#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1r s LEU 3 N 0.00 4.59 0.15 -2.67 1.43 -1.26 -4.93 118.68 116.00 3g1r s LEU 3 Ca 0.00 2.02 -0.03 0.00 -1.03 0.00 0.00 54.13 55.10 3g1r s LEU 3 Cb 0.00 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.57 3g1r s LEU 3 CO 0.00 0.03 0.12 -0.94 0.23 0.00 0.00 176.35 175.78 3g1r s SER 4 N -0.87 0.22 0.27 2.29 1.04 -0.39 -4.93 113.70 111.32 3g1r s SER 4 Ca 0.43 -1.18 -0.02 0.00 0.48 0.00 0.00 55.95 55.66 3g1r s SER 4 Cb -0.27 0.34 0.43 0.00 0.10 0.00 0.00 66.02 66.62 3g1r s SER 4 CO 0.34 -0.79 1.86 0.00 0.98 0.00 0.00 173.24 175.64 3g1r h ALA 5 N 2.75 1.39 0.00 5.32 0.00 -1.94 -2.30 119.26 124.47 3g1r h ALA 5 Ca -0.34 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 3g1r h ALA 5 Cb 1.21 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3g1r h ALA 5 CO 0.55 0.36 -0.33 0.00 0.00 0.00 0.00 179.25 179.83 3g1r h ALA 6 N 1.47 0.83 -2.10 0.00 0.00 -1.96 -3.43 119.26 114.07 3g1r h ALA 6 Ca 0.44 -0.17 -0.29 0.00 0.00 0.00 0.00 54.91 54.88 3g1r h ALA 6 Cb 0.25 -0.01 -0.32 0.00 0.00 0.00 0.00 17.79 17.71 3g1r h ALA 6 CO -0.20 0.23 -0.61 0.45 0.00 0.00 0.00 179.25 179.12 3g1r s SER 7 N -6.16 1.34 -0.12 0.00 0.15 -0.87 -5.00 113.70 103.05 3g1r s SER 7 Ca 0.05 -0.57 0.20 0.00 0.70 0.00 0.00 55.95 56.33 3g1r s SER 7 Cb 0.06 0.63 0.39 0.00 -1.71 0.00 0.00 66.02 65.39 3g1r s SER 7 CO 0.71 -0.37 1.17 0.00 1.20 0.00 0.00 173.24 175.95 3g1r n HIS 8 N 5.32 0.16 -3.24 3.44 -0.00 -1.22 -1.26 115.22 118.42 3g1r n HIS 8 Ca -0.02 -1.14 -0.38 0.00 -0.00 0.00 0.00 57.72 56.17 3g1r n HIS 8 Cb 0.47 0.11 -0.06 0.00 -0.00 0.00 0.00 29.99 30.52 3g1r n HIS 8 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 3g1r s ARG 9 N -1.17 4.21 0.12 -1.40 0.52 -1.26 -0.92 118.95 119.05 3g1r s ARG 9 Ca 0.24 0.76 0.11 0.00 -0.52 0.00 0.00 55.73 56.31 3g1r s ARG 9 Cb 0.32 -3.17 -0.04 0.00 0.52 0.00 0.00 34.95 32.58 3g1r s ARG 9 CO -0.10 0.59 -0.26 0.96 0.02 0.00 0.00 175.30 176.51 3g1r s ILE 10 N -1.19 2.18 0.37 1.52 -4.36 -0.07 -4.85 121.20 114.80 3g1r s ILE 10 Ca 0.32 -1.72 -0.28 0.00 -0.26 0.00 0.00 60.65 58.71 3g1r s ILE 10 Cb -0.19 -1.94 -0.10 0.00 1.25 0.00 0.00 42.46 41.49 3g1r s ILE 10 CO 0.20 0.08 1.35 -2.16 0.24 0.00 0.00 174.94 174.65 3g1r s PRO 11 N -2.02 4.16 0.22 0.37 0.04 -1.26 -0.96 135.00 135.55 3g1r s PRO 11 Ca 0.13 2.30 0.06 0.00 0.04 0.00 0.00 61.00 63.52 3g1r s PRO 11 Cb -0.10 -2.94 -0.04 0.00 0.04 0.00 0.00 34.50 31.46 3g1r s PRO 11 CO 0.06 -0.38 0.20 -0.51 0.04 0.00 0.00 177.00 176.41 3g1r s LEU 12 N -2.08 3.90 0.04 -3.56 1.43 0.19 -4.84 118.68 113.76 3g1r s LEU 12 Ca 0.52 -0.15 0.18 0.00 -1.03 0.00 0.00 54.13 53.65 3g1r s LEU 12 Cb -0.41 -2.46 0.76 0.00 0.03 0.00 0.00 46.19 44.11 3g1r s LEU 12 CO 0.55 -0.00 1.57 -1.54 0.23 0.00 0.00 176.35 177.15 3g1r n SER 13 N -0.92 0.11 -1.14 2.29 3.41 -1.26 -2.05 113.62 114.06 3g1r n SER 13 Ca -0.08 0.52 0.11 0.00 -0.26 0.00 0.00 58.87 59.16 3g1r n SER 13 Cb 0.57 -0.55 0.27 0.00 -0.26 0.00 0.00 64.21 64.24 3g1r n SER 13 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3g1r n ASP 14 N -1.61 3.31 0.00 4.04 5.68 -1.26 -4.93 116.55 121.78 3g1r n ASP 14 Ca 0.04 -1.98 0.00 0.00 -0.50 0.00 0.00 54.79 52.35 3g1r n ASP 14 Cb 0.21 -0.37 0.00 0.00 -1.14 0.00 0.00 41.12 39.82 3g1r n ASP 14 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3g1r n GLY 15 N 1.49 0.71 2.48 6.12 0.00 -0.87 -5.06 105.19 110.06 3g1r n GLY 15 Ca 0.21 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.05 3g1r n GLY 15 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3g1r n ASN 16 N 0.00 0.37 -3.98 1.61 3.02 -1.26 -4.87 115.26 110.15 3g1r n ASN 16 Ca 0.00 -1.47 -0.08 0.00 -0.03 0.00 0.00 54.58 53.00 3g1r n ASN 16 Cb 0.00 -0.56 -0.09 0.00 -0.61 0.00 0.00 39.78 38.52 3g1r n ASN 16 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3g1r s SER 17 N -3.92 0.32 -0.06 6.41 1.04 -1.26 -0.64 113.70 115.59 3g1r s SER 17 Ca 0.46 -0.83 0.01 0.00 0.48 0.00 0.00 55.95 56.07 3g1r s SER 17 Cb -0.02 0.26 0.02 0.00 0.10 0.00 0.00 66.02 66.38 3g1r s SER 17 CO 0.32 -0.65 -0.05 -0.51 0.98 0.00 0.00 173.24 173.33 3g1r s ILE 18 N -3.83 0.61 0.20 -1.02 2.07 -0.13 -4.89 121.20 114.21 3g1r s ILE 18 Ca 0.06 -0.14 -0.32 0.00 -1.41 0.00 0.00 60.65 58.84 3g1r s ILE 18 Cb 0.06 -0.65 -0.11 0.00 0.13 0.00 0.00 42.46 41.89 3g1r s ILE 18 CO -0.10 0.25 1.67 -2.84 -1.91 0.00 0.00 174.94 172.01 3g1r s PRO 19 N 1.10 4.15 0.24 3.50 0.02 -1.26 -0.89 135.00 141.87 3g1r s PRO 19 Ca -0.08 2.53 0.24 0.00 0.02 0.00 0.00 61.00 63.70 3g1r s PRO 19 Cb -0.14 -3.10 0.95 0.00 0.02 0.00 0.00 34.50 32.23 3g1r s PRO 19 CO -0.01 -0.70 1.72 1.51 -0.33 0.00 0.00 177.00 179.19 3g1r n ILE 20 N 3.92 0.79 -5.04 2.83 3.06 -0.10 -4.46 119.36 120.36 3g1r n ILE 20 Ca 0.15 0.16 -0.29 0.00 -2.50 0.00 0.00 62.75 60.27 3g1r n ILE 20 Cb 0.36 -1.08 -0.15 0.00 0.54 0.00 0.00 39.64 39.31 3g1r n ILE 20 CO 0.00 0.00 0.00 -0.51 -2.50 0.00 0.00 176.55 173.54 3g1r s ILE 21 N -3.28 1.87 0.15 9.51 2.07 -1.26 -0.79 121.20 129.47 3g1r s ILE 21 Ca 0.05 -1.10 -0.01 0.00 -1.41 0.00 0.00 60.65 58.18 3g1r s ILE 21 Cb 0.10 -1.57 -0.04 0.00 0.13 0.00 0.00 42.46 41.07 3g1r s ILE 21 CO 0.42 0.44 0.06 -0.83 -1.91 0.00 0.00 174.94 173.12 3g1r s GLY 22 N -0.77 1.09 -0.27 1.50 0.00 -0.02 -4.21 107.32 104.63 3g1r s GLY 22 Ca 0.09 -1.52 -0.18 0.00 0.00 0.00 0.00 44.72 43.11 3g1r s GLY 22 CO 0.00 -1.40 0.51 -2.27 0.00 0.00 0.00 173.10 169.94 3g1r s LEU 23 N -3.09 4.07 0.51 0.66 2.96 0.02 -3.22 118.68 120.60 3g1r s LEU 23 Ca 0.26 0.47 -0.19 0.00 -0.22 0.00 0.00 54.13 54.45 3g1r s LEU 23 Cb 0.07 -2.65 -0.07 0.00 0.50 0.00 0.00 46.19 44.04 3g1r s LEU 23 CO 0.03 -0.30 1.06 -0.83 -1.32 0.00 0.00 176.35 174.99 3g1r s GLY 24 N 1.57 2.48 -0.02 7.98 0.00 -0.35 -0.87 107.32 118.10 3g1r s GLY 24 Ca 0.21 0.62 0.03 0.00 0.00 0.00 0.00 44.72 45.57 3g1r s GLY 24 CO 0.09 0.95 0.83 -1.30 0.00 0.00 0.00 173.10 173.67 3g1r n THR 25 N -1.19 0.61 -2.42 0.90 -2.24 -0.89 -4.32 114.28 104.74 3g1r n THR 25 Ca 0.10 -0.66 -0.42 0.00 -2.27 0.00 0.00 64.05 60.80 3g1r n THR 25 Cb 0.52 0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 69.31 3g1r n THR 25 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3g1r s TYR 26 N -0.74 3.44 -0.08 4.78 5.04 -1.26 -4.98 117.35 123.55 3g1r s TYR 26 Ca 0.04 1.31 -0.05 0.00 -2.44 0.00 0.00 57.07 55.93 3g1r s TYR 26 Cb 0.04 -3.42 0.03 0.00 0.35 0.00 0.00 41.96 38.96 3g1r s TYR 26 CO 0.00 -1.26 0.20 0.45 -1.34 0.00 0.00 175.55 173.61 3g1r s SER 27 N 1.00 -0.20 -0.35 4.32 0.15 -1.26 -5.02 113.70 112.33 3g1r s SER 27 Ca 0.58 0.42 -0.39 0.00 0.70 0.00 0.00 55.95 57.27 3g1r s SER 27 Cb -0.30 0.35 -0.14 0.00 -1.71 0.00 0.00 66.02 64.22 3g1r s SER 27 CO 0.30 -0.12 2.01 1.21 1.20 0.00 0.00 173.24 177.84 3g1r n GLU 28 N 3.72 0.92 -0.09 5.44 2.13 -1.26 -4.83 120.64 126.67 3g1r n GLU 28 Ca -0.20 0.29 -0.09 0.00 0.66 0.00 0.00 57.16 57.82 3g1r n GLU 28 Cb 0.55 -2.16 -0.02 0.00 0.27 0.00 0.00 31.44 30.07 3g1r n GLU 28 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 3g1r h PRO 29 N 9.84 -0.28 0.00 5.31 0.11 -1.92 -2.24 132.00 142.82 3g1r h PRO 29 Ca -0.32 0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 3g1r h PRO 29 Cb 1.34 0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.51 3g1r h PRO 29 CO 1.01 -0.19 -0.17 1.57 -0.21 0.00 0.00 178.00 180.01 3g1r h LYS 30 N -0.30 0.00 -0.48 1.05 2.10 -2.01 -2.86 116.57 114.08 3g1r h LYS 30 Ca 0.15 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.80 3g1r h LYS 30 Cb 0.55 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.88 3g1r h LYS 30 CO -0.50 0.17 0.00 -1.13 -2.00 0.00 0.00 179.45 175.99 3g1r n SER 31 N -3.76 3.71 -4.19 7.07 3.41 -0.89 -4.92 113.62 114.04 3g1r n SER 31 Ca -0.02 -2.26 -0.33 0.00 -0.26 0.00 0.00 58.87 56.00 3g1r n SER 31 Cb 0.27 -0.41 -0.16 0.00 -0.26 0.00 0.00 64.21 63.66 3g1r n SER 31 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3g1r s THR 32 N -1.47 2.30 0.37 6.66 2.01 -0.94 -4.98 115.64 119.58 3g1r s THR 32 Ca 0.38 -0.88 -0.28 0.00 0.31 0.00 0.00 61.69 61.21 3g1r s THR 32 Cb 0.23 -1.95 -0.11 0.00 0.01 0.00 0.00 72.50 70.67 3g1r s THR 32 CO 0.20 0.53 1.43 -2.65 -0.69 0.00 0.00 174.62 173.45 3g1r n PRO 33 N 4.28 2.52 -1.76 4.92 -0.02 -1.26 -4.93 135.00 138.75 3g1r n PRO 33 Ca -0.20 0.89 -0.41 0.00 -2.02 0.00 0.00 63.50 61.75 3g1r n PRO 33 Cb 0.51 -2.58 -0.00 0.00 -0.02 0.00 0.00 33.50 31.41 3g1r n PRO 33 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3g1r n LYS 34 N 0.50 2.62 0.00 -0.52 4.76 -1.26 -2.29 118.16 121.96 3g1r n LYS 34 Ca 0.02 0.92 0.00 0.00 -2.87 0.00 0.00 58.31 56.38 3g1r n LYS 34 Cb 0.38 -2.64 0.00 0.00 -1.84 0.00 0.00 35.03 30.93 3g1r n LYS 34 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3g1r n GLY 35 N 0.75 1.89 0.31 0.72 0.00 -1.26 -4.91 105.19 102.69 3g1r n GLY 35 Ca 0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.00 3g1r n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1r h ALA 36 N 0.00 1.07 -0.20 4.61 0.00 -1.83 -1.16 119.26 121.76 3g1r h ALA 36 Ca 0.00 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 3g1r h ALA 36 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3g1r h ALA 36 CO 0.00 0.60 -0.05 0.00 0.00 0.00 0.00 179.25 179.81 3g1r h ALA 38 N 0.74 0.30 -0.80 0.00 0.00 -1.69 -0.63 119.26 117.18 3g1r h ALA 38 Ca 0.05 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3g1r h ALA 38 Cb 0.49 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 3g1r h ALA 38 CO 0.02 -0.28 0.50 1.15 0.00 0.00 0.00 179.25 180.64 3g1r h THR 39 N 0.26 1.08 -0.49 0.00 2.02 -1.18 -1.63 112.91 112.96 3g1r h THR 39 Ca 0.10 -0.32 -0.12 0.00 0.77 0.00 0.00 66.41 66.84 3g1r h THR 39 Cb 0.03 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.47 3g1r h THR 39 CO -0.07 0.17 -0.14 0.28 0.37 0.00 0.00 175.52 176.13 3g1r h SER 40 N 0.95 0.98 -0.54 4.18 0.02 -0.76 -0.98 113.55 117.39 3g1r h SER 40 Ca 0.34 -0.37 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 3g1r h SER 40 Cb 0.09 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 3g1r h SER 40 CO -0.14 1.12 0.18 0.58 -1.14 0.00 0.00 176.83 177.43 3g1r h VAL 41 N 0.82 1.23 -0.45 2.27 2.07 -0.83 0.12 116.25 121.48 3g1r h VAL 41 Ca 0.12 -0.78 0.02 0.00 0.82 0.00 0.00 66.70 66.88 3g1r h VAL 41 Cb 0.71 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 3g1r h VAL 41 CO 0.05 0.29 0.26 0.11 0.02 0.00 0.00 177.57 178.31 3g1r h LYS 42 N 0.75 0.52 -0.68 1.57 1.57 -1.13 -1.27 116.57 117.89 3g1r h LYS 42 Ca 0.18 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.86 3g1r h LYS 42 Cb 0.27 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 3g1r h LYS 42 CO -0.01 0.34 0.19 0.28 -0.57 0.00 0.00 179.45 179.69 3g1r h VAL 43 N 0.53 1.26 -0.39 0.50 2.07 -0.85 -1.02 116.25 118.36 3g1r h VAL 43 Ca 0.18 -0.91 0.03 0.00 0.82 0.00 0.00 66.70 66.82 3g1r h VAL 43 Cb 0.02 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 3g1r h VAL 43 CO -0.09 0.35 0.20 0.00 0.02 0.00 0.00 177.57 178.06 3g1r h ALA 44 N 1.09 0.48 -0.57 1.67 0.00 -0.50 0.75 119.26 122.18 3g1r h ALA 44 Ca 0.22 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 3g1r h ALA 44 Cb 0.33 