 0.00 0.00 46.19 41.91 2gbl s LEU 36 CO 0.00 -1.16 1.37 -2.84 0.23 0.00 0.00 176.35 173.95 2gbl s PRO 37 N -2.78 4.30 0.30 1.29 0.02 -1.26 0.29 135.00 137.15 2gbl s PRO 37 Ca 0.67 1.93 -0.29 0.00 0.02 0.00 0.00 61.00 63.32 2gbl s PRO 37 Cb -0.33 -3.54 -0.11 0.00 0.02 0.00 0.00 34.50 30.55 2gbl s PRO 37 CO 0.39 -0.53 1.45 0.42 -0.33 0.00 0.00 177.00 178.40 2gbl s ILE 38 N 2.21 2.44 0.00 2.83 1.09 0.18 -2.78 121.20 127.17 2gbl s ILE 38 Ca 0.63 0.40 0.00 0.00 -1.10 0.00 0.00 60.65 60.58 2gbl s ILE 38 Cb -0.31 -3.25 0.00 0.00 -1.06 0.00 0.00 42.46 37.84 2gbl s ILE 38 CO 0.26 0.08 0.00 0.61 -0.10 0.00 0.00 174.94 175.79 2gbl n GLY 39 N 1.60 1.45 3.77 6.18 0.00 -1.26 -4.89 105.19 112.04 2gbl n GLY 39 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2gbl n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gbl s ARG 40 N -0.09 2.18 0.16 1.61 0.52 -1.12 -4.56 118.95 117.65 2gbl s ARG 40 Ca 0.00 -2.16 0.09 0.00 -0.52 0.00 0.00 55.73 53.14 2gbl s ARG 40 Cb 0.00 -1.76 -0.04 0.00 0.52 0.00 0.00 34.95 33.66 2gbl s ARG 40 CO 0.00 -0.32 -0.11 -1.54 0.02 0.00 0.00 175.30 173.35 2gbl s SER 41 N -3.94 4.20 -0.09 0.23 1.04 -1.26 -1.33 113.70 112.55 2gbl s SER 41 Ca 0.24 -0.55 0.03 0.00 0.48 0.00 0.00 55.95 56.14 2gbl s SER 41 Cb 0.03 -0.70 0.01 0.00 0.10 0.00 0.00 66.02 65.45 2gbl s SER 41 CO 0.13 0.13 -0.19 -0.89 0.98 0.00 0.00 173.24 173.40 2gbl s THR 42 N -1.55 1.69 -0.18 2.02 2.01 0.40 -3.51 115.64 116.52 2gbl s THR 42 Ca 0.23 -0.80 -0.19 0.00 0.31 0.00 0.00 61.69 61.24 2gbl s THR 42 Cb -0.09 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 70.90 2gbl s THR 42 CO 0.14 0.48 0.53 -0.22 -0.69 0.00 0.00 174.62 174.86 2gbl s LEU 43 N 0.49 4.18 -0.25 4.42 2.96 0.45 0.47 118.68 131.40 2gbl s LEU 43 Ca -0.17 0.74 0.02 0.00 -0.22 0.00 0.00 54.13 54.51 2gbl s LEU 43 Cb -0.17 -2.75 0.06 0.00 0.50 0.00 0.00 46.19 43.83 2gbl s LEU 43 CO 0.07 -0.16 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.14 2gbl s VAL 44 N 1.46 2.06 0.20 1.68 1.01 0.39 0.16 120.40 127.34 2gbl s VAL 44 Ca 0.26 -1.49 0.06 0.00 0.00 0.00 0.00 61.98 60.80 2gbl s VAL 44 Cb -0.15 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2gbl s VAL 44 CO 0.10 0.03 -0.10 -0.94 0.00 0.00 0.00 175.10 174.19 2gbl s SER 45 N 1.17 2.24 -0.03 3.32 1.04 -0.38 -1.10 113.70 119.96 2gbl s SER 45 Ca -0.07 -1.07 -0.30 0.00 0.48 0.00 0.00 55.95 54.99 2gbl s SER 45 Cb -0.19 -0.08 0.11 0.00 0.10 0.00 0.00 66.02 65.96 2gbl s SER 45 CO -0.06 -0.30 1.31 -0.83 0.98 0.00 0.00 173.24 174.34 2gbl s GLY 46 N -3.29 -0.30 0.90 7.32 0.00 -0.97 -0.74 107.32 110.24 2gbl s GLY 46 Ca 0.23 0.44 -0.13 0.00 0.00 0.00 0.00 44.72 45.25 2gbl s GLY 46 CO 0.06 2.52 1.22 -1.30 0.00 0.00 0.00 173.10 175.60 2gbl n THR 47 N -0.67 0.00 -1.71 0.90 -2.24 -1.26 -0.99 114.28 108.31 2gbl n THR 47 Ca -0.03 -1.02 -0.43 0.00 -2.27 0.00 0.00 64.05 60.29 2gbl n THR 47 Cb 0.61 -1.44 -0.01 0.00 -2.10 0.00 0.00 70.33 67.39 2gbl n THR 47 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2gbl n SER 48 N -3.68 3.15 -0.21 3.42 2.88 -1.26 -2.54 113.62 115.38 2gbl n SER 48 Ca 0.16 1.17 -0.03 0.00 -1.33 0.00 0.00 58.87 58.84 2gbl n SER 48 Cb 0.55 -1.51 -0.01 0.00 -0.75 0.00 0.00 64.21 62.49 2gbl n SER 48 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gbl n GLY 49 N 1.55 0.59 0.04 0.46 0.00 -1.26 -4.91 105.19 101.66 2gbl n GLY 49 Ca 0.08 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.70 2gbl n GLY 49 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gbl n THR 50 N -2.83 0.23 0.00 2.61 -2.24 -1.05 -4.94 114.28 106.05 2gbl n THR 50 Ca -0.03 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2gbl n THR 50 Cb 0.13 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 2gbl n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gbl n GLY 51 N 1.40 1.72 0.28 3.38 0.00 -1.26 -4.83 105.19 105.88 2gbl n GLY 51 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 2gbl n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gbl h LYS 52 N 0.00 -0.69 -0.59 1.61 1.57 -1.92 -1.32 116.57 115.24 2gbl h LYS 52 Ca 0.00 0.05 0.11 0.00 -1.87 0.00 0.00 60.65 58.94 2gbl h LYS 52 Cb 0.00 0.16 -0.11 0.00 0.08 0.00 0.00 32.23 32.35 2gbl h LYS 52 CO 0.00 -0.46 -0.27 1.15 -0.57 0.00 0.00 179.45 179.31 2gbl h THR 53 N -0.77 0.25 -0.62 -0.16 2.02 -1.96 -0.63 112.91 111.03 2gbl h THR 53 Ca -0.07 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.18 2gbl h THR 53 Cb 0.55 0.25 -0.06 0.00 -1.74 0.00 0.00 68.15 67.14 2gbl h THR 53 CO 0.12 0.00 0.30 0.25 0.37 0.00 0.00 175.52 176.56 2gbl h LEU 54 N -0.11 0.39 -0.65 2.58 5.85 -1.97 0.10 115.31 121.50 2gbl h LEU 54 Ca 0.26 0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.03 2gbl h LEU 54 Cb 0.52 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2gbl h LEU 54 CO -0.66 0.24 0.41 0.15 -0.34 0.00 0.00 178.44 178.25 2gbl h PHE 55 N 0.54 0.83 -0.19 1.25 3.57 0.02 0.50 116.94 123.46 2gbl h PHE 55 Ca 0.29 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.73 2gbl h PHE 55 Cb 0.27 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2gbl h PHE 55 CO -0.12 0.55 -0.21 0.66 -2.23 0.00 0.00 178.31 176.96 2gbl h SER 56 N 0.88 0.33 -0.01 0.41 4.64 0.41 -1.17 113.55 119.03 2gbl h SER 56 Ca 0.24 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.45 2gbl h SER 56 Cb -0.06 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 2gbl h SER 56 CO -0.05 0.55 -0.04 0.40 -0.87 0.00 0.00 176.83 176.83 2gbl h ILE 57 N 0.31 1.50 -0.51 0.95 1.08 -0.44 -3.00 117.51 117.40 2gbl h ILE 57 Ca 0.05 -1.54 0.12 0.00 -0.39 0.00 0.00 64.86 63.10 2gbl h ILE 57 Cb 0.54 2.52 -0.03 0.00 -3.07 0.00 0.00 36.82 36.79 2gbl h ILE 57 CO 0.04 0.41 0.36 -0.61 -0.69 0.00 0.00 178.15 177.65 2gbl h GLN 58 N -0.58 0.13 -0.31 2.37 4.15 -0.73 0.24 115.11 120.38 2gbl h GLN 58 Ca -0.00 -0.01 -0.16 0.00 0.77 0.00 0.00 58.65 59.25 2gbl h GLN 58 Cb 0.69 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 2gbl h GLN 58 CO 0.01 0.08 -0.45 0.35 -1.93 0.00 0.00 178.83 176.90 2gbl h PHE 59 N 0.13 0.98 0.39 3.99 3.57 -1.15 -1.01 116.94 123.84 2gbl h PHE 59 Ca 0.24 -0.31 -0.02 0.00 3.53 0.00 0.00 57.97 61.41 2gbl h PHE 59 Cb 0.78 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.33 2gbl h PHE 59 CO -0.00 1.11 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.93 2gbl h LEU 60 N 0.65 -0.44 -0.59 0.59 3.38 -1.06 -2.63 115.31 115.21 2gbl h LEU 60 Ca 0.04 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.12 2gbl h LEU 60 Cb 1.02 0.11 -0.11 0.00 0.09 0.00 0.00 40.66 41.77 2gbl h LEU 60 CO 0.10 -0.15 -0.37 0.22 0.09 0.00 0.00 178.44 178.32 2gbl h TYR 61 N -0.84 -1.05 -0.64 1.13 3.20 -0.62 0.54 116.97 118.69 2gbl h TYR 61 Ca -0.05 0.08 0.03 0.00 3.14 0.00 0.00 58.73 61.92 2gbl h TYR 61 Cb 0.40 0.55 -0.03 0.00 1.54 0.00 0.00 36.73 39.18 2gbl h TYR 61 CO 0.04 -0.40 0.42 -0.91 -1.64 0.00 0.00 178.16 175.67 2gbl h ASN 62 N -0.19 0.68 -0.21 -2.11 4.21 -1.30 0.23 115.58 116.90 2gbl h ASN 62 Ca 0.21 -0.01 0.05 0.00 1.21 0.00 0.00 56.30 57.76 2gbl h ASN 62 Cb 0.56 -0.16 -0.05 0.00 -1.12 0.00 0.00 38.32 37.54 2gbl h ASN 62 CO -0.68 0.47 -0.12 1.23 -1.29 0.00 0.00 177.43 177.04 2gbl h GLY 63 N 0.79 0.04 0.00 2.83 0.00 0.40 -1.24 103.07 105.88 2gbl h GLY 63 Ca 0.25 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.73 2gbl h GLY 63 CO -0.06 -0.14 0.00 1.39 0.00 0.00 0.00 176.54 177.73 2gbl n ILE 64 N -5.28 0.00 0.00 2.60 5.41 -0.21 -2.14 119.36 119.74 2gbl n ILE 64 Ca -0.02 1.50 0.00 0.00 1.00 0.00 0.00 62.75 65.23 2gbl n ILE 64 Cb 0.20 -2.48 0.00 0.00 -0.71 0.00 0.00 39.64 36.65 2gbl n ILE 64 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 2gbl n ILE 65 N -2.03 0.12 0.00 1.39 2.08 -0.03 -0.62 119.36 120.28 2gbl n ILE 65 Ca 0.00 0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.34 2gbl n ILE 65 Cb 0.00 -1.03 0.00 0.00 -0.75 0.00 0.00 39.64 37.86 2gbl n ILE 65 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2gbl n GLU 66 N -1.00 1.07 0.00 0.38 -0.58 -0.48 -4.82 120.64 115.22 2gbl n GLU 66 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2gbl n GLU 66 Cb 0.00 -0.08 0.00 0.00 -0.57 0.00 0.00 31.44 30.79 2gbl n GLU 66 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2gbl n PHE 67 N -0.15 0.00 -3.45 -0.32 3.01 -0.91 -5.03 117.46 110.61 2gbl n PHE 67 Ca 0.00 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.26 2gbl n PHE 67 Cb 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 39.48 39.53 2gbl n PHE 67 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2gbl n ASP 68 N 0.00 -4.82 -4.18 4.37 -0.08 0.21 -4.98 116.55 107.07 2gbl n ASP 68 Ca 0.00 -0.79 -0.36 0.00 -1.51 0.00 0.00 54.79 52.13 2gbl n ASP 68 Cb 0.10 -4.58 -0.13 0.00 2.34 0.00 0.00 41.12 38.86 2gbl n ASP 68 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2gbl s GLU 69 N -5.16 2.40 0.68 -0.67 2.02 -1.06 -4.96 118.70 111.95 2gbl s GLU 69 Ca 0.33 -1.32 -0.17 0.00 0.02 0.00 0.00 54.97 53.82 2gbl s GLU 69 Cb -0.07 -3.28 0.01 0.00 0.10 0.00 0.00 34.13 30.89 2gbl s GLU 69 CO 0.78 -0.69 1.26 -2.14 0.02 0.00 0.00 175.26 174.49 2gbl s PRO 70 N 1.26 2.41 0.08 0.39 0.02 -1.26 -3.09 135.00 134.82 2gbl s PRO 70 Ca -0.03 1.94 0.05 0.00 0.02 0.00 0.00 61.00 62.98 2gbl s PRO 70 Cb -0.20 -1.84 -0.03 0.00 0.02 0.00 0.00 34.50 32.44 2gbl s PRO 70 CO -0.01 -1.67 -0.14 0.20 -0.33 0.00 0.00 177.00 175.05 2gbl s GLY 71 N -1.64 0.90 -0.15 0.52 0.00 0.82 -0.54 107.32 107.23 2gbl s GLY 71 Ca 0.79 -1.07 -0.00 0.00 0.00 0.00 0.00 44.72 44.44 2gbl s GLY 71 CO 0.41 -1.11 -0.14 0.14 0.00 0.00 0.00 173.10 172.41 2gbl s VAL 72 N -1.56 2.86 -0.30 1.40 1.01 -0.20 -1.23 120.40 122.39 2gbl s VAL 72 Ca 0.01 -0.71 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 2gbl s VAL 72 Cb -0.08 -2.21 0.03 0.00 0.00 0.00 0.00 36.38 34.11 2gbl s VAL 72 CO 0.02 0.51 0.05 0.12 0.00 0.00 0.00 175.10 175.81 2gbl s PHE 73 N 0.66 3.18 -0.17 5.22 5.36 0.49 -1.68 117.98 131.04 2gbl s PHE 73 Ca -0.07 -1.32 -0.15 0.00 -0.96 0.00 0.00 56.93 54.43 2gbl s PHE 73 Cb -0.16 -2.21 -0.04 0.00 -0.34 0.00 0.00 43.02 40.27 2gbl s PHE 73 CO 0.02 -0.68 0.33 0.08 -1.46 0.00 0.00 175.22 173.52 2gbl s VAL 74 N 1.41 5.27 -0.05 3.12 1.01 0.06 -0.25 120.40 130.96 2gbl s VAL 74 Ca -0.00 0.61 0.04 0.00 0.00 0.00 0.00 61.98 62.64 2gbl s VAL 74 Cb -0.18 -3.67 -0.00 0.00 0.00 0.00 0.00 36.38 32.52 2gbl s VAL 74 CO 0.01 0.34 -0.19 0.28 0.00 0.00 0.00 175.10 175.54 2gbl s THR 75 N 0.79 1.58 -0.35 3.92 -1.32 -0.96 -1.41 115.64 117.89 2gbl s THR 75 Ca 0.18 -0.79 0.14 0.00 -1.21 0.00 0.00 61.69 60.00 2gbl s THR 75 Cb -0.14 -1.36 -0.18 0.00 -1.51 0.00 0.00 72.50 69.32 2gbl s THR 75 CO 0.06 0.45 0.45 0.49 -2.21 0.00 0.00 174.62 173.85 2gbl n PHE 76 N 3.18 0.00 0.08 9.09 3.01 -1.22 -0.60 117.46 131.00 2gbl n PHE 76 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.28 2gbl n PHE 76 Cb 0.53 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 39.85 2gbl n PHE 76 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2gbl n GLU 77 N -1.62 0.00 -1.46 -1.08 2.13 -1.26 -4.13 120.64 113.22 2gbl n GLU 77 Ca 0.00 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.47 2gbl n GLU 77 Cb 0.28 -0.18 0.10 0.00 0.27 0.00 0.00 31.44 31.91 2gbl n GLU 77 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2gbl s GLU 78 N -1.74 2.13 0.28 5.31 2.02 -1.26 -4.87 118.70 120.57 2gbl s GLU 78 Ca 0.00 1.94 -0.15 0.00 0.02 0.00 0.00 54.97 56.78 2gbl s GLU 78 Cb 0.00 -1.81 -0.08 0.00 0.10 0.00 0.00 34.13 32.34 2gbl s GLU 78 CO 0.00 -1.89 0.69 0.99 0.02 0.00 0.00 175.26 175.07 2gbl s THR 79 N -1.71 4.71 0.48 3.63 2.01 -1.26 -4.83 115.64 118.67 2gbl s THR 79 Ca 0.79 0.93 0.15 0.00 0.31 0.00 0.00 61.69 63.87 2gbl s THR 79 Cb -0.34 -3.67 0.30 0.00 0.01 0.00 0.00 72.50 68.81 2gbl s THR 79 CO 0.45 -0.06 2.07 -0.65 -0.69 0.00 0.00 174.62 175.73 2gbl h PRO 80 N 2.62 0.21 0.01 4.92 0.11 -1.97 0.10 132.00 138.00 2gbl h PRO 80 Ca -0.48 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 2gbl h PRO 80 Cb 1.18 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2gbl h PRO 80 CO 0.66 0.14 -0.01 1.96 -0.21 0.00 0.00 178.00 180.54 2gbl h GLN 81 N 0.22 -0.01 0.60 1.05 1.08 -1.99 -2.16 115.11 113.89 2gbl h GLN 81 Ca 0.14 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.32 2gbl h GLN 81 Cb 0.28 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 2gbl h GLN 81 CO -0.02 0.20 -0.45 -0.44 -0.95 0.00 0.00 178.83 177.17 2gbl h ASP 82 N -0.23 -1.18 -0.78 1.46 3.32 -1.69 0.46 116.42 117.78 2gbl h ASP 82 Ca -0.00 0.08 0.16 0.00 0.02 0.00 0.00 57.03 57.29 2gbl h ASP 82 Cb 0.22 0.37 -0.15 0.00 0.22 0.00 0.00 39.33 39.99 2gbl h ASP 82 CO 0.00 -0.65 -0.18 0.40 -1.72 0.00 0.00 179.24 177.09 2gbl h ILE 83 N -1.02 0.22 -0.70 0.35 5.03 -0.98 0.30 117.51 120.72 2gbl h ILE 83 Ca -0.07 -0.00 -0.04 0.00 -0.12 0.00 0.00 64.86 64.62 2gbl h ILE 83 Cb 0.85 0.22 -0.03 0.00 -3.03 0.00 0.00 36.82 34.83 2gbl h ILE 83 CO 0.02 0.00 0.28 0.40 -0.68 0.00 0.00 178.15 178.17 2gbl h ILE 84 N 0.01 1.25 0.48 -0.67 2.04 -0.73 -2.23 117.51 117.66 2gbl h ILE 84 Ca 0.38 -0.78 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 2gbl h ILE 84 Cb 0.59 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 2gbl h ILE 84 CO -0.80 0.31 -0.46 0.50 0.00 0.00 0.00 178.15 177.70 2gbl h LYS 85 N 1.00 -0.90 -0.93 2.37 1.63 0.34 -2.86 116.57 117.22 2gbl h LYS 85 Ca 0.23 0.06 0.06 0.00 -0.85 0.00 0.00 60.65 60.15 2gbl h LYS 85 Cb 0.22 0.21 -0.06 0.00 -0.60 0.00 0.00 32.23 31.99 2gbl h LYS 85 CO -0.02 -0.60 0.61 -0.91 -3.45 0.00 0.00 179.45 175.08 2gbl h ASN 86 N -0.94 0.96 0.00 4.20 2.35 -0.93 -1.76 115.58 119.47 2gbl h ASN 86 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2gbl h ASN 86 Cb 0.81 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.97 2gbl h ASN 86 CO -0.04 0.63 0.01 0.00 -1.65 0.00 0.00 177.43 176.38 2gbl n ALA 87 N -2.39 1.02 -0.10 -0.83 0.00 -0.84 -0.04 120.51 117.33 2gbl n ALA 87 Ca 0.14 0.19 -0.04 0.00 0.00 0.00 0.00 53.44 53.73 2gbl n ALA 87 Cb 0.17 -1.28 0.17 0.00 0.00 0.00 0.00 19.45 18.51 2gbl n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gbl h ARG 88 N 0.00 0.77 -1.34 0.00 3.08 -1.30 -1.67 114.38 113.92 2gbl h ARG 88 Ca 0.00 -0.20 0.40 0.00 0.07 0.00 0.00 59.98 60.25 2gbl h ARG 88 Cb 0.02 -0.09 -0.09 0.00 0.08 0.00 0.00 29.97 29.89 2gbl h ARG 88 CO 0.00 0.78 0.91 1.03 -1.07 0.00 0.00 179.97 181.62 2gbl h SER 89 N 0.72 0.19 -0.62 7.04 0.87 -0.61 0.95 113.55 122.09 2gbl h SER 89 Ca 0.14 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 2gbl h SER 89 Cb 0.43 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 2gbl h SER 89 CO 0.02 -0.05 0.00 0.49 -0.53 0.00 0.00 176.83 176.76 2gbl n PHE 90 N -4.43 1.17 -3.12 2.24 3.01 -0.66 -4.83 117.46 110.84 2gbl n PHE 90 Ca 0.33 -0.58 -0.14 0.00 1.01 0.00 0.00 57.45 58.07 2gbl n PHE 90 Cb 1.37 -0.15 0.06 0.00 -0.01 0.00 0.00 39.48 40.75 2gbl n PHE 90 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2gbl n GLY 91 N 1.12 -0.06 2.93 1.37 0.00 0.33 -4.75 105.19 106.13 2gbl n GLY 91 Ca 0.23 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 2gbl n GLY 91 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2gbl s TRP 92 N -3.22 -0.18 -0.57 1.61 -2.14 -1.03 -5.03 118.94 108.38 2gbl s TRP 92 Ca 0.25 0.52 -0.22 0.00 2.66 0.00 0.00 56.10 59.31 2gbl s TRP 92 Cb -0.11 -0.09 0.06 0.00 -3.10 0.00 0.00 33.47 30.23 2gbl s TRP 92 CO 0.48 -0.18 0.83 0.34 -2.66 0.00 0.00 176.95 175.76 2gbl s ASP 93 N 1.30 6.24 0.02 -2.66 2.15 -1.26 -3.84 116.67 118.62 2gbl s ASP 93 Ca -0.08 -0.82 -0.12 0.00 0.43 0.00 0.00 52.55 51.97 2gbl s ASP 93 Cb -0.12 -2.37 -0.33 0.00 -0.30 0.00 0.00 42.92 39.80 2gbl s ASP 93 CO -0.06 -1.18 0.95 -0.07 -0.17 0.00 0.00 175.17 174.64 2gbl h LEU 94 N 10.60 0.69 -1.71 -1.34 3.38 -1.94 -3.25 115.31 121.74 2gbl h LEU 94 Ca -0.28 -0.80 0.22 0.00 0.09 0.00 0.00 57.88 57.12 2gbl h LEU 94 Cb 1.08 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 2gbl h LEU 94 CO 1.08 1.64 0.60 0.00 0.09 0.00 0.00 178.44 181.84 2gbl h ALA 95 N 0.26 2.45 -0.13 1.53 0.00 -1.90 0.25 119.26 121.72 2gbl h ALA 95 Ca -0.25 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2gbl h ALA 95 Cb 2.11 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.91 2gbl h ALA 95 CO 0.24 -0.72 -0.18 -0.22 0.00 0.00 0.00 179.25 178.37 2gbl h LYS 96 N 0.23 0.35 -0.31 0.00 3.64 -1.99 -2.33 116.57 116.18 2gbl h LYS 96 Ca 0.44 -0.20 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 2gbl h LYS 96 Cb 1.35 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.17 2gbl h LYS 96 CO -0.11 0.78 0.01 -0.07 -2.27 0.00 0.00 179.45 177.79 2gbl h LEU 97 N -0.05 0.43 -0.53 5.20 3.38 -0.68 -0.03 115.31 123.03 2gbl h LEU 97 Ca 0.01 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2gbl