#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u5r n PRO 13 N 0.00 0.67 -0.30 -0.24 -0.02 -1.26 -4.97 135.00 128.88 1u5r n PRO 13 Ca 0.00 0.25 0.28 0.00 -2.02 0.00 0.00 63.50 62.01 1u5r n PRO 13 Cb 0.00 -1.68 0.63 0.00 -0.02 0.00 0.00 33.50 32.43 1u5r n PRO 13 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1u5r h ASP 14 N 0.67 0.22 -0.87 2.55 3.32 -2.04 -0.10 116.42 120.17 1u5r h ASP 14 Ca -0.43 0.04 0.14 0.00 0.02 0.00 0.00 57.03 56.79 1u5r h ASP 14 Cb 1.39 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.88 1u5r h ASP 14 CO 0.50 0.05 0.56 0.58 -1.72 0.00 0.00 179.24 179.21 1u5r h VAL 15 N 0.20 0.85 -0.05 -1.35 2.07 -1.98 0.57 116.25 116.56 1u5r h VAL 15 Ca 0.55 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.80 1u5r h VAL 15 Cb 1.79 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1u5r h VAL 15 CO -0.15 0.12 -0.12 0.00 0.02 0.00 0.00 177.57 177.44 1u5r h ALA 16 N 1.60 0.08 0.03 1.67 0.00 -1.34 -3.26 119.26 118.04 1u5r h ALA 16 Ca 0.43 -0.35 -0.24 0.00 0.00 0.00 0.00 54.91 54.75 1u5r h ALA 16 Cb 0.68 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1u5r h ALA 16 CO -0.19 -0.03 -1.17 1.05 0.00 0.00 0.00 179.25 178.91 1u5r h GLU 17 N -0.35 0.07 0.00 0.00 4.11 -1.49 -3.38 114.58 113.54 1u5r h GLU 17 Ca -0.00 -0.12 0.00 0.00 0.07 0.00 0.00 59.36 59.31 1u5r h GLU 17 Cb 0.72 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1u5r h GLU 17 CO 0.03 0.99 -0.96 -0.07 0.07 0.00 0.00 179.01 179.07 1u5r h LEU 18 N 0.02 0.00 -9.09 3.06 3.38 -1.07 -3.48 115.31 108.13 1u5r h LEU 18 Ca -0.08 -0.03 -0.66 0.00 0.09 0.00 0.00 57.88 57.20 1u5r h LEU 18 Cb 1.86 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 42.43 1u5r h LEU 18 CO 0.14 0.02 -0.80 -0.36 0.09 0.00 0.00 178.44 177.52 1u5r s PHE 19 N -3.34 2.40 0.47 1.13 0.40 -1.23 -4.31 117.98 113.50 1u5r s PHE 19 Ca 0.00 -0.32 -0.12 0.00 -0.60 0.00 0.00 56.93 55.90 1u5r s PHE 19 Cb 0.10 -1.21 -0.06 0.00 0.51 0.00 0.00 43.02 42.36 1u5r s PHE 19 CO 0.78 0.47 0.86 -0.06 0.70 0.00 0.00 175.22 177.98 1u5r s PHE 20 N -1.56 3.50 -0.99 0.36 0.40 -0.15 -4.87 117.98 114.67 1u5r s PHE 20 Ca 0.21 1.16 0.24 0.00 -0.60 0.00 0.00 56.93 57.94 1u5r s PHE 20 Cb -0.09 -2.55 0.41 0.00 0.51 0.00 0.00 43.02 41.30 1u5r s PHE 20 CO 0.11 -0.27 1.34 1.17 0.70 0.00 0.00 175.22 178.27 1u5r n LYS 21 N -1.67 0.01 -0.75 0.44 0.00 -1.26 -4.51 118.16 110.41 1u5r n LYS 21 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 58.31 58.03 1u5r n LYS 21 Cb 0.54 -1.50 0.15 0.00 0.00 0.00 0.00 35.03 34.22 1u5r n LYS 21 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1u5r n ASP 22 N -1.52 -0.40 -4.50 3.14 8.00 -1.26 -4.94 116.55 115.07 1u5r n ASP 22 Ca 0.05 0.41 -0.43 0.00 0.71 0.00 0.00 54.79 55.53 1u5r n ASP 22 Cb 0.34 -1.39 -0.06 0.00 -0.02 0.00 0.00 41.12 39.99 1u5r n ASP 22 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1u5r s ASP 23 N -2.39 6.32 0.46 -2.24 3.68 -1.26 -4.60 116.67 116.63 1u5r s ASP 23 Ca 0.64 -0.46 0.20 0.00 2.13 0.00 0.00 52.55 55.06 1u5r s ASP 23 Cb -0.23 -2.36 1.18 0.00 -1.45 0.00 0.00 42.92 40.06 1u5r s ASP 23 CO 0.60 -0.98 1.90 1.55 0.13 0.00 0.00 175.17 178.38 1u5r h PRO 24 N 9.07 0.28 0.00 4.34 0.13 -1.92 0.11 132.00 144.00 1u5r h PRO 24 Ca -0.26 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 1u5r h PRO 24 Cb 1.09 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 1u5r h PRO 24 CO 0.99 0.18 -0.04 0.93 -0.23 0.00 0.00 178.00 179.83 1u5r h GLU 25 N 0.29 0.00 0.00 0.86 5.08 -1.92 -1.04 114.58 117.85 1u5r h GLU 25 Ca 0.40 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.71 1u5r h GLU 25 Cb 1.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1u5r h GLU 25 CO -0.10 0.04 -0.96 0.87 -1.00 0.00 0.00 179.01 177.86 1u5r h LYS 26 N 0.00 0.00 0.04 2.33 1.79 -1.39 -3.37 116.57 115.97 1u5r h LYS 26 Ca -0.00 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 58.17 1u5r h LYS 26 Cb 0.10 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.71 1u5r h LYS 26 CO 0.01 0.09 -1.68 -0.07 -1.08 0.00 0.00 179.45 176.71 1u5r h LEU 27 N 0.00 0.14 -8.58 2.94 3.38 -1.09 -3.46 115.31 108.64 1u5r h LEU 27 Ca -0.04 -0.27 -0.69 0.00 0.09 0.00 0.00 57.88 56.97 1u5r h LEU 27 Cb 1.15 -0.05 -0.30 0.00 0.09 0.00 0.00 40.66 41.56 1u5r h LEU 27 CO 0.01 1.24 -0.86 -0.36 0.09 0.00 0.00 178.44 178.56 1u5r s PHE 28 N -2.60 2.48 0.23 1.13 0.40 -0.52 -1.14 117.98 117.95 1u5r s PHE 28 Ca -0.08 -0.58 0.02 0.00 -0.60 0.00 0.00 56.93 55.69 1u5r s PHE 28 Cb 0.08 -1.60 -0.05 0.00 0.51 0.00 0.00 43.02 41.96 1u5r s PHE 28 CO 0.82 -0.12 0.04 -1.54 0.70 0.00 0.00 175.22 175.11 1u5r s SER 29 N -0.31 1.45 -1.19 1.36 1.04 -0.43 -4.80 113.70 110.82 1u5r s SER 29 Ca 0.01 -1.27 -0.03 0.00 0.48 0.00 0.00 55.95 55.14 1u5r s SER 29 Cb -0.13 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.09 1u5r s SER 29 CO 0.02 -0.61 1.01 -0.67 0.98 0.00 0.00 173.24 173.98 1u5r n ASP 30 N -0.40 -3.47 -4.72 7.02 2.03 -1.26 -0.70 116.55 115.06 1u5r n ASP 30 Ca -0.04 -0.56 -0.42 0.00 0.52 0.00 0.00 54.79 54.29 1u5r n ASP 30 Cb 0.65 -4.87 -0.03 0.00 -0.72 0.00 0.00 41.12 36.14 1u5r n ASP 30 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1u5r s LEU 31 N -6.45 4.38 -0.04 -2.67 1.43 -1.26 -4.42 118.68 109.66 1u5r s LEU 31 Ca 0.19 2.33 -0.00 0.00 -1.03 0.00 0.00 54.13 55.63 1u5r s LEU 31 Cb -0.09 -3.59 0.03 0.00 0.03 0.00 0.00 46.19 42.57 1u5r s LEU 31 CO 0.69 -0.63 0.01 -0.13 0.23 0.00 0.00 176.35 176.52 1u5r s ARG 32 N 0.89 0.32 0.26 1.70 0.52 -0.45 -4.94 118.95 117.24 1u5r s ARG 32 Ca 0.63 0.10 -0.31 0.00 -0.52 0.00 0.00 55.73 55.64 1u5r s ARG 32 Cb -0.37 -0.55 -0.12 0.00 0.52 0.00 0.00 34.95 34.44 1u5r s ARG 32 CO 0.32 -0.17 1.65 -2.00 0.02 0.00 0.00 175.30 175.11 1u5r s GLU 33 N 1.24 4.12 0.00 3.54 2.12 -1.26 -0.19 118.70 128.27 1u5r s GLU 33 Ca -0.07 2.59 0.00 0.00 0.36 0.00 0.00 54.97 57.86 1u5r s GLU 33 Cb -0.13 -3.04 0.00 0.00 0.26 0.00 0.00 34.13 31.21 1u5r s GLU 33 CO -0.02 -0.69 0.56 0.44 -0.54 0.00 0.00 175.26 175.01 1u5r n ILE 34 N 2.95 0.27 0.00 -3.70 -5.35 -0.13 -4.83 119.36 108.58 1u5r n ILE 34 Ca 0.11 -0.31 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 1u5r n ILE 34 Cb 0.36 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.27 1u5r n ILE 34 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1u5r n GLY 35 N -0.14 0.91 2.89 3.28 0.00 -1.13 -4.95 105.19 106.06 1u5r n GLY 35 Ca 0.00 -0.73 -0.15 0.00 0.00 0.00 0.00 46.02 45.14 1u5r n GLY 35 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1u5r s HIS 36 N -2.00 0.27 0.15 1.61 2.46 -1.26 -0.80 115.29 115.72 1u5r s HIS 36 Ca 0.00 -0.04 0.00 0.00 0.47 0.00 0.00 55.06 55.50 1u5r s HIS 36 Cb 0.00 -0.23 -0.00 0.00 -0.13 0.00 0.00 32.58 32.22 1u5r s HIS 36 CO 0.00 -0.04 0.02 0.41 -2.47 0.00 0.00 174.74 172.66 1u5r n GLY 37 N 3.32 3.94 0.18 1.59 0.00 0.27 -4.93 105.19 109.56 1u5r n GLY 37 Ca -0.17 -2.17 -0.00 0.00 0.00 0.00 0.00 46.02 43.68 1u5r n GLY 37 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1u5r h SER 38 N 0.43 0.11 -0.02 1.61 4.64 -2.00 -3.11 113.55 115.22 1u5r h SER 38 Ca -0.12 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1u5r h SER 38 Cb 0.40 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1u5r h SER 38 CO 0.20 0.54 -0.43 0.49 -0.87 0.00 0.00 176.83 176.77 1u5r n PHE 39 N -4.00 0.00 -1.97 4.77 3.01 -1.26 -5.03 117.46 112.98 1u5r n PHE 39 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1u5r n PHE 39 Cb 0.48 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.95 1u5r n PHE 39 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1u5r n GLY 40 N 1.40 -0.85 3.96 1.37 0.00 -1.17 -1.89 105.19 108.00 1u5r n GLY 40 Ca 0.10 -1.48 -0.23 0.00 0.00 0.00 0.00 46.02 44.41 1u5r n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u5r s ALA 41 N -1.17 3.61 -0.06 4.61 0.00 -1.26 0.95 121.76 128.44 1u5r s ALA 41 Ca 0.00 -1.15 0.04 0.00 0.00 0.00 0.00 51.96 50.85 1u5r s ALA 41 Cb 0.00 -2.28 -0.02 0.00 0.00 0.00 0.00 23.12 20.82 1u5r s ALA 41 CO 0.00 -0.92 -0.18 0.08 0.00 0.00 0.00 175.76 174.74 1u5r s VAL 42 N -2.93 2.75 0.14 0.00 1.01 0.02 -2.01 120.40 119.37 1u5r s VAL 42 Ca 0.58 -0.83 0.09 0.00 0.00 0.00 0.00 61.98 61.82 1u5r s VAL 42 Cb -0.10 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 1u5r s VAL 42 CO 0.41 0.58 -0.22 -0.31 0.00 0.00 0.00 175.10 175.55 1u5r s TYR 43 N -0.46 1.99 0.11 5.22 1.51 0.25 -0.96 117.35 125.01 1u5r s TYR 43 Ca 0.05 -0.41 -0.24 0.00 -1.01 0.00 0.00 57.07 55.47 1u5r s TYR 43 Cb -0.12 -1.04 -0.07 0.00 -0.11 0.00 0.00 41.96 40.62 1u5r s TYR 43 CO 0.02 0.32 0.71 0.12 -1.11 0.00 0.00 175.55 175.61 1u5r s PHE 44 N -1.48 3.84 0.23 2.71 5.36 0.73 -0.61 117.98 128.77 1u5r s PHE 44 Ca 0.13 1.49 -0.17 0.00 -0.96 0.00 0.00 56.93 57.42 1u5r s PHE 44 Cb -0.08 -2.71 0.01 0.00 -0.34 0.00 0.00 43.02 39.91 1u5r s PHE 44 CO 0.06 0.47 0.56 0.00 -1.46 0.00 0.00 175.22 174.85 1u5r s ALA 45 N -0.85 -0.78 -0.12 11.12 0.00 0.20 -1.35 121.76 129.99 1u5r s ALA 45 Ca 0.34 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.86 1u5r s ALA 45 Cb -0.21 0.92 0.01 0.00 0.00 0.00 0.00 23.12 23.84 1u5r s ALA 45 CO 0.23 -0.88 -0.19 1.03 0.00 0.00 0.00 175.76 175.95 1u5r s ARG 46 N -3.93 2.65 -0.12 0.00 0.52 0.13 0.33 118.95 118.51 1u5r s ARG 46 Ca 0.14 -0.72 -0.30 0.00 -0.52 0.00 0.00 55.73 54.33 1u5r s ARG 46 Cb -0.02 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.28 1u5r s ARG 46 CO 0.04 -0.00 1.14 0.34 0.02 0.00 0.00 175.30 176.83 1u5r s ASP 47 N 0.81 7.08 0.36 0.23 -1.08 0.23 -1.31 116.67 122.99 1u5r s ASP 47 Ca -0.09 1.64 0.16 0.00 -0.52 0.00 0.00 52.55 53.75 1u5r s ASP 47 Cb -0.16 -2.55 0.66 0.00 -1.46 0.00 0.00 42.92 39.41 1u5r s ASP 47 CO 0.00 -0.60 1.74 -0.37 0.52 0.00 0.00 175.17 176.46 1u5r h VAL 48 N 5.21 1.06 -0.18 1.11 -1.51 -1.46 0.75 116.25 121.24 1u5r h VAL 48 Ca -0.29 -1.56 0.05 0.00 -1.23 0.00 0.00 66.70 63.67 1u5r h VAL 48 Cb 1.13 1.90 -0.01 0.00 -2.13 0.00 0.00 31.29 32.18 1u5r h VAL 48 CO 0.91 0.41 0.14 0.03 -1.23 0.00 0.00 177.57 177.83 1u5r h ARG 49 N 0.00 0.00 0.00 5.19 3.08 -1.91 -3.32 114.38 117.42 1u5r h ARG 49 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1u5r h ARG 49 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.92 1u5r h ARG 49 CO 0.05 0.00 -0.05 0.27 -1.07 0.00 0.00 179.97 179.17 1u5r n ASN 50 N -4.31 0.00 -1.26 7.04 6.94 -1.19 -5.00 115.26 117.47 1u5r n ASN 50 Ca 0.01 -1.10 -0.16 0.00 -0.02 0.00 0.00 54.58 53.31 1u5r n ASN 50 Cb 0.27 -0.02 -0.07 0.00 -2.36 0.00 0.00 39.78 37.60 1u5r n ASN 50 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1u5r n SER 51 N 0.00 -5.06 -4.71 0.53 7.64 0.25 -4.96 113.62 107.31 1u5r n SER 51 Ca 0.00 0.41 -0.42 0.00 1.01 0.00 0.00 58.87 59.87 1u5r n