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3g1r h ALA 44 CO -0.00 -0.15 0.05 0.82 0.00 0.00 0.00 179.25 179.96 3g1r h ILE 45 N 0.41 1.26 -0.99 0.00 2.04 -0.92 -0.31 117.51 119.00 3g1r h ILE 45 Ca 0.16 -1.05 0.07 0.00 1.00 0.00 0.00 64.86 65.04 3g1r h ILE 45 Cb 0.05 0.83 -0.07 0.00 -0.74 0.00 0.00 36.82 36.89 3g1r h ILE 45 CO -0.10 0.38 0.64 0.44 0.00 0.00 0.00 178.15 179.50 3g1r h ASP 46 N 0.86 1.01 0.43 1.72 3.32 -0.86 -2.54 116.42 120.36 3g1r h ASP 46 Ca 0.17 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.13 3g1r h ASP 46 Cb 0.48 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 3g1r h ASP 46 CO 0.02 0.63 -0.46 0.74 -1.72 0.00 0.00 179.24 178.46 3g1r h THR 47 N 1.14 1.33 0.00 0.35 2.02 -0.18 -3.47 112.91 114.11 3g1r h THR 47 Ca 0.44 -1.58 0.00 0.00 0.77 0.00 0.00 66.41 66.03 3g1r h THR 47 Cb 0.20 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 3g1r h THR 47 CO -0.18 0.46 0.00 0.61 0.37 0.00 0.00 175.52 176.77 3g1r n GLY 48 N -0.19 0.17 3.77 2.16 0.00 -0.61 -5.09 105.19 105.39 3g1r n GLY 48 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 3g1r n GLY 48 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g1r s TYR 49 N -0.84 2.90 -0.02 1.61 1.51 -0.22 -4.91 117.35 117.37 3g1r s TYR 49 Ca 0.00 1.35 0.03 0.00 -1.01 0.00 0.00 57.07 57.44 3g1r s TYR 49 Cb 0.00 -3.77 0.04 0.00 -0.11 0.00 0.00 41.96 38.12 3g1r s TYR 49 CO 0.00 -2.19 0.85 0.54 -1.11 0.00 0.00 175.55 173.64 3g1r n ARG 50 N 0.62 1.33 -4.13 -0.62 5.12 -1.26 -4.20 116.66 113.52 3g1r n ARG 50 Ca 0.01 -1.26 -0.21 0.00 -1.93 0.00 0.00 57.85 54.46 3g1r n ARG 50 Cb 0.41 -0.84 -0.16 0.00 -1.16 0.00 0.00 32.46 30.71 3g1r n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 3g1r s HIS 51 N -0.81 0.79 -0.08 -1.55 2.46 -1.26 -0.32 115.29 114.52 3g1r s HIS 51 Ca 0.05 -0.23 0.03 0.00 0.47 0.00 0.00 55.06 55.37 3g1r s HIS 51 Cb 0.04 -0.71 0.01 0.00 -0.13 0.00 0.00 32.58 31.79 3g1r s HIS 51 CO 0.00 -0.22 -0.17 0.42 -2.47 0.00 0.00 174.74 172.31 3g1r s ILE 52 N 1.04 1.53 -0.21 0.89 -1.09 -0.00 -0.80 121.20 122.55 3g1r s ILE 52 Ca -0.09 -0.70 -0.07 0.00 -2.23 0.00 0.00 60.65 57.56 3g1r s ILE 52 Cb -0.14 -1.36 -0.03 0.00 -1.58 0.00 0.00 42.46 39.35 3g1r s ILE 52 CO -0.01 0.44 0.05 -0.62 -1.23 0.00 0.00 174.94 173.57 3g1r s ASP 53 N 0.59 5.19 0.19 3.58 2.15 -0.05 -1.73 116.67 126.59 3g1r s ASP 53 Ca -0.15 -0.12 0.03 0.00 0.43 0.00 0.00 52.55 52.74 3g1r s ASP 53 Cb -0.16 -1.90 -0.01 0.00 -0.30 0.00 0.00 42.92 40.54 3g1r s ASP 53 CO 0.05 0.06 0.19 0.61 -0.17 0.00 0.00 175.17 175.91 3g1r n GLY 54 N 4.29 3.19 3.62 2.66 0.00 -0.38 -2.08 105.19 116.48 3g1r n GLY 54 Ca -0.16 -1.72 -0.12 0.00 0.00 0.00 0.00 46.02 44.01 3g1r n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1r s ALA 55 N -2.64 -1.88 0.33 4.61 0.00 -1.26 -4.03 121.76 116.89 3g1r s ALA 55 Ca 0.21 1.86 0.05 0.00 0.00 0.00 0.00 51.96 54.08 3g1r s ALA 55 Cb 0.01 -1.15 0.70 0.00 0.00 0.00 0.00 23.12 22.68 3g1r s ALA 55 CO 0.15 -0.29 1.88 -0.92 0.00 0.00 0.00 175.76 176.57 3g1r h TYR 56 N 4.24 0.93 0.00 0.00 3.20 -1.98 -1.02 116.97 122.35 3g1r h TYR 56 Ca -0.28 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.62 3g1r h TYR 56 Cb 1.17 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.14 3g1r h TYR 56 CO 0.35 0.39 0.00 0.44 -1.64 0.00 0.00 178.16 177.70 3g1r n ILE 57 N -4.56 0.44 0.60 1.81 -5.35 -1.26 -1.69 119.36 109.36 3g1r n ILE 57 Ca 0.16 0.11 0.09 0.00 -0.27 0.00 0.00 62.75 62.84 3g1r n ILE 57 Cb 0.37 -0.75 0.38 0.00 -1.74 0.00 0.00 39.64 37.91 3g1r n ILE 57 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3g1r n TYR 58 N -1.40 0.02 -0.96 4.28 4.01 -0.39 -4.89 117.16 117.84 3g1r n TYR 58 Ca 0.07 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 3g1r n TYR 58 Cb 0.22 -0.51 0.00 0.00 -0.31 0.00 0.00 39.34 38.73 3g1r n TYR 58 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3g1r n GLN 59 N -1.52 -0.76 -0.22 -0.72 6.02 -0.68 -4.77 117.38 114.72 3g1r n GLN 59 Ca 0.04 0.19 0.04 0.00 -0.01 0.00 0.00 57.00 57.27 3g1r n GLN 59 Cb 0.21 -3.84 0.06 0.00 1.02 0.00 0.00 30.24 27.69 3g1r n GLN 59 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3g1r n ASN 60 N -0.38 1.23 0.26 1.08 0.23 -1.26 -4.79 115.26 111.63 3g1r n ASN 60 Ca 0.00 -2.40 0.11 0.00 -0.53 0.00 0.00 54.58 51.76 3g1r n ASN 60 Cb 0.19 -0.27 0.72 0.00 -2.08 0.00 0.00 39.78 38.35 3g1r n ASN 60 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3g1r h GLU 61 N 0.00 0.00 -0.04 -3.83 4.81 -1.83 -0.36 114.58 113.32 3g1r h GLU 61 Ca 0.00 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 3g1r h GLU 61 Cb 1.11 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 3g1r h GLU 61 CO 0.00 0.10 -0.45 1.12 -0.73 0.00 0.00 179.01 179.05 3g1r h HIS 62 N 0.00 0.12 -0.34 0.92 2.07 -1.87 -1.85 115.15 114.20 3g1r h HIS 62 Ca -0.00 -0.03 -0.17 0.00 -2.85 0.00 0.00 60.37 57.31 3g1r h HIS 62 Cb 0.23 -0.03 -0.00 0.00 2.57 0.00 0.00 27.41 30.18 3g1r h HIS 62 CO 0.00 0.53 -0.46 0.93 -3.07 0.00 0.00 177.93 175.86 3g1r h GLU 63 N 0.08 0.91 -0.23 5.12 5.08 -1.43 -1.61 114.58 122.51 3g1r h GLU 63 Ca 0.00 -0.53 0.03 0.00 -1.00 0.00 0.00 59.36 57.87 3g1r h GLU 63 Cb 0.83 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.09 3g1r h GLU 63 CO 0.06 1.17 0.05 0.28 -1.00 0.00 0.00 179.01 179.57 3g1r h VAL 64 N 0.72 0.89 -0.53 3.13 2.07 -1.15 -1.63 116.25 119.75 3g1r h VAL 64 Ca 0.04 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3g1r h VAL 64 Cb 1.07 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 3g1r h VAL 64 CO 0.11 0.03 0.34 1.23 0.02 0.00 0.00 177.57 179.30 3g1r h GLY 65 N 0.14 0.75 0.46 2.17 0.00 -1.31 -1.47 103.07 103.80 3g1r h GLY 65 Ca 0.11 -0.29 0.08 0.00 0.00 0.00 0.00 47.33 47.23 3g1r h GLY 65 CO -0.14 0.28 0.24 -2.09 0.00 0.00 0.00 176.54 174.83 3g1r h GLU 66 N 0.72 0.43 -0.04 4.80 4.81 -1.02 0.72 114.58 124.99 3g1r h GLU 66 Ca 0.19 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 3g1r h GLU 66 Cb -0.06 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.22 3g1r h GLU 66 CO -0.04 0.28 -0.02 0.00 -0.73 0.00 0.00 179.01 178.50 3g1r h ALA 67 N 1.39 0.05 -0.34 2.92 0.00 -1.00 -1.21 119.26 121.07 3g1r h ALA 67 Ca 0.29 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3g1r h ALA 67 Cb 0.33 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3g1r h ALA 67 CO -0.28 -0.21 0.19 0.82 0.00 0.00 0.00 179.25 179.77 3g1r h ILE 68 N -0.32 1.02 -0.62 0.00 2.04 -1.11 -1.70 117.51 116.82 3g1r h ILE 68 Ca 0.01 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.68 3g1r h ILE 68 Cb 0.45 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 3g1r h ILE 68 CO 0.01 0.07 0.16 0.03 0.00 0.00 0.00 178.15 178.42 3g1r h ARG 69 N 0.39 0.96 -0.84 2.37 3.08 -0.82 -1.22 114.38 118.30 3g1r h ARG 69 Ca 0.14 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 3g1r h ARG 69 Cb 0.02 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 29.89 3g1r h ARG 69 CO -0.08 0.85 0.39 1.49 -1.07 0.00 0.00 179.97 181.56 3g1r h GLU 70 N 0.92 1.22 -0.03 0.04 4.81 -0.85 0.60 114.58 121.28 3g1r h GLU 70 Ca 0.20 -0.18 -0.14 0.00 -0.13 0.00 0.00 59.36 59.11 3g1r h GLU 70 Cb 0.32 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 3g1r h GLU 70 CO -0.00 0.94 -0.61 0.87 -0.73 0.00 0.00 179.01 179.48 3g1r h LYS 71 N 1.20 0.11 -0.21 1.92 1.79 -0.75 -2.17 116.57 118.46 3g1r h LYS 71 Ca 0.29 -0.07 -0.16 0.00 -2.18 0.00 0.00 60.65 58.53 3g1r h LYS 71 Cb 0.13 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 3g1r h LYS 71 CO -0.03 0.68 -0.48 0.82 -1.08 0.00 0.00 179.45 179.36 3g1r h ILE 72 N 0.08 1.31 -0.73 1.86 2.04 -0.90 -1.18 117.51 119.99 3g1r h ILE 72 Ca -0.01 -1.70 -0.02 0.00 1.00 0.00 0.00 64.86 64.13 3g1r h ILE 72 Cb 1.10 1.84 -0.04 0.00 -0.74 0.00 0.00 36.82 38.99 3g1r h ILE 72 CO 0.09 0.54 0.39 0.00 0.00 0.00 0.00 178.15 179.16 3g1r h ALA 73 N 0.60 1.31 -0.00 1.87 0.00 -0.67 -2.09 119.26 120.28 3g1r h ALA 73 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3g1r h ALA 73 Cb 1.09 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3g1r h ALA 73 CO 0.11 0.56 -0.13 -0.85 0.00 0.00 0.00 179.25 178.93 3g1r n GLU 74 N -4.35 0.48 -0.66 0.00 0.28 -0.83 -4.91 120.64 110.64 3g1r n GLU 74 Ca 0.07 -0.15 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 3g1r n GLU 74 Cb 0.11 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.48 3g1r n GLU 74 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3g1r n GLY 75 N 1.34 0.63 0.26 -1.84 0.00 -0.79 -4.96 105.19 99.83 3g1r n GLY 75 Ca 0.12 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.65 3g1r n GLY 75 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3g1r h LYS 76 N 0.93 0.90 -4.25 1.61 1.63 -1.44 -3.45 116.57 112.50 3g1r h LYS 76 Ca 0.00 -0.33 -0.13 0.00 -0.85 0.00 0.00 60.65 59.34 3g1r h LYS 76 Cb 0.00 -0.06 -0.15 0.00 -0.60 0.00 0.00 32.23 31.42 3g1r h LYS 76 CO 0.00 0.98 -0.64 0.14 -3.45 0.00 0.00 179.45 176.48 3g1r s VAL 77 N -4.86 0.18 0.37 2.00 -7.23 -1.15 -5.04 120.40 104.66 3g1r s VAL 77 Ca -0.12 -1.78 0.01 0.00 -1.81 0.00 0.00 61.98 58.28 3g1r s VAL 77 Cb 0.12 -1.66 -0.02 0.00 0.56 0.00 0.00 36.38 35.37 3g1r s VAL 77 CO 0.84 -0.80 0.57 -0.13 -0.31 0.00 0.00 175.10 175.26 3g1r s ARG 78 N -3.95 3.37 0.27 4.82 0.52 -1.26 -4.14 118.95 118.57 3g1r s ARG 78 Ca 0.12 -0.42 -0.01 0.00 -0.52 0.00 0.00 55.73 54.90 3g1r s ARG 78 Cb 0.07 -2.66 0.58 0.00 0.52 0.00 0.00 34.95 33.47 3g1r s ARG 78 CO -0.06 0.06 1.72 -0.09 0.02 0.00 0.00 175.30 176.94 3g1r h ARG 79 N 0.69 0.42 0.00 3.54 9.65 -1.94 -0.99 114.38 125.75 3g1r h ARG 79 Ca -0.49 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.37 3g1r h ARG 79 Cb 1.23 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.71 3g1r h ARG 79 CO 0.60 0.28 0.00 1.05 2.80 0.00 0.00 179.97 184.70 3g1r h GLU 80 N 0.43 0.00 0.00 0.20 4.11 -2.04 -2.09 114.58 115.19 3g1r h GLU 80 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.91 3g1r h GLU 80 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 3g1r h GLU 80 CO -0.46 0.00 -0.18 -0.44 0.07 0.00 0.00 179.01 178.00 3g1r h ASP 81 N 0.00 0.00 -3.19 3.06 3.32 -1.57 -3.45 116.42 114.59 3g1r h ASP 81 Ca 0.00 -0.05 -0.66 0.00 0.02 0.00 0.00 57.03 56.34 3g1r h ASP 81 Cb 0.23 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.64 3g1r h ASP 81 CO 0.00 0.02 -0.59 -0.63 -1.72 0.00 0.00 179.24 176.33 3g1r s ILE 82 N -3.14 4.60 -0.30 0.35 -1.09 -0.79 -4.81 121.20 116.02 3g1r s ILE 82 Ca 0.09 -0.13 -0.02 0.00 -2.23 0.00 0.00 60.65 58.36 3g1r s ILE 82 Cb 0.11 -2.98 0.05 0.00 -1.58 0.00 0.00 42.46 38.06 3g1r s ILE 82 CO 0.64 0.57 -0.01 0.12 -1.23 0.00 0.00 174.94 175.04 3g1r s PHE 83 N -0.54 3.27 -0.16 3.97 2.19 0.57 -4.91 117.98 122.36 3g1r s PHE 83 Ca 0.10 -1.90 -0.04 0.00 0.33 0.00 0.00 56.93 55.42 3g1r s PHE 83 Cb -0.12 -2.10 -0.03 0.00 -1.31 0.00 0.00 43.02 39.46 3g1r s PHE 83 CO 0.02 -0.81 -0.01 -0.47 1.83 0.00 0.00 175.22 175.78 3g1r s TYR 84 N 1.25 3.08 -0.18 10.12 5.04 -1.26 -0.82 117.35 134.57 3g1r s TYR 84 Ca -0.05 -0.20 -0.04 0.00 -2.44 0.00 0.00 57.07 54.33 3g1r s TYR 84 Cb -0.20 -1.98 -0.02 0.00 0.35 0.00 0.00 41.96 40.11 3g1r s TYR 84 CO -0.01 0.02 -0.02 0.00 -1.34 0.00 0.00 175.55 174.20 3g1r s GLY 86 N 0.74 2.47 -0.00 0.00 0.00 -0.30 -1.25 107.32 108.98 3g1r s GLY 86 Ca -0.01 -1.81 -0.00 0.00 0.00 0.00 0.00 44.72 42.90 3g1r s GLY 86 CO 0.02 -1.99 0.01 0.54 0.00 0.00 0.00 173.10 171.68 3g1r s LYS 87 N -3.91 0.02 -0.41 2.90 1.02 -1.26 -1.78 119.74 116.33 3g1r s LYS 87 Ca 0.34 -0.01 -0.19 0.00 0.02 0.00 0.00 55.97 56.13 3g1r s LYS 87 Cb 0.04 0.01 0.01 0.00 -0.52 0.00 0.00 37.83 37.37 3g1r s LYS 87 CO 0.19 -0.00 0.56 -1.17 -0.92 0.00 0.00 175.35 174.00 3g1r s LEU 88 N -0.06 4.53 0.73 3.17 2.96 0.91 -4.48 118.68 126.45 3g1r s LEU 88 Ca -0.01 -0.31 -0.11 0.00 -0.22 0.00 0.00 54.13 53.48 3g1r s LEU 88 Cb -0.00 -2.61 0.03 0.00 0.50 0.00 0.00 46.19 44.10 3g1r s LEU 88 CO -0.00 -0.64 1.08 0.86 -1.32 0.00 0.00 176.35 176.32 3g1r s TRP 89 N 2.54 3.06 0.43 5.38 -0.00 -1.26 -1.32 118.94 127.76 3g1r s TRP 89 Ca 0.19 1.25 0.20 0.00 -0.00 0.00 0.00 56.10 57.74 3g1r s TRP 89 Cb -0.15 -2.99 1.15 0.00 -0.00 0.00 0.00 33.47 31.48 3g1r s TRP 89 CO 0.16 -1.41 1.82 0.00 -0.00 0.00 0.00 176.95 177.53 3g1r h ALA 90 N -0.83 2.32 0.00 5.86 0.00 -1.86 -0.63 119.26 124.11 3g1r h ALA 90 Ca -0.45 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3g1r h ALA 90 Cb 1.