#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 0.00 -3.64 0.00 0.63 -1.26 -5.05 116.66 107.34 1hdu n ARG 2 Ca 0.00 -0.36 -0.08 0.00 -0.92 0.00 0.00 57.85 56.49 1hdu n ARG 2 Cb 0.00 -0.21 -0.07 0.00 0.45 0.00 0.00 32.46 32.63 1hdu n ARG 2 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1hdu s SER 3 N -0.29 -0.38 0.14 6.15 0.15 -1.26 -5.01 113.70 113.19 1hdu s SER 3 Ca 0.00 0.74 0.14 0.00 0.70 0.00 0.00 55.95 57.52 1hdu s SER 3 Cb 0.00 0.74 0.65 0.00 -1.71 0.00 0.00 66.02 65.70 1hdu s SER 3 CO 0.00 -0.13 1.42 0.35 1.20 0.00 0.00 173.24 176.08 1hdu n THR 4 N 2.08 1.29 1.05 6.45 -2.24 -1.26 -0.79 114.28 120.86 1hdu n THR 4 Ca -0.12 0.46 0.12 0.00 -2.27 0.00 0.00 64.05 62.24 1hdu n THR 4 Cb 0.56 -1.39 0.28 0.00 -2.10 0.00 0.00 70.33 67.68 1hdu n THR 4 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1hdu n ASN 5 N -1.86 0.58 -0.19 3.42 3.02 -1.26 -3.70 115.26 115.27 1hdu n ASN 5 Ca 0.01 -0.35 0.06 0.00 -0.03 0.00 0.00 54.58 54.27 1hdu n ASN 5 Cb 0.09 0.21 -0.02 0.00 -0.61 0.00 0.00 39.78 39.45 1hdu n ASN 5 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1hdu n THR 6 N -1.35 0.00 -2.18 3.41 -1.04 0.03 -4.99 114.28 108.16 1hdu n THR 6 Ca 0.07 -0.33 -0.41 0.00 -2.04 0.00 0.00 64.05 61.34 1hdu n THR 6 Cb 0.34 1.10 -0.03 0.00 -1.82 0.00 0.00 70.33 69.92 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 -1.72 3.18 -0.66 -1.42 2.19 -0.97 -3.63 117.98 114.94 1hdu s PHE 7 Ca 0.08 1.32 -0.22 0.00 0.33 0.00 0.00 56.93 58.45 1hdu s PHE 7 Cb 0.10 -3.63 0.08 0.00 -1.31 0.00 0.00 43.02 38.25 1hdu s PHE 7 CO 0.36 -1.83 0.95 1.21 1.83 0.00 0.00 175.22 177.74 1hdu s ASN 8 N -0.12 6.19 0.10 6.13 3.84 -1.26 -4.87 114.94 124.95 1hdu s ASN 8 Ca 0.53 -1.07 0.25 0.00 0.21 0.00 0.00 52.86 52.77 1hdu s ASN 8 Cb -0.38 -2.41 0.96 0.00 -0.55 0.00 0.00 41.25 38.87 1hdu s ASN 8 CO 0.45 -1.40 1.77 -1.22 -2.79 0.00 0.00 177.10 173.91 1hdu n TYR 9 N 7.55 0.41 -0.81 0.43 4.01 -1.26 -3.58 117.16 123.91 1hdu n TYR 9 Ca -0.03 0.13 -0.14 0.00 -0.16 0.00 0.00 57.90 57.70 1hdu n TYR 9 Cb 0.45 -0.72 0.20 0.00 -0.31 0.00 0.00 39.34 38.97 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 -1.63 4.76 -2.61 -0.72 0.00 -1.26 -4.64 120.51 114.40 1hdu n ALA 10 Ca 0.05 -2.24 -0.09 0.00 0.00 0.00 0.00 53.44 51.16 1hdu n ALA 10 Cb 0.32 -1.31 -0.07 0.00 0.00 0.00 0.00 19.45 18.39 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 -2.71 0.13 0.12 0.00 -1.32 -1.23 -4.62 115.64 106.01 1hdu s THR 11 Ca 0.48 -1.10 -0.24 0.00 -1.21 0.00 0.00 61.69 59.62 1hdu s THR 11 Cb 0.39 -1.31 -0.07 0.00 -1.51 0.00 0.00 72.50 70.00 1hdu s THR 11 CO 0.10 -0.61 0.72 -0.31 -2.21 0.00 0.00 174.62 172.31 1hdu s TYR 12 N -3.83 3.85 0.35 9.09 2.02 -1.26 -5.02 117.35 122.55 1hdu s TYR 12 Ca 0.04 1.50 0.09 0.00 -0.37 0.00 0.00 57.07 58.33 1hdu s TYR 12 Cb 0.04 -2.70 -0.05 0.00 -0.40 0.00 0.00 41.96 38.85 1hdu s TYR 12 CO -0.11 0.50 0.06 -1.01 -1.57 0.00 0.00 175.55 173.42 1hdu s HIS 13 N -0.95 2.59 0.71 2.71 3.76 -1.26 -5.15 115.29 117.70 1hdu s HIS 13 Ca 0.34 -0.45 -0.05 0.00 -0.15 0.00 0.00 55.06 54.75 1hdu s HIS 13 Cb -0.22 -1.59 0.09 0.00 1.11 0.00 0.00 32.58 31.97 1hdu s HIS 13 CO 0.24 0.41 1.00 0.95 -0.85 0.00 0.00 174.74 176.48 1hdu s THR 14 N -2.52 2.28 0.15 1.30 -4.23 -1.26 -4.93 115.64 106.43 1hdu s THR 14 Ca 0.36 -0.39 -0.15 0.00 -1.18 0.00 0.00 61.69 60.33 1hdu s THR 14 Cb 0.00 -2.89 0.02 0.00 1.34 0.00 0.00 72.50 70.97 1hdu s THR 14 CO 0.20 0.00 1.73 0.25 -0.54 0.00 0.00 174.62 176.26 1hdu h LEU 15 N -0.57 0.59 -0.63 4.79 7.12 -1.97 -2.55 115.31 122.08 1hdu h LEU 15 Ca -0.42 -0.13 0.04 0.00 0.13 0.00 0.00 57.88 57.50 1hdu h LEU 15 Cb 1.29 -0.15 -0.05 0.00 -0.53 0.00 0.00 40.66 41.22 1hdu h LEU 15 CO 0.51 0.55 0.37 0.44 -0.13 0.00 0.00 178.44 180.18 1hdu h ASP 16 N 0.59 0.58 -0.59 1.25 3.32 -1.99 -1.00 116.42 118.59 1hdu h ASP 16 Ca 0.16 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 1hdu h ASP 16 Cb 0.12 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1hdu h ASP 16 CO -0.02 0.40 0.23 -0.33 -1.72 0.00 0.00 179.24 177.80 1hdu h GLU 17 N 0.71 0.92 -0.17 3.56 5.08 -1.90 0.65 114.58 123.44 1hdu h GLU 17 Ca 0.27 -0.16 -0.18 0.00 -1.00 0.00 0.00 59.36 58.29 1hdu h GLU 17 Cb 0.09 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.19 1hdu h GLU 17 CO -0.13 0.77 -0.59 0.82 -1.00 0.00 0.00 179.01 178.87 1hdu h ILE 18 N 0.90 1.31 -0.43 3.13 2.04 -1.09 -1.08 117.51 122.30 1hdu h ILE 18 Ca 0.21 -1.83 -0.07 0.00 1.00 0.00 0.00 64.86 64.17 1hdu h ILE 18 Cb 0.21 1.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.24 1hdu h ILE 18 CO -0.02 0.57 -0.01 1.88 0.00 0.00 0.00 178.15 180.58 1hdu h TYR 19 N 0.39 0.74 -0.50 1.37 -1.99 -0.96 -1.59 116.97 114.42 1hdu h TYR 19 Ca -0.03 -0.10 -0.09 0.00 2.00 0.00 0.00 58.73 60.52 1hdu h TYR 19 Cb 1.22 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 39.72 1hdu h TYR 19 CO 0.09 0.71 -0.04 -0.44 -0.00 0.00 0.00 178.16 178.48 1hdu h ASP 20 N 0.66 0.90 -0.52 3.88 3.32 -0.80 -2.86 116.42 121.00 1hdu h ASP 20 Ca 0.13 -0.33 0.07 0.00 0.02 0.00 0.00 57.03 56.92 1hdu h ASP 20 Cb 0.43 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.68 1hdu h ASP 20 CO 0.02 1.01 0.20 0.15 -1.72 0.00 0.00 179.24 178.90 1hdu h PHE 21 N 0.77 0.35 -0.98 4.55 3.57 -0.67 -1.46 116.94 123.07 1hdu h PHE 21 Ca 0.14 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.77 1hdu h PHE 21 Cb 0.57 -0.08 -0.08 0.00 2.79 0.00 0.00 35.95 39.15 1hdu h PHE 21 CO 0.04 0.12 0.61 0.52 -2.23 0.00 0.00 178.31 177.38 1hdu h MET 22 N 0.39 0.96 -0.44 1.11 2.86 -1.08 -0.56 114.93 118.17 1hdu h MET 22 Ca 0.25 -0.06 -0.14 0.00 -2.06 0.00 0.00 59.70 57.69 1hdu h MET 22 Cb 0.25 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 1hdu h MET 22 CO -0.24 0.63 -0.29 -0.44 1.06 0.00 0.00 176.91 177.64 1hdu h ASP 23 N 0.99 0.99 -0.43 1.22 3.32 -1.15 -2.35 116.42 119.01 1hdu h ASP 23 Ca 0.48 -0.41 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 1hdu h ASP 23 Cb 0.45 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1hdu h ASP 23 CO -0.26 1.20 0.15 -0.07 -1.72 0.00 0.00 179.24 178.55 1hdu h LEU 24 N 0.81 0.61 -0.36 1.55 3.38 -0.61 -1.74 115.31 118.95 1hdu h LEU 24 Ca 0.09 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.88 1hdu h LEU 24 Cb 0.87 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1hdu h LEU 24 CO 0.08 0.63 0.22 0.25 0.09 0.00 0.00 178.44 179.71 1hdu h LEU 25 N 0.55 0.36 -0.86 1.67 5.85 -1.07 -1.41 115.31 120.40 1hdu h LEU 25 Ca 0.14 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1hdu h LEU 25 Cb 0.23 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1hdu h LEU 25 CO -0.01 0.26 0.52 0.58 -0.34 0.00 0.00 178.44 179.45 1hdu h VAL 26 N 0.44 1.24 -0.01 1.05 2.07 -1.28 -0.53 116.25 119.23 1hdu h VAL 26 Ca 0.14 -0.52 -0.09 0.00 0.82 0.00 0.00 66.70 67.05 1hdu h VAL 26 Cb -0.02 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.77 1hdu h VAL 26 CO -0.05 0.25 -0.42 0.00 0.02 0.00 0.00 177.57 177.37 1hdu h ALA 27 N 1.28 1.28 0.00 1.67 0.00 -0.98 -2.48 119.26 120.02 1hdu h ALA 27 Ca 0.31 -0.39 -0.18 0.00 0.00 0.00 0.00 54.91 54.65 1hdu h ALA 27 Cb -0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1hdu h ALA 27 CO -0.06 0.54 -1.06 1.96 0.00 0.00 0.00 179.25 180.63 1hdu h GLN 28 N 0.03 0.00 -1.87 0.00 4.20 -0.75 -3.39 115.11 113.33 1hdu h GLN 28 Ca -0.00 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.20 1hdu h GLN 28 Cb 0.75 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 28.12 1hdu h GLN 28 CO 0.06 0.57 -0.96 0.72 -0.67 0.00 0.00 178.83 178.55 1hdu n HIS 29 N -3.14 2.00 -0.33 2.96 8.25 -0.25 -4.95 115.22 119.76 1hdu n HIS 29 Ca -0.04 -3.62 0.14 0.00 -0.26 0.00 0.00 57.72 53.94 1hdu n HIS 29 Cb 0.87 -0.39 0.37 0.00 1.12 0.00 0.00 29.99 31.95 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 2.94 0.66 0.00 -0.41 0.11 -1.65 -1.29 132.00 132.37 1hdu h PRO 30 Ca 0.10 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1hdu h PRO 30 Cb 0.85 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1hdu h PRO 30 CO 0.65 0.44 0.00 0.39 -0.21 0.00 0.00 178.00 179.27 1hdu n GLU 31 N -4.68 0.09 0.00 1.05 -0.58 -1.26 -4.12 120.64 111.13 1hdu n GLU 31 Ca 0.22 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 57.05 1hdu n GLU 31 Cb 0.60 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.97 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 -1.44 1.38 -4.19 -4.62 7.94 -0.63 -4.76 117.00 110.68 1hdu n LEU 32 Ca 0.07 0.00 -0.23 0.00 -1.11 0.00 0.00 56.01 54.74 1hdu n LEU 32 Cb 0.25 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 44.06 1hdu n LEU 32 CO 0.21 0.23 -0.50 0.54 -1.11 0.00 0.00 177.39 176.76 1hdu s VAL 33 N -1.99 1.38 0.07 1.96 0.11 -0.58 -1.06 120.40 120.30 1hdu s VAL 33 Ca 0.00 -0.99 0.02 0.00 -2.93 0.00 0.00 61.98 58.08 1hdu s VAL 33 Cb 0.00 -1.20 -0.03 0.00 -1.53 0.00 0.00 36.38 33.61 1hdu s VAL 33 CO 0.00 0.19 -0.07 -0.94 -3.33 0.00 0.00 175.10 170.96 1hdu s SER 34 N -0.92 0.98 -0.21 3.54 1.04 -0.76 -4.54 113.70 112.82 1hdu s SER 34 Ca 0.05 -0.81 -0.06 0.00 0.48 0.00 0.00 55.95 55.61 1hdu s SER 34 Cb -0.08 0.08 -0.02 0.00 0.10 0.00 0.00 66.02 66.10 1hdu s SER 34 CO 0.01 -0.37 0.01 -0.75 0.98 0.00 0.00 173.24 173.13 1hdu s LYS 35 N -2.89 3.61 -0.07 4.02 2.20 -1.26 -1.30 119.74 124.04 1hdu s LYS 35 Ca 0.02 -0.52 0.01 0.00 -0.36 0.00 0.00 55.97 55.13 1hdu s LYS 35 Cb -0.01 -3.13 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 1hdu s LYS 35 CO -0.03 -0.05 -0.10 -0.51 -0.36 0.00 0.00 175.35 174.30 1hdu s LEU 36 N 1.19 2.98 -0.28 5.43 1.43 -0.08 -4.97 118.68 124.39 1hdu s LEU 36 Ca 0.03 -0.12 -0.10 0.00 -1.03 0.00 0.00 54.13 52.92 1hdu s LEU 36 Cb -0.14 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1hdu s LEU 36 CO 0.02 0.33 0.16 -1.58 0.23 0.00 0.00 176.35 175.50 1hdu s GLN 37 N -0.60 3.77 0.00 1.70 0.74 -1.26 -0.57 119.66 123.45 1hdu s GLN 37 Ca 0.09 -0.43 0.21 0.00 0.05 0.00 0.00 55.36 55.28 1hdu s GLN 37 Cb -0.12 -3.58 0.27 0.00 1.10 0.00 0.00 33.01 30.68 1hdu s GLN 37 CO 0.02 -0.23 1.25 0.44 -0.55 0.00 0.00 175.29 176.22 1hdu n ILE 38 N 5.02 0.23 -3.90 -2.34 -5.35 -0.71 -5.01 119.36 107.30 1hdu n ILE 38 Ca -0.14 -0.62 0.00 0.00 -0.27 0.00 0.00 62.75 61.72 1hdu n ILE 38 Cb 0.51 1.23 0.00 0.00 -1.74 0.00 0.00 