#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 0.27 -4.56 4.31 8.25 -1.26 -5.01 115.22 117.22 2gbl n HIS 15 Ca 0.00 -0.13 -0.27 0.00 -0.26 0.00 0.00 57.72 57.06 2gbl n HIS 15 Cb 0.00 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.02 2gbl n HIS 15 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2gbl s GLN 16 N -1.73 1.94 -0.63 -0.41 -0.21 -1.26 -5.09 119.66 112.26 2gbl s GLN 16 Ca 0.29 -2.18 -0.33 0.00 0.02 0.00 0.00 55.36 53.16 2gbl s GLN 16 Cb 0.16 -0.91 -0.15 0.00 1.00 0.00 0.00 33.01 33.10 2gbl s GLN 16 CO 0.23 -0.38 2.41 0.00 -2.12 0.00 0.00 175.29 175.43 2gbl n ALA 17 N -0.95 0.61 -0.39 6.09 0.00 -1.26 -4.77 120.51 119.84 2gbl n ALA 17 Ca -0.08 -0.29 -0.15 0.00 0.00 0.00 0.00 53.44 52.92 2gbl n ALA 17 Cb 0.66 -2.52 -0.02 0.00 0.00 0.00 0.00 19.45 17.57 2gbl n ALA 17 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2gbl n ILE 18 N 7.37 0.00 -3.00 0.00 -0.00 -1.26 -4.88 119.36 117.59 2gbl n ILE 18 Ca 0.51 0.00 -0.35 0.00 -0.00 0.00 0.00 62.75 62.91 2gbl n ILE 18 Cb 0.19 -0.11 -0.06 0.00 -0.00 0.00 0.00 39.64 39.65 2gbl n ILE 18 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2gbl s ALA 19 N 0.77 3.30 0.05 -1.39 0.00 -1.26 -4.98 121.76 118.25 2gbl s ALA 19 Ca 0.24 0.25 0.09 0.00 0.00 0.00 0.00 51.96 52.54 2gbl s ALA 19 Cb -0.34 -2.93 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 2gbl s ALA 19 CO 0.18 0.27 -0.25 0.15 0.00 0.00 0.00 175.76 176.11 2gbl s LYS 20 N -2.37 1.68 -0.19 0.00 1.02 -1.26 -1.00 119.74 117.63 2gbl s LYS 20 Ca 0.49 -1.09 -0.11 0.00 0.02 0.00 0.00 55.97 55.28 2gbl s LYS 20 Cb -0.15 -1.87 -0.05 0.00 -0.52 0.00 0.00 37.83 35.24 2gbl s LYS 20 CO 0.20 0.48 0.17 1.41 -0.92 0.00 0.00 175.35 176.69 2gbl s MET 21 N -1.29 4.20 0.44 1.68 -2.45 0.07 -4.81 119.30 117.15 2gbl s MET 21 Ca 0.11 -0.15 -0.23 0.00 -1.25 0.00 0.00 55.69 54.17 2gbl s MET 21 Cb -0.10 -3.42 -0.08 0.00 1.25 0.00 0.00 34.83 32.48 2gbl s MET 21 CO 0.02 0.28 1.14 1.03 1.05 0.00 0.00 175.02 178.54 2gbl s ARG 22 N 0.41 3.85 0.01 4.11 0.52 -1.25 -1.12 118.95 125.47 2gbl s ARG 22 Ca 0.10 1.72 0.20 0.00 -0.52 0.00 0.00 55.73 57.23 2gbl s ARG 22 Cb -0.12 -2.45 -0.20 0.00 0.52 0.00 0.00 34.95 32.70 2gbl s ARG 22 CO -0.01 -0.46 0.60 0.25 0.02 0.00 0.00 175.30 175.71 2gbl n THR 23 N -0.38 0.69 -0.71 0.02 -2.24 -1.26 -4.87 114.28 105.53 2gbl n THR 23 Ca 0.07 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2gbl n THR 23 Cb 0.48 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 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 -2.60 -0.30 -2.33 -0.78 2.81 -1.26 -4.73 117.12 107.92 2gbl n MET 24 Ca -0.10 0.08 -0.42 0.00 -1.81 0.00 0.00 57.70 55.44 2gbl n MET 24 Cb 0.75 -4.06 -0.03 0.00 -0.71 0.00 0.00 33.22 29.17 2gbl n MET 24 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2gbl s ILE 25 N -1.71 4.05 -0.22 2.02 1.01 -1.26 -4.89 121.20 120.21 2gbl s ILE 25 Ca 0.00 1.35 -0.39 0.00 0.00 0.00 0.00 60.65 61.60 2gbl s ILE 25 Cb 0.00 -3.87 -0.16 0.00 0.01 0.00 0.00 42.46 38.45 2gbl s ILE 25 CO 0.00 -0.06 1.69 1.21 0.00 0.00 0.00 174.94 177.78 2gbl n GLU 26 N 6.00 1.21 0.00 2.79 2.13 -1.26 -1.34 120.64 130.16 2gbl n GLU 26 Ca 0.13 0.44 0.00 0.00 0.66 0.00 0.00 57.16 58.39 2gbl n GLU 26 Cb 0.45 -2.13 0.00 0.00 0.27 0.00 0.00 31.44 30.03 2gbl n GLU 26 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2gbl n GLY 27 N 3.97 3.04 0.27 8.31 0.00 -1.26 -1.55 105.19 117.96 2gbl n GLY 27 Ca 0.25 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.14 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 1.12 0.00 1.61 3.57 -1.51 -2.94 116.94 118.79 2gbl h PHE 28 Ca 0.00 -0.33 -0.04 0.00 3.53 0.00 0.00 57.97 61.13 2gbl h PHE 28 Cb 0.00 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.50 2gbl h PHE 28 CO 0.00 1.16 -0.19 -0.44 -2.23 0.00 0.00 178.31 176.62 2gbl h ASP 29 N 0.76 0.00 -0.08 0.41 3.32 -1.90 -1.25 116.42 117.68 2gbl h ASP 29 Ca 0.06 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 2gbl h ASP 29 Cb 0.98 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.53 2gbl h ASP 29 CO 0.09 0.19 -0.13 0.44 -1.72 0.00 0.00 179.24 178.11 2gbl h ASP 30 N 0.00 0.25 -0.99 6.45 3.32 -1.89 0.30 116.42 123.86 2gbl h ASP 30 Ca -0.00 -0.54 0.05 0.00 0.02 0.00 0.00 57.03 56.55 2gbl h ASP 30 Cb 0.53 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 39.95 2gbl h ASP 30 CO 0.02 0.74 0.64 0.40 -1.72 0.00 0.00 179.24 179.33 2gbl h ILE 31 N -0.24 1.14 -0.22 0.35 2.04 -1.25 -1.48 117.51 117.86 2gbl h ILE 31 Ca 0.01 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2gbl h ILE 31 Cb 0.70 -0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2gbl h ILE 31 CO 0.03 0.22 0.00 -1.54 0.00 0.00 0.00 178.15 176.86 2gbl n SER 32 N -4.46 1.90 -3.69 1.72 3.41 -0.53 0.62 113.62 112.58 2gbl n SER 32 Ca 0.14 -1.78 -0.26 0.00 -0.26 0.00 0.00 58.87 56.71 2gbl n SER 32 Cb 0.13 -0.14 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 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 0.48 -1.92 0.00 7.33 8.25 -0.56 -3.66 115.22 125.15 2gbl n HIS 33 Ca 0.16 0.64 0.00 0.00 -0.26 0.00 0.00 57.72 58.26 2gbl n HIS 33 Cb 0.36 -3.80 0.00 0.00 1.12 0.00 0.00 29.99 27.67 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 -1.66 0.98 0.00 -1.41 0.00 0.96 -5.00 105.19 99.06 2gbl n GLY 34 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.02 0.94 3.76 -0.02 0.00 -1.24 -3.95 105.19 104.66 2gbl n GLY 35 Ca 0.00 -1.93 -0.40 0.00 0.00 0.00 0.00 46.02 43.69 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 4.59 0.15 0.99 1.43 -0.28 -4.71 118.68 120.86 2gbl s LEU 36 Ca 0.00 1.77 -0.31 0.00 -1.03 0.00 0.00 54.13 54.55 2gbl s LEU 36 Cb 0.00 -3.45 -0.10 0.00 0.03 0.00 0.00 46.19 42.67 2gbl s LEU 36 CO 0.00 0.14 1.67 -2.84 0.23 0.00 0.00 176.35 175.55 2gbl s PRO 37 N -0.92 4.17 0.35 1.29 0.02 -1.26 -0.75 135.00 137.90 2gbl s PRO 37 Ca 0.39 2.46 -0.29 0.00 0.02 0.00 0.00 61.00 63.59 2gbl s PRO 37 Cb -0.24 -3.30 -0.11 0.00 0.02 0.00 0.00 34.50 30.87 2gbl s PRO 37 CO 0.29 -0.71 1.49 -0.89 -0.33 0.00 0.00 177.00 176.85 2gbl n ILE 38 N 4.26 1.73 -0.84 2.83 -0.00 -0.17 -3.07 119.36 124.10 2gbl n ILE 38 Ca 0.15 -0.43 0.00 0.00 -0.00 0.00 0.00 62.75 62.47 2gbl n ILE 38 Cb 0.38 -1.92 0.00 0.00 -0.00 0.00 0.00 39.64 38.10 2gbl n ILE 38 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2gbl n GLY 39 N 0.95 0.56 3.61 7.39 0.00 -1.26 -4.93 105.19 111.52 2gbl n GLY 39 Ca 0.04 0.00 -0.28 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 -0.46 1.95 -0.08 1.61 0.52 -1.17 -4.62 118.95 116.70 2gbl s ARG 40 Ca 0.00 -2.12 0.01 0.00 -0.52 0.00 0.00 55.73 53.10 2gbl s ARG 40 Cb 0.00 -1.50 -0.03 0.00 0.52 0.00 0.00 34.95 33.94 2gbl s ARG 40 CO 0.00 -0.11 -0.10 -1.54 0.02 0.00 0.00 175.30 173.57 2gbl s SER 41 N -3.70 4.40 -0.24 0.23 1.04 -1.26 -1.99 113.70 112.19 2gbl s SER 41 Ca 0.31 -0.12 -0.08 0.00 0.48 0.00 0.00 55.95 56.55 2gbl s SER 41 Cb 0.09 -1.17 -0.04 0.00 0.10 0.00 0.00 66.02 65.00 2gbl s SER 41 CO 0.16 0.32 0.09 -0.89 0.98 0.00 0.00 173.24 173.90 2gbl s THR 42 N -0.56 4.66 0.10 2.02 2.01 0.10 -3.31 115.64 120.66 2gbl s THR 42 Ca 0.08 -0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.72 2gbl s THR 42 Cb -0.12 -3.17 -0.06 0.00 0.01 0.00 0.00 72.50 69.17 2gbl s THR 42 CO 0.02 0.35 0.99 -0.22 -0.69 0.00 0.00 174.62 175.07 2gbl s LEU 43 N 1.30 4.47 -0.22 4.42 2.96 0.06 -0.60 118.68 131.07 2gbl s LEU 43 Ca 0.05 1.81 -0.01 0.00 -0.22 0.00 0.00 54.13 55.77 2gbl s LEU 43 Cb -0.15 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 43.02 2gbl s LEU 43 CO 0.04 -0.13 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.25 2gbl s VAL 44 N 0.18 1.04 0.13 1.68 1.01 0.43 0.27 120.40 125.15 2gbl s VAL 44 Ca 0.49 -0.94 0.09 0.00 0.00 0.00 0.00 61.98 61.61 2gbl s VAL 44 Cb -0.24 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 2gbl s VAL 44 CO 0.30 -0.19 -0.22 -0.94 0.00 0.00 0.00 175.10 174.05 2gbl s SER 45 N 1.61 2.78 0.17 3.32 1.04 0.11 -0.75 113.70 121.97 2gbl s SER 45 Ca -0.03 -0.75 -0.24 0.00 0.48 0.00 0.00 55.95 55.41 2gbl s SER 45 Cb -0.18 -0.17 0.06 0.00 0.10 0.00 0.00 66.02 65.84 2gbl s SER 45 CO -0.08 0.06 0.96 -0.83 0.98 0.00 0.00 173.24 174.33 2gbl s GLY 46 N -2.17 -0.18 0.98 7.32 0.00 -0.95 -0.52 107.32 111.81 2gbl s GLY 46 Ca 0.11 0.04 -0.16 0.00 0.00 0.00 0.00 44.72 44.71 2gbl s GLY 46 CO 0.06 0.22 1.30 -0.51 0.00 0.00 0.00 173.10 174.17 2gbl s THR 47 N -3.16 1.96 0.25 0.90 -4.23 -1.26 -1.87 115.64 108.23 2gbl s THR 47 Ca 0.13 0.00 -0.31 0.00 -1.18 0.00 0.00 61.69 60.33 2gbl s THR 47 Cb -0.02 -2.95 -0.13 0.00 1.34 0.00 0.00 72.50 70.74 2gbl s THR 47 CO 0.03 0.00 1.43 -0.24 -0.54 0.00 0.00 174.62 175.29 2gbl n SER 48 N -3.86 2.89 -0.82 3.99 2.88 -1.26 -2.89 113.62 114.55 2gbl n SER 48 Ca 0.15 1.15 -0.10 0.00 -1.33 0.00 0.00 58.87 58.74 2gbl n SER 48 Cb 0.59 -1.45 -0.03 0.00 -0.75 0.00 0.00 64.21 62.57 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 2.09 0.84 0.11 0.46 0.00 -1.26 -4.93 105.19 102.50 2gbl n GLY 49 Ca 0.11 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 45.68 2gbl n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2gbl h THR 50 N 0.00 0.00 0.00 2.61 1.35 -1.89 -3.48 112.91 111.50 2gbl h THR 50 Ca -0.20 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 2gbl h THR 50 Cb 0.76 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 2gbl h THR 50 CO 0.28 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.16 2gbl n GLY 51 N 1.24 1.27 0.37 5.82 0.00 -1.26 -4.89 105.19 107.75 2gbl n GLY 51 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.31 1.61 1.57 -1.93 0.74 116.57 117.56 2gbl h LYS 52 Ca 0.00 0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.89 2gbl h LYS 52 Cb 0.00 0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.41 2gbl h LYS 52 CO 0.00 -0.46 -0.09 1.15 -0.57 0.00 0.00 179.45 179.47 2gbl h THR 53 N -0.72 0.65 -0.42 -0.16 2.02 -1.97 -1.34 112.91 110.99 2gbl h THR 53 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 2gbl h THR 53 Cb 0.66 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 2gbl h THR 53 CO -0.08 0.00 0.27 0.25 0.37 0.00 0.00 175.52 176.33 2gbl h LEU 54 N -0.03 0.48 0.09 2.58 5.85 -1.93 0.36 115.31 122.71 2gbl h LEU 54 Ca 0.15 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 2gbl h LEU 54 Cb 0.26 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.17 2gbl h LEU 54 CO -0.33 0.36 -0.04 0.15 -0.34 0.00 0.00 178.44 178.23 2gbl h PHE 55 N 0.57 -0.12 -0.28 1.25 3.57 0.17 -1.48 116.94 120.62 2gbl h PHE 55 Ca 0.15 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.66 2gbl h PHE 55 Cb -0.05 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 2gbl h PHE 55 CO 0.00 0.26 0.19 0.66 -2.23 0.00 0.00 178.31 177.19 2gbl h SER 56 N -0.52 0.30 0.19 0.41 4.64 -0.78 -0.70 113.55 117.09 2gbl h SER 56 Ca -0.01 -0.01 -0.26 0.00 -0.47 0.00 0.00 61.79 61.04 2gbl h SER 56 Cb 0.43 -0.07 0.01 0.00 -0.31 0.00 0.00 62.40 62.46 2gbl h SER 56 CO 0.02 0.22 -1.05 0.40 -0.87 0.00 0.00 176.83 175.55 2gbl h ILE 57 N 0.35 1.34 -0.01 0.95 1.08 -0.80 -3.14 117.51 117.29 2gbl h ILE 57 Ca 0.11 -2.40 -0.08 0.00 -0.39 0.00 0.00 64.86 62.10 2gbl h ILE 57 Cb 0.00 2.47 -0.01 0.00 -3.07 0.00 0.00 36.82 36.22 2gbl h ILE 57 CO -0.02 0.73 -0.37 -0.61 -0.69 0.00 0.00 178.15 177.18 2gbl h GLN 58 N 0.30 0.02 -0.41 2.37 4.15 -0.52 0.35 115.11 121.36 2gbl h GLN 58 Ca -0.12 -0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.21 2gbl h GLN 58 Cb 1.70 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.37 2gbl h GLN 58 CO 0.19 0.39 -0.07 0.35 -1.93 0.00 0.00 178.83 177.76 2gbl h PHE 59 N 0.01 0.86 0.00 3.99 3.57 -1.17 0.29 116.94 124.50 2gbl h PHE 59 Ca -0.00 -0.17 -0.00 0.00 3.53 0.00 0.00 57.97 61.32 2gbl h PHE 59 Cb 0.66 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.19 2gbl h PHE 59 CO 0.00 0.88 -0.00 -0.07 -2.23 0.00 0.00 178.31 176.89 2gbl h LEU 60 N 0.60 -0.01 -0.50 0.59 3.38 -1.44 -2.83 115.31 115.09 2gbl h LEU 60 Ca 0.11 -0.50 0.01 0.00 0.09 0.00 0.00 57.88 57.59 2gbl h LEU 60 Cb 0.58 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2gbl h LEU 60 CO 0.03 0.49 0.32 0.22 0.09 0.00 0.00 178.44 179.60 2gbl h TYR 61 N -0.51 0.61 -0.68 1.13 3.20 -0.16 -1.62 116.97 118.94 2gbl h TYR 61 Ca -0.00 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.83 2gbl h TYR 61 Cb 0.50 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 2gbl h TYR 61 CO 0.10 0.37 0.21 -0.91 -1.64 0.00 0.00 178.16 176.30 2gbl h ASN 62 N 0.65 0.96 -0.14 -2.11 2.35 -0.55 -0.14 115.58 116.62 2gbl h ASN 62 Ca 0.19 -0.17 0.03 0.00 -0.55 0.00 0.00 56.30 55.80 2gbl h ASN 62 Cb -0.05 -0.25 -0.06 0.00 0.05 0.00 0.00 38.32 38.00 2gbl h ASN 62 CO -0.05 0.90 -0.55 1.23 -1.65 0.00 0.00 177.43 177.31 2gbl h GLY 63 N 1.07 -1.09 0.70 2.83 0.00 -1.05 0.56 103.07 106.09 2gbl h GLY 63 Ca 0.22 0.68 -0.00 0.00 0.00 0.00 0.00 47.33 48.23 2gbl h GLY 63 CO -0.01 -0.19 -0.32 -2.22 0.00 0.00 0.00 176.54 173.80 2gbl h ILE 64 N -0.58 0.34 0.00 2.60 2.04 -1.02 -1.18 117.51 119.71 2gbl h ILE 64 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 2gbl h ILE 64 Cb 0.68 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2gbl h ILE 64 CO -0.44 0.00 0.00 -0.38 0.00 0.00 0.00 178.15 177.33 2gbl n ILE 65 N -5.43 0.72 -0.00 -0.67 2.08 -0.09 -1.76 119.36 114.20 2gbl n ILE 65 Ca -0.10 0.12 0.01 0.00 0.56 0.00 0.00 62.75 63.35 2gbl n ILE 65 Cb 0.34 -0.91 -0.02 0.00 -0.75 0.00 0.00 39.64 38.29 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 -1.85 0.76 0.00 0.38 -0.58 0.17 -4.74 120.64 114.78 2gbl n GLU 66 Ca 0.04 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 2gbl n GLU 66 Cb 0.26 -1.08 0.00 0.00 -0.57 0.00 0.00 31.44 30.05 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 -1.71 0.00 -3.74 -0.32 0.99 -0.48 -5.00 117.46 107.21 2gbl n PHE 67 Ca -0.01 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.16 2gbl n PHE 67 Cb 0.18 0.00 0.04 0.00 -1.00 0.00 0.00 39.48 38.71 2gbl n PHE 67 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 2gbl n ASP 68 N -0.03 -5.38 -4.59 4.37 -0.08 -0.72 -4.95 116.55 105.16 2gbl n ASP 68 Ca 0.00 -0.65 -0.39 0.00 -1.51 0.00 0.00 54.79 52.24 2gbl n ASP 68 Cb 0.12 -4.28 -0.10 0.00 2.34 0.00 0.00 41.12 39.20 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 -6.45 3.96 0.74 -0.67 2.02 -1.05 -4.91 118.70 112.34 2gbl s GLU 69 Ca 0.61 -0.18 -0.12 0.00 0.02 0.00 0.00 54.97 55.30 2gbl s GLU 69 Cb -0.29 -3.66 0.04 0.00 0.10 0.00 0.00 34.13 30.31 2gbl s GLU 69 CO 0.75 -0.23 1.11 -2.14 0.02 0.00 0.00 175.26 174.77 2gbl s PRO 70 N 1.90 2.36 0.08 0.39 0.02 -1.26 -2.37 135.00 136.11 2gbl s PRO 70 Ca 0.10 1.32 0.04 0.00 0.02 0.00 0.00 61.00 62.49 2gbl s PRO 70 Cb -0.16 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.43 2gbl s PRO 70 CO 0.11 -1.58 -0.11 0.20 -0.33 0.00 0.00 177.00 175.28 2gbl s GLY 71 N -2.94 0.81 -0.12 0.52 0.00 -0.08 -0.87 107.32 104.65 2gbl s GLY 71 Ca 0.65 -1.06 0.02 0.00 0.00 0.00 0.00 44.72 44.32 2gbl s GLY 71 CO 0.50 -1.11 -0.16 0.14 0.00 0.00 0.00 173.10 172.47 2gbl s VAL 72 N -1.85 1.59 -0.30 1.40 1.01 -0.45 -0.90 120.40 120.89 2gbl s VAL 72 Ca 0.00 -0.69 -0.02 0.00 0.00 0.00 0.00 61.98 61.27 2gbl s VAL 72 Cb -0.07 -1.45 0.05 0.00 0.00 0.00 0.00 36.38 34.91 2gbl s VAL 72 CO 0.01 0.46 0.01 0.12 0.00 0.00 0.00 175.10 175.70 2gbl s PHE 73 N 1.03 3.25 -0.30 5.22 5.36 0.16 -1.64 117.98 131.07 2gbl s PHE 73 Ca -0.05 -1.80 -0.19 0.00 -0.96 0.00 0.00 56.93 53.93 2gbl s PHE 73 Cb -0.15 -2.12 -0.02 0.00 -0.34 0.00 0.00 43.02 40.40 2gbl s PHE 73 CO -0.03 -0.79 0.55 0.08 -1.46 0.00 0.00 175.22 173.57 2gbl s VAL 74 N 1.27 5.01 -0.16 3.12 1.01 -0.40 -0.58 120.40 129.68 2gbl s VAL 74 Ca -0.05 0.75 -0.04 0.00 0.00 0.00 0.00 61.98 62.64 2gbl s VAL 74 Cb -0.20 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 2gbl s VAL 74 CO -0.01 -0.06 -0.04 0.28 0.00 0.00 0.00 175.10 175.28 2gbl s THR 75 N 2.42 3.84 -0.11 3.92 -1.32 -0.29 -1.01 115.64 123.10 2gbl s THR 75 Ca 0.22 -0.37 0.20 0.00 -1.21 0.00 0.00 61.69 60.53 2gbl s THR 75 Cb -0.15 -2.69 -0.31 0.00 -1.51 0.00 0.00 72.50 67.84 2gbl s THR 75 CO 0.11 0.48 0.48 0.49 -2.21 0.00 0.00 174.62 173.97 2gbl n PHE 76 N 3.67 0.00 0.03 9.09 3.01 -1.19 -0.21 117.46 131.86 2gbl n PHE 76 Ca -0.17 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.29 