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3g1r h ALA 90 CO 0.59 -0.65 0.00 0.25 0.00 0.00 0.00 179.25 179.44 3g1r n THR 91 N -4.51 0.00 -1.91 0.00 -2.24 -1.26 -0.94 114.28 103.42 3g1r n THR 91 Ca 0.22 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 62.03 3g1r n THR 91 Cb 0.82 -0.40 0.14 0.00 -2.10 0.00 0.00 70.33 68.79 3g1r n THR 91 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3g1r n ASN 92 N -0.89 1.78 0.03 3.42 3.02 -0.24 -4.12 115.26 118.26 3g1r n ASN 92 Ca 0.19 -3.34 0.11 0.00 -0.03 0.00 0.00 54.58 51.51 3g1r n ASN 92 Cb 0.09 -0.45 -0.00 0.00 -0.61 0.00 0.00 39.78 38.80 3g1r n ASN 92 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3g1r n HIS 93 N -0.65 0.34 -1.69 3.10 8.25 -1.24 -4.22 115.22 119.11 3g1r n HIS 93 Ca 0.17 0.10 -0.44 0.00 -0.26 0.00 0.00 57.72 57.29 3g1r n HIS 93 Cb 0.84 -0.52 -0.04 0.00 1.12 0.00 0.00 29.99 31.39 3g1r n HIS 93 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3g1r n VAL 94 N -2.10 0.16 -0.29 1.59 0.31 -1.26 -4.52 118.33 112.21 3g1r n VAL 94 Ca 0.01 -0.03 0.12 0.00 -0.01 0.00 0.00 64.34 64.43 3g1r n VAL 94 Cb 0.47 -1.87 0.28 0.00 -0.91 0.00 0.00 33.84 31.80 3g1r n VAL 94 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3g1r h PRO 95 N 7.23 0.33 0.00 5.55 0.11 -1.89 0.31 132.00 143.64 3g1r h PRO 95 Ca -0.45 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 3g1r h PRO 95 Cb 1.23 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 3g1r h PRO 95 CO 0.93 0.22 -0.02 0.93 -0.21 0.00 0.00 178.00 179.85 3g1r h GLU 96 N 0.34 0.00 0.00 1.05 3.07 -1.96 -1.91 114.58 115.17 3g1r h GLU 96 Ca 0.53 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 3g1r h GLU 96 Cb 1.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.92 3g1r h GLU 96 CO -0.55 0.02 -0.63 0.52 -1.40 0.00 0.00 179.01 176.97 3g1r h MET 97 N 0.00 0.00 0.74 2.33 2.86 -0.68 -3.41 114.93 116.77 3g1r h MET 97 Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 3g1r h MET 97 Cb 0.14 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.81 3g1r h MET 97 CO 0.00 0.00 -0.36 0.28 1.06 0.00 0.00 176.91 177.90 3g1r h VAL 98 N 0.00 0.23 -0.47 -2.22 2.07 -1.25 -0.90 116.25 113.71 3g1r h VAL 98 Ca 0.00 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.43 3g1r h VAL 98 Cb 0.78 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 3g1r h VAL 98 CO 0.00 0.01 0.29 -0.09 0.02 0.00 0.00 177.57 177.80 3g1r h ARG 99 N -1.07 0.63 -0.10 1.57 2.43 -1.79 -1.18 114.38 114.87 3g1r h ARG 99 Ca -0.10 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 3g1r h ARG 99 Cb 0.78 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 3g1r h ARG 99 CO 0.17 0.45 0.06 -1.35 -1.51 0.00 0.00 179.97 177.79 3g1r h PRO 100 N 0.63 0.13 -0.22 0.20 0.11 -1.77 0.12 132.00 131.19 3g1r h PRO 100 Ca 0.17 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.15 3g1r h PRO 100 Cb -0.03 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.05 3g1r h PRO 100 CO -0.03 0.08 -0.32 1.15 -0.21 0.00 0.00 178.00 178.67 3g1r h THR 101 N 0.13 1.32 -0.55 -1.15 2.02 -0.45 -1.34 112.91 112.90 3g1r h THR 101 Ca 0.04 -1.53 -0.03 0.00 0.77 0.00 0.00 66.41 65.66 3g1r h THR 101 Cb -0.01 1.77 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 3g1r h THR 101 CO -0.01 0.48 0.23 0.25 0.37 0.00 0.00 175.52 176.84 3g1r h LEU 102 N 0.30 0.74 -1.18 2.58 5.85 -0.82 -2.55 115.31 120.24 3g1r h LEU 102 Ca 0.02 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.62 3g1r h LEU 102 Cb 0.91 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 3g1r h LEU 102 CO 0.08 0.69 0.57 -0.33 -0.34 0.00 0.00 178.44 179.10 3g1r h GLU 103 N 0.74 1.04 -0.32 1.25 5.08 -0.67 -0.46 114.58 121.23 3g1r h GLU 103 Ca 0.18 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3g1r h GLU 103 Cb 0.17 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3g1r h GLU 103 CO -0.02 0.69 0.19 -0.09 -1.00 0.00 0.00 179.01 178.78 3g1r h ARG 104 N 1.07 0.38 -0.77 2.33 2.43 -0.94 -1.06 114.38 117.82 3g1r h ARG 104 Ca 0.34 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.45 3g1r h ARG 104 Cb 0.04 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 3g1r h ARG 104 CO -0.10 0.25 0.32 1.15 -1.51 0.00 0.00 179.97 180.08 3g1r h THR 105 N 0.39 1.25 -0.72 0.20 2.02 -0.91 0.11 112.91 115.25 3g1r h THR 105 Ca 0.12 -0.78 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 3g1r h THR 105 Cb -0.01 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 66.68 3g1r h THR 105 CO -0.05 0.32 0.39 -0.07 0.37 0.00 0.00 175.52 176.48 3g1r h LEU 106 N 1.12 0.91 -0.86 2.58 3.38 -0.84 -0.30 115.31 121.29 3g1r h LEU 106 Ca 0.26 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 3g1r h LEU 106 Cb 0.19 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3g1r h LEU 106 CO -0.02 0.75 -0.23 0.03 0.09 0.00 0.00 178.44 179.06 3g1r h ARG 107 N 1.00 0.59 -0.23 1.13 3.08 -0.60 0.24 114.38 119.58 3g1r h ARG 107 Ca 0.25 -0.22 -0.09 0.00 0.07 0.00 0.00 59.98 59.99 3g1r h ARG 107 Cb 0.05 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 3g1r h ARG 107 CO -0.04 0.77 -0.21 0.28 -1.07 0.00 0.00 179.97 179.70 3g1r h VAL 108 N 0.52 1.32 0.00 2.04 2.07 -0.45 -2.81 116.25 118.93 3g1r h VAL 108 Ca 0.08 -1.37 -0.07 0.00 0.82 0.00 0.00 66.70 66.16 3g1r h VAL 108 Cb 0.68 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 3g1r h VAL 108 CO 0.05 0.42 -0.31 -0.07 0.02 0.00 0.00 177.57 177.68 3g1r h LEU 109 N 0.26 0.00 -1.22 2.57 3.38 -1.01 -3.40 115.31 115.89 3g1r h LEU 109 Ca 0.04 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.65 3g1r h LEU 109 Cb 0.76 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.66 3g1r h LEU 109 CO 0.05 0.31 -0.71 0.00 0.09 0.00 0.00 178.44 178.19 3g1r n GLN 110 N -3.64 -7.29 -4.38 1.13 6.02 0.76 -4.56 117.38 105.43 3g1r n GLN 110 Ca -0.01 0.83 -0.21 0.00 -0.01 0.00 0.00 57.00 57.60 3g1r n GLN 110 Cb 0.43 -5.84 -0.10 0.00 1.02 0.00 0.00 30.24 25.75 3g1r n GLN 110 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3g1r s LEU 111 N -6.81 2.53 0.27 1.08 1.43 -0.68 -5.03 118.68 111.47 3g1r s LEU 111 Ca 0.32 -0.98 0.15 0.00 -1.03 0.00 0.00 54.13 52.58 3g1r s LEU 111 Cb -0.14 -0.84 0.06 0.00 0.03 0.00 0.00 46.19 45.30 3g1r s LEU 111 CO 0.72 -0.07 1.44 0.44 0.23 0.00 0.00 176.35 179.11 3g1r h ASP 112 N 2.68 0.00 -5.01 2.29 3.32 -1.96 -3.42 116.42 114.32 3g1r h ASP 112 Ca -0.40 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.64 3g1r h ASP 112 Cb 1.23 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.66 3g1r h ASP 112 CO 0.58 0.53 0.19 -0.72 -1.72 0.00 0.00 179.24 178.10 3g1r s TYR 113 N -2.96 -0.48 0.17 4.55 1.13 -1.26 -4.70 117.35 113.80 3g1r s TYR 113 Ca 0.04 0.24 0.06 0.00 -1.41 0.00 0.00 57.07 56.00 3g1r s TYR 113 Cb 0.08 0.55 -0.04 0.00 -1.10 0.00 0.00 41.96 41.44 3g1r s TYR 113 CO 0.75 -0.87 0.07 0.14 -2.51 0.00 0.00 175.55 173.13 3g1r s VAL 114 N -3.77 4.09 0.12 -3.49 -7.23 -0.82 -4.98 120.40 104.31 3g1r s VAL 114 Ca 0.02 -1.27 -0.06 0.00 -1.81 0.00 0.00 61.98 58.86 3g1r s VAL 114 Cb -0.01 -3.07 -0.20 0.00 0.56 0.00 0.00 36.38 33.66 3g1r s VAL 114 CO -0.11 -0.12 1.28 0.44 -0.31 0.00 0.00 175.10 176.28 3g1r h ASP 115 N 2.53 0.59 -3.54 4.85 3.32 -1.62 -2.10 116.42 120.44 3g1r h ASP 115 Ca -0.47 -0.48 -0.26 0.00 0.02 0.00 0.00 57.03 55.84 3g1r h ASP 115 Cb 1.20 -0.18 -0.32 0.00 0.22 0.00 0.00 39.33 40.26 3g1r h ASP 115 CO 0.61 1.28 -0.66 -0.22 -1.72 0.00 0.00 179.24 178.52 3g1r s LEU 116 N -7.75 1.11 -0.09 1.55 2.96 -0.85 -0.99 118.68 114.61 3g1r s LEU 116 Ca -0.06 0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.02 3g1r s LEU 116 Cb 0.08 0.15 0.01 0.00 0.50 0.00 0.00 46.19 46.94 3g1r s LEU 116 CO 0.88 -0.11 -0.13 -0.47 -1.32 0.00 0.00 176.35 175.19 3g1r s TYR 117 N 0.87 1.73 0.06 5.38 5.04 -0.74 -1.15 117.35 128.54 3g1r s TYR 117 Ca -0.07 -0.75 0.06 0.00 -2.44 0.00 0.00 57.07 53.87 3g1r s TYR 117 Cb -0.10 -1.27 -0.03 0.00 0.35 0.00 0.00 41.96 40.92 3g1r s TYR 117 CO -0.03 -0.40 -0.16 0.96 -1.34 0.00 0.00 175.55 174.57 3g1r s ILE 118 N 0.92 1.31 -0.14 3.14 -4.36 -0.73 -1.89 121.20 119.44 3g1r s ILE 118 Ca -0.09 -1.20 -0.29 0.00 -0.26 0.00 0.00 60.65 58.81 3g1r s ILE 118 Cb -0.15 -1.19 -0.04 0.00 1.25 0.00 0.00 42.46 42.33 3g1r s ILE 118 CO 0.00 -0.03 1.63 -0.63 0.24 0.00 0.00 174.94 176.15 3g1r s ILE 119 N -0.99 3.66 0.11 8.37 1.01 -0.90 -0.06 121.20 132.40 3g1r s ILE 119 Ca 0.03 0.77 -0.14 0.00 0.00 0.00 0.00 60.65 61.31 3g1r s ILE 119 Cb -0.09 -3.59 -0.05 0.00 0.01 0.00 0.00 42.46 38.74 3g1r s ILE 119 CO 0.02 -0.17 1.48 -0.08 0.00 0.00 0.00 174.94 176.20 3g1r h GLU 120 N 10.16 0.74 -3.90 2.79 4.81 -1.47 -0.02 114.58 127.68 3g1r h GLU 120 Ca -0.36 -0.33 -0.14 0.00 -0.13 0.00 0.00 59.36 58.40 3g1r h GLU 120 Cb 1.16 -0.02 -0.19 0.00 0.63 0.00 0.00 28.75 30.34 3g1r h GLU 120 CO 0.98 0.94 -0.61 0.14 -0.73 0.00 0.00 179.01 179.72 3g1r s VAL 121 N -4.61 0.13 -1.30 0.32 -7.23 -1.25 -4.34 120.40 102.12 3g1r s VAL 121 Ca -0.12 -1.08 0.18 0.00 -1.81 0.00 0.00 61.98 59.15 3g1r s VAL 121 Cb 0.10 -0.69 0.27 0.00 0.56 0.00 0.00 36.38 36.61 3g1r s VAL 121 CO 0.82 -0.60 1.57 -0.81 -0.31 0.00 0.00 175.10 175.77 3g1r n PRO 122 N 1.06 0.18 -3.17 4.82 -0.04 -1.26 -4.78 135.00 131.82 3g1r n PRO 122 Ca -0.21 0.14 -0.39 0.00 -0.04 0.00 0.00 63.50 63.00 3g1r n PRO 122 Cb 0.57 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.48 3g1r n PRO 122 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3g1r s MET 123 N -2.70 4.35 -0.10 0.54 -1.94 -1.26 -4.85 119.30 113.34 3g1r s MET 123 Ca 0.15 0.78 -0.13 0.00 -1.71 0.00 0.00 55.69 54.77 3g1r s MET 123 Cb 0.12 -3.35 -0.05 0.00 2.01 0.00 0.00 34.83 33.56 3g1r s MET 123 CO 0.30 0.34 0.32 0.00 -0.01 0.00 0.00 175.02 175.96 3g1r s ALA 124 N -0.10 3.67 0.32 3.03 0.00 -1.26 -4.40 121.76 123.01 3g1r s ALA 124 Ca 0.32 -0.39 0.09 0.00 0.00 0.00 0.00 51.96 51.98 3g1r s ALA 124 Cb -0.18 -2.33 -0.05 0.00 0.00 0.00 0.00 23.12 20.56 3g1r s ALA 124 CO 0.18 0.31 0.06 -0.06 0.00 0.00 0.00 175.76 176.25 