39.64 39.64 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 1.27 -1.20 3.05 3.28 0.00 -1.25 -4.79 105.19 105.54 1hdu n GLY 39 Ca 0.15 -1.16 -0.15 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.80 0.58 1.02 1.61 0.52 -1.26 -1.30 118.95 118.32 1hdu s ARG 40 Ca 0.00 -0.58 -0.15 0.00 -0.52 0.00 0.00 55.73 54.49 1hdu s ARG 40 Cb 0.00 -0.47 0.20 0.00 0.52 0.00 0.00 34.95 35.20 1hdu s ARG 40 CO 0.00 0.11 1.15 -1.54 0.02 0.00 0.00 175.30 175.03 1hdu s SER 41 N -1.02 2.54 0.28 0.23 1.04 0.11 -4.71 113.70 112.16 1hdu s SER 41 Ca -0.04 0.81 0.01 0.00 0.48 0.00 0.00 55.95 57.22 1hdu s SER 41 Cb -0.07 -1.24 0.56 0.00 0.10 0.00 0.00 66.02 65.37 1hdu s SER 41 CO 0.00 -3.14 1.81 0.22 0.98 0.00 0.00 173.24 173.11 1hdu h TYR 42 N -1.91 1.03 -0.30 5.02 3.20 -1.96 0.57 116.97 122.62 1hdu h TYR 42 Ca -0.49 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.40 1hdu h TYR 42 Cb 1.31 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 39.26 1hdu h TYR 42 CO -0.58 0.35 0.02 0.39 -1.64 0.00 0.00 178.16 176.70 1hdu n GLU 43 N -4.71 2.89 -0.99 1.82 1.02 -1.26 -4.90 120.64 114.51 1hdu n GLU 43 Ca 0.19 -1.58 0.00 0.00 -0.02 0.00 0.00 57.16 55.75 1hdu n GLU 43 Cb 0.40 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 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 0.28 0.75 3.76 0.62 0.00 0.19 -5.03 105.19 105.76 1hdu n GLY 44 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.05 4.64 0.45 1.61 0.52 -1.26 -4.64 118.95 120.22 1hdu s ARG 45 Ca 0.00 1.68 -0.24 0.00 -0.52 0.00 0.00 55.73 56.65 1hdu s ARG 45 Cb 0.00 -3.12 -0.07 0.00 0.52 0.00 0.00 34.95 32.28 1hdu s ARG 45 CO 0.00 0.25 1.23 -1.25 0.02 0.00 0.00 175.30 175.55 1hdu s PRO 46 N -1.53 3.74 -0.30 3.54 0.04 -1.26 0.07 135.00 139.30 1hdu s PRO 46 Ca 0.45 1.96 -0.08 0.00 0.04 0.00 0.00 61.00 63.38 1hdu s PRO 46 Cb -0.29 -2.50 0.00 0.00 0.04 0.00 0.00 34.50 31.75 1hdu s PRO 46 CO 0.37 -0.62 0.10 0.42 0.04 0.00 0.00 177.00 177.30 1hdu s ILE 47 N -1.41 4.15 0.04 0.56 1.01 -0.42 -4.80 121.20 120.33 1hdu s ILE 47 Ca 0.62 -0.58 0.03 0.00 0.00 0.00 0.00 60.65 60.72 1hdu s ILE 47 Cb -0.33 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 1hdu s ILE 47 CO 0.41 0.10 0.00 -0.31 0.00 0.00 0.00 174.94 175.14 1hdu s TYR 48 N 1.54 3.05 -0.03 3.97 2.02 -1.26 -1.74 117.35 124.89 1hdu s TYR 48 Ca 0.03 0.04 0.03 0.00 -0.37 0.00 0.00 57.07 56.81 1hdu s TYR 48 Cb -0.17 -1.62 -0.00 0.00 -0.40 0.00 0.00 41.96 39.77 1hdu s TYR 48 CO 0.03 0.47 -0.13 0.08 -1.57 0.00 0.00 175.55 174.43 1hdu s VAL 49 N -1.19 1.09 -0.16 0.71 1.01 0.27 -4.45 120.40 117.68 1hdu s VAL 49 Ca 0.23 -0.53 -0.14 0.00 0.00 0.00 0.00 61.98 61.53 1hdu s VAL 49 Cb -0.12 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 35.27 1hdu s VAL 49 CO 0.14 0.33 0.31 -0.76 0.00 0.00 0.00 175.10 175.12 1hdu s LEU 50 N 0.11 4.24 -0.25 3.92 1.43 0.24 -0.90 118.68 127.46 1hdu s LEU 50 Ca -0.03 0.52 -0.05 0.00 -1.03 0.00 0.00 54.13 53.54 1hdu s LEU 50 Cb -0.10 -2.40 -0.00 0.00 0.03 0.00 0.00 46.19 43.72 1hdu s LEU 50 CO 0.01 0.08 0.00 -0.75 0.23 0.00 0.00 176.35 175.93 1hdu s LYS 51 N 0.55 3.31 -0.25 1.70 2.20 -0.42 -0.73 119.74 126.10 1hdu s LYS 51 Ca 0.17 -0.69 -0.09 0.00 -0.36 0.00 0.00 55.97 55.01 1hdu s LYS 51 Cb -0.13 -3.15 -0.04 0.00 -1.51 0.00 0.00 37.83 33.00 1hdu s LYS 51 CO 0.04 -0.27 0.11 -0.06 -0.36 0.00 0.00 175.35 174.81 1hdu s PHE 52 N 1.49 3.16 -0.02 4.03 0.40 -0.17 -1.83 117.98 125.04 1hdu s PHE 52 Ca 0.05 -0.14 -0.19 0.00 -0.60 0.00 0.00 56.93 56.05 1hdu s PHE 52 Cb -0.15 -2.26 0.04 0.00 0.51 0.00 0.00 43.02 41.15 1hdu s PHE 52 CO -0.01 -0.20 0.41 0.45 0.70 0.00 0.00 175.22 176.58 1hdu s SER 53 N 1.45 -0.32 -0.07 1.36 0.15 -0.22 -1.65 113.70 114.40 1hdu s SER 53 Ca 0.06 0.25 0.13 0.00 0.70 0.00 0.00 55.95 57.09 1hdu s SER 53 Cb -0.15 0.37 0.38 0.00 -1.71 0.00 0.00 66.02 64.91 1hdu s SER 53 CO 0.06 -0.50 1.30 1.07 1.20 0.00 0.00 173.24 176.37 1hdu n THR 54 N 1.16 1.51 0.00 6.45 5.66 -1.26 -4.40 114.28 123.40 1hdu n THR 54 Ca -0.21 -1.36 0.00 0.00 -3.05 0.00 0.00 64.05 59.43 1hdu n THR 54 Cb 0.56 0.20 0.00 0.00 -1.55 0.00 0.00 70.33 69.54 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 0.03 0.51 0.00 1.09 0.00 -1.26 -5.07 105.19 100.49 1hdu n GLY 55 Ca 0.15 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 44.09 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 -0.74 0.00 -0.02 0.00 -1.26 -4.85 105.19 98.32 1hdu n GLY 56 Ca 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.84 0.00 -3.10 1.61 7.64 -1.26 -4.86 113.62 112.81 1hdu n SER 57 Ca 0.00 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.57 1hdu n SER 57 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 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 0.00 5.39 -4.70 6.43 5.03 -1.26 -5.07 115.26 121.08 1hdu n ASN 58 Ca 0.00 -3.70 -0.36 0.00 0.87 0.00 0.00 54.58 51.39 1hdu n ASN 58 Cb 0.00 -0.74 0.08 0.00 -1.02 0.00 0.00 39.78 38.11 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 0.84 -1.79 3.52 1.74 -1.26 -4.93 116.66 114.56 1hdu n ARG 59 Ca 0.37 0.35 -0.38 0.00 -0.77 0.00 0.00 57.85 57.42 1hdu n ARG 59 Cb 0.37 -2.46 0.05 0.00 -1.02 0.00 0.00 32.46 29.40 1hdu n ARG 59 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1hdu s PRO 60 N -3.49 2.92 0.27 5.56 0.04 -1.26 -4.66 135.00 134.37 1hdu s PRO 60 Ca 0.80 2.14 0.05 0.00 0.04 0.00 0.00 61.00 64.03 1hdu s PRO 60 Cb -0.36 -2.08 -0.06 0.00 0.04 0.00 0.00 34.50 32.04 1hdu s PRO 60 CO 0.44 -1.34 -0.03 0.00 0.04 0.00 0.00 177.00 176.11 1hdu s ALA 61 N -1.36 2.18 -0.11 8.56 0.00 0.10 -2.12 121.76 129.01 1hdu s ALA 61 Ca 0.76 -1.88 0.03 0.00 0.00 0.00 0.00 51.96 50.87 1hdu s ALA 61 Cb -0.39 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.08 1hdu s ALA 61 CO 0.44 -0.16 -0.22 0.42 0.00 0.00 0.00 175.76 176.24 1hdu s ILE 62 N -3.18 1.98 -0.12 0.00 -1.09 -0.25 -0.36 121.20 118.18 1hdu s ILE 62 Ca 0.30 -0.96 -0.04 0.00 -2.23 0.00 0.00 60.65 57.72 1hdu s ILE 62 Cb 0.05 -1.73 -0.04 0.00 -1.58 0.00 0.00 42.46 39.17 1hdu s ILE 62 CO 0.11 0.54 0.04 0.86 -1.23 0.00 0.00 174.94 175.26 1hdu s TRP 63 N 0.55 3.25 -0.04 3.97 -0.11 -0.28 -0.59 118.94 125.69 1hdu s TRP 63 Ca -0.14 0.19 -0.02 0.00 1.22 0.00 0.00 56.10 57.36 1hdu s TRP 63 Cb -0.17 -1.89 0.03 0.00 -1.50 0.00 0.00 33.47 29.94 1hdu s TRP 63 CO 0.05 0.42 0.05 0.42 -4.62 0.00 0.00 176.95 173.26 1hdu s ILE 64 N -0.55 -0.06 0.10 5.86 1.01 -0.17 -0.41 121.20 126.99 1hdu s ILE 64 Ca 0.10 0.37 0.09 0.00 0.00 0.00 0.00 60.65 61.22 1hdu s ILE 64 Cb -0.12 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 1hdu s ILE 64 CO 0.02 0.18 -0.23 1.51 0.00 0.00 0.00 174.94 176.42 1hdu s ASP 65 N 2.01 2.80 0.05 3.58 1.47 -0.30 -0.93 116.67 125.34 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 -0.17 -0.04 0.00 -0.34 0.00 0.00 42.92 42.25 1hdu s ASP 65 CO -0.03 0.11 -0.04 -0.76 0.68 0.00 0.00 175.17 175.13 1hdu s LEU 66 N -1.88 2.42 -1.14 2.11 1.02 -0.19 -1.27 118.68 119.75 1hdu s LEU 66 Ca 0.09 -0.86 0.00 0.00 0.02 0.00 0.00 54.13 53.38 1hdu s LEU 66 Cb -0.10 0.08 0.00 0.00 0.02 0.00 0.00 46.19 46.19 1hdu s LEU 66 CO 0.05 -0.47 0.00 0.61 0.02 0.00 0.00 176.35 176.55 1hdu n GLY 67 N 0.50 0.04 0.23 -3.19 0.00 -1.25 -2.19 105.19 99.33 1hdu n GLY 67 Ca -0.16 -0.36 0.07 0.00 0.00 0.00 0.00 46.02 45.58 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 0.93 -3.55 -0.61 2.10 -1.90 -3.10 117.51 111.38 1hdu h ILE 68 Ca -0.30 -0.82 -0.71 0.00 1.08 0.00 0.00 64.86 64.11 1hdu h ILE 68 Cb 1.17 1.47 -0.29 0.00 -1.09 0.00 0.00 36.82 38.09 1hdu h ILE 68 CO 0.37 0.22 -0.53 -1.00 -1.08 0.00 0.00 178.15 176.12 1hdu s HIS 69 N -4.28 3.32 0.32 2.19 3.76 -1.26 -4.58 115.29 114.76 1hdu s HIS 69 Ca -0.03 -1.53 0.10 0.00 -0.15 0.00 0.00 55.06 53.45 1hdu s HIS 69 Cb 0.14 -2.69 0.91 0.00 1.11 0.00 0.00 32.58 32.05 1hdu s HIS 69 CO 0.66 -0.80 1.70 0.66 -0.85 0.00 0.00 174.74 176.11 1hdu h SER 70 N 8.31 0.53 0.61 1.40 4.64 -1.66 -2.42 113.55 124.96 1hdu h SER 70 Ca -0.22 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1hdu h SER 70 Cb 1.08 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1hdu h SER 70 CO 0.69 -0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.53 1hdu n ARG 71 N -4.98 0.04 -1.98 4.77 1.85 -0.57 -4.08 116.66 111.70 1hdu n ARG 71 Ca 0.27 0.25 -0.41 0.00 -1.00 0.00 0.00 57.85 56.96 1hdu n ARG 71 Cb 0.80 -1.57 -0.00 0.00 -1.05 0.00 0.00 32.46 30.64 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 -1.63 3.76 -0.15 2.89 1.02 -0.91 -4.78 120.64 120.83 1hdu n GLU 72 Ca 0.04 -3.14 0.25 0.00 -0.02 0.00 0.00 57.16 54.29 1hdu n GLU 72 Cb 0.20 -2.89 0.68 0.00 -0.02 0.00 0.00 31.44 29.41 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 5.37 0.09 0.00 -0.32 4.06 -1.80 -1.53 115.95 121.81 1hdu h TRP 73 Ca 0.58 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.53 1hdu h TRP 73 Cb 0.49 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 28.62 1hdu h TRP 73 CO 1.48 0.02 -0.05 0.97 -3.56 0.00 0.00 178.44 177.31 1hdu h ILE 74 N 0.07 0.44 -0.02 1.49 6.09 -1.86 -2.57 117.51 121.15 1hdu h ILE 74 Ca 0.40 -0.23 -0.03 0.00 -1.37 0.00 0.00 64.86 63.64 1hdu h ILE 74 Cb 1.48 1.15 0.00 0.00 0.47 0.00 0.00 36.82 39.92 1hdu h ILE 74 CO -0.03 0.05 -0.09 0.71 -3.07 0.00 0.00 178.15 175.72 1hdu h THR 75 N 0.00 1.49 -0.87 2.19 1.35 -1.62 -1.30 112.91 114.16 1hdu h THR 75 Ca -0.00 -1.58 -0.01 0.00 -0.55 0.00 0.00 66.41 64.26 1hdu h THR 75 Cb 0.15 2.49 -0.04 0.00 -1.73 0.00 0.00 68.15 69.02 1hdu h THR 75 CO 0.01 0.42 0.48 1.56 -0.25 0.00 0.00 175.52 177.74 1hdu h GLN 76 N -0.51 1.20 -0.78 4.72 7.50 -1.65 0.18 115.11 125.78 1hdu h GLN 76 Ca -0.00 -0.13 -0.04 0.00 0.50 0.00 0.00 58.65 58.97 1hdu h GLN 76 Cb 0.74 -0.24 -0.03 0.00 0.05 0.00 0.00 27.48 27.99 1hdu h GLN 76 CO 0.02 0.87 0.31 0.00 -1.50 0.00 0.00 178.83 178.53 1hdu h ALA 77 N 1.32 1.08 -0.20 3.87 0.00 -1.48 -1.16 119.26 122.69 1hdu h ALA 77 Ca 0.31 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 1hdu h ALA 77 Cb 0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1hdu h ALA 77 CO -0.05 0.65 -0.46 1.15 0.00 0.00 0.00 179.25 180.54 1hdu h THR 78 N 1.13 1.31 -0.30 0.00 2.02 -0.60 -2.62 112.91 113.85 1hdu h THR 78 Ca 0.26 -1.66 -0.00 0.00 0.77 0.00 0.00 66.41 65.77 1hdu h THR 78 Cb 0.21 1.