#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ipj n ASN 10 N 0.00 0.22 0.21 6.41 2.85 -1.26 -4.75 115.26 118.94 1ipj n ASN 10 Ca 0.00 0.15 0.18 0.00 -0.11 0.00 0.00 54.58 54.80 1ipj n ASN 10 Cb 0.00 -0.58 0.81 0.00 1.24 0.00 0.00 39.78 41.24 1ipj n ASN 10 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1ipj h PRO 11 N 7.42 0.00 0.00 1.20 0.13 -2.00 0.22 132.00 138.97 1ipj h PRO 11 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1ipj h PRO 11 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1ipj h PRO 11 CO 0.86 0.00 -0.74 1.19 -0.23 0.00 0.00 178.00 179.09 1ipj n PHE 12 N -3.41 0.38 -2.92 1.56 3.72 -1.26 -4.66 117.46 110.86 1ipj n PHE 12 Ca 0.03 0.11 -0.42 0.00 -0.05 0.00 0.00 57.45 57.12 1ipj n PHE 12 Cb 0.46 -0.52 -0.05 0.00 -0.94 0.00 0.00 39.48 38.43 1ipj n PHE 12 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 1ipj s TYR 13 N -3.15 3.31 -0.38 1.38 6.04 0.78 -2.88 117.35 122.45 1ipj s TYR 13 Ca 0.06 1.10 0.01 0.00 0.04 0.00 0.00 57.07 58.28 1ipj s TYR 13 Cb 0.14 -3.02 0.11 0.00 -1.04 0.00 0.00 41.96 38.15 1ipj s TYR 13 CO 0.74 -0.38 0.13 -0.51 -1.54 0.00 0.00 175.55 173.99 1ipj s LEU 14 N 2.74 4.93 0.02 6.97 1.43 0.18 -4.90 118.68 130.05 1ipj s LEU 14 Ca 0.34 -2.18 -0.30 0.00 -1.03 0.00 0.00 54.13 50.96 1ipj s LEU 14 Cb -0.15 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1ipj s LEU 14 CO 0.08 -0.43 0.97 -0.60 0.23 0.00 0.00 176.35 176.60 1ipj s ARG 15 N 0.89 4.58 0.54 1.70 3.52 -1.26 -1.05 118.95 127.88 1ipj s ARG 15 Ca 0.11 1.41 0.31 0.00 -0.13 0.00 0.00 55.73 57.43 1ipj s ARG 15 Cb -0.21 -3.45 1.53 0.00 -1.56 0.00 0.00 34.95 31.27 1ipj s ARG 15 CO -0.06 -0.01 2.07 1.03 -0.81 0.00 0.00 175.30 177.52 1ipj h SER 16 N 6.61 0.00 0.09 -2.12 0.87 -1.91 -2.06 113.55 115.03 1ipj h SER 16 Ca -0.41 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.15 1ipj h SER 16 Cb 1.22 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1ipj h SER 16 CO 0.75 0.08 -0.01 -1.28 -0.53 0.00 0.00 176.83 175.84 1ipj h SER 17 N 0.00 0.00 -0.12 6.23 0.87 -1.92 -3.29 113.55 115.32 1ipj h SER 17 Ca -0.00 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.36 1ipj h SER 17 Cb 0.37 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 62.13 1ipj h SER 17 CO 0.01 0.01 -0.48 -0.46 -0.53 0.00 0.00 176.83 175.38 1ipj n ASN 18 N -3.35 -0.85 0.00 6.23 6.94 -1.02 -4.91 115.26 118.30 1ipj n ASN 18 Ca -0.03 -2.24 0.00 0.00 -0.02 0.00 0.00 54.58 52.30 1ipj n ASN 18 Cb 0.10 0.47 0.00 0.00 -2.36 0.00 0.00 39.78 37.99 1ipj n ASN 18 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1ipj n SER 19 N -1.19 1.55 -4.89 0.53 7.64 -0.81 -4.92 113.62 111.54 1ipj n SER 19 Ca -0.10 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.49 1ipj n SER 19 Cb 0.86 0.12 0.01 0.00 -1.01 0.00 0.00 64.21 64.18 1ipj n SER 19 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ipj s PHE 20 N -1.33 3.56 -0.20 1.43 0.40 -1.25 -1.99 117.98 118.61 1ipj s PHE 20 Ca 0.00 0.96 -0.11 0.00 -0.60 0.00 0.00 56.93 57.19 1ipj s PHE 20 Cb 0.00 -2.49 0.06 0.00 0.51 0.00 0.00 43.02 41.11 1ipj s PHE 20 CO 0.00 -0.47 0.48 -1.14 0.70 0.00 0.00 175.22 174.79 1ipj s GLN 21 N -4.92 0.47 0.10 0.44 0.74 -0.98 -4.94 119.66 110.58 1ipj s GLN 21 Ca 0.51 0.90 -0.30 0.00 0.05 0.00 0.00 55.36 56.52 1ipj s GLN 21 Cb -0.11 0.03 -0.06 0.00 1.10 0.00 0.00 33.01 33.97 1ipj s GLN 21 CO 0.48 -0.16 1.09 0.95 -0.55 0.00 0.00 175.29 177.10 1ipj s THR 22 N 1.50 4.18 -0.96 -0.34 -4.23 -1.26 -0.35 115.64 114.18 1ipj s THR 22 Ca -0.09 1.71 0.25 0.00 -1.18 0.00 0.00 61.69 62.38 1ipj s THR 22 Cb -0.08 -4.10 -0.00 0.00 1.34 0.00 0.00 72.50 69.66 1ipj s THR 22 CO -0.15 0.21 1.38 0.18 -0.54 0.00 0.00 174.62 175.71 1ipj n LEU 23 N 3.15 0.53 -3.60 4.79 4.77 -0.25 -4.94 117.00 121.46 1ipj n LEU 23 Ca 0.05 -0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.04 1ipj n LEU 23 Cb 0.47 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 1ipj n LEU 23 CO 0.54 0.11 1.13 0.12 -1.33 0.00 0.00 177.39 177.96 1ipj s PHE 24 N -3.02 -0.03 -0.29 -1.77 5.36 -1.24 -5.06 117.98 111.93 1ipj s PHE 24 Ca 0.10 -0.02 -0.24 0.00 -0.96 0.00 0.00 56.93 55.82 1ipj s PHE 24 Cb 0.17 0.52 0.15 0.00 -0.34 0.00 0.00 43.02 43.52 1ipj s PHE 24 CO 0.71 -0.14 1.19 -2.00 -1.46 0.00 0.00 175.22 173.53 1ipj s GLU 25 N -2.23 0.31 0.20 10.12 2.12 -1.26 -3.28 118.70 124.68 1ipj s GLU 25 Ca 0.14 0.38 -0.17 0.00 0.36 0.00 0.00 54.97 55.68 1ipj s GLU 25 Cb 0.05 0.14 0.03 0.00 0.26 0.00 0.00 34.13 34.61 1ipj s GLU 25 CO -0.05 -0.04 0.52 0.54 -0.54 0.00 0.00 175.26 175.70 1ipj s ASN 26 N 0.25 -0.25 0.00 -1.70 4.22 -0.73 -5.00 114.94 111.72 1ipj s ASN 26 Ca 0.04 -0.50 0.00 0.00 -2.14 0.00 0.00 52.86 50.26 1ipj s ASN 26 Cb -0.05 0.58 0.00 0.00 1.28 0.00 0.00 41.25 43.06 1ipj s ASN 26 CO -0.10 -1.06 0.09 0.00 -2.04 0.00 0.00 177.10 173.98 1ipj n GLN 27 N -0.34 0.17 0.00 3.55 10.64 -1.26 -1.23 117.38 128.91 1ipj n GLN 27 Ca -0.10 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.07 1ipj n GLN 27 Cb 0.62 -1.08 0.00 0.00 -0.86 0.00 0.00 30.24 28.92 1ipj n GLN 27 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 1ipj n ASN 28 N 0.35 0.16 0.00 2.61 2.85 -1.26 -5.01 115.26 114.96 1ipj n ASN 28 Ca 0.00 -0.51 0.00 0.00 -0.11 0.00 0.00 54.58 53.96 1ipj n ASN 28 Cb 0.04 0.27 0.00 0.00 1.24 0.00 0.00 39.78 41.33 1ipj n ASN 28 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ipj n GLY 29 N 0.27 -0.32 3.47 8.20 0.00 -0.36 -2.67 105.19 113.78 1ipj n GLY 29 Ca 0.00 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.78 1ipj n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ipj s ARG 30 N -2.00 0.65 -0.12 1.61 3.00 0.15 -1.77 118.95 120.47 1ipj s ARG 30 Ca 0.00 0.82 -0.00 0.00 -1.00 0.00 0.00 55.73 55.55 1ipj s ARG 30 Cb 0.00 0.29 0.03 0.00 0.00 0.00 0.00 34.95 35.27 1ipj s ARG 30 CO 0.00 -0.09 -0.08 0.42 0.00 0.00 0.00 175.30 175.55 1ipj s ILE 31 N 0.46 1.11 0.03 4.11 1.01 -1.21 -1.02 121.20 125.70 1ipj s ILE 31 Ca -0.01 -0.35 0.08 0.00 0.00 0.00 0.00 60.65 60.37 1ipj s ILE 31 Cb -0.04 -1.12 -0.03 0.00 0.01 0.00 0.00 42.46 41.28 1ipj s ILE 31 CO -0.02 0.37 -0.24 -0.13 0.00 0.00 0.00 174.94 174.93 1ipj s ARG 32 N 1.67 1.67 -0.12 2.79 0.52 0.15 -1.10 118.95 124.54 1ipj s ARG 32 Ca 0.05 -1.00 0.03 0.00 -0.52 0.00 0.00 55.73 54.29 1ipj s ARG 32 Cb -0.13 -1.78 0.00 0.00 0.52 0.00 0.00 34.95 33.57 1ipj s ARG 32 CO -0.09 0.46 -0.22 -1.17 0.02 0.00 0.00 175.30 174.30 1ipj s LEU 33 N -1.08 2.14 1.36 2.53 2.96 0.52 0.69 118.68 127.81 1ipj s LEU 33 Ca 0.10 -0.56 -0.22 0.00 -0.22 0.00 0.00 54.13 53.23 1ipj s LEU 33 Cb -0.09 -1.44 0.34 0.00 0.50 0.00 0.00 46.19 45.50 1ipj s LEU 33 CO 0.01 0.13 0.98 -0.22 -1.32 0.00 0.00 176.35 175.93 1ipj s LEU 34 N 0.52 -0.59 0.62 -0.68 2.96 -0.44 -2.31 118.68 118.76 1ipj s LEU 34 Ca -0.14 0.82 -0.09 0.00 -0.22 0.00 0.00 54.13 54.50 1ipj s LEU 34 Cb -0.17 -2.34 -0.01 0.00 0.50 0.00 0.00 46.19 44.17 1ipj s LEU 34 CO 0.05 -5.03 0.98 -1.58 -1.32 0.00 0.00 176.35 169.45 1ipj s GLN 35 N -5.13 3.15 -0.07 1.98 0.74 -0.84 -4.85 119.66 114.63 1ipj s GLN 35 Ca 0.69 0.36 -0.30 0.00 0.05 0.00 0.00 55.36 56.16 1ipj s GLN 35 Cb -0.13 -2.16 -0.03 0.00 1.10 0.00 0.00 33.01 31.79 1ipj s GLN 35 CO 0.58 -0.71 1.23 1.03 -0.55 0.00 0.00 175.29 176.87 1ipj s ARG 36 N -5.12 4.32 0.22 1.67 3.00 -1.26 -4.87 118.95 116.91 1ipj s ARG 36 Ca 0.55 1.70 -0.09 0.00 0.00 0.00 0.00 55.73 57.88 1ipj s ARG 36 Cb -0.11 -3.60 0.34 0.00 0.00 0.00 0.00 34.95 31.58 1ipj s ARG 36 CO 0.49 -0.51 1.69 0.74 0.00 0.00 0.00 175.30 177.70 1ipj h PHE 37 N 7.66 0.14 0.00 -0.53 0.05 -1.85 0.17 116.94 122.58 1ipj h PHE 37 Ca -0.33 0.04 -0.05 0.00 3.82 0.00 0.00 57.97 61.45 1ipj h PHE 37 Cb 1.15 0.04 -0.01 0.00 2.00 0.00 0.00 35.95 39.13 1ipj h PHE 37 CO 0.75 -0.09 -0.26 -2.95 -0.18 0.00 0.00 178.31 175.58 1ipj h ASN 38 N 0.21 0.00 0.11 2.17 -0.00 -1.78 -2.83 115.58 113.46 1ipj h ASN 38 Ca 0.34 0.00 -0.02 0.00 -0.00 0.00 0.00 56.30 56.62 1ipj h ASN 38 Cb 0.55 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.87 1ipj h ASN 38 CO -0.47 0.26 -0.10 0.11 -0.00 0.00 0.00 177.43 177.23 1ipj h LYS 39 N 0.00 0.00 0.00 4.14 1.79 -1.32 -3.16 116.57 118.02 1ipj h LYS 39 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1ipj h LYS 39 Cb 0.88 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.53 1ipj h LYS 39 CO 0.03 0.10 0.00 -2.13 -1.08 0.00 0.00 179.45 176.37 1ipj n ARG 40 N -4.33 0.00 -4.46 3.15 3.00 -1.07 -4.90 116.66 108.05 1ipj n ARG 40 Ca -0.03 0.29 -0.26 0.00 -0.00 0.00 0.00 57.85 57.86 1ipj n ARG 40 Cb 0.17 -0.92 -0.17 0.00 0.00 0.00 0.00 32.46 31.54 1ipj n ARG 40 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1ipj s SER 41 N -2.13 2.01 0.63 6.15 0.15 -1.20 -4.99 113.70 114.32 1ipj s SER 41 Ca 0.00 -0.33 0.27 0.00 0.70 0.00 0.00 55.95 56.59 1ipj s SER 41 Cb 0.00 -0.90 1.41 0.00 -1.71 0.00 0.00 66.02 64.82 1ipj s SER 41 CO 0.00 0.01 1.81 -0.65 1.20 0.00 0.00 173.24 175.61 1ipj h PRO 42 N 7.26 0.00 -0.56 5.44 0.11 -1.88 0.12 132.00 142.49 1ipj h PRO 42 Ca -0.30 0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.97 1ipj h PRO 42 Cb 1.18 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1ipj h PRO 42 CO 0.47 0.00 0.70 1.96 -0.21 0.00 0.00 178.00 180.92 1ipj h GLN 43 N 0.00 0.00 -1.42 1.05 1.08 -1.93 0.71 115.11 114.59 1ipj h GLN 43 Ca 0.12 0.00 -0.67 0.00 -1.45 0.00 0.00 58.65 56.65 1ipj h GLN 43 Cb 1.11 0.00 -0.34 0.00 -0.05 0.00 0.00 27.48 28.21 1ipj h GLN 43 CO -0.00 0.00 0.29 1.28 -0.95 0.00 0.00 178.83 179.45 1ipj n LEU 44 N -3.44 6.50 0.26 1.46 4.77 0.42 -4.83 117.00 122.14 1ipj n LEU 44 Ca 0.11 -4.77 -0.14 0.00 -0.03 0.00 0.00 56.01 51.19 1ipj n LEU 44 Cb 0.90 -0.79 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 1ipj n LEU 44 CO 0.24 1.85 0.52 -0.33 -1.33 0.00 0.00 177.39 178.34 1ipj h GLU 45 N 2.51 -0.77 0.00 3.23 5.08 -1.06 -2.96 114.58 120.62 1ipj h GLU 45 Ca 0.49 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 1ipj h GLU 45 Cb 0.68 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1ipj h GLU 45 CO 1.23 -0.51 0.03 0.09 -1.00 0.00 0.00 179.01 178.85 1ipj n ASN 46 N -4.60 0.00 -0.50 1.42 4.13 -1.26 0.24 115.26 114.69 1ipj n ASN 46 Ca -0.10 0.03 0.08 0.00 1.68 0.00 0.00 54.58 56.27 1ipj n ASN 46 Cb 0.35 -0.03 0.03 0.00 -1.54 0.00 0.00 39.78 38.59 1ipj n ASN 46 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1ipj n LEU 47 N -0.80 1.96 -0.33 3.41 4.77 -1.12 -4.64 117.00 120.25 1ipj n LEU 47 Ca 0.00 -0.87 0.29 0.00 -0.03 0.00 0.00 56.01 55.40 1ipj n LEU 47 Cb 0.03 0.00 0.63 0.00 -2.33 0.00 0.00 43.42 41.75 1ipj n LEU 47 CO 0.00 0.36 1.27 0.08 -1.33 0.00 0.00 177.39 177.77 1ipj h ARG 48 N 2.45 0.18 0.00 3.23 0.11 -0.34 -0.80 114.38 119.21 1ipj h ARG 48 Ca 0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 1ipj h ARG 48 Cb 0.61 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.65 1ipj h ARG 48 CO 0.00 0.12 0.00 -0.25 0.10 0.00 0.00 179.97 179.94 1ipj n ASP 49 N -4.42 0.50 -4.97 0.08 10.43 -1.26 -3.23 116.55 113.67 1ipj n ASP 49 Ca 0.26 0.58 -0.18 0.00 2.57 0.00 0.00 54.79 58.02 1ipj n ASP 49 Cb 1.08 -0.70 -0.00 0.00 1.84 0.00 0.00 41.12 43.34 1ipj n ASP 49 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1ipj s TYR 50 N -3.13 2.82 0.23 1.24 2.02 -0.31 -3.86 117.35 116.36 1ipj s TYR 50 Ca 0.09 -0.40 -0.20 0.00 -0.37 0.00 0.00 57.07 56.18 1ipj s TYR 50 Cb 0.12 -2.28 0.03 0.00 -0.40 0.00 0.00 41.96 39.44 1ipj s TYR 50 CO 0.47 -0.29 0.63 1.03 -1.57 0.00 0.00 175.55 175.82 1ipj s ARG 51 N -4.27 1.55 -0.09 -0.62 1.81 -0.87 -4.74 118.95 111.72 1ipj s ARG 51 Ca 0.52 -0.84 0.01 0.00 -1.72 0.00 0.00 55.73 53.70 1ipj s ARG 51 Cb -0.08 0.58 0.02 0.00 -0.45 0.00 0.00 34.95 35.01 1ipj s ARG 51 CO 0.31 -0.69 -0.11 0.42 -0.68 0.00 0.00 175.30 174.55 1ipj s ILE 52 N -3.87 1.19 -0.08 1.52 -1.09 -1.26 -1.59 121.20 116.02 1ipj s ILE 52 Ca 0.09 -0.45 0.03 0.00 -2.23 0.00 0.00 60.65 58.09 1ipj s ILE 52 Cb -0.03 -1.12 -0.02 0.00 -1.58 0.00 0.00 42.46 39.70 1ipj s ILE 52 CO -0.00 0.38 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.24 1ipj s VAL 53 N 1.14 2.87 -0.20 2.92 1.01 0.36 -1.32 120.40 127.16 1ipj s VAL 53 Ca -0.05 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 1ipj s VAL 53 Cb -0.14 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.11 1ipj s VAL 53 CO -0.02 0.57 -0.13 -1.58 0.00 0.00 0.00 175.10 173.93 1ipj s GLN 54 N -0.28 3.06 -0.10 2.72 0.74 0.22 -0.92 119.66 125.09 1ipj s GLN 54 Ca 0.01 -0.81 -0.00 0.00 0.05 0.00 0.00 55.36 54.61 1ipj s GLN 54 Cb -0.13 -2.78 -0.03 0.00 1.10 0.00 0.00 33.01 31.18 1ipj s GLN 54 CO 0.03 -0.25 -0.08 0.12 -0.55 0.00 0.00 175.29 174.56 1ipj s PHE 55 N 1.35 2.91 -0.17 1.67 5.36 0.01 -0.68 117.98 128.43 