#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uqy h LEU 27 N 0.00 0.71 -1.50 0.99 3.38 -1.77 -1.56 115.31 115.55 1uqy h LEU 27 Ca 0.00 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1uqy h LEU 27 Cb 0.00 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1uqy h LEU 27 CO 0.00 0.59 0.38 0.07 0.09 0.00 0.00 178.44 179.57 1uqy h LYS 28 N 0.77 0.63 0.01 1.13 5.09 -1.16 -1.00 116.57 122.05 1uqy h LYS 28 Ca 0.20 -0.04 -0.18 0.00 0.09 0.00 0.00 60.65 60.73 1uqy h LYS 28 Cb 0.03 -0.14 0.01 0.00 0.10 0.00 0.00 32.23 32.24 1uqy h LYS 28 CO -0.03 0.42 -0.70 0.77 -2.09 0.00 0.00 179.45 177.81 1uqy h SER 29 N 0.65 0.60 -0.99 7.07 0.02 -1.69 -2.56 113.55 116.64 1uqy h SER 29 Ca 0.23 -0.77 0.11 0.00 -0.84 0.00 0.00 61.79 60.52 1uqy h SER 29 Cb 0.11 -0.18 -0.08 0.00 0.14 0.00 0.00 62.40 62.39 1uqy h SER 29 CO -0.06 1.29 0.63 0.00 -1.14 0.00 0.00 176.83 177.55 1uqy h ALA 30 N 0.32 1.53 -0.60 3.77 0.00 -0.92 -1.91 119.26 121.44 1uqy h ALA 30 Ca -0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1uqy h ALA 30 Cb 1.41 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1uqy h ALA 30 CO 0.14 0.25 0.00 0.66 0.00 0.00 0.00 179.25 180.30 1uqy n TYR 31 N -4.58 1.36 -0.30 0.00 4.01 -0.41 -4.68 117.16 112.56 1uqy n TYR 31 Ca 0.18 -0.55 0.04 0.00 -0.16 0.00 0.00 57.90 57.41 1uqy n TYR 31 Cb 0.32 -0.22 0.18 0.00 -0.31 0.00 0.00 39.34 39.32 1uqy n TYR 31 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1uqy h LYS 32 N 3.79 0.78 0.00 -0.72 3.64 -0.90 -0.06 116.57 123.10 1uqy h LYS 32 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1uqy h LYS 32 Cb 1.34 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1uqy h LYS 32 CO 0.21 0.52 0.00 -3.47 -2.27 0.00 0.00 179.45 174.43 1uqy n ASP 33 N -4.74 0.00 -0.03 4.20 2.03 -1.26 -4.23 116.55 112.52 1uqy n ASP 33 Ca 0.15 -0.07 -0.04 0.00 0.52 0.00 0.00 54.79 55.35 1uqy n ASP 33 Cb 0.30 -0.29 -0.01 0.00 -0.72 0.00 0.00 41.12 40.40 1uqy n ASP 33 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1uqy n ASN 34 N -1.29 1.13 -3.64 1.67 4.13 -0.10 -5.03 115.26 112.13 1uqy n ASN 34 Ca 0.12 0.18 -0.04 0.00 1.68 0.00 0.00 54.58 56.52 1uqy n ASN 34 Cb 0.21 -0.54 -0.01 0.00 -1.54 0.00 0.00 39.78 37.90 1uqy n ASN 34 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1uqy s PHE 35 N -2.09 -0.18 0.63 3.10 -0.12 -0.84 -4.82 117.98 113.68 1uqy s PHE 35 Ca -0.14 -0.02 -0.18 0.00 -0.05 0.00 0.00 56.93 56.55 1uqy s PHE 35 Cb 0.02 0.58 -0.02 0.00 -0.63 0.00 0.00 43.02 42.97 1uqy s PHE 35 CO 0.20 -0.58 1.26 -0.51 -0.05 0.00 0.00 175.22 175.54 1uqy s LEU 36 N -2.73 3.59 -0.18 -1.99 1.43 -0.69 -4.54 118.68 113.57 1uqy s LEU 36 Ca 0.10 2.52 0.01 0.00 -1.03 0.00 0.00 54.13 55.73 1uqy s LEU 36 Cb -0.00 -4.61 0.03 0.00 0.03 0.00 0.00 46.19 41.64 1uqy s LEU 36 CO -0.03 -1.88 -0.16 -0.63 0.23 0.00 0.00 176.35 173.88 1uqy s ILE 37 N -1.51 1.84 0.31 -0.59 -1.09 -1.26 -1.12 121.20 117.78 1uqy s ILE 37 Ca 0.80 -0.89 0.09 0.00 -2.23 0.00 0.00 60.65 58.42 1uqy s ILE 37 Cb -0.34 -1.73 -0.06 0.00 -1.58 0.00 0.00 42.46 38.74 1uqy s ILE 37 CO 0.38 0.42 -0.11 -0.83 -1.23 0.00 0.00 174.94 173.57 1uqy s GLY 38 N 1.36 2.02 -0.02 6.18 0.00 -0.13 -0.50 107.32 116.22 1uqy s GLY 38 Ca 0.03 -1.99 -0.03 0.00 0.00 0.00 0.00 44.72 42.73 1uqy s GLY 38 CO -0.11 -1.96 0.07 0.00 0.00 0.00 0.00 173.10 171.10 1uqy s ALA 39 N -2.71 -0.17 0.04 3.20 0.00 -0.70 -1.06 121.76 120.36 1uqy s ALA 39 Ca 0.31 0.12 -0.30 0.00 0.00 0.00 0.00 51.96 52.08 1uqy s ALA 39 Cb 0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 23.00 1uqy s ALA 39 CO 0.15 -0.06 1.15 0.00 0.00 0.00 0.00 175.76 176.99 1uqy s ALA 40 N -0.22 3.35 -0.15 0.00 0.00 -0.43 -1.88 121.76 122.43 1uqy s ALA 40 Ca -0.03 0.76 -0.01 0.00 0.00 0.00 0.00 51.96 52.68 1uqy s ALA 40 Cb -0.02 -3.43 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 1uqy s ALA 40 CO 0.00 -0.41 -0.12 -0.51 0.00 0.00 0.00 175.76 174.72 1uqy s LEU 41 N 1.15 2.72 0.96 0.00 1.43 0.35 -3.54 118.68 121.76 1uqy s LEU 41 Ca 0.57 -0.36 -0.15 0.00 -1.03 0.00 0.00 54.13 53.16 1uqy s LEU 41 Cb -0.27 -1.63 0.18 0.00 0.03 0.00 0.00 46.19 44.50 1uqy s LEU 41 CO 0.28 0.12 1.21 0.54 0.23 0.00 0.00 176.35 178.72 1uqy s ASN 42 N 0.65 3.07 0.27 2.29 2.20 -1.26 -1.61 114.94 120.54 1uqy s ASN 42 Ca -0.06 0.63 0.01 0.00 -0.94 0.00 0.00 52.86 52.49 1uqy s ASN 42 Cb -0.15 -0.94 0.37 0.00 -2.00 0.00 0.00 41.25 38.53 1uqy s ASN 42 CO 0.03 -2.79 1.72 0.00 -2.94 0.00 0.00 177.10 173.11 1uqy h ALA 43 N -1.67 1.07 -0.44 3.54 0.00 -1.98 -1.45 119.26 118.33 1uqy h ALA 43 Ca -0.47 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.07 1uqy h ALA 43 Cb 1.29 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1uqy h ALA 43 CO 0.49 0.57 0.13 1.15 0.00 0.00 0.00 179.25 181.58 1uqy h THR 44 N 0.50 1.23 -0.27 0.00 2.02 -2.01 -2.42 112.91 111.97 1uqy h THR 44 Ca 0.08 -0.76 -0.06 0.00 0.77 0.00 0.00 66.41 66.43 1uqy h THR 44 Cb 0.64 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1uqy h THR 44 CO 0.05 0.27 -0.06 0.40 0.37 0.00 0.00 175.52 176.55 1uqy h ILE 45 N 0.58 1.28 0.00 3.11 2.04 -1.89 -3.06 117.51 119.57 1uqy h ILE 45 Ca 0.14 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 64.93 1uqy h ILE 45 Cb 0.29 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1uqy h ILE 45 CO -0.00 0.34 0.00 0.00 0.00 0.00 0.00 178.15 178.49 1uqy n ALA 46 N -2.39 1.54 0.29 1.87 0.00 -0.56 -1.94 120.51 119.31 1uqy n ALA 46 Ca -0.03 0.08 0.15 0.00 0.00 0.00 0.00 53.44 53.63 1uqy n ALA 46 Cb 0.30 -1.34 0.86 0.00 0.00 0.00 0.00 19.45 19.28 1uqy n ALA 46 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1uqy h SER 47 N 0.00 0.00 0.00 0.00 4.64 -1.32 -3.41 113.55 113.46 1uqy h SER 47 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uqy h SER 47 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1uqy h SER 47 CO 0.00 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1uqy n GLY 48 N -0.98 0.54 0.19 -0.77 0.00 -0.82 -4.92 105.19 98.42 1uqy n GLY 48 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.05 1uqy n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uqy h ALA 49 N 0.00 1.01 -2.05 4.61 0.00 -1.81 -3.41 119.26 117.61 1uqy h ALA 49 Ca 0.00 -0.34 -0.74 0.00 0.00 0.00 0.00 54.91 53.83 1uqy h ALA 49 Cb 0.00 -0.06 -0.23 0.00 0.00 0.00 0.00 17.79 17.50 1uqy h ALA 49 CO 0.00 0.46 -0.13 0.34 0.00 0.00 0.00 179.25 179.92 1uqy s ASP 50 N -6.45 6.19 0.39 0.00 -1.08 -1.26 -4.92 116.67 109.53 1uqy s ASP 50 Ca -0.00 -1.67 0.12 0.00 -0.52 0.00 0.00 52.55 50.48 1uqy s ASP 50 Cb 0.11 -2.23 0.77 0.00 -1.46 0.00 0.00 42.92 40.11 1uqy s ASP 50 CO 0.69 -0.92 1.87 1.05 0.52 0.00 0.00 175.17 178.38 1uqy h GLU 51 N 8.96 0.07 0.02 4.34 -0.00 -2.00 -0.94 114.58 125.04 1uqy h GLU 51 Ca -0.30 -0.02 -0.00 0.00 -0.00 0.00 0.00 59.36 59.04 1uqy h GLU 51 Cb 1.10 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 29.84 1uqy h GLU 51 CO 1.05 0.35 -0.01 -0.09 -0.00 0.00 0.00 179.01 180.31 1uqy h ARG 52 N 0.06 -0.03 -0.54 1.06 2.43 -1.98 -1.50 114.38 113.90 1uqy h ARG 52 Ca 0.01 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.10 1uqy h ARG 52 Cb 0.54 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 1uqy h ARG 52 CO 0.04 0.08 0.03 -0.07 -1.51 0.00 0.00 179.97 178.54 1uqy h LEU 53 N -0.13 0.86 -0.69 3.80 3.38 -1.87 -1.34 115.31 119.32 1uqy h LEU 53 Ca -0.00 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.78 1uqy h LEU 53 Cb 0.12 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1uqy h LEU 53 CO 0.00 0.90 0.44 0.78 0.09 0.00 0.00 178.44 180.65 1uqy h ASN 54 N 0.83 0.73 -0.07 -0.43 2.35 -1.01 0.11 115.58 118.09 1uqy h ASN 54 Ca 0.16 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 1uqy h ASN 54 Cb 0.45 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.66 1uqy h ASN 54 CO 0.02 0.51 0.02 0.74 -1.65 0.00 0.00 177.43 177.07 1uqy h THR 55 N 0.86 1.18 -0.20 2.81 2.02 -1.06 -2.19 112.91 116.34 1uqy h THR 55 Ca 0.27 -0.54 0.04 0.00 0.77 0.00 0.00 66.41 66.95 1uqy h THR 55 Cb -0.01 1.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.78 1uqy h THR 55 CO -0.10 0.15 -0.04 0.25 0.37 0.00 0.00 175.52 176.15 1uqy h LEU 56 N -0.09 -0.17 -0.57 2.58 6.46 -0.95 -2.14 115.31 120.42 1uqy h LEU 56 Ca 0.02 0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 57.81 1uqy h LEU 56 Cb 0.23 0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.25 1uqy h LEU 56 CO -0.00 -0.06 0.25 0.40 -0.62 0.00 0.00 178.44 178.41 1uqy h ILE 57 N 0.01 1.22 -0.28 4.05 2.04 -0.73 -0.58 117.51 123.23 1uqy h ILE 57 Ca 0.10 -0.65 -0.05 0.00 1.00 0.00 0.00 64.86 65.26 1uqy h ILE 57 Cb 0.14 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1uqy h ILE 57 CO -0.20 0.25 -0.03 0.00 0.00 0.00 0.00 178.15 178.17 1uqy h ALA 58 N 1.09 1.42 -0.25 1.87 0.00 -1.27 -0.51 119.26 121.61 1uqy h ALA 58 Ca 0.19 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1uqy h ALA 58 Cb 0.17 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1uqy h ALA 58 CO -0.02 0.41 -0.28 -0.22 0.00 0.00 0.00 179.25 179.14 1uqy h LYS 59 N 0.42 0.64 0.01 0.00 3.64 -0.95 -3.40 116.57 116.93 1uqy h LYS 59 Ca 0.09 -0.35 -0.37 0.00 -1.27 0.00 0.00 60.65 58.75 1uqy h LYS 59 Cb 0.33 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.11 1uqy h LYS 59 CO 0.01 0.95 -2.30 0.39 -2.27 0.00 0.00 179.45 176.24 1uqy n GLU 60 N -4.30 0.68 -4.77 1.90 -0.58 -0.26 -4.14 120.64 109.16 1uqy n GLU 60 Ca -0.04 0.12 -0.30 0.00 -0.42 0.00 0.00 57.16 56.51 1uqy n GLU 60 Cb 0.46 -1.57 -0.14 0.00 -0.57 0.00 0.00 31.44 29.62 1uqy n GLU 60 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1uqy s PHE 61 N -2.52 2.41 -0.00 -0.32 0.08 -0.23 -0.74 117.98 116.66 1uqy s PHE 61 Ca -0.20 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 56.51 1uqy s PHE 61 Cb 0.07 -1.41 0.01 0.00 -0.57 0.00 0.00 43.02 41.13 1uqy s PHE 61 CO 0.74 0.19 0.98 0.27 -0.10 0.00 0.00 175.22 177.30 1uqy n ASN 62 N 1.62 1.89 -3.91 1.36 0.23 0.34 -4.61 115.26 112.17 1uqy n ASN 62 Ca -0.17 -1.98 -0.10 0.00 -0.53 0.00 0.00 54.58 51.80 1uqy n ASN 62 Cb 0.52 -0.02 -0.10 0.00 -2.08 0.00 0.00 39.78 38.10 1uqy n ASN 62 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1uqy s SER 63 N -1.01 0.12 0.03 0.53 0.15 -1.07 -1.50 113.70 110.96 1uqy s SER 63 Ca 0.01 -0.36 -0.02 0.00 0.70 0.00 0.00 55.95 56.28 1uqy s SER 63 Cb 0.01 0.18 -0.02 0.00 -1.71 0.00 0.00 66.02 64.48 1uqy s SER 63 CO 0.00 -0.38 0.01 0.27 1.20 0.00 0.00 173.24 174.34 1uqy s ILE 64 N -1.69 0.14 -0.01 6.45 -4.36 0.09 -1.71 121.20 120.10 1uqy s ILE 64 Ca -0.13 -1.12 0.03 0.00 -0.26 0.00 0.00 60.65 59.18 1uqy s ILE 64 Cb -0.07 -0.68 -0.01 0.00 1.25 0.00 0.00 42.46 42.96 1uqy s ILE 64 CO -0.00 -0.61 -0.11 -0.89 0.24 0.00 0.00 174.94 173.56 1uqy s THR 65 N -2.22 0.88 -0.06 8.37 2.01 -0.78 -1.45 115.64 122.38 1uqy s THR 65 Ca -0.09 -0.47 -0.30 0.00 0.31 0.00 0.00 61.69 61.14 1uqy s THR 65 Cb -0.04 -0.74 -0.03 0.00 0.01 0.00 0.00 72.50 71.70 1uqy s THR 65 CO -0.03 0.25 1.19 -2.16 -0.69 0.00 0.00 174.62 173.18 1uqy s PRO 66 N -0.23 4.35 0.25 4.92 0.04 -1.26 -0.49 135.00 142.58 1uqy s PRO 66 Ca 0.04 1.66 -0.03 0.00 0.04 0.00 0.00 61.00 62.71 1uqy s PRO 66 Cb -0.05 -3.56 0.29 0.00 0.04 0.00 0.00 34.50 31.23 1uqy s PRO 66 CO -0.00 -0.44 1.75 1.49 0.04 0.00 0.00 177.00 179.83 1uqy h GLU 67 N 7.44 0.84 0.00 4.56 4.81 -1.63 -3.41 114.58 127.19 1uqy h GLU 67 Ca -0.34 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 58.66 1uqy h GLU 67 Cb 1.16 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.44 1uqy h GLU 67 CO 0.88 0.84 0.00 0.09 -0.73 0.00 0.00 179.01 180.09 1uqy n ASN 68 N -4.21 0.00 0.11 1.04 3.02 -1.26 -4.97 115.26 108.98 1uqy n ASN 68 Ca 0.03 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.69 1uqy n ASN 68 Cb 0.30 0.00 0.46 0.00 -0.61 0.00 0.00 39.78 39.93 1uqy n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uqy n MET 70 N -2.13 2.59 -2.43 0.00 2.81 -1.26 -3.92 117.12 112.77 1uqy n MET 70 Ca 0.03 -2.42 -0.40 0.00 -1.81 0.00 0.00 57.70 53.10 1uqy n MET 70 Cb 0.25 -1.51 -0.04 0.00 -0.71 0.00 0.00 33.22 31.21 1uqy n MET 70 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1uqy s LYS 71 N -1.22 4.55 