#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 2.05 0.21 -2.67 1.43 -1.26 -4.88 118.68 113.57 3g1r s LEU 3 Ca 0.00 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 3g1r s LEU 3 Cb 0.00 -1.32 -0.05 0.00 0.03 0.00 0.00 46.19 44.85 3g1r s LEU 3 CO 0.00 0.25 0.08 -0.94 0.23 0.00 0.00 176.35 175.97 3g1r s SER 4 N -0.24 0.90 0.26 2.29 1.04 -0.08 -4.94 113.70 112.94 3g1r s SER 4 Ca -0.01 -1.32 -0.02 0.00 0.48 0.00 0.00 55.95 55.08 3g1r s SER 4 Cb -0.13 0.21 0.44 0.00 0.10 0.00 0.00 66.02 66.64 3g1r s SER 4 CO 0.03 -0.72 1.86 0.00 0.98 0.00 0.00 173.24 175.39 3g1r h ALA 5 N 2.55 1.37 0.00 5.32 0.00 -1.94 -2.57 119.26 123.99 3g1r h ALA 5 Ca -0.37 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.38 3g1r h ALA 5 Cb 1.23 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3g1r h ALA 5 CO 0.59 0.32 -0.75 0.00 0.00 0.00 0.00 179.25 179.41 3g1r h ALA 6 N 1.47 0.58 -2.52 0.00 0.00 -1.96 -3.43 119.26 113.41 3g1r h ALA 6 Ca 0.44 -0.69 -0.37 0.00 0.00 0.00 0.00 54.91 54.30 3g1r h ALA 6 Cb 0.28 -0.12 -0.36 0.00 0.00 0.00 0.00 17.79 17.58 3g1r h ALA 6 CO -0.21 0.94 -0.66 0.45 0.00 0.00 0.00 179.25 179.77 3g1r s SER 7 N -6.63 1.87 -0.20 0.00 0.15 -0.97 -5.00 113.70 102.92 3g1r s SER 7 Ca 0.01 -0.55 0.21 0.00 0.70 0.00 0.00 55.95 56.32 3g1r s SER 7 Cb 0.10 0.24 0.44 0.00 -1.71 0.00 0.00 66.02 65.09 3g1r s SER 7 CO 0.78 -0.36 1.19 0.00 1.20 0.00 0.00 173.24 176.04 3g1r n HIS 8 N 5.30 0.35 -3.29 3.44 -0.00 -1.22 -0.90 115.22 118.91 3g1r n HIS 8 Ca -0.05 -1.58 -0.39 0.00 -0.00 0.00 0.00 57.72 55.70 3g1r n HIS 8 Cb 0.48 0.12 -0.06 0.00 -0.00 0.00 0.00 29.99 30.53 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 -2.05 4.20 0.19 -1.40 0.52 -1.26 -0.69 118.95 118.46 3g1r s ARG 9 Ca 0.24 0.67 0.10 0.00 -0.52 0.00 0.00 55.73 56.23 3g1r s ARG 9 Cb 0.34 -3.27 -0.04 0.00 0.52 0.00 0.00 34.95 32.49 3g1r s ARG 9 CO -0.08 0.55 -0.16 0.96 0.02 0.00 0.00 175.30 176.58 3g1r s ILE 10 N -0.77 2.78 0.28 1.52 -4.36 -0.21 -4.86 121.20 115.58 3g1r s ILE 10 Ca 0.29 -1.88 -0.29 0.00 -0.26 0.00 0.00 60.65 58.51 3g1r s ILE 10 Cb -0.19 -2.37 -0.09 0.00 1.25 0.00 0.00 42.46 41.07 3g1r s ILE 10 CO 0.17 -0.14 1.01 -2.16 0.24 0.00 0.00 174.94 174.06 3g1r s PRO 11 N -2.82 4.66 0.15 0.37 0.04 -1.26 -0.96 135.00 135.18 3g1r s PRO 11 Ca 0.23 1.58 0.03 0.00 0.04 0.00 0.00 61.00 62.88 3g1r s PRO 11 Cb -0.08 -3.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.33 3g1r s PRO 11 CO 0.13 0.30 0.28 -0.51 0.04 0.00 0.00 177.00 177.24 3g1r s LEU 12 N -1.57 4.32 0.42 -3.56 1.43 -0.07 -4.87 118.68 114.78 3g1r s LEU 12 Ca 0.45 0.16 0.30 0.00 -1.03 0.00 0.00 54.13 54.01 3g1r s LEU 12 Cb -0.27 -2.89 1.35 0.00 0.03 0.00 0.00 46.19 44.41 3g1r s LEU 12 CO 0.33 0.05 1.89 0.77 0.23 0.00 0.00 176.35 179.62 3g1r h SER 13 N 2.14 0.00 -0.35 2.29 4.64 -1.84 -1.83 113.55 118.60 3g1r h SER 13 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3g1r h SER 13 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3g1r h SER 13 CO 0.68 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.74 3g1r n ASP 14 N -2.63 1.93 0.00 4.97 5.75 -1.26 -4.90 116.55 120.41 3g1r n ASP 14 Ca 0.00 -1.97 0.00 0.00 -0.01 0.00 0.00 54.79 52.81 3g1r n ASP 14 Cb 0.20 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 3g1r n ASP 14 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3g1r n GLY 15 N 1.09 1.22 2.27 6.12 0.00 -0.69 -5.05 105.19 110.16 3g1r n GLY 15 Ca 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 3g1r n GLY 15 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3g1r n ASN 16 N 0.00 0.16 -3.95 1.61 5.15 -1.25 -4.87 115.26 112.11 3g1r n ASN 16 Ca 0.00 -1.34 -0.08 0.00 -0.60 0.00 0.00 54.58 52.56 3g1r n ASN 16 Cb 0.00 -0.57 -0.09 0.00 -0.53 0.00 0.00 39.78 38.59 3g1r n ASN 16 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3g1r s SER 17 N -3.79 0.25 -0.05 1.20 1.04 -1.26 -0.89 113.70 110.20 3g1r s SER 17 Ca 0.44 -0.71 0.02 0.00 0.48 0.00 0.00 55.95 56.17 3g1r s SER 17 Cb -0.01 0.26 0.02 0.00 0.10 0.00 0.00 66.02 66.38 3g1r s SER 17 CO 0.30 -0.61 -0.08 -0.51 0.98 0.00 0.00 173.24 173.32 3g1r s ILE 18 N -3.44 0.75 0.18 -1.02 2.07 -0.13 -4.88 121.20 114.72 3g1r s ILE 18 Ca 0.02 -0.27 -0.32 0.00 -1.41 0.00 0.00 60.65 58.67 3g1r s ILE 18 Cb 0.04 -0.72 -0.11 0.00 0.13 0.00 0.00 42.46 41.79 3g1r s ILE 18 CO -0.08 0.27 1.74 -2.84 -1.91 0.00 0.00 174.94 172.11 3g1r s PRO 19 N 0.70 4.14 0.26 3.50 0.02 -1.26 -1.04 135.00 141.32 3g1r s PRO 19 Ca -0.11 2.57 0.23 0.00 0.02 0.00 0.00 61.00 63.71 3g1r s PRO 19 Cb -0.14 -3.25 0.99 0.00 0.02 0.00 0.00 34.50 32.13 3g1r s PRO 19 CO 0.01 -0.76 1.71 1.51 -0.33 0.00 0.00 177.00 179.14 3g1r n ILE 20 N 4.22 0.84 -5.07 2.83 3.06 0.13 -4.44 119.36 120.94 3g1r n ILE 20 Ca 0.16 0.26 -0.28 0.00 -2.50 0.00 0.00 62.75 60.39 3g1r n ILE 20 Cb 0.36 -1.20 -0.16 0.00 0.54 0.00 0.00 39.64 39.19 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 -3.33 1.73 0.20 9.51 2.07 -1.26 -0.96 121.20 129.16 3g1r s ILE 21 Ca 0.04 -0.95 0.01 0.00 -1.41 0.00 0.00 60.65 58.33 3g1r s ILE 21 Cb 0.09 -1.44 -0.05 0.00 0.13 0.00 0.00 42.46 41.19 3g1r s ILE 21 CO 0.38 0.48 0.06 -0.83 -1.91 0.00 0.00 174.94 173.12 3g1r s GLY 22 N -0.55 1.41 -0.24 1.50 0.00 0.02 -4.27 107.32 105.19 3g1r s GLY 22 Ca 0.08 -1.69 -0.18 0.00 0.00 0.00 0.00 44.72 42.94 3g1r s GLY 22 CO -0.01 -1.51 0.50 -2.27 0.00 0.00 0.00 173.10 169.82 3g1r s LEU 23 N -3.20 4.09 0.46 0.66 2.96 0.09 -3.18 118.68 120.54 3g1r s LEU 23 Ca 0.31 0.56 -0.22 0.00 -0.22 0.00 0.00 54.13 54.57 3g1r s LEU 23 Cb 0.07 -2.66 -0.09 0.00 0.50 0.00 0.00 46.19 44.01 3g1r s LEU 23 CO 0.08 -0.24 1.04 -0.83 -1.32 0.00 0.00 176.35 175.09 3g1r s GLY 24 N 1.39 2.58 0.00 7.98 0.00 -0.06 -0.79 107.32 118.43 3g1r s GLY 24 Ca 0.22 0.63 0.00 0.00 0.00 0.00 0.00 44.72 45.57 3g1r s GLY 24 CO 0.09 0.99 0.63 -1.30 0.00 0.00 0.00 173.10 173.51 3g1r n THR 25 N -0.66 0.39 -2.18 0.90 -2.24 -1.02 -4.24 114.28 105.23 3g1r n THR 25 Ca 0.08 -0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 60.98 3g1r n THR 25 Cb 0.52 0.93 -0.03 0.00 -2.10 0.00 0.00 70.33 69.65 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 -0.39 3.23 -0.13 4.78 5.04 -1.26 -4.97 117.35 123.65 3g1r s TYR 26 Ca 0.00 1.12 -0.11 0.00 -2.44 0.00 0.00 57.07 55.64 3g1r s TYR 26 Cb 0.00 -3.65 0.04 0.00 0.35 0.00 0.00 41.96 38.70 3g1r s TYR 26 CO 0.00 -2.11 0.33 0.45 -1.34 0.00 0.00 175.55 172.88 3g1r s SER 27 N 0.56 -0.36 -0.28 4.32 0.15 -1.26 -5.01 113.70 111.83 3g1r s SER 27 Ca 0.59 0.68 -0.35 0.00 0.70 0.00 0.00 55.95 57.57 3g1r s SER 27 Cb -0.37 0.67 -0.11 0.00 -1.71 0.00 0.00 66.02 64.49 3g1r s SER 27 CO 0.36 -0.13 2.07 1.21 1.20 0.00 0.00 173.24 177.96 3g1r n GLU 28 N 3.12 1.37 -0.12 5.44 2.13 -1.26 -4.84 120.64 126.48 3g1r n GLU 28 Ca -0.15 0.43 -0.06 0.00 0.66 0.00 0.00 57.16 58.04 3g1r n GLU 28 Cb 0.57 -2.51 0.02 0.00 0.27 0.00 0.00 31.44 29.79 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 11.28 0.34 -0.01 5.31 0.11 -1.92 -1.71 132.00 145.40 3g1r h PRO 29 Ca -0.35 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.74 3g1r h PRO 29 Cb 1.30 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3g1r h PRO 29 CO 0.99 0.22 -0.00 0.87 -0.21 0.00 0.00 178.00 179.87 3g1r h LYS 30 N 0.35 0.01 -0.01 1.05 1.79 -2.00 -3.10 116.57 114.66 3g1r h LYS 30 Ca 0.17 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.64 3g1r h LYS 30 Cb 0.12 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 3g1r h LYS 30 CO -0.15 0.01 -0.20 -1.13 -1.08 0.00 0.00 179.45 176.91 3g1r n SER 31 N -4.53 1.31 -4.71 0.86 3.41 -1.01 -4.98 113.62 103.96 3g1r n SER 31 Ca -0.03 -1.15 -0.37 0.00 -0.26 0.00 0.00 58.87 57.06 3g1r n SER 31 Cb 0.10 0.43 -0.07 0.00 -0.26 0.00 0.00 64.21 64.40 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 -1.36 5.30 0.36 6.66 2.01 -0.67 -5.04 115.64 122.89 3g1r s THR 32 Ca 0.09 0.53 -0.28 0.00 0.31 0.00 0.00 61.69 62.34 3g1r s THR 32 Cb 0.09 -3.63 -0.11 0.00 0.01 0.00 0.00 72.50 68.85 3g1r s THR 32 CO 0.25 0.36 1.48 -2.16 -0.69 0.00 0.00 174.62 173.87 3g1r s PRO 33 N 0.66 4.14 0.49 4.92 0.04 -1.26 -4.95 135.00 139.04 3g1r s PRO 33 Ca 0.16 2.52 -0.24 0.00 0.04 0.00 0.00 61.00 63.48 3g1r s PRO 33 Cb -0.13 -2.99 -0.07 0.00 0.04 0.00 0.00 34.50 31.35 3g1r s PRO 33 CO 0.04 -0.50 1.41 1.63 0.04 0.00 0.00 177.00 179.62 3g1r n LYS 34 N 0.79 2.05 0.00 4.56 4.76 -1.26 -2.57 118.16 126.49 3g1r n LYS 34 Ca 0.02 0.74 0.00 0.00 -2.87 0.00 0.00 58.31 56.20 3g1r n LYS 34 Cb 0.39 -2.62 0.00 0.00 -1.84 0.00 0.00 35.03 30.96 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 0.64 2.98 0.29 0.72 0.00 -1.26 -4.90 105.19 103.65 3g1r n GLY 35 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 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 0.91 -0.12 4.61 0.00 -1.88 -0.76 119.26 122.02 3g1r h ALA 36 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3g1r h ALA 36 Cb 0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 3g1r h ALA 36 CO 0.00 0.38 0.03 0.00 0.00 0.00 0.00 179.25 179.66 3g1r h ALA 38 N 0.84 0.43 -0.53 0.00 0.00 -1.66 0.05 119.26 118.40 3g1r h ALA 38 Ca 0.04 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3g1r h ALA 38 Cb 0.23 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3g1r h ALA 38 CO -0.00 -0.32 0.33 1.15 0.00 0.00 0.00 179.25 180.42 3g1r h THR 39 N 0.22 1.15 -0.59 0.00 2.02 -1.06 -2.08 112.91 112.56 3g1r h THR 39 Ca 0.19 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 67.01 3g1r h THR 39 Cb 0.22 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 3g1r h THR 39 CO -0.25 0.15 0.18 0.28 0.37 0.00 0.00 175.52 176.25 3g1r h SER 40 N 0.71 0.86 -0.63 4.18 0.02 -0.74 -0.71 113.55 117.24 3g1r h SER 40 Ca 0.19 -0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 60.87 3g1r h SER 40 Cb -0.04 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 3g1r h SER 40 CO -0.04 0.84 0.16 0.58 -1.14 0.00 0.00 176.83 177.24 3g1r h VAL 41 N 0.83 1.25 -0.20 2.27 2.07 -0.80 0.27 116.25 121.94 3g1r h VAL 41 Ca 0.19 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 3g1r h VAL 41 Cb 0.29 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3g1r h VAL 41 CO -0.01 0.35 0.07 0.11 0.02 0.00 0.00 177.57 178.12 3g1r h LYS 42 N 0.98 0.30 -0.64 1.57 1.57 -0.99 -1.13 116.57 118.22 3g1r h LYS 42 Ca 0.21 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.96 3g1r h LYS 42 Cb 0.34 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 3g1r h LYS 42 CO -0.00 0.38 0.40 0.28 -0.57 0.00 0.00 179.45 179.94 3g1r h VAL 43 N 0.16 1.09 -0.17 0.50 2.07 -0.90 -0.63 116.25 118.36 3g1r h VAL 43 Ca 0.06 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.32 3g1r h VAL 43 Cb 0.20 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 3g1r h VAL 43 CO -0.00 0.14 0.08 0.00 0.02 0.00 0.00 177.57 177.81 3g1r h ALA 44 N 1.27 0.20 -0.55 1.67 0.00 -0.76 -0.16 119.26 120.93 3g1r h ALA 44 Ca 0.26 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 3g1r h ALA 44 Cb 0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3g1r h ALA 44 CO -0.10 -0.35 0.30 0.82 0.00 0.00 0.00 179.25 179.92 3g1r h ILE 45 N 0.17 1.18 -0.53 0.00 2.04 -0.92 -0.41 117.51 119.04 3g1r h ILE 45 Ca 0.07 -0.45 0.06 0.00 1.00 0.00 0.00 64.86 65.54 3g1r h ILE 45 Cb 0.02 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 3g1r h ILE 45 CO -0.06 0.19 0.35 0.44 0.00 0.00 0.00 178.15 179.08 3g1r h ASP 46 N 0.73 0.42 1.05 1.72 3.32 -0.85 -2.35 116.42 120.46 3g1r h ASP 46 Ca 0.19 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.15 3g1r h ASP 46 Cb 0.04 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 3g1r h ASP 46 CO -0.03 0.28 -0.46 0.74 -1.72 0.00 0.00 179.24 178.04 3g1r h THR 47 N 0.48 0.95 0.00 0.35 2.02 0.02 -3.47 112.91 113.27 3g1r h THR 47 Ca 0.23 -1.88 0.00 0.00 0.77 0.00 0.00 66.41 65.53 3g1r h THR 47 Cb 0.29 2.