#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 2.40 0.00 0.00 0.63 -1.26 -4.96 116.66 113.46 1hdu n ARG 2 Ca 0.00 -4.42 0.00 0.00 -0.92 0.00 0.00 57.85 52.51 1hdu n ARG 2 Cb 0.00 -2.06 0.00 0.00 0.45 0.00 0.00 32.46 30.85 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 0.44 0.00 0.19 6.15 2.88 -1.26 -4.93 113.62 117.09 1hdu n SER 3 Ca 0.29 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.96 1hdu n SER 3 Cb 0.45 0.00 0.68 0.00 -0.75 0.00 0.00 64.21 64.58 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 -1.93 0.34 112.91 115.13 1hdu h THR 4 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1hdu h THR 4 Cb 0.00 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 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 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1hdu h ASN 5 CO 0.00 0.00 -0.88 0.41 -1.65 0.00 0.00 177.43 175.31 1hdu n THR 6 N -2.86 0.00 -1.97 2.81 -1.04 0.07 -4.98 114.28 106.32 1hdu n THR 6 Ca 0.04 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.05 61.58 1hdu n THR 6 Cb 0.48 1.01 -0.01 0.00 -1.82 0.00 0.00 70.33 69.98 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 -2.78 2.87 -0.65 -1.42 2.19 -1.00 -4.08 117.98 113.12 1hdu s PHE 7 Ca 0.07 1.22 -0.23 0.00 0.33 0.00 0.00 56.93 58.32 1hdu s PHE 7 Cb 0.14 -3.84 0.06 0.00 -1.31 0.00 0.00 43.02 38.07 1hdu s PHE 7 CO 0.77 -2.50 1.00 1.21 1.83 0.00 0.00 175.22 177.53 1hdu s ASN 8 N -0.15 6.20 0.16 6.13 3.84 -1.26 -4.88 114.94 124.99 1hdu s ASN 8 Ca 0.53 -0.79 0.27 0.00 0.21 0.00 0.00 52.86 53.07 1hdu s ASN 8 Cb -0.43 -2.44 0.91 0.00 -0.55 0.00 0.00 41.25 38.74 1hdu s ASN 8 CO 0.54 -1.45 1.81 -1.22 -2.79 0.00 0.00 177.10 174.00 1hdu n TYR 9 N 7.86 0.72 -0.38 0.43 4.01 -1.26 -3.74 117.16 124.80 1hdu n TYR 9 Ca -0.02 0.21 -0.05 0.00 -0.16 0.00 0.00 57.90 57.88 1hdu n TYR 9 Cb 0.46 -0.84 0.20 0.00 -0.31 0.00 0.00 39.34 38.85 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 -1.72 3.98 -2.44 -0.72 0.00 -1.26 -4.67 120.51 113.67 1hdu n ALA 10 Ca 0.06 -1.60 -0.08 0.00 0.00 0.00 0.00 53.44 51.81 1hdu n ALA 10 Cb 0.41 -1.19 -0.08 0.00 0.00 0.00 0.00 19.45 18.59 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 -2.21 0.15 0.18 0.00 -1.32 -1.24 -4.60 115.64 106.60 1hdu s THR 11 Ca 0.38 -1.38 -0.22 0.00 -1.21 0.00 0.00 61.69 59.26 1hdu s THR 11 Cb 0.30 -1.47 -0.08 0.00 -1.51 0.00 0.00 72.50 69.74 1hdu s THR 11 CO 0.09 -0.68 0.73 -0.31 -2.21 0.00 0.00 174.62 172.23 1hdu s TYR 12 N -3.89 3.77 0.35 9.09 2.02 -1.26 -5.03 117.35 122.39 1hdu s TYR 12 Ca 0.08 1.47 0.09 0.00 -0.37 0.00 0.00 57.07 58.34 1hdu s TYR 12 Cb 0.06 -2.66 -0.06 0.00 -0.40 0.00 0.00 41.96 38.89 1hdu s TYR 12 CO -0.09 0.44 -0.05 -1.01 -1.57 0.00 0.00 175.55 173.26 1hdu s HIS 13 N -1.33 2.46 0.69 2.71 3.76 -1.26 -5.15 115.29 117.17 1hdu s HIS 13 Ca 0.38 -0.50 -0.05 0.00 -0.15 0.00 0.00 55.06 54.75 1hdu s HIS 13 Cb -0.19 -1.46 0.08 0.00 1.11 0.00 0.00 32.58 32.11 1hdu s HIS 13 CO 0.23 0.54 0.98 0.95 -0.85 0.00 0.00 174.74 176.59 1hdu s THR 14 N -2.59 2.32 0.14 1.30 -4.23 -1.26 -4.93 115.64 106.39 1hdu s THR 14 Ca 0.34 -0.38 -0.17 0.00 -1.18 0.00 0.00 61.69 60.29 1hdu s THR 14 Cb 0.02 -2.93 -0.00 0.00 1.34 0.00 0.00 72.50 70.93 1hdu s THR 14 CO 0.18 0.00 1.78 0.25 -0.54 0.00 0.00 174.62 176.29 1hdu h LEU 15 N -0.52 0.44 -0.93 4.79 7.12 -1.97 -2.33 115.31 121.90 1hdu h LEU 15 Ca -0.43 -0.04 0.02 0.00 0.13 0.00 0.00 57.88 57.56 1hdu h LEU 15 Cb 1.30 -0.11 -0.05 0.00 -0.53 0.00 0.00 40.66 41.27 1hdu h LEU 15 CO 0.54 0.35 0.61 0.44 -0.13 0.00 0.00 178.44 180.25 1hdu h ASP 16 N 0.49 1.05 -0.31 1.25 3.32 -1.99 -1.07 116.42 119.15 1hdu h ASP 16 Ca 0.13 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.08 1hdu h ASP 16 Cb -0.01 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 1hdu h ASP 16 CO -0.03 0.75 -0.08 -0.33 -1.72 0.00 0.00 179.24 177.84 1hdu h GLU 17 N 1.23 0.72 -0.24 3.56 5.08 -1.88 -0.74 114.58 122.31 1hdu h GLU 17 Ca 0.35 -0.21 -0.15 0.00 -1.00 0.00 0.00 59.36 58.34 1hdu h GLU 17 Cb -0.10 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.07 1hdu h GLU 17 CO -0.09 0.78 -0.44 0.82 -1.00 0.00 0.00 179.01 179.08 1hdu h ILE 18 N 0.66 1.31 -0.35 3.13 2.04 -0.99 -1.48 117.51 121.82 1hdu h ILE 18 Ca 0.12 -1.65 -0.06 0.00 1.00 0.00 0.00 64.86 64.27 1hdu h ILE 18 Cb 0.52 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 1hdu h ILE 18 CO 0.03 0.52 -0.05 1.88 0.00 0.00 0.00 178.15 180.53 1hdu h TYR 19 N 0.44 0.61 -0.37 1.37 -1.99 -1.04 -2.01 116.97 113.98 1hdu h TYR 19 Ca 0.01 -0.08 -0.14 0.00 2.00 0.00 0.00 58.73 60.52 1hdu h TYR 19 Cb 1.04 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 39.59 1hdu h TYR 19 CO 0.08 0.62 -0.32 -0.44 -0.00 0.00 0.00 178.16 178.11 1hdu h ASP 20 N 0.54 0.86 -0.92 3.88 3.32 -1.04 -2.93 116.42 120.12 1hdu h ASP 20 Ca 0.11 -0.36 0.05 0.00 0.02 0.00 0.00 57.03 56.85 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 1.11 0.59 0.15 -1.72 0.00 0.00 179.24 179.39 1hdu h PHE 21 N 0.69 1.10 -0.72 4.55 3.57 -0.64 -1.60 116.94 123.89 1hdu h PHE 21 Ca 0.07 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1hdu h PHE 21 Cb 0.87 -0.36 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 1hdu h PHE 21 CO 0.05 0.59 0.44 0.52 -2.23 0.00 0.00 178.31 177.68 1hdu h MET 22 N 1.10 0.97 -0.65 1.11 2.86 -1.21 -0.28 114.93 118.84 1hdu h MET 22 Ca 0.39 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.86 1hdu h MET 22 Cb 0.10 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.53 1hdu h MET 22 CO -0.15 0.68 0.08 -0.44 1.06 0.00 0.00 176.91 178.14 1hdu h ASP 23 N 0.98 1.05 -0.12 1.22 3.32 -1.24 -1.86 116.42 119.77 1hdu h ASP 23 Ca 0.26 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1hdu h ASP 23 Cb -0.04 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.22 1hdu h ASP 23 CO -0.05 1.05 0.02 -0.07 -1.72 0.00 0.00 179.24 178.47 1hdu h LEU 24 N 1.01 0.19 -0.40 1.55 3.38 -0.95 -1.32 115.31 118.78 1hdu h LEU 24 Ca 0.20 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 57.94 1hdu h LEU 24 Cb 0.46 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1hdu h LEU 24 CO 0.02 0.41 0.16 0.25 0.09 0.00 0.00 178.44 179.36 1hdu h LEU 25 N -0.04 0.19 -0.85 1.67 5.85 -0.94 -0.75 115.31 120.44 1hdu h LEU 25 Ca 0.04 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1hdu h LEU 25 Cb 0.30 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1hdu h LEU 25 CO 0.00 0.15 0.42 0.58 -0.34 0.00 0.00 178.44 179.25 1hdu h VAL 26 N 0.33 1.26 0.00 1.05 2.07 -1.29 -0.62 116.25 119.05 1hdu h VAL 26 Ca 0.18 -0.70 -0.05 0.00 0.82 0.00 0.00 66.70 66.95 1hdu h VAL 26 Cb 0.14 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1hdu h VAL 26 CO -0.17 0.31 -0.23 0.00 0.02 0.00 0.00 177.57 177.50 1hdu h ALA 27 N 1.23 1.41 0.00 1.67 0.00 -0.57 -2.62 119.26 120.37 1hdu h ALA 27 Ca 0.29 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 1hdu h ALA 27 Cb 0.10 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1hdu h ALA 27 CO -0.04 0.29 -1.34 1.96 0.00 0.00 0.00 179.25 180.12 1hdu h GLN 28 N 0.00 0.00 -2.08 0.00 4.20 -0.52 -3.40 115.11 113.30 1hdu h GLN 28 Ca -0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 1hdu h GLN 28 Cb 0.47 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 27.85 1hdu h GLN 28 CO 0.03 0.41 -0.99 0.72 -0.67 0.00 0.00 178.83 178.32 1hdu n HIS 29 N -2.99 1.23 -0.23 2.96 8.25 -0.30 -4.96 115.22 119.17 1hdu n HIS 29 Ca -0.09 -3.83 0.08 0.00 -0.26 0.00 0.00 57.72 53.62 1hdu n