0.19 0.03 1.02 -0.66 -3.99 119.74 119.65 1uqy s LYS 71 Ca 0.42 1.83 -0.18 0.00 0.02 0.00 0.00 55.97 58.05 1uqy s LYS 71 Cb 0.23 -3.10 0.16 0.00 -0.52 0.00 0.00 37.83 34.59 1uqy s LYS 71 CO 0.31 0.12 1.61 2.35 -0.92 0.00 0.00 175.35 178.81 1uqy h TRP 72 N 3.61 -0.65 0.00 3.18 2.91 -1.79 0.44 115.95 123.66 1uqy h TRP 72 Ca -0.47 0.06 0.00 0.00 1.13 0.00 0.00 58.89 59.61 1uqy h TRP 72 Cb 1.21 0.37 0.00 0.00 -0.51 0.00 0.00 29.16 30.23 1uqy h TRP 72 CO 0.58 -0.33 0.00 0.41 -1.03 0.00 0.00 178.44 178.07 1uqy n GLY 73 N -1.43 -1.14 0.13 2.65 0.00 0.02 -0.99 105.19 104.44 1uqy n GLY 73 Ca 0.05 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1uqy n GLY 73 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1uqy n VAL 74 N -1.59 1.52 0.05 1.61 0.31 -0.41 -4.45 118.33 115.37 1uqy n VAL 74 Ca 0.04 -0.49 -0.04 0.00 -0.01 0.00 0.00 64.34 63.84 1uqy n VAL 74 Cb 0.21 -1.63 0.17 0.00 -0.91 0.00 0.00 33.84 31.69 1uqy n VAL 74 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1uqy h LEU 75 N -0.40 0.41 -8.82 7.52 5.85 -0.92 -3.46 115.31 115.50 1uqy h LEU 75 Ca -0.61 -0.17 -0.60 0.00 0.84 0.00 0.00 57.88 57.34 1uqy h LEU 75 Cb 1.78 -0.11 -0.21 0.00 0.37 0.00 0.00 40.66 42.49 1uqy h LEU 75 CO -0.21 0.77 -0.83 -0.13 -0.34 0.00 0.00 178.44 177.70 1uqy s ARG 76 N -4.21 1.28 0.81 1.25 0.52 -0.16 -1.67 118.95 116.77 1uqy s ARG 76 Ca -0.06 -1.31 -0.05 0.00 -0.52 0.00 0.00 55.73 53.79 1uqy s ARG 76 Cb 0.13 -1.58 0.16 0.00 0.52 0.00 0.00 34.95 34.19 1uqy s ARG 76 CO 0.79 0.36 1.11 0.16 0.02 0.00 0.00 175.30 177.74 1uqy s ASP 77 N -2.20 3.86 0.48 0.23 1.47 -0.29 -4.45 116.67 115.76 1uqy s ASP 77 Ca 0.12 -0.29 0.32 0.00 1.18 0.00 0.00 52.55 53.88 1uqy s ASP 77 Cb -0.09 0.09 1.46 0.00 -0.34 0.00 0.00 42.92 44.04 1uqy s ASP 77 CO 0.06 -2.21 1.96 0.00 0.68 0.00 0.00 175.17 175.66 1uqy h ALA 78 N -0.90 1.00 -0.18 2.11 0.00 -1.93 -0.64 119.26 118.72 1uqy h ALA 78 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1uqy h ALA 78 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1uqy h ALA 78 CO 0.36 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.65 1uqy n GLN 79 N -2.78 1.93 -0.63 0.00 6.02 -1.26 -4.83 117.38 115.83 1uqy n GLN 79 Ca 0.00 -1.39 0.00 0.00 -0.01 0.00 0.00 57.00 55.60 1uqy n GLN 79 Cb 0.21 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 30.03 1uqy n GLN 79 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1uqy n GLY 80 N 1.23 0.76 3.76 1.08 0.00 -0.24 -5.03 105.19 106.74 1uqy n GLY 80 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1uqy n GLY 80 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1uqy s GLN 81 N -0.37 4.66 -0.07 1.61 -0.21 -1.26 -4.75 119.66 119.27 1uqy s GLN 81 Ca 0.00 1.71 -0.04 0.00 0.02 0.00 0.00 55.36 57.05 1uqy s GLN 81 Cb 0.00 -3.16 -0.04 0.00 1.00 0.00 0.00 33.01 30.81 1uqy s GLN 81 CO 0.00 0.26 0.13 -1.58 -2.12 0.00 0.00 175.29 171.98 1uqy s TRP 82 N -1.20 3.49 -0.19 0.91 0.52 -1.26 -1.14 118.94 120.07 1uqy s TRP 82 Ca 0.45 0.40 -0.03 0.00 0.02 0.00 0.00 56.10 56.93 1uqy s TRP 82 Cb -0.30 -1.86 0.06 0.00 -1.15 0.00 0.00 33.47 30.22 1uqy s TRP 82 CO 0.38 0.66 0.05 1.21 0.02 0.00 0.00 176.95 179.26 1uqy s ASN 83 N -1.39 2.76 0.00 2.95 3.84 -0.67 -5.02 114.94 117.42 1uqy s ASN 83 Ca 0.20 -0.76 0.25 0.00 0.21 0.00 0.00 52.86 52.75 1uqy s ASN 83 Cb -0.12 -0.52 0.94 0.00 -0.55 0.00 0.00 41.25 41.00 1uqy s ASN 83 CO 0.10 -0.31 1.67 0.79 -2.79 0.00 0.00 177.10 176.55 1uqy n TRP 84 N 5.10 0.09 -0.04 0.43 7.02 -1.26 -4.58 117.44 124.21 1uqy n TRP 84 Ca -0.08 -0.05 -0.08 0.00 -1.02 0.00 0.00 57.50 56.27 1uqy n TRP 84 Cb 0.48 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.35 1uqy n TRP 84 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 1uqy h LYS 85 N 2.23 -0.22 0.06 -0.99 3.64 -1.97 0.88 116.57 120.20 1uqy h LYS 85 Ca 0.00 0.02 -0.28 0.00 -1.27 0.00 0.00 60.65 59.12 1uqy h LYS 85 Cb 0.48 0.05 0.03 0.00 -0.41 0.00 0.00 32.23 32.38 1uqy h LYS 85 CO 0.00 -0.15 -1.11 -0.44 -2.27 0.00 0.00 179.45 175.48 1uqy h ASP 86 N -0.23 0.87 -0.60 4.20 3.32 -1.94 -2.16 116.42 119.88 1uqy h ASP 86 Ca 0.13 -0.79 -0.06 0.00 0.02 0.00 0.00 57.03 56.33 1uqy h ASP 86 Cb 0.43 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1uqy h ASP 86 CO -0.35 1.56 0.13 0.00 -1.72 0.00 0.00 179.24 178.85 1uqy h ALA 87 N 0.33 0.79 -0.70 3.45 0.00 -1.76 -0.29 119.26 121.08 1uqy h ALA 87 Ca -0.16 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 1uqy h ALA 87 Cb 1.78 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 1uqy h ALA 87 CO 0.22 0.51 0.20 -0.44 0.00 0.00 0.00 179.25 179.75 1uqy h ASP 88 N 0.88 1.03 -0.69 0.00 3.32 -0.85 -2.11 116.42 118.00 1uqy h ASP 88 Ca 0.19 -0.22 0.04 0.00 0.02 0.00 0.00 57.03 57.06 1uqy h ASP 88 Cb 0.38 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.61 1uqy h ASP 88 CO 0.01 0.97 0.42 0.00 -1.72 0.00 0.00 179.24 178.92 1uqy h ALA 89 N 1.09 0.92 -0.27 3.45 0.00 -0.83 0.12 119.26 123.74 1uqy h ALA 89 Ca 0.22 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1uqy h ALA 89 Cb 0.32 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1uqy h ALA 89 CO -0.00 0.16 0.15 0.35 0.00 0.00 0.00 179.25 179.91 1uqy h PHE 90 N 0.80 0.29 -0.36 0.00 3.04 -0.79 -0.34 116.94 119.58 1uqy h PHE 90 Ca 0.29 0.01 -0.12 0.00 3.98 0.00 0.00 57.97 62.13 1uqy h PHE 90 Cb 0.08 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 38.48 1uqy h PHE 90 CO -0.05 0.17 -0.28 0.28 -2.02 0.00 0.00 178.31 176.41 1uqy h VAL 91 N 0.32 1.28 -0.89 1.41 2.07 -1.03 -1.21 116.25 118.19 1uqy h VAL 91 Ca 0.11 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.22 1uqy h VAL 91 Cb 0.00 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1uqy h VAL 91 CO -0.05 0.46 0.55 0.00 0.02 0.00 0.00 177.57 178.55 1uqy h ALA 92 N 1.04 1.29 -0.02 1.67 0.00 -0.46 -0.31 119.26 122.47 1uqy h ALA 92 Ca 0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1uqy h ALA 92 Cb 0.80 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1uqy h ALA 92 CO 0.07 0.62 0.00 0.35 0.00 0.00 0.00 179.25 180.29 1uqy h PHE 93 N 1.22 0.03 -0.75 0.00 3.04 -0.58 0.50 116.94 120.40 1uqy h PHE 93 Ca 0.32 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.29 1uqy h PHE 93 Cb -0.07 -0.01 -0.04 0.00 2.56 0.00 0.00 35.95 38.39 1uqy h PHE 93 CO 0.00 0.27 0.50 0.78 -2.02 0.00 0.00 178.31 177.85 1uqy h GLY 94 N -0.22 1.05 0.86 2.40 0.00 -1.06 -2.09 103.07 104.02 1uqy h GLY 94 Ca 0.01 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 1uqy h GLY 94 CO 0.00 0.35 -0.12 -0.84 0.00 0.00 0.00 176.54 175.93 1uqy h THR 95 N 0.97 1.30 -0.86 4.70 2.02 -0.83 0.38 112.91 120.59 1uqy h THR 95 Ca 0.29 -1.20 0.03 0.00 0.77 0.00 0.00 66.41 66.29 1uqy h THR 95 Cb -0.04 1.55 -0.05 0.00 -1.74 0.00 0.00 68.15 67.87 1uqy h THR 95 CO -0.07 0.37 0.56 0.50 0.37 0.00 0.00 175.52 177.25 1uqy h LYS 96 N 0.25 1.06 -0.53 6.66 3.64 -0.57 -2.63 116.57 124.45 1uqy h LYS 96 Ca 0.06 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1uqy h LYS 96 Cb 0.63 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1uqy h LYS 96 CO 0.04 0.70 0.00 0.72 -2.27 0.00 0.00 179.45 178.64 1uqy n HIS 97 N -4.54 0.70 -3.91 1.91 8.25 -0.81 -4.97 115.22 111.85 1uqy n HIS 97 Ca 0.11 -0.35 -0.31 0.00 -0.26 0.00 0.00 57.72 56.91 1uqy n HIS 97 Cb 0.08 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.19 1uqy n HIS 97 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1uqy n ASN 98 N 1.43 -2.29 -4.85 0.41 5.15 -0.40 -4.98 115.26 109.73 1uqy n ASN 98 Ca 0.21 -1.07 -0.36 0.00 -0.60 0.00 0.00 54.58 52.76 1uqy n ASN 98 Cb 0.58 -2.86 -0.06 0.00 -0.53 0.00 0.00 39.78 36.90 1uqy n ASN 98 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1uqy s LEU 99 N -6.91 4.26 0.25 1.20 1.43 -0.01 -5.01 118.68 113.88 1uqy s LEU 99 Ca 0.22 0.39 -0.31 0.00 -1.03 0.00 0.00 54.13 53.40 1uqy s LEU 99 Cb -0.09 -2.14 -0.11 0.00 0.03 0.00 0.00 46.19 43.88 1uqy s LEU 99 CO 0.90 0.37 1.57 -2.28 0.23 0.00 0.00 176.35 177.15 1uqy s HIS 100 N -1.07 2.89 -0.08 0.29 5.65 -0.56 -4.73 115.29 117.68 1uqy s HIS 100 Ca 0.17 0.74 0.04 0.00 0.25 0.00 0.00 55.06 56.27 1uqy s HIS 100 Cb -0.12 -4.00 -0.00 0.00 -1.18 0.00 0.00 32.58 27.28 1uqy s HIS 100 CO 0.07 -3.47 -0.22 -1.64 -0.65 0.00 0.00 174.74 168.83 1uqy s MET 101 N 0.05 2.62 -0.23 2.88 1.00 -1.26 -0.73 119.30 123.62 1uqy s MET 101 Ca 0.65 -0.81 -0.05 0.00 0.00 0.00 0.00 55.69 55.48 1uqy s MET 101 Cb -0.46 -2.08 -0.02 0.00 0.00 0.00 0.00 34.83 32.27 1uqy s MET 101 CO 0.42 0.23 0.00 0.08 0.00 0.00 0.00 175.02 175.75 1uqy s VAL 102 N 0.20 3.75 0.23 -6.03 1.01 -0.53 -1.37 120.40 117.66 1uqy s VAL 102 Ca -0.12 -0.37 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 1uqy s VAL 102 Cb -0.16 -2.73 -0.09 0.00 0.00 0.00 0.00 36.38 33.40 1uqy s VAL 102 CO 0.06 0.38 1.21 -0.83 0.00 0.00 0.00 175.10 175.92 1uqy s GLY 103 N 1.53 2.78 -0.14 4.51 0.00 0.37 -4.05 107.32 112.32 1uqy s GLY 103 Ca 0.06 1.01 -0.04 0.00 0.00 0.00 0.00 44.72 45.75 1uqy s GLY 103 CO -0.00 1.81 0.19 -1.58 0.00 0.00 0.00 173.10 173.52 1uqy s HIS 104 N -0.46 -0.21 -0.04 1.90 5.04 -1.26 -0.83 115.29 119.43 1uqy s HIS 104 Ca 0.51 0.41 -0.12 0.00 -1.54 0.00 0.00 55.06 54.31 1uqy s HIS 104 Cb -0.34 -0.32 0.02 0.00 0.04 0.00 0.00 32.58 31.98 1uqy s HIS 104 CO 0.40 -0.43 0.29 -0.08 -2.34 0.00 0.00 174.74 172.58 1uqy s THR 105 N 2.30 0.04 -0.05 0.89 -1.32 -1.26 -3.71 115.64 112.54 1uqy s THR 105 Ca 0.04 -0.35 -0.26 0.00 -1.21 0.00 0.00 61.69 59.91 1uqy s THR 105 Cb -0.14 -0.53 -0.22 0.00 -1.51 0.00 0.00 72.50 70.10 1uqy s THR 105 CO -0.09 -0.19 1.12 -0.07 -2.21 0.00 0.00 174.62 173.18 1uqy h LEU 106 N 4.50 0.04 -7.51 9.08 3.38 -1.23 -3.41 115.31 120.16 1uqy h LEU 106 Ca -0.29 -0.65 -0.56 0.00 0.09 0.00 0.00 57.88 56.47 1uqy h LEU 106 Cb 1.18 -0.01 -0.39 0.00 0.09 0.00 0.00 40.66 41.54 1uqy h LEU 106 CO 0.37 0.68 -0.78 -0.69 0.09 0.00 0.00 178.44 178.11 1uqy s VAL 107 N -3.61 1.09 -0.01 1.22 1.01 0.17 -4.81 120.40 115.46 1uqy s VAL 107 Ca -0.17 -0.85 -0.17 0.00 0.00 0.00 0.00 61.98 60.79 1uqy s VAL 107 Cb 0.00 -1.41 0.03 0.00 0.00 0.00 0.00 36.38 35.00 1uqy s VAL 107 CO 0.69 -0.08 0.37 0.86 0.00 0.00 0.00 175.10 176.94 1uqy s TRP 108 N 1.61 -0.25 -1.05 5.22 -0.00 -1.26 -2.04 118.94 121.16 1uqy s TRP 108 Ca -0.03 0.37 0.28 0.00 -0.00 0.00 0.00 56.10 56.72 1uqy s TRP 108 Cb -0.17 0.15 1.02 0.00 -0.00 0.00 0.00 33.47 34.47 1uqy s TRP 108 CO -0.07 -0.45 1.77 -2.39 -0.00 0.00 0.00 176.95 175.81 1uqy n HIS 109 N 1.09 0.00 -4.12 5.86 1.44 -1.26 -4.83 115.22 113.40 1uqy n HIS 109 Ca -0.21 0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.23 1uqy n HIS 109 Cb 0.57 -0.40 -0.07 0.00 0.12 0.00 0.00 29.99 30.21 1uqy n HIS 109 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1uqy s SER 110 N -2.96 5.23 -1.34 4.39 0.01 -1.26 -4.62 113.70 113.15 1uqy s SER 110 Ca 0.14 -0.20 -0.01 0.00 1.31 0.00 0.00 55.95 57.19 1uqy s SER 110 Cb 0.19 -1.28 -0.00 0.00 0.21 0.00 0.00 66.02 65.13 1uqy s SER 110 CO 0.58 0.10 0.59 0.00 0.41 0.00 0.00 173.24 174.92 1uqy n GLN 111 N -0.06 -4.13 -3.76 12.44 6.02 -1.26 -4.87 117.38 121.77 1uqy n GLN 111 Ca -0.09 0.53 -0.13 0.00 -0.01 0.00 0.00 57.00 57.31 1uqy n GLN 111 Cb 0.54 -4.89 -0.13 0.00 1.02 0.00 0.00 30.24 26.78 1uqy n GLN 111 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 1uqy s ILE 112 N -3.78 -0.02 0.30 5.09 2.07 -1.26 -0.80 121.20 122.80 1uqy s ILE 112 Ca 0.02 0.09 -0.29 0.00 -1.41 0.00 0.00 60.65 59.05 1uqy s ILE 112 Cb -0.01 -0.34 -0.11 0.00 0.13 0.00 0.00 42.46 42.14 1uqy s ILE 112 CO 0.84 0.04 1.48 -1.00 -1.91 0.00 0.00 174.94 174.39 1uqy s HIS 113 N 0.75 2.84 0.56 3.50 3.76 -1.26 -4.90 115.29 120.54 1uqy s HIS 113 Ca -0.05 1.04 0.25 0.00 -0.15 0.00 0.00 55.06 56.15 1uqy s HIS 113 Cb -0.07 -3.93 1.54 0.00 1.11 0.00 0.00 32.58 31.24 1uqy s HIS 113 CO -0.04 -2.92 2.12 -0.44 -0.85 0.00 0.00 174.74 172.61 1uqy h ASP 114 N 4.25 0.00 -0.09 1.40 3.32 -1.97 -1.79 116.42 121.54 1uqy h ASP 114 Ca -0.48 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.60 1uqy h ASP 114 Cb 1.22 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.77 1uqy h ASP 114 CO 0.73 0.00 0.25 -0.33 -1.72 0.00 0.00 179.24 178.18 1uqy h GLU 115 N 0.00 0.00 -0.41 3.56 3.07 -1.88 -0.32 114.58 118.60 1uqy h GLU 115 Ca 0.08 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.86 1uqy h GLU 115 Cb 0.37 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.26 1uqy h GLU 115 CO -0.00 0.00 -0.06 0.28 -1.40 0.00 0.00 179.01 177.83 1uqy h VAL 116 N 0.00 1.24 0.00 3.13 2.07 -1.64 -3.34 116.25 117.71 1uqy h VAL 116 Ca 0.04 -1.02 -0.08 0.00 0.82 0.00 0.00 66.70 66.46 1uqy h VAL 116 Cb 0.55 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1uqy h VAL 116 CO -0.00 0.35 -1.86 0.49 0.02 0.00 0.00 177.57 176.57 1uqy n PHE 117 N -4.21 0.00 -4.58 1.57 3.72 -0.26 -4.89 117.46 108.82 1uqy n PHE 117 Ca 0.02 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.19 1uqy n PHE 117 Cb 0.31 -0.50 -0.14 0.00 -0.94 0.00 0.00 39.48 38.21 1uqy n PHE 117 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1uqy s LYS 118 N -2.98 1.13 0.91 -1.08 1.02 -0.46 -1.51 119.74 116.79 1uqy s LYS 118 Ca -0.07 -0.64 -0.11 0.00 0.02 0.00 0.00 55.97 55.17 1uqy s LYS 118 Cb 0.09 -1.13 0.14 0.00 -0.52 0.00 0.00 37.83 36.42 1uqy s LYS 118 CO 0.70 0.30 1.10 -0.80 -0.92 0.00 0.00 175.35 175.72 1uqy s ASN 119 N -0.68 3.18 0.60 2.83 0.01 0.67 -4.54 114.94 117.02 1uqy s ASN 119 Ca 0.05 1.76 0.37 0.00 -0.71 0.00 0.00 52.86 54.33 1uqy s ASN 119 Cb -0.07 -2.38 1.92 0.00 0.41 0.00 0.00 41.25 41.14 1uqy s ASN 119 CO 0.00 -2.87 2.21 0.00 -1.51 0.00 0.00 177.10 174.93 1uqy h ALA 120 N -1.70 1.09 -0.00 0.60 0.00 -1.98 0.15 119.26 117.42 1uqy h ALA 120 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1uqy h ALA 120 Cb 1.