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 3g1r h THR 47 CO -0.06 0.45 0.00 0.61 0.37 0.00 0.00 175.52 176.89 3g1r n GLY 48 N 0.61 0.67 3.78 2.16 0.00 -0.70 -5.09 105.19 106.62 3g1r n GLY 48 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.17 2.77 -0.01 1.61 1.51 -0.27 -4.91 117.35 116.89 3g1r s TYR 49 Ca 0.00 1.27 0.02 0.00 -1.01 0.00 0.00 57.07 57.35 3g1r s TYR 49 Cb 0.00 -3.88 0.03 0.00 -0.11 0.00 0.00 41.96 38.00 3g1r s TYR 49 CO 0.00 -2.53 0.88 0.54 -1.11 0.00 0.00 175.55 173.33 3g1r n ARG 50 N 0.59 1.87 -4.03 -0.62 5.12 -1.26 -4.22 116.66 114.12 3g1r n ARG 50 Ca 0.01 -1.31 -0.20 0.00 -1.93 0.00 0.00 57.85 54.41 3g1r n ARG 50 Cb 0.40 -0.89 -0.17 0.00 -1.16 0.00 0.00 32.46 30.65 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 -0.87 0.65 -0.06 -1.55 2.46 -1.26 -0.16 115.29 114.50 3g1r s HIS 51 Ca 0.03 -0.16 0.04 0.00 0.47 0.00 0.00 55.06 55.44 3g1r s HIS 51 Cb 0.03 -0.65 -0.00 0.00 -0.13 0.00 0.00 32.58 31.83 3g1r s HIS 51 CO 0.00 -0.21 -0.19 0.42 -2.47 0.00 0.00 174.74 172.29 3g1r s ILE 52 N 1.15 1.65 -0.17 0.89 -1.09 -0.14 -0.73 121.20 122.75 3g1r s ILE 52 Ca -0.07 -0.82 -0.04 0.00 -2.23 0.00 0.00 60.65 57.49 3g1r s ILE 52 Cb -0.14 -1.42 -0.02 0.00 -1.58 0.00 0.00 42.46 39.30 3g1r s ILE 52 CO -0.01 0.47 -0.04 -0.62 -1.23 0.00 0.00 174.94 173.51 3g1r s ASP 53 N 0.15 4.65 0.02 3.58 2.15 0.03 -1.68 116.67 125.58 3g1r s ASP 53 Ca -0.09 -0.21 -0.00 0.00 0.43 0.00 0.00 52.55 52.69 3g1r s ASP 53 Cb -0.14 -1.77 0.00 0.00 -0.30 0.00 0.00 42.92 40.71 3g1r s ASP 53 CO 0.04 0.11 0.03 0.61 -0.17 0.00 0.00 175.17 175.79 3g1r n GLY 54 N 3.92 3.21 3.62 2.66 0.00 -0.26 -2.45 105.19 115.90 3g1r n GLY 54 Ca -0.17 -1.43 -0.08 0.00 0.00 0.00 0.00 46.02 44.33 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 -1.71 -2.00 0.27 4.61 0.00 -1.26 -4.02 121.76 117.65 3g1r s ALA 55 Ca 0.02 1.77 -0.00 0.00 0.00 0.00 0.00 51.96 53.75 3g1r s ALA 55 Cb -0.00 -1.29 0.52 0.00 0.00 0.00 0.00 23.12 22.35 3g1r s ALA 55 CO 0.01 -0.24 1.82 -0.92 0.00 0.00 0.00 175.76 176.44 3g1r h TYR 56 N 3.51 1.05 0.00 0.00 3.20 -1.98 -1.12 116.97 121.63 3g1r h TYR 56 Ca -0.24 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.66 3g1r h TYR 56 Cb 1.18 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 39.12 3g1r h TYR 56 CO 0.29 0.40 0.00 0.44 -1.64 0.00 0.00 178.16 177.66 3g1r n ILE 57 N -4.67 0.74 0.71 1.81 -5.35 -1.26 -1.70 119.36 109.63 3g1r n ILE 57 Ca 0.18 0.19 0.11 0.00 -0.27 0.00 0.00 62.75 62.95 3g1r n ILE 57 Cb 0.35 -0.92 0.47 0.00 -1.74 0.00 0.00 39.64 37.80 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 0.19 -0.90 4.28 4.01 -0.42 -4.90 117.16 118.02 3g1r n TYR 58 Ca 0.06 0.07 0.00 0.00 -0.16 0.00 0.00 57.90 57.86 3g1r n TYR 58 Cb 0.16 -0.61 0.00 0.00 -0.31 0.00 0.00 39.34 38.58 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 -1.67 -0.10 -0.24 -0.72 1.13 -0.69 -4.75 117.38 110.34 3g1r n GLN 59 Ca 0.05 0.02 0.05 0.00 -1.94 0.00 0.00 57.00 55.19 3g1r n GLN 59 Cb 0.27 -3.09 0.07 0.00 0.11 0.00 0.00 30.24 27.61 3g1r n GLN 59 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 3g1r n ASN 60 N -0.05 1.32 0.19 1.08 0.23 -1.26 -4.79 115.26 111.98 3g1r n ASN 60 Ca 0.00 -2.56 0.06 0.00 -0.53 0.00 0.00 54.58 51.55 3g1r n ASN 60 Cb 0.02 -0.31 0.54 0.00 -2.08 0.00 0.00 39.78 37.96 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 0.13 -0.30 -3.83 4.81 -1.83 -0.66 114.58 112.90 3g1r h GLU 61 Ca 0.00 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 3g1r h GLU 61 Cb 1.14 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 3g1r h GLU 61 CO 0.00 0.15 -0.11 1.12 -0.73 0.00 0.00 179.01 179.44 3g1r h HIS 62 N 0.13 0.54 -0.34 0.92 2.07 -1.87 -2.35 115.15 114.26 3g1r h HIS 62 Ca 0.03 -0.08 -0.09 0.00 -2.85 0.00 0.00 60.37 57.38 3g1r h HIS 62 Cb 0.10 -0.15 -0.02 0.00 2.57 0.00 0.00 27.41 29.91 3g1r h HIS 62 CO 0.00 0.60 -0.18 0.93 -3.07 0.00 0.00 177.93 176.21 3g1r h GLU 63 N 0.47 0.63 -0.22 5.12 5.08 -1.47 -0.77 114.58 123.42 3g1r h GLU 63 Ca 0.09 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3g1r h GLU 63 Cb 0.47 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3g1r h GLU 63 CO 0.03 0.77 0.13 0.28 -1.00 0.00 0.00 179.01 179.22 3g1r h VAL 64 N 0.56 1.10 -0.83 3.13 2.07 -1.15 -2.14 116.25 118.99 3g1r h VAL 64 Ca 0.09 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 3g1r h VAL 64 Cb 0.63 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3g1r h VAL 64 CO 0.04 0.10 0.49 1.23 0.02 0.00 0.00 177.57 179.45 3g1r h GLY 65 N 0.26 1.22 0.72 2.17 0.00 -1.22 -1.32 103.07 104.90 3g1r h GLY 65 Ca 0.08 -0.52 0.04 0.00 0.00 0.00 0.00 47.33 46.93 3g1r h GLY 65 CO -0.01 0.50 0.20 0.83 0.00 0.00 0.00 176.54 178.06 3g1r h GLU 66 N 1.15 0.39 -0.33 4.80 5.08 -0.92 -0.40 114.58 124.35 3g1r h GLU 66 Ca 0.30 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.53 3g1r h GLU 66 Cb -0.03 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3g1r h GLU 66 CO -0.05 0.26 -0.22 0.00 -1.00 0.00 0.00 179.01 178.00 3g1r h ALA 67 N 1.25 0.47 -0.15 3.43 0.00 -1.11 -1.58 119.26 121.56 3g1r h ALA 67 Ca 0.19 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3g1r h ALA 67 Cb 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3g1r h ALA 67 CO -0.16 0.43 0.08 0.82 0.00 0.00 0.00 179.25 180.42 3g1r h ILE 68 N 0.49 1.12 -0.35 0.00 2.04 -1.05 -1.59 117.51 118.17 3g1r h ILE 68 Ca 0.07 -0.34 -0.07 0.00 1.00 0.00 0.00 64.86 65.52 3g1r h ILE 68 Cb 0.77 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 3g1r h ILE 68 CO 0.06 0.11 -0.07 0.03 0.00 0.00 0.00 178.15 178.28 3g1r h ARG 69 N 0.13 0.58 -0.39 2.37 3.08 -1.07 -1.21 114.38 117.86 3g1r h ARG 69 Ca 0.05 -0.16 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 3g1r h ARG 69 Cb 0.11 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 3g1r h ARG 69 CO -0.01 0.65 -0.07 1.49 -1.07 0.00 0.00 179.97 180.96 3g1r h GLU 70 N 0.54 0.73 -0.10 0.04 4.81 -1.07 -0.30 114.58 119.22 3g1r h GLU 70 Ca 0.10 -0.27 -0.09 0.00 -0.13 0.00 0.00 59.36 58.97 3g1r h GLU 70 Cb 0.46 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 3g1r h GLU 70 CO 0.02 0.87 -0.34 0.87 -0.73 0.00 0.00 179.01 179.70 3g1r h LYS 71 N 0.54 0.20 -0.38 1.92 1.79 -0.98 -0.53 116.57 119.14 3g1r h LYS 71 Ca 0.10 -0.08 -0.13 0.00 -2.18 0.00 0.00 60.65 58.36 3g1r h LYS 71 Cb 0.58 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.21 3g1r h LYS 71 CO 0.03 0.52 -0.26 0.82 -1.08 0.00 0.00 179.45 179.49 3g1r h ILE 72 N 0.18 1.28 -0.47 1.86 2.04 -1.06 -1.54 117.51 119.80 3g1r h ILE 72 Ca 0.02 -1.42 -0.07 0.00 1.00 0.00 0.00 64.86 64.39 3g1r h ILE 72 Cb 0.69 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 3g1r h ILE 72 CO 0.05 0.47 0.01 0.00 0.00 0.00 0.00 178.15 178.68 3g1r h ALA 73 N 0.78 1.14 -0.01 1.87 0.00 -0.49 -2.08 119.26 120.48 3g1r h ALA 73 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3g1r h ALA 73 Cb 0.84 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3g1r h ALA 73 CO 0.07 0.56 0.00 -0.85 0.00 0.00 0.00 179.25 179.03 3g1r n GLU 74 N -4.23 1.14 -0.95 0.00 0.28 -0.26 -4.88 120.64 111.74 3g1r n GLU 74 Ca 0.03 -0.20 0.00 0.00 -0.16 0.00 0.00 57.16 56.82 3g1r n GLU 74 Cb 0.29 -1.45 0.00 0.00 1.43 0.00 0.00 31.44 31.71 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 0.99 0.76 0.30 -1.84 0.00 -0.78 -4.92 105.19 99.70 3g1r n GLY 75 Ca 0.21 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.17 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 2.18 1.04 -4.20 1.61 1.63 -1.50 -3.45 116.57 113.87 3g1r h LYS 76 Ca 0.00 -0.15 -0.14 0.00 -0.85 0.00 0.00 60.65 59.51 3g1r h LYS 76 Cb 0.00 -0.19 -0.15 0.00 -0.60 0.00 0.00 32.23 31.30 3g1r h LYS 76 CO 0.00 0.81 -0.58 0.14 -3.45 0.00 0.00 179.45 176.37 3g1r s VAL 77 N -5.71 0.15 0.26 2.00 -7.23 -1.18 -5.04 120.40 103.64 3g1r s VAL 77 Ca -0.13 -1.70 0.06 0.00 -1.81 0.00 0.00 61.98 58.40 3g1r s VAL 77 Cb 0.15 -1.72 -0.03 0.00 0.56 0.00 0.00 36.38 35.34 3g1r s VAL 77 CO 0.81 -0.67 0.36 -0.13 -0.31 0.00 0.00 175.10 175.16 3g1r s ARG 78 N -3.96 3.30 0.32 4.82 0.52 -1.26 -4.16 118.95 118.53 3g1r s ARG 78 Ca 0.14 -0.85 0.07 0.00 -0.52 0.00 0.00 55.73 54.57 3g1r s ARG 78 Cb 0.07 -2.83 0.77 0.00 0.52 0.00 0.00 34.95 33.48 3g1r s ARG 78 CO -0.05 0.35 1.81 -0.09 0.02 0.00 0.00 175.30 177.34 3g1r h ARG 79 N 1.16 0.72 0.00 3.54 9.65 -1.95 -0.49 114.38 127.01 3g1r h ARG 79 Ca -0.50 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.33 3g1r h ARG 79 Cb 1.24 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 29.65 3g1r h ARG 79 CO 0.59 0.48 0.00 0.39 2.80 0.00 0.00 179.97 184.23 3g1r n GLU 80 N -4.67 0.12 0.05 0.20 4.71 -1.26 -2.13 120.64 117.66 3g1r n GLU 80 Ca 0.21 0.29 0.12 0.00 -0.01 0.00 0.00 57.16 57.78 3g1r n GLU 80 Cb 0.54 -1.71 0.25 0.00 -1.01 0.00 0.00 31.44 29.52 3g1r n GLU 80 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3g1r n ASP 81 N -1.93 0.63 -4.56 1.62 8.00 -0.20 -4.87 116.55 115.25 3g1r n ASP 81 Ca 0.04 0.16 -0.34 0.00 0.71 0.00 0.00 54.79 55.35 3g1r n ASP 81 Cb 0.25 -0.02 -0.11 0.00 -0.02 0.00 0.00 41.12 41.22 3g1r n ASP 81 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3g1r s ILE 82 N -3.12 3.88 -0.30 0.53 -1.09 -0.91 -4.81 121.20 115.39 3g1r s ILE 82 Ca 0.08 -0.39 -0.02 0.00 -2.23 0.00 0.00 60.65 58.10 3g1r s ILE 82 Cb 0.14 -2.64 0.05 0.00 -1.58 0.00 0.00 42.46 38.43 3g1r s ILE 82 CO 0.68 0.55 0.00 0.12 -1.23 0.00 0.00 174.94 175.07 3g1r s PHE 83 N -0.28 3.28 -0.17 3.97 2.19 0.77 -4.93 117.98 122.81 3g1r s PHE 83 Ca 0.05 -1.91 -0.05 0.00 0.33 0.00 0.00 56.93 55.35 3g1r s PHE 83 Cb -0.13 -2.14 -0.03 0.00 -1.31 0.00 0.00 43.02 39.41 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 1.24 3.07 -0.19 10.12 5.04 -1.26 -0.96 117.35 134.41 3g1r s TYR 84 Ca -0.05 -0.26 -0.06 0.00 -2.44 0.00 0.00 57.07 54.26 3g1r s TYR 84 Cb -0.20 -2.01 -0.03 0.00 0.35 0.00 0.00 41.96 40.07 3g1r s TYR 84 CO -0.01 -0.04 0.02 0.00 -1.34 0.00 0.00 175.55 174.18 3g1r s GLY 86 N 0.70 2.72 -0.02 0.00 0.00 -0.24 -1.10 107.32 109.38 3g1r s GLY 86 Ca 0.01 -1.24 -0.02 0.00 0.00 0.00 0.00 44.72 43.47 3g1r s GLY 86 CO 0.02 -2.10 0.06 0.54 0.00 0.00 0.00 173.10 171.62 3g1r s LYS 87 N -3.88 0.09 -0.43 2.90 1.02 -1.26 -2.10 119.74 116.08 3g1r s LYS 87 Ca 0.22 0.05 -0.20 0.00 0.02 0.00 0.00 55.97 56.06 3g1r s LYS 87 Cb 0.04 0.04 0.02 0.00 -0.52 0.00 0.00 37.83 37.41 3g1r s LYS 87 CO 0.12 -0.01 0.59 -1.17 -0.92 0.00 0.00 175.35 173.96 3g1r s LEU 88 N -0.05 4.55 0.72 3.17 2.96 0.40 -4.51 118.68 125.93 3g1r s LEU 88 Ca -0.01 -0.36 -0.11 0.00 -0.22 0.00 0.00 54.13 53.43 3g1r s LEU 88 Cb -0.01 -2.65 0.02 0.00 0.50 0.00 0.00 46.19 44.05 3g1r s LEU 88 CO 0.00 -0.71 1.07 0.86 -1.32 0.00 0.00 176.35 176.25 3g1r s TRP 89 N 2.65 3.00 0.50 5.38 -0.00 -1.26 -1.20 118.94 128.01 3g1r s TRP 89 Ca 0.20 1.39 0.27 0.00 -0.00 0.00 0.00 56.10 57.97 3g1r s TRP 89 Cb -0.15 -2.94 1.36 0.00 -0.00 0.00 0.00 33.47 31.74 3g1r s TRP 89 CO 0.17 -1.39 1.86 0.00 -0.00 0.00 0.00 176.95 177.60 3g1r h ALA 90 N -0.83 2.65 0.00 5.86 0.00 -1.88 0.36 119.26 125.42 3g1r h ALA 90 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3g1r h ALA 90 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3g1r h ALA 90 CO 0.56 -0.93 0.00 0.25 0.00 0.00 0.00 179.25 179.13 3g1r n THR 91 N -4.36 0.02 -1.81 0.00 -2.24 -1.26 -0.86 114.28 103.78 3g1r n THR 91 Ca 0.20 0.01 0.04 0.00 -2.27 0.00 0.00 64.05 62.03 3g1r n THR 91 Cb 0.91 -0.54 0.16 0.00 -2.10 0.00 0.00 70.33 68.76 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 -1.09 1.68 0.17 3.42 4.13 0.11 -3.99 115.26 119.70 3g1r n ASN 92 Ca 0.20 -3.50 0.12 0.00 1.68 0.00 0.00 54.58 53.07 3g1r n ASN 92 Cb 0.14 -0.48 0.13 0.00 -1.54 0.00 0.00 39.78 38.04 3g1r n ASN 92 CO 0.00 0.00 0.00 0.45 0.28 0.00 0.00 177.26 177.99 3g1r h HIS 93 N 1.06 0.00 -2.42 3.10 3.86 -1.67 -3.37 115.15 115.71 3g1r h HIS 93 Ca -0.03 0.00 -0.55 0.00 -1.16 0.00 0.00 60.37 58.63 3g1r h HIS 93 Cb 1.20 0.00 0.04 0.00 1.06 0.00 0.00 27.41 29.71 3g1r h HIS 93 CO 0.64 0.00 1.06 0.28 0.86 0.00 0.00 177.93 180.78 3g1r n VAL 94 N -2.89 0.32 -0.29 2.45 0.31 -1.26 -4.49 118.33 112.49 3g1r n VAL 94 Ca 0.03 -0.06 0.09 0.00 -0.01 0.00 0.00 64.34 64.39 3g1r n VAL 94 Cb 0.53 -2.01 0.25 0.00 -0.91 0.00 0.00 33.84 31.70 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 8.18 0.46 0.00 5.55 0.11 -1.88 0.21 132.00 144.64 3g1r h PRO 95 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3g1r h PRO 95 Cb 1.23 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3g1r h PRO 95 CO 0.94 0.31 0.00 0.93 -0.21 0.00 0.00 178.00 179.97 3g1r h GLU 96 N 0.48 0.00 0.00 1.05 3.07 -1.95 -2.11 114.58 115.12 3g1r h GLU 96 Ca 0.49 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.35 3g1r h GLU 96 Cb 0.82 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.73 3g1r h GLU 96 CO -0.45 0.00 -0.93 -1.33 -1.40 0.00 0.00 179.01 174.90 3g1r n MET 97 N -2.51 0.36 0.25 2.33 2.81 0.73 -4.54 117.12 116.55 3g1r n MET 97 Ca -0.00 0.04 -0.16 0.00 -1.81 0.00 0.00 57.70 55.77 3g1r n MET 97 Cb 0.14 -1.66 -0.08 0.00 -0.71 0.00 0.00 33.22 30.91 3g1r n MET 97 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3g1r h VAL 98 N 0.00 0.57 -0.32 2.03 2.07 -1.31 -0.72 116.25 118.57 3g1r h VAL 98 Ca 0.00 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 3g1r h VAL 98 Cb 0.79 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3g1r h VAL 98 CO 0.00 0.01 0.16 -0.09 0.02 0.00 0.00 177.57 177.68 3g1r h ARG 99 N -0.62 0.45 -0.69 1.57 2.43 -1.80 -1.26 114.38 114.45 3g1r h ARG 99 Ca -0.06 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.10 3g1r h ARG 99 Cb 0.47 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 3g1r h ARG 99 CO 0.10 0.40 0.46 -1.35 -1.51 0.00 0.00 179.97 178.06 3g1r h PRO 100 N 0.38 0.73 -0.38 0.20 0.11 -1.78 0.70 132.00 131.96 3g1r h PRO 100 Ca 0.11 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.10 3g1r h PRO 100 Cb 0.09 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 3g1r h PRO 100 CO -0.02 0.48 -0.06 1.15 -0.21 0.00 0.00 178.00 179.35 3g1r h THR 101 N 0.75 1.27 -0.51 -1.15 2.02 -0.51 -1.31 112.91 113.47 3g1r h THR 101 Ca 0.29 -1.11 -0.03 0.00 0.77 0.00 0.00 66.41 66.32 3g1r h THR 101 Cb 0.19 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 3g1r h THR 101 CO -0.09 0.37 0.19 0.25 0.37 0.00 0.00 175.52 176.62 3g1r h LEU 102 N 0.53 0.71 -1.41 2.58 5.85 -0.77 -2.50 115.31 120.30 3g1r h LEU 102 Ca 0.10 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.67 3g1r h LEU 102 Cb 0.56 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 3g1r h LEU 102 CO 0.03 0.70 0.42 -0.33 -0.34 0.00 0.00 178.44 178.92 3g1r h GLU 103 N 0.69 0.76 -0.34 1.25 5.08 -0.72 -0.66 114.58 120.63 3g1r h GLU 103 Ca 0.17 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 3g1r h GLU 103 Cb 0.21 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 3g1r h GLU 103 CO -0.01 0.50 0.16 -0.09 -1.00 0.00 0.00 179.01 178.57 3g1r h ARG 104 N 0.78 0.49 -0.81 2.33 2.43 -0.90 -1.09 114.38 117.61 3g1r h ARG 104 Ca 0.25 -0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.37 3g1r h ARG 104 Cb 0.05 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.47 3g1r h ARG 104 CO -0.07 0.45 0.54 1.15 -1.51 0.00 0.00 179.97 180.53 3g1r h THR 105 N 0.41 1.18 -0.45 0.20 2.02 -0.88 -0.77 112.91 114.61 3g1r h THR 105 Ca 0.12 -0.36 -0.09 0.00 0.77 0.00 0.00 66.41 66.84 3g1r h THR 105 Cb 0.12 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.54 3g1r h THR 105 CO -0.01 0.19 -0.09 -0.07 0.37 0.00 0.00 175.52 175.91 3g1r h LEU 106 N 1.06 0.78 -0.23 2.58 3.38 -0.72 0.01 115.31 122.17 3g1r h LEU 106 Ca 0.31 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 3g1r h LEU 106 Cb -0.06 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3g1r h LEU 106 CO -0.08 0.90 0.13 0.03 0.09 0.00 0.00 178.44 179.52 3g1r h ARG 107 N 0.72 0.33 -0.37 1.13 3.08 -0.74 0.37 114.38 118.89 3g1r h ARG 107 Ca 0.13 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.17 3g1r h ARG 107 Cb 0.57 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.53 3g1r h ARG 107 CO 0.04 0.29 0.18 0.28 -1.07 0.00 0.00 179.97 179.69 3g1r h VAL 108 N 0.27 0.98 0.00 2.04 2.07 -0.83 -2.31 116.25 118.47 3g1r h VAL 108 Ca 0.08 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 3g1r h VAL 108 Cb 0.06 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3g1r h VAL 108 CO -0.01 0.07 -0.10 -0.07 0.02 0.00 0.00 177.57 177.47 3g1r h LEU 109 N 0.38 0.00 -1.34 2.57 3.38 -0.94 -3.41 115.31 115.94 3g1r h LEU 109 Ca 0.16 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.68 3g1r h LEU 109 Cb 0.07 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.82 3g1r h LEU 109 CO -0.11 0.10 -0.79 0.00 0.09 0.00 0.00 178.44 177.73 3g1r n GLN 110 N -3.17 -5.30 -4.33 1.13 6.02 0.08 -4.62 117.38 107.18 3g1r n GLN 110 Ca 0.02 0.61 -0.20 0.00 -0.01 0.00 0.00 57.00 57.42 3g1r n GLN 110 Cb 0.46 -5.35 -0.11 0.00 1.02 0.00 0.00 30.24 26.26 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 -7.02 2.50 0.27 1.08 1.43 -0.97 -5.05 118.68 110.93 3g1r s LEU 111 Ca 0.36 -0.94 0.19 0.00 -1.03 0.00 0.00 54.13 52.71 3g1r s LEU 111 Cb -0.18 -0.72 0.09 0.00 0.03 0.00 0.00 46.19 45.42 3g1r s LEU 111 CO 0.82 -0.12 1.32 0.44 0.23 0.00 0.00 176.35 179.04 3g1r h ASP 112 N 2.89 0.00 -5.07 2.29 3.32 -1.95 -3.43 116.42 114.47 3g1r h ASP 112 Ca -0.40 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.62 3g1r h ASP 112 Cb 1.21 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.65 3g1r h ASP 112 CO 0.57 0.30 0.02 -0.72 -1.72 0.00 0.00 179.24 177.68 3g1r s TYR 113 N -3.09 -0.22 0.15 4.55 1.13 -1.26 -4.71 117.35 113.91 3g1r s TYR 113 Ca 0.03 -0.09 0.07 0.00 -1.41 0.00 0.00 57.07 55.67 3g1r s TYR 113 Cb 0.07 0.37 -0.04 0.00 -1.10 0.00 0.00 41.96 41.26 3g1r s TYR 113 CO 0.74 -0.82 0.01 0.14 -2.51 0.00 0.00 175.55 173.11 3g1r s VAL 114 N -3.83 3.84 0.10 -3.49 -7.23 -0.74 -4.97 120.40 104.09 3g1r s VAL 114 Ca 0.05 -1.30 -0.07 0.00 -1.81 0.00 0.00 61.98 58.85 3g1r s VAL 114 Cb 0.00 -2.91 -0.22 0.00 0.56 0.00 0.00 36.38 33.81 3g1r s VAL 114 CO -0.08 -0.06 1.23 0.44 -0.31 0.00 0.00 175.10 176.32 3g1r h ASP 115 N 2.84 0.63 -3.49 4.85 3.32 -1.58 -1.17 116.42 121.82 3g1r h ASP 115 Ca -0.47 -0.54 -0.27 0.00 0.02 0.00 0.00 57.03 55.77 3g1r h ASP 115 Cb 1.19 -0.19 -0.33 0.00 0.22 0.00 0.00 39.33 40.22 3g1r h ASP 115 CO 0.59 1.35 -0.67 -0.22 -1.72 0.00 0.00 179.24 178.57 3g1r s LEU 116 N -7.72 0.94 -0.09 1.55 2.96 -0.79 -0.88 118.68 114.64 3g1r s LEU 116 Ca -0.07 0.16 0.02 0.00 -0.22 0.00 0.00 54.13 54.03 3g1r s LEU 116 Cb 0.08 0.14 0.01 0.00 0.50 0.00 0.00 46.19 46.92 3g1r s LEU 116 CO 0.89 -0.13 -0.16 -0.47 -1.32 0.00 0.00 176.35 175.16 3g1r s TYR 117 N 1.08 1.93 0.05 5.38 5.04 -0.67 -1.08 117.35 129.07 3g1r s TYR 117 Ca -0.09 -0.84 0.05 0.00 -2.44 0.00 0.00 57.07 53.76 3g1r s TYR 117 Cb -0.12 -1.37 -0.02 0.00 0.35 0.00 0.00 41.96 40.79 3g1r s TYR 117 CO -0.04 -0.41 -0.16 0.96 -1.34 0.00 0.00 175.55 174.56 3g1r s ILE 118 N 0.78 1.23 -0.15 3.14 -4.36 -0.89 -1.71 121.20 119.24 3g1r s ILE 118 Ca -0.11 -1.08 -0.29 0.00 -0.26 0.00 0.00 60.65 58.90 3g1r s ILE 118 Cb -0.16 -1.11 -0.03 0.00 1.25 0.00 0.00 42.46 42.41 3g1r s ILE 118 CO 0.02 0.01 1.49 -0.63 0.24 0.00 0.00 174.94 176.07 3g1r s ILE 119 N -0.89 3.89 0.15 8.37 1.01 -0.88 -0.45 121.20 132.40 3g1r s ILE 119 Ca 0.02 1.05 -0.09 0.00 0.00 0.00 0.00 60.65 61.64 3g1r s ILE 119 Cb -0.08 -3.75 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 3g1r s ILE 119 CO 0.02 -0.17 1.49 -0.08 0.00 0.00 0.00 174.94 176.20 3g1r h GLU 120 N 9.34 0.88 -4.11 2.79 4.81 -1.42 0.34 114.58 127.20 3g1r h GLU 120 Ca -0.33 -0.47 -0.12 0.00 -0.13 0.00 0.00 59.36 58.32 3g1r h GLU 120 Cb 1.14 0.02 -0.15 0.00 0.63 0.00 0.00 28.75 30.38 3g1r h GLU 120 CO 0.98 1.11 -0.61 0.14 -0.73 0.00 0.00 179.01 179.89 3g1r s VAL 121 N -4.36 0.19 -1.32 0.32 -7.23 -1.25 -4.32 120.40 102.43 3g1r s VAL 121 Ca -0.10 -1.58 0.29 0.00 -1.81 0.00 0.00 61.98 58.77 3g1r s VAL 121 Cb 0.11 -1.36 0.44 0.00 0.56 0.00 0.00 36.38 36.14 3g1r s VAL 121 CO 0.87 -0.87 1.99 -0.81 -0.31 0.00 0.00 175.10 175.97 3g1r n PRO 122 N 0.23 0.31 -3.16 4.82 -0.04 -1.26 -4.79 135.00 131.12 3g1r n PRO 122 Ca -0.15 0.01 -0.40 0.00 -0.04 0.00 0.00 63.50 62.92 3g1r n PRO 122 Cb 0.61 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.51 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 -2.68 4.24 -0.03 0.54 -1.94 -1.26 -4.87 119.30 113.29 3g1r s MET 123 Ca 0.24 0.58 -0.21 0.00 -1.71 0.00 0.00 55.69 54.59 3g1r s MET 123 Cb 0.19 -3.55 -0.05 0.00 2.01 0.00 0.00 34.83 33.43 3g1r s MET 123 CO 0.46 -0.16 0.63 0.00 -0.01 0.00 0.00 175.02 175.94 3g1r s ALA 124 N 1.65 3.43 0.32 3.03 0.00 -1.26 -4.49 121.76 124.45 3g1r s ALA 124 Ca 0.28 0.06 