SER 51 Cb 0.52 -4.01 -0.03 0.00 -1.01 0.00 0.00 64.21 59.68 1u5r n SER 51 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1u5r s GLU 52 N -3.38 4.47 0.34 1.43 2.56 -1.17 -4.78 118.70 118.18 1u5r s GLU 52 Ca 0.00 1.63 -0.27 0.00 0.00 0.00 0.00 54.97 56.33 1u5r s GLU 52 Cb 0.00 -3.40 -0.09 0.00 2.00 0.00 0.00 34.13 32.63 1u5r s GLU 52 CO 0.00 -0.19 1.13 0.08 -0.56 0.00 0.00 175.26 175.72 1u5r s VAL 53 N 1.13 3.34 0.13 3.70 1.01 -1.26 -0.60 120.40 127.84 1u5r s VAL 53 Ca 0.56 1.23 -0.05 0.00 0.00 0.00 0.00 61.98 63.72 1u5r s VAL 53 Cb -0.26 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 1u5r s VAL 53 CO 0.28 0.21 0.16 0.54 0.00 0.00 0.00 175.10 176.29 1u5r s VAL 54 N -1.31 0.11 -0.07 2.92 0.11 0.15 -4.34 120.40 117.97 1u5r s VAL 54 Ca 0.50 -1.57 0.04 0.00 -2.93 0.00 0.00 61.98 58.02 1u5r s VAL 54 Cb -0.31 -1.79 -0.02 0.00 -1.53 0.00 0.00 36.38 32.73 1u5r s VAL 54 CO 0.40 -0.49 -0.18 0.00 -3.33 0.00 0.00 175.10 171.50 1u5r s ALA 55 N -3.97 2.47 -0.13 1.54 0.00 -0.20 -0.63 121.76 120.84 1u5r s ALA 55 Ca 0.16 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.15 1u5r s ALA 55 Cb 0.05 -0.91 0.02 0.00 0.00 0.00 0.00 23.12 22.28 1u5r s ALA 55 CO -0.02 0.43 -0.17 0.42 0.00 0.00 0.00 175.76 176.42 1u5r s ILE 56 N -0.27 1.66 -0.44 0.00 1.01 0.22 -0.41 121.20 122.97 1u5r s ILE 56 Ca 0.01 -0.73 -0.09 0.00 0.00 0.00 0.00 60.65 59.84 1u5r s ILE 56 Cb -0.13 -1.51 0.10 0.00 0.01 0.00 0.00 42.46 40.93 1u5r s ILE 56 CO 0.03 0.47 0.30 -0.75 0.00 0.00 0.00 174.94 174.99 1u5r s LYS 57 N 1.05 2.55 0.17 2.79 2.20 0.37 0.86 119.74 129.72 1u5r s LYS 57 Ca -0.04 -1.60 -0.29 0.00 -0.36 0.00 0.00 55.97 53.68 1u5r s LYS 57 Cb -0.15 -3.85 -0.07 0.00 -1.51 0.00 0.00 37.83 32.25 1u5r s LYS 57 CO -0.04 -1.07 0.90 0.15 -0.36 0.00 0.00 175.35 174.94 1u5r s LYS 58 N 1.40 4.72 -0.20 4.03 1.02 -0.85 -2.00 119.74 127.85 1u5r s LYS 58 Ca 0.04 1.38 -0.03 0.00 0.02 0.00 0.00 55.97 57.38 1u5r s LYS 58 Cb -0.25 -3.32 0.06 0.00 -0.52 0.00 0.00 37.83 33.81 1u5r s LYS 58 CO 0.01 0.41 0.06 -1.64 -0.92 0.00 0.00 175.35 173.26 1u5r s MET 59 N -0.68 0.51 0.26 1.68 -1.94 -0.03 -3.60 119.30 115.50 1u5r s MET 59 Ca 0.42 -0.41 -0.15 0.00 -1.71 0.00 0.00 55.69 53.84 1u5r s MET 59 Cb -0.24 -2.00 -0.08 0.00 2.01 0.00 0.00 34.83 34.52 1u5r s MET 59 CO 0.29 -0.69 0.68 -1.12 -0.01 0.00 0.00 175.02 174.17 1u5r s SER 60 N 1.91 6.83 -0.12 3.03 0.01 -0.79 -0.82 113.70 123.74 1u5r s SER 60 Ca 0.01 1.22 0.15 0.00 1.31 0.00 0.00 55.95 58.64 1u5r s SER 60 Cb -0.17 -2.35 0.34 0.00 0.21 0.00 0.00 66.02 64.06 1u5r s SER 60 CO -0.11 -0.08 1.17 0.00 0.41 0.00 0.00 173.24 174.62 1u5r n TYR 61 N 0.10 0.00 -0.09 2.43 0.18 0.17 -4.88 117.16 115.07 1u5r n TYR 61 Ca 0.00 -0.97 0.00 0.00 1.88 0.00 0.00 57.90 58.81 1u5r n TYR 61 Cb 0.52 -0.18 0.00 0.00 -0.38 0.00 0.00 39.34 39.30 1u5r n TYR 61 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 1u5r n SER 62 N -0.67 -0.19 -0.40 9.48 3.41 -1.25 -3.76 113.62 120.24 1u5r n SER 62 Ca 0.13 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1u5r n SER 62 Cb 0.79 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.74 1u5r n SER 62 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u5r n GLY 63 N 2.37 -0.36 2.50 5.00 0.00 -1.26 -3.92 105.19 109.52 1u5r n GLY 63 Ca 0.00 -1.00 -0.27 0.00 0.00 0.00 0.00 46.02 44.75 1u5r n GLY 63 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1u5r n LYS 64 N -0.79 2.60 0.00 1.61 3.00 -1.26 -4.22 118.16 119.10 1u5r n LYS 64 Ca 0.00 -4.67 0.00 0.00 -0.00 0.00 0.00 58.31 53.64 1u5r n LYS 64 Cb 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 35.03 32.80 1u5r n LYS 64 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1u5r n GLN 65 N 0.67 0.00 -0.25 1.64 1.13 -1.26 -4.99 117.38 114.32 1u5r n GLN 65 Ca 0.30 -0.01 -0.07 0.00 -1.94 0.00 0.00 57.00 55.29 1u5r n GLN 65 Cb 0.41 -0.12 -0.06 0.00 0.11 0.00 0.00 30.24 30.58 1u5r n GLN 65 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1u5r n SER 66 N 0.00 -0.64 0.26 1.08 3.41 -1.25 0.44 113.62 116.93 1u5r n SER 66 Ca 0.00 1.27 0.16 0.00 -0.26 0.00 0.00 58.87 60.04 1u5r n SER 66 Cb 0.26 -0.24 0.74 0.00 -0.26 0.00 0.00 64.21 64.71 1u5r n SER 66 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1u5r h ASN 67 N 0.00 0.00 0.00 4.04 2.35 -1.94 1.25 115.58 121.28 1u5r h ASN 67 Ca 0.10 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.56 1u5r h ASN 67 Cb 0.25 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.57 1u5r h ASN 67 CO -0.57 0.00 -1.58 -0.62 -1.65 0.00 0.00 177.43 173.01 1u5r n GLU 68 N -3.08 0.57 -0.26 0.81 4.71 0.17 -3.28 120.64 120.28 1u5r n GLU 68 Ca 0.01 0.50 0.00 0.00 -0.01 0.00 0.00 57.16 57.66 1u5r n GLU 68 Cb 0.51 -1.68 0.22 0.00 -1.01 0.00 0.00 31.44 29.47 1u5r n GLU 68 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 1u5r h LYS 69 N -1.00 1.06 -0.11 3.49 1.57 0.48 -1.70 116.57 120.36 1u5r h LYS 69 Ca -0.44 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.27 1u5r h LYS 69 Cb 1.38 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1u5r h LYS 69 CO -0.26 0.70 0.05 2.35 -0.57 0.00 0.00 179.45 181.72 1u5r h TRP 70 N 1.09 0.17 -0.77 -1.35 2.91 0.13 -0.61 115.95 117.53 1u5r h TRP 70 Ca 0.31 -0.01 0.12 0.00 1.13 0.00 0.00 58.89 60.43 1u5r h TRP 70 Cb -0.10 -0.05 -0.08 0.00 -0.51 0.00 0.00 29.16 28.42 1u5r h TRP 70 CO -0.00 0.24 0.37 1.96 -1.03 0.00 0.00 178.44 179.98 1u5r h GLN 71 N 0.05 0.57 -0.53 2.65 1.08 -1.37 0.14 115.11 117.71 1u5r h GLN 71 Ca 0.04 -0.03 -0.12 0.00 -1.45 0.00 0.00 58.65 57.08 1u5r h GLN 71 Cb 0.14 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.42 1u5r h GLN 71 CO -0.00 0.38 -0.14 -0.44 -0.95 0.00 0.00 178.83 177.67 1u5r h ASP 72 N 0.59 1.04 0.09 1.46 3.45 -1.04 -1.81 116.42 120.20 1u5r h ASP 72 Ca 0.40 -0.37 -0.00 0.00 0.43 0.00 0.00 57.03 57.49 1u5r h ASP 72 Cb 0.49 -0.28 0.00 0.00 -0.56 0.00 0.00 39.33 38.98 1u5r h ASP 72 CO -0.32 1.17 -0.04 0.40 -1.57 0.00 0.00 179.24 178.88 1u5r h ILE 73 N 0.90 0.94 -0.68 0.35 2.04 0.00 -2.38 117.51 118.68 1u5r h ILE 73 Ca 0.13 -0.09 0.08 0.00 1.00 0.00 0.00 64.86 65.98 1u5r h ILE 73 Cb 0.72 1.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.73 1u5r h ILE 73 CO 0.06 0.02 0.36 0.40 0.00 0.00 0.00 178.15 178.98 1u5r h ILE 74 N -0.16 0.90 -0.49 -0.67 1.08 -0.65 -0.97 117.51 116.55 1u5r h ILE 74 Ca -0.01 -0.22 -0.00 0.00 -0.39 0.00 0.00 64.86 64.24 1u5r h ILE 74 Cb 0.13 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 34.07 1u5r h ILE 74 CO 0.02 0.12 0.30 0.11 -0.69 0.00 0.00 178.15 178.00 1u5r h LYS 75 N 0.63 0.67 -0.74 2.37 1.57 -1.18 0.97 116.57 120.86 1u5r h LYS 75 Ca 0.32 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 59.00 1u5r h LYS 75 Cb 0.28 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1u5r h LYS 75 CO -0.23 0.49 0.31 1.49 -0.57 0.00 0.00 179.45 180.94 1u5r h GLU 76 N 0.66 1.10 -0.47 3.15 4.81 -0.87 -0.63 114.58 122.32 1u5r h GLU 76 Ca 0.18 -0.19 -0.12 0.00 -0.13 0.00 0.00 59.36 59.10 1u5r h GLU 76 Cb -0.01 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1u5r h GLU 76 CO -0.03 0.89 -0.18 0.28 -0.73 0.00 0.00 179.01 179.24 1u5r h VAL 77 N 1.06 1.27 -0.48 0.32 2.07 -0.87 -1.31 116.25 118.31 1u5r h VAL 77 Ca 0.25 -1.33 0.04 0.00 0.82 0.00 0.00 66.70 66.47 1u5r h VAL 77 Cb 0.19 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1u5r h VAL 77 CO -0.02 0.46 0.25 -0.09 0.02 0.00 0.00 177.57 178.19 1u5r h ARG 78 N 0.80 0.48 -0.22 1.57 9.65 -0.42 -2.08 114.38 124.16 1u5r h ARG 78 Ca 0.11 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 58.94 1u5r h ARG 78 Cb 0.75 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.21 1u5r h ARG 78 CO 0.06 0.32 0.07 0.35 2.80 0.00 0.00 179.97 183.57 1u5r h PHE 79 N 0.50 0.35 -0.61 2.20 3.57 -0.96 -3.14 116.94 118.84 1u5r h PHE 79 Ca 0.20 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.68 1u5r h PHE 79 Cb 0.09 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 1u5r h PHE 79 CO -0.09 0.41 0.40 -0.07 -2.23 0.00 0.00 178.31 176.73 1u5r h LEU 80 N 0.18 0.71 -1.67 0.59 3.38 -0.95 -2.45 115.31 115.10 1u5r h LEU 80 Ca 0.07 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1u5r h LEU 80 Cb 0.22 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1u5r h LEU 80 CO -0.00 0.52 -0.19 -0.61 0.09 0.00 0.00 178.44 178.24 1u5r h GLN 81 N 0.83 0.00 0.00 1.13 4.15 -1.33 -2.95 115.11 116.94 1u5r h GLN 81 Ca 0.22 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.58 1u5r h GLN 81 Cb -0.09 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 1u5r h GLN 81 CO -0.05 0.19 -0.31 0.87 -1.93 0.00 0.00 178.83 177.60 1u5r h LYS 82 N 0.00 0.00 -6.37 1.69 1.57 -1.47 -3.47 116.57 108.53 1u5r h LYS 82 Ca -0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 1u5r h LYS 82 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1u5r h LYS 82 CO 0.02 0.31 0.71 -0.51 -0.57 0.00 0.00 179.45 179.42 1u5r s LEU 83 N -6.58 4.31 -0.41 2.94 1.43 -1.11 -4.99 118.68 114.27 1u5r s LEU 83 Ca 0.03 1.94 0.05 0.00 -1.03 0.00 0.00 54.13 55.12 1u5r s LEU 83 Cb 0.08 -3.56 0.19 0.00 0.03 0.00 0.00 46.19 42.93 1u5r s LEU 83 CO 0.69 -0.60 0.39 0.54 0.23 0.00 0.00 176.35 177.60 1u5r n ARG 84 N 4.98 0.31 -3.77 1.70 1.74 -1.26 -4.85 116.66 115.50 1u5r n ARG 84 Ca 0.11 -3.14 -0.13 0.00 -0.77 0.00 0.00 57.85 53.92 1u5r n ARG 84 Cb 0.45 -1.56 -0.11 0.00 -1.02 0.00 0.00 32.46 30.22 1u5r n ARG 84 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1u5r s HIS 85 N -0.18 -0.31 0.58 -1.55 2.46 -1.26 -5.05 115.29 109.98 1u5r s HIS 85 Ca 0.33 0.76 0.28 0.00 0.47 0.00 0.00 55.06 56.90 1u5r s HIS 85 Cb 0.07 0.10 1.71 0.00 -0.13 0.00 0.00 32.58 34.33 1u5r s HIS 85 CO -0.18 -0.16 2.18 -1.00 -2.47 0.00 0.00 174.74 173.12 1u5r h PRO 86 N 5.84 0.00 -0.68 2.88 0.13 -1.98 -2.62 132.00 135.56 1u5r h PRO 86 Ca -0.27 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.76 1u5r h PRO 86 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 1u5r h PRO 86 CO 0.33 0.00 0.12 0.09 -0.23 0.00 0.00 178.00 178.32 1u5r n ASN 87 N -3.88 5.16 -4.28 1.44 4.13 -1.26 -4.79 115.26 111.77 1u5r n ASN 87 Ca -0.01 -3.01 -0.25 0.00 1.68 0.00 0.00 54.58 52.99 1u5r n ASN 87 Cb 0.19 -0.71 -0.13 0.00 -1.54 0.00 0.00 39.78 37.60 1u5r n ASN 87 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1u5r s THR 88 N -2.77 1.73 0.35 3.41 -4.23 -0.99 -0.54 115.64 112.60 1u5r s THR 88 Ca 0.52 -1.44 -0.29 0.00 -1.18 0.00 0.00 61.69 59.30 1u5r s THR 88 Cb 0.41 -1.55 -0.11 0.00 1.34 0.00 0.00 72.50 72.59 1u5r s THR 88 CO 0.14 0.04 1.54 -0.51 -0.54 0.00 0.00 174.62 175.28 1u5r s ILE 89 N -1.04 2.01 -0.09 2.99 1.10 0.20 -4.75 121.20 121.62 1u5r s ILE 89 Ca 0.07 0.01 -0.30 0.00 -0.51 0.00 0.00 60.65 59.92 1u5r s ILE 89 Cb -0.10 -3.01 -0.02 0.00 0.15 0.00 0.00 42.46 39.49 1u5r s ILE 89 CO 0.03 0.00 1.15 -1.58 -2.11 0.00 0.00 174.94 172.44 1u5r s GLN 90 N -1.56 4.35 -0.09 3.50 0.74 -1.26 -4.97 119.66 120.37 1u5r s GLN 90 Ca 0.57 1.59 -0.18 0.00 0.05 0.00 0.00 55.36 57.39 1u5r s GLN 90 Cb -0.47 -3.58 -0.05 0.00 1.10 0.00 0.00 33.01 30.01 1u5r s GLN 90 CO 0.58 -0.45 0.47 -0.47 -0.55 0.00 0.00 175.29 174.88 1u5r s TYR 91 N 2.33 3.56 -1.37 1.67 5.04 -1.26 -1.10 117.35 126.22 1u5r s TYR 91 Ca 0.53 0.93 0.11 0.00 -2.44 0.00 0.00 57.07 56.20 1u5r s TYR 91 Cb -0.22 -2.51 0.10 0.00 0.35 0.00 0.00 41.96 39.67 1u5r s TYR 91 CO 0.19 0.26 0.87 0.54 -1.34 0.00 0.00 175.55 176.08 1u5r n ARG 92 N 3.31 0.67 0.00 4.97 1.74 0.58 -4.93 116.66 123.00 1u5r n ARG 92 Ca -0.08 -1.21 0.00 0.00 -0.77 0.00 0.00 57.85 55.79 1u5r n ARG 92 Cb 0.52 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.74 1u5r n ARG 92 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1u5r n GLY 93 N 0.62 3.55 3.24 -0.13 0.00 -1.21 -4.93 105.19 106.33 1u5r n GLY 93 Ca 0.07 -1.85 -0.28 0.00 0.00 0.00 0.00 46.02 43.96 1u5r n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u5r s TYR 95 N -0.52 1.96 -0.06 0.00 1.51 0.27 -0.97 117.35 119.55 1u5r s TYR 95 Ca 0.08 -0.54 0.02 0.00 -1.01 0.00 0.00 57.07 55.63 1u5r s TYR 95 Cb -0.08 -0.96 0.01 0.00 -0.11 0.00 0.00 41.96 40.82 1u5r s TYR 95 CO -0.01 0.45 -0.11 -0.51 -1.11 0.00 0.00 175.55 174.26 1u5r s LEU 96 N -3.42 1.61 -0.17 -1.29 1.43 -1.26 0.66 118.68 116.24 1u5r s LEU 96 Ca 0.27 -0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1u5r s LEU 96 Cb -0.00 -0.73 0.08 0.00 0.03 0.00 0.00 46.19 45.56 1u5r s LEU 96 CO 0.11 0.02 0.18 -0.60 0.23 0.00 0.00 176.35 176.29 1u5r s ARG 97 N 0.64 0.13 -0.33 1.70 6.06 -0.61 -4.82 118.95 121.72 1u5r s ARG 97 Ca -0.13 0.22 -0.29 0.00 -2.50 0.00 0.00 55.73 53.04 1u5r s ARG 97 Cb -0.15 -1.13 0.04 0.00 0.06 0.00 0.00 34.95 33.78 1u5r s ARG 97 CO 0.03 -0.58 0.49 -0.85 -2.50 0.00 0.00 175.30 171.89 1u5r n GLU 98 N 5.31 -1.41 -0.96 5.12 0.28 -1.26 -1.32 120.64 126.40 1u5r n GLU 98 Ca -0.06 1.05 0.00 0.00 -0.16 0.00 0.00 57.16 58.00 1u5r n GLU 98 Cb 0.49 -1.47 0.00 0.00 1.43 0.00 0.00 31.44 31.89 1u5r n GLU 98 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1u5r n HIS 99 N -0.10 0.00 -3.87 -1.84 8.25 -1.26 -4.94 115.22 111.45 1u5r n HIS 99 Ca -0.07 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.11 1u5r n HIS 99 Cb 0.51 -1.71 -0.16 0.00 1.12 0.00 0.00 29.99 29.75 1u5r n HIS 99 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1u5r s THR 100 N -1.15 1.08 0.04 1.59 2.01 -0.43 -0.66 115.64 118.12 1u5r s THR 100 Ca 0.00 -0.70 -0.26 0.00 0.31 0.00 0.00 61.69 61.04 1u5r s THR 100 Cb 0.00 -1.32 -0.05 0.00 0.01 0.00 0.00 72.50 71.14 1u5r s THR 100 CO 0.00 0.05 0.82 0.00 -0.69 0.00 0.00 174.62 174.80 1u5r s ALA 101 N 1.63 3.32 -0.46 7.40 0.00 -0.01 -1.57 121.76 132.08 1u5r s ALA 101 Ca -0.00 0.35 -0.11 0.00 0.00 0.00 0.00 51.96 52.19 1u5r s ALA 101 Cb -0.16 -3.08 0.10 0.00 0.00 0.00 0.00 23.12 19.98 1u5r s ALA 101 CO -0.07 -0.00 0.35 -1.58 0.00 0.00 0.00 175.76 174.45 1u5r s TRP 102 N 0.16 3.34 -0.41 0.00 0.52 0.21 -0.85 118.94 121.90 1u5r s TRP 102 Ca 0.41 -1.50 -0.19 0.00 0.02 0.00 0.00 56.10 54.84 1u5r s TRP 102 Cb -0.21 -3.29 0.02 0.00 -1.15 0.00 0.00 33.47 28.84 1u5r s TRP 102 CO 0.24 -0.91 0.58 -1.17 0.02 0.00 0.00 176.95 175.71 1u5r s LEU 103 N 1.47 4.54 -0.16 2.99 0.20 -0.85 -0.56 118.68 126.31 1u5r s LEU 103 Ca 0.04 -0.33 -0.08 0.00 0.69 0.00 0.00 54.13 54.45 1u5r s LEU 103 Cb -0.25 -2.63 -0.04 0.00 -0.43 0.00 0.00 46.19 42.83 1u5r s LEU 103 CO 0.02 -0.67 0.13 -0.69 -0.29 0.00 0.00 176.35 174.85 1u5r s VAL 104 N 2.59 5.45 0.17 1.68 1.01 -0.30 -0.48 120.40 130.53 1u5r s VAL 104 Ca 0.20 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1u5r s VAL 104 Cb -0.15 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 1u5r s VAL 104 CO 0.17 0.54 0.05 -0.04 0.00 0.00 0.00 175.10 175.82 1u5r s MET 105 N -0.40 1.08 0.72 2.72 -1.94 0.45 -0.30 119.30 121.63 1u5r s MET 105 Ca 0.12 -1.54 -0.15 0.00 -1.71 0.00 0.00 55.69 52.41 1u5r s MET 105 Cb -0.12 0.02 0.03 0.00 2.01 0.00 0.00 34.83 36.78 1u5r s MET 105 CO 0.01 -0.24 1.20 -1.83 -0.01 0.00 0.00 175.02 174.15 1u5r s GLU 106 N -4.02 2.21 -0.04 2.03 -1.05 -0.25 -1.03 118.70 116.55 1u5r s GLU 106 Ca 0.28 1.72 -0.20 0.00 -0.15 0.00 0.00 54.97 56.62 1u5r s GLU 106 Cb 0.07 -1.85 -0.05 0.00 -0.44 0.00 0.00 34.13 31.86 1u5r s GLU 106 CO 0.05 -1.77 0.55 -0.47 0.95 0.00 0.00 175.26 174.57 1u5r s TYR 107 N -2.02 3.64 0.03 4.83 5.04 -1.26 -4.25 117.35 123.37 1u5r s TYR 107 Ca 0.74 1.10 0.07 0.00 -2.44 0.00 0.00 57.07 56.54 1u5r s TYR 107 Cb -0.28 -2.58 -0.03 0.00 0.35 0.00 0.00 41.96 39.42 1u5r s TYR 107 CO 0.45 0.32 -0.18 0.00 -1.34 0.00 0.00 175.55 174.80 1u5r h LEU 109 N 4.60 0.51 0.00 0.00 4.07 -1.71 -3.48 115.31 119.29 1u5r h LEU 109 Ca -0.47 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.48 1u5r h LEU 109 Cb 1.15 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 42.77 1u5r h LEU 109 CO 0.48 0.35 0.00 0.61 -1.08 0.00 0.00 178.44 178.80 1u5r n GLY 110 N -1.47 -1.79 3.99 0.83 0.00 -1.25 -4.29 105.19 101.21 1u5r n GLY 110 Ca 0.05 -1.13 -0.19 0.00 0.00 0.00 0.00 46.02 44.76 1u5r n GLY 110 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u5r s SER 111 N -0.26 5.45 0.39 1.61 1.04 -1.26 -0.77 113.70 119.91 1u5r s SER 111 Ca 0.00 -0.22 0.09 0.00 0.48 0.00 0.00 55.95 56.30 1u5r s SER 111 Cb 0.00 -0.75 0.81 0.00 0.10 0.00 0.00 66.02 66.18 1u5r s SER 111 CO 0.00 -0.96 1.94 0.00 0.98 0.00 0.00 173.24 175.20 1u5r h ALA 112 N 0.34 1.55 -0.71 5.32 0.00 -0.48 -1.93 119.26 123.35 1u5r h ALA 112 Ca -0.41 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.26 1u5r h ALA 112 Cb 1.29 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1u5r h ALA 112 CO 0.48 0.33 0.19 1.03 0.00 0.00 0.00 179.25 181.28 1u5r h SER 113 N 0.26 1.07 -0.78 0.00 0.87 -1.75 -2.38 113.55 110.84 1u5r h SER 113 Ca 0.06 -0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.38 1u5r h SER 113 Cb 0.30 -0.28 -0.04 0.00 -0.44 0.00 0.00 62.40 61.95 1u5r h SER 113 CO 0.01 1.01 0.45 0.44 -0.53 0.00 0.00 176.83 178.22 1u5r h ASP 114 N 1.07 0.96 -0.79 6.23 3.32 -1.67 -1.27 116.42 124.28 1u5r h ASP 114 Ca 0.23 -0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.17 1u5r h ASP 114 Cb 0.35 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1u5r h ASP 114 CO -0.00 0.76 0.33 -0.07 -1.72 0.00 0.00 179.24 178.54 1u5r h LEU 115 N 1.09 1.07 -0.56 1.55 3.38 -1.14 -0.77 115.31 119.93 1u5r h LEU 115 Ca 0.28 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1u5r h LEU 115 Cb -0.01 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1u5r h LEU 115 CO -0.05 0.94 0.07 -0.07 0.09 0.00 0.00 178.44 179.42 1u5r h LEU 116 N 1.13 0.91 -0.62 1.67 3.38 -0.92 -2.66 115.31 118.20 1u5r h LEU 116 Ca 0.26 -0.27 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 1u5r h LEU 116 Cb 0.19 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1u5r h LEU 116 CO -0.02 0.95 -0.47 -0.08 0.09 0.00 0.00 178.44 178.90 1u5r h GLU 117 N 0.84 0.53 -0.25 1.13 4.81 -0.99 -1.34 114.58 119.30 1u5r h GLU 117 Ca 0.17 -0.30 -0.05 0.00 -0.13 0.00 0.00 59.36 59.05 1u5r h GLU 117 Cb 0.44 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1u5r h GLU 117 CO 0.01 0.89 -0.04 0.28 -0.73 0.00 0.00 179.01 179.42 1u5r h VAL 118 N 0.42 1.27 0.00 0.32 2.07 -1.08 -3.18 116.25 116.08 1u5r h VAL 118 Ca 0.02 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.53 1u5r h VAL 118 Cb 0.99 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1u5r h VAL 118 CO 0.09 0.32 -0.38 1.41 0.02 0.00 0.00 177.57 179.02 1u5r n HIS 119 N -4.58 0.39 -2.70 1.57 8.25 -1.01 -4.91 115.22 112.23 1u5r n HIS 119 Ca -0.04 0.11 -0.17 0.00 -0.26 0.00 0.00 57.72 57.37 1u5r n HIS 119 Cb 0.28 -0.58 -0.00 0.00 1.12 0.00 0.00 29.99 30.81 1u5r n HIS 119 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1u5r n LYS 120 N -1.88 -2.73 -3.67 -0.41 4.76 -0.51 -4.92 118.16 108.82 1u5r n LYS 120 Ca 0.05 0.65 -0.10 0.00 -2.87 0.00 0.00 58.31 56.04 1u5r n LYS 120 Cb 0.39 -5.32 -0.05 0.00 -1.84 0.00 0.00 35.03 28.22 1u5r n LYS 120 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1u5r s LYS 121 N -5.32 1.04 0.77 1.97 1.02 -1.23 -5.08 119.74 112.92 1u5r s LYS 121 Ca 0.12 -0.75 -0.11 0.00 0.02 0.00 0.00 55.97 55.25 1u5r s LYS 121 Cb -0.06 0.45 0.05 0.00 -0.52 0.00 0.00 37.83 37.76 1u5r s LYS 121 CO 0.15 -0.40 1.08 -2.14 -0.92 0.00 0.00 175.35 173.13 1u5r s PRO 122 N -3.81 2.30 0.66 -1.68 0.02 -1.26 -4.68 135.00 126.54 1u5r s PRO 122 Ca 0.03 0.78 -0.10 0.00 0.02 0.00 0.00 61.00 61.73 1u5r s PRO 122 Cb 0.02 -1.93 0.01 0.00 0.02 0.00 0.00 34.50 32.62 1u5r s PRO 122 CO -0.12 -1.50 1.03 -0.51 -0.33 0.00 0.00 177.00 175.57 1u5r s LEU 123 N -5.74 3.04 0.66 -5.54 1.43 -1.00 -5.04 118.68 106.49 1u5r s LEU 123 Ca 0.60 1.03 -0.16 0.00 -1.03 0.00 0.00 54.13 54.58 1u5r s LEU 123 Cb -0.15 -3.86 -0.00 0.00 0.03 0.00 0.00 46.19 42.22 1u5r s LEU 123 CO 0.55 -1.21 1.13 -1.10 0.23 0.00 0.00 176.35 175.95 1u5r s GLN 124 N -5.23 2.74 0.24 1.70 -0.21 -1.26 -4.80 119.66 112.84 1u5r s GLN 124 Ca 0.56 1.49 -0.06 0.00 0.02 0.00 0.00 55.36 57.37 1u5r s GLN 124 Cb -0.11 -1.93 0.28 0.00 1.00 0.00 0.00 33.01 32.25 1u5r s GLN 124 CO 0.50 -1.31 1.88 1.49 -2.12 0.00 0.00 175.29 175.72 1u5r h GLU 125 N 0.12 1.06 -0.17 2.91 4.81 -1.99 -0.89 114.58 120.43 1u5r h GLU 125 Ca -0.47 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.68 1u5r h GLU 125 Cb 1.26 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.39 1u5r h GLU 125 CO 0.54 0.70 0.05 -0.24 -0.73 0.00 0.00 179.01 179.32 1u5r h VAL 126 N 1.09 1.08 -0.13 0.32 3.04 -1.99 0.18 116.25 119.84 1u5r h VAL 126 Ca 0.36 -0.29 -0.22 0.00 -1.01 0.00 0.00 66.70 65.54 1u5r h VAL 126 Cb 0.03 0.90 0.01 0.00 -2.01 0.00 0.00 31.29 30.23 1u5r h VAL 126 CO -0.13 0.10 -0.79 -0.33 -1.01 0.00 0.00 177.57 175.42 1u5r h GLU 127 N 0.24 0.77 -0.57 4.17 5.08 -1.57 -1.40 114.58 121.30 1u5r h GLU 127 Ca 0.06 -0.65 -0.05 0.00 -1.00 0.00 0.00 59.36 57.72 1u5r h GLU 127 Cb 0.09 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1u5r h GLU 127 CO -0.00 1.25 0.15 0.82 -1.00 0.00 0.00 179.01 180.23 1u5r h ILE 128 N 0.49 1.23 -0.36 3.13 2.04 -0.15 -0.58 117.51 123.31 1u5r h ILE 128 Ca -0.06 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 1u5r h ILE 128 Cb 1.42 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 1u5r h ILE 128 CO 0.16 0.31 0.15 0.00 0.00 0.00 0.00 178.15 178.77 1u5r h ALA 129 N 1.32 0.47 -0.13 1.87 0.00 -0.52 0.25 119.26 122.53 1u5r h ALA 129 Ca 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1u5r h