2gbl n PHE 76 Cb 0.52 -0.42 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 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 -2.14 0.00 -1.33 -1.08 2.13 -1.26 -3.78 120.64 113.17 2gbl n GLU 77 Ca -0.03 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.43 2gbl n GLU 77 Cb 0.51 -0.13 0.08 0.00 0.27 0.00 0.00 31.44 32.18 2gbl n GLU 77 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2gbl n GLU 78 N -2.88 0.46 -3.07 5.31 1.02 -1.26 -4.87 120.64 115.35 2gbl n GLU 78 Ca 0.00 0.21 -0.34 0.00 -0.02 0.00 0.00 57.16 57.02 2gbl n GLU 78 Cb 0.00 -2.16 -0.06 0.00 -0.02 0.00 0.00 31.44 29.20 2gbl n GLU 78 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2gbl s THR 79 N -1.84 4.59 0.45 2.62 2.01 -1.26 -4.83 115.64 117.37 2gbl s THR 79 Ca 0.72 1.14 0.11 0.00 0.31 0.00 0.00 61.69 63.96 2gbl s THR 79 Cb -0.34 -3.68 0.25 0.00 0.01 0.00 0.00 72.50 68.73 2gbl s THR 79 CO 0.52 -0.10 2.07 -0.65 -0.69 0.00 0.00 174.62 175.76 2gbl h PRO 80 N 2.51 0.30 -0.45 4.92 0.11 -1.97 0.35 132.00 137.77 2gbl h PRO 80 Ca -0.48 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.53 2gbl h PRO 80 Cb 1.18 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2gbl h PRO 80 CO 0.65 0.23 -0.01 1.96 -0.21 0.00 0.00 178.00 180.62 2gbl h GLN 81 N 0.30 0.74 -0.21 1.05 1.08 -1.99 -1.13 115.11 114.94 2gbl h GLN 81 Ca 0.08 -0.20 -0.11 0.00 -1.45 0.00 0.00 58.65 56.98 2gbl h GLN 81 Cb 0.03 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.38 2gbl h GLN 81 CO -0.01 0.76 -0.28 -0.44 -0.95 0.00 0.00 178.83 177.90 2gbl h ASP 82 N 0.69 0.62 -0.74 1.46 3.32 -1.56 -0.13 116.42 120.08 2gbl h ASP 82 Ca 0.14 -0.51 0.09 0.00 0.02 0.00 0.00 57.03 56.76 2gbl h ASP 82 Cb 0.44 -0.18 -0.07 0.00 0.22 0.00 0.00 39.33 39.75 2gbl h ASP 82 CO 0.02 1.00 0.39 0.40 -1.72 0.00 0.00 179.24 179.33 2gbl h ILE 83 N 0.25 0.89 -0.42 0.35 5.03 -0.70 0.43 117.51 123.34 2gbl h ILE 83 Ca 0.02 -0.23 -0.05 0.00 -0.12 0.00 0.00 64.86 64.48 2gbl h ILE 83 Cb 0.86 0.16 -0.02 0.00 -3.03 0.00 0.00 36.82 34.78 2gbl h ILE 83 CO 0.07 0.12 0.07 0.40 -0.68 0.00 0.00 178.15 178.13 2gbl h ILE 84 N 0.68 1.24 -0.27 -0.67 2.04 -0.94 -1.75 117.51 117.84 2gbl h ILE 84 Ca 0.35 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 2gbl h ILE 84 Cb 0.32 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 2gbl h ILE 84 CO -0.24 0.30 0.13 0.50 0.00 0.00 0.00 178.15 178.83 2gbl h LYS 85 N 0.55 0.40 -0.49 2.37 1.63 -0.03 -2.90 116.57 118.09 2gbl h LYS 85 Ca 0.13 -0.06 0.03 0.00 -0.85 0.00 0.00 60.65 59.89 2gbl h LYS 85 Cb 0.36 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.89 2gbl h LYS 85 CO 0.01 0.39 0.28 -0.91 -3.45 0.00 0.00 179.45 175.77 2gbl h ASN 86 N 0.30 0.44 -0.05 4.20 2.35 -0.02 -1.52 115.58 121.29 2gbl h ASN 86 Ca 0.09 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.87 2gbl h ASN 86 Cb 0.13 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 2gbl h ASN 86 CO -0.01 0.31 0.21 0.00 -1.65 0.00 0.00 177.43 176.29 2gbl h ALA 87 N 1.23 1.34 0.00 -0.83 0.00 -1.11 0.14 119.26 120.02 2gbl h ALA 87 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2gbl h ALA 87 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2gbl h ALA 87 CO -0.10 -0.23 0.00 0.00 0.00 0.00 0.00 179.25 178.91 2gbl h ARG 88 N 0.00 0.00 -1.00 0.00 3.08 -1.24 0.11 114.38 115.33 2gbl h ARG 88 Ca 0.02 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.16 2gbl h ARG 88 Cb 0.44 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.42 2gbl h ARG 88 CO -0.00 0.00 0.64 1.03 -1.07 0.00 0.00 179.97 180.57 2gbl h SER 89 N 0.00 0.99 -0.60 7.04 0.87 -0.87 -1.45 113.55 119.53 2gbl h SER 89 Ca 0.00 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2gbl h SER 89 Cb 0.14 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 2gbl h SER 89 CO 0.00 0.60 0.00 0.49 -0.53 0.00 0.00 176.83 177.39 2gbl n PHE 90 N -4.54 0.96 -3.14 2.24 3.01 0.37 -4.83 117.46 111.52 2gbl n PHE 90 Ca 0.17 -0.44 -0.14 0.00 1.01 0.00 0.00 57.45 58.04 2gbl n PHE 90 Cb 0.25 -0.06 0.05 0.00 -0.01 0.00 0.00 39.48 39.71 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 1.36 0.01 3.29 1.37 0.00 -0.55 -4.75 105.19 105.93 2gbl n GLY 91 Ca 0.21 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2gbl n GLY 91 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2gbl s TRP 92 N -3.20 2.90 -0.86 1.61 0.51 -1.10 -5.02 118.94 113.78 2gbl s TRP 92 Ca 0.32 -0.99 -0.16 0.00 -2.12 0.00 0.00 56.10 53.15 2gbl s TRP 92 Cb -0.14 -2.02 0.19 0.00 -0.81 0.00 0.00 33.47 30.69 2gbl s TRP 92 CO 0.45 -0.51 0.89 0.34 -0.51 0.00 0.00 176.95 177.61 2gbl s ASP 93 N 1.19 6.70 0.22 2.95 -1.08 -1.26 -3.94 116.67 121.45 2gbl s ASP 93 Ca 0.02 -2.44 0.11 0.00 -0.52 0.00 0.00 52.55 49.73 2gbl s ASP 93 Cb -0.14 -2.28 0.03 0.00 -1.46 0.00 0.00 42.92 39.07 2gbl s ASP 93 CO -0.03 -0.76 1.41 -0.07 0.52 0.00 0.00 175.17 176.25 2gbl h LEU 94 N 8.74 0.00 -1.28 -1.34 3.38 -1.95 -2.91 115.31 119.95 2gbl h LEU 94 Ca 0.11 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.11 2gbl h LEU 94 Cb 1.04 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.74 2gbl h LEU 94 CO 0.88 0.72 0.50 0.00 0.09 0.00 0.00 178.44 180.64 2gbl h ALA 95 N 1.28 1.53 -0.43 1.53 0.00 -1.90 -0.01 119.26 121.26 2gbl h ALA 95 Ca -0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2gbl h ALA 95 Cb 1.48 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 2gbl h ALA 95 CO 0.09 0.40 0.12 -0.22 0.00 0.00 0.00 179.25 179.64 2gbl h LYS 96 N 0.94 0.68 0.00 0.00 3.64 -1.93 -1.79 116.57 118.11 2gbl h LYS 96 Ca 0.30 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.47 2gbl h LYS 96 Cb 0.02 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2gbl h LYS 96 CO -0.08 0.68 -0.23 -0.07 -2.27 0.00 0.00 179.45 177.47 2gbl h LEU 97 N 0.56 0.00 -0.11 5.20 3.38 -1.20 -0.02 115.31 123.11 2gbl h LEU 97 Ca 0.14 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.87 2gbl h LEU 97 Cb 0.30 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.06 2gbl h LEU 97 CO -0.00 0.23 -0.90 0.58 0.09 0.00 0.00 178.44 178.44 2gbl h VAL 98 N 0.00 1.30 -0.78 1.22 2.07 -0.68 -0.70 116.25 118.68 2gbl h VAL 98 Ca -0.00 -2.15 -0.04 0.00 0.82 0.00 0.00 66.70 65.33 2gbl h VAL 98 Cb 0.50 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.44 2gbl h VAL 98 CO 0.03 0.67 0.32 -0.78 0.02 0.00 0.00 177.57 177.83 2gbl h ASP 99 N 0.43 1.07 0.00 0.57 3.58 -0.65 -2.28 116.42 119.15 2gbl h ASP 99 Ca -0.09 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.19 2gbl h ASP 99 Cb 1.54 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 42.31 2gbl h ASP 99 CO 0.18 0.95 0.00 -0.62 -2.88 0.00 0.00 179.24 176.86 2gbl n GLU 100 N -4.30 0.96 -1.13 0.28 1.02 -0.08 -4.87 120.64 112.52 2gbl n GLU 100 Ca 0.07 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.17 2gbl n GLU 100 Cb 0.18 -1.13 -0.02 0.00 -0.02 0.00 0.00 31.44 30.45 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 0.58 0.51 0.11 0.62 0.00 -0.86 -4.86 105.19 101.29 2gbl n GLY 101 Ca 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2gbl n GLY 101 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gbl h LYS 102 N 0.16 0.00 -5.61 1.61 1.79 -1.40 -3.46 116.57 109.65 2gbl h LYS 102 Ca -0.09 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.82 2gbl h LYS 102 Cb 0.87 0.00 -0.30 0.00 -1.58 0.00 0.00 32.23 31.22 2gbl h LYS 102 CO 0.13 0.48 -0.84 -1.17 -1.08 0.00 0.00 179.45 176.97 2gbl s LEU 103 N -6.19 2.00 -0.14 2.94 2.96 -0.61 -0.90 118.68 118.73 2gbl s LEU 103 Ca 0.00 -0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 53.56 2gbl s LEU 103 Cb 0.08 -0.95 0.04 0.00 0.50 0.00 0.00 46.19 45.86 2gbl s LEU 103 CO 0.79 0.20 -0.03 0.12 -1.32 0.00 0.00 176.35 176.11 2gbl s PHE 104 N -0.28 1.32 -0.26 5.38 5.36 -0.08 -3.88 117.98 125.54 2gbl s PHE 104 Ca 0.04 -0.79 -0.15 0.00 -0.96 0.00 0.00 56.93 55.07 2gbl s PHE 104 Cb -0.08 -1.14 -0.04 0.00 -0.34 0.00 0.00 43.02 41.42 2gbl s PHE 104 CO 0.00 -0.53 0.37 0.42 -1.46 0.00 0.00 175.22 174.01 2gbl s ILE 105 N 1.76 5.19 -0.36 3.12 1.01 -1.26 -0.67 121.20 129.99 2gbl s ILE 105 Ca 0.02 0.57 -0.10 0.00 0.00 0.00 0.00 60.65 61.14 2gbl s ILE 105 Cb -0.14 -3.69 0.02 0.00 0.01 0.00 0.00 42.46 38.66 2gbl s ILE 105 CO -0.07 0.18 0.18 -0.22 0.00 0.00 0.00 174.94 175.01 2gbl s LEU 106 N 1.91 4.55 -0.46 2.97 2.96 0.25 -4.95 118.68 125.92 2gbl s LEU 106 Ca 0.15 -0.95 -0.28 0.00 -0.22 0.00 0.00 54.13 52.82 2gbl s LEU 106 Cb -0.16 -1.99 0.01 0.00 0.50 0.00 0.00 46.19 44.55 2gbl s LEU 106 CO 0.09 -0.35 1.42 -0.62 -1.32 0.00 0.00 176.35 175.58 2gbl s ASP 107 N 1.53 6.26 -0.05 3.68 -1.08 -1.26 -1.14 116.67 124.61 2gbl s ASP 107 Ca 0.02 0.67 0.08 0.00 -0.52 0.00 0.00 52.55 52.80 2gbl s ASP 107 Cb -0.19 -2.54 0.16 0.00 -1.46 0.00 0.00 42.92 38.89 2gbl s ASP 107 CO 0.06 -1.53 1.11 0.00 0.52 0.00 0.00 175.17 175.33 2gbl n ALA 108 N 9.11 2.17 -1.23 3.66 0.00 0.70 -4.96 120.51 129.98 2gbl n ALA 108 Ca 0.15 -1.58 -0.29 0.00 0.00 0.00 0.00 53.44 51.72 2gbl n ALA 108 Cb 0.48 -0.22 0.15 0.00 0.00 0.00 0.00 19.45 19.87 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 -1.61 3.17 0.41 0.00 1.04 -0.98 -4.67 113.70 111.08 2gbl s SER 109 Ca 0.15 1.32 0.03 0.00 0.48 0.00 0.00 55.95 57.94 2gbl s SER 109 Cb 0.12 -1.99 -0.00 0.00 0.10 0.00 0.00 66.02 64.24 2gbl s SER 109 CO 0.04 -2.80 0.59 -2.84 0.98 0.00 0.00 173.24 169.21 2gbl s PRO 110 N -4.98 3.04 -0.24 4.02 0.02 -1.26 -5.03 135.00 130.57 2gbl s PRO 110 Ca 0.64 -0.75 -0.29 0.00 0.02 0.00 0.00 61.00 60.62 2gbl s PRO 110 Cb -0.18 -2.67 -0.03 0.00 0.02 0.00 0.00 34.50 31.64 2gbl s PRO 110 CO 0.57 -0.17 1.77 -0.51 -0.33 0.00 0.00 177.00 178.33 2gbl s ASP 111 N -4.22 6.12 0.42 2.53 1.01 -1.26 -4.89 116.67 116.38 2gbl s ASP 111 Ca 0.48 1.62 0.14 0.00 0.71 0.00 0.00 52.55 55.50 2gbl s ASP 111 Cb -0.10 -2.53 1.02 0.00 1.01 0.00 0.00 42.92 42.32 2gbl s ASP 111 CO 0.35 -1.47 1.93 -0.65 0.21 0.00 0.00 175.17 175.54 2gbl h PRO 112 N 11.93 0.43 0.00 8.23 0.11 -2.03 -3.14 132.00 147.54 2gbl h PRO 112 Ca -0.36 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2gbl h PRO 112 Cb 1.17 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2gbl h PRO 112 CO 1.00 0.29 0.00 0.39 -0.21 0.00 0.00 178.00 179.47 2gbl n GLU 113 N -4.48 0.00 0.00 1.05 4.71 -1.26 -5.06 120.64 115.60 2gbl n GLU 113 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.28 2gbl n GLU 113 Cb 0.48 -0.61 0.00 0.00 -1.01 0.00 0.00 31.44 30.30 2gbl n GLU 113 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2gbl n GLY 114 N 0.38 4.52 3.67 0.62 0.00 -1.19 -5.17 105.19 108.02 2gbl n GLY 114 Ca 0.00 -0.67 -0.01 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.59 0.72 0.00 1.61 1.11 -1.26 -5.10 119.66 113.14 2gbl s GLN 115 Ca 0.00 -0.39 0.00 0.00 0.01 0.00 0.00 55.36 54.98 2gbl s GLN 115 Cb 0.00 0.25 0.00 0.00 -1.01 0.00 0.00 33.01 32.25 2gbl s GLN 115 CO 0.00 -0.33 0.13 0.39 0.01 0.00 0.00 175.29 175.49 2gbl n GLU 116 N -0.47 0.00 -3.30 2.91 -0.58 -1.26 -4.96 120.64 112.98 2gbl n GLU 116 Ca -0.07 -0.13 -0.25 0.00 -0.42 0.00 0.00 57.16 56.28 2gbl n GLU 116 Cb 0.62 -0.40 -0.07 0.00 -0.57 0.00 0.00 31.44 31.01 2gbl n GLU 116 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2gbl n VAL 117 N 0.00 0.91 0.00 2.62 0.31 -1.26 -4.74 118.33 116.17 2gbl n VAL 117 Ca 0.00 -4.65 0.00 0.00 -0.01 0.00 0.00 64.34 59.68 2gbl n VAL 117 Cb 0.33 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.25 2gbl n VAL 117 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2gbl n VAL 118 N 1.09 0.00 -2.94 2.52 0.31 -1.26 -4.90 118.33 113.15 2gbl n VAL 118 Ca 0.26 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.22 2gbl n VAL 118 Cb 0.47 -0.12 -0.01 0.00 -0.91 0.00 0.00 33.84 33.26 2gbl n VAL 118 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gbl n GLY 119 N 0.81 5.53 0.24 2.92 0.00 -1.26 -4.38 105.19 109.06 2gbl n GLY 119 Ca 0.00 -2.68 0.04 0.00 0.00 0.00 0.00 46.02 43.37 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 0.46 -0.52 0.44 -0.02 0.00 -1.26 -4.13 105.19 100.16 2gbl n GLY 120 Ca 0.35 -0.21 0.05 0.00 0.00 0.00 0.00 46.02 46.21 2gbl n GLY 120 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2gbl n PHE 121 N 0.13 0.09 0.00 1.61 3.01 -1.26 -5.04 117.46 116.00 2gbl n PHE 121 Ca 0.04 -0.11 0.00 0.00 1.01 0.00 0.00 57.45 58.39 2gbl n PHE 121 Cb 0.17 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 2gbl n PHE 121 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2gbl n ASP 122 N 0.53 0.00 -0.25 4.37 9.92 -1.26 -1.21 116.55 128.65 2gbl n ASP 122 Ca 0.07 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.31 2gbl n ASP 122 Cb 0.28 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 40.78 2gbl n ASP 122 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2gbl n LEU 123 N 0.00 -0.47 -0.02 0.64 7.99 -1.26 -1.04 117.00 122.85 2gbl n LEU 123 Ca 0.00 1.13 -0.01 0.00 -0.01 0.00 0.00 56.01 57.13 2gbl n LEU 123 Cb 0.00 -0.24 -0.00 0.00 -0.11 0.00 0.00 43.42 43.07 2gbl n LEU 123 CO 0.00 -1.00 0.50 0.28 -1.51 0.00 0.00 177.39 175.66 2gbl h SER 124 N 0.00 -0.09 -0.61 -1.43 0.02 -1.97 0.23 113.55 109.70 2gbl h SER 124 Ca 0.20 0.01 0.13 0.00 -0.84 0.00 0.00 61.79 61.29 2gbl h SER 124 Cb 0.37 0.04 -0.10 0.00 0.14 0.00 0.00 62.40 62.85 2gbl h SER 124 CO -0.64 -0.01 0.02 0.00 -1.14 0.00 0.00 176.83 175.06 2gbl h ALA 125 N -1.01 0.61 -0.24 3.77 0.00 0.39 -1.74 119.26 121.04 2gbl h ALA 125 Ca 0.01 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2gbl h ALA 125 Cb 0.02 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2gbl h ALA 125 CO -0.04 -0.39 0.09 1.25 0.00 0.00 0.00 179.25 180.17 2gbl h LEU 126 N 0.13 0.34 -1.86 0.00 5.85 -1.12 -0.45 115.31 118.21 2gbl h LEU 126 Ca 0.32 -0.18 0.14 0.00 0.84 0.00 0.00 57.88 59.01 2gbl h LEU 126 Cb 0.51 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 2gbl h LEU 126 CO -0.51 0.43 0.41 0.40 -0.34 0.00 0.00 178.44 178.83 2gbl h ILE 127 N 0.24 0.77 -0.12 4.05 2.04 0.30 0.12 117.51 124.90 2gbl h ILE 127 Ca 0.08 -0.05 -0.10 0.00 1.00 0.00 0.00 64.86 65.79 2gbl h ILE 127 Cb 0.20 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.89 2gbl h ILE 127 CO -0.01 0.03 -0.30 -0.33 0.00 0.00 0.00 178.15 177.55 2gbl h GLU 128 N 0.15 0.42 -0.58 2.37 5.08 -0.47 -1.98 114.58 119.58 2gbl h GLU 128 Ca 0.28 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2gbl h GLU 128 Cb 0.91 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 2gbl h GLU 128 CO -0.04 0.90 0.14 0.00 -1.00 0.00 0.00 179.01 179.01 2gbl h ARG 129 N 0.01 0.89 -0.65 2.33 3.08 0.55 0.75 114.38 121.34 2gbl h ARG 129 Ca -0.00 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 59.81 2gbl h ARG 129 Cb 0.90 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 2gbl h ARG 129 CO 0.06 0.80 0.20 0.82 -1.07 0.00 0.00 179.97 180.78 2gbl h ILE 130 N 0.86 1.25 -0.41 2.04 2.04 -0.86 0.25 117.51 122.68 2gbl h ILE 130 Ca 0.19 -0.86 -0.05 0.00 1.00 0.00 0.00 64.86 65.14 2gbl h ILE 130 Cb 0.31 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 2gbl h ILE 130 CO -0.00 0.33 0.07 -1.13 0.00 0.00 0.00 178.15 177.42 2gbl h ASN 131 N 0.94 0.65 -0.26 1.72 -1.24 -0.82 0.10 115.58 116.67 2gbl h ASN 131 Ca 0.21 -0.26 0.02 0.00 0.71 0.00 0.00 56.30 56.99 2gbl h ASN 131 Cb 0.30 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 39.15 2gbl h ASN 131 CO -0.01 0.74 0.10 0.22 -1.29 0.00 0.00 177.43 177.19 2gbl h TYR 132 N 0.53 0.18 -0.89 0.67 3.20 0.85 -2.30 116.97 119.22 2gbl h TYR 132 Ca 0.13 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 2gbl h TYR 132 Cb 0.36 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 2gbl h TYR 132 CO 0.02 0.09 0.52 0.00 -1.64 0.00 0.00 178.16 177.15 2gbl h ALA 133 N 1.16 1.13 -0.10 1.82 0.00 -0.03 -0.20 119.26 123.03 2gbl h ALA 133 Ca 0.11 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2gbl h ALA 133 Cb 0.07 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2gbl h ALA 133 CO -0.11 0.61 -0.02 0.82 0.00 0.00 0.00 179.25 180.55 2gbl h ILE 134 N 1.23 0.91 -0.23 0.00 2.04 -0.50 -1.19 117.51 119.76 2gbl h ILE 134 Ca 0.32 -0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.16 2gbl h ILE 134 Cb -0.03 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 2gbl h ILE 134 CO -0.06 0.00 0.07 1.56 0.00 0.00 0.00 178.15 179.73 