#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d2r s LYS 2 N 0.00 3.80 -0.12 0.03 1.02 -1.26 -4.86 119.74 118.35 1d2r s LYS 2 Ca 0.00 0.86 -0.01 0.00 0.02 0.00 0.00 55.97 56.84 1d2r s LYS 2 Cb 0.00 -2.12 -0.02 0.00 -0.52 0.00 0.00 37.83 35.17 1d2r s LYS 2 CO 0.00 -0.39 -0.08 0.99 -0.92 0.00 0.00 175.35 174.95 1d2r s THR 3 N -2.85 3.53 -0.15 2.17 2.01 -1.26 -1.19 115.64 117.91 1d2r s THR 3 Ca 0.57 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 62.07 1d2r s THR 3 Cb -0.10 -2.49 -0.00 0.00 0.01 0.00 0.00 72.50 69.91 1d2r s THR 3 CO 0.41 0.54 -0.16 -0.63 -0.69 0.00 0.00 174.62 174.08 1d2r s ILE 4 N -0.00 2.62 -0.10 1.82 1.01 -0.16 -0.33 121.20 126.06 1d2r s ILE 4 Ca -0.01 -0.79 -0.00 0.00 0.00 0.00 0.00 60.65 59.84 1d2r s ILE 4 Cb -0.14 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 1d2r s ILE 4 CO 0.03 0.52 -0.08 0.12 0.00 0.00 0.00 174.94 175.53 1d2r s PHE 5 N 0.73 2.91 -0.06 3.97 2.19 -0.98 -0.46 117.98 126.29 1d2r s PHE 5 Ca -0.07 -0.22 -0.01 0.00 0.33 0.00 0.00 56.93 56.96 1d2r s PHE 5 Cb -0.16 -1.80 0.03 0.00 -1.31 0.00 0.00 43.02 39.79 1d2r s PHE 5 CO 0.01 0.11 0.02 0.45 1.83 0.00 0.00 175.22 177.64 1d2r s SER 6 N -0.24 1.33 0.10 6.13 0.15 0.45 -4.14 113.70 117.48 1d2r s SER 6 Ca 0.03 -0.02 -0.23 0.00 0.70 0.00 0.00 55.95 56.43 1d2r s SER 6 Cb -0.13 -0.31 -0.07 0.00 -1.71 0.00 0.00 66.02 63.80 1d2r s SER 6 CO 0.03 -0.21 0.70 -0.83 1.20 0.00 0.00 173.24 174.13 1d2r s GLY 7 N 1.97 2.80 -0.20 9.45 0.00 -1.26 -1.64 107.32 118.44 1d2r s GLY 7 Ca 0.04 0.22 0.02 0.00 0.00 0.00 0.00 44.72 45.00 1d2r s GLY 7 CO -0.04 0.80 -0.17 -0.42 0.00 0.00 0.00 173.10 173.27 1d2r s ILE 8 N -0.80 2.08 -0.04 0.90 -1.09 0.39 -4.93 121.20 117.71 1d2r s ILE 8 Ca 0.34 -1.14 -0.30 0.00 -2.23 0.00 0.00 60.65 57.32 1d2r s ILE 8 Cb -0.21 -1.97 -0.04 0.00 -1.58 0.00 0.00 42.46 38.66 1d2r s ILE 8 CO 0.23 0.37 1.27 -1.10 -1.23 0.00 0.00 174.94 174.48 1d2r s GLN 9 N 1.24 4.32 -0.43 2.79 -1.52 -1.26 -2.23 119.66 122.58 1d2r s GLN 9 Ca 0.01 1.77 -0.28 0.00 -1.95 0.00 0.00 55.36 54.91 1d2r s GLN 9 Cb -0.15 -3.57 0.00 0.00 -0.22 0.00 0.00 33.01 29.07 1d2r s GLN 9 CO -0.11 -0.50 1.54 -1.25 -0.25 0.00 0.00 175.29 174.72 1d2r s PRO 10 N 2.34 3.42 0.00 2.91 0.04 -1.26 -4.61 135.00 137.83 1d2r s PRO 10 Ca 0.59 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.59 1d2r s PRO 10 Cb -0.27 -4.10 0.00 0.00 0.04 0.00 0.00 34.50 30.17 1d2r s PRO 10 CO 0.23 -1.77 0.06 0.43 0.04 0.00 0.00 177.00 176.00 1d2r n SER 11 N 9.54 0.00 -0.85 6.66 7.64 -1.26 -4.91 113.62 130.44 1d2r n SER 11 Ca 0.18 -1.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.00 1d2r n SER 11 Cb 0.48 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.66 1d2r n SER 11 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1d2r n GLY 12 N 0.00 0.52 2.55 0.23 0.00 -1.26 -4.86 105.19 102.37 1d2r n GLY 12 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1d2r n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2r s VAL 13 N -1.27 0.34 -0.21 1.61 0.11 -1.26 -4.94 120.40 114.79 1d2r s VAL 13 Ca 0.00 -1.50 -0.04 0.00 -2.93 0.00 0.00 61.98 57.51 1d2r s VAL 13 Cb 0.00 -1.26 -0.02 0.00 -1.53 0.00 0.00 36.38 33.57 1d2r s VAL 13 CO 0.00 -0.86 -0.03 0.27 -3.33 0.00 0.00 175.10 171.16 1d2r s ILE 14 N 1.36 3.63 0.76 7.04 -4.36 -1.26 -4.90 121.20 123.46 1d2r s ILE 14 Ca 0.14 -0.42 -0.12 0.00 -0.26 0.00 0.00 60.65 60.00 1d2r s ILE 14 Cb -0.20 -2.64 0.05 0.00 1.25 0.00 0.00 42.46 40.91 1d2r s ILE 14 CO -0.14 0.43 1.11 0.42 0.24 0.00 0.00 174.94 177.00 1d2r s THR 15 N 1.21 3.06 0.57 8.37 -4.23 -1.26 -2.57 115.64 120.80 1d2r s THR 15 Ca 0.03 0.40 0.38 0.00 -1.18 0.00 0.00 61.69 61.31 1d2r s THR 15 Cb -0.14 -2.84 0.40 0.00 1.34 0.00 0.00 72.50 71.25 1d2r s THR 15 CO -0.00 -0.40 2.28 -0.29 -0.54 0.00 0.00 174.62 175.66 1d2r h ILE 16 N -0.84 0.22 -0.16 2.99 6.09 -1.25 0.88 117.51 125.43 1d2r h ILE 16 Ca -0.45 -0.11 -0.22 0.00 -1.37 0.00 0.00 64.86 62.71 1d2r h ILE 16 Cb 1.24 1.08 0.01 0.00 0.47 0.00 0.00 36.82 39.63 1d2r h ILE 16 CO 0.51 0.01 -0.77 1.23 -3.07 0.00 0.00 178.15 176.06 1d2r h GLY 17 N 0.27 0.89 0.96 8.18 0.00 -1.90 -1.09 103.07 110.38 1d2r h GLY 17 Ca -0.00 -1.25 -0.04 0.00 0.00 0.00 0.00 47.33 46.04 1d2r h GLY 17 CO 0.00 1.11 0.13 3.43 0.00 0.00 0.00 176.54 181.21 1d2r h ASN 18 N 0.55 0.70 -0.61 0.19 -0.26 -1.20 0.58 115.58 115.53 1d2r h ASN 18 Ca -0.05 -0.22 0.00 0.00 -0.56 0.00 0.00 56.30 55.47 1d2r h ASN 18 Cb 1.40 -0.19 -0.03 0.00 -1.06 0.00 0.00 38.32 38.45 1d2r h ASN 18 CO 0.16 0.74 0.39 0.22 -1.06 0.00 0.00 177.43 177.88 1d2r h TYR 19 N 0.63 0.78 -0.03 1.19 5.03 -1.25 -1.33 116.97 121.99 1d2r h TYR 19 Ca 0.15 0.01 -0.25 0.00 2.58 0.00 0.00 58.73 61.22 1d2r h TYR 19 Cb 0.30 -0.26 0.02 0.00 1.55 0.00 0.00 36.73 38.34 1d2r h TYR 19 CO 0.02 0.52 -0.97 0.82 -1.32 0.00 0.00 178.16 177.22 1d2r h ILE 20 N 0.82 1.30 -0.18 1.81 2.04 -0.98 -0.68 117.51 121.64 1d2r h ILE 20 Ca 0.22 -2.21 -0.02 0.00 1.00 0.00 0.00 64.86 63.84 1d2r h ILE 20 Cb -0.06 2.30 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 1d2r h ILE 20 CO -0.04 0.68 0.02 1.23 0.00 0.00 0.00 178.15 180.04 1d2r h GLY 21 N 0.57 0.32 0.00 5.37 0.00 0.39 -3.45 103.07 106.28 1d2r h GLY 21 Ca -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1d2r h GLY 21 CO 0.19 0.21 0.00 0.00 0.00 0.00 0.00 176.54 176.93 1d2r n ALA 22 N -2.30 2.62 -0.35 3.60 0.00 -0.55 -4.52 120.51 119.01 1d2r n ALA 22 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.38 1d2r n ALA 22 Cb 0.20 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.68 1d2r n ALA 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1d2r n LEU 23 N -2.45 -0.61 0.11 0.00 -0.00 -0.89 -0.13 117.00 113.04 1d2r n LEU 23 Ca 0.00 1.59 0.04 0.00 -0.00 0.00 0.00 56.01 57.63 1d2r n LEU 23 Cb 0.00 -0.35 0.44 0.00 -0.00 0.00 0.00 43.42 43.51 1d2r n LEU 23 CO 0.00 -1.42 0.99 -0.09 -0.00 0.00 0.00 177.39 176.87 1d2r h ARG 24 N 0.00 0.27 -0.10 1.96 2.43 -1.34 -1.33 114.38 116.27 1d2r h ARG 24 Ca 0.30 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 1d2r h ARG 24 Cb 0.53 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1d2r h ARG 24 CO -0.90 0.31 0.00 0.37 -1.51 0.00 0.00 179.97 178.24 1d2r h GLN 25 N 0.27 0.14 -0.39 0.20 5.75 -0.77 -3.03 115.11 117.28 1d2r h GLN 25 Ca 0.06 -0.01 -0.16 0.00 -0.15 0.00 0.00 58.65 58.39 1d2r h GLN 25 Cb 0.20 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 1d2r h GLN 25 CO 0.01 0.15 -0.37 0.74 -2.65 0.00 0.00 178.83 176.71 1d2r h PHE 26 N 0.14 1.10 -0.23 3.99 0.04 -1.02 -2.02 116.94 118.93 1d2r h PHE 26 Ca 0.04 -0.32 0.07 0.00 2.80 0.00 0.00 57.97 60.55 1d2r h PHE 26 Cb 0.09 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.00 1d2r h PHE 26 CO 0.00 1.14 0.32 0.28 -0.60 0.00 0.00 178.31 179.46 1d2r h VAL 27 N 0.75 0.30 0.01 -0.55 2.07 -1.58 0.13 116.25 117.39 1d2r h VAL 27 Ca 0.07 0.00 -0.32 0.00 0.82 0.00 0.00 66.70 67.26 1d2r h VAL 27 Cb 0.96 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 1d2r h VAL 27 CO 0.09 0.00 -1.77 -0.62 0.02 0.00 0.00 177.57 175.29 1d2r n GLU 28 N -3.52 0.59 0.18 1.57 1.02 -1.11 -4.35 120.64 115.03 1d2r n GLU 28 Ca 0.03 0.44 0.15 0.00 -0.02 0.00 0.00 57.16 57.75 1d2r n GLU 28 Cb 0.45 -1.66 0.73 0.00 -0.02 0.00 0.00 31.44 30.95 1d2r n GLU 28 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1d2r h LEU 29 N -0.87 0.00 -1.35 -4.62 3.38 -0.72 -2.66 115.31 108.47 1d2r h LEU 29 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1d2r h LEU 29 Cb 1.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1d2r h LEU 29 CO -0.25 0.00 0.08 0.06 0.09 0.00 0.00 178.44 178.42 1d2r h GLN 30 N 0.00 0.00 0.01 1.13 3.07 -1.19 -0.77 115.11 117.36 1d2r h GLN 30 Ca 0.09 0.00 -0.32 0.00 0.09 0.00 0.00 58.65 58.52 1d2r h GLN 30 Cb 0.41 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 27.92 1d2r h GLN 30 CO -0.00 0.00 -1.88 0.72 0.09 0.00 0.00 178.83 177.76 1d2r n HIS 31 N -2.24 0.82 -0.09 0.06 8.25 -1.00 -4.54 115.22 116.48 1d2r n HIS 31 Ca -0.01 0.28 -0.19 0.00 -0.26 0.00 0.00 57.72 57.53 1d2r n HIS 31 Cb 0.11 -1.15 -0.12 0.00 1.12 0.00 0.00 29.99 29.96 1d2r n HIS 31 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1d2r h GLU 32 N 0.01 0.00 -7.06 -0.41 5.08 -1.51 -3.48 114.58 107.20 1d2r h GLU 32 Ca -0.35 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.54 1d2r h GLU 32 Cb 2.06 0.00 0.08 0.00 0.50 0.00 0.00 28.75 31.38 1d2r h GLU 32 CO 0.07 0.99 0.08 0.71 -1.00 0.00 0.00 179.01 179.86 1d2r s TYR 33 N -2.32 1.65 -0.61 4.33 2.02 -0.38 -4.77 117.35 117.28 1d2r s TYR 33 Ca -0.26 -0.29 -0.09 0.00 -0.37 0.00 0.00 57.07 56.06 1d2r s TYR 33 Cb 0.03 -2.92 0.16 0.00 -0.40 0.00 0.00 41.96 38.83 1d2r s TYR 33 CO 0.62 -1.62 0.49 1.21 -1.57 0.00 0.00 175.55 174.68 1d2r s ASN 34 N -4.71 5.87 0.11 2.29 3.84 -0.33 -4.69 114.94 117.32 1d2r s ASN 34 Ca 0.65 -2.38 -0.26 0.00 0.21 0.00 0.00 52.86 51.09 1d2r s ASN 34 Cb -0.06 -2.03 -0.07 0.00 -0.55 0.00 0.00 41.25 38.55 1d2r s ASN 34 CO 0.44 -0.58 0.79 0.00 -2.79 0.00 0.00 177.10 174.96 1d2r s TYR 36 N -0.56 2.67 -0.39 0.00 1.51 0.39 -2.08 117.35 118.89 1d2r s TYR 36 Ca 0.38 -1.80 -0.07 0.00 -1.01 0.00 0.00 57.07 54.56 1d2r s TYR 36 Cb -0.22 -1.73 0.07 0.00 -0.11 0.00 0.00 41.96 39.96 1d2r s TYR 36 CO 0.25 -0.79 0.19 -0.06 -1.11 0.00 0.00 175.55 174.03 1d2r s PHE 37 N 1.31 3.34 -0.25 2.71 0.08 0.86 -0.41 117.98 125.62 1d2r s PHE 37 Ca -0.03 -1.62 -0.05 0.00 0.12 0.00 0.00 56.93 55.34 1d2r s PHE 37 Cb -0.17 -2.73 -0.01 0.00 -0.57 0.00 0.00 43.02 39.54 1d2r s PHE 37 CO -0.08 -0.82 0.02 0.00 -0.10 0.00 0.00 175.22 174.24 1d2r s ILE 39 N 1.52 3.97 -0.70 0.00 1.01 -0.13 -0.46 121.20 126.40 1d2r s ILE 39 Ca 0.05 -1.29 -0.26 0.00 0.00 0.00 0.00 60.65 59.15 1d2r s ILE 39 Cb -0.15 -5.04 -0.26 0.00 0.01 0.00 0.00 42.46 37.01 1d2r s ILE 39 CO 0.00 -1.88 1.88 1.33 0.00 0.00 0.00 174.94 176.27 1d2r n VAL 40 N 6.77 0.00 0.22 2.92 0.24 -0.94 -2.60 118.33 124.93 1d2r n VAL 40 Ca 0.41 -0.04 0.11 0.00 -2.04 0.00 0.00 64.34 62.79 1d2r n VAL 40 Cb 0.48 -1.85 0.26 0.00 -1.47 0.00 0.00 33.84 31.26 1d2r n VAL 40 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1d2r h ASP 41 N 10.97 0.00 1.50 -1.34 2.03 -1.91 -2.98 116.42 124.69 1d2r h ASP 41 Ca 0.07 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.35 1d2r h ASP 41 Cb 0.90 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.40 1d2r h ASP 41 CO 1.28 0.12 -0.12 1.56 -1.03 0.00 0.00 179.24 181.05 1d2r h GLN 42 N 0.00 0.00 0.20 4.15 4.20 -1.96 -3.01 115.11 118.70 1d2r h GLN 42 Ca -0.00 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.40 1d2r h GLN 42 Cb 0.96 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.77 1d2r h GLN 42 CO 0.02 0.12 -1.39 0.45 -0.67 0.00 0.00 178.83 177.36 1d2r h HIS 43 N 0.00 0.78 0.00 2.96 3.86 -1.92 -3.21 115.15 117.63 1d2r h HIS 43 Ca -0.00 -0.57 0.00 0.00 -1.16 0.00 0.00 60.37 58.64 1d2r h HIS 43 Cb 0.90 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.34 1d2r h HIS 43 CO 0.00 1.45 0.00 0.00 0.86 0.00 0.00 177.93 180.24 1d2r h ALA 44 N 0.33 1.00 -0.06 2.45 0.00 -1.43 -2.24 119.26 119.31 1d2r h ALA 44 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1d2r h ALA 44 Cb 2.