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1uqy h ALA 120 CO 0.50 0.03 -0.01 -0.40 0.00 0.00 0.00 179.25 179.36 1uqy n ASP 121 N -3.25 0.34 0.00 0.00 5.68 -1.26 -4.91 116.55 113.15 1uqy n ASP 121 Ca -0.02 -0.95 0.00 0.00 -0.50 0.00 0.00 54.79 53.32 1uqy n ASP 121 Cb 0.17 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 1uqy n ASP 121 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uqy n GLY 122 N 1.10 2.50 3.78 6.12 0.00 0.04 -5.07 105.19 113.66 1uqy n GLY 122 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 1uqy n GLY 122 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uqy s SER 123 N -1.35 6.37 0.41 1.61 1.04 -1.26 -4.73 113.70 115.79 1uqy s SER 123 Ca 0.00 2.15 -0.24 0.00 0.48 0.00 0.00 55.95 58.34 1uqy s SER 123 Cb 0.00 -2.59 -0.09 0.00 0.10 0.00 0.00 66.02 63.44 1uqy s SER 123 CO 0.00 -0.77 1.08 -0.31 0.98 0.00 0.00 173.24 174.22 1uqy s TYR 124 N -1.66 3.18 0.79 5.02 2.02 -1.26 -0.24 117.35 125.21 1uqy s TYR 124 Ca 0.63 1.62 -0.12 0.00 -0.37 0.00 0.00 57.07 58.83 1uqy s TYR 124 Cb -0.24 -3.21 0.07 0.00 -0.40 0.00 0.00 41.96 38.18 1uqy s TYR 124 CO 0.30 -0.86 1.12 0.96 -1.57 0.00 0.00 175.55 175.50 1uqy s ILE 125 N -1.60 2.80 0.76 2.71 -4.36 -0.57 -4.80 121.20 116.15 1uqy s ILE 125 Ca 0.58 0.26 -0.11 0.00 -0.26 0.00 0.00 60.65 61.12 1uqy s ILE 125 Cb -0.24 -3.13 0.05 0.00 1.25 0.00 0.00 42.46 40.39 1uqy s ILE 125 CO 0.30 -0.34 1.10 -0.94 0.24 0.00 0.00 174.94 175.30 1uqy s SER 126 N -4.19 4.52 0.22 4.36 1.04 -1.26 -4.86 113.70 113.52 1uqy s SER 126 Ca 0.61 1.87 -0.08 0.00 0.48 0.00 0.00 55.95 58.82 1uqy s SER 126 Cb -0.13 -2.53 0.27 0.00 0.10 0.00 0.00 66.02 63.74 1uqy s SER 126 CO 0.52 -2.03 1.80 0.50 0.98 0.00 0.00 173.24 175.02 1uqy h LYS 127 N -1.00 0.66 -0.76 4.02 3.64 -1.97 -0.98 116.57 120.18 1uqy h LYS 127 Ca -0.44 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 58.91 1uqy h LYS 127 Cb 1.23 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.87 1uqy h LYS 127 CO 0.51 0.44 0.50 0.00 -2.27 0.00 0.00 179.45 178.63 1uqy h ALA 128 N 1.37 0.97 -0.57 5.00 0.00 -1.94 0.13 119.26 124.21 1uqy h ALA 128 Ca 0.32 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 1uqy h ALA 128 Cb 0.24 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1uqy h ALA 128 CO -0.21 0.39 0.08 0.00 0.00 0.00 0.00 179.25 179.51 1uqy h ALA 129 N 1.28 0.76 -0.35 0.00 0.00 -1.81 -1.98 119.26 117.16 1uqy h ALA 129 Ca 0.28 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1uqy h ALA 129 Cb -0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1uqy h ALA 129 CO -0.06 0.52 -0.33 1.25 0.00 0.00 0.00 179.25 180.63 1uqy h LEU 130 N 0.85 0.81 -0.76 0.00 5.85 -0.84 -2.46 115.31 118.77 1uqy h LEU 130 Ca 0.17 -0.34 0.05 0.00 0.84 0.00 0.00 57.88 58.60 1uqy h LEU 130 Cb 0.43 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 1uqy h LEU 130 CO 0.01 1.07 0.46 -0.61 -0.34 0.00 0.00 178.44 179.04 1uqy h GLN 131 N 0.65 0.85 -0.61 1.25 5.75 -0.60 -0.10 115.11 122.30 1uqy h GLN 131 Ca 0.07 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.51 1uqy h GLN 131 Cb 0.87 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 29.20 1uqy h GLN 131 CO 0.08 0.56 0.34 -0.22 -2.65 0.00 0.00 178.83 176.94 1uqy h LYS 132 N 0.87 0.84 -0.57 1.69 3.64 -1.12 -0.01 116.57 121.91 1uqy h LYS 132 Ca 0.32 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.59 1uqy h LYS 132 Cb 0.10 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1uqy h LYS 132 CO -0.15 0.63 0.29 0.87 -2.27 0.00 0.00 179.45 178.82 1uqy h LYS 133 N 0.82 0.82 -0.70 1.90 1.57 -0.95 -1.47 116.57 118.57 1uqy h LYS 133 Ca 0.21 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1uqy h LYS 133 Cb 0.02 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 1uqy h LYS 133 CO -0.04 0.66 0.40 1.98 -0.57 0.00 0.00 179.45 181.88 1uqy h MET 134 N 0.78 0.96 -0.24 3.15 4.05 -0.46 -0.31 114.93 122.86 1uqy h MET 134 Ca 0.20 -0.10 0.01 0.00 -0.28 0.00 0.00 59.70 59.53 1uqy h MET 134 Cb 0.10 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 30.69 1uqy h MET 134 CO -0.03 0.70 0.14 0.93 0.23 0.00 0.00 176.91 178.88 1uqy h GLU 135 N 0.95 0.28 -0.45 0.39 5.08 -0.82 -0.43 114.58 119.58 1uqy h GLU 135 Ca 0.25 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.56 1uqy h GLU 135 Cb 0.00 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 1uqy h GLU 135 CO -0.04 0.19 0.15 1.49 -1.00 0.00 0.00 179.01 179.79 1uqy h GLU 136 N 0.29 0.70 -0.01 2.33 4.81 -1.04 -1.15 114.58 120.51 1uqy h GLU 136 Ca 0.09 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1uqy h GLU 136 Cb -0.01 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 1uqy h GLU 136 CO -0.04 0.67 0.00 1.25 -0.73 0.00 0.00 179.01 180.16 1uqy h HIS 137 N 0.60 0.02 -0.29 0.92 2.76 -0.52 -1.68 115.15 116.95 1uqy h HIS 137 Ca 0.15 -0.00 -0.12 0.00 -2.20 0.00 0.00 60.37 58.20 1uqy h HIS 137 Cb 0.26 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.21 1uqy h HIS 137 CO 0.01 0.18 -0.29 0.82 -1.30 0.00 0.00 177.93 177.36 1uqy h ILE 138 N -0.15 1.30 -0.97 6.26 2.04 -1.07 0.23 117.51 125.15 1uqy h ILE 138 Ca 0.00 -1.46 0.02 0.00 1.00 0.00 0.00 64.86 64.43 1uqy h ILE 138 Cb 0.17 1.59 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 1uqy h ILE 138 CO -0.00 0.47 0.64 0.74 0.00 0.00 0.00 178.15 179.99 1uqy h THR 139 N 0.44 1.21 0.14 -0.27 2.02 -1.18 0.27 112.91 115.55 1uqy h THR 139 Ca 0.05 -0.44 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 1uqy h THR 139 Cb 0.86 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1uqy h THR 139 CO 0.07 0.23 -0.07 0.74 0.37 0.00 0.00 175.52 176.87 1uqy h THR 140 N 1.27 0.98 0.09 3.16 2.02 -1.15 -1.87 112.91 117.41 1uqy h THR 140 Ca 0.37 -1.12 -0.00 0.00 0.77 0.00 0.00 66.41 66.42 1uqy h THR 140 Cb -0.08 1.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1uqy h THR 140 CO -0.10 0.24 -0.05 0.25 0.37 0.00 0.00 175.52 176.24 1uqy h LEU 141 N -0.78 -0.11 -1.37 2.58 5.85 -0.85 -0.04 115.31 120.60 1uqy h LEU 141 Ca -0.02 -0.48 -0.07 0.00 0.84 0.00 0.00 57.88 58.16 1uqy h LEU 141 Cb 0.54 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1uqy h LEU 141 CO 0.03 0.49 -0.31 0.00 -0.34 0.00 0.00 178.44 178.31 1uqy h ALA 142 N -0.06 1.40 -0.35 1.25 0.00 -1.13 -2.92 119.26 117.45 1uqy h ALA 142 Ca -0.01 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 1uqy h ALA 142 Cb 0.58 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1uqy h ALA 142 CO 0.02 0.39 -0.11 0.78 0.00 0.00 0.00 179.25 180.34 1uqy h GLY 143 N 1.05 0.74 0.97 0.00 0.00 -1.25 -2.05 103.07 102.53 1uqy h GLY 143 Ca -0.00 -0.63 0.06 0.00 0.00 0.00 0.00 47.33 46.76 1uqy h GLY 143 CO 0.04 0.57 0.53 -0.09 0.00 0.00 0.00 176.54 177.60 1uqy h ARG 144 N 0.47 0.89 -0.37 4.80 2.43 -0.80 -2.68 114.38 119.12 1uqy h ARG 144 Ca 0.08 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1uqy h ARG 144 Cb 0.62 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1uqy h ARG 144 CO 0.04 0.59 0.00 0.66 -1.51 0.00 0.00 179.97 179.75 1uqy n TYR 145 N -4.48 1.01 -1.63 2.20 4.01 -1.21 -4.98 117.16 112.08 1uqy n TYR 145 Ca 0.12 -0.73 -0.51 0.00 -0.16 0.00 0.00 57.90 56.63 1uqy n TYR 145 Cb 0.20 -0.25 -0.05 0.00 -0.31 0.00 0.00 39.34 38.92 1uqy n TYR 145 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1uqy n LYS 146 N 0.11 1.52 0.00 -0.72 4.81 -0.77 -0.45 118.16 122.66 1uqy n LYS 146 Ca 0.20 0.55 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 1uqy n LYS 146 Cb 0.80 -2.25 0.00 0.00 0.02 0.00 0.00 35.03 33.60 1uqy n LYS 146 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1uqy n GLY 147 N 3.13 2.98 0.12 3.14 0.00 -1.26 -4.78 105.19 108.52 1uqy n GLY 147 Ca 0.19 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 1uqy n GLY 147 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1uqy n LYS 148 N -2.00 0.61 -2.88 1.61 5.02 0.41 -4.84 118.16 116.09 1uqy n LYS 148 Ca 0.00 0.40 -0.41 0.00 -2.02 0.00 0.00 58.31 56.28 1uqy n LYS 148 Cb 0.00 -1.64 -0.04 0.00 -0.02 0.00 0.00 35.03 33.33 1uqy n LYS 148 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1uqy s LEU 149 N -7.54 4.22 0.32 -0.35 1.43 -0.87 -4.64 118.68 111.25 1uqy s LEU 149 Ca -0.32 1.25 0.17 0.00 -1.03 0.00 0.00 54.13 54.20 1uqy s LEU 149 Cb 0.09 -3.27 0.21 0.00 0.03 0.00 0.00 46.19 43.26 1uqy s LEU 149 CO 0.59 -0.34 1.52 0.00 0.23 0.00 0.00 176.35 178.34 1uqy h ALA 150 N 7.16 0.76 -2.60 4.21 0.00 -1.54 -3.45 119.26 123.80 1uqy h ALA 150 Ca -0.32 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.08 1uqy h ALA 150 Cb 1.15 -0.07 -0.18 0.00 0.00 0.00 0.00 17.79 18.70 1uqy h ALA 150 CO 0.82 0.53 -0.49 0.00 0.00 0.00 0.00 179.25 180.10 1uqy s ALA 151 N -3.09 -0.14 -0.03 0.00 0.00 -1.12 -1.15 121.76 116.23 1uqy s ALA 151 Ca 0.04 -0.48 0.02 0.00 0.00 0.00 0.00 51.96 51.54 1uqy s ALA 151 Cb 0.08 0.25 0.01 0.00 0.00 0.00 0.00 23.12 23.46 1uqy s ALA 151 CO 0.72 -0.33 -0.09 -1.58 0.00 0.00 0.00 175.76 174.48 1uqy s TRP 152 N -2.57 1.04 -0.67 0.00 0.52 -0.19 -0.48 118.94 116.60 1uqy s TRP 152 Ca -0.05 -0.29 -0.27 0.00 0.02 0.00 0.00 56.10 55.51 1uqy s TRP 152 Cb -0.01 -0.76 0.02 0.00 -1.15 0.00 0.00 33.47 31.56 1uqy s TRP 152 CO -0.04 -0.14 1.41 -0.51 0.02 0.00 0.00 176.95 177.69 1uqy s ASP 153 N 0.33 6.00 -0.12 2.95 1.01 -0.01 -0.57 116.67 126.26 1uqy s ASP 153 Ca -0.06 -0.12 -0.24 0.00 0.71 0.00 0.00 52.55 52.84 1uqy s ASP 153 Cb -0.10 -2.55 -0.21 0.00 1.01 0.00 0.00 42.92 41.07 1uqy s ASP 153 CO 0.01 -1.89 0.69 0.58 0.21 0.00 0.00 175.17 174.76 1uqy h VAL 154 N 6.27 1.43 -4.23 -1.27 2.07 -1.51 -1.24 116.25 117.76 1uqy h VAL 154 Ca -0.27 -1.98 -0.54 0.00 0.82 0.00 0.00 66.70 64.73 1uqy h VAL 154 Cb 1.08 2.66 -0.30 0.00 -1.52 0.00 0.00 31.29 33.21 1uqy h VAL 154 CO 1.24 0.47 -0.83 -0.69 0.02 0.00 0.00 177.57 177.78 1uqy s VAL 155 N -2.32 1.33 -0.10 2.57 1.01 -1.24 -0.65 120.40 121.00 1uqy s VAL 155 Ca -0.15 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1uqy s VAL 155 Cb -0.02 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.25 1uqy s VAL 155 CO 0.57 0.38 -0.23 0.21 0.00 0.00 0.00 175.10 176.03 1uqy s ASN 156 N -0.32 2.97 -0.90 3.32 2.47 -0.87 -1.90 114.94 119.71 1uqy s ASN 156 Ca 0.05 -0.54 -0.01 0.00 0.42 0.00 0.00 52.86 52.78 1uqy s ASN 156 Cb -0.07 -1.36 0.00 0.00 -1.45 0.00 0.00 41.25 38.37 1uqy s ASN 156 CO -0.00 0.14 0.75 -0.62 -3.72 0.00 0.00 177.10 173.65 1uqy n GLU 157 N 3.61 -5.01 0.03 0.43 1.02 -0.16 -4.59 120.64 115.98 1uqy n GLU 157 Ca -0.19 0.62 0.12 0.00 -0.02 0.00 0.00 57.16 57.69 1uqy n GLU 157 Cb 0.53 -4.97 0.25 0.00 -0.02 