2gbl h GLN 135 N 0.01 0.35 -0.72 2.37 4.20 -1.16 0.24 115.11 120.40 2gbl h GLN 135 Ca 0.05 -0.07 0.08 0.00 0.06 0.00 0.00 58.65 58.76 2gbl h GLN 135 Cb 0.07 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 27.73 2gbl h GLN 135 CO -0.10 0.44 0.39 -0.22 -0.67 0.00 0.00 178.83 178.67 2gbl h LYS 136 N 0.20 0.67 -0.09 1.46 3.64 -0.71 -2.77 116.57 118.96 2gbl h LYS 136 Ca 0.07 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2gbl h LYS 136 Cb 0.23 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2gbl h LYS 136 CO -0.00 0.44 0.00 0.66 -2.27 0.00 0.00 179.45 178.28 2gbl n TYR 137 N -4.80 0.09 -3.43 1.91 4.02 -0.48 -4.95 117.16 109.52 2gbl n TYR 137 Ca 0.11 -0.05 -0.18 0.00 -0.01 0.00 0.00 57.90 57.76 2gbl n TYR 137 Cb 0.23 -0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.62 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 1.20 -4.75 -2.72 -0.72 1.74 0.64 -4.70 116.66 107.35 2gbl n ARG 138 Ca 0.13 0.80 -0.38 0.00 -0.77 0.00 0.00 57.85 57.63 2gbl n ARG 138 Cb 0.53 -5.65 -0.06 0.00 -1.02 0.00 0.00 32.46 26.26 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 -3.43 3.26 -0.10 7.54 0.00 0.05 -4.19 121.76 124.89 2gbl s ALA 139 Ca 0.16 0.61 0.07 0.00 0.00 0.00 0.00 51.96 52.80 2gbl s ALA 139 Cb -0.03 -3.21 -0.11 0.00 0.00 0.00 0.00 23.12 19.77 2gbl s ALA 139 CO 0.75 0.12 0.00 0.54 0.00 0.00 0.00 175.76 177.18 2gbl n ARG 140 N 0.89 2.01 -4.87 0.00 5.12 -0.05 -4.93 116.66 114.84 2gbl n ARG 140 Ca 0.01 0.01 -0.33 0.00 -1.93 0.00 0.00 57.85 55.61 2gbl n ARG 140 Cb 0.48 -1.24 -0.14 0.00 -1.16 0.00 0.00 32.46 30.41 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 -2.23 2.79 -0.03 5.56 0.52 -1.15 -2.39 118.95 122.02 2gbl s ARG 141 Ca -0.07 -0.70 0.03 0.00 -0.52 0.00 0.00 55.73 54.47 2gbl s ARG 141 Cb 0.03 -2.45 -0.00 0.00 0.52 0.00 0.00 34.95 33.05 2gbl s ARG 141 CO 0.37 0.49 -0.11 0.08 0.02 0.00 0.00 175.30 176.14 2gbl s VAL 142 N -0.37 0.93 -0.18 3.52 1.01 -0.36 -1.34 120.40 123.60 2gbl s VAL 142 Ca 0.04 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.57 2gbl s VAL 142 Cb -0.12 -0.81 0.04 0.00 0.00 0.00 0.00 36.38 35.48 2gbl s VAL 142 CO 0.02 0.28 -0.11 -0.44 0.00 0.00 0.00 175.10 174.85 2gbl s SER 143 N 0.09 3.18 -0.30 3.32 0.01 -0.65 0.00 113.70 119.35 2gbl s SER 143 Ca -0.02 -0.78 -0.09 0.00 1.31 0.00 0.00 55.95 56.37 2gbl s SER 143 Cb -0.08 -1.20 -0.02 0.00 0.21 0.00 0.00 66.02 64.93 2gbl s SER 143 CO 0.01 -0.13 0.14 -0.63 0.41 0.00 0.00 173.24 173.04 2gbl s ILE 144 N 1.44 4.62 -0.41 1.44 1.01 0.12 -1.27 121.20 128.14 2gbl s ILE 144 Ca 0.00 -0.32 -0.19 0.00 0.00 0.00 0.00 60.65 60.15 2gbl s ILE 144 Cb -0.15 -3.30 0.01 0.00 0.01 0.00 0.00 42.46 39.03 2gbl s ILE 144 CO -0.09 0.13 0.56 -0.62 0.00 0.00 0.00 174.94 174.93 2gbl s ASP 145 N 1.63 6.29 -0.48 3.58 3.68 -0.18 -1.10 116.67 130.09 2gbl s ASP 145 Ca 0.05 -0.31 -0.13 0.00 2.13 0.00 0.00 52.55 54.28 2gbl s ASP 145 Cb -0.17 -2.28 0.02 0.00 -1.45 0.00 0.00 42.92 39.04 2gbl s ASP 145 CO 0.06 -0.64 0.62 -1.54 0.13 0.00 0.00 175.17 173.79 2gbl n SER 146 N 5.96 -7.94 -0.07 -0.34 3.41 -1.18 -3.17 113.62 110.29 2gbl n SER 146 Ca -0.04 0.44 -0.09 0.00 -0.26 0.00 0.00 58.87 58.93 2gbl n SER 146 Cb 0.48 -5.39 0.07 0.00 -0.26 0.00 0.00 64.21 59.10 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 1.75 1.28 -0.99 -3.33 -1.51 -1.70 -3.14 116.25 108.61 2gbl h VAL 147 Ca -0.00 -1.47 0.17 0.00 -1.23 0.00 0.00 66.70 64.16 2gbl h VAL 147 Cb 1.00 1.37 -0.17 0.00 -2.13 0.00 0.00 31.29 31.36 2gbl h VAL 147 CO 0.22 0.48 -0.35 0.41 -1.23 0.00 0.00 177.57 177.10 2gbl n THR 148 N -4.07 -0.49 0.07 7.19 -1.04 -1.26 -0.37 114.28 114.30 2gbl n THR 148 Ca -0.01 2.31 0.20 0.00 -2.04 0.00 0.00 64.05 64.50 2gbl n THR 148 Cb 0.49 -3.09 0.74 0.00 -1.82 0.00 0.00 70.33 66.64 2gbl n THR 148 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2gbl h SER 149 N 0.00 0.00 0.24 8.00 4.64 -1.92 -2.87 113.55 121.65 2gbl h SER 149 Ca 0.38 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.69 2gbl h SER 149 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 2gbl h SER 149 CO -0.99 0.00 -0.12 1.62 -0.87 0.00 0.00 176.83 176.47 2gbl h VAL 150 N 0.00 0.82 0.00 0.95 3.04 -0.86 -2.99 116.25 117.21 2gbl h VAL 150 Ca 0.20 -0.52 0.00 0.00 -1.01 0.00 0.00 66.70 65.37 2gbl h VAL 150 Cb 0.94 1.12 0.00 0.00 -2.01 0.00 0.00 31.29 31.34 2gbl h VAL 150 CO -0.00 0.11 0.00 2.22 -1.01 0.00 0.00 177.57 178.89 2gbl n PHE 151 N -5.11 0.00 -0.61 3.17 1.16 -1.14 -3.59 117.46 111.33 2gbl n PHE 151 Ca -0.09 0.00 -0.06 0.00 -1.87 0.00 0.00 57.45 55.42 2gbl n PHE 151 Cb 0.23 -0.16 -0.09 0.00 -1.61 0.00 0.00 39.48 37.85 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 -1.16 1.23 -0.04 3.97 1.13 -1.09 -2.09 117.38 119.32 2gbl n GLN 152 Ca 0.17 -0.53 -0.05 0.00 -1.94 0.00 0.00 57.00 54.66 2gbl n GLN 152 Cb 0.17 -1.68 -0.06 0.00 0.11 0.00 0.00 30.24 28.78 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 2.42 2.26 0.00 -1.09 6.02 -1.24 -4.99 117.38 120.76 2gbl n GLN 153 Ca 0.23 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 2gbl n GLN 153 Cb 0.57 -1.21 0.00 0.00 1.02 0.00 0.00 30.24 30.62 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 -2.39 0.00 -4.44 1.08 0.18 -0.89 -5.20 117.16 105.51 2gbl n TYR 154 Ca -0.14 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.38 2gbl n TYR 154 Cb 0.76 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.63 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 3.99 0.04 9.48 1.01 -1.16 -5.15 116.67 124.88 2gbl s ASP 155 Ca 0.00 -1.12 0.07 0.00 0.71 0.00 0.00 52.55 52.20 2gbl s ASP 155 Cb 0.00 -0.44 -0.03 0.00 1.01 0.00 0.00 42.92 43.46 2gbl s ASP 155 CO 0.00 -0.27 -0.17 0.00 0.21 0.00 0.00 175.17 174.94 2gbl s ALA 156 N -2.58 2.65 0.08 5.23 0.00 -1.26 -5.02 121.76 120.86 2gbl s ALA 156 Ca 0.34 -1.17 -0.04 0.00 0.00 0.00 0.00 51.96 51.09 2gbl s ALA 156 Cb 0.02 -0.78 0.12 0.00 0.00 0.00 0.00 23.12 22.48 2gbl s ALA 156 CO 0.18 0.58 0.49 -1.13 0.00 0.00 0.00 175.76 175.88 2gbl n SER 157 N 1.54 -0.15 -0.18 0.00 3.41 -1.26 -0.23 113.62 116.75 2gbl n SER 157 Ca -0.16 0.54 -0.03 0.00 -0.26 0.00 0.00 58.87 58.96 2gbl n SER 157 Cb 0.52 -0.15 0.16 0.00 -0.26 0.00 0.00 64.21 64.49 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 0.86 -0.55 4.04 4.64 -1.96 -1.38 113.55 119.20 2gbl h SER 158 Ca 0.13 -0.14 -0.09 0.00 -0.47 0.00 0.00 61.79 61.22 2gbl h SER 158 Cb 0.21 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 2gbl h SER 158 CO -0.32 0.81 0.01 0.58 -0.87 0.00 0.00 176.83 177.05 2gbl h VAL 159 N 0.90 1.26 -0.34 0.95 2.07 -1.02 -2.72 116.25 117.35 2gbl h VAL 159 Ca 0.20 -1.10 -0.11 0.00 0.82 0.00 0.00 66.70 66.52 2gbl h VAL 159 Cb 0.25 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2gbl h VAL 159 CO -0.01 0.40 -0.21 0.58 0.02 0.00 0.00 177.57 178.34 2gbl h VAL 160 N 0.91 1.29 -0.99 2.57 2.07 -1.38 -2.34 116.25 118.38 2gbl h VAL 160 Ca 0.17 -1.35 0.04 0.00 0.82 0.00 0.00 66.70 66.37 2gbl h VAL 160 Cb 0.51 1.43 -0.06 0.00 -1.52 0.00 0.00 31.29 31.65 2gbl h VAL 160 CO 0.02 0.44 0.65 -0.09 0.02 0.00 0.00 177.57 178.61 2gbl h ARG 161 N 0.51 1.22 -0.09 1.57 2.43 -1.09 -1.60 114.38 117.33 2gbl h ARG 161 Ca 0.07 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2gbl h ARG 161 Cb 0.77 -0.27 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2gbl h ARG 161 CO 0.06 0.81 -0.12 0.00 -1.51 0.00 0.00 179.97 179.20 2gbl h ARG 162 N 1.25 0.25 -0.06 0.20 3.08 -1.41 -2.13 114.38 115.56 2gbl h ARG 162 Ca 0.40 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.30 2gbl h ARG 162 Cb 0.00 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 2gbl h ARG 162 CO -0.13 0.70 0.03 0.93 -1.07 0.00 0.00 179.97 180.44 2gbl h GLU 163 N -0.18 0.08 0.08 0.04 4.39 -1.22 -0.48 114.58 117.28 2gbl h GLU 163 Ca 0.01 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.73 2gbl h GLU 163 Cb 0.67 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.26 2gbl h GLU 163 CO 0.03 0.10 -0.33 -0.07 -1.16 0.00 0.00 179.01 177.58 2gbl h LEU 164 N 0.04 -0.95 -0.30 1.33 3.38 -1.37 -1.09 115.31 116.35 2gbl h LEU 164 Ca 0.02 0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.17 2gbl h LEU 164 Cb 0.04 0.37 -0.07 0.00 0.09 0.00 0.00 40.66 41.08 2gbl h LEU 164 CO -0.00 -0.40 -0.22 0.15 0.09 0.00 0.00 178.44 178.05 2gbl h PHE 165 N -0.53 -0.58 -0.43 1.13 3.57 -1.25 0.20 116.94 119.05 2gbl h PHE 165 Ca 0.04 0.04 0.09 0.00 3.53 0.00 0.00 57.97 61.67 2gbl h PHE 165 Cb 0.58 0.30 -0.09 0.00 2.79 0.00 0.00 35.95 39.52 2gbl h PHE 165 CO -0.31 -0.30 -0.23 -0.09 -2.23 0.00 0.00 178.31 175.15 2gbl h ARG 166 N -0.20 -0.14 0.72 1.11 2.43 -0.47 -1.21 114.38 116.61 2gbl h ARG 166 Ca 0.16 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 2gbl h ARG 166 Cb 0.44 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2gbl h ARG 166 CO -0.41 -0.10 -0.42 1.25 -1.51 0.00 0.00 179.97 178.78 2gbl h LEU 167 N -0.15 -1.04 -0.61 3.80 5.85 -0.48 -1.40 115.31 121.28 2gbl h LEU 167 Ca 0.20 0.05 0.12 0.00 0.84 0.00 0.00 57.88 59.10 2gbl h LEU 167 Cb 0.47 0.30 -0.12 0.00 0.37 0.00 0.00 40.66 41.68 2gbl h LEU 167 CO -0.52 -0.66 -0.19 0.58 -0.34 0.00 0.00 178.44 177.31 2gbl h VAL 168 N -1.07 0.34 -0.03 1.05 2.07 -0.69 -0.17 116.25 117.75 2gbl h VAL 168 Ca -0.09 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.44 2gbl h VAL 168 Cb 0.85 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 2gbl h VAL 168 CO 0.11 0.00 -0.07 0.00 0.02 0.00 0.00 177.57 177.63 2gbl h ALA 169 N 1.52 -0.04 -0.83 1.67 0.00 -1.19 -0.36 119.26 120.03 2gbl h ALA 169 Ca 0.29 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.23 2gbl h ALA 169 Cb 0.48 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 2gbl h ALA 169 CO -0.65 -0.55 0.55 0.00 0.00 0.00 0.00 179.25 178.60 2gbl h ARG 170 N -0.10 1.07 -0.06 0.00 2.47 0.06 -0.02 114.38 117.81 2gbl h ARG 170 Ca 0.04 -0.06 -0.06 0.00 -1.26 0.00 0.00 59.98 58.64 2gbl h ARG 170 Cb 0.15 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.22 2gbl h ARG 170 CO -0.09 0.71 -0.24 -0.07 0.56 0.00 0.00 179.97 180.83 2gbl h LEU 171 N 1.10 0.09 -0.22 3.04 3.38 -0.78 0.20 115.31 122.12 2gbl h LEU 171 Ca 0.31 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 2gbl h LEU 171 Cb -0.09 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2gbl h LEU 171 CO -0.08 0.34 0.02 0.50 0.09 0.00 0.00 178.44 179.31 2gbl h LYS 172 N 0.09 0.38 0.71 1.13 3.64 0.50 -1.14 116.57 121.89 2gbl h LYS 172 Ca 0.01 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 2gbl h LYS 172 Cb 0.48 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 2gbl h LYS 172 CO 0.03 0.55 -0.49 1.96 -2.27 0.00 0.00 179.45 179.24 2gbl h GLN 173 N 0.16 -1.10 -0.46 1.90 4.20 -0.36 -0.66 115.11 118.79 2gbl h GLN 173 Ca 0.07 0.08 0.13 0.00 0.06 0.00 0.00 58.65 58.98 2gbl h GLN 173 Cb 0.37 0.25 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2gbl h GLN 173 CO 0.01 -0.73 0.76 0.82 -0.67 0.00 0.00 178.83 179.02 2gbl h ILE 174 N -1.14 0.12 0.00 2.54 1.08 -0.90 -3.44 117.51 115.77 2gbl h ILE 174 Ca -0.09 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 2gbl h ILE 174 Cb 0.93 0.34 0.00 0.00 -3.07 0.00 0.00 36.82 35.02 2gbl h ILE 174 CO 0.06 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.13 2gbl n GLY 175 N -1.51 0.76 3.77 5.37 0.00 -0.26 -5.05 105.19 108.27 2gbl n GLY 175 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.34 3.27 -0.36 4.61 0.00 -0.84 -4.28 121.76 121.81 2gbl s ALA 176 Ca 0.00 0.54 -0.19 0.00 0.00 0.00 0.00 51.96 52.30 2gbl s ALA 176 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.95 2gbl s ALA 176 CO 0.00 0.20 0.58 0.99 0.00 0.00 0.00 175.76 177.53 2gbl s THR 177 N -1.45 4.94 0.05 0.00 2.01 -1.00 -3.77 115.64 116.42 2gbl s THR 177 Ca 0.46 0.40 0.06 0.00 0.31 0.00 0.00 61.69 62.93 2gbl s THR 177 Cb -0.21 -4.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 2gbl s THR 177 CO 0.27 -0.31 -0.13 -0.89 -0.69 0.00 0.00 174.62 172.87 2gbl s THR 178 N 2.58 3.19 -0.24 -0.82 2.01 -0.84 -1.22 115.64 120.29 2gbl s THR 178 Ca 0.21 -1.12 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 2gbl s THR 178 Cb -0.15 -2.40 0.02 0.00 0.01 0.00 0.00 72.50 69.98 2gbl s THR 178 CO 0.15 0.27 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.60 2gbl s VAL 179 N -1.04 2.92 -0.12 3.82 1.01 0.10 0.01 120.40 127.10 2gbl s VAL 179 Ca 0.17 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 2gbl s VAL 179 Cb -0.11 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 2gbl s VAL 179 CO 0.09 0.24 -0.04 -0.04 0.00 0.00 0.00 175.10 175.35 2gbl s MET 180 N 1.35 3.35 -0.16 2.72 -1.94 0.24 0.14 119.30 124.99 2gbl s MET 180 Ca 0.01 -0.51 -0.06 0.00 -1.71 0.00 0.00 55.69 53.43 2gbl s MET 180 Cb -0.16 -2.82 -0.04 0.00 2.01 0.00 0.00 34.83 33.82 2gbl s MET 180 CO -0.05 0.41 0.03 0.99 -0.01 0.00 0.00 175.02 176.40 2gbl s THR 181 N -0.11 4.50 0.25 2.05 2.01 -0.26 -0.43 115.64 123.65 2gbl s THR 181 Ca 0.02 -0.14 0.08 0.00 0.31 0.00 0.00 61.69 61.96 2gbl s THR 181 Cb -0.13 -3.00 -0.05 0.00 0.01 0.00 0.00 72.50 69.33 2gbl s THR 181 CO 0.02 0.49 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.44 2gbl s THR 182 N 0.22 1.78 0.11 -0.82 2.01 0.07 -2.51 115.64 116.50 2gbl s THR 182 Ca 0.02 -2.19 0.06 0.00 0.31 0.00 0.00 61.69 59.89 2gbl s THR 182 Cb -0.13 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 2gbl s THR 182 CO 0.01 -0.43 -0.04 -1.83 -0.69 0.00 0.00 174.62 171.64 2gbl s GLU 183 N -3.67 2.36 0.19 4.92 -1.05 -1.26 -2.25 118.70 117.94 2gbl s GLU 183 Ca 0.27 -0.95 0.05 0.00 -0.15 0.00 0.00 54.97 54.19 2gbl s GLU 183 Cb 0.01 -2.42 -0.05 0.00 -0.44 0.00 0.00 34.13 31.23 2gbl s GLU 183 CO 0.10 0.52 -0.09 1.03 0.95 0.00 0.00 175.26 177.77 2gbl s ARG 184 N -2.36 1.23 -0.01 -4.83 0.52 -0.78 -2.11 118.95 110.61 2gbl s ARG 184 Ca 0.24 -1.56 0.06 0.00 -0.52 0.00 0.00 55.73 53.95 2gbl s ARG 184 Cb -0.11 -0.78 -0.09 0.00 0.52 0.00 0.00 34.95 34.50 2gbl s ARG 184 CO 0.17 0.06 0.14 -0.89 0.02 0.00 0.00 175.30 174.80 2gbl n ILE 185 N -0.32 0.00 -4.75 1.52 2.08 -1.26 -4.12 119.36 112.51 2gbl n ILE 185 Ca -0.08 -0.17 -0.33 0.00 0.56 0.00 0.00 62.75 62.73 2gbl n ILE 185 Cb 0.62 0.47 -0.15 0.00 -0.75 0.00 0.00 39.64 39.82 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 -2.27 3.24 0.45 0.38 -6.30 -1.26 -5.01 118.70 107.93 2gbl s GLU 186 Ca -0.01 -0.76 0.18 0.00 -2.50 0.00 0.00 54.97 51.88 2gbl s GLU 186 Cb 0.04 -2.56 1.13 0.00 0.00 0.00 0.00 34.13 32.73 2gbl s GLU 186 CO 0.24 0.11 1.94 1.49 0.02 0.00 0.00 175.26 179.06 2gbl h GLU 187 N 6.99 0.31 0.00 4.30 4.57 -1.94 -2.95 114.58 125.86 2gbl h GLU 187 Ca -0.28 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.89 2gbl h GLU 187 Cb 1.21 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.73 2gbl h GLU 187 CO 0.54 0.21 0.00 0.66 -1.18 0.00 0.00 179.01 179.24 2gbl n TYR 188 N -4.45 0.00 -0.01 0.92 4.02 -1.26 -4.96 117.16 111.41 2gbl n TYR 188 Ca 0.13 -0.35 0.00 0.00 -0.01 0.00 0.00 57.90 57.67 2gbl n TYR 188 Cb 0.53 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 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 -0.35 0.92 3.64 2.72 0.00 -1.12 -5.00 105.19 106.00 2gbl n GLY 189 Ca 0.00 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 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 -0.42 -0.18 1.61 -0.04 -1.26 -4.93 135.00 129.78 2gbl n PRO 190 Ca 0.00 -0.06 -0.10 0.00 -0.04 0.00 0.00 63.50 63.30 2gbl n PRO 190 Cb 0.00 -2.31 0.01 0.00 -0.04 0.00 0.00 33.50 31.16 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 -1.82 1.27 -4.04 0.52 5.03 -1.94 -3.46 117.51 113.06 2gbl h ILE 191 Ca -0.43 -1.19 -0.13 0.00 -0.12 0.00 0.00 64.86 62.99 2gbl h ILE 191 Cb 1.27 0.99 -0.13 0.00 -3.03 0.00 0.00 36.82 35.93 2gbl h ILE 191 CO 0.40 0.42 -0.39 0.00 -0.68 0.00 0.00 178.15 177.90 2gbl s ALA 192 N -4.91 0.27 0.19 1.87 0.00 -1.26 -4.72 121.76 113.20 2gbl s ALA 192 Ca -0.12 -1.09 -0.07 0.00 0.00 0.00 0.00 51.96 50.68 2gbl s ALA 192 Cb 0.12 0.96 0.29 0.00 0.00 0.00 0.00 23.12 24.49 2gbl s ALA 192 CO 0.84 -0.64 1.09 0.54 0.00 0.00 0.00 175.76 177.60 2gbl n ARG 193 N -0.22 -0.09 -0.31 0.00 1.74 -0.90 -1.90 116.66 114.99 2gbl n ARG 193 Ca -0.05 1.09 0.11 0.00 -0.77 0.00 0.00 57.85 58.24 2gbl n ARG 193 Cb 0.63 -1.63 0.29 0.00 -1.02 0.00 0.00 32.46 30.73 