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.88 1d2r h ALA 44 CO 0.25 0.00 0.00 1.51 0.00 0.00 0.00 179.25 181.01 1d2r n ILE 45 N -2.47 0.08 0.90 0.00 0.13 -1.15 -3.78 119.36 113.06 1d2r n ILE 45 Ca -0.00 -0.15 0.13 0.00 -1.10 0.00 0.00 62.75 61.63 1d2r n ILE 45 Cb 0.12 -0.00 0.50 0.00 -0.84 0.00 0.00 39.64 39.42 1d2r n ILE 45 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 1d2r n THR 46 N -0.32 0.15 -4.36 9.51 -2.24 -0.84 -4.82 114.28 111.36 1d2r n THR 46 Ca 0.16 -0.08 -0.20 0.00 -2.27 0.00 0.00 64.05 61.66 1d2r n THR 46 Cb 0.19 -0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 67.93 1d2r n THR 46 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1d2r s VAL 47 N -3.03 1.88 0.17 2.28 -7.23 -1.25 -4.56 120.40 108.66 1d2r s VAL 47 Ca 0.12 -2.14 -0.33 0.00 -1.81 0.00 0.00 61.98 57.82 1d2r s VAL 47 Cb 0.17 -2.01 -0.15 0.00 0.56 0.00 0.00 36.38 34.95 1d2r s VAL 47 CO 0.58 -0.47 1.28 1.87 -0.31 0.00 0.00 175.10 178.05 1d2r n TRP 48 N -0.18 1.60 -4.01 2.82 -0.00 -1.26 -4.96 117.44 111.45 1d2r n TRP 48 Ca -0.09 0.59 -0.10 0.00 -0.00 0.00 0.00 57.50 57.90 1d2r n TRP 48 Cb 0.59 -2.35 -0.11 0.00 -0.00 0.00 0.00 31.31 29.44 1d2r n TRP 48 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 1d2r s GLN 49 N -0.16 0.38 -0.33 5.87 -1.52 -1.26 -5.06 119.66 117.58 1d2r s GLN 49 Ca 0.74 -0.70 -0.17 0.00 -1.95 0.00 0.00 55.36 53.29 1d2r s GLN 49 Cb -0.81 0.04 -0.01 0.00 -0.22 0.00 0.00 33.01 32.01 1d2r s GLN 49 CO 0.50 -0.04 0.45 0.34 -0.25 0.00 0.00 175.29 176.29 1d2r s ASP 50 N -1.62 6.28 0.30 5.90 2.15 -1.26 -4.96 116.67 123.45 1d2r s ASP 50 Ca -0.13 0.00 -0.02 0.00 0.43 0.00 0.00 52.55 52.84 1d2r s ASP 50 Cb -0.08 -2.24 0.66 0.00 -0.30 0.00 0.00 42.92 40.96 1d2r s ASP 50 CO -0.01 -0.38 1.56 -2.65 -0.17 0.00 0.00 175.17 173.52 1d2r n PRO 51 N 5.56 -0.08 -0.13 4.34 -0.02 -1.26 -0.16 135.00 143.25 1d2r n PRO 51 Ca -0.06 1.52 -0.11 0.00 -2.02 0.00 0.00 63.50 62.83 1d2r n PRO 51 Cb 0.49 -2.36 0.02 0.00 -0.02 0.00 0.00 33.50 31.63 1d2r n PRO 51 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1d2r h HIS 52 N 0.00 1.06 0.55 6.00 2.76 -2.00 -2.85 115.15 120.68 1d2r h HIS 52 Ca 0.56 -0.27 -0.03 0.00 -2.20 0.00 0.00 60.37 58.44 1d2r h HIS 52 Cb 1.07 -0.24 0.01 0.00 1.55 0.00 0.00 27.41 29.79 1d2r h HIS 52 CO -0.60 1.07 -0.27 0.93 -1.30 0.00 0.00 177.93 177.76 1d2r h GLU 53 N 0.79 -0.72 -0.80 5.26 4.39 -0.96 -2.11 114.58 120.42 1d2r h GLU 53 Ca 0.10 0.05 0.17 0.00 0.34 0.00 0.00 59.36 60.02 1d2r h GLU 53 Cb 0.82 0.16 -0.15 0.00 -0.10 0.00 0.00 28.75 29.48 1d2r h GLU 53 CO 0.07 -0.48 -0.12 1.25 -1.16 0.00 0.00 179.01 178.57 1d2r h LEU 54 N -0.82 -0.61 -1.50 1.33 5.85 -1.26 0.72 115.31 119.02 1d2r h LEU 54 Ca -0.08 0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1d2r h LEU 54 Cb 0.57 0.45 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 1d2r h LEU 54 CO 0.12 -0.25 0.21 -0.09 -0.34 0.00 0.00 178.44 178.10 1d2r h ARG 55 N 0.03 0.55 -0.01 1.25 9.65 -1.50 -2.13 114.38 122.22 1d2r h ARG 55 Ca 0.41 -0.05 -0.24 0.00 -1.10 0.00 0.00 59.98 59.00 1d2r h ARG 55 Cb 0.68 -0.11 0.01 0.00 -1.39 0.00 0.00 29.97 29.15 1d2r h ARG 55 CO -0.79 0.41 -0.96 0.37 2.80 0.00 0.00 179.97 181.80 1d2r h GLN 56 N 0.56 0.53 0.00 0.20 5.75 0.10 -3.22 115.11 119.03 1d2r h GLN 56 Ca 0.14 -0.56 -0.09 0.00 -0.15 0.00 0.00 58.65 58.00 1d2r h GLN 56 Cb 0.03 0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 1d2r h GLN 56 CO -0.02 1.18 -0.45 -0.91 -2.65 0.00 0.00 178.83 175.99 1d2r h ASN 57 N 0.30 0.00 -0.40 -0.69 2.35 -0.51 -2.00 115.58 114.63 1d2r h ASN 57 Ca -0.09 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 1d2r h ASN 57 Cb 1.60 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.95 1d2r h ASN 57 CO 0.18 0.45 0.19 0.40 -1.65 0.00 0.00 177.43 177.00 1d2r h ILE 58 N 0.00 1.17 -0.39 2.81 2.04 -1.40 0.66 117.51 122.40 1d2r h ILE 58 Ca -0.00 -0.49 -0.07 0.00 1.00 0.00 0.00 64.86 65.29 1d2r h ILE 58 Cb 0.85 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1d2r h ILE 58 CO 0.06 0.19 -0.03 0.03 0.00 0.00 0.00 178.15 178.39 1d2r h ARG 59 N 0.51 0.72 0.17 2.37 3.08 -1.53 -2.22 114.38 117.48 1d2r h ARG 59 Ca 0.14 -0.24 0.01 0.00 0.07 0.00 0.00 59.98 59.96 1d2r h ARG 59 Cb 0.12 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 1d2r h ARG 59 CO -0.02 0.82 -0.24 0.00 -1.07 0.00 0.00 179.97 179.46 1d2r h ARG 60 N 0.53 -0.46 -0.44 0.04 3.08 -1.13 0.12 114.38 116.13 1d2r h ARG 60 Ca 0.11 0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.25 1d2r h ARG 60 Cb 0.52 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.62 1d2r h ARG 60 CO 0.03 -0.31 0.13 1.25 -1.07 0.00 0.00 179.97 180.00 1d2r h LEU 61 N -0.48 0.11 -0.44 3.04 5.85 -0.83 0.82 115.31 123.37 1d2r h LEU 61 Ca 0.01 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1d2r h LEU 61 Cb 0.48 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1d2r h LEU 61 CO -0.10 0.09 0.22 0.00 -0.34 0.00 0.00 178.44 178.31 1d2r h ALA 62 N 1.30 0.57 -0.42 1.25 0.00 -1.19 0.16 119.26 120.94 1d2r h ALA 62 Ca 0.21 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1d2r h ALA 62 Cb 0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1d2r h ALA 62 CO -0.23 0.13 0.12 0.00 0.00 0.00 0.00 179.25 179.27 1d2r h ALA 63 N 1.06 0.55 -0.26 0.00 0.00 0.05 -1.93 119.26 118.72 1d2r h ALA 63 Ca 0.15 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1d2r h ALA 63 Cb 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1d2r h ALA 63 CO -0.02 0.20 -0.14 1.25 0.00 0.00 0.00 179.25 180.54 1d2r h LEU 64 N 0.53 0.43 -0.53 0.00 6.46 0.83 -0.66 115.31 122.38 1d2r h LEU 64 Ca 0.13 -0.11 -0.14 0.00 -0.12 0.00 0.00 57.88 57.64 1d2r h LEU 64 Cb 0.28 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.08 1d2r h LEU 64 CO -0.00 0.60 -0.37 1.88 -0.62 0.00 0.00 178.44 179.93 1d2r h TYR 65 N 0.42 0.93 -0.52 1.25 -1.99 -0.73 -1.26 116.97 115.07 1d2r h TYR 65 Ca 0.08 -0.27 -0.12 0.00 2.00 0.00 0.00 58.73 60.42 1d2r h TYR 65 Cb 0.49 -0.20 -0.02 0.00 2.00 0.00 0.00 36.73 39.01 1d2r h TYR 65 CO 0.01 1.03 -0.14 -0.07 -0.00 0.00 0.00 178.16 179.00 1d2r h LEU 66 N 0.65 1.01 -0.97 3.88 3.38 -1.01 -2.53 115.31 119.72 1d2r h LEU 66 Ca 0.06 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 1d2r h LEU 66 Cb 0.92 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 1d2r h LEU 66 CO 0.08 1.14 0.44 0.00 0.09 0.00 0.00 178.44 180.20 1d2r h ALA 67 N 0.90 1.20 0.00 1.53 0.00 -0.89 -1.80 119.26 120.21 1d2r h ALA 67 Ca 0.13 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1d2r h ALA 67 Cb 0.71 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1d2r h ALA 67 CO 0.05 0.63 -0.10 0.28 0.00 0.00 0.00 179.25 180.11 1d2r h VAL 68 N 1.18 0.82 0.00 0.00 2.07 -1.14 -3.44 116.25 115.74 1d2r h VAL 68 Ca 0.29 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1d2r h VAL 68 Cb 0.05 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1d2r h VAL 68 CO -0.04 0.10 0.00 0.61 0.02 0.00 0.00 177.57 178.25 1d2r n GLY 69 N -1.06 -0.48 3.71 2.17 0.00 -0.68 -4.99 105.19 103.87 1d2r n GLY 69 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1d2r n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1d2r s ILE 70 N -0.50 2.42 -0.46 -0.61 -1.09 -0.96 -4.88 121.20 115.13 1d2r s ILE 70 Ca 0.00 0.21 -0.22 0.00 -2.23 0.00 0.00 60.65 58.42 1d2r s ILE 70 Cb 0.00 -3.14 0.03 0.00 -1.58 0.00 0.00 42.46 37.77 1d2r s ILE 70 CO 0.00 0.01 0.72 -0.62 -1.23 0.00 0.00 174.94 173.82 1d2r s ASP 71 N 1.57 6.35 0.15 3.58 -1.08 -1.26 -4.64 116.67 121.33 1d2r s ASP 71 Ca 0.74 -0.30 0.11 0.00 -0.52 0.00 0.00 52.55 52.58 1d2r s ASP 71 Cb -0.46 -2.35 0.57 0.00 -1.46 0.00 0.00 42.92 39.22 1d2r s ASP 71 CO 0.32 -0.87 1.33 -0.81 0.52 0.00 0.00 175.17 175.66 1d2r n PRO 72 N 6.52 0.07 -0.03 4.34 -0.04 -1.26 -0.33 135.00 144.27 1d2r n PRO 72 Ca -0.00 0.55 0.05 0.00 -0.04 0.00 0.00 63.50 64.06 1d2r n PRO 72 Cb 0.48 -1.71 -0.16 0.00 -0.04 0.00 0.00 33.50 32.07 1d2r n PRO 72 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1d2r n THR 73 N -1.86 0.32 -0.03 0.52 -2.24 -1.26 -4.35 114.28 105.39 1d2r n THR 73 Ca -0.00 -0.55 -0.10 0.00 -2.27 0.00 0.00 64.05 61.12 1d2r n THR 73 Cb 0.03 -0.10 -0.14 0.00 -2.10 0.00 0.00 70.33 68.02 1d2r n THR 73 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1d2r n GLN 74 N -2.33 0.65 -4.61 -0.78 -0.06 -0.59 -4.97 117.38 104.70 1d2r n GLN 74 Ca -0.10 0.27 -0.28 0.00 -2.00 0.00 0.00 57.00 54.89 1d2r n GLN 74 Cb 0.68 -1.76 -0.10 0.00 -4.06 0.00 0.00 30.24 25.00 1d2r n GLN 74 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1d2r s ALA 75 N -2.58 3.18 -0.27 1.69 0.00 0.55 -4.67 121.76 119.66 1d2r s ALA 75 Ca -0.07 -1.80 -0.02 0.00 0.00 0.00 0.00 51.96 50.07 1d2r s ALA 75 Cb 0.08 0.28 0.03 0.00 0.00 0.00 0.00 23.12 23.51 1d2r s ALA 75 CO 0.82 -0.15 -0.04 0.99 0.00 0.00 0.00 175.76 177.37 1d2r s THR 76 N -2.90 2.90 -0.25 0.00 2.01 -0.88 -4.54 115.64 111.98 1d2r s THR 76 Ca 0.29 -1.16 -0.03 0.00 0.31 0.00 0.00 61.69 61.10 1d2r s THR 76 Cb 0.08 -2.55 0.02 0.00 0.01 0.00 0.00 72.50 70.06 1d2r s THR 76 CO 0.14 0.09 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.90 1d2r s LEU 77 N 1.30 3.23 0.09 4.42 2.96 -1.26 -0.10 118.68 129.31 1d2r s LEU 77 Ca -0.02 -0.77 -0.08 0.00 -0.22 0.00 0.00 54.13 53.03 1d2r s LEU 77 Cb -0.18 -1.71 -0.00 0.00 0.50 0.00 0.00 46.19 44.80 1d2r s LEU 77 CO -0.03 -0.12 0.18 0.72 -1.32 0.00 0.00 176.35 175.78 1d2r s PHE 78 N 1.37 0.16 -0.18 5.38 -0.71 -0.59 -4.29 117.98 119.13 1d2r s PHE 78 Ca 0.01 -0.59 -0.21 0.00 -1.04 0.00 0.00 56.93 55.10 1d2r s PHE 78 Cb -0.16 -0.07 -0.03 0.00 -1.21 0.00 0.00 43.02 41.55 1d2r s PHE 78 CO -0.03 -0.54 0.65 0.42 -1.34 0.00 0.00 175.22 174.38 1d2r s ILE 79 N -3.84 5.02 0.15 -4.49 1.01 -1.26 -0.95 121.20 116.84 1d2r s ILE 79 Ca 0.05 1.24 -0.31 0.00 0.00 0.00 0.00 60.65 61.63 1d2r s ILE 79 Cb 0.05 -3.97 -0.07 0.00 0.01 0.00 0.00 42.46 38.49 1d2r s ILE 79 CO -0.11 0.13 1.55 -0.61 0.00 0.00 0.00 174.94 175.90 1d2r h GLN 80 N 7.35 -0.21 0.00 2.79 4.15 -1.83 -1.76 115.11 125.60 1d2r h GLN 80 Ca -0.33 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.11 1d2r h GLN 80 Cb 1.15 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.89 1d2r h GLN 80 CO 0.78 -0.14 0.17 0.66 -1.93 0.00 0.00 178.83 178.36 1d2r h SER 81 N -0.22 0.00 0.08 -0.69 4.64 -1.95 -0.64 113.55 114.78 1d2r h SER 81 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1d2r h SER 81 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1d2r h SER 81 CO -0.75 0.00 -0.01 -0.62 -0.87 0.00 0.00 176.83 174.59 1d2r n GLU 82 N -2.69 0.98 -3.88 4.77 1.02 -0.66 -4.27 120.64 115.91 1d2r n GLU 82 Ca -0.02 -0.10 -0.30 0.00 -0.02 0.00 0.00 57.16 56.72 1d2r n GLU 82 Cb 0.22 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.00 1d2r n GLU 82 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1d2r s VAL 83 N -2.09 2.12 0.54 2.62 1.01 -0.25 -4.96 120.40 119.40 1d2r s VAL 83 Ca 0.44 -2.87 0.30 0.00 0.00 0.00 0.00 61.98 59.85 1d2r s VAL 83 Cb 0.22 -2.50 0.45 0.00 0.00 0.00 0.00 36.38 34.55 1d2r s VAL 83 CO 0.38 -0.79 1.92 -0.65 0.00 0.00 0.00 175.10 175.96 1d2r h PRO 84 N 6.81 0.00 -1.05 2.72 0.11 -1.80 -2.40 132.00 136.39 1d2r h PRO 84 Ca -0.06 0.00 0.27 0.00 0.11 0.00 0.00 66.00 66.32 1d2r h PRO 84 Cb 0.93 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.94 1d2r h PRO 84 CO 0.60 0.00 0.67 0.00 -0.21 0.00 0.00 178.00 179.06 1d2r h ALA 85 N 1.60 2.24 -0.58 -0.75 0.00 -1.93 