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.26 1hdu h THR 78 CO -0.02 0.52 0.17 1.23 0.37 0.00 0.00 175.52 177.79 1hdu h GLY 79 N 1.09 0.45 0.94 2.16 0.00 0.06 0.21 103.07 107.98 1hdu h GLY 79 Ca 0.03 -0.20 0.02 0.00 0.00 0.00 0.00 47.33 47.18 1hdu h GLY 79 CO 0.09 0.19 0.47 -2.08 0.00 0.00 0.00 176.54 175.21 1hdu h VAL 80 N 0.37 1.14 -0.55 4.60 2.07 -1.18 -1.73 116.25 120.97 1hdu h VAL 80 Ca 0.11 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1hdu h VAL 80 Cb 0.05 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 1hdu h VAL 80 CO -0.02 0.17 0.20 -0.25 0.02 0.00 0.00 177.57 177.69 1hdu h TRP 81 N 0.93 0.87 -0.20 1.57 7.01 -1.07 -2.77 115.95 122.29 1hdu h TRP 81 Ca 0.28 -0.08 0.03 0.00 2.11 0.00 0.00 58.89 61.23 1hdu h TRP 81 Cb -0.05 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 26.73 1hdu h TRP 81 CO -0.03 0.72 0.03 0.74 -2.79 0.00 0.00 178.44 177.11 1hdu h PHE 82 N 0.76 0.05 -0.61 2.65 -1.00 -0.56 -0.52 116.94 117.71 1hdu h PHE 82 Ca 0.18 0.01 0.10 0.00 2.81 0.00 0.00 57.97 61.08 1hdu h PHE 82 Cb 0.24 0.01 -0.08 0.00 3.61 0.00 0.00 35.95 39.73 1hdu h PHE 82 CO 0.01 0.01 0.21 0.00 -1.61 0.00 0.00 178.31 176.93 1hdu h ALA 83 N 1.16 0.79 -0.28 2.45 0.00 -1.17 -0.54 119.26 121.66 1hdu h ALA 83 Ca 0.09 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1hdu h ALA 83 Cb 0.10 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1hdu h ALA 83 CO -0.13 -0.22 0.01 -0.22 0.00 0.00 0.00 179.25 178.69 1hdu h LYS 84 N 0.38 0.49 -0.56 0.00 1.63 -1.19 -3.09 116.57 114.23 1hdu h LYS 84 Ca 0.32 -0.15 0.00 0.00 -0.85 0.00 0.00 60.65 59.97 1hdu h LYS 84 Cb 0.41 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.97 1hdu h LYS 84 CO -0.33 0.64 0.37 -0.22 -3.45 0.00 0.00 179.45 176.45 1hdu h LYS 85 N 0.29 0.74 -0.58 1.90 3.64 -0.29 -2.20 116.57 120.07 1hdu h LYS 85 Ca 0.08 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1hdu h LYS 85 Cb 0.41 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.01 1hdu h LYS 85 CO 0.01 0.49 0.32 0.74 -2.27 0.00 0.00 179.45 178.74 1hdu h PHE 86 N 0.76 0.58 0.00 1.91 0.04 -1.04 0.70 116.94 119.89 1hdu h PHE 86 Ca 0.20 0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.00 1hdu h PHE 86 Cb -0.08 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 37.89 1hdu h PHE 86 CO 0.00 0.29 0.00 1.79 -0.60 0.00 0.00 178.31 179.79 1hdu h THR 87 N 0.61 0.00 0.11 -1.55 1.35 -1.42 -2.39 112.91 109.62 1hdu h THR 87 Ca 0.25 -0.48 -0.31 0.00 -0.55 0.00 0.00 66.41 65.32 1hdu h THR 87 Cb 0.13 1.39 -0.01 0.00 -1.73 0.00 0.00 68.15 67.93 1hdu h THR 87 CO -0.16 0.00 -1.64 -0.33 -0.25 0.00 0.00 175.52 173.14 1hdu h GLU 88 N 0.00 0.24 0.00 4.72 5.08 -0.77 -3.39 114.58 120.45 1hdu h GLU 88 Ca 0.00 -0.41 -0.05 0.00 -1.00 0.00 0.00 59.36 57.90 1hdu h GLU 88 Cb 0.60 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1hdu h GLU 88 CO 0.00 1.20 -0.33 -0.91 -1.00 0.00 0.00 179.01 177.97 1hdu h ASN 89 N -0.22 0.00 -2.82 1.42 4.21 -0.91 -3.42 115.58 113.84 1hdu h ASN 89 Ca -0.36 0.00 -0.53 0.00 1.21 0.00 0.00 56.30 56.63 1hdu h ASN 89 Cb 1.84 0.00 0.04 0.00 -1.12 0.00 0.00 38.32 39.08 1hdu h ASN 89 CO 0.05 0.23 0.88 -0.47 -1.29 0.00 0.00 177.43 176.83 1hdu s TYR 90 N -3.10 3.01 0.00 1.19 5.04 -0.90 -0.27 117.35 122.31 1hdu s TYR 90 Ca 0.05 0.61 0.00 0.00 -2.44 0.00 0.00 57.07 55.29 1hdu s TYR 90 Cb 0.06 -3.92 0.00 0.00 0.35 0.00 0.00 41.96 38.46 1hdu s TYR 90 CO 0.71 -3.41 0.00 0.41 -1.34 0.00 0.00 175.55 171.92 1hdu n GLY 91 N 3.77 3.08 0.25 8.97 0.00 -1.26 -4.78 105.19 115.22 1hdu n GLY 91 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 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 0.50 -3.01 1.61 1.13 -0.27 -4.92 117.38 110.43 1hdu n GLN 92 Ca 0.00 0.21 -0.41 0.00 -1.94 0.00 0.00 57.00 54.86 1hdu n GLN 92 Cb 0.00 -1.34 -0.05 0.00 0.11 0.00 0.00 30.24 28.96 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 -6.84 6.70 0.18 1.08 3.84 0.62 -4.97 114.94 115.55 1hdu s ASN 93 Ca -0.31 0.86 -0.14 0.00 0.21 0.00 0.00 52.86 53.48 1hdu s ASN 93 Cb 0.10 -2.38 0.17 0.00 -0.55 0.00 0.00 41.25 38.60 1hdu s ASN 93 CO 0.41 -0.44 1.69 -0.65 -2.79 0.00 0.00 177.10 175.32 1hdu h PRO 94 N 7.80 0.13 0.35 0.43 0.11 -1.91 -0.08 132.00 138.82 1hdu h PRO 94 Ca -0.25 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.84 1hdu h PRO 94 Cb 1.11 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1hdu h PRO 94 CO 0.82 0.09 -0.17 0.77 -0.21 0.00 0.00 178.00 179.30 1hdu h SER 95 N 0.14 -0.39 -0.75 -2.05 0.02 -1.96 -1.76 113.55 106.78 1hdu h SER 95 Ca 0.24 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 1hdu h SER 95 Cb 0.35 0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.96 1hdu h SER 95 CO -0.38 -0.15 0.35 0.15 -1.14 0.00 0.00 176.83 175.66 1hdu h PHE 96 N -0.63 1.11 -0.64 3.45 3.57 -1.88 -2.31 116.94 119.61 1hdu h PHE 96 Ca -0.05 -0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.42 1hdu h PHE 96 Cb 0.45 -0.34 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 1hdu h PHE 96 CO -0.01 0.82 0.40 1.15 -2.23 0.00 0.00 178.31 178.43 1hdu h THR 97 N 1.10 1.09 -0.84 4.41 2.02 -0.95 -1.56 112.91 118.17 1hdu h THR 97 Ca 0.26 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 67.19 1hdu h THR 97 Cb 0.14 0.23 -0.04 0.00 -1.74 0.00 0.00 68.15 66.74 1hdu h THR 97 CO -0.03 0.14 0.55 0.00 0.37 0.00 0.00 175.52 176.56 1hdu h ALA 98 N 1.28 1.42 -0.12 6.16 0.00 -0.82 -1.98 119.26 125.19 1hdu h ALA 98 Ca 0.26 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1hdu h ALA 98 Cb 0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 1hdu h ALA 98 CO -0.10 0.53 0.02 0.82 0.00 0.00 0.00 179.25 180.52 1hdu h ILE 99 N 1.12 1.22 0.00 0.00 2.04 -0.79 -3.05 117.51 118.05 1hdu h ILE 99 Ca 0.31 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1hdu h ILE 99 Cb -0.10 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1hdu h ILE 99 CO -0.07 0.21 0.00 -0.07 0.00 0.00 0.00 178.15 178.21 1hdu h LEU 100 N -0.04 0.00 0.00 1.44 3.38 -1.12 0.11 115.31 119.08 1hdu h LEU 100 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1hdu h LEU 100 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1hdu h LEU 100 CO 0.00 0.00 -0.06 0.47 0.09 0.00 0.00 178.44 178.94 1hdu n ASP 101 N -2.86 0.66 -0.01 -0.43 8.00 -0.77 -4.01 116.55 117.14 1hdu n ASP 101 Ca 0.02 0.51 -0.00 0.00 0.71 0.00 0.00 54.79 56.02 1hdu n ASP 101 Cb 0.32 -0.65 -0.03 0.00 -0.02 0.00 0.00 41.12 40.74 1hdu n ASP 101 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1hdu n SER 102 N -2.11 4.13 -4.13 -2.24 7.64 -0.98 -5.02 113.62 110.91 1hdu n SER 102 Ca 0.06 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.85 1hdu n SER 102 Cb 0.41 0.79 -0.10 0.00 -1.01 0.00 0.00 64.21 64.30 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 -2.15 0.77 0.12 1.43 -1.94 0.34 -4.39 119.30 113.48 1hdu s MET 103 Ca -0.02 -1.32 0.02 0.00 -1.71 0.00 0.00 55.69 52.67 1hdu s MET 103 Cb 0.02 0.08 -0.04 0.00 2.01 0.00 0.00 34.83 36.90 1hdu s MET 103 CO 0.15 -0.12 0.24 -0.51 -0.01 0.00 0.00 175.02 174.77 1hdu s ASP 104 N -3.00 6.23 -0.11 3.03 1.01 -0.90 -4.23 116.67 118.71 1hdu s ASP 104 Ca 0.13 0.16 0.03 0.00 0.71 0.00 0.00 52.55 53.58 1hdu s ASP 104 Cb 0.07 -1.86 0.01 0.00 1.01 0.00 0.00 42.92 42.15 1hdu s ASP 104 CO -0.05 0.09 -0.20 -0.63 0.21 0.00 0.00 175.17 174.59 1hdu s ILE 105 N -1.67 1.82 -0.18 0.77 1.01 -0.66 -1.09 121.20 121.21 1hdu s ILE 105 Ca 0.34 -0.86 -0.04 0.00 0.00 0.00 0.00 60.65 60.10 1hdu s ILE 105 Cb -0.12 -1.61 -0.02 0.00 0.01 0.00 0.00 42.46 40.72 1hdu s ILE 105 CO 0.28 0.51 -0.04 -0.36 0.00 0.00 0.00 174.94 175.33 1hdu s PHE 106 N 0.68 2.99 -0.17 3.97 0.40 0.24 -1.00 117.98 125.09 1hdu s PHE 106 Ca -0.12 -0.49 0.01 0.00 -0.60 0.00 0.00 56.93 55.73 1hdu s PHE 106 Cb -0.16 -2.01 0.03 0.00 0.51 0.00 0.00 43.02 41.39 1hdu s PHE 106 CO 0.03 -0.20 -0.12 -1.17 0.70 0.00 0.00 175.22 174.45 1hdu s LEU 107 N 0.75 1.96 -0.43 -0.37 2.96 0.09 -1.00 118.68 122.65 1hdu s LEU 107 Ca -0.01 -0.67 -0.09 0.00 -0.22 0.00 0.00 54.13 53.13 1hdu s LEU 107 Cb -0.14 -1.21 0.09 0.00 0.50 0.00 0.00 46.19 45.43 1hdu s LEU 107 CO 0.02 -0.10 0.27 -0.70 -1.32 0.00 0.00 176.35 174.53 1hdu s GLU 108 N 1.44 2.54 0.09 1.98 2.12 -0.11 -0.59 118.70 126.17 1hdu s GLU 108 Ca 0.02 -1.55 -0.14 0.00 0.36 0.00 0.00 54.97 53.66 1hdu s GLU 108 Cb -0.14 -3.80 -0.14 0.00 0.26 0.00 0.00 34.13 30.31 1hdu s GLU 108 CO -0.10 -1.01 1.32 0.82 -0.54 0.00 0.00 175.26 175.75 1hdu h ILE 109 N 6.11 1.31 -3.31 -3.70 2.04 -1.82 -0.47 117.51 117.66 1hdu h ILE 109 Ca -0.22 -1.80 -0.63 0.00 1.00 0.00 0.00 64.86 63.21 1hdu h ILE 109 Cb 1.08 1.91 -0.41 0.00 -0.74 0.00 0.00 36.82 38.66 1hdu h ILE 109 CO 0.78 0.57 -0.67 -0.69 0.00 0.00 0.00 178.15 178.13 1hdu s VAL 110 N -3.90 2.20 -0.11 1.67 1.01 -1.26 -4.18 120.40 115.83 1hdu s VAL 110 Ca -0.11 -2.96 0.21 0.00 0.00 0.00 0.00 61.98 59.11 1hdu s VAL 110 Cb 0.08 -2.54 0.21 0.00 0.00 0.00 0.00 36.38 34.12 1hdu s VAL 110 CO 0.87 -0.80 1.64 0.74 0.00 0.00 0.00 175.10 177.55 1hdu h THR 111 N 5.59 0.50 -2.52 3.92 2.02 -1.56 -3.37 112.91 117.49 1hdu h THR 111 Ca -0.06 -1.47 -0.60 0.00 0.77 0.00 0.00 66.41 65.06 1hdu h THR 111 Cb 0.92 2.05 -0.40 0.00 -1.74 0.00 0.00 68.15 68.98 1hdu h THR 111 CO 0.61 0.26 -0.81 -3.20 0.37 0.00 0.00 175.52 172.75 1hdu n ASN 112 N -3.24 1.43 0.08 4.18 4.05 -1.17 -4.89 115.26 115.70 1hdu n ASN 112 Ca 0.02 -2.87 0.01 0.00 0.45 0.00 0.00 54.58 52.19 1hdu n ASN 112 Cb 0.56 -0.65 0.33 0.00 1.23 0.00 0.00 39.78 41.25 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 5.07 0.31 -0.52 1.20 0.13 -1.89 -2.15 132.00 134.16 1hdu h PRO 113 Ca 0.19 -0.08 -0.12 0.00 -0.87 0.00 0.00 66.00 65.12 1hdu h PRO 113 Cb 0.81 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.89 1hdu h PRO 113 CO 0.57 0.48 -0.14 -0.91 -0.23 0.00 0.00 178.00 177.77 1hdu h ASN 114 N 0.29 0.99 -0.55 1.44 -0.26 -1.95 -1.45 115.58 114.09 1hdu h ASN 114 Ca 0.05 -0.34 -0.11 0.00 -0.56 0.00 0.00 56.30 55.35 1hdu h ASN 114 Cb 0.46 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 37.43 1hdu h ASN 114 CO 0.03 1.12 -0.08 1.23 -1.06 0.00 0.00 177.43 178.67 1hdu h GLY 115 N 0.93 1.12 0.99 2.83 0.00 -1.75 -2.39 103.07 104.80 1hdu h GLY 115 Ca 0.13 -0.89 -0.03 0.00 0.00 0.00 0.00 47.33 46.54 1hdu h GLY 115 CO 0.05 