#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hdu n ARG 2 N 0.00 1.91 0.00 0.00 0.63 -1.26 -5.00 116.66 112.93 1hdu n ARG 2 Ca 0.00 -3.89 0.00 0.00 -0.92 0.00 0.00 57.85 53.04 1hdu n ARG 2 Cb 0.00 -1.83 0.00 0.00 0.45 0.00 0.00 32.46 31.08 1hdu n ARG 2 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1hdu n SER 3 N -0.02 0.00 0.19 6.15 2.88 -1.26 -4.96 113.62 116.60 1hdu n SER 3 Ca 0.25 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.93 1hdu n SER 3 Cb 0.62 0.00 0.66 0.00 -0.75 0.00 0.00 64.21 64.74 1hdu n SER 3 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1hdu h THR 4 N 0.00 0.00 0.00 2.46 1.35 -1.94 0.06 112.91 114.84 1hdu h THR 4 Ca 0.00 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 1hdu h THR 4 Cb 0.00 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 67.17 1hdu h THR 4 CO 0.00 0.00 0.00 0.78 -0.25 0.00 0.00 175.52 176.05 1hdu h ASN 5 N 0.00 0.00 0.00 5.36 2.35 -2.01 -3.20 115.58 118.08 1hdu h ASN 5 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1hdu h ASN 5 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1hdu h ASN 5 CO 0.00 0.00 -0.95 0.41 -1.65 0.00 0.00 177.43 175.24 1hdu n THR 6 N -2.43 0.00 -1.84 2.81 -1.04 -0.04 -4.99 114.28 106.76 1hdu n THR 6 Ca 0.05 -0.20 -0.41 0.00 -2.04 0.00 0.00 64.05 61.45 1hdu n THR 6 Cb 0.44 0.79 -0.01 0.00 -1.82 0.00 0.00 70.33 69.73 1hdu n THR 6 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1hdu s PHE 7 N -2.58 2.69 -0.57 -1.42 2.19 -0.92 -4.09 117.98 113.28 1hdu s PHE 7 Ca 0.03 1.10 -0.23 0.00 0.33 0.00 0.00 56.93 58.15 1hdu s PHE 7 Cb 0.11 -3.99 0.05 0.00 -1.31 0.00 0.00 43.02 37.88 1hdu s PHE 7 CO 0.62 -3.01 0.91 1.21 1.83 0.00 0.00 175.22 176.78 1hdu s ASN 8 N -0.01 6.28 0.02 6.13 3.84 -1.26 -4.88 114.94 125.06 1hdu s ASN 8 Ca 0.55 -0.57 0.28 0.00 0.21 0.00 0.00 52.86 53.32 1hdu s ASN 8 Cb -0.46 -2.42 0.99 0.00 -0.55 0.00 0.00 41.25 38.81 1hdu s ASN 8 CO 0.58 -1.25 1.77 -1.22 -2.79 0.00 0.00 177.10 174.19 1hdu n TYR 9 N 7.39 0.11 -0.46 0.43 4.01 -1.26 -3.84 117.16 123.54 1hdu n TYR 9 Ca -0.01 0.03 -0.03 0.00 -0.16 0.00 0.00 57.90 57.73 1hdu n TYR 9 Cb 0.47 -0.49 0.23 0.00 -0.31 0.00 0.00 39.34 39.24 1hdu n TYR 9 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1hdu n ALA 10 N -1.54 3.97 -2.50 -0.72 0.00 -1.26 -4.66 120.51 113.80 1hdu n ALA 10 Ca 0.06 -1.65 -0.09 0.00 0.00 0.00 0.00 53.44 51.77 1hdu n ALA 10 Cb 0.35 -1.18 -0.08 0.00 0.00 0.00 0.00 19.45 18.54 1hdu n ALA 10 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1hdu s THR 11 N -2.31 0.13 0.12 0.00 -1.32 -1.25 -4.60 115.64 106.40 1hdu s THR 11 Ca 0.40 -1.39 -0.23 0.00 -1.21 0.00 0.00 61.69 59.26 1hdu s THR 11 Cb 0.32 -1.58 -0.07 0.00 -1.51 0.00 0.00 72.50 69.66 1hdu s THR 11 CO 0.10 -0.58 0.69 -0.31 -2.21 0.00 0.00 174.62 172.32 1hdu s TYR 12 N -3.92 3.86 0.34 9.09 2.02 -1.26 -5.03 117.35 122.45 1hdu s TYR 12 Ca 0.11 1.48 0.09 0.00 -0.37 0.00 0.00 57.07 58.37 1hdu s TYR 12 Cb 0.05 -2.66 -0.05 0.00 -0.40 0.00 0.00 41.96 38.89 1hdu s TYR 12 CO -0.06 0.53 0.02 -1.01 -1.57 0.00 0.00 175.55 173.46 1hdu s HIS 13 N -1.05 2.56 0.71 2.71 3.76 -1.26 -5.15 115.29 117.57 1hdu s HIS 13 Ca 0.33 -0.44 -0.04 0.00 -0.15 0.00 0.00 55.06 54.75 1hdu s HIS 13 Cb -0.21 -1.52 0.09 0.00 1.11 0.00 0.00 32.58 32.05 1hdu s HIS 13 CO 0.23 0.46 1.00 0.95 -0.85 0.00 0.00 174.74 176.53 1hdu s THR 14 N -2.52 2.28 0.13 1.30 -4.23 -1.26 -4.91 115.64 106.42 1hdu s THR 14 Ca 0.35 -0.41 -0.19 0.00 -1.18 0.00 0.00 61.69 60.26 1hdu s THR 14 Cb 0.00 -2.87 -0.05 0.00 1.34 0.00 0.00 72.50 70.93 1hdu s THR 14 CO 0.20 0.00 1.76 0.25 -0.54 0.00 0.00 174.62 176.29 1hdu h LEU 15 N -0.58 0.30 -0.86 4.79 7.12 -1.97 -2.15 115.31 121.97 1hdu h LEU 15 Ca -0.42 -0.04 0.03 0.00 0.13 0.00 0.00 57.88 57.58 1hdu h LEU 15 Cb 1.29 -0.08 -0.05 0.00 -0.53 0.00 0.00 40.66 41.29 1hdu h LEU 15 CO 0.50 0.25 0.56 0.44 -0.13 0.00 0.00 178.44 180.06 1hdu h ASP 16 N 0.33 0.94 -0.63 1.25 3.32 -1.99 -0.98 116.42 118.66 1hdu h ASP 16 Ca 0.09 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 1hdu h ASP 16 Cb -0.00 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 1hdu h ASP 16 CO -0.02 0.66 0.18 -0.33 -1.72 0.00 0.00 179.24 178.02 1hdu h GLU 17 N 1.11 1.02 -0.38 3.56 5.08 -1.88 0.02 114.58 123.12 1hdu h GLU 17 Ca 0.33 -0.22 -0.12 0.00 -1.00 0.00 0.00 59.36 58.36 1hdu h GLU 17 Cb -0.04 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1hdu h GLU 17 CO -0.10 0.89 -0.22 0.82 -1.00 0.00 0.00 179.01 179.40 1hdu h ILE 18 N 0.98 1.28 -0.56 3.13 2.04 -0.91 -1.36 117.51 122.12 1hdu h ILE 18 Ca 0.21 -1.37 -0.09 0.00 1.00 0.00 0.00 64.86 64.62 1hdu h ILE 18 Cb 0.31 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.72 1hdu h ILE 18 CO -0.00 0.45 0.01 1.88 0.00 0.00 0.00 178.15 180.49 1hdu h TYR 19 N 0.61 1.03 -0.58 1.37 -1.99 -0.96 -2.22 116.97 114.23 1hdu h TYR 19 Ca 0.08 -0.16 -0.04 0.00 2.00 0.00 0.00 58.73 60.61 1hdu h TYR 19 Cb 0.79 -0.27 -0.03 0.00 2.00 0.00 0.00 36.73 39.22 1hdu h TYR 19 CO 0.06 0.92 0.22 -0.44 -0.00 0.00 0.00 178.16 178.92 1hdu h ASP 20 N 0.88 0.81 -0.75 3.88 3.32 -0.88 -2.67 116.42 121.01 1hdu h ASP 20 Ca 0.16 -0.18 0.11 0.00 0.02 0.00 0.00 57.03 57.15 1hdu h ASP 20 Cb 0.51 -0.21 -0.08 0.00 0.22 0.00 0.00 39.33 39.76 1hdu h ASP 20 CO 0.02 0.77 0.36 0.15 -1.72 0.00 0.00 179.24 178.83 1hdu h PHE 21 N 0.80 0.64 -0.73 4.55 3.57 -0.83 -1.39 116.94 123.55 1hdu h PHE 21 Ca 0.19 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.76 1hdu h PHE 21 Cb 0.22 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.74 1hdu h PHE 21 CO 0.01 0.19 0.45 0.52 -2.23 0.00 0.00 178.31 177.26 1hdu h MET 22 N 0.58 0.85 -0.47 1.11 2.86 -1.07 0.14 114.93 118.93 1hdu h MET 22 Ca 0.39 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.88 1hdu h MET 22 Cb 0.48 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1hdu h MET 22 CO -0.31 0.56 -0.08 -0.44 1.06 0.00 0.00 176.91 177.69 1hdu h ASP 23 N 0.87 0.83 -0.32 1.22 3.32 -1.13 -1.87 116.42 119.34 1hdu h ASP 23 Ca 0.30 -0.25 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 1hdu h ASP 23 Cb 0.06 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1hdu h ASP 23 CO -0.13 0.95 -0.06 -0.07 -1.72 0.00 0.00 179.24 178.21 1hdu h LEU 24 N 0.77 0.61 -0.26 1.55 3.38 -0.79 -1.16 115.31 119.40 1hdu h LEU 24 Ca 0.13 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.76 1hdu h LEU 24 Cb 0.58 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1hdu h LEU 24 CO 0.04 0.82 0.17 0.25 0.09 0.00 0.00 178.44 179.80 1hdu h LEU 25 N 0.39 0.28 -1.03 1.67 5.85 -0.82 -0.95 115.31 120.70 1hdu h LEU 25 Ca 0.08 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1hdu h LEU 25 Cb 0.54 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1hdu h LEU 25 CO 0.03 0.20 0.34 0.58 -0.34 0.00 0.00 178.44 179.25 1hdu h VAL 26 N 0.34 1.23 -0.09 1.05 2.07 -1.29 -0.79 116.25 118.78 1hdu h VAL 26 Ca 0.10 -0.66 -0.08 0.00 0.82 0.00 0.00 66.70 66.88 1hdu h VAL 26 Cb -0.02 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1hdu h VAL 26 CO -0.03 0.28 -0.32 0.00 0.02 0.00 0.00 177.57 177.51 1hdu h ALA 27 N 1.35 1.30 0.00 1.67 0.00 -0.77 -2.50 119.26 120.30 1hdu h ALA 27 Ca 0.25 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1hdu h ALA 27 Cb 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1hdu h ALA 27 CO -0.03 0.49 -0.69 1.96 0.00 0.00 0.00 179.25 180.98 1hdu h GLN 28 N 0.15 0.00 -2.03 0.00 4.20 -0.58 -3.40 115.11 113.45 1hdu h GLN 28 Ca 0.02 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.23 1hdu h GLN 28 Cb 0.65 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.03 1hdu h GLN 28 CO 0.05 0.22 -1.13 0.72 -0.67 0.00 0.00 178.83 178.02 1hdu n HIS 29 N -3.00 0.47 0.03 2.96 8.25 -0.36 -4.96 115.22 118.60 1hdu n HIS 29 Ca -0.00 -3.80 0.14 0.00 -0.26 0.00 0.00 57.72 53.80 1hdu n HIS 29 Cb 0.67 -0.42 0.61 0.00 1.12 0.00 0.00 29.99 31.97 1hdu n HIS 29 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1hdu h PRO 30 N 3.17 0.15 0.00 -0.41 0.11 -1.67 -0.79 132.00 132.56 1hdu h PRO 30 Ca 0.10 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1hdu h PRO 30 Cb 0.91 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1hdu h PRO 30 CO 0.53 0.10 -0.08 0.39 -0.21 0.00 0.00 178.00 178.72 1hdu n GLU 31 N -4.45 0.06 -0.01 1.05 -0.58 -1.26 -4.25 120.64 111.20 1hdu n GLU 31 Ca 0.07 0.04 -0.02 0.00 -0.42 0.00 0.00 57.16 56.84 1hdu n GLU 31 Cb 0.40 -1.57 -0.02 0.00 -0.57 0.00 0.00 31.44 29.69 1hdu n GLU 31 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1hdu n LEU 32 N -1.67 1.45 -4.17 -4.62 7.94 -0.75 -4.76 117.00 110.42 1hdu n LEU 32 Ca 0.06 -0.01 -0.23 0.00 -1.11 0.00 0.00 56.01 54.73 1hdu n LEU 32 Cb 0.36 -0.02 -0.14 0.00 0.53 0.00 0.00 43.42 44.15 1hdu n LEU 32 CO 0.29 0.30 -0.49 0.54 -1.11 0.00 0.00 177.39 176.92 1hdu s VAL 33 N -2.06 1.31 0.04 1.96 0.11 -0.38 -1.11 120.40 120.25 1hdu s VAL 33 Ca -0.03 -0.93 0.01 0.00 -2.93 0.00 0.00 61.98 58.10 1hdu s VAL 33 Cb 0.01 -1.13 -0.03 0.00 -1.53 0.00 0.00 36.38 33.70 1hdu s VAL 33 CO 0.09 0.18 -0.05 -0.94 -3.33 0.00 0.00 175.10 171.06 1hdu s SER 34 N -0.87 0.53 -0.22 3.54 1.04 -0.84 -4.51 113.70 112.37 1hdu s SER 34 Ca 0.05 -0.61 -0.08 0.00 0.48 0.00 0.00 55.95 55.78 1hdu s SER 34 Cb -0.07 0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.10 1hdu s SER 34 CO 0.01 -0.32 0.09 -0.75 0.98 0.00 0.00 173.24 173.25 1hdu s LYS 35 N -1.96 3.91 -0.07 4.02 2.20 -1.26 -1.00 119.74 125.57 1hdu s LYS 35 Ca -0.09 -0.36 0.03 0.00 -0.36 0.00 0.00 55.97 55.18 1hdu s LYS 35 Cb -0.07 -3.33 -0.02 0.00 -1.51 0.00 0.00 37.83 32.90 1hdu s LYS 35 CO -0.02 0.09 -0.14 -0.51 -0.36 0.00 0.00 175.35 174.40 1hdu s LEU 36 N 0.91 2.72 -0.38 5.43 1.43 -0.04 -4.97 118.68 123.78 1hdu s LEU 36 Ca 0.05 -0.24 -0.13 0.00 -1.03 0.00 0.00 54.13 52.78 1hdu s LEU 36 Cb -0.14 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.53 1hdu s LEU 36 CO 0.03 0.29 0.25 -1.58 0.23 0.00 0.00 176.35 175.57 1hdu s GLN 37 N -0.41 3.09 0.00 1.70 0.74 -1.26 -0.51 119.66 123.00 1hdu s GLN 37 Ca 0.05 -0.92 0.25 0.00 0.05 0.00 0.00 55.36 54.78 1hdu s GLN 37 Cb -0.12 -3.84 0.65 0.00 1.10 0.00 0.00 33.01 30.80 1hdu s GLN 37 CO 0.02 -0.64 1.52 0.44 -0.55 0.00 0.00 175.29 176.08 1hdu n ILE 38 N 5.09 0.10 -3.68 -2.34 -5.35 -0.32 -4.99 119.36 107.87 1hdu n ILE 38 Ca -0.12 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 61.95 1hdu n ILE 38 Cb 0.48 0.85 0.00 0.00 -1.74 0.00 0.00 39.64 39.22 1hdu n ILE 38 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1hdu n GLY 39 N 1.26 -1.46 3.12 3.28 0.00 -1.25 -4.81 105.19 105.34 1hdu n GLY 39 Ca 0.17 -1.20 -0.19 0.00 