h LEU 97 Cb 0.73 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 2gbl h LEU 97 CO 0.04 0.49 0.06 0.58 0.09 0.00 0.00 178.44 179.70 2gbl h VAL 98 N 0.45 1.26 -0.18 1.22 2.07 -0.72 0.41 116.25 120.76 2gbl h VAL 98 Ca 0.10 -1.00 0.01 0.00 0.82 0.00 0.00 66.70 66.63 2gbl h VAL 98 Cb 0.29 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2gbl h VAL 98 CO 0.01 0.36 0.07 0.44 0.02 0.00 0.00 177.57 178.47 2gbl h ASP 99 N 0.77 0.10 0.00 0.57 5.19 -0.78 -0.50 116.42 121.76 2gbl h ASP 99 Ca 0.16 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 2gbl h ASP 99 Cb 0.45 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.96 2gbl h ASP 99 CO 0.02 0.08 0.00 -0.62 -3.12 0.00 0.00 179.24 175.60 2gbl n GLU 100 N -5.03 1.00 -3.42 3.56 1.02 -0.10 -4.88 120.64 112.78 2gbl n GLU 100 Ca -0.03 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.86 2gbl n GLU 100 Cb 0.06 -1.09 0.05 0.00 -0.02 0.00 0.00 31.44 30.43 2gbl n GLU 100 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2gbl n GLY 101 N 0.59 -0.53 0.06 0.62 0.00 -0.20 -4.87 105.19 100.87 2gbl n GLY 101 Ca 0.05 0.19 -0.02 0.00 0.00 0.00 0.00 46.02 46.24 2gbl n GLY 101 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2gbl n LYS 102 N -4.48 0.80 -4.52 1.61 4.76 0.08 -4.94 118.16 111.46 2gbl n LYS 102 Ca -0.03 -0.08 -0.22 0.00 -2.87 0.00 0.00 58.31 55.11 2gbl n LYS 102 Cb 0.57 -1.48 -0.16 0.00 -1.84 0.00 0.00 35.03 32.12 2gbl n LYS 102 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2gbl s LEU 103 N -5.00 1.79 -0.12 -0.35 2.96 -1.00 -0.13 118.68 116.83 2gbl s LEU 103 Ca -0.09 -0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 53.58 2gbl s LEU 103 Cb 0.09 -0.69 0.03 0.00 0.50 0.00 0.00 46.19 46.12 2gbl s LEU 103 CO 0.80 0.08 -0.06 0.12 -1.32 0.00 0.00 176.35 175.97 2gbl s PHE 104 N 0.22 1.40 -0.31 5.38 5.36 -0.36 -3.81 117.98 125.86 2gbl s PHE 104 Ca -0.05 -0.72 -0.18 0.00 -0.96 0.00 0.00 56.93 55.02 2gbl s PHE 104 Cb -0.10 -1.19 -0.01 0.00 -0.34 0.00 0.00 43.02 41.38 2gbl s PHE 104 CO 0.01 -0.51 0.51 0.42 -1.46 0.00 0.00 175.22 174.20 2gbl s ILE 105 N 1.73 5.04 -0.52 3.12 1.01 -1.26 -0.38 121.20 129.94 2gbl s ILE 105 Ca 0.04 0.57 -0.17 0.00 0.00 0.00 0.00 60.65 61.09 2gbl s ILE 105 Cb -0.13 -3.90 0.09 0.00 0.01 0.00 0.00 42.46 38.53 2gbl s ILE 105 CO -0.08 -0.09 0.53 -0.22 0.00 0.00 0.00 174.94 175.08 2gbl s LEU 106 N 2.37 5.64 -0.19 2.97 2.96 0.65 -4.94 118.68 128.14 2gbl s LEU 106 Ca 0.20 -1.41 -0.29 0.00 -0.22 0.00 0.00 54.13 52.40 2gbl s LEU 106 Cb -0.15 -2.26 -0.03 0.00 0.50 0.00 0.00 46.19 44.24 2gbl s LEU 106 CO 0.12 -0.84 1.64 -0.62 -1.32 0.00 0.00 176.35 175.33 2gbl s ASP 107 N 3.11 6.41 0.00 3.68 -1.08 -1.26 -2.26 116.67 125.27 2gbl s ASP 107 Ca 0.07 1.75 0.03 0.00 -0.52 0.00 0.00 52.55 53.89 2gbl s ASP 107 Cb -0.25 -2.53 0.07 0.00 -1.46 0.00 0.00 42.92 38.74 2gbl s ASP 107 CO 0.06 -1.21 0.88 0.00 0.52 0.00 0.00 175.17 175.42 2gbl n ALA 108 N 8.29 2.24 -1.35 3.66 0.00 0.23 -4.95 120.51 128.63 2gbl n ALA 108 Ca 0.19 -0.82 -0.33 0.00 0.00 0.00 0.00 53.44 52.48 2gbl n ALA 108 Cb 0.45 -0.13 0.08 0.00 0.00 0.00 0.00 19.45 19.85 2gbl n ALA 108 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2gbl s SER 109 N -0.69 4.59 0.51 0.00 1.04 -0.93 -4.74 113.70 113.49 2gbl s SER 109 Ca 0.06 2.05 -0.12 0.00 0.48 0.00 0.00 55.95 58.42 2gbl s SER 109 Cb 0.03 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.54 2gbl s SER 109 CO 0.05 -1.98 0.91 -2.84 0.98 0.00 0.00 173.24 170.36 2gbl s PRO 110 N -4.29 3.75 0.44 4.02 0.02 -1.26 -5.03 135.00 132.64 2gbl s PRO 110 Ca 0.67 0.66 -0.17 0.00 0.02 0.00 0.00 61.00 62.18 2gbl s PRO 110 Cb -0.22 -2.22 -0.09 0.00 0.02 0.00 0.00 34.50 31.99 2gbl s PRO 110 CO 0.47 -0.28 0.91 0.34 -0.33 0.00 0.00 177.00 178.11 2gbl s ASP 111 N -3.56 6.75 0.00 2.53 -1.08 -1.26 -4.91 116.67 115.14 2gbl s ASP 111 Ca 0.54 1.52 0.00 0.00 -0.52 0.00 0.00 52.55 54.09 2gbl s ASP 111 Cb -0.10 -2.48 0.00 0.00 -1.46 0.00 0.00 42.92 38.88 2gbl s ASP 111 CO 0.40 -0.43 0.19 -2.65 0.52 0.00 0.00 175.17 173.20 2gbl n PRO 112 N -1.03 0.24 -3.09 4.34 -0.02 -1.26 -3.55 135.00 130.62 2gbl n PRO 112 Ca 0.06 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.35 2gbl n PRO 112 Cb 0.54 -1.27 -0.03 0.00 -0.02 0.00 0.00 33.50 32.72 2gbl n PRO 112 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2gbl n GLU 113 N 0.68 0.82 -1.42 -0.52 -0.58 -1.26 -5.16 120.64 113.20 2gbl n GLU 113 Ca 0.00 -2.97 -0.36 0.00 -0.42 0.00 0.00 57.16 53.42 2gbl n GLU 113 Cb 0.09 -1.38 0.09 0.00 -0.57 0.00 0.00 31.44 29.67 2gbl n GLU 113 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gbl n GLY 114 N 1.01 -0.06 3.24 0.62 0.00 -1.23 -5.08 105.19 103.69 2gbl n GLY 114 Ca 0.19 -0.31 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 2gbl n GLY 114 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gbl s GLN 115 N -3.48 1.23 0.42 1.61 -0.21 -1.26 -5.16 119.66 112.81 2gbl s GLN 115 Ca 0.76 -1.64 -0.01 0.00 0.02 0.00 0.00 55.36 54.49 2gbl s GLN 115 Cb -0.35 -0.01 -0.02 0.00 1.00 0.00 0.00 33.01 33.63 2gbl s GLN 115 CO 0.47 -0.30 0.65 -1.21 -2.12 0.00 0.00 175.29 172.78 2gbl s GLU 116 N -4.06 3.35 -0.05 2.91 0.41 -1.26 -4.92 118.70 115.09 2gbl s GLU 116 Ca 0.34 -0.25 -0.01 0.00 -0.41 0.00 0.00 54.97 54.64 2gbl s GLU 116 Cb 0.07 -2.55 0.01 0.00 -1.78 0.00 0.00 34.13 29.87 2gbl s GLU 116 CO 0.10 -0.08 0.03 0.28 -0.49 0.00 0.00 175.26 175.09 2gbl n VAL 117 N -2.01 -3.56 -3.36 2.63 0.31 -1.26 -5.06 118.33 106.02 2gbl n VAL 117 Ca -0.01 0.64 -0.26 0.00 -0.01 0.00 0.00 64.34 64.69 2gbl n VAL 117 Cb 0.56 -3.49 -0.08 0.00 -0.91 0.00 0.00 33.84 29.93 2gbl n VAL 117 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 2gbl n VAL 118 N 1.84 0.52 -0.47 2.52 0.24 -1.26 -4.93 118.33 116.78 2gbl n VAL 118 Ca -0.04 -4.44 0.00 0.00 -2.04 0.00 0.00 64.34 57.82 2gbl n VAL 118 Cb 0.26 -1.99 0.00 0.00 -1.47 0.00 0.00 33.84 30.63 2gbl n VAL 118 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2gbl n GLY 119 N 1.44 -0.14 1.41 7.63 0.00 -1.26 -4.75 105.19 109.51 2gbl n GLY 119 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2gbl n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gbl n GLY 120 N -0.10 -0.04 0.08 -0.02 0.00 -1.26 -4.60 105.19 99.25 2gbl n GLY 120 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2gbl n GLY 120 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2gbl n PHE 121 N -2.64 0.49 -0.03 1.61 1.16 -1.26 -2.03 117.46 114.76 2gbl n PHE 121 Ca 0.00 0.19 -0.13 0.00 -1.87 0.00 0.00 57.45 55.64 2gbl n PHE 121 Cb 0.00 -0.81 -0.14 0.00 -1.61 0.00 0.00 39.48 36.92 2gbl n PHE 121 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 2gbl n ASP 122 N -1.95 1.24 -0.04 5.98 5.75 -1.26 -1.73 116.55 124.54 2gbl n ASP 122 Ca 0.03 0.26 -0.12 0.00 -0.01 0.00 0.00 54.79 54.95 2gbl n ASP 122 Cb 0.21 -0.21 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 2gbl n ASP 122 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2gbl h LEU 123 N 0.02 0.23 -0.98 -2.12 7.12 -1.73 0.31 115.31 118.17 2gbl h LEU 123 Ca -0.38 -0.27 -0.09 0.00 0.13 0.00 0.00 57.88 57.27 2gbl h LEU 123 Cb 2.04 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 42.10 2gbl h LEU 123 CO 0.06 0.44 -0.43 0.77 -0.13 0.00 0.00 178.44 179.16 2gbl h SER 124 N 0.02 0.00 0.15 1.25 4.64 -1.55 -2.59 113.55 115.47 2gbl h SER 124 Ca 0.04 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.22 2gbl h SER 124 Cb 0.31 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 2gbl h SER 124 CO 0.00 0.43 -0.51 0.00 -0.87 0.00 0.00 176.83 175.88 2gbl h ALA 125 N 1.57 0.85 -0.04 5.18 0.00 -0.86 -1.26 119.26 124.71 2gbl h ALA 125 Ca -0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 2gbl h ALA 125 Cb 0.89 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2gbl h ALA 125 CO 0.06 0.67 0.00 1.25 0.00 0.00 0.00 179.25 181.23 2gbl h LEU 126 N 0.32 0.06 -1.31 0.00 5.85 -0.17 -2.27 115.31 117.80 2gbl h LEU 126 Ca 0.01 -0.28 -0.03 0.00 0.84 0.00 0.00 57.88 58.42 2gbl h LEU 126 Cb 1.00 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 2gbl h LEU 126 CO 0.09 0.33 0.13 0.40 -0.34 0.00 0.00 178.44 179.05 2gbl h ILE 127 N -0.21 1.17 0.28 4.05 1.08 -1.28 0.59 117.51 123.20 2gbl h ILE 127 Ca 0.01 -0.59 -0.00 0.00 -0.39 0.00 0.00 64.86 63.89 2gbl h ILE 127 Cb 0.29 0.71 -0.02 0.00 -3.07 0.00 0.00 36.82 34.74 2gbl h ILE 127 CO 0.00 0.22 -0.25 -0.33 -0.69 0.00 0.00 178.15 177.10 2gbl h GLU 128 N 0.60 -0.53 0.31 2.37 5.08 -1.09 1.49 114.58 122.81 2gbl h GLU 128 Ca 0.14 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 2gbl h GLU 128 Cb 0.18 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2gbl h GLU 128 CO -0.01 -0.36 -0.16 0.00 -1.00 0.00 0.00 179.01 177.48 2gbl h ARG 129 N -0.55 -0.42 0.17 2.33 3.08 -0.77 2.21 114.38 120.41 2gbl h ARG 129 Ca -0.01 0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.08 2gbl h ARG 129 Cb 0.50 0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 2gbl h ARG 129 CO -0.04 -0.28 -0.31 0.82 -1.07 0.00 0.00 179.97 179.09 2gbl h ILE 130 N -0.44 0.34 -0.17 2.04 2.04 0.32 1.17 117.51 122.82 2gbl h ILE 130 Ca -0.04 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.87 2gbl h ILE 130 Cb 0.35 0.34 -0.07 0.00 -0.74 0.00 0.00 36.82 36.70 2gbl h ILE 130 CO 0.06 0.00 -0.30 -1.13 0.00 0.00 0.00 178.15 176.78 2gbl h ASN 131 N -0.56 -0.94 -0.42 1.72 -1.24 0.24 0.35 115.58 114.73 2gbl h ASN 131 Ca 0.02 0.15 0.07 0.00 0.71 0.00 0.00 56.30 57.24 2gbl h ASN 131 Cb 0.57 0.41 -0.09 0.00 0.73 0.00 0.00 38.32 39.94 2gbl h ASN 131 CO -0.15 -0.34 -0.46 0.22 -1.29 0.00 0.00 177.43 175.41 2gbl h TYR 132 N -0.35 -1.35 -0.74 0.67 3.20 0.49 0.21 116.97 119.10 2gbl h TYR 132 Ca 0.11 0.07 0.03 0.00 3.14 0.00 0.00 58.73 62.08 2gbl h TYR 132 Cb 0.52 0.65 -0.04 0.00 1.54 0.00 0.00 36.73 39.40 2gbl h TYR 132 CO -0.41 -0.45 0.47 0.00 -1.64 0.00 0.00 178.16 176.13 2gbl h ALA 133 N 0.34 0.97 0.29 1.82 0.00 0.24 0.33 119.26 123.25 2gbl h ALA 133 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2gbl h ALA 133 Cb 0.59 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2gbl h ALA 133 CO -0.59 0.27 -0.34 0.82 0.00 0.00 0.00 179.25 179.41 2gbl h ILE 134 N 0.92 0.29 -0.40 0.00 2.04 0.10 0.14 117.51 120.61 2gbl h ILE 134 Ca 0.30 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.17 2gbl h ILE 134 Cb 0.00 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.35 2gbl h ILE 134 CO -0.11 0.00 0.24 1.56 0.00 0.00 0.00 178.15 179.84 2gbl h GLN 135 N -0.68 0.47 -0.36 2.37 4.20 -0.29 0.26 115.11 121.08 2gbl h GLN 135 Ca -0.01 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 2gbl h GLN 135 Cb 0.63 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 2gbl h GLN 135 CO -0.10 0.31 0.21 -0.22 -0.67 0.00 0.00 178.83 178.36 2gbl h LYS 136 N 0.48 0.49 -0.13 1.46 3.64 0.12 -3.01 116.57 119.62 2gbl h LYS 136 Ca 0.16 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2gbl h LYS 136 Cb 0.00 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 2gbl h LYS 136 CO -0.07 0.39 0.00 0.66 -2.27 0.00 0.00 179.45 178.16 2gbl n TYR 137 N -4.79 0.15 -3.45 1.91 4.02 0.46 -4.93 117.16 110.54 2gbl n TYR 137 Ca -0.00 -0.07 -0.17 0.00 -0.01 0.00 0.00 57.90 57.64 2gbl n TYR 137 Cb 0.06 0.00 0.09 0.00 -0.02 0.00 0.00 39.34 39.47 2gbl n TYR 137 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2gbl n ARG 138 N 1.02 -6.57 -2.55 -0.72 1.74 0.70 -4.76 116.66 105.52 2gbl n ARG 138 Ca 0.17 0.84 -0.36 0.00 -0.77 0.00 0.00 57.85 57.72 2gbl n ARG 138 Cb 0.52 -5.84 -0.04 0.00 -1.02 0.00 0.00 32.46 26.08 2gbl n ARG 138 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gbl s ALA 139 N -3.37 3.08 -0.02 7.54 0.00 0.03 -4.36 121.76 124.65 2gbl s ALA 139 Ca 0.01 0.69 0.07 0.00 0.00 0.00 0.00 51.96 52.73 2gbl s ALA 139 Cb -0.00 -3.27 -0.11 0.00 0.00 0.00 0.00 23.12 19.74 2gbl s ALA 139 CO 0.73 -0.21 0.14 0.54 0.00 0.00 0.00 175.76 176.96 2gbl n ARG 140 N -0.11 0.52 -4.51 0.00 5.12 0.29 -4.89 116.66 113.08 2gbl n ARG 140 Ca 0.05 -0.06 -0.22 0.00 -1.93 0.00 0.00 57.85 55.69 2gbl n ARG 140 Cb 0.50 -1.17 -0.14 0.00 -1.16 0.00 0.00 32.46 30.49 2gbl n ARG 140 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2gbl s ARG 141 N -2.45 1.12 0.02 5.56 0.52 -1.18 -2.73 118.95 119.81 2gbl s ARG 141 Ca -0.03 -0.75 0.01 0.00 -0.52 0.00 0.00 55.73 54.44 2gbl s ARG 141 Cb 0.04 -1.14 -0.02 0.00 0.52 0.00 0.00 34.95 34.35 2gbl s ARG 141 CO 0.29 0.29 -0.04 0.08 0.02 0.00 0.00 175.30 175.94 2gbl s VAL 142 N -0.72 0.23 -0.04 3.52 1.01 -1.01 -1.03 120.40 122.36 2gbl s VAL 142 Ca 0.04 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 2gbl s VAL 142 Cb -0.08 -0.33 0.03 0.00 0.00 0.00 0.00 36.38 36.01 2gbl s VAL 142 CO 0.01 -0.36 0.02 -0.44 0.00 0.00 0.00 175.10 174.33 2gbl s SER 143 N -1.22 0.86 -0.20 3.32 0.01 -0.67 -1.60 113.70 114.19 2gbl s SER 143 Ca -0.11 0.00 -0.04 0.00 1.31 0.00 0.00 55.95 57.11 2gbl s SER 143 Cb -0.08 -0.23 -0.02 0.00 0.21 0.00 0.00 66.02 65.90 2gbl s SER 143 CO -0.00 -0.17 -0.02 -0.63 0.41 0.00 0.00 173.24 172.82 2gbl s ILE 144 N 1.58 3.68 -0.37 1.44 1.01 0.19 -0.76 121.20 127.98 2gbl s ILE 144 Ca -0.02 -0.40 -0.14 0.00 0.00 0.00 0.00 60.65 60.09 2gbl s ILE 144 Cb -0.13 -2.66 -0.00 0.00 0.01 0.00 0.00 42.46 39.68 2gbl s ILE 144 CO -0.03 0.43 0.28 -0.62 0.00 0.00 0.00 174.94 175.00 2gbl s ASP 145 N 1.16 6.09 -0.48 3.58 3.68 -0.50 -2.01 116.67 128.20 2gbl s ASP 145 Ca 0.02 -0.60 -0.08 0.00 2.13 0.00 0.00 52.55 54.02 2gbl s ASP 145 Cb -0.15 -2.15 0.01 0.00 -1.45 0.00 0.00 42.92 39.18 2gbl s ASP 145 CO 0.00 -0.33 0.55 -1.54 0.13 0.00 0.00 175.17 173.98 2gbl n SER 146 N 5.16 -7.10 0.17 -0.34 3.41 -0.96 -3.39 113.62 110.56 2gbl n SER 146 Ca -0.12 0.26 0.02 0.00 -0.26 0.00 0.00 58.87 58.78 2gbl n SER 146 Cb 0.49 -4.78 0.29 0.00 -0.26 0.00 0.00 64.21 59.95 2gbl n SER 146 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2gbl h VAL 147 N 1.21 1.21 -0.75 -3.33 -1.51 -1.74 -3.10 116.25 108.25 2gbl h VAL 147 Ca 0.00 -1.64 0.09 0.00 -1.23 0.00 0.00 66.70 63.92 2gbl h VAL 147 Cb 0.92 1.91 -0.12 0.00 -2.13 0.00 0.00 31.29 31.88 2gbl h VAL 147 CO 0.21 0.45 -0.50 0.74 -1.23 0.00 0.00 177.57 177.24 2gbl h THR 148 N 0.00 0.03 -0.71 7.19 2.02 -1.92 -0.31 112.91 119.21 2gbl h THR 148 Ca -0.00 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.38 2gbl h THR 148 Cb 0.88 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 2gbl h THR 148 CO 0.06 0.00 0.60 0.77 0.37 0.00 0.00 175.52 177.32 2gbl h SER 149 N -0.15 0.00 0.23 4.18 4.64 -1.91 -2.59 113.55 117.96 2gbl h SER 149 Ca 0.18 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 2gbl h SER 149 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2gbl h SER 149 CO -0.80 0.00 -0.11 1.62 -0.87 0.00 0.00 176.83 176.67 2gbl h VAL 150 N 0.00 0.83 0.00 0.95 3.04 -1.20 -3.01 116.25 116.86 2gbl h VAL 150 Ca 0.34 -0.61 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 2gbl h VAL 150 Cb 1.53 1.17 0.00 0.00 -2.01 0.00 0.00 31.29 31.98 2gbl h VAL 150 CO -0.00 0.13 0.00 2.22 -1.01 0.00 0.00 177.57 178.91 2gbl n PHE 151 N -5.09 0.00 -0.50 3.17 1.16 -1.00 -3.64 117.46 111.56 2gbl n PHE 151 Ca -0.09 0.00 -0.04 0.00 -1.87 0.00 0.00 57.45 55.45 2gbl n PHE 151 Cb 0.24 -0.12 -0.05 0.00 -1.61 0.00 0.00 39.48 37.94 2gbl n PHE 151 CO 0.00 0.00 0.00 1.04 -1.87 0.00 0.00 176.76 175.93 2gbl n GLN 152 N -1.12 1.00 -0.06 3.97 1.13 -1.07 -2.48 117.38 118.75 2gbl n GLN 152 Ca 0.19 -0.30 -0.05 0.00 -1.94 0.00 0.00 57.00 54.89 2gbl n GLN 152 Cb 0.15 -1.46 -0.10 0.00 0.11 0.00 0.00 30.24 28.94 2gbl n GLN 152 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2gbl n GLN 153 N 2.09 1.77 0.00 -1.09 6.02 -1.24 -4.97 117.38 119.97 2gbl n GLN 153 Ca 0.13 -0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2gbl n GLN 153 Cb 0.47 -1.33 0.00 0.00 1.02 0.00 0.00 30.24 30.41 2gbl n GLN 153 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 2gbl n TYR 154 N -2.42 0.00 -4.18 1.08 0.18 -1.03 -5.12 117.16 105.66 2gbl n TYR 154 Ca -0.19 0.00 -0.25 0.00 1.88 0.00 0.00 57.90 59.34 2gbl n TYR 154 Cb 0.86 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.74 2gbl n TYR 154 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2gbl s ASP 155 N 0.00 4.36 -0.02 9.48 1.01 -1.18 -5.14 116.67 125.18 2gbl s ASP 155 Ca 0.00 -1.11 0.06 0.00 0.71 0.00 0.00 52.55 52.20 2gbl s ASP 155 Cb 0.00 -0.47 -0.01 0.00 1.01 0.00 0.00 42.92 43.45 2gbl s ASP 155 CO 0.00 -0.53 -0.19 0.00 0.21 0.00 0.00 175.17 174.66 2gbl s ALA 156 N -2.61 1.56 0.00 5.23 0.00 -1.26 -5.01 121.76 119.67 2gbl s ALA 156 Ca 0.40 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.57 2gbl s ALA 156 Cb 0.05 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.75 2gbl s ALA 156 CO 0.22 0.37 