ALA 129 Cb 0.29 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1u5r h ALA 129 CO -0.00 0.06 0.05 0.00 0.00 0.00 0.00 179.25 179.36 1u5r h ALA 130 N 1.00 0.17 -0.47 0.00 0.00 -0.81 0.25 119.26 119.40 1u5r h ALA 130 Ca 0.12 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1u5r h ALA 130 Cb 0.17 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1u5r h ALA 130 CO -0.01 -0.24 0.28 0.28 0.00 0.00 0.00 179.25 179.55 1u5r h VAL 131 N 0.06 1.15 -0.84 0.00 2.07 -1.01 -1.96 116.25 115.71 1u5r h VAL 131 Ca 0.04 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 1u5r h VAL 131 Cb 0.16 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 1u5r h VAL 131 CO -0.00 0.15 0.50 0.74 0.02 0.00 0.00 177.57 178.98 1u5r h THR 132 N 0.62 1.23 -0.21 2.57 2.02 -0.29 -2.21 112.91 116.65 1u5r h THR 132 Ca 0.17 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 1u5r h THR 132 Cb 0.00 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.46 1u5r h THR 132 CO -0.03 0.25 0.10 -0.74 0.37 0.00 0.00 175.52 175.47 1u5r h HIS 133 N 1.16 0.31 -0.24 3.16 2.76 -0.63 -0.54 115.15 121.12 1u5r h HIS 133 Ca 0.30 -0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.47 1u5r h HIS 133 Cb -0.04 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 28.80 1u5r h HIS 133 CO -0.00 0.32 0.12 0.78 -1.30 0.00 0.00 177.93 177.85 1u5r h GLY 134 N 0.21 0.32 1.43 5.26 0.00 -1.14 -1.09 103.07 108.06 1u5r h GLY 134 Ca 0.07 -0.09 -0.07 0.00 0.00 0.00 0.00 47.33 47.24 1u5r h GLY 134 CO -0.01 0.08 -0.03 0.00 0.00 0.00 0.00 176.54 176.57 1u5r h ALA 135 N 1.12 1.16 -0.40 3.60 0.00 -1.34 -2.00 119.26 121.40 1u5r h ALA 135 Ca 0.10 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1u5r h ALA 135 Cb 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1u5r h ALA 135 CO -0.07 0.54 0.11 1.25 0.00 0.00 0.00 179.25 181.08 1u5r h LEU 136 N 0.65 0.60 -0.99 0.00 5.85 -0.74 -0.64 115.31 120.04 1u5r h LEU 136 Ca 0.13 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1u5r h LEU 136 Cb 0.45 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 1u5r h LEU 136 CO 0.02 0.66 0.64 1.56 -0.34 0.00 0.00 178.44 180.98 1u5r h GLN 137 N 0.50 1.31 -0.63 1.25 4.20 -0.90 0.18 115.11 121.02 1u5r h GLN 137 Ca 0.13 -0.09 -0.05 0.00 0.06 0.00 0.00 58.65 58.70 1u5r h GLN 137 Cb 0.29 -0.29 -0.03 0.00 0.30 0.00 0.00 27.48 27.75 1u5r h GLN 137 CO -0.00 0.89 0.21 0.78 -0.67 0.00 0.00 178.83 180.03 1u5r h GLY 138 N 1.35 1.05 1.07 3.46 0.00 -0.96 -1.90 103.07 107.14 1u5r h GLY 138 Ca 0.36 -0.62 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 1u5r h GLY 138 CO -0.07 0.58 0.00 1.41 0.00 0.00 0.00 176.54 178.45 1u5r h LEU 139 N 0.91 1.03 -0.92 3.11 3.38 -0.52 -1.42 115.31 120.88 1u5r h LEU 139 Ca 0.21 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 1u5r h LEU 139 Cb 0.28 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1u5r h LEU 139 CO -0.01 1.09 0.13 0.00 0.09 0.00 0.00 178.44 179.73 1u5r h ALA 140 N 0.98 1.12 0.49 1.53 0.00 -0.82 0.12 119.26 122.67 1u5r h ALA 140 Ca 0.17 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1u5r h ALA 140 Cb 0.56 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1u5r h ALA 140 CO 0.03 0.59 -0.26 -0.92 0.00 0.00 0.00 179.25 178.69 1u5r h TYR 141 N 0.88 -0.68 -0.53 0.00 3.20 -1.04 -1.38 116.97 117.42 1u5r h TYR 141 Ca 0.19 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.11 1u5r h TYR 141 Cb 0.34 0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.79 1u5r h TYR 141 CO 0.02 -0.41 0.21 -0.07 -1.64 0.00 0.00 178.16 176.27 1u5r h LEU 142 N -0.70 0.24 -1.01 2.82 3.38 -0.80 -2.54 115.31 116.71 1u5r h LEU 142 Ca -0.06 0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1u5r h LEU 142 Cb 0.55 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1u5r h LEU 142 CO 0.09 0.17 -0.15 0.45 0.09 0.00 0.00 178.44 179.08 1u5r h HIS 143 N 0.41 0.58 0.00 1.13 3.86 -0.66 -0.66 115.15 119.81 1u5r h HIS 143 Ca 0.25 -0.10 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 1u5r h HIS 143 Cb 0.25 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.57 1u5r h HIS 143 CO -0.15 0.66 -0.04 0.66 0.86 0.00 0.00 177.93 179.93 1u5r h SER 144 N 0.49 0.00 -0.65 2.45 4.64 -0.82 0.61 113.55 120.27 1u5r h SER 144 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1u5r h SER 144 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1u5r h SER 144 CO 0.03 0.04 0.00 1.41 -0.87 0.00 0.00 176.83 177.44 1u5r n HIS 145 N -3.35 1.60 -2.17 4.77 -0.00 -0.68 -4.92 115.22 110.47 1u5r n HIS 145 Ca -0.02 -0.63 -0.17 0.00 -0.00 0.00 0.00 57.72 56.90 1u5r n HIS 145 Cb 0.17 -0.28 -0.02 0.00 -0.00 0.00 0.00 29.99 29.85 1u5r n HIS 145 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 1u5r n ASN 146 N 1.10 -5.08 -4.83 0.41 5.15 0.21 -4.94 115.26 107.28 1u5r n ASN 146 Ca 0.27 0.07 -0.22 0.00 -0.60 0.00 0.00 54.58 54.10 1u5r n ASN 146 Cb 0.95 -4.15 -0.04 0.00 -0.53 0.00 0.00 39.78 36.00 1u5r n ASN 146 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 1u5r s MET 147 N -4.59 2.72 -0.02 1.20 -1.94 -0.34 -2.64 119.30 113.69 1u5r s MET 147 Ca 0.00 -1.27 0.00 0.00 -1.71 0.00 0.00 55.69 52.71 1u5r s MET 147 Cb 0.00 -2.46 0.02 0.00 2.01 0.00 0.00 34.83 34.41 1u5r s MET 147 CO 0.00 0.17 0.02 0.42 -0.01 0.00 0.00 175.02 175.62 1u5r s ILE 148 N -2.28 0.03 -0.04 2.53 1.01 -0.74 -3.77 121.20 117.94 1u5r s ILE 148 Ca 0.39 0.14 -0.26 0.00 0.00 0.00 0.00 60.65 60.92 1u5r s ILE 148 Cb -0.06 -0.14 -0.20 0.00 0.01 0.00 0.00 42.46 42.07 1u5r s ILE 148 CO 0.26 0.10 1.13 -0.74 0.00 0.00 0.00 174.94 175.68 1u5r h HIS 149 N 7.11 -0.05 0.00 3.97 -0.00 -1.92 0.17 115.15 124.44 1u5r h HIS 149 Ca -0.42 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.95 1u5r h HIS 149 Cb 1.14 0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.56 1u5r h HIS 149 CO 0.49 0.50 0.00 0.54 -0.00 0.00 0.00 177.93 179.47 1u5r n ARG 150 N -4.84 -0.23 -2.69 5.26 1.74 -1.26 -2.65 116.66 111.99 1u5r n ARG 150 Ca -0.09 0.06 -0.07 0.00 -0.77 0.00 0.00 57.85 56.98 1u5r n ARG 150 Cb 0.29 -3.45 0.07 0.00 -1.02 0.00 0.00 32.46 28.35 1u5r n ARG 150 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1u5r n ASP 151 N -0.11 0.14 -4.73 0.55 2.03 -1.26 -4.04 116.55 109.12 1u5r n ASP 151 Ca 0.00 -2.52 -0.41 0.00 0.52 0.00 0.00 54.79 52.39 1u5r n ASP 151 Cb 0.06 0.08 -0.05 0.00 -0.72 0.00 0.00 41.12 40.49 1u5r n ASP 151 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1u5r s VAL 152 N -1.86 4.53 0.03 5.18 -7.23 -1.26 -4.79 120.40 114.99 1u5r s VAL 152 Ca 0.24 1.99 -0.28 0.00 -1.81 0.00 0.00 61.98 62.12 1u5r s VAL 152 Cb 0.42 -4.28 0.09 0.00 0.56 0.00 0.00 36.38 33.17 1u5r s VAL 152 CO -0.02 0.33 0.96 -1.59 -0.31 0.00 0.00 175.10 174.47 1u5r s LYS 153 N -0.06 0.87 0.45 4.82 -2.85 -1.26 -4.72 119.74 116.99 1u5r s LYS 153 Ca 0.45 -0.39 0.14 0.00 -1.00 0.00 0.00 55.97 55.17 1u5r s LYS 153 Cb -0.23 0.35 1.06 0.00 -2.06 0.00 0.00 37.83 36.95 1u5r s LYS 153 CO 0.29 -0.39 2.00 0.00 0.10 0.00 0.00 175.35 177.35 1u5r h ALA 154 N 2.00 2.02 0.00 0.59 0.00 -1.94 -1.41 119.26 120.53 1u5r h ALA 154 Ca -0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1u5r h ALA 154 Cb 1.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1u5r h ALA 154 CO 0.28 -0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.81 1u5r n GLY 155 N -1.53 -1.21 0.75 0.00 0.00 -1.26 -2.25 105.19 99.70 1u5r n GLY 155 Ca 0.08 0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.24 1u5r n GLY 155 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1u5r n ASN 156 N -2.13 3.14 -4.37 1.61 3.02 -0.54 -4.88 115.26 111.11 1u5r n ASN 156 Ca 0.02 -2.07 -0.37 0.00 -0.03 0.00 0.00 54.58 52.14 1u5r n ASN 156 Cb 0.21 -0.29 -0.13 0.00 -0.61 0.00 0.00 39.78 38.96 1u5r n ASN 156 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1u5r s ILE 157 N -1.12 3.98 0.06 2.41 1.01 -0.95 -0.63 121.20 125.95 1u5r s ILE 157 Ca 0.28 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.45 1u5r s ILE 157 Cb 0.15 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 1u5r s ILE 157 CO 0.18 0.22 0.14 -0.76 0.00 0.00 0.00 174.94 174.72 1u5r s LEU 158 N 1.53 4.08 -0.13 2.97 1.02 0.81 -0.39 118.68 128.57 1u5r s LEU 158 Ca 0.04 0.14 -0.01 0.00 0.02 0.00 0.00 54.13 54.33 1u5r s LEU 158 Cb -0.16 -2.69 -0.02 0.00 0.02 0.00 0.00 46.19 43.34 1u5r s LEU 158 CO 0.02 0.18 -0.10 -0.76 0.02 0.00 0.00 176.35 175.72 1u5r s LEU 159 N -2.37 2.92 -0.17 1.79 2.01 0.05 -0.51 118.68 122.40 1u5r s LEU 159 Ca 0.31 -0.24 -0.09 0.00 0.01 0.00 0.00 54.13 54.12 1u5r s LEU 159 Cb -0.13 -1.67 -0.05 0.00 0.01 0.00 0.00 46.19 44.36 1u5r s LEU 159 CO 0.24 0.19 0.15 -0.55 1.01 0.00 0.00 176.35 177.38 1u5r s SER 160 N 0.23 6.29 0.09 2.29 0.15 0.85 -1.76 113.70 121.85 1u5r s SER 160 Ca -0.06 0.33 -0.12 0.00 0.70 0.00 0.00 55.95 56.80 1u5r s SER 160 Cb -0.15 -2.09 0.03 0.00 -1.71 0.00 0.00 66.02 62.10 1u5r s SER 160 CO 0.04 0.25 0.75 1.21 1.20 0.00 0.00 173.24 176.69 1u5r n GLU 161 N 3.02 -0.17 0.08 5.44 4.07 -1.26 -0.09 120.64 131.72 1u5r n GLU 161 Ca -0.17 0.74 -0.13 0.00 -0.06 0.00 0.00 57.16 57.54 1u5r n GLU 161 Cb 0.53 -1.09 -0.06 0.00 -0.06 0.00 0.00 31.44 30.76 1u5r n GLU 161 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 1u5r h PRO 162 N 0.00 -0.51 0.00 5.31 0.11 -1.99 -3.45 132.00 131.46 1u5r h PRO 162 Ca 0.12 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1u5r h PRO 162 Cb 0.24 0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.47 1u5r h PRO 162 CO -0.47 -0.34 0.00 0.41 -0.21 0.00 0.00 178.00 177.39 1u5r n GLY 163 N -1.43 -0.19 3.43 -0.55 0.00 0.87 -4.60 105.19 102.71 1u5r n GLY 163 Ca -0.06 0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1u5r n GLY 163 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u5r s LEU 164 N 0.00 2.51 -0.23 0.99 1.43 -0.89 -4.81 118.68 117.69 1u5r s LEU 164 Ca 0.00 -0.35 -0.11 0.00 -1.03 0.00 0.00 54.13 52.64 1u5r s LEU 164 Cb 0.00 -1.48 -0.05 0.00 0.03 0.00 0.00 46.19 44.69 1u5r s LEU 164 CO 0.00 0.31 0.18 -0.69 0.23 0.00 0.00 176.35 176.37 1u5r s VAL 165 N -0.77 5.36 -0.02 -1.59 1.01 -1.26 -0.10 120.40 123.02 1u5r s VAL 165 Ca 0.12 0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.37 1u5r s VAL 165 Cb -0.10 -3.52 -0.00 0.00 0.00 0.00 0.00 36.38 32.76 1u5r s VAL 165 CO 0.02 0.36 -0.10 -0.54 0.00 0.00 0.00 175.10 174.83 1u5r s LYS 166 N 0.90 0.97 0.15 2.72 1.02 0.33 -4.47 119.74 121.36 1u5r s LYS 166 Ca 0.09 -0.37 -0.30 0.00 0.02 0.00 0.00 55.97 55.41 1u5r s LYS 166 Cb -0.13 -0.91 -0.07 0.00 -0.52 0.00 0.00 37.83 36.20 1u5r s LYS 166 CO 0.03 0.19 1.09 -0.51 -0.92 0.00 0.00 175.35 175.23 1u5r s LEU 167 N -0.06 4.47 0.00 3.17 1.02 0.29 -0.14 118.68 127.44 1u5r s LEU 167 Ca 0.01 2.02 0.03 0.00 0.02 0.00 0.00 