0.81 0.23 -2.75 0.00 0.00 0.00 176.54 174.89 1hdu h PHE 116 N 0.91 0.90 -0.69 5.60 3.57 -1.15 -1.32 116.94 124.76 1hdu h PHE 116 Ca 0.15 -0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 1hdu h PHE 116 Cb 0.65 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 1hdu h PHE 116 CO 0.05 0.73 0.28 0.00 -2.23 0.00 0.00 178.31 177.13 1hdu h ALA 117 N 1.08 1.18 -0.36 2.41 0.00 -1.19 -2.63 119.26 119.75 1hdu h ALA 117 Ca 0.20 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1hdu h ALA 117 Cb 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1hdu h ALA 117 CO -0.02 0.59 -0.16 0.35 0.00 0.00 0.00 179.25 180.02 1hdu h PHE 118 N 1.00 0.73 0.00 0.00 3.57 -0.93 -2.14 116.94 119.17 1hdu h PHE 118 Ca 0.23 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1hdu h PHE 118 Cb 0.19 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1hdu h PHE 118 CO 0.02 0.78 -0.08 1.79 -2.23 0.00 0.00 178.31 178.59 1hdu h THR 119 N 0.60 0.26 0.00 4.41 1.35 -0.88 -0.19 112.91 118.46 1hdu h THR 119 Ca 0.10 -0.58 -0.27 0.00 -0.55 0.00 0.00 66.41 65.10 1hdu h THR 119 Cb 0.61 1.46 -0.05 0.00 -1.73 0.00 0.00 68.15 68.44 1hdu h THR 119 CO 0.04 0.08 -1.59 0.45 -0.25 0.00 0.00 175.52 174.25 1hdu h HIS 120 N 0.00 0.00 0.01 4.73 3.86 -1.36 -3.20 115.15 119.20 1hdu h HIS 120 Ca -0.00 0.00 -0.38 0.00 -1.16 0.00 0.00 60.37 58.83 1hdu h HIS 120 Cb 0.45 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.85 1hdu h HIS 120 CO 0.00 0.98 -2.41 -1.13 0.86 0.00 0.00 177.93 176.23 1hdu n SER 121 N -3.08 1.69 0.00 2.45 3.41 -0.84 -4.94 113.62 112.31 1hdu n SER 121 Ca -0.14 -0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 1hdu n SER 121 Cb 1.02 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 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 -3.20 0.42 -3.62 4.33 1.02 -0.18 -5.04 120.64 114.37 1hdu n GLU 122 Ca -0.42 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.42 1hdu n GLU 122 Cb 1.02 -0.67 -0.15 0.00 -0.02 0.00 0.00 31.44 31.62 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 -2.82 3.70 0.56 1.62 3.84 -0.62 -4.99 114.94 116.23 1hdu s ASN 123 Ca 0.00 -1.41 0.26 0.00 0.21 0.00 0.00 52.86 51.93 1hdu s ASN 123 Cb 0.00 -0.55 1.50 0.00 -0.55 0.00 0.00 41.25 41.64 1hdu s ASN 123 CO 0.00 -0.43 2.03 -0.09 -2.79 0.00 0.00 177.10 175.82 1hdu h ARG 124 N 8.28 0.00 -0.61 0.43 9.65 -1.78 -2.29 114.38 128.05 1hdu h ARG 124 Ca -0.17 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.71 1hdu h ARG 124 Cb 1.02 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.60 1hdu h ARG 124 CO 0.45 0.00 0.00 1.28 2.80 0.00 0.00 179.97 184.50 1hdu n LEU 125 N -4.07 5.41 -4.73 3.80 4.77 -1.26 -4.61 117.00 116.31 1hdu n LEU 125 Ca 0.06 -2.74 -0.42 0.00 -0.03 0.00 0.00 56.01 52.88 1hdu n LEU 125 Cb 0.47 -0.65 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 1hdu n LEU 125 CO 0.32 0.71 1.03 0.86 -1.33 0.00 0.00 177.39 178.97 1hdu s TRP 126 N -2.41 3.22 -0.15 -1.77 -0.11 -0.86 -4.82 118.94 112.03 1hdu s TRP 126 Ca 0.54 1.10 0.03 0.00 1.22 0.00 0.00 56.10 58.99 1hdu s TRP 126 Cb 0.39 -3.66 -0.12 0.00 -1.50 0.00 0.00 33.47 28.58 1hdu s TRP 126 CO 0.20 -2.17 -0.10 -2.13 -4.62 0.00 0.00 176.95 168.13 1hdu n ARG 127 N 3.02 0.74 -1.76 5.86 0.63 -1.26 -1.52 116.66 122.38 1hdu n ARG 127 Ca 0.08 0.07 -0.25 0.00 -0.92 0.00 0.00 57.85 56.83 1hdu n ARG 127 Cb 0.42 -1.32 0.17 0.00 0.45 0.00 0.00 32.46 32.18 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 -2.86 -0.96 0.00 -0.14 5.02 -1.26 -3.30 118.16 114.66 1hdu n LYS 128 Ca -0.27 -1.88 0.00 0.00 -2.02 0.00 0.00 58.31 54.14 1hdu n LYS 128 Cb 0.83 -1.10 0.00 0.00 -0.02 0.00 0.00 35.03 34.74 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 -3.45 0.00 -1.81 -0.18 -2.24 -0.41 -4.45 114.28 101.74 1hdu n THR 129 Ca 0.14 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.98 1hdu n THR 129 Cb 0.50 -1.85 0.13 0.00 -2.10 0.00 0.00 70.33 67.02 1hdu n THR 129 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1hdu n ARG 130 N -1.02 0.96 -2.47 -0.78 0.63 -1.26 -3.93 116.66 108.78 1hdu n ARG 130 Ca 0.00 -2.63 -0.33 0.00 -0.92 0.00 0.00 57.85 53.98 1hdu n ARG 130 Cb 0.00 -1.05 -0.04 0.00 0.45 0.00 0.00 32.46 31.83 1hdu n ARG 130 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1hdu s SER 131 N -2.64 6.51 0.15 6.15 0.01 -1.26 -4.63 113.70 117.99 1hdu s SER 131 Ca 0.33 1.70 0.07 0.00 1.31 0.00 0.00 55.95 59.36 1hdu s SER 131 Cb 0.33 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.99 1hdu s SER 131 CO -0.08 -0.66 -0.01 -0.69 0.41 0.00 0.00 173.24 172.21 1hdu s VAL 132 N -2.37 3.76 0.02 3.43 1.01 -1.26 -1.28 120.40 123.71 1hdu s VAL 132 Ca 0.62 -1.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 1hdu s VAL 132 Cb -0.12 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.39 1hdu s VAL 132 CO 0.26 -0.04 -0.01 -0.89 0.00 0.00 0.00 175.10 174.41 1hdu s THR 133 N -1.60 0.10 -0.05 3.92 2.01 -1.26 -5.04 115.64 113.71 1hdu s THR 133 Ca 0.27 -0.80 0.26 0.00 0.31 0.00 0.00 61.69 61.73 1hdu s THR 133 Cb -0.10 -0.26 0.30 0.00 0.01 0.00 0.00 72.50 72.45 1hdu s THR 133 CO 0.18 -0.44 1.79 0.77 -0.69 0.00 0.00 174.62 176.23 1hdu h SER 134 N 4.75 0.00 0.41 3.53 4.64 -2.00 -3.14 113.55 121.74 1hdu h SER 134 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1hdu h SER 134 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1hdu h SER 134 CO 0.42 0.12 0.00 -1.54 -0.87 0.00 0.00 176.83 174.95 1hdu n SER 135 N -3.19 0.46 -3.79 4.97 3.41 -1.26 -4.82 113.62 109.40 1hdu n SER 135 Ca 0.01 0.65 -0.08 0.00 -0.26 0.00 0.00 58.87 59.20 1hdu n SER 135 Cb 0.44 -0.74 -0.02 0.00 -0.26 0.00 0.00 64.21 63.64 1hdu n SER 135 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1hdu s SER 136 N -3.86 -0.31 0.00 4.04 0.15 -1.19 -5.01 113.70 107.52 1hdu s SER 136 Ca 0.02 -0.51 0.23 0.00 0.70 0.00 0.00 55.95 56.40 1hdu s SER 136 Cb 0.07 0.71 0.25 0.00 -1.71 0.00 0.00 66.02 65.34 1hdu s SER 136 CO 0.27 -1.28 1.29 0.18 1.20 0.00 0.00 173.24 174.90 1hdu n LEU 137 N -0.44 3.10 -4.84 3.45 4.32 -1.26 -4.57 117.00 116.76 1hdu n LEU 137 Ca -0.06 -1.15 -0.34 0.00 -0.02 0.00 0.00 56.01 54.44 1hdu n LEU 137 Cb 0.60 -0.07 -0.06 0.00 -1.62 0.00 0.00 43.42 42.27 1hdu n LEU 137 CO 0.15 0.57 0.37 0.00 -1.22 0.00 0.00 177.39 177.26 1hdu s VAL 139 N -1.72 3.83 0.00 0.00 1.01 -1.26 -4.64 120.40 117.63 1hdu s VAL 139 Ca 0.47 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1hdu s VAL 139 Cb -0.13 -2.78 0.00 0.00 0.00 0.00 0.00 36.38 33.47 1hdu s VAL 139 CO 0.19 0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.11 1hdu n GLY 140 N 0.90 -1.22 3.07 4.51 0.00 -0.40 -4.92 105.19 107.12 1hdu n GLY 140 Ca -0.13 -1.59 -0.16 0.00 0.00 0.00 0.00 46.02 44.15 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 -2.85 0.71 -0.57 1.61 1.01 -1.26 -4.84 120.40 114.20 1hdu s VAL 141 Ca 0.00 -0.90 -0.28 0.00 0.00 0.00 0.00 61.98 60.80 1hdu s VAL 141 Cb 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.70 1hdu s VAL 141 CO 0.00 -0.17 1.39 -0.62 0.00 0.00 0.00 175.10 175.70 1hdu s ASP 142 N -1.18 6.15 0.61 3.32 -1.08 0.00 -1.29 116.67 123.21 1hdu s ASP 142 Ca -0.04 0.23 0.32 0.00 -0.52 0.00 0.00 52.55 52.54 1hdu s ASP 142 Cb -0.08 -2.55 1.81 0.00 -1.46 0.00 0.00 42.92 40.64 1hdu s ASP 142 CO 0.01 -1.70 2.14 0.00 0.52 0.00 0.00 175.17 176.14 1hdu h ALA 143 N 10.89 1.58 -0.67 3.66 0.00 -1.86 -1.13 119.26 131.72 1hdu h ALA 143 Ca -0.27 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.40 1hdu h ALA 143 Cb 1.09 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.74 1hdu h ALA 143 CO 1.18 -0.22 0.31 -1.71 0.00 0.00 0.00 179.25 178.81 1hdu n ASN 144 N -3.56 4.18 0.00 0.00 5.15 -1.26 -3.45 115.26 116.33 1hdu n ASN 144 Ca -0.00 -3.08 0.00 0.00 -0.60 0.00 0.00 54.58 50.90 1hdu n ASN 144 Cb 0.27 -0.73 0.00 0.00 -0.53 0.00 0.00 39.78 38.79 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 -0.26 0.22 0.00 1.20 5.12 -0.44 -3.46 116.66 119.04 1hdu n ARG 145 Ca 0.38 -0.42 0.11 0.00 -1.93 0.00 0.00 57.85 55.98 1hdu n ARG 145 Cb 1.28 -0.58 0.04 0.00 -1.16 0.00 0.00 32.46 32.05 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 -0.05 2.38 -4.85 0.55 4.05 -1.09 -4.41 115.26 111.84 1hdu n ASN 146 Ca 0.00 -1.69 -0.32 0.00 0.45 0.00 0.00 54.58 53.02 1hdu n ASN 146 Cb 0.36 0.25 -0.03 0.00 1.23 0.00 0.00 39.78 41.60 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 -2.12 3.49 -1.41 1.20 0.52 -0.45 -0.05 118.94 120.11 1hdu s TRP 147 Ca 0.21 1.38 -0.15 0.00 0.02 0.00 0.00 56.10 57.57 1hdu s TRP 147 Cb 0.18 -2.74 0.05 0.00 -1.15 0.00 0.00 33.47 29.81 1hdu s TRP 147 CO 0.41 -0.40 2.10 -3.47 0.02 0.00 0.00 176.95 175.62 1hdu n ASP 148 N -1.76 4.15 -3.29 2.95 2.03 -1.26 -4.30 116.55 115.07 1hdu n ASP 148 Ca 0.06 -2.86 -0.08 0.00 0.52 0.00 0.00 54.79 52.43 1hdu n ASP 148 Cb 0.54 -1.68 -0.05 0.00 -0.72 0.00 0.00 41.12 39.21 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 3.49 -1.33 -1.54 -1.67 0.00 -1.26 -4.78 121.76 114.67 1hdu s ALA 149 Ca 0.49 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1hdu s ALA 149 Cb 0.11 -2.23 0.00 0.00 0.00 0.00 0.00 23.12 21.01 1hdu s ALA 149 CO -0.04 -1.92 0.00 0.41 0.00 0.00 0.00 175.76 174.20 1hdu n GLY 150 N 4.96 0.24 3.60 0.00 0.00 -1.26 -1.03 105.19 111.70 1hdu n GLY 150 Ca 0.05 -0.19 -0.47 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.59 1.43 -0.74 1.61 7.35 -1.26 -1.79 117.46 120.48 1hdu n PHE 151 Ca -0.19 0.64 0.00 0.00 -0.76 0.00 0.00 57.45 57.14 1hdu n PHE 151 Cb 0.62 -2.30 0.00 0.00 0.35 0.00 0.00 39.48 38.15 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 1.84 1.10 3.97 7.13 0.00 -1.26 -4.98 105.19 112.99 1hdu n GLY 152 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.16 0.92 0.30 1.61 1.02 -0.74 -4.95 119.74 117.74 1hdu s LYS 153 Ca 0.00 -0.84 -0.27 0.00 0.02 0.00 0.00 55.97 54.88 1hdu s LYS 153 Cb 0.00 -2.06 -0.14 0.00 -0.52 0.00 0.00 37.83 35.11 1hdu s LYS 153 CO 0.00 -2.11 0.88 0.00 -0.92 0.00 0.00 175.35 173.21 1hdu n ALA 154 N -3.41 -0.76 0.00 5.17 0.00 -1.26 -3.30 120.51 116.96 1hdu n ALA 154 Ca 0.17 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1hdu n ALA 154 Cb 0.60 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 18.12 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 1.40 0.90 3.18 0.00 