HIS 29 Cb 0.88 -0.43 0.34 0.00 1.12 0.00 0.00 29.99 31.90 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 3.39 0.76 -0.00 -0.41 0.11 -1.70 -0.85 132.00 133.30 1hdu h PRO 30 Ca 0.11 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1hdu h PRO 30 Cb 0.82 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.75 1hdu h PRO 30 CO 0.59 0.51 -0.03 0.39 -0.21 0.00 0.00 178.00 179.25 1hdu n GLU 31 N -4.50 0.54 -0.01 1.05 -0.58 -1.26 -4.16 120.64 111.72 1hdu n GLU 31 Ca 0.13 -0.05 -0.01 0.00 -0.42 0.00 0.00 57.16 56.81 1hdu n GLU 31 Cb 0.30 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.66 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 -1.18 2.26 -4.14 -4.62 7.94 -0.83 -4.73 117.00 111.70 1hdu n LEU 32 Ca 0.15 -0.01 -0.22 0.00 -1.11 0.00 0.00 56.01 54.83 1hdu n LEU 32 Cb 0.24 -0.04 -0.14 0.00 0.53 0.00 0.00 43.42 44.01 1hdu n LEU 32 CO 0.23 0.41 -0.48 0.54 -1.11 0.00 0.00 177.39 176.98 1hdu s VAL 33 N -2.04 1.18 0.06 1.96 0.11 -0.39 -1.21 120.40 120.08 1hdu s VAL 33 Ca -0.02 -0.84 0.02 0.00 -2.93 0.00 0.00 61.98 58.21 1hdu s VAL 33 Cb 0.01 -1.02 -0.03 0.00 -1.53 0.00 0.00 36.38 33.80 1hdu s VAL 33 CO 0.05 0.17 -0.08 -0.94 -3.33 0.00 0.00 175.10 170.97 1hdu s SER 34 N -0.77 0.99 -0.20 3.54 1.04 -0.86 -4.53 113.70 112.92 1hdu s SER 34 Ca 0.04 -0.73 -0.07 0.00 0.48 0.00 0.00 55.95 55.68 1hdu s SER 34 Cb -0.07 0.06 -0.03 0.00 0.10 0.00 0.00 66.02 66.07 1hdu s SER 34 CO 0.00 -0.30 0.04 -0.75 0.98 0.00 0.00 173.24 173.22 1hdu s LYS 35 N -2.46 3.79 -0.04 4.02 2.20 -1.26 -1.00 119.74 124.99 1hdu s LYS 35 Ca -0.01 -0.43 0.05 0.00 -0.36 0.00 0.00 55.97 55.22 1hdu s LYS 35 Cb -0.04 -3.19 -0.02 0.00 -1.51 0.00 0.00 37.83 33.07 1hdu s LYS 35 CO -0.02 0.10 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.38 1hdu s LEU 36 N 0.82 2.49 -0.36 5.43 1.43 -0.02 -4.97 118.68 123.51 1hdu s LEU 36 Ca 0.02 -0.29 -0.12 0.00 -1.03 0.00 0.00 54.13 52.71 1hdu s LEU 36 Cb -0.14 -1.48 0.00 0.00 0.03 0.00 0.00 46.19 44.61 1hdu s LEU 36 CO 0.02 0.33 0.23 -1.58 0.23 0.00 0.00 176.35 175.59 1hdu s GLN 37 N -0.67 3.18 0.00 1.70 0.74 -1.26 -0.52 119.66 122.82 1hdu s GLN 37 Ca 0.11 -0.85 0.23 0.00 0.05 0.00 0.00 55.36 54.89 1hdu s GLN 37 Cb -0.10 -3.78 0.56 0.00 1.10 0.00 0.00 33.01 30.78 1hdu s GLN 37 CO 0.00 -0.57 1.46 0.44 -0.55 0.00 0.00 175.29 176.07 1hdu n ILE 38 N 5.07 0.26 -2.78 -2.34 -5.35 -0.39 -5.00 119.36 108.84 1hdu n ILE 38 Ca -0.12 -0.52 0.00 0.00 -0.27 0.00 0.00 62.75 61.84 1hdu n ILE 38 Cb 0.48 0.82 0.00 0.00 -1.74 0.00 0.00 39.64 39.20 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 1.32 -1.70 3.13 3.28 0.00 -1.25 -4.80 105.19 105.18 1hdu n GLY 39 Ca 0.17 -1.29 -0.22 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.99 1.10 1.17 1.61 0.52 -1.26 -0.38 118.95 119.73 1hdu s ARG 40 Ca 0.00 -0.63 -0.16 0.00 -0.52 0.00 0.00 55.73 54.41 1hdu s ARG 40 Cb 0.00 -1.09 0.27 0.00 0.52 0.00 0.00 34.95 34.65 1hdu s ARG 40 CO 0.00 0.29 1.06 -1.54 0.02 0.00 0.00 175.30 175.12 1hdu s SER 41 N -0.69 1.07 0.24 0.23 1.04 0.92 -4.75 113.70 111.76 1hdu s SER 41 Ca 0.04 1.01 -0.06 0.00 0.48 0.00 0.00 55.95 57.42 1hdu s SER 41 Cb -0.07 -1.52 0.35 0.00 0.10 0.00 0.00 66.02 64.88 1hdu s SER 41 CO 0.00 -4.07 1.82 0.22 0.98 0.00 0.00 173.24 172.19 1hdu h TYR 42 N -2.54 0.84 -0.22 5.02 3.20 -1.96 -0.57 116.97 120.74 1hdu h TYR 42 Ca -0.52 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.38 1hdu h TYR 42 Cb 1.32 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.33 1hdu h TYR 42 CO -1.06 0.37 0.00 0.39 -1.64 0.00 0.00 178.16 176.22 1hdu n GLU 43 N -4.73 1.78 -0.72 1.82 1.02 -1.26 -4.90 120.64 113.65 1hdu n GLU 43 Ca 0.12 -0.90 0.00 0.00 -0.02 0.00 0.00 57.16 56.36 1hdu n GLU 43 Cb 0.23 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 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 0.65 0.70 3.76 0.62 0.00 -0.22 -5.05 105.19 105.65 1hdu n GLY 44 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.28 4.66 0.33 1.61 0.52 -1.26 -4.65 118.95 119.88 1hdu s ARG 45 Ca 0.00 1.59 -0.29 0.00 -0.52 0.00 0.00 55.73 56.52 1hdu s ARG 45 Cb 0.00 -3.10 -0.10 0.00 0.52 0.00 0.00 34.95 32.27 1hdu s ARG 45 CO 0.00 0.29 1.29 -1.25 0.02 0.00 0.00 175.30 175.65 1hdu s PRO 46 N -1.55 4.36 -0.31 3.54 0.04 -1.26 -0.06 135.00 139.76 1hdu s PRO 46 Ca 0.45 2.17 -0.10 0.00 0.04 0.00 0.00 61.00 63.57 1hdu s PRO 46 Cb -0.27 -3.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.20 1hdu s PRO 46 CO 0.34 -0.17 0.16 0.42 0.04 0.00 0.00 177.00 177.79 1hdu s ILE 47 N -1.15 4.73 0.02 0.56 1.01 0.49 -4.83 121.20 122.03 1hdu s ILE 47 Ca 0.49 -0.34 0.03 0.00 0.00 0.00 0.00 60.65 60.82 1hdu s ILE 47 Cb -0.39 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 1hdu s ILE 47 CO 0.52 0.08 -0.01 -0.31 0.00 0.00 0.00 174.94 175.22 1hdu s TYR 48 N 1.64 3.02 -0.03 3.97 2.02 -1.26 -1.26 117.35 125.44 1hdu s TYR 48 Ca 0.05 0.03 0.04 0.00 -0.37 0.00 0.00 57.07 56.82 1hdu s TYR 48 Cb -0.17 -1.62 -0.00 0.00 -0.40 0.00 0.00 41.96 39.76 1hdu s TYR 48 CO 0.07 0.45 -0.14 0.08 -1.57 0.00 0.00 175.55 174.44 1hdu s VAL 49 N -1.13 1.14 -0.19 0.71 1.01 0.32 -4.51 120.40 117.75 1hdu s VAL 49 Ca 0.21 -0.57 -0.12 0.00 0.00 0.00 0.00 61.98 61.50 1hdu s VAL 49 Cb -0.11 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 1hdu s VAL 49 CO 0.12 0.34 0.21 -0.76 0.00 0.00 0.00 175.10 175.01 1hdu s LEU 50 N 0.06 4.20 -0.27 3.92 1.43 0.28 -0.84 118.68 127.47 1hdu s LEU 50 Ca -0.02 0.33 -0.07 0.00 -1.03 0.00 0.00 54.13 53.34 1hdu s LEU 50 Cb -0.10 -2.23 -0.01 0.00 0.03 0.00 0.00 46.19 43.89 1hdu s LEU 50 CO 0.01 0.11 0.07 -0.75 0.23 0.00 0.00 176.35 176.03 1hdu s LYS 51 N 0.58 3.40 -0.26 1.70 2.20 -0.17 -0.50 119.74 126.69 1hdu s LYS 51 Ca 0.12 -0.65 -0.09 0.00 -0.36 0.00 0.00 55.97 54.99 1hdu s LYS 51 Cb -0.12 -3.34 -0.04 0.00 -1.51 0.00 0.00 37.83 32.82 1hdu s LYS 51 CO 0.02 -0.30 0.13 -0.06 -0.36 0.00 0.00 175.35 174.77 1hdu s PHE 52 N 1.56 3.17 -0.03 4.03 0.40 0.25 -2.03 117.98 125.34 1hdu s PHE 52 Ca 0.05 -0.10 -0.22 0.00 -0.60 0.00 0.00 56.93 56.06 1hdu s PHE 52 Cb -0.16 -2.29 0.04 0.00 0.51 0.00 0.00 43.02 41.13 1hdu s PHE 52 CO 0.03 -0.20 0.47 0.45 0.70 0.00 0.00 175.22 176.68 1hdu s SER 53 N 1.52 -0.40 0.00 1.36 0.15 -0.35 -1.40 113.70 114.58 1hdu s SER 53 Ca 0.06 0.36 0.12 0.00 0.70 0.00 0.00 55.95 57.20 1hdu s SER 53 Cb -0.15 0.41 0.16 0.00 -1.71 0.00 0.00 66.02 64.73 1hdu s SER 53 CO 0.07 -0.52 0.99 1.07 1.20 0.00 0.00 173.24 176.04 1hdu n THR 54 N 1.10 0.28 -0.45 6.45 5.66 -1.26 -4.38 114.28 121.67 1hdu n THR 54 Ca -0.20 -0.64 0.00 0.00 -3.05 0.00 0.00 64.05 60.16 1hdu n THR 54 Cb 0.56 1.05 0.00 0.00 -1.55 0.00 0.00 70.33 70.39 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 0.66 0.72 0.00 1.09 0.00 -1.26 -5.10 105.19 101.30 1hdu n GLY 55 Ca 0.09 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.91 0.00 -0.02 0.00 -1.26 -4.82 105.19 97.18 1hdu n GLY 56 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.51 1hdu n GLY 56 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hdu n SER 57 N -2.37 0.00 -3.09 1.61 3.41 -1.26 -4.81 113.62 107.10 1hdu n SER 57 Ca 0.00 0.17 -0.22 0.00 -0.26 0.00 0.00 58.87 58.57 1hdu n SER 57 Cb 0.00 -0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 63.57 1hdu n SER 57 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1hdu n ASN 58 N -1.85 2.25 -4.69 4.04 5.15 -1.26 -5.11 115.26 113.79 1hdu n ASN 58 Ca 0.00 -3.27 -0.37 0.00 -0.60 0.00 0.00 54.58 50.34 1hdu n ASN 58 Cb 0.00 -0.60 