54.13 56.21 1u5r s LEU 167 Cb -0.06 -3.60 -0.01 0.00 0.02 0.00 0.00 46.19 42.54 1u5r s LEU 167 CO 0.00 -0.23 0.11 0.61 0.02 0.00 0.00 176.35 176.86 1u5r n GLY 168 N 2.26 3.36 2.94 -3.19 0.00 0.19 -0.63 105.19 110.13 1u5r n GLY 168 Ca 0.04 -2.14 -0.11 0.00 0.00 0.00 0.00 46.02 43.81 1u5r n GLY 168 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1u5r n ASP 169 N -1.53 -7.54 -1.80 1.61 2.03 -1.26 -4.83 116.55 103.23 1u5r n ASP 169 Ca -0.07 0.59 -0.02 0.00 0.52 0.00 0.00 54.79 55.81 1u5r n ASP 169 Cb 0.56 -4.65 0.29 0.00 -0.72 0.00 0.00 41.12 36.60 1u5r n ASP 169 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1u5r n PHE 170 N -0.03 2.03 0.29 -0.67 3.01 -1.26 -4.50 117.46 116.33 1u5r n PHE 170 Ca 0.06 -0.92 0.16 0.00 1.01 0.00 0.00 57.45 57.77 1u5r n PHE 170 Cb 0.41 -0.57 0.88 0.00 -0.01 0.00 0.00 39.48 40.20 1u5r n PHE 170 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1u5r h GLY 171 N 3.39 0.00 -1.01 1.37 0.00 -1.91 -2.68 103.07 102.23 1u5r h GLY 171 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 1u5r h GLY 171 CO 0.57 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.55 1u5r n SER 172 N -3.47 2.35 -4.72 0.19 7.64 -1.26 -4.87 113.62 109.47 1u5r n SER 172 Ca -0.02 -1.70 -0.33 0.00 1.01 0.00 0.00 58.87 57.83 1u5r n SER 172 Cb 0.18 -0.10 0.11 0.00 -1.01 0.00 0.00 64.21 63.38 1u5r n SER 172 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u5r s ALA 173 N -0.93 2.01 -0.10 -0.43 0.00 -1.01 -4.66 121.76 116.64 1u5r s ALA 173 Ca 0.17 0.69 0.01 0.00 0.00 0.00 0.00 51.96 52.83 1u5r s ALA 173 Cb 0.10 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.78 1u5r s ALA 173 CO 0.14 -2.02 -0.14 0.45 0.00 0.00 0.00 175.76 174.19 1u5r s SER 174 N -2.43 3.97 0.18 0.00 0.15 0.61 -4.98 113.70 111.19 1u5r s SER 174 Ca 0.70 -0.30 0.26 0.00 0.70 0.00 0.00 55.95 57.32 1u5r s SER 174 Cb -0.25 -1.33 0.89 0.00 -1.71 0.00 0.00 66.02 63.62 1u5r s SER 174 CO 0.49 0.23 1.79 2.30 1.20 0.00 0.00 173.24 179.25 1u5r n ILE 175 N 3.11 0.52 -4.27 6.45 -0.00 -1.26 -1.79 119.36 122.12 1u5r n ILE 175 Ca -0.18 -0.19 -0.16 0.00 -0.00 0.00 0.00 62.75 62.22 1u5r n ILE 175 Cb 0.53 -0.62 -0.09 0.00 -0.00 0.00 0.00 39.64 39.45 1u5r n ILE 175 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1u5r s MET 176 N -3.10 1.48 -0.18 6.28 0.23 -1.23 -4.48 119.30 118.31 1u5r s MET 176 Ca 0.11 -1.83 -0.16 0.00 -1.03 0.00 0.00 55.69 52.78 1u5r s MET 176 Cb 0.13 0.18 0.05 0.00 -1.53 0.00 0.00 34.83 33.65 1u5r s MET 176 CO 0.56 -0.49 0.47 0.00 -2.03 0.00 0.00 175.02 173.54 1u5r s ALA 177 N -3.78 -1.16 0.95 3.16 0.00 -1.08 -4.52 121.76 115.32 1u5r s ALA 177 Ca 0.39 1.34 -0.11 0.00 0.00 0.00 0.00 51.96 53.58 1u5r s ALA 177 Cb 0.05 -0.78 0.16 0.00 0.00 0.00 0.00 23.12 22.55 1u5r s ALA 177 CO 0.18 -0.22 1.12 -2.14 0.00 0.00 0.00 175.76 174.70 1u5r s PRO 178 N 0.30 0.77 0.22 0.00 0.02 -1.26 -5.04 135.00 130.01 1u5r s PRO 178 Ca -0.00 1.39 0.01 0.00 0.02 0.00 0.00 61.00 62.41 1u5r s PRO 178 Cb -0.03 -1.71 -0.05 0.00 0.02 0.00 0.00 34.50 32.73 1u5r s PRO 178 CO -0.00 -2.75 0.07 0.00 -0.33 0.00 0.00 177.00 173.99 1u5r s ALA 179 N -2.64 1.48 -0.41 -1.55 0.00 -0.29 -4.92 121.76 113.43 1u5r s ALA 179 Ca 0.67 -1.74 0.02 0.00 0.00 0.00 0.00 51.96 50.90 1u5r s ALA 179 Cb -0.23 0.93 0.13 0.00 0.00 0.00 0.00 23.12 23.96 1u5r s ALA 179 CO 0.59 -0.44 0.22 0.54 0.00 0.00 0.00 175.76 176.68 1u5r s ASN 180 N -3.23 3.53 -0.49 0.00 2.20 -1.26 -1.16 114.94 114.53 1u5r s ASN 180 Ca 0.33 -2.48 0.03 0.00 -0.94 0.00 0.00 52.86 49.80 1u5r s ASN 180 Cb 0.07 -0.90 0.13 0.00 -2.00 0.00 0.00 41.25 38.56 1u5r s ASN 180 CO 0.10 -0.28 0.26 0.12 -2.94 0.00 0.00 177.10 174.36 1u5r s PHE 182 N 0.57 2.63 0.04 1.54 5.36 -1.26 -3.03 117.98 123.82 1u5r s PHE 182 Ca 0.17 -2.83 -0.01 0.00 -0.96 0.00 0.00 56.93 53.30 1u5r s PHE 182 Cb -0.24 -2.37 -0.03 0.00 -0.34 0.00 0.00 43.02 40.05 1u5r s PHE 182 CO -0.01 -0.75 -0.02 0.54 -1.46 0.00 0.00 175.22 173.53 1u5r s VAL 183 N -0.05 0.17 -2.71 3.12 0.11 -1.26 -5.00 120.40 114.77 1u5r s VAL 183 Ca 0.18 -1.37 0.00 0.00 -2.93 0.00 0.00 61.98 57.86 1u5r s VAL 183 Cb -0.24 -0.94 0.00 0.00 -1.53 0.00 0.00 36.38 33.67 1u5r s VAL 183 CO -0.01 -0.75 0.00 0.61 -3.33 0.00 0.00 175.10 171.62 1u5r n GLY 184 N 0.79 0.71 3.17 6.54 0.00 -1.26 -4.93 105.19 110.21 1u5r n GLY 184 Ca -0.19 -2.08 -0.34 0.00 0.00 0.00 0.00 46.02 43.41 1u5r n GLY 184 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u5r s THR 185 N -1.34 2.63 0.03 2.61 2.01 -1.26 -5.04 115.64 115.28 1u5r s THR 185 Ca 0.00 -1.03 -0.06 0.00 0.31 0.00 0.00 61.69 60.92 1u5r s THR 185 Cb 0.00 -2.29 -0.01 0.00 0.01 0.00 0.00 72.50 70.21 1u5r s THR 185 CO 0.00 0.28 0.34 -2.65 -0.69 0.00 0.00 174.62 171.90 1u5r n PRO 186 N 4.64 -0.08 0.31 4.92 -0.02 -1.26 -0.64 135.00 142.87 1u5r n PRO 186 Ca -0.17 0.33 0.18 0.00 -2.02 0.00 0.00 63.50 61.82 1u5r n PRO 186 Cb 0.48 -0.49 1.00 0.00 -0.02 0.00 0.00 33.50 34.46 1u5r n PRO 186 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1u5r h TYR 187 N 0.00 0.00 -0.01 6.00 0.99 -1.94 -2.35 116.97 119.65 1u5r h TYR 187 Ca 0.03 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1u5r h TYR 187 Cb 0.07 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.80 1u5r h TYR 187 CO -0.24 0.02 -0.47 0.91 -0.00 0.00 0.00 178.16 178.38 1u5r n TRP 188 N -3.42 0.00 -2.23 4.88 8.01 0.19 -4.83 117.44 120.04 1u5r n TRP 188 Ca -0.02 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.76 1u5r n TRP 188 Cb 0.12 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.39 1u5r n TRP 188 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 1u5r s MET 189 N -2.31 4.44 0.43 -0.99 -1.94 -0.89 -4.05 119.30 114.00 1u5r s MET 189 Ca 0.16 2.08 -0.22 0.00 -1.71 0.00 0.00 55.69 56.00 1u5r s MET 189 Cb 0.16 -3.12 -0.10 0.00 2.01 0.00 0.00 34.83 33.78 1u5r s MET 189 CO 0.53 -0.08 0.98 0.00 -0.01 0.00 0.00 175.02 176.45 1u5r s ALA 190 N -1.01 3.02 0.27 3.03 0.00 -1.26 -4.96 121.76 120.84 1u5r s ALA 190 Ca 0.48 0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.94 1u5r s ALA 190 Cb -0.37 -3.19 0.57 0.00 0.00 0.00 0.00 23.12 20.13 1u5r s ALA 190 CO 0.48 -0.00 1.78 -1.00 0.00 0.00 0.00 175.76 177.02 1u5r h PRO 191 N 2.01 0.71 -0.39 0.00 0.13 -1.91 -2.16 132.00 130.40 1u5r h PRO 191 Ca -0.49 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1u5r h PRO 191 Cb 1.19 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 1u5r h PRO 191 CO 0.61 0.47 0.25 0.93 -0.23 0.00 0.00 178.00 180.03 1u5r h GLU 192 N 0.73 0.52 -0.36 0.86 3.07 -1.94 0.24 114.58 117.71 1u5r h GLU 192 Ca 0.49 -0.04 -0.11 0.00 -0.50 0.00 0.00 59.36 59.21 1u5r h GLU 192 Cb 0.65 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.44 1u5r h GLU 192 CO -0.34 0.36 -0.19 0.28 -1.40 0.00 0.00 179.01 177.71 1u5r h VAL 193 N 0.54 1.29 -0.30 3.13 2.07 -1.77 0.32 116.25 121.52 1u5r h VAL 193 Ca 0.14 -1.32 -0.07 0.00 0.82 0.00 0.00 66.70 66.27 1u5r h VAL 193 Cb -0.04 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1u5r h VAL 193 CO -0.03 0.44 -0.07 0.40 0.02 0.00 0.00 177.57 178.32 1u5r h ILE 194 N 0.55 1.28 -0.23 4.57 2.04 -1.23 -3.13 117.51 121.36 1u5r h ILE 194 Ca 0.08 -1.11 -0.11 0.00 1.00 0.00 0.00 64.86 64.72 1u5r h ILE 194 Cb 0.74 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 1u5r h ILE 194 CO 0.06 0.35 -0.34 -0.07 0.00 0.00 0.00 178.15 178.15 1u5r h LEU 195 N 0.35 0.50 -2.05 1.44 4.07 -0.50 -2.42 115.31 116.69 1u5r h LEU 195 Ca 0.08 -0.20 0.11 0.00 0.08 0.00 0.00 57.88 57.95 1u5r h LEU 195 Cb 0.56 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 1u5r h LEU 195 CO 0.03 0.80 0.30 0.00 -1.08 0.00 0.00 178.44 178.49 1u5r h ALA 196 N 1.23 2.24 -6.44 1.53 0.00 -0.31 -3.46 119.26 114.05 1u5r h ALA 196 Ca 0.05 -0.01 -0.50 0.00 0.00 0.00 0.00 54.91 54.45 1u5r h ALA 196 Cb 0.79 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.52 1u5r h ALA 196 CO 0.06 -0.49 -0.79 -0.12 0.00 0.00 0.00 179.25 177.91 1u5r n MET 197 N -4.20 -4.64 -1.65 0.00 1.56 -0.91 -0.43 117.12 106.85 1u5r n MET 197 Ca 0.06 0.52 -0.13 0.00 -0.27 0.00 0.00 57.70 57.88 1u5r n MET 197 Cb 0.48 -5.30 -0.04 0.00 2.15 0.00 0.00 33.22 30.51 1u5r n MET 197 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1u5r n ASP 198 N -2.80 -4.43 0.00 6.12 -0.08 -1.19 -4.75 116.55 109.41 1u5r n ASP 198 Ca 0.02 0.22 0.00 0.00 -1.51 0.00 0.00 54.79 53.52 1u5r n ASP 198 Cb 0.53 -3.25 0.00 0.00 2.34 0.00 0.00 41.12 40.74 1u5r n ASP 198 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1u5r n GLU 199 N -2.51 0.00 0.00 -0.67 2.13 -0.37 -4.76 120.64 114.46 1u5r n GLU 199 Ca -0.14 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.68 1u5r n GLU 199 Cb 0.49 -0.04 0.00 0.00 0.27 0.00 0.00 31.44 32.16 1u5r n GLU 199 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1u5r n GLY 200 N 0.00 0.74 3.02 8.31 0.00 0.42 -4.99 105.19 112.69 1u5r n GLY 200 Ca 0.00 -1.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.07 1u5r n GLY 200 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1u5r s GLN 201 N 1.66 0.33 0.26 1.61 -2.07 -1.26 -4.04 119.66 116.15 1u5r s GLN 201 Ca 0.00 -0.40 -0.08 0.00 -1.82 0.00 0.00 55.36 53.06 1u5r s GLN 201 Cb 0.00 0.13 -0.01 0.00 -1.09 0.00 0.00 33.01 32.04 1u5r s GLN 201 CO 0.00 -0.06 0.40 1.52 -1.32 0.00 0.00 175.29 175.83 1u5r s TYR 202 N -1.15 0.69 0.00 9.60 -0.85 -0.31 -4.93 117.35 120.40 1u5r s TYR 202 Ca -0.12 -0.99 0.00 0.00 -0.52 0.00 0.00 57.07 55.43 1u5r s TYR 202 Cb -0.07 -0.03 0.00 0.00 0.38 0.00 0.00 41.96 42.24 1u5r s TYR 202 CO 0.00 -0.95 0.00 -0.40 -1.52 0.00 0.00 175.55 172.68 1u5r n ASP 203 N -0.58 0.66 0.21 -0.18 5.75 -1.26 -1.14 116.55 120.02 1u5r n ASP 203 Ca -0.00 0.00 0.14 0.00 -0.01 0.00 0.00 54.79 54.92 1u5r n ASP 203 Cb 0.63 0.00 0.75 0.00 -1.03 0.00 0.00 41.12 41.47 1u5r n ASP 203 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1u5r h GLY 204 N 0.00 0.00 1.63 6.12 0.00 -1.97 -2.33 103.07 106.52 1u5r h GLY 204 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 1u5r h GLY 204 CO 0.00 0.00 0.14 0.50 0.00 0.00 0.00 176.54 177.18 1u5r h LYS 205 N 0.00 0.00 0.00 4.80 1.79 -1.95 -1.23 116.57 119.98 1u5r h LYS 205 Ca 0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1u5r h LYS 205 Cb 0.02 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 1u5r h LYS 205 CO 0.00 0.00 -0.20 -0.39 -1.08 0.00 0.00 179.45 177.78 1u5r h VAL 206 N 0.00 0.92 0.00 0.50 -1.51 -1.83 -1.49 116.25 112.84 1u5r h VAL 206 Ca 0.07 -0.74 -0.12 0.00 -1.23 0.00 0.00 66.70 64.68 1u5r h VAL 206 Cb 0.36 1.43 -0.02 0.00 -2.13 0.00 0.00 31.29 30.93 1u5r h VAL 206 CO -0.00 0.19 -0.59 0.44 -1.23 0.00 0.00 177.57 176.38 1u5r h ASP 207 N 0.00 0.00 -0.47 4.19 3.32 -1.45 -1.93 116.42 120.08 1u5r h