0.08 0.00 0.00 0.00 0.00 51.96 52.38 3g1r s ALA 124 Cb -0.16 -2.82 -0.04 0.00 0.00 0.00 0.00 23.12 20.11 3g1r s ALA 124 CO 0.11 0.06 0.19 -0.06 0.00 0.00 0.00 175.76 176.06 3g1r s PHE 125 N 0.19 2.82 0.15 0.00 2.99 -0.04 -1.50 117.98 122.59 3g1r s PHE 125 Ca 0.33 -0.31 -0.34 0.00 0.00 0.00 0.00 56.93 56.61 3g1r s PHE 125 Cb -0.18 -1.64 -0.14 0.00 0.00 0.00 0.00 43.02 41.06 3g1r s PHE 125 CO 0.17 0.32 1.61 1.17 -0.00 0.00 0.00 175.22 178.49 3g1r n LYS 126 N -1.22 2.20 -1.63 0.44 4.81 -0.05 -4.22 118.16 118.50 3g1r n LYS 126 Ca -0.03 0.79 -0.41 0.00 -0.87 0.00 0.00 58.31 57.79 3g1r n LYS 126 Cb 0.60 -2.58 0.01 0.00 0.02 0.00 0.00 35.03 33.09 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 3.70 1.49 0.00 1.64 -0.02 -1.26 -4.71 135.00 135.84 3g1r n PRO 127 Ca 0.17 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3g1r n PRO 127 Cb 0.29 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 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 1.09 2.33 0.31 -1.23 0.00 -1.26 -5.00 105.19 101.44 3g1r n GLY 128 Ca 0.09 -1.41 -0.09 0.00 0.00 0.00 0.00 46.02 44.61 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 1.07 -2.51 1.61 3.45 -1.96 -3.42 116.42 114.65 3g1r h ASP 129 Ca 0.00 -0.29 -0.54 0.00 0.43 0.00 0.00 57.03 56.63 3g1r h ASP 129 Cb 0.00 -0.29 0.00 0.00 -0.56 0.00 0.00 39.33 38.49 3g1r h ASP 129 CO 0.00 1.09 1.15 -0.70 -1.57 0.00 0.00 179.24 179.21 3g1r s GLU 130 N -5.09 4.15 0.44 3.56 2.56 -1.26 -4.86 118.70 118.19 3g1r s GLU 130 Ca -0.12 2.35 0.24 0.00 0.00 0.00 0.00 54.97 57.45 3g1r s GLU 130 Cb 0.14 -4.06 0.87 0.00 2.00 0.00 0.00 34.13 33.08 3g1r s GLU 130 CO 0.86 -0.91 1.80 -0.84 -0.56 0.00 0.00 175.26 175.61 3g1r h ILE 131 N 5.63 0.51 -2.16 -3.70 3.07 -1.97 -3.32 117.51 115.57 3g1r h ILE 131 Ca -0.43 -1.14 -0.59 0.00 1.55 0.00 0.00 64.86 64.25 3g1r h ILE 131 Cb 1.20 1.80 -0.41 0.00 -0.27 0.00 0.00 36.82 39.14 3g1r h ILE 131 CO 0.95 0.21 -0.70 -1.22 -1.05 0.00 0.00 178.15 176.34 3g1r n TYR 132 N -3.34 2.86 -2.18 0.16 0.53 -1.26 -4.80 117.16 109.12 3g1r n TYR 132 Ca 0.00 -4.03 -0.42 0.00 -1.02 0.00 0.00 57.90 52.43 3g1r n TYR 132 Cb 0.44 -0.51 -0.03 0.00 -1.03 0.00 0.00 39.34 38.21 3g1r n TYR 132 CO 0.00 0.00 0.00 -1.25 -1.02 0.00 0.00 176.86 174.59 3g1r s PRO 133 N -2.28 4.26 0.04 -0.72 0.04 -1.25 -5.00 135.00 130.09 3g1r s PRO 133 Ca 0.39 2.00 0.04 0.00 0.04 0.00 0.00 61.00 63.48 3g1r s PRO 133 Cb 0.16 -3.65 -0.02 0.00 0.04 0.00 0.00 34.50 31.03 3g1r s PRO 133 CO -0.04 -0.64 -0.12 1.03 0.04 0.00 0.00 177.00 177.27 3g1r s ARG 134 N 2.76 0.78 0.27 4.56 0.52 -1.26 -1.23 118.95 125.35 3g1r s ARG 134 Ca 0.65 -0.75 -0.05 0.00 -0.52 0.00 0.00 55.73 55.06 3g1r s ARG 134 Cb -0.31 -0.74 0.06 0.00 0.52 0.00 0.00 34.95 34.47 3g1r s ARG 134 CO 0.26 0.18 0.36 -0.40 0.02 0.00 0.00 175.30 175.72 3g1r n ASP 135 N 1.76 -0.02 0.30 0.23 3.85 -0.30 -4.81 116.55 117.57 3g1r n ASP 135 Ca -0.19 -1.12 0.15 0.00 -0.71 0.00 0.00 54.79 52.92 3g1r n ASP 135 Cb 0.55 -0.28 0.91 0.00 -1.35 0.00 0.00 41.12 40.95 3g1r n ASP 135 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 3g1r h GLU 136 N 0.00 0.00 -0.63 0.11 9.09 -2.02 -0.30 114.58 120.83 3g1r h GLU 136 Ca -0.12 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.29 3g1r h GLU 136 Cb 0.32 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.42 3g1r h GLU 136 CO 0.08 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.24 3g1r n ASN 137 N -3.85 3.52 -0.05 3.06 3.02 -1.26 -4.92 115.26 114.77 3g1r n ASN 137 Ca -0.03 -2.07 -0.01 0.00 -0.03 0.00 0.00 54.58 52.44 3g1r n ASN 137 Cb 0.08 -0.44 -0.00 0.00 -0.61 0.00 0.00 39.78 38.81 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 1.41 0.42 3.72 7.41 0.00 -0.12 -5.00 105.19 113.03 3g1r n GLY 138 Ca 0.21 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.75 4.53 0.25 1.61 2.20 -1.26 -4.72 119.74 121.59 3g1r s LYS 139 Ca 0.00 1.58 -0.30 0.00 -0.36 0.00 0.00 55.97 56.89 3g1r s LYS 139 Cb 0.00 -3.39 -0.10 0.00 -1.51 0.00 0.00 37.83 32.83 3g1r s LYS 139 CO 0.00 -0.09 1.42 -1.58 -0.36 0.00 0.00 175.35 174.74 3g1r s TRP 140 N 0.82 3.05 -0.48 4.03 0.52 -1.26 -1.14 118.94 124.47 3g1r s TRP 140 Ca 0.54 1.07 -0.18 0.00 0.02 0.00 0.00 56.10 57.55 3g1r s TRP 140 Cb -0.25 -3.79 0.06 0.00 -1.15 0.00 0.00 33.47 28.34 3g1r s TRP 140 CO 0.29 -2.52 0.52 -0.51 0.02 0.00 0.00 176.95 174.75 3g1r s LEU 141 N -0.42 5.19 0.52 2.99 1.43 -0.37 -4.90 118.68 123.13 3g1r s LEU 141 Ca 0.58 -1.03 0.09 0.00 -1.03 0.00 0.00 54.13 52.74 3g1r s LEU 141 Cb -0.41 -2.34 0.06 0.00 0.03 0.00 0.00 46.19 43.53 3g1r s LEU 141 CO 0.43 -0.76 0.71 -0.31 0.23 0.00 0.00 176.35 176.65 3g1r s TYR 142 N 2.21 1.94 0.09 0.29 4.12 -1.26 -0.87 117.35 123.87 3g1r s TYR 142 Ca 0.11 -0.59 0.02 0.00 0.02 0.00 0.00 57.07 56.63 3g1r s TYR 142 Cb -0.21 -2.29 -0.04 0.00 -1.52 0.00 0.00 41.96 37.90 3g1r s TYR 142 CO 0.10 -0.89 -0.07 -1.58 0.02 0.00 0.00 175.55 173.13 3g1r s HIS 143 N -2.56 0.84 -0.06 2.71 2.46 -0.56 -3.61 115.29 114.51 3g1r s HIS 143 Ca 0.59 -0.85 -0.30 0.00 0.47 0.00 0.00 55.06 54.98 3g1r s HIS 143 Cb -0.07 -0.49 -0.06 0.00 -0.13 0.00 0.00 32.58 31.83 3g1r s HIS 143 CO 0.37 -0.15 1.74 0.15 -2.47 0.00 0.00 174.74 174.39 3g1r s LYS 144 N -3.44 4.08 0.24 2.88 -0.14 -1.26 -4.42 119.74 117.67 3g1r s LYS 144 Ca 0.08 2.21 -0.30 0.00 -1.36 0.00 0.00 55.97 56.60 3g1r s LYS 144 Cb 0.03 -4.05 -0.10 0.00 -1.68 0.00 0.00 37.83 32.03 3g1r s LYS 144 CO -0.04 -0.98 1.39 -1.12 -0.76 0.00 0.00 175.35 173.84 3g1r s SER 145 N 3.91 6.74 -0.44 2.83 0.01 -1.26 -4.89 113.70 120.59 3g1r s SER 145 Ca 0.78 2.58 0.04 0.00 1.31 0.00 0.00 55.95 60.66 3g1r s SER 145 Cb -0.34 -2.62 0.17 0.00 0.21 0.00 0.00 66.02 63.43 3g1r s SER 145 CO 0.32 -0.63 0.35 0.21 0.41 0.00 0.00 173.24 173.90 3g1r s ASN 146 N 0.28 2.06 0.34 2.44 3.84 -1.26 -5.01 114.94 117.63 3g1r s ASN 146 Ca 0.58 -3.08 0.02 0.00 0.21 0.00 0.00 52.86 50.58 3g1r s ASN 146 Cb -0.40 -0.61 0.60 0.00 -0.55 0.00 0.00 41.25 40.30 3g1r s ASN 146 CO 0.42 -0.17 1.99 -0.07 -2.79 0.00 0.00 177.10 176.48 3g1r h LEU 147 N 5.76 0.75 -0.47 3.21 3.38 -1.93 -1.39 115.31 124.61 3g1r h LEU 147 Ca 0.23 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 3g1r h LEU 147 Cb 0.90 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 3g1r h LEU 147 CO 0.41 0.56 -0.04 0.00 0.09 0.00 0.00 178.44 179.45 3g1r h ALA 149 N 0.90 0.63 -0.82 0.00 0.00 -1.83 -1.28 119.26 116.86 3g1r h ALA 149 Ca 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3g1r h ALA 149 Cb 0.57 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3g1r h ALA 149 CO 0.03 0.39 0.45 1.15 0.00 0.00 0.00 179.25 181.27 3g1r h THR 150 N 0.67 1.24 -0.66 0.00 2.02 -1.17 -2.33 112.91 112.67 3g1r h THR 150 Ca 0.14 -0.60 -0.02 0.00 0.77 0.00 0.00 66.41 66.70 3g1r h THR 150 Cb 0.44 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 3g1r h THR 150 CO 0.02 0.27 0.35 -0.25 0.37 0.00 0.00 175.52 176.27 3g1r h TRP 151 N 1.14 0.93 -0.95 3.16 2.91 -0.64 -0.72 115.95 121.78 3g1r h TRP 151 Ca 0.29 -0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.31 3g1r h TRP 151 Cb 0.03 -0.29 -0.05 0.00 -0.51 0.00 0.00 29.16 28.34 3g1r h TRP 151 CO 0.00 0.68 0.63 0.93 -1.03 0.00 0.00 178.44 179.65 3g1r h GLU 152 N 0.91 1.19 -0.39 2.65 5.08 -0.91 0.16 114.58 123.27 3g1r h GLU 152 Ca 0.23 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 3g1r h GLU 152 Cb 0.07 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 3g1r h GLU 152 CO -0.03 0.78 -0.09 0.00 -1.00 0.00 0.00 179.01 178.67 3g1r h ALA 153 N 1.44 1.12 -0.46 3.43 0.00 -0.84 -1.44 119.26 122.50 3g1r h ALA 153 Ca 0.37 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3g1r h ALA 153 Cb -0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3g1r h ALA 153 CO -0.11 0.55 0.07 0.52 0.00 0.00 0.00 179.25 180.28 3g1r h MET 154 N 0.62 0.77 -1.00 0.00 2.86 0.31 -2.73 114.93 115.76 3g1r h MET 154 Ca 0.11 -0.21 0.05 0.00 -2.06 0.00 0.00 59.70 57.60 3g1r h MET 154 Cb 0.52 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 32.03 3g1r h MET 154 CO 0.03 0.79 0.65 0.93 1.06 0.00 0.00 176.91 180.36 3g1r h GLU 155 N 0.63 1.17 -0.24 1.72 5.08 -0.33 -0.66 114.58 121.95 3g1r h GLU 155 Ca 0.14 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 3g1r h GLU 155 Cb 0.40 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 3g1r h GLU 155 CO 0.01 0.77 0.01 0.00 -1.00 0.00 0.00 179.01 178.80 3g1r h ALA 156 N 1.44 1.57 -0.62 3.43 0.00 -1.05 -1.59 119.26 122.44 3g1r h ALA 156 Ca 0.42 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 3g1r h ALA 156 Cb 0.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3g1r h ALA 156 CO -0.15 0.32 0.02 0.00 0.00 0.00 0.00 179.25 179.43 3g1r h LYS 158 N 1.00 0.80 0.00 0.00 3.64 -0.97 -2.06 116.57 118.97 3g1r h LYS 158 Ca 0.18 -0.23 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 3g1r h LYS 158 Cb 0.54 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3g1r h LYS 158 CO 0.03 0.82 -0.04 -0.44 -2.27 0.00 0.00 179.45 177.56 3g1r h ASP 159 N 0.66 0.00 -0.01 4.20 3.32 -1.10 -1.01 116.42 122.49 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 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3g1r h ASP 159 CO 0.01 0.04 0.00 0.00 -1.72 0.00 0.00 179.24 177.57 3g1r n ALA 160 N -2.53 2.65 -1.05 3.45 0.00 -0.60 -4.90 120.51 117.53 3g1r n ALA 160 Ca -0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 53.44 53.11 3g1r n ALA 160 Cb 0.12 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.17 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 1.06 0.53 0.06 0.00 0.00 -0.38 -4.92 105.19 101.54 3g1r n GLY 161 Ca 0.22 -0.55 0.12 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.19 0.67 -3.72 0.99 4.77 -0.80 -4.74 117.00 113.98 3g1r n LEU 162 Ca -0.02 0.31 -0.13 0.00 -0.03 0.00 0.00 56.01 56.15 3g1r n LEU 162 Cb 0.08 -0.24 -0.10 0.00 -2.33 0.00 0.00 43.42 40.83 3g1r n LEU 162 CO 0.03 -0.07 0.12 0.54 -1.33 0.00 0.00 177.39 176.68 3g1r s VAL 163 N -3.12 -0.00 -0.01 4.08 0.11 -1.25 -1.79 120.40 118.42 3g1r s VAL 163 Ca 0.08 0.01 -0.19 0.00 -2.93 0.00 0.00 61.98 58.95 3g1r s VAL 163 Cb 0.14 -0.63 -0.33 0.00 -1.53 0.00 0.00 36.38 34.03 3g1r s VAL 163 CO 0.67 0.00 0.95 0.11 -3.33 0.00 0.00 175.10 173.51 3g1r h LYS 164 N 5.57 0.41 -4.61 1.54 1.79 -1.23 -3.40 116.57 116.64 3g1r h LYS 164 Ca -0.28 -0.68 -0.31 0.00 -2.18 0.00 0.00 60.65 57.21 3g1r h LYS 164 Cb 1.18 0.25 -0.23 0.00 -1.58 0.00 0.00 32.23 31.85 3g1r h LYS 164 CO 0.23 1.32 -0.75 -1.12 -1.08 0.00 0.00 179.45 178.05 3g1r s SER 165 N -7.21 0.91 -0.05 0.86 0.01 -0.06 -5.02 113.70 103.14 3g1r s SER 165 Ca -0.12 -0.44 0.04 0.00 1.31 0.00 0.00 55.95 56.74 3g1r s SER 165 Cb 0.02 -0.00 -0.02 0.00 0.21 0.00 0.00 66.02 66.23 3g1r s SER 165 CO 0.88 -0.12 -0.17 -0.76 0.41 0.00 0.00 173.24 173.48 3g1r s LEU 166 N -1.22 2.55 0.00 2.44 1.43 -1.26 -1.68 118.68 120.94 3g1r