3g1r s PHE 125 N -0.32 2.66 -0.05 0.00 2.99 -0.12 -1.63 117.98 121.51 3g1r s PHE 125 Ca 0.19 -0.35 -0.34 0.00 0.00 0.00 0.00 56.93 56.44 3g1r s PHE 125 Cb -0.14 -1.45 -0.12 0.00 0.00 0.00 0.00 43.02 41.31 3g1r s PHE 125 CO 0.08 0.47 1.87 1.17 -0.00 0.00 0.00 175.22 178.81 3g1r n LYS 126 N -1.01 2.27 -1.65 0.44 4.81 -0.59 -4.25 118.16 118.17 3g1r n LYS 126 Ca -0.04 0.83 -0.38 0.00 -0.87 0.00 0.00 58.31 57.85 3g1r n LYS 126 Cb 0.61 -2.68 0.05 0.00 0.02 0.00 0.00 35.03 33.02 3g1r n LYS 126 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 3g1r n PRO 127 N 6.50 1.08 -2.56 1.64 -0.02 -1.26 -4.79 135.00 135.59 3g1r n PRO 127 Ca 0.22 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 3g1r n PRO 127 Cb 0.31 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 3g1r n PRO 127 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g1r n GLY 128 N 1.15 -0.22 0.12 -1.23 0.00 -1.26 -4.96 105.19 98.78 3g1r n GLY 128 Ca 0.13 -1.43 0.12 0.00 0.00 0.00 0.00 46.02 44.84 3g1r n GLY 128 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g1r h ASP 129 N 0.00 0.00 -3.54 1.61 3.45 -1.98 -3.44 116.42 112.52 3g1r h ASP 129 Ca 0.00 -0.05 -0.62 0.00 0.43 0.00 0.00 57.03 56.80 3g1r h ASP 129 Cb 0.00 0.00 -0.12 0.00 -0.56 0.00 0.00 39.33 38.65 3g1r h ASP 129 CO 0.00 0.02 0.06 -1.61 -1.57 0.00 0.00 179.24 176.15 3g1r s GLU 130 N -3.30 4.06 0.57 3.56 0.41 -1.26 -4.93 118.70 117.80 3g1r s GLU 130 Ca 0.02 0.39 0.35 0.00 -0.41 0.00 0.00 54.97 55.32 3g1r s GLU 130 Cb 0.10 -3.66 1.65 0.00 -1.78 0.00 0.00 34.13 30.44 3g1r s GLU 130 CO 0.76 -0.40 2.10 -0.84 -0.49 0.00 0.00 175.26 176.39 3g1r h ILE 131 N 5.42 0.16 -3.05 -1.63 3.07 -1.95 -3.32 117.51 116.22 3g1r h ILE 131 Ca -0.28 -0.42 -0.62 0.00 1.55 0.00 0.00 64.86 65.10 3g1r h ILE 131 Cb 1.13 1.35 -0.41 0.00 -0.27 0.00 0.00 36.82 38.63 3g1r h ILE 131 CO 0.75 0.04 -0.68 -0.31 -1.05 0.00 0.00 178.15 176.89 3g1r s TYR 132 N -3.91 2.73 -0.42 0.16 1.51 -1.26 -4.78 117.35 111.38 3g1r s TYR 132 Ca -0.01 -2.92 -0.28 0.00 -1.01 0.00 0.00 57.07 52.85 3g1r s TYR 132 Cb 0.11 -2.29 -0.02 0.00 -0.11 0.00 0.00 41.96 39.65 3g1r s TYR 132 CO 0.52 -0.69 1.84 -2.14 -1.11 0.00 0.00 175.55 173.97 3g1r s PRO 133 N -0.47 3.08 -0.01 -1.71 0.02 -1.25 -4.98 135.00 129.68 3g1r s PRO 133 Ca 0.22 1.20 0.03 0.00 0.02 0.00 0.00 61.00 62.47 3g1r s PRO 133 Cb -0.15 -4.27 -0.01 0.00 0.02 0.00 0.00 34.50 30.10 3g1r s PRO 133 CO -0.08 -2.16 -0.11 1.03 -0.33 0.00 0.00 177.00 175.35 3g1r s ARG 134 N 6.15 0.95 0.00 5.54 0.52 -1.26 0.14 118.95 131.00 3g1r s ARG 134 Ca 0.77 -0.38 0.00 0.00 -0.52 0.00 0.00 55.73 55.60 3g1r s ARG 134 Cb -0.19 -0.90 0.00 0.00 0.52 0.00 0.00 34.95 34.38 3g1r s ARG 134 CO 0.30 0.20 0.00 -0.40 0.02 0.00 0.00 175.30 175.42 3g1r n ASP 135 N 2.95 0.00 -0.18 0.23 5.68 0.06 -4.89 116.55 120.40 3g1r n ASP 135 Ca -0.15 -0.30 -0.04 0.00 -0.50 0.00 0.00 54.79 53.79 3g1r n ASP 135 Cb 0.56 0.00 0.14 0.00 -1.14 0.00 0.00 41.12 40.67 3g1r n ASP 135 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3g1r h GLU 136 N 0.00 0.95 -0.92 0.11 4.11 -2.02 -2.67 114.58 114.15 3g1r h GLU 136 Ca 0.00 -0.20 -0.01 0.00 0.07 0.00 0.00 59.36 59.21 3g1r h GLU 136 Cb 0.00 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3g1r h GLU 136 CO 0.00 0.84 0.02 0.09 0.07 0.00 0.00 179.01 180.03 3g1r n ASN 137 N -4.26 2.19 0.00 3.06 3.02 -1.26 -4.81 115.26 113.21 3g1r n ASN 137 Ca 0.05 -2.23 0.00 0.00 -0.03 0.00 0.00 54.58 52.37 3g1r n ASN 137 Cb 0.23 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 3g1r n ASN 137 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3g1r n GLY 138 N 0.14 0.21 3.77 7.41 0.00 -1.00 -4.95 105.19 110.77 3g1r n GLY 138 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 3g1r n GLY 138 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g1r s LYS 139 N -1.10 4.06 -0.04 1.61 2.20 -1.26 -4.72 119.74 120.49 3g1r s LYS 139 Ca 0.00 1.95 -0.26 0.00 -0.36 0.00 0.00 55.97 57.30 3g1r s LYS 139 Cb 0.00 -2.74 -0.03 0.00 -1.51 0.00 0.00 37.83 33.55 3g1r s LYS 139 CO 0.00 -0.35 0.82 -1.58 -0.36 0.00 0.00 175.35 173.89 3g1r s TRP 140 N -1.34 3.61 -0.58 4.03 0.52 -1.26 -0.76 118.94 123.15 3g1r s TRP 140 Ca 0.56 1.44 -0.20 0.00 0.02 0.00 0.00 56.10 57.92 3g1r s TRP 140 Cb -0.33 -2.94 0.09 0.00 -1.15 0.00 0.00 33.47 29.13 3g1r s TRP 140 CO 0.42 0.04 0.74 -0.51 0.02 0.00 0.00 176.95 177.66 3g1r s LEU 141 N 0.92 5.09 0.00 2.99 1.43 0.12 -4.95 118.68 124.28 3g1r s LEU 141 Ca 0.44 -1.21 -0.09 0.00 -1.03 0.00 0.00 54.13 52.24 3g1r s LEU 141 Cb -0.19 -2.37 0.16 0.00 0.03 0.00 0.00 46.19 43.81 3g1r s LEU 141 CO 0.22 -1.12 0.96 -1.22 0.23 0.00 0.00 176.35 175.41 3g1r n TYR 142 N 6.56 -3.69 -3.75 0.29 0.53 -1.26 -1.55 117.16 114.29 3g1r n TYR 142 Ca -0.08 -1.06 -0.14 0.00 -1.02 0.00 0.00 57.90 55.61 3g1r n TYR 142 Cb 0.44 -0.73 -0.09 0.00 -1.03 0.00 0.00 39.34 37.93 3g1r n TYR 142 CO 0.00 0.00 0.00 -1.58 -1.02 0.00 0.00 176.86 174.26 3g1r s HIS 143 N -2.98 -0.22 -0.09 -0.72 2.46 -0.64 -3.61 115.29 109.49 3g1r s HIS 143 Ca 0.57 0.36 -0.30 0.00 0.47 0.00 0.00 55.06 56.16 3g1r s HIS 143 Cb -0.02 0.12 -0.04 0.00 -0.13 0.00 0.00 32.58 32.51 3g1r s HIS 143 CO 0.39 -0.39 1.46 0.21 -2.47 0.00 0.00 174.74 173.94 3g1r s LYS 144 N -1.23 4.22 0.29 2.88 2.20 -1.26 -4.23 119.74 122.61 3g1r s LYS 144 Ca -0.13 1.95 -0.29 0.00 -0.36 0.00 0.00 55.97 57.14 3g1r s LYS 144 Cb -0.05 -3.83 -0.09 0.00 -1.51 0.00 0.00 37.83 32.34 3g1r s LYS 144 CO 0.04 -0.75 1.08 -1.12 -0.36 0.00 0.00 175.35 174.24 3g1r s SER 145 N 2.58 7.23 -0.41 1.43 0.01 -1.26 -4.90 113.70 118.38 3g1r s SER 145 Ca 0.65 2.21 0.02 0.00 1.31 0.00 0.00 55.95 60.14 3g1r s SER 145 Cb -0.28 -2.62 0.15 0.00 0.21 0.00 0.00 66.02 63.48 3g1r s SER 145 CO 0.23 -0.16 0.27 0.21 0.41 0.00 0.00 173.24 174.20 3g1r s ASN 146 N -0.99 2.71 0.19 2.44 3.84 -1.26 -5.03 114.94 116.83 3g1r s ASN 146 Ca 0.46 -2.65 -0.10 0.00 0.21 0.00 0.00 52.86 50.78 3g1r s ASN 146 Cb -0.30 -0.60 0.11 0.00 -0.55 0.00 0.00 41.25 39.91 3g1r s ASN 146 CO 0.39 -0.24 1.75 -0.07 -2.79 0.00 0.00 177.10 176.13 3g1r h LEU 147 N 6.43 0.94 -0.97 3.21 3.38 -1.95 -1.48 115.31 124.87 3g1r h LEU 147 Ca 0.12 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3g1r h LEU 147 Cb 0.93 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 3g1r h LEU 147 CO 0.36 0.85 0.35 0.00 0.09 0.00 0.00 178.44 180.09 3g1r h ALA 149 N 1.30 0.45 -0.71 0.00 0.00 -1.87 -1.51 119.26 116.92 3g1r h ALA 149 Ca 0.26 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.82 3g1r h ALA 149 Cb 0.13 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3g1r h ALA 149 CO -0.03 0.39 0.47 1.15 0.00 0.00 0.00 179.25 181.23 3g1r h THR 150 N 0.45 1.19 -0.74 0.00 2.02 -0.96 -2.57 112.91 112.30 3g1r h THR 150 Ca 0.06 -0.35 0.01 0.00 0.77 0.00 0.00 66.41 66.90 3g1r h THR 150 Cb 0.74 0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 3g1r h THR 150 CO 0.05 0.18 0.49 -0.25 0.37 0.00 0.00 175.52 176.37 3g1r h TRP 151 N 0.97 0.94 -0.86 3.16 2.91 -0.62 -1.16 115.95 121.28 3g1r h TRP 151 Ca 0.26 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.35 3g1r h TRP 151 Cb -0.10 -0.32 -0.05 0.00 -0.51 0.00 0.00 29.16 28.18 3g1r h TRP 151 CO -0.02 0.59 0.57 0.93 -1.03 0.00 0.00 178.44 179.48 3g1r h GLU 152 N 1.01 1.01 -0.35 2.65 5.08 -0.89 0.22 114.58 123.31 3g1r h GLU 152 Ca 0.27 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.45 3g1r h GLU 152 Cb -0.11 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 28.90 3g1r h GLU 152 CO -0.06 0.67 -0.28 0.00 -1.00 0.00 0.00 179.01 178.34 3g1r h ALA 153 N 1.51 0.86 -0.46 3.43 0.00 -1.02 -2.08 119.26 121.49 3g1r h ALA 153 Ca 0.35 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3g1r h ALA 153 Cb 0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3g1r h ALA 153 CO -0.11 0.63 0.27 0.52 0.00 0.00 0.00 179.25 180.55 3g1r h MET 154 N 0.62 0.64 -0.97 0.00 2.86 -0.01 -2.85 114.93 115.22 3g1r h MET 154 Ca 0.08 -0.07 0.07 0.00 -2.06 0.00 0.00 59.70 57.72 3g1r h MET 154 Cb 0.79 -0.13 -0.07 0.00 0.06 0.00 0.00 31.60 32.25 3g1r h MET 154 CO 0.06 0.49 0.61 0.93 1.06 0.00 0.00 176.91 180.07 3g1r h GLU 155 N 0.61 1.06 -0.06 1.72 5.08 -0.29 -0.71 114.58 121.99 3g1r h GLU 155 Ca 0.16 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.42 3g1r h GLU 155 Cb 0.03 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 3g1r h GLU 155 CO -0.03 0.70 -0.18 0.00 -1.00 0.00 0.00 179.01 178.51 3g1r h ALA 156 N 1.45 1.60 -0.58 3.43 0.00 -1.20 -1.17 119.26 122.80 3g1r h ALA 156 Ca 0.43 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 3g1r h ALA 156 Cb 0.22 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3g1r h ALA 156 CO -0.19 0.30 0.03 0.00 0.00 0.00 0.00 179.25 179.39 3g1r h LYS 158 N 0.90 0.94 -0.62 0.00 3.64 -1.14 -2.24 116.57 118.06 3g1r h LYS 158 Ca 0.17 -0.33 0.06 0.00 -1.27 0.00 0.00 60.65 59.28 3g1r h LYS 158 Cb 0.51 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.23 3g1r h LYS 158 CO 0.02 0.99 0.41 -0.44 -2.27 0.00 0.00 179.45 178.17 3g1r h ASP 159 N 0.80 0.53 0.95 4.20 3.32 -0.88 -0.52 116.42 124.83 3g1r h ASP 159 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3g1r h ASP 159 Cb 0.61 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3g1r h ASP 159 CO 0.04 0.35 0.00 0.00 -1.72 0.00 0.00 179.24 177.91 3g1r n ALA 160 N -2.47 2.22 -0.50 3.45 0.00 -0.51 -4.92 120.51 117.78 3g1r n ALA 160 Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3g1r n ALA 160 Cb 0.23 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.25 3g1r n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1r n GLY 161 N 1.26 0.75 0.09 0.00 0.00 -0.20 -4.95 105.19 102.13 3g1r n GLY 161 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 3g1r n GLY 161 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3g1r n LEU 162 N 0.00 0.73 -3.70 0.99 4.77 -0.87 -4.78 117.00 114.14 3g1r n LEU 162 Ca 0.00 0.51 -0.12 0.00 -0.03 0.00 0.00 56.01 56.37 3g1r n LEU 162 Cb 0.00 -0.31 -0.09 0.00 -2.33 0.00 0.00 43.42 40.69 3g1r n LEU 162 CO 0.00 -0.14 0.17 0.54 -1.33 0.00 0.00 177.39 176.63 3g1r s VAL 163 N -3.10 -0.00 -0.03 4.08 0.11 -1.25 -1.95 120.40 118.25 3g1r s VAL 163 Ca 0.10 0.02 -0.20 0.00 -2.93 0.00 0.00 61.98 58.97 3g1r s VAL 163 Cb 0.13 -0.70 -0.32 0.00 -1.53 0.00 0.00 36.38 33.96 3g1r s VAL 163 CO 0.61 0.01 0.90 0.11 -3.33 0.00 0.00 175.10 173.40 3g1r h LYS 164 N 5.75 0.35 -4.95 1.54 1.57 -1.43 -3.40 116.57 116.00 3g1r h LYS 164 Ca -0.29 -0.61 -0.38 0.00 -1.87 0.00 0.00 60.65 57.51 3g1r h LYS 164 Cb 1.18 0.23 -0.24 0.00 0.08 0.00 0.00 32.23 33.48 3g1r h LYS 164 CO 0.21 1.29 -0.77 -1.12 -0.57 0.00 0.00 179.45 178.49 3g1r s SER 165 N -7.12 1.28 -0.00 0.86 0.01 -0.16 -5.01 113.70 103.55 3g1r s SER 165 Ca -0.13 -0.44 0.05 0.00 1.31 0.00 0.00 55.95 56.74 3g1r s SER 165 Cb 0.02 -0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.16 3g1r s SER 165 CO 0.86 -0.04 -0.14 -0.76 0.41 0.00 0.00 173.24 173.57 3g1r s LEU 166 N -1.15 2.81 0.00 2.44 1.43 -1.26 -1.79 118.68 121.16 3g1r s LEU 166 Ca -0.02 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.82 3g1r s LEU 166 Cb -0.08 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.53 3g1r s