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 -5.12 0.81 -3.21 -1.55 4.02 -1.26 -4.93 117.16 105.92 2gbl n TYR 194 Ca 0.10 -0.41 -0.23 0.00 -0.01 0.00 0.00 57.90 57.36 2gbl n TYR 194 Cb 0.34 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.67 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 1.57 -0.50 0.00 2.72 0.00 -0.80 -4.75 105.19 103.43 2gbl n GLY 195 Ca 0.22 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.35 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 -4.20 0.00 0.07 1.61 0.31 -1.26 -4.83 118.33 110.03 2gbl n VAL 196 Ca -0.06 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.26 2gbl n VAL 196 Cb 0.58 -0.18 0.28 0.00 -0.91 0.00 0.00 33.84 33.61 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 0.33 -0.90 5.55 3.07 -1.90 -3.06 114.58 117.66 2gbl h GLU 197 Ca 0.00 -0.11 0.18 0.00 -0.50 0.00 0.00 59.36 58.93 2gbl h GLU 197 Cb 0.19 -0.03 -0.17 0.00 -0.84 0.00 0.00 28.75 27.90 2gbl h GLU 197 CO 0.00 0.56 -0.24 0.93 -1.40 0.00 0.00 179.01 178.86 2gbl h GLU 198 N 0.30 -0.00 0.00 2.33 3.07 -1.94 -2.27 114.58 116.06 2gbl h GLU 198 Ca 0.05 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.90 2gbl h GLU 198 Cb 0.59 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.50 2gbl h GLU 198 CO 0.04 -0.00 -0.65 0.74 -1.40 0.00 0.00 179.01 177.73 2gbl h PHE 199 N -0.00 0.00 0.00 4.33 0.04 -1.89 -3.35 116.94 116.07 2gbl h PHE 199 Ca 0.43 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 61.13 2gbl h PHE 199 Cb 0.66 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.80 2gbl h PHE 199 CO -0.71 0.01 -0.63 0.28 -0.60 0.00 0.00 178.31 176.66 2gbl h VAL 200 N 0.00 0.35 -3.35 -0.55 2.07 -1.36 -3.46 116.25 109.95 2gbl h VAL 200 Ca -0.00 -1.55 -0.48 0.00 0.82 0.00 0.00 66.70 65.48 2gbl h VAL 200 Cb 1.01 2.02 0.03 0.00 -1.52 0.00 0.00 31.29 32.84 2gbl h VAL 200 CO 0.00 0.20 0.04 -0.44 0.02 0.00 0.00 177.57 177.40 2gbl s SER 201 N -6.02 6.11 0.00 0.57 0.01 -1.07 -4.93 113.70 108.37 2gbl s SER 201 Ca 0.03 0.73 -0.01 0.00 1.31 0.00 0.00 55.95 58.01 2gbl s SER 201 Cb 0.07 -2.04 -0.26 0.00 0.21 0.00 0.00 66.02 64.00 2gbl s SER 201 CO 0.75 -0.62 0.84 0.44 0.41 0.00 0.00 173.24 175.06 2gbl h ASP 202 N 0.27 0.31 -4.23 2.44 3.32 -1.89 -3.46 116.42 113.19 2gbl h ASP 202 Ca -0.47 -0.45 -0.56 0.00 0.02 0.00 0.00 57.03 55.56 2gbl h ASP 202 Cb 1.22 -0.10 -0.23 0.00 0.22 0.00 0.00 39.33 40.44 2gbl h ASP 202 CO 0.61 1.38 -0.83 0.20 -1.72 0.00 0.00 179.24 178.88 2gbl s ASN 203 N -6.85 2.49 -0.04 6.45 0.01 -1.22 -1.63 114.94 114.16 2gbl s ASN 203 Ca -0.08 -0.61 0.02 0.00 -0.71 0.00 0.00 52.86 51.47 2gbl s ASN 203 Cb 0.07 -0.17 0.01 0.00 0.41 0.00 0.00 41.25 41.58 2gbl s ASN 203 CO 0.84 0.10 -0.07 -0.69 -1.51 0.00 0.00 177.10 175.78 2gbl s VAL 204 N -1.00 0.65 -0.07 1.60 1.01 -0.37 -0.76 120.40 121.45 2gbl s VAL 204 Ca 0.07 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2gbl s VAL 204 Cb -0.09 -0.62 0.02 0.00 0.00 0.00 0.00 36.38 35.68 2gbl s VAL 204 CO 0.03 0.23 -0.11 -0.69 0.00 0.00 0.00 175.10 174.56 2gbl s VAL 205 N 0.58 1.11 -0.19 2.92 1.01 0.14 -1.10 120.40 124.87 2gbl s VAL 205 Ca -0.08 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 2gbl s VAL 205 Cb -0.12 -1.03 -0.01 0.00 0.00 0.00 0.00 36.38 35.22 2gbl s VAL 205 CO 0.01 0.35 -0.07 -0.63 0.00 0.00 0.00 175.10 174.76 2gbl s ILE 206 N 0.83 3.30 -0.28 2.22 1.01 0.47 -0.71 121.20 128.04 2gbl s ILE 206 Ca -0.11 -0.54 -0.10 0.00 0.00 0.00 0.00 60.65 59.89 2gbl s ILE 206 Cb -0.15 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 2gbl s ILE 206 CO 0.02 0.46 0.17 -0.76 0.00 0.00 0.00 174.94 174.83 2gbl s LEU 207 N 1.03 3.96 0.06 2.97 1.43 0.32 -0.42 118.68 128.04 2gbl s LEU 207 Ca 0.00 -0.15 0.06 0.00 -1.03 0.00 0.00 54.13 53.01 2gbl s LEU 207 Cb -0.15 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.97 2gbl s LEU 207 CO -0.01 -0.08 -0.13 -0.13 0.23 0.00 0.00 176.35 176.24 2gbl s ARG 208 N 1.71 2.19 -0.63 1.70 0.52 0.89 -4.16 118.95 121.16 2gbl s ARG 208 Ca 0.07 -0.94 0.05 0.00 -0.52 0.00 0.00 55.73 54.38 2gbl s ARG 208 Cb -0.16 -2.30 0.17 0.00 0.52 0.00 0.00 34.95 33.18 2gbl s ARG 208 CO 0.09 0.54 0.45 1.21 0.02 0.00 0.00 175.30 177.61 2gbl s ASN 209 N -1.73 4.08 0.15 0.23 3.04 -1.26 -0.29 114.94 119.17 2gbl s ASN 209 Ca 0.18 -3.64 -0.30 0.00 0.04 0.00 0.00 52.86 49.13 2gbl s ASN 209 Cb -0.11 -1.37 -0.07 0.00 -1.54 0.00 0.00 41.25 38.16 2gbl s ASN 209 CO 0.09 -0.11 1.02 -0.69 -3.04 0.00 0.00 177.10 174.37 2gbl s VAL 210 N -1.07 4.18 0.00 -5.21 1.01 0.47 -4.76 120.40 115.02 2gbl s VAL 210 Ca 0.26 1.88 0.00 0.00 0.00 0.00 0.00 61.98 64.12 2gbl s VAL 210 Cb -0.04 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.15 2gbl s VAL 210 CO -0.16 0.32 0.00 -0.11 0.00 0.00 0.00 175.10 175.14 2gbl n LEU 211 N 2.47 0.00 -2.62 3.92 7.94 -1.26 0.13 117.00 127.58 2gbl n LEU 211 Ca 0.02 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 54.92 2gbl n LEU 211 Cb 0.48 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.43 2gbl n LEU 211 CO 0.52 0.00 -0.43 1.21 -1.11 0.00 0.00 177.39 177.58 2gbl n GLU 212 N 0.00 -3.17 -1.99 1.96 0.00 -1.26 -4.11 120.64 112.07 2gbl n GLU 212 Ca 0.00 2.58 -0.04 0.00 0.00 0.00 0.00 57.16 59.71 2gbl n GLU 212 Cb 0.00 -5.05 -0.00 0.00 0.00 0.00 0.00 31.44 26.38 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 0.59 0.25 3.20 8.31 0.00 -1.26 -3.33 105.19 112.96 2gbl n GLY 213 Ca 0.01 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.50 -0.09 -4.12 1.61 1.02 -1.26 -5.00 120.64 111.29 2gbl n GLU 214 Ca -0.04 0.02 -0.25 0.00 -0.02 0.00 0.00 57.16 56.86 2gbl n GLU 214 Cb 0.50 -3.25 -0.06 0.00 -0.02 0.00 0.00 31.44 28.61 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 -0.39 2.78 -0.05 3.49 1.81 -1.21 -5.12 118.95 120.27 2gbl s ARG 215 Ca 0.00 -0.97 0.05 0.00 -1.72 0.00 0.00 55.73 53.09 2gbl s ARG 215 Cb 0.00 -2.56 -0.02 0.00 -0.45 0.00 0.00 34.95 31.92 2gbl s ARG 215 CO 0.00 0.46 -0.19 1.03 -0.68 0.00 0.00 175.30 175.92 2gbl s ARG 216 N -3.21 2.48 -0.14 3.54 1.81 -1.26 -4.13 118.95 118.04 2gbl s ARG 216 Ca 0.31 -0.79 -0.00 0.00 -1.72 0.00 0.00 55.73 53.53 2gbl s ARG 216 Cb -0.09 -2.28 0.03 0.00 -0.45 0.00 0.00 34.95 32.15 2gbl s ARG 216 CO 0.22 0.54 -0.10 0.50 -0.68 0.00 0.00 175.30 175.78 2gbl s ARG 217 N -0.53 1.89 -0.07 3.54 3.52 0.12 -4.94 118.95 122.48 2gbl s ARG 217 Ca 0.07 -0.46 -0.23 0.00 -0.13 0.00 0.00 55.73 54.98 2gbl s ARG 217 Cb -0.11 -1.92 -0.04 0.00 -1.56 0.00 0.00 34.95 31.32 2gbl s ARG 217 CO 0.01 -0.28 0.67 -0.98 -0.81 0.00 0.00 175.30 173.91 2gbl s ARG 218 N 1.58 4.42 0.05 5.12 1.70 -1.26 -0.39 118.95 130.17 2gbl s ARG 218 Ca 0.04 0.83 0.05 0.00 -0.47 0.00 0.00 55.73 56.18 2gbl s ARG 218 Cb -0.13 -3.44 -0.02 0.00 -0.57 0.00 0.00 34.95 30.78 2gbl s ARG 218 CO -0.09 0.09 -0.15 0.95 -1.08 0.00 0.00 175.30 175.01 2gbl s THR 219 N 0.74 1.22 -0.03 4.99 -4.23 0.60 -1.48 115.64 117.45 2gbl s THR 219 Ca 0.36 -1.13 0.03 0.00 -1.18 0.00 0.00 61.69 59.78 2gbl s THR 219 Cb -0.17 -1.11 -0.03 0.00 1.34 0.00 0.00 72.50 72.52 2gbl s THR 219 CO 0.17 -0.03 -0.12 -0.22 -0.54 0.00 0.00 174.62 173.89 2gbl s LEU 220 N -1.33 2.90 -0.03 4.79 0.20 0.14 -0.08 118.68 125.28 2gbl s LEU 220 Ca 0.02 -0.18 0.01 0.00 0.69 0.00 0.00 54.13 54.67 2gbl s LEU 220 Cb -0.09 -1.64 0.02 0.00 -0.43 0.00 0.00 46.19 44.06 2gbl s LEU 220 CO 0.02 0.32 -0.01 -0.70 -0.29 0.00 0.00 176.35 175.69 2gbl s GLU 221 N -0.99 0.38 -0.55 1.98 2.12 0.44 -0.72 118.70 121.36 2gbl s GLU 221 Ca 0.13 0.04 -0.20 0.00 0.36 0.00 0.00 54.97 55.30 2gbl s GLU 221 Cb -0.11 -0.52 0.06 0.00 0.26 0.00 0.00 34.13 33.83 2gbl s GLU 221 CO 0.03 -0.12 0.74 0.42 -0.54 0.00 0.00 175.26 175.79 2gbl s ILE 222 N 0.94 4.70 -0.07 -3.70 1.01 -1.26 -0.39 121.20 122.44 2gbl s ILE 222 Ca -0.10 -0.42 0.24 0.00 0.00 0.00 0.00 60.65 60.38 2gbl s ILE 222 Cb -0.13 -4.43 0.27 0.00 0.01 0.00 0.00 42.46 38.18 2gbl s ILE 222 CO -0.01 -1.00 1.74 0.25 0.00 0.00 0.00 174.94 175.92 2gbl h LEU 223 N 10.19 0.00 -7.00 2.97 6.46 -1.47 -3.42 115.31 123.04 2gbl h LEU 223 Ca -0.28 0.00 0.23 0.00 -0.12 0.00 0.00 57.88 57.71 2gbl h LEU 223 Cb 1.09 0.00 -0.31 0.00 -0.73 0.00 0.00 40.66 40.70 2gbl h LEU 223 CO 1.04 0.17 0.95 -1.59 -0.62 0.00 0.00 178.44 178.39 2gbl s LYS 224 N -3.42 0.02 -0.29 1.25 -2.85 -1.20 -4.93 119.74 108.32 2gbl s LYS 224 Ca 0.03 0.01 -0.04 0.00 -1.00 0.00 0.00 55.97 54.97 2gbl s LYS 224 Cb 0.08 0.01 0.10 0.00 -2.06 0.00 0.00 37.83 35.96 2gbl s LYS 224 CO 0.64 -0.00 0.13 -0.51 0.10 0.00 0.00 175.35 175.71 2gbl s LEU 225 N -0.43 0.62 -0.04 2.77 1.43 -1.26 -1.23 118.68 120.54 2gbl s LEU 225 Ca 0.09 -1.30 -0.35 0.00 -1.03 0.00 0.00 54.13 51.54 2gbl s LEU 225 Cb -0.03 -0.37 -0.13 0.00 0.03 0.00 0.00 46.19 45.68 2gbl s LEU 225 CO -0.13 -0.44 1.73 0.54 0.23 0.00 0.00 176.35 178.28 2gbl n ARG 226 N 5.23 1.92 0.00 1.70 1.74 -0.64 -2.32 116.66 124.29 2gbl n ARG 226 Ca -0.06 0.70 0.00 0.00 -0.77 0.00 0.00 57.85 57.72 2gbl n ARG 226 Cb 0.42 -2.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.38 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 3.94 3.18 0.96 -0.13 0.00 -1.26 -5.01 105.19 106.87 2gbl n GLY 227 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.40 0.00 -3.45 2.61 -2.24 -0.98 -4.73 114.28 104.08 2gbl n THR 228 Ca 0.00 -0.69 -0.22 0.00 -2.27 0.00 0.00 64.05 60.87 2gbl n THR 228 Cb 0.00 0.25 0.01 0.00 -2.10 0.00 0.00 70.33 68.49 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 -1.72 4.98 0.00 3.42 1.04 -1.26 -4.70 113.70 115.47 2gbl s SER 229 Ca 0.06 -0.92 -0.30 0.00 0.48 0.00 0.00 55.95 55.28 2gbl s SER 229 Cb 0.00 0.03 0.11 0.00 0.10 0.00 0.00 66.02 66.26 2gbl s SER 229 CO 0.04 -1.03 1.20 -1.38 0.98 0.00 0.00 173.24 173.05 2gbl s HIS 230 N -2.62 -0.08 0.29 5.02 -3.43 -1.26 -4.59 115.29 108.61 2gbl s HIS 230 Ca 0.48 -0.06 -0.28 0.00 -0.80 0.00 0.00 55.06 54.40 2gbl s HIS 230 Cb -0.04 0.56 -0.09 0.00 -1.43 0.00 0.00 32.58 31.58 2gbl s HIS 230 CO 0.30 -0.40 0.95 -1.64 -2.00 0.00 0.00 174.74 171.95 2gbl s MET 231 N -2.63 4.69 0.33 -0.38 -1.94 0.20 -5.02 119.30 114.55 2gbl s MET 231 Ca 0.13 1.42 0.03 0.00 -1.71 0.00 0.00 55.69 55.55 2gbl s MET 231 Cb 0.03 -3.01 -0.02 0.00 2.01 0.00 0.00 34.83 33.84 2gbl s MET 231 CO -0.03 0.37 0.50 0.15 -0.01 0.00 0.00 175.02 176.00 2gbl s LYS 232 N -1.68 3.35 0.98 2.03 3.01 -1.26 -4.59 119.74 121.58 2gbl s LYS 232 Ca 0.46 -0.59 0.00 0.00 -1.01 0.00 0.00 55.97 54.83 2gbl s LYS 232 Cb -0.22 -2.74 0.00 0.00 -1.01 0.00 0.00 37.83 33.86 2gbl s LYS 232 CO 0.28 0.15 0.00 0.41 0.51 0.00 0.00 175.35 176.70 2gbl n GLY 233 N -1.70 -1.94 3.86 -3.33 0.00 -1.26 -4.94 105.19 95.88 2gbl n GLY 233 Ca -0.04 -1.52 -0.37 0.00 0.00 0.00 0.00 46.02 44.09 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 0.00 3.52 -0.04 1.61 2.02 -1.26 -4.15 118.70 120.41 2gbl s GLU 234 Ca 0.00 -0.15 0.05 0.00 0.02 0.00 0.00 54.97 54.89 2gbl s GLU 234 Cb 0.00 -3.21 -0.01 0.00 0.10 0.00 0.00 34.13 31.02 2gbl s GLU 234 CO 0.00 0.72 -0.19 0.71 0.02 0.00 0.00 175.26 176.52 2gbl s TYR 235 N -0.85 1.84 0.48 1.61 1.51 0.10 -4.91 117.35 117.12 2gbl s TYR 235 Ca 0.14 -0.48 -0.21 0.00 -1.01 0.00 0.00 57.07 55.51 2gbl s TYR 235 Cb -0.12 -1.22 -0.08 0.00 -0.11 0.00 0.00 41.96 40.44 2gbl s TYR 235 CO 0.03 -0.13 1.09 -1.25 -1.11 0.00 0.00 175.55 174.18 2gbl s PRO 236 N -0.15 3.76 0.19 -1.71 0.04 -1.26 0.26 135.00 136.14 2gbl s PRO 236 Ca -0.00 1.54 -0.10 0.00 0.04 0.00 0.00 61.00 62.48 2gbl s PRO 236 Cb -0.11 -2.23 -0.01 0.00 0.04 0.00 0.00 34.50 32.20 2gbl s PRO 236 CO 0.01 -0.49 0.35 -0.59 0.04 0.00 0.00 177.00 176.32 2gbl s PHE 237 N -1.77 0.41 -0.01 0.56 -0.12 -0.55 -2.65 117.98 113.85 2gbl s PHE 237 Ca 0.66 -0.76 0.02 0.00 -0.05 0.00 0.00 56.93 56.79 2gbl s PHE 237 Cb -0.22 0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.18 2gbl s PHE 237 CO 0.26 -0.81 -0.06 0.99 -0.05 0.00 0.00 175.22 175.55 2gbl s THR 238 N -3.99 0.49 -0.26 -4.49 2.01 -0.29 -4.30 115.64 104.82 2gbl s THR 238 Ca 0.20 -0.22 -0.18 0.00 0.31 0.00 0.00 61.69 61.80 2gbl s THR 238 Cb 0.02 -0.44 -0.03 0.00 0.01 0.00 0.00 72.50 72.07 2gbl s THR 238 CO 0.04 0.16 0.50 -0.63 -0.69 0.00 0.00 174.62 173.99 2gbl s ILE 239 N 0.10 5.08 0.00 1.82 1.01 -1.26 -1.81 121.20 126.15 2gbl s ILE 239 Ca -0.01 0.85 0.00 0.00 0.00 0.00 0.00 60.65 61.49 2gbl s ILE 239 Cb -0.05 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.60 2gbl s ILE 239 CO -0.00 0.10 0.00 0.35 0.00 0.00 0.00 174.94 175.39 2gbl n THR 240 N 5.10 0.00 0.28 2.92 -2.24 -0.50 -4.91 114.28 114.93 2gbl n THR 240 Ca -0.05 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.86 2gbl n THR 240 Cb 0.50 0.00 0.79 0.00 -2.10 0.00 0.00 70.33 69.52 2gbl n THR 240 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2gbl h ASP 241 N 0.00 0.00 -0.50 3.42 3.32 -1.96 0.34 116.42 121.04 2gbl h ASP 241 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2gbl h ASP 241 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2gbl h ASP 241 CO 0.00 0.03 0.00 1.41 -1.72 0.00 0.00 179.24 178.96 2gbl n HIS 242 N -4.04 1.18 -2.95 4.55 8.25 -1.26 -4.19 115.22 116.76 2gbl n HIS 242 Ca -0.03 -0.47 0.00 0.00 -0.26 0.00 0.00 57.72 56.97 2gbl n HIS 242 Cb 0.12 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.01 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 0.92 -1.29 3.73 -1.41 0.00 0.11 -4.88 105.19 102.35 2gbl n GLY 243 Ca 0.20 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 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 2.71 -0.10 -0.61 1.01 -1.26 -1.41 121.20 121.54 2gbl s ILE 244 Ca 0.00 0.54 -0.02 0.00 0.00 0.00 0.00 60.65 61.17 2gbl s ILE 244 Cb 0.00 -3.35 0.04 0.00 0.01 0.00 0.00 42.46 39.16 2gbl s ILE 244 CO 0.00 0.06 0.03 0.21 0.00 0.00 0.00 174.94 175.23 2gbl s ASN 245 N 0.85 1.89 -0.03 3.58 2.47 -0.75 -4.12 114.94 118.84 2gbl s ASN 245 Ca 0.65 -0.28 0.06 0.00 0.42 0.00 0.00 52.86 53.71 2gbl s ASN 245 Cb -0.42 -0.42 -0.02 0.00 -1.45 0.00 0.00 41.25 38.94 2gbl s ASN 245 CO 0.36 -0.24 -0.19 -0.63 -3.72 0.00 0.00 177.10 172.68 2gbl s ILE 246 N 1.99 2.69 -0.31 -5.21 1.01 -0.59 -1.13 121.20 119.64 2gbl s ILE 246 Ca 0.03 -0.92 -0.02 0.00 0.00 0.00 0.00 60.65 59.74 2gbl s ILE 246 Cb -0.14 -2.03 0.06 0.00 0.01 0.00 0.00 42.46 40.36 2gbl s ILE 246 CO -0.06 0.55 0.02 -0.36 0.00 0.00 0.00 174.94 175.09 2gbl s PHE 247 N -0.72 3.31 -1.22 3.97 0.40 -1.08 -4.01 117.98 118.63 2gbl s PHE 247 Ca 0.11 -1.97 -0.12 0.00 -0.60 0.00 0.00 56.93 54.35 2gbl s PHE 247 Cb -0.10 -2.24 0.18 0.00 0.51 0.00 0.00 43.02 41.36 2gbl s PHE 247 CO 0.01 -0.83 1.51 -2.30 0.70 0.00 0.00 175.22 174.31 2gbl n PRO 248 N 4.61 3.45 0.34 0.24 -0.02 -1.26 -4.31 135.00 138.04 2gbl n PRO 248 Ca -0.12 -3.84 0.19 0.00 -2.02 0.00 0.00 63.50 57.72 2gbl n PRO 248 Cb 0.43 -2.98 1.03 0.00 -0.02 0.00 0.00 33.50 31.96 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 9.08 0.00 -0.83 2.45 3.38 -1.95 0.46 115.31 127.90 2gbl h LEU 249 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2gbl h LEU 249 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2gbl h LEU 249 CO 1.31 0.00 -0.27 0.61 0.09 0.00 0.00 178.44 180.18 2gbl n GLY 250 N -1.15 -0.20 0.98 0.83 0.00 -1.26 -3.71 105.19 100.68 2gbl n GLY 250 Ca -0.03 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.18 2.46 -2.71 4.61 0.00 0.16 -4.89 120.51 119.96 2gbl n ALA 251 Ca 0.12 -0.74 -0.41 0.00 0.00 0.00 0.00 53.44 52.41 2gbl n ALA 251 Cb 0.41 -0.84 -0.04 0.00 0.00 0.00 0.00 19.45 18.98 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 -1.90 4.49 0.35 0.00 0.00 -1.18 -5.03 119.30 116.03 2gbl s MET 252 Ca 0.31 1.22 -0.07 0.00 0.00 0.00 0.00 55.69 57.14 2gbl s MET 252 Cb 0.21 -3.47 -0.06 0.00 0.00 0.00 0.00 34.83 31.51 2gbl s MET 252 CO 0.30 -0.06 0.66 1.03 0.00 0.00 0.00 175.02 176.95 2gbl s ARG 253 N 1.14 3.69 -1.40 4.11 0.52 -1.26 -4.99 118.95 120.76 2gbl s ARG 253 Ca 0.46 0.22 -0.07 0.00 -0.52 0.00 0.00 55.73 55.82 2gbl s ARG 253 Cb -0.19 -2.52 0.07 0.00 0.52 0.00 0.00 34.95 32.82 2gbl s ARG 253 CO 0.23 0.08 2.53 -0.11 0.02 0.00 0.00 175.30 178.04 2gbl n LEU 254 N -1.18 8.22 -2.11 2.53 7.94 -1.26 -4.49 117.00 126.64 2gbl n LEU 254 Ca 0.00 -4.75 -0.09 0.00 -1.11 0.00 0.00 56.01 50.07 2gbl n LEU 254 Cb 0.54 -1.42 0.05 0.00 0.53 0.00 0.00 43.42 43.13 2gbl n LEU 254 CO 0.48 2.05 0.12 0.41 -1.11 0.00 0.00 177.39 179.34 