0.02 119.26 119.86 1d2r h ALA 85 Ca 0.36 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.39 1d2r h ALA 85 Cb 1.47 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.24 1d2r h ALA 85 CO -0.00 -0.65 0.28 0.45 0.00 0.00 0.00 179.25 179.33 1d2r h HIS 86 N 0.39 0.52 -0.04 0.00 3.86 -1.76 0.49 115.15 118.60 1d2r h HIS 86 Ca 0.60 0.02 -0.18 0.00 -1.16 0.00 0.00 60.37 59.65 1d2r h HIS 86 Cb 1.53 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.85 1d2r h HIS 86 CO -0.00 0.23 -0.77 0.00 0.86 0.00 0.00 177.93 178.24 1d2r h ALA 87 N 1.33 0.60 -0.03 2.45 0.00 -1.23 -1.47 119.26 120.90 1d2r h ALA 87 Ca 0.26 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1d2r h ALA 87 Cb 0.20 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1d2r h ALA 87 CO -0.20 0.81 -0.01 1.96 0.00 0.00 0.00 179.25 181.81 1d2r h GLN 88 N 0.20 0.06 -0.74 0.00 4.20 -0.77 -2.57 115.11 115.49 1d2r h GLN 88 Ca -0.04 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 1d2r h GLN 88 Cb 1.35 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.10 1d2r h GLN 88 CO 0.13 0.44 0.38 0.00 -0.67 0.00 0.00 178.83 179.11 1d2r h ALA 89 N 0.62 0.95 -0.79 3.87 0.00 -0.09 -2.63 119.26 121.20 1d2r h ALA 89 Ca 0.01 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.86 1d2r h ALA 89 Cb 0.42 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1d2r h ALA 89 CO 0.00 0.49 0.52 0.00 0.00 0.00 0.00 179.25 180.27 1d2r h ALA 90 N 1.19 1.69 -0.16 0.00 0.00 -1.21 -1.45 119.26 119.31 1d2r h ALA 90 Ca 0.26 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1d2r h ALA 90 Cb 0.08 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1d2r h ALA 90 CO -0.04 0.16 -0.16 2.35 0.00 0.00 0.00 179.25 181.57 1d2r h TRP 91 N 0.79 0.47 -0.54 0.00 2.91 -1.09 -2.11 115.95 116.38 1d2r h TRP 91 Ca 0.35 -0.14 0.01 0.00 1.13 0.00 0.00 58.89 60.25 1d2r h TRP 91 Cb 0.34 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 28.86 1d2r h TRP 91 CO -0.00 0.77 0.35 0.52 -1.03 0.00 0.00 178.44 179.05 1d2r h MET 92 N 0.04 0.68 -0.41 2.65 2.86 -1.18 -2.21 114.93 117.36 1d2r h MET 92 Ca 0.03 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.56 1d2r h MET 92 Cb 0.69 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.18 1d2r h MET 92 CO 0.04 0.45 -0.01 -0.07 1.06 0.00 0.00 176.91 178.37 1d2r h LEU 93 N 0.70 0.63 -2.47 1.22 3.38 -1.28 -1.02 115.31 116.46 1d2r h LEU 93 Ca 0.21 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1d2r h LEU 93 Cb -0.04 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 1d2r h LEU 93 CO -0.07 0.71 0.14 1.56 0.09 0.00 0.00 178.44 180.87 1d2r h GLN 94 N 0.62 0.00 0.00 1.13 4.20 -0.74 0.74 115.11 121.06 1d2r h GLN 94 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1d2r h GLN 94 Cb 0.41 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.19 1d2r h GLN 94 CO 0.02 0.00 -0.34 0.00 -0.67 0.00 0.00 178.83 177.83 1d2r n ILE 96 N -2.12 0.00 -3.51 0.00 -5.35 0.15 -4.95 119.36 103.57 1d2r n ILE 96 Ca 0.04 -0.41 -0.38 0.00 -0.27 0.00 0.00 62.75 61.74 1d2r n ILE 96 Cb 0.43 1.14 -0.06 0.00 -1.74 0.00 0.00 39.64 39.40 1d2r n ILE 96 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1d2r s VAL 97 N -1.30 5.13 0.41 7.28 0.11 -0.59 -5.06 120.40 126.38 1d2r s VAL 97 Ca 0.09 0.76 -0.19 0.00 -2.93 0.00 0.00 61.98 59.71 1d2r s VAL 97 Cb 0.08 -3.69 -0.10 0.00 -1.53 0.00 0.00 36.38 31.14 1d2r s VAL 97 CO 0.24 0.52 0.90 -0.31 -3.33 0.00 0.00 175.10 173.12 1d2r s TYR 98 N -0.63 3.33 0.30 1.54 2.02 -1.26 -4.93 117.35 117.72 1d2r s TYR 98 Ca 0.22 1.52 0.01 0.00 -0.37 0.00 0.00 57.07 58.45 1d2r s TYR 98 Cb -0.16 -2.78 0.53 0.00 -0.40 0.00 0.00 41.96 39.16 1d2r s TYR 98 CO 0.11 -0.07 1.91 0.82 -1.57 0.00 0.00 175.55 176.74 1d2r h ILE 99 N 1.89 1.06 -0.40 2.71 2.04 -1.97 -2.12 117.51 120.72 1d2r h ILE 99 Ca -0.49 -0.35 0.02 0.00 1.00 0.00 0.00 64.86 65.05 1d2r h ILE 99 Cb 1.18 -0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 1d2r h ILE 99 CO 0.62 0.19 0.22 1.23 0.00 0.00 0.00 178.15 180.41 1d2r h GLY 100 N 1.02 0.55 1.66 5.37 0.00 -1.98 -0.97 103.07 108.72 1d2r h GLY 100 Ca 0.40 -0.16 0.04 0.00 0.00 0.00 0.00 47.33 47.61 1d2r h GLY 100 CO -0.15 0.13 0.13 0.83 0.00 0.00 0.00 176.54 177.48 1d2r h GLU 101 N 0.45 0.00 0.02 4.80 5.08 -1.77 -0.10 114.58 123.05 1d2r h GLU 101 Ca 0.16 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.46 1d2r h GLU 101 Cb 0.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1d2r h GLU 101 CO -0.09 0.00 -0.34 -0.07 -1.00 0.00 0.00 179.01 177.50 1d2r h LEU 102 N 0.00 0.06 -1.09 1.33 3.38 -1.21 -3.27 115.31 114.52 1d2r h LEU 102 Ca 0.07 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.13 1d2r h LEU 102 Cb 0.33 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1d2r h LEU 102 CO -0.00 1.14 0.00 -0.33 0.09 0.00 0.00 178.44 179.34 1d2r h GLU 103 N -0.91 0.00 0.00 1.13 5.08 -0.90 -2.38 114.58 116.60 1d2r h GLU 103 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1d2r h GLU 103 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1d2r h GLU 103 CO -0.02 0.00 -0.57 0.07 -1.00 0.00 0.00 179.01 177.50 1d2r h ARG 104 N 0.00 0.00 -6.27 2.33 0.11 -1.13 -3.42 114.38 106.00 1d2r h ARG 104 Ca 0.00 0.00 -0.58 0.00 0.10 0.00 0.00 59.98 59.50 1d2r h ARG 104 Cb 0.37 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.47 1d2r h ARG 104 CO 0.00 0.00 1.20 -0.12 0.10 0.00 0.00 179.97 181.15 1d2r n MET 105 N -2.14 2.39 0.30 0.08 1.56 -0.90 -4.83 117.12 113.58 1d2r n MET 105 Ca 0.03 0.86 0.17 0.00 -0.27 0.00 0.00 57.70 58.50 1d2r n MET 105 Cb 0.44 -2.84 0.91 0.00 2.15 0.00 0.00 33.22 33.88 1d2r n MET 105 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 1d2r h THR 106 N 5.75 0.25 0.00 1.12 2.02 -1.89 0.20 112.91 120.36 1d2r h THR 106 Ca -0.48 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.41 1d2r h THR 106 Cb 1.26 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1d2r h THR 106 CO 0.95 0.04 0.00 -0.61 0.37 0.00 0.00 175.52 176.27 1d2r h GLN 107 N 0.00 0.00 0.00 6.66 5.75 -1.95 -2.69 115.11 122.88 1d2r h GLN 107 Ca -0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1d2r h GLN 107 Cb 0.23 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.78 1d2r h GLN 107 CO 0.01 0.00 -0.27 0.35 -2.65 0.00 0.00 178.83 176.26 1d2r h PHE 108 N 0.00 0.00 0.00 3.99 3.57 -1.01 -3.35 116.94 120.14 1d2r h PHE 108 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1d2r h PHE 108 Cb 0.88 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.62 1d2r h PHE 108 CO 0.00 0.15 0.24 0.87 -2.23 0.00 0.00 178.31 177.34 1d2r h LYS 109 N -1.00 0.00 0.23 1.11 1.57 -0.98 -1.58 116.57 115.92 1d2r h LYS 109 Ca -0.02 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1d2r h LYS 109 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1d2r h LYS 109 CO -0.01 0.00 -0.11 0.93 -0.57 0.00 0.00 179.45 179.69 1d2r h GLU 110 N 0.00 -0.29 0.00 3.15 5.08 -1.61 -3.33 114.58 117.57 1d2r h GLU 110 Ca 0.00 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1d2r h GLU 110 Cb 0.47 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1d2r h GLU 110 CO 0.00 -0.04 -0.17 1.63 -1.00 0.00 0.00 179.01 179.43 1d2r n LYS 111 N -4.97 0.03 -0.04 2.33 5.02 -1.00 -3.55 118.16 115.98 1d2r n LYS 111 Ca -0.06 0.02 0.12 0.00 -2.02 0.00 0.00 58.31 56.37 1d2r n LYS 111 Cb 0.20 -1.53 0.49 0.00 -0.02 0.00 0.00 35.03 34.17 1d2r n LYS 111 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1d2r n SER 112 N -1.58 1.18 -0.11 4.39 3.41 -0.63 -3.90 113.62 116.38 1d2r n SER 112 Ca 0.06 -1.55 -0.15 0.00 -0.26 0.00 0.00 58.87 56.98 1d2r n SER 112 Cb 0.35 -0.05 -0.11 0.00 -0.26 0.00 0.00 64.21 64.14 1d2r n SER 112 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1d2r n ALA 113 N -0.02 1.52 -2.68 7.33 0.00 -1.23 -4.73 120.51 120.70 1d2r n ALA 113 Ca 0.17 -0.99 -0.42 0.00 0.00 0.00 0.00 53.44 52.20 1d2r n ALA 113 Cb 0.27 -0.03 0.01 0.00 0.00 0.00 0.00 19.45 19.70 1d2r n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d2r n GLY 114 N 2.36 5.50 3.65 0.00 0.00 -1.25 -4.93 105.19 110.52 1d2r n GLY 114 Ca -0.39 -2.50 -0.02 0.00 0.00 0.00 0.00 46.02 43.11 1d2r n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2r s ALA 115 N -2.83 -2.20 -0.15 4.61 0.00 -1.26 -5.06 121.76 114.87 1d2r s ALA 115 Ca 0.37 1.93 -0.24 0.00 0.00 0.00 0.00 51.96 54.02 1d2r s ALA 115 Cb 0.12 -0.62 -0.24 0.00 0.00 0.00 0.00 23.12 22.38 1d2r s ALA 115 CO -0.01 -0.49 0.56 0.00 0.00 0.00 0.00 175.76 175.82 1d2r h ALA 116 N 2.00 0.11 -3.09 0.00 0.00 -1.96 -3.47 119.26 112.86 1d2r h ALA 116 Ca -0.03 -0.85 -0.27 0.00 0.00 0.00 0.00 54.91 53.77 1d2r h ALA 116 Cb 1.13 0.33 -0.34 0.00 0.00 0.00 0.00 17.79 18.91 1d2r h ALA 116 CO 0.19 0.39 -0.61 0.00 0.00 0.00 0.00 179.25 179.22 1d2r s ALA 117 N -2.32 -0.25 0.24 0.00 0.00 -1.26 -5.16 121.76 113.01 1d2r s ALA 117 Ca -0.22 0.65 0.08 0.00 0.00 0.00 0.00 51.96 52.47 1d2r s ALA 117 Cb 0.01 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1d2r s ALA 117 CO 0.68 -0.47 0.08 0.00 0.00 0.00 0.00 175.76 176.05 1d2r s ALA 118 N 2.03 3.35 0.35 0.00 0.00 -1.26 -5.09 121.76 121.15 1d2r s ALA 118 Ca -0.00 -1.50 -0.28 0.00 0.00 0.00 0.00 51.96 50.18 1d2r s ALA 118 Cb -0.12 -1.04 -0.10 0.00 0.00 0.00 0.00 23.12 21.86 1d2r s ALA 118 CO -0.06 0.30 1.38 0.00 0.00 0.00 0.00 175.76 177.38 1d2r s ALA 119 N -2.13 3.52 -0.05 0.00 0.00 -1.26 -4.85 121.76 116.99 1d2r s ALA 119 Ca 0.31 1.38 0.27 0.00 0.00 0.00 0.00 51.96 53.92 1d2r s ALA 119 Cb -0.08 -3.53 1.41 0.00 0.00 0.00 0.00 23.12 20.92 1d2r s ALA 119 CO 0.22 -0.81 1.82 0.00 0.00 0.00 0.00 175.76 176.99 1d2r h ALA 120 N 3.20 1.00 0.00 0.00 0.00 -1.98 -0.96 119.26 120.52 1d2r h ALA 120 Ca -0.50 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 1d2r h ALA 120 Cb 1.