ASP 207 Ca -0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1u5r h ASP 207 Cb 0.41 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1u5r h ASP 207 CO 0.03 0.59 -0.22 0.58 -1.72 0.00 0.00 179.24 178.50 1u5r h VAL 208 N 0.00 1.27 -0.02 -1.35 2.07 -1.30 -0.47 116.25 116.45 1u5r h VAL 208 Ca -0.01 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.13 1u5r h VAL 208 Cb 1.30 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1u5r h VAL 208 CO 0.08 0.48 0.01 -0.25 0.02 0.00 0.00 177.57 177.90 1u5r h TRP 209 N 0.85 0.04 -0.25 1.57 2.91 -1.34 -1.46 115.95 118.27 1u5r h TRP 209 Ca 0.11 -0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.15 1u5r h TRP 209 Cb 0.80 -0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 29.42 1u5r h TRP 209 CO 0.05 0.25 0.17 0.77 -1.03 0.00 0.00 178.44 178.65 1u5r h SER 210 N -0.19 0.21 -0.38 2.65 0.02 -1.25 0.46 113.55 115.07 1u5r h SER 210 Ca 0.01 -0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 1u5r h SER 210 Cb 0.24 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1u5r h SER 210 CO 0.00 0.14 -0.26 0.25 -1.14 0.00 0.00 176.83 175.82 1u5r h LEU 211 N 0.24 0.92 -0.20 5.07 5.85 -0.68 -1.14 115.31 125.37 1u5r h LEU 211 Ca 0.10 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.47 1u5r h LEU 211 Cb 0.11 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1u5r h LEU 211 CO -0.02 1.13 0.11 1.23 -0.34 0.00 0.00 178.44 180.54 1u5r h GLY 212 N 0.90 0.27 0.97 3.75 0.00 0.13 -0.19 103.07 108.90 1u5r h GLY 212 Ca 0.09 -0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.37 1u5r h GLY 212 CO 0.07 0.07 0.65 -2.22 0.00 0.00 0.00 176.54 175.10 1u5r h ILE 213 N 0.22 1.21 -0.36 2.60 1.08 -1.14 -1.38 117.51 119.74 1u5r h ILE 213 Ca 0.08 -0.44 -0.06 0.00 -0.39 0.00 0.00 64.86 64.05 1u5r h ILE 213 Cb 0.01 -0.18 -0.02 0.00 -3.07 0.00 0.00 36.82 33.56 1u5r h ILE 213 CO -0.05 0.23 -0.03 0.74 -0.69 0.00 0.00 178.15 178.36 1u5r h THR 214 N 1.28 1.22 -0.58 -0.27 2.02 -0.66 0.17 112.91 116.09 1u5r h THR 214 Ca 0.38 -0.89 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 1u5r h THR 214 Cb -0.07 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 1u5r h THR 214 CO -0.10 0.30 0.29 0.00 0.37 0.00 0.00 175.52 176.38 1u5r h ILE 216 N 0.79 1.19 -0.85 0.00 2.04 -0.72 -1.63 117.51 118.33 1u5r h ILE 216 Ca 0.20 -0.60 0.13 0.00 1.00 0.00 0.00 64.86 65.59 1u5r h ILE 216 Cb 0.11 1.01 -0.09 0.00 -0.74 0.00 0.00 36.82 37.11 1u5r h ILE 216 CO -0.03 0.20 0.46 -0.08 0.00 0.00 0.00 178.15 178.71 1u5r h GLU 217 N 0.34 0.68 -0.00 2.37 4.81 -0.23 0.61 114.58 123.16 1u5r h GLU 217 Ca 0.10 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.17 1u5r h GLU 217 Cb 0.21 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 1u5r h GLU 217 CO -0.01 0.45 -0.55 -0.07 -0.73 0.00 0.00 179.01 178.10 1u5r h LEU 218 N 0.70 0.00 0.00 1.64 3.38 -0.55 0.79 115.31 121.28 1u5r h LEU 218 Ca 0.44 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.28 1u5r h LEU 218 Cb 0.54 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1u5r h LEU 218 CO -0.31 0.55 -0.96 0.00 0.09 0.00 0.00 178.44 177.81 1u5r h ALA 219 N 1.45 0.65 0.00 1.53 0.00 -0.05 -2.64 119.26 120.20 1u5r h ALA 219 Ca -0.01 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1u5r h ALA 219 Cb 0.98 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1u5r h ALA 219 CO 0.07 0.70 0.00 0.39 0.00 0.00 0.00 179.25 180.42 1u5r n GLU 220 N -3.02 -0.70 0.00 0.00 1.02 0.19 -4.65 120.64 113.49 1u5r n GLU 220 Ca -0.04 -0.37 0.00 0.00 -0.02 0.00 0.00 57.16 56.74 1u5r n GLU 220 Cb 0.77 -0.86 0.00 0.00 -0.02 0.00 0.00 31.44 31.33 1u5r n GLU 220 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1u5r n ARG 221 N -0.00 0.00 -3.88 3.49 1.74 0.27 -4.94 116.66 113.35 1u5r n ARG 221 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 1u5r n ARG 221 Cb 0.07 -1.22 -0.09 0.00 -1.02 0.00 0.00 32.46 30.19 1u5r n ARG 221 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1u5r s LYS 222 N 0.00 0.54 0.67 5.56 -0.14 -1.20 -4.92 119.74 120.25 1u5r s LYS 222 Ca 0.00 -0.51 -0.12 0.00 -1.36 0.00 0.00 55.97 53.99 1u5r s LYS 222 Cb 0.00 0.22 -0.01 0.00 -1.68 0.00 0.00 37.83 36.37 1u5r s LYS 222 CO 0.00 -0.14 1.05 -1.25 -0.76 0.00 0.00 175.35 174.26 1u5r s PRO 223 N -1.82 3.10 0.10 -1.68 0.04 -1.26 -3.90 135.00 129.57 1u5r s PRO 223 Ca -0.11 0.96 -0.21 0.00 0.04 0.00 0.00 61.00 61.67 1u5r s PRO 223 Cb -0.05 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.42 1u5r s PRO 223 CO -0.00 -0.97 1.37 -1.35 0.04 0.00 0.00 177.00 176.08 1u5r h PRO 224 N -0.47 -0.08 -0.95 0.56 0.11 -1.88 -2.58 132.00 126.70 1u5r h PRO 224 Ca -0.44 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 1u5r h PRO 224 Cb 1.21 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1u5r h PRO 224 CO 0.58 -0.06 0.02 1.28 -0.21 0.00 0.00 178.00 179.61 1u5r n LEU 225 N -4.52 2.12 0.30 2.35 4.77 -1.26 -4.41 117.00 116.34 1u5r n LEU 225 Ca 0.00 -1.07 0.18 0.00 -0.03 0.00 0.00 56.01 55.09 1u5r n LEU 225 Cb 0.19 -0.53 0.92 0.00 -2.33 0.00 0.00 43.42 41.67 1u5r n LEU 225 CO -0.07 0.37 1.15 2.19 -1.33 0.00 0.00 177.39 179.69 1u5r h PHE 226 N 0.51 0.00 -0.47 -1.77 -5.15 -1.84 -2.11 116.94 106.11 1u5r h PHE 226 Ca 0.02 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.77 1u5r h PHE 226 Cb 0.85 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.00 1u5r h PHE 226 CO 0.18 0.00 0.03 0.27 -2.00 0.00 0.00 178.31 176.79 1u5r n ASN 227 N -3.13 4.65 -4.13 -0.68 0.23 -1.26 -4.87 115.26 106.08 1u5r n ASN 227 Ca -0.01 -2.76 -0.20 0.00 -0.53 0.00 0.00 54.58 51.08 1u5r n ASN 227 Cb 0.31 -0.65 -0.13 0.00 -2.08 0.00 0.00 39.78 37.22 1u5r n ASN 227 CO 0.00 0.00 0.00 -0.32 -0.93 0.00 0.00 177.26 176.01 1u5r s MET 228 N -2.39 0.93 0.78 -3.83 1.75 -0.80 -5.14 119.30 110.60 1u5r s MET 228 Ca 0.43 -0.71 -0.12 0.00 -1.25 0.00 0.00 55.69 54.04 1u5r s MET 228 Cb 0.33 -0.92 0.07 0.00 2.84 0.00 0.00 34.83 37.14 1u5r s MET 228 CO 0.12 0.23 1.12 0.54 -0.65 0.00 0.00 175.02 176.39 1u5r s ASN 229 N -1.02 4.18 0.23 1.11 2.20 -1.26 -4.72 114.94 115.66 1u5r s ASN 229 Ca 0.02 2.01 -0.06 0.00 -0.94 0.00 0.00 52.86 53.89 1u5r s ASN 229 Cb -0.07 -2.55 0.36 0.00 -2.00 0.00 0.00 41.25 36.99 1u5r s ASN 229 CO 0.01 -2.26 1.77 0.00 -2.94 0.00 0.00 177.10 173.69 1u5r h ALA 230 N -1.00 1.00 -0.37 3.54 0.00 -1.97 -0.93 119.26 119.53 1u5r h ALA 230 Ca -0.44 0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.54 1u5r h ALA 230 Cb 1.25 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 1u5r h ALA 230 CO 0.49 -0.06 0.21 1.98 0.00 0.00 0.00 179.25 181.87 1u5r h MET 231 N 0.59 0.42 -0.42 0.00 1.85 -2.01 -1.82 114.93 113.54 1u5r h MET 231 Ca 0.36 -0.03 -0.10 0.00 -0.61 0.00 0.00 59.70 59.33 1u5r h MET 231 Cb 0.41 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.32 1u5r h MET 231 CO -0.29 0.28 -0.14 0.77 -0.40 0.00 0.00 176.91 177.13 1u5r h SER 232 N 0.43 0.78 -0.87 1.39 0.02 -1.80 -2.82 113.55 110.67 1u5r h SER 232 Ca 0.15 -0.25 0.01 0.00 -0.84 0.00 0.00 61.79 60.87 1u5r h SER 232 Cb 0.01 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 62.30 1u5r h SER 232 CO -0.07 0.93 0.58 0.00 -1.14 0.00 0.00 176.83 177.12 1u5r h ALA 233 N 1.14 1.12 -1.01 3.77 0.00 -0.67 -1.91 119.26 121.70 1u5r h ALA 233 Ca 0.11 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1u5r h ALA 233 Cb 0.63 -0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 1u5r h ALA 233 CO 0.04 0.49 0.66 -0.07 0.00 0.00 0.00 179.25 180.37 1u5r h LEU 234 N 1.16 1.12 -0.11 0.00 3.38 -1.10 -0.83 115.31 118.94 1u5r h LEU 234 Ca 0.33 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 1u5r h LEU 234 Cb -0.10 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.38 1u5r h LEU 234 CO -0.08 0.78 0.04 0.22 0.09 0.00 0.00 178.44 179.49 1u5r h TYR 235 N 1.31 0.17 -0.74 1.13 3.20 -1.24 -2.92 116.97 117.87 1u5r h TYR 235 Ca 0.39 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.21 1u5r h TYR 235 Cb -0.06 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 1u5r h TYR 235 CO -0.00 0.28 0.31 0.45 -1.64 0.00 0.00 178.16 177.56 1u5r h HIS 236 N 0.01 1.09 -0.49 -3.82 3.86 -0.89 -0.87 115.15 114.03 1u5r h HIS 236 Ca 0.04 -0.06 0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1u5r h HIS 236 Cb 0.18 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.30 1u5r h HIS 236 CO -0.01 0.81 0.32 0.82 0.86 0.00 0.00 177.93 180.73 1u5r h ILE 237 N 1.06 1.12 -0.37 2.45 2.04 -1.13 0.42 117.51 123.10 1u5r h ILE 237 Ca 0.25 -0.23 -0.14 0.00 1.00 0.00 0.00 64.86 65.75 1u5r h ILE 237 Cb 0.17 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1u5r h ILE 237 CO -0.03 0.12 -0.32 0.00 0.00 0.00 0.00 178.15 177.92 1u5r h ALA 238 N 1.18 0.74 0.10 1.87 0.00 -1.32 -3.38 119.26 118.45 1u5r h ALA 238 Ca 0.18 -0.42 -0.30 0.00 0.00 0.00 0.00 54.91 54.37 1u5r h ALA 238 Cb -0.07 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1u5r h ALA 238 CO -0.04 0.66 -1.60 1.96 0.00 0.00 0.00 179.25 180.23 1u5r h GLN 239 N 0.68 0.20 -7.53 0.00 1.08 -0.77 -3.49 115.11 105.29 1u5r h GLN 239 Ca 0.07 -0.35 -0.46 0.00 -1.45 0.00 0.00 58.65 56.46 1u5r h GLN 239 Cb 0.87 0.13 0.11 0.00 -0.05 0.00 0.00 27.48 28.54 1u5r h GLN 239 CO 0.08 1.17 0.33 -0.80 -0.95 0.00 0.00 178.83 178.65 1u5r s ASN 240 N -7.01 4.21 0.88 1.46 0.02 0.14 -5.07 114.94 109.57 1u5r s ASN 240 Ca -0.23 0.43 -0.12 0.00 -1.02 0.00 0.00 52.86 51.92 1u5r s ASN 240 Cb 0.06 -0.84 0.12 0.00 0.02 0.00 0.00 41.25 40.61 1u5r s ASN 240 CO 0.73 -2.03 1.11 -1.61 0.02 0.00 0.00 177.10 175.32 1u5r s GLU 241 N -5.52 1.40 0.44 -0.60 2.02 -1.26 -4.87 118.70 110.32 1u5r s GLU 241 Ca 0.65 0.54 -0.24 0.00 0.02 0.00 0.00 54.97 55.94 1u5r s GLU 241 Cb -0.08 -1.85 -0.08 0.00 0.10 0.00 0.00 34.13 32.22 1u5r s GLU 241 CO 0.48 -2.07 1.25 -1.12 0.02 0.00 0.00 175.26 173.83 1u5r s SER 242 N -3.80 6.14 0.87 -0.19 0.01 -1.26 -5.02 113.70 110.45 1u5r s SER 242 Ca 0.63 2.53 -0.13 0.00 1.31 0.00 0.00 55.95 60.29 1u5r s SER 242 Cb -0.16 -2.62 0.12 0.00 0.21 0.00 0.00 66.02 63.57 1u5r s SER 242 CO 0.55 -0.96 1.20 -2.16 0.41 0.00 0.00 173.24 172.28 1u5r s PRO 243 N -2.48 1.42 0.24 12.44 0.04 -1.26 -5.08 135.00 140.32 1u5r s PRO 243 Ca 0.61 0.02 -0.10 0.00 0.04 0.00 0.00 61.00 61.56 1u5r s PRO 243 Cb -0.35 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.28 1u5r s PRO 243 CO 0.43 -1.95 0.40 0.00 0.04 0.00 0.00 177.00 175.92 1u5r s ALA 244 N -3.58 0.06 0.35 8.56 0.00 -1.26 -4.93 121.76 120.96 1u5r s ALA 244 Ca 0.65 -1.05 -0.29 0.00 0.00 0.00 0.00 51.96 51.27 1u5r s ALA 244 Cb -0.10 1.14 -0.11 0.00 0.00 0.00 0.00 23.12 24.05 1u5r s ALA 244 CO 0.51 -0.80 1.48 -0.51 0.00 0.00 0.00 175.76 176.44 1u5r s LEU 245 N -3.05 4.34 -0.04 0.00 1.43 -1.26 -4.93 118.68 115.17 1u5r s LEU 245 Ca 0.26 2.96 -0.25 0.00 -1.03 0.00 0.00 54.13 56.07 1u5r s LEU 245 Cb 0.01 -3.66 -0.20 0.00 0.03 0.00 0.00 46.19 42.37 1u5r s LEU 245 CO 0.10 -0.82 1.13 1.56 0.23 0.00 0.00 176.35 178.55 1u5r h GLN 246 N 3.47 -0.06 -6.59 1.70 4.20 -1.99 -3.46 115.11 112.37 1u5r h GLN 246 Ca -0.50 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 57.70 1u5r h GLN 246 Cb 1.23 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 29.00 1u5r h GLN 246 CO 0.68 0.46 0.13 0.45 -0.67 0.00 0.00 178.83 179.87 1u5r s SER 247 N -5.67 7.09 0.00 1.46 0.15 -1.26 -4.99 113.70 110.48 1u5r s SER 247 Ca -0.16 1.46 0.28 0.00 0.70 0.00 0.00 55.95 58.24 1u5r s SER 247 Cb 0.01 -2.43 1.16 0.00 -1.71 0.00 0.00 66.02 63.05 1u5r s SER 247 CO 0.63 0.03 1.81 0.61 1.20 0.00 0.00 173.24 177.52 1u5r n GLY 248 N 0.75 -0.61 0.00 9.45 0.00 -1.26 -3.92 105.19 109.59 1u5r n GLY 248 Ca -0.02 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.75 1u5r n GLY 248 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1u5r n HIS 249 N -0.58 0.00 -2.59 1.61 1.44 -1.26 -4.75 115.22 109.09 1u5r n HIS 249 Ca 0.16 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.52 1u5r n HIS 249 Cb 0.29 -0.46 -0.04 0.00 0.12 0.00 0.00 29.99 29.89 1u5r n HIS 249 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1u5r s TRP 250 N -2.93 3.27 0.88 -1.40 0.52 -1.25 -5.01 118.94 113.02 1u5r s TRP 250 Ca 0.11 1.64 -0.11 0.00 0.02 0.00 0.00 56.10 57.76 1u5r s TRP 250 Cb 0.13 -3.08 0.12 0.00 -1.15 0.00 0.00 33.47 29.49 1u5r s TRP 250 CO 0.34 -0.54 1.12 -1.13 0.02 0.00 0.00 176.95 176.76 1u5r n SER 251 N -0.18 0.42 -0.09 2.95 3.41 -1.26 -4.79 113.62 114.09 1u5r n SER 251 Ca 0.05 0.48 -0.01 0.00 -0.26 0.00 0.00 58.87 59.13 1u5r n SER 251 Cb 0.50 -1.47 0.26 0.00 -0.26 0.00 0.00 64.21 63.24 1u5r n SER 251 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1u5r h GLU 252 N -1.51 0.73 -0.38 4.33 4.81 -1.94 -2.05 114.58 118.55 1u5r h GLU 252 Ca -0.44 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 1u5r h GLU 252 Cb 1.28 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1u5r h GLU 252 CO 0.42 0.63 0.26 1.88 -0.73 0.00 0.00 179.01 181.47 1u5r h TYR 253 N 0.71 0.48 0.01 0.92 0.99 -1.98 0.42 116.97 118.52 1u5r h TYR 253 Ca 0.17 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.91 1u5r h TYR 253 Cb 0.21 -0.16 0.00 0.00 1.00 0.00 0.00 36.73 37.78 1u5r h TYR 253 CO 0.01 0.31 -0.00 0.35 -0.00 0.00 0.00 178.16 178.82 1u5r h PHE 254 N 0.52 -0.01 -0.91 4.88 3.57 -1.84 -0.10 116.94 123.06 1u5r h PHE 254 Ca 0.14 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.68 1u5r h PHE 254 Cb -0.06 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.63 1u5r h PHE 254 CO -0.05 0.15 0.59 -0.09 -2.23 0.00 0.00 178.31 176.67 1u5r h ARG 255 N -0.16 1.10 -0.45 1.11 2.43 -1.19 -0.69 114.38 116.53 1u5r h ARG 255 Ca -0.00 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 1u5r h ARG 255 Cb 0.16 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 1u5r h ARG 255 CO 0.00 0.73 0.11 -0.97 -1.51 0.00 0.00 179.97 178.34 1u5r h ASN 256 N 1.14 0.68 -0.13 -3.80 -0.73 -0.70 -1.01 115.58 111.03 1u5r h ASN 256 Ca 0.36 -0.23 0.03 0.00 1.87 0.00 0.00 56.30 58.33 1u5r h ASN 256 Cb 0.01 -0.18 -0.03 0.00 0.27 0.00 0.00 38.32 38.39 1u5r h ASN 256 CO -0.12 0.73 -0.07 0.15 -0.37 0.00 0.00 177.43 177.76 1u5r h PHE 257 N 0.60 -0.16 -0.43 0.67 3.57 -0.31 0.49 116.94 121.37 1u5r h PHE 257 Ca 0.14 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 1u5r h PHE 257 Cb 0.32 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 1u5r h PHE 257 CO 0.02 -0.11 0.25 0.28 -2.23 0.00 0.00 178.31 176.52 1u5r h VAL 258 N -0.06 1.14 -0.10 1.41 2.07 -0.98 -1.45 116.25 118.29 1u5r h VAL 258 Ca 0.08 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.18 1u5r h VAL 258 Cb 0.17 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1u5r h VAL 258 CO -0.17 0.15 -0.26 0.44 0.02 0.00 0.00 177.57 177.74 1u5r h ASP 259 N 0.56 0.17 -0.23 0.57 3.32 -0.84 -1.10 116.42 118.88 1u5r h ASP 259 Ca 0.15 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.09 1u5r h ASP 259 Cb 0.02 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1u5r h ASP 259 CO -0.03 0.44 -0.11 0.28 -1.72 0.00 0.00 179.24 178.11 1u5r h SER 260 N 0.16 0.49 -0.50 6.45 0.02 -0.54 -3.02 113.55 116.59 1u5r h SER 260 Ca 0.02 -0.41 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 1u5r h SER 260 Cb 0.56 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 1u5r h SER 260 CO 0.04 0.79 0.33 0.00 -1.14 0.00 0.00 176.83 176.85 1u5r n LEU 262 N -4.46 5.19 -4.70 0.00 4.77 -0.45 -3.79 117.00 113.56 1u5r n LEU 262 Ca 0.05 -2.71 -0.42 0.00 -0.03 0.00 0.00 56.01 52.89 1u5r n LEU 262 Cb 0.05 -0.70 -0.03 0.00 -2.33 0.00 0.00 43.42 40.41 1u5r n LEU 262 CO 0.36 0.76 1.15 -1.10 -1.33 0.00 0.00 177.39 177.22 1u5r s GLN 263 N -2.29 4.27 0.20 3.23 -1.52 -1.13 -4.71 119.66 117.72 1u5r s GLN 263 Ca 0.39 2.09 -0.05 0.00 -1.95 0.00 0.00 55.36 55.84 1u5r s GLN 263 Cb 0.32 -3.47 0.15 0.00 -0.22 0.00 0.00 33.01 29.79 1u5r s GLN 263 CO 0.09 -0.57 1.60 0.87 -0.25 0.00 0.00 175.29 177.02 1u5r h LYS 264 N 7.61 0.76 -6.31 2.91 1.57 -1.93 -3.41 116.57 117.78 1u5r h LYS 264 Ca -0.40 -0.34 -0.57 0.00 -1.87 0.00 0.00 60.65 57.47 1u5r h LYS 264 Cb 1.19 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.42 1u5r h LYS 264 CO 0.90 0.95 0.88 0.42 -0.57 0.00 0.00 179.45 182.03 1u5r s ILE 265 N -4.50 4.41 0.22 1.86 1.01 -1.26 -4.84 121.20 118.10 1u5r s ILE 265 Ca -0.09 1.62 -0.11 0.00 0.00 0.00 0.00 60.65 62.07 1u5r s ILE 265 Cb 0.13 -4.33 0.24 0.00 0.01 0.00 0.00 42.46 38.51 1u5r s ILE 265 CO 0.84 -0.46 1.64 -0.65 0.00 0.00 0.00 174.94 176.31 1u5r h PRO 266 N 8.37 0.06 -0.03 2.79 0.11 -1.94 0.71 132.00 142.06 1u5r h PRO 266 Ca -0.22 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.89 1u5r h PRO 266 Cb 1.07 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1u5r h PRO 266 CO 1.03 0.04 0.03 -0.56 -0.21 0.00 0.00 178.00 178.33 1u5r h GLN 267 N 0.06 0.00 0.00 1.05 -0.00 -1.95 -0.62 115.11 113.65 1u5r h GLN 267 Ca 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.99 1u5r h GLN 267 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.04 1u5r h GLN 267 CO -0.63 0.00 -0.27 -0.44 -0.00 0.00 0.00 178.83 177.49 1u5r h ASP 268 N 0.00 0.00 -3.56 0.06 3.32 -1.23 -3.45 116.42 111.56 1u5r h ASP 268 Ca 0.01 -0.03 -0.52 0.00 0.02 0.00 0.00 57.03 56.52 1u5r h ASP 268 Cb 0.08 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1u5r h ASP 268 CO -0.00 0.01 0.35 -0.60 -1.72 0.00 0.00 179.24 177.28 1u5r s ARG 269 N -3.21 4.69 0.57 3.56 3.52 -0.24 -4.93 118.95 122.90 1u5r s ARG 269 Ca 0.06 1.43 -0.16 0.00 -0.13 0.00 0.00 55.73 56.93 1u5r s ARG 269 Cb 0.09 -3.38 -0.05 0.00 -1.56 0.00 0.00 34.95 30.05 1u5r s ARG 269 CO 0.68 0.22 1.04 -1.25 -0.81 0.00 0.00 175.30 175.18 1u5r s PRO 270 N -0.00 3.47 0.84 5.12 0.04 -1.26 -4.99 135.00 138.23 1u5r s PRO 270 Ca 0.46 1.18 -0.12 0.00 0.04 0.00 0.00 61.00 62.56 1u5r s PRO 270 Cb -0.23 -2.06 0.10 0.00 0.04 0.00 0.00 34.50 32.35 1u5r s PRO 270 CO 0.29 -0.68 1.10 0.95 0.04 0.00 0.00 177.00 178.70 1u5r s THR 271 N -2.44 2.80 0.38 1.26 -4.23 -1.26 -4.90 115.64 107.24 1u5r s THR 271 Ca 0.63 0.26 0.11 0.00 -1.18 0.00 0.00 61.69 61.51 1u5r s THR 271 Cb -0.15 -2.92 0.13 0.00 1.34 0.00 0.00 72.50 70.89 1u5r s THR 271 CO 0.34 -0.34 1.87 0.77 -0.54 0.00 0.00 174.62 176.73 1u5r h SER 272 N -1.29 0.13 -0.17 3.99 4.64 -1.93 -2.68 113.55 116.24 1u5r h SER 272 Ca -0.48 -0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 60.80 1u5r h SER 272 Cb 1.28 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 1u5r h SER 272 CO 0.58 0.39 0.09 -0.08 -0.87 0.00 0.00 176.83 176.93 1u5r h GLU 273 N 0.13 0.24 -0.79 4.77 4.81 -1.91 -2.69 114.58 119.14 1u5r h GLU 273 Ca 0.02 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1u5r h GLU 273 Cb 0.51 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 1u5r h GLU 273 CO 0.04 0.27 0.34 0.28 -0.73 0.00 0.00 179.01 179.21 1u5r h VAL 274 N 0.16 1.26 0.00 0.32 2.07 -1.87 -2.76 116.25 115.42 1u5r h VAL 274 Ca 0.06 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1u5r h VAL 274 Cb 0.10 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1u5r h VAL 274 CO -0.01 0.32 -0.02 -0.07 0.02 0.00 0.00 177.57 177.81 1u5r h LEU 275 N 1.13 0.00 -2.19 2.57 3.38 -1.25 -2.68 115.31 116.27 1u5r h LEU 275 Ca 0.27 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.29 1u5r h LEU 275 Cb 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1u5r h LEU 275 CO -0.03 0.02 0.16 -0.07 0.09 0.00 0.00 178.44 178.61 1u5r h LEU 276 N 0.00 0.00 -3.27 1.67 3.38 -1.17 -0.56 115.31 115.36 1u5r h LEU 276 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u5r h LEU 276 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1u5r h LEU 276 CO 0.00 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.82 1u5r n LYS 277 N -4.03 3.75 -2.56 1.13 4.76 -1.01 -4.69 118.16 115.52 1u5r n LYS 277 Ca 0.01 -2.87 -0.41 0.00 -2.87 0.00 0.00 58.31 52.18 1u5r n LYS 277 Cb 0.29 -1.92 -0.04 0.00 -1.84 0.00 0.00 35.03 31.51 1u5r n LYS 277 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1u5r s HIS 278 N -2.28 3.66 0.44 2.13 2.46 -0.22 -4.89 115.29 116.59 1u5r s HIS 278 Ca 0.47 1.68 0.21 0.00 0.47 0.00 0.00 55.06 57.90 1u5r s HIS 278 Cb 0.34 -3.22 1.18 0.00 -0.13 0.00 0.00 32.58 30.75 1u5r s HIS 278 CO 0.17 -0.38 1.83 0.00 -2.47 0.00 0.00 174.74 173.89 1u5r h ARG 279 N 4.71 0.30 -0.88 2.88 2.47 -1.93 -1.71 114.38 120.23 1u5r h ARG 279 Ca -0.45 -0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.28 1u5r h ARG 279 Cb 1.21 -0.07 -0.05 0.00 -1.65 0.00 0.00 29.97 29.41 1u5r h ARG 279 CO 0.70 0.20 0.57 0.35 0.56 0.00 0.00 179.97 182.36 1u5r h PHE 280 N 0.31 1.08 0.00 3.04 3.57 -1.92 0.28 116.94 123.30 1u5r h PHE 280 Ca 0.52 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.82 1u5r h PHE 280 Cb 1.46 -0.36 -0.03 0.00 2.79 0.00 0.00 35.95 39.80 1u5r h PHE 280 CO -0.00 0.65 -1.09 0.28 -2.23 0.00 0.00 178.31 175.91 1u5r h VAL 281 N 1.14 1.58 -0.01 1.41 2.07 -1.66 -3.33 116.25 117.44 1u5r h VAL 281 Ca 0.34 -3.30 0.00 0.00 0.82 0.00 0.00 66.70 64.55 1u5r h VAL 281 Cb -0.06 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 1u5r h VAL 281 CO -0.10 0.90 -0.38 0.18 0.02 0.00 0.00 177.57 178.19 1u5r n LEU 282 N -3.30 1.34 -4.76 2.57 4.77 -0.82 -4.92 117.00 111.88 1u5r n LEU 282 Ca -0.02 -0.43 -0.41 0.00 -0.03 0.00 0.00 56.01 55.11 1u5r n LEU 282 Cb 0.95 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.95 1u5r n LEU 282 CO 0.47 0.26 1.20 -0.60 -1.33 0.00 0.00 177.39 177.38 1u5r s ARG 283 N -2.55 4.15 -0.08 3.23 3.52 0.07 -4.88 