0.00 -1.13 0.00 0.00 0.00 175.76 175.22 2gbl n SER 157 N 2.68 0.00 -0.18 0.00 3.41 -1.26 0.88 113.62 119.14 2gbl n SER 157 Ca -0.15 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.37 2gbl n SER 157 Cb 0.53 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.52 2gbl n SER 157 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2gbl h SER 158 N 0.00 1.01 -0.13 4.04 4.64 -1.97 0.28 113.55 121.43 2gbl h SER 158 Ca 0.00 -0.31 -0.10 0.00 -0.47 0.00 0.00 61.79 60.91 2gbl h SER 158 Cb 0.00 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.80 2gbl h SER 158 CO 0.00 1.09 -0.24 0.58 -0.87 0.00 0.00 176.83 177.40 2gbl h VAL 159 N 0.92 1.27 -0.13 0.95 2.07 0.07 -1.70 116.25 119.70 2gbl h VAL 159 Ca 0.15 -1.28 -0.03 0.00 0.82 0.00 0.00 66.70 66.37 2gbl h VAL 159 Cb 0.62 1.30 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 2gbl h VAL 159 CO 0.04 0.41 -0.03 0.58 0.02 0.00 0.00 177.57 178.59 2gbl h VAL 160 N 0.50 1.28 -0.75 2.57 2.07 -1.03 -2.59 116.25 118.30 2gbl h VAL 160 Ca 0.07 -0.95 0.07 0.00 0.82 0.00 0.00 66.70 66.71 2gbl h VAL 160 Cb 0.68 1.65 -0.06 0.00 -1.52 0.00 0.00 31.29 32.04 2gbl h VAL 160 CO 0.05 0.28 0.44 -0.09 0.02 0.00 0.00 177.57 178.26 2gbl h ARG 161 N -0.05 0.76 0.31 1.57 2.43 -0.28 -1.80 114.38 117.32 2gbl h ARG 161 Ca 0.03 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2gbl h ARG 161 Cb 0.44 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2gbl h ARG 161 CO 0.01 0.51 -0.15 0.00 -1.51 0.00 0.00 179.97 178.83 2gbl h ARG 162 N 0.79 -0.40 -0.76 0.20 3.08 -1.26 -2.39 114.38 113.63 2gbl h ARG 162 Ca 0.34 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.52 2gbl h ARG 162 Cb 0.22 0.09 -0.07 0.00 0.08 0.00 0.00 29.97 30.29 2gbl h ARG 162 CO -0.19 -0.13 0.40 0.93 -1.07 0.00 0.00 179.97 179.91 2gbl h GLU 163 N -0.64 0.65 -0.10 0.04 4.39 -1.38 0.48 114.58 118.02 2gbl h GLU 163 Ca -0.04 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.62 2gbl h GLU 163 Cb 0.46 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2gbl h GLU 163 CO 0.07 0.43 0.06 -0.07 -1.16 0.00 0.00 179.01 178.34 2gbl h LEU 164 N 0.67 0.11 -0.59 1.33 3.38 -1.35 0.65 115.31 119.52 2gbl h LEU 164 Ca 0.38 -0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.43 2gbl h LEU 164 Cb 0.39 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.04 2gbl h LEU 164 CO -0.27 0.10 0.17 0.15 0.09 0.00 0.00 178.44 178.68 2gbl h PHE 165 N 0.12 0.28 0.21 1.13 3.57 -0.76 0.63 116.94 122.11 2gbl h PHE 165 Ca 0.04 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.57 2gbl h PHE 165 Cb 0.00 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 2gbl h PHE 165 CO -0.07 0.03 -0.25 -0.09 -2.23 0.00 0.00 178.31 175.70 2gbl h ARG 166 N 0.32 -0.49 0.07 1.11 2.43 -0.48 -0.63 114.38 116.70 2gbl h ARG 166 Ca 0.31 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.52 2gbl h ARG 166 Cb 0.42 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 2gbl h ARG 166 CO -0.35 -0.33 -0.15 1.25 -1.51 0.00 0.00 179.97 178.88 2gbl h LEU 167 N -0.51 -0.43 -0.31 3.80 5.85 -0.08 -0.92 115.31 122.71 2gbl h LEU 167 Ca 0.00 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.84 2gbl h LEU 167 Cb 0.49 0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.62 2gbl h LEU 167 CO -0.08 -0.22 -0.09 0.58 -0.34 0.00 0.00 178.44 178.29 2gbl h VAL 168 N -0.29 0.66 0.06 1.05 2.07 -0.84 -1.91 116.25 117.05 2gbl h VAL 168 Ca 0.03 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.57 2gbl h VAL 168 Cb 0.32 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 2gbl h VAL 168 CO -0.10 0.00 -0.36 0.00 0.02 0.00 0.00 177.57 177.13 2gbl h ALA 169 N 1.28 -0.59 -0.49 1.67 0.00 -0.84 -0.09 119.26 120.19 2gbl h ALA 169 Ca 0.15 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.08 2gbl h ALA 169 Cb 0.25 0.62 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 2gbl h ALA 169 CO -0.33 -0.90 0.21 0.00 0.00 0.00 0.00 179.25 178.22 2gbl h ARG 170 N -0.56 0.39 -0.50 0.00 2.47 -1.04 -0.90 114.38 114.24 2gbl h ARG 170 Ca 0.04 -0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.75 2gbl h ARG 170 Cb 0.61 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.82 2gbl h ARG 170 CO -0.25 0.26 0.33 -0.07 0.56 0.00 0.00 179.97 180.81 2gbl h LEU 171 N 0.41 0.55 -0.07 3.04 3.38 -0.97 -0.49 115.31 121.15 2gbl h LEU 171 Ca 0.23 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 2gbl h LEU 171 Cb 0.20 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2gbl h LEU 171 CO -0.21 0.39 0.02 0.50 0.09 0.00 0.00 178.44 179.24 2gbl h LYS 172 N 0.65 0.12 0.07 1.13 3.64 0.13 -1.46 116.57 120.84 2gbl h LYS 172 Ca 0.19 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.57 2gbl h LYS 172 Cb -0.02 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 2gbl h LYS 172 CO -0.04 0.30 -0.29 1.96 -2.27 0.00 0.00 179.45 179.10 2gbl h GLN 173 N -0.08 -0.47 -0.33 1.90 4.20 -0.42 0.32 115.11 120.23 2gbl h GLN 173 Ca 0.02 0.03 0.10 0.00 0.06 0.00 0.00 58.65 58.86 2gbl h GLN 173 Cb 0.23 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 2gbl h GLN 173 CO -0.00 -0.31 0.49 0.82 -0.67 0.00 0.00 178.83 179.15 2gbl h ILE 174 N -0.49 0.24 0.00 2.54 1.08 -0.87 -3.45 117.51 116.56 2gbl h ILE 174 Ca 0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 2gbl h ILE 174 Cb 0.54 0.59 0.00 0.00 -3.07 0.00 0.00 36.82 34.87 2gbl h ILE 174 CO -0.20 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 177.87 2gbl n GLY 175 N -1.43 0.61 3.75 5.37 0.00 0.11 -5.05 105.19 108.55 2gbl n GLY 175 Ca 0.06 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 2gbl n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gbl s ALA 176 N -2.00 3.40 -0.48 4.61 0.00 -0.95 -4.31 121.76 122.02 2gbl s ALA 176 Ca 0.00 0.87 -0.18 0.00 0.00 0.00 0.00 51.96 52.64 2gbl s ALA 176 Cb 0.00 -3.34 0.05 0.00 0.00 0.00 0.00 23.12 19.84 2gbl s ALA 176 CO 0.00 -0.17 0.57 0.99 0.00 0.00 0.00 175.76 177.14 2gbl s THR 177 N -0.81 4.95 0.03 0.00 2.01 -1.11 -3.76 115.64 116.95 2gbl s THR 177 Ca 0.46 -0.51 0.02 0.00 0.31 0.00 0.00 61.69 61.97 2gbl s THR 177 Cb -0.31 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 67.93 2gbl s THR 177 CO 0.39 -0.70 0.05 -0.89 -0.69 0.00 0.00 174.62 172.78 2gbl s THR 178 N 2.43 4.46 -0.24 -0.82 2.01 -0.44 -2.42 115.64 120.62 2gbl s THR 178 Ca 0.14 -0.62 0.01 0.00 0.31 0.00 0.00 61.69 61.52 2gbl s THR 178 Cb -0.19 -3.07 0.04 0.00 0.01 0.00 0.00 72.50 69.29 2gbl s THR 178 CO 0.12 0.26 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.51 2gbl s VAL 179 N -1.24 2.39 -0.14 3.82 1.01 -0.63 -0.45 120.40 125.16 2gbl s VAL 179 Ca 0.24 -1.27 -0.04 0.00 0.00 0.00 0.00 61.98 60.91 2gbl s VAL 179 Cb -0.12 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 2gbl s VAL 179 CO 0.16 0.17 -0.02 -0.04 0.00 0.00 0.00 175.10 175.38 2gbl s MET 180 N 1.22 3.50 -0.21 2.72 -1.94 0.18 -0.63 119.30 124.14 2gbl s MET 180 Ca -0.03 -0.47 -0.08 0.00 -1.71 0.00 0.00 55.69 53.41 2gbl s MET 180 Cb -0.17 -2.91 -0.04 0.00 2.01 0.00 0.00 34.83 33.72 2gbl s MET 180 CO -0.07 0.38 0.08 0.99 -0.01 0.00 0.00 175.02 176.39 2gbl s THR 181 N 0.00 4.72 0.16 2.05 2.01 -0.85 0.15 115.64 123.87 2gbl s THR 181 Ca 0.02 -0.05 0.06 0.00 0.31 0.00 0.00 61.69 62.03 2gbl s THR 181 Cb -0.13 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 2gbl s THR 181 CO 0.02 0.41 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.34 2gbl s THR 182 N 0.84 1.42 0.12 -0.82 2.01 -0.26 -2.27 115.64 116.68 2gbl s THR 182 Ca 0.04 -1.98 0.04 0.00 0.31 0.00 0.00 61.69 60.11 2gbl s THR 182 Cb -0.14 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 2gbl s THR 182 CO 0.02 -0.57 0.09 -1.83 -0.69 0.00 0.00 174.62 171.65 2gbl s GLU 183 N -3.30 2.83 0.37 4.92 -1.05 -1.26 -2.30 118.70 118.92 2gbl s GLU 183 Ca 0.16 -0.80 0.04 0.00 -0.15 0.00 0.00 54.97 54.22 2gbl s GLU 183 Cb -0.01 -2.66 -0.06 0.00 -0.44 0.00 0.00 34.13 30.96 2gbl s GLU 183 CO 0.03 0.53 0.05 1.03 0.95 0.00 0.00 175.26 177.85 2gbl s ARG 184 N -2.69 1.82 0.00 -4.83 0.52 -0.16 -2.35 118.95 111.25 2gbl s ARG 184 Ca 0.29 -2.04 0.00 0.00 -0.52 0.00 0.00 55.73 53.46 2gbl s ARG 184 Cb -0.11 -1.09 0.00 0.00 0.52 0.00 0.00 34.95 34.27 2gbl s ARG 184 CO 0.22 -0.21 0.00 -0.89 0.02 0.00 0.00 175.30 174.44 2gbl n ILE 185 N -0.84 0.00 -4.89 1.52 2.08 -1.26 -4.40 119.36 111.57 2gbl n ILE 185 Ca -0.05 -0.15 -0.30 0.00 0.56 0.00 0.00 62.75 62.81 2gbl n ILE 185 Cb 0.67 0.64 -0.17 0.00 -0.75 0.00 0.00 39.64 40.02 2gbl n ILE 185 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 2gbl s GLU 186 N -0.99 2.64 0.53 0.38 -6.30 -1.26 -5.01 118.70 108.69 2gbl s GLU 186 Ca 0.00 -0.73 0.22 0.00 -2.50 0.00 0.00 54.97 51.96 2gbl s GLU 186 Cb 0.00 -2.07 1.38 0.00 0.00 0.00 0.00 34.13 33.43 2gbl s GLU 186 CO 0.00 0.08 2.08 1.49 0.02 0.00 0.00 175.26 178.93 2gbl h GLU 187 N 6.97 0.00 0.00 4.30 4.57 -1.95 -3.10 114.58 125.37 2gbl h GLU 187 Ca -0.25 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 2gbl h GLU 187 Cb 1.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2gbl h GLU 187 CO 0.49 0.00 -0.14 0.66 -1.18 0.00 0.00 179.01 178.83 2gbl n TYR 188 N -4.38 0.00 -0.10 0.92 4.02 -1.26 -4.97 117.16 111.39 2gbl n TYR 188 Ca 0.03 -0.41 0.00 0.00 -0.01 0.00 0.00 57.90 57.51 2gbl n TYR 188 Cb 0.34 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.59 2gbl n TYR 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2gbl n GLY 189 N -0.55 1.38 3.57 2.72 0.00 -1.17 -5.00 105.19 106.14 2gbl n GLY 189 Ca 0.05 -1.57 -0.36 0.00 0.00 0.00 0.00 46.02 44.14 2gbl n GLY 189 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2gbl n PRO 190 N 0.00 0.39 -0.24 1.61 -0.04 -1.26 -4.87 135.00 130.59 2gbl n PRO 190 Ca 0.00 0.19 -0.08 0.00 -0.04 0.00 0.00 63.50 63.57 2gbl n PRO 190 Cb 0.00 -2.10 0.04 0.00 -0.04 0.00 0.00 33.50 31.39 2gbl n PRO 190 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2gbl h ILE 191 N -0.38 1.27 -4.04 0.52 5.03 -1.94 -3.45 117.51 114.51 2gbl h ILE 191 Ca -0.47 -1.05 -0.15 0.00 -0.12 0.00 0.00 64.86 63.07 2gbl h ILE 191 Cb 1.33 0.64 -0.11 0.00 -3.03 0.00 0.00 36.82 35.65 2gbl h ILE 191 CO 0.45 0.40 -0.30 0.00 -0.68 0.00 0.00 178.15 178.01 2gbl s ALA 192 N -5.19 0.38 0.15 1.87 0.00 -1.26 -4.71 121.76 112.99 2gbl s ALA 192 Ca -0.12 -1.25 -0.29 0.00 0.00 0.00 0.00 51.96 50.31 2gbl s ALA 192 Cb 0.14 1.20 -0.06 0.00 0.00 0.00 0.00 23.12 24.39 2gbl s ALA 192 CO 0.85 -0.75 1.49 0.54 0.00 0.00 0.00 175.76 177.89 2gbl n ARG 193 N -0.37 -0.41 0.00 0.00 1.74 -0.99 -2.73 116.66 113.91 2gbl n ARG 193 Ca 0.00 1.46 0.15 0.00 -0.77 0.00 0.00 57.85 58.69 2gbl n ARG 193 Cb 0.63 -2.16 0.73 0.00 -1.02 0.00 0.00 32.46 30.65 2gbl n ARG 193 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2gbl n TYR 194 N -5.08 0.00 -1.92 -1.55 4.02 -1.26 -4.90 117.16 106.47 2gbl n TYR 194 Ca 0.02 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.79 2gbl n TYR 194 Cb 0.24 -0.31 -0.02 0.00 -0.02 0.00 0.00 39.34 39.22 2gbl n TYR 194 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2gbl n GLY 195 N 1.32 0.38 0.00 2.72 0.00 -1.11 -4.82 105.19 103.69 2gbl n GLY 195 Ca 0.13 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2gbl n GLY 195 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2gbl n VAL 196 N -3.53 0.00 0.23 1.61 0.31 -1.26 -4.84 118.33 110.85 2gbl n VAL 196 Ca -0.14 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.27 2gbl n VAL 196 Cb 0.54 -0.35 0.62 0.00 -0.91 0.00 0.00 33.84 33.74 2gbl n VAL 196 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2gbl h GLU 197 N 0.00 0.04 -0.62 5.55 3.07 -1.90 -2.73 114.58 117.99 2gbl h GLU 197 Ca 0.00 -0.00 0.09 0.00 -0.50 0.00 0.00 59.36 58.94 2gbl h GLU 197 Cb 0.40 -0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 28.23 2gbl h GLU 197 CO 0.00 0.03 0.27 0.93 -1.40 0.00 0.00 179.01 178.84 2gbl h GLU 198 N 0.04 0.46 0.00 2.33 3.07 -1.94 -2.61 114.58 115.93 2gbl h GLU 198 Ca 0.02 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 2gbl h GLU 198 Cb 0.03 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 27.84 2gbl h GLU 198 CO -0.00 0.31 -0.62 0.74 -1.40 0.00 0.00 179.01 178.03 2gbl h PHE 199 N 0.48 0.00 0.00 4.33 0.04 -1.84 -3.33 116.94 116.62 2gbl h PHE 199 Ca 0.31 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.88 2gbl h PHE 199 Cb 0.34 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.46 2gbl h PHE 199 CO -0.14 0.00 -1.08 0.28 -0.60 0.00 0.00 178.31 176.77 2gbl h VAL 200 N 0.00 1.26 -4.00 -0.55 2.07 -1.48 -3.46 116.25 110.08 2gbl h VAL 200 Ca 0.00 -2.90 -0.47 0.00 0.82 0.00 0.00 66.70 64.15 2gbl h VAL 200 Cb 0.99 2.60 -0.01 0.00 -1.52 0.00 0.00 31.29 33.36 2gbl h VAL 200 CO 0.00 0.72 0.28 -0.44 0.02 0.00 0.00 177.57 178.15 2gbl s SER 201 N -6.45 6.75 0.24 0.57 0.01 -1.01 -4.95 113.70 108.87 2gbl s SER 201 Ca 0.00 1.51 0.17 0.00 1.31 0.00 0.00 55.95 58.94 2gbl s SER 201 Cb 0.09 -2.47 0.05 0.00 0.21 0.00 0.00 66.02 63.90 2gbl s SER 201 CO 0.81 -0.42 1.28 0.44 0.41 0.00 0.00 173.24 175.75 2gbl h ASP 202 N 1.54 0.00 -4.45 2.44 3.32 -1.90 -3.46 116.42 113.91 2gbl h ASP 202 Ca -0.48 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.30 2gbl h ASP 202 Cb 1.18 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.49 2gbl h ASP 202 CO 0.62 0.38 -0.74 0.20 -1.72 0.00 0.00 179.24 177.99 2gbl s ASN 203 N -6.13 0.65 -0.02 6.45 0.01 -1.23 -1.12 114.94 113.55 2gbl s ASN 203 Ca 0.02 -0.36 -0.00 0.00 -0.71 0.00 0.00 52.86 51.81 2gbl s ASN 203 Cb 0.08 0.01 0.02 0.00 0.41 0.00 0.00 41.25 41.77 2gbl s ASN 203 CO 0.75 -0.12 0.04 -0.69 -1.51 0.00 0.00 177.10 175.57 2gbl s VAL 204 N -0.90 -0.04 -0.06 1.60 1.01 -0.45 -0.41 120.40 121.14 2gbl s VAL 204 Ca -0.06 0.16 0.03 0.00 0.00 0.00 0.00 61.98 62.11 2gbl s VAL 204 Cb -0.07 -0.08 0.01 0.00 0.00 0.00 0.00 36.38 36.24 2gbl s VAL 204 CO 0.00 0.07 -0.13 -0.69 0.00 0.00 0.00 175.10 174.34 2gbl s VAL 205 N 0.82 1.20 -0.18 2.92 1.01 0.41 -0.82 120.40 125.77 2gbl s VAL 205 Ca -0.07 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 61.36 2gbl s VAL 205 Cb -0.10 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 2gbl s VAL 205 CO -0.03 0.37 -0.10 -0.63 0.00 0.00 0.00 175.10 174.71 2gbl s ILE 206 N 0.52 3.03 -0.22 2.22 1.01 0.48 -1.25 121.20 126.99 2gbl s ILE 206 Ca -0.12 -0.63 -0.12 0.00 0.00 0.00 0.00 60.65 59.78 2gbl s ILE 206 Cb -0.15 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.95 2gbl s ILE 206 CO 0.04 0.48 0.22 -0.76 0.00 0.00 0.00 174.94 174.92 2gbl s LEU 207 N 1.02 4.14 0.08 2.97 1.43 0.08 -0.86 118.68 127.53 2gbl s LEU 207 Ca -0.01 0.24 0.10 0.00 -1.03 0.00 0.00 54.13 53.43 2gbl s LEU 207 Cb -0.15 -2.22 -0.03 0.00 0.03 0.00 0.00 46.19 43.82 2gbl s LEU 207 CO -0.01 0.04 -0.26 -0.13 0.23 0.00 0.00 176.35 176.21 2gbl s ARG 208 N 1.03 1.65 -0.59 1.70 0.52 0.28 -4.22 118.95 119.33 2gbl s ARG 208 Ca 0.11 -1.21 0.05 0.00 -0.52 0.00 0.00 55.73 54.16 2gbl s ARG 208 Cb -0.14 -1.95 0.18 0.00 0.52 0.00 0.00 34.95 33.56 2gbl s ARG 208 CO 0.05 0.49 0.47 -1.71 0.02 0.00 0.00 175.30 174.62 2gbl n ASN 209 N 1.41 1.79 -4.71 0.23 4.05 -1.26 -0.97 115.26 115.81 2gbl n ASN 209 Ca -0.17 -2.93 -0.42 0.00 0.45 0.00 0.00 54.58 51.50 2gbl n ASN 209 Cb 0.52 -0.68 -0.03 0.00 1.23 0.00 0.00 39.78 40.83 2gbl n ASN 209 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2gbl s VAL 210 N -1.07 4.47 0.00 3.44 1.01 0.70 -4.74 120.40 124.22 2gbl s VAL 210 Ca 0.30 1.78 0.00 0.00 0.00 0.00 0.00 61.98 64.06 2gbl s VAL 210 Cb 0.02 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2gbl s VAL 210 CO -0.16 0.14 0.00 -0.11 0.00 0.00 0.00 175.10 174.97 2gbl n LEU 211 N 3.89 0.00 -1.49 3.92 7.94 -1.26 -0.72 117.00 129.28 2gbl n LEU 211 Ca 0.07 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.97 2gbl n LEU 211 Cb 0.49 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.44 2gbl n LEU 211 CO 0.54 0.00 0.00 1.21 -1.11 0.00 0.00 177.39 178.03 2gbl n GLU 212 N 0.00 0.00 -1.60 1.96 0.00 -1.25 -4.41 120.64 115.34 2gbl n GLU 212 Ca 0.00 0.50 -0.07 0.00 0.00 0.00 0.00 57.16 57.58 2gbl n GLU 212 Cb 0.00 -0.99 -0.02 0.00 0.00 0.00 0.00 31.44 30.43 2gbl n GLU 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2gbl n GLY 213 N 0.00 0.59 2.72 8.31 0.00 -1.26 -2.88 105.19 112.67 2gbl n GLY 213 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2gbl n GLY 213 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gbl n GLU 214 N -2.35 0.00 -4.06 1.61 1.02 -1.26 -5.01 120.64 110.59 2gbl n GLU 214 Ca -0.08 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.84 2gbl n GLU 214 Cb 0.38 -1.86 -0.04 0.00 -0.02 0.00 0.00 31.44 29.90 2gbl n GLU 214 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2gbl s ARG 215 N -0.09 2.94 -0.04 3.49 1.81 -1.14 -5.12 118.95 120.80 2gbl s ARG 215 