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1d2r h ALA 120 CO 0.65 0.00 -0.19 0.78 0.00 0.00 0.00 179.25 180.49 1d2r h GLY 121 N 0.33 0.00 1.97 0.00 0.00 -1.88 -1.57 103.07 101.91 1d2r h GLY 121 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1d2r h GLY 121 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 1d2r n LEU 122 N -3.61 0.00 -0.00 3.11 4.32 -0.36 -2.15 117.00 118.30 1d2r n LEU 122 Ca -0.01 0.48 0.03 0.00 -0.02 0.00 0.00 56.01 56.49 1d2r n LEU 122 Cb 0.32 -0.48 -0.03 0.00 -1.62 0.00 0.00 43.42 41.61 1d2r n LEU 122 CO 0.32 -0.13 -0.20 -0.11 -1.22 0.00 0.00 177.39 176.04 1d2r n LEU 123 N -1.48 0.16 -0.25 2.23 7.94 -0.68 -4.69 117.00 120.23 1d2r n LEU 123 Ca 0.05 -0.33 0.04 0.00 -1.11 0.00 0.00 56.01 54.66 1d2r n LEU 123 Cb 0.24 0.00 0.08 0.00 0.53 0.00 0.00 43.42 44.27 1d2r n LEU 123 CO 0.19 0.04 0.56 0.35 -1.11 0.00 0.00 177.39 177.43 1d2r n THR 124 N -1.32 1.23 0.17 1.96 -2.24 -0.71 -4.64 114.28 108.73 1d2r n THR 124 Ca 0.00 -1.25 0.05 0.00 -2.27 0.00 0.00 64.05 60.58 1d2r n THR 124 Cb 0.10 0.34 0.21 0.00 -2.10 0.00 0.00 70.33 68.87 1d2r n THR 124 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 1d2r h TYR 125 N 0.69 0.00 -0.18 4.78 -0.00 -1.71 -3.32 116.97 117.23 1d2r h TYR 125 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 58.73 58.78 1d2r h TYR 125 Cb 0.71 0.00 -0.07 0.00 0.00 0.00 0.00 36.73 37.37 1d2r h TYR 125 CO 0.10 0.42 -0.32 -1.35 -0.00 0.00 0.00 178.16 177.01 1d2r h PRO 126 N 0.00 -0.35 -0.87 0.10 0.11 -1.88 0.14 132.00 129.24 1d2r h PRO 126 Ca -0.00 0.02 0.19 0.00 0.11 0.00 0.00 66.00 66.32 1d2r h PRO 126 Cb 1.11 0.08 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 1d2r h PRO 126 CO 0.05 -0.24 0.58 -1.35 -0.21 0.00 0.00 178.00 176.84 1d2r h PRO 127 N -0.37 0.38 -0.14 1.05 0.11 -1.91 0.23 132.00 131.36 1d2r h PRO 127 Ca 0.11 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 65.97 1d2r h PRO 127 Cb 0.54 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.58 1d2r h PRO 127 CO -0.39 0.25 -0.80 1.25 -0.21 0.00 0.00 178.00 178.10 1d2r h LEU 128 N 0.39 0.94 -0.38 2.35 5.85 -1.25 -2.21 115.31 121.01 1d2r h LEU 128 Ca 0.45 -0.63 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 1d2r h LEU 128 Cb 1.12 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 1d2r h LEU 128 CO -0.16 1.43 0.09 -0.03 -0.34 0.00 0.00 178.44 179.43 1d2r h MET 129 N 0.53 0.60 -0.65 1.25 4.05 0.93 -1.36 114.93 120.28 1d2r h MET 129 Ca -0.06 -0.14 0.07 0.00 -0.28 0.00 0.00 59.70 59.29 1d2r h MET 129 Cb 1.44 -0.08 -0.06 0.00 -0.80 0.00 0.00 31.60 32.10 1d2r h MET 129 CO 0.16 0.64 0.33 0.00 0.23 0.00 0.00 176.91 178.27 1d2r h ALA 130 N 0.94 0.87 -0.80 0.39 0.00 -0.62 -1.90 119.26 118.14 1d2r h ALA 130 Ca 0.12 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1d2r h ALA 130 Cb 0.30 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1d2r h ALA 130 CO 0.00 -0.03 0.39 0.00 0.00 0.00 0.00 179.25 179.61 1d2r h ALA 131 N 1.37 1.03 -0.62 0.00 0.00 -0.97 0.27 119.26 120.33 1d2r h ALA 131 Ca 0.30 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.16 1d2r h ALA 131 Cb 0.26 -0.32 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 1d2r h ALA 131 CO -0.22 0.58 0.24 -0.44 0.00 0.00 0.00 179.25 179.41 1d2r h ASP 132 N 1.12 0.25 0.24 0.00 3.32 -0.45 -1.01 116.42 119.89 1d2r h ASP 132 Ca 0.27 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.39 1d2r h ASP 132 Cb 0.11 0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1d2r h ASP 132 CO -0.04 0.14 -0.11 0.40 -1.72 0.00 0.00 179.24 177.91 1d2r h ILE 133 N 0.42 0.00 -0.71 0.35 2.04 -1.20 -3.34 117.51 115.08 1d2r h ILE 133 Ca 0.32 -0.39 0.20 0.00 1.00 0.00 0.00 64.86 65.99 1d2r h ILE 133 Cb 0.39 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.44 1d2r h ILE 133 CO -0.31 0.00 0.51 -0.07 0.00 0.00 0.00 178.15 178.28 1d2r h LEU 134 N -0.71 0.00 -2.64 1.44 3.38 -0.90 -2.43 115.31 113.45 1d2r h LEU 134 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1d2r h LEU 134 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1d2r h LEU 134 CO 0.05 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.51 1d2r h LEU 135 N 0.00 0.00 -3.09 1.67 3.38 -1.30 -2.85 115.31 113.12 1d2r h LEU 135 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1d2r h LEU 135 Cb 1.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1d2r h LEU 135 CO -0.00 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.31 1d2r n TYR 136 N -3.05 0.64 -1.99 1.13 4.01 -0.91 -4.40 117.16 112.59 1d2r n TYR 136 Ca -0.02 -0.73 -0.15 0.00 -0.16 0.00 0.00 57.90 56.84 1d2r n TYR 136 Cb 0.11 -0.18 -0.03 0.00 -0.31 0.00 0.00 39.34 38.93 1d2r n TYR 136 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1d2r n ASN 137 N -0.21 -4.35 -4.67 7.72 4.13 -1.08 -4.87 115.26 111.93 1d2r n ASN 137 Ca 0.16 0.24 -0.42 0.00 1.68 0.00 0.00 54.58 56.24 1d2r n ASN 137 Cb 0.67 -3.79 0.00 0.00 -1.54 0.00 0.00 39.78 35.11 1d2r n ASN 137 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1d2r n THR 138 N -2.89 2.24 -0.12 3.41 -2.24 -1.25 -4.78 114.28 108.65 1d2r n THR 138 Ca -0.17 -0.50 -0.24 0.00 -2.27 0.00 0.00 64.05 60.87 1d2r n THR 138 Cb 0.58 -1.44 -0.11 0.00 -2.10 0.00 0.00 70.33 67.25 1d2r n THR 138 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1d2r n ASP 139 N 0.60 1.97 -4.29 3.42 8.00 0.55 -4.32 116.55 122.48 1d2r n ASP 139 Ca 0.07 0.17 -0.32 0.00 0.71 0.00 0.00 54.79 55.41 1d2r n ASP 139 Cb 0.37 -0.69 -0.16 0.00 -0.02 0.00 0.00 41.12 40.62 1d2r n ASP 139 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1d2r s ILE 140 N -2.50 2.39 -0.31 0.53 1.01 -0.46 -0.64 121.20 121.22 1d2r s ILE 140 Ca -0.35 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 59.41 1d2r s ILE 140 Cb 0.11 -1.93 0.09 0.00 0.01 0.00 0.00 42.46 40.74 1d2r s ILE 140 CO 0.56 0.55 0.01 -0.69 0.00 0.00 0.00 174.94 175.38 1d2r s VAL 141 N 0.16 2.09 -0.36 2.92 1.01 -0.27 -2.31 120.40 123.64 1d2r s VAL 141 Ca -0.11 -2.02 -0.28 0.00 0.00 0.00 0.00 61.98 59.57 1d2r s VAL 141 Cb -0.16 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 1d2r s VAL 141 CO 0.06 -0.43 1.81 -2.16 0.00 0.00 0.00 175.10 174.38 1d2r s PRO 142 N 1.04 3.26 0.14 2.72 0.04 -1.26 -2.77 135.00 138.17 1d2r s PRO 142 Ca 0.05 1.36 0.02 0.00 0.04 0.00 0.00 61.00 62.47 1d2r s PRO 142 Cb -0.19 -4.22 -0.04 0.00 0.04 0.00 0.00 34.50 30.09 1d2r s PRO 142 CO -0.08 -1.95 -0.04 0.14 0.04 0.00 0.00 177.00 175.11 1d2r s VAL 143 N 7.13 0.73 0.66 -0.36 -7.23 -1.15 -4.94 120.40 115.24 1d2r s VAL 143 Ca 0.79 -1.97 -0.09 0.00 -1.81 0.00 0.00 61.98 58.90 1d2r s VAL 143 Cb -0.21 -1.90 0.01 0.00 0.56 0.00 0.00 36.38 34.84 1d2r s VAL 143 CO 0.32 -0.68 1.02 -0.83 -0.31 0.00 0.00 175.10 174.63 1d2r s GLY 144 N -3.12 1.62 0.59 2.32 0.00 -1.26 -4.34 107.32 103.14 1d2r s GLY 144 Ca 0.18 -0.49 0.30 0.00 0.00 0.00 0.00 44.72 44.71 1d2r s GLY 144 CO -0.00 -0.15 2.26 0.83 0.00 0.00 0.00 173.10 176.04 1d2r h GLU 145 N -0.48 0.00 0.00 2.90 3.07 -2.00 -0.71 114.58 117.37 1d2r h GLU 145 Ca -0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 1d2r h GLU 145 Cb 1.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 1d2r h GLU 145 CO 0.63 0.00 0.00 -0.40 -1.40 0.00 0.00 179.01 177.84 1d2r n ASP 146 N -3.83 0.00 -0.05 1.42 5.75 -1.26 -3.23 116.55 115.35 1d2r n ASP 146 Ca -0.03 0.23 0.02 0.00 -0.01 0.00 0.00 54.79 55.01 1d2r n ASP 146 Cb 0.09 -0.40 -0.02 0.00 -1.03 0.00 0.00 41.12 39.76 1d2r n ASP 146 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1d2r n GLN 147 N -1.40 4.13 -0.22 0.11 1.13 -0.29 -4.68 117.38 116.16 1d2r n GLN 147 Ca 0.09 -0.19 0.02 0.00 -1.94 0.00 0.00 57.00 54.98 1d2r n GLN 147 Cb 0.24 -0.81 0.10 0.00 0.11 0.00 0.00 30.24 29.89 1d2r n GLN 147 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1d2r h LYS 148 N 0.24 0.07 -0.85 -1.09 1.63 -1.48 0.64 116.57 115.73 1d2r h LYS 148 Ca 0.00 -0.00 0.23 0.00 -0.85 0.00 0.00 60.65 60.02 1d2r h LYS 148 Cb 0.14 -0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 31.71 1d2r h LYS 148 CO 0.00 0.05 0.60 0.37 -3.45 0.00 0.00 179.45 177.01 1d2r h GLN 149 N 0.07 0.13 -0.10 1.90 4.15 -1.83 -0.21 115.11 119.22 1d2r h GLN 149 Ca 0.34 -0.01 -0.16 0.00 0.77 0.00 0.00 58.65 59.59 1d2r h GLN 149 Cb 0.56 -0.03 0.01 0.00 0.21 0.00 0.00 27.48 28.23 1d2r h GLN 149 CO -0.61 0.09 -0.57 0.45 -1.93 0.00 0.00 178.83 176.26 1d2r h HIS 150 N 0.13 0.76 0.00 3.99 3.86 -0.04 -3.01 115.15 120.84 1d2r h HIS 150 Ca 0.42 -0.34 -0.03 0.00 -1.16 0.00 0.00 60.37 59.26 1d2r h HIS 150 Cb 1.45 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 29.80 1d2r h HIS 150 CO -0.00 1.14 -0.14 0.82 0.86 0.00 0.00 177.93 180.61 1d2r h ILE 151 N 0.16 1.06 0.18 2.45 1.08 -0.59 -2.44 117.51 119.41 1d2r h ILE 151 Ca -0.04 -0.47 -0.01 0.00 -0.39 0.00 0.00 64.86 63.94 1d2r h ILE 151 Cb 1.22 1.26 -0.00 0.00 -3.07 0.00 0.00 36.82 36.23 1d2r h ILE 151 CO 0.12 0.13 -0.09 -0.33 -0.69 0.00 0.00 178.15 177.29 1d2r h GLU 152 N 0.00 -0.24 -0.43 2.37 4.39 -1.11 -0.89 114.58 118.68 1d2r h GLU 152 Ca -0.00 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.72 1d2r h GLU 152 Cb 0.25 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 1d2r h GLU 152 CO 0.02 -0.16 0.28 1.25 -1.16 0.00 0.00 179.01 179.23 1d2r h LEU 153 N -0.25 0.47 -1.96 1.33 5.85 -1.35 -1.17 115.31 118.24 1d2r h LEU 153 Ca -0.02 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1d2r h LEU 153 Cb 0.20 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1d2r h LEU 153 CO 0.03 0.34 -0.11 0.00 -0.34 0.00 0.00 178.44 178.36 1d2r h THR 154 N 0.56 0.76 -0.03 1.05 1.03 -1.30 -0.34 112.91 114.63 1d2r h THR 154 Ca 0.16 -0.41 -0.02 0.00 -0.01 0.00 0.00 66.41 66.12 1d2r h THR 154 Cb -0.05 1.25 0.00 0.00 -1.07 0.00 0.00 68.15 68.28 1d2r h THR 154 CO -0.05 0.10 -0.08 0.03 -0.01 0.00 0.00 175.52 175.52 1d2r h ARG 155 N 0.00 0.11 -0.16 0.00 3.08 -0.17 -2.46 114.38 114.77 1d2r h ARG 155 Ca -0.00 -0.07 0.04 0.00 0.07 0.00 0.00 59.98 60.02 1d2r h ARG 155 Cb 0.24 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.25 1d2r h ARG 155 CO 0.01 0.67 -0.11 -0.44 -1.07 0.00 0.00 179.97 179.03 1d2r h ASP 156 N -0.43 -0.35 -0.45 7.04 3.32 -0.74 -1.56 116.42 123.24 1d2r h ASP 156 Ca -0.00 0.08 0.08 0.00 0.02 0.00 0.00 57.03 57.21 1d2r h ASP 156 Cb 0.67 0.18 -0.07 0.00 0.22 0.00 0.00 39.33 40.33 1d2r h ASP 156 CO 0.02 -0.15 0.04 -0.07 -1.72 0.00 0.00 179.24 177.36 1d2r h LEU 157 N -0.11 -0.10 0.38 1.55 3.38 -1.10 0.80 115.31 120.11 1d2r h LEU 157 Ca 0.10 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 1d2r h LEU 157 Cb 0.26 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1d2r h LEU 157 CO -0.23 -0.02 -0.35 0.00 0.09 0.00 0.00 178.44 177.93 1d2r h ALA 158 N 1.38 -0.77 -0.63 1.53 0.00 -0.97 -0.61 119.26 119.19 1d2r h ALA 158 Ca 0.23 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.10 1d2r h ALA 158 Cb 0.32 0.50 -0.07 0.00 0.00 0.00 0.00 17.79 18.53 1d2r h ALA 158 CO -0.34 -0.97 0.27 1.49 0.00 0.00 0.00 179.25 179.71 1d2r h GLU 159 N -0.75 0.47 -0.82 0.00 4.81 -0.76 0.13 114.58 117.67 1d2r h GLU 159 Ca -0.03 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1d2r h GLU 159 Cb 0.66 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.90 1d2r h GLU 159 CO -0.05 0.31 0.51 -0.09 -0.73 0.00 0.00 179.01 178.97 1d2r h ARG 160 N 0.49 1.10 -0.32 1.92 2.43 -0.58 -0.90 114.38 118.52 1d2r h ARG 160 Ca 0.31 -0.09 -0.12 0.00 -0.81 0.00 0.00 59.98 59.28 1d2r h ARG 160 Cb 0.34 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1d2r h ARG 160 CO -0.27 0.76 -0.27 0.35 -1.51 0.00 0.00 179.97 179.02 1d2r h PHE 161 N 1.12 0.75 -0.44 2.20 3.04 -0.14 -1.58 116.94 121.88 1d2r h PHE 161 Ca 0.30 -0.18 -0.05 0.00 3.98 0.00 0.00 57.97 62.02 1d2r h PHE 161 Cb -0.07 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 38.24 1d2r h PHE 161 CO -0.01 0.86 0.08 -0.91 -2.02 0.00 0.00 178.31 176.31 1d2r h ASN 162 N 0.57 0.69 -0.04 0.41 2.35 0.03 -0.58 115.58 119.00 1d2r h ASN 162 Ca 0.07 -0.25 -0.02 0.00 -0.55 0.00 0.00 56.30 55.55 1d2r h ASN 162 Cb 0.76 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.95 1d2r h ASN 162 CO 0.06 0.77 -0.06 0.11 -1.65 0.00 0.00 177.43 176.66 1d2r h LYS 163 N 0.58 0.11 -0.45 0.81 1.57 -1.13 0.79 116.57 118.87 1d2r h LYS 163 Ca 0.13 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1d2r h LYS 163 Cb 0.36 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1d2r h LYS 163 CO 0.01 0.60 0.25 -0.09 -0.57 0.00 0.00 179.45 179.65 1d2r h ARG 164 N -0.37 0.62 -0.01 3.15 2.43 -1.28 -3.31 114.38 115.61 1d2r h ARG 164 Ca 0.00 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1d2r h ARG 164 Cb 0.59 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1d2r h ARG 164 CO 0.01 0.48 -0.10 0.66 -1.51 0.00 0.00 179.97 179.52 1d2r n TYR 165 N -4.70 0.00 0.00 2.20 4.02 -0.23 -5.09 117.16 113.35 1d2r n TYR 165 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.90 