s LEU 166 Ca -0.06 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 3g1r s LEU 166 Cb -0.08 -1.50 0.00 0.00 0.03 0.00 0.00 46.19 44.64 3g1r s LEU 166 CO 0.00 0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.51 3g1r n GLY 167 N 2.49 3.33 3.29 -3.19 0.00 -0.69 -1.15 105.19 109.26 3g1r n GLY 167 Ca -0.17 -1.31 -0.18 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.34 0.15 -0.13 1.61 -7.23 -0.09 -2.08 120.40 110.28 3g1r s VAL 168 Ca 0.00 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.04 3g1r s VAL 168 Cb 0.00 -2.50 0.04 0.00 0.56 0.00 0.00 36.38 34.48 3g1r s VAL 168 CO 0.00 0.00 0.37 -0.55 -0.31 0.00 0.00 175.10 174.61 3g1r s SER 169 N -3.33 -0.38 -1.81 4.85 0.15 0.11 -1.10 113.70 112.18 3g1r s SER 169 Ca 0.38 0.73 0.00 0.00 0.70 0.00 0.00 55.95 57.75 3g1r s SER 169 Cb 0.04 0.75 0.00 0.00 -1.71 0.00 0.00 66.02 65.10 3g1r s SER 169 CO 0.20 -0.15 0.00 0.59 1.20 0.00 0.00 173.24 175.08 3g1r n ASN 170 N 2.80 -5.68 -4.82 5.45 3.02 -0.35 -3.87 115.26 111.82 3g1r n ASN 170 Ca -0.13 0.09 -0.38 0.00 -0.03 0.00 0.00 54.58 54.13 3g1r n ASN 170 Cb 0.57 -4.75 -0.06 0.00 -0.61 0.00 0.00 39.78 34.93 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 -2.95 3.70 0.70 3.10 0.40 -1.26 -4.43 117.98 117.24 3g1r s PHE 171 Ca 0.00 0.99 0.02 0.00 -0.60 0.00 0.00 56.93 57.34 3g1r s PHE 171 Cb 0.00 -2.34 0.13 0.00 0.51 0.00 0.00 43.02 41.33 3g1r s PHE 171 CO 0.00 0.57 0.96 0.27 0.70 0.00 0.00 175.22 177.72 3g1r n ASN 172 N 2.10 1.52 -0.10 1.36 0.23 -1.26 -4.87 115.26 114.24 3g1r n ASN 172 Ca -0.13 -2.23 -0.07 0.00 -0.53 0.00 0.00 54.58 51.62 3g1r n ASN 172 Cb 0.52 -0.60 0.00 0.00 -2.08 0.00 0.00 39.78 37.62 3g1r n ASN 172 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 3g1r h ARG 173 N 0.00 0.36 -0.56 -3.83 2.43 -1.18 -0.84 114.38 110.76 3g1r h ARG 173 Ca -0.32 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 58.89 3g1r h ARG 173 Cb 1.23 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 30.64 3g1r h ARG 173 CO 0.36 0.24 0.26 -0.09 -1.51 0.00 0.00 179.97 179.23 3g1r h ARG 174 N 0.37 0.47 -0.46 0.20 2.43 -1.96 -0.72 114.38 114.72 3g1r h ARG 174 Ca 0.14 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.16 3g1r h ARG 174 Cb 0.04 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 3g1r h ARG 174 CO -0.09 0.31 -0.22 1.96 -1.51 0.00 0.00 179.97 180.42 3g1r h GLN 175 N 0.48 0.95 -0.51 0.20 4.20 -1.83 -1.09 115.11 117.52 3g1r h GLN 175 Ca 0.26 -0.42 0.03 0.00 0.06 0.00 0.00 58.65 58.59 3g1r h GLN 175 Cb 0.23 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.95 3g1r h GLN 175 CO -0.22 1.08 0.28 -0.07 -0.67 0.00 0.00 178.83 179.23 3g1r h LEU 176 N 0.80 0.42 -1.18 1.46 3.38 -0.91 -2.92 115.31 116.35 3g1r h LEU 176 Ca 0.10 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 3g1r h LEU 176 Cb 0.80 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3g1r h LEU 176 CO 0.07 0.30 -0.28 -0.33 0.09 0.00 0.00 178.44 178.28 3g1r h GLU 177 N 0.55 0.20 -0.99 1.13 5.08 -0.67 0.16 114.58 120.05 3g1r h GLU 177 Ca 0.21 -0.07 0.09 0.00 -1.00 0.00 0.00 59.36 58.59 3g1r h GLU 177 Cb 0.08 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 3g1r h GLU 177 CO -0.13 0.48 0.63 -0.07 -1.00 0.00 0.00 179.01 178.92 3g1r h LEU 178 N 0.18 0.97 0.16 1.33 3.38 -1.02 0.20 115.31 120.51 3g1r h LEU 178 Ca 0.03 0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.81 3g1r h LEU 178 Cb 0.60 -0.18 0.02 0.00 0.09 0.00 0.00 40.66 41.20 3g1r h LEU 178 CO 0.04 0.58 -0.93 0.40 0.09 0.00 0.00 178.44 178.63 3g1r h ILE 179 N 1.08 1.46 -0.18 1.22 2.04 -1.30 -3.20 117.51 118.63 3g1r h ILE 179 Ca 0.45 -2.56 0.00 0.00 1.00 0.00 0.00 64.86 63.75 3g1r h ILE 179 Cb 0.30 3.17 -0.01 0.00 -0.74 0.00 0.00 36.82 39.54 3g1r h ILE 179 CO -0.20 0.73 0.12 -0.07 0.00 0.00 0.00 178.15 178.73 3g1r h LEU 180 N -0.30 0.21 -2.20 1.44 3.38 -0.75 -2.41 115.31 114.69 3g1r h LEU 180 Ca -0.16 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3g1r h LEU 180 Cb 1.72 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.42 3g1r h LEU 180 CO 0.17 0.16 0.00 0.59 0.09 0.00 0.00 178.44 179.45 3g1r n ASN 181 N -4.50 3.25 -4.73 -0.43 3.02 0.04 -4.98 115.26 106.92 3g1r n ASN 181 Ca -0.00 -1.96 -0.41 0.00 -0.03 0.00 0.00 54.58 52.17 3g1r n ASN 181 Cb 0.08 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 38.91 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 4.43 0.33 3.52 2.20 -0.91 -4.96 119.74 122.97 3g1r s LYS 182 Ca 0.40 1.94 -0.29 0.00 -0.36 0.00 0.00 55.97 57.65 3g1r s LYS 182 Cb 0.22 -3.24 -0.11 0.00 -1.51 0.00 0.00 37.83 33.18 3g1r s LYS 182 CO 0.30 -0.21 1.56 -2.14 -0.36 0.00 0.00 175.35 174.50 3g1r s PRO 183 N 0.17 4.11 -1.02 4.03 0.02 -1.26 -2.24 135.00 138.81 3g1r s PRO 183 Ca 0.56 2.59 0.00 0.00 0.02 0.00 0.00 61.00 64.17 3g1r s PRO 183 Cb -0.34 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.18 3g1r s PRO 183 CO 0.35 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.82 3g1r n GLY 184 N 1.51 1.05 3.63 0.52 0.00 -1.26 -4.95 105.19 105.69 3g1r n GLY 184 Ca 0.05 -0.58 -0.49 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.13 2.42 -0.07 0.99 7.94 -0.95 -4.90 117.00 121.31 3g1r n LEU 185 Ca -0.10 1.10 -0.11 0.00 -1.11 0.00 0.00 56.01 55.79 3g1r n LEU 185 Cb 0.34 -1.32 -0.05 0.00 0.53 0.00 0.00 43.42 42.92 3g1r n LEU 185 CO 0.15 -0.66 -0.94 1.17 -1.11 0.00 0.00 177.39 176.00 3g1r n LYS 186 N 2.87 0.30 -3.98 1.96 4.81 -1.26 -4.94 118.16 117.92 3g1r n LYS 186 Ca 0.17 0.10 -0.31 0.00 -0.87 0.00 0.00 58.31 57.40 3g1r n LYS 186 Cb 0.25 -1.14 -0.15 0.00 0.02 0.00 0.00 35.03 34.00 3g1r n LYS 186 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 3g1r s HIS 187 N -2.25 2.65 0.47 5.64 3.76 -1.26 -5.11 115.29 119.18 3g1r s HIS 187 Ca -0.18 -1.89 -0.25 0.00 -0.15 0.00 0.00 55.06 52.59 3g1r s HIS 187 Cb 0.06 -1.69 -0.08 0.00 1.11 0.00 0.00 32.58 31.98 3g1r s HIS 187 CO 0.27 -0.80 1.41 0.21 -0.85 0.00 0.00 174.74 174.98 3g1r s LYS 188 N 1.31 3.60 0.26 1.40 2.20 -1.26 -4.95 119.74 122.29 3g1r s LYS 188 Ca -0.06 2.38 -0.30 0.00 -0.36 0.00 0.00 55.97 57.63 3g1r s LYS 188 Cb -0.19 -2.59 -0.10 0.00 -1.51 0.00 0.00 37.83 33.44 3g1r s LYS 188 CO -0.06 -0.88 1.49 -2.14 -0.36 0.00 0.00 175.35 173.40 3g1r s PRO 189 N -2.53 4.23 0.01 4.03 0.02 -1.26 -4.78 135.00 134.72 3g1r s PRO 189 Ca 0.63 2.38 0.22 0.00 0.02 0.00 0.00 61.00 64.24 3g1r s PRO 189 Cb -0.43 -3.09 -0.13 0.00 0.02 0.00 0.00 34.50 30.87 3g1r s PRO 189 CO 0.55 -0.48 0.86 1.33 -0.33 0.00 0.00 177.00 178.92 3g1r n VAL 190 N 2.36 0.07 -3.74 3.83 0.24 -0.30 -4.78 118.33 116.01 3g1r n VAL 190 Ca 0.07 -0.23 -0.13 0.00 -2.04 0.00 0.00 64.34 62.01 3g1r n VAL 190 Cb 0.39 0.41 -0.10 0.00 -1.47 0.00 0.00 33.84 33.07 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 -3.77 -0.34 -0.18 -1.34 0.15 -1.26 -1.59 113.70 105.37 3g1r s SER 191 Ca 0.02 0.55 0.00 0.00 0.70 0.00 0.00 55.95 57.23 3g1r s SER 191 Cb 0.15 0.62 0.04 0.00 -1.71 0.00 0.00 66.02 65.13 3g1r s SER 191 CO 0.85 -0.24 -0.07 0.21 1.20 0.00 0.00 173.24 175.19 3g1r s ASN 192 N -0.31 3.13 -0.32 5.45 2.47 -0.61 -0.92 114.94 123.82 3g1r s ASN 192 Ca -0.05 -0.80 -0.18 0.00 0.42 0.00 0.00 52.86 52.25 3g1r s ASN 192 Cb -0.03 -1.04 -0.01 0.00 -1.45 0.00 0.00 41.25 38.72 3g1r s ASN 192 CO 0.02 -0.18 0.53 -1.58 -3.72 0.00 0.00 177.10 172.17 3g1r s GLN 193 N 1.53 3.76 0.08 0.43 0.74 -0.26 -1.90 119.66 124.05 3g1r s GLN 193 Ca -0.01 0.01 -0.03 0.00 0.05 0.00 0.00 55.36 55.39 3g1r s GLN 193 Cb -0.16 -3.76 -0.03 0.00 1.10 0.00 0.00 33.01 30.16 3g1r s GLN 193 CO -0.08 -0.57 0.04 0.14 -0.55 0.00 0.00 175.29 174.27 3g1r s VAL 194 N 2.42 0.17 0.20 1.34 -7.23 -0.26 -1.21 120.40 115.83 3g1r s VAL 194 Ca 0.20 -1.72 -0.32 0.00 -1.81 0.00 0.00 61.98 58.33 3g1r s VAL 194 Cb -0.15 -1.63 -0.12 0.00 0.56 0.00 0.00 36.38 35.04 3g1r s VAL 194 CO 0.12 -0.79 1.73 -0.70 -0.31 0.00 0.00 175.10 175.16 3g1r s GLU 195 N -3.94 4.13 -0.27 4.82 2.12 -1.26 -0.80 118.70 123.50 3g1r s GLU 195 Ca 0.11 2.60 -0.14 0.00 0.36 0.00 0.00 54.97 57.90 3g1r s GLU 195 Cb 0.07 -3.12 0.08 0.00 0.26 0.00 0.00 34.13 31.42 3g1r s GLU 195 CO -0.07 -0.76 0.64 0.00 -0.54 0.00 0.00 175.26 174.54 3g1r s HIS 197 N 1.80 0.01 -0.06 0.00 -3.43 -1.00 -4.14 115.29 108.46 3g1r s HIS 197 Ca -0.09 -0.18 0.28 0.00 -0.80 0.00 0.00 55.06 54.27 3g1r s HIS 197 Cb -0.07 0.58 1.41 0.00 -1.43 0.00 0.00 32.58 33.08 3g1r s HIS 197 CO -0.19 -0.41 1.85 -1.35 -2.00 0.00 0.00 174.74 172.64 3g1r h PRO 198 N 2.00 0.00 0.00 -0.38 0.11 -1.88 -0.69 132.00 131.16 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 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3g1r h PRO 198 CO 0.31 0.00 -0.60 0.66 -0.21 0.00 0.00 178.00 178.16 3g1r n TYR 199 N -2.50 0.30 -3.30 0.65 4.01 -1.26 -1.63 117.16 113.43 3g1r n TYR 199 Ca -0.01 0.09 -0.22 0.00 -0.16 0.00 0.00 57.90 57.60 3g1r n TYR 199 Cb 0.11 -0.48 -0.08 0.00 -0.31 0.00 0.00 39.34 38.58 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 -3.10 0.32 -1.37 -0.72 5.36 -0.29 -0.84 117.98 117.35 3g1r s PHE 200 Ca 0.08 -1.63 0.28 0.00 -0.96 0.00 0.00 56.93 54.70 3g1r s PHE 200 Cb 0.15 -0.62 0.99 0.00 -0.34 0.00 0.00 43.02 43.20 3g1r s PHE 200 CO 0.71 -0.93 1.72 0.25 -1.46 0.00 0.00 175.22 175.52 3g1r n THR 201 N 3.35 0.00 -3.51 0.12 -2.24 -1.06 -2.39 114.28 108.56 3g1r n THR 201 Ca 0.21 -0.04 -0.18 0.00 -2.27 0.00 0.00 64.05 61.77 3g1r n THR 201 Cb 0.47 -0.03 0.07 0.00 -2.10 0.00 0.00 70.33 68.74 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 -1.16 -5.87 0.04 -0.78 1.13 -1.26 -4.86 117.38 104.62 3g1r n GLN 202 Ca 0.10 0.78 -0.11 0.00 -1.94 0.00 0.00 57.00 55.83 3g1r n GLN 202 Cb 0.31 -5.64 -0.06 0.00 0.11 0.00 0.00 30.24 24.96 3g1r n GLN 202 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 3g1r h PRO 203 N -1.85 -0.06 -0.07 -1.09 0.11 -1.99 -0.28 132.00 126.76 3g1r h PRO 203 Ca -0.60 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.27 3g1r h PRO 203 Cb 1.34 0.01 0.02 0.00 0.11 0.00 0.00 31.00 32.48 3g1r h PRO 203 CO 0.52 -0.04 -0.92 0.87 -0.21 0.00 0.00 178.00 178.22 3g1r h LYS 204 N -0.07 0.75 -0.52 1.05 1.57 -1.97 -1.93 116.57 115.45 3g1r h LYS 204 Ca 0.02 -0.71 -0.12 0.00 -1.87 0.00 0.00 60.65 57.97 3g1r h LYS 204 Cb 0.09 0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3g1r h LYS 204 CO -0.05 1.29 -0.16 1.25 -0.57 0.00 0.00 179.45 181.21 3g1r h LEU 205 N 0.46 1.03 -0.13 2.94 5.85 -1.88 -0.68 115.31 122.91 3g1r h LEU 205 Ca -0.09 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.26 3g1r h LEU 205 Cb 1.56 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 3g1r h LEU 205 CO 0.18 1.17 0.08 0.25 -0.34 0.00 0.00 178.44 179.78 3g1r h LEU 206 N 0.89 0.13 -0.35 2.25 5.85 -1.03 0.51 115.31 123.55 3g1r h LEU 206 Ca 0.13 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.87 3g1r h LEU 206 Cb 0.73 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.71 