2gbl n THR 255 N 2.25 1.76 -2.59 1.96 -1.04 -1.26 -5.10 114.28 110.26 2gbl n THR 255 Ca 0.66 -3.29 -0.39 0.00 -2.04 0.00 0.00 64.05 58.99 2gbl n THR 255 Cb 0.24 0.10 -0.05 0.00 -1.82 0.00 0.00 70.33 68.81 2gbl n THR 255 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2gbl s GLN 256 N -3.26 4.58 0.41 -2.82 0.00 -1.26 -5.02 119.66 112.29 2gbl s GLN 256 Ca 0.39 1.62 -0.25 0.00 -0.00 0.00 0.00 55.36 57.11 2gbl s GLN 256 Cb 0.37 -3.02 -0.08 0.00 0.00 0.00 0.00 33.01 30.27 2gbl s GLN 256 CO -0.02 0.21 1.27 1.03 0.00 0.00 0.00 175.29 177.77 2gbl s ARG 257 N -1.68 3.94 -0.17 9.60 0.52 -1.26 -5.01 118.95 124.88 2gbl s ARG 257 Ca 0.47 2.06 -0.03 0.00 -0.52 0.00 0.00 55.73 57.72 2gbl s ARG 257 Cb -0.27 -2.70 0.05 0.00 0.52 0.00 0.00 34.95 32.55 2gbl s ARG 257 CO 0.34 -0.48 0.03 0.45 0.02 0.00 0.00 175.30 175.66 2gbl s SER 258 N -0.87 2.68 0.58 0.23 0.15 -1.26 -4.93 113.70 110.28 2gbl s SER 258 Ca 0.58 -0.70 0.08 0.00 0.70 0.00 0.00 55.95 56.62 2gbl s SER 258 Cb -0.36 -0.57 0.09 0.00 -1.71 0.00 0.00 66.02 63.47 2gbl s SER 258 CO 0.46 -0.29 0.80 -0.94 1.20 0.00 0.00 173.24 174.47 2gbl s SER 259 N 1.88 5.06 0.00 5.45 1.04 -1.26 -5.03 113.70 120.84 2gbl s SER 259 Ca 0.00 -0.76 0.06 0.00 0.48 0.00 0.00 55.95 55.73 2gbl s SER 259 Cb -0.16 0.19 0.08 0.00 0.10 0.00 0.00 66.02 66.23 2gbl s SER 259 CO -0.08 -1.36 0.81 -3.20 0.98 0.00 0.00 173.24 170.40 2gbl n ASN 260 N -2.28 1.76 -4.76 7.02 2.85 -1.26 -4.71 115.26 113.88 2gbl n ASN 260 Ca 0.15 -1.46 -0.36 0.00 -0.11 0.00 0.00 54.58 52.80 2gbl n ASN 260 Cb 0.61 -0.03 0.01 0.00 1.24 0.00 0.00 39.78 41.61 2gbl n ASN 260 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2gbl s VAL 261 N -0.63 2.84 0.39 3.44 1.01 -1.26 -4.91 120.40 121.28 2gbl s VAL 261 Ca 0.08 0.57 0.08 0.00 0.00 0.00 0.00 61.98 62.71 2gbl s VAL 261 Cb 0.05 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 2gbl s VAL 261 CO 0.07 -0.07 0.40 -0.13 0.00 0.00 0.00 175.10 175.38 2gbl s ARG 262 N -3.06 2.67 0.00 2.72 1.81 -1.26 -1.21 118.95 120.62 2gbl s ARG 262 Ca 0.71 -1.39 -0.18 0.00 -1.72 0.00 0.00 55.73 53.15 2gbl s ARG 262 Cb -0.30 -2.50 0.03 0.00 -0.45 0.00 0.00 34.95 31.74 2gbl s ARG 262 CO 0.34 -0.13 0.39 0.08 -0.68 0.00 0.00 175.30 175.31 2gbl s VAL 263 N -2.39 0.05 0.52 3.52 1.01 0.26 -4.63 120.40 118.73 2gbl s VAL 263 Ca 0.48 -0.42 -0.13 0.00 0.00 0.00 0.00 61.98 61.90 2gbl s VAL 263 Cb -0.05 -0.80 -0.06 0.00 0.00 0.00 0.00 36.38 35.46 2gbl s VAL 263 CO 0.29 -0.23 0.94 -0.55 0.00 0.00 0.00 175.10 175.55 2gbl s SER 264 N -1.58 6.49 0.03 3.32 0.15 -1.26 -1.54 113.70 119.30 2gbl s SER 264 Ca -0.10 1.41 0.24 0.00 0.70 0.00 0.00 55.95 58.20 2gbl s SER 264 Cb -0.03 -2.45 0.27 0.00 -1.71 0.00 0.00 66.02 62.10 2gbl s SER 264 CO 0.02 -0.62 1.23 -1.54 1.20 0.00 0.00 173.24 173.54 2gbl n SER 265 N -1.84 0.62 0.00 5.45 3.41 -1.26 -4.84 113.62 115.16 2gbl n SER 265 Ca 0.05 -0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 2gbl n SER 265 Cb 0.54 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.97 2gbl n SER 265 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gbl n GLY 266 N 1.45 0.59 2.76 5.00 0.00 -1.26 -2.91 105.19 110.81 2gbl n GLY 266 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.33 0.65 0.10 1.61 1.01 -1.26 -4.88 120.40 115.31 2gbl s VAL 267 Ca 0.00 -0.67 -0.26 0.00 0.00 0.00 0.00 61.98 61.04 2gbl s VAL 267 Cb 0.00 -1.15 -0.10 0.00 0.00 0.00 0.00 36.38 35.13 2gbl s VAL 267 CO 0.00 -0.22 1.66 0.58 0.00 0.00 0.00 175.10 177.12 2gbl h VAL 268 N 6.53 0.54 -0.92 2.92 2.07 -1.96 -0.31 116.25 125.11 2gbl h VAL 268 Ca -0.16 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.47 2gbl h VAL 268 Cb 1.11 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 31.34 2gbl h VAL 268 CO 0.35 0.00 0.55 -0.09 0.02 0.00 0.00 177.57 178.40 2gbl h ARG 269 N -0.41 0.86 -0.44 1.57 9.65 -1.96 0.77 114.38 124.42 2gbl h ARG 269 Ca 0.02 -0.05 0.03 0.00 -1.10 0.00 0.00 59.98 58.88 2gbl h ARG 269 Cb 0.42 -0.19 -0.04 0.00 -1.39 0.00 0.00 29.97 28.77 2gbl h ARG 269 CO -0.09 0.57 0.23 1.25 2.80 0.00 0.00 179.97 184.72 2gbl h LEU 270 N 0.88 0.34 -0.91 3.80 6.46 -1.72 -0.03 115.31 124.13 2gbl h LEU 270 Ca 0.46 0.02 0.13 0.00 -0.12 0.00 0.00 57.88 58.36 2gbl h LEU 270 Cb 0.45 -0.05 -0.09 0.00 -0.73 0.00 0.00 40.66 40.25 2gbl h LEU 270 CO -0.27 0.24 0.53 0.44 -0.62 0.00 0.00 178.44 178.77 2gbl h ASP 271 N 0.46 0.73 0.73 1.25 3.32 0.75 -0.14 116.42 123.51 2gbl h ASP 271 Ca 0.19 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.27 2gbl h ASP 271 Cb 0.08 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.56 2gbl h ASP 271 CO -0.12 0.36 -0.36 -0.33 -1.72 0.00 0.00 179.24 177.07 2gbl h GLU 272 N 0.81 -0.95 -0.36 3.56 5.08 0.47 0.33 114.58 123.52 2gbl h GLU 272 Ca 0.47 0.06 0.10 0.00 -1.00 0.00 0.00 59.36 59.00 2gbl h GLU 272 Cb 0.55 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 2gbl h GLU 272 CO -0.30 -0.63 0.42 0.52 -1.00 0.00 0.00 179.01 178.01 2gbl h MET 273 N -0.99 0.00 -0.60 2.33 2.86 -0.06 0.69 114.93 119.16 2gbl h MET 273 Ca -0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2gbl h MET 273 Cb 0.76 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.42 2gbl h MET 273 CO 0.16 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.13 2gbl n GLY 275 N 0.93 0.12 0.00 0.00 0.00 0.24 -3.99 105.19 102.50 2gbl n GLY 275 Ca 0.18 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.30 1.11 0.00 -0.02 0.00 0.96 -4.87 105.19 101.07 2gbl n GLY 276 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.78 1.69 3.84 -0.02 0.00 -0.13 -4.66 105.19 104.13 2gbl n GLY 277 Ca 0.00 -2.06 -0.31 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.95 3.34 0.27 1.61 2.99 -0.59 -4.76 117.98 118.90 2gbl s PHE 278 Ca 0.00 1.36 -0.20 0.00 0.00 0.00 0.00 56.93 58.09 2gbl s PHE 278 Cb 0.00 -2.81 -0.09 0.00 0.00 0.00 0.00 43.02 40.12 2gbl s PHE 278 CO 0.00 -0.98 0.78 -0.06 -0.00 0.00 0.00 175.22 174.96 2gbl s PHE 279 N -3.09 3.59 0.05 0.36 2.99 -1.26 -0.57 117.98 120.05 2gbl s PHE 279 Ca 0.57 1.44 -0.26 0.00 0.00 0.00 0.00 56.93 58.68 2gbl s PHE 279 Cb -0.13 -2.67 -0.17 0.00 0.00 0.00 0.00 43.02 40.06 2gbl s PHE 279 CO 0.54 0.25 1.55 -0.22 -0.00 0.00 0.00 175.22 177.35 2gbl h LYS 280 N 3.10 -0.22 -5.70 0.44 3.64 -1.42 -3.23 116.57 113.18 2gbl h LYS 280 Ca -0.48 0.02 -0.64 0.00 -1.27 0.00 0.00 60.65 58.28 2gbl h LYS 280 Cb 1.19 0.05 -0.13 0.00 -0.41 0.00 0.00 32.23 32.93 2gbl h LYS 280 CO 0.65 -0.04 1.32 -0.51 -2.27 0.00 0.00 179.45 178.60 2gbl s ASP 281 N -5.11 6.58 -0.07 4.20 1.01 -1.26 -3.91 116.67 118.11 2gbl s ASP 281 Ca -0.15 -1.75 -0.30 0.00 0.71 0.00 0.00 52.55 51.07 2gbl s ASP 281 Cb 0.04 -2.51 0.11 0.00 1.01 0.00 0.00 42.92 41.57 2gbl s ASP 281 CO 0.63 -1.32 0.92 -0.94 0.21 0.00 0.00 175.17 174.68 2gbl s SER 282 N 4.43 -0.38 -0.35 0.27 1.04 -1.22 -4.82 113.70 112.67 2gbl s SER 282 Ca 0.42 0.21 -0.06 0.00 0.48 0.00 0.00 55.95 57.00 2gbl s SER 282 Cb -0.01 0.36 0.06 0.00 0.10 0.00 0.00 66.02 66.52 2gbl s SER 282 CO -0.09 -0.50 0.13 -0.63 0.98 0.00 0.00 173.24 173.13 2gbl s ILE 283 N -2.18 3.68 -0.18 -1.02 -1.09 -1.26 -1.88 121.20 117.27 2gbl s ILE 283 Ca 0.01 -1.32 -0.12 0.00 -2.23 0.00 0.00 60.65 56.99 2gbl s ILE 283 Cb -0.01 -3.17 -0.05 0.00 -1.58 0.00 0.00 42.46 37.66 2gbl s ILE 283 CO -0.03 -0.28 0.21 -0.63 -1.23 0.00 0.00 174.94 172.98 2gbl s ILE 284 N 1.35 5.36 -0.16 2.92 -1.09 0.32 -1.49 121.20 128.41 2gbl s ILE 284 Ca -0.00 0.37 -0.04 0.00 -2.23 0.00 0.00 60.65 58.75 2gbl s ILE 284 Cb -0.21 -3.55 -0.03 0.00 -1.58 0.00 0.00 42.46 37.10 2gbl s ILE 284 CO 0.01 0.42 -0.03 -0.22 -1.23 0.00 0.00 174.94 173.90 2gbl s LEU 285 N 0.36 3.27 -0.33 2.97 2.96 0.37 -0.92 118.68 127.35 2gbl s LEU 285 Ca 0.12 -0.14 -0.05 0.00 -0.22 0.00 0.00 54.13 53.85 2gbl s LEU 285 Cb -0.12 -1.80 0.04 0.00 0.50 0.00 0.00 46.19 44.81 2gbl s LEU 285 CO 0.01 0.15 0.08 0.00 -1.32 0.00 0.00 176.35 175.27 2gbl s ALA 286 N 0.47 2.99 0.14 5.97 0.00 -0.28 0.48 121.76 131.53 2gbl s ALA 286 Ca -0.03 -1.73 0.10 0.00 0.00 0.00 0.00 51.96 50.31 2gbl s ALA 286 Cb -0.14 -2.18 -0.04 0.00 0.00 0.00 0.00 23.12 20.76 2gbl s ALA 286 CO 0.03 -1.29 -0.23 0.99 0.00 0.00 0.00 175.76 175.25 2gbl s THR 287 N 1.37 2.49 0.00 0.00 2.01 -0.98 -0.41 115.64 120.13 2gbl s THR 287 Ca -0.02 -1.75 0.00 0.00 0.31 0.00 0.00 61.69 60.23 2gbl s THR 287 Cb -0.19 -2.14 0.00 0.00 0.01 0.00 0.00 72.50 70.18 2gbl s THR 287 CO 0.02 0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.59 2gbl n GLY 288 N 0.69 1.25 3.33 4.40 0.00 -0.67 -0.70 105.19 113.49 2gbl n GLY 288 Ca -0.16 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 44.92 2gbl n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gbl n ALA 289 N -0.22 -3.80 -1.74 4.61 0.00 -1.25 -2.25 120.51 115.86 2gbl n ALA 289 Ca 0.00 -1.26 -0.37 0.00 0.00 0.00 0.00 53.44 51.81 2gbl n ALA 289 Cb 0.00 -1.66 0.06 0.00 0.00 0.00 0.00 19.45 17.84 2gbl n ALA 289 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2gbl s THR 290 N -2.28 2.19 0.00 0.00 -1.32 -1.26 -2.79 115.64 110.17 2gbl s THR 290 Ca 0.60 0.12 0.00 0.00 -1.21 0.00 0.00 61.69 61.20 2gbl s THR 290 Cb -0.16 -3.05 0.00 0.00 -1.51 0.00 0.00 72.50 67.78 2gbl s THR 290 CO 0.66 -0.02 0.00 0.61 -2.21 0.00 0.00 174.62 173.66 2gbl n GLY 291 N 0.79 0.49 0.20 6.08 0.00 -1.26 -4.87 105.19 106.62 2gbl n GLY 291 Ca 0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.22 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 0.97 0.00 2.61 1.35 -1.85 -3.47 112.91 112.51 2gbl h THR 292 Ca 0.00 -1.33 0.00 0.00 -0.55 0.00 0.00 66.41 64.53 2gbl h THR 292 Cb 0.00 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 2gbl h THR 292 CO 0.00 0.34 0.00 0.61 -0.25 0.00 0.00 175.52 176.22 2gbl n GLY 293 N -0.10 1.70 0.19 5.82 0.00 -1.26 -4.97 105.19 106.56 2gbl n GLY 293 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 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 0.47 0.00 1.61 6.56 -1.91 -2.25 116.57 121.05 2gbl h LYS 294 Ca 0.00 -0.03 -0.05 0.00 -1.06 0.00 0.00 60.65 59.51 2gbl h LYS 294 Cb 0.00 -0.11 -0.01 0.00 -0.57 0.00 0.00 32.23 31.55 2gbl h LYS 294 CO 0.00 0.31 -0.24 1.15 -2.06 0.00 0.00 179.45 178.61 2gbl h THR 295 N 0.48 0.81 -0.24 -0.16 2.02 -1.97 -0.27 112.91 113.58 2gbl h THR 295 Ca 0.18 -0.97 -0.18 0.00 0.77 0.00 0.00 66.41 66.22 2gbl h THR 295 Cb 0.05 1.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 2gbl h THR 295 CO -0.10 0.24 -0.54 0.25 0.37 0.00 0.00 175.52 175.73 2gbl h LEU 296 N 0.00 0.89 0.22 2.58 5.85 -1.85 -0.99 115.31 122.02 2gbl h LEU 296 Ca -0.00 -0.55 -0.01 0.00 0.84 0.00 0.00 57.88 58.15 2gbl h LEU 296 Cb 0.57 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.34 2gbl h LEU 296 CO 0.03 1.29 -0.11 -0.07 -0.34 0.00 0.00 178.44 179.24 2gbl h LEU 297 N 0.54 -0.26 -0.37 2.25 3.38 -0.73 -0.79 115.31 119.33 2gbl h LEU 297 Ca 0.00 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.06 2gbl h LEU 297 Cb 1.15 0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.89 2gbl h LEU 297 CO 0.12 -0.18 -0.23 0.58 0.09 0.00 0.00 178.44 178.82 2gbl h VAL 298 N -0.30 0.38 -0.36 1.22 2.07 -1.01 0.34 116.25 118.58 2gbl h VAL 298 Ca -0.03 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.57 2gbl h VAL 298 Cb 0.23 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 30.30 2gbl h VAL 298 CO 0.05 0.00 -0.25 0.28 0.02 0.00 0.00 177.57 177.67 2gbl h SER 299 N -0.17 -0.82 -0.24 0.57 0.02 -0.99 0.43 113.55 112.34 2gbl h SER 299 Ca 0.18 0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.28 2gbl h SER 299 Cb 0.45 0.41 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 2gbl h SER 299 CO -0.47 -0.27 0.12 -0.09 -1.14 0.00 0.00 176.83 174.97 2gbl h ARG 300 N -0.20 0.40 0.00 3.45 9.65 0.44 0.89 114.38 129.00 2gbl h ARG 300 Ca 0.17 -0.04 -0.17 0.00 -1.10 0.00 0.00 59.98 58.84 2gbl h ARG 300 Cb 0.47 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 28.95 2gbl h ARG 300 CO -0.47 0.33 -0.80 0.35 2.80 0.00 0.00 179.97 182.18 2gbl h PHE 301 N 0.40 0.00 0.12 2.20 3.57 0.67 -2.72 116.94 121.18 2gbl h PHE 301 Ca 0.10 0.00 -0.27 0.00 3.53 0.00 0.00 57.97 61.33 2gbl h PHE 301 Cb 0.08 0.00 0.01 0.00 2.79 0.00 0.00 35.95 38.83 2gbl h PHE 301 CO 0.00 0.80 -1.22 0.28 -2.23 0.00 0.00 178.31 175.95 2gbl h VAL 302 N 0.00 1.47 -0.22 1.41 2.07 -0.35 -3.27 116.25 117.35 2gbl h VAL 302 Ca -0.01 -2.94 -0.12 0.00 0.82 0.00 0.00 66.70 64.45 2gbl h VAL 302 Cb 1.47 2.88 -0.01 0.00 -1.52 0.00 0.00 31.29 34.11 2gbl h VAL 302 CO 0.10 0.86 -0.38 -0.08 0.02 0.00 0.00 177.57 178.09 2gbl h GLU 303 N 0.10 0.50 0.00 1.57 4.81 -0.86 -3.05 114.58 117.66 2gbl h GLU 303 Ca -0.14 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 58.83 2gbl h GLU 303 Cb 1.93 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.31 2gbl h GLU 303 CO 0.20 0.81 -0.08 -0.97 -0.73 0.00 0.00 179.01 178.25 2gbl h ASN 304 N 0.42 0.00 1.79 1.04 -0.73 -1.53 -2.23 115.58 114.35 2gbl h ASN 304 Ca 0.04 0.00 -0.04 0.00 1.87 0.00 0.00 56.30 58.17 2gbl h ASN 304 Cb 0.86 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.44 2gbl h ASN 304 CO 0.07 0.08 -0.18 0.00 -0.37 0.00 0.00 177.43 177.03 2gbl h ALA 305 N 1.92 0.88 0.14 1.57 0.00 -1.62 -3.20 119.26 118.96 2gbl h ALA 305 Ca -0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 54.91 54.45 2gbl h ALA 305 Cb 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2gbl h ALA 305 CO 0.01 0.23 -1.51 0.00 0.00 0.00 0.00 179.25 177.98 2gbl n ALA 307 N -2.92 1.04 -0.72 0.00 0.00 -0.93 0.19 120.51 117.18 2gbl n ALA 307 Ca -0.24 0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.34 2gbl n ALA 307 Cb 0.96 -1.12 0.17 0.00 0.00 0.00 0.00 19.45 19.46 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 -1.78 3.05 -3.73 0.00 3.02 -1.21 -4.98 115.26 109.63 2gbl n ASN 308 Ca -0.00 -2.71 -0.31 0.00 -0.03 0.00 0.00 54.58 51.53 2gbl n ASN 308 Cb 0.02 -0.38 0.04 0.00 -0.61 0.00 0.00 39.78 38.84 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 -0.56 -1.50 -4.21 3.52 5.02 0.52 -5.00 118.16 115.96 2gbl n LYS 309 Ca 0.15 0.44 -0.17 0.00 -2.02 0.00 0.00 58.31 56.71 2gbl n LYS 309 Cb 0.65 -4.11 -0.11 0.00 -0.02 0.00 0.00 35.03 31.43 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 -6.12 0.92 0.08 1.97 2.02 0.41 -4.99 118.70 113.00 2gbl s GLU 310 Ca 0.41 -1.14 -0.22 0.00 0.02 0.00 0.00 54.97 54.04 2gbl s GLU 310 Cb -0.15 -0.79 -0.07 0.00 0.10 0.00 0.00 34.13 33.23 2gbl s GLU 310 CO 0.87 0.15 0.66 1.03 0.02 0.00 0.00 175.26 177.99 2gbl s ARG 311 N -2.45 4.37 0.00 1.61 0.52 -1.26 -3.89 118.95 117.85 2gbl s ARG 311 Ca 0.05 0.91 0.01 0.00 -0.52 0.00 0.00 55.73 56.18 2gbl s ARG 311 Cb -0.06 -3.28 -0.01 0.00 0.52 0.00 0.00 34.95 32.13 2gbl s ARG 311 CO 0.02 0.53 -0.04 0.00 0.02 0.00 0.00 175.30 175.82 2gbl s ALA 312 N -0.83 0.34 -0.08 2.13 0.00 -0.47 0.17 121.76 123.02 2gbl s ALA 312 Ca 0.33 -0.24 0.03 0.00 0.00 0.00 0.00 51.96 52.08 2gbl s ALA 312 Cb -0.21 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 2gbl s ALA 312 CO 0.21 0.06 -0.18 0.42 0.00 0.00 0.00 175.76 176.27 2gbl s ILE 313 N -0.26 2.65 -0.46 0.00 1.01 -0.91 -1.82 121.20 121.40 2gbl s ILE 313 Ca -0.00 -0.84 -0.05 0.00 0.00 0.00 0.00 60.65 59.76 2gbl s ILE 313 Cb -0.03 -2.04 0.12 0.00 0.01 0.00 0.00 42.46 40.52 2gbl s ILE 313 CO -0.00 0.56 0.28 -0.22 0.00 0.00 0.00 174.94 175.56 2gbl s LEU 314 N -0.09 5.39 -0.38 2.97 2.96 -0.48 -0.73 118.68 128.32 2gbl s LEU 314 Ca -0.04 -2.14 -0.25 0.00 -0.22 0.00 0.00 54.13 51.48 2gbl s LEU 314 Cb -0.14 -1.88 0.01 0.00 0.50 0.00 0.00 46.19 44.68 2gbl s LEU 314 CO 0.04 -0.55 0.87 -0.36 -1.32 0.00 0.00 176.35 175.03 2gbl s PHE 315 N 0.99 3.08 -0.21 5.38 0.40 0.47 -1.96 117.98 126.12 2gbl s PHE 315 Ca 0.09 0.65 -0.08 0.00 -0.60 0.00 0.00 56.93 56.99 2gbl s PHE 315 Cb -0.23 -3.58 -0.04 0.00 0.51 0.00 0.00 43.02 39.67 2gbl s PHE 315 CO -0.03 -0.82 0.09 0.00 0.70 0.00 0.00 175.22 175.16 2gbl s ALA 316 N 3.36 3.40 -0.20 5.36 0.00 -1.26 -1.06 121.76 131.36 2gbl s ALA 316 Ca 0.35 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 51.47 2gbl s ALA 316 Cb -0.12 -2.05 0.03 0.00 0.00 0.00 0.00 23.12 20.98 2gbl s ALA 316 CO 0.19 -0.04 0.75 0.66 0.00 0.00 0.00 175.76 177.31 2gbl n TYR 317 N 4.00 0.03 0.00 0.00 4.02 -1.16 -2.06 117.16 121.99 2gbl n TYR 317 Ca -0.16 