1ipj s PHE 55 Ca 0.04 -0.23 -0.05 0.00 -0.96 0.00 0.00 56.93 55.73 1ipj s PHE 55 Cb -0.14 -1.80 0.08 0.00 -0.34 0.00 0.00 43.02 40.82 1ipj s PHE 55 CO -0.09 0.09 0.30 -1.14 -1.46 0.00 0.00 175.22 172.93 1ipj s GLN 56 N -0.22 0.21 0.05 10.12 0.74 -0.19 -1.20 119.66 129.17 1ipj s GLN 56 Ca 0.02 0.72 0.05 0.00 0.05 0.00 0.00 55.36 56.21 1ipj s GLN 56 Cb -0.13 -0.15 -0.02 0.00 1.10 0.00 0.00 33.01 33.80 1ipj s GLN 56 CO 0.03 -0.37 -0.15 -1.54 -0.55 0.00 0.00 175.29 172.71 1ipj s SER 57 N 2.47 1.83 1.04 6.67 1.04 -0.84 0.33 113.70 126.23 1ipj s SER 57 Ca 0.03 -0.51 -0.02 0.00 0.48 0.00 0.00 55.95 55.92 1ipj s SER 57 Cb -0.13 -0.11 0.03 0.00 0.10 0.00 0.00 66.02 65.91 1ipj s SER 57 CO -0.11 0.03 0.08 0.29 0.98 0.00 0.00 173.24 174.52 1ipj n LYS 58 N 1.72 -1.97 -3.25 4.02 4.76 -1.09 -2.28 118.16 120.06 1ipj n LYS 58 Ca -0.19 -0.14 -0.39 0.00 -2.87 0.00 0.00 58.31 54.73 1ipj n LYS 58 Cb 0.54 -0.17 -0.06 0.00 -1.84 0.00 0.00 35.03 33.51 1ipj n LYS 58 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1ipj s PRO 59 N -3.20 4.27 -0.44 1.97 0.04 -1.26 -4.45 135.00 131.93 1ipj s PRO 59 Ca 0.06 0.69 -0.00 0.00 0.04 0.00 0.00 61.00 61.79 1ipj s PRO 59 Cb -0.01 -3.32 -0.00 0.00 0.04 0.00 0.00 34.50 31.21 1ipj s PRO 59 CO 0.05 0.44 0.42 0.09 0.04 0.00 0.00 177.00 178.03 1ipj n ASN 60 N 2.50 -5.36 -3.84 6.66 3.02 0.54 -4.95 115.26 113.82 1ipj n ASN 60 Ca -0.08 -0.06 -0.12 0.00 -0.03 0.00 0.00 54.58 54.29 1ipj n ASN 60 Cb 0.51 -3.51 -0.06 0.00 -0.61 0.00 0.00 39.78 36.11 1ipj n ASN 60 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ipj s THR 61 N -3.01 0.00 -0.02 3.41 -4.23 -1.23 -2.90 115.64 107.66 1ipj s THR 61 Ca 0.01 -1.64 -0.15 0.00 -1.18 0.00 0.00 61.69 58.73 1ipj s THR 61 Cb -0.00 -2.41 0.03 0.00 1.34 0.00 0.00 72.50 71.46 1ipj s THR 61 CO 0.44 0.00 0.32 -0.51 -0.54 0.00 0.00 174.62 174.33 1ipj s ILE 62 N -3.79 0.05 -0.49 2.99 2.07 -0.54 -1.24 121.20 120.25 1ipj s ILE 62 Ca 0.30 -0.42 -0.15 0.00 -1.41 0.00 0.00 60.65 58.96 1ipj s ILE 62 Cb 0.02 -0.62 0.09 0.00 0.13 0.00 0.00 42.46 42.08 1ipj s ILE 62 CO 0.13 -0.23 0.42 -0.22 -1.91 0.00 0.00 174.94 173.13 1ipj s LEU 63 N -1.20 5.75 0.22 8.50 0.20 -0.34 -2.01 118.68 129.80 1ipj s LEU 63 Ca -0.12 -1.43 -0.30 0.00 0.69 0.00 0.00 54.13 52.96 1ipj s LEU 63 Cb -0.05 -2.19 -0.15 0.00 -0.43 0.00 0.00 46.19 43.37 1ipj s LEU 63 CO 0.04 -0.69 0.93 0.18 -0.29 0.00 0.00 176.35 176.51 1ipj n LEU 64 N 5.21 0.85 -4.23 -0.68 4.32 -0.63 -3.47 117.00 118.38 1ipj n LEU 64 Ca -0.13 1.16 -0.60 0.00 -0.02 0.00 0.00 56.01 56.41 1ipj n LEU 64 Cb 0.43 -1.17 -0.09 0.00 -1.62 0.00 0.00 43.42 40.97 1ipj n LEU 64 CO 0.49 -1.81 1.12 -2.65 -1.22 0.00 0.00 177.39 173.32 1ipj n PRO 65 N 1.10 0.00 -3.75 3.23 -0.02 -1.26 -4.83 135.00 129.48 1ipj n PRO 65 Ca 0.14 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.48 1ipj n PRO 65 Cb 0.27 -1.36 -0.03 0.00 -0.02 0.00 0.00 33.50 32.37 1ipj n PRO 65 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 1ipj n HIS 66 N 4.11 -1.37 -3.53 6.00 1.44 -1.16 -0.07 115.22 120.64 1ipj n HIS 66 Ca 0.31 -2.12 -0.16 0.00 -2.01 0.00 0.00 57.72 53.74 1ipj n HIS 66 Cb -0.05 0.50 -0.06 0.00 0.12 0.00 0.00 29.99 30.51 1ipj n HIS 66 CO 0.00 0.00 0.00 -3.38 -2.81 0.00 0.00 176.34 170.15 1ipj s HIS 67 N -3.11 -0.58 0.07 -1.40 -3.43 -0.72 -2.23 115.29 103.88 1ipj s HIS 67 Ca 0.26 0.99 0.04 0.00 -0.80 0.00 0.00 55.06 55.55 1ipj s HIS 67 Cb -0.01 0.42 -0.03 0.00 -1.43 0.00 0.00 32.58 31.53 1ipj s HIS 67 CO 0.19 -0.55 -0.11 0.00 -2.00 0.00 0.00 174.74 172.27 1ipj s ALA 68 N -1.21 1.01 -0.88 -1.38 0.00 -1.26 -0.06 121.76 117.98 1ipj s ALA 68 Ca -0.08 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 50.78 1ipj s ALA 68 Cb -0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 23.12 22.97 1ipj s ALA 68 CO 0.08 0.05 2.86 -0.40 0.00 0.00 0.00 175.76 178.35 1ipj n ASP 69 N 1.04 6.39 -3.67 0.00 5.75 -1.23 -1.87 116.55 122.96 1ipj n ASP 69 Ca -0.20 -2.43 -0.15 0.00 -0.01 0.00 0.00 54.79 52.01 1ipj n ASP 69 Cb 0.56 -1.33 -0.07 0.00 -1.03 0.00 0.00 41.12 39.24 1ipj n ASP 69 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ipj s ALA 70 N 2.11 -1.12 -0.25 2.12 0.00 -1.26 -2.34 121.76 121.02 1ipj s ALA 70 Ca 0.59 0.63 -0.18 0.00 0.00 0.00 0.00 51.96 53.00 1ipj s ALA 70 Cb 0.20 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.38 1ipj s ALA 70 CO -0.03 -0.32 0.52 -0.51 0.00 0.00 0.00 175.76 175.41 1ipj s ASP 71 N -1.38 6.46 0.17 0.00 1.01 -1.11 -3.88 116.67 117.93 1ipj s ASP 71 Ca -0.12 0.55 0.05 0.00 0.71 0.00 0.00 52.55 53.75 1ipj s ASP 71 Cb -0.03 -2.28 -0.04 0.00 1.01 0.00 0.00 42.92 41.58 1ipj s ASP 71 CO 0.05 -0.27 0.13 -0.36 0.21 0.00 0.00 175.17 174.93 1ipj s PHE 72 N 2.20 3.12 -0.41 4.23 2.99 -1.15 -0.12 117.98 128.84 1ipj s PHE 72 Ca 0.22 -0.03 0.04 0.00 0.00 0.00 0.00 56.93 57.15 1ipj s PHE 72 Cb -0.16 -1.49 0.17 0.00 0.00 0.00 0.00 43.02 41.54 1ipj s PHE 72 CO 0.09 0.52 0.36 -1.17 -0.00 0.00 0.00 175.22 175.02 1ipj s LEU 73 N -3.13 1.11 0.22 -0.37 2.96 -1.11 -2.35 118.68 116.01 1ipj s LEU 73 Ca 0.31 -2.88 -0.25 0.00 -0.22 0.00 0.00 54.13 51.08 1ipj s LEU 73 Cb -0.10 -0.22 -0.09 0.00 0.50 0.00 0.00 46.19 46.28 1ipj s LEU 73 CO 0.23 -0.17 0.82 -1.48 -1.32 0.00 0.00 176.35 174.43 1ipj s LEU 74 N 0.21 4.50 -0.08 -0.68 0.05 -0.88 -3.32 118.68 118.49 1ipj s LEU 74 Ca 0.32 1.69 0.03 0.00 0.05 0.00 0.00 54.13 56.21 1ipj s LEU 74 Cb 0.02 -3.54 0.01 0.00 -2.05 0.00 0.00 46.19 40.62 1ipj s LEU 74 CO -0.17 0.11 -0.15 0.12 -0.55 0.00 0.00 176.35 175.71 1ipj s PHE 75 N -1.32 1.71 -0.34 3.48 2.19 0.85 -1.91 117.98 122.64 1ipj s PHE 75 Ca 0.41 -0.66 -0.24 0.00 0.33 0.00 0.00 56.93 56.76 1ipj s PHE 75 Cb -0.21 -1.22 0.01 0.00 -1.31 0.00 0.00 43.02 40.28 1ipj s PHE 75 CO 0.26 -0.32 0.83 0.08 1.83 0.00 0.00 175.22 177.90 1ipj s VAL 76 N 0.63 4.71 0.15 3.12 1.01 -0.79 -1.32 120.40 127.91 1ipj s VAL 76 Ca -0.15 1.10 0.04 0.00 0.00 0.00 0.00 61.98 62.97 1ipj s VAL 76 Cb -0.16 -4.23 -0.17 0.00 0.00 0.00 0.00 36.38 31.82 1ipj s VAL 76 CO 0.04 -0.39 1.34 -0.07 0.00 0.00 0.00 175.10 176.02 1ipj h LEU 77 N 9.73 0.18 -7.00 3.92 3.38 -1.39 -1.51 115.31 122.62 1ipj h LEU 77 Ca -0.24 -0.16 0.12 0.00 0.09 0.00 0.00 57.88 57.69 1ipj h LEU 77 Cb 1.09 -0.06 -0.27 0.00 0.09 0.00 0.00 40.66 41.51 1ipj h LEU 77 CO 0.92 1.02 0.65 -0.94 0.09 0.00 0.00 178.44 180.18 1ipj s SER 78 N -6.89 -0.28 0.00 -0.43 1.04 -1.18 -4.78 113.70 101.19 1ipj s SER 78 Ca -0.02 0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.84 1ipj s SER 78 Cb 0.10 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.62 1ipj s SER 78 CO 0.83 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 175.49 1ipj n GLY 79 N 1.34 0.20 3.53 7.32 0.00 -1.26 -2.32 105.19 114.00 1ipj n GLY 79 Ca -0.09 -1.97 -0.31 0.00 0.00 0.00 0.00 46.02 43.65 1ipj n GLY 79 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ipj s ARG 80 N -1.25 2.29 0.05 1.61 3.52 -1.26 -2.95 118.95 120.96 1ipj s ARG 80 Ca 0.00 -0.87 -0.01 0.00 -0.13 0.00 0.00 55.73 54.72 1ipj s ARG 80 Cb 0.00 -2.34 -0.04 0.00 -1.56 0.00 0.00 34.95 31.01 1ipj s ARG 80 CO 0.00 0.57 -0.03 0.00 -0.81 0.00 0.00 175.30 175.02 1ipj s ALA 81 N -0.98 0.54 -0.23 6.12 0.00 -0.78 -4.46 121.76 121.97 1ipj s ALA 81 Ca 0.16 -1.20 0.01 0.00 0.00 0.00 0.00 51.96 50.93 1ipj s ALA 81 Cb -0.11 0.26 0.06 0.00 0.00 0.00 0.00 23.12 23.32 1ipj s ALA 81 CO 0.07 -0.35 -0.07 0.42 0.00 0.00 0.00 175.76 175.83 1ipj s ILE 82 N -3.82 1.58 -0.26 0.00 1.01 -0.44 -0.90 121.20 118.37 1ipj s ILE 82 Ca 0.07 -1.19 -0.10 0.00 0.00 0.00 0.00 60.65 59.43 1ipj s ILE 82 Cb 0.07 -1.79 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 1ipj s ILE 82 CO -0.09 -0.03 0.15 -0.22 0.00 0.00 0.00 174.94 174.74 1ipj s LEU 83 N 1.38 3.92 -0.22 2.97 2.96 -0.52 -1.81 118.68 127.36 1ipj s LEU 83 Ca -0.05 -0.01 -0.02 0.00 -0.22 0.00 0.00 54.13 53.83 1ipj s LEU 83 Cb -0.18 -2.07 0.01 0.00 0.50 0.00 0.00 46.19 44.45 1ipj s LEU 83 CO -0.07 0.00 -0.09 -0.89 -1.32 0.00 0.00 176.35 173.99 1ipj s THR 84 N 1.44 2.83 -0.19 3.68 2.01 -0.98 -0.32 115.64 124.12 1ipj s THR 84 Ca 0.07 -0.84 -0.09 0.00 0.31 0.00 0.00 61.69 61.14 1ipj s THR 84 Cb -0.15 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 1ipj s THR 84 CO 0.07 0.35 0.10 -0.76 -0.69 0.00 0.00 174.62 173.68 1ipj s LEU 85 N 1.36 4.03 -0.17 4.42 1.43 0.24 -2.03 118.68 127.96 1ipj s LEU 85 Ca 0.03 0.17 0.01 0.00 -1.03 0.00 0.00 54.13 53.31 1ipj s LEU 85 Cb -0.15 -2.03 0.02 0.00 0.03 0.00 0.00 46.19 44.06 1ipj s LEU 85 CO -0.06 0.19 -0.20 0.68 0.23 0.00 0.00 176.35 177.19 1ipj s VAL 86 N 0.29 1.99 0.00 -1.59 -7.23 -0.09 0.36 120.40 114.12 1ipj s VAL 86 Ca 0.06 -0.90 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1ipj s VAL 86 Cb -0.12 -1.80 0.00 0.00 0.56 0.00 0.00 36.38 35.03 1ipj s VAL 86 CO -0.01 0.53 0.00 0.59 -0.31 0.00 0.00 175.10 175.90 1ipj n ASN 87 N 4.54 0.19 0.21 4.85 5.03 0.44 -3.85 115.26 126.67 1ipj n ASN 87 Ca -0.20 -0.92 0.10 0.00 0.87 0.00 0.00 54.58 54.43 1ipj n ASN 87 Cb 0.50 0.00 0.28 0.00 -1.02 0.00 0.00 39.78 39.54 1ipj n ASN 87 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1ipj h ASN 88 N 0.00 0.00 0.00 6.41 -0.00 -2.01 -3.36 115.58 116.62 1ipj h ASN 88 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 1ipj h ASN 88 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 1ipj h ASN 88 CO 0.00 0.16 0.00 -0.90 -0.00 0.00 0.00 177.43 176.69 1ipj n ASP 89 N -3.18 0.13 -4.03 6.14 5.68 -1.26 -5.10 116.55 114.93 1ipj n ASP 89 Ca 0.02 -0.45 -0.20 0.00 -0.50 0.00 0.00 54.79 53.67 1ipj n ASP 89 Cb 0.52 0.37 -0.09 0.00 -1.14 0.00 0.00 41.12 40.78 1ipj n ASP 89 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1ipj s ASP 90 N -0.37 1.72 -0.24 -1.12 -0.00 -1.26 -5.14 116.67 110.26 1ipj s ASP 90 Ca 0.00 -1.56 -0.04 0.00 -0.00 0.00 0.00 52.55 50.95 1ipj s ASP 90 Cb 0.00 0.37 0.13 0.00 -0.00 0.00 0.00 42.92 43.42 1ipj s ASP 90 CO 0.00 -0.87 0.42 -0.60 -0.00 0.00 0.00 175.17 174.12 1ipj s ARG 91 N -3.81 0.37 -0.10 8.23 3.52 -1.26 -0.42 118.95 125.49 1ipj s ARG 91 Ca 0.34 0.76 0.03 0.00 -0.13 0.00 0.00 55.73 56.73 1ipj s ARG 91 Cb 0.05 -0.09 -0.01 0.00 -1.56 0.00 0.00 34.95 33.34 1ipj s ARG 91 CO 0.17 -0.51 -0.18 -0.51 -0.81 0.00 0.00 175.30 173.46 1ipj s ASP 92 N 2.61 3.63 -0.05 -2.12 1.01 0.16 -4.94 116.67 116.96 1ipj s ASP 92 Ca 0.09 -0.39 0.06 0.00 0.71 0.00 0.00 52.55 53.02 1ipj s ASP 92 Cb -0.14 -1.29 -0.01 0.00 1.01 0.00 0.00 42.92 42.48 1ipj s ASP 92 CO -0.16 0.21 -0.25 -0.44 0.21 0.00 0.00 175.17 174.75 1ipj s SER 93 N 0.07 3.11 -0.03 0.27 0.01 -1.26 0.79 113.70 116.67 1ipj s SER 93 Ca -0.08 -0.49 0.07 0.00 1.31 0.00 0.00 55.95 56.76 1ipj s SER 93 Cb -0.15 -0.72 -0.02 0.00 0.21 0.00 0.00 66.02 65.34 1ipj s SER 93 CO 0.05 0.27 -0.23 -0.31 0.41 0.00 0.00 173.24 173.43 1ipj s TYR 94 N -0.29 2.13 -1.13 2.43 2.02 0.57 -3.12 117.35 119.96 1ipj s TYR 94 Ca 0.00 -0.47 -0.13 0.00 -0.37 0.00 0.00 57.07 56.10 1ipj s TYR 94 Cb -0.13 -1.38 0.19 0.00 -0.40 0.00 0.00 41.96 40.24 1ipj s TYR 94 CO 0.02 -0.08 1.29 1.21 -1.57 0.00 0.00 175.55 176.42 1ipj s ASN 95 N -0.43 7.05 0.30 2.29 3.04 -0.41 -1.44 114.94 125.33 1ipj s ASN 95 Ca 0.06 -2.98 -0.29 0.00 0.04 0.00 0.00 52.86 49.69 1ipj s ASN 95 Cb -0.10 -2.35 -0.10 0.00 -1.54 0.00 0.00 41.25 37.16 1ipj s ASN 95 CO 0.00 -0.68 1.30 -0.76 -3.04 0.00 0.00 177.10 173.92 1ipj s LEU 96 N 1.06 4.44 0.23 3.21 1.43 -0.08 -4.20 118.68 124.76 1ipj s LEU 96 Ca 0.38 2.60 0.10 0.00 -1.03 0.00 0.00 54.13 56.18 1ipj s LEU 96 Cb -0.05 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.49 1ipj s LEU 96 CO -0.03 -0.51 -0.19 -1.00 0.23 0.00 0.00 176.35 174.85 1ipj s HIS 97 N -0.84 2.09 0.02 0.29 3.76 -1.26 -1.87 115.29 117.47 1ipj s HIS 97 Ca 0.51 -0.41 -0.35 0.00 -0.15 0.00 0.00 55.06 54.65 1ipj s HIS 97 Cb -0.39 -0.96 -0.14 0.00 1.11 0.00 0.00 32.58 32.20 1ipj s HIS 97 CO 0.48 0.54 1.64 -2.30 -0.85 0.00 0.00 174.74 174.25 1ipj n PRO 98 N -0.25 1.82 0.00 8.40 -0.02 -1.15 -0.42 135.00 143.37 1ipj n PRO 98 Ca -0.08 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1ipj n PRO 98 Cb 0.59 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1ipj n PRO 98 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ipj n GLY 99 N 3.61 0.41 3.75 -1.23 0.00 -0.57 -5.00 105.19 106.17 1ipj n GLY 99 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1ipj n GLY 99 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ipj s ASP 100 N -2.23 7.23 0.12 1.61 -0.00 0.44 -2.14 116.67 121.70 1ipj s ASP 100 Ca 0.00 1.47 0.09 0.00 -0.00 0.00 0.00 52.55 54.10 1ipj s ASP 100 Cb 0.00 -2.47 -0.04 0.00 -0.00 0.00 0.00 42.92 40.42 1ipj s ASP 100 CO 0.00 0.07 -0.21 0.00 -0.00 0.00 0.00 175.17 175.03 1ipj s ALA 101 N -0.32 1.94 0.17 5.23 0.00 0.34 -1.88 121.76 127.23 1ipj s ALA 101 Ca 0.37 -1.33 -0.24 0.00 0.00 0.00 0.00 51.96 50.76 1ipj s ALA 101 Cb -0.21 -0.25 0.06 0.00 0.00 0.00 0.00 23.12 22.72 1ipj s ALA 101 CO 0.23 0.36 0.74 -1.14 0.00 0.00 0.00 175.76 175.95 1ipj s GLN 102 N -2.12 1.35 -0.15 0.00 0.74 -0.80 0.01 119.66 118.68 1ipj s GLN 102 Ca 0.10 -0.63 0.00 0.00 0.05 0.00 0.00 55.36 54.88 1ipj s GLN 102 Cb -0.09 0.53 -0.00 0.00 1.10 0.00 0.00 33.01 34.55 1ipj s GLN 102 CO 0.05 -0.60 -0.16 0.50 -0.55 0.00 0.00 175.29 174.53 1ipj s ARG 103 N -3.63 3.20 -0.74 1.67 3.52 -1.26 -2.07 118.95 119.63 1ipj s ARG 103 Ca 0.06 -0.76 -0.11 0.00 -0.13 0.00 0.00 55.73 54.80 1ipj s ARG 103 Cb -0.03 -2.61 0.19 0.00 -1.56 0.00 0.00 34.95 30.95 1ipj s ARG 103 CO -0.04 0.01 0.64 0.42 -0.81 0.00 0.00 175.30 175.52 1ipj s ILE 104 N 0.83 4.98 0.49 4.11 1.01 -0.99 -5.01 121.20 126.62 1ipj s ILE 104 Ca -0.05 -2.55 -0.17 0.00 0.00 0.00 0.00 60.65 57.88 1ipj s ILE 104 Cb -0.15 -4.13 -0.14 0.00 0.01 0.00 0.00 42.46 38.05 1ipj s ILE 104 CO -0.01 -0.97 -0.14 -2.65 0.00 0.00 0.00 174.94 171.17 1ipj n PRO 105 N 3.92 0.00 -1.67 2.79 -0.02 -1.26 -2.92 135.00 135.83 1ipj n PRO 105 Ca 0.10 0.00 -0.45 0.00 -2.02 0.00 0.00 63.50 61.13 1ipj n PRO 105 Cb 0.44 -0.92 -0.02 0.00 -0.02 0.00 0.00 33.50 32.97 1ipj n PRO 105 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ipj n ALA 106 N -1.43 1.01 -0.98 3.55 0.00 -1.25 -1.91 120.51 119.49 1ipj n ALA 106 Ca 0.07 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1ipj n ALA 106 Cb 0.44 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.64 1ipj n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ipj n GLY 107 N 1.88 0.29 3.76 0.00 0.00 -0.78 -4.94 105.19 105.40 1ipj n GLY 107 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1ipj n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ipj s THR 108 N -1.61 4.19 0.08 2.61 2.01 -0.80 -4.85 115.64 117.26 1ipj s THR 108 Ca 0.00 1.94 -0.18 0.00 0.31 0.00 0.00 61.69 63.76 1ipj s THR 108 Cb 0.00 -4.25 -0.07 0.00 0.01 0.00 0.00 72.50 68.19 1ipj s THR 108 CO 0.00 0.50 0.55 -0.89 -0.69 0.00 0.00 174.62 174.09 1ipj s THR 109 N -1.18 4.80 0.04 -0.82 2.01 -1.25 -4.47 115.64 114.77 1ipj s THR 109 Ca 0.39 1.08 -0.28 0.00 0.31 0.00 0.00 61.69 63.20 1ipj s THR 109 Cb -0.25 -3.84 0.09 0.00 0.01 0.00 0.00 72.50 68.52 1ipj s THR 109 CO 0.30 0.48 0.86 -0.72 -0.69 0.00 0.00 174.62 174.85 1ipj s TYR 110 N -1.19 -0.34 0.05 4.92 1.13 -0.95 -0.91 117.35 120.05 1ipj s TYR 110 Ca 0.30 0.18 0.00 0.00 -1.41 0.00 0.00 57.07 56.14 1ipj s TYR 110 Cb -0.18 0.55 -0.03 0.00 -1.10 0.00 0.00 41.96 41.20 1ipj s TYR 110 CO 0.18 -0.62 -0.04 1.52 -2.51 0.00 0.00 175.55 174.08 1ipj s TYR 111 N -3.23 0.53 -0.11 -3.49 1.13 -0.86 -2.99 117.35 108.33 1ipj s TYR 111 Ca 0.05 -0.85 0.03 0.00 -1.41 0.00 0.00 57.07 54.89 1ipj s TYR 111 Cb -0.01 -0.36 -0.00 0.00 -1.10 0.00 0.00 41.96 40.48 1ipj s TYR 111 CO -0.08 -0.26 -0.20 -0.51 -2.51 0.00 0.00 175.55 171.98 1ipj s LEU 112 N -2.43 2.28 -0.05 -3.49 1.02 -1.23 -2.32 118.68 112.47 1ipj s LEU 112 Ca 0.00 -0.49 0.04 0.00 0.02 0.00 0.00 54.13 53.70 1ipj s LEU 112 Cb 0.01 -1.47 -0.02 0.00 0.02 0.00 0.00 46.19 44.72 1ipj s LEU 112 CO -0.06 0.15 -0.18 -0.69 0.02 0.00 0.00 176.35 175.60 1ipj s VAL 113 N 0.39 2.77 -0.65 -1.59 1.01 -0.75 -1.20 120.40 120.38 1ipj s VAL 113 Ca -0.16 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 60.97 1ipj s VAL 113 Cb -0.17 -2.06 0.17 0.00 0.00 0.00 0.00 36.38 34.31 1ipj s VAL 113 CO 0.07 0.58 0.47 0.21 0.00 0.00 0.00 175.10 176.43 1ipj s ASN 114 N -0.59 5.24 0.57 3.32 3.84 -0.37 -1.33 114.94 125.61 1ipj s ASN 114 Ca 0.09 -2.98 0.34 0.00 0.21 0.00 0.00 52.86 50.51 1ipj s ASN 114 Cb -0.11 -1.84 1.72 0.00 -0.55 0.00 0.00 41.25 40.46 1ipj s ASN 114 CO 0.01 -0.33 2.14 1.55 -2.79 0.00 0.00 177.10 177.68 1ipj h PRO 115 N 6.85 0.00 -7.05 0.43 0.13 -1.87 0.15 132.00 130.64 1ipj h PRO 115 Ca 0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.57 1ipj h PRO 115 Cb 0.93 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.22 1ipj h PRO 115 CO 0.72 0.06 0.42 1.58 -0.23 0.00 0.00 178.00 180.54 1ipj n HIS 116 N -3.38 1.64 -0.03 1.56 -0.00 -1.26 -4.69 115.22 109.06 1ipj n HIS 116 Ca -0.02 0.42 0.03 0.00 0.46 0.00 0.00 57.72 58.61 1ipj n HIS 116 Cb 0.20 -2.23 -0.11 0.00 -0.12 0.00 0.00 29.99 27.73 1ipj n HIS 116 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 1ipj n ASP 117 N -1.72 1.65 -0.02 0.26 8.00 -1.26 -2.54 116.55 120.92 1ipj n ASP 117 Ca 0.15 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.62 1ipj n ASP 117 Cb 0.48 1.41 -0.03 0.00 -0.02 0.00 0.00 41.12 42.96 1ipj n ASP 117 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1ipj n HIS 118 N -2.17 0.00 -1.91 1.24 8.25 -1.26 -4.87 115.22 114.50 1ipj n HIS 118 Ca -0.09 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.08 1ipj n HIS 118 Cb 0.56 -0.20 0.17 0.00 1.12 0.00 0.00 29.99 31.64 1ipj n HIS 118 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1ipj s GLN 119 N -2.10 0.88 0.46 -0.41 0.74 -1.26 -4.93 119.66 113.03 1ipj s GLN 119 Ca -0.05 -0.30 0.03 0.00 0.05 0.00 0.00 55.36 55.08 1ipj s GLN 119 Cb 0.02 -1.86 0.03 0.00 1.10 0.00 0.00 33.01 32.29 1ipj s GLN 119 CO 0.13 -2.27 0.21 0.09 -0.55 0.00 0.00 175.29 172.90 1ipj n ASN 120 N -3.69 2.79 -3.76 6.67 5.03 -1.26 -4.04 115.26 116.99 1ipj n ASN 120 Ca 0.14 -2.75 -0.24 0.00 0.87 0.00 0.00 54.58 52.60 1ipj n ASN 120 Cb 0.60 0.10 -0.17 0.00 -1.02 0.00 0.00 39.78 39.28 1ipj n ASN 120 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1ipj s LEU 121 N 0.00 0.72 -0.22 3.41 2.96 -0.97 -4.23 118.68 120.35 1ipj s LEU 121 Ca 0.16 -0.27 0.02 0.00 -0.22 0.00 0.00 54.13 53.82 1ipj s LEU 121 Cb -0.01 -0.47 0.04 0.00 0.50 0.00 0.00 46.19 46.25 1ipj s LEU 121 CO 0.10 -0.22 -0.13 -0.75 -1.32 0.00 0.00 176.35 174.03 1ipj s LYS 122 N 1.95 2.39 -0.03 1.98 2.20 -0.98 -1.99 119.74 125.25 1ipj s LYS 122 Ca 0.04 -1.05 0.05 0.00 -0.36 0.00 0.00 55.97 54.65 1ipj s LYS 122 Cb -0.13 -2.66 -0.01 0.00 -1.51 0.00 0.00 37.83 33.52 1ipj s LYS 122 CO -0.06 -0.43 -0.20 0.42 -0.36 0.00 0.00 175.35 174.72 1ipj s ILE 123 N 1.24 1.61 0.03 5.43 1.01 -0.34 -0.93 121.20 129.26 1ipj s ILE 123 Ca -0.03 -0.84 0.06 0.00 0.00 0.00 0.00 60.65 59.84 1ipj s ILE 123 Cb -0.17 -1.36 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 1ipj s ILE 123 CO -0.08 0.46 -0.17 -0.51 0.00 0.00 0.00 174.94 174.64 1ipj s ILE 124 N -0.23 2.88 -0.04 2.92 2.07 -0.44 -0.81 121.20 127.55 1ipj s ILE 124 Ca 0.02 -1.09 -0.05 0.00 -1.41 0.00 0.00 60.65 58.11 1ipj s ILE 124 Cb -0.10 -2.20 0.01 0.00 0.13 0.00 0.00 42.46 40.30 1ipj s ILE 124 CO 0.01 0.38 0.13 -1.59 -1.91 0.00 0.00 174.94 171.96 1ipj s LYS 125 N -1.33 0.23 -0.32 3.50 -2.85 -0.10 -0.10 119.74 118.76 1ipj s LYS 125 Ca 0.14 0.05 -0.13 0.00 -1.00 0.00 0.00 55.97 55.03 1ipj s LYS 125 Cb -0.11 0.10 -0.02 0.00 -2.06 0.00 0.00 37.83 35.74 1ipj s LYS 125 CO 0.05 -0.04 0.28 -1.17 0.10 0.00 0.00 175.35 174.57 1ipj s LEU 126 N -0.27 4.37 -0.13 2.77 2.96 -1.21 0.13 118.68 127.31 1ipj s LEU 126 Ca -0.03 -0.24 -0.17 0.00 -0.22 0.00 0.00 54.13 53.47 1ipj s LEU 126 Cb -0.03 -2.22 -0.04 0.00 0.50 0.00 0.00 46.19 44.40 1ipj s LEU 126 CO 0.00 -0.23 0.42 0.00 -1.32 0.00 0.00 176.35 175.22 1ipj s ALA 127 N 1.84 3.52 -0.73 5.97 0.00 -0.62 -2.75 121.76 128.98 1ipj s ALA 127 Ca 0.09 -0.27 0.03 0.00 0.00 0.00 0.00 51.96 51.81 1ipj s ALA 127 Cb -0.17 -2.56 0.18 0.00 0.00 0.00 0.00 23.12 20.57 1ipj s ALA 127 CO 0.11 0.04 0.54 0.42 0.00 0.00 0.00 175.76 176.87 1ipj s ILE 128 N 0.53 3.19 0.78 0.00 1.01 0.83 -2.05 121.20 125.49 1ipj s ILE 128 Ca 0.23 -4.14 -0.14 0.00 0.00 0.00 0.00 60.65 56.60 1ipj s ILE 128 Cb -0.14 -3.07 -0.13 0.00 0.01 0.00 0.00 42.46 39.13 1ipj s ILE 128 CO 0.08 -1.01 -0.59 -2.65 0.00 0.00 0.00 174.94 170.77 1ipj n PRO 129 N 2.12 0.00 -0.00 2.79 -0.02 -1.25 -2.74 135.00 135.89 1ipj n PRO 129 Ca 0.19 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1ipj n PRO 129 Cb 0.35 -0.84 -0.00 0.00 -0.02 0.00 0.00 33.50 32.99 1ipj n PRO 129 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1ipj n VAL 130 N -1.97 0.01 0.00 -1.45 0.31 -0.99 -4.78 118.33 109.46 1ipj n VAL 130 Ca -0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1ipj n VAL 130 Cb 0.46 -0.57 0.00 0.00 -0.91 0.00 0.00 33.84 32.82 1ipj n VAL 130 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1ipj n ASN 131 N -1.87 0.00 -4.71 4.52 3.02 -1.26 -4.97 115.26 109.99 1ipj n ASN 131 Ca -0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.16 1ipj n ASN 131 Cb 0.36 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.48 1ipj n ASN 131 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ipj s LYS 132 N 0.00 4.37 -0.16 3.52 3.01 -1.26 -5.00 119.74 124.22 1ipj s LYS 132 Ca 0.00 0.66 -0.36 0.00 -1.01 0.00 0.00 55.97 55.26 1ipj s LYS 132 Cb 0.00 -3.46 -0.13 0.00 -1.01 0.00 0.00 37.83 33.23 1ipj s LYS 132 CO 0.00 0.07 1.87 -0.35 0.51 0.00 0.00 175.35 177.44 1ipj n PRO 133 N 3.89 1.84 -0.94 -1.68 -0.04 -1.26 -2.26 135.00 134.55 1ipj n PRO 133 Ca -0.04 0.67 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 1ipj n PRO 133 Cb 0.51 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 1ipj n PRO 133 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ipj n GLY 134 N 4.48 0.42 2.73 0.55 0.00 -1.20 -4.86 105.19 107.31 1ipj n GLY 134 Ca 0.25 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.05 1ipj n GLY 134 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ipj s ARG 135 N -0.60 0.28 0.14 1.61 3.52 -0.96 -4.92 118.95 118.03 1ipj s ARG 135 Ca 0.00 0.23 0.05 0.00 -0.13 0.00 0.00 55.73 55.87 1ipj s ARG 135 Cb 0.00 -0.73 -0.04 0.00 -1.56 0.00 0.00 34.95 32.61 1ipj s ARG 135 CO 0.00 -0.30 -0.11 1.52 -0.81 0.00 0.00 175.30 175.60 1ipj s TYR 136 N 1.99 1.27 0.34 5.12 1.13 -1.26 -4.20 117.35 121.75 1ipj s TYR 136 Ca 0.04 -0.72 0.09 0.00 -1.41 0.00 0.00 57.07 55.07 1ipj s TYR 136 Cb -0.12 -0.65 -0.06 0.00 -1.10 0.00 0.00 41.96 40.02 1ipj s TYR 136 CO -0.04 0.09 -0.09 -0.51 -2.51 0.00 0.00 175.55 172.49 1ipj s ASP 137 N -3.03 3.72 -0.08 -0.18 1.01 -1.26 -5.02 116.67 111.82 1ipj s ASP 137 Ca 0.15 -1.20 -0.00 0.00 0.71 0.00 0.00 52.55 52.21 1ipj s ASP 137 Cb 0.01 -0.35 -0.03 0.00 1.01 0.00 0.00 42.92 43.56 1ipj s ASP 137 CO 0.01 -0.21 -0.04 -1.81 0.21 0.00 0.00 175.17 173.33 1ipj s ASP 138 N -3.61 4.90 -0.41 0.27 1.01 -1.26 -3.51 116.67 114.06 1ipj s ASP 138 Ca 0.32 0.04 0.03 0.00 0.71 0.00 0.00 52.55 53.66 1ipj s ASP 138 Cb 0.03 -1.32 0.11 0.00 1.01 0.00 0.00 42.92 42.75 1ipj s ASP 138 CO 0.16 0.36 0.15 -0.36 0.21 0.00 0.00 175.17 175.69 1ipj s PHE 139 N -0.79 3.18 -0.24 4.23 0.40 0.92 -4.97 117.98 120.71 1ipj s PHE 139 Ca 0.12 -2.88 -0.24 0.00 -0.60 0.00 0.00 56.93 53.33 1ipj s PHE 139 Cb -0.11 -2.67 -0.01 0.00 0.51 0.00 0.00 43.02 40.74 1ipj s PHE 139 CO 0.02 -0.85 0.79 -0.06 0.70 0.00 0.00 175.22 175.81 1ipj s PHE 140 N 0.51 3.31 0.12 0.36 0.40 -1.26 -1.76 117.98 119.66 1ipj s PHE 140 Ca 0.14 1.08 -0.17 0.00 -0.60 0.00 0.00 56.93 57.37 1ipj s PHE 140 Cb -0.22 -3.01 -0.03 0.00 0.51 0.00 0.00 43.02 40.27 1ipj s PHE 140 CO -0.06 -0.38 1.68 1.25 0.70 0.00 0.00 175.22 178.41 1ipj h LEU 141 N 9.10 0.44-10.16 -0.37 6.46 -0.80 -3.23 115.31 116.75 1ipj h LEU 141 Ca -0.24 -0.14 -0.54 0.00 -0.12 0.00 0.00 57.88 56.84 1ipj h LEU 141 Cb 1.10 -0.11 0.18 0.00 -0.73 0.00 0.00 40.66 41.10 1ipj h LEU 141 CO 0.85 0.46 0.32 -1.54 -0.62 0.00 0.00 178.44 177.91 1ipj n SER 142 N -4.74 1.07 -4.73 1.25 3.41 -1.24 -4.49 113.62 104.16 1ipj n SER 142 Ca -0.01 0.62 -0.35 0.00 -0.26 0.00 0.00 58.87 58.86 1ipj n SER 142 Cb 0.12 -1.50 -0.08 0.00 -0.26 0.00 0.00 64.21 62.48 1ipj n SER 142 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1ipj s SER 143 N -1.99 5.72 0.33 4.04 0.15 -1.26 -3.56 113.70 117.13 1ipj s SER 143 Ca 0.74 0.23 -0.09 0.00 0.70 0.00 0.00 55.95 57.53 1ipj s SER 143 Cb -0.31 -1.81 0.02 0.00 -1.71 0.00 0.00 66.02 62.21 1ipj s SER 143 CO 0.50 0.32 0.57 -0.89 1.20 0.00 0.00 173.24 174.94 1ipj s THR 144 N -0.54 0.00 0.19 6.45 2.01 0.47 -4.93 115.64 119.29 1ipj s THR 144 Ca 0.11 -1.37 0.20 0.00 0.31 0.00 0.00 61.69 60.94 1ipj s THR 144 Cb -0.12 -2.58 0.16 0.00 0.01 0.00 0.00 72.50 69.97 1ipj s THR 144 CO 0.02 0.00 1.78 1.56 -0.69 0.00 0.00 174.62 177.29 1ipj h GLN 145 N 2.11 0.00 -0.01 4.92 4.20 -1.99 -3.11 115.11 121.23 1ipj h GLN 145 Ca -0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.43 1ipj h GLN 145 Cb 1.