0.00 0.00 0.00 46.02 44.80 1hdu n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hdu s ARG 40 N -1.83 0.86 1.17 1.61 0.52 -1.26 -0.55 118.95 119.48 1hdu s ARG 40 Ca 0.00 -0.69 -0.17 0.00 -0.52 0.00 0.00 55.73 54.34 1hdu s ARG 40 Cb 0.00 -0.84 0.27 0.00 0.52 0.00 0.00 34.95 34.90 1hdu s ARG 40 CO 0.00 0.21 1.08 -1.54 0.02 0.00 0.00 175.30 175.07 1hdu s SER 41 N -1.05 1.16 0.22 0.23 1.04 0.12 -4.75 113.70 110.67 1hdu s SER 41 Ca 0.01 0.86 -0.08 0.00 0.48 0.00 0.00 55.95 57.22 1hdu s SER 41 Cb -0.07 -1.28 0.26 0.00 0.10 0.00 0.00 66.02 65.03 1hdu s SER 41 CO 0.01 -4.00 1.82 0.22 0.98 0.00 0.00 173.24 172.26 1hdu h TYR 42 N -2.50 0.75 -0.19 5.02 3.20 -1.96 -0.72 116.97 120.58 1hdu h TYR 42 Ca -0.49 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.41 1hdu h TYR 42 Cb 1.31 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.35 1hdu h TYR 42 CO -1.39 0.37 0.00 0.39 -1.64 0.00 0.00 178.16 175.89 1hdu n GLU 43 N -4.75 1.59 -0.60 1.82 1.02 -1.26 -4.90 120.64 113.56 1hdu n GLU 43 Ca 0.09 -0.75 0.00 0.00 -0.02 0.00 0.00 57.16 56.48 1hdu n GLU 43 Cb 0.17 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 1hdu n GLU 43 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1hdu n GLY 44 N 0.68 0.77 3.77 0.62 0.00 -0.28 -5.06 105.19 105.70 1hdu n GLY 44 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1hdu n GLY 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hdu s ARG 45 N -0.40 4.52 0.42 1.61 0.52 -1.26 -4.61 118.95 119.74 1hdu s ARG 45 Ca 0.00 1.67 -0.25 0.00 -0.52 0.00 0.00 55.73 56.63 1hdu s ARG 45 Cb 0.00 -2.99 -0.08 0.00 0.52 0.00 0.00 34.95 32.40 1hdu s ARG 45 CO 0.00 0.14 1.24 -1.25 0.02 0.00 0.00 175.30 175.45 1hdu s PRO 46 N -1.75 3.93 -0.31 3.54 0.04 -1.26 0.14 135.00 139.32 1hdu s PRO 46 Ca 0.48 1.99 -0.09 0.00 0.04 0.00 0.00 61.00 63.42 1hdu s PRO 46 Cb -0.28 -2.66 -0.00 0.00 0.04 0.00 0.00 34.50 31.60 1hdu s PRO 46 CO 0.35 -0.47 0.13 0.42 0.04 0.00 0.00 177.00 177.48 1hdu s ILE 47 N -1.35 4.43 0.04 0.56 1.01 0.29 -4.81 121.20 121.37 1hdu s ILE 47 Ca 0.58 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.75 1hdu s ILE 47 Cb -0.34 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1hdu s ILE 47 CO 0.43 0.06 0.03 -0.31 0.00 0.00 0.00 174.94 175.16 1hdu s TYR 48 N 1.58 3.12 -0.01 3.97 2.02 -1.26 -1.18 117.35 125.59 1hdu s TYR 48 Ca 0.04 0.07 0.04 0.00 -0.37 0.00 0.00 57.07 56.85 1hdu s TYR 48 Cb -0.17 -1.64 -0.01 0.00 -0.40 0.00 0.00 41.96 39.74 1hdu s TYR 48 CO 0.05 0.50 -0.13 0.08 -1.57 0.00 0.00 175.55 174.48 1hdu s VAL 49 N -1.24 1.00 -0.21 0.71 1.01 0.34 -4.51 120.40 117.50 1hdu s VAL 49 Ca 0.24 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 1hdu s VAL 49 Cb -0.12 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 1hdu s VAL 49 CO 0.16 0.28 0.12 -0.76 0.00 0.00 0.00 175.10 174.90 1hdu s LEU 50 N -0.31 4.06 -0.26 3.92 1.43 0.38 -0.86 118.68 127.04 1hdu s LEU 50 Ca 0.05 0.14 -0.07 0.00 -1.03 0.00 0.00 54.13 53.21 1hdu s LEU 50 Cb -0.05 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 1hdu s LEU 50 CO -0.00 0.13 0.08 -0.75 0.23 0.00 0.00 176.35 176.03 1hdu s LYS 51 N 0.64 3.61 -0.31 1.70 2.20 -0.17 -0.46 119.74 126.94 1hdu s LYS 51 Ca 0.07 -0.51 -0.10 0.00 -0.36 0.00 0.00 55.97 55.07 1hdu s LYS 51 Cb -0.12 -3.34 -0.01 0.00 -1.51 0.00 0.00 37.83 32.85 1hdu s LYS 51 CO 0.01 -0.21 0.16 -0.06 -0.36 0.00 0.00 175.35 174.88 1hdu s PHE 52 N 1.61 3.18 0.02 4.03 0.40 0.35 -1.99 117.98 125.58 1hdu s PHE 52 Ca 0.06 -0.56 -0.03 0.00 -0.60 0.00 0.00 56.93 55.80 1hdu s PHE 52 Cb -0.15 -2.36 -0.01 0.00 0.51 0.00 0.00 43.02 41.00 1hdu s PHE 52 CO 0.04 -0.45 0.04 0.45 0.70 0.00 0.00 175.22 175.99 1hdu s SER 53 N 1.62 0.18 0.00 1.36 0.15 -0.27 -1.57 113.70 115.17 1hdu s SER 53 Ca 0.05 -0.44 0.14 0.00 0.70 0.00 0.00 55.95 56.39 1hdu s SER 53 Cb -0.17 0.15 -0.05 0.00 -1.71 0.00 0.00 66.02 64.24 1hdu s SER 53 CO 0.06 -0.36 0.70 1.07 1.20 0.00 0.00 173.24 175.92 1hdu n THR 54 N 1.37 0.00 -0.46 6.45 5.66 -1.26 -4.39 114.28 121.65 1hdu n THR 54 Ca -0.23 -0.30 0.00 0.00 -3.05 0.00 0.00 64.05 60.48 1hdu n THR 54 Cb 0.56 1.11 0.00 0.00 -1.55 0.00 0.00 70.33 70.45 1hdu n THR 54 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1hdu n GLY 55 N 1.15 0.79 0.00 1.09 0.00 -1.26 -5.09 105.19 101.87 1hdu n GLY 55 Ca 0.05 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1hdu n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hdu n GLY 56 N 0.00 -1.18 0.00 -0.02 0.00 -1.26 -4.81 105.19 97.92 1hdu n GLY 56 Ca 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1hdu n GLY 56 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1hdu n SER 57 N -1.58 0.00 -2.89 1.61 7.64 -1.26 -4.82 113.62 112.33 1hdu n SER 57 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.63 1hdu n SER 57 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1hdu n SER 57 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1hdu n ASN 58 N -0.88 3.98 -4.64 6.43 5.03 -1.26 -5.09 115.26 118.83 1hdu n ASN 58 Ca 0.00 -3.58 -0.38 0.00 0.87 0.00 0.00 54.58 51.49 1hdu n ASN 58 Cb 0.00 -0.55 0.05 0.00 -1.02 0.00 0.00 39.78 38.26 1hdu n ASN 58 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1hdu n ARG 59 N -0.22 0.98 -1.63 3.52 1.74 -1.26 -4.88 116.66 114.92 1hdu n ARG 59 Ca 0.31 0.38 -0.40 0.00 -0.77 0.00 0.00 57.85 57.37 1hdu n ARG 59 Cb 0.48 -2.25 0.02 0.00 -1.02 0.00 0.00 32.46 29.70 1hdu n ARG 59 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1hdu n PRO 60 N -1.14 1.34 -4.32 5.56 -0.04 -1.26 -4.57 135.00 130.57 1hdu n PRO 60 Ca 0.14 0.49 -0.17 0.00 -0.04 0.00 0.00 63.50 63.91 1hdu n PRO 60 Cb 0.47 -2.13 -0.10 0.00 -0.04 0.00 0.00 33.50 31.70 1hdu n PRO 60 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hdu s ALA 61 N -1.33 1.82 -0.13 0.55 0.00 -0.38 -2.10 121.76 120.19 1hdu s ALA 61 Ca 0.66 -1.67 0.01 0.00 0.00 0.00 0.00 51.96 50.96 1hdu s ALA 61 Cb -0.51 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 1hdu s ALA 61 CO 0.55 -0.10 -0.17 0.42 0.00 0.00 0.00 175.76 176.46 1hdu s ILE 62 N -3.23 2.63 -0.13 0.00 -1.09 -0.47 -0.08 121.20 118.84 1hdu s ILE 62 Ca 0.23 -0.80 -0.04 0.00 -2.23 0.00 0.00 60.65 57.81 1hdu s ILE 62 Cb 0.03 -2.08 -0.03 0.00 -1.58 0.00 0.00 42.46 38.79 1hdu s ILE 62 CO 0.06 0.53 0.00 0.86 -1.23 0.00 0.00 174.94 175.17 1hdu s TRP 63 N 0.49 3.14 -0.05 3.97 -0.11 -0.12 -0.65 118.94 125.61 1hdu s TRP 63 Ca -0.11 0.03 -0.01 0.00 1.22 0.00 0.00 56.10 57.22 1hdu s TRP 63 Cb -0.16 -1.90 0.03 0.00 -1.50 0.00 0.00 33.47 29.94 1hdu s TRP 63 CO 0.05 0.26 0.03 0.42 -4.62 0.00 0.00 176.95 173.09 1hdu s ILE 64 N -0.27 0.09 0.10 5.86 1.01 -0.42 0.17 121.20 127.75 1hdu s ILE 64 Ca 0.06 0.28 0.09 0.00 0.00 0.00 0.00 60.65 61.09 1hdu s ILE 64 Cb -0.12 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 42.02 1hdu s ILE 64 CO 0.02 0.20 -0.23 1.51 0.00 0.00 0.00 174.94 176.44 1hdu s ASP 65 N 1.96 2.83 0.06 3.58 1.47 -0.19 -0.98 116.67 125.41 1hdu s ASP 65 Ca 0.03 -0.69 -0.00 0.00 1.18 0.00 0.00 52.55 53.07 1hdu s ASP 65 Cb -0.12 -0.18 -0.04 0.00 -0.34 0.00 0.00 42.92 42.24 1hdu s ASP 65 CO -0.04 0.12 -0.04 -0.76 0.68 0.00 0.00 175.17 175.13 1hdu s LEU 66 N -1.86 2.49 -1.18 2.11 1.02 -0.42 -0.88 118.68 119.96 1hdu s LEU 66 Ca 0.09 -0.99 0.00 0.00 0.02 0.00 0.00 54.13 53.25 1hdu s LEU 66 Cb -0.10 0.13 0.00 0.00 0.02 0.00 0.00 46.19 46.24 1hdu s LEU 66 CO 0.05 -0.56 0.00 0.61 0.02 0.00 0.00 176.35 176.46 1hdu n GLY 67 N 0.10 0.93 0.23 -3.19 0.00 -1.25 -2.31 105.19 99.69 1hdu n GLY 67 Ca -0.14 -0.47 0.07 0.00 0.00 0.00 0.00 46.02 45.48 1hdu n GLY 67 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1hdu h ILE 68 N 0.00 1.03 -3.61 -0.61 2.10 -1.90 -3.05 117.51 111.48 1hdu h ILE 68 Ca -0.25 -0.56 -0.70 0.00 1.08 0.00 0.00 64.86 64.43 1hdu h ILE 68 Cb 0.87 1.31 -0.28 0.00 -1.09 0.00 0.00 36.82 37.63 1hdu h ILE 68 CO 0.34 0.16 -0.56 -1.00 -1.08 0.00 0.00 178.15 176.01 1hdu s HIS 69 N -4.61 3.28 0.31 2.19 3.76 -1.26 -4.58 115.29 114.38 1hdu s HIS 69 Ca -0.04 -1.39 0.08 0.00 -0.15 0.00 0.00 55.06 53.56 1hdu s HIS 69 Cb 0.15 -2.47 0.84 0.00 1.11 0.00 0.00 32.58 32.22 1hdu s HIS 69 CO 0.68 -0.75 1.73 0.66 -0.85 0.00 0.00 174.74 176.21 1hdu h SER 70 N 8.29 0.63 0.63 1.40 4.64 -1.66 -2.54 113.55 124.94 1hdu h SER 70 Ca -0.23 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1hdu h SER 70 Cb 1.08 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1hdu h SER 70 CO 0.65 0.10 0.00 -2.11 -0.87 0.00 0.00 176.83 174.60 1hdu n ARG 71 N -4.90 0.05 -1.91 4.77 1.85 -0.58 -4.09 116.66 111.86 1hdu n ARG 71 Ca 0.26 0.27 -0.41 0.00 -1.00 0.00 0.00 57.85 56.97 1hdu n ARG 71 Cb 0.71 -1.60 -0.01 0.00 -1.05 0.00 0.00 32.46 30.52 1hdu n ARG 71 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1hdu n GLU 72 N -1.70 3.96 -0.25 2.89 1.02 -0.96 -4.77 120.64 120.83 1hdu n GLU 72 Ca 0.04 -3.11 0.27 0.00 -0.02 0.00 0.00 57.16 54.34 1hdu n GLU 72 Cb 0.21 -2.82 0.65 0.00 -0.02 0.00 0.00 31.44 29.47 1hdu n GLU 72 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 1hdu h TRP 73 N 5.14 0.21 0.00 -0.32 4.06 -1.80 -0.48 115.95 122.77 1hdu h TRP 73 Ca 0.65 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 61.60 1hdu h TRP 73 Cb 0.42 -0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.52 1hdu h TRP 73 CO 1.56 0.03 -0.01 0.97 -3.56 0.00 0.00 178.44 177.43 1hdu h ILE 74 N 0.14 0.59 -0.00 1.49 6.09 -1.86 -2.54 117.51 121.42 1hdu h ILE 74 Ca 0.50 -0.05 -0.00 0.00 -1.37 0.00 0.00 64.86 63.94 1hdu h ILE 74 Cb 1.71 1.03 0.00 0.00 0.47 0.00 0.00 36.82 40.03 1hdu h ILE 74 CO -0.09 0.01 -0.01 0.71 -3.07 0.00 0.00 178.15 175.70 1hdu h THR 75 N 0.00 1.45 -0.36 2.19 1.35 -1.42 -1.53 112.91 114.59 1hdu h THR 75 Ca -0.00 -1.33 -0.05 0.00 -0.55 0.00 0.00 66.41 64.48 1hdu h THR 75 Cb 0.03 2.34 -0.02 0.00 -1.73 0.00 0.00 68.15 68.77 1hdu h THR 75 CO 0.00 0.35 0.01 1.56 -0.25 0.00 0.00 175.52 177.19 1hdu h GLN 76 N -0.54 0.56 -0.43 4.72 7.50 -1.66 -0.45 115.11 124.80 1hdu h GLN 76 Ca 0.00 -0.12 -0.08 0.00 0.50 0.00 0.00 58.65 58.96 1hdu h GLN 76 Cb 0.57 -0.08 -0.02 0.00 0.05 0.00 0.00 27.48 28.00 1hdu h GLN 76 CO 0.00 0.57 -0.05 0.00 -1.50 0.00 0.00 178.83 177.86 1hdu h ALA 77 N 1.49 1.11 -0.17 3.87 0.00 -1.46 -1.76 119.26 122.33 1hdu h ALA 77 Ca 0.12 -0.28 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 1hdu h ALA 77 Cb 0.32 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1hdu h ALA 77 CO 0.01 0.56 -0.63 1.15 0.00 0.00 0.00 179.25 180.34 1hdu h THR 78 N 0.68 1.32 -0.88 0.00 2.02 -0.63 -2.85 112.91 112.56 1hdu h THR 78 Ca 0.13 -1.89 -0.01 0.00 0.77 0.00 0.00 66.41 65.40 1hdu h THR 78 Cb 0.49 1.86 -0.04 