0.00 0.00 31.44 27.22 1uqy n GLU 157 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1uqy n ALA 158 N -3.44 3.09 -2.71 0.62 0.00 -1.26 -4.79 120.51 112.02 1uqy n ALA 158 Ca -0.18 -0.27 -0.36 0.00 0.00 0.00 0.00 53.44 52.63 1uqy n ALA 158 Cb 0.61 -1.19 -0.09 0.00 0.00 0.00 0.00 19.45 18.79 1uqy n ALA 158 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1uqy s VAL 159 N -3.09 5.32 0.78 0.00 1.01 -1.26 -0.43 120.40 122.73 1uqy s VAL 159 Ca 0.09 0.16 -0.12 0.00 0.00 0.00 0.00 61.98 62.11 1uqy s VAL 159 Cb 0.15 -3.45 0.06 0.00 0.00 0.00 0.00 36.38 33.14 1uqy s VAL 159 CO 0.69 0.39 1.13 -0.83 0.00 0.00 0.00 175.10 176.49 1uqy s GLY 160 N 0.72 1.61 0.01 4.51 0.00 0.91 -4.60 107.32 110.47 1uqy s GLY 160 Ca 0.07 -0.45 0.26 0.00 0.00 0.00 0.00 44.72 44.61 1uqy s GLY 160 CO 0.01 -0.00 1.83 1.22 0.00 0.00 0.00 173.10 176.16 1uqy n ASP 161 N -3.29 0.02 -0.41 1.64 8.00 -1.26 -1.47 116.55 119.78 1uqy n ASP 161 Ca 0.07 0.50 0.06 0.00 0.71 0.00 0.00 54.79 56.13 1uqy n ASP 161 Cb 0.59 -0.51 0.20 0.00 -0.02 0.00 0.00 41.12 41.38 1uqy n ASP 161 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1uqy n ASP 162 N -1.52 1.20 0.00 -2.24 5.75 -1.26 -4.92 116.55 113.56 1uqy n ASP 162 Ca 0.06 -1.88 0.00 0.00 -0.01 0.00 0.00 54.79 52.96 1uqy n ASP 162 Cb 0.31 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1uqy n ASP 162 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1uqy n LEU 163 N 0.11 0.31 -4.96 -2.12 4.77 -0.54 -5.01 117.00 109.56 1uqy n LEU 163 Ca 0.10 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.86 1uqy n LEU 163 Cb 0.21 -0.74 0.03 0.00 -2.33 0.00 0.00 43.42 40.59 1uqy n LEU 163 CO 0.07 -0.22 0.35 -0.54 -1.33 0.00 0.00 177.39 175.72 1uqy s LYS 164 N -0.44 2.70 0.36 3.23 1.02 -1.26 -4.84 119.74 120.51 1uqy s LYS 164 Ca 0.00 -0.66 -0.28 0.00 0.02 0.00 0.00 55.97 55.05 1uqy s LYS 164 Cb 0.00 -2.50 -0.12 0.00 -0.52 0.00 0.00 37.83 34.70 1uqy s LYS 164 CO 0.00 -0.59 1.40 -1.33 -0.92 0.00 0.00 175.35 173.91 1uqy n MET 165 N -2.28 2.41 -1.84 1.68 2.81 -1.26 -0.06 117.12 118.57 1uqy n MET 165 Ca 0.06 0.85 -0.41 0.00 -1.81 0.00 0.00 57.70 56.38 1uqy n MET 165 Cb 0.59 -2.51 -0.02 0.00 -0.71 0.00 0.00 33.22 30.58 1uqy n MET 165 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1uqy s ARG 166 N -1.93 4.16 -0.46 0.03 3.52 0.42 -4.43 118.95 120.27 1uqy s ARG 166 Ca 0.55 2.50 -0.05 0.00 -0.13 0.00 0.00 55.73 58.60 1uqy s ARG 166 Cb -0.52 -3.04 -0.06 0.00 -1.56 0.00 0.00 34.95 29.77 1uqy s ARG 166 CO 0.63 -0.56 3.05 -3.47 -0.81 0.00 0.00 175.30 174.13 1uqy n ASP 167 N 2.00 6.35 -4.90 -2.12 2.03 -1.26 -4.67 116.55 113.98 1uqy n ASP 167 Ca 0.07 -2.91 -0.29 0.00 0.52 0.00 0.00 54.79 52.18 1uqy n ASP 167 Cb 0.38 -1.33 0.08 0.00 -0.72 0.00 0.00 41.12 39.53 1uqy n ASP 167 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1uqy s SER 168 N 1.04 4.76 0.24 1.67 1.04 -1.26 -4.83 113.70 116.36 1uqy s SER 168 Ca 0.62 0.86 -0.07 0.00 0.48 0.00 0.00 55.95 57.84 1uqy s SER 168 Cb 0.33 -1.44 0.24 0.00 0.10 0.00 0.00 66.02 65.25 1uqy s SER 168 CO -0.12 -1.75 1.91 0.45 0.98 0.00 0.00 173.24 174.70 1uqy h HIS 169 N -0.94 1.16 -0.48 5.02 -0.00 -1.94 0.24 115.15 118.21 1uqy h HIS 169 Ca -0.46 0.03 0.10 0.00 -0.00 0.00 0.00 60.37 60.04 1uqy h HIS 169 Cb 1.31 -0.39 -0.10 0.00 -0.00 0.00 0.00 27.41 28.23 1uqy h HIS 169 CO 0.36 0.72 -0.21 -1.49 -0.00 0.00 0.00 177.93 177.31 1uqy h TRP 170 N 1.24 -0.53 -0.09 2.45 4.06 -1.95 -0.62 115.95 120.51 1uqy h TRP 170 Ca 0.35 0.05 -0.23 0.00 2.06 0.00 0.00 58.89 61.12 1uqy h TRP 170 Cb -0.12 0.31 0.01 0.00 -1.00 0.00 0.00 29.16 28.36 1uqy h TRP 170 CO -0.01 -0.29 -0.83 -0.92 -3.56 0.00 0.00 178.44 172.83 1uqy h TYR 171 N -0.11 1.00 -0.71 0.49 3.20 -1.73 -1.47 116.97 117.65 1uqy h TYR 171 Ca 0.22 -0.48 -0.04 0.00 3.14 0.00 0.00 58.73 61.58 1uqy h TYR 171 Cb 0.46 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.55 1uqy h TYR 171 CO -0.48 1.31 0.30 0.87 -1.64 0.00 0.00 178.16 178.52 1uqy h LYS 172 N 0.41 1.04 0.07 1.82 1.57 -0.82 0.57 116.57 121.23 1uqy h LYS 172 Ca -0.08 -0.16 -0.23 0.00 -1.87 0.00 0.00 60.65 58.31 1uqy h LYS 172 Cb 1.47 -0.18 0.02 0.00 0.08 0.00 0.00 32.23 33.62 1uqy h LYS 172 CO 0.17 0.83 -0.94 0.82 -0.57 0.00 0.00 179.45 179.76 1uqy h ILE 173 N 1.02 1.37 0.00 1.86 2.04 -1.11 -3.41 117.51 119.28 1uqy h ILE 173 Ca 0.24 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.79 1uqy h ILE 173 Cb 0.16 2.70 0.00 0.00 -0.74 0.00 0.00 36.82 38.94 1uqy h ILE 173 CO -0.02 0.69 -1.29 0.23 0.00 0.00 0.00 178.15 177.75 1uqy n MET 174 N -4.00 1.02 0.00 2.37 2.81 -0.56 -4.52 117.12 114.24 1uqy n MET 174 Ca -0.12 -0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.69 1uqy n MET 174 Cb 0.84 -1.21 0.00 0.00 -0.71 0.00 0.00 33.22 32.14 1uqy n MET 174 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1uqy n GLY 175 N 1.73 0.12 0.00 3.03 0.00 0.18 -3.63 105.19 106.62 1uqy n GLY 175 Ca -0.01 -0.98 0.09 0.00 0.00 0.00 0.00 46.02 45.12 1uqy n GLY 175 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1uqy n ASP 176 N -2.10 0.00 0.20 1.61 5.68 -1.26 -1.64 116.55 119.03 1uqy n ASP 176 Ca 0.00 0.06 0.17 0.00 -0.50 0.00 0.00 54.79 54.52 1uqy n ASP 176 Cb 0.00 -0.31 0.82 0.00 -1.14 0.00 0.00 41.12 40.49 1uqy n ASP 176 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1uqy h ASP 177 N 0.00 0.00 -0.48 -1.12 3.32 -1.97 -1.08 116.42 115.09 1uqy h ASP 177 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1uqy h ASP 177 Cb 0.20 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 1uqy h ASP 177 CO 0.00 0.00 0.27 2.19 -1.72 0.00 0.00 179.24 179.98 1uqy h PHE 178 N 0.00 0.68 0.04 4.55 -5.15 -1.49 0.19 116.94 115.76 1uqy h PHE 178 Ca 0.09 -0.01 -0.00 0.00 -0.20 0.00 0.00 57.97 57.85 1uqy h PHE 178 Cb 0.53 -0.22 0.00 0.00 0.22 0.00 0.00 35.95 36.48 1uqy h PHE 178 CO 0.00 0.49 -0.02 0.82 -2.00 0.00 0.00 178.31 177.60 1uqy h ILE 179 N 0.71 1.17 -0.46 0.88 2.04 -1.44 -2.82 117.51 117.60 1uqy h ILE 179 Ca 0.18 -1.70 0.08 0.00 1.00 0.00 0.00 64.86 64.43 1uqy h ILE 179 Cb 0.03 2.15 -0.07 0.00 -0.74 0.00 0.00 36.82 38.19 1uqy h ILE 179 CO -0.03 0.37 0.03 0.22 0.00 0.00 0.00 178.15 178.74 1uqy h TYR 180 N -0.93 0.02 -0.47 1.37 3.20 -1.29 -2.31 116.97 116.56 1uqy h TYR 180 Ca -0.01 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.79 1uqy h TYR 180 Cb 0.65 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 1uqy h TYR 180 CO 0.16 -0.07 -0.13 -0.91 -1.64 0.00 0.00 178.16 175.57 1uqy h ASN 181 N 0.14 0.87 -0.41 -2.11 2.35 -0.74 -1.96 115.58 113.72 1uqy h ASN 181 Ca 0.23 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1uqy h ASN 181 Cb 0.33 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 1uqy h ASN 181 CO -0.36 1.01 0.25 0.00 -1.65 0.00 0.00 177.43 176.68 1uqy h ALA 182 N 1.06 0.52 -0.46 -0.83 0.00 -1.20 0.13 119.26 118.48 1uqy h ALA 182 Ca 0.12 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1uqy h ALA 182 Cb 0.65 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1uqy h ALA 182 CO 0.05 0.01 -0.16 0.74 0.00 0.00 0.00 179.25 179.89 1uqy h PHE 183 N 0.54 1.05 -0.21 0.00 0.04 -1.38 -0.45 116.94 116.54 1uqy h PHE 183 Ca 0.15 -0.24 -0.00 0.00 2.80 0.00 0.00 57.97 60.67 1uqy h PHE 183 Cb -0.01 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 37.89 1uqy h PHE 183 CO -0.04 1.03 0.12 1.15 -0.60 0.00 0.00 178.31 179.98 1uqy h THR 184 N 0.76 1.10 -0.10 -1.55 2.02 -1.06 -0.85 112.91 113.23 1uqy h THR 184 Ca 0.11 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 1uqy h THR 184 Cb 0.73 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1uqy h THR 184 CO 0.06 0.09 0.06 -0.07 0.37 0.00 0.00 175.52 176.03 1uqy h LEU 185 N 0.24 0.12 -0.91 2.58 3.38 -0.92 -0.91 115.31 118.89 1uqy h LEU 185 Ca 0.07 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.05 1uqy h LEU 185 Cb 0.05 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 1uqy h LEU 185 CO -0.01 0.13 0.58 0.00 0.09 0.00 0.00 178.44 179.23 1uqy h ALA 186 N 1.00 1.22 -0.31 1.53 0.00 -0.90 -1.10 119.26 120.70 1uqy h ALA 186 Ca 0.04 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1uqy h ALA 186 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1uqy h ALA 186 CO -0.01 0.40 -0.24 -0.97 0.00 0.00 0.00 179.25 178.44 1uqy h ASN 187 N 1.10 0.61 0.03 0.00 -1.24 -0.84 -0.64 115.58 114.60 1uqy h ASN 187 Ca 0.37 -0.21 -0.12 0.00 0.71 0.00 0.00 56.30 57.05 1uqy h ASN 187 Cb 0.07 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 1uqy h ASN 187 CO -0.14 0.84 -0.37 -0.33 -1.29 0.00 0.00 177.43 176.14 1uqy h GLU 188 N 0.54 0.46 0.07 6.67 5.08 -0.62 -2.67 114.58 124.11 1uqy h GLU 188 Ca 0.08 -0.22 -0.16 0.00 -1.00 0.00 0.00 59.36 58.06 1uqy h GLU 188 Cb 0.69 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.95 1uqy h GLU 188 CO 0.05 0.77 -0.68 0.28 -1.00 0.00 0.00 179.01 178.43 1uqy h VAL 189 N 0.39 1.48 -2.88 3.13 2.07 -0.86 -3.40 116.25 116.17 1uqy h VAL 189 Ca 0.04 -2.29 -0.60 0.00 0.82 0.00 0.00 66.70 64.67 1uqy h VAL 189 Cb 0.83 2.90 -0.40 0.00 -1.52 0.00 0.00 31.29 33.11 1uqy h VAL 189 CO 0.07 0.66 -0.77 -0.62 0.02 0.00 0.00 177.57 176.92 1uqy s ASP 190 N -6.83 3.47 0.57 0.57 -1.08 -0.28 -4.82 116.67 108.27 1uqy s ASP 190 Ca -0.14 -2.43 0.38 0.00 -0.52 0.00 0.00 52.55 49.85 1uqy s ASP 190 Cb 0.02 -0.83 1.99 0.00 -1.46 0.00 0.00 42.92 42.63 1uqy s ASP 190 CO 0.82 -0.29 2.15 -0.65 0.52 0.00 0.00 175.17 177.73 1uqy h PRO 191 N 6.91 0.00 0.00 4.34 0.11 -1.70 -2.09 132.00 139.58 1uqy h PRO 191 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1uqy h PRO 191 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1uqy h PRO 191 CO 0.42 0.00 -0.50 1.63 -0.21 0.00 0.00 178.00 179.34 1uqy n LYS 192 N -2.88 0.16 -2.28 1.05 5.02 -1.26 -4.93 118.16 113.04 1uqy n LYS 192 Ca -0.02 0.05 -0.39 0.00 -2.02 0.00 0.00 58.31 55.93 1uqy n LYS 192 Cb 0.10 -1.61 -0.02 0.00 -0.02 0.00 0.00 35.03 33.48 1uqy n LYS 192 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uqy s ALA 193 N -3.09 3.30 -0.43 7.82 0.00 -0.78 -4.95 121.76 123.62 1uqy s ALA 193 Ca 0.09 1.04 -0.24 0.00 0.00 0.00 0.00 51.96 52.84 1uqy s ALA 193 Cb 0.15 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.90 1uqy s ALA 193 CO 0.69 -0.49 0.86 -1.58 0.00 0.00 0.00 175.76 175.24 1uqy s HIS 194 N -1.29 3.00 -0.16 0.00 2.46 -0.30 -4.93 115.29 114.07 1uqy s HIS 194 Ca 0.52 0.39 -0.15 0.00 0.47 0.00 0.00 55.06 56.29 1uqy s HIS 194 Cb -0.33 -3.74 -0.04 0.00 -0.13 0.00 0.00 32.58 28.34 1uqy s HIS 194 CO 0.43 -0.97 0.35 -0.51 -2.47 0.00 0.00 174.74 171.57 1uqy s LEU 195 N 3.46 4.23 0.08 8.88 1.43 -1.26 -1.02 118.68 134.48 1uqy s LEU 195 Ca 0.34 0.56 0.08 0.00 -1.03 0.00 0.00 54.13 54.08 1uqy s LEU 195 Cb -0.11 -2.46 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 1uqy s LEU 195 CO 0.23 0.04 -0.22 -0.04 0.23 0.00 0.00 176.35 176.59 1uqy s MET 196 N 0.69 1.31 -0.15 1.70 -1.94 0.27 -1.00 119.30 120.17 1uqy s MET 196 Ca 0.19 -1.11 -0.08 0.00 -1.71 0.00 0.00 55.69 52.97 1uqy s MET 196 Cb -0.14 -1.55 -0.04 0.00 2.01 0.00 0.00 34.83 35.11 1uqy s MET 196 CO 0.06 0.38 0.13 -0.47 -0.01 0.00 0.00 175.02 175.11 1uqy s TYR 197 N -1.00 3.51 -0.00 -0.03 5.04 -0.98 -1.30 117.35 122.58 1uqy s TYR 197 Ca 0.08 0.43 0.04 0.00 -2.44 0.00 0.00 57.07 55.18 1uqy s TYR 197 Cb -0.10 -2.03 -0.01 0.00 0.35 0.00 0.00 41.96 40.17 1uqy s TYR 197 CO 0.04 0.54 -0.12 1.21 -1.34 0.00 0.00 175.55 175.88 1uqy s ASN 198 N -0.43 1.35 0.15 4.32 2.47 -0.80 -0.12 114.94 121.89 1uqy s ASN 198 Ca 0.12 -0.25 -0.24 0.00 0.42 0.00 0.00 52.86 52.91 1uqy s ASN 198 Cb -0.12 -0.14 0.07 0.00 -1.45 0.00 0.00 41.25 39.61 1uqy s ASN 198 CO 0.01 0.12 0.73 -0.62 -3.72 0.00 0.00 177.10 173.62 1uqy s ASP 199 N -0.41 -0.41 0.15 -4.21 -1.08 -0.80 -0.98 116.67 108.92 1uqy s ASP 199 Ca 0.04 -0.19 0.05 0.00 -0.52 0.00 0.00 52.55 51.93 1uqy s ASP 199 Cb -0.05 0.57 -0.04 0.00 -1.46 0.00 0.00 42.92 41.94 1uqy s ASP 199 CO -0.00 -0.97 0.13 -0.72 0.52 0.00 0.00 175.17 174.13 1uqy s TYR 200 N -3.59 3.16 -0.29 -5.34 -0.85 -1.26 -1.18 117.35 108.00 1uqy s TYR 200 Ca 0.05 -0.00 0.00 0.00 -0.52 0.00 0.00 57.07 56.60 1uqy s TYR 200 Cb -0.02 -1.53 0.00 0.00 0.38 0.00 