Ca 0.00 -1.06 0.05 0.00 -1.72 0.00 0.00 55.73 53.00 2gbl s ARG 215 Cb 0.00 -2.58 -0.01 0.00 -0.45 0.00 0.00 34.95 31.91 2gbl s ARG 215 CO 0.00 0.36 -0.20 1.03 -0.68 0.00 0.00 175.30 175.81 2gbl s ARG 216 N -3.88 1.96 -0.08 3.54 1.81 -1.26 -3.92 118.95 117.12 2gbl s ARG 216 Ca 0.34 -0.72 0.01 0.00 -1.72 0.00 0.00 55.73 53.64 2gbl s ARG 216 Cb -0.08 -1.73 0.02 0.00 -0.45 0.00 0.00 34.95 32.71 2gbl s ARG 216 CO 0.25 0.34 -0.10 0.50 -0.68 0.00 0.00 175.30 175.61 2gbl s ARG 217 N -0.16 1.61 -0.15 3.54 3.52 0.10 -4.92 118.95 122.49 2gbl s ARG 217 Ca -0.00 -0.35 -0.14 0.00 -0.13 0.00 0.00 55.73 55.11 2gbl s ARG 217 Cb -0.11 -1.46 -0.05 0.00 -1.56 0.00 0.00 34.95 31.77 2gbl s ARG 217 CO 0.02 -0.09 0.30 -0.98 -0.81 0.00 0.00 175.30 173.74 2gbl s ARG 218 N 1.06 4.19 0.17 5.12 1.70 -1.26 -0.22 118.95 129.72 2gbl s ARG 218 Ca -0.07 0.11 0.04 0.00 -0.47 0.00 0.00 55.73 55.35 2gbl s ARG 218 Cb -0.15 -3.40 -0.05 0.00 -0.57 0.00 0.00 34.95 30.79 2gbl s ARG 218 CO -0.01 0.30 -0.07 0.95 -1.08 0.00 0.00 175.30 175.39 2gbl s THR 219 N 0.27 1.14 -0.01 4.99 -4.23 -0.14 -0.31 115.64 117.35 2gbl s THR 219 Ca 0.17 -2.06 0.01 0.00 -1.18 0.00 0.00 61.69 58.63 2gbl s THR 219 Cb -0.13 -2.00 0.01 0.00 1.34 0.00 0.00 72.50 71.72 2gbl s THR 219 CO 0.05 -0.62 -0.02 -0.22 -0.54 0.00 0.00 174.62 173.27 2gbl s LEU 220 N -3.21 1.69 -0.02 4.79 0.20 0.34 -0.55 118.68 121.92 2gbl s LEU 220 Ca 0.20 -0.04 0.01 0.00 0.69 0.00 0.00 54.13 55.00 2gbl s LEU 220 Cb 0.03 -0.17 0.01 0.00 -0.43 0.00 0.00 46.19 45.63 2gbl s LEU 220 CO 0.03 -0.02 -0.05 -0.70 -0.29 0.00 0.00 176.35 175.33 2gbl s GLU 221 N 0.34 0.53 -0.45 1.98 2.12 -0.04 -0.93 118.70 122.25 2gbl s GLU 221 Ca -0.03 -0.15 -0.16 0.00 0.36 0.00 0.00 54.97 54.99 2gbl s GLU 221 Cb -0.06 -0.55 0.04 0.00 0.26 0.00 0.00 34.13 33.83 2gbl s GLU 221 CO -0.01 0.04 0.40 0.42 -0.54 0.00 0.00 175.26 175.58 2gbl s ILE 222 N 0.26 5.17 0.03 -3.70 1.01 -1.26 -0.38 121.20 122.33 2gbl s ILE 222 Ca -0.03 -0.72 -0.21 0.00 0.00 0.00 0.00 60.65 59.70 2gbl s ILE 222 Cb -0.07 -4.07 -0.15 0.00 0.01 0.00 0.00 42.46 38.18 2gbl s ILE 222 CO -0.00 -0.49 1.32 0.25 0.00 0.00 0.00 174.94 176.02 2gbl h LEU 223 N 8.89 0.35 -7.15 2.97 6.46 -1.34 -3.43 115.31 122.07 2gbl h LEU 223 Ca -0.27 -0.50 -0.06 0.00 -0.12 0.00 0.00 57.88 56.93 2gbl h LEU 223 Cb 1.11 -0.10 -0.17 0.00 -0.73 0.00 0.00 40.66 40.78 2gbl h LEU 223 CO 0.82 0.78 0.08 -1.59 -0.62 0.00 0.00 178.44 177.91 2gbl s LYS 224 N -4.24 1.05 -0.31 1.25 -2.85 -1.20 -4.98 119.74 108.45 2gbl s LYS 224 Ca -0.14 -0.14 -0.01 0.00 -1.00 0.00 0.00 55.97 54.68 2gbl s LYS 224 Cb 0.05 0.48 0.13 0.00 -2.06 0.00 0.00 37.83 36.43 2gbl s LYS 224 CO 0.75 -0.37 0.25 -0.51 0.10 0.00 0.00 175.35 175.56 2gbl s LEU 225 N -1.83 0.22 0.22 2.77 1.43 -1.26 -1.34 118.68 118.89 2gbl s LEU 225 Ca -0.06 -1.30 -0.32 0.00 -1.03 0.00 0.00 54.13 51.42 2gbl s LEU 225 Cb -0.01 0.11 -0.13 0.00 0.03 0.00 0.00 46.19 46.19 2gbl s LEU 225 CO 0.00 -0.37 1.48 0.54 0.23 0.00 0.00 176.35 178.23 2gbl n ARG 226 N 4.89 2.11 0.00 1.70 1.74 -0.27 -2.52 116.66 124.31 2gbl n ARG 226 Ca 0.01 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 57.85 2gbl n ARG 226 Cb 0.43 -2.46 0.00 0.00 -1.02 0.00 0.00 32.46 29.41 2gbl n ARG 226 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gbl n GLY 227 N 2.58 3.15 0.55 -0.13 0.00 -1.26 -5.00 105.19 105.08 2gbl n GLY 227 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 2gbl n GLY 227 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gbl n THR 228 N -0.86 0.00 -3.36 2.61 -2.24 -1.05 -4.57 114.28 104.81 2gbl n THR 228 Ca 0.00 -0.41 -0.22 0.00 -2.27 0.00 0.00 64.05 61.15 2gbl n THR 228 Cb 0.00 0.21 0.03 0.00 -2.10 0.00 0.00 70.33 68.46 2gbl n THR 228 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2gbl s SER 229 N -1.40 4.98 -0.12 3.42 1.04 -1.26 -4.73 113.70 115.64 2gbl s SER 229 Ca 0.07 -0.94 -0.33 0.00 0.48 0.00 0.00 55.95 55.23 2gbl s SER 229 Cb 0.00 0.18 0.14 0.00 0.10 0.00 0.00 66.02 66.44 2gbl s SER 229 CO 0.05 -1.15 1.31 -1.38 0.98 0.00 0.00 173.24 173.04 2gbl s HIS 230 N -2.66 -0.05 0.46 5.02 -0.00 -1.26 -4.51 115.29 112.29 2gbl s HIS 230 Ca 0.51 -0.00 -0.21 0.00 -0.00 0.00 0.00 55.06 55.35 2gbl s HIS 230 Cb -0.05 0.52 -0.09 0.00 -0.00 0.00 0.00 32.58 32.97 2gbl s HIS 230 CO 0.32 -0.17 1.04 -1.64 -0.00 0.00 0.00 174.74 174.28 2gbl s MET 231 N -2.29 3.90 0.28 -0.38 -1.94 0.17 -4.99 119.30 114.05 2gbl s MET 231 Ca 0.13 1.38 0.08 0.00 -1.71 0.00 0.00 55.69 55.57 2gbl s MET 231 Cb 0.03 -2.20 -0.04 0.00 2.01 0.00 0.00 34.83 34.64 2gbl s MET 231 CO -0.04 -0.35 0.13 0.15 -0.01 0.00 0.00 175.02 174.90 2gbl s LYS 232 N -3.07 2.61 0.10 2.03 3.01 -1.26 -4.57 119.74 118.59 2gbl s LYS 232 Ca 0.65 -1.27 0.00 0.00 -1.01 0.00 0.00 55.97 54.34 2gbl s LYS 232 Cb -0.17 -2.36 0.00 0.00 -1.01 0.00 0.00 37.83 34.29 2gbl s LYS 232 CO 0.21 0.32 0.00 0.41 0.51 0.00 0.00 175.35 176.80 2gbl n GLY 233 N -1.10 -3.14 3.85 -3.33 0.00 -1.26 -4.94 105.19 95.27 2gbl n GLY 233 Ca -0.06 -1.90 -0.35 0.00 0.00 0.00 0.00 46.02 43.71 2gbl n GLY 233 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gbl s GLU 234 N -0.71 3.89 -0.05 1.61 2.02 -1.26 -4.23 118.70 119.97 2gbl s GLU 234 Ca 0.00 0.37 0.01 0.00 0.02 0.00 0.00 54.97 55.36 2gbl s GLU 234 Cb 0.00 -2.96 0.02 0.00 0.10 0.00 0.00 34.13 31.30 2gbl s GLU 234 CO 0.00 0.51 -0.04 0.71 0.02 0.00 0.00 175.26 176.46 2gbl s TYR 235 N -1.44 0.75 0.41 1.61 1.51 -0.10 -4.91 117.35 115.18 2gbl s TYR 235 Ca 0.36 -0.21 -0.24 0.00 -1.01 0.00 0.00 57.07 55.97 2gbl s TYR 235 Cb -0.15 -0.69 -0.09 0.00 -0.11 0.00 0.00 41.96 40.93 2gbl s TYR 235 CO 0.19 -0.21 1.09 -1.25 -1.11 0.00 0.00 175.55 174.26 2gbl s PRO 236 N 1.03 4.09 0.15 -1.71 0.04 -1.26 0.13 135.00 137.46 2gbl s PRO 236 Ca -0.09 1.61 -0.10 0.00 0.04 0.00 0.00 61.00 62.46 2gbl s PRO 236 Cb -0.14 -2.55 -0.00 0.00 0.04 0.00 0.00 34.50 31.84 2gbl s PRO 236 CO -0.01 -0.23 0.29 -0.59 0.04 0.00 0.00 177.00 176.50 2gbl s PHE 237 N -1.59 0.29 0.03 0.56 -0.12 0.58 -2.23 117.98 115.49 2gbl s PHE 237 Ca 0.58 -0.66 0.05 0.00 -0.05 0.00 0.00 56.93 56.85 2gbl s PHE 237 Cb -0.25 -0.01 -0.02 0.00 -0.63 0.00 0.00 43.02 42.11 2gbl s PHE 237 CO 0.31 -0.70 -0.14 0.99 -0.05 0.00 0.00 175.22 175.63 2gbl s THR 238 N -3.93 1.13 -0.28 -4.49 2.01 0.11 -4.27 115.64 105.92 2gbl s THR 238 Ca 0.14 -0.90 -0.10 0.00 0.31 0.00 0.00 61.69 61.14 2gbl s THR 238 Cb 0.03 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.51 2gbl s THR 238 CO -0.03 0.09 0.16 -0.63 -0.69 0.00 0.00 174.62 173.52 2gbl s ILE 239 N -0.71 4.90 0.00 1.82 1.01 -1.26 -0.74 121.20 126.22 2gbl s ILE 239 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.60 2gbl s ILE 239 Cb -0.07 -3.37 0.00 0.00 0.01 0.00 0.00 42.46 39.02 2gbl s ILE 239 CO 0.01 0.21 0.00 0.35 0.00 0.00 0.00 174.94 175.51 2gbl n THR 240 N 5.01 0.00 0.78 2.92 -2.24 -0.84 -4.96 114.28 114.96 2gbl n THR 240 Ca -0.14 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.75 2gbl n THR 240 Cb 0.51 0.00 0.50 0.00 -2.10 0.00 0.00 70.33 69.24 2gbl n THR 240 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2gbl n ASP 241 N -0.04 0.14 -1.22 3.42 8.00 -1.26 -2.57 116.55 123.01 2gbl n ASP 241 Ca 0.00 0.52 -0.01 0.00 0.71 0.00 0.00 54.79 56.01 2gbl n ASP 241 Cb 0.00 -0.56 0.23 0.00 -0.02 0.00 0.00 41.12 40.78 2gbl n ASP 241 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2gbl n HIS 242 N -1.64 1.33 -4.35 1.24 8.25 -1.26 -4.35 115.22 114.44 2gbl n HIS 242 Ca 0.06 -1.29 0.00 0.00 -0.26 0.00 0.00 57.72 56.23 2gbl n HIS 242 Cb 0.30 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 30.93 2gbl n HIS 242 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gbl n GLY 243 N -0.78 -0.35 3.71 -1.41 0.00 -1.06 -4.83 105.19 100.47 2gbl n GLY 243 Ca 0.31 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 2gbl n GLY 243 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gbl s ILE 244 N 0.00 2.98 -0.18 -0.61 1.01 -1.26 -1.98 121.20 121.16 2gbl s ILE 244 Ca 0.00 0.68 -0.01 0.00 0.00 0.00 0.00 60.65 61.32 2gbl s ILE 244 Cb 0.00 -3.43 0.05 0.00 0.01 0.00 0.00 42.46 39.09 2gbl s ILE 244 CO 0.00 0.05 -0.02 0.21 0.00 0.00 0.00 174.94 175.17 2gbl s ASN 245 N 1.26 2.98 -0.09 3.58 2.47 0.08 -4.13 114.94 121.09 2gbl s ASN 245 Ca 0.68 -0.78 0.01 0.00 0.42 0.00 0.00 52.86 53.18 2gbl s ASN 245 Cb -0.40 -0.83 -0.02 0.00 -1.45 0.00 0.00 41.25 38.54 2gbl s ASN 245 CO 0.31 -0.23 -0.10 -0.63 -3.72 0.00 0.00 177.10 172.72 2gbl s ILE 246 N 1.68 3.40 -0.32 -5.21 1.01 -0.81 -0.71 121.20 120.24 2gbl s ILE 246 Ca -0.01 -0.57 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 2gbl s ILE 246 Cb -0.16 -2.40 0.04 0.00 0.01 0.00 0.00 42.46 39.94 2gbl s ILE 246 CO -0.07 0.56 0.06 -0.36 0.00 0.00 0.00 174.94 175.13 2gbl s PHE 247 N -0.28 3.23 -1.27 3.97 0.40 -0.95 -4.11 117.98 118.97 2gbl s PHE 247 Ca 0.03 -1.51 -0.10 0.00 -0.60 0.00 0.00 56.93 54.75 2gbl s PHE 247 Cb -0.13 -2.21 0.16 0.00 0.51 0.00 0.00 43.02 41.36 2gbl s PHE 247 CO 0.03 -0.73 1.81 -2.30 0.70 0.00 0.00 175.22 174.72 2gbl n PRO 248 N 4.75 3.55 0.31 0.24 -0.02 -1.26 -4.33 135.00 138.25 2gbl n PRO 248 Ca -0.13 -3.55 0.16 0.00 -2.02 0.00 0.00 63.50 57.96 2gbl n PRO 248 Cb 0.45 -2.96 0.85 0.00 -0.02 0.00 0.00 33.50 31.82 2gbl n PRO 248 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2gbl h LEU 249 N 8.29 0.00 -2.03 2.45 3.38 -1.95 0.77 115.31 126.22 2gbl h LEU 249 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2gbl h LEU 249 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2gbl h LEU 249 CO 1.57 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.71 2gbl n GLY 250 N -1.20 1.33 0.34 0.83 0.00 -1.26 -3.92 105.19 101.31 2gbl n GLY 250 Ca -0.02 -0.68 0.09 0.00 0.00 0.00 0.00 46.02 45.41 2gbl n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gbl n ALA 251 N 1.27 3.52 -2.43 4.61 0.00 0.27 -4.94 120.51 122.81 2gbl n ALA 251 Ca 0.18 -0.57 -0.42 0.00 0.00 0.00 0.00 53.44 52.63 2gbl n ALA 251 Cb 0.56 -0.65 -0.03 0.00 0.00 0.00 0.00 19.45 19.33 2gbl n ALA 251 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2gbl s MET 252 N -2.23 4.47 0.32 0.00 0.00 -1.18 -5.01 119.30 115.66 2gbl s MET 252 Ca 0.14 1.71 -0.08 0.00 0.00 0.00 0.00 55.69 57.46 2gbl s MET 252 Cb 0.15 -3.36 -0.06 0.00 0.00 0.00 0.00 34.83 31.56 2gbl s MET 252 CO 0.52 -0.19 0.63 1.03 0.00 0.00 0.00 175.02 177.01 2gbl s ARG 253 N 0.89 3.72 -0.97 4.11 0.52 -1.26 -4.99 118.95 120.98 2gbl s ARG 253 Ca 0.57 0.23 -0.06 0.00 -0.52 0.00 0.00 55.73 55.95 2gbl s ARG 253 Cb -0.28 -2.56 0.04 0.00 0.52 0.00 0.00 34.95 32.68 2gbl s ARG 253 CO 0.30 0.15 2.68 -0.11 0.02 0.00 0.00 175.30 178.34 2gbl n LEU 254 N -0.89 7.41 -2.41 2.53 7.94 -1.26 -4.52 117.00 125.80 2gbl n LEU 254 Ca 0.00 -4.43 -0.19 0.00 -1.11 0.00 0.00 56.01 50.28 2gbl n LEU 254 Cb 0.54 -1.35 0.02 0.00 0.53 0.00 0.00 43.42 43.16 2gbl n LEU 254 CO 0.47 1.93 0.11 0.41 -1.11 0.00 0.00 177.39 179.20 2gbl n THR 255 N 1.74 2.04 -2.92 1.96 -1.04 -1.26 -5.08 114.28 109.71 2gbl n THR 255 Ca 0.59 -4.08 -0.40 0.00 -2.04 0.00 0.00 64.05 58.11 2gbl n THR 255 Cb 0.40 -0.52 -0.05 0.00 -1.82 0.00 0.00 70.33 68.34 2gbl n THR 255 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2gbl s GLN 256 N -3.54 4.53 0.40 -2.82 -1.52 -1.26 -5.01 119.66 110.44 2gbl s GLN 256 Ca 0.42 1.15 -0.27 0.00 -1.95 0.00 0.00 55.36 54.71 2gbl s GLN 256 Cb 0.40 -3.38 -0.10 0.00 -0.22 0.00 0.00 33.01 29.72 2gbl s GLN 256 CO -0.05 0.24 1.40 1.03 -0.25 0.00 0.00 175.29 177.66 2gbl s ARG 257 N 0.07 3.99 -0.19 2.91 0.52 -1.26 -5.00 118.95 120.00 2gbl s ARG 257 Ca 0.41 2.38 -0.02 0.00 -0.52 0.00 0.00 55.73 57.98 2gbl s ARG 257 Cb -0.21 -2.85 0.05 0.00 0.52 0.00 0.00 34.95 32.47 2gbl s ARG 257 CO 0.24 -0.55 0.01 0.45 0.02 0.00 0.00 175.30 175.47 2gbl s SER 258 N -0.43 2.93 0.52 0.23 0.15 -1.26 -4.92 113.70 110.91 2gbl s SER 258 Ca 0.55 -0.79 0.08 0.00 0.70 0.00 0.00 55.95 56.49 2gbl s SER 258 Cb -0.43 -0.72 0.04 0.00 -1.71 0.00 0.00 66.02 63.21 2gbl s SER 258 CO 0.56 -0.27 0.58 -0.94 1.20 0.00 0.00 173.24 174.38 2gbl s SER 259 N 1.76 5.04 0.00 5.45 1.04 -1.26 -5.04 113.70 120.69 2gbl s SER 259 Ca -0.01 -0.88 0.13 0.00 0.48 0.00 0.00 55.95 55.67 2gbl s SER 259 Cb -0.17 0.05 0.29 0.00 0.10 0.00 0.00 66.02 66.30 2gbl s SER 259 CO -0.07 -1.08 1.19 0.59 0.98 0.00 0.00 173.24 174.85 2gbl n ASN 260 N -1.94 2.82 -4.74 7.02 3.02 -1.26 -4.74 115.26 115.45 2gbl n ASN 260 Ca 0.08 -1.86 -0.41 0.00 -0.03 0.00 0.00 54.58 52.36 2gbl n ASN 260 Cb 0.62 -0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.56 2gbl n ASN 260 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2gbl s VAL 261 N -1.05 3.55 0.43 2.41 1.01 -1.26 -4.94 120.40 120.54 2gbl s VAL 261 Ca 0.25 1.29 0.08 0.00 0.00 0.00 0.00 61.98 63.59 2gbl s VAL 261 Cb 0.14 -3.82 0.01 0.00 0.00 0.00 0.00 36.38 32.71 2gbl s VAL 261 CO 0.19 0.20 0.56 -0.13 0.00 0.00 0.00 175.10 175.91 2gbl s ARG 262 N -0.15 2.77 -0.02 2.72 1.81 -1.26 0.23 118.95 125.04 2gbl s ARG 262 Ca 0.54 -1.29 -0.29 0.00 -1.72 0.00 0.00 55.73 52.97 2gbl s ARG 262 Cb -0.33 -2.71 0.07 0.00 -0.45 0.00 0.00 34.95 31.53 2gbl s ARG 262 CO 0.36 -0.29 0.64 0.08 -0.68 0.00 0.00 175.30 175.42 2gbl s VAL 263 N -2.38 0.01 0.50 3.52 1.01 0.99 -4.58 120.40 119.46 2gbl s VAL 263 Ca 0.54 -0.04 -0.15 0.00 0.00 0.00 0.00 61.98 62.33 2gbl s VAL 263 Cb -0.09 -0.97 -0.07 0.00 0.00 0.00 0.00 36.38 35.24 2gbl s VAL 263 CO 0.33 -0.02 0.95 -0.55 0.00 0.00 0.00 175.10 175.80 2gbl s SER 264 N -1.37 6.59 0.21 3.32 0.15 -1.26 -0.57 113.70 120.77 2gbl s SER 264 Ca -0.10 1.49 0.21 0.00 0.70 0.00 0.00 55.95 58.24 2gbl s SER 264 Cb -0.00 -2.47 0.02 0.00 -1.71 0.00 0.00 66.02 61.85 2gbl s SER 264 CO 0.07 -0.57 1.11 0.77 1.20 0.00 0.00 173.24 175.82 2gbl h SER 265 N 0.91 0.00 0.00 5.45 4.64 -1.93 -3.46 113.55 119.16 2gbl h SER 265 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2gbl h SER 265 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2gbl h SER 265 CO 0.62 0.17 0.00 0.61 -0.87 0.00 0.00 176.83 177.36 2gbl n GLY 266 N 1.22 0.56 2.77 -0.77 0.00 -1.22 -2.51 105.19 105.24 2gbl n GLY 266 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 2gbl n GLY 266 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gbl s VAL 267 N -2.00 0.47 0.01 1.61 1.01 -1.26 -4.88 120.40 115.36 2gbl s VAL 267 Ca 0.00 -0.07 -0.25 0.00 0.00 0.00 0.00 61.98 61.66 2gbl s VAL 267 Cb 0.00 -0.70 -0.18 0.00 0.00 0.00 0.00 36.38 35.51 2gbl s VAL 267 CO 0.00 0.16 1.36 0.58 0.00 0.00 0.00 175.10 177.20 2gbl h VAL 268 N 6.36 1.05 -0.98 2.92 2.07 -1.96 -2.07 116.25 123.64 2gbl h VAL 268 Ca -0.20 -0.69 0.14 0.00 0.82 0.00 0.00 66.70 66.77 2gbl h VAL 268 Cb 1.12 1.48 -0.08 0.00 -1.52 0.00 0.00 31.29 32.29 2gbl h VAL 268 CO 0.29 0.16 0.62 -0.09 0.02 0.00 0.00 177.57 178.57 2gbl h ARG 269 N -0.48 0.86 0.18 1.57 9.65 -1.96 -0.06 114.38 124.15 2gbl h ARG 269 Ca -0.02 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 2gbl h ARG 269 Cb 0.39 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 2gbl h ARG 269 CO 0.03 0.57 -0.18 1.25 2.80 0.00 0.00 179.97 184.44 2gbl h LEU 270 N 0.89 -0.48 -0.87 3.80 6.46 -1.94 -1.30 115.31 121.87 2gbl h LEU 270 Ca 0.50 0.05 0.21 0.00 -0.12 0.00 0.00 57.88 58.51 2gbl h LEU 270 Cb 0.60 0.17 -0.12 0.00 -0.73 0.00 0.00 40.66 40.58 2gbl h LEU 270 CO -0.26 -0.27 0.35 0.44 -0.62 0.00 0.00 178.44 178.07 2gbl h ASP 271 N -0.40 0.25 0.42 1.25 3.32 -0.37 -0.25 116.42 120.65 2gbl h ASP 271 Ca 0.00 0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 2gbl h ASP 271 Cb 0.37 0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.08 2gbl h ASP 271 CO -0.04 -0.02 -0.22 -0.33 -1.72 0.00 0.00 179.24 176.91 2gbl h GLU 272 N 0.36 -0.57 -0.84 3.56 5.08 -0.02 0.23 114.58 122.39 2gbl h GLU 272 Ca 0.54 0.04 0.19 0.00 -1.00 0.00 0.00 59.36 59.13 2gbl h GLU 272 Cb 1.01 0.13 -0.05 0.00 0.50 0.00 0.00 28.75 30.34 2gbl h GLU 272 CO -0.54 -0.38 0.56 0.52 -1.00 0.00 0.00 179.01 178.18 2gbl h MET 273 N -0.59 0.30 -0.83 2.33 2.86 -0.11 0.26 114.93 119.16 2gbl h MET 273 Ca -0.05 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 2gbl h MET 273 Cb 0.46 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.06 2gbl h MET 273 CO 0.08 0.20 0.00 0.00 1.06 0.00 0.00 176.91 178.25 2gbl n GLY 275 N 0.25 -0.32 0.00 0.00 0.00 0.91 -3.86 105.19 102.17 2gbl n GLY 275 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2gbl n GLY 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gbl n GLY 276 N -1.25 1.88 0.00 -0.02 0.00 0.55 -4.87 105.19 101.48 2gbl n GLY 276 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2gbl n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gbl n GLY 277 N -0.72 1.40 3.81 -0.02 0.00 0.22 -4.61 105.19 105.27 2gbl n GLY 277 