0.08 0.00 -0.53 0.00 0.00 39.78 38.73 1hdu n ASN 58 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1hdu n ARG 59 N 0.09 0.90 -1.66 1.20 1.74 -1.26 -4.90 116.66 112.77 1hdu n ARG 59 Ca 0.27 0.37 -0.41 0.00 -0.77 0.00 0.00 57.85 57.31 1hdu n ARG 59 Cb 0.55 -2.43 0.02 0.00 -1.02 0.00 0.00 32.46 29.59 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 -1.90 1.61 -4.33 5.56 -0.04 -1.26 -4.58 135.00 130.06 1hdu n PRO 60 Ca 0.15 0.58 -0.18 0.00 -0.04 0.00 0.00 63.50 64.01 1hdu n PRO 60 Cb 0.48 -2.25 -0.10 0.00 -0.04 0.00 0.00 33.50 31.59 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 -1.26 1.90 -0.13 0.55 0.00 -0.47 -2.05 121.76 120.31 1hdu s ALA 61 Ca 0.64 -1.67 0.01 0.00 0.00 0.00 0.00 51.96 50.94 1hdu s ALA 61 Cb -0.51 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 1hdu s ALA 61 CO 0.56 -0.03 -0.17 0.42 0.00 0.00 0.00 175.76 176.54 1hdu s ILE 62 N -3.12 2.70 -0.13 0.00 -1.09 -0.54 -0.10 121.20 118.93 1hdu s ILE 62 Ca 0.23 -0.78 -0.04 0.00 -2.23 0.00 0.00 60.65 57.82 1hdu s ILE 62 Cb 0.01 -2.11 -0.04 0.00 -1.58 0.00 0.00 42.46 38.75 1hdu s ILE 62 CO 0.06 0.53 0.03 0.86 -1.23 0.00 0.00 174.94 175.19 1hdu s TRP 63 N 0.43 3.21 -0.06 3.97 -0.11 0.14 -0.95 118.94 125.57 1hdu s TRP 63 Ca -0.12 0.11 -0.02 0.00 1.22 0.00 0.00 56.10 57.29 1hdu s TRP 63 Cb -0.16 -1.92 0.03 0.00 -1.50 0.00 0.00 33.47 29.91 1hdu s TRP 63 CO 0.06 0.32 0.03 0.42 -4.62 0.00 0.00 176.95 173.15 1hdu s ILE 64 N -0.31 0.15 0.07 5.86 1.01 -0.53 0.15 121.20 127.60 1hdu s ILE 64 Ca 0.07 0.26 0.09 0.00 0.00 0.00 0.00 60.65 61.07 1hdu s ILE 64 Cb -0.12 -0.35 -0.03 0.00 0.01 0.00 0.00 42.46 41.97 1hdu s ILE 64 CO 0.02 0.22 -0.23 1.51 0.00 0.00 0.00 174.94 176.46 1hdu s ASP 65 N 2.02 2.80 0.08 3.58 1.47 -0.11 -1.17 116.67 125.34 1hdu s ASP 65 Ca 0.04 -0.61 0.01 0.00 1.18 0.00 0.00 52.55 53.17 1hdu s ASP 65 Cb -0.12 -0.21 -0.04 0.00 -0.34 0.00 0.00 42.92 42.20 1hdu s ASP 65 CO -0.04 0.17 -0.06 -0.76 0.68 0.00 0.00 175.17 175.16 1hdu s LEU 66 N -1.50 2.49 -1.19 2.11 1.02 -0.32 -0.55 118.68 120.73 1hdu s LEU 66 Ca 0.09 -0.97 0.00 0.00 0.02 0.00 0.00 54.13 53.28 1hdu s LEU 66 Cb -0.10 -0.03 0.00 0.00 0.02 0.00 0.00 46.19 46.09 1hdu s LEU 66 CO 0.03 -0.47 0.00 0.61 0.02 0.00 0.00 176.35 176.54 1hdu n GLY 67 N 0.11 0.99 0.24 -3.19 0.00 -1.25 -2.26 105.19 99.83 1hdu n GLY 67 Ca -0.13 -0.47 0.08 0.00 0.00 0.00 0.00 46.02 45.50 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 1.00 -3.64 -0.61 2.10 -1.90 -3.05 117.51 111.40 1hdu h ILE 68 Ca -0.25 -0.35 -0.70 0.00 1.08 0.00 0.00 64.86 64.64 1hdu h ILE 68 Cb 0.86 1.19 -0.27 0.00 -1.09 0.00 0.00 36.82 37.51 1hdu h ILE 68 CO 0.35 0.10 -0.57 -1.00 -1.08 0.00 0.00 178.15 175.94 1hdu s HIS 69 N -4.76 3.25 0.33 2.19 3.76 -1.26 -4.55 115.29 114.26 1hdu s HIS 69 Ca -0.04 -1.28 0.09 0.00 -0.15 0.00 0.00 55.06 53.68 1hdu s HIS 69 Cb 0.16 -2.34 0.84 0.00 1.11 0.00 0.00 32.58 32.35 1hdu s HIS 69 CO 0.67 -0.71 1.78 0.66 -0.85 0.00 0.00 174.74 176.29 1hdu h SER 70 N 8.29 0.69 0.64 1.40 4.64 -1.65 -2.59 113.55 124.97 1hdu h SER 70 Ca -0.24 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1hdu h SER 70 Cb 1.09 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1hdu h SER 70 CO 0.63 0.22 0.00 -2.11 -0.87 0.00 0.00 176.83 174.70 1hdu n ARG 71 N -4.73 0.04 -1.81 4.77 1.85 -0.58 -4.08 116.66 112.12 1hdu n ARG 71 Ca 0.23 0.25 -0.40 0.00 -1.00 0.00 0.00 57.85 56.93 1hdu n ARG 71 Cb 0.64 -1.58 -0.01 0.00 -1.05 0.00 0.00 32.46 30.46 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 -1.66 4.05 -0.30 2.89 1.02 -0.98 -4.77 120.64 120.88 1hdu n GLU 72 Ca 0.04 -3.01 0.30 0.00 -0.02 0.00 0.00 57.16 54.47 1hdu n GLU 72 Cb 0.21 -2.78 0.67 0.00 -0.02 0.00 0.00 31.44 29.52 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 5.00 0.22 0.00 -0.32 4.06 -1.80 -0.08 115.95 123.03 1hdu h TRP 73 Ca 0.70 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 61.66 1hdu h TRP 73 Cb 0.37 -0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.46 1hdu h TRP 73 CO 1.63 0.02 -0.03 0.97 -3.56 0.00 0.00 178.44 177.47 1hdu h ILE 74 N 0.13 0.48 -0.03 1.49 6.09 -1.86 -2.62 117.51 121.19 1hdu h ILE 74 Ca 0.55 -0.13 -0.03 0.00 -1.37 0.00 0.00 64.86 63.88 1hdu h ILE 74 Cb 1.92 1.09 0.00 0.00 0.47 0.00 0.00 36.82 40.30 1hdu h ILE 74 CO -0.10 0.03 -0.10 0.71 -3.07 0.00 0.00 178.15 175.62 1hdu h THR 75 N 0.00 1.48 -0.39 2.19 1.35 -1.35 -1.17 112.91 115.03 1hdu h THR 75 Ca -0.00 -1.57 -0.04 0.00 -0.55 0.00 0.00 66.41 64.25 1hdu h THR 75 Cb 0.08 2.46 -0.02 0.00 -1.73 0.00 0.00 68.15 68.95 1hdu h THR 75 CO 0.00 0.42 0.07 1.56 -0.25 0.00 0.00 175.52 177.32 1hdu h GLN 76 N -0.48 0.58 -0.52 4.72 7.50 -1.66 -0.24 115.11 125.01 1hdu h GLN 76 Ca -0.00 -0.11 -0.09 0.00 0.50 0.00 0.00 58.65 58.95 1hdu h GLN 76 Cb 0.74 -0.09 -0.02 0.00 0.05 0.00 0.00 27.48 28.16 1hdu h GLN 76 CO 0.02 0.56 -0.05 0.00 -1.50 0.00 0.00 178.83 177.86 1hdu h ALA 77 N 1.51 0.94 -0.13 3.87 0.00 -1.47 -1.82 119.26 122.16 1hdu h ALA 77 Ca 0.13 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 1hdu h ALA 77 Cb 0.26 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1hdu h ALA 77 CO 0.00 0.63 -0.53 1.15 0.00 0.00 0.00 179.25 180.50 1hdu h THR 78 N 0.83 1.34 -0.63 0.00 2.02 -0.53 -2.77 112.91 113.17 1hdu h THR 78 Ca 0.15 -1.80 -0.06 0.00 0.77 0.00 0.00 66.41 65.46 1hdu h THR 78 Cb 0.56 1.83 -0.03 0.00 -1.74 0.00 0.00 68.15 68.78 1hdu h THR 78 CO 0.03 0.54 0.14 1.23 0.37 0.00 0.00 175.52 177.84 1hdu h GLY 79 N 1.26 1.10 0.99 2.16 0.00 -0.69 -0.51 103.07 107.38 1hdu h GLY 79 Ca 0.01 -0.70 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 1hdu h GLY 79 CO 0.09 0.65 0.30 -2.08 0.00 0.00 0.00 176.54 175.50 1hdu h VAL 80 N 0.94 1.19 -0.63 4.60 2.07 -1.25 -1.65 116.25 121.51 1hdu h VAL 80 Ca 0.20 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 1hdu h VAL 80 Cb 0.37 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1hdu h VAL 80 CO 0.00 0.20 0.10 -0.25 0.02 0.00 0.00 177.57 177.65 1hdu h TRP 81 N 0.74 1.09 -0.18 1.57 7.01 -1.22 -2.87 115.95 122.08 1hdu h TRP 81 Ca 0.19 -0.14 0.00 0.00 2.11 0.00 0.00 58.89 61.05 1hdu h TRP 81 Cb 0.05 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 26.80 1hdu h TRP 81 CO -0.01 0.92 0.12 0.74 -2.79 0.00 0.00 178.44 177.41 1hdu h PHE 82 N 0.97 0.23 -0.68 2.65 -1.00 -0.73 0.20 116.94 118.57 1hdu h PHE 82 Ca 0.19 0.00 0.10 0.00 2.81 0.00 0.00 57.97 61.08 1hdu h PHE 82 Cb 0.42 -0.08 -0.08 0.00 3.61 0.00 0.00 35.95 39.82 1hdu h PHE 82 CO 0.03 0.15 0.30 0.00 -1.61 0.00 0.00 178.31 177.18 1hdu h ALA 83 N 1.06 0.93 -0.22 2.45 0.00 -1.16 0.98 119.26 123.31 1hdu h ALA 83 Ca 0.07 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1hdu h ALA 83 Cb -0.02 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1hdu h ALA 83 CO -0.01 -0.13 -0.25 -0.22 0.00 0.00 0.00 179.25 178.63 1hdu h LYS 84 N 0.50 0.56 -0.69 0.00 1.63 -1.30 -3.17 116.57 114.11 1hdu h LYS 84 Ca 0.35 -0.31 0.09 0.00 -0.85 0.00 0.00 60.65 59.93 1hdu h LYS 84 Cb 0.42 0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 32.00 1hdu h LYS 84 CO -0.31 0.90 0.33 -0.22 -3.45 0.00 0.00 179.45 176.70 1hdu h LYS 85 N 0.24 0.55 -0.52 1.90 1.63 -0.13 -1.91 116.57 118.34 1hdu h LYS 85 Ca 0.03 -0.03 0.06 0.00 -0.85 0.00 0.00 60.65 59.86 1hdu h LYS 85 Cb 0.81 -0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 32.27 1hdu h LYS 85 CO 0.06 0.37 0.23 0.74 -3.45 0.00 0.00 179.45 177.39 1hdu h PHE 86 N 0.57 0.41 0.00 1.91 0.04 -0.81 -0.32 116.94 