0.00 -1.74 0.00 0.00 68.15 68.72 1hdu h THR 78 CO 0.03 0.59 0.50 1.23 0.37 0.00 0.00 175.52 178.23 1hdu h GLY 79 N 0.98 1.30 0.97 2.16 0.00 -0.68 0.74 103.07 108.53 1hdu h GLY 79 Ca -0.01 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 1hdu h GLY 79 CO 0.12 0.55 0.19 -2.08 0.00 0.00 0.00 176.54 175.33 1hdu h VAL 80 N 1.22 1.21 -0.66 4.60 2.07 -1.29 -1.41 116.25 121.99 1hdu h VAL 80 Ca 0.31 -0.65 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1hdu h VAL 80 Cb 0.01 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 1hdu h VAL 80 CO -0.05 0.25 0.13 -0.25 0.02 0.00 0.00 177.57 177.67 1hdu h TRP 81 N 0.65 1.13 -0.29 1.57 7.01 -1.20 -2.76 115.95 122.06 1hdu h TRP 81 Ca 0.16 -0.15 0.03 0.00 2.11 0.00 0.00 58.89 61.04 1hdu h TRP 81 Cb 0.20 -0.31 -0.03 0.00 -2.10 0.00 0.00 29.16 26.91 1hdu h TRP 81 CO 0.00 0.94 0.12 0.74 -2.79 0.00 0.00 178.44 177.46 1hdu h PHE 82 N 0.99 0.23 -0.63 2.65 -1.00 -0.61 0.45 116.94 119.02 1hdu h PHE 82 Ca 0.20 0.01 0.08 0.00 2.81 0.00 0.00 57.97 61.08 1hdu h PHE 82 Cb 0.40 -0.06 -0.07 0.00 3.61 0.00 0.00 35.95 39.84 1hdu h PHE 82 CO 0.03 0.11 0.28 0.00 -1.61 0.00 0.00 178.31 177.13 1hdu h ALA 83 N 1.17 0.83 -0.33 2.45 0.00 -1.06 -0.24 119.26 122.08 1hdu h ALA 83 Ca 0.13 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 1hdu h ALA 83 Cb 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1hdu h ALA 83 CO -0.11 -0.11 -0.32 -0.22 0.00 0.00 0.00 179.25 178.49 1hdu h LYS 84 N 0.51 0.80 -0.90 0.00 1.63 -1.20 -3.18 116.57 114.23 1hdu h LYS 84 Ca 0.31 -0.42 -0.01 0.00 -0.85 0.00 0.00 60.65 59.68 1hdu h LYS 84 Cb 0.32 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.92 1hdu h LYS 84 CO -0.26 1.05 0.53 -0.22 -3.45 0.00 0.00 179.45 177.10 1hdu h LYS 85 N 0.57 1.23 -0.69 1.90 3.64 -0.16 -2.24 116.57 120.83 1hdu h LYS 85 Ca 0.05 -0.12 0.09 0.00 -1.27 0.00 0.00 60.65 59.41 1hdu h LYS 85 Cb 0.90 -0.25 -0.07 0.00 -0.41 0.00 0.00 32.23 32.40 1hdu h LYS 85 CO 0.08 0.87 0.33 0.74 -2.27 0.00 0.00 179.45 179.20 1hdu h PHE 86 N 1.24 0.59 0.00 1.91 0.04 -1.05 0.40 116.94 120.07 1hdu h PHE 86 Ca 0.32 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 61.07 1hdu h PHE 86 Cb -0.03 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 1hdu h PHE 86 CO 0.00 0.20 -0.26 1.79 -0.60 0.00 0.00 178.31 179.45 1hdu h THR 87 N 0.56 0.62 0.15 -1.55 1.35 -1.45 -2.80 112.91 109.80 1hdu h THR 87 Ca 0.34 -1.21 -0.32 0.00 -0.55 0.00 0.00 66.41 64.68 1hdu h THR 87 Cb 0.37 1.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 1hdu h THR 87 CO -0.28 0.25 -1.56 -0.33 -0.25 0.00 0.00 175.52 173.35 1hdu h GLU 88 N 0.00 0.32 0.00 4.72 5.08 -0.62 -3.38 114.58 120.70 1hdu h GLU 88 Ca -0.00 -0.54 -0.04 0.00 -1.00 0.00 0.00 59.36 57.77 1hdu h GLU 88 Cb 0.78 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 1hdu h GLU 88 CO 0.03 1.20 -0.78 -0.91 -1.00 0.00 0.00 179.01 177.55 1hdu h ASN 89 N 0.09 0.00 -2.68 1.42 4.21 -1.01 -3.42 115.58 114.19 1hdu h ASN 89 Ca -0.26 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 56.71 1hdu h ASN 89 Cb 2.05 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 39.27 1hdu h ASN 89 CO 0.18 0.17 1.01 -0.47 -1.29 0.00 0.00 177.43 177.03 1hdu s TYR 90 N -3.20 2.34 0.00 1.19 5.04 -1.06 -0.49 117.35 121.18 1hdu s TYR 90 Ca 0.01 0.30 0.00 0.00 -2.44 0.00 0.00 57.07 54.94 1hdu s TYR 90 Cb 0.08 -3.95 0.00 0.00 0.35 0.00 0.00 41.96 38.44 1hdu s TYR 90 CO 0.76 -3.86 0.00 0.41 -1.34 0.00 0.00 175.55 171.52 1hdu n GLY 91 N 4.02 1.38 0.34 8.97 0.00 -1.26 -4.82 105.19 113.82 1hdu n GLY 91 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 1hdu n GLY 91 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1hdu n GLN 92 N -2.00 0.21 -3.30 1.61 1.13 -0.09 -4.95 117.38 109.99 1hdu n GLN 92 Ca 0.00 0.07 -0.40 0.00 -1.94 0.00 0.00 57.00 54.72 1hdu n GLN 92 Cb 0.00 -1.02 -0.08 0.00 0.11 0.00 0.00 30.24 29.25 1hdu n GLN 92 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1hdu s ASN 93 N -5.30 6.31 0.24 1.08 3.84 0.35 -4.98 114.94 116.50 1hdu s ASN 93 Ca -0.12 0.18 -0.04 0.00 0.21 0.00 0.00 52.86 53.08 1hdu s ASN 93 Cb 0.04 -2.25 0.44 0.00 -0.55 0.00 0.00 41.25 38.93 1hdu s ASN 93 CO 0.18 -0.34 1.76 -0.65 -2.79 0.00 0.00 177.10 175.27 1hdu h PRO 94 N 8.27 0.54 0.12 0.43 0.11 -1.92 0.21 132.00 139.76 1hdu h PRO 94 Ca -0.29 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 1hdu h PRO 94 Cb 1.14 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1hdu h PRO 94 CO 0.71 0.36 -0.06 0.77 -0.21 0.00 0.00 178.00 179.58 1hdu h SER 95 N 0.56 -0.13 -0.67 -2.05 0.02 -1.96 -2.39 113.55 106.92 1hdu h SER 95 Ca 0.41 -0.30 -0.08 0.00 -0.84 0.00 0.00 61.79 60.98 1hdu h SER 95 Cb 0.54 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.09 1hdu h SER 95 CO -0.34 0.25 0.13 0.15 -1.14 0.00 0.00 176.83 175.87 1hdu h PHE 96 N -0.54 1.17 -0.72 3.45 3.57 -1.87 -2.19 116.94 119.80 1hdu h PHE 96 Ca -0.02 -0.15 0.04 0.00 3.53 0.00 0.00 57.97 61.37 1hdu h PHE 96 Cb 0.43 -0.32 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 1hdu h PHE 96 CO 0.05 0.97 0.44 1.15 -2.23 0.00 0.00 178.31 178.69 1hdu h THR 97 N 1.04 1.06 -0.93 4.41 2.02 -0.99 -0.83 112.91 118.70 1hdu h THR 97 Ca 0.21 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1hdu h THR 97 Cb 0.42 0.14 -0.05 0.00 -1.74 0.00 0.00 68.15 66.92 1hdu h THR 97 CO 0.01 0.15 0.60 0.00 0.37 0.00 0.00 175.52 176.65 1hdu h ALA 98 N 1.33 1.30 0.12 6.16 0.00 -1.05 -1.17 119.26 125.96 1hdu h ALA 98 Ca 0.30 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1hdu h ALA 98 Cb 0.07 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1hdu h ALA 98 CO -0.13 0.63 -0.06 0.82 0.00 0.00 0.00 179.25 180.51 1hdu h ILE 99 N 1.27 1.00 0.00 0.00 2.04 -0.63 -3.11 117.51 118.08 1hdu h ILE 99 Ca 0.34 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 1hdu h ILE 99 Cb -0.11 1.33 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1hdu h ILE 99 CO -0.07 0.12 -0.00 -0.07 0.00 0.00 0.00 178.15 178.13 1hdu h LEU 100 N -0.41 0.00 -0.47 1.44 3.38 -1.03 -0.28 115.31 117.95 1hdu h LEU 100 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1hdu h LEU 100 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1hdu h LEU 100 CO 0.03 0.00 0.00 0.44 0.09 0.00 0.00 178.44 179.00 1hdu h ASP 101 N 0.00 0.00 0.00 -0.43 3.32 -1.14 -3.34 116.42 114.83 1hdu h ASP 101 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1hdu h ASP 101 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1hdu h ASP 101 CO 0.00 0.00 -0.74 -1.20 -1.72 0.00 0.00 179.24 175.58 1hdu n SER 102 N -2.53 3.71 -4.22 6.45 7.64 -1.03 -4.98 113.62 118.65 1hdu n SER 102 Ca 0.03 -0.08 -0.13 0.00 1.01 0.00 0.00 58.87 59.70 1hdu n SER 102 Cb 0.36 0.91 -0.10 0.00 -1.01 0.00 0.00 64.21 64.37 1hdu n SER 102 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1hdu s MET 103 N -1.65 1.00 0.11 1.43 -1.94 -0.14 -4.43 119.30 113.67 1hdu s MET 103 Ca 0.00 -1.43 0.03 0.00 -1.71 0.00 0.00 55.69 52.58 1hdu s MET 103 Cb 0.00 -0.43 -0.04 0.00 2.01 0.00 0.00 34.83 36.37 1hdu s MET 103 CO 0.00 0.01 0.14 -0.51 -0.01 0.00 0.00 175.02 174.65 1hdu s ASP 104 N -3.13 5.75 -0.07 3.03 1.01 -0.89 -4.36 116.67 118.00 1hdu s ASP 104 Ca 0.16 0.02 0.04 0.00 0.71 0.00 0.00 52.55 53.48 1hdu s ASP 104 Cb 0.04 -1.59 0.00 0.00 1.01 0.00 0.00 42.92 42.38 1hdu s ASP 104 CO -0.01 0.13 -0.20 -0.63 0.21 0.00 0.00 175.17 174.67 1hdu s ILE 105 N -1.56 1.71 -0.19 0.77 1.01 -0.61 -1.37 121.20 120.96 1hdu s ILE 105 Ca 0.31 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 60.11 1hdu s ILE 105 Cb -0.11 -1.48 -0.00 0.00 0.01 0.00 0.00 42.46 40.87 1hdu s ILE 105 CO 0.24 0.48 -0.10 -0.36 0.00 0.00 0.00 174.94 175.20 1hdu s PHE 106 N 0.29 2.88 -0.19 3.97 0.40 0.17 -0.49 117.98 125.01 1hdu s PHE 106 Ca -0.13 -1.00 0.00 0.00 -0.60 0.00 0.00 56.93 55.21 1hdu s PHE 106 Cb -0.16 -1.99 0.02 0.00 0.51 0.00 0.00 43.02 41.40 1hdu s PHE 106 CO 0.06 -0.51 -0.17 -1.17 0.70 0.00 0.00 175.22 174.13 1hdu s LEU 107 N 1.12 2.37 -0.41 -0.37 2.96 0.39 -1.30 118.68 123.45 1hdu s LEU 107 Ca 0.01 -0.68 -0.05 0.00 -0.22 0.00 0.00 54.13 53.18 1hdu s LEU 107 Cb -0.14 -1.53 0.10 0.00 0.50 0.00 0.00 46.19 45.11 1hdu s LEU 107 CO -0.03 -0.02 0.21 -0.70 -1.32 0.00 0.00 176.35 174.49 1hdu s GLU 108 N 1.30 2.29 0.08 1.98 2.12 -0.15 -0.47 118.70 125.84 1hdu s GLU 108 Ca 0.04 -1.65 -0.16 0.00 0.36 0.00 0.00 54.97 53.57 1hdu s GLU 108 Cb -0.14 -3.64 -0.14 0.00 0.26 0.00 0.00 34.13 30.48 1hdu s GLU 108 CO -0.11 -1.00 1.32 0.82 -0.54 0.00 0.00 175.26 175.75 1hdu h ILE 109 N 6.27 1.32 -3.22 -3.70 2.04 -1.82 -1.11 117.51 117.29 1hdu h ILE 109 Ca -0.18 -1.72 -0.63 0.00 1.00 0.00 0.00 64.86 63.34 1hdu h ILE 109 Cb 1.06 1.91 -0.41 0.00 -0.74 0.00 0.00 36.82 38.64 1hdu h ILE 109 CO 0.72 0.53 -0.61 -0.69 0.00 0.00 0.00 178.15 178.10 1hdu s VAL 110 N -3.95 2.64 0.19 1.67 1.01 -1.26 -4.15 120.40 116.54 1hdu s VAL 110 Ca -0.12 -3.70 0.22 0.00 0.00 0.00 0.00 61.98 58.38 1hdu s VAL 110 Cb 0.07 -2.79 0.21 0.00 0.00 0.00 0.00 36.38 33.87 1hdu s VAL 110 CO 0.85 -0.90 1.83 0.74 0.00 0.00 0.00 175.10 177.61 1hdu h THR 111 N 4.99 0.68 -2.53 3.92 2.02 -1.60 -3.34 112.91 117.06 1hdu h THR 111 Ca 0.03 -1.17 -0.60 0.00 0.77 0.00 0.00 66.41 65.44 1hdu h THR 111 Cb 0.83 1.76 -0.40 0.00 -1.74 0.00 0.00 68.15 68.60 1hdu h THR 111 CO 0.69 0.26 -0.77 -3.20 0.37 0.00 0.00 175.52 172.86 1hdu n ASN 112 N -3.49 1.77 0.01 4.18 4.05 -1.15 -4.87 115.26 115.75 1hdu n ASN 112 Ca -0.00 -2.95 0.01 0.00 0.45 0.00 0.00 54.58 52.08 1hdu n ASN 112 Cb 0.43 -0.66 0.33 0.00 1.23 0.00 0.00 39.78 41.10 1hdu n ASN 112 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1hdu h PRO 113 N 4.98 0.50 -0.26 1.20 0.13 -1.89 -1.95 132.00 134.72 1hdu h PRO 113 Ca 0.18 -0.09 -0.04 0.00 -0.87 0.00 0.00 66.00 65.18 1hdu h PRO 113 Cb 0.80 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 1hdu h PRO 113 CO 0.61 0.51 -0.00 -0.91 -0.23 0.00 0.00 178.00 177.97 1hdu h ASN 114 N 0.49 0.45 -0.22 1.44 -0.26 -1.95 -1.72 115.58 113.80 1hdu h ASN 114 Ca 0.11 -0.31 -0.09 0.00 -0.56 0.00 0.00 56.30 55.45 1hdu h ASN 114 Cb 0.27 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.39 1hdu h ASN 114 CO 0.00 0.65 -0.15 1.23 -1.06 0.00 0.00 177.43 178.10 1hdu h GLY 115 N 0.23 0.69 0.88 2.83 0.00 -1.75 -2.05 103.07 103.91 1hdu h GLY 115 Ca 0.07 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1hdu h GLY 115 CO 0.01 0.48 0.07 -2.75 0.00 0.00 0.00 176.54 174.35 1hdu h PHE 116 N 0.58 0.29 -0.69 5.60 3.57 -1.20 -0.98 116.94 124.12 1hdu h PHE 116 Ca 0.10 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 1hdu h PHE 116 Cb 0.59 