1d2r n TYR 165 Cb 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.39 1d2r n TYR 165 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1d2r n GLY 166 N 0.67 2.57 3.68 2.72 0.00 0.27 -4.94 105.19 110.17 1d2r n GLY 166 Ca 0.04 -1.60 -0.60 0.00 0.00 0.00 0.00 46.02 43.86 1d2r n GLY 166 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1d2r n GLU 167 N 1.29 0.64 0.00 1.61 2.13 -1.04 -4.43 120.64 120.85 1d2r n GLU 167 Ca 0.00 0.23 0.00 0.00 0.66 0.00 0.00 57.16 58.05 1d2r n GLU 167 Cb 0.00 -1.83 0.00 0.00 0.27 0.00 0.00 31.44 29.88 1d2r n GLU 167 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1d2r n LEU 168 N 4.08 0.00 -4.87 4.31 0.00 -1.26 -5.06 117.00 114.21 1d2r n LEU 168 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 56.01 55.96 1d2r n LEU 168 Cb 0.07 0.22 -0.04 0.00 0.00 0.00 0.00 43.42 43.66 1d2r n LEU 168 CO 0.79 -0.46 0.42 -0.36 0.00 0.00 0.00 177.39 177.78 1d2r s PHE 169 N -1.91 3.44 -0.35 1.96 0.08 -1.26 -5.02 117.98 114.92 1d2r s PHE 169 Ca 0.00 1.07 -0.13 0.00 0.12 0.00 0.00 56.93 57.99 1d2r s PHE 169 Cb 0.00 -2.45 -0.01 0.00 -0.57 0.00 0.00 43.02 39.99 1d2r s PHE 169 CO 0.00 -0.02 0.25 0.99 -0.10 0.00 0.00 175.22 176.33 1d2r s THR 170 N -2.23 5.23 -0.21 0.64 2.01 -1.26 -4.95 115.64 114.87 1d2r s THR 170 Ca 0.52 -0.31 -0.31 0.00 0.31 0.00 0.00 61.69 61.90 1d2r s THR 170 Cb -0.10 -3.73 -0.08 0.00 0.01 0.00 0.00 72.50 68.60 1d2r s THR 170 CO 0.27 -0.06 2.15 -0.38 -0.69 0.00 0.00 174.62 175.91 1d2r n ILE 171 N 5.11 0.37 -1.49 1.82 -0.00 -1.26 -4.78 119.36 119.12 1d2r n ILE 171 Ca -0.12 -0.33 -0.30 0.00 -0.00 0.00 0.00 62.75 62.00 1d2r n ILE 171 Cb 0.49 -2.19 0.10 0.00 -0.00 0.00 0.00 39.64 38.03 1d2r n ILE 171 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 1d2r s PRO 172 N 5.83 1.97 -0.04 0.38 0.04 -1.26 -4.92 135.00 137.00 1d2r s PRO 172 Ca 1.01 0.68 0.03 0.00 0.04 0.00 0.00 61.00 62.76 1d2r s PRO 172 Cb -0.54 -1.90 0.01 0.00 0.04 0.00 0.00 34.50 32.11 1d2r s PRO 172 CO 0.42 -1.71 -0.10 -2.00 0.04 0.00 0.00 177.00 173.64 1d2r s GLU 173 N -5.11 1.24 -0.52 4.56 2.12 0.19 -4.91 118.70 116.27 1d2r s GLU 173 Ca 0.61 -0.35 -0.23 0.00 0.36 0.00 0.00 54.97 55.36 1d2r s GLU 173 Cb -0.15 -1.11 0.04 0.00 0.26 0.00 0.00 34.13 33.17 1d2r s GLU 173 CO 0.55 0.09 0.84 0.00 -0.54 0.00 0.00 175.26 176.20 1d2r s ALA 174 N 0.38 3.24 -0.23 6.30 0.00 -1.26 -1.11 121.76 129.07 1d2r s ALA 174 Ca -0.07 -1.26 -0.11 0.00 0.00 0.00 0.00 51.96 50.52 1d2r s ALA 174 Cb -0.12 -3.60 -0.05 0.00 0.00 0.00 0.00 23.12 19.36 1d2r s ALA 174 CO 0.01 -2.19 0.19 0.50 0.00 0.00 0.00 175.76 174.27 1d2r s ARG 175 N 3.54 4.10 0.06 0.00 3.52 -1.12 -4.93 118.95 124.12 1d2r s ARG 175 Ca 0.28 -0.19 -0.12 0.00 -0.13 0.00 0.00 55.73 55.56 1d2r s ARG 175 Cb -0.14 -3.52 -0.06 0.00 -1.56 0.00 0.00 34.95 29.67 1d2r s ARG 175 CO 0.19 0.08 0.42 0.42 -0.81 0.00 0.00 175.30 175.60 1d2r s ILE 176 N 1.01 5.04 0.34 4.11 1.01 -1.26 -2.95 121.20 128.50 1d2r s ILE 176 Ca 0.09 0.63 -0.29 0.00 0.00 0.00 0.00 60.65 61.09 1d2r s ILE 176 Cb -0.13 -3.68 -0.11 0.00 0.01 0.00 0.00 42.46 38.55 1d2r s ILE 176 CO 0.04 0.38 1.48 -2.84 0.00 0.00 0.00 174.94 174.00 1d2r s PRO 177 N -1.64 4.16 -0.17 2.79 0.02 -1.26 -4.90 135.00 134.00 1d2r s PRO 177 Ca 0.30 2.50 -0.35 0.00 0.02 0.00 0.00 61.00 63.48 1d2r s PRO 177 Cb -0.15 -3.01 -0.12 0.00 0.02 0.00 0.00 34.50 31.24 1d2r s PRO 177 CO 0.17 -0.50 1.92 1.63 -0.33 0.00 0.00 177.00 179.89 1d2r n LYS 178 N 1.06 1.84 -1.46 5.54 5.02 -1.26 -4.87 118.16 124.03 1d2r n LYS 178 Ca 0.03 0.65 -0.28 0.00 -2.02 0.00 0.00 58.31 56.69 1d2r n LYS 178 Cb 0.39 -2.56 -0.02 0.00 -0.02 0.00 0.00 35.03 32.83 1d2r n LYS 178 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1d2r n VAL 179 N 5.47 3.30 -1.39 -0.18 0.31 -1.26 -3.72 118.33 120.87 1d2r n VAL 179 Ca 0.26 -2.99 0.02 0.00 -0.01 0.00 0.00 64.34 61.63 1d2r n VAL 179 Cb 0.26 -1.47 0.20 0.00 -0.91 0.00 0.00 33.84 31.92 1d2r n VAL 179 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1d2r n GLY 180 N 0.46 4.87 0.33 2.92 0.00 -1.26 -4.37 105.19 108.14 1d2r n GLY 180 Ca 0.48 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1d2r n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2r n ALA 181 N -1.09 1.40 -1.62 4.61 0.00 -1.24 -5.06 120.51 117.51 1d2r n ALA 181 Ca 0.25 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.44 1d2r n ALA 181 Cb 0.86 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.26 1d2r n ALA 181 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1d2r s ARG 182 N 0.00 1.92 -0.15 0.00 3.00 -1.26 -4.62 118.95 117.84 1d2r s ARG 182 Ca 0.00 0.83 -0.29 0.00 -1.00 0.00 0.00 55.73 55.27 1d2r s ARG 182 Cb 0.00 -4.70 -0.03 0.00 0.00 0.00 0.00 34.95 30.22 1d2r s ARG 182 CO 0.00 -3.81 1.49 0.42 0.00 0.00 0.00 175.30 173.40 1d2r s ILE 183 N 13.13 3.88 0.84 4.11 -1.09 -1.26 -4.99 121.20 135.83 1d2r s ILE 183 Ca 0.92 1.05 -0.11 0.00 -2.23 0.00 0.00 60.65 60.28 1d2r s ILE 183 Cb -0.14 -3.75 0.13 0.00 -1.58 0.00 0.00 42.46 37.12 1d2r s ILE 183 CO 0.16 -0.18 1.18 -0.04 -1.23 0.00 0.00 174.94 174.83 1d2r s MET 184 N 4.04 1.41 0.43 2.79 -1.94 -1.26 -1.86 119.30 122.91 1d2r s MET 184 Ca 0.65 -0.37 -0.25 0.00 -1.71 0.00 0.00 55.69 54.01 1d2r s MET 184 Cb -0.26 -2.01 -0.08 0.00 2.01 0.00 0.00 34.83 34.49 1d2r s MET 184 CO 0.24 -1.85 1.31 0.45 -0.01 0.00 0.00 175.02 175.17 1d2r s SER 185 N -4.72 6.16 0.18 3.03 0.15 0.28 -4.06 113.70 114.71 1d2r s SER 185 Ca 0.67 2.67 0.23 0.00 0.70 0.00 0.00 55.95 60.23 1d2r s SER 185 Cb -0.07 -2.64 0.90 0.00 -1.71 0.00 0.00 66.02 62.50 1d2r s SER 185 CO 0.49 -0.96 1.71 0.18 1.20 0.00 0.00 173.24 175.86 1d2r n LEU 186 N -0.05 0.53 -0.00 3.45 4.77 -0.38 -3.27 117.00 122.04 1d2r n LEU 186 Ca 0.05 0.60 0.04 0.00 -0.03 0.00 0.00 56.01 56.67 1d2r n LEU 186 Cb 0.44 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.98 1d2r n LEU 186 CO 0.55 -0.35 -0.51 1.33 -1.33 0.00 0.00 177.39 177.08 1d2r n VAL 187 N -2.05 0.00 -3.56 4.08 0.24 -1.26 -1.56 118.33 114.22 1d2r n VAL 187 Ca 0.04 -0.21 -0.29 0.00 -2.04 0.00 0.00 64.34 61.83 1d2r n VAL 187 Cb 0.28 0.41 -0.13 0.00 -1.47 0.00 0.00 33.84 32.93 1d2r n VAL 187 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1d2r s ASP 188 N -2.79 3.39 0.62 -1.34 -1.08 -1.20 -4.86 116.67 109.40 1d2r s ASP 188 Ca -0.02 -1.90 0.32 0.00 -0.52 0.00 0.00 52.55 50.42 1d2r s ASP 188 Cb 0.06 -0.54 1.76 0.00 -1.46 0.00 0.00 42.92 42.73 1d2r s ASP 188 CO 0.35 -0.36 2.09 -0.65 0.52 0.00 0.00 175.17 177.12 1d2r h PRO 189 N 7.54 0.00 0.08 4.34 0.11 -1.89 -1.23 132.00 140.96 1d2r h PRO 189 Ca -0.06 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.77 1d2r h PRO 189 Cb 0.98 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 1d2r h PRO 189 CO 0.38 0.00 -1.41 1.79 -0.21 0.00 0.00 178.00 178.54 1d2r h THR 190 N 0.00 1.27 -3.97 -1.15 1.35 -1.94 -3.43 112.91 105.04 1d2r h THR 190 Ca 0.06 -2.94 -0.48 0.00 -0.55 0.00 0.00 66.41 62.51 1d2r h THR 190 Cb 0.51 2.76 0.01 0.00 -1.73 0.00 0.00 68.15 69.70 1d2r h THR 190 CO -0.00 0.82 0.26 -0.75 -0.25 0.00 0.00 175.52 175.60 1d2r s LYS 191 N -2.64 3.91 0.42 4.72 2.20 -0.47 -4.95 119.74 122.92 1d2r s LYS 191 Ca -0.06 0.76 -0.16 0.00 -0.36 0.00 0.00 55.97 56.15 1d2r s LYS 191 Cb 0.08 -2.25 -0.09 0.00 -1.51 0.00 0.00 37.83 34.05 1d2r s LYS 191 CO 0.85 -0.14 0.87 0.21 -0.36 0.00 0.00 175.35 176.78 1d2r s LYS 192 N -3.85 4.02 -0.51 4.03 2.20 -1.26 -0.56 119.74 123.81 1d2r s LYS 192 Ca 0.56 0.84 -0.28 0.00 -0.36 0.00 0.00 55.97 56.73 1d2r s LYS 192 Cb -0.10 -2.28 0.00 0.00 -1.51 0.00 0.00 37.83 33.95 1d2r s LYS 192 CO 0.29 -0.04 1.52 1.41 -0.36 0.00 0.00 175.35 178.17 1d2r s MET 193 N -3.46 3.28 -0.04 4.03 -2.45 -0.77 -4.15 119.30 115.74 1d2r s MET 193 Ca 0.57 0.69 0.02 0.00 -1.25 0.00 0.00 55.69 55.72 1d2r s MET 193 Cb -0.10 -4.15 -0.03 0.00 1.25 0.00 0.00 34.83 31.81 1d2r s MET 193 CO 0.22 -1.95 -0.07 0.45 1.05 0.00 0.00 175.02 174.72 1d2r s SER 194 N 4.98 4.66 0.55 1.11 0.15 -1.26 -4.88 113.70 119.01 1d2r s SER 194 Ca 0.59 -0.06 0.28 0.00 0.70 0.00 0.00 55.95 57.46 1d2r s SER 194 Cb -0.13 -1.15 1.59 0.00 -1.71 0.00 0.00 66.02 64.62 1d2r s SER 194 CO 0.27 0.33 2.15 0.11 1.20 0.00 0.00 173.24 177.30 1d2r h LYS 195 N 4.97 0.00 -0.87 5.44 6.56 -1.93 -2.61 116.57 128.13 1d2r h LYS 195 Ca -0.49 0.00 -0.51 0.00 -1.06 0.00 0.00 60.65 58.59 1d2r h LYS 195 Cb 1.17 0.00 -0.28 0.00 -0.57 0.00 0.00 32.23 32.56 1d2r h LYS 195 CO 0.53 0.07 0.49 -1.13 -2.06 0.00 0.00 179.45 177.35 1d2r n SER 196 N -3.78 4.78 -4.75 0.86 3.41 -1.26 -4.99 113.62 107.89 1d2r n SER 196 Ca -0.02 -3.71 -0.40 0.00 -0.26 0.00 0.00 58.87 54.48 1d2r n SER 196 Cb 0.17 -0.81 -0.06 0.00 -0.26 0.00 0.00 64.21 63.25 1d2r n SER 196 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1d2r s ASP 197 N -1.84 7.57 0.08 4.04 -1.08 -0.98 -4.91 116.67 119.56 1d2r s ASP 197 Ca 0.57 1.87 0.08 0.00 -0.52 0.00 0.00 52.55 54.54 1d2r s ASP 197 Cb 0.47 -2.59 0.39 0.00 -1.46 0.00 0.00 42.92 39.74 1d2r s ASP 197 CO 0.05 0.11 1.25 -2.65 0.52 0.00 0.00 175.17 174.45 1d2r n PRO 198 N 1.84 0.04 -4.03 4.34 -0.02 -1.26 -4.33 135.00 131.58 1d2r n PRO 198 Ca -0.01 0.49 -0.31 0.00 -2.02 0.00 0.00 63.50 61.64 1d2r n PRO 198 Cb 0.48 -1.62 -0.15 0.00 -0.02 0.00 0.00 33.50 32.19 1d2r n PRO 198 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1d2r s ASN 199 N -3.29 4.42 0.14 2.55 3.04 -1.26 -4.98 114.94 115.56 1d2r s ASN 199 Ca 0.01 -1.55 0.10 0.00 0.04 0.00 0.00 52.86 51.46 1d2r s ASN 199 Cb 0.03 -1.49 0.54 0.00 -1.54 0.00 0.00 41.25 38.79 1d2r s ASN 199 CO 0.10 -0.25 1.32 -0.81 -3.04 0.00 0.00 177.10 174.42 1d2r n PRO 200 N 4.44 0.06 0.00 0.43 -0.04 -1.26 -0.68 135.00 137.95 1d2r n PRO 200 Ca -0.09 0.55 0.14 0.00 -0.04 0.00 0.00 63.50 64.05 1d2r n PRO 200 Cb 0.42 -1.70 0.57 0.00 -0.04 0.00 0.00 33.50 32.75 1d2r n PRO 200 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1d2r n LYS 201 N -1.84 0.04 0.06 0.54 4.76 -1.26 -3.36 118.16 117.10 1d2r n LYS 201 Ca -0.00 -0.01 0.12 0.00 -2.87 0.00 0.00 58.31 55.55 1d2r n LYS 201 Cb 0.03 -1.50 0.27 0.00 -1.84 0.00 0.00 35.03 31.99 1d2r n LYS 201 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1d2r n ALA 202 N -1.47 2.78 -2.19 7.82 0.00 0.15 -4.44 120.51 123.15 1d2r n ALA 202 Ca 0.07 -0.19 -0.09 0.00 0.00 0.00 0.00 53.44 53.24 1d2r n ALA 202 Cb 0.33 -1.27 -0.10 0.00 0.00 0.00 0.00 19.45 18.42 1d2r n ALA 202 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1d2r s TYR 203 N -3.12 0.70 -0.11 0.00 -0.85 -1.21 -1.24 117.35 111.51 1d2r s TYR 203 Ca 0.08 -1.13 0.03 0.00 -0.52 0.00 0.00 57.07 55.54 1d2r s TYR 203 Cb 0.14 -0.40 0.01 0.00 0.38 0.00 0.00 41.96 42.08 1d2r s TYR 203 CO 0.67 -0.50 -0.20 0.42 -1.52 0.00 0.00 175.55 174.42 1d2r s ILE 204 N -4.00 1.82 0.24 -3.49 1.01 -1.26 -4.96 121.20 110.56 1d2r s ILE 204 Ca 0.18 -0.86 -0.09 0.00 0.00 0.00 0.00 60.65 59.88 1d2r s ILE 204 Cb 0.07 -1.61 -0.07 0.00 0.01 0.00 0.00 42.46 40.86 1d2r s ILE 204 CO -0.02 0.51 0.55 -0.89 0.00 0.00 0.00 174.94 175.08 1d2r s THR 205 N 0.65 4.96 0.07 2.92 2.01 -1.26 -0.73 115.64 124.25 1d2r s THR 205 Ca -0.13 0.37 0.30 0.00 0.31 0.00 0.00 61.69 62.55 1d2r s THR 205 Cb -0.16 -3.64 0.31 0.00 0.01 0.00 0.00 72.50 69.01 1d2r s THR 205 CO 0.03 -0.12 1.92 -0.07 -0.69 0.00 0.00 174.62 175.69 1d2r h LEU 206 N 2.37 0.00 -0.70 