118.73 1hdu h PHE 86 Ca 0.34 0.02 -0.07 0.00 2.80 0.00 0.00 57.97 61.06 1hdu h PHE 86 Cb 0.36 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1hdu h PHE 86 CO -0.12 0.17 -0.35 1.79 -0.60 0.00 0.00 178.31 179.20 1hdu h THR 87 N 0.44 0.96 0.17 -1.55 1.35 -1.41 -2.77 112.91 110.11 1hdu h THR 87 Ca 0.24 -1.35 -0.30 0.00 -0.55 0.00 0.00 66.41 64.45 1hdu h THR 87 Cb 0.21 1.79 0.01 0.00 -1.73 0.00 0.00 68.15 68.44 1hdu h THR 87 CO -0.21 0.34 -1.38 -0.33 -0.25 0.00 0.00 175.52 173.69 1hdu h GLU 88 N 0.00 0.37 0.00 4.72 5.08 -0.60 -3.37 114.58 120.78 1hdu h GLU 88 Ca -0.00 -0.63 -0.03 0.00 -1.00 0.00 0.00 59.36 57.70 1hdu h GLU 88 Cb 0.77 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 1hdu h GLU 88 CO 0.05 1.29 -0.87 -0.91 -1.00 0.00 0.00 179.01 177.56 1hdu h ASN 89 N 0.10 0.00 -2.64 1.42 4.21 -1.10 -3.42 115.58 114.15 1hdu h ASN 89 Ca -0.20 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 56.78 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 0.22 0.12 1.04 -0.47 -1.29 0.00 0.00 177.43 177.05 1hdu s TYR 90 N -3.25 2.22 0.00 1.19 5.04 -1.05 -0.59 117.35 120.92 1hdu s TYR 90 Ca 0.01 0.21 0.00 0.00 -2.44 0.00 0.00 57.07 54.85 1hdu s TYR 90 Cb 0.09 -3.98 0.00 0.00 0.35 0.00 0.00 41.96 38.41 1hdu s TYR 90 CO 0.77 -4.04 0.00 0.41 -1.34 0.00 0.00 175.55 171.35 1hdu n GLY 91 N 4.08 2.24 0.10 8.97 0.00 -1.26 -4.82 105.19 114.50 1hdu n GLY 91 Ca 0.17 0.00 -0.09 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 0.29 -3.42 1.61 1.13 -0.20 -4.94 117.38 109.85 1hdu n GLN 92 Ca 0.00 0.07 -0.40 0.00 -1.94 0.00 0.00 57.00 54.74 1hdu n GLN 92 Cb 0.00 -1.21 -0.09 0.00 0.11 0.00 0.00 30.24 29.04 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 -5.22 6.20 0.22 1.08 3.84 0.25 -4.98 114.94 116.32 1hdu s ASN 93 Ca -0.16 0.06 -0.07 0.00 0.21 0.00 0.00 52.86 52.89 1hdu s ASN 93 Cb 0.04 -2.19 0.35 0.00 -0.55 0.00 0.00 41.25 38.89 1hdu s ASN 93 CO 0.27 -0.23 1.75 -0.65 -2.79 0.00 0.00 177.10 175.45 1hdu h PRO 94 N 8.31 0.45 0.12 0.43 0.11 -1.92 -0.33 132.00 139.17 1hdu h PRO 94 Ca -0.31 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.76 1hdu h PRO 94 Cb 1.16 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1hdu h PRO 94 CO 0.65 0.30 -0.06 0.77 -0.21 0.00 0.00 178.00 179.45 1hdu h SER 95 N 0.46 -0.14 -0.63 -2.05 0.02 -1.97 -2.51 113.55 106.74 1hdu h SER 95 Ca 0.35 -0.28 -0.08 0.00 -0.84 0.00 0.00 61.79 60.94 1hdu h SER 95 Cb 0.45 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 1hdu h SER 95 CO -0.33 0.22 0.10 0.15 -1.14 0.00 0.00 176.83 175.84 1hdu h PHE 96 N -0.51 1.12 -0.77 3.45 3.57 -1.88 -2.59 116.94 119.33 1hdu h PHE 96 Ca -0.02 -0.15 0.03 0.00 3.53 0.00 0.00 57.97 61.36 1hdu h PHE 96 Cb 0.41 -0.31 -0.05 0.00 2.79 0.00 0.00 35.95 38.79 1hdu h PHE 96 CO 0.04 0.94 0.49 1.15 -2.23 0.00 0.00 178.31 178.70 1hdu h THR 97 N 0.99 1.11 -0.94 4.41 2.02 -1.08 -1.25 112.91 118.18 1hdu h THR 97 Ca 0.20 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1hdu h THR 97 Cb 0.43 0.08 -0.05 0.00 -1.74 0.00 0.00 68.15 66.87 1hdu h THR 97 CO 0.01 0.17 0.56 0.00 0.37 0.00 0.00 175.52 176.64 1hdu h ALA 98 N 1.32 1.22 0.25 6.16 0.00 -1.15 -1.12 119.26 125.95 1hdu h ALA 98 Ca 0.31 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1hdu h ALA 98 Cb 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.43 1hdu h ALA 98 CO -0.11 0.66 -0.12 0.82 0.00 0.00 0.00 179.25 180.50 1hdu h ILE 99 N 1.30 0.80 0.00 0.00 2.04 -0.94 -2.97 117.51 117.74 1hdu h ILE 99 Ca 0.34 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1hdu h ILE 99 Cb -0.05 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1hdu h ILE 99 CO -0.06 0.08 0.00 -0.07 0.00 0.00 0.00 178.15 178.10 1hdu h LEU 100 N -0.54 0.00 -0.35 1.44 3.38 -1.11 0.60 115.31 118.73 1hdu h LEU 100 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1hdu h LEU 100 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1hdu h LEU 100 CO 0.06 0.00 0.00 0.44 0.09 0.00 0.00 178.44 179.03 1hdu h ASP 101 N 0.00 0.00 0.00 -0.43 3.32 -1.04 -3.34 116.42 114.92 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 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1hdu h ASP 101 CO 0.00 0.00 -0.38 -1.20 -1.72 0.00 0.00 179.24 175.94 1hdu n SER 102 N -2.52 1.91 -4.13 6.45 7.64 -0.85 -4.99 113.62 117.13 1hdu n SER 102 Ca 0.04 -0.22 -0.10 0.00 1.01 0.00 0.00 58.87 59.60 1hdu n SER 102 Cb 0.39 0.83 -0.10 0.00 -1.01 0.00 0.00 64.21 64.31 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 -1.21 0.74 0.13 1.43 -1.94 0.15 -4.40 119.30 114.19 1hdu s MET 103 Ca 0.00 -1.24 0.03 0.00 -1.71 0.00 0.00 55.69 52.76 1hdu s MET 103 Cb 0.00 -0.09 -0.04 0.00 2.01 0.00 0.00 34.83 36.72 1hdu s MET 103 CO 0.00 -0.04 0.23 -0.51 -0.01 0.00 0.00 175.02 174.69 1hdu s ASP 104 N -2.87 6.15 -0.07 3.03 1.01 -0.87 -4.33 116.67 118.72 1hdu s ASP 104 Ca 0.08 0.12 0.03 0.00 0.71 0.00 0.00 52.55 53.50 1hdu s ASP 104 Cb 0.05 -1.81 0.01 0.00 1.01 0.00 0.00 42.92 42.17 1hdu s ASP 104 CO -0.06 0.08 -0.17 -0.63 0.21 0.00 0.00 175.17 174.61 1hdu s ILE 105 N -1.68 1.47 -0.21 0.77 1.01 -0.49 -1.47 121.20 120.60 1hdu s ILE 105 Ca 0.34 -0.68 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 1hdu s ILE 105 Cb -0.11 -1.30 -0.00 0.00 0.01 0.00 0.00 42.46 41.06 1hdu s ILE 105 CO 0.27 0.43 -0.08 -0.36 0.00 0.00 0.00 174.94 175.20 1hdu s PHE 106 N 0.48 2.91 -0.19 3.97 0.40 -0.13 -0.58 117.98 124.84 1hdu s PHE 106 Ca -0.15 -1.11 -0.01 0.00 -0.60 0.00 0.00 56.93 55.07 1hdu s PHE 106 Cb -0.16 -2.06 0.01 0.00 0.51 0.00 0.00 43.02 41.32 1hdu s PHE 106 CO 0.05 -0.61 -0.13 -1.17 0.70 0.00 0.00 175.22 174.06 1hdu s LEU 107 N 1.42 2.47 -0.41 -0.37 2.96 0.34 -1.45 118.68 123.64 1hdu s LEU 107 Ca 0.05 -0.53 -0.05 0.00 -0.22 0.00 0.00 54.13 53.39 1hdu s LEU 107 Cb -0.14 -1.59 0.10 0.00 0.50 0.00 0.00 46.19 45.06 1hdu s LEU 107 CO -0.06 0.00 0.22 -0.70 -1.32 0.00 0.00 176.35 174.49 1hdu s GLU 108 N 1.30 2.19 0.11 1.98 2.12 -0.32 -0.55 118.70 125.54 1hdu s GLU 108 Ca 0.04 -1.72 -0.13 0.00 0.36 0.00 0.00 54.97 53.53 1hdu s GLU 108 Cb -0.14 -3.63 -0.11 0.00 0.26 0.00 0.00 34.13 30.51 1hdu s GLU 108 CO -0.08 -1.04 1.37 0.82 -0.54 0.00 0.00 175.26 175.80 1hdu h ILE 109 N 6.30 1.28 -3.18 -3.70 2.04 -1.82 -0.83 117.51 117.59 1hdu h ILE 109 Ca -0.16 -1.76 -0.63 0.00 1.00 0.00 0.00 64.86 63.31 1hdu h ILE 109 Cb 1.06 1.73 -0.41 0.00 -0.74 0.00 0.00 36.82 38.46 1hdu h ILE 109 CO 0.72 0.57 -0.66 -0.69 0.00 0.00 0.00 178.15 178.09 1hdu s VAL 110 N -4.04 2.29 0.16 1.67 1.01 -1.26 -4.17 120.40 116.06 1hdu s VAL 110 Ca -0.11 -3.34 0.21 0.00 0.00 0.00 0.00 61.98 58.74 1hdu s VAL 110 Cb 0.09 -2.57 0.17 0.00 0.00 0.00 0.00 36.38 34.07 1hdu s VAL 110 CO 0.89 -0.88 1.77 0.74 0.00 0.00 0.00 175.10 177.61 1hdu h THR 111 N 5.16 0.76 -2.67 3.92 2.02 -1.59 -3.35 112.91 117.16 1hdu h THR 111 Ca 0.00 -1.36 -0.60 0.00 0.77 0.00 0.00 66.41 65.22 1hdu h THR 111 Cb 0.87 1.86 -0.41 0.00 -1.74 0.00 0.00 68.15 68.73 1hdu h THR 111 CO 0.64 0.31 -0.72 -3.20 0.37 0.00 0.00 175.52 172.91 1hdu n ASN 112 N -3.49 2.02 -0.07 4.18 4.05 -1.15 -4.87 115.26 115.92 1hdu n ASN 112 Ca -0.00 -2.99 -0.02 0.00 0.45 0.00 0.00 54.58 52.01 1hdu n ASN 112 Cb 0.48 -0.68 0.22 0.00 1.23 0.00 0.00 39.78 41.02 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 5.15 0.69 -0.33 1.20 0.13 -1.89 -1.74 132.00 135.21 1hdu h PRO 113 Ca 0.18 -0.16 -0.03 0.00 -0.87 0.00 0.00 66.00 65.12 1hdu h PRO 113 Cb 0.79 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 1hdu h PRO 