3g1r h LEU 206 CO 0.06 0.09 0.19 0.50 -0.34 0.00 0.00 178.44 178.94 3g1r h LYS 207 N 0.16 0.38 -0.34 1.25 3.64 -1.21 0.11 116.57 120.56 3g1r h LYS 207 Ca 0.05 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 3g1r h LYS 207 Cb -0.01 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 3g1r h LYS 207 CO -0.02 0.25 0.05 0.35 -2.27 0.00 0.00 179.45 177.81 3g1r h PHE 208 N 0.39 0.08 -0.59 1.91 3.57 -0.89 -1.51 116.94 119.91 3g1r h PHE 208 Ca 0.14 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 3g1r h PHE 208 Cb 0.03 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 3g1r h PHE 208 CO -0.09 -0.00 0.25 0.00 -2.23 0.00 0.00 178.31 176.24 3g1r h GLN 210 N 0.80 0.59 0.00 0.00 4.20 -0.44 0.11 115.11 120.39 3g1r h GLN 210 Ca 0.20 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.87 3g1r h GLN 210 Cb 0.18 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3g1r h GLN 210 CO -0.02 0.39 0.00 1.96 -0.67 0.00 0.00 178.83 180.49 3g1r h GLN 211 N 0.61 0.00 -0.21 1.46 4.20 -0.80 -2.36 115.11 118.01 3g1r h GLN 211 Ca 0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.06 3g1r h GLN 211 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 3g1r h GLN 211 CO -0.27 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.61 3g1r n HIS 212 N -2.85 0.54 -3.80 2.96 8.25 -0.44 -4.97 115.22 114.91 3g1r n HIS 212 Ca -0.00 -0.75 -0.27 0.00 -0.26 0.00 0.00 57.72 56.43 3g1r n HIS 212 Cb 0.19 -0.18 0.04 0.00 1.12 0.00 0.00 29.99 31.17 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 -0.38 -4.91 -4.43 0.41 8.00 -0.60 -4.98 116.55 109.66 3g1r n ASP 213 Ca 0.15 -0.71 -0.34 0.00 0.71 0.00 0.00 54.79 54.60 3g1r n ASP 213 Cb 0.64 -4.25 -0.13 0.00 -0.02 0.00 0.00 41.12 37.36 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 -3.34 3.73 -0.00 0.53 1.01 0.27 -4.45 121.20 118.94 3g1r s ILE 214 Ca 0.58 -0.40 -0.23 0.00 0.00 0.00 0.00 60.65 60.60 3g1r s ILE 214 Cb -0.28 -2.66 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 3g1r s ILE 214 CO 0.80 0.45 0.68 -0.69 0.00 0.00 0.00 174.94 176.18 3g1r s VAL 215 N 0.85 4.89 -0.03 2.92 1.01 -0.62 -3.86 120.40 125.55 3g1r s VAL 215 Ca -0.01 1.42 -0.23 0.00 0.00 0.00 0.00 61.98 63.17 3g1r s VAL 215 Cb -0.14 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 3g1r s VAL 215 CO 0.02 0.36 0.69 -0.63 0.00 0.00 0.00 175.10 175.53 3g1r s ILE 216 N 0.12 4.96 -0.25 2.22 1.01 -1.26 -1.58 121.20 126.43 3g1r s ILE 216 Ca 0.35 1.44 -0.09 0.00 0.00 0.00 0.00 60.65 62.35 3g1r s ILE 216 Cb -0.19 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 3g1r s ILE 216 CO 0.19 0.31 0.13 -0.89 0.00 0.00 0.00 174.94 174.68 3g1r s THR 217 N 0.44 4.97 -0.61 2.92 2.01 -0.80 -1.28 115.64 123.30 3g1r s THR 217 Ca 0.36 0.05 -0.27 0.00 0.31 0.00 0.00 61.69 62.14 3g1r s THR 217 Cb -0.18 -3.33 0.03 0.00 0.01 0.00 0.00 72.50 69.04 3g1r s THR 217 CO 0.19 0.33 1.15 0.00 -0.69 0.00 0.00 174.62 175.59 3g1r s ALA 218 N 1.34 2.99 0.59 7.40 0.00 0.14 -1.10 121.76 133.12 3g1r s ALA 218 Ca 0.06 -1.06 -0.09 0.00 0.00 0.00 0.00 51.96 50.87 3g1r s ALA 218 Cb -0.15 -4.01 -0.03 0.00 0.00 0.00 0.00 23.12 18.94 3g1r s ALA 218 CO 0.06 -2.73 0.96 1.52 0.00 0.00 0.00 175.76 175.57 3g1r s TYR 219 N 4.85 3.55 -1.49 0.00 -0.85 0.02 -2.96 117.35 120.47 3g1r s TYR 219 Ca 0.38 1.09 -0.02 0.00 -0.52 0.00 0.00 57.07 57.99 3g1r s TYR 219 Cb -0.09 -2.64 0.02 0.00 0.38 0.00 0.00 41.96 39.63 3g1r s TYR 219 CO 0.21 -0.64 0.31 0.43 -1.52 0.00 0.00 175.55 174.35 3g1r n SER 220 N -2.63 -0.16 0.04 -0.18 7.64 -1.26 -2.51 113.62 114.56 3g1r n SER 220 Ca 0.04 -1.11 0.10 0.00 1.01 0.00 0.00 58.87 58.92 3g1r n SER 220 Cb 0.55 -2.49 0.42 0.00 -1.01 0.00 0.00 64.21 61.68 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 -4.45 0.07 -0.32 1.43 -0.04 -1.26 -1.14 135.00 129.29 3g1r n PRO 221 Ca -0.27 0.25 0.10 0.00 -0.04 0.00 0.00 63.50 63.53 3g1r n PRO 221 Cb 0.67 -1.62 0.27 0.00 -0.04 0.00 0.00 33.50 32.78 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 -1.75 3.66 0.00 1.53 4.77 -1.26 -4.73 117.00 119.22 3g1r n LEU 222 Ca 0.04 -2.02 0.00 0.00 -0.03 0.00 0.00 56.01 54.00 3g1r n LEU 222 Cb 0.24 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 3g1r n LEU 222 CO 0.19 0.90 0.00 0.61 -1.33 0.00 0.00 177.39 177.76 3g1r n GLY 223 N 1.25 0.61 0.09 -0.72 0.00 -0.30 -4.58 105.19 101.54 3g1r n GLY 223 Ca 0.20 -0.51 0.01 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.68 -0.01 0.78 2.61 -2.24 -1.26 -4.54 114.28 106.94 3g1r n THR 224 Ca 0.00 0.04 0.11 0.00 -2.27 0.00 0.00 64.05 61.93 3g1r n THR 224 Cb 0.00 -0.07 0.49 0.00 -2.10 0.00 0.00 70.33 68.65 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 -2.56 0.06 -2.10 3.42 3.41 -1.26 -4.90 113.62 109.69 3g1r n SER 225 Ca -0.00 0.51 -0.19 0.00 -0.26 0.00 0.00 58.87 58.93 3g1r n SER 225 Cb 0.04 -0.52 -0.01 0.00 -0.26 0.00 0.00 64.21 63.46 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 -1.56 -1.49 -1.59 4.33 1.74 -1.26 -4.88 116.66 111.94 3g1r n ARG 226 Ca 0.05 0.94 -0.46 0.00 -0.77 0.00 0.00 57.85 57.62 3g1r n ARG 226 Cb 0.28 -5.47 -0.04 0.00 -1.02 0.00 0.00 32.46 26.21 3g1r n ARG 226 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3g1r n ASN 227 N -1.57 3.22 0.22 0.55 2.85 -1.26 -4.79 115.26 114.48 3g1r n ASN 227 Ca -0.22 0.51 0.15 0.00 -0.11 0.00 0.00 54.58 54.91 3g1r n ASN 227 Cb 0.67 -1.46 0.77 0.00 1.24 0.00 0.00 39.78 41.00 3g1r n ASN 227 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3g1r h PRO 228 N 12.69 0.00 -0.43 1.20 0.11 -1.90 0.03 132.00 143.70 3g1r h PRO 228 Ca -0.41 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.74 3g1r h PRO 228 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 3g1r h PRO 228 CO 0.97 0.00 0.29 0.82 -0.21 0.00 0.00 178.00 179.87 3g1r h ILE 229 N 0.00 1.00 0.00 4.15 1.08 -2.02 -3.40 117.51 118.32 3g1r h ILE 229 Ca 0.00 -0.14 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 3g1r h ILE 229 Cb 0.11 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 34.42 3g1r h ILE 229 CO 0.00 0.07 0.00 -2.67 -0.69 0.00 0.00 178.15 174.86 3g1r n TRP 230 N -4.48 0.00 -2.76 1.37 4.27 -0.64 -5.11 117.44 110.09 3g1r n TRP 230 Ca 0.05 0.00 -0.36 0.00 -3.89 0.00 0.00 57.50 53.30 3g1r n TRP 230 Cb 0.20 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.09 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 4.19 -0.72 -1.67 1.01 -0.10 -4.88 120.40 118.23 3g1r s VAL 231 Ca 0.00 1.74 -0.26 0.00 0.00 0.00 0.00 61.98 63.46 3g1r s VAL 231 Cb 0.00 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 3g1r s VAL 231 CO 0.00 0.07 1.81 0.21 0.00 0.00 0.00 175.10 177.19 3g1r s ASN 232 N -1.68 5.38 -0.17 3.32 2.47 -0.32 -4.80 114.94 119.14 3g1r s ASN 232 Ca 0.52 -0.08 0.08 0.00 0.42 0.00 0.00 52.86 53.80 3g1r s ASN 232 Cb -0.18 -2.54 0.52 0.00 -1.45 0.00 0.00 41.25 37.60 3g1r s ASN 232 CO 0.23 -2.38 1.33 1.33 -3.72 0.00 0.00 177.10 173.89 3g1r n VAL 233 N 7.29 1.84 -0.12 -5.21 0.24 -1.26 -4.27 118.33 116.84 3g1r n VAL 233 Ca 0.24 -0.93 -0.10 0.00 -2.04 0.00 0.00 64.34 61.51 3g1r n VAL 233 Cb 0.50 -0.39 0.04 0.00 -1.47 0.00 0.00 33.84 32.52 3g1r n VAL 233 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3g1r h SER 234 N 2.39 0.91 -3.89 -1.34 4.64 -1.95 -3.42 113.55 110.89 3g1r h SER 234 Ca 0.04 -0.35 -0.50 0.00 -0.47 0.00 0.00 61.79 60.50 3g1r h SER 234 Cb 1.53 -0.25 0.03 0.00 -0.31 0.00 0.00 62.40 63.40 3g1r h SER 234 CO 0.36 1.11 0.48 -0.44 -0.87 0.00 0.00 176.83 177.47 3g1r s SER 235 N -6.76 6.88 1.00 4.97 0.01 -1.26 -5.03 113.70 113.50 3g1r s SER 235 Ca -0.10 2.26 -0.11 0.00 1.31 0.00 0.00 55.95 59.30 3g1r s SER 235 Cb 0.12 -2.61 0.19 0.00 0.21 0.00 0.00 66.02 63.93 3g1r s SER 235 CO 0.86 -0.42 1.09 -2.16 0.41 0.00 0.00 173.24 173.02 3g1r s PRO 236 N -1.99 0.39 0.09 12.44 0.04 -1.26 -4.88 135.00 139.83 3g1r s PRO 236 Ca 0.52 1.10 -0.32 0.00 0.04 0.00 0.00 61.00 62.34 3g1r s PRO 236 Cb -0.30 -1.69 -0.11 0.00 0.04 0.00 0.00 34.50 32.44 3g1r s PRO 236 CO 0.38 -2.92 1.82 -2.30 0.04 0.00 0.00 177.00 174.02 3g1r n PRO 237 N -4.38 2.59 -0.29 0.56 -0.02 -1.26 -4.87 135.00 127.32 3g1r n PRO 237 Ca 0.07 0.94 0.01 0.00 -2.02 0.00 0.00 63.50 62.51 3g1r n PRO 237 Cb 0.54 -2.81 0.15 0.00 -0.02 0.00 0.00 33.50 31.35 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 8.39 0.71 0.00 2.45 5.85 -1.88 -2.08 115.31 128.75 3g1r h LEU 238 Ca -0.47 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.29 3g1r h LEU 238 Cb 1.24 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.16 3g1r h LEU 238 CO 0.94 0.43 0.00 0.18 -0.34 0.00 0.00 178.44 179.65 3g1r n LEU 239 N -4.71 0.00 -0.76 2.25 4.77 -1.26 -1.93 117.00 115.35 3g1r n LEU 239 Ca 0.12 0.22 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 3g1r n LEU 239 Cb 0.23 -0.22 0.14 0.00 -2.33 0.00 0.00 43.42 41.24 3g1r n LEU 239 CO 0.28 -0.05 0.59 0.29 -1.33 0.00 0.00 177.39 177.18 3g1r n LYS 240 N -1.22 1.92 -1.65 3.23 4.76 -0.78 -4.76 118.16 119.66 3g1r n LYS 240 Ca 0.13 -1.53 -0.48 0.00 -2.87 0.00 0.00 58.31 53.57 3g1r n LYS 240 Cb 0.17 -1.47 -0.05 0.00 -1.84 0.00 0.00 35.03 31.84 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 0.80 2.78 -0.02 4.39 -0.08 -0.81 -4.88 116.55 118.72 3g1r n ASP 241 Ca 0.13 1.08 -0.09 0.00 -1.51 0.00 0.00 54.79 54.41 3g1r n ASP 241 Cb 0.53 -1.37 -0.03 0.00 2.34 0.00 0.00 41.12 42.59 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 5.84 0.04 -0.14 -1.67 0.00 -1.94 -1.33 119.26 120.07 3g1r h ALA 242 Ca -0.46 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 3g1r h ALA 242 Cb 1.27 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 3g1r h ALA 242 CO 0.87 -0.53 0.07 1.25 0.00 0.00 0.00 179.25 180.91 3g1r h LEU 243 N -0.09 0.18 -1.05 0.00 5.85 -1.99 -0.31 115.31 117.90 3g1r h LEU 243 Ca 0.10 -0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3g1r h LEU 243 Cb 0.23 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 3g1r h LEU 243 CO -0.22 0.23 0.63 -0.07 -0.34 0.00 0.00 178.44 178.67 3g1r h LEU 244 N 0.11 1.02 -0.46 2.25 3.38 -1.88 0.28 115.31 120.01 3g1r h LEU 244 Ca 0.05 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.87 3g1r h LEU 244 Cb 0.09 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3g1r h LEU 244 CO -0.01 0.67 -0.32 0.78 0.09 0.00 0.00 178.44 179.65 3g1r h ASN 245 N 1.16 0.98 -0.38 -0.43 2.35 -0.90 -1.57 115.58 116.80 3g1r h ASN 245 Ca 0.41 -0.42 -0.11 0.00 -0.55 0.00 0.00 56.30 55.63 3g1r h ASN 245 Cb 0.12 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 3g1r h ASN 245 CO -0.15 1.21 -0.17 0.77 -1.65 0.00 0.00 177.43 177.44 3g1r h SER 246 N 0.78 0.86 -0.73 5.81 4.64 -0.26 -2.42 113.55 122.23 3g1r h SER 246 Ca 0.08 -0.29 -0.03 0.00 -0.47 0.00 0.00 61.79 61.07 3g1r h SER 246 Cb 0.91 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.73 3g1r h SER 246 CO 0.08 1.02 0.33 -0.07 -0.87 0.00 0.00 176.83 177.33 3g1r h LEU 247 N 