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1hdu h PHE 116 CO 0.03 0.36 0.42 0.00 -2.23 0.00 0.00 178.31 176.89 1hdu h ALA 117 N 0.90 1.46 -0.30 2.41 0.00 -1.20 -1.99 119.26 120.54 1hdu h ALA 117 Ca 0.06 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1hdu h ALA 117 Cb 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1hdu h ALA 117 CO -0.00 0.48 -0.13 0.35 0.00 0.00 0.00 179.25 179.94 1hdu h PHE 118 N 0.94 0.55 0.00 0.00 3.57 -0.84 -2.21 116.94 118.95 1hdu h PHE 118 Ca 0.25 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 1hdu h PHE 118 Cb -0.06 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 1hdu h PHE 118 CO 0.00 0.62 -0.19 1.79 -2.23 0.00 0.00 178.31 178.31 1hdu h THR 119 N 0.47 0.60 0.00 4.41 1.35 -0.42 -0.33 112.91 118.99 1hdu h THR 119 Ca 0.09 -0.85 -0.24 0.00 -0.55 0.00 0.00 66.41 64.85 1hdu h THR 119 Cb 0.51 1.56 -0.04 0.00 -1.73 0.00 0.00 68.15 68.45 1hdu h THR 119 CO 0.03 0.18 -1.37 0.45 -0.25 0.00 0.00 175.52 174.56 1hdu h HIS 120 N 0.00 0.00 0.00 4.73 3.86 -1.25 -3.23 115.15 119.25 1hdu h HIS 120 Ca -0.00 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.94 1hdu h HIS 120 Cb 0.54 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.96 1hdu h HIS 120 CO 0.00 0.93 -2.13 -1.13 0.86 0.00 0.00 177.93 176.47 1hdu n SER 121 N -3.14 0.81 0.00 2.45 3.41 -0.88 -4.95 113.62 111.31 1hdu n SER 121 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 1hdu n SER 121 Cb 0.98 1.03 0.00 0.00 -0.26 0.00 0.00 64.21 65.96 1hdu n SER 121 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1hdu n GLU 122 N -2.57 0.00 -3.73 4.33 1.02 -0.22 -5.06 120.64 114.40 1hdu n GLU 122 Ca -0.25 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.60 1hdu n GLU 122 Cb 0.98 -0.31 -0.16 0.00 -0.02 0.00 0.00 31.44 31.93 1hdu n GLU 122 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1hdu s ASN 123 N -4.23 3.58 0.56 1.62 3.84 -0.69 -4.99 114.94 114.64 1hdu s ASN 123 Ca 0.00 -1.29 0.25 0.00 0.21 0.00 0.00 52.86 52.03 1hdu s ASN 123 Cb 0.00 -0.75 1.61 0.00 -0.55 0.00 0.00 41.25 41.56 1hdu s ASN 123 CO 0.00 -0.37 2.20 -0.09 -2.79 0.00 0.00 177.10 176.06 1hdu h ARG 124 N 8.16 0.00 -0.61 0.43 9.65 -1.79 -2.33 114.38 127.89 1hdu h ARG 124 Ca -0.15 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.73 1hdu h ARG 124 Cb 1.06 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 1hdu h ARG 124 CO 0.42 0.00 0.00 1.28 2.80 0.00 0.00 179.97 184.47 1hdu n LEU 125 N -4.10 5.35 -4.76 3.80 4.77 -1.26 -4.56 117.00 116.24 1hdu n LEU 125 Ca -0.02 -2.71 -0.41 0.00 -0.03 0.00 0.00 56.01 52.83 1hdu n LEU 125 Cb 0.11 -0.66 -0.03 0.00 -2.33 0.00 0.00 43.42 40.51 1hdu n LEU 125 CO 0.30 0.64 0.98 0.86 -1.33 0.00 0.00 177.39 178.83 1hdu s TRP 126 N -2.54 3.15 -0.04 -1.77 -0.11 -0.88 -4.83 118.94 111.93 1hdu s TRP 126 Ca 0.51 1.34 0.03 0.00 1.22 0.00 0.00 56.10 59.20 1hdu s TRP 126 Cb 0.38 -3.64 -0.04 0.00 -1.50 0.00 0.00 33.47 28.67 1hdu s TRP 126 CO 0.16 -1.83 0.00 -2.13 -4.62 0.00 0.00 176.95 168.53 1hdu n ARG 127 N 1.51 2.83 -1.41 5.86 0.63 -1.26 -1.53 116.66 123.29 1hdu n ARG 127 Ca 0.02 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.81 1hdu n ARG 127 Cb 0.42 -1.09 0.09 0.00 0.45 0.00 0.00 32.46 32.33 1hdu n ARG 127 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1hdu n LYS 128 N -2.22 -0.21 0.00 -0.14 5.02 -1.26 -3.45 118.16 115.89 1hdu n LYS 128 Ca -0.06 -1.35 0.00 0.00 -2.02 0.00 0.00 58.31 54.88 1hdu n LYS 128 Cb 0.61 -0.55 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 1hdu n LYS 128 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1hdu n THR 129 N -2.58 0.00 -0.71 -0.18 -2.24 -0.41 -4.42 114.28 103.74 1hdu n THR 129 Ca 0.09 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.93 1hdu n THR 129 Cb 0.33 -1.89 0.08 0.00 -2.10 0.00 0.00 70.33 66.75 1hdu n THR 129 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hdu n ARG 130 N -0.82 1.83 -2.49 -0.78 3.00 -1.26 -3.96 116.66 112.18 1hdu n ARG 130 Ca 0.00 -2.08 -0.36 0.00 -0.01 0.00 0.00 57.85 55.40 1hdu n ARG 130 Cb 0.00 -1.26 -0.03 0.00 0.00 0.00 0.00 32.46 31.17 1hdu n ARG 130 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1hdu s SER 131 N -2.06 6.49 0.08 0.55 0.01 -1.26 -4.59 113.70 112.93 1hdu s SER 131 Ca 0.18 2.05 0.07 0.00 1.31 0.00 0.00 55.95 59.56 1hdu s SER 131 Cb 0.16 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.77 1hdu s SER 131 CO 0.02 -0.68 -0.11 -0.69 0.41 0.00 0.00 173.24 172.19 1hdu s VAL 132 N -1.74 3.31 -0.05 3.43 1.01 -1.26 -0.63 120.40 124.47 1hdu s VAL 132 Ca 0.62 -1.21 -0.02 0.00 0.00 0.00 0.00 61.98 61.38 1hdu s VAL 132 Cb -0.21 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.69 1hdu s VAL 132 CO 0.26 0.17 0.08 -0.89 0.00 0.00 0.00 175.10 174.73 1hdu s THR 133 N -1.15 -0.13 0.00 3.92 2.01 -1.26 -5.04 115.64 113.99 1hdu s THR 133 Ca 0.20 0.35 -0.00 0.00 0.31 0.00 0.00 61.69 62.55 1hdu s THR 133 Cb -0.11 -0.17 -0.00 0.00 0.01 0.00 0.00 72.50 72.23 1hdu s THR 133 CO 0.12 0.15 0.05 -1.54 -0.69 0.00 0.00 174.62 172.71 1hdu n SER 134 N 4.99 -0.01 -2.21 3.53 3.41 -1.26 -2.38 113.62 119.69 1hdu n SER 134 Ca -0.10 0.05 -0.02 0.00 -0.26 0.00 0.00 58.87 58.54 1hdu n SER 134 Cb 0.50 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.39 1hdu n SER 134 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1hdu n SER 135 N -2.28 1.47 0.00 4.04 3.41 -1.26 -4.67 113.62 114.33 1hdu n SER 135 Ca 0.00 -1.66 0.00 0.00 -0.26 0.00 0.00 58.87 56.95 1hdu n SER 135 Cb 0.00 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1hdu n SER 135 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1hdu n SER 136 N 2.56 0.00 -0.64 4.04 2.88 -1.00 -4.99 113.62 116.47 1hdu n SER 136 Ca 0.08 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.76 1hdu n SER 136 Cb 0.22 0.00 0.37 0.00 -0.75 0.00 0.00 64.21 64.05 1hdu n SER 136 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1hdu n LEU 137 N 0.00 2.00 -4.88 2.46 4.32 -1.26 -4.62 117.00 115.02 1hdu n LEU 137 Ca 0.00 -0.67 -0.31 0.00 -0.02 0.00 0.00 56.01 55.01 1hdu n LEU 137 Cb 0.00 -0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 41.75 1hdu n LEU 137 CO 0.00 0.33 0.24 0.00 -1.22 0.00 0.00 177.39 176.75 1hdu s VAL 139 N -1.94 2.32 0.00 0.00 1.01 -1.26 -4.58 120.40 115.95 1hdu s VAL 139 Ca 0.47 -1.77 0.00 0.00 0.00 0.00 0.00 61.98 60.68 1hdu s VAL 139 Cb -0.11 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.23 1hdu s VAL 139 CO 0.24 0.07 0.00 0.61 0.00 0.00 0.00 175.10 176.02 1hdu n GLY 140 N 0.83 -1.29 3.15 4.51 0.00 0.20 -4.91 105.19 107.68 1hdu n GLY 140 Ca -0.17 -1.51 -0.20 0.00 0.00 0.00 0.00 46.02 44.14 1hdu n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hdu s VAL 141 N -3.20 1.15 -0.54 1.61 1.01 -1.26 -4.81 120.40 114.36 1hdu s VAL 141 Ca 0.00 -1.05 -0.28 0.00 0.00 0.00 0.00 61.98 60.66 1hdu s VAL 141 Cb 0.00 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.34 1hdu s VAL 141 CO 0.00 -0.01 1.48 -0.62 0.00 0.00 0.00 175.10 175.95 1hdu s ASP 142 N -1.21 6.04 0.62 3.32 -1.08 -0.03 -1.29 116.67 123.04 1hdu s ASP 142 Ca 0.02 0.39 0.33 0.00 -0.52 0.00 0.00 52.55 52.76 1hdu s ASP 142 Cb -0.08 -2.54 1.86 0.00 -1.46 0.00 0.00 42.92 40.70 1hdu s ASP 142 CO 0.01 -1.76 2.16 0.00 0.52 0.00 0.00 175.17 176.10 1hdu h ALA 143 N 11.54 1.51 -0.79 3.66 0.00 -1.86 -1.68 119.26 131.64 1hdu h ALA 143 Ca -0.27 -0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.27 1hdu h ALA 143 Cb 1.10 0.01 -0.22 0.00 0.00 0.00 0.00 17.79 18.68 1hdu h ALA 143 CO 1.17 -0.19 0.47 -1.71 0.00 0.00 0.00 179.25 178.98 1hdu n ASN 144 N -3.50 3.88 0.00 0.00 5.15 -1.26 -3.35 115.26 116.18 1hdu n ASN 144 Ca -0.01 -3.27 0.00 0.00 -0.60 0.00 0.00 54.58 50.70 1hdu n ASN 144 Cb 0.24 -0.77 0.00 0.00 -0.53 0.00 0.00 39.78 38.72 1hdu n ASN 144 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1hdu n ARG 145 N -0.66 0.02 0.00 1.20 5.12 -0.64 -3.77 116.66 117.93 1hdu n ARG 145 Ca 0.46 -0.21 0.12 0.00 -1.93 0.00 0.00 57.85 56.30 1hdu n ARG 145 Cb 1.43 -0.53 0.10 0.00 -1.16 0.00 0.00 32.46 32.31 1hdu n ARG 145 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1hdu n ASN 146 N -0.01 2.78 -4.86 0.55 4.05 -1.06 -4.40 115.26 112.30 1hdu n ASN 146 Ca 0.00 -1.90 -0.31 0.00 0.45 0.00 0.00 54.58 52.82 1hdu n ASN 146 Cb 0.32 0.07 -0.01 0.00 1.23 0.00 0.00 39.78 41.39 1hdu n ASN 146 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1hdu s TRP 147 N -2.07 3.54 -1.45 1.20 0.52 -0.23 -0.54 118.94 119.92 1hdu s TRP 147 Ca 0.27 1.29 -0.14 0.00 0.02 0.00 0.00 56.10 57.54 1hdu s TRP 147 Cb 0.20 -2.68 0.04 0.00 -1.15 0.00 0.00 33.47 29.88 1hdu s TRP 147 CO 0.34 -0.48 2.20 -3.47 0.02 0.00 0.00 176.95 175.57 1hdu n ASP 148 N -2.14 3.94 -3.32 2.95 2.03 -1.26 -4.29 116.55 114.46 1hdu n ASP 148 Ca 0.05 -2.85 -0.11 0.00 0.52 0.00 0.00 54.79 52.41 1hdu n ASP 148 Cb 0.54 -1.66 -0.06 0.00 -0.72 0.00 0.00 41.12 39.22 1hdu n ASP 148 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1hdu s ALA 149 N 3.15 -1.07 -1.52 -1.67 0.00 -1.26 -4.77 121.76 114.62 1hdu s ALA 149 Ca 0.47 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.28 1hdu s ALA 149 Cb 0.14 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 21.13 1hdu s ALA 149 CO -0.08 -1.91 0.00 0.41 0.00 0.00 0.00 175.76 174.18 1hdu n GLY 150 N 4.95 0.13 3.61 0.00 0.00 -1.26 -0.80 105.19 111.82 1hdu n GLY 150 Ca 0.04 -0.19 -0.45 0.00 0.00 0.00 0.00 46.02 45.43 1hdu n GLY 150 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1hdu n PHE 151 N -3.67 1.52 -0.30 1.61 7.35 -1.26 -2.01 117.46 120.69 1hdu n PHE 151 Ca -0.19 0.65 0.00 0.00 -0.76 0.00 0.00 57.45 57.15 1hdu n PHE 151 Cb 0.63 -2.30 0.00 0.00 0.35 0.00 0.00 39.48 38.16 1hdu n PHE 151 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1hdu n GLY 152 N 1.39 2.05 3.95 7.13 0.00 -1.26 -4.98 105.19 113.46 1hdu n GLY 152 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 1hdu n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hdu s LYS 153 N -0.04 1.37 0.13 1.61 1.02 -0.85 -4.95 119.74 118.03 1hdu s LYS 153 Ca 0.00 -0.56 -0.34 0.00 0.02 0.00 0.00 55.97 55.09 1hdu s LYS 153 Cb 0.00 -2.07 -0.17 0.00 -0.52 0.00 0.00 37.83 35.07 1hdu s LYS 153 CO 0.00 -1.82 1.12 0.00 -0.92 0.00 0.00 175.35 173.73 1hdu n ALA 154 N -3.27 -1.56 0.00 5.17 0.00 -1.26 -3.38 120.51 116.20 1hdu n ALA 154 Ca 0.13 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.07 1hdu n ALA 154 Cb 0.60 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.10 1hdu n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hdu n GLY 155 N 2.01 1.20 3.22 0.00 0.00 -1.26 -3.50 105.19 106.86 1hdu n GLY 155 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 