Ca 0.00 -1.94 -0.33 0.00 0.00 0.00 0.00 46.02 43.75 2gbl n GLY 277 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gbl s PHE 278 N -2.33 3.17 0.39 1.61 2.99 0.27 -4.68 117.98 119.39 2gbl s PHE 278 Ca 0.00 1.53 -0.24 0.00 0.00 0.00 0.00 56.93 58.22 2gbl s PHE 278 Cb 0.00 -2.94 -0.09 0.00 0.00 0.00 0.00 43.02 39.99 2gbl s PHE 278 CO 0.00 -0.69 1.06 -0.06 -0.00 0.00 0.00 175.22 175.53 2gbl s PHE 279 N -2.34 3.28 0.17 0.36 0.40 -1.26 -0.01 117.98 118.58 2gbl s PHE 279 Ca 0.63 1.64 -0.12 0.00 -0.60 0.00 0.00 56.93 58.49 2gbl s PHE 279 Cb -0.13 -3.15 0.07 0.00 0.51 0.00 0.00 43.02 40.32 2gbl s PHE 279 CO 0.27 -0.66 1.72 -0.22 0.70 0.00 0.00 175.22 177.04 2gbl h LYS 280 N 2.60 0.89 -4.94 0.44 3.64 -0.47 -3.29 116.57 115.44 2gbl h LYS 280 Ca -0.48 -0.17 -0.70 0.00 -1.27 0.00 0.00 60.65 58.03 2gbl h LYS 280 Cb 1.22 -0.14 -0.18 0.00 -0.41 0.00 0.00 32.23 32.72 2gbl h LYS 280 CO 0.63 0.77 0.83 -0.51 -2.27 0.00 0.00 179.45 178.90 2gbl s ASP 281 N -6.12 6.67 -0.12 4.20 1.01 -1.26 -3.52 116.67 117.53 2gbl s ASP 281 Ca -0.13 -2.16 -0.32 0.00 0.71 0.00 0.00 52.55 50.65 2gbl s ASP 281 Cb 0.13 -2.39 0.13 0.00 1.01 0.00 0.00 42.92 41.80 2gbl s ASP 281 CO 0.80 -1.01 1.08 -0.94 0.21 0.00 0.00 175.17 175.31 2gbl s SER 282 N 3.49 -0.24 -0.23 0.27 1.04 -1.24 -4.83 113.70 111.96 2gbl s SER 282 Ca 0.33 0.03 -0.05 0.00 0.48 0.00 0.00 55.95 56.74 2gbl s SER 282 Cb -0.05 0.24 -0.01 0.00 0.10 0.00 0.00 66.02 66.30 2gbl s SER 282 CO -0.09 -0.38 -0.01 -0.63 0.98 0.00 0.00 173.24 173.11 2gbl s ILE 283 N -2.52 3.55 -0.07 -1.02 -1.09 -1.26 -2.33 121.20 116.45 2gbl s ILE 283 Ca 0.07 -0.49 0.02 0.00 -2.23 0.00 0.00 60.65 58.02 2gbl s ILE 283 Cb -0.01 -2.66 -0.03 0.00 -1.58 0.00 0.00 42.46 38.19 2gbl s ILE 283 CO -0.06 0.36 -0.12 -0.63 -1.23 0.00 0.00 174.94 173.27 2gbl s ILE 284 N 1.49 3.27 -0.11 2.92 -1.09 0.29 -1.07 121.20 126.91 2gbl s ILE 284 Ca 0.05 -0.63 0.01 0.00 -2.23 0.00 0.00 60.65 57.85 2gbl s ILE 284 Cb -0.15 -2.31 0.02 0.00 -1.58 0.00 0.00 42.46 38.43 2gbl s ILE 284 CO -0.02 0.58 -0.15 -0.22 -1.23 0.00 0.00 174.94 173.91 2gbl s LEU 285 N -0.58 1.70 -0.28 2.97 2.96 0.10 0.13 118.68 125.68 2gbl s LEU 285 Ca 0.08 -0.43 -0.05 0.00 -0.22 0.00 0.00 54.13 53.51 2gbl s LEU 285 Cb -0.11 -1.09 0.02 0.00 0.50 0.00 0.00 46.19 45.50 2gbl s LEU 285 CO 0.01 0.00 0.03 0.00 -1.32 0.00 0.00 176.35 175.08 2gbl s ALA 286 N 1.06 2.94 0.11 5.97 0.00 0.14 -0.34 121.76 131.64 2gbl s ALA 286 Ca -0.05 -1.48 0.08 0.00 0.00 0.00 0.00 51.96 50.51 2gbl s ALA 286 Cb -0.15 -2.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.93 2gbl s ALA 286 CO -0.03 -0.92 -0.15 0.99 0.00 0.00 0.00 175.76 175.65 2gbl s THR 287 N 1.43 3.07 0.00 0.00 2.01 -0.53 -1.43 115.64 120.18 2gbl s THR 287 Ca 0.01 -1.40 0.00 0.00 0.31 0.00 0.00 61.69 60.61 2gbl s THR 287 Cb -0.17 -2.42 0.00 0.00 0.01 0.00 0.00 72.50 69.92 2gbl s THR 287 CO 0.00 0.11 0.00 0.61 -0.69 0.00 0.00 174.62 174.65 2gbl n GLY 288 N 0.77 0.30 3.63 4.40 0.00 -0.89 0.09 105.19 113.49 2gbl n GLY 288 Ca -0.15 -0.94 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 2gbl n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gbl s ALA 289 N -2.00 0.76 0.63 4.61 0.00 -1.25 -1.21 121.76 123.31 2gbl s ALA 289 Ca 0.00 -0.03 -0.18 0.00 0.00 0.00 0.00 51.96 51.75 2gbl s ALA 289 Cb 0.00 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 2gbl s ALA 289 CO 0.00 -3.00 1.12 -2.37 0.00 0.00 0.00 175.76 171.51 2gbl n THR 290 N -4.33 4.32 0.00 0.00 5.66 -1.26 -2.53 114.28 116.13 2gbl n THR 290 Ca 0.06 -0.49 0.00 0.00 -3.05 0.00 0.00 64.05 60.57 2gbl n THR 290 Cb 0.55 -1.31 0.00 0.00 -1.55 0.00 0.00 70.33 68.02 2gbl n THR 290 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2gbl n GLY 291 N 1.11 2.25 0.28 1.09 0.00 -1.26 -4.86 105.19 103.81 2gbl n GLY 291 Ca 0.15 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.32 2gbl n GLY 291 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2gbl h THR 292 N 0.00 0.31 0.00 2.61 1.35 -1.85 -3.47 112.91 111.86 2gbl h THR 292 Ca 0.00 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 2gbl h THR 292 Cb 0.00 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 2gbl h THR 292 CO 0.00 0.08 0.00 0.61 -0.25 0.00 0.00 175.52 175.96 2gbl n GLY 293 N -0.45 1.91 0.17 5.82 0.00 -1.26 -4.93 105.19 106.46 2gbl n GLY 293 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 2gbl n GLY 293 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gbl h LYS 294 N 0.00 0.50 -0.01 1.61 6.56 -1.90 -2.37 116.57 120.95 2gbl h LYS 294 Ca 0.00 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 2gbl h LYS 294 Cb 0.00 -0.09 -0.00 0.00 -0.57 0.00 0.00 32.23 31.57 2gbl h LYS 294 CO 0.00 0.44 0.01 1.15 -2.06 0.00 0.00 179.45 179.00 2gbl h THR 295 N 0.43 0.55 0.39 -0.16 2.02 -1.97 -1.31 112.91 112.86 2gbl h THR 295 Ca 0.12 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.28 2gbl h THR 295 Cb 0.10 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 2gbl h THR 295 CO -0.02 0.00 -0.19 0.25 0.37 0.00 0.00 175.52 175.94 2gbl h LEU 296 N 0.00 -0.44 -0.97 2.58 5.85 -1.84 -2.65 115.31 117.84 2gbl h LEU 296 Ca 0.01 0.00 0.30 0.00 0.84 0.00 0.00 57.88 59.03 2gbl h LEU 296 Cb 0.03 0.11 -0.15 0.00 0.37 0.00 0.00 40.66 41.03 2gbl h LEU 296 CO -0.00 -0.00 0.46 -0.07 -0.34 0.00 0.00 178.44 178.49 2gbl h LEU 297 N -1.13 0.34 -0.35 2.25 3.38 -1.03 0.24 115.31 119.01 2gbl h LEU 297 Ca -0.05 0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2gbl h LEU 297 Cb 0.41 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2gbl h LEU 297 CO 0.09 -0.15 0.20 0.58 0.09 0.00 0.00 178.44 179.25 2gbl h VAL 298 N 0.28 1.14 0.06 1.22 2.07 -1.27 -0.56 116.25 119.19 2gbl h VAL 298 Ca 0.68 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.86 2gbl h VAL 298 Cb 1.50 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 2gbl h VAL 298 CO -0.63 0.14 -0.09 0.28 0.02 0.00 0.00 177.57 177.29 2gbl h SER 299 N 0.45 -0.25 0.57 0.57 0.02 -0.63 0.22 113.55 114.50 2gbl h SER 299 Ca 0.12 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2gbl h SER 299 Cb 0.05 0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2gbl h SER 299 CO -0.02 -0.14 0.00 -0.09 -1.14 0.00 0.00 176.83 175.44 2gbl h ARG 300 N -0.19 0.00 0.11 3.45 9.65 -1.02 -0.47 114.38 125.93 2gbl h ARG 300 Ca 0.02 0.00 -0.33 0.00 -1.10 0.00 0.00 59.98 58.57 2gbl h ARG 300 Cb 0.20 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.76 2gbl h ARG 300 CO -0.05 0.00 -1.74 0.35 2.80 0.00 0.00 179.97 181.33 2gbl h PHE 301 N 0.00 0.43 -0.30 2.20 3.57 -0.55 -3.03 116.94 119.27 2gbl h PHE 301 Ca 0.00 -0.32 -0.15 0.00 3.53 0.00 0.00 57.97 61.03 2gbl h PHE 301 Cb 0.28 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.00 2gbl h PHE 301 CO 0.00 1.49 -0.42 0.28 -2.23 0.00 0.00 178.31 177.43 2gbl h VAL 302 N 0.07 1.29 -0.51 1.41 2.07 -0.38 -3.21 116.25 116.99 2gbl h VAL 302 Ca -0.32 -1.60 -0.10 0.00 0.82 0.00 0.00 66.70 65.50 2gbl h VAL 302 Cb 2.04 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 33.38 2gbl h VAL 302 CO 0.13 0.52 -0.06 -0.08 0.02 0.00 0.00 177.57 178.10 2gbl h GLU 303 N 0.58 0.94 -0.01 1.57 4.81 -1.24 -2.70 114.58 118.52 2gbl h GLU 303 Ca 0.03 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2gbl h GLU 303 Cb 1.01 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.32 2gbl h GLU 303 CO 0.10 0.99 0.16 -0.97 -0.73 0.00 0.00 179.01 178.56 2gbl h ASN 304 N 0.80 0.00 0.98 1.04 -0.73 -1.53 0.16 115.58 116.30 2gbl h ASN 304 Ca 0.14 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.31 2gbl h ASN 304 Cb 0.60 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.19 2gbl h ASN 304 CO 0.04 0.00 -0.49 0.00 -0.37 0.00 0.00 177.43 176.61 2gbl n ALA 305 N -2.01 2.80 -0.05 1.57 0.00 -1.02 -3.57 120.51 118.24 2gbl n ALA 305 Ca -0.02 -0.20 -0.14 0.00 0.00 0.00 0.00 53.44 53.08 2gbl n ALA 305 Cb 0.23 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.30 2gbl n ALA 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gbl n ALA 307 N -2.82 1.55 -1.31 0.00 0.00 -0.83 0.19 120.51 117.30 2gbl n ALA 307 Ca -0.29 -0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.19 2gbl n ALA 307 Cb 1.07 -1.18 0.16 0.00 0.00 0.00 0.00 19.45 19.50 2gbl n ALA 307 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2gbl n ASN 308 N -1.44 2.05 -4.16 0.00 3.02 -1.23 -4.99 115.26 108.50 2gbl n ASN 308 Ca 0.03 -3.38 -0.36 0.00 -0.03 0.00 0.00 54.58 50.84 2gbl n ASN 308 Cb 0.12 -0.46 -0.05 0.00 -0.61 0.00 0.00 39.78 38.78 2gbl n ASN 308 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2gbl n LYS 309 N -1.27 -0.64 -4.46 3.52 5.02 0.13 -4.97 118.16 115.49 2gbl n LYS 309 Ca 0.17 0.06 -0.23 0.00 -2.02 0.00 0.00 58.31 56.28 2gbl n LYS 309 Cb 0.67 -2.91 -0.10 0.00 -0.02 0.00 0.00 35.03 32.67 2gbl n LYS 309 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2gbl s GLU 310 N -7.26 1.64 -0.14 1.97 2.02 0.25 -4.99 118.70 112.19 2gbl s GLU 310 Ca 0.20 -1.76 -0.13 0.00 0.02 0.00 0.00 54.97 53.30 2gbl s GLU 310 Cb -0.11 -1.65 -0.05 0.00 0.10 0.00 0.00 34.13 32.42 2gbl s GLU 310 CO 0.94 0.28 0.27 1.03 0.02 0.00 0.00 175.26 177.80 2gbl s ARG 311 N -3.55 4.10 0.02 1.61 0.52 -1.25 -4.03 118.95 116.36 2gbl s ARG 311 Ca 0.29 0.08 0.03 0.00 -0.52 0.00 0.00 55.73 55.61 2gbl s ARG 311 Cb -0.03 -3.37 -0.01 0.00 0.52 0.00 0.00 34.95 32.06 2gbl s ARG 311 CO 0.14 0.37 -0.09 0.00 0.02 0.00 0.00 175.30 175.75 2gbl s ALA 312 N 0.06 0.70 -0.09 2.13 0.00 0.06 0.17 121.76 124.79 2gbl s ALA 312 Ca 0.17 -0.54 0.02 0.00 0.00 0.00 0.00 51.96 51.61 2gbl s ALA 312 Cb -0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 2gbl s ALA 312 CO 0.05 0.11 -0.16 0.42 0.00 0.00 0.00 175.76 176.18 2gbl s ILE 313 N -0.64 2.80 -0.35 0.00 1.01 -0.75 -1.57 121.20 121.69 2gbl s ILE 313 Ca -0.01 -0.78 -0.01 0.00 0.00 0.00 0.00 60.65 59.85 2gbl s ILE 313 Cb -0.06 -2.12 0.09 0.00 0.01 0.00 0.00 42.46 40.38 2gbl s ILE 313 CO 0.00 0.55 0.09 -0.22 0.00 0.00 0.00 174.94 175.36 2gbl s LEU 314 N -0.03 4.61 -0.50 2.97 2.96 -0.72 -0.89 118.68 127.08 2gbl s LEU 314 Ca -0.04 -1.77 -0.22 0.00 -0.22 0.00 0.00 54.13 51.87 2gbl s LEU 314 Cb -0.14 -1.73 0.04 0.00 0.50 0.00 0.00 46.19 44.85 2gbl s LEU 314 CO 0.04 -0.40 0.78 -0.36 -1.32 0.00 0.00 176.35 175.09 2gbl s PHE 315 N 1.13 2.94 -0.25 5.38 0.40 0.47 -1.58 117.98 126.48 2gbl s PHE 315 Ca 0.03 -0.13 -0.08 0.00 -0.60 0.00 0.00 56.93 56.15 2gbl s PHE 315 Cb -0.21 -3.73 -0.04 0.00 0.51 0.00 0.00 43.02 39.55 2gbl s PHE 315 CO -0.04 -1.12 0.10 0.00 0.70 0.00 0.00 175.22 174.86 2gbl s ALA 316 N 3.28 3.29 -1.06 5.36 0.00 -1.26 -0.03 121.76 131.34 2gbl s ALA 316 Ca 0.25 -1.06 0.09 0.00 0.00 0.00 0.00 51.96 51.24 2gbl s ALA 316 Cb -0.15 -2.16 0.11 0.00 0.00 0.00 0.00 23.12 20.93 2gbl s ALA 316 CO 0.18 -0.40 0.88 0.66 0.00 0.00 0.00 175.76 177.08 2gbl n TYR 317 N 4.74 0.08 0.00 0.00 4.02 -1.16 -1.75 117.16 123.10 2gbl n TYR 317 Ca -0.16 -0.11 0.00 0.00 -0.01 0.00 0.00 57.90 57.63 2gbl n TYR 317 Cb 0.52 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.83 2gbl n TYR 317 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2gbl n GLU 318 N 0.47 3.41 -4.30 -0.72 1.02 -1.26 -4.53 120.64 114.74 2gbl n GLU 318 Ca 0.06 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.92 2gbl n GLU 318 Cb 0.26 -0.99 -0.10 0.00 -0.02 0.00 0.00 31.44 30.59 2gbl n GLU 318 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2gbl s GLU 319 N -1.99 1.95 0.89 3.49 2.02 -1.26 -5.13 118.70 118.67 2gbl s GLU 319 Ca 0.00 -1.24 -0.12 0.00 0.02 0.00 0.00 54.97 53.63 2gbl s GLU 319 Cb 0.00 -2.13 0.13 0.00 0.10 0.00 0.00 34.13 32.22 2gbl s GLU 319 CO 0.00 0.45 1.11 -1.54 0.02 0.00 0.00 175.26 175.30 2gbl s SER 320 N -2.57 3.61 0.27 -0.19 1.04 -1.26 -4.84 113.70 109.76 2gbl s SER 320 Ca 0.22 1.15 0.00 0.00 0.48 0.00 0.00 55.95 57.81 2gbl s SER 320 Cb -0.09 -1.80 0.38 0.00 0.10 0.00 0.00 66.02 64.61 2gbl s SER 320 CO 0.13 -2.51 1.75 0.03 0.98 0.00 0.00 173.24 173.62 2gbl h ARG 321 N -1.46 0.64 0.18 4.02 3.08 -1.97 -1.20 114.38 117.66 2gbl h ARG 321 Ca -0.50 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.34 2gbl h ARG 321 Cb 1.31 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2gbl h ARG 321 CO 0.60 0.74 -0.09 0.00 -1.07 0.00 0.00 179.97 180.15 2gbl h ALA 322 N 1.29 -0.24 -0.68 0.04 0.00 -2.00 -2.80 119.26 114.87 2gbl h ALA 322 Ca 0.10 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2gbl h ALA 322 Cb 0.55 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2gbl h ALA 322 CO 0.03 -0.47 0.44 0.37 0.00 0.00 0.00 179.25 179.62 2gbl h GLN 323 N -0.57 0.85 -0.88 0.00 4.15 -1.90 -0.86 115.11 115.90 2gbl h GLN 323 Ca -0.02 -0.05 0.15 0.00 0.77 0.00 0.00 58.65 59.50 2gbl h GLN 323 Cb 0.43 -0.19 -0.07 0.00 0.21 0.00 0.00 27.48 27.86 2gbl h GLN 323 CO 0.04 0.56 0.57 -0.07 -1.93 0.00 0.00 178.83 178.00 2gbl h LEU 324 N 0.87 0.60 -0.05 -2.39 3.38 -1.21 -1.59 115.31 114.92 2gbl h LEU 324 Ca 0.26 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.18 2gbl h LEU 324 Cb -0.03 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.65 2gbl h LEU 324 CO -0.08 0.30 -0.35 -0.07 0.09 0.00 0.00 178.44 178.32 2gbl h LEU 325 N 0.63 0.40 -0.10 1.67 3.38 -0.93 -2.15 115.31 118.22 2gbl h LEU 325 Ca 0.45 -0.67 0.01 0.00 0.09 0.00 0.00 57.88 57.76 2gbl h LEU 325 Cb 0.79 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2gbl h LEU 325 CO -0.20 1.01 0.02 -0.09 0.09 0.00 0.00 178.44 179.27 2gbl h ARG 326 N -0.18 0.06 -0.63 1.13 2.43 -0.82 -0.11 114.38 116.26 2gbl h ARG 326 Ca -0.03 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 2gbl h ARG 326 Cb 1.02 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.52 2gbl h ARG 326 CO 0.07 0.04 0.28 -0.91 -1.51 0.00 0.00 179.97 177.94 2gbl h ASN 327 N 0.06 0.82 -0.06 -3.80 2.35 -1.40 -2.18 115.58 111.36 2gbl h ASN 327 Ca 0.04 -0.09 -0.02 0.00 -0.55 0.00 0.00 56.30 55.68 2gbl h ASN 327 Cb 0.04 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.20 2gbl h ASN 327 CO -0.06 0.71 -0.04 0.00 -1.65 0.00 0.00 177.43 176.39 2gbl h ALA 328 N 1.41 0.09 -0.52 -0.83 0.00 -1.11 -2.99 119.26 115.32 2gbl h ALA 328 Ca 0.22 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2gbl h ALA 328 Cb 0.13 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 2gbl h ALA 328 CO -0.02 -0.14 0.25 -0.92 0.00 0.00 0.00 179.25 178.42 2gbl h TYR 329 N -0.27 0.46 0.00 0.00 3.20 -0.88 -1.34 116.97 118.14 2gbl h TYR 329 Ca 0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2gbl h TYR 329 Cb 0.51 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.65 2gbl h TYR 329 CO 0.08 0.22 0.00 0.43 -1.64 0.00 0.00 178.16 177.24 2gbl n SER 330 N -4.90 0.00 -0.70 -2.11 7.64 -0.83 -0.03 113.62 112.70 2gbl n SER 330 Ca 0.05 0.37 0.07 0.00 1.01 0.00 0.00 58.87 60.36 2gbl n SER 330 Cb 0.15 -0.40 0.15 0.00 -1.01 0.00 0.00 64.21 63.09 2gbl n SER 330 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2gbl n TRP 331 N -1.40 0.40 0.00 1.43 8.01 -0.53 -4.29 117.44 121.06 2gbl n TRP 331 Ca 0.02 -0.36 0.00 0.00 -1.31 0.00 0.00 57.50 55.85 2gbl n TRP 331 Cb 0.06 -0.02 0.00 0.00 -2.01 0.00 0.00 31.31 29.34 2gbl n TRP 331 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2gbl n GLY 332 N 0.72 0.70 0.00 6.99 0.00 0.96 -3.79 105.19 110.78 2gbl n GLY 332 Ca 0.12 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2gbl n GLY 332 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2gbl n MET 333 N 0.00 0.00 -3.22 1.61 0.00 -1.25 -3.61 117.12 110.64 2gbl n MET 333 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 57.70 57.24 2gbl n MET 333 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.18 2gbl n MET 333 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2gbl s ASP 334 N 0.00 6.28 0.43 3.17 -1.08 -1.26 -2.88 116.67 121.33 2gbl s ASP 334 Ca 0.00 -1.79 0.20 0.00 -0.52 0.00 0.00 52.55 50.44 2gbl s ASP 334 Cb 0.00 -2.25 0.97 0.00 -1.46 0.00 0.00 42.92 40.18 2gbl s ASP 334 CO 0.00 -0.93 1.89 -0.26 0.52 0.00 0.00 175.17 176.39 2gbl h PHE 335 N 8.85 0.00 -0.19 -5.34 0.05 -1.89 -3.09 116.94 115.34 2gbl h PHE 335 Ca -0.22 0.00 0.05 0.00 3.82 0.00 0.00 57.97 61.62 2gbl h PHE 335 Cb 1.08 0.00 -0.06 0.00 2.00 0.00 0.00 35.95 38.97 2gbl h PHE 335 CO 0.83 0.27 -0.24 0.93 -0.18 0.00 0.00 178.31 179.92 2gbl h GLU 336 N 0.00 -0.27 0.07 1.51 4.39 -1.95 -2.23 114.58 116.10 2gbl h GLU 336 Ca -0.00 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 2gbl h GLU 336 Cb 0.61 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.32 2gbl h GLU 336 CO 0.04 -0.18 -0.05 1.49 -1.16 0.00 0.00 179.01 179.15 2gbl h GLU 337 N -0.28 -0.12 -1.01 2.33 4.57 -1.97 -2.07 114.58 116.03 2gbl h GLU 337 Ca 0.12 0.01 0.24 0.00 -1.18 0.00 0.00 59.36 58.55 2gbl h GLU 337 Cb 0.46 0.03 -0.12 