0.75 0.99 -0.62 5.97 3.38 -0.91 -2.49 115.31 122.38 3g1r h LEU 247 Ca 0.11 -0.13 0.09 0.00 0.09 0.00 0.00 57.88 58.05 3g1r h LEU 247 Cb 0.69 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.12 3g1r h LEU 247 CO 0.05 0.85 0.26 1.23 0.09 0.00 0.00 178.44 180.93 3g1r h GLY 248 N 1.12 0.89 2.00 0.83 0.00 -0.89 -1.66 103.07 105.35 3g1r h GLY 248 Ca 0.26 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 3g1r h GLY 248 CO -0.03 0.01 -0.06 0.50 0.00 0.00 0.00 176.54 176.96 3g1r h LYS 249 N 0.47 0.00 0.00 4.80 1.57 -0.98 0.60 116.57 123.03 3g1r h LYS 249 Ca 0.31 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.06 3g1r h LYS 249 Cb 0.35 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 3g1r h LYS 249 CO -0.28 0.06 -0.13 0.00 -0.57 0.00 0.00 179.45 178.53 3g1r h ARG 250 N 0.00 0.00 0.00 3.15 3.08 -1.17 -3.26 114.38 116.18 3g1r h ARG 250 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g1r h ARG 250 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 3g1r h ARG 250 CO 0.01 0.13 -0.02 0.66 -1.07 0.00 0.00 179.97 179.68 3g1r n TYR 251 N -3.73 0.00 -3.75 3.04 4.02 -0.61 -4.99 117.16 111.14 3g1r n TYR 251 Ca -0.02 -0.34 -0.25 0.00 -0.01 0.00 0.00 57.90 57.29 3g1r n TYR 251 Cb 0.24 -0.04 0.04 0.00 -0.02 0.00 0.00 39.34 39.57 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 -0.36 -3.50 -4.39 7.72 5.15 -0.51 -5.00 115.26 114.37 3g1r n ASN 252 Ca 0.01 -0.74 -0.21 0.00 -0.60 0.00 0.00 54.58 53.03 3g1r n ASN 252 Cb 0.38 -4.23 -0.10 0.00 -0.53 0.00 0.00 39.78 35.29 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 -6.23 1.44 0.61 1.20 -0.14 0.09 -5.02 119.74 111.69 3g1r s LYS 253 Ca 0.36 -1.60 -0.06 0.00 -1.36 0.00 0.00 55.97 53.31 3g1r s LYS 253 Cb -0.17 -1.41 0.02 0.00 -1.68 0.00 0.00 37.83 34.58 3g1r s LYS 253 CO 0.80 0.26 0.92 0.95 -0.76 0.00 0.00 175.35 177.52 3g1r s THR 254 N -2.53 3.30 0.24 2.17 -4.23 -1.26 -4.01 115.64 109.32 3g1r s THR 254 Ca 0.23 -0.09 -0.05 0.00 -1.18 0.00 0.00 61.69 60.60 3g1r s THR 254 Cb -0.04 -3.33 0.21 0.00 1.34 0.00 0.00 72.50 70.68 3g1r s THR 254 CO 0.09 -0.34 1.81 0.00 -0.54 0.00 0.00 174.62 175.65 3g1r h ALA 255 N -0.26 1.15 -0.64 3.99 0.00 -1.86 -1.11 119.26 120.53 3g1r h ALA 255 Ca -0.45 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.55 3g1r h ALA 255 Cb 1.27 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 3g1r h ALA 255 CO 0.60 0.11 0.34 0.00 0.00 0.00 0.00 179.25 180.30 3g1r h ALA 256 N 1.44 0.85 -0.41 0.00 0.00 -1.93 -0.01 119.26 119.20 3g1r h ALA 256 Ca 0.39 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.22 3g1r h ALA 256 Cb 0.32 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3g1r h ALA 256 CO -0.23 -0.01 -0.15 1.96 0.00 0.00 0.00 179.25 180.81 3g1r h GLN 257 N 0.62 0.76 -0.22 0.00 4.20 -1.65 -1.72 115.11 117.09 3g1r h GLN 257 Ca 0.29 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 3g1r h GLN 257 Cb 0.22 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 3g1r h GLN 257 CO -0.20 0.87 0.10 0.82 -0.67 0.00 0.00 178.83 179.75 3g1r h ILE 258 N 0.68 1.14 -0.11 2.54 1.08 -0.43 -1.15 117.51 121.25 3g1r h ILE 258 Ca 0.11 -0.40 -0.10 0.00 -0.39 0.00 0.00 64.86 64.07 3g1r h ILE 258 Cb 0.64 1.01 -0.01 0.00 -3.07 0.00 0.00 36.82 35.38 3g1r h ILE 258 CO 0.04 0.14 -0.38 -0.37 -0.69 0.00 0.00 178.15 176.89 3g1r h VAL 259 N 0.22 1.30 -0.12 1.67 -1.51 -0.81 -0.31 116.25 116.70 3g1r h VAL 259 Ca 0.08 -1.44 -0.07 0.00 -1.23 0.00 0.00 66.70 64.04 3g1r h VAL 259 Cb 0.12 1.64 -0.00 0.00 -2.13 0.00 0.00 31.29 30.92 3g1r h VAL 259 CO -0.01 0.43 -0.18 -0.07 -1.23 0.00 0.00 177.57 176.51 3g1r h LEU 260 N 0.20 0.36 -0.96 4.19 3.38 -1.27 -2.96 115.31 118.25 3g1r h LEU 260 Ca 0.02 -0.53 0.06 0.00 0.09 0.00 0.00 57.88 57.52 3g1r h LEU 260 Cb 0.77 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.35 3g1r h LEU 260 CO 0.06 0.82 0.62 -0.09 0.09 0.00 0.00 178.44 179.94 3g1r h ARG 261 N -0.09 1.10 -0.18 1.13 9.65 -1.03 -1.82 114.38 123.14 3g1r h ARG 261 Ca 0.01 -0.07 0.05 0.00 -1.10 0.00 0.00 59.98 58.88 3g1r h ARG 261 Cb 0.75 -0.25 -0.06 0.00 -1.39 0.00 0.00 29.97 29.01 3g1r h ARG 261 CO 0.04 0.73 -0.26 0.35 2.80 0.00 0.00 179.97 183.63 3g1r h PHE 262 N 1.14 -0.69 -0.26 2.20 3.57 -0.97 0.35 116.94 122.27 3g1r h PHE 262 Ca 0.41 0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.84 3g1r h PHE 262 Cb 0.13 0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 3g1r h PHE 262 CO -0.01 -0.34 -0.25 -0.91 -2.23 0.00 0.00 178.31 174.57 3g1r h ASN 263 N -0.30 0.67 0.08 0.41 2.35 -1.33 -3.15 115.58 114.30 3g1r h ASN 263 Ca 0.11 -0.47 -0.06 0.00 -0.55 0.00 0.00 56.30 55.33 3g1r h ASN 263 Cb 0.48 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 3g1r h ASN 263 CO -0.35 1.00 -0.20 0.16 -1.65 0.00 0.00 177.43 176.40 3g1r h ILE 264 N 0.35 1.21 0.00 2.81 3.07 -1.10 -0.93 117.51 122.92 3g1r h ILE 264 Ca 0.04 -0.96 -0.02 0.00 1.55 0.00 0.00 64.86 65.47 3g1r h ILE 264 Cb 0.81 1.33 -0.00 0.00 -0.27 0.00 0.00 36.82 38.69 3g1r h ILE 264 CO 0.06 0.29 -0.08 -0.61 -1.05 0.00 0.00 178.15 176.77 3g1r h GLN 265 N 0.21 0.00 -0.51 0.16 4.15 -0.91 -1.53 115.11 116.68 3g1r h GLN 265 Ca 0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.46 3g1r h GLN 265 Cb 0.48 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.17 3g1r h GLN 265 CO 0.03 0.08 0.00 2.89 -1.93 0.00 0.00 178.83 179.90 3g1r n ARG 266 N -3.25 3.93 -0.81 1.69 1.85 -0.74 -4.94 116.66 114.38 3g1r n ARG 266 Ca -0.00 -2.93 0.00 0.00 -1.00 0.00 0.00 57.85 53.92 3g1r n ARG 266 Cb 0.31 -1.98 0.00 0.00 -1.05 0.00 0.00 32.46 29.74 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 0.53 0.52 3.66 2.89 0.00 -0.58 -5.04 105.19 107.18 3g1r n GLY 267 Ca 0.25 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 45.23 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 5.32 0.32 1.61 1.01 -0.43 -4.67 120.40 121.56 3g1r s VAL 268 Ca 0.00 0.31 -0.29 0.00 0.00 0.00 0.00 61.98 62.01 3g1r s VAL 268 Cb 0.00 -3.56 -0.10 0.00 0.00 0.00 0.00 36.38 32.73 3g1r s VAL 268 CO 0.00 0.32 1.21 -0.69 0.00 0.00 0.00 175.10 175.94 3g1r s VAL 269 N 1.12 3.05 -0.05 2.92 1.01 -0.40 -3.27 120.40 124.78 3g1r s VAL 269 Ca 0.10 1.04 0.06 0.00 0.00 0.00 0.00 61.98 63.19 3g1r s VAL 269 Cb -0.14 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 3g1r s VAL 269 CO 0.05 0.23 -0.25 0.68 0.00 0.00 0.00 175.10 175.81 3g1r s VAL 270 N -1.18 2.04 -0.55 2.92 -7.23 -0.13 0.28 120.40 116.55 3g1r s VAL 270 Ca 0.48 -1.07 0.06 0.00 -1.81 0.00 0.00 61.98 59.65 3g1r s VAL 270 Cb -0.36 -1.72 0.32 0.00 0.56 0.00 0.00 36.38 35.18 3g1r s VAL 270 CO 0.47 0.57 0.85 2.30 -0.31 0.00 0.00 175.10 178.98 3g1r n ILE 271 N 2.84 2.22 -1.84 -0.62 -5.35 -1.15 -0.80 119.36 114.65 3g1r n ILE 271 Ca -0.17 -5.27 -0.41 0.00 -0.27 0.00 0.00 62.75 56.63 3g1r n ILE 271 Cb 0.52 -1.39 -0.01 0.00 -1.74 0.00 0.00 39.64 37.02 3g1r n ILE 271 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 3g1r s PRO 272 N -2.99 4.15 -0.18 6.28 0.04 -1.19 -3.03 135.00 138.08 3g1r s PRO 272 Ca 0.45 2.52 -0.11 0.00 0.04 0.00 0.00 61.00 63.90 3g1r s PRO 272 Cb 0.26 -2.99 -0.05 0.00 0.04 0.00 0.00 34.50 31.76 3g1r s PRO 272 CO -0.10 -0.50 0.19 0.21 0.04 0.00 0.00 177.00 176.83 3g1r s LYS 273 N -1.77 4.15 -0.12 4.56 2.36 -1.26 -0.88 119.74 126.77 3g1r s LYS 273 Ca 0.54 -0.11 -0.09 0.00 -2.55 0.00 0.00 55.97 53.77 3g1r s LYS 273 Cb -0.46 -3.40 0.04 0.00 -1.05 0.00 0.00 37.83 32.96 3g1r s LYS 273 CO 0.59 0.33 0.30 0.45 1.55 0.00 0.00 175.35 178.57 3g1r s SER 274 N 0.26 -0.33 -0.20 1.43 0.15 -1.26 -4.94 113.70 108.81 3g1r s SER 274 Ca 0.11 0.63 0.16 0.00 0.70 0.00 0.00 55.95 57.55 3g1r s SER 274 Cb -0.12 0.57 0.60 0.00 -1.71 0.00 0.00 66.02 65.37 3g1r s SER 274 CO 0.01 -0.14 1.51 0.49 1.20 0.00 0.00 173.24 176.31 3g1r n PHE 275 N 3.58 1.25 -4.13 3.44 0.99 -1.26 -4.76 117.46 116.56 3g1r n PHE 275 Ca -0.19 -0.88 -0.35 0.00 -0.00 0.00 0.00 57.45 56.03 3g1r n PHE 275 Cb 0.56 -0.38 -0.13 0.00 -1.00 0.00 0.00 39.48 38.53 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 -1.68 4.77 0.20 4.37 3.84 -1.26 -4.90 114.94 120.28 3g1r s ASN 276 Ca 0.46 -0.20 -0.16 0.00 0.21 0.00 0.00 52.86 53.16 3g1r s ASN 276 Cb 0.36 -1.81 0.20 0.00 -0.55 0.00 0.00 41.25 39.46 3g1r s ASN 276 CO 0.10 0.08 1.61 0.25 -2.79 0.00 0.00 177.10 176.35 3g1r h LEU 277 N 7.38 -0.80 -0.48 3.21 5.85 -1.99 0.70 115.31 129.18 3g1r h LEU 277 Ca -0.35 0.20 -0.15 0.00 0.84 0.00 0.00 57.88 58.42 3g1r h LEU 277 Cb 1.18 0.46 -0.01 0.00 0.37 0.00 0.00 40.66 42.66 3g1r h LEU 277 CO 0.61 -0.25 -0.38 -0.33 -0.34 0.00 0.00 178.44 177.75 3g1r h GLU 278 N -0.07 0.84 -0.03 1.25 4.39 -2.00 -2.98 114.58 115.98 3g1r h GLU 278 Ca 0.28 -0.43 -0.20 0.00 0.34 0.00 0.00 59.36 59.35 3g1r h GLU 278 Cb 0.51 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.16 3g1r h GLU 278 CO -0.66 1.07 -0.83 0.00 -1.16 0.00 0.00 179.01 177.43 3g1r h ARG 279 N 0.69 0.33 -0.56 2.33 3.08 -1.81 -1.09 114.38 117.34 3g1r h ARG 279 Ca 0.06 -0.32 0.07 0.00 0.07 0.00 0.00 59.98 59.86 3g1r h ARG 279 Cb 0.95 0.08 -0.06 0.00 0.08 0.00 0.00 29.97 31.02 3g1r h ARG 279 CO 0.09 0.99 0.24 0.82 -1.07 0.00 0.00 179.97 181.04 3g1r h ILE 280 N 0.21 0.85 -0.25 2.04 2.04 -0.87 -0.66 117.51 120.86 3g1r h ILE 280 Ca -0.05 -0.15 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 3g1r h ILE 280 Cb 1.43 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 3g1r h ILE 280 CO 0.14 0.08 0.01 0.11 0.00 0.00 0.00 178.15 178.48 3g1r h LYS 281 N 0.45 0.43 -0.32 2.37 1.57 -1.38 -3.19 116.57 116.50 3g1r h LYS 281 Ca 0.27 -0.13 0.07 0.00 -1.87 0.00 0.00 60.65 58.98 3g1r h LYS 281 Cb 0.27 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.47 3g1r h LYS 281 CO -0.24 0.60 -0.12 1.49 -0.57 0.00 0.00 179.45 180.60 3g1r h GLU 282 N 0.21 -0.06 -0.00 3.15 4.81 -0.81 -1.88 114.58 119.99 3g1r h GLU 282 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3g1r h GLU 282 Cb 0.40 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.79 3g1r h GLU 282 CO 0.01 -0.04 0.01 -0.91 -0.73 0.00 0.00 179.01 177.35 3g1r h ASN 283 N -0.06 0.00 0.88 1.04 2.35 -1.14 -1.41 115.58 117.23 3g1r h ASN 283 Ca 0.16 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 3g1r h ASN 283 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 3g1r h ASN 283 CO -0.36 0.00 -0.61 0.33 -1.65 0.00 0.00 177.43 175.13 3g1r n PHE 284 N -3.47 0.57 -1.68 1.19 7.35 -0.72 -4.50 117.46 116.20 3g1r n PHE 284 Ca -0.03 0.16 -0.40 0.00 -0.76 0.00 0.00 57.45 56.42 3g1r n PHE 284 Cb 0.08 -0.66 -0.01 0.00 0.35 0.00 0.00 39.48 39.24 3g1r n PHE 284 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 3g1r n GLN 285 N -2.12 3.69 -0.23 -4.13 1.13 -0.53 -4.37 117.38 110.82 3g1r n GLN 285 Ca 0.03 -2.72 0.06 0.00 -1.94 0.00 0.00 57.00 52.43 3g1r n GLN 285 Cb 0.44 -2.89 0.08 0.00 0.11 0.00 0.00 30.24 27.98 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 3.51 