LEU 166 CO 0.01 0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.49 3g1r n GLY 167 N 1.83 2.95 3.33 -3.19 0.00 -0.79 -1.15 105.19 108.16 3g1r n GLY 167 Ca -0.16 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 3g1r n GLY 167 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3g1r s VAL 168 N -2.63 0.00 -0.08 1.61 -7.23 -0.29 -2.12 120.40 109.66 3g1r s VAL 168 Ca 0.00 -1.81 -0.09 0.00 -1.81 0.00 0.00 61.98 58.27 3g1r s VAL 168 Cb 0.00 -2.43 0.02 0.00 0.56 0.00 0.00 36.38 34.53 3g1r s VAL 168 CO 0.00 0.00 0.24 -0.55 -0.31 0.00 0.00 175.10 174.48 3g1r s SER 169 N -3.14 -0.24 -1.77 4.85 0.15 -0.02 -0.71 113.70 112.81 3g1r s SER 169 Ca 0.34 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.43 3g1r s SER 169 Cb 0.04 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 3g1r s SER 169 CO 0.13 -0.11 0.00 0.59 1.20 0.00 0.00 173.24 175.05 3g1r n ASN 170 N 2.83 -5.82 -4.77 5.45 3.02 -0.30 -3.95 115.26 111.72 3g1r n ASN 170 Ca -0.13 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.04 3g1r n ASN 170 Cb 0.58 -4.85 -0.06 0.00 -0.61 0.00 0.00 39.78 34.84 3g1r n ASN 170 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3g1r s PHE 171 N -3.01 3.57 0.77 3.10 0.40 -1.26 -4.42 117.98 117.14 3g1r s PHE 171 Ca 0.00 0.83 -0.04 0.00 -0.60 0.00 0.00 56.93 57.12 3g1r s PHE 171 Cb 0.00 -2.38 0.14 0.00 0.51 0.00 0.00 43.02 41.29 3g1r s PHE 171 CO 0.00 0.37 1.07 0.54 0.70 0.00 0.00 175.22 177.90 3g1r s ASN 172 N -0.06 4.07 0.24 1.36 2.20 -1.26 -4.85 114.94 116.63 3g1r s ASN 172 Ca 0.22 -0.23 -0.06 0.00 -0.94 0.00 0.00 52.86 51.85 3g1r s ASN 172 Cb -0.15 -0.07 0.35 0.00 -2.00 0.00 0.00 41.25 39.38 3g1r s ASN 172 CO 0.09 -2.06 1.82 -0.09 -2.94 0.00 0.00 177.10 173.92 3g1r h ARG 173 N -0.78 0.77 -0.61 3.55 2.43 -1.03 -0.76 114.38 117.95 3g1r h ARG 173 Ca -0.38 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.71 3g1r h ARG 173 Cb 1.26 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.61 3g1r h ARG 173 CO 0.40 0.51 0.24 -0.09 -1.51 0.00 0.00 179.97 179.51 3g1r h ARG 174 N 0.80 0.92 -0.11 0.20 2.43 -1.95 -0.56 114.38 116.11 3g1r h ARG 174 Ca 0.37 -0.17 -0.15 0.00 -0.81 0.00 0.00 59.98 59.21 3g1r h ARG 174 Cb 0.29 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3g1r h ARG 174 CO -0.22 0.79 -0.59 1.96 -1.51 0.00 0.00 179.97 180.40 3g1r h GLN 175 N 0.86 0.37 -0.12 0.20 4.20 -1.83 -1.47 115.11 117.33 3g1r h GLN 175 Ca 0.20 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 3g1r h GLN 175 Cb 0.22 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 3g1r h GLN 175 CO -0.02 0.85 0.06 -0.07 -0.67 0.00 0.00 178.83 178.99 3g1r h LEU 176 N 0.28 0.15 -1.16 1.46 3.38 -0.87 -3.03 115.31 115.51 3g1r h LEU 176 Ca -0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 3g1r h LEU 176 Cb 1.11 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 3g1r h LEU 176 CO 0.10 0.20 0.36 -0.33 0.09 0.00 0.00 178.44 178.86 3g1r h GLU 177 N 0.09 0.94 -0.68 1.13 4.39 -0.91 -0.64 114.58 118.90 3g1r h GLU 177 Ca 0.04 -0.11 0.14 0.00 0.34 0.00 0.00 59.36 59.78 3g1r h GLU 177 Cb 0.09 -0.19 -0.10 0.00 -0.10 0.00 0.00 28.75 28.45 3g1r h GLU 177 CO -0.01 0.70 0.11 1.25 -1.16 0.00 0.00 179.01 179.91 3g1r h LEU 178 N 0.95 -0.08 0.01 1.33 5.85 -1.16 0.16 115.31 122.37 3g1r h LEU 178 Ca 0.24 0.14 -0.20 0.00 0.84 0.00 0.00 57.88 58.91 3g1r h LEU 178 Cb 0.04 0.21 0.02 0.00 0.37 0.00 0.00 40.66 41.30 3g1r h LEU 178 CO -0.04 -0.06 -0.77 0.40 -0.34 0.00 0.00 178.44 177.64 3g1r h ILE 179 N 0.22 1.38 -0.16 4.05 2.04 -1.31 -3.07 117.51 120.66 3g1r h ILE 179 Ca 0.37 -2.17 -0.04 0.00 1.00 0.00 0.00 64.86 64.03 3g1r h ILE 179 Cb 0.61 2.57 -0.01 0.00 -0.74 0.00 0.00 36.82 39.24 3g1r h ILE 179 CO -0.50 0.64 -0.06 -0.07 0.00 0.00 0.00 178.15 178.16 3g1r h LEU 180 N 0.05 0.22 -2.10 1.44 3.38 -0.64 -1.99 115.31 115.68 3g1r h LEU 180 Ca -0.10 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3g1r h LEU 180 Cb 1.47 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3g1r h LEU 180 CO 0.15 0.32 0.00 0.59 0.09 0.00 0.00 178.44 179.59 3g1r n ASN 181 N -4.34 3.09 -4.71 -0.43 3.02 0.52 -4.97 115.26 107.44 3g1r n ASN 181 Ca -0.01 -1.96 -0.42 0.00 -0.03 0.00 0.00 54.58 52.17 3g1r n ASN 181 Cb 0.22 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 39.05 3g1r n ASN 181 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3g1r s LYS 182 N -1.38 4.13 0.12 3.52 2.20 -0.75 -4.90 119.74 122.69 3g1r s LYS 182 Ca 0.39 2.60 -0.31 0.00 -0.36 0.00 0.00 55.97 58.29 3g1r s LYS 182 Cb 0.21 -3.20 -0.10 0.00 -1.51 0.00 0.00 37.83 33.23 3g1r s LYS 182 CO 0.29 -0.77 1.80 -2.14 -0.36 0.00 0.00 175.35 174.17 3g1r s PRO 183 N 1.56 4.14 0.00 4.03 0.02 -1.26 -2.17 135.00 141.32 3g1r s PRO 183 Ca 0.76 2.57 0.00 0.00 0.02 0.00 0.00 61.00 64.35 3g1r s PRO 183 Cb -0.49 -3.55 0.00 0.00 0.02 0.00 0.00 34.50 30.48 3g1r s PRO 183 CO 0.33 -0.82 0.00 0.41 -0.33 0.00 0.00 177.00 176.59 3g1r n GLY 184 N 4.19 0.62 3.61 0.52 0.00 -1.26 -4.98 105.19 107.88 3g1r n GLY 184 Ca 0.17 -0.01 -0.58 0.00 0.00 0.00 0.00 46.02 45.60 3g1r n GLY 184 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3g1r n LEU 185 N 0.00 1.14 -0.13 0.99 7.94 -0.92 -4.90 117.00 121.12 3g1r n LEU 185 Ca 0.00 1.14 -0.23 0.00 -1.11 0.00 0.00 56.01 55.80 3g1r n LEU 185 Cb 0.00 -1.04 -0.10 0.00 0.53 0.00 0.00 43.42 42.81 3g1r n LEU 185 CO 0.00 -1.20 -1.35 0.29 -1.11 0.00 0.00 177.39 174.02 3g1r n LYS 186 N 2.91 0.57 -3.96 1.96 4.76 -1.26 -4.91 118.16 118.23 3g1r n LYS 186 Ca 0.22 0.20 -0.31 0.00 -2.87 0.00 0.00 58.31 55.56 3g1r n LYS 186 Cb 0.10 -1.45 -0.15 0.00 -1.84 0.00 0.00 35.03 31.69 3g1r n LYS 186 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 3g1r s HIS 187 N -2.48 2.60 0.53 2.13 3.76 -1.26 -5.12 115.29 115.46 3g1r s HIS 187 Ca -0.35 -1.93 -0.19 0.00 -0.15 0.00 0.00 55.06 52.44 3g1r s HIS 187 Cb 0.12 -1.73 -0.06 0.00 1.11 0.00 0.00 32.58 32.01 3g1r s HIS 187 CO 0.50 -0.81 1.07 -1.59 -0.85 0.00 0.00 174.74 173.06 3g1r s LYS 188 N 1.32 3.54 0.28 1.40 -2.85 -1.26 -4.97 119.74 117.20 3g1r s LYS 188 Ca -0.05 1.38 -0.30 0.00 -1.00 0.00 0.00 55.97 56.00 3g1r s LYS 188 Cb -0.19 -2.05 -0.11 0.00 -2.06 0.00 0.00 37.83 33.41 3g1r s LYS 188 CO -0.07 -0.66 1.60 -1.25 0.10 0.00 0.00 175.35 175.07 3g1r s PRO 189 N -3.49 4.13 0.00 1.78 0.04 -1.26 -4.79 135.00 131.40 3g1r s PRO 189 Ca 0.68 2.57 0.20 0.00 0.04 0.00 0.00 61.00 64.49 3g1r s PRO 189 Cb -0.18 -3.03 -0.16 0.00 0.04 0.00 0.00 34.50 31.17 3g1r s PRO 189 CO 0.27 -0.63 0.91 1.33 0.04 0.00 0.00 177.00 178.91 3g1r n VAL 190 N 2.32 0.00 -3.68 -0.36 0.24 -0.30 -4.71 118.33 111.84 3g1r n VAL 190 Ca 0.09 -0.09 -0.14 0.00 -2.04 0.00 0.00 64.34 62.16 3g1r n VAL 190 Cb 0.37 1.07 -0.08 0.00 -1.47 0.00 0.00 33.84 33.73 3g1r n VAL 190 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3g1r s SER 191 N -2.75 -0.60 -0.13 -1.34 0.15 -1.26 -1.35 113.70 106.42 3g1r s SER 191 Ca 0.10 1.16 0.00 0.00 0.70 0.00 0.00 55.95 57.91 3g1r s SER 191 Cb 0.16 1.17 0.02 0.00 -1.71 0.00 0.00 66.02 65.66 3g1r s SER 191 CO 0.75 -0.21 -0.12 0.21 1.20 0.00 0.00 173.24 175.07 3g1r s ASN 192 N 0.28 2.46 -0.34 5.45 2.47 -0.78 -1.14 114.94 123.34 3g1r s ASN 192 Ca -0.00 -0.41 -0.13 0.00 0.42 0.00 0.00 52.86 52.74 3g1r s ASN 192 Cb -0.04 -1.04 -0.01 0.00 -1.45 0.00 0.00 41.25 38.70 3g1r s ASN 192 CO 0.01 -0.07 0.25 -1.58 -3.72 0.00 0.00 177.10 171.99 3g1r s GLN 193 N 1.47 3.47 0.05 0.43 0.74 0.11 -1.77 119.66 124.17 3g1r s GLN 193 Ca 0.03 -0.65 -0.02 0.00 0.05 0.00 0.00 55.36 54.77 3g1r s GLN 193 Cb -0.13 -3.82 -0.03 0.00 1.10 0.00 0.00 33.01 30.13 3g1r s GLN 193 CO -0.08 -0.47 -0.01 0.14 -0.55 0.00 0.00 175.29 174.32 3g1r s VAL 194 N 1.74 0.20 0.08 1.34 -7.23 -0.36 -1.15 120.40 115.02 3g1r s VAL 194 Ca 0.06 -1.67 -0.34 0.00 -1.81 0.00 0.00 61.98 58.22 3g1r s VAL 194 Cb -0.17 -1.39 -0.13 0.00 0.56 0.00 0.00 36.38 35.24 3g1r s VAL 194 CO 0.11 -0.92 1.67 1.21 -0.31 0.00 0.00 175.10 176.85 3g1r n GLU 195 N 0.23 2.14 -3.66 4.82 2.13 -1.26 -0.80 120.64 124.25 3g1r n GLU 195 Ca -0.15 0.78 -0.06 0.00 0.66 0.00 0.00 57.16 58.39 3g1r n GLU 195 Cb 0.61 -2.57 -0.07 0.00 0.27 0.00 0.00 31.44 29.68 3g1r n GLU 195 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3g1r s HIS 197 N 2.26 0.01 0.62 0.00 -3.43 -0.89 -4.18 115.29 109.67 3g1r s HIS 197 Ca -0.07 -0.26 0.35 0.00 -0.80 0.00 0.00 55.06 54.29 3g1r s HIS 197 Cb -0.09 0.62 2.03 0.00 -1.43 0.00 0.00 32.58 33.71 3g1r s HIS 197 CO -0.17 -0.60 2.27 -1.35 -2.00 0.00 0.00 174.74 172.89 3g1r h PRO 198 N 2.00 0.00 0.00 -0.38 0.11 -1.88 -0.31 132.00 131.54 3g1r h PRO 198 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3g1r h PRO 198 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3g1r h PRO 198 CO 0.32 0.00 -0.42 0.66 -0.21 0.00 0.00 178.00 178.35 3g1r n TYR 199 N -3.50 0.38 -3.32 0.65 4.01 -1.26 -1.65 117.16 112.48 3g1r n TYR 199 Ca -0.02 0.11 -0.22 0.00 -0.16 0.00 0.00 57.90 57.61 3g1r n TYR 199 Cb 0.12 -0.57 -0.08 0.00 -0.31 0.00 0.00 39.34 38.50 3g1r n TYR 199 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 3g1r s PHE 200 N -3.09 0.28 -1.49 -0.72 5.36 -0.15 -0.82 117.98 117.35 3g1r s PHE 200 Ca 0.09 -1.53 0.29 0.00 -0.96 0.00 0.00 56.93 54.82 3g1r s PHE 200 Cb 0.15 -0.62 1.21 0.00 -0.34 0.00 0.00 43.02 43.43 3g1r s PHE 200 CO 0.67 -0.92 1.86 0.25 -1.46 0.00 0.00 175.22 175.62 3g1r n THR 201 N 3.52 0.00 -3.73 0.12 -2.24 -1.04 -2.10 114.28 108.80 3g1r n THR 201 Ca 0.19 -0.04 -0.23 0.00 -2.27 0.00 0.00 64.05 61.71 3g1r n THR 201 Cb 0.46 -0.17 0.03 0.00 -2.10 0.00 0.00 70.33 68.55 3g1r n THR 201 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g1r n GLN 202 N -1.11 -5.03 -0.08 -0.78 1.13 -1.26 -4.86 117.38 105.39 3g1r n GLN 202 Ca 0.13 0.62 -0.09 0.00 -1.94 0.00 0.00 57.00 55.72 3g1r n GLN 202 Cb 0.28 -5.23 -0.02 0.00 0.11 0.00 0.00 30.24 25.39 3g1r n GLN 202 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 3g1r h PRO 203 N -1.91 0.35 0.03 -1.09 0.13 -1.99 -0.73 132.00 126.79 3g1r h PRO 203 Ca -0.61 -0.02 -0.19 0.00 -0.87 0.00 0.00 66.00 64.31 3g1r h PRO 203 Cb 1.36 -0.08 0.02 0.00 0.13 0.00 0.00 31.00 32.43 3g1r h PRO 203 CO 0.58 0.23 -0.75 0.87 -0.23 0.00 0.00 178.00 178.70 3g1r h LYS 204 N 0.37 0.45 -0.76 0.86 1.57 -1.98 -2.69 116.57 114.37 3g1r h LYS 204 Ca 0.11 -0.53 -0.04 0.00 -1.87 0.00 0.00 60.65 58.32 3g1r h LYS 204 Cb -0.03 0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 3g1r h LYS 204 CO -0.03 1.18 0.32 1.25 -0.57 0.00 0.00 179.45 181.60 3g1r h LEU 205 N -0.05 1.03 -0.35 2.94 5.85 -1.88 -0.55 115.31 122.29 3g1r h LEU 205 Ca -0.10 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 3g1r h LEU 205 Cb 1.47 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 3g1r h LEU 205 CO 0.15 0.90 0.17 0.25 -0.34 0.00 0.00 178.44 179.57 3g1r h LEU 206 N 1.10 0.46 -0.57 2.25 5.85 -1.18 -0.14 115.31 123.09 3g1r h LEU 206 Ca 0.26 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 3g1r h LEU 206 Cb 0.18 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3g1r h LEU 206 CO -0.02 0.45 0.34 0.11 -0.34 0.00 0.00 178.44 178.98 3g1r h LYS 207 N 0.43 0.78 -0.48 1.25 1.57 -1.17 0.06 116.57 119.00 3g1r h LYS 207 Ca 0.12 