0.00 -1.26 -3.18 105.19 106.23 1hdu n GLY 155 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.53 -0.05 4.61 0.00 -1.21 -3.56 121.76 119.03 1hdu s ALA 156 Ca 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 51.96 51.94 1hdu s ALA 156 Cb 0.00 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 1hdu s ALA 156 CO 0.00 -0.27 0.15 0.45 0.00 0.00 0.00 175.76 176.09 1hdu s SER 157 N -1.56 6.25 0.00 0.00 0.15 -0.75 -4.92 113.70 112.87 1hdu s SER 157 Ca -0.12 0.35 0.27 0.00 0.70 0.00 0.00 55.95 57.16 1hdu s SER 157 Cb -0.05 -1.96 0.84 0.00 -1.71 0.00 0.00 66.02 63.15 1hdu s SER 157 CO 0.01 0.31 1.62 -1.54 1.20 0.00 0.00 173.24 174.85 1hdu n SER 158 N 1.34 1.53 -4.59 5.45 3.41 -1.26 -1.81 113.62 117.70 1hdu n SER 158 Ca -0.14 -1.38 -0.41 0.00 -0.26 0.00 0.00 58.87 56.68 1hdu n SER 158 Cb 0.53 0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 64.48 1hdu n SER 158 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1hdu s SER 159 N -2.16 6.48 0.61 4.04 0.15 -1.26 -4.94 113.70 116.62 1hdu s SER 159 Ca 0.32 0.35 0.28 0.00 0.70 0.00 0.00 55.95 57.60 1hdu s SER 159 Cb 0.20 -2.34 1.42 0.00 -1.71 0.00 0.00 66.02 63.60 1hdu s SER 159 CO 0.39 -0.53 1.82 -0.65 1.20 0.00 0.00 173.24 175.48 1hdu h PRO 160 N 8.28 0.00 -0.00 5.44 0.11 -1.94 0.16 132.00 144.04 1hdu h PRO 160 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1hdu h PRO 160 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1hdu h PRO 160 CO 0.82 0.00 -0.20 0.00 -0.21 0.00 0.00 178.00 178.41 1hdu s SER 162 N -2.73 6.77 0.41 0.00 0.15 0.54 -4.92 113.70 113.93 1hdu s SER 162 Ca 0.21 1.89 0.29 0.00 0.70 0.00 0.00 55.95 59.04 1hdu s SER 162 Cb 0.19 -2.57 1.30 0.00 -1.71 0.00 0.00 66.02 63.24 1hdu s SER 162 CO 0.55 -0.48 1.87 -0.08 1.20 0.00 0.00 173.24 176.31 1hdu h GLU 163 N 2.19 0.00 -0.12 5.44 4.81 -1.90 -2.63 114.58 122.36 1hdu h GLU 163 Ca -0.49 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.70 1hdu h GLU 163 Cb 1.20 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 1hdu h GLU 163 CO 0.61 0.00 -0.19 -2.37 -0.73 0.00 0.00 179.01 176.34 1hdu n THR 164 N -2.63 2.21 -1.70 0.32 5.66 -1.26 -4.55 114.28 112.32 1hdu n THR 164 Ca 0.01 -2.66 -0.43 0.00 -3.05 0.00 0.00 64.05 57.92 1hdu n THR 164 Cb 0.22 -0.26 -0.03 0.00 -1.55 0.00 0.00 70.33 68.70 1hdu n THR 164 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1hdu n TYR 165 N -1.13 2.63 1.11 1.09 9.36 -0.99 -1.82 117.16 127.41 1hdu n TYR 165 Ca 0.22 -0.02 0.14 0.00 3.32 0.00 0.00 57.90 61.56 1hdu n TYR 165 Cb 0.79 -2.68 0.55 0.00 -0.63 0.00 0.00 39.34 37.37 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 4.71 0.00 0.00 2.98 1.44 -0.75 -0.82 115.22 122.79 1hdu n HIS 166 Ca 0.17 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.88 1hdu n HIS 166 Cb 0.35 -0.37 0.00 0.00 0.12 0.00 0.00 29.99 30.09 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 1.44 -0.20 0.28 -1.39 0.00 -1.26 -4.24 105.19 99.83 1hdu n GLY 167 Ca 0.09 -1.79 -0.00 0.00 0.00 0.00 0.00 46.02 44.31 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 0.56 -2.51 1.61 1.57 -1.98 -3.46 116.57 112.35 1hdu h LYS 168 Ca 0.00 -0.11 0.07 0.00 -1.87 0.00 0.00 60.65 58.73 1hdu h LYS 168 Cb 0.00 -0.08 -0.14 0.00 0.08 0.00 0.00 32.23 32.08 1hdu h LYS 168 CO 0.00 0.56 0.40 1.52 -0.57 0.00 0.00 179.45 181.36 1hdu s TYR 169 N -5.03 -0.41 0.28 -1.35 -0.85 -1.26 -5.10 117.35 103.63 1hdu s TYR 169 Ca -0.08 0.26 -0.30 0.00 -0.52 0.00 0.00 57.07 56.43 1hdu s TYR 169 Cb 0.16 0.54 -0.13 0.00 0.38 0.00 0.00 41.96 42.91 1hdu s TYR 169 CO 0.77 -0.64 1.40 0.00 -1.52 0.00 0.00 175.55 175.55 1hdu n ALA 170 N -0.28 1.38 -1.68 9.51 0.00 -1.26 -1.97 120.51 126.21 1hdu n ALA 170 Ca -0.11 0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.57 1hdu n ALA 170 Cb 0.63 -2.30 -0.05 0.00 0.00 0.00 0.00 19.45 17.74 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 1.74 -4.70 0.21 0.00 5.03 0.93 -4.88 115.26 113.58 1hdu n ASN 171 Ca 0.09 0.25 0.08 0.00 0.87 0.00 0.00 54.58 55.88 1hdu n ASN 171 Cb 0.34 -3.61 0.45 0.00 -1.02 0.00 0.00 39.78 35.94 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 0.00 -3.35 6.41 4.64 -1.63 -3.41 113.55 116.21 1hdu h SER 172 Ca -0.32 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.43 1hdu h SER 172 Cb 1.05 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.08 1hdu h SER 172 CO 0.44 0.28 0.22 -1.61 -0.87 0.00 0.00 176.83 175.29 1hdu s GLU 173 N -3.77 4.35 0.55 4.77 0.41 -1.26 -4.94 118.70 118.81 1hdu s GLU 173 Ca -0.01 0.91 0.21 0.00 -0.41 0.00 0.00 54.97 55.68 1hdu s GLU 173 Cb 0.11 -3.52 1.49 0.00 -1.78 0.00 0.00 34.13 30.43 1hdu s GLU 173 CO 0.65 -0.14 2.19 -0.24 -0.49 0.00 0.00 175.26 177.23 1hdu h VAL 174 N 5.00 0.82 0.00 2.63 3.04 -1.91 0.08 116.25 125.91 1hdu h VAL 174 Ca -0.35 -0.00 -0.07 0.00 -1.01 0.00 0.00 66.70 65.27 1hdu h VAL 174 Cb 1.16 1.00 -0.01 0.00 -2.01 0.00 0.00 31.29 31.43 1hdu h VAL 174 CO 0.79 0.00 -0.32 -0.33 -1.01 0.00 0.00 177.57 176.70 1hdu h GLU 175 N 0.00 0.00 0.07 4.17 3.07 -1.90 -1.37 114.58 118.61 1hdu h GLU 175 Ca -0.00 0.00 -0.23 0.00 -0.50 0.00 0.00 59.36 58.63 1hdu h GLU 175 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 1hdu h GLU 175 CO 0.00 0.32 -1.19 0.28 -1.40 0.00 0.00 179.01 177.02 1hdu h VAL 176 N 0.00 1.09 -0.42 3.13 2.07 -1.41 -3.34 116.25 117.36 1hdu h VAL 176 Ca -0.00 -2.33 -0.01 0.00 0.82 0.00 0.00 66.70 65.18 1hdu h VAL 176 Cb 0.63 2.66 -0.02 0.00 -1.52 0.00 0.00 31.29 33.04 1hdu h VAL 176 CO 0.04 0.59 0.21 0.50 0.02 0.00 0.00 177.57 178.93 1hdu h LYS 177 N -0.58 0.58 -0.91 1.57 3.64 -1.04 -1.83 116.57 118.00 1hdu h LYS 177 Ca -0.28 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.09 1hdu h LYS 177 Cb 1.53 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 33.18 1hdu h LYS 177 CO -0.02 0.44 0.59 0.77 -2.27 0.00 0.00 179.45 178.96 1hdu h SER 178 N 0.58 0.96 -0.04 4.20 0.02 -1.39 0.11 113.55 117.99 1hdu h SER 178 Ca 0.15 -0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.98 1hdu h SER 178 Cb 0.05 -0.21 0.01 0.00 0.14 0.00 0.00 62.40 62.38 1hdu h SER 178 CO -0.02 0.64 -0.43 0.40 -1.14 0.00 0.00 176.83 176.29 1hdu h ILE 179 N 1.10 1.44 -0.17 3.27 2.04 -1.53 -2.64 117.51 121.02 1hdu h ILE 179 Ca 0.37 -1.89 0.05 0.00 1.00 0.00 0.00 64.86 64.39 1hdu h ILE 179 Cb 0.08 2.47 -0.05 0.00 -0.74 0.00 0.00 36.82 38.57 1hdu h ILE 179 CO -0.12 0.54 -0.16 0.58 0.00 0.00 0.00 178.15 178.99 1hdu h VAL 180 N -0.16 0.56 -0.75 1.67 2.07 -0.82 0.34 116.25 119.16 1hdu h VAL 180 Ca -0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 1hdu h VAL 180 Cb 1.11 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1hdu h VAL 180 CO 0.09 0.00 0.39 0.44 0.02 0.00 0.00 177.57 178.51 1hdu h ASP 181 N -0.19 0.96 -0.59 0.57 3.32 -0.87 -1.22 116.42 118.40 1hdu h ASP 181 Ca 0.11 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 56.97 1hdu h ASP 181 Cb 0.35 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1hdu h ASP 181 CO -0.28 0.80 0.07 0.15 -1.72 0.00 0.00 179.24 178.26 1hdu h PHE 182 N 1.05 1.05 -0.27 4.55 3.57 -1.05 -0.96 116.94 124.88 1hdu h PHE 182 Ca 0.26 -0.16 -0.18 0.00 3.53 0.00 0.00 57.97 61.43 1hdu h PHE 182 Cb 0.07 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.52 1hdu h PHE 182 CO 0.00 0.92 -0.54 0.28 -2.23 0.00 0.00 178.31 176.74 1hdu h VAL 183 N 0.88 1.28 -0.51 1.41 2.07 -0.79 -2.27 116.25 118.32 1hdu h VAL 183 Ca 0.17 -1.73 -0.07 0.00 0.82 0.00 0.00 66.70 65.90 1hdu h VAL 183 Cb 0.45 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1hdu h VAL 183 CO 0.02 0.56 0.07 0.11 0.02 0.00 0.00 177.57 178.34 1hdu h LYS 184 N 0.62 0.86 -0.45 1.57 1.57 -1.15 -1.60 116.57 117.99 1hdu h LYS 184 Ca 0.01 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1hdu h LYS 184 Cb 1.15 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.35 1hdu h LYS 184 CO 0.12 0.86 0.25 -0.91 -0.57 0.00 0.00 179.45 179.20 1hdu h ASN 185 N 0.74 0.56 0.10 0.86 2.35 -1.16 -3.03 115.58 116.00 1hdu h ASN 185 Ca 0.15 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1hdu h ASN 185 Cb 0.43 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.65 1hdu h ASN 185 CO 0.01 0.48 -0.05 -0.74 -1.65 0.00 0.00 177.43 175.48 1hdu h HIS 186 N 0.59 -0.14 0.00 1.19 2.76 -1.26 -3.46 115.15 114.82 1hdu h HIS 186 Ca 0.16 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1hdu h HIS 186 Cb 0.05 0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.05 1hdu h HIS 186 CO -0.02 -0.08 0.00 0.41 -1.30 0.00 0.00 177.93 176.93 1hdu n GLY 187 N -1.15 0.35 2.44 5.26 0.00 -0.61 -4.84 105.19 106.63 1hdu n GLY 187 Ca -0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.14 3.26 -4.74 1.61 5.15 -1.26 -5.05 115.26 114.09 1hdu n ASN 188 Ca 0.00 -2.92 -0.39 0.00 -0.60 0.00 0.00 54.58 50.67 1hdu n ASN 188 Cb 0.07 -0.42 -0.05 0.00 -0.53 0.00 0.00 39.78 38.85 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 -3.67 3.62 -0.10 1.20 0.08 -1.26 -0.72 117.98 117.13 1hdu s PHE 189 Ca 0.39 1.21 0.16 0.00 0.12 0.00 0.00 56.93 58.81 1hdu s PHE 189 Cb 0.37 -2.71 -0.24 0.00 -0.57 0.00 0.00 43.02 39.88 1hdu s PHE 189 CO -0.01 0.21 0.21 1.63 -0.10 0.00 0.00 175.22 177.16 1hdu n LYS 190 N 3.31 0.95 -4.03 0.44 4.76 0.51 -4.67 118.16 119.44 1hdu n LYS 190 Ca -0.04 -0.08 -0.12 0.00 -2.87 0.00 0.00 58.31 55.20 1hdu n LYS 190 Cb 0.51 -1.42 -0.12 0.00 -1.84 0.00 0.00 35.03 32.16 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 -2.79 0.35 -0.16 7.82 0.00 -1.19 -3.17 121.76 122.62 1hdu s ALA 191 Ca -0.07 -0.60 -0.05 0.00 0.00 0.00 0.00 51.96 51.24 1hdu s ALA 191 Cb 0.08 0.07 0.06 0.00 0.00 0.00 0.00 23.12 23.33 1hdu s ALA 191 CO 0.70 -0.06 0.10 0.12 0.00 0.00 0.00 175.76 176.62 1hdu s PHE 192 N -1.21 0.13 -0.17 0.00 2.19 -0.05 -1.12 117.98 117.74 1hdu s PHE 192 Ca -0.11 -0.19 0.00 0.00 0.33 0.00 0.00 56.93 56.97 1hdu s PHE 192 Cb -0.09 -0.63 0.00 0.00 -1.31 0.00 0.00 43.02 40.99 1hdu s PHE 192 CO -0.00 -0.49 -0.15 -0.51 1.83 0.00 0.00 175.22 175.90 1hdu s LEU 193 N 2.16 2.45 -0.19 6.12 1.02 0.46 -1.55 118.68 129.15 1hdu s LEU 193 Ca 0.03 -0.50 -0.01 0.00 0.02 0.00 0.00 54.13 53.67 1hdu s LEU 193 Cb -0.16 -1.56 0.01 0.00 0.02 0.00 0.00 46.19 44.50 1hdu s LEU 193 CO -0.09 0.06 -0.14 -0.55 0.02 0.00 0.00 176.35 175.66 1hdu s SER 194 N 0.97 3.64 -0.16 2.29 0.15 -0.65 -1.15 113.70 118.80 1hdu s SER 194 Ca -0.02 -0.52 -0.07 0.00 0.70 0.00 0.00 55.95 56.03 1hdu s SER 194 Cb -0.15 -1.59 -0.04 0.00 -1.71 0.00 0.00 66.02 62.53 1hdu s SER 194 CO -0.03 0.01 0.10 -0.63 1.20 0.00 0.00 173.24 173.89 1hdu s ILE 195 N 1.26 5.14 0.18 6.45 1.01 -0.40 -2.24 121.20 132.60 1hdu s ILE 195 Ca 0.03 0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.80 1hdu s ILE 195 Cb -0.14 -3.29 -0.01 0.00 0.01 0.00 0.00 42.46 39.03 1hdu s ILE 195 CO -0.07 0.52 0.12 1.41 0.00 0.00 0.00 174.94 176.91 1hdu n HIS 196 N 2.93 -0.23 -3.66 3.97 8.25 0.54 -3.88 115.22 123.13 1hdu n HIS 196 Ca -0.18 -1.35 -0.13 0.00 -0.26 0.00 0.00 57.72 55.81 1hdu n HIS 196 Cb 0.53 0.09 -0.06 0.00 1.12 0.00 0.00 29.99 31.67 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 -2.18 -0.29 0.35 0.41 1.04 -1.26 -0.56 113.70 111.20 1hdu s SER 197 Ca 0.16 0.02 0.04 0.00 0.48 0.00 0.00 55.95 56.65 1hdu s SER 197 Cb 0.01 0.43 -0.06 0.00 0.10 0.00 0.00 66.02 66.50 1hdu s SER 197 CO 0.12 -0.66 0.06 -0.72 0.98 0.00 0.00 173.24 173.01 1hdu s TYR 198 N -2.45 2.02 0.00 5.02 1.13 -1.26 -4.89 117.35 116.92 1hdu s TYR 198 Ca -0.05 -0.95 0.00 0.00 -1.41 0.00 0.00 57.07 54.66 1hdu s TYR 198 Cb -0.01 -1.35 0.00 0.00 -1.10 0.00 0.00 41.96 39.50 1hdu s TYR 198 CO -0.02 0.05 0.00 0.43 -2.51 0.00 0.00 175.55 173.49 1hdu n SER 199 N -0.80 0.00 -3.17 -0.18 7.64 -0.11 -4.87 113.62 112.13 1hdu n SER 199 Ca -0.04 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.79 1hdu n SER 199 Cb 0.67 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 -1.51 -4.09 1.43 6.02 -0.02 -4.87 117.38 114.35 1hdu n GLN 200 Ca 0.00 1.29 -0.10 0.00 -0.01 0.00 0.00 57.00 58.18 1hdu n GLN 200 Cb 0.00 -5.47 -0.11 0.00 1.02 0.00 0.00 30.24 25.68 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 -4.43 2.40 -0.20 1.08 1.43 -0.52 -2.51 118.68 115.93 1hdu s LEU 201 Ca 0.11 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 1hdu s LEU 201 Cb -0.02 -0.00 0.05 0.00 0.03 0.00 0.00 46.19 46.25 1hdu s LEU 201 CO 0.76 -0.41 -0.06 -0.22 0.23 0.00 0.00 176.35 176.65 1hdu s LEU 202 N -2.41 2.11 0.13 1.79 0.20 -0.43 -0.73 118.68 119.35 1hdu s LEU 202 Ca 0.01 -0.92 0.09 0.00 0.69 0.00 0.00 54.13 53.99 1hdu s LEU 202 Cb -0.00 -1.08 -0.04 0.00 -0.43 0.00 0.00 46.19 44.64 1hdu s LEU 202 CO -0.04 -0.20 -0.14 -0.76 -0.29 0.00 0.00 176.35 174.92 1hdu s LEU 203 N 1.50 2.85 0.24 -0.68 2.01 0.24 -2.44 118.68 122.39 1hdu s LEU 203 Ca -0.02 -0.53 0.03 0.00 0.01 0.00 0.00 54.13 53.62 1hdu s LEU 203 Cb -0.17 -1.64 -0.05 0.00 0.01 0.00 0.00 46.19 44.34 1hdu s LEU 203 CO -0.07 0.16 0.01 -0.72 1.01 0.00 0.00 176.35 176.74 1hdu s TYR 204 N -1.32 1.55 0.79 0.29 -0.85 -0.97 -1.19 117.35 115.66 1hdu s TYR 204 Ca 0.21 -0.96 -0.14 0.00 -0.52 0.00 0.00 57.07 55.65 1hdu s TYR 204 Cb -0.10 -0.91 0.05 0.00 0.38 0.00 0.00 41.96 41.37 1hdu s TYR 204 CO 0.12 -0.08 0.98 -2.30 -1.52 0.00 0.00 175.55 172.75 1hdu n PRO 205 N -0.43 0.22 -4.24 -3.49 -0.02 -1.26 -1.60 135.00 124.18 1hdu n PRO 205 Ca -0.04 0.14 -0.24 0.00 -2.02 0.00 0.00 63.50 61.33 1hdu n PRO 205 Cb 0.64 -2.25 -0.08 0.00 -0.02 0.00 0.00 33.50 31.79 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 -2.06 2.61 -0.11 6.00 2.02 -1.26 -4.59 117.35 119.96 1hdu s TYR 206 Ca 0.71 -0.44 0.11 0.00 -0.37 0.00 0.00 57.07 57.07 1hdu s TYR 206 Cb -0.30 -1.60 -0.15 0.00 -0.40 0.00 0.00 41.96 39.50 1hdu s TYR 206 CO 0.53 0.40 0.06 0.41 -1.57 0.00 0.00 175.55 175.38 1hdu n GLY 207 N -1.05 -0.60 0.01 0.71 0.00 -1.26 -1.77 105.19 101.23 1hdu n GLY 207 Ca -0.03 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.41 0.08 -3.89 1.61 4.11 -0.91 -0.96 117.16 114.79 1hdu n TYR 208 Ca -0.18 0.02 -0.11 0.00 -0.00 0.00 0.00 57.90 57.63 1hdu n TYR 208 Cb 0.85 -0.31 -0.10 0.00 -0.00 0.00 0.00 39.34 39.78 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 -3.03 0.09 -1.15 -3.48 -1.32 -1.26 -4.94 115.64 100.56 1hdu s THR 209 Ca 0.10 -0.77 0.25 0.00 -1.21 0.00 0.00 61.69 60.06 1hdu s THR 209 Cb 0.17 -0.51 0.28 0.00 -1.51 0.00 0.00 72.50 70.94 1hdu s THR 209 CO 0.70 -0.43 1.81 0.35 -2.21 0.00 0.00 174.62 174.84 1hdu n THR 210 N 1.33 0.27 -1.70 5.08 -2.24 -1.26 -4.59 114.28 111.17 1hdu n THR 210 Ca -0.22 0.07 -0.43 0.00 -2.27 0.00 0.00 64.05 61.19 1hdu n THR 210 Cb 0.56 -0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1hdu n THR 210 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1hdu n GLN 211 N -1.43 2.52 -2.79 -0.78 -0.06 -1.26 -4.95 117.38 108.62 1hdu n GLN 211 Ca 0.08 0.91 -0.41 0.00 -2.00 0.00 0.00 57.00 55.58 1hdu n GLN 211 Cb 0.26 -2.71 -0.04 0.00 -4.06 0.00 0.00 30.24 23.69 1hdu n GLN 211 CO 0.00 0.00 0.00 -1.12 -0.20 0.00 0.00 177.06 175.74 1hdu s SER 212 N 0.94 7.41 0.59 1.69 0.01 -1.26 -4.48 113.70 118.59 1hdu s SER 212 Ca 0.74 1.68 -0.19 0.00 1.31 0.00 0.00 55.95 59.50 1hdu s SER 212 Cb -0.57 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.07 1hdu s SER 212 CO 0.37 -0.07 1.21 0.27 0.41 0.00 0.00 173.24 175.43 1hdu s ILE 213 N 0.13 2.63 0.56 1.44 -4.36 -1.26 -4.89 121.20 115.45 1hdu s ILE 213 Ca 0.45 0.40 0.25 0.00 -0.26 0.00 0.00 60.65 61.49 1hdu s ILE 213 Cb -0.22 -3.16 0.33 0.00 1.25 0.00 0.00 42.46 40.65 1hdu s ILE 213 CO 0.28 -0.08 2.18 -0.65 0.24 0.00 0.00 174.94 176.91 1hdu h PRO 214 N 0.94 0.00 -0.69 0.37 0.11 -1.99 -2.32 132.00 128.42 1hdu h PRO 214 Ca -0.50 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.47 1hdu h PRO 214 Cb 1.30 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.32 1hdu h PRO 214 CO 0.55 0.00 0.18 -0.25 -0.21 0.00 0.00 178.00 178.27 1hdu n ASP 215 N -4.10 5.23 -0.25 -2.05 8.00 -1.26 -4.69 116.55 117.43 1hdu n ASP 215 Ca -0.02 -3.12 0.04 0.00 0.71 0.00 0.00 54.79 52.41 1hdu n ASP 215 Cb 0.15 -0.73 0.17 0.00 -0.02 0.00 0.00 41.12 40.69 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 3.21 0.43 0.23 -1.24 3.64 -1.78 -1.31 116.57 119.75 1hdu h LYS 216 Ca 0.17 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1hdu h LYS 216 Cb 2.23 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 33.95 1hdu h LYS 216 CO 0.66 0.29 -0.12 1.15 -2.27 0.00 0.00 179.45 179.15 1hdu h THR 217 N 0.45 0.74 0.15 1.00 2.02 -1.87 0.00 112.91 115.40 1hdu h THR 217 Ca 0.39 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.56 1hdu h THR 217 Cb 0.56 0.74 -0.00 0.00 -1.74 0.00 0.00 68.15 67.72 1hdu h THR 217 CO -0.38 0.00 -0.08 -0.08 0.37 0.00 0.00 175.52 175.35 1hdu h GLU 218 N -0.33 -0.21 -0.32 6.66 4.81 -1.84 -1.71 114.58 121.65 1hdu h GLU 218 Ca -0.03 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1hdu h GLU 218 Cb 0.26 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1hdu h GLU 218 CO 0.04 -0.14 0.07 -0.07 -0.73 0.00 0.00 179.01 178.18 1hdu h LEU 219 N -0.21 0.42 -0.67 1.64 4.07 -1.21 -0.59 115.31 118.76 1hdu h LEU 219 Ca -0.02 -0.05 -0.11 0.00 0.08 0.00 0.00 57.88 57.78 1hdu h LEU 219 Cb 0.17 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 41.79 1hdu h LEU 219 CO 0.03 0.44 -0.14 -1.13 -1.08 0.00 0.00 178.44 176.55 1hdu h ASN 220 N 0.46 0.89 -0.39 -0.43 -0.73 -0.75 -0.71 115.58 113.92 1hdu h ASN 220 Ca 0.11 -0.30 -0.10 0.00 1.87 0.00 0.00 56.30 57.89 1hdu h ASN 220 Cb 0.19 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.53 1hdu h ASN 220 CO -0.00 1.03 -0.14 -0.61 -0.37 0.00 0.00 177.43 177.34 1hdu h GLN 221 N 0.79 0.78 -0.81 6.67 5.75 -0.63 -1.06 115.11 126.60 1hdu h GLN 221 Ca 0.12 -0.32 -0.04 0.00 -0.15 0.00 0.00 58.65 58.26 1hdu h GLN 221 Cb 0.67 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.15 1hdu h GLN 221 CO 0.05 0.94 0.35 0.28 -2.65 0.00 0.00 178.83 177.79 1hdu h VAL 222 N 0.59 1.26 -0.60 2.39 2.07 -0.92 -1.74 116.25 119.29 1hdu h VAL 222 Ca 0.09 -0.79 -0.09 0.00 0.82 0.00 0.00 66.70 66.74 1hdu h VAL 222 Cb 0.67 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1hdu h VAL 222 CO 0.05 0.33 0.02 0.00 0.02 0.00 0.00 177.57 177.98 1hdu h ALA 223 N 1.19 0.89 -0.63 1.67 0.00 -0.95 -1.31 119.26 120.11 1hdu h ALA 223 Ca 0.27 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1hdu h ALA 223 Cb 0.18 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1hdu h ALA 223 CO -0.03 0.66 0.41 -0.22 0.00 0.00 0.00 179.25 180.07 1hdu h LYS 224 N 0.96 0.81 -0.36 0.00 3.64 -0.72 -1.06 116.57 119.83 1hdu h LYS 224 Ca 0.18 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.35 1hdu h LYS 224 Cb 0.52 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1hdu h LYS 224 CO 0.03 0.54 -0.38 0.77 -2.27 0.00 0.00 179.45 178.13 1hdu h SER 225 N 0.84 0.92 -0.58 4.20 0.02 -1.09 -2.50 113.55 115.36 1hdu h SER 225 Ca 0.24 -0.41 -0.07 0.00 -0.84 0.00 0.00 61.79 60.71 1hdu h SER 225 Cb -0.07 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.19 1hdu h SER 225 CO -0.06 1.19 0.10 0.00 -1.14 0.00 0.00 176.83 176.92 1hdu h ALA 226 N 0.85 0.77 -0.61 3.77 0.00 -0.96 -1.95 119.26 121.14 1hdu h ALA 226 Ca 0.06 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1hdu h ALA 226 Cb 0.95 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1hdu h ALA 226 CO 0.09 0.51 0.20 0.28 0.00 0.00 0.00 179.25 180.33 1hdu h VAL 227 N 0.85 1.24 -0.50 0.00 2.07 -1.17 -1.01 116.25 117.72 1hdu h VAL 227 Ca 0.18 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1hdu h VAL 227 Cb 0.41 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1hdu h VAL 227 CO 0.01 0.31 0.23 0.00 0.02 0.00 0.00 177.57 178.14 1hdu h ALA 228 N 1.07 0.65 -0.39 1.67 0.00 -1.27 -1.35 119.26 119.63 1hdu h ALA 228 Ca 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1hdu h ALA 228 Cb 0.27 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1hdu h ALA 228 CO -0.01 0.22 0.22 0.00 0.00 0.00 0.00 179.25 179.68 1hdu h ALA 229 N 1.08 0.50 -0.42 0.00 0.00 -1.11 -2.31 119.26 116.99 1hdu h ALA 229 Ca 0.17 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1hdu h ALA 229 Cb 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1hdu h ALA 229 CO -0.02 0.02 0.23 1.25 0.00 0.00 0.00 179.25 180.74 1hdu h LEU 230 N 0.51 0.53 -1.91 0.00 6.46 -0.96 -2.67 115.31 117.26 1hdu h LEU 230 Ca 0.14 -0.09 -0.02 0.00 -0.12 0.00 0.00 57.88 57.79 1hdu h LEU 230 Cb 0.05 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 39.84 1hdu h LEU 230 CO -0.02 0.46 -0.11 0.50 -0.62 0.00 0.00 178.44 178.65 