1.14 0.13 5.09 -5.35 -1.26 -4.68 119.36 117.93 3g1r n ILE 286 Ca 0.64 -1.36 0.03 0.00 -0.27 0.00 0.00 62.75 61.79 3g1r n ILE 286 Cb 0.29 0.07 0.04 0.00 -1.74 0.00 0.00 39.64 38.30 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 -0.86 0.08 -0.38 4.28 3.72 -1.26 -4.57 117.46 118.46 3g1r n PHE 287 Ca 0.09 -0.17 0.08 0.00 -0.05 0.00 0.00 57.45 57.41 3g1r n PHE 287 Cb 0.65 -0.01 0.23 0.00 -0.94 0.00 0.00 39.48 39.42 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 0.22 3.54 -3.70 4.37 5.75 -1.26 -4.83 116.55 120.64 3g1r n ASP 288 Ca 0.04 -2.18 -0.10 0.00 -0.01 0.00 0.00 54.79 52.54 3g1r n ASP 288 Cb 0.21 -0.38 -0.03 0.00 -1.03 0.00 0.00 41.12 39.89 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 -1.34 0.36 0.11 2.11 -0.71 -1.26 -5.18 117.98 112.07 3g1r s PHE 289 Ca 0.35 -0.76 -0.03 0.00 -1.04 0.00 0.00 56.93 55.45 3g1r s PHE 289 Cb 0.21 0.32 -0.03 0.00 -1.21 0.00 0.00 43.02 42.30 3g1r s PHE 289 CO 0.20 -1.14 0.08 -1.54 -1.34 0.00 0.00 175.22 171.49 3g1r s SER 290 N -3.05 0.29 -0.02 1.98 1.04 -1.26 -5.02 113.70 107.67 3g1r s SER 290 Ca 0.21 -1.05 -0.11 0.00 0.48 0.00 0.00 55.95 55.49 3g1r s SER 290 Cb -0.02 0.30 -0.05 0.00 0.10 0.00 0.00 66.02 66.35 3g1r s SER 290 CO 0.11 -0.72 0.32 -0.76 0.98 0.00 0.00 173.24 173.17 3g1r s LEU 291 N -2.98 4.42 0.90 2.42 1.43 -1.26 -5.09 118.68 118.51 3g1r s LEU 291 Ca 0.17 0.75 -0.11 0.00 -1.03 0.00 0.00 54.13 53.90 3g1r s LEU 291 Cb 0.07 -2.54 0.13 0.00 0.03 0.00 0.00 46.19 43.88 3g1r s LEU 291 CO -0.03 0.31 1.09 0.42 0.23 0.00 0.00 176.35 178.37 3g1r s THR 292 N -1.15 2.64 0.30 5.49 -4.23 -1.26 -4.78 115.64 112.64 3g1r s THR 292 Ca 0.24 0.21 -0.01 0.00 -1.18 0.00 0.00 61.69 60.95 3g1r s THR 292 Cb -0.15 -2.67 0.27 0.00 1.34 0.00 0.00 72.50 71.29 3g1r s THR 292 CO 0.12 -0.27 1.93 -0.33 -0.54 0.00 0.00 174.62 175.53 3g1r h GLU 293 N -1.57 1.05 -0.53 3.99 4.39 -1.99 -0.35 114.58 119.56 3g1r h GLU 293 Ca -0.49 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.13 3g1r h GLU 293 Cb 1.28 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 29.67 3g1r h GLU 293 CO 0.54 0.69 0.28 1.49 -1.16 0.00 0.00 179.01 180.85 3g1r h GLU 294 N 1.08 0.75 -0.33 2.33 4.81 -1.99 -2.31 114.58 118.92 3g1r h GLU 294 Ca 0.36 -0.10 -0.12 0.00 -0.13 0.00 0.00 59.36 59.38 3g1r h GLU 294 Cb 0.07 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 3g1r h GLU 294 CO -0.12 0.60 -0.28 0.93 -0.73 0.00 0.00 179.01 179.41 3g1r h GLU 295 N 0.72 0.67 -0.63 1.92 5.08 -1.65 0.12 114.58 120.80 3g1r h GLU 295 Ca 0.19 -0.28 0.04 0.00 -1.00 0.00 0.00 59.36 58.30 3g1r h GLU 295 Cb 0.07 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 3g1r h GLU 295 CO -0.03 0.87 0.38 0.52 -1.00 0.00 0.00 179.01 179.75 3g1r h MET 296 N 0.58 0.71 -0.36 2.33 2.86 -0.97 -1.21 114.93 118.86 3g1r h MET 296 Ca 0.07 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.54 3g1r h MET 296 Cb 0.77 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 3g1r h MET 296 CO 0.06 0.47 -0.29 0.87 1.06 0.00 0.00 176.91 179.09 3g1r h LYS 297 N 0.74 0.77 -0.74 1.72 1.57 -0.79 -1.18 116.57 118.64 3g1r h LYS 297 Ca 0.26 -0.34 0.10 0.00 -1.87 0.00 0.00 60.65 58.81 3g1r h LYS 297 Cb 0.06 -0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.28 3g1r h LYS 297 CO -0.12 0.96 0.37 -0.44 -0.57 0.00 0.00 179.45 179.65 3g1r h ASP 298 N 0.65 0.48 0.02 0.86 3.32 -0.35 -2.02 116.42 119.37 3g1r h ASP 298 Ca 0.08 0.07 -0.22 0.00 0.02 0.00 0.00 57.03 56.97 3g1r h ASP 298 Cb 0.81 -0.01 0.02 0.00 0.22 0.00 0.00 39.33 40.37 3g1r h ASP 298 CO 0.07 0.26 -0.88 0.40 -1.72 0.00 0.00 179.24 177.37 3g1r h ILE 299 N 0.61 1.35 -0.88 0.35 1.08 -0.93 -3.03 117.51 116.05 3g1r h ILE 299 Ca 0.37 -2.21 0.13 0.00 -0.39 0.00 0.00 64.86 62.77 3g1r h ILE 299 Cb 0.42 2.53 -0.07 0.00 -3.07 0.00 0.00 36.82 36.63 3g1r h ILE 299 CO -0.29 0.67 0.57 -0.33 -0.69 0.00 0.00 178.15 178.07 3g1r h GLU 300 N 0.16 0.70 0.00 2.37 5.08 -1.10 -1.10 114.58 120.69 3g1r h GLU 300 Ca -0.11 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3g1r h GLU 300 Cb 1.57 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.66 3g1r h GLU 300 CO 0.17 0.47 0.00 0.00 -1.00 0.00 0.00 179.01 178.65 3g1r n ALA 301 N -2.43 1.81 0.57 3.43 0.00 -0.77 -2.04 120.51 121.08 3g1r n ALA 301 Ca 0.17 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.65 3g1r n ALA 301 Cb 0.43 -1.27 0.45 0.00 0.00 0.00 0.00 19.45 19.05 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 -1.45 0.42 -4.69 0.00 4.77 -0.42 -4.87 117.00 110.76 3g1r n LEU 302 Ca 0.05 0.58 -0.54 0.00 -0.03 0.00 0.00 56.01 56.06 3g1r n LEU 302 Cb 0.18 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.72 3g1r n LEU 302 CO 0.15 -0.31 1.32 -3.20 -1.33 0.00 0.00 177.39 174.02 3g1r n ASN 303 N -1.93 2.59 -0.00 -1.43 4.05 -0.65 -4.42 115.26 113.47 3g1r n ASN 303 Ca 0.04 1.06 0.09 0.00 0.45 0.00 0.00 54.58 56.21 3g1r n ASN 303 Cb 0.27 -1.21 -0.11 0.00 1.23 0.00 0.00 39.78 39.96 3g1r n ASN 303 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 3g1r n LYS 304 N 5.30 0.76 -3.50 1.20 5.02 -0.02 -4.97 118.16 121.96 3g1r n LYS 304 Ca 0.24 -0.01 -0.26 0.00 -2.02 0.00 0.00 58.31 56.27 3g1r n LYS 304 Cb 0.18 -1.39 0.02 0.00 -0.02 0.00 0.00 35.03 33.82 3g1r n LYS 304 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3g1r n ASN 305 N -1.47 -4.81 -4.12 4.39 2.85 -1.05 -4.98 115.26 106.06 3g1r n ASN 305 Ca 0.03 -0.52 -0.32 0.00 -0.11 0.00 0.00 54.58 53.67 3g1r n ASN 305 Cb 0.30 -3.89 -0.16 0.00 1.24 0.00 0.00 39.78 37.27 3g1r n ASN 305 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3g1r s VAL 306 N -3.14 1.92 0.18 3.44 1.01 -1.24 -5.07 120.40 117.50 3g1r s VAL 306 Ca 0.49 -0.88 -0.26 0.00 0.00 0.00 0.00 61.98 61.32 3g1r s VAL 306 Cb -0.24 -1.73 -0.08 0.00 0.00 0.00 0.00 36.38 34.33 3g1r s VAL 306 CO 0.60 0.52 0.82 -0.13 0.00 0.00 0.00 175.10 176.91 3g1r s ARG 307 N 1.06 4.64 0.25 2.72 0.52 -1.26 -4.52 118.95 122.35 3g1r s ARG 307 Ca -0.02 1.24 0.13 0.00 -0.52 0.00 0.00 55.73 56.56 3g1r s ARG 307 Cb -0.14 -3.27 0.12 0.00 0.52 0.00 0.00 34.95 32.18 3g1r s ARG 307 CO -0.06 0.55 1.46 0.74 0.02 0.00 0.00 175.30 178.01 3g1r h PHE 308 N 4.33 0.00 -3.53 -0.53 -1.00 -1.94 -3.42 116.94 110.86 3g1r h PHE 308 Ca -0.46 0.00 -0.69 0.00 2.81 0.00 0.00 57.97 59.62 3g1r h PHE 308 Cb 1.20 0.00 -0.35 0.00 3.61 0.00 0.00 35.95 40.41 3g1r h PHE 308 CO 0.63 0.64 -0.41 0.08 -1.61 0.00 0.00 178.31 177.64 3g1r s VAL 309 N -3.05 3.58 -0.12 -0.55 1.01 -1.26 -1.18 120.40 118.83 3g1r s VAL 309 Ca 0.02 -2.82 0.16 0.00 0.00 0.00 0.00 61.98 59.35 3g1r s VAL 309 Cb 0.09 -3.36 -0.22 0.00 0.00 0.00 0.00 36.38 32.89 3g1r s VAL 309 CO 0.76 -0.84 0.50 -0.62 0.00 0.00 0.00 175.10 174.90 3g1r n GLU 310 N 3.66 0.65 -3.84 2.72 1.02 -1.26 -4.99 120.64 118.59 3g1r n GLU 310 Ca 0.06 0.13 -0.26 0.00 -0.02 0.00 0.00 57.16 57.07 3g1r n GLU 310 Cb 0.38 -1.68 0.02 0.00 -0.02 0.00 0.00 31.44 30.14 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 -2.83 -2.70 0.26 -4.62 4.77 -1.26 -4.85 117.00 105.77 3g1r n LEU 311 Ca -0.19 -0.84 0.10 0.00 -0.03 0.00 0.00 56.01 55.05 3g1r n LEU 311 Cb 0.98 -2.53 0.69 0.00 -2.33 0.00 0.00 43.42 40.23 3g1r n LEU 311 CO 0.44 0.43 1.03 -0.07 -1.33 0.00 0.00 177.39 177.89 3g1r h LEU 312 N -1.93 0.00 -1.59 2.23 3.38 -1.96 -1.88 115.31 113.55 3g1r h LEU 312 Ca -0.60 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.37 3g1r h LEU 312 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 3g1r h LEU 312 CO 0.62 0.05 0.00 0.00 0.09 0.00 0.00 178.44 179.21 3g1r h MET 313 N 0.00 0.00 -0.33 1.13 -0.00 -2.03 -2.31 114.93 111.39 3g1r h MET 313 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3g1r h MET 313 Cb 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.71 3g1r h MET 313 CO 0.01 0.00 0.00 0.91 -0.00 0.00 0.00 176.91 177.83 3g1r n TRP 314 N -2.63 0.88 0.31 -0.10 8.01 -0.71 -4.61 117.44 118.60 3g1r n TRP 314 Ca -0.00 -0.73 0.19 0.00 -1.31 0.00 0.00 57.50 55.65 3g1r n TRP 314 Cb 0.16 -0.23 1.05 0.00 -2.01 0.00 0.00 31.31 30.28 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 2.14 0.00 -0.01 -0.99 3.08 -1.51 -1.44 114.38 115.65 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 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 3g1r h ARG 315 CO 0.17 0.00 -0.02 -0.40 -1.07 0.00 0.00 179.97 178.65 3g1r n ASP 316 N -3.34 1.52 -4.74 7.04 5.75 -1.26 -4.82 116.55 116.69 3g1r n ASP 316 Ca -0.02 -1.47 -0.41 0.00 -0.01 0.00 0.00 54.79 52.88 3g1r n ASP 316 Cb 0.14 0.01 -0.03 0.00 -1.03 0.00 0.00 41.12 40.21 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 -2.04 3.41 0.55 2.11 2.46 -0.54 -4.90 115.29 116.34 3g1r s HIS 317 Ca 0.37 1.45 0.27 0.00 0.47 0.00 0.00 55.06 57.61 3g1r s HIS 317 Cb 0.21 -3.44 1.45 0.00 -0.13 0.00 0.00 32.58 30.68 3g1r s HIS 317 CO 0.35 -1.20 1.99 -1.35 -2.47 0.00 0.00 174.74 172.06 3g1r h PRO 318 N 4.95 0.00 -0.44 2.88 0.11 -1.89 -1.10 132.00 136.51 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 0.73 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.91 3g1r n GLU 319 N -4.17 3.64 -1.65 1.05 -0.58 -1.26 -4.99 120.64 112.69 3g1r n GLU 319 Ca 0.09 -2.86 -0.51 0.00 -0.42 0.00 0.00 57.16 53.46 3g1r n GLU 319 Cb 0.60 -1.91 -0.06 0.00 -0.57 0.00 0.00 31.44 29.50 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 0.25 1.94 0.78 -0.32 4.19 -0.42 -4.46 117.16 119.12 3g1r n TYR 320 Ca 0.23 0.42 0.13 0.00 3.31 0.00 0.00 57.90 61.99 3g1r n TYR 320 Cb 0.93 -2.46 0.33 0.00 0.49 0.00 0.00 39.34 38.62 3g1r n TYR 320 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 3g1r n PRO 321 N 3.98 0.15 -0.27 2.98 -0.04 -1.26 -4.26 135.00 136.28 3g1r n PRO 321 Ca 0.20 0.07 0.09 0.00 -0.04 0.00 0.00 63.50 63.82 3g1r n PRO 321 Cb 0.22 -1.62 0.24 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.86 0.70 -0.11 0.54 0.99 -1.26 -4.14 117.46 112.32 3g1r n PHE 322 Ca 0.05 -0.47 -0.12 0.00 -0.00 0.00 0.00 57.45 56.91 3g1r n PHE 322 Cb 0.39 -0.01 -0.03 0.00 -1.00 0.00 0.00 39.48 38.83 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 3.26 0.82 -4.18 1.38 3.86 -1.98 -3.45 115.15 114.85 3g1r h HIS 323 Ca 0.00 -0.20 -0.51 0.00 -1.16 0.00 0.00 60.37 58.50 3g1r h HIS 323 Cb 0.86 -0.19 0.11 0.00 1.06 0.00 0.00 27.41 29.25 3g1r h HIS 323 CO 0.35 0.92 0.39 -0.51 0.86 0.00 0.00 177.93 179.94 3g1r s ASP 324 N -6.41 5.07 0.22 2.45 1.01 -1.26 -4.92 116.67 112.83 3g1r s ASP 324 Ca -0.13 2.09 -0.08 0.00 0.71 0.00 0.00 52.55 55.14 3g1r s ASP 324 Cb 0.09 -2.56 0.34 0.00 1.01 0.00 0.00 42.92 41.80 3g1r s ASP 324 CO 0.82 -1.66 1.72 -0.08 0.21 0.00 0.00 175.17 176.18 3g1r h GLU 325 N 0.18 0.34 0.00 8.23 4.81 -1.93 -3.51 114.58 122.70 3g1r h GLU 325 Ca -0.47 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3g1r h GLU 325 Cb 1.26 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.56 3g1r h GLU 325 CO 0.54 0.23 0.00 2.48 -0.73 0.00 0.00 179.01 181.53