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3g1r h LYS 207 Cb 0.11 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3g1r h LYS 207 CO -0.02 0.56 0.25 0.35 -0.57 0.00 0.00 179.45 180.03 3g1r h PHE 208 N 0.77 0.67 -0.62 -1.35 3.57 -0.89 -1.47 116.94 117.62 3g1r h PHE 208 Ca 0.20 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 3g1r h PHE 208 Cb -0.01 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 3g1r h PHE 208 CO -0.02 0.51 0.15 0.00 -2.23 0.00 0.00 178.31 176.72 3g1r h GLN 210 N 0.90 0.61 -0.41 0.00 4.20 -0.71 0.10 115.11 119.81 3g1r h GLN 210 Ca 0.19 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.85 3g1r h GLN 210 Cb 0.36 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 3g1r h GLN 210 CO 0.00 0.44 0.23 1.96 -0.67 0.00 0.00 178.83 180.80 3g1r h GLN 211 N 0.63 0.55 -0.52 1.46 4.20 -0.81 -2.68 115.11 117.93 3g1r h GLN 211 Ca 0.16 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3g1r h GLN 211 Cb -0.01 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.65 3g1r h GLN 211 CO -0.03 0.40 0.00 0.72 -0.67 0.00 0.00 178.83 179.25 3g1r n HIS 212 N -4.44 1.41 -3.76 2.96 8.25 -0.41 -4.94 115.22 114.28 3g1r n HIS 212 Ca 0.03 -0.68 -0.28 0.00 -0.26 0.00 0.00 57.72 56.53 3g1r n HIS 212 Cb 0.09 -0.30 0.05 0.00 1.12 0.00 0.00 29.99 30.95 3g1r n HIS 212 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3g1r n ASP 213 N 0.61 -5.51 -4.55 0.41 8.00 -0.71 -4.98 116.55 109.82 3g1r n ASP 213 Ca 0.24 -0.67 -0.36 0.00 0.71 0.00 0.00 54.79 54.72 3g1r n ASP 213 Cb 0.92 -4.37 -0.11 0.00 -0.02 0.00 0.00 41.12 37.54 3g1r n ASP 213 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3g1r s ILE 214 N -3.30 4.60 0.04 0.53 1.01 0.22 -4.31 121.20 119.99 3g1r s ILE 214 Ca 0.63 -0.09 -0.25 0.00 0.00 0.00 0.00 60.65 60.94 3g1r s ILE 214 Cb -0.30 -3.11 -0.05 0.00 0.01 0.00 0.00 42.46 39.01 3g1r s ILE 214 CO 0.77 0.40 0.78 -0.69 0.00 0.00 0.00 174.94 176.21 3g1r s VAL 215 N 0.97 4.73 -0.03 2.92 1.01 -0.46 -3.89 120.40 125.66 3g1r s VAL 215 Ca 0.04 1.67 -0.26 0.00 0.00 0.00 0.00 61.98 63.43 3g1r s VAL 215 Cb -0.14 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 3g1r s VAL 215 CO 0.03 0.35 0.81 -0.63 0.00 0.00 0.00 175.10 175.66 3g1r s ILE 216 N 0.02 4.94 -0.23 2.22 -1.09 -1.26 -1.86 121.20 123.93 3g1r s ILE 216 Ca 0.40 1.70 -0.09 0.00 -2.23 0.00 0.00 60.65 60.43 3g1r s ILE 216 Cb -0.21 -4.15 -0.04 0.00 -1.58 0.00 0.00 42.46 36.48 3g1r s ILE 216 CO 0.23 0.23 0.11 -0.89 -1.23 0.00 0.00 174.94 173.40 3g1r s THR 217 N 0.76 4.85 -0.61 2.92 2.01 -0.73 -1.45 115.64 123.39 3g1r s THR 217 Ca 0.43 0.00 -0.26 0.00 0.31 0.00 0.00 61.69 62.17 3g1r s THR 217 Cb -0.19 -3.25 0.04 0.00 0.01 0.00 0.00 72.50 69.10 3g1r s THR 217 CO 0.22 0.36 1.10 0.00 -0.69 0.00 0.00 174.62 175.61 3g1r s ALA 218 N 1.19 3.02 0.58 7.40 0.00 0.21 -1.23 121.76 132.93 3g1r s ALA 218 Ca 0.06 -1.21 -0.07 0.00 0.00 0.00 0.00 51.96 50.73 3g1r s ALA 218 Cb -0.14 -3.96 -0.01 0.00 0.00 0.00 0.00 23.12 19.01 3g1r s ALA 218 CO 0.04 -2.71 0.92 1.52 0.00 0.00 0.00 175.76 175.53 3g1r s TYR 219 N 4.66 3.39 -1.52 0.00 -0.85 0.02 -3.07 117.35 119.97 3g1r s TYR 219 Ca 0.34 0.83 -0.00 0.00 -0.52 0.00 0.00 57.07 57.72 3g1r s TYR 219 Cb -0.11 -2.68 0.00 0.00 0.38 0.00 0.00 41.96 39.56 3g1r s TYR 219 CO 0.19 -0.72 0.00 0.43 -1.52 0.00 0.00 175.55 173.93 3g1r n SER 220 N -2.59 0.93 0.11 -0.18 7.64 -1.26 -2.49 113.62 115.77 3g1r n SER 220 Ca 0.04 -1.26 0.10 0.00 1.01 0.00 0.00 58.87 58.77 3g1r n SER 220 Cb 0.56 -1.56 0.46 0.00 -1.01 0.00 0.00 64.21 62.66 3g1r n SER 220 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3g1r n PRO 221 N -4.52 0.15 -0.28 1.43 -0.04 -1.25 -1.05 135.00 129.43 3g1r n PRO 221 Ca -0.32 0.43 0.09 0.00 -0.04 0.00 0.00 63.50 63.66 3g1r n PRO 221 Cb 0.69 -1.81 0.25 0.00 -0.04 0.00 0.00 33.50 32.58 3g1r n PRO 221 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3g1r n LEU 222 N -2.09 3.50 0.00 1.53 4.77 -1.26 -4.72 117.00 118.73 3g1r n LEU 222 Ca 0.02 -1.96 0.00 0.00 -0.03 0.00 0.00 56.01 54.03 3g1r n LEU 222 Cb 0.18 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 3g1r n LEU 222 CO 0.16 0.87 0.00 0.61 -1.33 0.00 0.00 177.39 177.70 3g1r n GLY 223 N 1.18 0.66 0.47 -0.72 0.00 -0.22 -4.60 105.19 101.96 3g1r n GLY 223 Ca 0.19 -0.55 0.06 0.00 0.00 0.00 0.00 46.02 45.71 3g1r n GLY 223 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g1r n THR 224 N -2.57 0.00 1.30 2.61 -2.24 -1.25 -4.49 114.28 107.64 3g1r n THR 224 Ca 0.00 0.15 0.14 0.00 -2.27 0.00 0.00 64.05 62.08 3g1r n THR 224 Cb 0.00 -0.31 0.71 0.00 -2.10 0.00 0.00 70.33 68.63 3g1r n THR 224 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3g1r n SER 225 N -3.06 0.00 -2.52 3.42 3.41 -1.26 -4.92 113.62 108.69 3g1r n SER 225 Ca -0.01 0.01 -0.18 0.00 -0.26 0.00 0.00 58.87 58.43 3g1r n SER 225 Cb 0.22 -0.33 0.03 0.00 -0.26 0.00 0.00 64.21 63.87 3g1r n SER 225 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3g1r n ARG 226 N -1.33 -4.17 -2.21 4.33 1.74 -1.26 -4.95 116.66 108.80 3g1r n ARG 226 Ca 0.12 0.74 -0.43 0.00 -0.77 0.00 0.00 57.85 57.51 3g1r n ARG 226 Cb 0.26 -5.25 -0.02 0.00 -1.02 0.00 0.00 32.46 26.42 3g1r n ARG 226 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3g1r s ASN 227 N -2.80 6.32 0.65 0.55 3.84 -1.26 -4.89 114.94 117.35 3g1r s ASN 227 Ca 0.26 1.28 0.38 0.00 0.21 0.00 0.00 52.86 54.99 3g1r s ASN 227 Cb -0.12 -2.53 2.08 0.00 -0.55 0.00 0.00 41.25 40.13 3g1r s ASN 227 CO 0.33 -1.36 2.21 1.55 -2.79 0.00 0.00 177.10 177.03 3g1r h PRO 228 N 10.89 0.00 -0.53 0.43 0.13 -1.93 0.23 132.00 141.22 3g1r h PRO 228 Ca -0.31 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.88 3g1r h PRO 228 Cb 1.13 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 3g1r h PRO 228 CO 1.03 0.00 0.35 0.82 -0.23 0.00 0.00 178.00 179.98 3g1r h ILE 229 N 0.00 0.99 0.00 -3.56 1.08 -2.03 -3.34 117.51 110.65 3g1r h ILE 229 Ca 0.01 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.31 3g1r h ILE 229 Cb 0.24 0.46 0.00 0.00 -3.07 0.00 0.00 36.82 34.45 3g1r h ILE 229 CO -0.00 0.09 0.00 -2.67 -0.69 0.00 0.00 178.15 174.88 3g1r n TRP 230 N -4.47 0.00 -3.67 1.37 4.27 -0.94 -5.08 117.44 108.92 3g1r n TRP 230 Ca 0.07 0.00 -0.37 0.00 -3.89 0.00 0.00 57.50 53.31 3g1r n TRP 230 Cb 0.23 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.12 3g1r n TRP 230 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 3g1r s VAL 231 N 0.00 5.31 -0.63 -1.67 1.01 0.75 -4.56 120.40 120.62 3g1r s VAL 231 Ca 0.00 0.47 -0.27 0.00 0.00 0.00 0.00 61.98 62.18 3g1r s VAL 231 Cb 0.00 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.84 3g1r s VAL 231 CO 0.00 0.53 1.44 0.21 0.00 0.00 0.00 175.10 177.28 3g1r s ASN 232 N -0.49 6.00 -0.18 3.32 2.47 0.47 -4.45 114.94 122.08 3g1r s ASN 232 Ca 0.17 0.06 0.09 0.00 0.42 0.00 0.00 52.86 53.60 3g1r s ASN 232 Cb -0.13 -2.55 0.57 0.00 -1.45 0.00 0.00 41.25 37.69 3g1r s ASN 232 CO 0.06 -1.85 1.41 1.33 -3.72 0.00 0.00 177.10 174.32 3g1r n VAL 233 N 6.76 2.01 0.02 -5.21 0.24 -1.26 -4.29 118.33 116.60 3g1r n VAL 233 Ca 0.11 -1.02 -0.12 0.00 -2.04 0.00 0.00 64.34 61.27 3g1r n VAL 233 Cb 0.50 -0.37 -0.06 0.00 -1.47 0.00 0.00 33.84 32.43 3g1r n VAL 233 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3g1r h SER 234 N 2.64 0.04 -3.51 -1.34 0.02 -1.94 -3.42 113.55 106.05 3g1r h SER 234 Ca 0.04 -0.01 -0.52 0.00 -0.84 0.00 0.00 61.79 60.46 3g1r h SER 234 Cb 1.62 -0.01 0.04 0.00 0.14 0.00 0.00 62.40 64.18 3g1r h SER 234 CO 0.39 0.04 0.63 -0.44 -1.14 0.00 0.00 176.83 176.31 3g1r s SER 235 N -5.23 6.91 0.93 3.07 0.01 -1.26 -5.01 113.70 113.11 3g1r s SER 235 Ca -0.13 2.44 -0.11 0.00 1.31 0.00 0.00 55.95 59.46 3g1r s SER 235 Cb 0.06 -2.62 0.11 0.00 0.21 0.00 0.00 66.02 63.79 3g1r s SER 235 CO 0.67 -0.49 0.89 -0.81 0.41 0.00 0.00 173.24 173.90 3g1r n PRO 236 N 2.19 -0.42 -1.69 12.44 -0.04 -1.26 -4.85 135.00 141.37 3g1r n PRO 236 Ca 0.04 -0.06 -0.43 0.00 -0.04 0.00 0.00 63.50 63.01 3g1r n PRO 236 Cb 0.43 -2.19 -0.03 0.00 -0.04 0.00 0.00 33.50 31.66 3g1r n PRO 236 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3g1r n PRO 237 N -3.36 2.64 -0.36 0.54 -0.02 -1.26 -4.87 135.00 128.30 3g1r n PRO 237 Ca 0.10 0.96 0.05 0.00 -2.02 0.00 0.00 63.50 62.59 3g1r n PRO 237 Cb 0.53 -2.83 0.21 0.00 -0.02 0.00 0.00 33.50 31.38 3g1r n PRO 237 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3g1r h LEU 238 N 8.27 0.96 0.00 2.45 5.85 -1.89 -1.69 115.31 129.27 3g1r h LEU 238 Ca -0.46 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.29 3g1r h LEU 238 Cb 1.23 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.09 3g1r h LEU 238 CO 0.94 0.56 0.00 0.18 -0.34 0.00 0.00 178.44 179.78 3g1r n LEU 239 N -4.58 0.00 -0.96 2.25 4.77 -1.26 -1.98 117.00 115.24 3g1r n LEU 239 Ca 0.17 0.23 0.11 0.00 -0.03 0.00 0.00 56.01 56.48 3g1r n LEU 239 Cb 0.28 -0.23 0.15 0.00 -2.33 0.00 0.00 43.42 41.29 3g1r n LEU 239 CO 0.29 -0.04 0.64 0.29 -1.33 0.00 0.00 177.39 177.24 3g1r n LYS 240 N -1.23 2.19 -1.70 3.23 4.76 -0.64 -4.77 118.16 120.02 3g1r n LYS 240 Ca 0.13 -2.01 -0.44 0.00 -2.87 0.00 0.00 58.31 53.13 3g1r n LYS 240 Cb 0.18 -1.44 -0.03 0.00 -1.84 0.00 0.00 35.03 31.90 3g1r n LYS 240 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3g1r n ASP 241 N 1.26 3.44 -0.02 4.39 -0.08 -0.84 -4.89 116.55 119.81 3g1r n ASP 241 Ca 0.15 1.10 -0.09 0.00 -1.51 0.00 0.00 54.79 54.44 3g1r n ASP 241 Cb 0.55 -1.50 -0.03 0.00 2.34 0.00 0.00 41.12 42.47 3g1r n ASP 241 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3g1r h ALA 242 N 5.64 0.06 -0.27 -1.67 0.00 -1.94 -1.10 119.26 119.99 3g1r h ALA 242 Ca -0.45 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 3g1r h ALA 242 Cb 1.24 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 3g1r h ALA 242 CO 0.87 -0.51 0.10 1.25 0.00 0.00 0.00 179.25 180.95 3g1r h LEU 243 N -0.05 0.38 -1.09 0.00 5.85 -1.99 0.25 115.31 118.66 3g1r h LEU 243 Ca 0.08 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.64 3g1r h LEU 243 Cb 0.18 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 3g1r h LEU 243 CO -0.19 0.46 0.61 -0.07 -0.34 0.00 0.00 178.44 178.92 3g1r h LEU 244 N 0.28 1.05 -0.26 2.25 3.38 -1.87 0.14 115.31 120.27 3g1r h LEU 244 Ca 0.09 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.83 3g1r h LEU 244 Cb 0.21 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3g1r h LEU 244 CO -0.01 0.75 -0.67 0.78 0.09 0.00 0.00 178.44 179.39 3g1r h ASN 245 N 1.23 0.91 -0.43 -0.43 2.35 -0.98 -1.51 115.58 116.73 3g1r h ASN 245 Ca 0.35 -0.55 0.01 0.00 -0.55 0.00 0.00 56.30 55.56 3g1r h ASN 245 Cb -0.10 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 37.98 3g1r h ASN 245 CO -0.08 1.34 0.28 -1.28 -1.65 0.00 0.00 177.43 176.03 3g1r h SER 246 N 0.58 0.47 -0.28 5.81 0.87 -0.33 -1.46 113.55 119.20 3g1r h SER 246 Ca -0.02 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.46 3g1r h SER 246 Cb 1.28 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 63.11 3g1r h SER 246 CO 0.14 0.34 -0.05 -0.07 -0.53 0.00 0.00 176.83 176.66 3g1r h LEU 247 N 0.56 0.62 -0.61 2.23 3.38 -0.72 -2.34 115.31 118.43 3g1r h LEU 247 Ca 0.16 -0.15 0.08 0.00 0.09 0.00 0.00 57.88 58.06 3g1r h