0.00 -0.16 0.00 0.00 28.75 28.96 2gbl h GLU 337 CO -0.35 -0.08 0.61 0.52 -1.18 0.00 0.00 179.01 178.53 2gbl h MET 338 N -0.12 0.56 0.66 1.92 2.86 -1.53 0.36 114.93 119.64 2gbl h MET 338 Ca -0.00 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 2gbl h MET 338 Cb 0.11 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 31.65 2gbl h MET 338 CO -0.00 0.37 -0.32 0.93 1.06 0.00 0.00 176.91 178.95 2gbl h GLU 339 N 0.58 -0.86 0.17 1.72 5.08 -0.77 -2.28 114.58 118.21 2gbl h GLU 339 Ca 0.62 0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 59.04 2gbl h GLU 339 Cb 1.22 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.65 2gbl h GLU 339 CO -0.42 -0.54 -0.25 0.00 -1.00 0.00 0.00 179.01 176.80 2gbl h ARG 340 N -1.06 -0.42 0.00 2.33 3.08 -0.90 -1.75 114.38 115.66 2gbl h ARG 340 Ca -0.09 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2gbl h ARG 340 Cb 0.72 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.87 2gbl h ARG 340 CO 0.15 -0.28 0.25 1.04 -1.07 0.00 0.00 179.97 180.06 2gbl n GLN 341 N -3.85 0.00 -2.96 0.04 6.02 0.04 -4.72 117.38 111.95 2gbl n GLN 341 Ca -0.05 0.07 -0.21 0.00 -0.01 0.00 0.00 57.00 56.80 2gbl n GLN 341 Cb 0.21 -1.75 0.01 0.00 1.02 0.00 0.00 30.24 29.73 2gbl n GLN 341 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2gbl n ASN 342 N -0.92 -5.08 -0.06 1.08 4.13 -0.66 -4.86 115.26 108.89 2gbl n ASN 342 Ca 0.00 -0.21 -0.02 0.00 1.68 0.00 0.00 54.58 56.03 2gbl n ASN 342 Cb 0.25 -4.17 -0.14 0.00 -1.54 0.00 0.00 39.78 34.19 2gbl n ASN 342 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2gbl n LEU 343 N -3.64 0.00 -4.12 3.41 4.77 -1.02 -4.93 117.00 111.47 2gbl n LEU 343 Ca -0.11 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.59 2gbl n LEU 343 Cb 0.61 0.27 -0.17 0.00 -2.33 0.00 0.00 43.42 41.79 2gbl n LEU 343 CO 0.42 0.27 -0.51 -0.22 -1.33 0.00 0.00 177.39 176.01 2gbl s LEU 344 N -4.89 1.87 -0.10 2.23 1.98 -0.89 -0.76 118.68 118.11 2gbl s LEU 344 Ca -0.08 -0.42 0.01 0.00 -2.89 0.00 0.00 54.13 50.76 2gbl s LEU 344 Cb 0.07 -1.10 0.02 0.00 0.66 0.00 0.00 46.19 45.84 2gbl s LEU 344 CO 0.72 0.10 -0.14 -0.75 -1.89 0.00 0.00 176.35 174.39 2gbl s LYS 345 N 0.47 2.05 -0.12 1.98 2.20 -0.61 -4.10 119.74 121.61 2gbl s LYS 345 Ca -0.16 -0.50 -0.05 0.00 -0.36 0.00 0.00 55.97 54.91 2gbl s LYS 345 Cb -0.16 -1.78 -0.04 0.00 -1.51 0.00 0.00 37.83 34.34 2gbl s LYS 345 CO 0.06 -0.08 0.06 0.42 -0.36 0.00 0.00 175.35 175.45 2gbl s ILE 346 N 1.03 4.83 0.00 5.43 1.01 -1.26 -1.76 121.20 130.49 2gbl s ILE 346 Ca -0.06 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.55 2gbl s ILE 346 Cb -0.15 -3.09 0.00 0.00 0.01 0.00 0.00 42.46 39.23 2gbl s ILE 346 CO -0.02 0.58 0.00 0.52 0.00 0.00 0.00 174.94 176.02 2gbl n VAL 347 N 2.38 0.00 -0.67 2.92 0.31 -0.61 -4.97 118.33 117.70 2gbl n VAL 347 Ca -0.19 0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2gbl n VAL 347 Cb 0.54 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.34 2gbl n VAL 347 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gbl s ALA 349 N -0.19 -2.04 0.29 0.00 0.00 -0.72 -4.95 121.76 114.15 2gbl s ALA 349 Ca 0.00 1.74 -0.29 0.00 0.00 0.00 0.00 51.96 53.42 2gbl s ALA 349 Cb 0.00 -1.25 -0.09 0.00 0.00 0.00 0.00 23.12 21.78 2gbl s ALA 349 CO 0.00 -0.24 1.07 0.71 0.00 0.00 0.00 175.76 177.29 2gbl s TYR 350 N -0.69 3.60 0.51 0.00 1.51 -1.26 -4.29 117.35 116.74 2gbl s TYR 350 Ca 0.04 1.73 0.20 0.00 -1.01 0.00 0.00 57.07 58.02 2gbl s TYR 350 Cb -0.02 -3.21 1.29 0.00 -0.11 0.00 0.00 41.96 39.91 2gbl s TYR 350 CO -0.05 -0.39 2.07 -1.35 -1.11 0.00 0.00 175.55 174.71 2gbl h PRO 351 N 3.67 0.05 0.00 -1.71 0.11 -1.85 -1.62 132.00 130.65 2gbl h PRO 351 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2gbl h PRO 351 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2gbl h PRO 351 CO 0.66 0.03 0.00 0.93 -0.21 0.00 0.00 178.00 179.41 2gbl h GLU 352 N 0.05 0.00 -0.93 1.05 3.07 -1.92 -3.24 114.58 112.65 2gbl h GLU 352 Ca 0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 2gbl h GLU 352 Cb 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 2gbl h GLU 352 CO -0.01 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.47 2gbl n SER 353 N -2.86 1.28 0.00 1.42 3.41 -0.61 -4.83 113.62 111.44 2gbl n SER 353 Ca 0.02 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.17 2gbl n SER 353 Cb 0.35 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 2gbl n SER 353 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gbl n ALA 354 N 0.32 0.00 -2.55 7.33 0.00 -1.22 -5.01 120.51 119.38 2gbl n ALA 354 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 2gbl n ALA 354 Cb 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.67 2gbl n ALA 354 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2gbl s GLY 355 N 0.00 1.71 0.19 0.00 0.00 -1.26 -4.98 107.32 102.98 2gbl s GLY 355 Ca 0.00 -1.61 -0.12 0.00 0.00 0.00 0.00 44.72 42.99 2gbl s GLY 355 CO 0.00 -1.55 1.79 1.41 0.00 0.00 0.00 173.10 174.75 2gbl h LEU 356 N 1.26 0.41 -0.43 0.66 4.07 -1.95 -1.67 115.31 117.67 2gbl h LEU 356 Ca -0.45 0.03 0.09 0.00 0.08 0.00 0.00 57.88 57.62 2gbl h LEU 356 Cb 1.25 -0.05 -0.09 0.00 1.08 0.00 0.00 40.66 42.85 2gbl h LEU 356 CO 0.58 0.28 -0.21 1.05 -1.08 0.00 0.00 178.44 179.06 2gbl h GLU 357 N 0.54 -0.12 0.21 1.13 4.11 -1.98 0.32 114.58 118.80 2gbl h GLU 357 Ca 0.24 0.01 0.01 0.00 0.07 0.00 0.00 59.36 59.69 2gbl h GLU 357 Cb 0.14 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 2gbl h GLU 357 CO -0.16 -0.08 -0.31 -0.44 0.07 0.00 0.00 179.01 178.09 2gbl h ASP 358 N -0.13 -0.85 -0.58 3.06 3.32 -1.84 -1.90 116.42 117.50 2gbl h ASP 358 Ca 0.21 0.09 0.11 0.00 0.02 0.00 0.00 57.03 57.45 2gbl h ASP 358 Cb 0.45 0.31 -0.09 0.00 0.22 0.00 0.00 39.33 40.22 2gbl h ASP 358 CO -0.51 -0.42 0.09 0.45 -1.72 0.00 0.00 179.24 177.14 2gbl h HIS 359 N -0.58 0.14 -0.62 4.55 3.86 -0.44 0.11 115.15 122.16 2gbl h HIS 359 Ca 0.01 0.04 0.10 0.00 -1.16 0.00 0.00 60.37 59.36 2gbl h HIS 359 Cb 0.57 0.03 -0.08 0.00 1.06 0.00 0.00 27.41 28.99 2gbl h HIS 359 CO -0.23 -0.06 0.21 1.25 0.86 0.00 0.00 177.93 179.96 2gbl h LEU 360 N 0.22 0.17 -0.17 2.43 6.46 0.16 -1.13 115.31 123.44 2gbl h LEU 360 Ca 0.30 0.09 -0.03 0.00 -0.12 0.00 0.00 57.88 58.12 2gbl h LEU 360 Cb 0.45 0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 2gbl h LEU 360 CO -0.41 0.10 -0.03 -0.61 -0.62 0.00 0.00 178.44 176.87 2gbl h GLN 361 N 0.37 0.33 -0.65 1.25 4.15 -0.40 -1.66 115.11 118.51 2gbl h GLN 361 Ca 0.32 -0.12 0.13 0.00 0.77 0.00 0.00 58.65 59.75 2gbl h GLN 361 Cb 0.43 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.06 2gbl h GLN 361 CO -0.34 0.58 0.44 0.82 -1.93 0.00 0.00 178.83 178.39 2gbl h ILE 362 N 0.05 0.84 0.12 2.39 1.08 0.10 0.90 117.51 122.98 2gbl h ILE 362 Ca 0.05 -0.12 -0.01 0.00 -0.39 0.00 0.00 64.86 64.39 2gbl h ILE 362 Cb 0.45 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 34.64 2gbl h ILE 362 CO 0.01 0.07 -0.06 0.40 -0.69 0.00 0.00 178.15 177.88 2gbl h ILE 363 N 0.36 1.03 0.02 -0.67 2.04 -1.15 -1.87 117.51 117.28 2gbl h ILE 363 Ca 0.31 -1.18 0.03 0.00 1.00 0.00 0.00 64.86 65.02 2gbl h ILE 363 Cb 0.72 1.71 -0.05 0.00 -0.74 0.00 0.00 36.82 38.46 2gbl h ILE 363 CO -0.08 0.26 -0.30 0.11 0.00 0.00 0.00 178.15 178.14 2gbl h LYS 364 N -0.77 -0.44 -0.65 2.37 1.57 -0.32 -0.48 116.57 117.84 2gbl h LYS 364 Ca -0.02 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 58.93 2gbl h LYS 364 Cb 0.55 0.10 -0.11 0.00 0.08 0.00 0.00 32.23 32.85 2gbl h LYS 364 CO 0.03 -0.29 0.04 1.03 -0.57 0.00 0.00 179.45 179.68 2gbl h SER 365 N -0.46 -0.22 1.40 0.86 0.87 0.72 -0.16 113.55 116.56 2gbl h SER 365 Ca 0.06 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 2gbl h SER 365 Cb 0.53 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 2gbl h SER 365 CO -0.24 -0.10 0.00 -0.08 -0.53 0.00 0.00 176.83 175.88 2gbl h GLU 366 N 0.15 0.00 -0.17 2.24 4.81 -0.75 -2.54 114.58 118.32 2gbl h GLU 366 Ca 0.34 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.38 2gbl h GLU 366 Cb 0.57 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.95 2gbl h GLU 366 CO -0.53 0.00 -0.68 0.82 -0.73 0.00 0.00 179.01 177.89 2gbl h ILE 367 N 0.00 1.31 -0.40 2.32 2.04 0.59 -2.62 117.51 120.74 2gbl h ILE 367 Ca 0.00 -1.94 -0.14 0.00 1.00 0.00 0.00 64.86 63.78 2gbl h ILE 367 Cb 0.70 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.68 2gbl h ILE 367 CO 0.00 0.61 -0.29 0.78 0.00 0.00 0.00 178.15 179.24 2gbl h ASN 368 N 0.48 0.96 1.71 1.72 2.35 -1.01 0.27 115.58 122.06 2gbl h ASN 368 Ca -0.02 -0.44 -0.01 0.00 -0.55 0.00 0.00 56.30 55.28 2gbl h ASN 368 Cb 1.28 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 39.38 2gbl h ASN 368 CO 0.13 1.19 -0.05 0.44 -1.65 0.00 0.00 177.43 177.50 2gbl h ASP 369 N 0.73 0.00 0.00 5.81 3.32 -1.50 -3.33 116.42 121.45 2gbl h ASP 369 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2gbl h ASP 369 Cb 0.88 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.43 2gbl h ASP 369 CO 0.08 0.05 -0.92 0.33 -1.72 0.00 0.00 179.24 177.06 2gbl n PHE 370 N -3.12 0.00 -4.11 4.55 7.35 -0.99 -5.03 117.46 116.11 2gbl n PHE 370 Ca 0.03 0.00 -0.29 0.00 -0.76 0.00 0.00 57.45 56.43 2gbl n PHE 370 Cb 0.49 -0.10 -0.05 0.00 0.35 0.00 0.00 39.48 40.17 2gbl n PHE 370 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 2gbl n LYS 371 N -1.51 -2.56 -0.87 -4.13 -0.00 0.96 -4.93 118.16 105.12 2gbl n LYS 371 Ca 0.00 0.31 -0.32 0.00 -0.00 0.00 0.00 58.31 58.30 2gbl n LYS 371 Cb 0.22 -4.36 0.14 0.00 -0.00 0.00 0.00 35.03 31.04 2gbl n LYS 371 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 2gbl n PRO 372 N -4.44 -0.18 -0.09 -1.58 -0.02 -1.25 -4.83 135.00 122.61 2gbl n PRO 372 Ca -0.25 0.02 -0.13 0.00 -2.02 0.00 0.00 63.50 61.12 2gbl n PRO 372 Cb 0.66 -2.31 -0.14 0.00 -0.02 0.00 0.00 33.50 31.68 2gbl n PRO 372 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gbl n ALA 373 N -3.76 1.43 -2.59 3.55 0.00 0.44 -4.86 120.51 114.73 2gbl n ALA 373 Ca 0.12 -1.14 -0.22 0.00 0.00 0.00 0.00 53.44 52.20 2gbl n ALA 373 Cb 0.52 -0.28 -0.13 0.00 0.00 0.00 0.00 19.45 19.56 2gbl n ALA 373 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2gbl s ARG 374 N -2.52 1.06 -0.02 0.00 0.52 -1.08 -1.71 118.95 115.20 2gbl s ARG 374 Ca -0.18 -1.04 -0.01 0.00 -0.52 0.00 0.00 55.73 53.98 2gbl s ARG 374 Cb 0.07 -1.21 0.00 0.00 0.52 0.00 0.00 34.95 34.34 2gbl s ARG 374 CO 0.75 0.28 0.04 0.42 0.02 0.00 0.00 175.30 176.82 2gbl s ILE 375 N -1.11 -0.00 -0.02 1.52 1.01 -0.24 -1.81 121.20 120.56 2gbl s ILE 375 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.70 2gbl s ILE 375 Cb -0.10 -0.07 0.01 0.00 0.01 0.00 0.00 42.46 42.31 2gbl s ILE 375 CO 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 174.94 174.94 2gbl s ALA 376 N 0.04 0.42 -0.34 9.38 0.00 -0.07 -0.34 121.76 130.83 2gbl s ALA 376 Ca -0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 2gbl s ALA 376 Cb -0.00 -0.20 0.07 0.00 0.00 0.00 0.00 23.12 22.99 2gbl s ALA 376 CO -0.00 0.04 0.09 0.42 0.00 0.00 0.00 175.76 176.31 2gbl s ILE 377 N 0.29 3.24 -0.76 0.00 1.01 -0.46 -0.39 121.20 124.13 2gbl s ILE 377 Ca -0.03 -1.57 -0.25 0.00 0.00 0.00 0.00 60.65 58.80 2gbl s ILE 377 Cb -0.06 -2.98 0.05 0.00 0.01 0.00 0.00 42.46 39.47 2gbl s ILE 377 CO -0.00 -0.32 1.21 -0.62 0.00 0.00 0.00 174.94 175.21 2gbl s ASP 378 N 1.47 6.23 0.00 3.58 -1.08 0.96 -2.38 116.67 125.44 2gbl s ASP 378 Ca 0.00 -0.79 0.00 0.00 -0.52 0.00 0.00 52.55 51.24 2gbl s ASP 378 Cb -0.21 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.73 2gbl s ASP 378 CO -0.01 -1.66 0.00 -0.24 0.52 0.00 0.00 175.17 173.77 2gbl n SER 379 N 8.77 -1.18 0.02 -0.34 2.88 -1.24 -2.96 113.62 119.56 2gbl n SER 379 Ca 0.06 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.59 2gbl n SER 379 Cb 0.48 -0.59 0.26 0.00 -0.75 0.00 0.00 64.21 63.61 2gbl n SER 379 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2gbl h LEU 380 N 0.00 0.47 -2.42 2.46 3.38 -0.53 -1.56 115.31 117.11 2gbl h LEU 380 Ca 0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2gbl h LEU 380 Cb 0.00 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2gbl h LEU 380 CO 0.00 0.62 -0.03 0.77 0.09 0.00 0.00 178.44 179.89 2gbl h SER 381 N 0.45 0.00 1.36 -0.43 4.64 -1.93 0.15 113.55 117.79 2gbl h SER 381 Ca 0.08 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.33 2gbl h SER 381 Cb 0.49 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2gbl h SER 381 CO 0.03 0.03 -0.66 0.00 -0.87 0.00 0.00 176.83 175.36 2gbl h ALA 382 N 1.97 0.71 0.00 5.18 0.00 -1.61 -3.27 119.26 122.24 2gbl h ALA 382 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2gbl h ALA 382 Cb 0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2gbl h ALA 382 CO 0.00 0.44 0.00 -0.07 0.00 0.00 0.00 179.25 179.63 2gbl h LEU 383 N 0.00 0.00 -0.02 0.00 3.38 -0.65 -3.02 115.31 115.00 2gbl h LEU 383 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2gbl h LEU 383 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2gbl h LEU 383 CO 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.55 2gbl n ALA 384 N -2.05 2.48 -1.68 1.53 0.00 -0.79 -4.76 120.51 115.24 2gbl n ALA 384 Ca 0.04 -0.14 -0.49 0.00 0.00 0.00 0.00 53.44 52.85 2gbl n ALA 384 Cb 0.48 -1.46 -0.05 0.00 0.00 0.00 0.00 19.45 18.42 2gbl n ALA 384 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2gbl n ARG 385 N -1.34 2.15 0.00 0.00 1.74 -1.14 -3.66 116.66 114.41 2gbl n ARG 385 Ca 0.12 0.78 0.00 0.00 -0.77 0.00 0.00 57.85 57.98 2gbl n ARG 385 Cb 0.28 -2.64 0.00 0.00 -1.02 0.00 0.00 32.46 29.08 2gbl n ARG 385 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gbl n GLY 386 N 4.46 2.07 2.09 -0.13 0.00 -1.26 -4.99 105.19 107.44 2gbl n GLY 386 Ca 0.23 -0.31 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 2gbl n GLY 386 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2gbl n VAL 387 N 0.00 0.00 -2.81 1.61 0.31 -1.24 -4.96 118.33 111.23 2gbl n VAL 387 Ca 0.00 -0.29 -0.29 0.00 -0.01 0.00 0.00 64.34 63.75 2gbl n VAL 387 Cb 0.00 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.91 2gbl n VAL 387 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2gbl s SER 388 N -0.70 6.45 0.28 4.52 1.04 -1.26 -4.92 113.70 119.11 2gbl s SER 388 Ca 0.27 1.07 -0.03 0.00 0.48 0.00 0.00 55.95 57.74 2gbl s SER 388 Cb -0.09 -2.30 0.37 0.00 0.10 0.00 0.00 66.02 64.11 2gbl s SER 388 CO 0.56 -0.44 1.92 -1.13 0.98 0.00 0.00 173.24 175.13 2gbl h ASN 389 N 1.01 0.98 0.54 7.02 -0.73 -1.94 0.41 115.58 122.87 2gbl h ASN 389 Ca -0.47 -0.06 -0.12 0.00 1.87 0.00 0.00 56.30 57.52 2gbl h ASN 389 Cb 1.19 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 39.52 2gbl h ASN 389 CO 0.63 0.76 -0.57 0.78 -0.37 0.00 0.00 177.43 178.66 2gbl h ASN 390 N 1.13 0.04 -0.23 1.15 2.35 -1.98 0.30 115.58 118.33 2gbl h ASN 390 Ca 0.29 -0.02 -0.20 0.00 -0.55 0.00 0.00 56.30 55.82 2gbl h ASN 390 Cb -0.04 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.33 2gbl h ASN 390 CO -0.05 0.60 -0.63 0.00 -1.65 0.00 0.00 177.43 175.69 2gbl h ALA 391 N 1.40 0.38 0.10 -0.83 0.00 -1.80 -2.72 119.26 115.80 2gbl h ALA 391 Ca -0.01 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 2gbl h ALA 391 Cb 1.