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.54 2gbl n TYR 317 Cb 0.52 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 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 -0.06 1.69 -4.24 -0.72 1.02 -1.26 -4.48 120.64 112.58 2gbl n GLU 318 Ca 0.01 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.95 2gbl n GLU 318 Cb 0.14 -0.87 -0.12 0.00 -0.02 0.00 0.00 31.44 30.56 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 -1.53 1.01 0.80 3.49 2.02 -1.26 -5.14 118.70 118.10 2gbl s GLU 319 Ca 0.00 -1.13 -0.11 0.00 0.02 0.00 0.00 54.97 53.75 2gbl s GLU 319 Cb 0.00 -1.09 0.08 0.00 0.10 0.00 0.00 34.13 33.22 2gbl s GLU 319 CO 0.00 0.24 1.09 -1.54 0.02 0.00 0.00 175.26 175.07 2gbl s SER 320 N -2.04 4.22 0.39 -0.19 1.04 -1.26 -4.81 113.70 111.06 2gbl s SER 320 Ca 0.05 1.78 0.10 0.00 0.48 0.00 0.00 55.95 58.36 2gbl s SER 320 Cb -0.08 -2.46 0.80 0.00 0.10 0.00 0.00 66.02 64.38 2gbl s SER 320 CO 0.04 -2.21 1.93 0.03 0.98 0.00 0.00 173.24 174.01 2gbl h ARG 321 N -1.25 0.24 -0.03 4.02 3.08 -1.97 -0.61 114.38 117.87 2gbl h ARG 321 Ca -0.45 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.40 2gbl h ARG 321 Cb 1.24 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 31.27 2gbl h ARG 321 CO 0.51 0.36 -0.59 0.00 -1.07 0.00 0.00 179.97 179.19 2gbl h ALA 322 N 1.66 0.11 -0.36 0.04 0.00 -1.99 -2.84 119.26 115.88 2gbl h ALA 322 Ca 0.05 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 2gbl h ALA 322 Cb 0.34 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2gbl h ALA 322 CO 0.02 0.37 0.16 0.37 0.00 0.00 0.00 179.25 180.18 2gbl h GLN 323 N -0.02 0.53 -0.77 0.00 4.15 -1.86 -0.10 115.11 117.04 2gbl h GLN 323 Ca -0.07 -0.08 0.17 0.00 0.77 0.00 0.00 58.65 59.44 2gbl h GLN 323 Cb 1.28 -0.09 -0.11 0.00 0.21 0.00 0.00 27.48 28.77 2gbl h GLN 323 CO 0.12 0.49 0.25 -0.07 -1.93 0.00 0.00 178.83 177.69 2gbl h LEU 324 N 0.44 0.15 -0.57 -2.39 3.38 -1.15 0.61 115.31 115.78 2gbl h LEU 324 Ca 0.12 0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.16 2gbl h LEU 324 Cb 0.14 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2gbl h LEU 324 CO -0.01 0.01 0.10 -0.07 0.09 0.00 0.00 178.44 178.56 2gbl h LEU 325 N 0.34 0.89 0.97 1.67 3.38 -1.10 -1.31 115.31 120.15 2gbl h LEU 325 Ca 0.44 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 2gbl h LEU 325 Cb 0.75 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.27 2gbl h LEU 325 CO -0.48 0.92 -0.46 -0.09 0.09 0.00 0.00 178.44 178.42 2gbl h ARG 326 N 0.83 -1.25 -0.73 1.13 2.43 0.91 -1.59 114.38 116.11 2gbl h ARG 326 Ca 0.17 0.09 0.11 0.00 -0.81 0.00 0.00 59.98 59.54 2gbl h ARG 326 Cb 0.41 0.28 -0.05 0.00 -0.42 0.00 0.00 29.97 30.19 2gbl h ARG 326 CO 0.01 -0.83 0.48 -0.91 -1.51 0.00 0.00 179.97 177.21 2gbl h ASN 327 N -1.31 0.53 -0.13 -3.80 2.35 -1.22 -1.01 115.58 110.99 2gbl h ASN 327 Ca -0.13 0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.57 2gbl h ASN 327 Cb 0.99 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 39.27 2gbl h ASN 327 CO 0.22 0.31 -0.18 0.00 -1.65 0.00 0.00 177.43 176.12 2gbl h ALA 328 N 1.64 0.20 -0.00 -0.83 0.00 -1.17 -2.82 119.26 116.27 2gbl h ALA 328 Ca 0.34 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2gbl h ALA 328 Cb 0.55 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2gbl h ALA 328 CO -0.12 0.12 -0.17 -0.92 0.00 0.00 0.00 179.25 178.15 2gbl h TYR 329 N -0.04 0.00 0.00 0.00 3.20 -0.83 -0.46 116.97 118.84 2gbl h TYR 329 Ca 0.02 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2gbl h TYR 329 Cb 0.74 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.00 2gbl h TYR 329 CO 0.09 0.18 0.00 0.43 -1.64 0.00 0.00 178.16 177.22 2gbl n SER 330 N -4.33 0.00 -0.40 -2.11 7.64 -0.42 -2.31 113.62 111.69 2gbl n SER 330 Ca -0.02 -0.61 0.06 0.00 1.01 0.00 0.00 58.87 59.31 2gbl n SER 330 Cb 0.24 -0.10 0.14 0.00 -1.01 0.00 0.00 64.21 63.48 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 -1.10 0.36 -0.59 1.43 8.01 -0.20 -4.47 117.44 120.88 2gbl n TRP 331 Ca 0.18 -0.73 0.00 0.00 -1.31 0.00 0.00 57.50 55.64 2gbl n TRP 331 Cb 0.14 -0.14 0.00 0.00 -2.01 0.00 0.00 31.31 29.30 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 -0.52 0.88 0.66 6.99 0.00 -0.98 -4.21 105.19 108.01 2gbl n GLY 332 Ca 0.13 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 3.01 0.00 -3.34 1.61 0.00 -1.26 -3.57 117.12 113.57 2gbl n MET 333 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 57.70 57.25 2gbl n MET 333 Cb 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 33.22 32.95 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 6.13 0.40 3.17 -1.08 -1.26 -3.14 116.67 120.89 2gbl s ASP 334 Ca 0.00 -1.80 0.16 0.00 -0.52 0.00 0.00 52.55 50.40 2gbl s ASP 334 Cb 0.00 -2.19 0.86 0.00 -1.46 0.00 0.00 42.92 40.13 2gbl s ASP 334 CO 0.00 -0.84 1.86 -0.26 0.52 0.00 0.00 175.17 176.46 2gbl h PHE 335 N 8.84 0.00 -0.44 -5.34 0.05 -1.89 -3.15 116.94 115.00 2gbl h PHE 335 Ca -0.29 0.00 0.09 0.00 3.82 0.00 0.00 57.97 61.59 2gbl h PHE 335 Cb 1.10 0.00 -0.09 0.00 2.00 0.00 0.00 35.95 38.96 2gbl h PHE 335 CO 0.72 0.32 -0.18 0.93 -0.18 0.00 0.00 178.31 179.91 2gbl h GLU 336 N 0.00 -0.09 0.10 1.51 4.39 -1.95 -2.08 114.58 116.46 2gbl h GLU 336 Ca -0.00 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 2gbl h GLU 336 Cb 0.63 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 2gbl h GLU 336 CO 0.04 -0.06 -0.05 1.49 -1.16 0.00 0.00 179.01 179.28 2gbl h GLU 337 N -0.09 -0.13 -0.92 2.33 4.57 -1.98 -2.58 114.58 115.78 2gbl h GLU 337 Ca 0.21 0.01 0.25 0.00 -1.18 0.00 0.00 59.36 58.65 2gbl h GLU 337 Cb 0.42 0.03 -0.13 0.00 -0.16 0.00 0.00 28.75 28.91 2gbl h GLU 337 CO -0.50 0.06 0.39 0.52 -1.18 0.00 0.00 179.01 178.29 2gbl h MET 338 N -0.29 0.32 0.98 1.92 2.86 -1.52 0.13 114.93 119.34 2gbl h MET 338 Ca -0.01 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 2gbl h MET 338 Cb 0.24 -0.07 0.01 0.00 0.06 0.00 0.00 31.60 31.84 2gbl h MET 338 CO 0.02 0.21 -0.47 0.93 1.06 0.00 0.00 176.91 178.67 2gbl h GLU 339 N 0.33 -1.27 0.03 1.72 5.08 -1.01 -1.95 114.58 117.51 2gbl h GLU 339 Ca 0.60 0.09 0.01 0.00 -1.00 0.00 0.00 59.36 59.05 2gbl h GLU 339 Cb 1.21 0.29 -0.02 0.00 0.50 0.00 0.00 28.75 30.73 2gbl h GLU 339 CO -0.58 -0.84 -0.19 0.00 -1.00 0.00 0.00 179.01 176.39 2gbl h ARG 340 N -1.32 -0.25 0.00 2.33 3.08 -0.87 -0.42 114.38 116.93 2gbl h ARG 340 Ca -0.13 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2gbl h ARG 340 Cb 1.01 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.12 2gbl h ARG 340 CO 0.22 -0.17 0.29 1.04 -1.07 0.00 0.00 179.97 180.28 2gbl n GLN 341 N -3.55 0.00 -3.03 0.04 6.02 0.35 -4.65 117.38 112.57 2gbl n GLN 341 Ca -0.03 0.03 -0.22 0.00 -0.01 0.00 0.00 57.00 56.77 2gbl n GLN 341 Cb 0.15 -1.79 0.02 0.00 1.02 0.00 0.00 30.24 29.63 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 -0.87 -5.37 -0.04 1.08 4.13 -0.17 -4.86 115.26 109.17 2gbl n ASN 342 Ca 0.00 -0.26 0.00 0.00 1.68 0.00 0.00 54.58 56.00 2gbl n ASN 342 Cb 0.29 -4.38 -0.12 0.00 -1.54 0.00 0.00 39.78 34.04 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 -3.81 0.00 -4.12 3.41 4.77 -0.84 -4.91 117.00 111.51 2gbl n LEU 343 Ca -0.10 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.64 2gbl n LEU 343 Cb 0.61 0.18 -0.16 0.00 -2.33 0.00 0.00 43.42 41.72 2gbl n LEU 343 CO 0.45 0.18 -0.49 -0.22 -1.33 0.00 0.00 177.39 175.99 2gbl s LEU 344 N -4.57 1.94 -0.08 2.23 1.98 -0.79 -1.37 118.68 118.01 2gbl s LEU 344 Ca -0.06 -0.30 0.01 0.00 -2.89 0.00 0.00 54.13 50.89 2gbl s LEU 344 Cb 0.07 -0.84 0.02 0.00 0.66 0.00 0.00 46.19 46.10 2gbl s LEU 344 CO 0.61 0.16 -0.09 -0.75 -1.89 0.00 0.00 176.35 174.38 2gbl s LYS 345 N -0.11 1.52 -0.13 1.98 2.20 -0.76 -4.09 119.74 120.35 2gbl s LYS 345 Ca 0.01 -0.30 -0.06 0.00 -0.36 0.00 0.00 55.97 55.25 2gbl s LYS 345 Cb -0.09 -1.43 -0.04 0.00 -1.51 0.00 0.00 37.83 34.77 2gbl s LYS 345 CO 0.01 -0.12 0.10 0.42 -0.36 0.00 0.00 175.35 175.39 2gbl s ILE 346 N 1.17 5.11 0.00 5.43 1.01 -1.26 -1.38 121.20 131.29 2gbl s ILE 346 Ca -0.05 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.66 2gbl s ILE 346 Cb -0.14 -3.23 0.00 0.00 0.01 0.00 0.00 42.46 39.09 2gbl s ILE 346 CO -0.02 0.57 0.00 0.52 0.00 0.00 0.00 174.94 176.01 2gbl n VAL 347 N 2.41 0.00 -0.71 2.92 0.31 -0.83 -4.96 118.33 117.46 2gbl n VAL 347 Ca -0.19 0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 2gbl n VAL 347 Cb 0.54 -0.87 0.00 0.00 -0.91 0.00 0.00 33.84 32.60 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 0.00 -1.94 0.13 0.00 0.00 -0.87 -4.96 121.76 114.12 2gbl s ALA 349 Ca 0.00 1.49 -0.27 0.00 0.00 0.00 0.00 51.96 53.18 2gbl s ALA 349 Cb 0.00 -0.48 -0.07 0.00 0.00 0.00 0.00 23.12 22.57 2gbl s ALA 349 CO 0.00 -0.41 0.85 0.71 0.00 0.00 0.00 175.76 176.91 2gbl s TYR 350 N -1.64 3.85 0.34 0.00 1.51 -1.26 -4.30 117.35 115.83 2gbl s TYR 350 Ca 0.01 1.68 0.12 0.00 -1.01 0.00 0.00 57.07 57.87 2gbl s TYR 350 Cb -0.01 -2.89 0.96 0.00 -0.11 0.00 0.00 41.96 39.91 2gbl s TYR 350 CO -0.02 0.35 1.72 -1.35 -1.11 0.00 0.00 175.55 175.15 2gbl h PRO 351 N 5.02 0.49 0.00 -1.71 0.11 -1.86 0.45 132.00 134.50 2gbl h PRO 351 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2gbl h PRO 351 Cb 1.21 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2gbl h PRO 351 CO 0.69 0.33 0.00 0.93 -0.21 0.00 0.00 178.00 179.74 2gbl h GLU 352 N 0.51 0.00 -1.27 1.05 3.07 -1.92 -3.05 114.58 112.97 2gbl h GLU 352 Ca 0.66 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 59.45 2gbl h GLU 352 Cb 1.36 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.24 2gbl h GLU 352 CO -0.47 0.00 0.08 -1.13 -1.40 0.00 0.00 179.01 176.09 2gbl n SER 353 N -3.08 3.87 0.00 1.42 3.41 0.15 -4.88 113.62 114.51 2gbl n SER 353 Ca -0.02 -2.30 0.00 0.00 -0.26 0.00 0.00 58.87 56.28 2gbl n SER 353 Cb 0.11 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 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 0.59 0.00 -2.84 7.33 0.00 -1.15 -4.94 120.51 119.50 2gbl n ALA 354 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.30 2gbl n ALA 354 Cb 0.60 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.03 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 1.31 0.20 0.00 0.00 -1.26 -4.94 107.32 102.63 2gbl s GLY 355 Ca 0.00 -1.26 -0.10 0.00 0.00 0.00 0.00 44.72 43.35 2gbl s GLY 355 CO 0.00 -1.25 1.83 1.41 0.00 0.00 0.00 173.10 175.09 2gbl h LEU 356 N 1.08 0.65 -0.33 0.66 4.07 -1.95 -0.26 115.31 119.22 2gbl h LEU 356 Ca -0.50 0.01 0.07 0.00 0.08 0.00 0.00 57.88 57.54 2gbl h LEU 356 Cb 1.24 -0.13 -0.08 0.00 1.08 0.00 0.00 40.66 42.76 2gbl h LEU 356 CO 0.59 0.44 -0.30 1.05 -1.08 0.00 0.00 178.44 179.15 2gbl h GLU 357 N 0.78 -0.25 0.20 1.13 4.11 -1.96 0.32 114.58 118.90 2gbl h GLU 357 Ca 0.28 0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.73 2gbl h GLU 357 Cb 0.06 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2gbl h GLU 357 CO -0.13 -0.17 -0.16 -0.44 0.07 0.00 0.00 179.01 178.18 2gbl h ASP 358 N -0.26 -0.42 -0.25 3.06 3.32 -1.84 -1.90 116.42 118.13 2gbl h ASP 358 Ca 0.16 0.04 0.06 0.00 0.02 0.00 0.00 57.03 57.31 2gbl h ASP 358 Cb 0.52 0.14 -0.07 0.00 0.22 0.00 0.00 39.33 40.14 2gbl h ASP 358 CO -0.48 -0.25 -0.30 0.45 -1.72 0.00 0.00 179.24 176.95 2gbl h HIS 359 N -0.37 -0.81 -0.44 4.55 3.86 -0.28 0.49 115.15 122.15 2gbl h HIS 359 Ca -0.01 0.04 0.09 0.00 -1.16 0.00 0.00 60.37 59.33 2gbl h HIS 359 Cb 0.34 0.39 -0.10 0.00 1.06 0.00 0.00 27.41 29.11 2gbl h HIS 359 CO -0.12 -0.37 -0.29 1.25 0.86 0.00 0.00 177.93 179.26 2gbl h LEU 360 N -0.30 -0.99 -0.04 2.43 6.46 -0.15 -0.92 115.31 121.79 2gbl h LEU 360 Ca 0.13 0.19 0.01 0.00 -0.12 0.00 0.00 57.88 58.09 2gbl h LEU 360 Cb 0.52 0.48 -0.01 0.00 -0.73 0.00 0.00 40.66 40.92 2gbl h LEU 360 CO -0.42 -0.30 -0.00 -0.61 -0.62 0.00 0.00 178.44 176.49 2gbl h GLN 361 N -0.20 0.01 -0.81 1.25 4.15 -0.67 -0.55 115.11 118.28 2gbl h GLN 361 Ca 0.19 -0.00 0.19 0.00 0.77 0.00 0.00 58.65 59.80 2gbl h GLN 361 Cb 0.52 -0.00 -0.12 0.00 0.21 0.00 0.00 27.48 28.09 2gbl h GLN 361 CO -0.55 0.01 0.27 0.82 -1.93 0.00 0.00 178.83 177.44 2gbl h ILE 362 N 0.01 0.48 0.50 2.39 1.08 -0.06 0.40 117.51 122.32 2gbl h ILE 362 Ca 0.02 -0.11 -0.02 0.00 -0.39 0.00 0.00 64.86 64.35 2gbl h ILE 362 Cb 0.02 0.13 0.00 0.00 -3.07 0.00 0.00 36.82 33.91 2gbl h ILE 362 CO -0.03 0.06 -0.24 0.40 -0.69 0.00 0.00 178.15 177.64 2gbl h ILE 363 N 0.32 0.50 0.08 -0.67 2.04 -0.43 0.17 117.51 119.53 2gbl h ILE 363 Ca 0.48 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 66.29 2gbl h ILE 363 Cb 0.87 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.43 2gbl h ILE 363 CO -0.53 0.01 -0.50 0.11 0.00 0.00 0.00 178.15 177.24 2gbl h LYS 364 N -0.71 -0.67 -0.58 2.37 1.57 -0.02 -0.38 116.57 118.15 2gbl h LYS 364 Ca -0.07 0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.81 2gbl h LYS 364 Cb 0.54 0.15 -0.07 0.00 0.08 0.00 0.00 32.23 32.93 2gbl h LYS 364 CO 0.11 -0.44 -0.34 0.45 -0.57 0.00 0.00 179.45 178.66 2gbl n SER 365 N -5.29 -0.61 0.28 0.86 2.88 0.13 0.62 113.62 112.48 2gbl n SER 365 Ca -0.08 1.38 0.13 0.00 -1.33 0.00 0.00 58.87 58.98 2gbl n SER 365 Cb 0.39 -0.31 0.82 0.00 -0.75 0.00 0.00 64.21 64.35 2gbl n SER 365 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2gbl h GLU 366 N 0.00 0.00 -0.32 -1.46 4.81 -0.15 -0.17 114.58 117.29 2gbl h GLU 366 Ca 0.09 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.17 2gbl h GLU 366 Cb 0.24 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 2gbl h GLU 366 CO -0.54 0.05 -0.39 0.82 -0.73 0.00 0.00 179.01 178.21 2gbl h ILE 367 N 0.00 1.28 -0.40 2.32 2.04 0.19 -1.89 117.51 121.06 2gbl h ILE 367 Ca -0.00 -1.57 -0.06 0.00 1.00 0.00 0.00 64.86 64.23 2gbl h ILE 367 Cb 0.11 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 2gbl h ILE 367 CO 0.01 0.51 0.00 0.78 0.00 0.00 0.00 178.15 179.45 2gbl h ASN 368 N 0.63 0.68 1.24 1.72 2.35 0.79 0.76 115.58 123.75 2gbl h ASN 368 Ca 0.05 -0.31 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 2gbl h ASN 368 Cb 0.95 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.13 2gbl h ASN 368 CO 0.09 0.82 0.00 0.44 -1.65 0.00 0.00 177.43 177.13 2gbl h ASP 369 N 0.52 0.00 0.00 5.81 3.32 -1.09 -3.29 116.42 121.70 2gbl h ASP 369 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2gbl h ASP 369 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 2gbl h ASP 369 CO 0.02 0.00 -0.86 0.33 -1.72 0.00 0.00 179.24 177.01 2gbl n PHE 370 N -2.97 0.00 -3.98 4.55 7.35 -0.72 -5.03 117.46 116.65 2gbl n PHE 370 Ca 0.02 0.00 -0.29 0.00 -0.76 0.00 0.00 57.45 56.42 2gbl n PHE 370 Cb 0.35 -0.08 -0.01 0.00 0.35 0.00 0.00 39.48 40.10 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 -1.47 -3.88 -0.59 -4.13 -0.00 0.26 -4.94 118.16 103.41 2gbl n LYS 371 Ca -0.00 0.46 -0.30 0.00 -0.00 0.00 0.00 58.31 58.47 2gbl n LYS 371 Cb 0.12 -4.93 0.21 0.00 -0.00 0.00 0.00 35.03 30.42 2gbl n LYS 371 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2gbl n PRO 372 N -4.43 -1.59 -0.10 -1.58 -0.05 -1.26 -4.82 135.00 121.17 2gbl n PRO 372 Ca -0.15 -0.43 -0.11 0.00 -0.05 0.00 0.00 63.50 62.76 2gbl n PRO 372 Cb 0.61 -2.11 -0.13 0.00 -0.05 0.00 0.00 33.50 31.82 2gbl n PRO 372 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2gbl n ALA 373 N -4.56 1.55 -2.45 0.55 0.00 0.44 -4.88 120.51 111.16 2gbl n ALA 373 Ca 0.05 -1.08 -0.21 0.00 0.00 0.00 0.00 53.44 52.20 2gbl n ALA 373 Cb 0.55 -0.08 -0.11 0.00 0.00 0.00 0.00 19.45 19.80 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 -2.43 1.27 -0.14 0.00 0.52 -0.96 -1.53 118.95 115.68 2gbl s ARG 374 Ca -0.17 -1.42 -0.12 0.00 -0.52 0.00 0.00 55.73 53.50 2gbl s ARG 374 Cb 0.06 -1.29 0.04 0.00 0.52 0.00 0.00 34.95 34.28 2gbl s ARG 374 CO 0.64 0.26 0.36 0.42 0.02 0.00 0.00 175.30 177.00 2gbl s ILE 375 N -2.15 -0.00 -0.08 1.52 1.01 -0.65 -2.14 121.20 118.72 2gbl s ILE 375 Ca 0.16 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.84 2gbl s ILE 375 Cb -0.05 -0.51 0.02 0.00 0.01 0.00 0.00 42.46 41.92 2gbl s ILE 375 CO 0.06 0.01 -0.09 0.00 0.00 0.00 0.00 174.94 174.92 2gbl s ALA 376 N 0.36 1.15 -0.35 9.38 0.00 0.09 -0.98 121.76 131.41 2gbl s ALA 376 Ca -0.01 -0.37 -0.05 0.00 0.00 0.00 0.00 51.96 51.52 2gbl s ALA 376 Cb -0.03 -0.64 0.06 0.00 0.00 0.00 0.00 23.12 22.50 2gbl s ALA 376 CO -0.01 -0.08 0.11 0.42 0.00 0.00 0.00 175.76 176.20 2gbl s ILE 377 N 1.05 3.59 -0.53 0.00 1.01 -0.55 -0.40 121.20 125.39 2gbl s ILE 377 Ca -0.08 -1.33 -0.26 0.00 0.00 0.00 0.00 60.65 58.98 2gbl s ILE 377 Cb -0.14 -3.11 0.03 0.00 0.01 0.00 0.00 42.46 39.25 2gbl s ILE 377 CO -0.01 -0.26 1.00 -0.62 0.00 0.00 0.00 174.94 175.05 2gbl s ASP 378 N 1.51 6.42 -0.02 3.58 -1.08 -0.22 -2.11 116.67 124.75 2gbl s ASP 378 Ca -0.01 -0.07 -0.00 0.00 -0.52 0.00 0.00 52.55 51.95 2gbl s ASP 378 Cb -0.20 -2.47 0.00 0.00 -1.46 0.00 0.00 42.92 38.79 2gbl s ASP 378 CO 0.01 -1.23 0.01 -0.24 0.52 0.00 0.00 175.17 174.23 2gbl n SER 379 N 7.61 -2.27 -0.05 -0.34 2.88 -1.25 -3.00 113.62 117.21 2gbl n SER 379 Ca 0.05 0.11 -0.11 0.00 -1.33 0.00 0.00 58.87 57.59 2gbl n SER 379 Cb 0.48 -1.32 0.03 0.00 -0.75 0.00 0.00 64.21 62.65 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 0.25 0.79 -2.45 2.46 3.38 -0.47 -2.84 115.31 116.43 2gbl h LEU 380 Ca -0.01 -0.38 0.01 0.00 0.09 0.00 0.00 57.88 57.59 2gbl h LEU 380 Cb 0.03 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2gbl h LEU 380 CO 0.01 1.12 0.17 0.77 0.09 0.00 0.00 178.44 180.60 2gbl h SER 381 N 0.59 0.00 0.83 -0.43 4.64 -1.91 0.78 113.55 118.05 2gbl h SER 381 Ca 0.04 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.13 2gbl h SER 381 Cb 1.01 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.06 2gbl h SER 381 CO 0.10 0.00 -1.25 0.00 -0.87 0.00 0.00 176.83 174.80 2gbl h ALA 382 N 1.71 0.55 0.00 5.18 0.00 -1.84 -3.28 119.26 121.57 2gbl h ALA 382 Ca 0.02 -1.08 -0.01 0.00 0.00 0.00 0.00 54.91 53.84 2gbl h ALA 382 Cb 0.35 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2gbl h ALA 382 CO -0.00 1.31 -0.03 -0.07 0.00 0.00 0.00 179.25 180.46 2gbl h LEU 383 N 0.00 0.00 0.00 0.00 3.38 0.52 -2.81 115.31 116.40 2gbl h LEU 383 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2gbl h LEU 383 Cb 1.