1hdu n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hdu s ALA 156 N -2.00 -0.61 0.11 4.61 0.00 -1.22 -3.48 121.76 119.16 1hdu s ALA 156 Ca 0.00 0.03 -0.06 0.00 0.00 0.00 0.00 51.96 51.92 1hdu s ALA 156 Cb 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 23.12 23.29 1hdu s ALA 156 CO 0.00 -0.34 0.37 0.45 0.00 0.00 0.00 175.76 176.24 1hdu s SER 157 N -1.80 6.53 0.00 0.00 0.15 -0.38 -4.92 113.70 113.27 1hdu s SER 157 Ca -0.08 0.63 0.23 0.00 0.70 0.00 0.00 55.95 57.43 1hdu s SER 157 Cb -0.03 -2.11 0.16 0.00 -1.71 0.00 0.00 66.02 62.34 1hdu s SER 157 CO -0.01 0.11 1.21 -1.54 1.20 0.00 0.00 173.24 174.21 1hdu n SER 158 N 0.43 2.82 -4.67 5.45 3.41 -1.26 -1.90 113.62 117.90 1hdu n SER 158 Ca -0.05 -1.91 -0.38 0.00 -0.26 0.00 0.00 58.87 56.27 1hdu n SER 158 Cb 0.52 0.04 -0.08 0.00 -0.26 0.00 0.00 64.21 64.44 1hdu n SER 158 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1hdu s SER 159 N -1.95 6.41 0.57 4.04 1.04 -1.26 -4.96 113.70 117.59 1hdu s SER 159 Ca 0.26 0.48 0.28 0.00 0.48 0.00 0.00 55.95 57.45 1hdu s SER 159 Cb 0.19 -2.22 1.49 0.00 0.10 0.00 0.00 66.02 65.58 1hdu s SER 159 CO 0.31 -0.06 1.96 -0.65 0.98 0.00 0.00 173.24 175.77 1hdu h PRO 160 N 7.37 0.00 -0.00 4.02 0.11 -1.95 -0.63 132.00 140.92 1hdu h PRO 160 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1hdu h PRO 160 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1hdu h PRO 160 CO 0.71 0.00 -0.15 0.00 -0.21 0.00 0.00 178.00 178.35 1hdu s SER 162 N -2.89 6.26 0.31 0.00 0.15 -0.24 -4.93 113.70 112.35 1hdu s SER 162 Ca 0.16 1.98 0.26 0.00 0.70 0.00 0.00 55.95 59.05 1hdu s SER 162 Cb 0.19 -2.57 1.03 0.00 -1.71 0.00 0.00 66.02 62.96 1hdu s SER 162 CO 0.56 -0.84 1.77 -0.08 1.20 0.00 0.00 173.24 175.85 1hdu h GLU 163 N 1.56 0.00 -0.11 5.44 4.81 -1.90 -2.93 114.58 121.46 1hdu h GLU 163 Ca -0.50 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.72 1hdu h GLU 163 Cb 1.23 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.60 1hdu h GLU 163 CO 0.59 0.00 -0.04 2.41 -0.73 0.00 0.00 179.01 181.24 1hdu n THR 164 N -2.42 2.09 -1.69 0.32 -1.04 -1.26 -4.60 114.28 105.68 1hdu n THR 164 Ca 0.02 -2.23 -0.45 0.00 -2.04 0.00 0.00 64.05 59.35 1hdu n THR 164 Cb 0.27 -0.25 -0.04 0.00 -1.82 0.00 0.00 70.33 68.49 1hdu n THR 164 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1hdu n TYR 165 N -1.09 2.48 0.90 -1.42 9.36 -1.11 -1.25 117.16 125.03 1hdu n TYR 165 Ca 0.19 0.04 0.13 0.00 3.32 0.00 0.00 57.90 61.58 1hdu n TYR 165 Cb 0.75 -2.65 0.47 0.00 -0.63 0.00 0.00 39.34 37.29 1hdu n TYR 165 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69 1hdu n HIS 166 N 4.85 0.21 0.00 2.98 1.44 -0.80 -0.85 115.22 123.04 1hdu n HIS 166 Ca 0.18 0.06 0.00 0.00 -2.01 0.00 0.00 57.72 55.95 1hdu n HIS 166 Cb 0.33 -0.54 0.00 0.00 0.12 0.00 0.00 29.99 29.90 1hdu n HIS 166 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1hdu n GLY 167 N 1.45 0.18 0.28 -1.39 0.00 -1.26 -4.27 105.19 100.18 1hdu n GLY 167 Ca 0.06 -1.89 -0.08 0.00 0.00 0.00 0.00 46.02 44.12 1hdu n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hdu h LYS 168 N 0.00 0.88 -3.08 1.61 1.57 -1.99 -3.47 116.57 112.09 1hdu h LYS 168 Ca 0.00 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 1hdu h LYS 168 Cb 0.00 -0.06 -0.11 0.00 0.08 0.00 0.00 32.23 32.14 1hdu h LYS 168 CO 0.00 0.95 0.16 1.52 -0.57 0.00 0.00 179.45 181.51 1hdu s TYR 169 N -4.79 -0.39 0.25 -1.35 -0.85 -1.26 -5.11 117.35 103.85 1hdu s TYR 169 Ca -0.10 0.11 -0.31 0.00 -0.52 0.00 0.00 57.07 56.24 1hdu s TYR 169 Cb 0.13 0.53 -0.13 0.00 0.38 0.00 0.00 41.96 42.88 1hdu s TYR 169 CO 0.84 -0.91 1.53 0.00 -1.52 0.00 0.00 175.55 175.49 1hdu n ALA 170 N -0.37 1.81 -1.63 9.51 0.00 -1.26 -2.27 120.51 126.29 1hdu n ALA 170 Ca -0.14 0.40 -0.11 0.00 0.00 0.00 0.00 53.44 53.59 1hdu n ALA 170 Cb 0.64 -2.37 -0.03 0.00 0.00 0.00 0.00 19.45 17.68 1hdu n ALA 170 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1hdu n ASN 171 N 2.49 -4.08 0.17 0.00 5.03 0.30 -4.92 115.26 114.26 1hdu n ASN 171 Ca 0.12 0.18 0.01 0.00 0.87 0.00 0.00 54.58 55.76 1hdu n ASN 171 Cb 0.33 -2.82 0.31 0.00 -1.02 0.00 0.00 39.78 36.58 1hdu n ASN 171 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 1hdu h SER 172 N 0.00 0.01 -3.33 6.41 4.64 -1.69 -3.41 113.55 116.17 1hdu h SER 172 Ca -0.24 -0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.52 1hdu h SER 172 Cb 0.89 -0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.93 1hdu h SER 172 CO 0.32 0.44 0.39 -1.61 -0.87 0.00 0.00 176.83 175.50 1hdu s GLU 173 N -4.06 4.45 0.53 4.77 0.41 -1.26 -4.92 118.70 118.61 1hdu s GLU 173 Ca -0.02 1.25 0.18 0.00 -0.41 0.00 0.00 54.97 55.97 1hdu s GLU 173 Cb 0.14 -3.51 1.35 0.00 -1.78 0.00 0.00 34.13 30.34 1hdu s GLU 173 CO 0.74 -0.17 2.16 -0.24 -0.49 0.00 0.00 175.26 177.26 1hdu h VAL 174 N 4.96 0.92 -0.31 2.63 3.04 -1.91 -0.51 116.25 125.07 1hdu h VAL 174 Ca -0.36 -0.04 -0.06 0.00 -1.01 0.00 0.00 66.70 65.23 1hdu h VAL 174 Cb 1.18 1.02 -0.02 0.00 -2.01 0.00 0.00 31.29 31.46 1hdu h VAL 174 CO 0.80 0.01 -0.08 -0.33 -1.01 0.00 0.00 177.57 176.96 1hdu h GLU 175 N 0.00 0.51 0.08 4.17 3.07 -1.90 -0.39 114.58 120.11 1hdu h GLU 175 Ca -0.00 -0.13 -0.12 0.00 -0.50 0.00 0.00 59.36 58.61 1hdu h GLU 175 Cb 0.02 -0.06 0.01 0.00 -0.84 0.00 0.00 28.75 27.88 1hdu h GLU 175 CO 0.00 0.60 -0.52 0.28 -1.40 0.00 0.00 179.01 177.96 1hdu h VAL 176 N 0.48 1.59 -0.47 3.13 2.07 -1.53 -3.32 116.25 118.20 1hdu h VAL 176 Ca 0.09 -2.44 -0.00 0.00 0.82 0.00 0.00 66.70 65.17 1hdu h VAL 176 Cb 0.43 3.23 -0.02 0.00 -1.52 0.00 0.00 31.29 33.41 1hdu h VAL 176 CO 0.02 0.66 0.28 0.50 0.02 0.00 0.00 177.57 179.05 1hdu h LYS 177 N -0.65 0.63 -0.98 1.57 3.64 -1.09 -1.64 116.57 118.06 1hdu h LYS 177 Ca -0.10 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.28 1hdu h LYS 177 Cb 1.37 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 33.00 1hdu h LYS 177 CO 0.07 0.44 0.64 0.77 -2.27 0.00 0.00 179.45 179.10 1hdu h SER 178 N 0.64 1.04 -0.06 4.20 0.02 -1.18 -0.13 113.55 118.07 1hdu h SER 178 Ca 0.17 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.03 1hdu h SER 178 Cb -0.02 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.29 1hdu h SER 178 CO -0.03 0.70 -0.29 0.40 -1.14 0.00 0.00 176.83 176.46 1hdu h ILE 179 N 1.20 1.43 -0.37 3.27 2.04 -1.46 -2.88 117.51 120.74 1hdu h ILE 179 Ca 0.40 -1.71 0.06 0.00 1.00 0.00 0.00 64.86 64.61 1hdu h ILE 179 Cb 0.07 2.35 -0.05 0.00 -0.74 0.00 0.00 36.82 38.44 1hdu h ILE 179 CO -0.14 0.49 0.04 0.58 0.00 0.00 0.00 178.15 179.12 1hdu h VAL 180 N -0.20 0.77 -0.51 1.67 2.07 -0.87 -0.10 116.25 119.08 1hdu h VAL 180 Ca -0.02 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1hdu h VAL 180 Cb 0.94 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1hdu h VAL 180 CO 0.06 0.03 0.24 0.44 0.02 0.00 0.00 177.57 178.36 1hdu h ASP 181 N 0.15 0.66 -0.50 0.57 3.32 -1.12 -0.57 116.42 118.94 1hdu h ASP 181 Ca 0.18 -0.13 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 1hdu h ASP 181 Cb 0.23 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1hdu h ASP 181 CO -0.27 0.61 0.04 0.15 -1.72 0.00 0.00 179.24 178.04 1hdu h PHE 182 N 0.68 0.92 -0.42 4.55 3.57 -1.24 -0.06 116.94 124.93 1hdu h PHE 182 Ca 0.17 -0.15 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 1hdu h PHE 182 Cb 0.12 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1hdu h PHE 182 CO -0.01 0.85 -0.03 0.28 -2.23 0.00 0.00 178.31 177.18 1hdu h VAL 183 N 0.72 1.27 -0.29 1.41 2.07 -0.88 -1.89 116.25 118.65 1hdu h VAL 183 Ca 0.15 -1.08 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 1hdu h VAL 183 Cb 0.46 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1hdu h VAL 183 CO 0.02 0.37 0.09 0.11 0.02 0.00 0.00 177.57 178.18 1hdu h LYS 184 N 0.60 0.45 -0.60 1.57 1.57 -0.98 -1.53 116.57 117.65 1hdu h LYS 184 Ca 0.12 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1hdu h LYS 184 Cb 0.53 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 1hdu h LYS 184 CO 0.03 0.51 0.40 -0.91 -0.57 0.00 0.00 179.45 178.90 1hdu h ASN 185 N 0.31 0.70 0.02 0.86 2.35 -0.96 -2.92 115.58 115.93 1hdu h ASN 185 Ca 0.09 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1hdu h ASN 185 Cb 0.24 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.44 1hdu h ASN 185 CO -0.00 0.51 -0.01 -0.74 -1.65 0.00 0.00 177.43 175.53 1hdu h HIS 186 N 0.82 -0.03 0.00 1.19 2.76 -1.23 -3.46 115.15 115.19 1hdu h HIS 186 Ca 0.22 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 1hdu h HIS 186 Cb -0.09 0.01 0.00 0.00 1.55 0.00 0.00 27.41 28.89 1hdu h HIS 186 CO -0.03 -0.02 0.00 0.41 -1.30 0.00 0.00 177.93 176.99 1hdu n GLY 187 N -1.11 0.14 1.66 5.26 0.00 -0.58 -4.82 105.19 105.73 1hdu n GLY 187 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 1hdu n GLY 187 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1hdu n ASN 188 N -0.53 2.08 -4.75 1.61 5.15 -1.26 -5.06 115.26 112.50 1hdu n ASN 188 Ca 0.00 -2.86 -0.40 0.00 -0.60 0.00 0.00 54.58 50.72 1hdu n ASN 188 Cb 0.27 -0.41 -0.05 0.00 -0.53 0.00 0.00 39.78 39.05 1hdu n ASN 188 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1hdu s PHE 189 N -2.42 3.84 -0.03 1.20 0.08 -1.26 -1.24 117.98 118.15 1hdu s PHE 189 Ca 0.37 1.64 0.11 0.00 0.12 0.00 0.00 56.93 59.17 1hdu s PHE 189 Cb 0.37 -2.86 -0.17 0.00 -0.57 0.00 0.00 43.02 39.78 1hdu s PHE 189 CO -0.07 0.37 0.23 1.63 -0.10 0.00 0.00 175.22 177.27 1hdu n LYS 190 N 2.24 0.56 -3.98 0.44 4.76 0.88 -4.74 118.16 118.32 1hdu n LYS 190 Ca -0.03 -0.09 -0.11 0.00 -2.87 0.00 0.00 58.31 55.21 1hdu n LYS 190 Cb 0.49 -1.27 -0.12 0.00 -1.84 0.00 0.00 35.03 32.29 1hdu n LYS 190 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hdu s ALA 191 N -2.74 0.20 -0.21 7.82 0.00 -1.15 -3.36 121.76 122.31 1hdu s ALA 191 Ca -0.04 -0.44 -0.05 0.00 0.00 0.00 0.00 51.96 51.43 1hdu s ALA 191 Cb 0.07 0.07 0.07 0.00 0.00 0.00 0.00 23.12 23.33 1hdu s ALA 191 CO 0.48 -0.07 0.10 0.12 0.00 0.00 0.00 175.76 176.39 1hdu s PHE 192 N -0.96 0.30 -0.18 0.00 2.19 -0.49 -0.95 117.98 117.89 1hdu s PHE 192 Ca -0.09 -0.54 -0.01 0.00 0.33 0.00 0.00 56.93 56.61 1hdu s PHE 192 Cb -0.07 -0.79 -0.00 0.00 -1.31 0.00 0.00 43.02 40.85 1hdu s PHE 192 CO -0.00 -0.62 -0.11 -0.51 1.83 0.00 0.00 175.22 175.80 1hdu s LEU 193 N 2.11 2.65 -0.17 6.12 1.02 0.13 -2.05 118.68 128.49 1hdu s LEU 193 Ca 0.04 -0.44 -0.01 0.00 0.02 0.00 0.00 54.13 53.74 1hdu s LEU 193 Cb -0.16 -1.64 -0.01 0.00 0.02 0.00 0.00 46.19 44.41 1hdu s LEU 193 CO -0.18 0.04 -0.11 -0.55 0.02 0.00 0.00 176.35 175.57 1hdu s SER 194 N 1.09 3.99 -0.15 2.29 0.15 -0.74 -1.02 113.70 119.31 