0.00 41.96 40.79 1uqy s TYR 200 CO -0.06 0.52 0.00 0.09 -1.52 0.00 0.00 175.55 174.58 1uqy n ASN 201 N -0.22 -4.75 -0.23 -0.18 3.02 -1.26 -4.83 115.26 106.81 1uqy n ASN 201 Ca -0.08 0.07 0.10 0.00 -0.03 0.00 0.00 54.58 54.63 1uqy n ASN 201 Cb 0.54 -2.49 0.48 0.00 -0.61 0.00 0.00 39.78 37.71 1uqy n ASN 201 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1uqy n ILE 202 N -2.45 0.09 0.42 2.41 -5.35 -1.26 -2.42 119.36 110.80 1uqy n ILE 202 Ca -0.03 -0.15 0.13 0.00 -0.27 0.00 0.00 62.75 62.43 1uqy n ILE 202 Cb 0.33 -0.01 0.49 0.00 -1.74 0.00 0.00 39.64 38.71 1uqy n ILE 202 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1uqy h GLU 203 N 0.94 0.00 -6.29 6.28 3.07 -1.90 -3.37 114.58 113.31 1uqy h GLU 203 Ca 0.00 0.00 -0.66 0.00 -0.50 0.00 0.00 59.36 58.20 1uqy h GLU 203 Cb 0.21 0.00 -0.13 0.00 -0.84 0.00 0.00 28.75 27.98 1uqy h GLU 203 CO 0.00 0.00 -0.66 1.03 -1.40 0.00 0.00 179.01 177.98 1uqy s ARG 204 N -3.32 2.61 0.29 2.33 0.52 -1.01 -3.47 118.95 116.90 1uqy s ARG 204 Ca 0.05 -0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 54.20 1uqy s ARG 204 Cb 0.10 -2.57 -0.12 0.00 0.52 0.00 0.00 34.95 32.88 1uqy s ARG 204 CO 0.45 0.57 1.47 2.41 0.02 0.00 0.00 175.30 180.22 1uqy n THR 205 N 0.94 1.22 0.00 0.02 -1.04 -1.26 -1.27 114.28 112.89 1uqy n THR 205 Ca -0.12 -0.31 0.00 0.00 -2.04 0.00 0.00 64.05 61.58 1uqy n THR 205 Cb 0.52 -1.73 0.00 0.00 -1.82 0.00 0.00 70.33 67.31 1uqy n THR 205 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1uqy n GLY 206 N 1.81 2.23 0.25 3.41 0.00 -1.26 -4.71 105.19 106.92 1uqy n GLY 206 Ca 0.08 -0.67 0.01 0.00 0.00 0.00 0.00 46.02 45.44 1uqy n GLY 206 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1uqy h LYS 207 N 0.00 0.36 0.01 1.61 3.64 -1.82 -1.12 116.57 119.26 1uqy h LYS 207 Ca 0.00 -0.09 0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1uqy h LYS 207 Cb 0.00 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 1uqy h LYS 207 CO 0.00 0.49 -0.26 -0.09 -2.27 0.00 0.00 179.45 177.32 1uqy h ARG 208 N 0.34 -0.39 -0.11 1.90 2.43 -1.36 -1.40 114.38 115.80 1uqy h ARG 208 Ca 0.07 0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.11 1uqy h ARG 208 Cb 0.42 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1uqy h ARG 208 CO 0.02 -0.26 -0.59 0.93 -1.51 0.00 0.00 179.97 178.56 1uqy h GLU 209 N -0.40 0.35 -0.82 0.20 3.07 -1.67 -0.98 114.58 114.33 1uqy h GLU 209 Ca 0.06 -0.24 -0.02 0.00 -0.50 0.00 0.00 59.36 58.66 1uqy h GLU 209 Cb 0.48 0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.39 1uqy h GLU 209 CO -0.22 0.84 0.42 0.00 -1.40 0.00 0.00 179.01 178.65 1uqy h ALA 210 N 1.11 1.05 -0.35 3.43 0.00 -1.12 -1.49 119.26 121.89 1uqy h ALA 210 Ca -0.00 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1uqy h ALA 210 Cb 1.11 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1uqy h ALA 210 CO 0.10 0.59 -0.14 1.15 0.00 0.00 0.00 179.25 180.96 1uqy h THR 211 N 1.15 1.28 -0.64 0.00 2.02 -0.82 -2.02 112.91 113.89 1uqy h THR 211 Ca 0.28 -1.24 0.07 0.00 0.77 0.00 0.00 66.41 66.30 1uqy h THR 211 Cb 0.08 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.77 1uqy h THR 211 CO -0.04 0.41 0.33 0.58 0.37 0.00 0.00 175.52 177.16 1uqy h VAL 212 N 0.50 0.91 -0.48 3.16 2.07 -1.01 -0.48 116.25 120.92 1uqy h VAL 212 Ca 0.08 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.29 1uqy h VAL 212 Cb 0.66 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1uqy h VAL 212 CO 0.05 0.11 -0.11 -0.08 0.02 0.00 0.00 177.57 177.55 1uqy h GLU 213 N 0.59 0.93 0.01 1.57 4.57 -1.16 0.28 114.58 121.36 1uqy h GLU 213 Ca 0.30 -0.35 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1uqy h GLU 213 Cb 0.25 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1uqy h GLU 213 CO -0.22 1.01 -0.00 1.98 -1.18 0.00 0.00 179.01 180.60 1uqy h MET 214 N 0.78 -0.01 -0.56 1.92 4.05 -1.07 -2.48 114.93 117.56 1uqy h MET 214 Ca 0.12 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.48 1uqy h MET 214 Cb 0.66 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.44 1uqy h MET 214 CO 0.05 0.12 0.11 0.82 0.23 0.00 0.00 176.91 178.24 1uqy h ILE 215 N -0.13 1.25 -0.48 1.77 1.08 -1.01 -2.04 117.51 117.96 1uqy h ILE 215 Ca -0.00 -0.93 0.09 0.00 -0.39 0.00 0.00 64.86 63.64 1uqy h ILE 215 Cb 0.13 0.78 -0.08 0.00 -3.07 0.00 0.00 36.82 34.57 1uqy h ILE 215 CO 0.00 0.34 -0.04 -0.33 -0.69 0.00 0.00 178.15 177.43 1uqy h GLU 216 N 0.81 0.07 -0.05 2.37 5.08 -0.83 0.15 114.58 122.17 1uqy h GLU 216 Ca 0.17 -0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.35 1uqy h GLU 216 Cb 0.38 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1uqy h GLU 216 CO 0.01 0.05 -0.72 0.00 -1.00 0.00 0.00 179.01 177.34 1uqy h ARG 217 N 0.07 0.30 -0.61 2.33 2.47 -1.28 -1.51 114.38 116.15 1uqy h ARG 217 Ca 0.24 -0.25 -0.09 0.00 -1.26 0.00 0.00 59.98 58.62 1uqy h ARG 217 Cb 0.36 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.71 1uqy h ARG 217 CO -0.43 0.90 0.04 -0.07 0.56 0.00 0.00 179.97 180.96 1uqy h LEU 218 N 0.20 1.02 -0.98 3.04 3.38 -0.91 -2.12 115.31 118.94 1uqy h LEU 218 Ca -0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1uqy h LEU 218 Cb 1.29 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 1uqy h LEU 218 CO 0.12 1.05 0.54 1.56 0.09 0.00 0.00 178.44 181.80 1uqy h GLN 219 N 0.97 1.25 0.00 1.13 4.20 -0.33 -1.82 115.11 120.50 1uqy h GLN 219 Ca 0.18 -0.12 -0.08 0.00 0.06 0.00 0.00 58.65 58.69 1uqy h GLN 219 Cb 0.51 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1uqy h GLN 219 CO 0.02 0.88 -0.38 1.57 -0.67 0.00 0.00 178.83 180.25 1uqy h LYS 220 N 1.27 0.00 0.00 1.46 2.10 -1.11 0.11 116.57 120.39 1uqy h LYS 220 Ca 0.33 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.98 1uqy h LYS 220 Cb -0.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.29 1uqy h LYS 220 CO -0.06 0.38 0.00 -2.13 -2.00 0.00 0.00 179.45 175.64 1uqy n ARG 221 N -3.87 0.00 -0.30 0.07 0.63 -0.81 -4.87 116.66 107.51 1uqy n ARG 221 Ca -0.01 0.21 0.00 0.00 -0.92 0.00 0.00 57.85 57.12 1uqy n ARG 221 Cb 0.44 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.85 1uqy n ARG 221 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1uqy n GLY 222 N 0.25 0.83 3.73 5.14 0.00 0.39 -5.05 105.19 110.47 1uqy n GLY 222 Ca 0.04 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1uqy n GLY 222 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1uqy s MET 223 N -0.65 4.25 0.05 1.61 1.75 -0.74 -4.94 119.30 120.62 1uqy s MET 223 Ca 0.00 2.28 -0.31 0.00 -1.25 0.00 0.00 55.69 56.42 1uqy s MET 223 Cb 0.00 -3.16 -0.06 0.00 2.84 0.00 0.00 34.83 34.45 1uqy s MET 223 CO 0.00 -0.51 1.27 -1.25 -0.65 0.00 0.00 175.02 173.88 1uqy s PRO 224 N 0.64 4.37 -0.27 4.11 0.04 -1.26 -4.68 135.00 137.96 1uqy s PRO 224 Ca 0.65 1.85 -0.23 0.00 0.04 0.00 0.00 61.00 63.32 1uqy s PRO 224 Cb -0.42 -3.40 0.08 0.00 0.04 0.00 0.00 34.50 30.81 1uqy s PRO 224 CO 0.35 -0.38 0.76 -1.50 0.04 0.00 0.00 177.00 176.27 1uqy s ILE 225 N 1.46 0.00 -0.01 0.56 2.07 -1.26 -4.76 121.20 119.26 1uqy s ILE 225 Ca 0.60 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.86 1uqy s ILE 225 Cb -0.31 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.26 1uqy s ILE 225 CO 0.28 0.00 0.01 1.41 -1.91 0.00 0.00 174.94 174.73 1uqy n HIS 226 N 3.04 0.00 -4.04 3.50 8.25 -0.17 -4.98 115.22 120.82 1uqy n HIS 226 Ca -0.15 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.23 1uqy n HIS 226 Cb 0.56 -0.07 -0.10 0.00 1.12 0.00 0.00 29.99 31.51 1uqy n HIS 226 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1uqy s GLY 227 N -3.02 0.38 -0.12 -1.41 0.00 -0.52 -1.88 107.32 100.75 1uqy s GLY 227 Ca -0.01 -1.04 -0.00 0.00 0.00 0.00 0.00 44.72 43.67 1uqy s GLY 227 CO 0.06 -1.16 -0.09 -2.27 0.00 0.00 0.00 173.10 169.65 1uqy s LEU 228 N -2.77 1.28 -0.29 0.66 1.98 0.12 -2.33 118.68 117.34 1uqy s LEU 228 Ca 0.04 -0.33 -0.11 0.00 -2.89 0.00 0.00 54.13 50.84 1uqy s LEU 228 Cb 0.06 -0.89 -0.04 0.00 0.66 0.00 0.00 46.19 45.98 1uqy s LEU 228 CO -0.09 -0.10 0.20 -0.83 -1.89 0.00 0.00 176.35 173.63 1uqy s GLY 229 N 1.62 1.93 -0.30 7.98 0.00 0.83 -1.10 107.32 118.28 1uqy s GLY 229 Ca 0.04 -1.14 -0.13 0.00 0.00 0.00 0.00 44.72 43.50 1uqy s GLY 229 CO -0.08 0.67 0.25 -0.42 0.00 0.00 0.00 173.10 173.52 1uqy s ILE 230 N 1.75 5.27 0.18 0.90 1.01 0.66 -1.91 121.20 129.06 1uqy s ILE 230 Ca 0.07 0.10 -0.14 0.00 0.00 0.00 0.00 60.65 60.67 1uqy s ILE 230 Cb -0.16 -3.64 0.07 0.00 0.01 0.00 0.00 42.46 38.74 1uqy s ILE 230 CO 0.11 0.12 1.84 1.56 0.00 0.00 0.00 174.94 178.57 1uqy h GLN 231 N 8.39 0.71 -2.82 2.79 4.20 -1.43 -0.98 115.11 125.96 1uqy h GLN 231 Ca -0.33 -0.04 -0.18 0.00 0.06 0.00 0.00 58.65 58.16 1uqy h GLN 231 Cb 1.17 -0.16 0.05 0.00 0.30 0.00 0.00 27.48 28.84 1uqy h GLN 231 CO 0.60 0.47 -0.30 0.41 -0.67 0.00 0.00 178.83 179.35 1uqy n GLY 232 N -1.25 0.21 3.55 3.46 0.00 -1.26 -0.25 105.19 109.66 1uqy n GLY 232 Ca 0.03 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1uqy n GLY 232 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1uqy s HIS 233 N -3.01 2.52 0.19 1.61 3.76 -1.26 -2.34 115.29 116.76 1uqy s HIS 233 Ca 0.21 -0.72 0.04 0.00 -0.15 0.00 0.00 55.06 54.44 1uqy s HIS 233 Cb -0.09 -4.66 -0.03 0.00 1.11 0.00 0.00 32.58 28.91 1uqy s HIS 233 CO 0.26 -1.94 0.32 -0.51 -0.85 0.00 0.00 174.74 172.02 1uqy s LEU 234 N 4.99 4.33 0.50 0.89 1.43 -0.19 -4.92 118.68 125.71 1uqy s LEU 234 Ca 0.43 0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.68 1uqy s LEU 234 Cb -0.02 -2.88 0.02 0.00 0.03 0.00 0.00 46.19 43.34 1uqy s LEU 234 CO -0.05 -0.00 0.71 -0.83 0.23 0.00 0.00 176.35 176.40 1uqy s GLY 235 N -3.58 1.82 0.41 -3.19 0.00 0.65 -0.94 107.32 102.48 1uqy s GLY 235 Ca 0.34 -1.37 0.11 0.00 0.00 0.00 0.00 44.72 43.80 1uqy s GLY 235 CO 0.29 -1.13 1.94 1.19 0.00 0.00 0.00 173.10 175.39 1uqy h ILE 236 N 0.26 1.16 0.00 0.90 6.09 -1.78 -3.33 117.51 120.81 1uqy h ILE 236 Ca -0.42 -0.72 -0.35 0.00 -1.37 0.00 0.00 64.86 62.00 1uqy h ILE 236 Cb 1.29 1.23 -0.05 0.00 0.47 0.00 0.00 36.82 39.76 1uqy h ILE 236 CO 0.51 0.22 -2.18 0.47 -3.07 0.00 0.00 178.15 174.10 1uqy n ASP 237 N -4.29 1.69 -4.66 2.19 8.00 -1.26 -4.88 116.55 113.33 1uqy n ASP 237 Ca -0.01 0.19 -0.29 0.00 0.71 0.00 0.00 54.79 55.39 1uqy n ASP 237 Cb 0.26 -0.57 -0.08 0.00 -0.02 0.00 0.00 41.12 40.71 1uqy n ASP 237 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1uqy s THR 238 N -2.39 3.82 0.66 -3.53 -4.23 -1.25 -4.27 115.64 104.45 1uqy s THR 238 Ca -0.29 -1.15 -0.10 0.00 -1.18 0.00 0.00 61.69 58.96 1uqy s THR 238 Cb 0.11 -2.84 -0.00 0.00 1.34 0.00 0.00 72.50 71.10 1uqy s THR 238 CO 0.39 0.06 1.04 -2.16 -0.54 0.00 0.00 174.62 173.41 1uqy s PRO 239 N -2.46 3.06 0.62 3.99 0.04 -1.26 -0.26 135.00 138.74 1uqy s PRO 239 Ca 0.25 0.45 -0.15 0.00 0.04 0.00 0.00 61.00 61.59 1uqy s PRO 239 Cb -0.11 -2.09 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 1uqy s PRO 239 CO 0.18 -0.85 1.08 -1.25 0.04 0.00 0.00 177.00 176.20 1uqy s PRO 240 N -5.24 3.08 0.30 0.56 0.04 -1.26 -4.90 135.00 127.58 1uqy s PRO 240 Ca 0.56 1.29 0.06 0.00 0.04 0.00 0.00 61.00 62.96 1uqy s PRO 240 Cb -0.11 -1.99 0.77 0.00 0.04 0.00 0.00 34.50 33.21 1uqy s PRO 240 CO 0.51 -1.01 1.74 0.82 0.04 0.00 0.00 177.00 179.10 1uqy h ILE 241 N 0.25 0.61 -0.46 0.56 1.08 -1.97 -1.65 117.51 115.93 1uqy h ILE 241 Ca -0.47 -0.21 -0.01 0.00 -0.39 0.00 0.00 64.86 63.78 1uqy h ILE 241 Cb 1.23 -0.07 -0.02 0.00 -3.07 0.00 0.00 36.82 34.89 1uqy h ILE 241 CO 0.56 0.11 0.25 0.00 -0.69 0.00 0.00 178.15 178.38 1uqy h ALA 242 N 1.68 1.58 -0.07 1.87 0.00 -1.99 0.16 119.26 122.49 1uqy h ALA 242 Ca 0.59 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.40 1uqy h ALA 242 Cb 1.03 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1uqy h ALA 242 CO -0.44 0.35 -0.05 0.93 0.00 0.00 0.00 179.25 180.04 1uqy h GLU 243 N 0.64 0.17 -0.95 0.00 4.39 -1.58 -2.36 114.58 114.88 1uqy h GLU 243 Ca 0.16 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1uqy h GLU 243 Cb 0.02 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.62 1uqy h GLU 243 CO -0.03 0.57 0.60 0.82 -1.16 0.00 0.00 179.01 179.82 1uqy h ILE 244 N -0.24 1.25 -0.56 3.13 2.04 -1.21 -2.19 117.51 119.73 1uqy h ILE 244 Ca 0.01 -0.50 0.05 0.00 1.00 0.00 0.00 64.86 65.42 1uqy h ILE 244 Cb 0.53 -0.12 -0.05 0.00 -0.74 0.00 0.00 36.82 36.44 1uqy h ILE 244 CO 0.01 0.25 0.29 -0.08 0.00 0.00 0.00 178.15 178.63 1uqy h GLU 245 N 1.30 0.54 -0.49 2.37 4.81 -0.92 -1.40 114.58 120.79 1uqy h GLU 245 Ca 0.35 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.55 1uqy h GLU 245 Cb -0.10 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 1uqy h GLU 245 CO -0.07 0.36 0.32 0.87 -0.73 0.00 0.00 179.01 179.76 1uqy h LYS 246 N 0.56 0.61 -0.23 1.92 1.57 -0.84 -1.96 116.57 118.20 1uqy h LYS 246 Ca 0.25 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.92 1uqy h LYS 246 Cb 0.16 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1uqy h LYS 246 CO -0.17 0.41 -0.15 0.77 -0.57 0.00 0.00 179.45 179.73 1uqy h SER 247 N 0.63 0.53 -0.31 0.86 0.02 -1.02 -0.22 113.55 114.04 1uqy h SER 247 Ca 0.18 -0.44 0.02 0.00 -0.84 0.00 0.00 61.79 60.72 1uqy h SER 247 Cb -0.03 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 1uqy h SER 247 CO -0.04 0.85 0.15 0.40 -1.14 0.00 0.00 176.83 177.05 1uqy h ILE 248 N 0.21 0.99 -0.42 3.27 2.04 -0.88 -0.73 117.51 121.99 1uqy h ILE 248 Ca 0.05 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 1uqy h ILE 248 Cb 0.67 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 1uqy h ILE 248 CO 0.04 0.06 0.20 0.40 0.00 0.00 0.00 178.15 178.85 1uqy h ILE 249 N 0.32 1.18 -0.39 -0.67 2.04 -1.28 -1.84 117.51 116.86 1uqy h ILE 249 Ca 0.13 -0.51 -0.07 0.00 1.00 0.00 0.00 64.86 65.41 1uqy h ILE 249 Cb 0.05 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 1uqy h ILE 249 CO -0.09 0.20 -0.02 0.00 0.00 0.00 0.00 178.15 178.24 1uqy h ALA 250 N 1.04 0.53 -0.19 1.87 0.00 -0.75 -1.88 119.26 119.90 1uqy h ALA 250 Ca 0.14 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.61 1uqy h ALA 250 Cb 0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1uqy h ALA 250 CO -0.02 0.33 -0.59 0.74 0.00 0.00 0.00 179.25 179.71 1uqy h PHE 251 N 0.53 0.77 -0.64 0.00 0.04 -1.11 -2.78 116.94 113.74 1uqy h PHE 251 Ca 0.11 -0.28 -0.00 0.00 2.80 0.00 0.00 57.97 60.59 1uqy h PHE 251 Cb 0.50 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.48 1uqy h PHE 251 CO 0.04 1.04 0.39 0.00 -0.60 0.00 0.00 178.31 179.18 1uqy h ALA 252 N 0.90 1.48 0.00 2.45 0.00 -1.23 -1.47 119.26 121.39 1uqy h ALA 252 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1uqy h ALA 252 Cb 1.15 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1uqy h ALA 252 CO 0.11 0.46 0.00 0.87 0.00 0.00 0.00 179.25 180.69 1uqy h LYS 253 N 0.88 0.00 0.00 0.00 1.57 -1.04 0.05 116.57 118.03 1uqy h LYS 253 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1uqy h LYS 253 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1uqy h LYS 253 CO -0.04 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.12 1uqy n LEU 254 N -2.66 0.00 -1.41 2.94 4.77 -0.55 -4.87 117.00 115.22 1uqy n LEU 254 Ca -0.01 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.87 1uqy n LEU 254 Cb 0.13 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1uqy n LEU 254 CO 0.18 0.00 -0.01 0.61 -1.33 0.00 0.00 177.39 176.84 1uqy n GLY 255 N 0.81 0.14 3.49 -0.72 0.00 0.00 -5.03 105.19 103.88 1uqy n GLY 255 Ca 0.19 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 1uqy n GLY 255 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uqy s LEU 256 N -3.13 2.72 0.22 0.99 1.43 -1.24 -4.96 118.68 114.71 1uqy s LEU 256 Ca 0.12 -0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 52.46 1uqy s LEU 256 Cb -0.05 -1.58 -0.08 0.00 0.03 0.00 0.00 46.19 44.51 1uqy s LEU 256 CO 0.15 0.22 1.13 -0.13 0.23 0.00 0.00 176.35 177.95 1uqy s ARG 257 N -1.79 4.57 -0.17 1.70 1.81 -0.79 -4.28 118.95 120.01 1uqy s ARG 257 Ca 0.17 1.81 -0.13 0.00 -1.72 0.00 0.00 55.73 55.86 1uqy s ARG 257 Cb -0.11 -3.23 -0.05 0.00 -0.45 0.00 0.00 34.95 31.12 1uqy s ARG 257 CO 0.08 0.07 0.25 0.08 -0.68 0.00 0.00 175.30 175.11 1uqy s VAL 258 N -0.54 5.33 -0.02 3.52 1.01 -0.70 0.16 120.40 129.17 1uqy s VAL 258 Ca 0.49 0.46 0.06 0.00 0.00 0.00 0.00 61.98 62.99 1uqy s VAL 258 Cb -0.31 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 1uqy s VAL 258 CO 0.38 0.41 -0.20 -1.00 0.00 0.00 0.00 175.10 174.69 1uqy s HIS 259 N 0.38 1.81 -0.29 5.22 3.76 -0.26 -0.68 115.29 125.22 1uqy s HIS 259 Ca 0.15 -0.36 -0.13 0.00 -0.15 0.00 0.00 55.06 54.57 1uqy s HIS 259 Cb -0.13 -1.17 -0.04 0.00 1.11 0.00 0.00 32.58 32.36 1uqy s HIS 259 CO 0.03 -0.04 0.27 -0.06 -0.85 0.00 0.00 174.74 174.08 1uqy s PHE 260 N -0.43 3.23 -0.02 1.40 0.08 -0.21 -0.25 117.98 121.78 1uqy s PHE 260 Ca 0.07 0.14 0.12 0.00 0.12 0.00 0.00 56.93 57.37 1uqy s PHE 260 Cb -0.08 -2.48 -0.18 0.00 -0.57 0.00 0.00 43.02 39.70 1uqy s PHE 260 CO -0.00 -0.24 0.25 0.25 -0.10 0.00 0.00 175.22 175.38 1uqy n THR 261 N 5.11 0.02 -2.72 0.64 -2.24 -0.37 -0.20 114.28 114.52 1uqy n THR 261 Ca -0.12 -0.28 -0.05 0.00 -2.27 0.00 0.00 64.05 61.34 1uqy n THR 261 Cb 0.51 0.20 0.08 0.00 -2.10 0.00 0.00 70.33 69.02 1uqy n THR 261 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1uqy n SER 262 N -1.93 0.09 -4.73 3.42 7.64 0.66 -4.59 113.62 114.19 1uqy n SER 262 Ca -0.03 -2.37 -0.42 0.00 1.01 0.00 0.00 58.87 57.07 1uqy n SER 262 Cb 0.32 0.10 -0.03 0.00 -1.01 0.00 0.00 64.21 63.59 1uqy n SER 262 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1uqy s LEU 263 N -3.53 4.38 0.17 -3.43 1.43 0.18 -4.07 118.68 113.82 1uqy s LEU 263 Ca 0.22 2.56 -0.23 0.00 -1.03 0.00 0.00 54.13 55.65 1uqy s LEU 263 Cb 0.41 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 43.08 1uqy s LEU 263 CO -0.05 -0.71 0.71 1.51 0.23 0.00 0.00 176.35 178.04 1uqy s ASP 264 N 0.74 -0.41 -0.19 2.29 1.47 -0.99 -0.79 116.67 118.79 1uqy s ASP 264 Ca 0.63 -0.21 -0.00 0.00 1.18 0.00 0.00 52.55 54.14 1uqy s ASP 264 Cb -0.41 0.60 0.05 0.00 -0.34 0.00 0.00 42.92 42.82 1uqy s ASP 264 CO 0.37 -1.02 -0.04 -0.69 0.68 0.00 0.00 175.17 174.46 1uqy s VAL 265 N -3.66 1.19 -0.31 2.11 1.01 -0.86 -1.02 120.40 118.86 1uqy s VAL 265 Ca 0.06 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.93 1uqy s VAL 265 Cb -0.02 -1.43 0.01 0.00 0.00 0.00 0.00 36.38 34.94 1uqy s VAL 265 CO -0.05 0.02 1.09 -0.62 0.00 0.00 0.00 175.10 175.53 1uqy s ASP 266 N 1.58 6.94 0.00 3.32 -1.08 -0.12 -4.02 116.67 123.28 1uqy s ASP 266 Ca -0.02 1.11 0.22 0.00 -0.52 0.00 0.00 52.55 53.35 1uqy s ASP 266 Cb -0.17 -2.54 0.42 0.00 -1.46 0.00 0.00 42.92 39.17 1uqy s ASP 266 CO -0.07 -0.87 1.39 1.33 0.52 0.00 0.00 175.17 177.47 1uqy n VAL 267 N 5.82 0.53 -3.96 1.11 0.24 -1.26 -2.26 118.33 118.55 1uqy n VAL 267 Ca 0.12 -0.77 -0.25 0.00 -2.04 0.00 0.00 64.34 61.41 1uqy n VAL 267 Cb 0.47 0.95 -0.03 0.00 -1.47 0.00 0.00 33.84 33.77 1uqy n VAL 267 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1uqy s LEU 268 N -1.42 4.31 0.05 1.34 1.43 -1.26 -5.01 118.68 118.12 1uqy s LEU 268 Ca 0.38 0.13 -0.38 0.00 -1.03 0.00 0.00 54.13 53.23 1uqy s LEU 268 Cb 0.22 -2.88 -0.18 0.00 0.03 0.00 0.00 46.19 43.39 1uqy s LEU 268 CO 0.31 0.02 1.28 -2.65 0.23 0.00 0.00 176.35 175.54 1uqy n PRO 269 N -0.75 0.82 -3.24 1.29 -0.02 -1.26 -4.89 135.00 126.95 1uqy n PRO 269 Ca -0.07 0.30 -0.39 0.00 -2.02 0.00 0.00 63.50 61.31 1uqy n PRO 269 Cb 0.55 -1.90 -0.06 0.00 -0.02 0.00 0.00 33.50 32.07 1uqy n PRO 269 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1uqy s SER 270 N 0.43 7.01 0.00 2.55 0.15 -1.26 -4.97 113.70 117.61 1uqy s SER 270 Ca 0.87 1.20 0.07 0.00 0.70 0.00 0.00 55.95 58.79 1uqy s SER 270 Cb -1.05 -2.36 0.20 0.00 -1.71 0.00 0.00 66.02 61.10 1uqy s SER 270 CO 0.50 0.18 1.15 1.33 1.20 0.00 0.00 173.24 177.60 1uqy n VAL 271 N 2.28 0.95 0.06 4.45 0.24 -1.26 -4.74 118.33 120.31 1uqy n VAL 271 Ca -0.09 -0.97 -0.03 0.00 -2.04 0.00 0.00 64.34 61.21 1uqy n VAL 271 Cb 0.51 0.53 0.21 0.00 -1.47 0.00 0.00 33.84 33.62 1uqy n VAL 271 CO 0.00 0.00 0.00 -0.50 -2.14 0.00 0.00 176.83 174.19 1uqy h TRP 272 N 1.36 0.40 -1.16 6.34 4.06 -1.95 -3.31 115.95 121.69 1uqy h TRP 272 Ca 0.00 -0.10 -0.55 0.00 2.06 0.00 0.00 58.89 60.30 1uqy h TRP 272 Cb 0.64 -0.09 -0.42 0.00 -1.00 0.00 0.00 29.16 28.28 1uqy h TRP 272 CO 0.15 0.66 -0.80 0.39 -3.56 0.00 0.00 178.44 175.28 1uqy n GLU 273 N -4.06 3.36 -1.86 0.49 1.02 -1.26 -5.07 120.64 113.25 1uqy n GLU 273 Ca -0.01 -4.29 -0.30 0.00 -0.02 0.00 0.00 57.16 52.53 1uqy n GLU 273 Cb 0.45 -2.20 0.05 0.00 -0.02 0.00 0.00 31.44 29.72 1uqy n GLU 273 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1uqy s LEU 274 N -3.55 2.86 0.82 -4.62 1.43 -1.25 -5.03 118.68 109.34 1uqy s LEU 274 Ca 0.48 1.13 -0.12 0.00 -1.03 0.00 0.00 54.13 54.59 1uqy s LEU 274 Cb 0.40 -3.90 0.09 0.00 0.03 0.00 0.00 46.19 42.81 1uqy s LEU 274 CO -0.09 -1.40 1.15 -2.84 0.23 0.00 0.00 176.35 173.40 1uqy s PRO 275 N -5.35 1.67 0.45 1.29 0.02 -1.26 -4.84 135.00 126.98 1uqy s PRO 275 Ca 0.58 1.52 0.15 0.00 0.02 0.00 0.00 61.00 63.28 1uqy s PRO 275 Cb -0.11 -1.80 1.09 0.00 0.02 0.00 0.00 34.50 33.70 1uqy s PRO 275 CO 0.52 -2.14 2.00 -0.24 -0.33 0.00 0.00 177.00 176.81 1uqy h VAL 276 N -1.18 0.89 -0.05 3.83 3.04 -2.01 -0.35 116.25 120.41 1uqy h VAL 276 Ca -0.45 -0.11 0.02 0.00 -1.01 0.00 0.00 66.70 65.15 1uqy h VAL 276 Cb 1.27 0.53 -0.00 0.00 -2.01 0.00 0.00 31.29 31.08 1uqy h VAL 276 CO 0.46 0.06 0.06 0.00 -1.01 0.00 0.00 177.57 177.14 1uqy h ALA 277 N 1.72 1.67 -0.39 3.17 0.00 -2.05 -1.82 119.26 121.57 1uqy h ALA 277 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1uqy h ALA 277 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1uqy h ALA 277 CO -0.06 -0.09 0.00 0.39 0.00 0.00 0.00 179.25 179.49 1uqy n GLU 278 N -3.92 2.44 -0.28 0.00 1.02 -0.15 -4.65 120.64 115.10 1uqy n GLU 278 Ca -0.02 -2.24 0.10 0.00 -0.02 0.00 0.00 57.16 54.98 1uqy n GLU 278 Cb 0.15 -1.48 0.34 0.00 -0.02 0.00 0.00 31.44 30.43 1uqy n GLU 278 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1uqy h VAL 279 N 4.14 0.89 0.00 2.62 3.04 -1.30 0.13 116.25 125.77 1uqy h VAL 279 Ca 0.00 -0.27 -0.18 0.00 -1.01 0.00 0.00 66.70 65.24 1uqy h VAL 279 Cb 0.94 0.04 -0.03 0.00 -2.01 0.00 0.00 31.29 30.22 1uqy h VAL 279 CO 0.00 0.14 -1.80 -1.54 -1.01 0.00 0.00 177.57 173.36 1uqy n SER 280 N -4.56 0.43 -0.03 3.17 3.41 -1.26 -4.15 113.62 110.64 1uqy n SER 280 Ca 0.17 0.19 0.12 0.00 -0.26 0.00 0.00 58.87 59.08 1uqy n SER 280 Cb 0.40 0.81 0.16 0.00 -0.26 0.00 0.00 64.21 65.32 1uqy n SER 280 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1uqy n THR 281 N -2.70 0.00 0.30 6.66 -2.24 -0.87 -4.42 114.28 111.01 1uqy n THR 281 Ca -0.14 -0.01 0.14 0.00 -2.27 0.00 0.00 64.05 61.77 1uqy n THR 281 Cb 0.86 0.48 0.66 0.00 -2.10 0.00 0.00 70.33 70.23 1uqy n THR 281 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1uqy h ARG 282 N 0.13 0.00 -0.40 -0.78 0.11 -0.93 -1.33 114.38 111.17 1uqy h ARG 282 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1uqy h ARG 282 Cb 0.51 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.59 1uqy h ARG 282 CO 0.00 0.00 0.00 1.19 0.10 0.00 0.00 179.97 181.26 1uqy n PHE 283 N -2.55 0.53 -2.76 4.08 3.72 -1.26 -4.87 117.46 114.35 1uqy n PHE 283 Ca 0.00 -0.26 -0.36 0.00 -0.05 0.00 0.00 57.45 56.78 1uqy n PHE 283 Cb 0.17 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.65 1uqy n PHE 283 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1uqy s GLU 284 N -1.47 4.44 0.06 -1.08 0.41 -0.51 -4.50 118.70 116.05 1uqy s GLU 284 Ca 0.38 1.30 -0.31 0.00 -0.41 0.00 0.00 54.97 55.94 1uqy s GLU 284 Cb 0.21 -2.61 -0.06 0.00 -1.78 0.00 0.00 34.13 29.90 1uqy s GLU 284 CO 0.30 0.14 1.26 -0.47 -0.49 0.00 0.00 175.26 176.00 1uqy s TYR 285 N -1.77 3.35 -0.00 1.61 6.14 -1.26 -5.00 117.35 120.41 1uqy s TYR 285 Ca 0.54 1.18 0.01 0.00 0.64 0.00 0.00 57.07 59.44 1uqy s TYR 285 Cb -0.17 -3.50 0.00 0.00 0.42 0.00 0.00 41.96 38.72 1uqy s TYR 285 CO 0.22 -1.62 -0.02 0.15 0.64 0.00 0.00 175.55 174.92 1uqy s LYS 286 N 1.20 0.18 0.39 4.97 1.02 -1.26 -5.07 119.74 121.17 1uqy s LYS 286 Ca 0.60 -0.05 0.09 0.00 0.02 0.00 0.00 55.97 56.64 1uqy s LYS 286 Cb -0.31 -0.20 0.86 0.00 -0.52 0.00 0.00 37.83 37.66 1uqy s LYS 286 CO 0.29 0.02 1.94 -1.00 -0.92 0.00 0.00 175.35 175.68 