113 CO 0.63 0.69 0.08 -0.91 -0.23 0.00 0.00 178.00 178.26 1hdu h ASN 114 N 0.66 0.50 -0.58 1.44 -0.26 -1.95 -1.56 115.58 113.84 1hdu h ASN 114 Ca 0.14 -0.23 -0.08 0.00 -0.56 0.00 0.00 56.30 55.56 1hdu h ASN 114 Cb 0.37 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.48 1hdu h ASN 114 CO 0.01 0.60 0.05 1.23 -1.06 0.00 0.00 177.43 178.26 1hdu h GLY 115 N 0.38 1.10 0.99 2.83 0.00 -1.75 -2.01 103.07 104.60 1hdu h GLY 115 Ca 0.10 -0.75 0.00 0.00 0.00 0.00 0.00 47.33 46.68 1hdu h GLY 115 CO 0.00 0.70 0.04 -2.75 0.00 0.00 0.00 176.54 174.53 1hdu h PHE 116 N 0.94 0.08 -0.91 5.60 3.57 -1.10 -0.66 116.94 124.46 1hdu h PHE 116 Ca 0.18 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.73 1hdu h PHE 116 Cb 0.48 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.14 1hdu h PHE 116 CO 0.03 0.06 0.59 0.00 -2.23 0.00 0.00 178.31 176.77 1hdu h ALA 117 N 1.01 1.45 -0.30 2.41 0.00 -1.18 -1.69 119.26 120.96 1hdu h ALA 117 Ca 0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1hdu h ALA 117 Cb 0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1hdu h ALA 117 CO -0.00 0.44 -0.09 0.35 0.00 0.00 0.00 179.25 179.95 1hdu h PHE 118 N 1.10 0.51 0.00 0.00 3.57 -0.60 -2.25 116.94 119.27 1hdu h PHE 118 Ca 0.37 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.78 1hdu h PHE 118 Cb 0.08 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.67 1hdu h PHE 118 CO -0.00 0.57 -0.10 1.79 -2.23 0.00 0.00 178.31 178.34 1hdu h THR 119 N 0.45 0.27 0.00 4.41 1.35 -0.19 -0.07 112.91 119.14 1hdu h THR 119 Ca 0.09 -0.73 -0.16 0.00 -0.55 0.00 0.00 66.41 65.06 1hdu h THR 119 Cb 0.43 1.57 -0.03 0.00 -1.73 0.00 0.00 68.15 68.40 1hdu h THR 119 CO 0.02 0.10 -1.20 0.45 -0.25 0.00 0.00 175.52 174.64 1hdu h HIS 120 N 0.00 0.00 0.00 4.73 3.86 -1.23 -3.24 115.15 119.27 1hdu h HIS 120 Ca -0.00 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 1hdu h HIS 120 Cb 0.56 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.03 1hdu h HIS 120 CO 0.00 0.60 -1.24 -1.13 0.86 0.00 0.00 177.93 177.02 1hdu n SER 121 N -2.99 3.98 0.03 2.45 3.41 -1.03 -4.98 113.62 114.48 1hdu n SER 121 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1hdu n SER 121 Cb 0.83 0.98 0.00 0.00 -0.26 0.00 0.00 64.21 65.75 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 -1.84 0.00 -3.86 4.33 -0.58 -0.12 -5.05 120.64 113.51 1hdu n GLU 122 Ca -0.03 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.41 1hdu n GLU 122 Cb 0.31 -0.21 -0.15 0.00 -0.57 0.00 0.00 31.44 30.82 1hdu n GLU 122 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1hdu s ASN 123 N -5.34 3.93 0.55 1.62 3.84 -0.70 -5.00 114.94 113.84 1hdu s ASN 123 Ca 0.00 -1.43 0.25 0.00 0.21 0.00 0.00 52.86 51.90 1hdu s ASN 123 Cb 0.00 -1.08 1.48 0.00 -0.55 0.00 0.00 41.25 41.10 1hdu s ASN 123 CO 0.00 -0.32 2.05 -0.09 -2.79 0.00 0.00 177.10 175.94 1hdu h ARG 124 N 7.98 0.00 -0.61 0.43 9.65 -1.79 -1.97 114.38 128.07 1hdu h ARG 124 Ca -0.14 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 1hdu h ARG 124 Cb 1.05 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.63 1hdu h ARG 124 CO 0.44 0.00 0.00 1.28 2.80 0.00 0.00 179.97 184.49 1hdu n LEU 125 N -4.14 5.45 -4.75 3.80 4.77 -1.26 -4.59 117.00 116.28 1hdu n LEU 125 Ca 0.05 -2.77 -0.41 0.00 -0.03 0.00 0.00 56.01 52.85 1hdu n LEU 125 Cb 0.44 -0.65 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 1hdu n LEU 125 CO 0.32 0.70 1.06 0.86 -1.33 0.00 0.00 177.39 179.00 1hdu s TRP 126 N -2.46 3.07 -0.08 -1.77 -0.11 -0.74 -4.80 118.94 112.05 1hdu s TRP 126 Ca 0.54 1.12 0.04 0.00 1.22 0.00 0.00 56.10 59.03 1hdu s TRP 126 Cb 0.39 -3.75 -0.08 0.00 -1.50 0.00 0.00 33.47 28.53 1hdu s TRP 126 CO 0.19 -2.39 -0.02 -2.13 -4.62 0.00 0.00 176.95 167.99 1hdu n ARG 127 N 2.17 1.78 -0.95 5.86 0.63 -1.26 -1.53 116.66 123.36 1hdu n ARG 127 Ca 0.06 0.02 -0.10 0.00 -0.92 0.00 0.00 57.85 56.91 1hdu n ARG 127 Cb 0.41 -1.19 0.06 0.00 0.45 0.00 0.00 32.46 32.19 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 -2.47 -0.12 0.00 -0.14 5.02 -1.26 -3.38 118.16 115.80 1hdu n LYS 128 Ca -0.14 -0.84 0.00 0.00 -2.02 0.00 0.00 58.31 55.31 1hdu n LYS 128 Cb 0.71 -0.39 0.00 0.00 -0.02 0.00 0.00 35.03 35.34 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 -2.35 0.00 -0.74 -0.18 -2.24 -0.44 -4.44 114.28 103.89 1hdu n THR 129 Ca 0.06 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.91 1hdu n THR 129 Cb 0.21 -1.93 0.10 0.00 -2.10 0.00 0.00 70.33 66.60 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 -0.98 1.81 -2.32 -0.78 3.00 -1.26 -3.95 116.66 112.18 1hdu n ARG 130 Ca 0.00 -2.24 -0.37 0.00 -0.01 0.00 0.00 57.85 55.24 1hdu n ARG 130 Cb 0.00 -1.34 -0.02 0.00 0.00 0.00 0.00 32.46 31.10 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 -2.29 6.25 -0.07 0.55 0.01 -1.26 -4.59 113.70 112.30 1hdu s SER 131 Ca 0.22 2.23 0.02 0.00 1.31 0.00 0.00 55.95 59.73 1hdu s SER 131 Cb 0.19 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.80 1hdu s SER 131 CO 0.02 -0.86 -0.13 -0.69 0.41 0.00 0.00 173.24 171.99 1hdu s VAL 132 N -1.61 3.12 -0.16 3.43 1.01 -1.26 -0.64 120.40 124.29 1hdu s VAL 132 Ca 0.63 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1hdu s VAL 132 Cb -0.26 -2.25 0.04 0.00 0.00 0.00 0.00 36.38 33.91 1hdu s VAL 132 CO 0.32 0.57 -0.02 -0.89 0.00 0.00 0.00 175.10 175.08 1hdu s THR 133 N -0.43 0.85 0.00 3.92 2.01 -1.26 -5.05 115.64 115.68 1hdu s THR 133 Ca 0.05 -0.51 0.00 0.00 0.31 0.00 0.00 61.69 61.54 1hdu s THR 133 Cb -0.12 -1.12 0.00 0.00 0.01 0.00 0.00 72.50 71.27 1hdu s THR 133 CO 0.02 0.05 0.00 -1.54 -0.69 0.00 0.00 174.62 172.46 1hdu n SER 134 N 4.96 0.00 0.00 3.53 3.41 -1.26 -1.30 113.62 122.96 1hdu n SER 134 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1hdu n SER 134 Cb 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 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 -1.62 0.00 -3.55 4.04 3.41 -1.26 -4.57 113.62 110.07 1hdu n SER 135 Ca 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.45 1hdu n SER 135 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 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 -1.00 -0.65 0.01 4.04 0.15 -0.42 -5.01 113.70 110.83 1hdu s SER 136 Ca 0.00 0.83 0.26 0.00 0.70 0.00 0.00 55.95 57.74 1hdu s SER 136 Cb 0.00 0.69 0.77 0.00 -1.71 0.00 0.00 66.02 65.77 1hdu s SER 136 CO 0.00 -0.51 1.60 0.18 1.20 0.00 0.00 173.24 175.71 1hdu n LEU 137 N 1.24 0.34 -4.82 3.45 4.32 -1.26 -4.58 117.00 115.69 1hdu n LEU 137 Ca -0.17 0.21 -0.34 0.00 -0.02 0.00 0.00 56.01 55.68 1hdu n LEU 137 Cb 0.57 -0.34 -0.07 0.00 -1.62 0.00 0.00 43.42 41.96 1hdu n LEU 137 CO 0.19 0.06 0.56 0.00 -1.22 0.00 0.00 177.39 176.99 1hdu s VAL 139 N -1.96 2.94 0.00 0.00 1.01 -1.26 -4.58 120.40 116.56 1hdu s VAL 139 Ca 0.56 -1.47 0.00 0.00 0.00 0.00 0.00 61.98 61.07 1hdu s VAL 139 Cb -0.12 -2.36 0.00 0.00 0.00 0.00 0.00 36.38 33.90 1hdu s VAL 139 CO 0.17 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1hdu n GLY 140 N 0.75 -1.38 3.19 4.51 0.00 0.18 -4.92 105.19 107.52 1hdu n GLY 140 Ca -0.15 -1.48 -0.22 0.00 0.00 0.00 0.00 46.02 44.17 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 -3.29 1.35 -0.53 1.61 1.01 -1.26 -4.81 120.40 114.48 1hdu s VAL 141 Ca 0.00 -1.09 -0.28 0.00 0.00 0.00 0.00 61.98 60.61 1hdu s VAL 141 Cb 0.00 -1.20 0.01 0.00 0.00 0.00 0.00 36.38 35.19 1hdu s VAL 141 CO 0.00 0.09 1.44 -0.62 0.00 0.00 0.00 175.10 176.00 1hdu s ASP 142 N -1.17 6.13 0.64 3.32 -1.08 0.01 -1.33 116.67 123.19 1hdu