1hdu s SER 194 Ca 0.00 -0.39 -0.05 0.00 0.70 0.00 0.00 55.95 56.21 1hdu s SER 194 Cb -0.15 -1.64 -0.03 0.00 -1.71 0.00 0.00 66.02 62.49 1hdu s SER 194 CO -0.03 0.08 0.02 -0.63 1.20 0.00 0.00 173.24 173.88 1hdu s ILE 195 N 0.86 4.41 0.22 6.45 1.01 -0.06 -1.60 121.20 132.49 1hdu s ILE 195 Ca -0.03 -0.18 0.04 0.00 0.00 0.00 0.00 60.65 60.47 1hdu s ILE 195 Cb -0.15 -2.94 -0.01 0.00 0.01 0.00 0.00 42.46 39.37 1hdu s ILE 195 CO 0.00 0.51 0.14 1.41 0.00 0.00 0.00 174.94 177.00 1hdu n HIS 196 N 3.19 -0.24 -3.60 3.97 8.25 0.78 -3.92 115.22 123.66 1hdu n HIS 196 Ca -0.17 -1.67 -0.15 0.00 -0.26 0.00 0.00 57.72 55.47 1hdu n HIS 196 Cb 0.53 0.10 -0.06 0.00 1.12 0.00 0.00 29.99 31.68 1hdu n HIS 196 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1hdu s SER 197 N -2.48 -0.44 0.40 0.41 1.04 -1.26 -0.61 113.70 110.76 1hdu s SER 197 Ca 0.19 0.27 0.04 0.00 0.48 0.00 0.00 55.95 56.93 1hdu s SER 197 Cb 0.01 0.47 -0.05 0.00 0.10 0.00 0.00 66.02 66.55 1hdu s SER 197 CO 0.14 -0.65 0.06 -0.72 0.98 0.00 0.00 173.24 173.04 1hdu s TYR 198 N -2.01 2.01 0.00 5.02 1.13 -1.26 -4.89 117.35 117.35 1hdu s TYR 198 Ca -0.08 -0.98 0.00 0.00 -1.41 0.00 0.00 57.07 54.60 1hdu s TYR 198 Cb -0.01 -1.42 0.00 0.00 -1.10 0.00 0.00 41.96 39.43 1hdu s TYR 198 CO 0.02 0.06 0.00 0.43 -2.51 0.00 0.00 175.55 173.55 1hdu n SER 199 N -1.01 0.00 -2.99 -0.18 7.64 0.62 -4.87 113.62 112.83 1hdu n SER 199 Ca -0.07 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.77 1hdu n SER 199 Cb 0.66 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.88 1hdu n SER 199 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hdu n GLN 200 N 0.00 -1.47 -4.05 1.43 6.02 -0.23 -4.84 117.38 114.23 1hdu n GLN 200 Ca 0.00 1.24 -0.11 0.00 -0.01 0.00 0.00 57.00 58.12 1hdu n GLN 200 Cb 0.00 -5.46 -0.11 0.00 1.02 0.00 0.00 30.24 25.69 1hdu n GLN 200 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1hdu s LEU 201 N -4.25 2.30 -0.22 1.08 1.43 -0.68 -2.20 118.68 116.15 1hdu s LEU 201 Ca 0.13 -0.63 0.01 0.00 -1.03 0.00 0.00 54.13 52.61 1hdu s LEU 201 Cb -0.02 -0.04 0.05 0.00 0.03 0.00 0.00 46.19 46.21 1hdu s LEU 201 CO 0.69 -0.30 -0.10 -0.22 0.23 0.00 0.00 176.35 176.65 1hdu s LEU 202 N -1.84 2.61 0.14 1.79 0.20 -0.18 -0.74 118.68 120.66 1hdu s LEU 202 Ca -0.08 -1.05 0.08 0.00 0.69 0.00 0.00 54.13 53.78 1hdu s LEU 202 Cb -0.07 -1.32 -0.04 0.00 -0.43 0.00 0.00 46.19 44.33 1hdu s LEU 202 CO -0.02 -0.16 -0.12 -0.76 -0.29 0.00 0.00 176.35 175.00 1hdu s LEU 203 N 1.31 2.90 0.24 -0.68 1.02 -0.07 -2.49 118.68 120.91 1hdu s LEU 203 Ca -0.03 -0.53 0.03 0.00 0.02 0.00 0.00 54.13 53.62 1hdu s LEU 203 Cb -0.17 -1.66 -0.05 0.00 0.02 0.00 0.00 46.19 44.32 1hdu s LEU 203 CO -0.07 0.15 0.02 -0.72 0.02 0.00 0.00 176.35 175.74 1hdu s TYR 204 N -1.41 1.54 0.76 0.29 -0.85 -0.90 -1.23 117.35 115.55 1hdu s TYR 204 Ca 0.22 -0.99 -0.15 0.00 -0.52 0.00 0.00 57.07 55.62 1hdu s TYR 204 Cb -0.10 -0.90 0.04 0.00 0.38 0.00 0.00 41.96 41.38 1hdu s TYR 204 CO 0.13 -0.12 1.11 -2.30 -1.52 0.00 0.00 175.55 172.85 1hdu n PRO 205 N -0.42 0.41 -4.08 -3.49 -0.02 -1.26 -1.36 135.00 124.77 1hdu n PRO 205 Ca -0.04 0.21 -0.24 0.00 -2.02 0.00 0.00 63.50 61.40 1hdu n PRO 205 Cb 0.64 -2.36 -0.07 0.00 -0.02 0.00 0.00 33.50 31.69 1hdu n PRO 205 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1hdu s TYR 206 N -1.92 2.59 -0.07 6.00 2.02 -1.26 -4.62 117.35 120.09 1hdu s TYR 206 Ca 0.74 -0.59 0.06 0.00 -0.37 0.00 0.00 57.07 56.91 1hdu s TYR 206 Cb -0.32 -1.98 -0.08 0.00 -0.40 0.00 0.00 41.96 39.18 1hdu s TYR 206 CO 0.50 0.15 0.02 0.41 -1.57 0.00 0.00 175.55 175.05 1hdu n GLY 207 N -1.27 -0.33 0.07 0.71 0.00 -1.26 -1.78 105.19 101.33 1hdu n GLY 207 Ca -0.01 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.02 1hdu n GLY 207 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1hdu n TYR 208 N -2.27 0.64 -3.97 1.61 4.11 -0.82 -1.21 117.16 115.26 1hdu n TYR 208 Ca -0.11 0.19 -0.09 0.00 -0.00 0.00 0.00 57.90 57.88 1hdu n TYR 208 Cb 0.72 -0.74 -0.10 0.00 -0.00 0.00 0.00 39.34 39.23 1hdu n TYR 208 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.86 176.78 1hdu s THR 209 N -3.12 0.14 -1.49 -3.48 -1.32 -1.26 -4.91 115.64 100.19 1hdu s THR 209 Ca 0.09 -1.12 0.29 0.00 -1.21 0.00 0.00 61.69 59.73 1hdu s THR 209 Cb 0.13 -0.75 0.43 0.00 -1.51 0.00 0.00 72.50 70.81 1hdu s THR 209 CO 0.66 -0.62 1.90 0.35 -2.21 0.00 0.00 174.62 174.71 1hdu n THR 210 N 1.00 0.00 -1.76 5.08 -2.24 -1.26 -4.58 114.28 110.51 1hdu n THR 210 Ca -0.20 -0.03 -0.42 0.00 -2.27 0.00 0.00 64.05 61.13 1hdu n THR 210 Cb 0.57 -0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.55 1hdu n THR 210 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1hdu s GLN 211 N -2.58 4.12 0.13 -0.78 2.00 -1.26 -4.96 119.66 116.32 1hdu s GLN 211 Ca 0.27 2.60 -0.27 0.00 -2.00 0.00 0.00 55.36 55.95 1hdu s GLN 211 Cb 0.20 -3.03 -0.07 0.00 0.80 0.00 0.00 33.01 30.91 1hdu s GLN 211 CO 0.49 -0.67 0.84 -1.12 -0.50 0.00 0.00 175.29 174.33 1hdu s SER 212 N 0.66 7.41 0.65 6.67 0.01 -1.26 -4.55 113.70 123.28 1hdu s SER 212 Ca 0.66 1.67 -0.16 0.00 1.31 0.00 0.00 55.95 59.43 1hdu s SER 212 Cb -0.48 -2.53 -0.00 0.00 0.21 0.00 0.00 66.02 63.21 1hdu s SER 212 CO 0.45 0.08 1.13 0.27 0.41 0.00 0.00 173.24 175.58 1hdu s ILE 213 N -0.55 3.05 0.47 1.44 -4.36 -1.26 -4.93 121.20 115.06 1hdu s ILE 213 Ca 0.40 0.52 0.17 0.00 -0.26 0.00 0.00 60.65 61.48 1hdu s ILE 213 Cb -0.23 -3.07 0.22 0.00 1.25 0.00 0.00 42.46 40.64 1hdu s ILE 213 CO 0.27 -0.27 2.05 -0.65 0.24 0.00 0.00 174.94 176.58 1hdu h PRO 214 N 0.18 0.00 -0.83 0.37 0.11 -1.99 -2.72 132.00 127.13 1hdu h PRO 214 Ca -0.48 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.34 1hdu h PRO 214 Cb 1.26 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.20 1hdu h PRO 214 CO 0.54 0.12 0.37 -0.25 -0.21 0.00 0.00 178.00 178.57 1hdu n ASP 215 N -4.30 4.56 -0.15 -2.05 8.00 -1.26 -4.67 116.55 116.68 1hdu n ASP 215 Ca -0.03 -3.29 -0.03 0.00 0.71 0.00 0.00 54.79 52.16 1hdu n ASP 215 Cb 0.20 -0.77 0.06 0.00 -0.02 0.00 0.00 41.12 40.59 1hdu n ASP 215 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1hdu h LYS 216 N 2.24 0.24 -0.59 -1.24 3.64 -1.86 -1.33 116.57 117.66 1hdu h LYS 216 Ca 0.36 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.76 1hdu h LYS 216 Cb 2.46 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 34.19 1hdu h LYS 216 CO 0.83 0.16 0.35 1.15 -2.27 0.00 0.00 179.45 179.67 1hdu h THR 217 N 0.24 1.04 -0.05 1.00 2.02 -1.87 -0.58 112.91 114.72 1hdu h THR 217 Ca 0.24 -0.24 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 1hdu h THR 217 Cb 0.32 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1hdu h THR 217 CO -0.31 0.13 -0.07 -0.08 0.37 0.00 0.00 175.52 175.55 1hdu h GLU 218 N 0.69 0.13 -0.63 6.66 4.81 -1.84 -2.97 114.58 121.43 1hdu h GLU 218 Ca 0.25 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.37 1hdu h GLU 218 Cb 0.06 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1hdu h GLU 218 CO -0.12 0.63 0.28 -0.07 -0.73 0.00 0.00 179.01 179.00 1hdu h LEU 219 N -0.35 0.82 -0.92 1.64 4.07 -1.19 -0.90 115.31 118.48 1hdu h LEU 219 Ca 0.00 -0.09 -0.05 0.00 0.08 0.00 0.00 57.88 57.82 1hdu h LEU 219 Cb 0.61 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 42.11 1hdu h LEU 219 CO 0.02 0.71 0.20 -1.13 -1.08 0.00 0.00 178.44 177.15 1hdu h ASN 220 N 0.89 0.92 0.09 -0.43 -0.73 -1.15 -0.10 115.58 115.07 1hdu h ASN 220 Ca 0.22 -0.16 -0.19 0.00 1.87 0.00 0.00 56.30 58.04 1hdu h ASN 220 Cb 0.13 -0.24 -0.00 0.00 0.27 0.00 0.00 38.32 38.48 1hdu h ASN 220 CO -0.02 0.86 -0.68 -0.61 -0.37 0.00 0.00 177.43 176.61 1hdu h GLN 221 N 0.95 0.54 -0.54 6.67 5.75 -1.27 -0.73 115.11 126.48 1hdu h GLN 221 Ca 0.21 -0.41 -0.05 0.00 -0.15 0.00 0.00 58.65 58.25 1hdu h GLN 221 Cb 0.28 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 1hdu h GLN 221 CO -0.01 1.03 0.13 0.28 -2.65 0.00 0.00 178.83 177.62 1hdu h VAL 222 N 0.39 1.24 -0.70 2.39 2.07 -0.81 -1.33 116.25 119.50 1hdu h VAL 222 Ca -0.02 -0.87 -0.07 0.00 0.82 0.00 0.00 66.70 66.56 1hdu h VAL 222 Cb 1.26 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1hdu h VAL 222 CO 0.13 0.32 0.17 0.00 0.02 0.00 0.00 177.57 178.20 1hdu h ALA 223 N 1.01 0.93 -0.53 1.67 0.00 -0.91 -0.76 119.26 120.66 1hdu h ALA 223 Ca 0.17 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1hdu h ALA 223 Cb 0.34 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1hdu h ALA 223 CO 0.00 0.65 0.34 -0.22 0.00 0.00 0.00 179.25 180.03 1hdu h LYS 224 N 1.06 0.67 -0.48 0.00 3.64 -0.77 -0.98 116.57 119.71 1hdu h LYS 224 Ca 0.22 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 1hdu h LYS 224 Cb 0.38 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1hdu h LYS 224 CO 0.00 0.44 0.02 0.77 -2.27 0.00 0.00 179.45 178.41 1hdu h SER 225 N 0.69 0.81 -0.72 4.20 0.02 -0.90 -2.40 113.55 115.26 1hdu h SER 225 Ca 0.20 -0.30 -0.04 0.00 -0.84 0.00 0.00 61.79 60.82 1hdu h SER 225 Cb -0.04 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.25 1hdu h SER 225 CO -0.07 0.91 0.30 0.00 -1.14 0.00 0.00 176.83 176.84 1hdu h ALA 226 N 0.93 0.93 -0.60 3.77 0.00 -0.87 -1.45 119.26 121.97 1hdu h ALA 226 Ca 0.14 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1hdu h ALA 226 Cb 0.48 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1hdu h ALA 226 CO 0.02 0.54 0.09 0.28 0.00 0.00 0.00 179.25 180.18 1hdu h VAL 227 N 1.02 1.25 -0.50 0.00 2.07 -1.11 -0.86 116.25 118.12 1hdu h VAL 227 Ca 0.24 -0.98 -0.12 0.00 0.82 0.00 0.00 66.70 66.65 1hdu h VAL 227 Cb 0.19 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1hdu h VAL 227 CO -0.02 0.36 -0.17 0.00 0.02 0.00 0.00 177.57 177.76 1hdu h ALA 228 N 1.17 0.74 -0.26 1.67 0.00 -1.13 -1.66 119.26 119.79 1hdu h ALA 228 Ca 0.19 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1hdu h ALA 228 Cb 0.41 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1hdu h ALA 228 CO 0.01 0.67 0.07 0.00 0.00 0.00 0.00 179.25 180.00 1hdu h ALA 229 N 0.92 0.35 -0.73 0.00 0.00 -0.99 -2.45 119.26 116.35 1hdu h ALA 229 Ca 0.12 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1hdu h ALA 229 Cb 0.74 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1hdu h ALA 229 CO 0.06 -0.00 0.45 1.25 0.00 0.00 0.00 179.25 181.01 1hdu h LEU 230 N 0.25 0.88 -1.44 0.00 6.46 -1.07 -2.62 115.31 117.76 1hdu h LEU 230 Ca 0.08 -0.06 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 1hdu h LEU 230 Cb 0.28 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1hdu h LEU 230 CO 0.00 0.67 -0.28 0.50 -0.62 0.00 0.00 178.44 178.71 1hdu h LYS 231 N 1.00 0.00 0.00 1.25 3.64 -1.21 -3.18 116.57 118.07 1hdu