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 1ipj h GLN 145 CO 0.38 0.33 -0.45 0.00 -0.67 0.00 0.00 178.83 178.42 1ipj n ALA 146 N -2.29 3.46 -3.63 3.87 0.00 -1.26 -4.97 120.51 115.67 1ipj n ALA 146 Ca -0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 53.44 52.77 1ipj n ALA 146 Cb 0.47 -0.66 -0.07 0.00 0.00 0.00 0.00 19.45 19.19 1ipj n ALA 146 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1ipj s GLN 147 N -2.20 0.75 0.03 0.00 0.00 -1.18 -5.02 119.66 112.04 1ipj s GLN 147 Ca 0.14 1.14 -0.29 0.00 -0.00 0.00 0.00 55.36 56.35 1ipj s GLN 147 Cb 0.15 0.23 -0.04 0.00 0.00 0.00 0.00 33.01 33.35 1ipj s GLN 147 CO 0.50 -0.13 0.93 -0.65 0.00 0.00 0.00 175.29 175.94 1ipj s GLN 148 N 1.20 4.59 0.42 9.60 -0.21 -1.26 -0.40 119.66 133.60 1ipj s GLN 148 Ca -0.07 1.35 -0.26 0.00 0.02 0.00 0.00 55.36 56.41 1ipj s GLN 148 Cb -0.05 -3.43 -0.08 0.00 1.00 0.00 0.00 33.01 30.45 1ipj s GLN 148 CO -0.13 0.07 1.33 0.45 -2.12 0.00 0.00 175.29 174.90 1ipj s SER 149 N 0.59 6.16 0.00 5.90 0.15 -1.23 -4.87 113.70 120.39 1ipj s SER 149 Ca 0.48 2.72 0.12 0.00 0.70 0.00 0.00 55.95 59.97 1ipj s SER 149 Cb -0.21 -2.64 0.54 0.00 -1.71 0.00 0.00 66.02 61.99 1ipj s SER 149 CO 0.27 -0.96 1.39 0.00 1.20 0.00 0.00 173.24 175.14 1ipj n TYR 150 N -0.02 0.00 1.52 3.44 0.18 -1.22 -1.90 117.16 119.16 1ipj n TYR 150 Ca 0.04 0.00 0.12 0.00 1.88 0.00 0.00 57.90 59.94 1ipj n TYR 150 Cb 0.43 -0.48 0.69 0.00 -0.38 0.00 0.00 39.34 39.60 1ipj n TYR 150 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1ipj n LEU 151 N -1.48 0.00 -0.45 -3.48 4.77 -1.26 -2.17 117.00 112.93 1ipj n LEU 151 Ca 0.03 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.14 1ipj n LEU 151 Cb 0.14 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.47 1ipj n LEU 151 CO 0.11 0.00 0.57 0.00 -1.33 0.00 0.00 177.39 176.74 1ipj n GLN 152 N -0.98 1.27 0.20 3.23 6.02 -0.80 -3.95 117.38 122.36 1ipj n GLN 152 Ca 0.18 -0.91 0.09 0.00 -0.01 0.00 0.00 57.00 56.35 1ipj n GLN 152 Cb 0.08 -1.48 0.13 0.00 1.02 0.00 0.00 30.24 29.99 1ipj n GLN 152 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1ipj h GLY 153 N 4.86 0.00 -1.87 1.08 0.00 -1.65 -3.45 103.07 102.05 1ipj h GLY 153 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.87 1ipj h GLY 153 CO 0.00 0.00 0.36 -1.36 0.00 0.00 0.00 176.54 175.54 1ipj s PHE 154 N -3.14 3.37 1.19 5.60 2.99 -1.25 -5.05 117.98 121.69 1ipj s PHE 154 Ca 0.06 1.52 -0.18 0.00 0.00 0.00 0.00 56.93 58.34 1ipj s PHE 154 Cb 0.06 -2.83 0.28 0.00 0.00 0.00 0.00 43.02 40.53 1ipj s PHE 154 CO 0.69 -0.31 1.08 -1.54 -0.00 0.00 0.00 175.22 175.14 1ipj s SER 155 N -2.71 1.01 0.15 1.36 1.04 -1.26 -4.85 113.70 108.45 1ipj s SER 155 Ca 0.60 0.83 0.06 0.00 0.48 0.00 0.00 55.95 57.92 1ipj s SER 155 Cb -0.10 -1.22 -0.08 0.00 0.10 0.00 0.00 66.02 64.72 1ipj s SER 155 CO 0.24 -4.09 1.35 0.45 0.98 0.00 0.00 173.24 172.17 1ipj h HIS 156 N -2.55 0.10 -0.07 5.02 -0.00 -1.97 -2.64 115.15 113.04 1ipj h HIS 156 Ca -0.48 -0.06 -0.00 0.00 -0.00 0.00 0.00 60.37 59.83 1ipj h HIS 156 Cb 1.31 -0.01 -0.00 0.00 -0.00 0.00 0.00 27.41 28.71 1ipj h HIS 156 CO -1.58 0.95 0.04 -0.91 -0.00 0.00 0.00 177.93 176.44 1ipj h ASN 157 N 0.03 0.09 -0.36 2.45 2.35 -1.98 0.36 115.58 118.52 1ipj h ASN 157 Ca -0.03 -0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 55.54 1ipj h ASN 157 Cb 1.62 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.95 1ipj h ASN 157 CO 0.13 0.11 -0.26 0.40 -1.65 0.00 0.00 177.43 176.16 1ipj h ILE 158 N 0.06 1.27 -0.33 2.81 5.03 -1.94 0.05 117.51 124.47 1ipj h ILE 158 Ca 0.03 -1.41 -0.16 0.00 -0.12 0.00 0.00 64.86 63.19 1ipj h ILE 158 Cb 0.04 1.23 -0.00 0.00 -3.03 0.00 0.00 36.82 35.06 1ipj h ILE 158 CO -0.00 0.48 -0.45 -0.07 -0.68 0.00 0.00 178.15 177.42 1ipj h LEU 159 N 0.74 0.92 -0.83 1.44 3.38 -1.33 0.83 115.31 120.46 1ipj h LEU 159 Ca 0.09 -0.45 -0.07 0.00 0.09 0.00 0.00 57.88 57.54 1ipj h LEU 159 Cb 0.81 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1ipj h LEU 159 CO 0.07 1.23 0.08 -0.33 0.09 0.00 0.00 178.44 179.58 1ipj h GLU 160 N 0.68 0.96 -0.01 1.13 5.08 -0.15 -2.91 114.58 119.36 1ipj h GLU 160 Ca 0.04 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 1ipj h GLU 160 Cb 1.03 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1ipj h GLU 160 CO 0.10 0.90 -0.04 1.15 -1.00 0.00 0.00 179.01 180.12 1ipj h THR 161 N 0.90 1.55 0.41 1.13 2.02 -0.81 -2.89 112.91 115.22 1ipj h THR 161 Ca 0.18 -1.66 -0.02 0.00 0.77 0.00 0.00 66.41 65.68 1ipj h THR 161 Cb 0.42 2.65 -0.00 0.00 -1.74 0.00 0.00 68.15 69.48 1ipj h THR 161 CO 0.01 0.44 -0.24 0.28 0.37 0.00 0.00 175.52 176.37 1ipj h SER 162 N -0.65 -0.61 0.00 4.18 0.02 -0.87 -2.87 113.55 112.75 1ipj h SER 162 Ca -0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1ipj h SER 162 Cb 0.73 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1ipj h SER 162 CO 0.01 -0.38 0.00 0.49 -1.14 0.00 0.00 176.83 175.81 1ipj n PHE 163 N -3.83 0.00 -4.13 3.45 3.72 -1.10 -4.84 117.46 110.74 1ipj n PHE 163 Ca -0.07 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.01 1ipj n PHE 163 Cb 0.25 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.75 1ipj n PHE 163 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 1ipj n HIS 164 N -0.86 -1.44 -3.71 1.38 -0.00 -1.09 -4.95 115.22 104.55 1ipj n HIS 164 Ca 0.04 0.56 -0.13 0.00 0.46 0.00 0.00 57.72 58.65 1ipj n HIS 164 Cb 0.02 -3.13 -0.07 0.00 -0.12 0.00 0.00 29.99 26.68 1ipj n HIS 164 CO 0.00 0.00 0.00 -1.12 0.46 0.00 0.00 176.34 175.68 1ipj s SER 165 N -4.19 -0.23 0.42 0.26 0.01 -1.10 -5.08 113.70 103.79 1ipj s SER 165 Ca 0.11 0.02 -0.25 0.00 1.31 0.00 0.00 55.95 57.13 1ipj s SER 165 Cb -0.05 0.38 -0.08 0.00 0.21 0.00 0.00 66.02 66.47 1ipj s SER 165 CO 0.95 -0.58 1.27 -1.61 0.41 0.00 0.00 173.24 173.68 1ipj s GLU 166 N -2.06 3.92 0.14 12.44 2.02 -1.26 -4.49 118.70 129.40 1ipj s GLU 166 Ca -0.08 2.08 -0.26 0.00 0.02 0.00 0.00 54.97 56.73 1ipj s GLU 166 Cb -0.02 -2.69 -0.02 0.00 0.10 0.00 0.00 34.13 31.50 1ipj s GLU 166 CO 0.00 -0.51 1.61 0.35 0.02 0.00 0.00 175.26 176.74 1ipj h PHE 167 N 2.56 -0.86 -1.41 1.61 3.04 -1.92 -2.39 116.94 117.57 1ipj h PHE 167 Ca -0.49 0.04 0.44 0.00 3.98 0.00 0.00 57.97 61.93 1ipj h PHE 167 Cb 1.25 0.40 -0.11 0.00 2.56 0.00 0.00 35.95 40.05 1ipj h PHE 167 CO 0.53 -0.39 0.95 0.93 -2.02 0.00 0.00 178.31 178.31 1ipj h GLU 168 N -0.39 0.08 0.01 1.11 3.07 -1.98 0.12 114.58 116.61 1ipj h GLU 168 Ca 0.09 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.95 1ipj h GLU 168 Cb 0.54 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1ipj h GLU 168 CO -0.34 0.06 -0.00 1.49 -1.40 0.00 0.00 179.01 178.81 1ipj h GLU 169 N 0.09 -0.01 -0.30 2.33 4.81 -1.81 -0.06 114.58 119.63 1ipj h GLU 169 Ca 0.79 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 60.05 1ipj h GLU 169 Cb 2.68 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 32.03 1ipj h GLU 169 CO -0.27 0.63 0.12 -0.84 -0.73 0.00 0.00 179.01 177.92 1ipj h ILE 170 N -0.66 0.95 -0.07 2.32 3.07 -0.83 0.49 117.51 122.78 1ipj h ILE 170 Ca -0.00 -0.09 -0.01 0.00 1.55 0.00 0.00 64.86 66.31 1ipj h ILE 170 Cb 0.64 0.66 -0.00 0.00 -0.27 0.00 0.00 36.82 37.85 1ipj h ILE 170 CO 0.00 0.05 -0.00 -1.13 -1.05 0.00 0.00 178.15 176.02 1ipj h ASN 171 N 0.27 0.08 0.97 2.16 -0.00 -1.01 0.72 115.58 118.77 1ipj h ASN 171 Ca 0.13 -0.01 -0.17 0.00 -0.00 0.00 0.00 56.30 56.25 1ipj h ASN 171 Cb 0.07 -0.02 -0.02 0.00 -0.00 0.00 0.00 38.32 38.35 1ipj h ASN 171 CO -0.11 0.11 -0.83 0.03 -0.00 0.00 0.00 177.43 176.62 1ipj h ARG 172 N 0.10 0.00 -0.00 6.67 3.08 0.12 -3.32 114.38 121.02 1ipj h ARG 172 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1ipj h ARG 172 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1ipj h ARG 172 CO 0.00 0.83 -0.05 0.28 -1.07 0.00 0.00 179.97 179.96 1ipj n VAL 173 N -3.44 0.00 0.01 2.04 0.31 0.15 -4.88 118.33 112.52 1ipj n VAL 173 Ca -0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 1ipj n VAL 173 Cb 0.83 1.07 0.00 0.00 -0.91 0.00 0.00 33.84 34.83 1ipj n VAL 173 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1ipj n LEU 174 N -0.10 0.06 -4.53 7.52 4.77 0.24 -5.04 117.00 119.92 1ipj n LEU 174 Ca 0.02 0.03 -0.43 0.00 -0.03 0.00 0.00 56.01 55.60 1ipj n LEU 174 Cb 0.11 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1ipj n LEU 174 CO 0.05 -0.23 0.65 -0.76 -1.33 0.00 0.00 177.39 175.76 1ipj s LEU 175 N -5.79 4.20 1.44 2.23 1.02 -1.20 -4.49 118.68 116.09 1ipj s LEU 175 Ca 0.00 -0.20 -0.24 0.00 0.02 0.00 0.00 54.13 53.71 1ipj s LEU 175 Cb 0.00 -2.93 0.37 0.00 0.02 0.00 0.00 46.19 43.65 1ipj s LEU 175 CO 0.00 -1.04 0.93 -0.83 0.02 0.00 0.00 176.35 175.43 1ipj s GLY 186 N 2.43 1.41 0.22 -3.19 0.00 -1.26 -4.71 107.32 102.22 1ipj s GLY 186 Ca 0.30 -0.89 0.25 0.00 0.00 0.00 0.00 44.72 44.39 1ipj s GLY 186 CO 0.22 0.15 1.62 -0.39 0.00 0.00 0.00 173.10 174.69 1ipj h VAL 187 N -3.46 0.00 -3.27 1.40 -1.51 -1.95 -3.38 116.25 104.07 1ipj h VAL 187 Ca -0.42 -0.57 -0.63 0.00 -1.23 0.00 0.00 66.70 63.85 1ipj h VAL 187 Cb 1.34 1.46 -0.41 0.00 -2.13 0.00 0.00 31.29 31.55 1ipj h VAL 187 CO 0.26 0.00 -0.67 -0.63 -1.23 0.00 0.00 177.57 175.30 1ipj s ILE 188 N -3.14 2.18 0.36 7.19 1.01 -1.26 -1.60 121.20 125.94 1ipj s ILE 188 Ca 0.09 -3.01 0.08 0.00 0.00 0.00 0.00 60.65 57.81 1ipj s ILE 188 Cb 0.11 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.02 1ipj s ILE 188 CO 0.64 -0.82 0.23 0.68 0.00 0.00 0.00 174.94 175.68 1ipj s VAL 189 N -0.00 3.07 1.31 2.92 -7.23 -0.85 -4.57 120.40 115.05 1ipj s VAL 189 Ca 0.17 -1.53 -0.22 0.00 -1.81 0.00 0.00 61.98 58.59 1ipj s VAL 189 Cb -0.25 -3.05 0.33 0.00 0.56 0.00 0.00 36.38 33.97 1ipj s VAL 189 CO -0.01 -0.14 0.92 1.21 -0.31 0.00 0.00 175.10 176.78 1ipj n GLU 190 N -1.29 -4.05 0.00 4.82 2.13 -1.26 -1.47 120.64 119.51 1ipj n GLU 190 Ca -0.01 -1.51 0.00 0.00 0.66 0.00 0.00 57.16 56.30 1ipj n GLU 190 Cb 0.61 -1.71 0.00 0.00 0.27 0.00 0.00 31.44 30.61 1ipj n GLU 190 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1ipj n LEU 191 N 0.00 0.00 -3.53 4.31 7.94 -1.14 -4.57 117.00 120.01 1ipj n LEU 191 Ca 0.14 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.90 1ipj n LEU 191 Cb 0.57 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.47 1ipj n LEU 191 CO 0.38 0.00 0.34 -0.44 -1.11 0.00 0.00 177.39 176.56 1ipj s SER 192 N 1.09 -0.51 0.12 1.96 0.01 -1.26 -5.04 113.70 110.08 1ipj s SER 192 Ca 0.00 0.23 -0.21 0.00 1.31 0.00 0.00 55.95 57.27 1ipj s SER 192 Cb 0.00 0.53 -0.04 0.00 0.21 0.00 0.00 66.02 66.72 1ipj s SER 192 CO 0.00 -0.76 1.69 0.50 0.41 0.00 0.00 173.24 175.08 1ipj h LYS 193 N 2.63 -0.09 -0.04 12.44 3.64 -2.00 0.14 116.57 133.29 1ipj h LYS 193 Ca -0.31 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.09 1ipj h LYS 193 Cb 1.22 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 33.02 1ipj h LYS 193 CO 0.40 -0.06 -0.37 0.93 -2.27 0.00 0.00 179.45 178.08 1ipj h GLU 194 N -0.09 -0.42 -0.49 1.90 5.08 -1.98 0.71 114.58 119.28 1ipj h GLU 194 Ca 0.08 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.57 1ipj h GLU 194 Cb 0.21 0.10 -0.10 0.00 0.50 0.00 0.00 28.75 29.46 1ipj h GLU 194 CO -0.19 -0.28 -0.20 1.96 -1.00 0.00 0.00 179.01 179.30 1ipj h GLN 195 N -0.44 -0.09 0.37 2.33 4.20 -1.91 0.23 115.11 119.81 1ipj h GLN 195 Ca 0.01 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1ipj h GLN 195 Cb 0.48 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1ipj h GLN 195 CO -0.27 -0.06 -0.36 0.82 -0.67 0.00 0.00 178.83 178.29 1ipj h ILE 196 N -0.09 0.00 -0.74 2.54 2.04 0.01 -0.60 117.51 120.66 1ipj h ILE 196 Ca 0.23 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.21 1ipj h ILE 196 Cb 0.45 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.40 1ipj h ILE 196 CO -0.55 0.00 -0.37 0.03 0.00 0.00 0.00 178.15 177.25 1ipj h ARG 197 N -0.72 -0.11 0.12 2.37 3.08 1.00 -0.68 114.38 119.45 1ipj h ARG 197 Ca -0.05 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.02 1ipj h ARG 197 Cb 0.62 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.65 1ipj h ARG 197 CO -0.04 -0.07 -0.50 0.37 -1.07 0.00 0.00 179.97 178.66 1ipj h GLN 198 N -0.11 -0.70 0.00 0.04 5.75 -0.26 -2.54 115.11 117.29 1ipj h GLN 198 Ca 0.26 0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.79 1ipj h GLN 198 Cb 0.57 0.16 -0.00 0.00 1.07 0.00 0.00 27.48 29.27 1ipj h GLN 198 CO -0.80 -0.46 -0.11 -0.07 -2.65 0.00 0.00 178.83 174.74 1ipj h LEU 199 N -0.72 0.00 -0.07 -2.39 3.38 -0.67 -3.22 115.31 111.62 1ipj h LEU 199 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1ipj h LEU 199 Cb 0.72 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1ipj h LEU 199 CO -0.27 0.11 -0.10 0.28 0.09 0.00 0.00 178.44 178.55 1ipj h SER 200 N 0.00 0.21 -1.73 -0.43 0.02 -0.72 -3.46 113.55 107.44 1ipj h SER 200 Ca -0.00 -0.54 -0.66 0.00 -0.84 0.00 0.00 61.79 59.75 1ipj h SER 200 Cb 0.26 -0.06 0.08 0.00 0.14 0.00 0.00 62.40 62.83 1ipj h SER 