118.95 122.41 1u5r s ARG 283 Ca 0.21 2.53 -0.36 0.00 -0.13 0.00 0.00 55.73 57.97 1u5r s ARG 283 Cb 0.19 -3.03 -0.14 0.00 -1.56 0.00 0.00 34.95 30.41 1u5r s ARG 283 CO 0.57 -0.57 1.71 0.39 -0.81 0.00 0.00 175.30 176.58 1u5r n GLU 284 N 1.83 1.71 -4.08 5.12 1.02 -1.26 -4.99 120.64 119.98 1u5r n GLU 284 Ca 0.06 0.62 -0.12 0.00 -0.02 0.00 0.00 57.16 57.71 1u5r n GLU 284 Cb 0.38 -2.38 -0.11 0.00 -0.02 0.00 0.00 31.44 29.32 1u5r n GLU 284 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1u5r s ARG 285 N 2.86 0.58 0.30 3.49 1.70 -1.26 -5.12 118.95 121.50 1u5r s ARG 285 Ca 0.91 -0.88 -0.30 0.00 -0.47 0.00 0.00 55.73 54.99 1u5r s ARG 285 Cb -0.84 -0.23 -0.12 0.00 -0.57 0.00 0.00 34.95 33.18 1u5r s ARG 285 CO 0.53 0.03 1.52 -2.30 -1.08 0.00 0.00 175.30 174.00 1u5r n PRO 286 N 1.12 2.55 0.00 3.89 -0.02 -1.26 -4.84 135.00 136.43 1u5r n PRO 286 Ca -0.20 0.90 0.03 0.00 -2.02 0.00 0.00 63.50 62.21 1u5r n PRO 286 Cb 0.56 -2.64 0.19 0.00 -0.02 0.00 0.00 33.50 31.59 1u5r n PRO 286 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1u5r n PRO 287 N 1.71 0.16 -0.21 0.52 -0.04 -1.26 -2.34 135.00 133.54 1u5r n PRO 287 Ca 0.07 0.09 0.09 0.00 -0.04 0.00 0.00 63.50 63.72 1u5r n PRO 287 Cb 0.36 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.50 1u5r n PRO 287 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1u5r n THR 288 N -1.11 2.03 0.09 0.52 -2.24 -1.26 -4.80 114.28 107.50 1u5r n THR 288 Ca 0.04 -2.18 -0.12 0.00 -2.27 0.00 0.00 64.05 59.52 1u5r n THR 288 Cb 0.03 -0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 67.96 1u5r n THR 288 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1u5r h VAL 289 N 0.60 0.35 -0.18 2.28 2.07 -1.84 -0.36 116.25 119.16 1u5r h VAL 289 Ca 0.00 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.43 1u5r h VAL 289 Cb 1.15 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1u5r h VAL 289 CO 0.08 0.00 -0.30 0.40 0.02 0.00 0.00 177.57 177.76 1u5r h ILE 290 N -0.48 1.27 0.08 4.57 2.04 -1.87 -1.68 117.51 121.45 1u5r h ILE 290 Ca 0.05 -1.30 -0.00 0.00 1.00 0.00 0.00 64.86 64.60 1u5r h ILE 290 Cb 0.54 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1u5r h ILE 290 CO -0.22 0.40 -0.04 0.24 0.00 0.00 0.00 178.15 178.53 1u5r h MET 291 N 0.30 -0.11 -0.67 2.37 2.86 -1.71 -0.71 114.93 117.26 1u5r h MET 291 Ca 0.04 0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1u5r h MET 291 Cb 0.69 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.34 1u5r h MET 291 CO 0.05 0.05 0.40 -0.44 1.06 0.00 0.00 176.91 178.03 1u5r h ASP 292 N -0.25 0.80 -0.01 1.22 3.32 -0.92 0.54 116.42 121.12 1u5r h ASP 292 Ca -0.01 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1u5r h ASP 292 Cb 0.21 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.56 1u5r h ASP 292 CO 0.02 0.62 0.00 0.25 -1.72 0.00 0.00 179.24 178.41 1u5r h LEU 293 N 0.92 0.01 -0.47 1.55 5.85 -1.09 0.36 115.31 122.45 1u5r h LEU 293 Ca 0.24 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.79 1u5r h LEU 293 Cb -0.03 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1u5r h LEU 293 CO -0.05 0.23 0.22 0.40 -0.34 0.00 0.00 178.44 178.90 1u5r h ILE 294 N -0.21 0.93 -0.16 4.05 2.04 -0.64 -0.16 117.51 123.36 1u5r h ILE 294 Ca 0.00 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1u5r h ILE 294 Cb 0.22 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1u5r h ILE 294 CO -0.00 0.08 0.06 -0.61 0.00 0.00 0.00 178.15 177.68 1u5r h GLN 295 N 0.43 0.25 0.00 2.37 5.75 -0.68 -1.32 115.11 121.92 1u5r h GLN 295 Ca 0.21 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.65 1u5r h GLN 295 Cb 0.14 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 28.65 1u5r h GLN 295 CO -0.17 0.34 -0.06 0.07 -2.65 0.00 0.00 178.83 176.37 1u5r h ARG 296 N 0.10 0.00 0.02 1.69 0.11 -0.01 -2.22 114.38 114.06 1u5r h ARG 296 Ca 0.05 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 59.89 1u5r h ARG 296 Cb 0.19 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.30 1u5r h ARG 296 CO -0.00 0.06 -0.98 1.15 0.10 0.00 0.00 179.97 180.30 1u5r h THR 297 N 0.00 1.31 -0.51 0.08 2.02 -0.57 -2.32 112.91 112.92 1u5r h THR 297 Ca -0.00 -2.24 0.03 0.00 0.77 0.00 0.00 66.41 64.96 1u5r h THR 297 Cb 0.42 2.48 -0.03 0.00 -1.74 0.00 0.00 68.15 69.28 1u5r h THR 297 CO 0.01 0.68 0.30 0.11 0.37 0.00 0.00 175.52 176.99 1u5r h LYS 298 N 0.26 0.58 -0.49 6.66 1.57 -0.80 -0.74 116.57 123.60 1u5r h LYS 298 Ca -0.13 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.67 1u5r h LYS 298 Cb 1.65 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 33.78 1u5r h LYS 298 CO 0.19 0.38 0.21 -0.44 -0.57 0.00 0.00 179.45 179.22 1u5r h ASP 299 N 0.59 0.26 -0.14 0.86 3.45 -1.42 -1.71 116.42 118.31 1u5r h ASP 299 Ca 0.21 0.04 -0.04 0.00 0.43 0.00 0.00 57.03 57.66 1u5r h ASP 299 Cb 0.03 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.79 1u5r h ASP 299 CO -0.10 0.18 -0.03 0.00 -1.57 0.00 0.00 179.24 177.73 1u5r h ALA 300 N 1.29 1.47 -0.13 3.45 0.00 -0.85 -2.13 119.26 122.37 1u5r h ALA 300 Ca 0.22 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1u5r h ALA 300 Cb 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1u5r h ALA 300 CO -0.20 0.38 -0.47 0.28 0.00 0.00 0.00 179.25 179.25 1u5r h VAL 301 N 0.39 1.33 -0.24 0.00 2.07 -0.30 -1.66 116.25 117.84 1u5r h VAL 301 Ca 0.08 -1.66 -0.09 0.00 0.82 0.00 0.00 66.70 65.86 1u5r h VAL 301 Cb 0.31 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 1u5r h VAL 301 CO 0.01 0.50 -0.23 0.03 0.02 0.00 0.00 177.57 177.90 1u5r h ARG 302 N 0.25 0.44 0.00 1.57 3.08 -0.73 -2.50 114.38 116.49 1u5r h ARG 302 Ca 0.02 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1u5r h ARG 302 Cb 0.92 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.94 1u5r h ARG 302 CO 0.08 0.64 0.00 0.93 -1.07 0.00 0.00 179.97 180.55 1u5r h GLU 303 N 0.39 0.00 -6.52 0.04 4.39 -1.01 -3.46 114.58 108.42 1u5r h GLU 303 Ca 0.06 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.24 1u5r h GLU 303 Cb 0.62 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 29.31 1u5r h GLU 303 CO 0.04 0.00 1.10 -0.51 -1.16 0.00 0.00 179.01 178.48 1u5r s LEU 304 N -4.93 4.40 0.12 1.33 1.43 -0.67 -4.94 118.68 115.42 1u5r s LEU 304 Ca 0.10 2.76 -0.30 0.00 -1.03 0.00 0.00 54.13 55.65 1u5r s LEU 304 Cb 0.11 -3.57 -0.07 0.00 0.03 0.00 0.00 46.19 42.69 1u5r s LEU 304 CO 0.61 -1.00 1.23 -1.81 0.23 0.00 0.00 176.35 175.61 1u5r s ASP 305 N 2.59 7.04 -0.10 2.29 1.11 -1.26 -3.65 116.67 124.69 1u5r s ASP 305 Ca 0.80 2.15 -0.01 0.00 0.18 0.00 0.00 52.55 55.68 1u5r s ASP 305 Cb -0.46 -2.59 -0.01 0.00 1.07 0.00 0.00 42.92 40.93 1u5r s ASP 305 CO 0.36 -0.46 0.09 -3.20 1.18 0.00 0.00 175.17 173.14 1u5r n ASN 306 N 3.39 -2.41 0.06 0.27 5.15 -1.26 -4.93 115.26 115.53 1u5r n ASN 306 Ca 0.08 -0.07 0.02 0.00 -0.60 0.00 0.00 54.58 54.01 1u5r n ASN 306 Cb 0.45 -0.96 -0.06 0.00 -0.53 0.00 0.00 39.78 38.69 1u5r n ASN 306 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1u5r h LEU 307 N -0.11 0.00 0.00 1.20 6.46 -1.91 0.22 115.31 121.16 1u5r h LEU 307 Ca -0.06 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.70 1u5r h LEU 307 Cb 1.03 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.96 1u5r h LEU 307 CO 0.04 0.49 0.00 0.00 -0.62 0.00 0.00 178.44 178.35 1u5r n GLN 308 N -2.90 0.28 0.00 1.25 6.02 -1.26 -2.77 117.38 118.00 1u5r n GLN 308 Ca -0.07 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 1u5r n GLN 308 Cb 0.79 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.55 1u5r n GLN 308 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1u5r n TYR 309 N -1.30 0.00 -1.48 1.08 4.01 -1.25 -5.09 117.16 113.13 1u5r n TYR 309 Ca 0.10 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.41 1u5r n TYR 309 Cb 0.17 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.20 1u5r n TYR 309 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1u5r n ARG 310 N -0.57 0.69 0.07 -0.72 5.12 0.06 -4.87 116.66 116.44 1u5r n ARG 310 Ca 0.00 0.25 0.13 0.00 -1.93 0.00 0.00 57.85 56.29 1u5r n ARG 310 Cb 0.00 -1.54 0.30 0.00 -1.16 0.00 0.00 32.46 30.07 1u5r n ARG 310 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1u5r n LYS 311 N 0.65 0.24 0.00 5.56 5.02 -1.26 -3.64 118.16 124.73 1u5r n LYS 311 Ca 0.12 0.13 0.12 0.00 -2.02 0.00 0.00 58.31 56.66 1u5r n LYS 311 Cb 0.36 -1.71 0.11 0.00 -0.02 0.00 0.00 35.03 33.78 1u5r n LYS 311 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1u5r n MET 312 N -2.09 2.24 0.04 1.97 2.81 -1.26 -4.19 117.12 116.63 1u5r n MET 312 Ca 0.05 -1.84 0.08 0.00 -1.81 0.00 0.00 57.70 54.18 1u5r n MET 312 Cb 0.42 -1.46 0.35 0.00 -0.71 0.00 0.00 33.22 31.82 1u5r n MET 312 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1u5r n LYS 313 N 1.22 0.06 0.29 0.03 2.85 -1.24 -1.88 118.16 119.49 1u5r n LYS 313 Ca 0.14 0.32 0.13 0.00 -1.05 0.00 0.00 58.31 57.86 1u5r n LYS 313 Cb 0.58 -1.61 0.85 0.00 -0.65 0.00 0.00 35.03 34.20 1u5r n LYS 313 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 1u5r h LYS 314 N 0.00 0.00 0.00 -1.58 2.10 -1.84 -0.08 116.57 115.17 1u5r h LYS 314 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1u5r h LYS 314 Cb 0.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.59 1u5r h LYS 314 CO 0.00 0.00 0.00 -0.89 -2.00 0.00 0.00 179.45 176.56 1u5r n ILE 315 N -4.02 1.20 0.17 0.07 5.41 -0.79 -1.33 119.36 120.08 1u5r n ILE 315 Ca -0.03 0.57 0.02 0.00 1.00 0.00 0.00 62.75 64.31 1u5r n ILE 315 Cb 0.08 -1.54 0.02 0.00 -0.71 0.00 0.00 39.64 37.49 1u5r n ILE 315 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1u5r n LEU 316 N -2.05 1.39 -0.36 1.39 4.77 -0.05 -4.80 117.00 117.29 1u5r n LEU 316 Ca -0.00 -1.03 0.29 0.00 -0.03 0.00 0.00 56.01 55.24 1u5r n LEU 316 Cb 0.07 -0.00 0.55 0.00 -2.33 0.00 0.00 43.42 41.71 1u5r n LEU 316 CO 0.10 0.30 1.14 -0.26 -1.33 0.00 0.00 177.39 177.35 1u5r h PHE 317 N 0.85 0.77 0.00 -1.77 0.05 -1.12 0.18 116.94 115.91 1u5r h PHE 317 Ca 0.00 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.82 1u5r h PHE 317 Cb 0.19 -0.20 0.00 0.00 2.00 0.00 0.00 35.95 37.95 1u5r h PHE 317 CO 0.00 -0.24 0.00 0.00 -0.18 0.00 0.00 178.31 177.90 1u5r n GLN 318 N -4.97 0.50 -0.10 1.51 10.64 -1.26 -3.42 117.38 120.28 1u5r n GLN 318 Ca 0.34 0.03 -0.18 0.00 -1.83 0.00 0.00 57.00 55.36 1u5r n GLN 318 Cb 1.18 -1.50 -0.06 0.00 -0.86 0.00 0.00 30.24 28.99 1u5r n GLN 318 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1u5r n GLU 319 N -1.07 0.46 -0.23 2.61 1.02 0.64 -5.17 120.64 118.90 1u5r n GLU 319 Ca 0.12 0.20 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1u5r n GLU 319 Cb 0.08 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 1u5r n GLU 319 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31