h LYS 231 Ca 0.26 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1hdu h LYS 231 Cb -0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1hdu h LYS 231 CO -0.05 0.28 0.00 0.66 -2.27 0.00 0.00 179.45 178.07 1hdu h SER 232 N 0.00 0.00 0.00 4.20 4.64 -1.04 0.22 113.55 121.57 1hdu h SER 232 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1hdu h SER 232 Cb 0.54 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1hdu h SER 232 CO 0.04 0.00 -0.09 0.25 -0.87 0.00 0.00 176.83 176.16 1hdu h LEU 233 N 0.00 0.00 -1.51 5.97 6.46 -1.70 -3.42 115.31 121.10 1hdu h LEU 233 Ca 0.00 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.70 1hdu h LEU 233 Cb 0.01 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.94 1hdu h LEU 233 CO 0.00 0.57 0.00 -1.22 -0.62 0.00 0.00 178.44 177.17 1hdu n TYR 234 N -4.74 0.00 -0.91 1.25 4.01 -1.23 -5.01 117.16 110.53 1hdu n TYR 234 Ca -0.02 -0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 1hdu n TYR 234 Cb 0.07 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 1hdu n TYR 234 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1hdu n GLY 235 N -0.15 0.50 3.69 2.72 0.00 0.77 -5.01 105.19 107.71 1hdu n GLY 235 Ca 0.00 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 1hdu n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hdu s THR 236 N -2.00 3.24 -0.17 2.61 2.01 -1.25 -4.97 115.64 115.10 1hdu s THR 236 Ca 0.00 0.67 -0.18 0.00 0.31 0.00 0.00 61.69 62.49 1hdu s THR 236 Cb 0.00 -3.43 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 1hdu s THR 236 CO 0.00 -0.00 0.48 -0.44 -0.69 0.00 0.00 174.62 173.96 1hdu s SER 237 N 2.26 6.57 0.10 3.53 0.01 -1.26 -4.11 113.70 120.80 1hdu s SER 237 Ca 0.71 0.68 0.09 0.00 1.31 0.00 0.00 55.95 58.74 1hdu s SER 237 Cb -0.37 -2.28 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 1hdu s SER 237 CO 0.30 -0.10 -0.22 -0.31 0.41 0.00 0.00 173.24 173.32 1hdu s TYR 238 N 1.24 2.43 0.26 2.43 1.51 -1.26 -4.89 117.35 119.08 1hdu s TYR 238 Ca 0.23 -0.32 0.07 0.00 -1.01 0.00 0.00 57.07 56.04 1hdu s TYR 238 Cb -0.15 -1.34 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 1hdu s TYR 238 CO 0.09 0.30 0.18 0.15 -1.11 0.00 0.00 175.55 175.17 1hdu s LYS 239 N -1.84 2.81 0.08 -0.62 3.01 -0.93 -4.98 119.74 117.28 1hdu s LYS 239 Ca 0.15 -1.13 -0.11 0.00 -1.01 0.00 0.00 55.97 53.87 1hdu s LYS 239 Cb -0.10 -2.49 0.01 0.00 -1.01 0.00 0.00 37.83 34.23 1hdu s LYS 239 CO 0.07 0.36 0.24 1.52 0.51 0.00 0.00 175.35 178.05 1hdu s TYR 240 N -2.18 0.04 -5.00 3.18 1.13 -1.26 -1.01 117.35 112.25 1hdu s TYR 240 Ca 0.34 -0.39 0.00 0.00 -1.41 0.00 0.00 57.07 55.61 1hdu s TYR 240 Cb -0.07 0.02 0.00 0.00 -1.10 0.00 0.00 41.96 40.81 1hdu s TYR 240 CO 0.24 -0.55 0.00 0.41 -2.51 0.00 0.00 175.55 173.14 1hdu n GLY 241 N 0.09 -0.79 3.78 5.49 0.00 -1.04 -4.98 105.19 107.75 1hdu n GLY 241 Ca -0.16 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.01 1hdu n GLY 241 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hdu s SER 242 N -2.73 5.41 0.11 1.61 1.04 -1.26 -2.12 113.70 115.76 1hdu s SER 242 Ca 0.00 1.97 -0.30 0.00 0.48 0.00 0.00 55.95 58.10 1hdu s SER 242 Cb 0.00 -2.55 -0.10 0.00 0.10 0.00 0.00 66.02 63.47 1hdu s SER 242 CO 0.00 -1.42 1.61 0.40 0.98 0.00 0.00 173.24 174.80 1hdu h ILE 243 N 0.34 0.25 -0.10 -1.02 2.04 -1.19 -0.94 117.51 116.90 1hdu h ILE 243 Ca -0.47 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 1hdu h ILE 243 Cb 1.24 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1hdu h ILE 243 CO 0.56 0.00 0.02 -0.29 0.00 0.00 0.00 178.15 178.44 1hdu h ILE 244 N -0.61 1.05 0.00 -0.67 2.10 -1.47 -0.16 117.51 117.75 1hdu h ILE 244 Ca 0.02 -0.19 -0.05 0.00 1.08 0.00 0.00 64.86 65.72 1hdu h ILE 244 Cb 0.63 0.96 -0.01 0.00 -1.09 0.00 0.00 36.82 37.31 1hdu h ILE 244 CO -0.19 0.07 -0.81 0.74 -1.08 0.00 0.00 178.15 176.88 1hdu h THR 245 N 0.14 0.22 0.04 2.19 2.02 -1.79 -3.34 112.91 112.38 1hdu h THR 245 Ca 0.03 -1.37 -0.37 0.00 0.77 0.00 0.00 66.41 65.48 1hdu h THR 245 Cb 0.06 1.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.27 1hdu h THR 245 CO -0.00 0.12 -2.09 0.41 0.37 0.00 0.00 175.52 174.33 1hdu n THR 246 N -2.89 1.59 0.00 3.16 -1.04 -0.37 -4.91 114.28 109.82 1hdu n THR 246 Ca -0.01 -0.43 0.00 0.00 -2.04 0.00 0.00 64.05 61.57 1hdu n THR 246 Cb 0.63 -1.76 0.00 0.00 -1.82 0.00 0.00 70.33 67.39 1hdu n THR 246 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 1hdu n ILE 247 N -3.82 0.00 -3.68 12.58 -5.35 -0.11 -5.09 119.36 113.88 1hdu n ILE 247 Ca -0.41 0.17 0.03 0.00 -0.27 0.00 0.00 62.75 62.26 1hdu n ILE 247 Cb 0.91 -1.16 0.00 0.00 -1.74 0.00 0.00 39.64 37.65 1hdu n ILE 247 CO 0.00 0.00 0.00 -0.72 -1.76 0.00 0.00 176.55 174.07 1hdu s TYR 248 N -0.99 -0.02 0.07 4.28 -0.85 -1.17 -5.01 117.35 113.67 1hdu s TYR 248 Ca 0.00 -0.05 -0.31 0.00 -0.52 0.00 0.00 57.07 56.19 1hdu s TYR 248 Cb 0.00 0.53 -0.08 0.00 0.38 0.00 0.00 41.96 42.80 1hdu s TYR 248 CO 0.00 -0.18 1.51 -1.14 -1.52 0.00 0.00 175.55 174.23 1hdu s GLN 249 N -2.20 4.25 -0.07 -3.49 0.74 -1.26 -3.93 119.66 113.70 1hdu s GLN 249 Ca 0.18 2.17 -0.03 0.00 0.05 0.00 0.00 55.36 57.73 1hdu s GLN 249 Cb 0.05 -3.46 0.04 0.00 1.10 0.00 0.00 33.01 30.74 1hdu s GLN 249 CO -0.04 -0.61 0.14 0.00 -0.55 0.00 0.00 175.29 174.23 1hdu s ALA 250 N 2.05 -0.16 0.13 1.58 0.00 -0.35 -4.07 121.76 120.94 1hdu s ALA 250 Ca 0.68 0.56 0.03 0.00 0.00 0.00 0.00 51.96 53.24 1hdu s ALA 250 Cb -0.37 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 1hdu s ALA 250 CO 0.30 -0.40 0.16 -1.54 0.00 0.00 0.00 175.76 174.28 1hdu s SER 251 N 1.84 5.78 -0.42 0.00 1.04 -1.23 -1.94 113.70 118.76 1hdu s SER 251 Ca -0.02 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1hdu s SER 251 Cb -0.12 -1.60 0.00 0.00 0.10 0.00 0.00 66.02 64.40 1hdu s SER 251 CO -0.05 0.10 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1hdu n GLY 252 N -0.11 0.46 3.83 7.32 0.00 0.02 -4.44 105.19 112.28 1hdu n GLY 252 Ca -0.08 -0.79 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 1hdu n GLY 252 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hdu s GLY 253 N -2.88 2.39 0.15 -0.02 0.00 -1.25 -1.06 107.32 104.65 1hdu s GLY 253 Ca 0.00 0.22 -0.17 0.00 0.00 0.00 0.00 44.72 44.77 1hdu s GLY 253 CO 0.00 0.47 1.76 1.48 0.00 0.00 0.00 173.10 176.81 1hdu h SER 254 N 2.22 0.15 -0.52 1.64 4.64 -1.90 -2.84 113.55 116.95 1hdu h SER 254 Ca -0.48 0.03 0.01 0.00 -0.47 0.00 0.00 61.79 60.88 1hdu h SER 254 Cb 1.18 0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 63.25 1hdu h SER 254 CO 0.64 0.12 0.34 0.40 -0.87 0.00 0.00 176.83 177.46 1hdu h ILE 255 N 0.27 1.11 -0.37 0.95 5.03 -1.94 -0.21 117.51 122.35 1hdu h ILE 255 Ca 0.14 -0.23 -0.14 0.00 -0.12 0.00 0.00 64.86 64.51 1hdu h ILE 255 Cb 0.10 0.38 -0.01 0.00 -3.03 0.00 0.00 36.82 34.26 1hdu h ILE 255 CO -0.13 0.12 -0.33 0.44 -0.68 0.00 0.00 178.15 177.57 1hdu h ASP 256 N 0.67 0.93 0.16 1.72 3.32 -1.92 -1.63 116.42 119.68 1hdu h ASP 256 Ca 0.19 -0.46 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1hdu h ASP 256 Cb -0.03 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.26 1hdu h ASP 256 CO -0.04 1.19 -0.08 -0.25 -1.72 0.00 0.00 179.24 178.34 1hdu h TRP 257 N 0.68 -0.20 -0.93 4.55 7.01 -1.13 -2.04 115.95 123.89 1hdu h TRP 257 Ca 0.06 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.06 1hdu h TRP 257 Cb 0.91 0.07 -0.05 0.00 -2.10 0.00 0.00 29.16 27.99 1hdu h TRP 257 CO 0.06 -0.03 0.57 0.66 -2.79 0.00 0.00 178.44 176.91 1hdu h SER 258 N -0.33 1.12 -0.54 2.65 4.64 -1.05 -2.04 113.55 118.00 1hdu h SER 258 Ca -0.02 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.19 1hdu h SER 258 Cb 0.26 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 1hdu h SER 258 CO 0.04 0.85 0.18 0.22 -0.87 0.00 0.00 176.83 177.24 1hdu h TYR 259 N 1.28 0.86 0.00 4.77 3.20 -1.24 -1.48 116.97 124.35 1hdu h TYR 259 Ca 0.34 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.12 1hdu h TYR 259 Cb -0.06 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 37.96 1hdu h TYR 259 CO 0.00 0.72 0.00 0.09 -1.64 0.00 0.00 178.16 177.34 1hdu n ASN 260 N -4.47 0.52 -0.48 -2.11 3.02 -0.77 -0.80 115.26 110.17 1hdu n ASN 260 Ca 0.02 0.67 0.13 0.00 -0.03 0.00 0.00 54.58 55.38 1hdu n ASN 260 Cb 0.19 -0.76 0.51 0.00 -0.61 0.00 0.00 39.78 39.11 1hdu n ASN 260 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1hdu n GLN 261 N -2.12 1.66 -0.19 3.52 -0.06 -0.62 -4.91 117.38 114.67 1hdu n GLN 261 Ca 0.01 -0.96 0.00 0.00 -2.00 0.00 0.00 57.00 54.05 1hdu n GLN 261 Cb 0.14 -1.47 0.00 0.00 -4.06 0.00 0.00 30.24 24.86 1hdu n GLN 261 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1hdu n GLY 262 N 1.16 0.81 3.43 1.69 0.00 0.02 -5.02 105.19 107.29 1hdu n GLY 262 Ca 0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.77 1hdu n GLY 262 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hdu s ILE 263 N -2.11 4.57 0.11 -0.61 1.01 -0.86 -4.92 121.20 118.38 1hdu s ILE 263 Ca 0.00 -0.85 -0.21 0.00 0.00 0.00 0.00 60.65 59.59 1hdu s ILE 263 Cb 0.00 -4.65 -0.09 0.00 0.01 0.00 0.00 42.46 37.73 1hdu s ILE 263 CO 0.00 -1.38 1.74 0.50 0.00 0.00 0.00 174.94 175.80 1hdu h LYS 264 N 9.27 0.07 -4.49 2.79 3.64 -1.85 -3.33 116.57 122.67 1hdu h LYS 264 Ca -0.18 -0.00 -0.72 0.00 -1.27 0.00 0.00 60.65 58.47 1hdu h LYS 264 Cb 1.06 -0.02 -0.12 0.00 -0.41 0.00 0.00 32.23 32.75 1hdu h LYS 264 CO 1.14 0.05 2.14 0.66 -2.27 0.00 0.00 179.45 181.16 1hdu n TYR 265 N -5.08 4.02 -3.78 1.91 4.01 -1.21 -4.92 117.16 112.11 1hdu n TYR 265 Ca -0.04 -3.00 -0.37 0.00 -0.16 0.00 0.00 57.90 54.33 1hdu n TYR 265 Cb 0.06 -2.31 -0.13 0.00 -0.31 0.00 0.00 39.34 36.66 1hdu n TYR 265 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1hdu s SER 266 N 2.68 5.03 0.03 7.72 0.01 -1.25 -1.39 113.70 126.52 1hdu s SER 266 Ca 0.45 -0.55 0.01 0.00 1.31 0.00 0.00 55.95 57.17 1hdu s SER 266 Cb 0.06 -1.87 -0.02 0.00 0.21 0.00 0.00 66.02 64.40 1hdu s SER 266 CO 0.00 -0.13 -0.05 -0.36 0.41 0.00 0.00 173.24 173.10 1hdu s PHE 267 N 1.52 0.47 -0.10 2.43 0.08 -0.87 -4.35 117.98 117.17 1hdu s PHE 267 Ca 0.04 -0.44 0.03 0.00 0.12 0.00 0.00 56.93 56.68 1hdu s PHE 267 Cb -0.16 -0.30 -0.01 0.00 -0.57 0.00 0.00 43.02 41.98 1hdu s PHE 267 CO 0.02 -0.11 -0.21 0.99 -0.10 0.00 0.00 175.22 175.81 1hdu s THR 268 N -1.19 2.36 -0.14 0.64 2.01 -0.36 -1.79 115.64 117.17 1hdu s THR 268 Ca -0.10 -0.92 -0.06 0.00 0.31 0.00 0.00 61.69 60.91 1hdu s THR 268 Cb -0.09 -1.92 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 1hdu s THR 268 CO -0.00 0.55 0.09 -0.36 -0.69 0.00 0.00 174.62 174.21 1hdu s PHE 269 N 0.20 3.40 -0.30 4.92 0.08 -0.63 -0.89 117.98 124.76 1hdu s