200 CO 0.01 0.70 0.09 0.54 -1.14 0.00 0.00 176.83 177.03 1ipj n ARG 201 N -4.66 0.84 -2.68 3.45 1.74 -1.08 -3.86 116.66 110.41 1ipj n ARG 201 Ca -0.08 0.30 -0.01 0.00 -0.77 0.00 0.00 57.85 57.29 1ipj n ARG 201 Cb 0.34 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 30.09 1ipj n ARG 201 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1ipj n ARG 202 N 1.46 -3.14 -3.17 5.56 3.00 -1.26 -5.05 116.66 114.06 1ipj n ARG 202 Ca 0.15 2.57 -0.04 0.00 -0.00 0.00 0.00 57.85 60.53 1ipj n ARG 202 Cb 0.24 -5.24 -0.02 0.00 0.00 0.00 0.00 32.46 27.44 1ipj n ARG 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ipj s ALA 203 N -1.74 -1.84 -0.08 5.13 0.00 -1.25 -4.89 121.76 117.09 1ipj s ALA 203 Ca 0.05 -0.21 -0.40 0.00 0.00 0.00 0.00 51.96 51.39 1ipj s ALA 203 Cb -0.01 -2.57 -0.19 0.00 0.00 0.00 0.00 23.12 20.35 1ipj s ALA 203 CO 0.74 -2.20 1.26 1.17 0.00 0.00 0.00 175.76 176.73 1ipj n LYS 204 N 4.07 0.31 -4.36 0.00 4.81 -1.18 -3.40 118.16 118.41 1ipj n LYS 204 Ca 0.13 0.11 -0.23 0.00 -0.87 0.00 0.00 58.31 57.45 1ipj n LYS 204 Cb 0.54 -1.66 -0.13 0.00 0.02 0.00 0.00 35.03 33.81 1ipj n LYS 204 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1ipj s SER 205 N 0.84 2.34 0.14 3.14 1.04 -1.26 -1.29 113.70 118.64 1ipj s SER 205 Ca 0.92 -0.62 -0.09 0.00 0.48 0.00 0.00 55.95 56.65 1ipj s SER 205 Cb -1.23 -0.14 -0.06 0.00 0.10 0.00 0.00 66.02 64.69 1ipj s SER 205 CO 0.60 0.06 0.07 -1.54 0.98 0.00 0.00 173.24 173.41 1ipj n SER 206 N 1.36 -0.96 -3.80 7.02 3.41 -1.26 -4.96 113.62 114.44 1ipj n SER 206 Ca -0.19 0.34 -0.06 0.00 -0.26 0.00 0.00 58.87 58.70 1ipj n SER 206 Cb 0.54 -0.34 -0.02 0.00 -0.26 0.00 0.00 64.21 64.13 1ipj n SER 206 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1ipj s SER 207 N -0.38 -0.25 0.58 4.04 0.15 -1.26 -5.02 113.70 111.56 1ipj s SER 207 Ca 0.23 -0.50 0.30 0.00 0.70 0.00 0.00 55.95 56.67 1ipj s SER 207 Cb -0.27 0.64 1.78 0.00 -1.71 0.00 0.00 66.02 66.46 1ipj s SER 207 CO 0.23 -1.18 2.23 0.03 1.20 0.00 0.00 173.24 175.75 1ipj h ARG 208 N 2.00 0.00 -1.19 5.44 3.08 -1.95 -0.32 114.38 121.44 1ipj h ARG 208 Ca -0.21 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.25 1ipj h ARG 208 Cb 1.25 0.00 -0.25 0.00 0.08 0.00 0.00 29.97 31.05 1ipj h ARG 208 CO 0.25 0.02 0.76 0.36 -1.07 0.00 0.00 179.97 180.29 1ipj n LYS 209 N -3.78 2.46 0.00 0.04 2.85 -1.26 -4.18 118.16 114.29 1ipj n LYS 209 Ca -0.03 -2.84 0.00 0.00 -1.05 0.00 0.00 58.31 54.39 1ipj n LYS 209 Cb 0.11 -2.11 0.00 0.00 -0.65 0.00 0.00 35.03 32.38 1ipj n LYS 209 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1ipj n THR 210 N -0.55 0.15 0.21 0.58 -1.04 -0.13 -4.93 114.28 108.57 1ipj n THR 210 Ca 0.54 -0.16 -0.10 0.00 -2.04 0.00 0.00 64.05 62.30 1ipj n THR 210 Cb 0.62 1.01 -0.05 0.00 -1.82 0.00 0.00 70.33 70.09 1ipj n THR 210 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1ipj h ILE 211 N 2.35 0.07 -0.17 12.58 1.08 -1.73 -3.34 117.51 128.34 1ipj h ILE 211 Ca 0.00 -0.58 -0.10 0.00 -0.39 0.00 0.00 64.86 63.79 1ipj h ILE 211 Cb 0.87 0.11 -0.05 0.00 -3.07 0.00 0.00 36.82 34.68 1ipj h ILE 211 CO 0.00 0.02 0.12 -1.20 -0.69 0.00 0.00 178.15 176.40 1ipj n SER 212 N -5.17 3.77 -4.96 1.72 7.64 -1.26 -4.57 113.62 110.79 1ipj n SER 212 Ca -0.08 -2.37 -0.22 0.00 1.01 0.00 0.00 58.87 57.21 1ipj n SER 212 Cb 0.25 -0.69 -0.01 0.00 -1.01 0.00 0.00 64.21 62.75 1ipj n SER 212 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1ipj s SER 213 N 0.78 6.18 -0.12 6.43 0.15 -1.25 -4.56 113.70 121.30 1ipj s SER 213 Ca 0.10 0.26 0.20 0.00 0.70 0.00 0.00 55.95 57.21 1ipj s SER 213 Cb 0.08 -1.82 -0.29 0.00 -1.71 0.00 0.00 66.02 62.29 1ipj s SER 213 CO 0.01 -0.33 0.25 -0.62 1.20 0.00 0.00 173.24 173.76 1ipj n GLU 214 N -1.74 0.68 -0.02 5.44 1.02 -1.26 -3.99 120.64 120.76 1ipj n GLU 214 Ca -0.04 -0.09 -0.02 0.00 -0.02 0.00 0.00 57.16 56.99 1ipj n GLU 214 Cb 0.57 -1.52 -0.01 0.00 -0.02 0.00 0.00 31.44 30.46 1ipj n GLU 214 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1ipj n ASP 215 N -2.54 0.52 -4.63 1.62 9.92 -1.26 -4.84 116.55 115.35 1ipj n ASP 215 Ca -0.20 0.22 -0.33 0.00 -0.53 0.00 0.00 54.79 53.95 1ipj n ASP 215 Cb 0.90 -0.58 0.14 0.00 -0.64 0.00 0.00 41.12 40.94 1ipj n ASP 215 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1ipj n GLU 216 N -2.98 -0.10 -2.85 -1.24 1.02 -1.26 -4.78 120.64 108.45 1ipj n GLU 216 Ca -0.03 0.04 -0.31 0.00 -0.02 0.00 0.00 57.16 56.84 1ipj n GLU 216 Cb 0.11 -2.29 -0.04 0.00 -0.02 0.00 0.00 31.44 29.20 1ipj n GLU 216 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1ipj s PRO 217 N -4.12 3.89 0.26 3.49 0.04 -1.26 -4.85 135.00 132.45 1ipj s PRO 217 Ca 0.68 0.64 0.08 0.00 0.04 0.00 0.00 61.00 62.44 1ipj s PRO 217 Cb -0.26 -2.35 -0.05 0.00 0.04 0.00 0.00 34.50 31.88 1ipj s PRO 217 CO 0.56 -0.02 -0.12 -0.59 0.04 0.00 0.00 177.00 176.87 1ipj s PHE 218 N -2.30 1.95 -0.11 0.56 -0.71 0.10 -4.44 117.98 113.03 1ipj s PHE 218 Ca 0.54 -0.58 0.00 0.00 -1.04 0.00 0.00 56.93 55.86 1ipj s PHE 218 Cb -0.10 -0.99 -0.02 0.00 -1.21 0.00 0.00 43.02 40.70 1ipj s PHE 218 CO 0.26 0.40 -0.12 1.21 -1.34 0.00 0.00 175.22 175.63 1ipj s ASN 219 N -3.42 4.09 0.05 1.98 2.47 -1.26 0.13 114.94 118.97 1ipj s ASN 219 Ca 0.27 -0.28 -0.28 0.00 0.42 0.00 0.00 52.86 52.99 1ipj s ASN 219 Cb 0.01 -1.47 -0.15 0.00 -1.45 0.00 0.00 41.25 38.18 1ipj s ASN 219 CO 0.11 0.21 1.42 -0.07 -3.72 0.00 0.00 177.10 175.04 1ipj h LEU 220 N 6.40 -0.86 -1.10 3.21 -0.00 -1.82 -3.19 115.31 117.94 1ipj h LEU 220 Ca -0.31 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.61 1ipj h LEU 220 Cb 1.20 0.23 0.00 0.00 -0.00 0.00 0.00 40.66 42.09 1ipj h LEU 220 CO 0.55 -0.60 0.00 0.54 -0.00 0.00 0.00 178.44 178.93 1ipj n ARG 221 N -4.70 0.16 0.00 1.13 1.74 -1.26 -2.51 116.66 111.22 1ipj n ARG 221 Ca -0.12 0.54 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 1ipj n ARG 221 Cb 0.39 -1.92 0.00 0.00 -1.02 0.00 0.00 32.46 29.91 1ipj n ARG 221 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1ipj n SER 222 N -2.25 0.74 -4.29 0.55 3.41 -1.21 -4.62 113.62 105.96 1ipj n SER 222 Ca 0.00 -1.48 -0.15 0.00 -0.26 0.00 0.00 58.87 56.98 1ipj n SER 222 Cb 0.12 -0.37 -0.10 0.00 -0.26 0.00 0.00 64.21 63.60 1ipj n SER 222 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1ipj s ARG 223 N -1.00 1.26 0.08 4.33 3.52 -1.05 -4.93 118.95 121.16 1ipj s ARG 223 Ca 0.00 -1.63 -0.28 0.00 -0.13 0.00 0.00 55.73 53.69 1ipj s ARG 223 Cb 0.00 -0.39 -0.06 0.00 -1.56 0.00 0.00 34.95 32.94 1ipj s ARG 223 CO 0.00 -0.15 0.88 -0.80 -0.81 0.00 0.00 175.30 174.42 1ipj s ASN 224 N -3.25 7.38 0.41 -2.12 0.01 -1.26 -5.02 114.94 111.08 1ipj s ASN 224 Ca 0.28 1.65 -0.25 0.00 -0.71 0.00 0.00 52.86 53.83 1ipj s ASN 224 Cb 0.06 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 39.10 1ipj s ASN 224 CO 0.08 -0.04 1.21 -2.16 -1.51 0.00 0.00 177.10 174.68 1ipj s PRO 225 N 0.00 4.00 0.21 -0.60 0.04 -1.26 -4.86 135.00 132.53 1ipj s PRO 225 Ca 0.44 1.94 0.05 0.00 0.04 0.00 0.00 61.00 63.46 1ipj s PRO 225 Cb -0.22 -2.68 0.14 0.00 0.04 0.00 0.00 34.50 31.78 1ipj s PRO 225 CO 0.27 -0.40 1.48 -0.84 0.04 0.00 0.00 177.00 177.55 1ipj h ILE 226 N 2.33 1.46 -3.53 0.56 -0.00 -1.51 -3.44 117.51 113.38 1ipj h ILE 226 Ca -0.49 -2.33 -0.65 0.00 -0.00 0.00 0.00 64.86 61.38 1ipj h ILE 226 Cb 1.24 2.25 -0.33 0.00 -0.00 0.00 0.00 36.82 39.99 1ipj h ILE 226 CO 0.62 0.68 -0.87 -0.31 -0.00 0.00 0.00 178.15 178.27 1ipj s TYR 227 N -3.46 2.34 -0.29 0.16 2.02 -1.19 -5.00 117.35 111.93 1ipj s TYR 227 Ca -0.03 -0.88 -0.16 0.00 -0.37 0.00 0.00 57.07 55.63 1ipj s TYR 227 Cb 0.11 -1.57 0.16 0.00 -0.40 0.00 0.00 41.96 40.26 1ipj s TYR 227 CO 0.81 -0.34 1.03 -1.54 -1.57 0.00 0.00 175.55 173.93 1ipj s SER 228 N 0.25 -0.45 0.24 2.29 1.04 -1.26 0.85 113.70 116.66 1ipj s SER 228 Ca -0.14 0.68 -0.01 0.00 0.48 0.00 0.00 55.95 56.96 1ipj s SER 228 Cb -0.16 1.29 -0.03 0.00 0.10 0.00 0.00 66.02 67.22 1ipj s SER 228 CO 0.07 -0.10 0.22 0.54 0.98 0.00 0.00 173.24 174.95 1ipj s ASN 229 N 1.62 0.46 0.00 7.02 2.20 -0.24 -4.98 114.94 121.02 1ipj s ASN 229 Ca -0.07 -1.41 0.00 0.00 -0.94 0.00 0.00 52.86 50.44 1ipj s ASN 229 Cb -0.04 0.46 0.00 0.00 -2.00 0.00 0.00 41.25 39.67 1ipj s ASN 229 CO -0.15 -0.95 0.24 0.59 -2.94 0.00 0.00 177.10 173.89 1ipj n ASN 230 N -0.60 0.00 -0.01 3.54 4.13 -1.26 -0.28 115.26 120.78 1ipj n ASN 230 Ca 0.03 0.00 0.02 0.00 1.68 0.00 0.00 54.58 56.31 1ipj n ASN 230 Cb 0.64 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.86 1ipj n ASN 230 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1ipj n PHE 231 N -0.71 0.00 0.00 3.10 3.72 -1.26 -5.01 117.46 117.30 1ipj n PHE 231 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1ipj n PHE 231 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1ipj n PHE 231 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ipj n GLY 232 N 1.09 0.96 3.03 1.37 0.00 0.61 -2.84 105.19 109.41 1ipj n GLY 232 Ca 0.01 -1.00 -0.16 0.00 0.00 0.00 0.00 46.02 44.87 1ipj n GLY 232 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ipj s LYS 233 N -2.00 0.57 -0.20 1.61 1.02 0.63 -1.08 119.74 120.29 1ipj s LYS 233 Ca 0.00 -0.51 0.01 0.00 0.02 0.00 0.00 55.97 55.49 1ipj s LYS 233 Cb 0.00 -0.47 0.04 0.00 -0.52 0.00 0.00 37.83 36.88 1ipj s LYS 233 CO 0.00 0.11 -0.14 0.12 -0.92 0.00 0.00 175.35 174.52 1ipj s PHE 234 N -0.73 2.70 -0.16 3.18 2.19 0.25 0.73 117.98 126.14 1ipj s PHE 234 Ca -0.03 -1.73 -0.04 0.00 0.33 0.00 0.00 56.93 55.46 1ipj s PHE 234 Cb -0.06 -1.79 -0.03 0.00 -1.31 0.00 0.00 43.02 39.83 1ipj s PHE 234 CO 0.00 -0.79 -0.04 -0.06 1.83 0.00 0.00 175.22 176.17 1ipj s PHE 235 N 1.31 3.03 -0.15 10.12 0.40 0.15 -1.17 117.98 131.66 1ipj s PHE 235 Ca -0.00 -0.31 -0.10 0.00 -0.60 0.00 0.00 56.93 55.93 1ipj s PHE 235 Cb -0.16 -1.96 0.05 0.00 0.51 0.00 0.00 43.02 41.46 1ipj s PHE 235 CO -0.09 -0.04 0.36 -1.83 0.70 0.00 0.00 175.22 174.31 1ipj s GLU 236 N 0.39 0.37 0.02 0.44 -1.05 -1.26 -0.57 118.70 117.04 1ipj s GLU 236 Ca -0.04 0.64 0.07 0.00 -0.15 0.00 0.00 54.97 55.49 1ipj s GLU 236 Cb -0.14 0.03 -0.03 0.00 -0.44 0.00 0.00 34.13 33.55 1ipj s GLU 236 CO 0.03 -0.12 -0.19 0.42 0.95 0.00 0.00 175.26 176.35 1ipj s ILE 237 N 0.96 2.73 0.19 1.83 1.01 0.73 -4.94 121.20 123.71 1ipj s ILE 237 Ca -0.06 -1.10 0.08 0.00 0.00 0.00 0.00 60.65 59.57 1ipj s ILE 237 Cb -0.07 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 1ipj s ILE 237 CO -0.07 0.42 -0.15 0.42 0.00 0.00 0.00 174.94 175.55 1ipj s THR 238 N -0.85 1.71 -0.38 2.92 -4.23 -1.26 -1.63 115.64 111.92 1ipj s THR 238 Ca 0.13 -2.10 0.04 0.00 -1.18 0.00 0.00 61.69 58.58 1ipj s THR 238 Cb -0.10 -1.95 0.04 0.00 1.34 0.00 0.00 72.50 71.83 1ipj s THR 238 CO 0.03 -0.52 0.94 -2.65 -0.54 0.00 0.00 174.62 171.88 1ipj n PRO 239 N -0.14 0.03 0.07 3.99 -0.02 -1.26 0.57 135.00 138.24 1ipj n PRO 239 Ca -0.10 0.37 -0.09 0.00 -2.02 0.00 0.00 63.50 61.66 1ipj n PRO 239 Cb 0.59 -1.83 -0.12 0.00 -0.02 0.00 0.00 33.50 32.11 1ipj n PRO 239 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1ipj h GLU 240 N 0.00 0.06 0.00 -0.52 3.07 -1.94 -3.35 114.58 111.89 1ipj h GLU 240 Ca 0.00 -0.10 -0.35 0.00 -0.50 0.00 0.00 59.36 58.41 1ipj h GLU 240 Cb 0.50 0.04 -0.07 0.00 -0.84 0.00 0.00 28.75 28.38 1ipj h GLU 240 CO 0.00 1.04 -2.28 1.63 -1.40 0.00 0.00 179.01 178.00 1ipj n LYS 241 N -3.38 0.68 -4.08 2.33 5.02 0.19 -4.93 118.16 114.00 1ipj n LYS 241 Ca -0.02 0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 55.98 1ipj n LYS 241 Cb 0.96 -1.56 -0.15 0.00 -0.02 0.00 0.00 35.03 34.25 1ipj n LYS 241 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1ipj s ASN 242 N -5.57 4.21 0.25 4.39 3.04 -1.07 -4.17 114.94 116.01 1ipj s ASN 242 Ca -0.09 -1.25 -0.14 0.00 0.04 0.00 0.00 52.86 51.42 1ipj s ASN 242 Cb 0.06 -1.54 0.32 0.00 -1.54 0.00 0.00 41.25 38.55 1ipj s ASN 242 CO 0.83 -0.16 1.56 -0.65 -3.04 0.00 0.00 177.10 175.65 1ipj h PRO 243 N 7.81 -0.01 -0.57 0.43 0.11 -1.80 0.54 132.00 138.50 1ipj h PRO 243 Ca -0.24 0.00 0.17 0.00 0.11 0.00 0.00 66.00 66.03 1ipj h PRO 243 Cb 1.06 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1ipj h PRO 243 CO 0.50 -0.01 0.43 1.96 -0.21 0.00 0.00 178.00 180.66 1ipj h GLN 244 N -0.01 0.00 0.15 1.05 4.20 -1.89 0.61 115.11 119.22 1ipj h GLN 244 Ca 0.39 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.79 1ipj h GLN 244 Cb 0.64 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.42 1ipj h GLN 244 CO -0.96 0.00 -1.50 -0.07 -0.67 0.00 0.00 178.83 175.63 1ipj h LEU 245 N 0.00 0.50 -0.72 1.46 -0.00 -0.29 -3.29 115.31 112.97 1ipj h LEU 245 Ca 0.27 -0.64 0.01 0.00 -0.00 0.00 0.00 57.88 57.52 1ipj h LEU 245 Cb 1.12 -0.16 -0.04 0.00 -0.00 0.00 0.00 40.66 41.58 1ipj h LEU 245 CO -0.00 1.52 0.47 -0.09 -0.00 0.00 0.00 178.44 180.34 1ipj h ARG 246 N 0.09 0.95 0.00 1.13 2.43 0.27 2.63 114.38 121.88 1ipj h ARG 246 Ca -0.24 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1ipj h ARG 246 Cb 2.05 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 31.38 1ipj h ARG 246 CO 0.19 0.64 -0.02 -0.44 -1.51 0.00 0.00 179.97 178.83 1ipj h ASP 247 N 0.98 0.00 0.00 -3.80 3.45 -1.31 -2.43 116.42 113.30 1ipj h ASP 247 Ca 0.26 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.69 1ipj h ASP 247 Cb -0.10 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.66 1ipj h ASP 247 CO -0.06 0.02 -1.66 0.18 -1.57 0.00 0.00 179.24 176.15 1ipj n LEU 248 N -3.62 0.00 -3.22 1.55 4.77 -0.43 -5.04 117.00 111.01 1ipj n LEU 248 Ca -0.03 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.86 1ipj n LEU 248 Cb 0.11 0.04 0.03 0.00 -2.33 0.00 0.00 43.42 41.27 1ipj n LEU 248 CO 0.26 0.04 0.17 -0.67 -1.33 0.00 0.00 177.39 175.86 1ipj n ASP 249 N -2.04 -7.02 -3.70 -1.43 4.64 0.87 -4.87 116.55 103.00 1ipj n ASP 249 Ca -0.05 -0.43 -0.12 0.00 -1.38 0.00 0.00 54.79 52.81 1ipj n ASP 249 Cb 0.43 -4.92 -0.12 0.00 -1.04 0.00 0.00 41.12 35.48 1ipj n ASP 249 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1ipj s ILE 250 N -3.18 -0.15 0.11 5.18 1.01 -1.13 -3.27 121.20 119.77 1ipj s ILE 250 Ca 0.21 0.16 -0.09 0.00 0.00 0.00 0.00 60.65 60.92 1ipj s ILE 250 Cb -0.04 -0.49 -0.06 0.00 0.01 0.00 0.00 42.46 41.88 1ipj s ILE 250 CO 0.76 0.06 0.42 0.72 0.00 0.00 0.00 174.94 176.91 1ipj s PHE 251 N 1.63 3.54 -0.04 3.97 -0.71 -0.74 -4.43 117.98 121.19 1ipj s PHE 251 Ca -0.07 0.77 0.03 0.00 -1.04 0.00 0.00 56.93 56.62 1ipj s PHE 251 Cb -0.10 -2.15 -0.03 0.00 -1.21 0.00 0.00 43.02 39.53 1ipj s PHE 251 CO -0.10 0.47 -0.11 -0.51 -1.34 0.00 0.00 175.22 173.63 1ipj s LEU 252 N -2.16 2.93 -0.17 -1.99 1.43 -0.65 -0.63 118.68 117.44 1ipj s LEU 252 Ca 0.36 -0.15 -0.13 0.00 -1.03 0.00 0.00 54.13 53.18 1ipj s LEU 252 Cb -0.13 -1.63 0.05 0.00 0.03 0.00 0.00 46.19 44.50 1ipj s LEU 252 CO 0.20 0.34 0.44 -0.94 0.23 0.00 0.00 176.35 176.62 1ipj s SER 253 N -0.91 -0.51 -0.06 2.29 1.04 -0.80 -0.19 113.70 114.56 1ipj s SER 253 Ca 0.13 0.93 0.03 0.00 0.48 0.00 0.00 55.95 57.51 1ipj s SER 253 Cb -0.11 0.88 0.01 0.00 0.10 0.00 0.00 66.02 66.90 1ipj s SER 253 CO 0.02 -0.17 -0.14 -0.55 0.98 0.00 0.00 173.24 173.38 1ipj s SER 254 N 0.75 1.89 0.22 7.02 0.15 0.27 0.08 113.70 124.07 1ipj s SER 254 Ca -0.04 -0.32 0.07 0.00 0.70 0.00 0.00 55.95 56.36 1ipj s SER 254 Cb -0.05 -0.81 -0.05 0.00 -1.71 0.00 0.00 66.02 63.40 1ipj s SER 254 CO -0.05 0.06 -0.10 0.68 1.20 0.00 0.00 173.24 175.03 1ipj s VAL 255 N 0.52 1.56 -0.09 4.45 -7.23 -1.13 0.29 120.40 118.78 1ipj s VAL 255 Ca -0.13 -2.15 0.01 0.00 -1.81 0.00 0.00 61.98 57.90 1ipj s VAL 255 Cb -0.15 -2.16 0.02 0.00 0.56 0.00 0.00 36.38 34.65 1ipj s VAL 255 CO 0.04 -0.51 -0.11 -1.81 -0.31 0.00 0.00 175.10 172.40 1ipj s ASP 256 N -3.33 2.00 -0.09 4.85 -0.00 0.22 -3.40 116.67 116.93 1ipj s ASP 256 Ca 0.24 -0.32 -0.00 0.00 -0.00 0.00 0.00 52.55 52.47 1ipj s ASP 256 Cb 0.02 -0.87 0.02 0.00 -0.00 0.00 0.00 42.92 42.09 1ipj s ASP 256 CO 0.08 -0.02 -0.06 -0.63 -0.00 0.00 0.00 175.17 174.54 1ipj s ILE 257 N 1.07 0.80 0.40 0.77 1.01 -0.54 -0.27 121.20 124.44 1ipj s ILE 257 Ca -0.07 -0.18 -0.17 0.00 0.00 0.00 0.00 60.65 60.23 1ipj s ILE 257 Cb -0.15 -0.84 -0.09 0.00 0.01 0.00 0.00 42.46 41.39 1ipj s ILE 257 CO -0.01 0.32 0.86 0.20 0.00 0.00 0.00 174.94 176.31 1ipj s ASN 258 N 1.53 6.80 0.16 3.58 0.02 -1.13 0.34 114.94 126.25 1ipj s ASN 258 Ca 0.00 1.48 -0.31 0.00 -1.02 0.00 0.00 52.86 53.02 1ipj s ASN 258 Cb -0.13 -2.46 -0.17 0.00 0.02 0.00 0.00 41.25 38.51 1ipj s ASN 258 CO -0.05 -0.34 0.71 1.21 0.02 0.00 0.00 177.10 178.65 1ipj n GLU 259 N -0.72 0.17 0.00 -0.60 2.13 -1.25 -1.12 120.64 119.25 1ipj n GLU 259 Ca 0.05 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.93 1ipj n GLU 259 Cb 0.54 -1.22 0.00 0.00 0.27 0.00 0.00 31.44 31.03 1ipj n GLU 259 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ipj n GLY 260 N 1.84 2.14 3.21 8.31 0.00 0.12 -4.88 105.19 115.94 1ipj n GLY 260 Ca 0.18 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 1ipj n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ipj n ALA 261 N 0.00 -3.31 -3.60 4.61 0.00 -0.28 -3.44 120.51 114.50 1ipj n ALA 261 Ca 0.00 -1.30 -0.13 0.00 0.00 0.00 0.00 53.44 52.01 1ipj n ALA 261 Cb 0.00 -1.37 -0.06 0.00 0.00 0.00 0.00 19.45 18.01 1ipj n ALA 261 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1ipj s LEU 262 N -1.91 -0.57 -0.44 0.00 2.34 -0.93 -2.54 118.68 114.63 1ipj s LEU 262 Ca 0.52 0.92 -0.29 0.00 0.06 0.00 0.00 54.13 55.35 1ipj s LEU 262 Cb -0.11 2.21 0.03 0.00 -0.56 0.00 0.00 46.19 47.76 1ipj s LEU 262 CO 0.56 -0.32 1.15 -0.22 -1.06 0.00 0.00 176.35 176.46 1ipj s LEU 263 N -0.31 3.70 0.19 1.48 2.96 0.12 -2.99 118.68 123.83 1ipj s LEU 263 Ca -0.02 0.63 -0.32 0.00 -0.22 0.00 0.00 54.13 54.20 1ipj s LEU 263 Cb -0.03 -3.55 -0.16 0.00 0.50 0.00 0.00 46.19 42.96 1ipj s LEU 263 CO 0.01 -1.19 1.09 0.18 -1.32 0.00 0.00 176.35 175.12 1ipj n LEU 264 N 7.71 1.34 -4.58 -0.68 4.77 -0.28 -3.20 117.00 122.08 1ipj n LEU 264 Ca 0.12 1.15 -0.53 0.00 -0.03 0.00 0.00 56.01 56.72 1ipj n LEU 264 Cb 0.48 -1.20 -0.06 0.00 -2.33 0.00 0.00 43.42 40.31 1ipj n LEU 264 CO 0.69 -1.45 0.84 -0.81 -1.33 0.00 0.00 177.39 175.33 1ipj n PRO 265 N 1.50 0.96 -2.84 3.23 -0.04 -1.26 -4.86 135.00 131.68 1ipj n PRO 265 Ca 0.14 0.35 -0.07 0.00 -0.04 0.00 0.00 63.50 63.88 1ipj n PRO 265 Cb 0.25 -1.96 -0.00 0.00 -0.04 0.00 0.00 33.50 31.75 1ipj n PRO 265 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1ipj n HIS 266 N 2.34 -1.40 -3.65 0.54 1.44 -0.94 -2.39 115.22 111.16 1ipj n HIS 266 Ca 0.19 -1.27 -0.08 0.00 -2.01 0.00 0.00 57.72 54.54 1ipj n HIS 266 Cb 0.17 0.43 -0.07 0.00 0.12 0.00 0.00 29.99 30.64 1ipj n HIS 266 CO 0.00 0.00 0.00 -0.59 -2.81 0.00 0.00 176.34 172.94 1ipj s PHE 267 N -4.32 -0.97 0.20 -1.40 -0.71 0.04 -0.95 117.98 109.87 1ipj s PHE 267 Ca 0.14 2.00 -0.30 0.00 -1.04 0.00 0.00 56.93 57.73 1ipj s PHE 267 Cb -0.02 0.54 -0.08 0.00 -1.21 0.00 0.00 43.02 42.25 1ipj s PHE 267 CO 0.10 -0.48 1.08 -0.80 -1.34 0.00 0.00 175.22 173.78 1ipj s ASN 268 N 1.42 7.30 0.04 1.98 0.01 -1.26 -1.77 114.94 122.67 1ipj s ASN 268 Ca -0.08 2.11 -0.22 0.00 -0.71 0.00 0.00 52.86 53.95 1ipj s ASN 268 Cb -0.05 -2.61 -0.15 0.00 0.41 0.00 0.00 41.25 38.85 1ipj s ASN 268 CO -0.16 -0.17 1.45 0.77 -1.51 0.00 0.00 177.10 177.48 1ipj h SER 269 N 4.77 0.18 0.00 -1.22 4.64 -1.10 0.44 113.55 121.26 1ipj h SER 269 Ca -0.45 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 60.53 1ipj h SER 269 Cb 1.21 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1ipj h SER 269 CO 0.71 0.48 0.00 2.29 -0.87 0.00 0.00 176.83 179.44 1ipj n LYS 270 N -4.79 0.52 -2.83 4.77 2.85 -1.26 -3.95 118.16 113.46 1ipj n LYS 270 Ca -0.06 -0.03 -0.41 0.00 -1.05 0.00 0.00 58.31 56.76 1ipj n LYS 270 Cb 0.22 -0.30 -0.05 0.00 -0.65 0.00 0.00 35.03 34.25 1ipj n LYS 270 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ipj s ALA 271 N -0.08 3.29 -0.24 0.58 0.00 -1.26 -4.78 121.76 119.26 1ipj s ALA 271 Ca 0.00 0.46 -0.14 0.00 0.00 0.00 0.00 51.96 52.28 1ipj s ALA 271 Cb 0.00 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 1ipj s ALA 271 CO 0.00 0.00 0.31 0.42 0.00 0.00 0.00 175.76 176.50 1ipj s ILE 272 N 0.02 5.24 -0.16 0.00 1.01 0.02 -4.18 121.20 123.15 1ipj s ILE 272 Ca 0.44 0.48 -0.05 0.00 0.00 0.00 0.00 60.65 61.52 1ipj s ILE 272 Cb -0.22 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 1ipj s ILE 272 CO 0.27 0.23 0.00 -0.69 0.00 0.00 0.00 174.94 174.76 1ipj s VAL 273 N 1.60 4.26 -0.30 2.92 1.01 -0.85 0.13 120.40 129.18 1ipj s VAL 273 Ca 0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 61.98 61.87 1ipj s VAL 273 Cb -0.15 -2.89 0.04 0.00 0.00 0.00 0.00 36.38 33.39 1ipj s VAL 273 CO 0.08 0.49 0.01 -0.63 0.00 0.00 0.00 175.10 175.05 1ipj s ILE 274 N 0.30 3.11 -0.11 2.22 1.01 -0.68 0.59 121.20 127.65 1ipj s ILE 274 Ca -0.01 -1.29 -0.00 0.00 0.00 0.00 0.00 60.65 59.35 1ipj s ILE 274 Cb -0.13 -2.75 -0.02 0.00 0.01 0.00 0.00 42.46 39.56 1ipj s ILE 274 CO 0.02 -0.08 -0.08 -1.48 0.00 0.00 0.00 174.94 173.32 1ipj s LEU 275 N 1.29 3.03 -0.11 2.97 0.05 0.48 -1.29 118.68 125.10 1ipj s LEU 275 Ca -0.04 -0.15 0.01 0.00 0.05 0.00 0.00 54.13 54.01 1ipj s LEU 275 Cb -0.19 -1.68 -0.01 0.00 -2.05 0.00 0.00 46.19 42.25 1ipj s LEU 275 CO -0.01 0.26 -0.16 -0.69 -0.55 0.00 0.00 176.35 175.20 1ipj s VAL 276 N -0.19 2.83 -0.59 1.48 1.01 0.59 -1.31 120.40 124.23 1ipj s VAL 276 Ca 0.02 -0.75 -0.28 0.00 0.00 0.00 0.00 61.98 60.97 1ipj s VAL 276 Cb -0.13 -2.16 0.03 0.00 0.00 0.00 0.00 36.38 34.12 1ipj s VAL 276 CO 0.03 0.54 1.17 -0.63 0.00 0.00 0.00 175.10 176.21 1ipj s ILE 277 N 0.19 4.04 -0.01 2.22 -1.09 -0.69 -0.70 121.20 125.16 1ipj s ILE 277 Ca -0.09 0.82 -0.11 0.00 -2.23 0.00 0.00 60.65 59.03 1ipj s ILE 277 Cb -0.16 -4.72 -0.06 0.00 -1.58 0.00 0.00 42.46 35.94 1ipj s ILE 277 CO 0.06 -1.35 0.67 -1.13 -1.23 0.00 0.00 174.94 171.96 1ipj h ASN 278 N 9.55 -0.34 -4.36 3.58 -0.00 -1.61 0.74 115.58 123.13 1ipj h ASN 278 Ca -0.25 0.01 -0.15 0.00 -0.00 0.00 0.00 56.30 55.91 1ipj h ASN 278 Cb 1.06 0.09 -0.23 0.00 -0.00 0.00 0.00 38.32 39.23 1ipj h ASN 278 CO 1.18 -0.10 -0.41 -1.83 -0.00 0.00 0.00 177.43 176.27 1ipj s GLU 279 N -3.05 0.42 0.00 6.67 1.03 -0.74 -4.45 118.70 118.57 1ipj s GLU 279 Ca -0.06 0.04 0.00 0.00 0.03 0.00 0.00 54.97 54.98 1ipj s GLU 279 Cb 0.01 0.19 0.00 0.00 -0.80 0.00 0.00 34.13 33.52 1ipj s GLU 279 CO 0.18 -0.09 0.00 0.41 -1.33 0.00 0.00 175.26 174.43 1ipj n GLY 280 N 2.21 -0.07 3.33 -3.83 0.00 -1.25 -0.73 105.19 104.85 1ipj n GLY 280 Ca -0.17 -2.16 -0.15 0.00 0.00 0.00 0.00 46.02 43.54 1ipj n GLY 280 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ipj s ASP 281 N -4.00 -0.34 -0.03 1.61 1.01 -1.26 -3.97 116.67 109.69 1ipj s ASP 281 Ca 0.00 0.30 -0.29 0.00 0.71 0.00 0.00 52.55 53.26 1ipj s ASP 281 Cb 0.00 0.39 0.11 0.00 1.01 0.00 0.00 42.92 44.43 1ipj s ASP 281 CO 0.00 -0.49 0.93 0.00 0.21 0.00 0.00 175.17 175.81 1ipj s ALA 282 N -1.26 -1.85 -0.01 5.23 0.00 -0.93 -1.75 121.76 121.18 1ipj s ALA 282 Ca -0.13 1.11 0.01 0.00 0.00 0.00 0.00 51.96 52.96 1ipj s ALA 282 Cb -0.04 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.35 1ipj s ALA 282 CO 0.06 -0.66 -0.01 -0.80 0.00 0.00 0.00 175.76 174.35 1ipj s ASN 283 N -2.37 5.02 -0.02 0.00 0.01 0.11 -0.91 114.94 116.79 1ipj s ASN 283 Ca 0.05 -0.02 0.05 0.00 -0.71 0.00 0.00 52.86 52.23 1ipj s ASN 283 Cb -0.01 -1.30 -0.01 0.00 0.41 0.00 0.00 41.25 40.34 1ipj s ASN 283 CO -0.08 0.30 -0.16 -0.51 -1.51 0.00 0.00 177.10 175.14 1ipj s ILE 284 N -1.04 1.26 -0.14 0.60 2.07 0.77 -1.32 121.20 123.41 1ipj s ILE 284 Ca 0.18 -0.67 0.02 0.00 -1.41 0.00 0.00 60.65 58.77 1ipj s ILE 284 Cb -0.11 -1.06 0.01 0.00 0.13 0.00 0.00 42.46 41.43 1ipj s ILE 284 CO 0.08 0.36 -0.20 -1.61 -1.91 0.00 0.00 174.94 171.66 1ipj s GLU 285 N -0.29 2.83 0.10 3.50 2.02 -0.66 -1.88 118.70 124.32 1ipj s GLU 285 Ca 0.04 -0.78 0.09 0.00 0.02 0.00 0.00 54.97 54.34 1ipj s GLU 285 Cb -0.07 -2.33 -0.03 0.00 0.10 0.00 0.00 34.13 31.80 1ipj s GLU 285 CO -0.00 -0.05 -0.24 -1.17 0.02 0.00 0.00 175.26 173.82 1ipj s LEU 286 N 0.92 2.27 -0.03 1.80 0.20 0.14 -1.30 118.68 122.68 1ipj s LEU 286 Ca -0.05 -0.68 -0.00 0.00 0.69 0.00 0.00 54.13 54.09 1ipj s LEU 286 Cb -0.15 -1.07 0.03 0.00 -0.43 0.00 0.00 46.19 44.57 1ipj s LEU 286 CO -0.03 0.14 0.02 0.68 -0.29 0.00 0.00 176.35 176.87 1ipj s VAL 287 N -1.03 0.03 0.13 1.68 -7.23 -1.08 -0.26 120.40 112.64 1ipj s VAL 287 Ca 0.10 0.20 0.02 0.00 -1.81 0.00 0.00 61.98 60.49 1ipj s VAL 287 Cb -0.10 -0.17 -0.04 0.00 0.56 0.00 0.00 36.38 36.63 1ipj s VAL 287 CO 0.04 0.13 -0.06 -0.83 -0.31 0.00 0.00 175.10 174.07 1ipj s GLY 288 N 1.23 0.96 0.65 2.32 0.00 -0.57 -4.17 107.32 107.75 1ipj s GLY 288 Ca -0.07 -1.45 -0.14 0.00 0.00 0.00 0.00 44.72 43.06 1ipj s GLY 288 CO -0.03 -1.51 1.09 -0.42 0.00 0.00 0.00 173.10 172.23 1ipj s ILE 289 N -3.56 3.50 -0.15 0.90 -1.09 -1.26 0.13 121.20 119.67 1ipj s ILE 289 Ca 0.16 0.66 -0.16 0.00 -2.23 0.00 0.00 60.65 59.08 1ipj s ILE 289 Cb 0.05 -3.20 -0.05 0.00 -1.58 0.00 0.00 42.46 37.68 1ipj s ILE 289 CO -0.01 -0.47 -0.31 1.17 -1.23 0.00 0.00 174.94 174.09 1ipj n LYS 290 N -2.47 0.47 -3.74 2.79 4.81 -1.26 -4.53 118.16 114.23 1ipj n LYS 290 Ca 0.09 0.19 -0.38 0.00 -0.87 0.00 0.00 58.31 57.35 1ipj n LYS 290 Cb 0.52 -1.33 -0.12 0.00 0.02 0.00 0.00 35.03 34.12 1ipj n LYS 290 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 1ipj s LEU 303 N -7.80 4.02 0.04 3.14 0.20 -1.26 -5.05 118.68 111.97 1ipj s LEU 303 Ca -0.26 -0.79 -0.05 