1hdu h LYS 231 N 0.55 0.00 -0.10 1.25 3.64 -1.11 -3.11 116.57 117.69 1hdu h LYS 231 Ca 0.15 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1hdu h LYS 231 Cb 0.05 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1hdu h LYS 231 CO -0.02 0.11 0.14 0.66 -2.27 0.00 0.00 179.45 178.07 1hdu h SER 232 N 0.00 0.00 0.03 4.20 4.64 -1.04 0.19 113.55 121.57 1hdu h SER 232 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hdu h SER 232 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1hdu h SER 232 CO 0.01 0.00 -0.01 -0.07 -0.87 0.00 0.00 176.83 175.89 1hdu h LEU 233 N 0.00 -0.03 -2.11 5.97 3.38 -1.70 -3.42 115.31 117.40 1hdu h LEU 233 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1hdu h LEU 233 Cb 0.33 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1hdu h LEU 233 CO -0.00 0.39 0.00 -1.22 0.09 0.00 0.00 178.44 177.70 1hdu n TYR 234 N -4.44 0.00 -0.98 1.13 4.01 -1.23 -4.99 117.16 110.66 1hdu n TYR 234 Ca -0.01 -0.28 0.00 0.00 -0.16 0.00 0.00 57.90 57.46 1hdu n TYR 234 Cb 0.02 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.02 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 -0.28 0.48 3.71 2.72 0.00 0.67 -4.99 105.19 107.50 1hdu n GLY 235 Ca 0.00 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 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 2.90 -0.18 2.61 2.01 -1.25 -4.97 115.64 114.75 1hdu s THR 236 Ca 0.00 0.58 -0.08 0.00 0.31 0.00 0.00 61.69 62.50 1hdu s THR 236 Cb 0.00 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 69.10 1hdu s THR 236 CO 0.00 0.03 0.09 -0.44 -0.69 0.00 0.00 174.62 173.61 1hdu s SER 237 N 1.47 5.90 0.11 3.53 0.01 -1.26 -3.91 113.70 119.55 1hdu s SER 237 Ca 0.70 0.17 0.10 0.00 1.31 0.00 0.00 55.95 58.23 1hdu s SER 237 Cb -0.41 -2.00 -0.04 0.00 0.21 0.00 0.00 66.02 63.78 1hdu s SER 237 CO 0.31 0.20 -0.25 -0.31 0.41 0.00 0.00 173.24 173.60 1hdu s TYR 238 N 0.20 2.36 0.25 2.43 1.51 -1.26 -4.89 117.35 117.95 1hdu s TYR 238 Ca 0.06 -0.36 0.07 0.00 -1.01 0.00 0.00 57.07 55.83 1hdu s TYR 238 Cb -0.12 -1.30 -0.03 0.00 -0.11 0.00 0.00 41.96 40.40 1hdu s TYR 238 CO -0.00 0.31 0.23 0.15 -1.11 0.00 0.00 175.55 175.12 1hdu s LYS 239 N -1.90 3.01 0.09 -0.62 3.01 -1.05 -4.97 119.74 117.31 1hdu s LYS 239 Ca 0.14 -1.02 -0.09 0.00 -1.01 0.00 0.00 55.97 54.00 1hdu s LYS 239 Cb -0.10 -2.62 -0.00 0.00 -1.01 0.00 0.00 37.83 34.10 1hdu s LYS 239 CO 0.06 0.39 0.19 1.52 0.51 0.00 0.00 175.35 178.02 1hdu s TYR 240 N -2.12 0.15 -5.00 3.18 1.13 -1.26 -1.31 117.35 112.12 1hdu s TYR 240 Ca 0.33 -0.58 0.00 0.00 -1.41 0.00 0.00 57.07 55.41 1hdu s TYR 240 Cb -0.08 -0.06 0.00 0.00 -1.10 0.00 0.00 41.96 40.72 1hdu s TYR 240 CO 0.26 -0.54 0.00 0.41 -2.51 0.00 0.00 175.55 173.17 1hdu n GLY 241 N -0.05 -0.83 3.80 5.49 0.00 -1.02 -4.98 105.19 107.60 1hdu n GLY 241 Ca -0.15 -1.50 -0.33 0.00 0.00 0.00 0.00 46.02 44.04 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 -2.84 5.91 0.14 1.61 1.04 -1.26 -2.29 113.70 116.02 1hdu s SER 242 Ca 0.00 1.88 -0.21 0.00 0.48 0.00 0.00 55.95 58.10 1hdu s SER 242 Cb 0.00 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.58 1hdu s SER 242 CO 0.00 -1.08 1.67 0.40 0.98 0.00 0.00 173.24 175.21 1hdu h ILE 243 N 0.79 0.58 -0.19 -1.02 2.04 -1.34 0.40 117.51 118.78 1hdu h ILE 243 Ca -0.48 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.31 1hdu h ILE 243 Cb 1.22 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1hdu h ILE 243 CO 0.58 0.00 -0.20 -0.29 0.00 0.00 0.00 178.15 178.24 1hdu h ILE 244 N -0.14 1.23 0.00 -0.67 2.10 -1.47 -1.49 117.51 117.07 1hdu h ILE 244 Ca 0.12 -1.05 -0.14 0.00 1.08 0.00 0.00 64.86 64.87 1hdu h ILE 244 Cb 0.32 1.31 -0.02 0.00 -1.09 0.00 0.00 36.82 37.34 1hdu h ILE 244 CO -0.29 0.33 -0.77 0.74 -1.08 0.00 0.00 178.15 177.08 1hdu h THR 245 N 0.30 0.99 0.04 2.19 2.02 -1.77 -3.34 112.91 113.33 1hdu h THR 245 Ca 0.05 -2.45 -0.34 0.00 0.77 0.00 0.00 66.41 64.44 1hdu h THR 245 Cb 0.53 2.45 -0.04 0.00 -1.74 0.00 0.00 68.15 69.35 1hdu h THR 245 CO 0.03 0.56 -1.91 0.41 0.37 0.00 0.00 175.52 174.98 1hdu n THR 246 N -3.20 1.60 0.00 3.16 -1.04 0.11 -4.90 114.28 110.02 1hdu n THR 246 Ca -0.01 -0.36 -0.03 0.00 -2.04 0.00 0.00 64.05 61.61 1hdu n THR 246 Cb 0.80 -1.83 -0.01 0.00 -1.82 0.00 0.00 70.33 67.47 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 -3.95 1.11 0.00 12.58 -6.64 -0.58 -5.09 119.36 116.79 1hdu n ILE 247 Ca -0.39 0.25 0.00 0.00 -1.77 0.00 0.00 62.75 60.84 1hdu n ILE 247 Cb 0.88 -1.74 0.00 0.00 -1.44 0.00 0.00 39.64 37.34 1hdu n ILE 247 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1hdu n TYR 248 N -3.65 0.00 -2.18 4.28 0.18 -1.11 -5.04 117.16 109.65 1hdu n TYR 248 Ca -0.06 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.31 1hdu n TYR 248 Cb 0.23 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.16 1hdu n TYR 248 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1hdu s GLN 249 N -2.00 4.39 -0.16 -3.48 0.74 -1.26 -3.94 119.66 113.95 1hdu s GLN 249 Ca 0.00 2.13 -0.07 0.00 0.05 0.00 0.00 55.36 57.47 1hdu s GLN 249 Cb 0.00 -3.12 0.07 0.00 1.10 0.00 0.00 33.01 31.05 1hdu s GLN 249 CO 0.00 -0.18 0.35 0.00 -0.55 0.00 0.00 175.29 174.90 1hdu s ALA 250 N -0.67 -0.87 0.13 1.58 0.00 -0.13 -4.23 121.76 117.57 1hdu s ALA 250 Ca 0.52 1.27 0.04 0.00 0.00 0.00 0.00 51.96 53.79 1hdu s ALA 250 Cb -0.38 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 21.68 1hdu s ALA 250 CO 0.46 -0.50 0.11 -1.54 0.00 0.00 0.00 175.76 174.29 1hdu s SER 251 N 2.01 5.51 -0.55 0.00 1.04 -1.19 -2.15 113.70 118.37 1hdu s SER 251 Ca -0.04 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.31 1hdu s SER 251 Cb -0.11 -1.45 0.00 0.00 0.10 0.00 0.00 66.02 64.56 1hdu s SER 251 CO -0.11 0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.84 1hdu n GLY 252 N 0.02 0.56 3.80 7.32 0.00 -0.20 -4.39 105.19 112.31 1hdu n GLY 252 Ca -0.08 -0.75 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.87 2.64 0.26 -0.02 0.00 -1.22 -1.35 107.32 104.76 1hdu s GLY 253 Ca 0.00 0.31 -0.03 0.00 0.00 0.00 0.00 44.72 45.00 1hdu s GLY 253 CO 0.00 0.68 1.86 1.48 0.00 0.00 0.00 173.10 177.12 1hdu h SER 254 N 3.10 0.92 0.66 1.64 4.64 -1.90 -2.84 113.55 119.78 1hdu h SER 254 Ca -0.48 0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 60.79 1hdu h SER 254 Cb 1.19 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 63.10 1hdu h SER 254 CO 0.65 0.57 -0.35 0.40 -0.87 0.00 0.00 176.83 177.23 1hdu h ILE 255 N 1.05 0.93 -0.17 0.95 5.03 -1.94 -0.16 117.51 123.21 1hdu h ILE 255 Ca 0.42 -1.35 -0.17 0.00 -0.12 0.00 0.00 64.86 63.64 1hdu h ILE 255 Cb 0.23 1.80 -0.00 0.00 -3.03 0.00 0.00 36.82 35.82 1hdu h ILE 255 CO -0.19 0.34 -0.59 0.44 -0.68 0.00 0.00 178.15 177.46 1hdu h ASP 256 N 0.00 0.62 -0.01 1.72 3.32 -1.90 -1.25 116.42 118.92 1hdu h ASP 256 Ca -0.00 -0.35 -0.00 0.00 0.02 0.00 0.00 57.03 56.69 1hdu h ASP 256 Cb 0.77 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.14 1hdu h ASP 256 CO 0.04 1.07 -0.00 -0.25 -1.72 0.00 0.00 179.24 178.39 1hdu h TRP 257 N 0.41 0.02 -0.46 4.55 7.01 -1.33 -1.82 115.95 124.34 1hdu h TRP 257 Ca -0.00 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.01 1hdu h TRP 257 Cb 1.15 -0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 28.18 1hdu h TRP 257 CO 0.05 0.40 0.29 0.66 -2.79 0.00 0.00 178.44 177.04 1hdu h SER 258 N -0.36 0.48 -0.83 2.65 4.64 -1.01 -1.68 113.55 117.44 1hdu h SER 258 Ca 0.00 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1hdu h SER 258 Cb 0.39 -0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 62.33 1hdu h SER 258 CO 0.00 0.34 0.51 0.22 -0.87 0.00 0.00 176.83 177.03 1hdu h TYR 259 N 0.58 1.09 0.00 4.77 3.20 -1.24 -0.30 116.97 125.07 1hdu h TYR 259 Ca 0.18 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.05 1hdu h TYR 259 Cb -0.03 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 37.88 1hdu h TYR 259 CO -0.06 0.72 0.00 0.09 -1.64 0.00 0.00 178.16 177.28 1hdu n ASN 260 N -4.45 0.22 -0.24 -2.11 3.02 -0.69 -1.21 115.26 109.79 1hdu n ASN 260 Ca 0.08 0.56 0.13 0.00 -0.03 0.00 0.00 54.58 55.32 1hdu n ASN 260 Cb 0.05 -0.60 0.41 0.00 -0.61 0.00 0.00 39.78 39.03 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 -1.75 0.86 0.00 3.52 -0.06 -0.16 -4.92 117.38 114.88 1hdu n GLN 261 Ca 0.03 -0.49 0.00 0.00 -2.00 0.00 0.00 57.00 54.54 1hdu n GLN 261 Cb 0.18 -1.49 0.00 0.00 -4.06 0.00 0.00 30.24 24.87 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 1.33 0.63 3.50 1.69 0.00 -0.35 -5.03 105.19 106.95 1hdu n GLY 262 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.00 4.27 0.17 -0.61 1.01 -0.97 -4.89 121.20 118.18 1hdu s ILE 263 Ca 0.00 -0.86 -0.15 0.00 0.00 0.00 0.00 60.65 59.64 1hdu s ILE 263 Cb 0.00 -4.87 0.08 0.00 0.01 0.00 0.00 42.46 37.68 1hdu s ILE 263 CO 0.00 -1.68 1.71 0.50 0.00 0.00 0.00 174.94 175.46 1hdu h LYS 264 N 9.43 0.15 -4.44 2.79 3.64 -1.85 -3.33 116.57 122.94 1hdu h LYS 264 Ca 0.04 -0.01 -0.74 0.00 -1.27 0.00 0.00 60.65 58.68 1hdu h LYS 264 Cb 1.03 -0.03 -0.15 0.00 -0.41 0.00 0.00 32.23 32.66 1hdu h LYS 264 CO 1.25 0.10 1.73 0.66 -2.27 0.00 0.00 179.45 180.91 1hdu n TYR 265 N -5.16 4.26 -3.82 1.91 4.01 -1.19 -4.93 117.16 112.24 1hdu n TYR 265 Ca 0.03 -3.12 -0.37 0.00 -0.16 0.00 0.00 57.90 54.29 1hdu n TYR 265 Cb 0.21 -2.18 -0.13 0.00 -0.31 0.00 0.00 39.34 36.94 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 2.37 5.04 0.10 7.72 0.01 -1.25 -0.88 113.70 126.82 1hdu s SER 266 Ca 0.43 -1.03 0.05 0.00 1.31 0.00 0.00 55.95 56.71 1hdu s SER 266 Cb 0.02 -1.81 -0.03 0.00 0.21 0.00 0.00 66.02 64.41 1hdu s SER 266 CO 0.01 -0.25 -0.13 -0.36 0.41 0.00 0.00 173.24 172.92 1hdu s PHE 267 N 1.38 1.23 -0.07 2.43 0.08 -0.60 -4.32 117.98 118.12 1hdu s PHE 267 Ca -0.01 -0.56 0.03 0.00 0.12 0.00 0.00 56.93 56.52 1hdu s PHE 267 Cb -0.19 -0.66 0.01 0.00 -0.57 0.00 0.00 43.02 41.61 1hdu s PHE 267 CO 0.01 0.07 -0.16 0.99 -0.10 0.00 0.00 175.22 176.03 1hdu s THR 268 N -1.96 1.43 -0.10 0.64 2.01 -0.34 -1.64 115.64 115.69 1hdu s THR 268 Ca 0.04 -0.67 -0.04 0.00 0.31 0.00 0.00 61.69 61.33 1hdu s THR 268 Cb -0.06 -1.26 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 1hdu s THR 268 CO 0.02 0.42 0.06 -0.36 -0.69 0.00 0.00 174.62 174.06 1hdu s PHE 269 N 0.40 3.34 -0.31 4.92 0.40 -0.95 -0.59 117.98 125.18 