s ASP 142 Ca 0.04 0.40 0.36 0.00 -0.52 0.00 0.00 52.55 52.83 1hdu s ASP 142 Cb -0.08 -2.54 2.00 0.00 -1.46 0.00 0.00 42.92 40.84 1hdu s ASP 142 CO 0.02 -1.68 2.19 0.00 0.52 0.00 0.00 175.17 176.21 1hdu h ALA 143 N 11.18 1.33 -0.98 3.66 0.00 -1.86 -1.76 119.26 130.81 1hdu h ALA 143 Ca -0.27 -0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.11 1hdu h ALA 143 Cb 1.10 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 18.59 1hdu h ALA 143 CO 1.16 -0.15 0.68 -1.71 0.00 0.00 0.00 179.25 179.23 1hdu n ASN 144 N -3.29 4.25 0.00 0.00 5.15 -1.26 -3.55 115.26 116.56 1hdu n ASN 144 Ca -0.02 -3.61 0.00 0.00 -0.60 0.00 0.00 54.58 50.36 1hdu n ASN 144 Cb 0.21 -0.85 0.00 0.00 -0.53 0.00 0.00 39.78 38.60 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 -1.09 0.00 0.00 1.20 5.12 -0.67 -3.82 116.66 117.40 1hdu n ARG 145 Ca 0.59 -0.14 0.12 0.00 -1.93 0.00 0.00 57.85 56.49 1hdu n ARG 145 Cb 1.53 -0.43 0.08 0.00 -1.16 0.00 0.00 32.46 32.47 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 0.00 2.80 -4.86 0.55 4.05 -1.08 -4.42 115.26 112.30 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 0.33 0.08 -0.01 0.00 1.23 0.00 0.00 39.78 41.41 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 -2.05 3.53 -1.47 1.20 0.52 -0.11 -0.53 118.94 120.04 1hdu s TRP 147 Ca 0.26 1.30 -0.14 0.00 0.02 0.00 0.00 56.10 57.54 1hdu s TRP 147 Cb 0.19 -2.69 0.03 0.00 -1.15 0.00 0.00 33.47 29.86 1hdu s TRP 147 CO 0.34 -0.46 2.27 -3.47 0.02 0.00 0.00 176.95 175.65 1hdu n ASP 148 N -2.06 4.17 -3.34 2.95 2.03 -1.26 -4.25 116.55 114.79 1hdu n ASP 148 Ca 0.05 -2.83 -0.13 0.00 0.52 0.00 0.00 54.79 52.40 1hdu n ASP 148 Cb 0.54 -1.65 -0.07 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 3.10 -0.80 -1.36 -1.67 0.00 -1.26 -4.77 121.76 114.99 1hdu s ALA 149 Ca 0.48 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.89 1hdu s ALA 149 Cb 0.14 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.15 1hdu s ALA 149 CO -0.09 -2.03 0.00 0.41 0.00 0.00 0.00 175.76 174.05 1hdu n GLY 150 N 4.58 -0.08 3.62 0.00 0.00 -1.26 -0.95 105.19 111.10 1hdu n GLY 150 Ca 0.08 -0.24 -0.44 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.86 1.57 0.00 1.61 7.35 -1.26 -2.12 117.46 120.74 1hdu n PHE 151 Ca -0.18 0.65 0.00 0.00 -0.76 0.00 0.00 57.45 57.16 1hdu n PHE 151 Cb 0.63 -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 1.21 2.88 3.86 7.13 0.00 -1.26 -4.98 105.19 114.03 1hdu n GLY 152 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 0.00 0.46 0.34 1.61 1.02 -0.90 -4.94 119.74 117.33 1hdu s LYS 153 Ca 0.00 -0.26 -0.26 0.00 0.02 0.00 0.00 55.97 55.47 1hdu s LYS 153 Cb 0.00 -1.81 -0.13 0.00 -0.52 0.00 0.00 37.83 35.37 1hdu s LYS 153 CO 0.00 -2.56 0.96 0.00 -0.92 0.00 0.00 175.35 172.84 1hdu n ALA 154 N -3.90 -0.21 0.00 5.17 0.00 -1.26 -3.56 120.51 116.74 1hdu n ALA 154 Ca 0.14 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1hdu n ALA 154 Cb 0.60 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 18.03 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 1.26 1.19 3.27 0.00 0.00 -1.26 -3.39 105.19 106.27 1hdu n GLY 155 Ca 0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.90 0.15 4.61 0.00 -1.23 -3.49 121.76 118.90 1hdu s ALA 156 Ca 0.00 0.45 -0.07 0.00 0.00 0.00 0.00 51.96 52.34 1hdu s ALA 156 Cb 0.00 0.06 -0.06 0.00 0.00 0.00 0.00 23.12 23.12 1hdu s ALA 156 CO 0.00 -0.27 0.41 0.45 0.00 0.00 0.00 175.76 176.35 1hdu s SER 157 N -1.30 6.54 0.00 0.00 0.15 -0.49 -4.91 113.70 113.70 1hdu s SER 157 Ca -0.13 0.69 0.22 0.00 0.70 0.00 0.00 55.95 57.42 1hdu s SER 157 Cb -0.05 -2.13 0.06 0.00 -1.71 0.00 0.00 66.02 62.19 1hdu s SER 157 CO 0.05 0.05 1.10 -1.54 1.20 0.00 0.00 173.24 174.10 1hdu n SER 158 N 0.19 2.29 -4.67 5.45 3.41 -1.26 -1.77 113.62 117.27 1hdu n SER 158 Ca -0.03 -1.65 -0.40 0.00 -0.26 0.00 0.00 58.87 56.54 1hdu n SER 158 Cb 0.52 0.30 -0.06 0.00 -0.26 0.00 0.00 64.21 64.71 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 -2.17 6.72 0.57 4.04 1.04 -1.26 -4.94 113.70 117.69 1hdu s SER 159 Ca 0.21 0.87 0.27 0.00 0.48 0.00 0.00 55.95 57.77 1hdu s SER 159 Cb 0.18 -2.35 1.53 0.00 0.10 0.00 0.00 66.02 65.48 1hdu s SER 159 CO 0.44 -0.25 2.04 -0.65 0.98 0.00 0.00 173.24 175.81 1hdu h PRO 160 N 7.37 0.00 -0.00 4.02 0.11 -1.95 -0.88 132.00 140.67 1hdu h PRO 160 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1hdu h PRO 160 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1hdu h PRO 160 CO 0.77 0.00 -0.11 0.00 -0.21 0.00 0.00 178.00 178.45 1hdu s SER 162 N -2.90 6.07 0.37 0.00 0.15 -0.34 -4.93 113.70 112.12 1hdu s SER 162 Ca 0.16 1.95 0.27 0.00 0.70 0.00 0.00 55.95 59.04 1hdu s SER 162 Cb 0.19 -2.56 1.12 0.00 -1.71 0.00 0.00 66.02 63.06 1hdu s SER 162 CO 0.55 -0.97 1.82 -0.08 1.20 0.00 0.00 173.24 175.76 1hdu h GLU 163 N 1.20 0.00 0.00 5.44 4.81 -1.90 -2.97 114.58 121.17 1hdu h GLU 163 Ca -0.49 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1hdu h GLU 163 Cb 1.23 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 1hdu h GLU 163 CO 0.58 0.00 -0.21 -2.37 -0.73 0.00 0.00 179.01 176.28 1hdu n THR 164 N -2.57 1.99 -1.69 0.32 5.66 -1.26 -4.62 114.28 112.11 1hdu n THR 164 Ca 0.02 -2.63 -0.44 0.00 -3.05 0.00 0.00 64.05 57.94 1hdu n THR 164 Cb 0.27 -0.23 -0.04 0.00 -1.55 0.00 0.00 70.33 68.79 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 -1.29 2.52 0.96 1.09 9.36 -1.12 -1.39 117.16 127.28 1hdu n TYR 165 Ca 0.17 -0.02 0.14 0.00 3.32 0.00 0.00 57.90 61.51 1hdu n TYR 165 Cb 0.66 -2.68 0.59 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 5.18 0.09 0.00 2.98 1.44 -0.73 -0.81 115.22 123.38 1hdu n HIS 166 Ca 0.18 0.03 0.00 0.00 -2.01 0.00 0.00 57.72 55.92 1hdu n HIS 166 Cb 0.34 -0.54 0.00 0.00 0.12 0.00 0.00 29.99 29.91 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 1.48 0.21 0.26 -1.39 0.00 -1.26 -4.24 105.19 100.25 1hdu n GLY 167 Ca 0.07 -1.86 -0.07 0.00 0.00 0.00 0.00 46.02 44.16 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 0.73 -3.10 1.61 1.57 -1.99 -3.47 116.57 111.93 1hdu h LYS 168 Ca 0.00 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 1hdu h LYS 168 Cb 0.00 -0.04 -0.12 0.00 0.08 0.00 0.00 32.23 32.16 1hdu h LYS 168 CO 0.00 0.88 0.15 1.52 -0.57 0.00 0.00 179.45 181.43 1hdu s TYR 169 N -4.61 -0.42 0.22 -1.35 -0.85 -1.26 -5.10 117.35 103.97 1hdu s TYR 169 Ca -0.09 0.17 -0.32 0.00 -0.52 0.00 0.00 57.07 56.31 1hdu s TYR 169 Cb 0.13 0.50 -0.14 0.00 0.38 0.00 0.00 41.96 42.84 1hdu s TYR 169 CO 0.83 -0.85 1.46 0.00 -1.52 0.00 0.00 175.55 175.46 1hdu n ALA 170 N -0.35 1.19 -1.88 9.51 0.00 -1.26 -2.03 120.51 125.69 1hdu n ALA 170 Ca -0.15 0.42 -0.12 0.00 0.00 0.00 0.00 53.44 53.58 1hdu n ALA 170 Cb 0.64 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.77 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 2.51 -4.12 0.12 0.00 5.03 0.31 -4.91 115.26 114.20 1hdu n ASN 171 Ca 0.13 0.11 -0.01 0.00 0.87 0.00 0.00 54.58 55.69 1hdu n ASN 171 Cb 0.31 -3.08 0.25 0.00 -1.02 0.00 0.00 39.78 36.24 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 0.15 -3.35 6.41 4.64 -1.65 -3.41 113.55 116.34 1hdu h SER 172 Ca -0.27 -0.06 -0.55 0.00 -0.47 0.00 0.00 61.79 60.43 1hdu h SER 172 Cb 1.05 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 63.06 1hdu h SER 172 CO 0.35 0.56 0.35 -1.61 -0.87 0.00 0.00 176.83 175.62 1hdu s GLU 173 N -4.09 4.47 0.50 4.77 0.41 -1.26 -4.93 118.70 118.56 1hdu s GLU 173 Ca -0.04 1.23 0.15 0.00 -0.41 0.00 0.00 54.97 55.90 1hdu s GLU 173 