0.00 0.69 0.00 0.00 54.13 53.72 1ipj s LEU 303 Cb 0.04 -1.90 -0.05 0.00 -0.43 0.00 0.00 46.19 43.85 1ipj s LEU 303 CO 0.38 -0.23 0.28 -1.61 -0.29 0.00 0.00 176.35 174.88 1ipj s GLU 304 N 1.50 3.57 0.02 1.98 2.02 -1.26 -5.09 118.70 121.43 1ipj s GLU 304 Ca 0.02 -0.13 -0.18 0.00 0.02 0.00 0.00 54.97 54.70 1ipj s GLU 304 Cb -0.18 -3.03 -0.06 0.00 0.10 0.00 0.00 34.13 30.97 1ipj s GLU 304 CO 0.03 0.61 0.51 0.08 0.02 0.00 0.00 175.26 176.51 1ipj s VAL 305 N -1.40 4.91 -0.02 2.63 1.01 -1.26 -4.68 120.40 121.59 1ipj s VAL 305 Ca 0.31 1.08 -0.01 0.00 0.00 0.00 0.00 61.98 63.35 1ipj s VAL 305 Cb -0.13 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1ipj s VAL 305 CO 0.20 0.51 0.11 -1.58 0.00 0.00 0.00 175.10 174.34 1ipj s GLN 306 N -0.74 3.18 -0.13 2.72 0.74 0.35 -4.80 119.66 120.98 1ipj s GLN 306 Ca 0.27 -0.42 -0.01 0.00 0.05 0.00 0.00 55.36 55.26 1ipj s GLN 306 Cb -0.18 -2.94 -0.02 0.00 1.10 0.00 0.00 33.01 30.97 1ipj s GLN 306 CO 0.16 0.66 -0.10 0.50 -0.55 0.00 0.00 175.29 175.96 1ipj s ARG 307 N -1.72 3.34 -0.18 1.67 3.52 -1.26 -1.51 118.95 122.81 1ipj s ARG 307 Ca 0.23 -0.63 -0.02 0.00 -0.13 0.00 0.00 55.73 55.18 1ipj s ARG 307 Cb -0.12 -2.68 -0.01 0.00 -1.56 0.00 0.00 34.95 30.58 1ipj s ARG 307 CO 0.14 0.29 -0.09 0.71 -0.81 0.00 0.00 175.30 175.54 1ipj s TYR 308 N 0.17 2.88 0.02 5.12 2.02 0.65 -4.98 117.35 123.23 1ipj s TYR 308 Ca -0.06 -0.90 0.03 0.00 -0.37 0.00 0.00 57.07 55.78 1ipj s TYR 308 Cb -0.15 -1.98 -0.01 0.00 -0.40 0.00 0.00 41.96 39.42 1ipj s TYR 308 CO 0.04 -0.44 -0.10 0.50 -1.57 0.00 0.00 175.55 173.98 1ipj s ARG 309 N 1.01 0.73 0.04 -0.62 3.52 -1.26 0.28 118.95 122.65 1ipj s ARG 309 Ca -0.01 -0.52 -0.20 0.00 -0.13 0.00 0.00 55.73 54.87 1ipj s ARG 309 Cb -0.15 -0.68 0.04 0.00 -1.56 0.00 0.00 34.95 32.60 1ipj s ARG 309 CO -0.01 0.17 0.45 0.00 -0.81 0.00 0.00 175.30 175.10 1ipj s ALA 310 N -0.61 -1.12 -0.67 6.12 0.00 -0.79 -4.88 121.76 119.82 1ipj s ALA 310 Ca 0.00 0.41 -0.09 0.00 0.00 0.00 0.00 51.96 52.29 1ipj s ALA 310 Cb -0.06 0.35 0.17 0.00 0.00 0.00 0.00 23.12 23.59 1ipj s ALA 310 CO 0.00 -0.47 0.55 -1.21 0.00 0.00 0.00 175.76 174.63 1ipj s GLU 311 N -2.44 2.95 0.25 0.00 2.02 -1.26 -0.16 118.70 120.05 1ipj s GLU 311 Ca -0.05 -2.33 -0.30 0.00 0.02 0.00 0.00 54.97 52.31 1ipj s GLU 311 Cb -0.01 -4.05 -0.09 0.00 0.10 0.00 0.00 34.13 30.08 1ipj s GLU 311 CO -0.02 -1.23 1.24 -0.51 0.02 0.00 0.00 175.26 174.77 1ipj s LEU 312 N 0.36 4.46 0.00 1.80 1.43 -0.09 -4.93 118.68 121.71 1ipj s LEU 312 Ca 0.15 2.42 0.00 0.00 -1.03 0.00 0.00 54.13 55.67 1ipj s LEU 312 Cb -0.18 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.42 1ipj s LEU 312 CO -0.05 -0.42 0.01 -1.20 0.23 0.00 0.00 176.35 174.92 1ipj n SER 313 N 1.81 1.97 -4.72 2.29 7.64 -1.26 -2.20 113.62 119.15 1ipj n SER 313 Ca 0.03 -1.47 -0.42 0.00 1.01 0.00 0.00 58.87 58.01 1ipj n SER 313 Cb 0.43 0.11 -0.03 0.00 -1.01 0.00 0.00 64.21 63.72 1ipj n SER 313 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1ipj s GLU 314 N -2.38 4.13 -0.96 1.43 2.12 -1.25 -2.59 118.70 119.19 1ipj s GLU 314 Ca 0.01 2.59 0.00 0.00 0.36 0.00 0.00 54.97 57.93 1ipj s GLU 314 Cb 0.00 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.32 1ipj s GLU 314 CO 0.01 -0.72 0.00 -0.25 -0.54 0.00 0.00 175.26 173.75 1ipj n ASP 315 N 3.69 -3.71 -4.86 -1.70 10.43 0.25 -4.90 116.55 115.75 1ipj n ASP 315 Ca 0.14 0.07 -0.31 0.00 2.57 0.00 0.00 54.79 57.26 1ipj n ASP 315 Cb 0.36 -2.71 -0.05 0.00 1.84 0.00 0.00 41.12 40.56 1ipj n ASP 315 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 1ipj s ASP 316 N -2.64 6.03 -0.06 -2.24 -0.00 -1.07 -4.18 116.67 112.52 1ipj s ASP 316 Ca 0.00 0.18 0.02 0.00 -0.00 0.00 0.00 52.55 52.76 1ipj s ASP 316 Cb 0.00 -1.79 -0.03 0.00 -0.00 0.00 0.00 42.92 41.11 1ipj s ASP 316 CO 0.00 0.20 -0.11 -0.69 -0.00 0.00 0.00 175.17 174.57 1ipj s VAL 317 N -1.41 3.34 -0.03 -1.27 1.01 -0.21 -1.71 120.40 120.12 1ipj s VAL 317 Ca 0.31 -0.62 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 1ipj s VAL 317 Cb -0.13 -2.34 0.03 0.00 0.00 0.00 0.00 36.38 33.95 1ipj s VAL 317 CO 0.23 0.59 0.03 0.12 0.00 0.00 0.00 175.10 176.07 1ipj s PHE 318 N -0.70 0.13 -0.16 5.22 2.19 -0.43 -0.64 117.98 123.59 1ipj s PHE 318 Ca 0.11 0.10 -0.02 0.00 0.33 0.00 0.00 56.93 57.45 1ipj s PHE 318 Cb -0.11 -0.34 -0.02 0.00 -1.31 0.00 0.00 43.02 41.24 1ipj s PHE 318 CO 0.01 -0.12 -0.07 0.54 1.83 0.00 0.00 175.22 177.40 1ipj s VAL 319 N 1.27 3.44 -0.37 3.12 0.11 -1.14 -0.38 120.40 126.44 1ipj s VAL 319 Ca -0.07 -0.51 -0.06 0.00 -2.93 0.00 0.00 61.98 58.42 1ipj s VAL 319 Cb -0.13 -2.50 0.06 0.00 -1.53 0.00 0.00 36.38 32.29 1ipj s VAL 319 CO -0.03 0.49 0.15 -0.63 -3.33 0.00 0.00 175.10 171.75 1ipj s ILE 320 N 0.66 3.71 0.63 7.04 1.01 0.20 -4.83 121.20 129.62 1ipj s ILE 320 Ca -0.04 -1.41 -0.08 0.00 0.00 0.00 0.00 60.65 59.12 1ipj s ILE 320 Cb -0.15 -3.23 0.12 0.00 0.01 0.00 0.00 42.46 39.22 1ipj s ILE 320 CO 0.02 -0.35 0.28 -2.65 0.00 0.00 0.00 174.94 172.24 1ipj n PRO 321 N 4.78 -0.92 -2.78 2.79 -0.02 -1.26 -2.01 135.00 135.58 1ipj n PRO 321 Ca -0.10 -0.46 -0.33 0.00 -2.02 0.00 0.00 63.50 60.59 1ipj n PRO 321 Cb 0.43 -0.92 -0.06 0.00 -0.02 0.00 0.00 33.50 32.92 1ipj n PRO 321 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ipj s ALA 322 N -2.03 3.06 -0.75 3.55 0.00 -1.26 -4.05 121.76 120.28 1ipj s ALA 322 Ca 0.21 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.52 1ipj s ALA 322 Cb -0.04 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1ipj s ALA 322 CO 0.18 0.09 0.00 0.00 0.00 0.00 0.00 175.76 176.03 1ipj n ALA 323 N -0.76 -0.44 -2.80 0.00 0.00 0.15 -4.94 120.51 111.73 1ipj n ALA 323 Ca 0.07 0.10 -0.36 0.00 0.00 0.00 0.00 53.44 53.25 1ipj n ALA 323 Cb 0.54 -1.01 -0.10 0.00 0.00 0.00 0.00 19.45 18.88 1ipj n ALA 323 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1ipj s TYR 324 N -1.96 3.25 0.35 0.00 1.51 -1.26 -4.92 117.35 114.32 1ipj s TYR 324 Ca 0.00 0.05 -0.27 0.00 -1.01 0.00 0.00 57.07 55.84 1ipj s TYR 324 Cb 0.00 -2.18 -0.09 0.00 -0.11 0.00 0.00 41.96 39.58 1ipj s TYR 324 CO 0.00 0.04 1.16 -2.14 -1.11 0.00 0.00 175.55 173.49 1ipj s PRO 325 N 0.83 4.30 0.11 -1.71 0.02 -1.26 -4.57 135.00 132.73 1ipj s PRO 325 Ca 0.05 1.85 -0.12 0.00 0.02 0.00 0.00 61.00 62.80 1ipj s PRO 325 Cb -0.13 -2.89 0.02 0.00 0.02 0.00 0.00 34.50 31.51 1ipj s PRO 325 CO 0.02 -0.11 0.30 -0.59 -0.33 0.00 0.00 177.00 176.30 1ipj s PHE 326 N -1.31 -0.02 -0.02 6.54 -0.12 -0.13 -2.62 117.98 120.30 1ipj s PHE 326 Ca 0.52 -0.36 -0.02 0.00 -0.05 0.00 0.00 56.93 57.02 1ipj s PHE 326 Cb -0.32 0.10 0.00 0.00 -0.63 0.00 0.00 43.02 42.18 1ipj s PHE 326 CO 0.41 -0.63 0.05 0.54 -0.05 0.00 0.00 175.22 175.54 1ipj s VAL 327 N -3.84 0.01 -0.18 -2.49 0.11 -0.42 -2.22 120.40 111.38 1ipj s VAL 327 Ca 0.04 -0.10 -0.01 0.00 -2.93 0.00 0.00 61.98 58.99 1ipj s VAL 327 Cb 0.03 -0.11 0.00 0.00 -1.53 0.00 0.00 36.38 34.77 1ipj s VAL 327 CO -0.11 -0.05 -0.13 -0.69 -3.33 0.00 0.00 175.10 170.78 1ipj s VAL 328 N -0.14 2.76 -0.18 2.04 1.01 -1.19 -1.65 120.40 123.04 1ipj s VAL 328 Ca -0.02 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.21 1ipj s VAL 328 Cb -0.01 -2.19 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 1ipj s VAL 328 CO 0.00 0.49 -0.07 0.21 0.00 0.00 0.00 175.10 175.74 1ipj s ASN 329 N 1.09 4.28 -0.24 3.32 3.84 -0.43 0.15 114.94 126.95 1ipj s ASN 329 Ca 0.00 -0.33 -0.16 0.00 0.21 0.00 0.00 52.86 52.58 1ipj s ASN 329 Cb -0.14 -1.71 -0.04 0.00 -0.55 0.00 0.00 41.25 38.81 1ipj s ASN 329 CO -0.04 0.06 0.42 0.00 -2.79 0.00 0.00 177.10 174.75 1ipj s ALA 330 N 0.97 3.57 -0.68 1.71 0.00 -1.05 0.05 121.76 126.33 1ipj s ALA 330 Ca -0.01 -0.64 -0.00 0.00 0.00 0.00 0.00 51.96 51.31 1ipj s ALA 330 Cb -0.15 -2.71 0.41 0.00 0.00 0.00 0.00 23.12 20.66 1ipj s ALA 330 CO 0.00 -0.51 1.85 0.25 0.00 0.00 0.00 175.76 177.35 1ipj n THR 331 N 4.77 3.37 0.00 0.00 -2.24 -0.72 -0.71 114.28 118.76 1ipj n THR 331 Ca -0.07 -3.86 0.00 0.00 -2.27 0.00 0.00 64.05 57.85 1ipj n THR 331 Cb 0.51 -1.20 0.00 0.00 -2.10 0.00 0.00 70.33 67.53 1ipj n THR 331 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ipj n SER 332 N -0.69 0.00 -4.70 3.42 2.88 -1.25 -4.72 113.62 108.57 1ipj n SER 332 Ca 0.55 0.00 -0.54 0.00 -1.33 0.00 0.00 58.87 57.54 1ipj n SER 332 Cb 0.51 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.91 1ipj n SER 332 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1ipj n ASN 333 N 0.00 2.75 -4.37 -3.46 3.02 -1.26 -3.80 115.26 108.14 1ipj n ASN 333 Ca 0.00 1.02 -0.23 0.00 -0.03 0.00 0.00 54.58 55.34 1ipj n ASN 333 Cb 0.00 -1.22 -0.11 0.00 -0.61 0.00 0.00 39.78 37.84 1ipj n ASN 333 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1ipj s LEU 334 N 3.85 2.45 -0.22 3.41 2.96 0.15 -3.93 118.68 127.37 1ipj s LEU 334 Ca 0.97 -0.88 -0.10 0.00 -0.22 0.00 0.00 54.13 53.90 1ipj s LEU 334 Cb -0.94 -0.95 0.08 0.00 0.50 0.00 0.00 46.19 44.88 1ipj s LEU 334 CO 0.61 0.01 0.50 0.21 -1.32 0.00 0.00 176.35 176.36 1ipj s ASN 335 N -2.76 -0.60 0.14 3.68 2.47 0.09 -1.46 114.94 116.50 1ipj s ASN 335 Ca 0.19 1.13 0.03 0.00 0.42 0.00 0.00 52.86 54.63 1ipj s ASN 335 Cb -0.06 1.28 -0.04 0.00 -1.45 0.00 0.00 41.25 40.97 1ipj s ASN 335 CO 0.08 -0.22 -0.07 0.72 -3.72 0.00 0.00 177.10 173.90 1ipj s PHE 336 N 2.03 1.16 0.00 0.43 -0.71 -1.22 -1.50 117.98 118.17 1ipj s PHE 336 Ca -0.07 -0.86 0.03 0.00 -1.04 0.00 0.00 56.93 54.99 1ipj s PHE 336 Cb -0.09 -0.63 -0.03 0.00 -1.21 0.00 0.00 43.02 41.06 1ipj s PHE 336 CO -0.15 -0.05 -0.06 -1.17 -1.34 0.00 0.00 175.22 172.45 1ipj s LEU 337 N -3.14 3.21 -0.05 -1.99 2.96 0.13 -2.85 118.68 116.95 1ipj s LEU 337 Ca 0.17 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.95 1ipj s LEU 337 Cb 0.04 -1.84 0.02 0.00 0.50 0.00 0.00 46.19 44.92 1ipj s LEU 337 CO -0.00 0.28 -0.02 0.00 -1.32 0.00 0.00 176.35 175.29 1ipj s ALA 338 N -1.01 0.61 -0.19 5.97 0.00 0.11 -0.30 121.76 126.96 1ipj s ALA 338 Ca 0.17 -0.04 -0.13 0.00 0.00 0.00 0.00 51.96 51.97 1ipj s ALA 338 Cb -0.11 -0.50 -0.05 0.00 0.00 0.00 0.00 23.12 22.46 1ipj s ALA 338 CO 0.08 -0.16 0.24 -0.06 0.00 0.00 0.00 175.76 175.86 1ipj s PHE 339 N 1.26 3.42 -0.35 0.00 0.40 -0.41 -1.91 117.98 120.39 1ipj s PHE 339 Ca -0.06 0.48 -0.07 0.00 -0.60 0.00 0.00 56.93 56.68 1ipj s PHE 339 Cb -0.14 -2.30 0.04 0.00 0.51 0.00 0.00 43.02 41.13 1ipj s PHE 339 CO -0.02 0.20 0.14 0.20 0.70 0.00 0.00 175.22 176.44 1ipj s GLY 340 N 0.58 1.87 0.24 4.36 0.00 0.20 -1.69 107.32 112.88 1ipj s GLY 340 Ca 0.13 -1.79 -0.22 0.00 0.00 0.00 0.00 44.72 42.84 1ipj s GLY 340 CO 0.03 0.81 0.80 -0.42 0.00 0.00 0.00 173.10 174.31 1ipj s ILE 341 N 1.43 4.44 -1.35 0.90 -1.09 0.12 -1.80 121.20 123.85 1ipj s ILE 341 Ca -0.00 1.50 -0.07 0.00 -2.23 0.00 0.00 60.65 59.84 1ipj s ILE 341 Cb -0.20 -3.94 0.02 0.00 -1.58 0.00 0.00 42.46 36.76 1ipj s ILE 341 CO 0.03 0.23 1.09 0.59 -1.23 0.00 0.00 174.94 175.65 1ipj n ASN 342 N 0.79 -4.94 -0.47 3.58 3.02 -1.20 -0.80 115.26 115.25 1ipj n ASN 342 Ca -0.02 -0.61 0.12 0.00 -0.03 0.00 0.00 54.58 54.04 1ipj n ASN 342 Cb 0.50 -4.81 0.46 0.00 -0.61 0.00 0.00 39.78 35.33 1ipj n ASN 342 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ipj n ALA 343 N -4.74 2.55 -0.63 5.41 0.00 -1.23 -4.16 120.51 117.71 1ipj n ALA 343 Ca -0.06 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1ipj n ALA 343 Cb 0.58 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1ipj n ALA 343 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ipj n GLU 344 N 0.14 0.00 -2.83 0.00 4.07 -1.26 -2.57 120.64 118.19 1ipj n GLU 344 Ca 0.17 0.15 -0.41 0.00 -0.06 0.00 0.00 57.16 57.01 1ipj n GLU 344 Cb 0.31 -0.46 0.01 0.00 -0.06 0.00 0.00 31.44 31.24 1ipj n GLU 344 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1ipj n ASN 345 N -0.38 6.75 -4.86 4.31 5.03 -1.26 -4.83 115.26 120.01 1ipj n ASN 345 Ca 0.00 -3.57 -0.31 0.00 0.87 0.00 0.00 54.58 51.57 1ipj n ASN 345 Cb 0.00 -1.17 0.00 0.00 -1.02 0.00 0.00 39.78 37.60 1ipj n ASN 345 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1ipj s ASN 346 N -1.67 6.24 -0.10 6.41 3.04 -1.06 -4.85 114.94 122.95 1ipj s ASN 346 Ca 0.36 1.46 -0.05 0.00 0.04 0.00 0.00 52.86 54.68 1ipj s ASN 346 Cb 0.14 -2.48 0.05 0.00 -1.54 0.00 0.00 41.25 37.41 1ipj s ASN 346 CO -0.03 -0.86 0.22 -1.10 -3.04 0.00 0.00 177.10 172.29 1ipj s GLN 347 N -4.97 0.16 -0.21 0.43 -1.52 -1.26 -4.97 119.66 107.32 1ipj s GLN 347 Ca 0.56 0.54 -0.15 0.00 -1.95 0.00 0.00 55.36 54.36 1ipj s GLN 347 Cb -0.11 -0.13 -0.04 0.00 -0.22 0.00 0.00 33.01 32.51 1ipj s GLN 347 CO 0.50 -0.20 0.37 0.50 -0.25 0.00 0.00 175.29 176.22 1ipj s ARG 348 N 1.52 4.14 -0.14 2.91 3.52 -1.26 -0.39 118.95 129.25 1ipj s ARG 348 Ca -0.07 0.14 -0.00 0.00 -0.13 