LEU 247 Cb -0.04 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.48 3g1r h LEU 247 CO -0.05 0.72 0.27 1.23 0.09 0.00 0.00 178.44 180.71 3g1r h GLY 248 N 0.94 0.88 0.80 0.83 0.00 -0.61 -2.19 103.07 103.71 3g1r h GLY 248 Ca 0.12 -0.16 0.05 0.00 0.00 0.00 0.00 47.33 47.33 3g1r h GLY 248 CO 0.02 0.04 0.61 0.50 0.00 0.00 0.00 176.54 177.71 3g1r h LYS 249 N 0.49 1.10 -0.69 4.80 1.79 -0.74 0.23 116.57 123.56 3g1r h LYS 249 Ca 0.30 -0.07 0.02 0.00 -2.18 0.00 0.00 60.65 58.72 3g1r h LYS 249 Cb 0.31 -0.25 -0.04 0.00 -1.58 0.00 0.00 32.23 30.67 3g1r h LYS 249 CO -0.26 0.73 0.44 -0.09 -1.08 0.00 0.00 179.45 179.19 3g1r h ARG 250 N 1.14 0.85 -0.16 3.15 2.43 -1.21 -2.56 114.38 118.01 3g1r h ARG 250 Ca 0.39 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.51 3g1r h ARG 250 Cb 0.09 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 3g1r h ARG 250 CO -0.15 0.56 0.00 0.66 -1.51 0.00 0.00 179.97 179.53 3g1r n TYR 251 N -4.65 0.18 -3.90 2.20 4.02 -1.02 -4.94 117.16 109.05 3g1r n TYR 251 Ca 0.07 -0.09 -0.26 0.00 -0.01 0.00 0.00 57.90 57.61 3g1r n TYR 251 Cb 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.38 3g1r n TYR 251 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3g1r n ASN 252 N 1.00 -1.70 -4.32 7.72 5.15 0.34 -5.00 115.26 118.44 3g1r n ASN 252 Ca 0.17 -0.91 -0.21 0.00 -0.60 0.00 0.00 54.58 53.03 3g1r n ASN 252 Cb 0.51 -3.48 -0.11 0.00 -0.53 0.00 0.00 39.78 36.17 3g1r n ASN 252 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3g1r s LYS 253 N -6.43 1.24 0.79 1.20 -0.14 0.54 -5.01 119.74 111.93 3g1r s LYS 253 Ca 0.20 -1.40 -0.12 0.00 -1.36 0.00 0.00 55.97 53.29 3g1r s LYS 253 Cb -0.11 -1.22 0.07 0.00 -1.68 0.00 0.00 37.83 34.89 3g1r s LYS 253 CO 0.86 0.24 1.13 0.95 -0.76 0.00 0.00 175.35 177.77 3g1r s THR 254 N -2.21 2.66 0.27 2.17 -4.23 -1.26 -4.09 115.64 108.94 3g1r s THR 254 Ca 0.15 0.21 -0.04 0.00 -1.18 0.00 0.00 61.69 60.83 3g1r s THR 254 Cb -0.05 -3.12 0.26 0.00 1.34 0.00 0.00 72.50 70.93 3g1r s THR 254 CO 0.06 -0.28 1.94 0.00 -0.54 0.00 0.00 174.62 175.80 3g1r h ALA 255 N -1.01 1.33 -0.54 3.99 0.00 -1.86 -1.57 119.26 119.61 3g1r h ALA 255 Ca -0.47 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.45 3g1r h ALA 255 Cb 1.30 -0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.65 3g1r h ALA 255 CO 0.63 0.61 0.22 0.00 0.00 0.00 0.00 179.25 180.72 3g1r h ALA 256 N 1.41 0.68 -0.40 0.00 0.00 -1.92 -0.14 119.26 118.89 3g1r h ALA 256 Ca 0.36 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.24 3g1r h ALA 256 Cb -0.11 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3g1r h ALA 256 CO -0.09 -0.16 -0.08 1.96 0.00 0.00 0.00 179.25 180.88 3g1r h GLN 257 N 0.43 0.69 -0.25 0.00 4.20 -1.67 -1.50 115.11 117.02 3g1r h GLN 257 Ca 0.25 -0.21 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 3g1r h GLN 257 Cb 0.25 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 3g1r h GLN 257 CO -0.23 0.77 0.10 0.82 -0.67 0.00 0.00 178.83 179.62 3g1r h ILE 258 N 0.64 1.17 -0.06 2.54 1.08 -0.61 -1.00 117.51 121.27 3g1r h ILE 258 Ca 0.12 -0.51 -0.11 0.00 -0.39 0.00 0.00 64.86 63.97 3g1r h ILE 258 Cb 0.52 1.05 -0.01 0.00 -3.07 0.00 0.00 36.82 35.30 3g1r h ILE 258 CO 0.03 0.17 -0.46 -0.37 -0.69 0.00 0.00 178.15 176.83 3g1r h VAL 259 N 0.25 1.33 -0.09 1.67 -1.51 -0.76 -0.22 116.25 116.92 3g1r h VAL 259 Ca 0.08 -1.62 -0.07 0.00 -1.23 0.00 0.00 66.70 63.87 3g1r h VAL 259 Cb 0.17 1.80 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 3g1r h VAL 259 CO -0.01 0.47 -0.20 -0.07 -1.23 0.00 0.00 177.57 176.54 3g1r h LEU 260 N 0.11 0.33 -0.78 4.19 3.38 -1.21 -2.97 115.31 118.36 3g1r h LEU 260 Ca 0.01 -0.57 0.06 0.00 0.09 0.00 0.00 57.88 57.46 3g1r h LEU 260 Cb 0.86 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 3g1r h LEU 260 CO 0.07 0.84 0.48 -0.09 0.09 0.00 0.00 178.44 179.82 3g1r h ARG 261 N -0.17 0.85 -0.24 1.13 9.65 -1.02 -1.79 114.38 122.80 3g1r h ARG 261 Ca 0.00 -0.05 0.06 0.00 -1.10 0.00 0.00 59.98 58.89 3g1r h ARG 261 Cb 0.79 -0.19 -0.07 0.00 -1.39 0.00 0.00 29.97 29.11 3g1r h ARG 261 CO 0.04 0.57 -0.26 0.35 2.80 0.00 0.00 179.97 183.47 3g1r h PHE 262 N 0.88 -0.70 -0.31 2.20 3.57 -1.00 -0.14 116.94 121.44 3g1r h PHE 262 Ca 0.34 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.78 3g1r h PHE 262 Cb 0.15 0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 3g1r h PHE 262 CO -0.05 -0.34 -0.19 -0.91 -2.23 0.00 0.00 178.31 174.60 3g1r h ASN 263 N -0.27 0.70 0.31 0.41 2.35 -1.30 -3.03 115.58 114.74 3g1r h ASN 263 Ca 0.13 -0.43 -0.07 0.00 -0.55 0.00 0.00 56.30 55.39 3g1r h ASN 263 Cb 0.48 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 3g1r h ASN 263 CO -0.40 0.98 -0.32 0.16 -1.65 0.00 0.00 177.43 176.20 3g1r h ILE 264 N 0.43 1.23 0.00 2.81 3.07 -1.14 -0.70 117.51 123.21 3g1r h ILE 264 Ca 0.06 -1.11 -0.03 0.00 1.55 0.00 0.00 64.86 65.33 3g1r h ILE 264 Cb 0.73 1.58 -0.00 0.00 -0.27 0.00 0.00 36.82 38.86 3g1r h ILE 264 CO 0.05 0.32 -0.16 -0.61 -1.05 0.00 0.00 178.15 176.70 3g1r h GLN 265 N 0.02 0.00 -0.67 0.16 4.15 -0.92 -1.63 115.11 116.22 3g1r h GLN 265 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3g1r h GLN 265 Cb 0.57 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.26 3g1r h GLN 265 CO 0.04 0.16 0.00 2.89 -1.93 0.00 0.00 178.83 179.99 3g1r n ARG 266 N -3.46 2.72 -0.82 1.69 1.85 -0.84 -4.93 116.66 112.87 3g1r n ARG 266 Ca -0.01 -2.45 0.00 0.00 -1.00 0.00 0.00 57.85 54.40 3g1r n ARG 266 Cb 0.33 -1.58 0.00 0.00 -1.05 0.00 0.00 32.46 30.16 3g1r n ARG 266 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3g1r n GLY 267 N 1.48 0.51 3.66 2.89 0.00 -0.61 -5.04 105.19 108.08 3g1r n GLY 267 Ca 0.23 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 3g1r n GLY 267 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1r s VAL 268 N -2.00 5.35 0.29 1.61 1.01 -0.33 -4.69 120.40 121.64 3g1r s VAL 268 Ca 0.00 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.90 3g1r s VAL 268 Cb 0.00 -3.51 -0.10 0.00 0.00 0.00 0.00 36.38 32.77 3g1r s VAL 268 CO 0.00 0.34 1.28 -0.69 0.00 0.00 0.00 175.10 176.03 3g1r s VAL 269 N 1.05 2.96 -0.03 2.92 1.01 -0.53 -3.29 120.40 124.49 3g1r s VAL 269 Ca 0.08 0.92 0.07 0.00 0.00 0.00 0.00 61.98 63.05 3g1r s VAL 269 Cb -0.13 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 3g1r s VAL 269 CO 0.04 0.20 -0.24 0.68 0.00 0.00 0.00 175.10 175.79 3g1r s VAL 270 N -0.81 2.25 -0.50 2.92 -7.23 0.03 0.63 120.40 117.70 3g1r s VAL 270 Ca 0.50 -1.03 0.08 0.00 -1.81 0.00 0.00 61.98 59.72 3g1r s VAL 270 Cb -0.38 -1.81 0.34 0.00 0.56 0.00 0.00 36.38 35.10 3g1r s VAL 270 CO 0.47 0.58 0.87 2.30 -0.31 0.00 0.00 175.10 179.01 3g1r n ILE 271 N 2.51 1.85 -1.74 -0.62 -5.35 -1.18 -0.84 119.36 113.99 3g1r n ILE 271 Ca -0.16 -5.20 -0.42 0.00 -0.27 0.00 0.00 62.75 56.69 3g1r n ILE 271 Cb 0.51 -0.96 -0.02 0.00 -1.74 0.00 0.00 39.64 37.43 3g1r n ILE 271 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 3g1r n PRO 272 N -0.05 2.65 -3.47 6.28 -0.04 -1.20 -2.84 135.00 136.33 3g1r n PRO 272 Ca 0.29 0.94 -0.37 0.00 -0.04 0.00 0.00 63.50 64.32 3g1r n PRO 272 Cb 0.49 -2.72 -0.07 0.00 -0.04 0.00 0.00 33.50 31.16 3g1r n PRO 272 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3g1r s LYS 273 N -0.43 4.23 -0.08 0.54 2.36 -1.26 -1.22 119.74 123.89 3g1r s LYS 273 Ca 0.65 0.15 -0.06 0.00 -2.55 0.00 0.00 55.97 54.16 3g1r s LYS 273 Cb -0.51 -3.47 0.03 0.00 -1.05 0.00 0.00 37.83 32.83 3g1r s LYS 273 CO 0.48 0.13 0.19 0.45 1.55 0.00 0.00 175.35 178.15 3g1r s SER 274 N 0.70 -0.20 -0.20 1.43 0.15 -1.26 -4.94 113.70 109.39 3g1r s SER 274 Ca 0.18 0.40 0.16 0.00 0.70 0.00 0.00 55.95 57.39 3g1r s SER 274 Cb -0.14 0.36 0.62 0.00 -1.71 0.00 0.00 66.02 65.15 3g1r s SER 274 CO 0.06 -0.10 1.52 0.49 1.20 0.00 0.00 173.24 176.41 3g1r n PHE 275 N 3.44 1.29 -4.00 3.44 0.99 -1.26 -4.75 117.46 116.60 3g1r n PHE 275 Ca -0.17 -0.84 -0.35 0.00 -0.00 0.00 0.00 57.45 56.09 3g1r n PHE 275 Cb 0.56 -0.38 -0.12 0.00 -1.00 0.00 0.00 39.48 38.55 3g1r n PHE 275 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 3g1r s ASN 276 N -1.60 5.18 0.19 4.37 3.84 -1.26 -4.89 114.94 120.76 3g1r s ASN 276 Ca 0.46 -0.10 -0.18 0.00 0.21 0.00 0.00 52.86 53.25 3g1r s ASN 276 Cb 0.37 -1.90 0.15 0.00 -0.55 0.00 0.00 41.25 39.32 3g1r s ASN 276 CO 0.11 0.08 1.62 0.25 -2.79 0.00 0.00 177.10 176.37 3g1r h LEU 277 N 7.36 -0.77 -0.47 3.21 5.85 -2.00 0.12 115.31 128.62 3g1r h LEU 277 Ca -0.36 0.18 -0.15 0.00 0.84 0.00 0.00 57.88 58.40 3g1r h LEU 277 Cb 1.18 0.43 -0.01 0.00 0.37 0.00 0.00 40.66 42.62 3g1r h LEU 277 CO 0.63 -0.25 -0.32 -0.33 -0.34 0.00 0.00 178.44 177.83 3g1r h GLU 278 N -0.10 0.93 -0.02 1.25 3.07 -2.00 -2.97 114.58 114.74 3g1r h GLU 278 Ca 0.24 -0.45 -0.19 0.00 -0.50 0.00 0.00 59.36 58.47 3g1r h GLU 278 Cb 0.48 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.37 3g1r h GLU 278 CO -0.58 1.10 -0.81 0.00 -1.40 0.00 0.00 179.01 177.32 3g1r h ARG 279 N 0.78 0.21 -0.49 2.33 3.08 -1.84 -0.71 114.38 117.73 3g1r h ARG 279 Ca 0.08 -0.21 0.06 0.00 0.07 0.00 0.00 59.98 59.99 3g1r h ARG 279 Cb 0.90 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.95 3g1r h ARG 279 CO 0.08 0.91 0.19 0.82 -1.07 0.00 0.00 179.97 180.90 3g1r h ILE 280 N 0.13 0.85 -0.33 2.04 2.04 -0.76 -0.84 117.51 120.63 3g1r h ILE 280 Ca -0.04 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.61 3g1r h ILE 280 Cb 1.41 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 3g1r h ILE 280 CO 0.12 0.07 -0.12 0.11 0.00 0.00 0.00 178.15 178.33 3g1r h LYS 281 N 0.37 0.67 -0.44 2.37 1.57 -1.35 -3.19 116.57 116.57 3g1r h LYS 281 Ca 0.23 -0.27 0.07 0.00 -1.87 0.00 0.00 60.65 58.81 3g1r h LYS 281 Cb 0.23 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.45 3g1r h LYS 281 CO -0.23 0.86 0.07 1.49 -0.57 0.00 0.00 179.45 181.07 3g1r h GLU 282 N 0.45 0.19 0.00 3.15 4.81 -0.75 -2.14 114.58 120.29 3g1r h GLU 282 Ca 0.08 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 3g1r h GLU 282 Cb 0.64 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 3g1r h GLU 282 CO 0.04 0.12 -0.04 -0.91 -0.73 0.00 0.00 179.01 177.49 3g1r h ASN 283 N 0.19 0.00 1.22 1.04 2.35 -1.15 -2.31 115.58 116.92 3g1r h ASN 283 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 3g1r h ASN 283 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 3g1r h ASN 283 CO -0.30 0.04 -0.51 0.15 -1.65 0.00 0.00 177.43 175.17 3g1r h PHE 284 N 0.00 0.00 -0.43 1.19 3.57 -1.40 -3.40 116.94 116.46 3g1r h PHE 284 Ca -0.00 0.00 -0.71 0.00 3.53 0.00 0.00 57.97 60.79 3g1r h PHE 284 Cb 0.21 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 38.89 3g1r h PHE 284 CO 0.00 0.00 2.99 1.04 -2.23 0.00 0.00 178.31 180.11 3g1r n GLN 285 N -2.48 3.42 -0.35 1.11 1.13 -0.87 -4.36 117.38 114.98 3g1r n GLN 285 Ca 0.03 -2.80 0.05 0.00 -1.94 0.00 0.00 57.00 52.33 3g1r n GLN 285 Cb 0.49 -3.02 0.07 0.00 0.11 0.00 0.00 30.24 27.89 3g1r n GLN 285 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 3g1r n ILE 286 N 3.96 0.94 0.30 5.09 -5.35 -1.26 -4.71 119.36 118.33 3g1r n ILE 286 Ca 0.57 -1.19 0.04 0.00 -0.27 0.00 0.00 62.75 61.90 3g1r n ILE 286 Cb 0.33 0.16 0.04 0.00 -1.74 0.00 0.00 39.64 38.43 3g1r n ILE 286 