1uqy h PRO 287 N 6.25 0.60 0.00 -1.68 0.13 -1.95 -0.43 132.00 134.92 1uqy h PRO 287 Ca -0.28 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 64.78 1uqy h PRO 287 Cb 1.19 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 1uqy h PRO 287 CO 0.50 0.40 -0.14 0.93 -0.23 0.00 0.00 178.00 179.46 1uqy h GLU 288 N 0.62 0.00 -0.00 0.86 3.07 -2.01 -0.81 114.58 116.31 1uqy h GLU 288 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1uqy h GLU 288 Cb 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 1uqy h GLU 288 CO -0.12 0.14 -0.05 0.54 -1.40 0.00 0.00 179.01 178.12 1uqy n ARG 289 N -3.78 0.78 -3.19 2.33 1.74 -0.18 -4.31 116.66 110.05 1uqy n ARG 289 Ca -0.02 -0.19 -0.23 0.00 -0.77 0.00 0.00 57.85 56.64 1uqy n ARG 289 Cb 0.25 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.14 1uqy n ARG 289 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1uqy n ASP 290 N -0.95 1.68 -0.00 0.55 2.03 -0.31 -4.26 116.55 115.29 1uqy n ASP 290 Ca 0.17 -3.08 0.14 0.00 0.52 0.00 0.00 54.79 52.54 1uqy n ASP 290 Cb 0.24 -0.63 0.54 0.00 -0.72 0.00 0.00 41.12 40.55 1uqy n ASP 290 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1uqy n PRO 291 N 0.70 0.00 -1.52 -0.67 -0.04 -1.24 -4.14 135.00 128.09 1uqy n PRO 291 Ca 0.25 -0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.53 1uqy n PRO 291 Cb 0.53 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.57 1uqy n PRO 291 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1uqy n TYR 292 N -1.50 2.19 0.25 0.54 4.01 -1.26 -4.76 117.16 116.63 1uqy n TYR 292 Ca 0.07 -2.15 0.09 0.00 -0.16 0.00 0.00 57.90 55.75 1uqy n TYR 292 Cb 0.34 -0.53 0.66 0.00 -0.31 0.00 0.00 39.34 39.50 1uqy n TYR 292 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 1uqy h THR 293 N 1.64 0.87 -0.00 -0.72 1.35 -1.86 -2.09 112.91 112.09 1uqy h THR 293 Ca 0.34 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 1uqy h THR 293 Cb 1.39 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 1uqy h THR 293 CO 0.73 0.10 -0.15 0.29 -0.25 0.00 0.00 175.52 176.24 1uqy n LYS 294 N -4.13 0.61 0.00 4.72 5.02 -1.26 -5.00 118.16 118.11 1uqy n LYS 294 Ca -0.03 -0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.04 1uqy n LYS 294 Cb 0.18 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1uqy n LYS 294 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1uqy n GLY 295 N 1.32 4.47 3.60 0.72 0.00 -0.79 -5.08 105.19 109.44 1uqy n GLY 295 Ca 0.13 -1.38 -0.40 0.00 0.00 0.00 0.00 46.02 44.37 1uqy n GLY 295 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1uqy s LEU 296 N 0.00 4.11 0.69 0.99 2.96 -1.26 -4.69 118.68 121.48 1uqy s LEU 296 Ca 0.00 0.39 -0.15 0.00 -0.22 0.00 0.00 54.13 54.15 1uqy s LEU 296 Cb 0.00 -2.64 0.02 0.00 0.50 0.00 0.00 46.19 44.07 1uqy s LEU 296 CO 0.00 -0.33 1.16 -2.16 -1.32 0.00 0.00 176.35 173.71 1uqy s PRO 297 N 2.33 2.46 0.34 0.98 0.04 -1.26 -4.70 135.00 135.18 1uqy s PRO 297 Ca 0.20 1.60 0.07 0.00 0.04 0.00 0.00 61.00 62.92 1uqy s PRO 297 Cb -0.16 -1.89 0.76 0.00 0.04 0.00 0.00 34.50 33.25 1uqy s PRO 297 CO 0.10 -1.55 1.86 0.37 0.04 0.00 0.00 177.00 177.82 1uqy h GLN 298 N -0.09 0.74 -0.65 4.56 5.75 -1.98 -0.09 115.11 123.35 1uqy h GLN 298 Ca -0.47 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 57.98 1uqy h GLN 298 Cb 1.27 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 29.63 1uqy h GLN 298 CO 0.52 0.49 0.39 1.05 -2.65 0.00 0.00 178.83 178.63 1uqy h GLU 299 N 0.76 0.87 0.01 1.69 -0.00 -2.00 0.12 114.58 116.03 1uqy h GLU 299 Ca 0.46 -0.07 -0.21 0.00 -0.00 0.00 0.00 59.36 59.54 1uqy h GLU 299 Cb 0.66 -0.19 -0.01 0.00 -0.00 0.00 0.00 28.75 29.22 1uqy h GLU 299 CO -0.22 0.60 -0.92 0.52 -0.00 0.00 0.00 179.01 178.99 1uqy h MET 300 N 0.89 0.26 -0.80 1.06 2.86 -1.41 -2.49 114.93 115.29 1uqy h MET 300 Ca 0.23 -0.29 0.09 0.00 -2.06 0.00 0.00 59.70 57.67 1uqy h MET 300 Cb -0.04 0.09 -0.07 0.00 0.06 0.00 0.00 31.60 31.63 1uqy h MET 300 CO -0.04 1.01 0.46 1.96 1.06 0.00 0.00 176.91 181.36 1uqy h GLN 301 N 0.14 0.77 -0.25 1.72 1.08 -0.42 -0.16 115.11 117.98 1uqy h GLN 301 Ca -0.06 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 1uqy h GLN 301 Cb 1.56 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 28.81 1uqy h GLN 301 CO 0.15 0.51 0.11 -0.44 -0.95 0.00 0.00 178.83 178.20 1uqy h ASP 302 N 0.79 0.34 -0.73 1.46 3.32 -0.67 -0.33 116.42 120.61 1uqy h ASP 302 Ca 0.38 -0.15 -0.06 0.00 0.02 0.00 0.00 57.03 57.22 1uqy h ASP 302 Cb 0.31 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 1uqy h ASP 302 CO -0.23 0.40 0.22 0.11 -1.72 0.00 0.00 179.24 178.02 1uqy h LYS 303 N 0.26 1.13 -0.52 3.56 1.57 -1.05 -0.56 116.57 120.96 1uqy h LYS 303 Ca 0.09 -0.25 -0.05 0.00 -1.87 0.00 0.00 60.65 58.57 1uqy h LYS 303 Cb 0.16 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1uqy h LYS 303 CO -0.01 0.97 0.14 1.25 -0.57 0.00 0.00 179.45 181.23 1uqy h LEU 304 N 1.08 0.78 -0.55 2.94 5.85 -0.84 -1.03 115.31 123.54 1uqy h LEU 304 Ca 0.23 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1uqy h LEU 304 Cb 0.31 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 1uqy h LEU 304 CO -0.01 0.80 0.30 0.00 -0.34 0.00 0.00 178.44 179.20 1uqy h ALA 305 N 1.01 0.70 -0.65 1.25 0.00 -0.74 -1.30 119.26 119.53 1uqy h ALA 305 Ca 0.17 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1uqy h ALA 305 Cb 0.32 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1uqy h ALA 305 CO -0.00 0.22 0.13 -0.22 0.00 0.00 0.00 179.25 179.38 1uqy h LYS 306 N 0.74 1.05 -0.00 0.00 1.63 -0.92 -0.13 116.57 118.94 1uqy h LYS 306 Ca 0.19 -0.26 -0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1uqy h LYS 306 Cb 0.04 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 31.54 1uqy h LYS 306 CO -0.03 0.95 0.00 -0.09 -3.45 0.00 0.00 179.45 176.83 1uqy h ARG 307 N 0.99 0.00 -0.92 1.90 9.65 -0.88 0.61 114.38 125.73 1uqy h ARG 307 Ca 0.20 -0.00 0.02 0.00 -1.10 0.00 0.00 59.98 59.11 1uqy h ARG 307 Cb 0.40 -0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.93 1uqy h ARG 307 CO 0.01 0.15 0.61 1.88 2.80 0.00 0.00 179.97 185.42 1uqy h TYR 308 N -0.15 1.14 -0.43 2.20 0.05 -1.13 -2.10 116.97 116.55 1uqy h TYR 308 Ca 0.00 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.78 1uqy h TYR 308 Cb 0.15 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 37.49 1uqy h TYR 308 CO -0.03 0.69 0.17 1.49 -1.05 0.00 0.00 178.16 179.44 1uqy h GLU 309 N 1.21 0.65 -0.55 4.88 4.81 -0.57 -0.52 114.58 124.49 1uqy h GLU 309 Ca 0.35 -0.12 0.05 0.00 -0.13 0.00 0.00 59.36 59.52 1uqy h GLU 309 Cb -0.07 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.16 1uqy h GLU 309 CO -0.09 0.60 0.27 -0.44 -0.73 0.00 0.00 179.01 178.62 1uqy h ASP 310 N 0.56 0.38 -0.20 1.04 3.32 -0.74 0.18 116.42 120.95 1uqy h ASP 310 Ca 0.14 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 1uqy h ASP 310 Cb 0.19 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1uqy h ASP 310 CO -0.01 0.25 0.03 0.25 -1.72 0.00 0.00 179.24 178.04 1uqy h LEU 311 N 0.52 0.33 -0.89 1.55 5.85 -0.96 -2.45 115.31 119.25 1uqy h LEU 311 Ca 0.25 -0.27 -0.10 0.00 0.84 0.00 0.00 57.88 58.60 1uqy h LEU 311 Cb 0.18 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1uqy h LEU 311 CO -0.19 0.52 -0.46 -0.26 -0.34 0.00 0.00 178.44 177.72 1uqy h PHE 312 N 0.13 0.00 -0.61 1.25 -1.00 -0.84 -1.18 116.94 114.68 1uqy h PHE 312 Ca 0.06 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.88 1uqy h PHE 312 Cb 0.33 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.85 1uqy h PHE 312 CO 0.02 0.46 0.36 0.87 -1.61 0.00 0.00 178.31 178.41 1uqy h LYS 313 N 0.00 0.68 -0.46 1.51 1.57 -0.86 0.43 116.57 119.44 1uqy h LYS 313 Ca -0.00 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1uqy h LYS 313 Cb 0.95 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 1uqy h LYS 313 CO 0.06 0.45 0.20 1.25 -0.57 0.00 0.00 179.45 180.84 1uqy h LEU 314 N 0.70 0.62 -0.65 2.94 5.85 -0.87 -1.11 115.31 122.79 1uqy h LEU 314 Ca 0.26 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1uqy h LEU 314 Cb 0.07 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1uqy h LEU 314 CO -0.13 0.60 0.38 -0.26 -0.34 0.00 0.00 178.44 178.69 1uqy h PHE 315 N 0.60 0.87 -0.46 1.25 0.04 -0.90 -2.06 116.94 116.28 1uqy h PHE 315 Ca 0.16 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.92 1uqy h PHE 315 Cb 0.15 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.00 1uqy h PHE 315 CO -0.00 0.60 0.29 0.82 -0.60 0.00 0.00 178.31 179.41 1uqy h ILE 316 N 0.88 1.14 -0.92 -0.55 2.04 -0.75 -0.10 117.51 119.25 1uqy h ILE 316 Ca 0.23 -0.29 0.17 0.00 1.00 0.00 0.00 64.86 65.96 1uqy h ILE 316 Cb -0.00 0.50 -0.08 0.00 -0.74 0.00 0.00 36.82 36.50 1uqy h ILE 316 CO -0.04 0.14 0.59 0.50 0.00 0.00 0.00 178.15 179.34 1uqy h LYS 317 N 0.62 0.63 -0.48 2.37 3.64 -0.63 -2.14 116.57 120.57 1uqy h LYS 317 Ca 0.17 -0.04 -0.27 0.00 -1.27 0.00 0.00 60.65 59.23 1uqy h LYS 317 Cb -0.03 -0.14 -0.17 0.00 -0.41 0.00 0.00 32.23 31.49 1uqy h LYS 317 CO -0.03 0.41 -0.03 0.72 -2.27 0.00 0.00 179.45 178.25 1uqy n HIS 318 N -4.59 1.53 0.25 1.91 8.25 -0.83 -4.73 115.22 117.01 1uqy n HIS 318 Ca 0.19 -1.78 0.09 0.00 -0.26 0.00 0.00 57.72 55.96 1uqy n HIS 318 Cb 0.54 -0.58 0.64 0.00 1.12 0.00 0.00 29.99 31.71 1uqy n HIS 318 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1uqy h SER 319 N 1.16 0.00 0.13 0.41 4.64 -0.33 -0.21 113.55 119.36 1uqy h SER 319 Ca 0.30 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.61 1uqy h SER 319 Cb 1.70 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.79 1uqy h SER 319 CO 0.56 0.13 -0.02 -2.24 -0.87 0.00 0.00 176.83 174.39 1uqy h ASP 320 N 0.00 0.00 0.13 4.97 2.03 -1.85 -2.78 116.42 118.93 1uqy h ASP 320 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1uqy h ASP 320 Cb 0.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.78 1uqy h ASP 320 CO 0.02 0.02 -1.47 0.29 -1.03 0.00 0.00 179.24 177.07 1uqy n LYS 321 N -3.50 0.39 -4.58 4.15 5.02 -0.10 -4.96 118.16 114.57 1uqy n LYS 321 Ca -0.03 -0.09 -0.33 0.00 -2.02 0.00 0.00 58.31 55.84 1uqy n LYS 321 Cb 0.12 -1.54 -0.13 0.00 -0.02 0.00 0.00 35.03 33.46 1uqy n LYS 321 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1uqy s ILE 322 N -3.30 3.50 -0.14 -0.18 1.01 -1.05 -1.72 121.20 119.33 1uqy s ILE 322 Ca -0.01 -0.50 0.19 0.00 0.00 0.00 0.00 60.65 60.33 1uqy s ILE 322 Cb 0.14 -2.51 -0.17 0.00 0.01 0.00 0.00 42.46 39.94 1uqy s ILE 322 CO 0.87 0.51 0.69 0.47 0.00 0.00 0.00 174.94 177.48 1uqy n ASP 323 N 3.51 0.57 -3.58 3.58 9.92 0.14 -4.66 116.55 126.03 1uqy n ASP 323 Ca -0.18 0.24 -0.12 0.00 -0.53 0.00 0.00 54.79 54.21 1uqy n ASP 323 Cb 0.53 0.69 -0.06 0.00 -0.64 0.00 0.00 41.12 41.64 1uqy n ASP 323 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1uqy s ARG 324 N -3.06 0.68 -0.22 -1.24 3.52 -1.26 -1.70 118.95 115.68 1uqy s ARG 324 Ca -0.04 0.31 -0.01 0.00 -0.13 0.00 0.00 55.73 55.85 1uqy s ARG 324 Cb 0.09 0.32 0.06 0.00 -1.56 0.00 0.00 34.95 33.87 1uqy s ARG 324 CO 0.83 -0.18 -0.01 0.00 -0.81 0.00 0.00 175.30 175.13 1uqy s ALA 325 N -0.77 1.49 -0.10 6.12 0.00 -0.28 -1.04 121.76 127.18 1uqy s ALA 325 Ca -0.02 -1.06 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 1uqy s ALA 325 Cb -0.02 -1.32 -0.03 0.00 0.00 0.00 0.00 23.12 21.75 1uqy s ALA 325 CO 0.02 -1.20 -0.05 0.99 0.00 0.00 0.00 175.76 175.52 1uqy s THR 326 N 1.62 3.86 0.06 0.00 2.01 0.72 -0.96 115.64 122.96 1uqy s THR 326 Ca -0.03 -0.40 -0.12 0.00 0.31 0.00 0.00 61.69 61.45 1uqy s THR 326 Cb -0.18 -2.63 -0.06 0.00 0.01 0.00 0.00 72.50 69.64 1uqy s THR 326 CO -0.08 0.56 0.41 -0.36 -0.69 0.00 0.00 174.62 174.47 1uqy s PHE 327 N -0.37 3.63 -1.41 4.92 0.40 -0.22 -0.64 117.98 124.28 1uqy s PHE 327 Ca 0.06 0.88 -0.08 0.00 -0.60 0.00 0.00 56.93 57.18 1uqy s PHE 327 Cb -0.12 -2.22 0.06 0.00 0.51 0.00 0.00 43.02 41.25 1uqy s PHE 327 CO 0.02 0.55 2.44 1.87 0.70 0.00 0.00 175.22 180.80 1uqy n TRP 328 N 1.20 2.70 0.00 0.36 -0.00 0.03 -1.31 117.44 120.42 1uqy n TRP 328 Ca -0.10 -2.91 0.00 0.00 -0.00 0.00 0.00 57.50 54.49 1uqy n TRP 328 Cb 0.52 -2.11 0.00 0.00 -0.00 0.00 0.00 31.31 29.72 1uqy n TRP 328 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1uqy