4.42 3.38 -1.81 -1.51 115.31 121.46 1d2r h LEU 206 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1d2r h LEU 206 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1d2r h LEU 206 CO 0.69 0.00 -0.61 0.18 0.09 0.00 0.00 178.44 178.79 1d2r n LEU 207 N -2.58 1.68 -4.65 1.67 4.77 -1.26 -4.63 117.00 112.00 1d2r n LEU 207 Ca -0.01 -0.68 -0.47 0.00 -0.03 0.00 0.00 56.01 54.81 1d2r n LEU 207 Cb 0.09 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 1d2r n LEU 207 CO 0.15 0.33 1.12 0.47 -1.33 0.00 0.00 177.39 178.14 1d2r n ASP 208 N -0.46 2.76 -4.83 -1.43 8.00 -0.57 -4.95 116.55 115.07 1d2r n ASP 208 Ca 0.07 1.09 -0.31 0.00 0.71 0.00 0.00 54.79 56.36 1d2r n ASP 208 Cb 0.41 -1.37 0.05 0.00 -0.02 0.00 0.00 41.12 40.19 1d2r n ASP 208 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1d2r s ASP 209 N 0.79 5.44 0.27 -2.24 1.47 -1.26 -4.73 116.67 116.41 1d2r s ASP 209 Ca 0.80 1.58 -0.03 0.00 1.18 0.00 0.00 52.55 56.07 1d2r s ASP 209 Cb -0.74 -2.47 0.56 0.00 -0.34 0.00 0.00 42.92 39.93 1d2r s ASP 209 CO 0.40 -1.40 1.62 0.00 0.68 0.00 0.00 175.17 176.47 1d2r h ALA 210 N -0.69 0.95 -0.96 2.11 0.00 -1.96 0.14 119.26 118.86 1d2r h ALA 210 Ca -0.44 0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.80 1d2r h ALA 210 Cb 1.21 0.47 -0.06 0.00 0.00 0.00 0.00 17.79 19.41 1d2r h ALA 210 CO 0.58 -0.46 0.62 -0.22 0.00 0.00 0.00 179.25 179.76 1d2r h LYS 211 N 0.09 1.11 -0.08 0.00 3.64 -1.99 -0.90 116.57 118.45 1d2r h LYS 211 Ca 0.48 -0.07 -0.15 0.00 -1.27 0.00 0.00 60.65 59.65 1d2r h LYS 211 Cb 0.91 -0.25 0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1d2r h LYS 211 CO -0.75 0.74 -0.53 1.15 -2.27 0.00 0.00 179.45 177.78 1d2r h THR 212 N 1.15 1.38 -0.81 1.00 2.02 -1.14 -1.53 112.91 114.98 1d2r h THR 212 Ca 0.40 -1.89 0.05 0.00 0.77 0.00 0.00 66.41 65.74 1d2r h THR 212 Cb 0.10 2.29 -0.05 0.00 -1.74 0.00 0.00 68.15 68.76 1d2r h THR 212 CO -0.15 0.56 0.53 0.40 0.37 0.00 0.00 175.52 177.23 1d2r h ILE 213 N 0.07 1.09 -0.19 3.11 2.04 -0.94 0.53 117.51 123.23 1d2r h ILE 213 Ca -0.05 -0.33 -0.18 0.00 1.00 0.00 0.00 64.86 65.31 1d2r h ILE 213 Cb 1.19 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1d2r h ILE 213 CO 0.11 0.17 -0.61 -0.08 0.00 0.00 0.00 178.15 177.74 1d2r h GLU 214 N 0.95 0.65 -0.22 2.37 4.81 -1.11 -0.27 114.58 121.76 1d2r h GLU 214 Ca 0.34 -0.45 -0.13 0.00 -0.13 0.00 0.00 59.36 58.99 1d2r h GLU 214 Cb 0.12 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1d2r h GLU 214 CO -0.11 1.07 -0.35 -0.22 -0.73 0.00 0.00 179.01 178.67 1d2r h LYS 215 N 0.49 0.63 -0.33 1.92 3.11 -0.23 -2.07 116.57 120.09 1d2r h LYS 215 Ca -0.01 -0.38 -0.12 0.00 -2.81 0.00 0.00 60.65 57.33 1d2r h LYS 215 Cb 1.19 0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 32.45 1d2r h LYS 215 CO 0.12 1.00 -0.26 0.87 -2.81 0.00 0.00 179.45 178.37 1d2r h LYS 216 N 0.33 0.75 -0.11 1.90 1.57 0.02 -2.84 116.57 118.20 1d2r h LYS 216 Ca 0.02 -0.37 -0.11 0.00 -1.87 0.00 0.00 60.65 58.32 1d2r h LYS 216 Cb 0.94 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 1d2r h LYS 216 CO 0.08 0.99 -0.42 0.82 -0.57 0.00 0.00 179.45 180.36 1d2r h ILE 217 N 0.52 1.31 0.00 1.86 1.08 -1.09 -2.64 117.51 118.55 1d2r h ILE 217 Ca 0.06 -1.54 0.00 0.00 -0.39 0.00 0.00 64.86 63.00 1d2r h ILE 217 Cb 0.82 1.69 0.00 0.00 -3.07 0.00 0.00 36.82 36.26 1d2r h ILE 217 CO 0.07 0.46 0.00 0.50 -0.69 0.00 0.00 178.15 178.49 1d2r h LYS 218 N 0.21 0.00 0.00 2.37 3.64 -1.32 -2.68 116.57 118.79 1d2r h LYS 218 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1d2r h LYS 218 Cb 0.83 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 1d2r h LYS 218 CO 0.07 0.00 -0.83 0.43 -2.27 0.00 0.00 179.45 176.85 1d2r n SER 219 N -2.78 0.81 -4.64 4.20 7.64 -1.02 -4.96 113.62 112.87 1d2r n SER 219 Ca 0.02 -0.71 -0.57 0.00 1.01 0.00 0.00 58.87 58.62 1d2r n SER 219 Cb 0.35 0.74 -0.07 0.00 -1.01 0.00 0.00 64.21 64.21 1d2r n SER 219 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d2r n ALA 220 N -1.51 -1.02 -1.77 -0.43 0.00 -1.01 -4.85 120.51 109.92 1d2r n ALA 220 Ca 0.04 0.47 -0.39 0.00 0.00 0.00 0.00 53.44 53.57 1d2r n ALA 220 Cb 0.34 -2.08 -0.00 0.00 0.00 0.00 0.00 19.45 17.70 1d2r n ALA 220 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1d2r s VAL 221 N 1.88 2.67 0.00 0.00 -7.23 -0.60 -5.01 120.40 112.10 1d2r s VAL 221 Ca 0.93 0.58 0.00 0.00 -1.81 0.00 0.00 61.98 61.68 1d2r s VAL 221 Cb -1.09 -3.34 0.00 0.00 0.56 0.00 0.00 36.38 32.51 1d2r s VAL 221 CO 0.59 0.07 0.00 0.35 -0.31 0.00 0.00 175.10 175.80 1d2r n THR 222 N 0.02 0.00 -2.76 5.32 -2.24 -1.26 -4.20 114.28 109.16 1d2r n THR 222 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1d2r n THR 222 Cb 0.44 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 1d2r n THR 222 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1d2r n ASP 223 N 0.00 0.00 -0.18 3.42 5.68 -1.26 -4.66 116.55 119.55 1d2r n ASP 223 Ca 0.00 0.00 0.05 0.00 -0.50 0.00 0.00 54.79 54.34 1d2r n ASP 223 Cb 0.00 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 39.97 1d2r n ASP 223 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1d2r n SER 224 N 0.00 1.05 -0.19 -1.12 7.64 -1.26 -4.54 113.62 115.19 1d2r n SER 224 Ca 0.00 -1.03 -0.10 0.00 1.01 0.00 0.00 58.87 58.76 1d2r n SER 224 Cb 0.00 0.59 0.01 0.00 -1.01 0.00 0.00 64.21 63.81 1d2r n SER 224 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1d2r h GLU 225 N 0.88 1.00 -0.88 1.43 4.81 -1.97 -3.47 114.58 116.37 1d2r h GLU 225 Ca 0.00 -0.33 -0.10 0.00 -0.13 0.00 0.00 59.36 58.80 1d2r h GLU 225 Cb 0.32 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.62 1d2r h GLU 225 CO 0.00 1.01 -0.13 0.41 -0.73 0.00 0.00 179.01 179.57 1d2r n GLY 226 N -0.37 0.22 2.88 1.92 0.00 -1.26 -5.05 105.19 103.54 1d2r n GLY 226 Ca 0.02 -0.65 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 1d2r n GLY 226 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1d2r s THR 227 N -2.35 0.51 -1.13 2.61 -4.23 -1.26 -4.67 115.64 105.12 1d2r s THR 227 Ca 0.02 -0.10 -0.22 0.00 -1.18 0.00 0.00 61.69 60.21 1d2r s THR 227 Cb -0.01 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.25 1d2r s THR 227 CO 0.02 0.22 1.86 -0.63 -0.54 0.00 0.00 174.62 175.55 1d2r s ILE 228 N 0.97 3.66 -0.05 2.99 -1.09 -1.26 -4.90 121.20 121.51 1d2r s ILE 228 Ca -0.10 -0.96 0.01 0.00 -2.23 0.00 0.00 60.65 57.37 1d2r s ILE 228 Cb -0.14 -4.60 0.02 0.00 -1.58 0.00 0.00 42.46 36.16 1d2r s ILE 228 CO -0.00 -1.25 -0.07 -0.60 -1.23 0.00 0.00 174.94 171.79 1d2r s ARG 229 N 6.06 1.14 0.24 2.79 3.52 -1.26 -4.64 118.95 126.80 1d2r s ARG 229 Ca 0.64 -0.22 -0.30 0.00 -0.13 0.00 0.00 55.73 55.73 1d2r s ARG 229 Cb -0.01 -1.04 -0.09 0.00 -1.56 0.00 0.00 34.95 32.25 1d2r s ARG 229 CO 0.07 -0.04 1.25 -0.47 -0.81 0.00 0.00 175.30 175.30 1d2r s TYR 230 N 0.81 3.31 -0.31 5.12 6.14 -1.26 -4.67 117.35 126.50 1d2r s TYR 230 Ca -0.13 1.40 -0.12 0.00 0.64 0.00 0.00 57.07 58.86 1d2r s TYR 230 Cb -0.15 -3.52 0.19 0.00 0.42 0.00 0.00 41.96 38.89 1d2r s TYR 230 CO 0.01 -1.48 1.08 0.34 0.64 0.00 0.00 175.55 176.14 1d2r s ASP 231 N -0.12 -0.29 0.04 4.32 2.15 -1.26 -5.06 116.67 116.46 1d2r s ASP 231 Ca 0.52 -0.04 -0.08 0.00 0.43 0.00 0.00 52.55 53.37 1d2r s ASP 231 Cb -0.36 0.82 -0.02 0.00 -0.30 0.00 0.00 42.92 43.07 1d2r s ASP 231 CO 0.42 -0.04 0.73 0.29 -0.17 0.00 0.00 175.17 176.39 1d2r n LYS 232 N 4.46 -0.12 0.02 4.34 4.76 -1.26 -2.80 118.16 127.55 1d2r n LYS 232 Ca 0.08 0.72 0.12 0.00 -2.87 0.00 0.00 58.31 56.36 1d2r n LYS 232 Cb 0.61 -1.07 0.13 0.00 -1.84 0.00 0.00 35.03 32.85 1d2r n LYS 232 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1d2r n GLU 233 N -3.57 0.16 -0.04 1.97 0.00 -1.26 -2.89 120.64 115.01 1d2r n GLU 233 Ca 0.01 0.02 -0.03 0.00 0.00 0.00 0.00 57.16 57.15 1d2r n GLU 233 Cb 0.07 -1.57 -0.08 0.00 0.00 0.00 0.00 31.44 29.86 1d2r n GLU 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1d2r n ALA 234 N -1.68 1.87 -2.85 -1.84 0.00 -1.19 -4.58 120.51 110.24 1d2r n ALA 234 Ca 0.04 -0.58 -0.24 0.00 0.00 0.00 0.00 53.44 52.65 1d2r n ALA 234 Cb 0.39 -0.04 -0.02 0.00 0.00 0.00 0.00 19.45 19.78 1d2r n ALA 234 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1d2r n LYS 235 N -2.28 2.72 0.13 0.00 5.02 -1.12 -4.99 118.16 117.64 1d2r n LYS 235 Ca -0.14 -4.39 -0.13 0.00 -2.02 0.00 0.00 58.31 51.63 1d2r n LYS 235 Cb 0.72 -2.07 -0.06 0.00 -0.02 0.00 0.00 35.03 33.61 1d2r n LYS 235 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1d2r h PRO 236 N 2.89 -0.50 0.29 1.97 0.11 -1.63 -2.38 132.00 132.75 1d2r h PRO 236 Ca 0.15 0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.29 1d2r h PRO 236 Cb 0.74 0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.93 1d2r h PRO 236 CO 0.74 -0.34 -0.49 0.78 -0.21 0.00 0.00 178.00 178.49 1d2r h GLY 237 N -0.52 -1.20 1.21 -0.55 0.00 -1.83 -1.79 103.07 98.38 1d2r h GLY 237 Ca 0.02 0.61 0.04 0.00 0.00 0.00 0.00 47.33 48.00 1d2r h GLY 237 CO -0.15 -0.32 0.45 -2.22 0.00 0.00 0.00 176.54 174.29 1d2r h ILE 238 N -0.83 1.09 -0.75 2.60 1.08 -1.73 -1.40 117.51 117.58 1d2r h ILE 238 Ca -0.03 -0.28 -0.05 0.00 -0.39 0.00 0.00 64.86 64.11 1d2r h ILE 238 Cb 0.77 0.21 -0.03 0.00 -3.07 0.00 0.00 36.82 34.70 1d2r h ILE 238 CO -0.16 0.15 0.28 0.28 -0.69 0.00 0.00 178.15 178.00 1d2r h SER 239 N 0.81 1.05 -0.32 1.72 0.02 -1.14 0.84 113.55 116.52 1d2r h SER 239 Ca 0.27 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1d2r h SER 239 Cb 0.08 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1d2r h SER 239 CO -0.08 0.95 0.14 -1.13 -1.14 0.00 0.00 176.83 175.57 1d2r h ASN 240 N 1.08 0.44 -0.97 3.07 -1.24 -0.43 -0.70 115.58 116.83 1d2r h ASN 240 Ca 0.25 -0.15 0.00 0.00 0.71 0.00 0.00 56.30 57.11 1d2r h ASN 240 Cb 0.24 -0.11 -0.05 0.00 0.73 0.00 0.00 38.32 39.13 1d2r h ASN 240 CO -0.02 0.47 0.61 -0.07 -1.29 0.00 0.00 177.43 177.13 1d2r h LEU 241 N 0.38 1.15 -1.12 0.34 4.07 -0.93 -1.78 115.31 117.42 1d2r h LEU 241 Ca 0.11 -0.05 -0.07 0.00 0.08 0.00 0.00 57.88 57.95 1d2r h LEU 241 Cb 0.15 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 41.59 1d2r h LEU 241 CO -0.01 0.86 -0.13 -0.07 -1.08 0.00 0.00 178.44 178.00 1d2r h LEU 242 N 1.33 0.44 -0.03 1.67 3.38 -0.42 -1.56 115.31 120.12 1d2r h LEU 242 Ca 0.35 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 1d2r h LEU 242 Cb -0.10 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 1d2r h LEU 242 CO -0.07 0.61 -0.00 -1.13 0.09 0.00 0.00 178.44 177.94 1d2r h ASN 243 N 0.42 0.05 -0.63 -0.43 -1.24 -0.40 0.54 115.58 113.89 1d2r h ASN 243 Ca 0.08 -0.32 0.05 0.00 0.71 0.00 0.00 56.30 56.82 1d2r h ASN 243 Cb 0.49 -0.01 -0.05 0.00 0.73 0.00 0.00 38.32 39.48 1d2r h ASN 243 CO 0.03 0.35 0.35 0.40 -1.29 0.00 0.00 177.43 177.27 1d2r h ILE 244 N -0.26 0.98 0.40 2.57 2.04 -1.18 -1.41 117.51 120.65 1d2r h ILE 244 Ca 0.01 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1d2r h ILE 244 Cb 0.33 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 1d2r h ILE 244 CO 0.00 0.12 -0.19 0.22 0.00 0.00 0.00 178.15 178.30 1d2r h TYR 245 N 0.66 -0.50 0.01 1.37 5.03 -1.16 -2.55 116.97 119.83 1d2r h TYR 245 Ca 0.28 -0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.61 1d2r h TYR 245 Cb 0.15 0.16 -0.05 0.00 1.55 0.00 0.00 36.73 38.54 1d2r h TYR 245 CO -0.08 -0.27 -0.30 1.03 -1.32 0.00 0.00 178.16 177.22 1d2r h SER 246 N -0.60 -0.88 0.37 -2.11 0.87 -0.56 -0.77 113.55 109.86 1d2r h SER 246 Ca -0.05 0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.60 1d2r h SER 246 Cb 0.45 0.36 -0.00 0.00 -0.44 0.00 0.00 62.40 62.76 1d2r h SER 246 CO 0.09 -0.36 -0.12 0.71 -0.53 0.00 0.00 176.83 176.61 1d2r h THR 247 N -0.45 0.59 0.00 2.23 1.35 -1.29 0.64 112.91 115.98 1d2r h THR 247 Ca 0.06 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1d2r h THR 247 Cb 0.53 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 1d2r h THR 247 CO -0.25 0.12 -1.21 0.18 -0.25 0.00 0.00 175.52 174.11 1d2r n LEU 248 N -3.67 0.58 -0.03 3.87 4.77 -0.96 -4.38 117.00 117.17 1d2r n LEU 248 Ca -0.02 0.13 0.02 0.00 -0.03 0.00 0.00 56.01 56.12 1d2r n LEU 248 Cb 0.24 -0.06 -0.13 0.00 -2.33 0.00 0.00 43.42 41.14 1d2r n LEU 248 CO 0.30 -0.06 -0.82 -1.54 -1.33 0.00 0.00 177.39 173.94 1d2r n SER 249 N -2.32 1.14 0.00 -1.43 3.41 -0.32 -5.01 113.62 109.09 1d2r n SER 249 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1d2r n SER 249 Cb 0.51 1.42 0.00 0.00 -0.26 0.00 0.00 64.21 65.88 1d2r n SER 249 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1d2r n GLY 250 N 1.74 3.32 3.75 5.00 0.00 0.20 -5.05 105.19 114.15 1d2r n GLY 250 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 1d2r n GLY 250 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1d2r s GLN 251 N -0.67 4.65 1.08 1.61 -0.21 -1.24 -4.99 119.66 119.88 1d2r s GLN 251 Ca 0.00 1.73 -0.13 0.00 0.02 0.00 0.00 55.36 56.98 1d2r s GLN 251 Cb 0.00 -3.24 0.23 0.00 1.00 0.00 0.00 33.01 31.01 1d2r s GLN 251 CO 0.00 0.19 1.07 -1.54 -2.12 0.00 0.00 175.29 172.89 1d2r s SER 252 N -0.60 1.87 0.49 5.90 1.04 -1.26 -4.43 113.70 116.71 1d2r s SER 252 Ca 0.46 1.20 0.28 0.00 0.48 0.00 0.00 55.95 58.37 1d2r s SER 252 Cb -0.30 -1.88 1.08 0.00 0.10 0.00 0.00 66.02 65.02 1d2r s SER 252 CO 0.37 -3.60 1.88 0.40 0.98 0.00 0.00 173.24 173.28 1d2r h ILE 253 N -2.22 0.31 0.16 -1.02 2.04 -1.95 -2.23 117.51 112.61 1d2r h ILE 253 Ca -0.56 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 64.42 1d2r h ILE 253 Cb 1.33 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1d2r h ILE 253 CO 0.54 0.12 -0.08 -0.33 0.00 0.00 0.00 178.15 178.40 1d2r h GLU 254 N 0.00 -0.21 -0.91 2.37 3.07 -2.00 -2.02 114.58 114.87 1d2r h GLU 254 Ca -0.00 0.01 0.08 0.00 -0.50 0.00 0.00 59.36 58.95 1d2r h GLU 254 Cb 0.66 0.05 -0.07 0.00 -0.84 0.00 0.00 28.75 28.55 1d2r h GLU 254 CO 0.02 0.21 0.57 1.49 -1.40 0.00 0.00 179.01 179.89 1d2r h GLU 255 N -0.75 0.97 -0.47 2.33 4.81 -1.88 -1.46 114.58 118.12 1d2r h GLU 255 Ca -0.02 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.08 1d2r h GLU 255 Cb 0.52 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 1d2r h GLU 255 CO 0.04 0.64 0.01 -0.07 -0.73 0.00 0.00 179.01 178.91 1d2r h LEU 256 N 1.00 0.80 -0.40 1.64 3.38 -1.43 0.28 115.31 120.59 1d2r h LEU 256 Ca 0.41 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 58.10 1d2r h LEU 256 Cb 0.25 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1d2r h LEU 256 CO -0.20 0.90 0.24 -0.33 0.09 0.00 0.00 178.44 179.14 1d2r h GLU 257 N 0.67 0.47 0.14 1.13 5.08 -0.75 -1.44 114.58 119.88 1d2r h GLU 257 Ca 0.13 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1d2r h GLU 257 Cb 0.48 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1d2r h GLU 257 CO 0.02 0.31 -0.07 -0.09 -1.00 0.00 0.00 179.01 178.18 1d2r h ARG 258 N 0.48 -0.18 0.00 2.33 9.65 -1.15 -2.73 114.38 122.78 1d2r h ARG 258 Ca 0.16 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.05 1d2r h ARG 258 Cb 0.00 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 1d2r h ARG 258 CO -0.07 0.06 0.24 0.37 2.80 0.00 0.00 179.97 183.36 1d2r h GLN 259 N -0.41 0.00 -0.67 0.20 4.15 -0.13 -0.66 115.11 117.60 1d2r h GLN 259 Ca -0.02 0.00 -0.49 0.00 0.77 0.00 0.00 58.65 58.91 1d2r h GLN 259 Cb 0.32 0.00 -0.38 0.00 0.21 0.00 0.00 27.48 27.63 1d2r h GLN 259 CO 0.03 0.00 -0.77 0.66 -1.93 0.00 0.00 178.83 176.82 1d2r n TYR 260 N -2.82 2.44 0.00 3.99 4.02 -0.57 -4.95 117.16 119.27 1d2r n TYR 260 Ca -0.02 -2.14 0.00 0.00 -0.01 0.00 0.00 57.90 55.72 1d2r n TYR 260 Cb 0.28 -0.34 0.00 0.00 -0.02 0.00 0.00 39.34 39.27 1d2r n TYR 260 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1d2r n GLU 261 N -0.76 0.00 0.00 -0.72 4.07 -0.26 -2.92 120.64 120.06 1d2r n GLU 261 Ca 0.41 0.27 0.15 0.00 -0.06 0.00 0.00 57.16 57.93 1d2r n GLU 261 Cb 0.94 -0.84 0.72 0.00 -0.06 0.00 0.00 31.44 32.20 1d2r n GLU 261 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1d2r n GLY 262 N -0.61 -0.93 3.75 8.31 0.00 -1.26 -4.79 105.19 109.66 1d2r n GLY 262 Ca 0.00 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 1d2r n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2r s LYS 263 N -2.32 3.25 0.32 1.61 -0.14 -1.15 -5.04 119.74 116.27 1d2r s LYS 263 Ca 0.35 2.20 0.03 0.00 -1.36 0.00 0.00 55.97 57.19 1d2r s LYS 263 Cb 0.21 -2.31 0.06 0.00 -1.68 0.00 0.00 37.83 34.11 1d2r s LYS 263 CO 0.43 -1.09 0.44 0.41 -0.76 0.00 0.00 175.35 174.78 1d2r n GLY 264 N 0.68 1.46 0.14 -3.33 0.00 -1.26 -4.49 105.19 98.39 1d2r n GLY 264 Ca 0.10 -2.11 -0.00 0.00 0.00 0.00 0.00 46.02 44.01 1d2r n GLY 264 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1d2r h TYR 265 N -0.16 0.00 -0.20 1.61 0.05 -1.97 -3.16 116.97 113.14 1d2r h TYR 265 Ca -0.15 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.69 1d2r h TYR 265 Cb 0.62 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 38.29 1d2r h TYR 265 CO 0.00 0.61 -0.33 0.78 -1.05 0.00 0.00 178.16 178.17 1d2r h GLY 266 N 2.10 -0.42 2.00 3.88 0.00 -2.00 0.29 103.07 108.93 1d2r h GLY 266 Ca -0.01 0.41 -0.09 0.00 0.00 0.00 0.00 47.33 47.64 1d2r h GLY 266 CO 0.08 -0.22 -0.44 -0.39 0.00 0.00 0.00 176.54 175.57 1d2r h VAL 267 N -0.37 1.04 0.36 4.60 -1.51 -1.98 -2.09 116.25 116.31 1d2r h VAL 267 Ca 0.11 -1.68 -0.02 0.00 -1.23 0.00 0.00 66.70 63.89 1d2r h VAL 267 Cb 0.55 1.98 0.00 0.00 -2.13 0.00 0.00 31.29 31.70 1d2r h VAL 267 CO -0.41 0.43 -0.17 0.15 -1.23 0.00 0.00 177.57 176.34 1d2r h PHE 268 N 0.00 -0.44 -0.22 5.19 3.57 -1.27 -1.00 116.94 122.77 1d2r h PHE 268 Ca -0.00 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.53 1d2r h PHE 268 Cb 0.95 0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.79 1d2r h PHE 268 CO 0.00 -0.15 -0.05 0.87 -2.23 0.00 0.00 178.31 176.75 1d2r h LYS 269 N -0.71 0.00 -0.77 1.11 1.79 -0.97 0.79 116.57 117.81 1d2r h LYS 269 Ca -0.05 -0.00 0.12 0.00 -2.18 0.00 0.00 60.65 58.54 1d2r h LYS 269 Cb 0.49 -0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.06 1d2r h LYS 269 CO 0.08 0.00 0.37 0.00 -1.08 0.00 0.00 179.45 178.82 1d2r h ALA 270 N 1.22 1.10 -0.16 3.86 0.00 -1.30 -0.25 119.26 123.73 1d2r h ALA 270 Ca 0.11 0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 1d2r h ALA 270 Cb 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1d2r h ALA 270 CO -0.23 -0.09 -0.52 -0.44 0.00 0.00 0.00 179.25 177.97 1d2r h ASP 271 N 0.58 0.74 -0.67 0.00 3.32 -0.38 -3.09 116.42 116.92 1d2r h ASP 271 Ca 0.40 -0.60 0.02 0.00 0.02 0.00 0.00 57.03 56.88 1d2r h ASP 271 Cb 0.51 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.81 1d2r h ASP 271 CO -0.33 1.21 0.45 0.25 -1.72 0.00 0.00 179.24 179.10 1d2r h LEU 272 N 0.32 0.72 -1.08 1.55 5.85 -0.39 -1.69 115.31 120.59 1d2r h LEU 272 Ca -0.02 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 1d2r h LEU 272 Cb 1.15 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 1d2r h LEU 272 CO 0.11 0.51 0.19 0.00 -0.34 0.00 0.00 178.44 178.91 1d2r h ALA 273 N 1.60 1.27 -0.11 1.25 0.00 -0.99 -2.41 119.26 119.87 1d2r h ALA 273 Ca 0.26 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1d2r h ALA 273 Cb 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1d2r h ALA 273 CO -0.07 0.53 -0.21 1.96 0.00 0.00 0.00 179.25 181.45 1d2r h GLN 274 N 0.82 0.33 0.00 0.00 1.08 -1.26 -2.20 115.11 113.89 1d2r h GLN 274 Ca 0.19 -0.22 -0.01 0.00 -1.45 0.00 0.00 58.65 57.17 1d2r h GLN 274 Cb 0.22 0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.68 1d2r h GLN 274 CO -0.01 0.81 -0.03 -0.24 -0.95 0.00 0.00 178.83 178.42 1d2r h VAL 275 N -0.10 0.82 0.04 -0.54 3.04 -1.28 0.16 116.25 118.38 1d2r h VAL 275 Ca 0.00 -0.09 -0.12 0.00 -1.01 0.00 0.00 66.70 65.48 1d2r h VAL 275 Cb 0.80 1.05 0.01 0.00 -2.01 0.00 0.00 31.29 31.15 1d2r h VAL 275 CO 0.05 0.03 -0.49 0.58 -1.01 0.00 0.00 177.57 176.72 1d2r h VAL 276 N 0.00 1.52 -0.53 1.51 2.07 -1.39 -2.84 116.25 116.58 1d2r h VAL 276 Ca -0.00 -2.19 -0.04 0.00 0.82 0.00 0.00 66.70 65.29 1d2r h VAL 276 Cb 0.05 2.89 -0.03 0.00 -1.52 0.00 0.00 31.29 32.69 1d2r h VAL 276 CO 0.00 0.61 0.17 0.40 0.02 0.00 0.00 177.57 178.77 1d2r h ILE 277 N -0.39 1.21 0.00 4.57 2.04 -0.80 -1.83 117.51 122.31 1d2r h ILE 277 Ca -0.07 -0.72 -0.06 0.00 1.00 0.00 0.00 64.86 65.01 1d2r h ILE 277 Cb 1.27 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 1d2r h ILE 277 CO 0.09 0.27 -0.28 -0.08 0.00 0.00 0.00 178.15 178.16 1d2r h GLU 278 N 0.78 0.00 0.09 2.37 4.57 -0.78 -1.33 114.58 120.29 1d2r h GLU 278 Ca 0.18 0.00 -0.28 0.00 -1.18 0.00 0.00 59.36 58.07 1d2r h GLU 278 Cb 0.23 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 1d2r h GLU 278 CO -0.01 0.28 -1.41 1.15 -1.18 0.00 0.00 179.01 177.84 1d2r h THR 279 N 0.00 1.27 0.00 0.32 2.02 -1.14 -3.36 112.91 112.02 1d2r h THR 279 Ca -0.00 -2.93 -0.17 0.00 0.77 0.00 0.00 66.41 64.07 1d2r h THR 279 Cb 0.75 2.78 -0.03 0.00 -1.74 0.00 0.00 68.15 69.91 1d2r h THR 279 CO 0.04 0.83 -1.13 -0.07 0.37 0.00 0.00 175.52 175.55 1d2r h LEU 280 N 0.05 0.00 -0.29 2.58 3.38 -1.29 -3.37 115.31 116.36 1d2r h LEU 280 Ca -0.19 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.85 1d2r h LEU 280 Cb 1.97 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.64 1d2r h LEU 280 CO 0.16 0.68 -0.31 -0.09 0.09 0.00 0.00 178.44 178.97 1d2r h ARG 281 N 0.00 -0.29 -0.17 1.13 2.43 -1.39 0.40 114.38 116.49 1d2r h ARG 281 Ca -0.11 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1d2r h ARG 281 Cb 1.62 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 31.23 1d2r h ARG 281 CO 0.07 -0.19 0.10 -1.00 -1.51 0.00 0.00 179.97 177.44 1d2r h PRO 282 N -0.30 0.24 -0.43 0.20 0.13 -1.77 -1.09 132.00 128.98 1d2r h PRO 282 Ca 0.14 -0.03 0.08 0.00 -0.87 0.00 0.00 66.00 65.33 1d2r h PRO 282 Cb 0.53 -0.05 -0.07 0.00 0.13 0.00 0.00 31.00 31.54 1d2r h PRO 282 CO -0.46 0.22 0.01 0.82 -0.23 0.00 0.00 178.00 178.36 1d2r h ILE 283 N 0.19 0.68 -0.92 -3.56 2.04 -1.57 -0.88 117.51 113.50 1d2r h ILE 283 Ca 0.06 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 1d2r h ILE 283 Cb 0.05 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 1d2r h ILE 283 CO -0.01 0.02 0.55 1.56 0.00 0.00 0.00 178.15 180.27 1d2r h GLN 284 N 0.12 1.25 0.60 2.37 4.20 0.04 0.16 115.11 123.84 1d2r h GLN 284 Ca 0.21 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 1d2r h GLN 284 Cb 0.31 -0.26 0.01 0.00 0.30 0.00 0.00 27.48 27.83 1d2r h GLN 284 CO -0.35 0.87 -0.29 0.93 -0.67 0.00 0.00 178.83 179.32 1d2r h GLU 285 N 1.27 -0.78 -1.12 1.46 5.08 -0.15 -2.00 114.58 118.34 1d2r h GLU 285 Ca 0.33 0.05 0.31 0.00 -1.00 0.00 0.00 59.36 59.05 1d2r h GLU 285 Cb -0.05 0.18 -0.10 0.00 0.50 0.00 0.00 28.75 29.27 1d2r h GLU 285 CO -0.06 -0.52 0.73 0.00 -1.00 0.00 0.00 179.01 178.16 1d2r h ARG 286 N -0.81 0.28 