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3g1r n PHE 287 N -0.67 0.02 -0.49 4.28 3.72 -1.26 -4.62 117.46 118.44 3g1r n PHE 287 Ca 0.08 -0.04 0.08 0.00 -0.05 0.00 0.00 57.45 57.52 3g1r n PHE 287 Cb 0.69 -0.00 0.24 0.00 -0.94 0.00 0.00 39.48 39.47 3g1r n PHE 287 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3g1r n ASP 288 N 0.43 3.70 -3.85 4.37 5.75 -1.26 -4.85 116.55 120.84 3g1r n ASP 288 Ca 0.05 -2.35 -0.08 0.00 -0.01 0.00 0.00 54.79 52.40 3g1r n ASP 288 Cb 0.21 -0.41 -0.03 0.00 -1.03 0.00 0.00 41.12 39.85 3g1r n ASP 288 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3g1r s PHE 289 N -1.63 -0.02 0.03 2.11 -0.71 -1.26 -5.18 117.98 111.30 3g1r s PHE 289 Ca 0.37 -0.36 -0.06 0.00 -1.04 0.00 0.00 56.93 55.83 3g1r s PHE 289 Cb 0.24 0.47 -0.01 0.00 -1.21 0.00 0.00 43.02 42.51 3g1r s PHE 289 CO 0.18 -1.06 0.11 -1.54 -1.34 0.00 0.00 175.22 171.57 3g1r s SER 290 N -2.93 0.12 0.08 1.98 1.04 -1.26 -5.03 113.70 107.71 3g1r s SER 290 Ca 0.13 -0.41 -0.18 0.00 0.48 0.00 0.00 55.95 55.98 3g1r s SER 290 Cb -0.03 0.22 -0.07 0.00 0.10 0.00 0.00 66.02 66.24 3g1r s SER 290 CO 0.04 -0.45 0.55 -0.76 0.98 0.00 0.00 173.24 173.60 3g1r s LEU 291 N -1.84 4.48 0.86 2.42 1.43 -1.26 -5.07 118.68 119.70 3g1r s LEU 291 Ca -0.09 1.20 -0.11 0.00 -1.03 0.00 0.00 54.13 54.10 3g1r s LEU 291 Cb -0.04 -2.96 0.11 0.00 0.03 0.00 0.00 46.19 43.34 3g1r s LEU 291 CO -0.02 0.24 1.09 0.42 0.23 0.00 0.00 176.35 178.31 3g1r s THR 292 N -1.19 2.82 0.26 5.49 -4.23 -1.26 -4.79 115.64 112.75 3g1r s THR 292 Ca 0.31 0.27 -0.05 0.00 -1.18 0.00 0.00 61.69 61.04 3g1r s THR 292 Cb -0.18 -2.70 0.23 0.00 1.34 0.00 0.00 72.50 71.19 3g1r s THR 292 CO 0.18 -0.35 1.90 -0.33 -0.54 0.00 0.00 174.62 175.49 3g1r h GLU 293 N -1.47 1.19 -0.36 3.99 5.08 -1.99 0.66 114.58 121.69 3g1r h GLU 293 Ca -0.47 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 57.66 3g1r h GLU 293 Cb 1.27 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 3g1r h GLU 293 CO 0.52 0.84 -0.24 1.05 -1.00 0.00 0.00 179.01 180.18 3g1r h GLU 294 N 1.20 0.71 -0.51 2.33 4.11 -1.99 0.10 114.58 120.54 3g1r h GLU 294 Ca 0.31 -0.29 -0.04 0.00 0.07 0.00 0.00 59.36 59.42 3g1r h GLU 294 Cb -0.04 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 3g1r h GLU 294 CO -0.06 0.89 0.18 0.93 0.07 0.00 0.00 179.01 181.02 3g1r h GLU 295 N 0.62 0.78 -0.65 1.06 5.08 -1.76 -0.63 114.58 119.08 3g1r h GLU 295 Ca 0.08 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3g1r h GLU 295 Cb 0.74 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 3g1r h GLU 295 CO 0.06 0.71 0.41 0.52 -1.00 0.00 0.00 179.01 179.70 3g1r h MET 296 N 0.68 0.87 -0.43 2.33 2.86 -0.52 -0.82 114.93 119.90 3g1r h MET 296 Ca 0.17 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 3g1r h MET 296 Cb 0.24 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 3g1r h MET 296 CO -0.01 0.60 0.25 0.87 1.06 0.00 0.00 176.91 179.68 3g1r h LYS 297 N 0.88 0.59 -0.22 1.72 1.57 -0.80 -1.43 116.57 118.87 3g1r h LYS 297 Ca 0.23 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.88 3g1r h LYS 297 Cb -0.06 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 3g1r h LYS 297 CO -0.05 0.45 -0.20 -0.44 -0.57 0.00 0.00 179.45 178.64 3g1r h ASP 298 N 0.56 0.39 -0.10 0.86 3.32 -0.81 -1.92 116.42 118.73 3g1r h ASP 298 Ca 0.15 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 3g1r h ASP 298 Cb 0.02 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3g1r h ASP 298 CO -0.03 0.60 -0.20 0.40 -1.72 0.00 0.00 179.24 178.29 3g1r h ILE 299 N 0.36 1.40 -0.35 0.35 2.04 -0.93 -3.05 117.51 117.32 3g1r h ILE 299 Ca 0.06 -1.50 0.04 0.00 1.00 0.00 0.00 64.86 64.46 3g1r h ILE 299 Cb 0.56 2.14 -0.02 0.00 -0.74 0.00 0.00 36.82 38.75 3g1r h ILE 299 CO 0.04 0.43 0.23 -0.08 0.00 0.00 0.00 178.15 178.77 3g1r h GLU 300 N -0.15 0.31 0.00 2.37 4.22 -1.16 -0.83 114.58 119.35 3g1r h GLU 300 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 3g1r h GLU 300 Cb 0.79 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.97 3g1r h GLU 300 CO 0.04 0.20 0.00 0.00 -2.18 0.00 0.00 179.01 177.08 3g1r n ALA 301 N -2.52 1.78 0.92 2.92 0.00 -0.73 -1.59 120.51 121.29 3g1r n ALA 301 Ca 0.03 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.53 3g1r n ALA 301 Cb 0.19 -1.24 0.55 0.00 0.00 0.00 0.00 19.45 18.96 3g1r n ALA 301 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3g1r n LEU 302 N -1.35 0.00 -4.64 0.00 4.77 -0.32 -4.89 117.00 110.58 3g1r n LEU 302 Ca 0.06 0.47 -0.53 0.00 -0.03 0.00 0.00 56.01 55.98 3g1r n LEU 302 Cb 0.13 -0.47 -0.06 0.00 -2.33 0.00 0.00 43.42 40.69 3g1r n LEU 302 CO 0.12 -0.06 1.09 -3.20 -1.33 0.00 0.00 177.39 174.00 3g1r n ASN 303 N -1.47 2.10 -0.00 -1.43 5.15 -0.62 -4.45 115.26 114.53 3g1r n ASN 303 Ca 0.07 1.09 0.07 0.00 -0.60 0.00 0.00 54.58 55.21 3g1r n ASN 303 Cb 0.28 -1.20 -0.09 0.00 -0.53 0.00 0.00 39.78 38.24 3g1r n ASN 303 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3g1r n LYS 304 N 3.71 1.84 -2.50 1.20 5.02 -0.00 -4.97 118.16 122.45 3g1r n LYS 304 Ca 0.21 -0.03 -0.18 0.00 -2.02 0.00 0.00 58.31 56.30 3g1r n LYS 304 Cb 0.19 -1.22 -0.00 0.00 -0.02 0.00 0.00 35.03 33.97 3g1r n LYS 304 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3g1r n ASN 305 N -1.48 -5.07 -4.13 4.39 3.02 -1.19 -4.98 115.26 105.82 3g1r n ASN 305 Ca 0.02 0.03 -0.30 0.00 -0.03 0.00 0.00 54.58 54.30 3g1r n ASN 305 Cb 0.26 -4.23 -0.17 0.00 -0.61 0.00 0.00 39.78 35.03 3g1r n ASN 305 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3g1r s VAL 306 N -2.88 1.76 0.07 2.41 1.01 -1.26 -5.10 120.40 116.42 3g1r s VAL 306 Ca 0.04 -0.83 -0.19 0.00 0.00 0.00 0.00 61.98 61.00 3g1r s VAL 306 Cb -0.02 -1.56 -0.07 0.00 0.00 0.00 0.00 36.38 34.74 3g1r s VAL 306 CO 0.05 0.49 0.56 -0.13 0.00 0.00 0.00 175.10 176.07 3g1r s ARG 307 N 0.66 4.18 0.22 2.72 0.52 -1.26 -4.58 118.95 121.40 3g1r s ARG 307 Ca -0.13 0.71 0.11 0.00 -0.52 0.00 0.00 55.73 55.90 3g1r s ARG 307 Cb -0.16 -3.23 0.14 0.00 0.52 0.00 0.00 34.95 32.22 3g1r s ARG 307 CO 0.03 0.64 1.48 0.74 0.02 0.00 0.00 175.30 178.21 3g1r h PHE 308 N 4.52 0.00 -3.50 -0.53 -1.00 -1.94 -3.42 116.94 111.07 3g1r h PHE 308 Ca -0.50 0.00 -0.69 0.00 2.81 0.00 0.00 57.97 59.59 3g1r h PHE 308 Cb 1.21 0.00 -0.35 0.00 3.61 0.00 0.00 35.95 40.42 3g1r h PHE 308 CO 0.68 0.73 -0.49 0.08 -1.61 0.00 0.00 178.31 177.70 3g1r s VAL 309 N -3.18 3.42 -0.17 -0.55 1.01 -1.26 -0.40 120.40 119.27 3g1r s VAL 309 Ca 0.00 -2.40 0.15 0.00 0.00 0.00 0.00 61.98 59.73 3g1r s VAL 309 Cb 0.11 -3.30 -0.21 0.00 0.00 0.00 0.00 36.38 32.97 3g1r s VAL 309 CO 0.77 -0.76 0.06 -0.62 0.00 0.00 0.00 175.10 174.56 3g1r n GLU 310 N 4.17 1.19 -3.62 2.72 1.02 -1.26 -5.02 120.64 119.83 3g1r n GLU 310 Ca 0.01 -0.01 -0.21 0.00 -0.02 0.00 0.00 57.16 56.94 3g1r n GLU 310 Cb 0.40 -1.44 0.05 0.00 -0.02 0.00 0.00 31.44 30.42 3g1r n GLU 310 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3g1r n LEU 311 N -2.63 -3.42 0.22 -4.62 4.77 -1.26 -4.87 117.00 105.20 3g1r n LEU 311 Ca -0.28 -0.79 0.05 0.00 -0.03 0.00 0.00 56.01 54.97 3g1r n LEU 311 Cb 1.05 -2.77 0.51 0.00 -2.33 0.00 0.00 43.42 39.88 3g1r n LEU 311 CO 0.36 0.39 0.90 -0.07 -1.33 0.00 0.00 177.39 177.64 3g1r h LEU 312 N -1.82 0.00 -2.13 2.23 3.38 -1.95 -2.11 115.31 112.90 3g1r h LEU 312 Ca -0.61 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.38 3g1r h LEU 312 Cb 1.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 3g1r h LEU 312 CO 0.54 0.18 0.30 0.24 0.09 0.00 0.00 178.44 179.79 3g1r h MET 313 N 0.00 0.00 -0.12 1.13 2.86 -2.01 -1.52 114.93 115.27 3g1r h MET 313 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1r h MET 313 Cb 0.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.98 3g1r h MET 313 CO 0.02 0.00 0.00 0.91 1.06 0.00 0.00 176.91 178.90 3g1r n TRP 314 N -3.13 0.41 0.30 -0.22 8.01 -0.79 -4.64 117.44 117.37 3g1r n TRP 314 Ca -0.00 -0.92 0.16 0.00 -1.31 0.00 0.00 57.50 55.43 3g1r n TRP 314 Cb 0.38 -0.21 0.92 0.00 -2.01 0.00 0.00 31.31 30.38 3g1r n TRP 314 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3g1r h ARG 315 N 0.82 0.00 -0.00 -0.99 3.08 -1.38 -2.36 114.38 113.55 3g1r h ARG 315 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g1r h ARG 315 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 3g1r h ARG 315 CO 0.09 0.04 -0.42 -0.40 -1.07 0.00 0.00 179.97 178.21 3g1r n ASP 316 N -3.59 0.65 -4.74 7.04 5.75 -1.26 -4.82 116.55 115.58 3g1r n ASP 316 Ca -0.02 -0.44 -0.41 0.00 -0.01 0.00 0.00 54.79 53.91 3g1r n ASP 316 Cb 0.13 0.20 -0.03 0.00 -1.03 0.00 0.00 41.12 40.40 3g1r n ASP 316 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 3g1r s HIS 317 N -2.84 3.33 0.61 2.11 2.46 -0.89 -4.91 115.29 115.16 3g1r s HIS 317 Ca 0.15 1.37 0.30 0.00 0.47 0.00 0.00 55.06 57.35 3g1r s HIS 317 Cb 0.18 -3.51 1.64 0.00 -0.13 0.00 0.00 32.58 30.75 3g1r s HIS 317 CO 0.64 -1.48 2.02 -1.35 -2.47 0.00 0.00 174.74 172.10 3g1r h PRO 318 N 4.98 0.00 -0.58 2.88 0.11 -1.89 -1.43 132.00 136.07 3g1r h PRO 318 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3g1r h PRO 318 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3g1r h PRO 318 CO 0.74 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.92 3g1r n GLU 319 N -3.59 3.43 -1.66 1.05 -0.58 -1.26 -4.96 120.64 113.07 3g1r n GLU 319 Ca 0.03 -2.75 -0.51 0.00 -0.42 0.00 0.00 57.16 53.51 3g1r n GLU 319 Cb 0.43 -1.76 -0.05 0.00 -0.57 0.00 0.00 31.44 29.48 3g1r n GLU 319 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 3g1r n TYR 320 N 0.96 2.01 0.64 -0.32 9.36 -0.54 -4.46 117.16 124.80 3g1r n TYR 320 Ca 0.23 0.38 0.12 0.00 3.32 0.00 0.00 57.90 61.95 3g1r n TYR 320 Cb 0.80 -2.49 0.22 0.00 -0.63 0.00 0.00 39.34 37.24 3g1r n TYR 320 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3g1r n PRO 321 N 4.27 0.25 -0.32 2.98 -0.04 -1.26 -4.29 135.00 136.59 3g1r n PRO 321 Ca 0.21 0.09 0.09 0.00 -0.04 0.00 0.00 63.50 63.85 3g1r n PRO 321 Cb 0.22 -1.67 0.26 0.00 -0.04 0.00 0.00 33.50 32.27 3g1r n PRO 321 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3g1r n PHE 322 N -2.04 0.83 -0.03 0.54 0.99 -1.26 -4.18 117.46 112.31 3g1r n PHE 322 Ca 0.04 -0.52 -0.13 0.00 -0.00 0.00 0.00 57.45 56.84 3g1r n PHE 322 Cb 0.42 -0.04 -0.10 0.00 -1.00 0.00 0.00 39.48 38.77 3g1r n PHE 322 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3g1r h HIS 323 N 3.34 0.13 -4.22 1.38 3.86 -1.98 -3.46 115.15 114.20 3g1r h HIS 323 Ca 0.00 -0.04 -0.53 0.00 -1.16 0.00 0.00 60.37 58.64 3g1r h HIS 323 Cb 0.94 -0.02 0.18 0.00 1.06 0.00 0.00 27.41 29.57 3g1r h HIS 323 CO 0.42 0.62 0.32 -0.51 0.86 0.00 0.00 177.93 179.63 3g1r s ASP 324 N -5.88 3.57 0.15 2.45 1.11 -1.26 -4.92 116.67 111.90 3g1r s ASP 324 Ca -0.16 2.28 -0.16 0.00 0.18 0.00 0.00 52.55 54.69 3g1r s ASP 324 Cb 0.02 -2.58 0.05 0.00 1.07 0.00 0.00 42.92 41.48 3g1r s ASP 324 CO 0.70 -2.67 1.76 -0.08 1.18 0.00 0.00 175.17 176.06 3g1r h GLU 325 N -1.07 0.31 0.00 8.23 4.81 -1.92 -3.52 114.58 121.42 3g1r h GLU 325 Ca -0.45 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3g1r h GLU 325 Cb 1.28 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.60 3g1r h GLU 325 CO 0.46 0.20 0.00 2.48 -0.73 0.00 0.00 179.01 181.42