n GLY 329 N 2.67 3.41 0.11 5.87 0.00 -1.23 -4.66 105.19 111.36 1uqy n GLY 329 Ca 0.62 -1.80 -0.19 0.00 0.00 0.00 0.00 46.02 44.65 1uqy n GLY 329 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1uqy n VAL 330 N -1.60 1.51 -4.29 1.61 0.31 -1.26 -4.59 118.33 110.01 1uqy n VAL 330 Ca 0.00 -0.08 -0.16 0.00 -0.01 0.00 0.00 64.34 64.09 1uqy n VAL 330 Cb 0.00 -2.12 -0.10 0.00 -0.91 0.00 0.00 33.84 30.71 1uqy n VAL 330 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1uqy s SER 331 N -6.68 2.10 0.48 4.52 1.04 -1.26 -3.57 113.70 110.32 1uqy s SER 331 Ca -0.30 -1.03 0.13 0.00 0.48 0.00 0.00 55.95 55.23 1uqy s SER 331 Cb 0.08 -0.06 1.14 0.00 0.10 0.00 0.00 66.02 67.28 1uqy s SER 331 CO 0.45 -0.29 2.11 0.44 0.98 0.00 0.00 173.24 176.94 1uqy h ASP 332 N 2.67 0.14 -0.24 7.02 3.32 -1.24 -1.98 116.42 126.11 1uqy h ASP 332 Ca -0.37 -0.00 0.06 0.00 0.02 0.00 0.00 57.03 56.73 1uqy h ASP 332 Cb 1.20 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 1uqy h ASP 332 CO 0.63 0.11 0.17 -2.24 -1.72 0.00 0.00 179.24 176.19 1uqy h ASP 333 N 0.16 0.03 -0.03 6.45 2.03 -1.85 -2.43 116.42 120.78 1uqy h ASP 333 Ca 0.04 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 1uqy h ASP 333 Cb 0.00 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 38.49 1uqy h ASP 333 CO -0.01 0.02 -0.00 0.00 -1.03 0.00 0.00 179.24 178.22 1uqy n ALA 334 N -2.58 2.48 -1.90 4.15 0.00 -0.74 -4.98 120.51 116.94 1uqy n ALA 334 Ca 0.03 -0.66 -0.41 0.00 0.00 0.00 0.00 53.44 52.39 1uqy n ALA 334 Cb 0.29 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 18.86 1uqy n ALA 334 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1uqy s SER 335 N -2.01 6.91 0.50 0.00 0.15 -0.92 -4.89 113.70 113.45 1uqy s SER 335 Ca 0.29 2.47 0.34 0.00 0.70 0.00 0.00 55.95 59.75 1uqy s SER 335 Cb 0.20 -2.62 1.71 0.00 -1.71 0.00 0.00 66.02 63.59 1uqy s SER 335 CO 0.31 -0.48 2.02 4.11 1.20 0.00 0.00 173.24 180.40 1uqy h TRP 336 N 4.57 0.00 0.00 3.44 5.08 -1.91 -2.26 115.95 124.86 1uqy h TRP 336 Ca -0.46 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.51 1uqy h TRP 336 Cb 1.22 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.38 1uqy h TRP 336 CO 0.60 0.00 0.00 1.28 -1.28 0.00 0.00 178.44 179.04 1uqy n LEU 337 N -2.75 0.46 0.16 0.11 4.77 -1.26 -1.63 117.00 116.85 1uqy n LEU 337 Ca -0.01 0.58 0.03 0.00 -0.03 0.00 0.00 56.01 56.57 1uqy n LEU 337 Cb 0.13 -0.48 0.40 0.00 -2.33 0.00 0.00 43.42 41.14 1uqy n LEU 337 CO 0.18 -0.30 0.83 0.78 -1.33 0.00 0.00 177.39 177.56 1uqy h ASN 338 N 0.00 0.12 -0.02 -1.43 2.35 -1.66 -3.31 115.58 111.63 1uqy h ASN 338 Ca 0.00 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1uqy h ASN 338 Cb 0.47 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1uqy h ASN 338 CO 0.00 0.35 0.00 0.61 -1.65 0.00 0.00 177.43 176.74 1uqy n GLY 339 N -0.76 -0.50 2.91 2.83 0.00 -0.77 -0.93 105.19 107.98 1uqy n GLY 339 Ca -0.01 -0.22 -0.18 0.00 0.00 0.00 0.00 46.02 45.61 1uqy n GLY 339 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1uqy s PHE 340 N -0.65 0.59 -2.14 1.61 5.36 -0.65 -3.28 117.98 118.82 1uqy s PHE 340 Ca 0.09 -0.13 0.29 0.00 -0.96 0.00 0.00 56.93 56.22 1uqy s PHE 340 Cb 0.06 -0.49 1.21 0.00 -0.34 0.00 0.00 43.02 43.46 1uqy s PHE 340 CO 0.09 -0.10 1.83 -0.35 -1.46 0.00 0.00 175.22 175.23 1uqy n PRO 341 N 3.60 1.24 -4.29 10.12 -0.04 -1.26 -4.35 135.00 140.02 1uqy n PRO 341 Ca -0.21 -0.58 -0.34 0.00 -0.04 0.00 0.00 63.50 62.34 1uqy n PRO 341 Cb 0.54 -1.49 -0.15 0.00 -0.04 0.00 0.00 33.50 32.36 1uqy n PRO 341 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1uqy s ILE 342 N -2.16 2.85 0.41 0.52 1.01 -1.25 -4.84 121.20 117.74 1uqy s ILE 342 Ca 0.36 -0.69 -0.26 0.00 0.00 0.00 0.00 60.65 60.06 1uqy s ILE 342 Cb 0.21 -2.24 -0.09 0.00 0.01 0.00 0.00 42.46 40.35 1uqy s ILE 342 CO 0.39 0.49 1.31 -2.84 0.00 0.00 0.00 174.94 174.29 1uqy s PRO 343 N 1.04 3.95 -0.27 2.79 0.02 -1.21 -3.74 135.00 137.59 1uqy s PRO 343 Ca -0.01 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.18 1uqy s PRO 343 Cb -0.15 -2.74 0.00 0.00 0.02 0.00 0.00 34.50 31.63 1uqy s PRO 343 CO -0.03 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.54 1uqy n GLY 344 N 0.66 0.56 3.91 0.52 0.00 -1.17 -4.80 105.19 104.87 1uqy n GLY 344 Ca 0.04 -0.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.83 1uqy n GLY 344 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1uqy s ARG 345 N -2.33 2.70 -0.44 1.61 0.52 -0.10 -5.04 118.95 115.88 1uqy s ARG 345 Ca 0.00 0.06 -0.02 0.00 -0.52 0.00 0.00 55.73 55.25 1uqy s ARG 345 Cb 0.00 -2.17 0.12 0.00 0.52 0.00 0.00 34.95 33.41 1uqy s ARG 345 CO 0.00 -0.94 0.23 0.99 0.02 0.00 0.00 175.30 175.60 1uqy s THR 346 N -3.16 3.24 0.36 0.02 2.01 -1.26 -4.60 115.64 112.24 1uqy s THR 346 Ca 0.57 -2.26 0.07 0.00 0.31 0.00 0.00 61.69 60.38 1uqy s THR 346 Cb -0.11 -3.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.17 1uqy s THR 346 CO 0.47 -0.72 0.37 0.21 -0.69 0.00 0.00 174.62 174.26 1uqy s ASN 347 N 1.51 5.42 -0.36 3.53 3.84 -1.26 -4.72 114.94 122.90 1uqy s ASN 347 Ca 0.10 -0.47 0.14 0.00 0.21 0.00 0.00 52.86 52.84 1uqy s ASN 347 Cb -0.22 -0.93 0.38 0.00 -0.55 0.00 0.00 41.25 39.93 1uqy s ASN 347 CO -0.04 -0.46 0.79 -1.22 -2.79 0.00 0.00 177.10 173.38 1uqy n TYR 348 N -1.50 0.49 1.01 0.43 4.02 -1.26 -4.86 117.16 115.49 1uqy n TYR 348 Ca 0.00 -3.53 0.12 0.00 -0.01 0.00 0.00 57.90 54.49 1uqy n TYR 348 Cb 0.60 -0.41 0.30 0.00 -0.02 0.00 0.00 39.34 39.81 1uqy n TYR 348 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1uqy n PRO 349 N 0.18 0.02 -3.36 -0.72 -0.02 -1.26 -4.83 135.00 125.02 1uqy n PRO 349 Ca 0.21 -0.01 -0.17 0.00 -2.02 0.00 0.00 63.50 61.50 1uqy n PRO 349 Cb 0.70 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.65 1uqy n PRO 349 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1uqy n LEU 350 N -1.48 0.00 0.08 2.45 4.77 -1.26 -2.02 117.00 119.54 1uqy n LEU 350 Ca 0.06 -1.69 0.12 0.00 -0.03 0.00 0.00 56.01 54.47 1uqy n LEU 350 Cb 0.34 0.17 0.15 0.00 -2.33 0.00 0.00 43.42 41.74 1uqy n LEU 350 CO 0.34 -0.26 0.35 -0.07 -1.33 0.00 0.00 177.39 176.41 1uqy h LEU 351 N 0.00 0.00 -8.53 2.23 3.38 -1.91 -3.46 115.31 107.02 1uqy h LEU 351 Ca -0.22 -0.14 -0.63 0.00 0.09 0.00 0.00 57.88 56.97 1uqy h LEU 351 Cb 0.68 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.15 1uqy h LEU 351 CO 0.37 0.07 -0.86 -0.36 0.09 0.00 0.00 178.44 177.74 1uqy s PHE 352 N -3.20 2.02 0.47 1.13 0.40 -1.23 -1.14 117.98 116.42 1uqy s PHE 352 Ca 0.05 -0.38 -0.04 0.00 -0.60 0.00 0.00 56.93 55.95 1uqy s PHE 352 Cb 0.12 -1.27 0.10 0.00 0.51 0.00 0.00 43.02 42.48 1uqy s PHE 352 CO 0.72 0.01 0.64 -0.40 0.70 0.00 0.00 175.22 176.89 1uqy n ASP 353 N 2.33 0.43 0.08 1.36 5.68 0.05 -1.01 116.55 125.45 1uqy n ASP 353 Ca -0.16 -1.46 0.10 0.00 -0.50 0.00 0.00 54.79 52.76 1uqy n ASP 353 Cb 0.52 -0.46 0.41 0.00 -1.14 0.00 0.00 41.12 40.46 1uqy n ASP 353 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1uqy n ARG 354 N -2.28 0.11 -0.57 0.11 1.74 -1.26 -1.17 116.66 113.34 1uqy n ARG 354 Ca 0.09 0.37 0.09 0.00 -0.77 0.00 0.00 57.85 57.64 1uqy n ARG 354 Cb 0.33 -1.73 0.35 0.00 -1.02 0.00 0.00 32.46 30.39 1uqy n ARG 354 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1uqy n LYS 355 N -1.94 3.60 -1.84 5.56 5.02 -1.26 -4.89 118.16 122.40 1uqy n LYS 355 Ca 0.02 -2.84 -0.20 0.00 -2.02 0.00 0.00 58.31 53.27 1uqy n LYS 355 Cb 0.19 -1.84 -0.06 0.00 -0.02 0.00 0.00 35.03 33.30 1uqy n LYS 355 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1uqy n LEU 356 N 1.10 -1.59 -4.85 -0.35 4.77 -0.32 -5.01 117.00 110.75 1uqy n LEU 356 Ca 0.25 0.31 -0.36 0.00 -0.03 0.00 0.00 56.01 56.18 1uqy n LEU 356 Cb 0.85 -2.75 -0.06 0.00 -2.33 0.00 0.00 43.42 39.14 1uqy n LEU 356 CO 0.22 -0.75 0.08 -1.10 -1.33 0.00 0.00 177.39 174.51 1uqy s GLN 357 N -4.11 3.81 0.32 3.23 -1.52 -1.26 -4.76 119.66 115.38 1uqy s GLN 357 Ca 0.00 0.27 -0.29 0.00 -1.95 0.00 0.00 55.36 53.39 1uqy s GLN 357 Cb 0.00 -3.11 -0.11 0.00 -0.22 0.00 0.00 33.01 29.58 1uqy s GLN 357 CO 0.00 0.63 1.41 -1.25 -0.25 0.00 0.00 175.29 175.84 1uqy s PRO 358 N -1.49 4.24 0.60 2.91 0.04 -1.26 -0.77 135.00 139.27 1uqy s PRO 358 Ca 0.28 2.37 -0.01 0.00 0.04 0.00 0.00 61.00 63.68 1uqy s PRO 358 Cb -0.15 -3.04 0.04 0.00 0.04 0.00 0.00 34.50 31.39 1uqy s PRO 358 CO 0.15 -0.38 0.85 0.15 0.04 0.00 0.00 177.00 177.81 1uqy s LYS 359 N -1.47 2.45 0.30 4.56 1.02 -0.29 -4.87 119.74 121.44 1uqy s LYS 359 Ca 0.54 -0.61 0.05 0.00 0.02 0.00 0.00 55.97 55.96 1uqy s LYS 359 Cb -0.43 -2.39 0.67 0.00 -0.52 0.00 0.00 37.83 35.16 1uqy s LYS 359 CO 0.54 -0.87 1.82 -0.44 -0.92 0.00 0.00 175.35 175.48 1uqy h ASP 360 N -0.13 0.83 -0.83 2.83 3.32 -1.89 -1.11 116.42 119.45 1uqy h ASP 360 Ca -0.43 0.06 0.15 0.00 0.02 0.00 0.00 57.03 56.84 1uqy h ASP 360 Cb 1.30 -0.10 -0.10 0.00 0.22 0.00 0.00 39.33 40.66 1uqy h ASP 360 CO 0.55 0.38 0.39 0.00 -1.72 0.00 0.00 179.24 178.85 1uqy h ALA 361 N 1.59 1.23 -0.19 3.45 0.00 -1.87 -1.93 119.26 121.54 1uqy h ALA 361 Ca 0.52 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.55 1uqy h ALA 361 Cb 0.69 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1uqy h ALA 361 CO -0.30 -0.15 0.06 -0.92 0.00 0.00 0.00 179.25 177.94 1uqy h TYR 362 N 0.55 0.10 -0.34 0.00 5.03 -1.42 -1.83 116.97 119.06 1uqy h TYR 362 Ca 0.46 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.73 1uqy h TYR 362 Cb 0.69 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.93 1uqy h TYR 362 CO -0.12 0.05 0.01 0.74 -1.32 0.00 0.00 178.16 177.52 1uqy h PHE 363 N 0.14 0.53 -0.73 -3.82 0.04 -1.40 -1.51 116.94 110.20 1uqy h PHE 363 Ca 0.08 -0.05 -0.06 0.00 2.80 0.00 0.00 57.97 60.74 1uqy h PHE 363 Cb 0.06 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.02 1uqy h PHE 363 CO -0.12 0.51 0.22 0.00 -0.60 0.00 0.00 178.31 178.32 1uqy h ARG 364 N 0.50 1.14 -0.70 1.51 2.47 -1.05 -1.11 114.38 117.14 1uqy h ARG 364 Ca 0.11 -0.25 -0.04 0.00 -1.26 0.00 0.00 59.98 58.54 1uqy h ARG 364 Cb 0.31 -0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 28.43 1uqy h ARG 364 CO 0.01 0.98 0.28 -0.07 0.56 0.00 0.00 179.97 181.72 1uqy h LEU 365 N 1.08 0.97 -0.35 3.04 4.07 -0.80 -2.34 115.31 120.97 1uqy h LEU 365 Ca 0.23 -0.17 -0.02 0.00 0.08 0.00 0.00 57.88 58.00 1uqy h LEU 365 Cb 0.32 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.80 1uqy h LEU 365 CO -0.01 0.88 0.12 -0.07 -1.08 0.00 0.00 178.44 178.29 1uqy h LEU 366 N 1.00 0.49 -1.66 1.67 3.38 -1.00 -3.06 115.31 116.12 1uqy h LEU 366 Ca 0.23 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1uqy h LEU 366 Cb 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1uqy h LEU 366 CO -0.02 0.54 0.10 0.44 0.09 0.00 0.00 178.44 179.59 1uqy h ASP 367 N 0.41 0.28 -0.44 -0.43 3.32 -1.03 0.08 116.42 118.61 1uqy h ASP 367 Ca 0.11 -0.02 0.08 0.00 0.02 0.00 0.00 57.03 57.22 1uqy h ASP 367 Cb 0.21 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1uqy h ASP 367 CO -0.01 0.26 0.30 -0.07 -1.72 0.00 0.00 179.24 178.00 1uqy h LEU 368 N 0.32 0.23 0.04 1.55 3.38 -1.31 -2.08 115.31 117.44 1uqy h LEU 368 Ca 0.08 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.70 1uqy h LEU 368 Cb 0.06 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 1uqy h LEU 368 CO -0.01 0.14 -2.17 0.29 0.09 0.00 0.00 178.44 176.78 1uqy n LYS 369 N -4.46 0.69 -0.22 1.13 4.76 -0.51 -3.72 118.16 115.82 1uqy n LYS 369 Ca 0.06 0.18 -0.01 0.00 -2.87 0.00 0.00 58.31 55.67 1uqy n LYS 369 Cb 0.33 -1.63 0.21 0.00 -1.84 0.00 0.00 35.03 32.09 1uqy n LYS 369 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1uqy h ARG 370 N 0.02 1.00 -0.63 1.97 -0.00 -0.85 -2.68 114.38 113.22 1uqy h ARG 370 Ca -0.47 -0.10 0.00 0.00 -0.50 0.00 0.00 59.98 58.91 1uqy h ARG 370 Cb 2.04 -0.20 0.00 0.00 0.00 0.00 0.00 29.97 31.80 1uqy h ARG 370 CO 0.02 0.72 0.00 1.28 0.00 0.00 0.00 179.97 181.99 1uqy n LEU 371 N -4.37 4.86 0.00 3.04 4.77 -0.80 -5.08 117.00 119.42 1uqy n LEU 371 Ca 0.07 -2.52 0.00 0.00 -0.03 0.00 0.00 56.01 53.53 1uqy n LEU 371 Cb 0.09 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 1uqy n LEU 371 CO 0.38 0.79 0.00 1.21 -1.33 0.00 0.00 177.39 178.43