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2gbl h ALA 391 CO 0.08 0.66 -0.05 0.35 0.00 0.00 0.00 179.25 180.29 2gbl h PHE 392 N 0.60 -0.12 -0.97 0.00 3.57 -0.53 -1.80 116.94 117.68 2gbl h PHE 392 Ca -0.01 -0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.63 2gbl h PHE 392 Cb 1.25 0.04 -0.09 0.00 2.79 0.00 0.00 35.95 39.95 2gbl h PHE 392 CO 0.08 0.10 0.61 0.00 -2.23 0.00 0.00 178.31 176.87 2gbl h ARG 393 N -0.34 0.78 -0.52 1.11 3.08 -0.45 0.16 114.38 118.21 2gbl h ARG 393 Ca -0.01 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 2gbl h ARG 393 Cb 0.28 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 2gbl h ARG 393 CO 0.02 0.52 0.20 0.37 -1.07 0.00 0.00 179.97 180.01 2gbl h GLN 394 N 0.81 0.75 -0.23 0.04 4.15 -1.13 -0.74 115.11 118.75 2gbl h GLN 394 Ca 0.50 -0.11 -0.09 0.00 0.77 0.00 0.00 58.65 59.72 2gbl h GLN 394 Cb 0.71 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.27 2gbl h GLN 394 CO -0.27 0.63 -0.19 0.35 -1.93 0.00 0.00 178.83 177.41 2gbl h PHE 395 N 0.74 0.64 0.21 3.99 3.57 0.13 -1.93 116.94 124.30 2gbl h PHE 395 Ca 0.18 -0.18 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2gbl h PHE 395 Cb 0.16 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.77 2gbl h PHE 395 CO 0.01 0.86 -0.10 0.28 -2.23 0.00 0.00 178.31 177.13 2gbl h VAL 396 N 0.24 0.79 -0.73 1.41 2.07 -0.76 0.13 116.25 119.41 2gbl h VAL 396 Ca 0.04 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.67 2gbl h VAL 396 Cb 0.73 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 2gbl h VAL 396 CO 0.05 0.00 0.48 0.40 0.02 0.00 0.00 177.57 178.52 2gbl h ILE 397 N -0.28 0.89 0.72 4.57 1.08 -1.18 0.41 117.51 123.71 2gbl h ILE 397 Ca -0.03 -0.19 -0.03 0.00 -0.39 0.00 0.00 64.86 64.22 2gbl h ILE 397 Cb 0.22 0.29 0.00 0.00 -3.07 0.00 0.00 36.82 34.26 2gbl h ILE 397 CO 0.05 0.10 -0.39 1.23 -0.69 0.00 0.00 178.15 178.45 2gbl h GLY 398 N 0.55 -1.09 2.00 5.37 0.00 -0.20 -0.15 103.07 109.57 2gbl h GLY 398 Ca 0.34 0.43 -0.11 0.00 0.00 0.00 0.00 47.33 47.99 2gbl h GLY 398 CO -0.12 -0.39 -0.54 -2.08 0.00 0.00 0.00 176.54 173.42 2gbl h VAL 399 N -1.02 1.08 0.62 4.60 2.07 -0.86 -2.97 116.25 119.77 2gbl h VAL 399 Ca -0.09 -2.08 -0.03 0.00 0.82 0.00 0.00 66.70 65.32 2gbl h VAL 399 Cb 0.80 2.23 0.01 0.00 -1.52 0.00 0.00 31.29 32.81 2gbl h VAL 399 CO 0.13 0.53 -0.30 0.74 0.02 0.00 0.00 177.57 178.69 2gbl h THR 400 N 0.00 0.05 0.00 2.57 2.02 -0.08 -2.88 112.91 114.59 2gbl h THR 400 Ca -0.01 -0.39 -0.03 0.00 0.77 0.00 0.00 66.41 66.76 2gbl h THR 400 Cb 1.19 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.67 2gbl h THR 400 CO 0.07 0.01 -0.15 1.23 0.37 0.00 0.00 175.52 177.05 2gbl h GLY 401 N -1.20 0.00 0.80 2.16 0.00 -1.13 -0.46 103.07 103.24 2gbl h GLY 401 Ca -0.09 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 2gbl h GLY 401 CO 0.14 0.00 0.01 -1.82 0.00 0.00 0.00 176.54 174.87 2gbl h TYR 402 N 0.00 0.32 -0.35 5.60 3.20 -1.58 -0.54 116.97 123.61 2gbl h TYR 402 Ca -0.00 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.81 2gbl h TYR 402 Cb 0.32 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2gbl h TYR 402 CO 0.00 0.49 0.20 0.00 -1.64 0.00 0.00 178.16 177.22 2gbl h ALA 403 N 0.78 0.45 -0.07 1.82 0.00 -1.21 -1.60 119.26 119.43 2gbl h ALA 403 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2gbl h ALA 403 Cb 0.36 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2gbl h ALA 403 CO 0.01 -0.05 0.04 0.87 0.00 0.00 0.00 179.25 180.12 2gbl h LYS 404 N 0.45 0.08 0.00 0.00 1.57 -0.94 -0.71 116.57 117.03 2gbl h LYS 404 Ca 0.12 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2gbl h LYS 404 Cb 0.03 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2gbl h LYS 404 CO -0.02 0.05 0.00 -0.56 -0.57 0.00 0.00 179.45 178.35 2gbl h GLN 405 N 0.08 0.00 -0.34 3.15 3.07 -1.03 -3.02 115.11 117.02 2gbl h GLN 405 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.77 2gbl h GLN 405 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.55 2gbl h GLN 405 CO -0.01 0.00 0.00 -1.91 0.09 0.00 0.00 178.83 177.00 2gbl n GLU 406 N -2.73 2.14 -1.88 0.06 4.07 -0.61 -4.80 120.64 116.90 2gbl n GLU 406 Ca 0.02 -1.74 -0.18 0.00 -0.06 0.00 0.00 57.16 55.21 2gbl n GLU 406 Cb 0.31 -1.44 -0.05 0.00 -0.06 0.00 0.00 31.44 30.21 2gbl n GLU 406 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2gbl n GLU 407 N 0.94 -1.30 -3.57 5.31 -0.58 -1.00 -4.98 120.64 115.46 2gbl n GLU 407 Ca 0.18 1.00 -0.38 0.00 -0.42 0.00 0.00 57.16 57.54 2gbl n GLU 407 Cb 0.46 -5.35 -0.10 0.00 -0.57 0.00 0.00 31.44 25.88 2gbl n GLU 407 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2gbl s ILE 408 N -2.75 5.30 0.00 -3.67 1.01 -0.33 -4.88 121.20 115.88 2gbl s ILE 408 Ca 0.00 0.27 -0.30 0.00 0.00 0.00 0.00 60.65 60.62 2gbl s ILE 408 Cb 0.00 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 2gbl s ILE 408 CO 0.00 0.27 1.18 -0.89 0.00 0.00 0.00 174.94 175.50 2gbl s THR 409 N 1.56 4.21 -0.06 2.92 2.01 -0.70 -4.43 115.64 121.16 2gbl s THR 409 Ca 0.09 1.57 0.05 0.00 0.31 0.00 0.00 61.69 63.71 2gbl s THR 409 Cb -0.15 -4.01 -0.01 0.00 0.01 0.00 0.00 72.50 68.35 2gbl s THR 409 CO 0.09 0.07 -0.22 -0.83 -0.69 0.00 0.00 174.62 173.04 2gbl s GLY 410 N 1.25 1.16 -0.26 4.40 0.00 -0.99 -1.07 107.32 111.81 2gbl s GLY 410 Ca 0.57 -0.89 -0.02 0.00 0.00 0.00 0.00 44.72 44.37 2gbl s GLY 410 CO 0.26 -0.47 -0.04 -2.27 0.00 0.00 0.00 173.10 170.58 2gbl s LEU 411 N 0.02 3.36 -0.03 0.66 2.96 0.53 -0.54 118.68 125.63 2gbl s LEU 411 Ca -0.07 -0.90 0.03 0.00 -0.22 0.00 0.00 54.13 52.98 2gbl s LEU 411 Cb -0.14 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 2gbl s LEU 411 CO 0.04 -0.15 -0.10 -0.36 -1.32 0.00 0.00 176.35 174.46 2gbl s PHE 412 N 1.34 2.81 -0.10 5.38 0.40 0.12 -1.35 117.98 126.58 2gbl s PHE 412 Ca -0.00 -0.08 -0.05 0.00 -0.60 0.00 0.00 56.93 56.20 2gbl s PHE 412 Cb -0.17 -1.63 -0.04 0.00 0.51 0.00 0.00 43.02 41.69 2gbl s PHE 412 CO -0.03 0.29 0.10 0.99 0.70 0.00 0.00 175.22 177.27 2gbl s THR 413 N -0.86 5.14 -0.13 0.64 2.01 -1.00 0.25 115.64 121.69 2gbl s THR 413 Ca 0.14 0.04 -0.05 0.00 0.31 0.00 0.00 61.69 62.13 2gbl s THR 413 Cb -0.11 -3.24 0.06 0.00 0.01 0.00 0.00 72.50 69.23 2gbl s THR 413 CO 0.03 0.59 0.26 0.21 -0.69 0.00 0.00 174.62 175.02 2gbl s ASN 414 N -1.07 0.35 -0.44 3.53 2.47 -0.52 0.08 114.94 119.34 2gbl s ASN 414 Ca 0.16 0.58 -0.18 0.00 0.42 0.00 0.00 52.86 53.84 2gbl s ASN 414 Cb -0.12 0.67 0.03 0.00 -1.45 0.00 0.00 41.25 40.38 2gbl s ASN 414 CO 0.05 -0.24 0.48 -0.89 -3.72 0.00 0.00 177.10 172.78 2gbl s THR 415 N 2.37 5.04 0.34 -5.21 2.01 -1.26 -2.09 115.64 116.84 2gbl s THR 415 Ca 0.01 -0.34 -0.28 0.00 0.31 0.00 0.00 61.69 61.39 2gbl s THR 415 Cb -0.12 -4.10 -0.10 0.00 0.01 0.00 0.00 72.50 68.20 2gbl s THR 415 CO -0.08 -0.50 1.29 -0.94 -0.69 0.00 0.00 174.62 173.70 2gbl s SER 416 N 1.97 6.72 0.58 3.53 1.04 -0.35 -4.90 113.70 122.29 2gbl s SER 416 Ca 0.13 2.65 0.39 0.00 0.48 0.00 0.00 55.95 59.60 2gbl s SER 416 Cb -0.17 -2.65 2.01 0.00 0.10 0.00 0.00 66.02 65.32 2gbl s SER 416 CO 0.14 -0.57 2.17 0.44 0.98 0.00 0.00 173.24 176.41 2gbl h ASP 417 N 3.27 0.00 -3.50 7.02 3.32 -1.97 -3.41 116.42 121.15 2gbl h ASP 417 Ca -0.49 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.11 2gbl h ASP 417 Cb 1.23 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.45 2gbl h ASP 417 CO 0.65 0.00 -0.79 0.00 -1.72 0.00 0.00 179.24 177.38 2gbl s GLN 418 N -3.94 1.15 0.06 3.56 -2.07 -1.26 -5.07 119.66 112.09 2gbl s GLN 418 Ca -0.03 -0.24 -0.30 0.00 -1.82 0.00 0.00 55.36 52.96 2gbl s GLN 418 Cb 0.11 -1.04 -0.04 0.00 -1.09 0.00 0.00 33.01 30.95 2gbl s GLN 418 CO 0.40 -0.01 0.97 -0.59 -1.32 0.00 0.00 175.29 174.74 2gbl s PHE 419 N 0.71 3.73 0.16 9.60 -0.12 -1.26 -4.31 117.98 126.49 2gbl s PHE 419 Ca -0.12 1.75 0.00 0.00 -0.05 0.00 0.00 56.93 58.51 2gbl s PHE 419 Cb -0.14 -3.09 0.00 0.00 -0.63 0.00 0.00 43.02 39.16 2gbl s PHE 419 CO 0.02 0.09 0.00 -1.33 -0.05 0.00 0.00 175.22 173.94 2gbl n MET 420 N 3.34 -4.52 -0.20 1.99 2.81 -1.26 -4.73 117.12 114.54 2gbl n MET 420 Ca 0.04 3.30 0.00 0.00 -1.81 0.00 0.00 57.70 59.24 2gbl n MET 420 Cb 0.50 -3.51 0.00 0.00 -0.71 0.00 0.00 33.22 29.50 2gbl n MET 420 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gbl n GLY 421 N 1.54 0.75 3.68 3.03 0.00 -1.04 -4.93 105.19 108.22 2gbl n GLY 421 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.49 2gbl n GLY 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gbl n ALA 422 N -1.17 0.09 0.84 4.61 0.00 -1.26 -4.85 120.51 118.78 2gbl n ALA 422 Ca 0.00 0.39 0.11 0.00 0.00 0.00 0.00 53.44 53.94 2gbl n ALA 422 Cb 0.00 -2.28 0.06 0.00 0.00 0.00 0.00 19.45 17.23 2gbl n ALA 422 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2gbl n HIS 423 N 4.99 0.09 -4.30 0.00 8.25 -1.26 -4.91 115.22 118.08 2gbl n HIS 423 Ca 0.23 0.03 -0.18 0.00 -0.26 0.00 0.00 57.72 57.53 2gbl n HIS 423 Cb 0.20 -0.24 -0.13 0.00 1.12 0.00 0.00 29.99 30.93 2gbl n HIS 423 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2gbl s SER 424 N -3.33 1.31 0.13 0.41 1.04 -1.26 -5.05 113.70 106.96 2gbl s SER 424 Ca 0.07 -0.38 -0.24 0.00 0.48 0.00 0.00 55.95 55.89 2gbl s SER 424 Cb 0.16 -0.08 -0.02 0.00 0.10 0.00 0.00 66.02 66.17 2gbl s SER 424 CO 0.79 0.02 1.64 0.40 0.98 0.00 0.00 173.24 177.06 2gbl h ILE 425 N 4.64 0.44 -4.03 -1.02 5.03 -2.03 -3.42 117.51 117.12 2gbl h ILE 425 Ca -0.35 0.00 -0.47 0.00 -0.12 0.00 0.00 64.86 63.91 2gbl h ILE 425 Cb 1.18 0.44 -0.24 0.00 -3.03 0.00 0.00 36.82 35.17 2gbl h ILE 425 CO 0.45 0.00 -0.80 -0.89 -0.68 0.00 0.00 178.15 176.23 2gbl s THR 426 N -6.08 1.27 0.17 -0.27 2.01 -1.26 -4.87 115.64 106.62 2gbl s THR 426 Ca -0.15 -1.15 -0.01 0.00 0.31 0.00 0.00 61.69 60.69 2gbl s THR 426 Cb 0.10 -1.16 -0.12 0.00 0.01 0.00 0.00 72.50 71.34 2gbl s THR 426 CO 0.67 -0.01 1.42 0.44 -0.69 0.00 0.00 174.62 176.44 2gbl h ASP 427 N 4.71 0.43 0.01 3.53 3.32 -1.95 -3.16 116.42 123.30 2gbl h ASP 427 Ca -0.40 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.35 2gbl h ASP 427 Cb 1.18 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2gbl h ASP 427 CO 0.43 1.05 -0.01 -1.54 -1.72 0.00 0.00 179.24 177.45 2gbl n SER 428 N -3.80 0.92 -3.40 6.45 3.41 -1.26 -4.97 113.62 110.96 2gbl n SER 428 Ca -0.04 -1.28 -0.18 0.00 -0.26 0.00 0.00 58.87 57.11 2gbl n SER 428 Cb 0.73 -0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.75 2gbl n SER 428 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2gbl n HIS 429 N -0.30 -2.25 -3.71 7.33 8.25 -1.19 -4.95 115.22 118.39 2gbl n HIS 429 Ca 0.21 0.86 -0.36 0.00 -0.26 0.00 0.00 57.72 58.17 2gbl n HIS 429 Cb 0.26 -4.49 -0.07 0.00 1.12 0.00 0.00 29.99 26.81 2gbl n HIS 429 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2gbl s ILE 430 N -3.42 5.39 0.00 1.59 -1.09 -1.26 -5.09 121.20 117.32 2gbl s ILE 430 Ca 0.22 0.32 0.00 0.00 -2.23 0.00 0.00 60.65 58.96 2gbl s ILE 430 Cb -0.04 -3.50 0.00 0.00 -1.58 0.00 0.00 42.46 37.34 2gbl s ILE 430 CO 0.75 0.49 0.00 -0.38 -1.23 0.00 0.00 174.94 174.57 2gbl n ILE 433 N 2.99 0.00 -4.65 2.92 -0.00 -1.26 -5.04 119.36 114.32 2gbl n ILE 433 Ca -0.16 0.00 -0.30 0.00 -0.00 0.00 0.00 62.75 62.29 2gbl n ILE 433 Cb 0.53 0.00 -0.13 0.00 -0.00 0.00 0.00 39.64 40.04 2gbl n ILE 433 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 2gbl s THR 434 N -3.23 2.61 -0.15 1.39 -1.32 -1.26 -4.99 115.64 108.69 2gbl s THR 434 Ca 0.00 -1.32 -0.25 0.00 -1.21 0.00 0.00 61.69 58.91 2gbl s THR 434 Cb 0.00 -2.10 -0.25 0.00 -1.51 0.00 0.00 72.50 68.64 2gbl s THR 434 CO 0.00 0.30 0.61 0.44 -2.21 0.00 0.00 174.62 173.76 2gbl h ASP 435 N 4.45 0.08 -3.56 8.08 3.32 -1.76 -3.47 116.42 123.56 2gbl h ASP 435 Ca -0.48 -0.85 -0.57 0.00 0.02 0.00 0.00 57.03 55.15 2gbl h ASP 435 Cb 1.15 -0.03 -0.33 0.00 0.22 0.00 0.00 39.33 40.35 2gbl h ASP 435 CO 0.46 1.23 -0.84 -0.89 -1.72 0.00 0.00 179.24 177.48 2gbl s THR 436 N -2.30 1.47 -0.19 0.35 2.01 -0.23 -2.43 115.64 114.32 2gbl s THR 436 Ca -0.21 -0.70 -0.01 0.00 0.31 0.00 0.00 61.69 61.08 2gbl s THR 436 Cb 0.00 -1.30 0.00 0.00 0.01 0.00 0.00 72.50 71.22 2gbl s THR 436 CO 0.69 0.43 -0.13 -0.63 -0.69 0.00 0.00 174.62 174.28 2gbl s ILE 437 N 0.38 2.68 -0.21 1.82 1.01 -0.24 0.02 121.20 126.65 2gbl s ILE 437 Ca -0.12 -0.74 -0.06 0.00 0.00 0.00 0.00 60.65 59.73 2gbl s ILE 437 Cb -0.15 -2.17 -0.03 0.00 0.01 0.00 0.00 42.46 40.13 2gbl s ILE 437 CO 0.05 0.49 0.02 -0.63 0.00 0.00 0.00 174.94 174.87 2gbl s ILE 438 N 1.26 4.07 -0.13 2.92 -1.09 0.54 -0.37 121.20 128.40 2gbl s ILE 438 Ca 0.03 -0.27 0.02 0.00 -2.23 0.00 0.00 60.65 58.20 2gbl s ILE 438 Cb -0.14 -2.86 0.00 0.00 -1.58 0.00 0.00 42.46 37.88 2gbl s ILE 438 CO -0.07 0.41 -0.19 -0.22 -1.23 0.00 0.00 174.94 173.64 2gbl s LEU 439 N 1.15 2.32 -0.10 2.97 2.96 0.33 -1.45 118.68 126.84 2gbl s LEU 439 Ca 0.03 -0.51 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 2gbl s LEU 439 Cb -0.14 -1.50 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 2gbl s LEU 439 CO 0.02 0.11 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.33 2gbl s LEU 440 N 0.65 3.10 -0.15 -0.68 1.43 0.11 -1.13 118.68 122.01 2gbl s LEU 440 Ca -0.10 -0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 52.75 2gbl s LEU 440 Cb -0.16 -1.70 0.04 0.00 0.03 0.00 0.00 46.19 44.40 2gbl s LEU 440 CO 0.02 0.27 0.41 0.00 0.23 0.00 0.00 176.35 177.29 2gbl s GLN 441 N -0.27 0.48 0.37 1.70 -2.07 -0.87 -3.80 119.66 115.19 2gbl s GLN 441 Ca 0.04 0.57 -0.26 0.00 -1.82 0.00 0.00 55.36 53.88 2gbl s GLN 441 Cb -0.13 0.24 -0.09 0.00 -1.09 0.00 0.00 33.01 31.94 2gbl s GLN 441 CO 0.03 -0.06 1.10 0.71 -1.32 0.00 0.00 175.29 175.75 2gbl s TYR 442 N 0.21 3.28 -0.09 9.60 4.12 -1.26 -1.80 117.35 131.39 2gbl s TYR 442 Ca -0.00 1.63 -0.00 0.00 0.02 0.00 0.00 57.07 58.71 2gbl s TYR 442 Cb -0.03 -3.26 0.02 0.00 -1.52 0.00 0.00 41.96 37.18 2gbl s TYR 442 CO 0.01 -0.84 -0.06 0.08 0.02 0.00 0.00 175.55 174.75 2gbl s VAL 443 N -1.45 0.84 -0.47 0.71 1.01 0.18 -4.27 120.40 116.95 2gbl s VAL 443 Ca 0.54 -0.19 -0.28 0.00 0.00 0.00 0.00 61.98 62.05 2gbl s VAL 443 Cb -0.28 -0.89 0.03 0.00 0.00 0.00 0.00 36.38 35.25 2gbl s VAL 443 CO 0.35 0.33 1.08 -0.70 0.00 0.00 0.00 175.10 176.16 2gbl s GLU 444 N 1.64 3.68 -0.17 2.72 2.12 0.02 -1.42 118.70 127.28 2gbl s GLU 444 Ca 0.02 0.46 0.01 0.00 0.36 0.00 0.00 54.97 55.82 2gbl s GLU 444 Cb -0.13 -3.91 0.03 0.00 0.26 0.00 0.00 34.13 30.38 2gbl s GLU 444 CO -0.06 -1.33 -0.14 0.42 -0.54 0.00 0.00 175.26 173.62 2gbl s ILE 445 N 4.24 1.66 -1.01 -3.70 -1.09 0.83 -4.22 121.20 117.92 2gbl s ILE 445 Ca 0.45 -0.80 -0.15 0.00 -2.23 0.00 0.00 60.65 57.92 2gbl s ILE 445 Cb -0.08 -1.61 0.01 0.00 -1.58 0.00 0.00 42.46 39.20 2gbl s ILE 445 CO 0.30 0.37 0.70 0.54 -1.23 0.00 0.00 174.94 175.62 2gbl n ARG 446 N 4.72 -1.12 -1.28 2.79 1.74 -1.26 -0.77 116.66 121.48 2gbl n ARG 446 Ca -0.17 0.61 -0.09 0.00 -0.77 0.00 0.00 57.85 57.43 2gbl n ARG 446 Cb 0.49 -3.46 -0.04 0.00 -1.02 0.00 0.00 32.46 28.43 2gbl n ARG 446 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gbl n GLY 447 N -1.77 0.95 3.15 -0.13 0.00 -1.26 -4.95 105.19 101.18 2gbl n GLY 447 Ca -0.15 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.63 2gbl n GLY 447 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gbl s GLU 448 N -2.71 0.81 -0.92 1.61 2.02 0.05 -5.10 118.70 114.46 2gbl s GLU 448 Ca 0.00 -0.87 -0.18 0.00 0.02 0.00 0.00 54.97 53.94 2gbl s GLU 448 Cb 0.00 -0.79 0.15 0.00 0.10 0.00 0.00 34.13 33.59 2gbl s GLU 448 CO 0.00 0.18 1.08 -1.64 0.02 0.00 0.00 175.26 174.90 2gbl s MET 449 N -1.54 3.62 0.26 1.61 -1.94 -1.26 -0.12 119.30 119.92 2gbl s MET 449 Ca -0.02 -1.90 0.06 0.00 -1.71 0.00 0.00 55.69 52.12 2gbl s MET 449 Cb -0.09 -4.84 -0.03 0.00 2.01 0.00 0.00 34.83 31.88 2gbl s MET 449 CO 0.02 -1.69 0.32 -1.54 -0.01 0.00 0.00 175.02 172.12 2gbl s SER 450 N 3.37 6.03 0.31 3.03 1.04 -0.51 -4.91 113.70 122.06 2gbl s SER 450 Ca 0.31 -0.06 0.05 0.00 0.48 0.00 0.00 55.95 56.73 2gbl s SER 450 Cb -0.06 -1.65 -0.02 0.00 0.10 0.00 0.00 66.02 64.40 2gbl s SER 450 CO -0.09 -0.10 0.45 -0.13 0.98 0.00 0.00 173.24 174.34 2gbl s ARG 451 N -3.96 3.25 -0.01 4.02 3.00 -1.25 0.48 118.95 124.47 2gbl s ARG 451 Ca 0.35 -0.85 -0.12 0.00 0.00 0.00 0.00 55.73 55.11 2gbl s ARG 451 Cb -0.09 -2.82 0.01 0.00 0.00 0.00 0.00 34.95 32.06 2gbl s ARG 451 CO 0.28 0.17 0.24 0.00 0.00 0.00 0.00 175.30 175.99 2gbl s ALA 452 N -2.14 -0.60 -0.00 2.13 0.00 -0.75 -2.39 121.76 118.01 2gbl s ALA 452 Ca 0.41 0.17 0.05 0.00 0.00 0.00 0.00 51.96 52.59 2gbl s ALA 452 Cb -0.09 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 2gbl s ALA 452 CO 0.31 -0.23 -0.15 -1.50 0.00 0.00 0.00 175.76 174.19 2gbl s ILE 453 N -1.26 1.16 -0.07 0.00 2.07 0.13 -2.06 121.20 121.18 2gbl s ILE 453 Ca -0.13 -0.68 -0.04 0.00 -1.41 0.00 0.00 60.65 58.39 2gbl s ILE 453 Cb -0.06 -0.98 0.03 0.00 0.13 0.00 0.00 42.46 41.59 2gbl s ILE 453 CO 0.03 0.29 0.17 0.21 -1.91 0.00 0.00 174.94 173.72 2gbl s ASN 454 N -0.45 -0.16 -0.82 4.50 2.47 -0.29 -1.45 114.94 118.75 2gbl s ASN 454 Ca 0.05 0.35 -0.22 0.00 0.42 0.00 0.00 52.86 53.46 2gbl s ASN 454 Cb -0.06 0.28 0.09 0.00 -1.45 0.00 0.00 41.25 40.10 2gbl s ASN 454 CO -0.00 -0.12 1.13 -0.69 -3.72 0.00 0.00 177.10 173.69 2gbl s VAL 455 N 0.82 4.35 0.12 -5.21 1.01 -1.26 -0.52 120.40 119.72 2gbl s VAL 455 Ca -0.06 -0.79 -0.19 0.00 0.00 0.00 0.00 61.98 60.94 2gbl s VAL 455 Cb -0.08 -4.80 -0.05 0.00 0.00 0.00 0.00 36.38 31.45 2gbl s VAL 455 CO -0.04 -1.59 1.74 0.15 0.00 0.00 0.00 175.10 175.36 2gbl h PHE 456 N 9.38 0.35 -2.83 5.22 3.57 -1.04 -3.45 116.94 128.14 2gbl h PHE 456 Ca -0.05 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.38 2gbl h PHE 456 Cb 1.04 -0.11 -0.17 0.00 2.79 0.00 0.00 35.95 39.50 2gbl h PHE 456 CO 1.10 0.27 -0.02 -1.59 -2.23 0.00 0.00 178.31 175.85 2gbl s LYS 457 N -5.96 0.98 -0.20 1.11 -2.85 -1.17 -4.99 119.74 106.66 2gbl s LYS 457 Ca -0.13 -0.25 -0.05 0.00 -1.00 0.00 0.00 55.97 54.54 2gbl s LYS 457 Cb 0.09 0.45 0.10 0.00 -2.06 0.00 0.00 37.83 36.40 2gbl s LYS 457 CO 0.71 -0.34 0.37 -1.64 0.10 0.00 0.00 175.35 174.54 2gbl s MET 458 N -2.35 0.29 0.13 1.78 -1.94 -1.26 -1.07 119.30 114.88 2gbl s MET 458 Ca -0.06 0.79 -0.18 0.00 -1.71 0.00 0.00 55.69 54.52 2gbl s MET 458 Cb -0.01 -0.06 -0.03 0.00 2.01 0.00 0.00 34.83 36.73 2gbl s MET 458 CO -0.01 -0.40 1.78 0.00 -0.01 0.00 0.00 175.02 176.38 2gbl h ARG 459 N 8.20 0.31 -0.01 2.03 3.08 -1.86 -3.28 114.38 122.86 2gbl h ARG 459 Ca -0.17 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2gbl h ARG 459 Cb 1.13 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.11 2gbl h ARG 459 CO 0.18 0.21 -0.80 0.41 -1.07 0.00 0.00 179.97 178.89 2gbl n GLY 460 N -1.17 -0.60 1.17 0.04 0.00 -1.26 -5.01 105.19 98.36 2gbl n GLY 460 Ca -0.02 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 45.31 2gbl n GLY 460 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2gbl n SER 461 N -0.94 1.33 -0.10 1.61 2.88 -1.24 -5.08 113.62 112.08 2gbl n SER 461 Ca 0.06 -1.55 -0.11 0.00 -1.33 0.00 0.00 58.87 55.94 2gbl n SER 461 Cb 0.38 -0.04 -0.15 0.00 -0.75 0.00 0.00 64.21 63.65 2gbl n SER 461 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 2gbl n TRP 462 N -1.01 0.00 -0.85 0.66 -0.00 -1.26 -4.85 117.44 110.13 2gbl n TRP 462 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.51 2gbl n TRP 462 Cb 0.19 -1.00 0.00 0.00 -0.00 0.00 0.00 31.31 30.50 2gbl n TRP 462 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 177.69 175.30 2gbl n HIS 463 N -2.82 0.00 -2.23 5.87 1.44 -1.25 -4.85 115.22 111.39 2gbl n HIS 463 Ca -0.35 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 54.96 2gbl n HIS 463 Cb 1.14 -0.24 -0.02 0.00 0.12 0.00 0.00 29.99 30.98 2gbl n HIS 463 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2gbl s ASP 464 N -2.90 6.80 -0.12 4.39 2.15 1.28 -4.89 116.67 123.38 2gbl s ASP 464 Ca 0.00 2.52 0.16 0.00 0.43 0.00 0.00 52.55 55.65 2gbl s ASP 464 Cb 0.00 -2.64 0.66 0.00 -0.30 0.00 0.00 42.92 40.64 2gbl s ASP 464 CO 0.00 -0.50 1.54 0.29 -0.17 0.00 0.00 175.17 176.34 2gbl n LYS 465 N 0.69 3.59 -3.38 4.34 4.76 -1.26 -4.39 118.16 122.51 2gbl n LYS 465 Ca 0.01 -2.58 -0.33 0.00 -2.87 0.00 0.00 58.31 52.54 2gbl n LYS 465 Cb 0.44 -1.88 -0.06 0.00 -1.84 0.00 0.00 35.03 31.69 2gbl n LYS 465 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2gbl s ALA 466 N -1.92 3.56 -0.71 7.82 0.00 -1.26 -5.00 121.76 124.24 2gbl s ALA 466 Ca 0.46 -0.19 -0.14 0.00 0.00 0.00 0.00 51.96 52.09 2gbl s ALA 466 Cb 0.30 -2.49 0.18 0.00 0.00 0.00 0.00 23.12 21.12 2gbl s ALA 466 CO 0.21 0.48 0.65 0.42 0.00 0.00 0.00 175.76 177.51 2gbl s ILE 467 N -1.67 5.34 0.20 0.00 1.01 -1.26 -4.48 121.20 120.33 2gbl s ILE 467 Ca 0.43 -2.16 -0.26 0.00 0.00 0.00 0.00 60.65 58.67 2gbl s ILE 467 Cb -0.13 -4.35 -0.08 0.00 0.01 0.00 0.00 42.46 37.91 2gbl s ILE 467 CO 0.20 -0.96 0.81 -0.13 0.00 0.00 0.00 174.94 174.86 2gbl s ARG 468 N 0.66 4.59 0.47 2.79 0.52 -0.52 -3.77 118.95 123.68 2gbl s ARG 468 Ca 0.13 1.20 -0.15 0.00 -0.52 0.00 0.00 55.73 56.39 2gbl s ARG 468 Cb -0.18 -3.19 -0.08 0.00 0.52 0.00 0.00 34.95 32.03 2gbl s ARG 468 CO -0.05 0.52 0.91 -2.00 0.02 0.00 0.00 175.30 174.71 2gbl s GLU 469 N -1.31 3.92 -0.10 3.54 2.12 0.10 0.21 118.70 127.18 2gbl s GLU 469 Ca 0.38 0.81 -0.22 0.00 0.36 0.00 0.00 54.97 56.31 2gbl s GLU 469 Cb -0.23 -2.22 0.05 0.00 0.26 0.00 0.00 34.13 31.99 2gbl s GLU 469 CO 0.27 -0.17 0.53 -0.59 -0.54 0.00 0.00 175.26 174.75 2gbl s PHE 470 N -2.50 -0.51 0.40 5.30 -0.12 -1.00 -0.61 117.98 118.94 2gbl s PHE 470 Ca 0.57 1.04 0.08 0.00 -0.05 0.00 0.00 56.93 58.56 2gbl s PHE 470 Cb -0.10 0.24 -0.03 0.00 -0.63 0.00 0.00 43.02 42.50 2gbl s PHE 470 CO 0.30 -0.42 0.29 0.00 -0.05 0.00 0.00 175.22 175.34 2gbl s MET 471 N -0.62 2.47 -0.05 1.99 0.23 -0.96 -3.96 119.30 118.41 2gbl s MET 471 Ca -0.07 -1.58 0.02 0.00 -1.03 0.00 0.00 55.69 53.03 2gbl s MET 471 Cb -0.03 -2.27 0.01 0.00 -1.53 0.00 0.00 34.83 31.01 2gbl s MET 471 CO 0.05 -0.10 -0.09 0.42 -2.03 0.00 0.00 175.02 173.27 2gbl s ILE 472 N -2.48 0.85 0.00 3.16 1.01 -1.26 -2.06 121.20 120.42 2gbl s ILE 472 Ca 0.44 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.77 2gbl s ILE 472 Cb -0.02 -0.80 0.00 0.00 0.01 0.00 0.00 42.46 41.66 2gbl s ILE 472 CO 0.26 0.29 0.00 -1.54 0.00 0.00 0.00 174.94 173.94 2gbl n SER 473 N 3.79 0.42 0.07 3.58 3.41 -0.54 -4.97 113.62 119.38 2gbl n SER 473 Ca -0.23 -0.78 -0.05 0.00 -0.26 0.00 0.00 58.87 57.55 2gbl n SER 473 Cb 0.52 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.62 2gbl n SER 473 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2gbl h ASP 474 N 0.00 0.32 0.38 4.04 3.32 -1.90 -1.72 116.42 120.86 2gbl h ASP 474 Ca 0.00 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.89 2gbl h ASP 474 Cb 0.00 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.46 2gbl h ASP 474 CO 0.00 0.78 0.00 0.11 -1.72 0.00 0.00 179.24 178.41 2gbl h LYS 475 N 0.23 0.00 0.00 3.56 1.57 -1.84 -2.82 116.57 117.27 2gbl h LYS 475 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2gbl h LYS 475 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2gbl h LYS 475 CO 0.08 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.37 2gbl n GLY 476 N -0.67 0.40 3.65 3.86 0.00 -0.65 -4.82 105.19 106.96 2gbl n GLY 476 Ca -0.01 -1.80 -0.40 0.00 0.00 0.00 0.00 46.02 43.80 2gbl n GLY 476 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gbl s PRO 477 N 0.00 4.19 -0.30 1.61 0.04 -1.26 -1.46 135.00 137.82 2gbl s PRO 477 Ca 0.00 0.63 -0.03 0.00 0.04 0.00 0.00 61.00 61.64 2gbl s PRO 477 Cb 0.00 -3.59 0.04 0.00 0.04 0.00 0.00 34.50 30.99 2gbl s PRO 477 CO 0.00 -0.28 0.01 0.34 0.04 0.00 0.00 177.00 177.11 2gbl s ASP 478 N 1.25 4.88 -0.55 6.66 2.15 -0.87 -5.00 116.67 125.19 2gbl s ASP 478 Ca 0.29 -1.13 -0.22 0.00 0.43 0.00 0.00 52.55 51.91 2gbl s ASP 478 Cb -0.16 -1.74 0.05 0.00 -0.30 0.00 0.00 42.92 40.77 2gbl s ASP 478 CO 0.10 -0.24 0.85 -0.63 -0.17 0.00 0.00 175.17 175.07 2gbl s ILE 479 N 1.31 4.53 0.00 4.11 1.01 -1.26 -2.25 121.20 128.65 2gbl s ILE 479 Ca -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.57 2gbl s ILE 479 Cb -0.19 -4.49 0.00 0.00 0.01 0.00 0.00 42.46 37.80 2gbl s ILE 479 CO -0.01 -1.07 0.00 0.29 0.00 0.00 0.00 174.94 174.16 2gbl n LYS 480 N 7.09 3.01 -3.14 2.79 5.02 0.23 -4.99 118.16 128.16 2gbl n LYS 480 Ca -0.02 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.08 2gbl n LYS 480 Cb 0.46 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.50 2gbl n LYS 480 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2gbl s ASP 481 N -1.00 5.30 0.63 4.39 1.01 -1.26 -4.53 116.67 121.22 2gbl s ASP 481 Ca 0.00 -0.68 -0.09 0.00 0.71 0.00 0.00 52.55 52.49 2gbl s ASP 481 Cb 0.00 -0.20 -0.00 0.00 1.01 0.00 0.00 42.92 43.73 2gbl s ASP 481 CO 0.00 -1.00 1.00 -0.94 0.21 0.00 0.00 175.17 174.44 2gbl s SER 482 N -4.45 5.72 -1.18 0.27 1.04 -1.26 0.03 113.70 113.88 2gbl s SER 482 Ca 0.56 1.04 -0.09 0.00 0.48 0.00 0.00 55.95 57.94 2gbl s SER 482 Cb -0.07 -2.00 0.23 0.00 0.10 0.00 0.00 66.02 64.28 2gbl s SER 482 CO 0.34 -1.09 1.51 0.49 0.98 0.00 0.00 173.24 175.47 2gbl n PHE 483 N -2.76 3.71 -0.04 5.02 3.01 -1.25 -4.83 117.46 120.32 2gbl n PHE 483 Ca 0.05 -3.10 0.02 0.00 1.01 0.00 0.00 57.45 55.44 2gbl n PHE 483 Cb 0.56 -1.76 0.35 0.00 -0.01 0.00 0.00 39.48 38.63 2gbl n PHE 483 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2gbl h ARG 484 N 6.16 0.62 -0.99 -1.08 2.43 -1.93 -3.01 114.38 116.59 2gbl h ARG 484 Ca 0.28 -0.06 -0.26 0.00 -0.81 0.00 0.00 59.98 59.13 2gbl h ARG 484 Cb 0.73 -0.13 -0.15 0.00 -0.42 0.00 0.00 29.97 30.00 2gbl h ARG 484 CO 1.33 0.47 0.33 0.27 -1.51 0.00 0.00 179.97 180.86 2gbl n ASN 485 N -4.41 3.41 -4.33 -3.80 6.94 -1.26 -4.91 115.26 106.89 2gbl n ASN 485 Ca 0.04 -2.83 -0.20 0.00 -0.02 0.00 0.00 54.58 51.56 2gbl n ASN 485 Cb 0.10 -0.68 -0.11 0.00 -2.36 0.00 0.00 39.78 36.74 2gbl n ASN 485 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 2gbl s PHE 486 N -1.76 1.73 0.22 -2.53 0.40 -1.14 -0.90 117.98 114.01 2gbl s PHE 486 Ca 0.30 -0.52 0.10 0.00 -0.60 0.00 0.00 56.93 56.21 2gbl s PHE 486 Cb 0.25 -0.84 -0.05 0.00 0.51 0.00 0.00 43.02 42.90 2gbl s PHE 486 CO 0.06 0.32 -0.19 -1.21 0.70 0.00 0.00 175.22 174.90 2gbl s GLU 487 N -3.12 1.48 -0.97 0.44 2.02 -1.00 -4.84 118.70 112.71 2gbl s GLU 487 Ca 0.18 -1.61 -0.12 0.00 0.02 0.00 0.00 54.97 53.44 2gbl s GLU 487 Cb -0.04 -1.53 -0.00 0.00 0.10 0.00 0.00 34.13 32.66 2gbl s GLU 487 CO 0.06 0.29 0.72 0.54 0.02 0.00 0.00 175.26 176.90 2gbl n ARG 488 N -0.22 -1.28 -0.02 1.61 1.74 -1.26 -1.37 116.66 115.86 2gbl n ARG 488 Ca -0.09 0.74 -0.22 0.00 -0.77 0.00 0.00 57.85 57.52 2gbl n ARG 488 Cb 0.59 -3.90 -0.13 0.00 -1.02 0.00 0.00 32.46 27.99 2gbl n ARG 488 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2gbl h ILE 489 N -1.00 0.73 -1.30 0.55 5.03 -1.90 -3.03 117.51 116.59 2gbl h ILE 489 Ca -0.52 -2.31 0.38 0.00 -0.12 0.00 0.00 64.86 62.29 2gbl h ILE 489 Cb 1.30 2.45 -0.07 0.00 -3.03 0.00 0.00 36.82 37.47 2gbl h ILE 489 CO 0.41 0.74 0.91 0.40 -0.68 0.00 0.00 178.15 179.94 2gbl h ILE 490 N -0.22 0.33 0.00 -0.67 1.08 -1.97 0.88 117.51 116.95 2gbl h ILE 490 Ca -0.40 -0.03 0.00 0.00 -0.39 0.00 0.00 64.86 64.05 2gbl h ILE 490 Cb 1.84 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 35.84 2gbl h ILE 490 CO 0.01 0.01 0.00 -1.54 -0.69 0.00 0.00 178.15 175.95 2gbl n SER 491 N -4.28 0.47 0.00 1.72 3.41 -1.26 -4.33 113.62 109.36 2gbl n SER 491 Ca 0.30 0.59 0.00 0.00 -0.26 0.00 0.00 58.87 59.49 2gbl n SER 491 Cb 1.33 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 2gbl n SER 491 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gbl n GLY 492 N 0.53 3.11 2.46 5.00 0.00 0.30 -2.49 105.19 114.10 2gbl n GLY 492 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 2gbl n GLY 492 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gbl s SER 493 N -1.15 2.26 1.21 1.61 0.01 -1.26 -0.80 113.70 115.58 2gbl s SER 493 Ca 0.00 -2.74 -0.16 0.00 1.31 0.00 0.00 55.95 54.36 2gbl s SER 493 Cb 0.00 -0.50 0.29 0.00 0.21 0.00 0.00 66.02 66.02 2gbl s SER 493 CO 0.00 -0.22 1.02 -2.84 0.41 0.00 0.00 173.24 171.61 2gbl s PRO 494 N 0.40 -1.26 -0.31 12.44 0.02 -1.14 -4.88 135.00 140.26 2gbl s PRO 494 Ca 0.26 0.47 0.03 0.00 0.02 0.00 0.00 61.00 61.78 2gbl s PRO 494 Cb -0.08 -1.54 0.09 0.00 0.02 0.00 0.00 34.50 32.98 2gbl s PRO 494 CO -0.11 -3.86 0.00 0.99 -0.33 0.00 0.00 177.00 173.70 2gbl s THR 495 N -2.58 2.07 0.31 0.99 2.01 -0.47 -4.96 115.64 113.01 2gbl s THR 495 Ca 0.68 -1.99 -0.30 0.00 0.31 0.00 0.00 61.69 60.40 2gbl s THR 495 Cb -0.19 -2.42 -0.12 0.00 0.01 0.00 0.00 72.50 69.78 2gbl s THR 495 CO 0.61 -0.41 1.52 0.54 -0.69 0.00 0.00 174.62 176.19 2gbl n ARG 496 N 4.38 2.56 -2.70 4.92 1.74 -1.26 -2.36 116.66 123.95 2gbl n ARG 496 Ca -0.03 0.91 -0.06 0.00 -0.77 0.00 0.00 57.85 57.90 2gbl n ARG 496 Cb 0.42 -2.65 0.08 0.00 -1.02 0.00 0.00 32.46 29.29 2gbl n ARG 496 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 2gbl n ILE 497 N 1.60 0.51 0.00 0.55 -6.64 -0.07 -4.95 119.36 110.35 2gbl n ILE 497 Ca 0.07 -2.18 0.00 0.00 -1.77 0.00 0.00 62.75 58.87 2gbl n ILE 497 Cb 0.36 0.91 0.00 0.00 -1.44 0.00 0.00 39.64 39.47 2gbl n ILE 497 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 2gbl n THR 498 N -0.50 0.00 -3.87 7.28 -2.24 -1.26 -4.91 114.28 108.78 2gbl n THR 498 Ca 0.01 1.17 -0.38 0.00 -2.27 0.00 0.00 64.05 62.59 2gbl n THR 498 Cb 0.84 -2.13 0.03 0.00 -2.10 0.00 0.00 70.33 66.97 2gbl n THR 498 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2gbl n VAL 499 N -1.68 -4.34 -0.68 2.28 0.31 -1.26 -4.41 118.33 108.55 2gbl n VAL 499 Ca 0.00 -0.79 0.00 0.00 -0.01 0.00 0.00 64.34 63.54 2gbl n VAL 499 Cb 0.00 -3.35 0.00 0.00 -0.91 0.00 0.00 33.84 29.58 2gbl n VAL 499 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2gbl n ASP 500 N -2.48 -0.91 -4.75 4.52 -0.08 -1.26 -5.09 116.55 106.49 2gbl n ASP 500 Ca -0.12 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.81 2gbl n ASP 500 Cb 0.59 -0.46 0.05 0.00 2.34 0.00 0.00 41.12 43.65 2gbl n ASP 500 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2gbl s GLU 501 N -0.13 2.68 0.00 -0.67 2.02 -1.26 -4.77 118.70 116.56 2gbl s GLU 501 Ca 0.00 1.73 0.00 0.00 0.02 0.00 0.00 54.97 56.72 2gbl s GLU 501 Cb 0.00 -1.90 0.00 0.00 0.10 0.00 0.00 34.13 32.33 2gbl s GLU 501 CO 0.00 -1.41 0.00 1.17 0.02 0.00 0.00 175.26 175.04 2gbl n LYS 502 N -2.09 0.00 -0.17 1.61 3.00 -1.26 -3.40 118.16 115.84 2gbl n LYS 502 Ca 0.13 0.00 0.05 0.00 -0.00 0.00 0.00 58.31 58.49 2gbl n LYS 502 Cb 0.50 -0.41 0.14 0.00 0.00 0.00 0.00 35.03 35.25 2gbl n LYS 502 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2gbl n SER 503 N -0.10 1.73 -1.48 3.14 3.41 -1.26 -5.06 113.62 113.99 2gbl n SER 503 Ca 0.00 -2.03 0.10 0.00 -0.26 0.00 0.00 58.87 56.68 2gbl n SER 503 Cb 0.00 -0.23 -0.06 0.00 -0.26 0.00 0.00 64.21 63.66 2gbl n SER 503 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gbl n GLU 504 N 0.38 -3.63 0.00 4.33 1.02 -1.22 -4.00 120.64 117.52 2gbl n GLU 504 Ca 0.10 2.91 0.00 0.00 -0.02 0.00 0.00 57.16 60.15 2gbl n GLU 504 Cb 0.29 -3.91 0.00 0.00 -0.02 0.00 0.00 31.44 27.79 2gbl n GLU 504 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2gbl n LEU 505 N -3.61 0.00 -3.08 -4.62 7.94 -1.26 -2.42 117.00 109.95 2gbl n LEU 505 Ca -0.06 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 54.47 2gbl n LEU 505 Cb 0.60 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.57 2gbl n LEU 505 CO 0.02 0.00 1.18 -1.54 -1.11 0.00 0.00 177.39 175.95 2gbl n SER 506 N -0.66 6.78 0.02 1.96 3.41 -1.26 -4.45 113.62 119.42 2gbl n SER 506 Ca 0.00 -3.76 -0.11 0.00 -0.26 0.00 0.00 58.87 54.74 2gbl n SER 506 Cb 0.00 -0.96 -0.14 0.00 -0.26 0.00 0.00 64.21 62.85 2gbl n SER 506 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2gbl h ARG 507 N 3.30 0.08 -0.65 4.33 -0.00 -1.61 -3.19 114.38 116.65 2gbl h ARG 507 Ca 0.48 -0.14 0.00 0.00 -0.00 0.00 0.00 59.98 60.32 2gbl h ARG 507 Cb 0.29 0.05 0.00 0.00 -0.00 0.00 0.00 29.97 30.31 2gbl h ARG 507 CO 1.22 0.81 0.00 0.44 -0.00 0.00 0.00 179.97 182.44 2gbl n ILE 508 N -3.25 1.34 -0.91 0.08 -0.00 -1.26 -4.97 119.36 110.40 2gbl n ILE 508 Ca -0.14 -0.78 0.00 0.00 -0.00 0.00 0.00 62.75 61.83 2gbl n ILE 508 Cb 1.02 -0.14 0.00 0.00 -0.00 0.00 0.00 39.64 40.52 2gbl n ILE 508 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 2gbl n VAL 509 N 0.53 0.00 0.00 7.28 0.31 -1.21 -4.08 118.33 121.17 2gbl n VAL 509 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.49 2gbl n VAL 509 Cb 0.69 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.62 2gbl n VAL 509 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2gbl n ARG 510 N -0.29 0.00 0.00 5.55 5.12 -1.26 -3.97 116.66 121.81 2gbl n ARG 510 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2gbl n ARG 510 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2gbl n ARG 510 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2gbl n GLY 511 N 0.00 1.42 0.20 -0.13 0.00 -1.26 -4.95 105.19 100.47 2gbl n GLY 511 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2gbl n GLY 511 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2gbl h VAL 512 N 0.00 1.29 -0.58 1.61 -1.51 -1.95 -3.09 116.25 112.03 2gbl h VAL 512 Ca 0.00 -1.42 -0.72 0.00 -1.23 0.00 0.00 66.70 63.34 2gbl h VAL 512 Cb 0.00 1.63 -0.08 0.00 -2.13 0.00 0.00 31.29 30.71 2gbl h VAL 512 CO 0.00 0.42 2.64 1.67 -1.23 0.00 0.00 177.57 181.07 2gbl n GLN 513 N -4.06 3.12 0.00 5.19 -0.06 -1.26 -4.20 117.38 116.10 2gbl n GLN 513 Ca -0.01 -2.99 0.00 0.00 -2.00 0.00 0.00 57.00 51.99 2gbl n GLN 513 Cb 0.45 -3.22 0.00 0.00 -4.06 0.00 0.00 30.24 23.41 2gbl n GLN 513 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 2gbl n GLU 514 N 5.89 0.91 -3.71 3.69 0.00 -1.17 -4.98 120.64 121.27 2gbl n GLU 514 Ca 0.48 -0.94 -0.13 0.00 0.00 0.00 0.00 57.16 56.57 2gbl n GLU 514 Cb 0.40 -0.96 -0.14 0.00 0.00 0.00 0.00 31.44 30.74 2gbl n GLU 514 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2gbl s LYS 515 N -0.46 0.15 0.00 5.31 3.01 -1.26 -4.82 119.74 121.67 2gbl s LYS 515 Ca 0.00 0.56 0.00 0.00 -1.01 0.00 0.00 55.97 55.52 2gbl s LYS 515 Cb 0.00 -0.13 0.00 0.00 -1.01 0.00 0.00 37.83 36.69 2gbl s LYS 515 CO 0.00 -0.21 0.00 0.41 0.51 0.00 0.00 175.35 176.06 2gbl n GLY 516 N 4.65 1.04 3.86 -3.33 0.00 -1.26 -5.11 105.19 105.05 2gbl n GLY 516 Ca -0.18 0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 2gbl n GLY 516 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gbl s PRO 517 N 0.00 3.42 0.00 1.61 0.02 -1.26 -5.10 135.00 133.68 2gbl s PRO 517 Ca 0.00 -0.15 0.00 0.00 0.02 0.00 0.00 61.00 60.87 2gbl s PRO 517 Cb 0.00 -3.17 0.00 0.00 0.02 0.00 0.00 34.50 31.35 2gbl s PRO 517 CO 0.00 0.77 0.00 -0.85 -0.33 0.00 0.00 177.00 176.59 2gbl n GLU 518 N 2.01 0.00 0.00 5.54 -0.00 -1.26 -5.05 120.64 121.89 2gbl n GLU 518 Ca -0.20 0.00 0.11 0.00 -0.00 0.00 0.00 57.16 57.08 2gbl n GLU 518 Cb 0.55 0.00 0.68 0.00 -0.00 0.00 0.00 31.44 32.67 2gbl n GLU 518 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58