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.57 2gbl h LEU 383 CO 0.10 0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.67 2gbl n ALA 384 N -2.11 2.40 -1.67 1.53 0.00 -0.73 -4.77 120.51 115.16 2gbl n ALA 384 Ca 0.01 -0.12 -0.46 0.00 0.00 0.00 0.00 53.44 52.87 2gbl n ALA 384 Cb 0.36 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.29 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 -1.37 2.41 0.00 0.00 1.74 -1.06 -3.58 116.66 114.81 2gbl n ARG 385 Ca 0.11 0.88 0.00 0.00 -0.77 0.00 0.00 57.85 58.07 2gbl n ARG 385 Cb 0.27 -2.80 0.00 0.00 -1.02 0.00 0.00 32.46 28.92 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 4.55 2.02 2.67 -0.13 0.00 -1.26 -4.97 105.19 108.07 2gbl n GLY 386 Ca 0.22 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.65 1.61 0.31 -1.23 -4.96 118.33 111.41 2gbl n VAL 387 Ca 0.00 -0.32 -0.31 0.00 -0.01 0.00 0.00 64.34 63.69 2gbl n VAL 387 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 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 -0.89 6.58 0.12 4.52 1.04 -1.26 -4.93 113.70 118.88 2gbl s SER 388 Ca 0.35 1.35 -0.19 0.00 0.48 0.00 0.00 55.95 57.94 2gbl s SER 388 Cb -0.09 -2.42 -0.06 0.00 0.10 0.00 0.00 66.02 63.56 2gbl s SER 388 CO 0.70 -0.48 1.73 -1.13 0.98 0.00 0.00 173.24 175.03 2gbl h ASN 389 N 1.14 0.31 -0.80 7.02 -0.73 -1.93 -0.14 115.58 120.44 2gbl h ASN 389 Ca -0.47 -0.07 -0.01 0.00 1.87 0.00 0.00 56.30 57.62 2gbl h ASN 389 Cb 1.19 -0.08 -0.04 0.00 0.27 0.00 0.00 38.32 39.66 2gbl h ASN 389 CO 0.63 0.29 0.48 0.78 -0.37 0.00 0.00 177.43 179.23 2gbl h ASN 390 N 0.30 0.98 -0.62 1.15 2.35 -1.98 0.31 115.58 118.06 2gbl h ASN 390 Ca 0.09 -0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.74 2gbl h ASN 390 Cb 0.05 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 2gbl h ASN 390 CO -0.02 0.76 0.25 0.00 -1.65 0.00 0.00 177.43 176.78 2gbl h ALA 391 N 1.41 0.80 -0.10 -0.83 0.00 -1.87 -2.35 119.26 116.33 2gbl h ALA 391 Ca 0.29 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2gbl h ALA 391 Cb -0.03 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2gbl h ALA 391 CO -0.05 0.41 0.01 0.35 0.00 0.00 0.00 179.25 179.97 2gbl h PHE 392 N 0.86 0.17 -0.73 0.00 3.57 -0.01 -2.17 116.94 118.63 2gbl h PHE 392 Ca 0.21 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.74 2gbl h PHE 392 Cb 0.19 -0.05 -0.06 0.00 2.79 0.00 0.00 35.95 38.83 2gbl h PHE 392 CO 0.01 0.37 0.43 0.00 -2.23 0.00 0.00 178.31 176.90 2gbl h ARG 393 N -0.08 0.77 -0.74 1.11 3.08 -0.36 0.28 114.38 118.45 2gbl h ARG 393 Ca 0.03 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.10 2gbl h ARG 393 Cb 0.30 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.13 2gbl h ARG 393 CO 0.00 0.51 0.48 0.37 -1.07 0.00 0.00 179.97 180.27 2gbl h GLN 394 N 0.80 0.76 -0.31 0.04 4.15 -1.33 -0.57 115.11 118.65 2gbl h GLN 394 Ca 0.32 -0.05 -0.11 0.00 0.77 0.00 0.00 58.65 59.59 2gbl h GLN 394 Cb 0.16 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 2gbl h GLN 394 CO -0.17 0.50 -0.23 0.35 -1.93 0.00 0.00 178.83 177.35 2gbl h PHE 395 N 0.78 0.83 -0.27 3.99 3.57 0.17 -2.12 116.94 123.89 2gbl h PHE 395 Ca 0.32 -0.23 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 2gbl h PHE 395 Cb 0.25 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 2gbl h PHE 395 CO -0.00 0.96 0.12 0.28 -2.23 0.00 0.00 178.31 177.45 2gbl h VAL 396 N 0.46 1.16 -0.99 1.41 2.07 -0.26 -1.49 116.25 118.60 2gbl h VAL 396 Ca 0.06 -0.45 0.04 0.00 0.82 0.00 0.00 66.70 67.17 2gbl h VAL 396 Cb 0.79 0.96 -0.06 0.00 -1.52 0.00 0.00 31.29 31.46 2gbl h VAL 396 CO 0.06 0.16 0.65 0.40 0.02 0.00 0.00 177.57 178.86 2gbl h ILE 397 N 0.30 1.15 0.65 4.57 1.08 -1.15 0.24 117.51 124.35 2gbl h ILE 397 Ca 0.09 -0.42 -0.03 0.00 -0.39 0.00 0.00 64.86 64.11 2gbl h ILE 397 Cb 0.14 -0.19 0.00 0.00 -3.07 0.00 0.00 36.82 33.70 2gbl h ILE 397 CO -0.01 0.23 -0.35 1.23 -0.69 0.00 0.00 178.15 178.55 2gbl h GLY 398 N 1.23 -0.98 1.17 5.37 0.00 -0.68 0.15 103.07 109.34 2gbl h GLY 398 Ca 0.40 0.38 -0.13 0.00 0.00 0.00 0.00 47.33 47.99 2gbl h GLY 398 CO -0.13 -0.35 -0.21 -2.08 0.00 0.00 0.00 176.54 173.76 2gbl h VAL 399 N -0.92 1.27 0.84 4.60 2.07 -1.03 -2.10 116.25 120.97 2gbl h VAL 399 Ca -0.08 -1.37 -0.04 0.00 0.82 0.00 0.00 66.70 66.03 2gbl h VAL 399 Cb 0.73 1.14 0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2gbl h VAL 399 CO 0.12 0.47 -0.40 0.74 0.02 0.00 0.00 177.57 178.51 2gbl h THR 400 N 0.82 0.00 -0.87 2.57 2.02 -0.54 -2.39 112.91 114.52 2gbl h THR 400 Ca 0.11 -0.05 0.21 0.00 0.77 0.00 0.00 66.41 67.45 2gbl h THR 400 Cb 0.78 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.13 2gbl h THR 400 CO 0.06 0.00 0.59 1.23 0.37 0.00 0.00 175.52 177.78 2gbl h GLY 401 N -1.18 0.64 0.88 2.16 0.00 -0.70 -0.17 103.07 104.70 2gbl h GLY 401 Ca -0.12 -0.14 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 2gbl h GLY 401 CO 0.19 -0.00 -0.24 -1.82 0.00 0.00 0.00 176.54 174.66 2gbl h TYR 402 N 0.30 0.68 -0.33 5.60 3.20 -1.29 -1.12 116.97 124.01 2gbl h TYR 402 Ca 0.45 -0.21 -0.10 0.00 3.14 0.00 0.00 58.73 62.01 2gbl h TYR 402 Cb 1.27 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.38 2gbl h TYR 402 CO -0.00 0.91 -0.21 0.00 -1.64 0.00 0.00 178.16 177.22 2gbl h ALA 403 N 0.66 1.02 -0.08 1.82 0.00 -0.66 -1.78 119.26 120.24 2gbl h ALA 403 Ca 0.03 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 2gbl h ALA 403 Cb 0.80 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2gbl h ALA 403 CO 0.06 0.59 -0.00 0.87 0.00 0.00 0.00 179.25 180.76 2gbl h LYS 404 N 0.56 0.14 0.00 0.00 1.57 -0.98 -0.72 116.57 117.14 2gbl h LYS 404 Ca 0.08 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2gbl h LYS 404 Cb 0.67 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.96 2gbl h LYS 404 CO 0.05 0.41 0.00 -0.56 -0.57 0.00 0.00 179.45 178.78 2gbl h GLN 405 N -0.15 0.00 -0.53 3.15 3.07 -1.09 -2.95 115.11 116.61 2gbl h GLN 405 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.76 2gbl h GLN 405 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.91 2gbl h GLN 405 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 178.83 177.01 2gbl n GLU 406 N -2.31 2.55 -1.42 0.06 4.07 -0.68 -4.78 120.64 118.14 2gbl n GLU 406 Ca 0.03 -2.38 -0.14 0.00 -0.06 0.00 0.00 57.16 54.61 2gbl n GLU 406 Cb 0.29 -1.53 -0.06 0.00 -0.06 0.00 0.00 31.44 30.07 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 1.50 -1.21 -3.19 5.31 -0.58 -1.03 -4.98 120.64 116.46 2gbl n GLU 407 Ca 0.21 0.99 -0.39 0.00 -0.42 0.00 0.00 57.16 57.56 2gbl n GLU 407 Cb 0.60 -5.19 -0.06 0.00 -0.57 0.00 0.00 31.44 26.22 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 -2.42 4.94 -0.26 -3.67 1.01 -0.31 -4.83 121.20 115.65 2gbl s ILE 408 Ca 0.00 1.26 -0.28 0.00 0.00 0.00 0.00 60.65 61.63 2gbl s ILE 408 Cb 0.00 -3.94 0.01 0.00 0.01 0.00 0.00 42.46 38.54 2gbl s ILE 408 CO 0.00 0.39 0.99 -0.89 0.00 0.00 0.00 174.94 175.44 2gbl s THR 409 N -0.03 4.67 -0.17 2.92 2.01 -0.58 -4.48 115.64 119.99 2gbl s THR 409 Ca 0.32 1.82 -0.02 0.00 0.31 0.00 0.00 61.69 64.11 2gbl s THR 409 Cb -0.18 -4.29 -0.02 0.00 0.01 0.00 0.00 72.50 68.02 2gbl s THR 409 CO 0.17 -0.24 -0.08 -0.83 -0.69 0.00 0.00 174.62 172.95 2gbl s GLY 410 N 1.36 1.61 -0.35 4.40 0.00 -0.79 -1.63 107.32 111.93 2gbl s GLY 410 Ca 0.42 -0.97 -0.10 0.00 0.00 0.00 0.00 44.72 44.07 2gbl s GLY 410 CO 0.09 0.06 0.17 -2.27 0.00 0.00 0.00 173.10 171.16 2gbl s LEU 411 N 0.76 4.46 0.03 0.66 2.96 -0.15 -0.52 118.68 126.88 2gbl s LEU 411 Ca -0.03 -0.88 0.05 0.00 -0.22 0.00 0.00 54.13 53.05 2gbl s LEU 411 Cb -0.15 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 2gbl s LEU 411 CO 0.02 -0.32 -0.12 -0.36 -1.32 0.00 0.00 176.35 174.25 2gbl s PHE 412 N 1.54 2.73 -0.00 5.38 0.40 -0.10 -1.48 117.98 126.45 2gbl s PHE 412 Ca 0.02 -0.15 0.01 0.00 -0.60 0.00 0.00 56.93 56.21 2gbl s PHE 412 Cb -0.19 -1.53 -0.04 0.00 0.51 0.00 0.00 43.02 41.78 2gbl s PHE 412 CO 0.06 0.32 0.04 0.99 0.70 0.00 0.00 175.22 177.33 2gbl s THR 413 N -0.99 4.42 -0.02 0.64 2.01 -0.90 -1.13 115.64 119.68 2gbl s THR 413 Ca 0.16 -0.51 0.00 0.00 0.31 0.00 0.00 61.69 61.65 2gbl s THR 413 Cb -0.11 -3.00 0.02 0.00 0.01 0.00 0.00 72.50 69.43 2gbl s THR 413 CO 0.07 0.36 0.02 0.21 -0.69 0.00 0.00 174.62 174.59 2gbl s ASN 414 N -1.64 0.17 -0.19 3.53 2.47 0.45 0.18 114.94 119.90 2gbl s ASN 414 Ca 0.21 0.01 -0.08 0.00 0.42 0.00 0.00 52.86 53.43 2gbl s ASN 414 Cb -0.12 -0.10 -0.04 0.00 -1.45 0.00 0.00 41.25 39.54 2gbl s ASN 414 CO 0.12 -0.10 0.07 -0.89 -3.72 0.00 0.00 177.10 172.58 2gbl s THR 415 N 0.91 4.80 0.27 -5.21 2.01 -1.26 -1.67 115.64 115.49 2gbl s THR 415 Ca -0.08 -0.03 -0.16 0.00 0.31 0.00 0.00 61.69 61.73 2gbl s THR 415 Cb -0.11 -3.18 -0.08 0.00 0.01 0.00 0.00 72.50 69.13 2gbl s THR 415 CO -0.02 0.44 0.71 -0.94 -0.69 0.00 0.00 174.62 174.11 2gbl s SER 416 N 0.53 6.87 0.56 3.53 1.04 -0.95 -4.90 113.70 120.38 2gbl s SER 416 Ca 0.04 1.29 0.34 0.00 0.48 0.00 0.00 55.95 58.10 2gbl s SER 416 Cb -0.13 -2.37 1.48 0.00 0.10 0.00 0.00 66.02 65.09 2gbl s SER 416 CO 0.01 -0.09 2.03 0.44 0.98 0.00 0.00 173.24 176.61 2gbl h ASP 417 N 2.80 0.00 -3.42 7.02 3.32 -1.98 -3.40 116.42 120.76 2gbl h ASP 417 Ca -0.48 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.10 2gbl h ASP 417 Cb 1.18 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.39 2gbl h ASP 417 CO 0.66 0.01 -0.80 0.00 -1.72 0.00 0.00 179.24 177.39 2gbl s GLN 418 N -3.74 1.36 0.13 3.56 -2.07 -1.26 -5.05 119.66 112.59 2gbl s GLN 418 Ca 0.00 -0.29 -0.30 0.00 -1.82 0.00 0.00 55.36 52.96 2gbl s GLN 418 Cb 0.10 -1.20 -0.06 0.00 -1.09 0.00 0.00 33.01 30.75 2gbl s GLN 418 CO 0.53 -0.03 1.04 -0.59 -1.32 0.00 0.00 175.29 174.92 2gbl s PHE 419 N 0.81 3.68 0.22 9.60 -0.12 -1.26 -4.29 117.98 126.63 2gbl s PHE 419 Ca -0.12 1.67 0.00 0.00 -0.05 0.00 0.00 56.93 58.43 2gbl s PHE 419 Cb -0.15 -3.18 0.00 0.00 -0.63 0.00 0.00 43.02 39.06 2gbl s PHE 419 CO 0.02 -0.26 0.00 -1.33 -0.05 0.00 0.00 175.22 173.59 2gbl n MET 420 N 2.76 -5.19 -0.36 1.99 2.81 -1.26 -4.72 117.12 113.15 2gbl n MET 420 Ca 0.03 3.71 0.00 0.00 -1.81 0.00 0.00 57.70 59.63 2gbl n MET 420 Cb 0.48 -3.97 0.00 0.00 -0.71 0.00 0.00 33.22 29.01 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 1.56 0.94 3.64 3.03 0.00 -1.07 -4.95 105.19 108.34 2gbl n GLY 421 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.67 -0.61 1.15 4.61 0.00 -1.26 -4.86 120.51 118.87 2gbl n ALA 422 Ca 0.00 0.46 0.12 0.00 0.00 0.00 0.00 53.44 54.02 2gbl n ALA 422 Cb 0.00 -2.14 0.21 0.00 0.00 0.00 0.00 19.45 17.51 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 3.73 0.00 -4.04 0.00 8.25 -1.26 -4.93 115.22 116.98 2gbl n HIS 423 Ca 0.22 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.56 2gbl n HIS 423 Cb 0.17 -0.02 -0.11 0.00 1.12 0.00 0.00 29.99 31.15 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 -2.21 0.65 0.09 0.41 1.04 -1.26 -5.06 113.70 107.36 2gbl s SER 424 Ca 0.27 -0.52 -0.22 0.00 0.48 0.00 0.00 55.95 55.96 2gbl s SER 424 Cb 0.20 0.05 -0.12 0.00 0.10 0.00 0.00 66.02 66.25 2gbl s SER 424 CO 0.42 -0.23 1.70 0.40 0.98 0.00 0.00 173.24 176.51 2gbl h ILE 425 N 4.56 1.08 -4.17 -1.02 5.03 -2.02 -3.43 117.51 117.54 2gbl h ILE 425 Ca -0.34 -0.21 -0.56 0.00 -0.12 0.00 0.00 64.86 63.63 2gbl h ILE 425 Cb 1.20 1.03 -0.26 0.00 -3.03 0.00 0.00 36.82 35.76 2gbl h ILE 425 CO 0.41 0.07 -0.83 -0.89 -0.68 0.00 0.00 178.15 176.22 2gbl s THR 426 N -5.92 1.57 -0.05 -0.27 2.01 -1.26 -4.91 115.64 106.81 2gbl s THR 426 Ca -0.13 -1.13 0.14 0.00 0.31 0.00 0.00 61.69 60.88 2gbl s THR 426 Cb 0.07 -1.36 0.02 0.00 0.01 0.00 0.00 72.50 71.23 2gbl s THR 426 CO 0.68 0.20 1.46 0.44 -0.69 0.00 0.00 174.62 176.71 2gbl h ASP 427 N 4.97 0.00 0.20 3.53 3.32 -1.94 -3.15 116.42 123.35 2gbl h ASP 427 Ca -0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2gbl h ASP 427 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 2gbl h ASP 427 CO 0.44 0.58 -0.30 -1.54 -1.72 0.00 0.00 179.24 176.71 2gbl n SER 428 N -3.30 1.16 -3.38 6.45 3.41 -1.26 -5.00 113.62 111.69 2gbl n SER 428 Ca 0.01 -0.97 -0.18 0.00 -0.26 0.00 0.00 58.87 57.48 2gbl n SER 428 Cb 0.74 0.19 0.07 0.00 -0.26 0.00 0.00 64.21 64.95 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 -0.58 -2.29 0.02 7.33 -0.00 -1.19 -4.95 115.22 113.57 2gbl n HIS 429 Ca 0.12 0.84 0.05 0.00 -0.00 0.00 0.00 57.72 58.73 2gbl n HIS 429 Cb 0.37 -4.36 -0.09 0.00 -0.00 0.00 0.00 29.99 25.90 2gbl n HIS 429 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.34 175.45 2gbl n ILE 430 N -3.67 0.69 -0.01 1.59 2.08 -1.26 -4.88 119.36 113.89 2gbl n ILE 430 Ca -0.16 -0.61 0.00 0.00 0.56 0.00 0.00 62.75 62.54 2gbl n ILE 430 Cb 0.64 -0.37 0.00 0.00 -0.75 0.00 0.00 39.64 39.16 2gbl n ILE 430 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 2gbl n SER 431 N -2.62 0.00 0.00 4.38 3.41 -1.26 -3.45 113.62 114.08 2gbl n SER 431 Ca -0.08 -0.61 0.00 0.00 -0.26 0.00 0.00 58.87 57.92 2gbl n SER 431 Cb 0.71 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 2gbl n SER 431 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2gbl n ILE 433 N 2.14 0.00 -4.56 -1.33 -0.00 -1.26 -5.03 119.36 109.31 2gbl n ILE 433 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 62.75 62.44 2gbl n ILE 433 Cb 0.00 -0.09 -0.12 0.00 -0.00 0.00 0.00 39.64 39.43 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 -0.35 2.91 -0.16 1.39 -1.32 -1.22 -4.98 115.64 111.90 2gbl s THR 434 Ca 0.00 -1.20 -0.22 0.00 -1.21 0.00 0.00 61.69 59.06 2gbl s THR 434 Cb 0.00 -2.25 -0.23 0.00 -1.51 0.00 0.00 72.50 68.51 2gbl s THR 434 CO 0.00 0.30 0.46 0.44 -2.21 0.00 0.00 174.62 173.60 2gbl h ASP 435 N 4.37 0.10 -3.38 8.08 3.32 -1.66 -3.47 116.42 123.78 2gbl h ASP 435 Ca -0.48 -0.74 -0.65 0.00 0.02 0.00 0.00 57.03 55.18 2gbl h ASP 435 Cb 1.16 -0.03 -0.33 0.00 0.22 0.00 0.00 39.33 40.34 2gbl h ASP 435 CO 0.48 1.40 -0.87 -0.89 -1.72 0.00 0.00 179.24 177.64 2gbl s THR 436 N -2.36 1.89 -0.27 0.35 2.01 -0.85 -2.16 115.64 114.25 2gbl s THR 436 Ca -0.24 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 60.86 2gbl s THR 436 Cb 0.03 -1.64 0.06 0.00 0.01 0.00 0.00 72.50 70.96 2gbl s THR 436 CO 0.67 0.52 -0.07 -0.63 -0.69 0.00 0.00 174.62 174.41 2gbl s ILE 437 N 0.38 2.34 -0.09 1.82 1.01 -0.21 0.14 121.20 126.58 2gbl s ILE 437 Ca -0.18 -1.65 -0.21 0.00 0.00 0.00 0.00 60.65 58.62 2gbl s ILE 437 Cb -0.17 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 2gbl s ILE 437 