0.17 2.33 3.08 -1.09 0.10 114.38 118.44 1d2r h ARG 286 Ca -0.08 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1d2r h ARG 286 Cb 0.62 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 1d2r h ARG 286 CO 0.14 0.18 -0.10 -0.92 -1.07 0.00 0.00 179.97 178.20 1d2r h TYR 287 N 0.29 -0.25 -0.58 3.04 5.03 -0.51 -1.12 116.97 122.87 1d2r h TYR 287 Ca 0.64 -0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.89 1d2r h TYR 287 Cb 1.82 0.09 -0.03 0.00 1.55 0.00 0.00 36.73 40.16 1d2r h TYR 287 CO -0.00 -0.15 0.11 0.45 -1.32 0.00 0.00 178.16 177.24 1d2r h HIS 288 N -0.25 0.96 -0.51 -3.82 3.86 -0.13 0.91 115.15 116.17 1d2r h HIS 288 Ca -0.02 -0.11 0.10 0.00 -1.16 0.00 0.00 60.37 59.18 1d2r h HIS 288 Cb 0.21 -0.27 -0.08 0.00 1.06 0.00 0.00 27.41 28.33 1d2r h HIS 288 CO -0.08 0.82 0.04 1.25 0.86 0.00 0.00 177.93 180.82 1d2r h HIS 289 N 0.87 0.05 -0.13 2.45 -0.00 -0.78 -2.29 115.15 115.33 1d2r h HIS 289 Ca 0.18 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.53 1d2r h HIS 289 Cb 0.37 0.06 -0.00 0.00 -0.00 0.00 0.00 27.41 27.83 1d2r h HIS 289 CO 0.02 -0.08 -0.12 -1.49 -0.00 0.00 0.00 177.93 176.26 1d2r h TRP 290 N 0.16 0.38 -0.69 5.26 4.06 -0.66 -3.20 115.95 121.26 1d2r h TRP 290 Ca 0.26 -0.11 0.14 0.00 2.06 0.00 0.00 58.89 61.24 1d2r h TRP 290 Cb 0.38 -0.08 -0.10 0.00 -1.00 0.00 0.00 29.16 28.35 1d2r h TRP 290 CO -0.28 0.71 0.14 0.52 -3.56 0.00 0.00 178.44 175.97 1d2r h MET 291 N -0.06 0.24 -0.60 0.49 2.86 -0.40 -2.39 114.93 115.06 1d2r h MET 291 Ca 0.02 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1d2r h MET 291 Cb 0.65 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1d2r h MET 291 CO 0.03 0.16 0.00 -0.85 1.06 0.00 0.00 176.91 177.31 1d2r n GLU 292 N -5.17 2.86 -4.36 1.72 0.28 -0.90 -4.92 120.64 110.14 1d2r n GLU 292 Ca 0.12 -1.99 -0.33 0.00 -0.16 0.00 0.00 57.16 54.81 1d2r n GLU 292 Cb 0.41 -1.68 -0.09 0.00 1.43 0.00 0.00 31.44 31.51 1d2r n GLU 292 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1d2r s SER 293 N -0.79 4.99 0.00 -1.84 0.15 -0.90 -4.99 113.70 110.33 1d2r s SER 293 Ca 0.36 -0.01 0.28 0.00 0.70 0.00 0.00 55.95 57.27 1d2r s SER 293 Cb 0.23 -1.29 1.27 0.00 -1.71 0.00 0.00 66.02 64.52 1d2r s SER 293 CO 0.18 0.30 1.91 -1.84 1.20 0.00 0.00 173.24 175.00 1d2r n GLU 294 N 1.62 0.17 0.10 5.44 0.28 -1.26 -2.80 120.64 124.18 1d2r n GLU 294 Ca -0.16 0.03 0.09 0.00 -0.16 0.00 0.00 57.16 56.96 1d2r n GLU 294 Cb 0.53 -1.50 0.41 0.00 1.43 0.00 0.00 31.44 32.31 1d2r n GLU 294 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1d2r n GLU 295 N -1.41 0.11 0.13 3.44 -0.58 -1.26 -2.51 120.64 118.56 1d2r n GLU 295 Ca 0.09 0.48 -0.13 0.00 -0.42 0.00 0.00 57.16 57.18 1d2r n GLU 295 Cb 0.28 -1.77 -0.08 0.00 -0.57 0.00 0.00 31.44 29.29 1d2r n GLU 295 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1d2r h LEU 296 N 0.00 -0.29 -1.67 -4.62 5.85 -1.79 -2.39 115.31 110.41 1d2r h LEU 296 Ca 0.00 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 1d2r h LEU 296 Cb 0.17 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1d2r h LEU 296 CO 0.00 0.09 0.06 0.44 -0.34 0.00 0.00 178.44 178.69 1d2r h ASP 297 N -0.71 0.24 -0.53 1.25 5.19 -1.73 -0.92 116.42 119.21 1d2r h ASP 297 Ca -0.03 -0.02 0.04 0.00 -0.62 0.00 0.00 57.03 56.40 1d2r h ASP 297 Cb 0.48 -0.06 -0.04 0.00 0.18 0.00 0.00 39.33 39.89 1d2r h ASP 297 CO 0.06 0.24 0.29 -0.09 -3.12 0.00 0.00 179.24 176.61 1d2r h ARG 298 N 0.27 0.54 -0.33 3.56 9.65 -1.44 0.20 114.38 126.84 1d2r h ARG 298 Ca 0.07 -0.03 -0.09 0.00 -1.10 0.00 0.00 59.98 58.82 1d2r h ARG 298 Cb 0.09 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 1d2r h ARG 298 CO -0.01 0.36 -0.16 0.28 2.80 0.00 0.00 179.97 183.24 1d2r h VAL 299 N 0.56 1.29 0.00 0.20 2.07 -0.69 -1.78 116.25 117.90 1d2r h VAL 299 Ca 0.23 -1.27 -0.06 0.00 0.82 0.00 0.00 66.70 66.42 1d2r h VAL 299 Cb 0.10 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1d2r h VAL 299 CO -0.14 0.41 -0.28 -0.07 0.02 0.00 0.00 177.57 177.52 1d2r h LEU 300 N 0.46 0.00 0.39 2.57 3.38 -0.95 -0.37 115.31 120.79 1d2r h LEU 300 Ca 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1d2r h LEU 300 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1d2r h LEU 300 CO 0.05 0.28 -0.19 0.44 0.09 0.00 0.00 178.44 179.11 1d2r h ASP 301 N 0.00 -0.45 -0.08 -0.43 5.19 -0.38 -1.92 116.42 118.35 1d2r h ASP 301 Ca -0.00 -0.04 0.02 0.00 -0.62 0.00 0.00 57.03 56.39 1d2r h ASP 301 Cb 0.60 0.12 -0.00 0.00 0.18 0.00 0.00 39.33 40.22 1d2r h ASP 301 CO 0.04 -0.00 0.11 -0.08 -3.12 0.00 0.00 179.24 176.18 1d2r h GLU 302 N -1.10 0.00 -0.01 3.56 4.81 -1.26 -0.41 114.58 120.16 1d2r h GLU 302 Ca -0.05 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 1d2r h GLU 302 Cb 0.45 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1d2r h GLU 302 CO 0.09 0.00 -0.18 0.78 -0.73 0.00 0.00 179.01 178.97 1d2r h GLY 303 N 0.00 0.16 2.00 1.92 0.00 -1.01 -2.04 103.07 104.11 1d2r h GLY 303 Ca 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 1d2r h GLY 303 CO -0.00 0.23 -0.12 0.00 0.00 0.00 0.00 176.54 176.65 1d2r h ALA 304 N 0.30 1.49 -0.20 3.60 0.00 -0.48 -0.42 119.26 123.55 1d2r h ALA 304 Ca -0.02 -0.11 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 1d2r h ALA 304 Cb 0.91 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.68 1d2r h ALA 304 CO 0.04 0.15 -0.68 1.49 0.00 0.00 0.00 179.25 180.25 1d2r h GLU 305 N 0.00 0.80 -0.03 0.00 4.81 -1.03 -0.91 114.58 118.22 1d2r h GLU 305 Ca -0.00 -0.59 -0.21 0.00 -0.13 0.00 0.00 59.36 58.43 1d2r h GLU 305 Cb 0.27 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.75 1d2r h GLU 305 CO 0.02 1.21 -0.87 0.87 -0.73 0.00 0.00 179.01 179.50 1d2r h LYS 306 N 0.57 0.44 -0.39 1.92 1.57 -0.62 -2.00 116.57 118.06 1d2r h LYS 306 Ca -0.02 -0.43 -0.14 0.00 -1.87 0.00 0.00 60.65 58.18 1d2r h LYS 306 Cb 1.30 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.71 1d2r h LYS 306 CO 0.14 1.08 -0.32 0.00 -0.57 0.00 0.00 179.45 179.79 1d2r h ALA 307 N 0.78 0.56 -0.48 3.86 0.00 -1.11 -3.06 119.26 119.81 1d2r h ALA 307 Ca -0.07 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 1d2r h ALA 307 Cb 1.49 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 1d2r h ALA 307 CO 0.15 0.62 -0.04 -0.97 0.00 0.00 0.00 179.25 179.01 1d2r h ASN 308 N 0.71 0.86 -0.97 0.00 -1.24 -1.19 -0.55 115.58 113.20 1d2r h ASN 308 Ca 0.07 -0.33 0.21 0.00 0.71 0.00 0.00 56.30 56.96 1d2r h ASN 308 Cb 0.91 -0.23 -0.09 0.00 0.73 0.00 0.00 38.32 39.63 1d2r h ASN 308 CO 0.08 0.99 0.62 -0.09 -1.29 0.00 0.00 177.43 177.74 1d2r h ARG 309 N 0.72 0.54 0.00 6.67 1.12 -1.26 -0.74 114.38 121.43 1d2r h ARG 309 Ca 0.13 -0.03 -0.04 0.00 -1.11 0.00 0.00 59.98 58.93 1d2r h ARG 309 Cb 0.57 -0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 30.40 1d2r h ARG 309 CO 0.03 0.36 -0.35 0.28 -3.11 0.00 0.00 179.97 177.18 1d2r h VAL 310 N 0.56 0.48 -0.82 0.20 2.07 -1.40 -3.36 116.25 113.98 1d2r h VAL 310 Ca 0.54 -1.44 0.19 0.00 0.82 0.00 0.00 66.70 66.80 1d2r h VAL 310 Cb 1.11 0.98 -0.12 0.00 -1.52 0.00 0.00 31.29 31.75 1d2r h VAL 310 CO -0.28 0.16 0.29 0.00 0.02 0.00 0.00 177.57 177.77 1d2r h ALA 311 N -0.73 1.19 0.12 1.67 0.00 -0.91 -2.14 119.26 118.47 1d2r h ALA 311 Ca -0.06 0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1d2r h ALA 311 Cb 0.54 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1d2r h ALA 311 CO -0.03 -0.32 -0.20 0.77 0.00 0.00 0.00 179.25 179.46 1d2r h SER 312 N 0.36 -0.57 -0.97 0.00 0.02 -1.33 0.25 113.55 111.31 1d2r h SER 312 Ca 0.48 0.06 0.11 0.00 -0.84 0.00 0.00 61.79 61.60 1d2r h SER 312 Cb 0.86 0.21 -0.08 0.00 0.14 0.00 0.00 62.40 63.53 1d2r h SER 312 CO -0.51 -0.29 0.61 -0.08 -1.14 0.00 0.00 176.83 175.42 1d2r h GLU 313 N -0.40 0.97 -0.41 3.45 4.57 -1.56 0.35 114.58 121.56 1d2r h GLU 313 Ca 0.02 -0.06 -0.12 0.00 -1.18 0.00 0.00 59.36 58.02 1d2r h GLU 313 Cb 0.41 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1d2r h GLU 313 CO -0.10 0.64 -0.22 1.98 -1.18 0.00 0.00 179.01 180.13 1d2r h MET 314 N 1.00 0.83 -0.09 1.92 4.05 -0.75 -2.41 114.93 119.48 1d2r h MET 314 Ca 0.47 -0.34 -0.13 0.00 -0.28 0.00 0.00 59.70 59.42 1d2r h MET 314 Cb 0.40 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.16 1d2r h MET 314 CO -0.24 0.97 -0.51 0.28 0.23 0.00 0.00 176.91 177.63 1d2r h VAL 315 N 0.72 1.35 -0.60 -5.77 2.07 -0.08 -2.09 116.25 111.85 1d2r h VAL 315 Ca 0.10 -1.76 -0.05 0.00 0.82 0.00 0.00 66.70 65.80 1d2r h VAL 315 Cb 0.75 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.35 1d2r h VAL 315 CO 0.06 0.52 0.18 -0.09 0.02 0.00 0.00 177.57 178.26 1d2r h ARG 316 N 0.18 0.95 -0.07 1.57 9.65 -0.72 0.06 114.38 126.00 1d2r h ARG 316 Ca 0.01 -0.21 -0.11 0.00 -1.10 0.00 0.00 59.98 58.57 1d2r h ARG 316 Cb 0.97 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.40 1d2r h ARG 316 CO 0.08 0.85 -0.45 0.87 2.80 0.00 0.00 179.97 184.12 1d2r h LYS 317 N 0.87 0.17 0.23 0.20 1.57 -1.24 -1.63 116.57 116.73 1d2r h LYS 317 Ca 0.19 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1d2r h LYS 317 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1d2r h LYS 317 CO -0.00 0.59 -0.11 0.52 -0.57 0.00 0.00 179.45 179.88 1d2r h MET 318 N 0.14 -0.29 -0.89 3.15 2.86 -0.66 -2.11 114.93 117.12 1d2r h MET 318 Ca 0.01 0.02 0.10 0.00 -2.06 0.00 0.00 59.70 57.77 1d2r h MET 318 Cb 0.85 0.07 -0.07 0.00 0.06 0.00 0.00 31.60 32.52 1d2r h MET 318 CO 0.07 -0.05 0.58 0.93 1.06 0.00 0.00 176.91 179.49 1d2r h GLU 319 N -0.50 0.85 0.34 1.72 5.08 -0.90 -0.66 114.58 120.51 1d2r h GLU 319 Ca -0.03 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1d2r h GLU 319 Cb 0.38 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1d2r h GLU 319 CO 0.05 0.56 -0.44 0.37 -1.00 0.00 0.00 179.01 178.56 1d2r h GLN 320 N 0.87 -0.79 0.43 2.33 5.75 -0.97 0.29 115.11 123.02 1d2r h GLN 320 Ca 0.42 0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.95 1d2r h GLN 320 Cb 0.43 0.18 -0.00 0.00 1.07 0.00 0.00 27.48 29.15 1d2r h GLN 320 CO -0.18 -0.53 -0.25 0.00 -2.65 0.00 0.00 178.83 175.22 1d2r h ALA 321 N -0.48 -0.65 -0.92 3.38 0.00 -0.75 -2.74 119.26 117.11 1d2r h ALA 321 Ca -0.02 -0.13 0.15 0.00 0.00 0.00 0.00 54.91 54.91 1d2r h ALA 321 Cb 0.75 0.31 -0.08 0.00 0.00 0.00 0.00 17.79 18.78 1d2r h ALA 321 CO -0.12 -0.87 0.59 0.52 0.00 0.00 0.00 179.25 179.36 1d2r h MET 322 N -0.65 0.69 0.00 0.00 2.86 -1.07 -3.46 114.93 113.30 1d2r h MET 322 Ca -0.05 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1d2r h MET 322 Cb 0.53 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.03 1d2r h MET 322 CO 0.06 0.46 0.00 0.41 1.06 0.00 0.00 176.91 178.89 1d2r n GLY 323 N -1.42 1.32 3.90 8.32 0.00 0.89 -5.08 105.19 113.11 1d2r n GLY 323 Ca 0.18 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1d2r n GLY 323 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d2r s LEU 324 N 0.00 3.39 0.00 0.99 1.43 -0.50 -4.93 118.68 119.05 1d2r s LEU 324 Ca 0.00 1.01 0.00 0.00 -1.03 0.00 0.00 54.13 54.11 1d2r s LEU 324 Cb 0.00 -3.95 0.00 0.00 0.03 0.00 0.00 46.19 42.27 1d2r s LEU 324 CO 0.00 -0.82 0.00 0.61 0.23 0.00 0.00 176.35 176.37 1d2r n GLY 325 N -2.51 2.06 0.00 -3.19 0.00 -1.26 -4.67 105.19 95.62 1d2r n GLY 325 Ca 0.03 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1d2r n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86