1hdu s PHE 269 Ca -0.12 0.32 0.02 0.00 -0.60 0.00 0.00 56.93 56.55 1hdu s PHE 269 Cb -0.15 -1.85 0.08 0.00 0.51 0.00 0.00 43.02 41.60 1hdu s PHE 269 CO 0.04 0.57 -0.00 -1.21 0.70 0.00 0.00 175.22 175.32 1hdu s GLU 270 N -0.92 2.03 0.37 0.44 0.41 0.09 -0.34 118.70 120.78 1hdu s GLU 270 Ca 0.14 -1.54 -0.06 0.00 -0.41 0.00 0.00 54.97 53.09 1hdu s GLU 270 Cb -0.12 -3.12 0.09 0.00 -1.78 0.00 0.00 34.13 29.20 1hdu s GLU 270 CO 0.03 -0.75 0.38 1.28 -0.49 0.00 0.00 175.26 175.71 1hdu n LEU 271 N 4.43 0.00 -4.72 1.80 4.32 0.27 -0.84 117.00 122.27 1hdu n LEU 271 Ca -0.07 -0.40 -0.33 0.00 -0.02 0.00 0.00 56.01 55.18 1hdu n LEU 271 Cb 0.42 -0.33 0.10 0.00 -1.62 0.00 0.00 43.42 42.00 1hdu n LEU 271 CO 0.24 -1.21 0.76 -0.13 -1.22 0.00 0.00 177.39 175.82 1hdu s ARG 272 N -3.84 2.02 0.00 3.23 0.52 -1.26 -1.80 118.95 117.82 1hdu s ARG 272 Ca 0.23 1.60 0.00 0.00 -0.52 0.00 0.00 55.73 57.04 1hdu s ARG 272 Cb -0.02 -1.84 0.00 0.00 0.52 0.00 0.00 34.95 33.62 1hdu s ARG 272 CO 0.17 -1.89 0.00 -0.40 0.02 0.00 0.00 175.30 173.21 1hdu n ASP 273 N -3.07 0.00 -0.75 0.23 5.68 -1.26 -4.69 116.55 112.69 1hdu n ASP 273 Ca 0.12 0.00 0.05 0.00 -0.50 0.00 0.00 54.79 54.46 1hdu n ASP 273 Cb 0.51 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.70 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 2.27 0.00 2.12 -2.24 -1.26 -0.94 114.28 114.23 1hdu n THR 274 Ca 0.00 -2.36 0.00 0.00 -2.27 0.00 0.00 64.05 59.42 1hdu n THR 274 Cb 0.00 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 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 -0.97 1.10 0.12 3.38 0.00 -1.26 -4.93 105.19 102.63 1hdu n GLY 275 Ca 0.23 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.08 0.00 1.61 2.43 -2.03 -3.32 114.38 112.99 1hdu h ARG 276 Ca 0.00 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 1hdu h ARG 276 Cb 0.00 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1hdu h ARG 276 CO 0.00 -0.06 -1.50 0.66 -1.51 0.00 0.00 179.97 177.56 1hdu n TYR 277 N -5.20 0.00 0.00 2.20 4.01 -1.26 -5.08 117.16 111.83 1hdu n TYR 277 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1hdu n TYR 277 Cb 0.13 -0.31 0.00 0.00 -0.31 0.00 0.00 39.34 38.85 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 2.18 4.03 0.26 2.72 0.00 -1.25 -1.50 105.19 111.62 1hdu n GLY 278 Ca -0.07 0.03 0.16 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.66 1.61 0.04 -1.93 -3.26 116.94 111.74 1hdu h PHE 279 Ca 0.00 0.00 -0.68 0.00 2.80 0.00 0.00 57.97 60.09 1hdu h PHE 279 Cb 0.00 0.00 -0.24 0.00 2.20 0.00 0.00 35.95 37.91 1hdu h PHE 279 CO 0.00 0.00 0.87 1.28 -0.60 0.00 0.00 178.31 179.86 1hdu n LEU 280 N -3.04 7.25 -4.73 1.54 4.77 -0.57 -4.55 117.00 117.68 1hdu n LEU 280 Ca 0.01 -4.57 -0.42 0.00 -0.03 0.00 0.00 56.01 51.00 1hdu n LEU 280 Cb 0.34 -1.11 -0.02 0.00 -2.33 0.00 0.00 43.42 40.30 1hdu n LEU 280 CO 0.28 1.72 1.27 -0.11 -1.33 0.00 0.00 177.39 179.22 1hdu n LEU 281 N -0.17 4.09 -4.76 2.23 0.00 -1.23 -4.88 117.00 112.29 1hdu n LEU 281 Ca 0.53 1.11 -0.39 0.00 0.00 0.00 0.00 56.01 57.26 1hdu n LEU 281 Cb 0.35 -1.57 0.02 0.00 0.00 0.00 0.00 43.42 42.22 1hdu n LEU 281 CO 0.48 0.10 1.00 -2.84 0.00 0.00 0.00 177.39 176.12 1hdu s PRO 282 N 0.13 3.52 0.59 1.96 0.02 -1.26 -4.88 135.00 135.08 1hdu s PRO 282 Ca 0.69 2.25 0.29 0.00 0.02 0.00 0.00 61.00 64.24 1hdu s PRO 282 Cb -0.52 -2.49 1.65 0.00 0.02 0.00 0.00 34.50 33.16 1hdu s PRO 282 CO 0.43 -0.89 2.10 0.00 -0.33 0.00 0.00 177.00 178.31 1hdu h ALA 283 N 2.02 1.81 0.00 -1.55 0.00 -1.91 -0.98 119.26 118.65 1hdu h ALA 283 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1hdu h ALA 283 Cb 1.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1hdu h ALA 283 CO 0.60 -0.29 0.00 -1.13 0.00 0.00 0.00 179.25 178.42 1hdu n SER 284 N -3.81 0.00 -0.66 0.00 3.41 -1.26 -2.19 113.62 109.10 1hdu n SER 284 Ca 0.02 0.32 0.09 0.00 -0.26 0.00 0.00 58.87 59.04 1hdu n SER 284 Cb 0.32 -0.41 0.07 0.00 -0.26 0.00 0.00 64.21 63.93 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 -1.41 1.43 0.36 4.33 6.02 -0.37 -4.64 117.38 123.11 1hdu n GLN 285 Ca 0.04 -1.46 -0.19 0.00 -0.01 0.00 0.00 57.00 55.38 1hdu n GLN 285 Cb 0.13 -1.33 -0.09 0.00 1.02 0.00 0.00 30.24 29.97 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 3.25 0.08 -0.14 5.09 2.04 -1.57 -1.17 117.51 125.09 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 0.71 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 1hdu h ILE 286 CO 0.00 0.00 0.09 0.40 0.00 0.00 0.00 178.15 178.64 1hdu h ILE 287 N -1.06 1.06 -0.73 -0.67 2.04 -1.82 -0.67 117.51 115.65 1hdu h ILE 287 Ca -0.08 -0.14 0.05 0.00 1.00 0.00 0.00 64.86 65.69 1hdu h ILE 287 Cb 0.88 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.80 1hdu h ILE 287 CO 0.05 0.05 0.44 -0.65 0.00 0.00 0.00 178.15 178.04 1hdu h PRO 288 N 0.17 0.81 -0.24 2.37 0.11 -1.82 0.15 132.00 133.55 1hdu h PRO 288 Ca 0.05 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 1hdu h PRO 288 Cb 0.01 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 1hdu h PRO 288 CO -0.01 0.54 0.11 1.15 -0.21 0.00 0.00 178.00 179.58 1hdu h THR 289 N 0.83 1.15 -0.62 -1.15 2.02 -0.99 -1.94 112.91 112.21 1hdu h THR 289 Ca 0.31 -0.43 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 1hdu h THR 289 Cb 0.11 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 1hdu h THR 289 CO -0.15 0.15 0.15 0.00 0.37 0.00 0.00 175.52 176.04 1hdu h ALA 290 N 0.97 1.10 -0.25 6.16 0.00 -0.70 -1.14 119.26 125.40 1hdu h ALA 290 Ca 0.08 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1hdu h ALA 290 Cb 0.13 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1hdu h ALA 290 CO -0.01 0.60 0.09 1.96 0.00 0.00 0.00 179.25 181.90 1hdu h GLN 291 N 0.93 0.37 -0.13 0.00 4.20 -0.47 -1.42 115.11 118.59 1hdu h GLN 291 Ca 0.20 -0.07 -0.19 0.00 0.06 0.00 0.00 58.65 58.65 1hdu h GLN 291 Cb 0.33 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 1hdu h GLN 291 CO -0.00 0.42 -0.70 1.05 -0.67 0.00 0.00 178.83 178.93 1hdu h GLU 292 N 0.24 0.57 -0.44 1.46 4.11 -1.28 -3.08 114.58 116.17 1hdu h GLU 292 Ca 0.08 -0.44 -0.05 0.00 0.07 0.00 0.00 59.36 59.02 1hdu h GLU 292 Cb 0.19 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1hdu h GLU 292 CO -0.01 1.06 0.05 0.00 0.07 0.00 0.00 179.01 180.19 1hdu h THR 293 N 0.40 1.21 -0.96 -1.06 1.03 -1.17 -2.40 112.91 109.96 1hdu h THR 293 Ca -0.03 -0.83 0.04 0.00 -0.01 0.00 0.00 66.41 65.58 1hdu h THR 293 Cb 1.29 0.83 -0.06 0.00 -1.07 0.00 0.00 68.15 69.14 1hdu h THR 293 CO 0.13 0.29 0.63 -0.25 -0.01 0.00 0.00 175.52 176.31 1hdu h TRP 294 N 0.65 1.17 -0.39 0.00 -0.00 -1.17 0.02 115.95 116.24 1hdu h TRP 294 Ca 0.14 0.03 -0.05 0.00 -0.00 0.00 0.00 58.89 59.01 1hdu h TRP 294 Cb 0.33 -0.39 -0.02 0.00 -0.00 0.00 0.00 29.16 29.08 1hdu h TRP 294 CO 0.02 0.67 0.04 -0.07 -0.00 0.00 0.00 178.44 179.09 1hdu h LEU 295 N 1.21 0.56 -0.23 0.65 3.38 -1.43 0.11 115.31 119.56 1hdu h LEU 295 Ca 0.39 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.16 1hdu h LEU 295 Cb 0.02 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1hdu h LEU 295 CO -0.13 0.61 -0.21 1.23 0.09 0.00 0.00 178.44 180.03 1hdu h GLY 296 N 0.86 0.60 1.04 0.83 0.00 -1.03 -2.48 103.07 102.90 1hdu h GLY 296 Ca 0.13 -0.61 -0.11 0.00 0.00 0.00 0.00 47.33 46.74 1hdu h GLY 296 CO 0.01 0.55 -0.14 -2.08 0.00 0.00 0.00 176.54 174.88 1hdu h VAL 297 N 0.25 1.27 -0.73 4.60 2.07 -0.76 -2.93 116.25 120.03 1hdu h VAL 297 Ca 0.04 -1.27 0.04 0.00 0.82 0.00 0.00 66.70 66.33 1hdu h VAL 297 Cb 0.76 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.62 1hdu h VAL 297 CO 0.05 0.44 0.45 0.25 0.02 0.00 0.00 177.57 178.78 1hdu h LEU 298 N 0.74 0.72 -0.67 2.57 6.46 -0.81 -1.03 115.31 123.30 1hdu h LEU 298 Ca 0.11 0.01 0.07 0.00 -0.12 0.00 0.00 57.88 57.95 1hdu h LEU 298 Cb 0.69 -0.15 -0.06 0.00 -0.73 0.00 0.00 40.66 40.42 1hdu h LEU 298 CO 0.05 0.49 0.36 0.74 -0.62 0.00 0.00 178.44 179.46 1hdu h THR 299 N 0.86 0.93 -0.41 1.05 2.02 -1.28 0.10 112.91 116.18 1hdu h THR 299 Ca 0.30 -0.22 -0.08 0.00 0.77 0.00 0.00 66.41 67.18 1hdu h THR 299 Cb 0.07 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 1hdu h THR 299 CO -0.13 0.12 -0.04 0.40 0.37 0.00 0.00 175.52 176.23 1hdu h ILE 300 N 0.65 1.27 -0.71 3.11 2.04 -1.21 -2.76 117.51 119.90 1hdu h ILE 300 Ca 0.31 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1hdu h ILE 300 Cb 0.23 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1hdu h ILE 300 CO -0.20 0.37 0.46 0.24 0.00 0.00 0.00 178.15 179.02 1hdu h MET 301 N 0.58 0.94 -0.84 2.37 2.86 -0.58 -1.97 114.93 118.30 1hdu h MET 301 Ca 0.11 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1hdu h MET 301 Cb 0.55 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 31.96 1hdu h MET 301 CO 0.03 0.64 0.49 0.93 1.06 0.00 0.00 176.91 180.06 1hdu h GLU 302 N 0.96 1.14 0.00 1.72 5.08 -0.90 -1.32 114.58 121.26 1hdu h GLU 302 Ca 0.26 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 1hdu h GLU 302 Cb -0.09 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 28.91 1hdu h GLU 302 CO -0.05 0.81 -0.40 1.25 -1.00 0.00 0.00 179.01 179.62 1hdu h HIS 303 N 1.16 0.00 -0.26 4.33 2.76 -1.16 -2.91 115.15 119.07 1hdu h HIS 303 Ca 0.30 0.00 -0.19 0.00 -2.20 0.00 0.00 60.37 58.28 1hdu h HIS 303 Cb -0.03 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.94 1hdu h HIS 303 CO 0.01 0.40 -0.59 1.15 -1.30 0.00 0.00 177.93 177.60 1hdu h THR 304 N 0.00 1.28 -0.36 6.26 2.02 -0.52 -2.75 112.91 118.84 1hdu h THR 304 Ca -0.00 -1.78 -0.05 0.00 0.77 0.00 0.00 66.41 65.34 1hdu h THR 304 Cb 0.77 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.87 1hdu h THR 304 CO 0.05 0.58 0.02 0.58 0.37 0.00 0.00 175.52 177.11 1hdu h VAL 305 N 0.63 1.25 -0.04 3.16 2.07 -1.21 -2.72 116.25 119.39 1hdu h VAL 305 Ca 0.00 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.58 1hdu h VAL 305 Cb 1.20 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.13 1hdu h VAL 305 CO 0.13 0.31 0.00 0.59 0.02 0.00 0.00 177.57 178.62 1hdu n ASN 306 N -4.52 0.32 0.00 0.57 4.13 -1.11 -5.13 115.26 109.52 1hdu n ASN 306 Ca -0.02 -1.61 0.00 0.00 1.68 0.00 0.00 54.58 54.63 1hdu n ASN 306 Cb 0.26 -0.03 0.00 0.00 -1.54 0.00 0.00 39.78 38.47 1hdu n ASN 306 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13