CO 0.08 -0.09 0.58 -0.63 0.00 0.00 0.00 174.94 174.88 2gbl s ILE 438 N 1.11 5.12 -0.16 2.92 -1.09 0.18 -0.87 121.20 128.41 2gbl s ILE 438 Ca -0.07 1.19 0.01 0.00 -2.23 0.00 0.00 60.65 59.56 2gbl s ILE 438 Cb -0.20 -3.92 0.02 0.00 -1.58 0.00 0.00 42.46 36.77 2gbl s ILE 438 CO -0.04 0.29 -0.20 -0.22 -1.23 0.00 0.00 174.94 173.54 2gbl s LEU 439 N 0.68 2.06 -0.18 2.97 2.96 0.15 -2.30 118.68 125.02 2gbl s LEU 439 Ca 0.31 -0.61 -0.07 0.00 -0.22 0.00 0.00 54.13 53.55 2gbl s LEU 439 Cb -0.16 -1.42 -0.04 0.00 0.50 0.00 0.00 46.19 45.07 2gbl s LEU 439 CO 0.14 0.02 0.04 -0.76 -1.32 0.00 0.00 176.35 174.47 2gbl s LEU 440 N 1.17 3.72 0.02 -0.68 1.43 0.12 -1.29 118.68 123.17 2gbl s LEU 440 Ca 0.01 0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.14 2gbl s LEU 440 Cb -0.14 -1.93 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 2gbl s LEU 440 CO -0.09 0.18 0.01 0.00 0.23 0.00 0.00 176.35 176.67 2gbl s GLN 441 N 0.33 0.40 0.35 1.70 -2.07 -0.38 -3.89 119.66 116.11 2gbl s GLN 441 Ca 0.02 -0.68 -0.22 0.00 -1.82 0.00 0.00 55.36 52.66 2gbl s GLN 441 Cb -0.13 0.15 -0.10 0.00 -1.09 0.00 0.00 33.01 31.84 2gbl s GLN 441 CO 0.01 -0.08 0.89 0.71 -1.32 0.00 0.00 175.29 175.50 2gbl s TYR 442 N -1.91 3.50 -0.04 9.60 1.51 -1.26 -0.71 117.35 128.03 2gbl s TYR 442 Ca -0.11 1.59 0.00 0.00 -1.01 0.00 0.00 57.07 57.54 2gbl s TYR 442 Cb -0.06 -2.80 0.03 0.00 -0.11 0.00 0.00 41.96 39.01 2gbl s TYR 442 CO -0.02 0.09 -0.01 0.08 -1.11 0.00 0.00 175.55 174.57 2gbl s VAL 443 N -1.87 0.33 -0.46 0.71 1.01 0.60 -4.59 120.40 116.12 2gbl s VAL 443 Ca 0.54 0.03 -0.27 0.00 0.00 0.00 0.00 61.98 62.28 2gbl s VAL 443 Cb -0.13 -0.42 0.03 0.00 0.00 0.00 0.00 36.38 35.86 2gbl s VAL 443 CO 0.18 0.20 1.03 -0.70 0.00 0.00 0.00 175.10 175.81 2gbl s GLU 444 N 1.20 3.65 -0.27 2.72 2.12 0.10 -1.38 118.70 126.85 2gbl s GLU 444 Ca -0.07 0.39 0.01 0.00 0.36 0.00 0.00 54.97 55.66 2gbl s GLU 444 Cb -0.14 -3.91 0.07 0.00 0.26 0.00 0.00 34.13 30.42 2gbl s GLU 444 CO -0.02 -1.29 -0.00 0.42 -0.54 0.00 0.00 175.26 173.83 2gbl s ILE 445 N 4.09 1.49 -1.01 -3.70 -1.09 -0.32 -4.29 121.20 116.37 2gbl s ILE 445 Ca 0.43 -1.42 -0.09 0.00 -2.23 0.00 0.00 60.65 57.33 2gbl s ILE 445 Cb -0.09 -1.89 -0.04 0.00 -1.58 0.00 0.00 42.46 38.87 2gbl s ILE 445 CO 0.29 -0.30 0.83 0.54 -1.23 0.00 0.00 174.94 175.06 2gbl n ARG 446 N 4.65 -1.73 -1.03 2.79 1.74 -1.26 -2.24 116.66 119.58 2gbl n ARG 446 Ca -0.07 0.85 -0.01 0.00 -0.77 0.00 0.00 57.85 57.84 2gbl n ARG 446 Cb 0.43 -5.13 -0.00 0.00 -1.02 0.00 0.00 32.46 26.74 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 -1.48 0.19 3.35 -0.13 0.00 -1.26 -4.96 105.19 100.90 2gbl n GLY 447 Ca -0.08 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.77 1.32 -0.57 1.61 2.02 -0.95 -5.10 118.70 115.27 2gbl s GLU 448 Ca 0.00 -1.55 -0.12 0.00 0.02 0.00 0.00 54.97 53.32 2gbl s GLU 448 Cb 0.00 -1.18 0.14 0.00 0.10 0.00 0.00 34.13 33.19 2gbl s GLU 448 CO 0.00 0.21 0.48 -1.64 0.02 0.00 0.00 175.26 174.33 2gbl s MET 449 N -3.44 2.85 0.46 1.61 -1.94 -1.26 -1.17 119.30 116.40 2gbl s MET 449 Ca 0.21 -1.94 0.05 0.00 -1.71 0.00 0.00 55.69 52.30 2gbl s MET 449 Cb -0.02 -4.12 0.01 0.00 2.01 0.00 0.00 34.83 32.71 2gbl s MET 449 CO 0.07 -1.25 0.64 -1.54 -0.01 0.00 0.00 175.02 172.92 2gbl s SER 450 N 2.71 5.58 0.33 3.03 1.04 -0.48 -4.90 113.70 121.01 2gbl s SER 450 Ca 0.08 -0.19 0.08 0.00 0.48 0.00 0.00 55.95 56.40 2gbl s SER 450 Cb -0.24 -0.88 -0.04 0.00 0.10 0.00 0.00 66.02 64.96 2gbl s SER 450 CO -0.01 -0.85 0.19 -0.13 0.98 0.00 0.00 173.24 173.42 2gbl s ARG 451 N -4.49 2.54 -0.08 4.02 3.00 -1.26 -0.29 118.95 122.40 2gbl s ARG 451 Ca 0.54 -1.41 -0.14 0.00 0.00 0.00 0.00 55.73 54.72 2gbl s ARG 451 Cb -0.10 -2.31 0.03 0.00 0.00 0.00 0.00 34.95 32.56 2gbl s ARG 451 CO 0.35 0.14 0.35 0.00 0.00 0.00 0.00 175.30 176.14 2gbl s ALA 452 N -2.35 -0.87 0.09 2.13 0.00 0.11 -2.33 121.76 118.54 2gbl s ALA 452 Ca 0.38 0.70 0.09 0.00 0.00 0.00 0.00 51.96 53.12 2gbl s ALA 452 Cb -0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 2gbl s ALA 452 CO 0.24 -0.22 -0.23 -1.50 0.00 0.00 0.00 175.76 174.05 2gbl s ILE 453 N -0.58 1.88 -0.14 0.00 2.07 0.68 -1.25 121.20 123.86 2gbl s ILE 453 Ca -0.07 -1.51 -0.07 0.00 -1.41 0.00 0.00 60.65 57.60 2gbl s ILE 453 Cb -0.04 -1.67 0.06 0.00 0.13 0.00 0.00 42.46 40.94 2gbl s ILE 453 CO 0.03 0.08 0.33 0.21 -1.91 0.00 0.00 174.94 173.67 2gbl s ASN 454 N -1.72 -0.26 -0.75 4.50 2.47 -0.41 -1.56 114.94 117.21 2gbl s ASN 454 Ca 0.09 0.72 -0.25 0.00 0.42 0.00 0.00 52.86 53.84 2gbl s ASN 454 Cb -0.10 0.68 0.05 0.00 -1.45 0.00 0.00 41.25 40.44 2gbl s ASN 454 CO 0.04 -0.19 1.19 -0.69 -3.72 0.00 0.00 177.10 173.73 2gbl s VAL 455 N 1.64 3.98 0.13 -5.21 1.01 -1.26 0.31 120.40 120.99 2gbl s VAL 455 Ca -0.07 -0.06 -0.17 0.00 0.00 0.00 0.00 61.98 61.68 2gbl s VAL 455 Cb -0.10 -4.85 -0.01 0.00 0.00 0.00 0.00 36.38 31.41 2gbl s VAL 455 CO -0.11 -1.73 1.71 0.15 0.00 0.00 0.00 175.10 175.13 2gbl h PHE 456 N 9.80 0.52 -2.43 5.22 3.57 -1.33 -3.45 116.94 128.85 2gbl h PHE 456 Ca -0.21 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.18 2gbl h PHE 456 Cb 1.05 -0.16 -0.19 0.00 2.79 0.00 0.00 35.95 39.43 2gbl h PHE 456 CO 1.10 0.44 -0.00 -1.59 -2.23 0.00 0.00 178.31 176.02 2gbl s LYS 457 N -5.73 0.89 -0.07 1.11 -2.85 -1.18 -4.98 119.74 106.94 2gbl s LYS 457 Ca -0.13 0.08 -0.03 0.00 -1.00 0.00 0.00 55.97 54.89 2gbl s LYS 457 Cb 0.10 0.41 0.04 0.00 -2.06 0.00 0.00 37.83 36.32 2gbl s LYS 457 CO 0.74 -0.27 0.13 -1.64 0.10 0.00 0.00 175.35 174.41 2gbl s MET 458 N -1.22 0.03 0.15 1.78 -1.94 -1.26 -1.05 119.30 115.79 2gbl s MET 458 Ca -0.12 0.45 -0.11 0.00 -1.71 0.00 0.00 55.69 54.20 2gbl s MET 458 Cb -0.02 -0.27 0.01 0.00 2.01 0.00 0.00 34.83 36.56 2gbl s MET 458 CO 0.08 -0.26 1.57 0.00 -0.01 0.00 0.00 175.02 176.40 2gbl h ARG 459 N 7.95 0.93 -0.14 2.03 3.08 -1.81 -3.31 114.38 123.09 2gbl h ARG 459 Ca -0.25 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.46 2gbl h ARG 459 Cb 1.12 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.12 2gbl h ARG 459 CO 0.26 1.00 0.00 0.41 -1.07 0.00 0.00 179.97 180.57 2gbl n GLY 460 N -0.25 4.10 1.57 0.04 0.00 -1.26 -5.02 105.19 104.37 2gbl n GLY 460 Ca 0.00 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 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 -0.74 1.31 -0.05 1.61 2.88 -1.25 -5.09 113.62 112.28 2gbl n SER 461 Ca 0.16 -2.01 -0.22 0.00 -1.33 0.00 0.00 58.87 55.47 2gbl n SER 461 Cb 0.68 0.43 -0.13 0.00 -0.75 0.00 0.00 64.21 64.44 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 -0.45 1.13 -1.32 0.66 -0.00 -1.26 -4.84 117.44 111.36 2gbl n TRP 462 Ca -0.04 0.36 0.00 0.00 -0.00 0.00 0.00 57.50 57.82 2gbl n TRP 462 Cb 0.29 -1.13 0.00 0.00 -0.00 0.00 0.00 31.31 30.46 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 -4.01 -1.78 -2.24 5.87 1.44 -1.25 -4.90 115.22 108.35 2gbl n HIS 463 Ca -0.32 0.94 -0.39 0.00 -2.01 0.00 0.00 57.72 55.94 2gbl n HIS 463 Cb 0.85 -1.70 -0.02 0.00 0.12 0.00 0.00 29.99 29.24 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 -2.97 6.71 0.00 4.39 2.15 0.99 -4.96 116.67 122.98 2gbl s ASP 464 Ca 0.00 2.47 0.23 0.00 0.43 0.00 0.00 52.55 55.68 2gbl s ASP 464 Cb 0.00 -2.63 0.39 0.00 -0.30 0.00 0.00 42.92 40.38 2gbl s ASP 464 CO 0.00 -0.55 1.37 0.29 -0.17 0.00 0.00 175.17 176.11 2gbl n LYS 465 N 0.51 2.47 -2.37 4.34 4.76 -1.26 -4.38 118.16 122.22 2gbl n LYS 465 Ca 0.02 -2.24 -0.32 0.00 -2.87 0.00 0.00 58.31 52.90 2gbl n LYS 465 Cb 0.44 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 32.10 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 -1.53 3.01 -0.81 7.82 0.00 -1.26 -4.98 121.76 124.02 2gbl s ALA 466 Ca 0.37 0.23 -0.09 0.00 0.00 0.00 0.00 51.96 52.47 2gbl s ALA 466 Cb 0.22 -3.14 0.21 0.00 0.00 0.00 0.00 23.12 20.41 2gbl s ALA 466 CO 0.31 -0.30 0.72 0.42 0.00 0.00 0.00 175.76 176.91 2gbl s ILE 467 N -2.56 4.99 0.24 0.00 1.01 -1.26 -4.45 121.20 119.16 2gbl s ILE 467 Ca 0.60 -2.88 -0.30 0.00 0.00 0.00 0.00 60.65 58.07 2gbl s ILE 467 Cb -0.11 -4.11 -0.09 0.00 0.01 0.00 0.00 42.46 38.17 2gbl s ILE 467 CO 0.31 -1.01 0.99 -0.13 0.00 0.00 0.00 174.94 175.10 2gbl s ARG 468 N -0.24 4.78 0.45 2.79 0.52 -0.60 -3.90 118.95 122.75 2gbl s ARG 468 Ca 0.20 1.58 -0.20 0.00 -0.52 0.00 0.00 55.73 56.79 2gbl s ARG 468 Cb -0.13 -3.26 -0.10 0.00 0.52 0.00 0.00 34.95 31.98 2gbl s ARG 468 CO -0.08 0.39 0.96 -2.00 0.02 0.00 0.00 175.30 174.60 2gbl s GLU 469 N -1.11 4.13 0.04 3.54 2.12 0.50 -0.23 118.70 127.70 2gbl s GLU 469 Ca 0.43 1.10 -0.10 0.00 0.36 0.00 0.00 54.97 56.76 2gbl s GLU 469 Cb -0.27 -2.16 0.01 0.00 0.26 0.00 0.00 34.13 31.96 2gbl s GLU 469 CO 0.34 -0.11 0.21 -0.59 -0.54 0.00 0.00 175.26 174.56 2gbl s PHE 470 N -2.26 0.04 0.30 5.30 -0.12 -0.98 -0.70 117.98 119.55 2gbl s PHE 470 Ca 0.62 -0.25 0.10 0.00 -0.05 0.00 0.00 56.93 57.35 2gbl s PHE 470 Cb -0.10 -0.02 -0.05 0.00 -0.63 0.00 0.00 43.02 42.23 2gbl s PHE 470 CO 0.17 -0.44 -0.07 0.00 -0.05 0.00 0.00 175.22 174.84 2gbl s MET 471 N -2.57 2.00 -0.10 1.99 0.23 -0.63 -4.08 119.30 116.15 2gbl s MET 471 Ca -0.05 -1.66 0.03 0.00 -1.03 0.00 0.00 55.69 52.98 2gbl s MET 471 Cb -0.01 -1.94 0.01 0.00 -1.53 0.00 0.00 34.83 31.36 2gbl s MET 471 CO -0.04 0.27 -0.18 0.42 -2.03 0.00 0.00 175.02 173.46 2gbl s ILE 472 N -2.46 1.67 0.00 3.16 1.01 -1.26 -0.35 121.20 122.97 2gbl s ILE 472 Ca 0.32 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 60.19 2gbl s ILE 472 Cb -0.04 -1.48 0.00 0.00 0.01 0.00 0.00 42.46 40.95 2gbl s ILE 472 CO 0.18 0.47 0.00 -1.54 0.00 0.00 0.00 174.94 174.05 2gbl n SER 473 N 3.83 0.35 0.10 3.58 3.41 -0.78 -4.97 113.62 119.13 2gbl n SER 473 Ca -0.20 -0.26 -0.05 0.00 -0.26 0.00 0.00 58.87 58.10 2gbl n SER 473 Cb 0.52 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.52 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 0.12 0.95 4.04 3.32 -1.92 -2.80 116.42 120.13 2gbl h ASP 474 Ca 0.00 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 2gbl h ASP 474 Cb 0.00 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2gbl h ASP 474 CO 0.00 0.85 -0.01 0.11 -1.72 0.00 0.00 179.24 178.47 2gbl h LYS 475 N 0.06 0.00 0.00 3.56 1.57 -1.86 -2.91 116.57 116.99 2gbl h LYS 475 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2gbl h LYS 475 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.68 2gbl h LYS 475 CO 0.11 0.01 0.00 0.41 -0.57 0.00 0.00 179.45 179.41 2gbl n GLY 476 N -0.04 0.36 3.68 3.86 0.00 -1.06 -4.86 105.19 107.13 2gbl n GLY 476 Ca 0.00 -2.14 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 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 4.36 -0.30 1.61 0.04 -1.26 -1.87 135.00 137.58 2gbl s PRO 477 Ca 0.00 1.22 -0.01 0.00 0.04 0.00 0.00 61.00 62.25 2gbl s PRO 477 Cb 0.00 -3.56 0.05 0.00 0.04 0.00 0.00 34.50 31.03 2gbl s PRO 477 CO 0.00 -0.33 -0.01 0.34 0.04 0.00 0.00 177.00 177.04 2gbl s ASP 478 N 1.12 4.85 -0.28 6.66 2.15 0.52 -4.97 116.67 126.71 2gbl s ASP 478 Ca 0.44 -1.31 -0.21 0.00 0.43 0.00 0.00 52.55 51.89 2gbl s ASP 478 Cb -0.17 -1.70 -0.01 0.00 -0.30 0.00 0.00 42.92 40.74 2gbl s ASP 478 CO 0.15 -0.26 0.67 -0.63 -0.17 0.00 0.00 175.17 174.93 2gbl s ILE 479 N 1.23 4.92 0.00 4.11 1.01 -1.26 -1.60 121.20 129.60 2gbl s ILE 479 Ca -0.05 1.07 0.00 0.00 0.00 0.00 0.00 60.65 61.66 2gbl s ILE 479 Cb -0.20 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.26 2gbl s ILE 479 CO -0.02 -0.09 0.00 0.29 0.00 0.00 0.00 174.94 175.12 2gbl n LYS 480 N 5.89 1.39 -3.58 2.79 5.02 0.12 -5.01 118.16 124.78 2gbl n LYS 480 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.08 2gbl n LYS 480 Cb 0.49 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.48 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 4.96 0.65 4.39 1.01 -1.25 -4.61 116.67 120.82 2gbl s ASP 481 Ca 0.00 -0.87 -0.09 0.00 0.71 0.00 0.00 52.55 52.30 2gbl s ASP 481 Cb 0.00 -0.27 0.01 0.00 1.01 0.00 0.00 42.92 43.67 2gbl s ASP 481 CO 0.00 -0.82 1.01 -0.94 0.21 0.00 0.00 175.17 174.63 2gbl s SER 482 N -4.22 5.57 -1.25 0.27 1.04 -1.26 -0.37 113.70 113.48 2gbl s SER 482 Ca 0.46 0.97 -0.08 0.00 0.48 0.00 0.00 55.95 57.79 2gbl s SER 482 Cb -0.03 -1.88 0.19 0.00 0.10 0.00 0.00 66.02 64.40 2gbl s SER 482 CO 0.27 -1.18 1.85 0.49 0.98 0.00 0.00 173.24 175.65 2gbl n PHE 483 N -2.80 2.79 -0.17 5.02 3.01 -1.25 -4.81 117.46 119.24 2gbl n PHE 483 Ca 0.06 -2.75 -0.03 0.00 1.01 0.00 0.00 57.45 55.74 2gbl n PHE 483 Cb 0.57 -1.83 0.07 0.00 -0.01 0.00 0.00 39.48 38.28 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 5.60 0.41 -1.02 -1.08 2.43 -1.94 -2.77 114.38 116.01 2gbl h ARG 484 Ca 0.39 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.48 2gbl h ARG 484 Cb 0.60 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 2gbl h ARG 484 CO 1.58 0.27 0.06 0.27 -1.51 0.00 0.00 179.97 180.63 2gbl n ASN 485 N -4.96 3.12 -4.10 -3.80 6.94 -1.26 -4.86 115.26 106.34 2gbl n ASN 485 Ca 0.06 -2.15 -0.15 0.00 -0.02 0.00 0.00 54.58 52.31 2gbl n ASN 485 Cb 0.19 -0.54 -0.12 0.00 -2.36 0.00 0.00 39.78 36.95 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 -0.29 0.89 0.36 -2.53 0.40 -1.05 -2.36 117.98 113.40 2gbl s PHE 486 Ca 0.05 -0.47 0.08 0.00 -0.60 0.00 0.00 56.93 55.99 2gbl s PHE 486 Cb 0.04 -0.52 -0.04 0.00 0.51 0.00 0.00 43.02 43.01 2gbl s PHE 486 CO 0.01 -0.03 0.18 -1.21 0.70 0.00 0.00 175.22 174.88 2gbl s GLU 487 N -1.61 2.39 -1.74 0.44 2.02 -1.20 -4.72 118.70 114.27 2gbl s GLU 487 Ca -0.06 -1.58 -0.14 0.00 0.02 0.00 0.00 54.97 53.21 2gbl s GLU 487 Cb -0.10 -2.19 0.14 0.00 0.10 0.00 0.00 34.13 32.08 2gbl s GLU 487 CO 0.01 0.04 0.35 0.54 0.02 0.00 0.00 175.26 176.22 2gbl n ARG 488 N -1.22 -0.81 0.24 1.61 1.74 -1.26 -1.40 116.66 115.55 2gbl n ARG 488 Ca -0.02 0.12 0.11 0.00 -0.77 0.00 0.00 57.85 57.29 2gbl n ARG 488 Cb 0.62 -4.24 0.61 0.00 -1.02 0.00 0.00 32.46 28.44 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 -1.26 0.59 0.00 0.55 1.08 -1.88 -1.89 117.51 114.69 2gbl h ILE 489 Ca -0.63 -0.79 -0.00 0.00 -0.39 0.00 0.00 64.86 63.05 2gbl h ILE 489 Cb 1.39 1.52 -0.00 0.00 -3.07 0.00 0.00 36.82 36.66 2gbl h ILE 489 CO 0.82 0.17 -0.00 -0.29 -0.69 0.00 0.00 178.15 178.15 2gbl h ILE 490 N 0.00 0.01 0.00 -0.67 6.09 -1.95 -2.70 117.51 118.28 2gbl h ILE 490 Ca -0.00 -0.87 -0.06 0.00 -1.37 0.00 0.00 64.86 62.56 2gbl h ILE 490 Cb 0.50 1.86 -0.01 0.00 0.47 0.00 0.00 36.82 39.64 2gbl h ILE 490 CO 0.02 0.00 -0.29 0.77 -3.07 0.00 0.00 178.15 175.58 2gbl h SER 491 N 0.00 0.00 0.00 2.19 4.64 -1.72 -3.35 113.55 115.31 2gbl h SER 491 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2gbl h SER 491 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2gbl h SER 491 CO 0.00 0.29 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 2gbl n GLY 492 N -0.10 2.72 2.96 -0.77 0.00 -1.02 -2.59 105.19 106.38 2gbl n GLY 492 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 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 0.36 5.05 1.41 1.61 0.01 -1.26 0.00 113.70 120.88 2gbl s SER 493 Ca 0.00 -3.72 -0.21 0.00 1.31 0.00 0.00 55.95 53.33 2gbl s SER 493 Cb 0.00 -1.70 0.33 0.00 0.21 0.00 0.00 66.02 64.85 2gbl s SER 493 CO 0.00 -0.13 0.77 -2.65 0.41 0.00 0.00 173.24 171.64 2gbl n PRO 494 N 2.21 -4.43 -3.35 12.44 -0.02 -1.21 -4.84 135.00 135.79 2gbl n PRO 494 Ca 0.18 -1.29 -0.23 0.00 -2.02 0.00 0.00 63.50 60.14 2gbl n PRO 494 Cb 0.35 -1.64 -0.09 0.00 -0.02 0.00 0.00 33.50 32.10 2gbl n PRO 494 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2gbl s THR 495 N -2.01 0.01 -0.38 3.45 2.01 -0.50 -4.95 115.64 113.28 2gbl s THR 495 Ca 0.59 -1.87 -0.38 0.00 0.31 0.00 0.00 61.69 60.33 2gbl s THR 495 Cb -0.10 -0.97 -0.14 0.00 0.01 0.00 0.00 72.50 71.30 2gbl s THR 495 CO 0.49 -0.92 2.10 -2.11 -0.69 0.00 0.00 174.62 173.49 2gbl n ARG 496 N 3.49 0.79 -3.68 4.92 1.85 -1.26 -3.25 116.66 119.52 2gbl n ARG 496 Ca 0.20 0.23 -0.37 0.00 -1.00 0.00 0.00 57.85 56.91 2gbl n ARG 496 Cb 0.45 -2.14 -0.11 0.00 -1.05 0.00 0.00 32.46 29.62 2gbl n ARG 496 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 2gbl s ILE 497 N 6.35 5.12 -2.56 8.89 -5.25 -1.00 -4.99 121.20 127.76 2gbl s ILE 497 Ca 1.11 0.10 0.28 0.00 -0.99 0.00 0.00 60.65 61.14 2gbl s ILE 497 Cb -1.07 -3.40 0.51 0.00 2.95 0.00 0.00 42.46 41.44 2gbl s ILE 497 CO 0.57 0.32 1.69 0.35 -1.79 0.00 0.00 174.94 176.07