0.00 0.00 55.73 55.67 1ipj s ARG 348 Cb -0.11 -3.55 -0.01 0.00 -1.56 0.00 0.00 34.95 29.72 1ipj s ARG 348 CO -0.08 -0.06 -0.14 -0.80 -0.81 0.00 0.00 175.30 173.42 1ipj s ASN 349 N 1.11 3.85 -0.15 -2.12 0.02 -0.73 -4.95 114.94 111.98 1ipj s ASN 349 Ca 0.17 -0.40 -0.06 0.00 -1.02 0.00 0.00 52.86 51.56 1ipj s ASN 349 Cb -0.15 -1.59 -0.04 0.00 0.02 0.00 0.00 41.25 39.49 1ipj s ASN 349 CO 0.08 0.12 0.05 -0.36 0.02 0.00 0.00 177.10 177.01 1ipj s PHE 350 N 0.60 3.26 -2.47 2.20 0.08 -0.29 -0.78 117.98 120.58 1ipj s PHE 350 Ca -0.08 0.13 0.23 0.00 0.12 0.00 0.00 56.93 57.33 1ipj s PHE 350 Cb -0.16 -1.98 0.09 0.00 -0.57 0.00 0.00 43.02 40.40 1ipj s PHE 350 CO 0.03 0.29 1.17 1.28 -0.10 0.00 0.00 175.22 177.89 1ipj n LEU 351 N 3.00 2.46 -3.82 -0.37 4.77 -1.01 -1.35 117.00 120.69 1ipj n LEU 351 Ca -0.18 -0.86 -0.13 0.00 -0.03 0.00 0.00 56.01 54.81 1ipj n LEU 351 Cb 0.53 -0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.47 1ipj n LEU 351 CO 0.33 0.43 -0.35 0.00 -1.33 0.00 0.00 177.39 176.47 1ipj s ALA 352 N -2.26 0.02 0.00 -1.18 0.00 -1.26 -4.82 121.76 112.26 1ipj s ALA 352 Ca 0.23 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.35 1ipj s ALA 352 Cb 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.18 1ipj s ALA 352 CO 0.45 -0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.56 1ipj n GLY 353 N 3.61 1.09 0.09 0.00 0.00 -1.26 -4.68 105.19 104.04 1ipj n GLY 353 Ca -0.20 -2.24 -0.17 0.00 0.00 0.00 0.00 46.02 43.41 1ipj n GLY 353 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ipj h GLU 354 N 0.00 0.14 -5.72 1.61 4.81 -1.76 -3.43 114.58 110.23 1ipj h GLU 354 Ca 0.00 -0.24 -0.61 0.00 -0.13 0.00 0.00 59.36 58.37 1ipj h GLU 354 Cb 0.00 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 29.39 1ipj h GLU 354 CO 0.00 1.12 -0.31 0.15 -0.73 0.00 0.00 179.01 179.24 1ipj s LYS 355 N -2.33 3.97 -1.22 1.92 1.02 -1.26 -4.42 119.74 117.42 1ipj s LYS 355 Ca -0.17 0.17 -0.02 0.00 0.02 0.00 0.00 55.97 55.98 1ipj s LYS 355 Cb -0.01 -3.30 0.00 0.00 -0.52 0.00 0.00 37.83 34.00 1ipj s LYS 355 CO 0.75 0.51 1.03 -0.25 -0.92 0.00 0.00 175.35 176.47 1ipj n ASP 356 N 2.63 -2.90 -4.26 2.83 8.00 -1.26 -4.72 116.55 116.86 1ipj n ASP 356 Ca -0.14 -0.60 -0.42 0.00 0.71 0.00 0.00 54.79 54.34 1ipj n ASP 356 Cb 0.53 -5.06 -0.08 0.00 -0.02 0.00 0.00 41.12 36.48 1ipj n ASP 356 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1ipj s ASN 357 N -4.14 5.81 0.11 -2.24 2.47 -1.24 -1.14 114.94 114.58 1ipj s ASN 357 Ca 0.12 -1.71 -0.29 0.00 0.42 0.00 0.00 52.86 51.40 1ipj s ASN 357 Cb -0.05 -2.06 -0.10 0.00 -1.45 0.00 0.00 41.25 37.60 1ipj s ASN 357 CO 0.72 -0.67 1.62 0.58 -3.72 0.00 0.00 177.10 175.63 1ipj h VAL 358 N 6.03 0.34 0.00 -5.21 2.07 -1.57 -0.91 116.25 117.00 1ipj h VAL 358 Ca -0.24 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1ipj h VAL 358 Cb 1.08 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1ipj h VAL 358 CO 0.86 0.00 0.23 1.62 0.02 0.00 0.00 177.57 180.31 1ipj h VAL 359 N -0.57 0.00 0.00 2.57 3.04 -1.88 0.83 116.25 120.24 1ipj h VAL 359 Ca 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.71 1ipj h VAL 359 Cb 0.57 0.43 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 1ipj h VAL 359 CO -0.15 0.00 -0.32 0.54 -1.01 0.00 0.00 177.57 176.63 1ipj n ARG 360 N -2.31 0.17 -0.02 4.17 5.12 -0.35 -3.73 116.66 119.71 1ipj n ARG 360 Ca -0.01 0.08 -0.01 0.00 -1.93 0.00 0.00 57.85 55.98 1ipj n ARG 360 Cb 0.26 -1.64 -0.12 0.00 -1.16 0.00 0.00 32.46 29.80 1ipj n ARG 360 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1ipj n GLN 361 N -1.90 0.65 -1.56 5.56 1.13 0.29 -4.94 117.38 116.61 1ipj n GLN 361 Ca 0.05 0.07 -0.37 0.00 -1.94 0.00 0.00 57.00 54.80 1ipj n GLN 361 Cb 0.40 -1.66 0.06 0.00 0.11 0.00 0.00 30.24 29.14 1ipj n GLN 361 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1ipj n ILE 362 N -2.72 3.58 -2.35 5.09 5.41 -1.12 -4.88 119.36 122.38 1ipj n ILE 362 Ca -0.15 -0.48 -0.41 0.00 1.00 0.00 0.00 62.75 62.71 1ipj n ILE 362 Cb 0.88 -1.12 -0.03 0.00 -0.71 0.00 0.00 39.64 38.66 1ipj n ILE 362 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1ipj s GLU 363 N -2.88 4.47 0.21 0.38 2.02 -1.26 -4.79 118.70 116.85 1ipj s GLU 363 Ca 0.76 1.91 -0.11 0.00 0.02 0.00 0.00 54.97 57.54 1ipj s GLU 363 Cb -0.40 -3.23 0.28 0.00 0.10 0.00 0.00 34.13 30.88 1ipj s GLU 363 CO 0.47 -0.12 1.67 -0.09 0.02 0.00 0.00 175.26 177.22 1ipj h ARG 364 N 5.26 0.14 0.00 1.61 2.43 -1.96 1.21 114.38 123.07 1ipj h ARG 364 Ca -0.45 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1ipj h ARG 364 Cb 1.21 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1ipj h ARG 364 CO 0.75 0.09 0.00 1.04 -1.51 0.00 0.00 179.97 180.34 1ipj n GLN 365 N -5.24 0.08 -0.02 0.20 6.02 -1.26 -2.70 117.38 114.45 1ipj n GLN 365 Ca 0.08 0.26 -0.02 0.00 -0.01 0.00 0.00 57.00 57.32 1ipj n GLN 365 Cb 0.34 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.07 1ipj n GLN 365 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1ipj n VAL 366 N -1.34 0.23 0.02 5.09 0.31 0.26 -4.40 118.33 118.50 1ipj n VAL 366 Ca 0.03 -0.14 0.05 0.00 -0.01 0.00 0.00 64.34 64.27 1ipj n VAL 366 Cb 0.06 -0.90 0.46 0.00 -0.91 0.00 0.00 33.84 32.55 1ipj n VAL 366 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1ipj h GLN 367 N 0.00 0.46 -0.07 5.55 4.20 0.13 0.17 115.11 125.54 1ipj h GLN 367 Ca -0.09 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.54 1ipj h GLN 367 Cb 1.21 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 1ipj h GLN 367 CO 0.00 0.30 -0.20 1.49 -0.67 0.00 0.00 178.83 179.76 1ipj h GLU 368 N 0.47 0.12 0.00 1.46 4.81 -1.76 -1.89 114.58 117.79 1ipj h GLU 368 Ca 0.15 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 59.22 1ipj h GLU 368 Cb 0.01 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1ipj h GLU 368 CO -0.03 0.32 -0.83 -0.07 -0.73 0.00 0.00 179.01 177.67 1ipj h LEU 369 N 0.11 0.00 0.00 1.64 3.38 -0.92 -3.37 115.31 116.15 1ipj h LEU 369 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1ipj h LEU 369 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1ipj h LEU 369 CO 0.03 0.55 -1.25 0.00 0.09 0.00 0.00 178.44 177.86 1ipj n ALA 370 N -2.29 4.07 -2.42 1.53 0.00 -0.61 -4.97 120.51 115.83 1ipj n ALA 370 Ca -0.02 -0.55 -0.30 0.00 0.00 0.00 0.00 53.44 52.58 1ipj n ALA 370 Cb 0.78 -0.72 -0.13 0.00 0.00 0.00 0.00 19.45 19.38 1ipj n ALA 370 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ipj s PHE 371 N -3.06 2.43 0.43 0.00 0.40 -0.73 -5.01 117.98 112.44 1ipj s PHE 371 Ca 0.03 -0.33 0.15 0.00 -0.60 0.00 0.00 56.93 56.18 1ipj s PHE 371 Cb 0.15 -1.37 1.03 0.00 0.51 0.00 0.00 43.02 43.34 1ipj s PHE 371 CO 0.84 0.27 1.94 -1.35 0.70 0.00 0.00 175.22 177.62 1ipj h PRO 372 N 4.29 0.41 0.00 0.24 0.11 -1.89 -3.42 132.00 131.74 1ipj h PRO 372 Ca -0.49 -0.02 -0.35 0.00 0.11 0.00 0.00 66.00 65.25 1ipj h PRO 372 Cb 1.16 -0.09 0.19 0.00 0.11 0.00 0.00 31.00 32.37 1ipj h PRO 372 CO 0.44 0.27 -0.06 0.41 -0.21 0.00 0.00 178.00 178.86 1ipj n GLY 373 N -1.52 -3.49 3.90 -0.55 0.00 -1.26 -5.04 105.19 97.22 1ipj n GLY 373 Ca 0.13 -1.37 -0.23 0.00 0.00 0.00 0.00 46.02 44.55 1ipj n GLY 373 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ipj s SER 374 N -3.49 6.00 0.26 1.61 1.04 -1.26 -4.76 113.70 113.10 1ipj s SER 374 Ca 0.64 -0.02 -0.05 0.00 0.48 0.00 0.00 55.95 57.00 1ipj s SER 374 Cb -0.09 -1.69 0.51 0.00 0.10 0.00 0.00 66.02 64.84 1ipj s SER 374 CO 0.52 -0.01 1.63 0.00 0.98 0.00 0.00 173.24 176.35 1ipj h ALA 375 N 1.66 0.89 0.20 5.32 0.00 -1.85 -0.58 119.26 124.91 1ipj h ALA 375 Ca -0.50 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1ipj h ALA 375 Cb 1.22 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1ipj h ALA 375 CO 0.63 -0.44 -0.09 0.37 0.00 0.00 0.00 179.25 179.71 1ipj h GLN 376 N 0.11 -0.26 0.00 0.00 4.15 -1.94 -2.86 115.11 114.32 1ipj h GLN 376 Ca 0.45 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.88 1ipj h GLN 376 Cb 0.83 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 28.58 1ipj h GLN 376 CO -0.70 -0.06 -0.05 -0.44 -1.93 0.00 0.00 178.83 175.65 1ipj h ASP 377 N -0.41 0.00 0.01 -0.69 3.45 -1.55 -2.86 116.42 114.37 1ipj h ASP 377 Ca -0.03 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.43 1ipj h ASP 377 Cb 0.31 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.08 1ipj h ASP 377 CO 0.04 0.05 -0.01 0.58 -1.57 0.00 0.00 179.24 178.34 1ipj h VAL 378 N 0.00 1.47 -0.30 -1.35 2.07 -1.11 -3.04 116.25 113.99 1ipj h VAL 378 Ca -0.00 -1.98 0.04 0.00 0.82 0.00 0.00 66.70 65.58 1ipj h VAL 378 Cb 0.13 2.71 -0.07 0.00 -1.52 0.00 0.00 31.29 32.55 1ipj h VAL 378 CO 0.01 0.48 -0.49 -0.08 0.02 0.00 0.00 177.57 177.50 1ipj h GLU 379 N -0.94 -0.38 -0.94 1.57 4.81 -1.35 0.47 114.58 117.81 1ipj h GLU 379 Ca -0.00 0.03 0.25 0.00 -0.13 0.00 0.00 59.36 59.50 1ipj h GLU 379 Cb 0.79 0.09 -0.13 0.00 0.63 0.00 0.00 28.75 30.13 1ipj h GLU 379 CO 0.00 -0.25 0.46 -0.09 -0.73 0.00 0.00 179.01 178.40 1ipj h ARG 380 N -0.40 0.40 -0.19 1.92 2.43 -1.65 -0.51 114.38 116.37 1ipj h ARG 380 Ca 0.06 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1ipj h ARG 380 Cb 0.55 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1ipj h ARG 380 CO -0.49 0.26 -0.27 1.25 -1.51 0.00 0.00 179.97 179.21 1ipj h LEU 381 N 0.41 0.57 0.00 3.80 6.46 -0.72 -2.38 115.31 123.44 1ipj h LEU 381 Ca 0.62 -0.51 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 1ipj h LEU 381 Cb 1.23 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.00 1ipj h LEU 381 CO -0.55 0.97 0.00 0.18 -0.62 0.00 0.00 178.44 178.42 1ipj n LEU 382 N -4.38 0.00 -0.04 2.25 4.77 0.14 -1.44 117.00 118.30 1ipj n LEU 382 Ca -0.06 0.14 -0.01 0.00 -0.03 0.00 0.00 56.01 56.06 1ipj n LEU 382 Cb 0.45 -0.14 -0.15 0.00 -2.33 0.00 0.00 43.42 41.25 1ipj n LEU 382 CO 0.43 -0.11 -0.86 1.17 -1.33 0.00 0.00 177.39 176.69 1ipj n LYS 383 N -1.14 0.67 -0.27 3.23 3.00 -0.80 -4.48 118.16 118.37 1ipj n LYS 383 Ca 0.04 -0.04 0.08 0.00 -0.00 0.00 0.00 58.31 58.40 1ipj n LYS 383 Cb 0.04 -1.57 0.22 0.00 0.00 0.00 0.00 35.03 33.72 1ipj n LYS 383 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 1ipj h LYS 384 N 0.00 0.25 -6.66 1.64 1.79 -1.14 -3.38 116.57 109.07 1ipj h LYS 384 Ca -0.28 -0.02 -0.51 0.00 -2.18 0.00 0.00 60.65 57.66 1ipj h LYS 384 Cb 1.68 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 32.27 1ipj h LYS 384 CO 0.02 0.17 0.45 -1.14 -1.08 0.00 0.00 179.45 177.87 1ipj s GLN 385 N -6.00 4.64 -0.03 3.15 2.00 -1.26 -4.94 119.66 117.22 1ipj s GLN 385 Ca -0.12 1.66 0.04 0.00 -2.00 0.00 0.00 55.36 54.93 1ipj s GLN 385 Cb 0.23 -3.29 -0.06 0.00 0.80 0.00 0.00 33.01 30.69 1ipj s GLN 385 CO 0.76 0.15 0.05 0.54 -0.50 0.00 0.00 175.29 176.29 1ipj n ARG 386 N 2.27 2.13 -2.78 1.67 5.12 -1.26 -4.52 116.66 119.29 1ipj n ARG 386 Ca 0.02 -0.02 -0.26 0.00 -1.93 0.00 0.00 57.85 55.66 1ipj n ARG 386 Cb 0.47 -1.11 0.00 0.00 -1.16 0.00 0.00 32.46 30.66 1ipj n ARG 386 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1ipj s GLU 387 N -2.18 3.39 0.16 5.56 2.02 -1.26 -4.57 118.70 121.81 1ipj s GLU 387 Ca -0.02 -0.01 0.10 0.00 0.02 0.00 0.00 54.97 55.06 1ipj s GLU 387 Cb 0.02 -2.43 -0.04 0.00 0.10 0.00 0.00 34.13 31.77 1ipj s GLU 387 CO 0.18 -0.22 -0.21 -1.12 0.02 0.00 0.00 175.26 173.91 1ipj s SER 388 N -4.14 2.95 0.00 -0.19 0.01 -1.26 -2.93 113.70 108.15 1ipj s SER 388 Ca 0.47 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 56.90 1ipj s SER 388 Cb -0.10 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 65.94 1ipj s SER 388 CO 0.42 0.05 0.00 -1.22 0.41 0.00 0.00 173.24 172.90 1ipj n TYR 389 N 0.46 0.00 -5.08 2.43 4.02 -1.26 -4.68 117.16 113.04 1ipj n TYR 389 Ca -0.14 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.42 1ipj n TYR 389 Cb 0.56 0.00 -0.16 0.00 -0.02 0.00 0.00 39.34 39.72 1ipj n TYR 389 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1ipj s PHE 390 N 0.00 2.62 0.25 -0.72 0.08 -1.26 -1.13 117.98 117.81 1ipj s PHE 390 Ca 0.00 -0.82 0.03 0.00 0.12 0.00 0.00 56.93 56.25 1ipj s PHE 390 Cb 0.00 -1.72 -0.05 0.00 -0.57 0.00 0.00 43.02 40.67 1ipj s PHE 390 CO 0.00 -0.29 0.04 0.14 -0.10 0.00 0.00 175.22 175.01 1ipj s VAL 391 N 0.19 0.88 0.09 -0.44 -7.23 -1.16 -4.78 120.40 107.95 1ipj s VAL 391 Ca -0.12 -2.01 -0.21 0.00 -1.81 0.00 0.00 61.98 57.82 1ipj s VAL 391 Cb -0.16 -2.48 -0.07 0.00 0.56 0.00 0.00 36.38 34.23 1ipj s VAL 391 CO 0.07 -0.20 0.63 -0.62 -0.31 0.00 0.00 175.10 174.67 1ipj s ASP 392 N -3.32 7.14 0.00 4.85 3.68 -1.26 -2.20 116.67 125.56 1ipj s ASP 392 Ca 0.32 1.36 0.32 0.00 2.13 0.00 0.00 52.55 56.67 1ipj s ASP 392 Cb 0.07 -2.40 1.84 0.00 -1.45 0.00 0.00 42.92 40.98 1ipj s ASP 392 CO 0.11 0.23 2.19 0.00 0.13 0.00 0.00 175.17 177.83