PHE 269 Ca -0.13 0.33 0.01 0.00 0.12 0.00 0.00 56.93 57.26 1hdu s PHE 269 Cb -0.16 -1.96 0.07 0.00 -0.57 0.00 0.00 43.02 40.40 1hdu s PHE 269 CO 0.07 0.50 -0.01 -1.21 -0.10 0.00 0.00 175.22 174.46 1hdu s GLU 270 N -0.52 2.12 0.07 0.44 0.41 0.08 -0.15 118.70 121.14 1hdu s GLU 270 Ca 0.11 -1.48 -0.01 0.00 -0.41 0.00 0.00 54.97 53.18 1hdu s GLU 270 Cb -0.12 -3.11 0.02 0.00 -1.78 0.00 0.00 34.13 29.14 1hdu s GLU 270 CO 0.02 -0.71 0.08 1.28 -0.49 0.00 0.00 175.26 175.44 1hdu n LEU 271 N 4.47 0.00 -4.76 1.80 4.32 0.22 -1.07 117.00 121.98 1hdu n LEU 271 Ca -0.09 -0.08 -0.34 0.00 -0.02 0.00 0.00 56.01 55.48 1hdu n LEU 271 Cb 0.42 -0.06 0.05 0.00 -1.62 0.00 0.00 43.42 42.21 1hdu n LEU 271 CO 0.24 -0.80 0.77 -0.13 -1.22 0.00 0.00 177.39 176.25 1hdu s ARG 272 N -3.17 2.69 0.00 3.23 0.52 -1.26 -1.93 118.95 119.02 1hdu s ARG 272 Ca 0.05 1.54 0.00 0.00 -0.52 0.00 0.00 55.73 56.79 1hdu s ARG 272 Cb -0.00 -1.92 0.00 0.00 0.52 0.00 0.00 34.95 33.54 1hdu s ARG 272 CO 0.03 -1.37 0.00 -0.40 0.02 0.00 0.00 175.30 173.59 1hdu n ASP 273 N -2.33 0.54 -1.99 0.23 5.68 -1.26 -4.70 116.55 112.72 1hdu n ASP 273 Ca 0.11 0.00 -0.03 0.00 -0.50 0.00 0.00 54.79 54.38 1hdu n ASP 273 Cb 0.51 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.83 1hdu n ASP 273 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1hdu n THR 274 N 0.00 2.91 0.00 2.12 -2.24 -1.26 -0.28 114.28 115.53 1hdu n THR 274 Ca 0.00 -1.59 0.00 0.00 -2.27 0.00 0.00 64.05 60.19 1hdu n THR 274 Cb 0.00 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 1hdu n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hdu n GLY 275 N 0.04 1.14 0.14 3.38 0.00 -1.26 -4.92 105.19 103.71 1hdu n GLY 275 Ca 0.38 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.30 1hdu n GLY 275 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1hdu h ARG 276 N 0.00 -0.10 0.00 1.61 2.43 -2.03 -3.29 114.38 113.00 1hdu h ARG 276 Ca 0.00 0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 58.97 1hdu h ARG 276 Cb 0.00 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.53 1hdu h ARG 276 CO 0.00 -0.07 -1.97 0.66 -1.51 0.00 0.00 179.97 177.08 1hdu n TYR 277 N -5.23 0.00 0.00 2.20 4.01 -1.26 -5.07 117.16 111.81 1hdu n TYR 277 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1hdu n TYR 277 Cb 0.15 -0.66 0.00 0.00 -0.31 0.00 0.00 39.34 38.53 1hdu n TYR 277 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1hdu n GLY 278 N 1.94 3.32 0.24 2.72 0.00 -1.24 -1.93 105.19 110.23 1hdu n GLY 278 Ca -0.19 -0.14 0.12 0.00 0.00 0.00 0.00 46.02 45.82 1hdu n GLY 278 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1hdu h PHE 279 N 0.00 0.00 -1.20 1.61 0.04 -1.93 -3.30 116.94 112.17 1hdu h PHE 279 Ca 0.00 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.20 1hdu h PHE 279 Cb 0.00 0.00 -0.18 0.00 2.20 0.00 0.00 35.95 37.97 1hdu h PHE 279 CO 0.00 0.13 0.81 1.28 -0.60 0.00 0.00 178.31 179.92 1hdu n LEU 280 N -3.22 6.85 -4.72 1.54 4.77 -0.81 -4.55 117.00 116.86 1hdu n LEU 280 Ca 0.01 -4.31 -0.42 0.00 -0.03 0.00 0.00 56.01 51.26 1hdu n LEU 280 Cb 0.42 -1.24 -0.03 0.00 -2.33 0.00 0.00 43.42 40.25 1hdu n LEU 280 CO 0.32 1.80 1.15 -0.22 -1.33 0.00 0.00 177.39 179.11 1hdu s LEU 281 N -2.40 4.38 0.41 2.23 0.20 -1.24 -4.86 118.68 117.40 1hdu s LEU 281 Ca 0.57 2.56 -0.26 0.00 0.69 0.00 0.00 54.13 57.69 1hdu s LEU 281 Cb 0.35 -3.60 -0.10 0.00 -0.43 0.00 0.00 46.19 42.41 1hdu s LEU 281 CO -0.22 -0.75 1.43 -2.65 -0.29 0.00 0.00 176.35 173.87 1hdu n PRO 282 N 3.51 2.37 0.10 0.98 -0.02 -1.26 -4.88 135.00 135.79 1hdu n PRO 282 Ca 0.11 0.84 0.18 0.00 -2.02 0.00 0.00 63.50 62.61 1hdu n PRO 282 Cb 0.40 -2.60 0.73 0.00 -0.02 0.00 0.00 33.50 32.01 1hdu n PRO 282 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hdu h ALA 283 N 2.53 2.19 0.00 3.55 0.00 -1.92 -0.19 119.26 125.42 1hdu h ALA 283 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1hdu h ALA 283 Cb 1.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1hdu h ALA 283 CO 0.62 -0.46 0.00 -1.13 0.00 0.00 0.00 179.25 178.28 1hdu n SER 284 N -4.17 0.46 -0.83 0.00 3.41 -1.26 -1.61 113.62 109.62 1hdu n SER 284 Ca 0.05 0.67 0.11 0.00 -0.26 0.00 0.00 58.87 59.45 1hdu n SER 284 Cb 0.46 -0.75 0.08 0.00 -0.26 0.00 0.00 64.21 63.74 1hdu n SER 284 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hdu n GLN 285 N -2.07 2.00 0.34 4.33 6.02 -0.08 -4.59 117.38 123.32 1hdu n GLN 285 Ca 0.00 -1.70 -0.17 0.00 -0.01 0.00 0.00 57.00 55.12 1hdu n GLN 285 Cb 0.10 -1.43 -0.09 0.00 1.02 0.00 0.00 30.24 29.84 1hdu n GLN 285 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1hdu h ILE 286 N 4.09 0.29 -0.18 5.09 2.04 -1.41 -1.49 117.51 125.93 1hdu h ILE 286 Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1hdu h ILE 286 Cb 0.90 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1hdu h ILE 286 CO 0.00 0.00 0.10 0.40 0.00 0.00 0.00 178.15 178.65 1hdu h ILE 287 N -0.89 1.08 -1.00 -0.67 2.04 -1.81 -0.63 117.51 115.64 1hdu h ILE 287 Ca -0.07 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.58 1hdu h ILE 287 Cb 0.71 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 1hdu h ILE 287 CO 0.09 0.08 0.66 -0.65 0.00 0.00 0.00 178.15 178.33 1hdu h PRO 288 N 0.20 1.30 -0.39 2.37 0.11 -1.82 0.19 132.00 133.95 1hdu h PRO 288 Ca 0.06 -0.08 -0.03 0.00 0.11 0.00 0.00 66.00 66.06 1hdu h PRO 288 Cb 0.04 -0.29 -0.02 0.00 0.11 0.00 0.00 31.00 30.84 1hdu h PRO 288 CO -0.01 0.86 0.12 1.15 -0.21 0.00 0.00 178.00 179.90 1hdu h THR 289 N 1.34 1.22 -0.45 -1.15 2.02 -1.05 -2.37 112.91 112.46 1hdu h THR 289 Ca 0.37 -0.72 -0.04 0.00 0.77 0.00 0.00 66.41 66.79 1hdu h THR 289 Cb -0.12 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 1hdu h THR 289 CO -0.09 0.25 0.13 0.00 0.37 0.00 0.00 175.52 176.18 1hdu h ALA 290 N 0.96 0.59 -0.25 6.16 0.00 -0.57 -1.61 119.26 124.53 1hdu h ALA 290 Ca 0.13 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1hdu h ALA 290 Cb 0.27 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1hdu h ALA 290 CO -0.00 0.25 0.14 1.96 0.00 0.00 0.00 179.25 181.59 1hdu h GLN 291 N 0.58 0.28 -0.12 0.00 4.20 -0.52 -1.64 115.11 117.89 1hdu h GLN 291 Ca 0.14 -0.02 -0.18 0.00 0.06 0.00 0.00 58.65 58.66 1hdu h GLN 291 Cb 0.28 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 1hdu h GLN 291 CO -0.00 0.19 -0.66 1.05 -0.67 0.00 0.00 178.83 178.73 1hdu h GLU 292 N 0.29 0.47 -0.48 1.46 4.11 -1.41 -3.08 114.58 115.95 1hdu h GLU 292 Ca 0.10 -0.35 -0.05 0.00 0.07 0.00 0.00 59.36 59.13 1hdu h GLU 292 Cb 0.01 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1hdu h GLU 292 CO -0.06 0.97 0.10 0.00 0.07 0.00 0.00 179.01 180.10 1hdu h THR 293 N 0.34 1.21 -0.76 -1.06 1.03 -1.15 -2.21 112.91 110.31 1hdu h THR 293 Ca -0.02 -0.77 -0.00 0.00 -0.01 0.00 0.00 66.41 65.61 1hdu h THR 293 Cb 1.22 0.74 -0.04 0.00 -1.07 0.00 0.00 68.15 69.01 1hdu h THR 293 CO 0.12 0.28 0.47 -0.25 -0.01 0.00 0.00 175.52 176.13 1hdu h TRP 294 N 0.70 0.98 -0.73 0.00 2.91 -1.21 -0.18 115.95 118.43 1hdu h TRP 294 Ca 0.16 0.01 -0.06 0.00 1.13 0.00 0.00 58.89 60.12 1hdu h TRP 294 Cb 0.29 -0.33 -0.03 0.00 -0.51 0.00 0.00 29.16 28.58 1hdu h TRP 294 CO 0.01 0.65 0.23 -0.07 -1.03 0.00 0.00 178.44 178.23 1hdu h LEU 295 N 1.04 1.05 -0.35 0.65 3.38 -1.38 0.20 115.31 119.90 1hdu h LEU 295 Ca 0.27 -0.19 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 1hdu h LEU 295 Cb -0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 1hdu h LEU 295 CO -0.05 0.97 -0.33 1.23 0.09 0.00 0.00 178.44 180.35 1hdu h GLY 296 N 1.11 0.92 0.92 0.83 0.00 -1.22 -2.52 103.07 103.10 1hdu h GLY 296 Ca 0.24 -0.93 -0.06 0.00 0.00 0.00 0.00 47.33 46.57 1hdu h GLY 296 CO -0.01 0.84 -0.02 -2.08 0.00 0.00 0.00 176.54 175.28 1hdu h VAL 297 N 0.64 1.26 -0.97 4.60 2.07 -0.76 -2.88 116.25 120.21 1hdu h VAL 297 Ca 0.06 -1.01 0.05 0.00 0.82 0.00 0.00 66.70 66.62 1hdu h VAL 297 Cb 0.92 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 31.85 1hdu h VAL 297 CO 0.08 0.33 0.64 0.25 0.02 0.00 0.00 177.57 178.89 1hdu h LEU 298 N 0.43 1.04 -0.59 2.57 6.46 -0.61 -1.35 115.31 123.26 1hdu h LEU 298 Ca 0.10 -0.00 0.03 0.00 -0.12 0.00 0.00 57.88 57.88 1hdu h LEU 298 Cb 0.48 -0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 40.14 1hdu h LEU 298 CO 0.02 0.69 0.35 0.74 -0.62 0.00 0.00 178.44 179.62 1hdu h THR 299 N 1.19 1.06 -0.37 1.05 2.02 -1.25 0.41 112.91 117.01 1hdu h THR 299 Ca 0.40 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 67.28 1hdu h THR 299 Cb 0.08 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 1hdu h THR 299 CO -0.14 0.13 -0.02 0.40 0.37 0.00 0.00 175.52 176.26 1hdu h ILE 300 N 0.69 1.26 -0.50 3.11 2.04 -1.17 -2.65 117.51 120.30 1hdu h ILE 300 Ca 0.24 -1.03 0.02 0.00 1.00 0.00 0.00 64.86 65.09 1hdu h ILE 300 Cb 0.04 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 1hdu h ILE 300 CO -0.11 0.34 0.30 0.24 0.00 0.00 0.00 178.15 178.93 1hdu h MET 301 N 0.49 0.58 -0.86 2.37 2.86 -0.81 -1.58 114.93 117.98 1hdu h MET 301 Ca 0.10 -0.03 0.07 0.00 -2.06 0.00 0.00 59.70 57.78 1hdu h MET 301 Cb 0.50 -0.13 -0.06 0.00 0.06 0.00 0.00 31.60 31.96 1hdu h MET 301 CO 0.02 0.38 0.52 0.93 1.06 0.00 0.00 176.91 179.83 1hdu h GLU 302 N 0.59 0.91 -0.70 1.72 5.08 -0.81 -1.41 114.58 119.96 1hdu h GLU 302 Ca 0.20 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.44 1hdu h GLU 302 Cb 0.02 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1hdu h GLU 302 CO -0.09 0.60 0.17 1.25 -1.00 0.00 0.00 179.01 179.94 1hdu h HIS 303 N 0.94 1.18 -0.76 4.33 2.76 -1.08 -2.91 115.15 119.62 1hdu h HIS 303 Ca 0.38 -0.14 -0.05 0.00 -2.20 0.00 0.00 60.37 58.36 1hdu h HIS 303 Cb 0.21 -0.33 -0.03 0.00 1.55 0.00 0.00 27.41 28.80 1hdu h HIS 303 CO -0.04 0.96 0.29 1.15 -1.30 0.00 0.00 177.93 179.00 1hdu h THR 304 N 1.06 1.26 -0.31 6.26 2.02 -0.31 -2.44 112.91 120.44 1hdu h THR 304 Ca 0.22 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 1hdu h THR 304 Cb 0.37 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 1hdu h THR 304 CO 0.00 0.33 0.14 0.58 0.37 0.00 0.00 175.52 176.94 1hdu h VAL 305 N 1.10 1.17 -0.14 3.16 2.07 -1.20 -2.58 116.25 119.83 1hdu h VAL 305 Ca 0.25 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1hdu h VAL 305 Cb 0.23 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1hdu h VAL 305 CO -0.02 0.17 0.00 0.59 0.02 0.00 0.00 177.57 178.33 1hdu n ASN 306 N -4.75 1.22 0.00 0.57 3.02 -1.11 -5.13 115.26 109.07 1hdu n ASN 306 Ca -0.02 -2.07 0.00 0.00 -0.03 0.00 0.00 54.58 52.47 1hdu n ASN 306 Cb 0.12 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 1hdu n ASN 306 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23