Cb 0.14 -3.49 1.20 0.00 -1.78 0.00 0.00 34.13 30.19 1hdu s GLU 173 CO 0.76 -0.12 2.13 -0.24 -0.49 0.00 0.00 175.26 177.30 1hdu h VAL 174 N 4.91 1.02 -0.47 2.63 3.04 -1.91 -0.33 116.25 125.14 1hdu h VAL 174 Ca -0.37 -0.07 -0.04 0.00 -1.01 0.00 0.00 66.70 65.21 1hdu h VAL 174 Cb 1.19 0.96 -0.02 0.00 -2.01 0.00 0.00 31.29 31.40 1hdu h VAL 174 CO 0.79 0.03 0.13 -0.33 -1.01 0.00 0.00 177.57 177.17 1hdu h GLU 175 N 0.07 0.70 0.04 4.17 3.07 -1.90 0.18 114.58 120.91 1hdu h GLU 175 Ca 0.02 -0.12 -0.06 0.00 -0.50 0.00 0.00 59.36 58.70 1hdu h GLU 175 Cb 0.02 -0.12 0.01 0.00 -0.84 0.00 0.00 28.75 27.82 1hdu h GLU 175 CO -0.00 0.62 -0.26 0.28 -1.40 0.00 0.00 179.01 178.25 1hdu h VAL 176 N 0.68 1.69 -0.39 3.13 2.07 -1.55 -3.32 116.25 118.57 1hdu h VAL 176 Ca 0.16 -2.37 0.00 0.00 0.82 0.00 0.00 66.70 65.31 1hdu h VAL 176 Cb 0.23 3.29 -0.02 0.00 -1.52 0.00 0.00 31.29 33.27 1hdu h VAL 176 CO -0.01 0.63 0.25 0.50 0.02 0.00 0.00 177.57 178.97 1hdu h LYS 177 N -0.78 0.52 -0.97 1.57 3.64 -1.00 -1.98 116.57 117.57 1hdu h LYS 177 Ca -0.04 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1hdu h LYS 177 Cb 1.19 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.84 1hdu h LYS 177 CO 0.05 0.35 0.63 0.77 -2.27 0.00 0.00 179.45 178.98 1hdu h SER 178 N 0.53 1.06 -0.08 4.20 0.02 -1.07 0.09 113.55 118.30 1hdu h SER 178 Ca 0.14 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.02 1hdu h SER 178 Cb -0.05 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.24 1hdu h SER 178 CO -0.03 0.73 -0.19 0.40 -1.14 0.00 0.00 176.83 176.60 1hdu h ILE 179 N 1.23 1.41 -0.40 3.27 2.04 -1.48 -2.76 117.51 120.82 1hdu h ILE 179 Ca 0.38 -1.53 0.07 0.00 1.00 0.00 0.00 64.86 64.78 1hdu h ILE 179 Cb -0.02 2.21 -0.06 0.00 -0.74 0.00 0.00 36.82 38.21 1hdu h ILE 179 CO -0.12 0.43 0.03 0.58 0.00 0.00 0.00 178.15 179.07 1hdu h VAL 180 N -0.21 0.73 -0.65 1.67 2.07 -1.02 0.37 116.25 119.21 1hdu h VAL 180 Ca -0.00 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 1hdu h VAL 180 Cb 0.80 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1hdu h VAL 180 CO 0.04 0.03 0.28 0.44 0.02 0.00 0.00 177.57 178.38 1hdu h ASP 181 N 0.14 0.88 -0.42 0.57 3.32 -1.05 -0.43 116.42 119.44 1hdu h ASP 181 Ca 0.20 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 1hdu h ASP 181 Cb 0.26 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1hdu h ASP 181 CO -0.30 0.80 0.01 0.15 -1.72 0.00 0.00 179.24 178.18 1hdu h PHE 182 N 0.91 0.79 -0.41 4.55 3.57 -1.13 -0.04 116.94 125.17 1hdu h PHE 182 Ca 0.22 -0.13 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 1hdu h PHE 182 Cb 0.18 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1hdu h PHE 182 CO 0.01 0.79 -0.07 0.28 -2.23 0.00 0.00 178.31 177.09 1hdu h VAL 183 N 0.56 1.27 -0.37 1.41 2.07 -0.79 -1.67 116.25 118.73 1hdu h VAL 183 Ca 0.12 -1.15 -0.04 0.00 0.82 0.00 0.00 66.70 66.45 1hdu h VAL 183 Cb 0.46 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 1hdu h VAL 183 CO 0.02 0.39 0.08 0.11 0.02 0.00 0.00 177.57 178.19 1hdu h LYS 184 N 0.60 0.60 -0.54 1.57 1.57 -0.99 -1.52 116.57 117.86 1hdu h LYS 184 Ca 0.11 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1hdu h LYS 184 Cb 0.59 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 1hdu h LYS 184 CO 0.04 0.64 0.31 -0.91 -0.57 0.00 0.00 179.45 178.96 1hdu h ASN 185 N 0.45 0.66 0.09 0.86 2.35 -0.94 -2.98 115.58 116.07 1hdu h ASN 185 Ca 0.12 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1hdu h ASN 185 Cb 0.32 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1hdu h ASN 185 CO 0.00 0.54 -0.08 -0.74 -1.65 0.00 0.00 177.43 175.50 1hdu h HIS 186 N 0.72 -0.21 0.00 1.19 2.76 -1.19 -3.46 115.15 114.96 1hdu h HIS 186 Ca 0.19 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.36 1hdu h HIS 186 Cb 0.01 0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.05 1hdu h HIS 186 CO -0.02 -0.13 0.00 0.41 -1.30 0.00 0.00 177.93 176.89 1hdu n GLY 187 N -1.19 0.37 1.77 5.26 0.00 -0.58 -4.84 105.19 105.98 1hdu n GLY 187 Ca -0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.09 2.64 -4.76 1.61 5.15 -1.26 -5.05 115.26 113.49 1hdu n ASN 188 Ca 0.00 -3.07 -0.40 0.00 -0.60 0.00 0.00 54.58 50.51 1hdu n ASN 188 Cb 0.05 -0.41 -0.06 0.00 -0.53 0.00 0.00 39.78 38.83 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 -2.93 3.91 -0.01 1.20 0.08 -1.26 -1.37 117.98 117.59 1hdu s PHE 189 Ca 0.39 1.71 0.08 0.00 0.12 0.00 0.00 56.93 59.23 1hdu s PHE 189 Cb 0.38 -2.86 -0.12 0.00 -0.57 0.00 0.00 43.02 39.85 1hdu s PHE 189 CO -0.04 0.45 0.16 1.63 -0.10 0.00 0.00 175.22 177.32 1hdu n LYS 190 N 1.77 0.33 -3.98 0.44 4.76 0.86 -4.73 118.16 117.61 1hdu n LYS 190 Ca -0.04 -0.07 -0.11 0.00 -2.87 0.00 0.00 58.31 55.22 1hdu n LYS 190 Cb 0.48 -1.18 -0.12 0.00 -1.84 0.00 0.00 35.03 32.37 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 -2.52 0.19 -0.20 7.82 0.00 -1.18 -3.31 121.76 122.56 1hdu s ALA 191 Ca -0.03 -0.40 -0.05 0.00 0.00 0.00 0.00 51.96 51.48 1hdu s ALA 191 Cb 0.05 0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.30 1hdu s ALA 191 CO 0.32 -0.06 0.11 0.12 0.00 0.00 0.00 175.76 176.25 1hdu s PHE 192 N -0.86 0.16 -0.16 0.00 2.19 -0.41 -0.68 117.98 118.23 1hdu s PHE 192 Ca -0.08 -0.39 0.00 0.00 0.33 0.00 0.00 56.93 56.79 1hdu s PHE 192 Cb -0.06 -0.70 0.00 0.00 -1.31 0.00 0.00 43.02 40.95 1hdu s PHE 192 CO -0.00 -0.60 -0.15 -0.51 1.83 0.00 0.00 175.22 175.79 1hdu s LEU 193 N 2.15 2.46 -0.17 6.12 1.02 0.12 -1.84 118.68 128.54 1hdu s LEU 193 Ca 0.04 -0.48 -0.00 0.00 0.02 0.00 0.00 54.13 53.70 1hdu s LEU 193 Cb -0.16 -1.56 0.00 0.00 0.02 0.00 0.00 46.19 44.49 1hdu s LEU 193 CO -0.16 0.07 -0.14 -0.55 0.02 0.00 0.00 176.35 175.59 1hdu s SER 194 N 0.90 3.69 -0.16 2.29 0.15 -0.84 -0.93 113.70 118.80 1hdu s SER 194 Ca -0.04 -0.49 -0.07 0.00 0.70 0.00 0.00 55.95 56.06 1hdu s SER 194 Cb -0.15 -1.58 -0.04 0.00 -1.71 0.00 0.00 66.02 62.54 1hdu s SER 194 CO -0.01 0.05 0.07 -0.63 1.20 0.00 0.00 173.24 173.91 1hdu s ILE 195 N 1.03 4.88 0.22 6.45 1.01 0.29 -2.05 121.20 133.03 1hdu s ILE 195 Ca -0.01 -0.01 0.04 0.00 0.00 0.00 0.00 60.65 60.67 1hdu s ILE 195 Cb -0.15 -3.17 -0.01 0.00 0.01 0.00 0.00 42.46 39.14 1hdu s ILE 195 CO -0.03 0.50 0.13 1.41 0.00 0.00 0.00 174.94 176.94 1hdu n HIS 196 N 3.14 -0.21 -3.59 3.97 8.25 0.10 -3.88 115.22 123.00 1hdu n HIS 196 Ca -0.17 -1.59 -0.15 0.00 -0.26 0.00 0.00 57.72 55.55 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 -2.41 -0.46 0.38 0.41 1.04 -1.26 -0.42 113.70 110.97 1hdu s SER 197 Ca 0.18 0.32 0.04 0.00 0.48 0.00 0.00 55.95 56.97 1hdu s SER 197 Cb 0.01 0.48 -0.05 0.00 0.10 0.00 0.00 66.02 66.56 1hdu s SER 197 CO 0.13 -0.64 0.07 -0.72 0.98 0.00 0.00 173.24 173.05 1hdu s TYR 198 N -1.90 1.97 0.00 5.02 1.13 -1.26 -4.89 117.35 117.41 1hdu s TYR 198 Ca -0.08 -1.01 0.00 0.00 -1.41 0.00 0.00 57.07 54.56 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 0.03 0.00 0.00 0.43 -2.51 0.00 0.00 175.55 173.50 1hdu n SER 199 N -0.96 0.00 -3.03 -0.18 7.64 0.56 -4.86 113.62 112.79 1hdu n SER 199 Ca -0.06 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.76 1hdu n SER 199 Cb 0.66 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.89 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 -1.62 -4.10 1.43 6.02 -0.40 -4.83 117.38 113.88 1hdu n GLN 200 Ca 0.00 1.16 -0.15 0.00 -0.01 0.00 0.00 57.00 58.00 1hdu n GLN 200 Cb 0.00 -5.51 -0.12 0.00 1.02 0.00 0.00 30.24 25.63 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 -4.47 2.26 -0.23 1.08 1.43 -0.50 -2.30 118.68 115.95 1hdu s LEU 201 Ca 0.19 -0.57 0.02 0.00 -1.03 0.00 0.00 54.13 52.73 1hdu s LEU 201 Cb -0.02 -0.29 0.05 0.00 0.03 0.00 0.00 46.19 45.96 1hdu s LEU 201 CO 0.70 -0.16 -0.09 -0.22 0.23 0.00 0.00 176.35 176.81 1hdu s LEU 202 N -1.63 2.80 0.14 1.79 0.20 -0.26 -0.44 118.68 121.28 1hdu s LEU 202 Ca -0.07 -1.17 0.09 0.00 0.69 0.00 0.00 54.13 53.67 1hdu s LEU 202 Cb -0.10 -1.34 -0.04 0.00 -0.43 0.00 0.00 46.19 44.28 1hdu s LEU 202 CO 0.01 -0.19 -0.14 -0.76 -0.29 0.00 0.00 176.35 174.98 1hdu s LEU 203 N 1.28 2.84 0.25 -0.68 1.02 0.31 -2.42 118.68 121.28 1hdu s LEU 203 Ca -0.05 -0.54 0.03 0.00 0.02 0.00 0.00 54.13 53.58 1hdu s LEU 203 Cb -0.18 -1.63 -0.05 0.00 0.02 0.00 0.00 46.19 44.35 1hdu s LEU 203 CO -0.06 0.15 0.03 -0.72 0.02 0.00 0.00 176.35 175.77 1hdu s TYR 204 N -1.34 1.58 0.76 0.29 -0.85 -0.82 -0.98 117.35 115.99 1hdu s TYR 204 Ca 0.21 -1.01 -0.15 0.00 -0.52 0.00 0.00 57.07 55.60 1hdu s TYR 204 Cb -0.10 -0.94 0.05 0.00 0.38 0.00 0.00 41.96 41.35 1hdu s TYR 204 CO 0.12 -0.13 1.15 -2.30 -1.52 0.00 0.00 175.55 172.88 1hdu n PRO 205 N -0.46 0.41 -4.01 -3.49 -0.02 -1.26 -1.08 135.00 125.10 1hdu n PRO 205 Ca -0.03 0.21 -0.24 0.00 -2.02 0.00 0.00 63.50 61.41 1hdu n PRO 205 Cb 0.65 -2.40 -0.06 0.00 -0.02 0.00 0.00 33.50 31.68 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 -1.93 2.48 -0.04 6.00 2.02 -1.26 -4.61 117.35 120.01 1hdu s TYR 206 Ca 0.75 -0.61 0.04 0.00 -0.37 0.00 0.00 57.07 56.88 1hdu s TYR 206 Cb -0.32 -1.99 -0.06 0.00 -0.40 0.00 0.00 41.96 39.19 1hdu s TYR 206 CO 0.49 0.04 0.03 0.41 -1.57 0.00 0.00 175.55 174.96 1hdu n GLY 207 N -1.37 -0.24 0.07 0.71 0.00 -1.26 -1.73 105.19 101.38 1hdu n GLY 207 Ca -0.01 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1hdu n GLY 207 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1hdu h TYR 208 N 0.00 0.00 -3.90 1.61 -0.00 -1.75 -0.23 116.97 112.69 1hdu h TYR 208 Ca -0.11 0.00 -0.15 0.00 -0.00 0.00 0.00 58.73 58.47 1hdu h TYR 208 Cb 1.11 0.00 -0.19 0.00 -0.00 0.00 0.00 36.73 37.64 1hdu h TYR 208 CO 0.00 0.00 -0.62 -0.08 -0.00 0.00 0.00 178.16 177.46 1hdu s THR 209 N -3.16 0.13 -1.53 -0.90 -1.32 -1.26 -4.91 115.64 102.69 1hdu s THR 209 Ca 0.07 -1.04 0.30 0.00 -1.21 0.00 0.00 61.69 59.81 1hdu s THR 209 Cb 0.13 -0.61 0.55 0.00 -1.51 0.00 0.00 72.50 71.06 1hdu s THR 209 CO 0.70 -0.57 2.03 0.35 -2.21 0.00 0.00 174.62 174.92 1hdu n THR 210 N 1.17 0.00 -1.74 5.08 -2.24 -1.26 -4.57 114.28 110.72 1hdu n THR 210 Ca -0.21 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 1hdu n THR 210 Cb 0.57 -0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 68.37 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 -1.19 2.68 -2.87 -0.78 -0.06 -1.26 -4.96 117.38 108.94 1hdu n GLN 211 Ca 0.15 0.95 -0.41 0.00 -2.00 0.00 0.00 57.00 55.70 1hdu n GLN 211 Cb 0.24 -2.73 -0.05 0.00 -4.06 0.00 0.00 30.24 23.64 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 0.51 7.31 0.63 1.69 0.01 -1.26 -4.52 113.70 118.06 1hdu s SER 212 Ca 0.65 1.57 -0.17 0.00 1.31 0.00 0.00 55.95 59.30 1hdu s SER 212 Cb -0.50 -2.52 -0.02 0.00 0.21 0.00 0.00 66.02 63.20 1hdu s SER 212 CO 0.48 -0.06 1.17 0.27 0.41 0.00 0.00 173.24 175.51 1hdu s ILE 213 N 0.18 2.84 0.50 1.44 -4.36 -1.26 -4.91 121.20 115.62 1hdu s ILE 213 Ca 0.43 0.46 0.21 0.00 -0.26 0.00 0.00 60.65 61.49 1hdu s ILE 213 Cb -0.21 -3.08 0.26 0.00 1.25 0.00 0.00 42.46 40.68 1hdu s ILE 213 CO 0.25 -0.17 2.11 -0.65 0.24 0.00 0.00 174.94 176.72 1hdu h PRO 214 N 0.49 0.00 -0.73 0.37 0.11 -1.99 -2.58 132.00 127.67 1hdu h PRO 214 Ca -0.49 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.46 1hdu h PRO 214 Cb 1.28 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.29 1hdu h PRO 214 CO 0.54 0.08 0.20 -0.25 -0.21 0.00 0.00 178.00 178.36 1hdu n ASP 215 N -4.16 4.92 -0.17 -2.05 8.00 -1.26 -4.66 116.55 117.17 1hdu n ASP 215 Ca -0.03 -3.09 -0.02 0.00 0.71 0.00 0.00 54.79 52.37 1hdu n ASP 215 Cb 0.16 -0.72 0.07 0.00 -0.02 0.00 0.00 41.12 40.61 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 2.86 0.14 -0.61 -1.24 3.64 -1.83 -1.49 116.57 118.03 1hdu h LYS 216 Ca 0.20 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 1hdu h LYS 216 Cb 2.19 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.95 1hdu h LYS 216 CO 0.66 0.09 0.39 1.15 -2.27 0.00 0.00 179.45 179.47 1hdu h THR 217 N 0.14 1.12 -0.03 1.00 2.02 -1.87 -0.66 112.91 114.63 1hdu h THR 217 Ca 0.27 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1hdu h THR 217 Cb 0.40 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1hdu h THR 217 CO -0.42 0.14 -0.04 -0.08 0.37 0.00 0.00 175.52 175.50 1hdu h GLU 218 N 0.79 0.08 -0.61 6.66 4.81 -1.82 -2.97 114.58 121.52 1hdu h GLU 218 Ca 0.24 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 1hdu h GLU 218 Cb -0.04 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 1hdu h GLU 218 CO -0.08 0.56 0.24 -0.07 -0.73 0.00 0.00 179.01 178.93 1hdu h LEU 219 N -0.39 0.82 -0.93 1.64 4.07 -1.24 -0.82 115.31 118.45 1hdu h LEU 219 Ca 0.00 -0.11 -0.04 0.00 0.08 0.00 0.00 57.88 57.82 1hdu h LEU 219 Cb 0.55 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 42.04 1hdu h LEU 219 CO 0.01 0.74 0.33 -1.13 -1.08 0.00 0.00 178.44 177.31 1hdu h ASN 220 N 0.88 1.01 -0.20 -0.43 -0.73 -1.17 0.12 115.58 115.05 1hdu h ASN 220 Ca 0.21 -0.13 -0.17 0.00 1.87 0.00 0.00 56.30 58.07 1hdu h ASN 220 Cb 0.18 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.51 1hdu h ASN 220 CO -0.02 0.88 -0.53 -0.61 -0.37 0.00 0.00 177.43 176.78 1hdu h GLN 221 N 1.09 0.79 -0.51 6.67 5.75 -1.25 -0.22 115.11 127.42 1hdu h GLN 221 Ca 0.26 -0.48 -0.04 0.00 -0.15 0.00 0.00 58.65 58.23 1hdu h GLN 221 Cb 0.16 0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 1hdu h GLN 221 CO -0.03 1.11 0.16 0.28 -2.65 0.00 0.00 178.83 177.71 1hdu h VAL 222 N 0.61 1.23 -0.81 2.39 2.07 -0.76 -1.61 116.25 119.37 1hdu h VAL 222 Ca 0.02 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 1hdu h VAL 222 Cb 1.11 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 1hdu h VAL 222 CO 0.11 0.29 0.45 0.00 0.02 0.00 0.00 177.57 178.44 1hdu h ALA 223 N 1.02 1.04 -0.28 1.67 0.00 -0.61 -0.64 119.26 121.45 1hdu h ALA 223 Ca 0.17 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1hdu h ALA 223 Cb 0.27 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1hdu h ALA 223 CO -0.01 0.54 0.15 -0.22 0.00 0.00 0.00 179.25 179.71 1hdu h LYS 224 N 1.12 0.30 -0.60 0.00 3.64 -0.62 -1.39 116.57 119.02 1hdu h LYS 224 Ca 0.29 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.59 1hdu h LYS 224 Cb 0.01 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1hdu h LYS 224 CO -0.05 0.20 0.15 0.77 -2.27 0.00 0.00 179.45 178.25 1hdu h SER 225 N 0.31 0.91 -0.64 4.20 0.02 -0.88 -2.18 113.55 115.29 1hdu h SER 225 Ca 0.11 -0.23 -0.03 0.00 -0.84 0.00 0.00 61.79 60.80 1hdu h SER 225 Cb 0.02 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 1hdu h SER 225 CO -0.07 0.90 0.28 0.00 -1.14 0.00 0.00 176.83 176.81 1hdu h ALA 226 N 1.04 0.82 -0.63 3.77 0.00 -0.93 -1.44 119.26 121.90 1hdu h ALA 226 Ca 0.19 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1hdu h ALA 226 Cb 0.34 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1hdu h ALA 226 CO 0.00 0.41 0.17 0.28 0.00 0.00 0.00 179.25 180.11 1hdu h VAL 227 N 0.88 1.24 -0.43 0.00 2.07 -1.14 -1.12 116.25 117.76 1hdu h VAL 227 Ca 0.22 -0.86 -0.09 0.00 0.82 0.00 0.00 66.70 66.79 1hdu h VAL 227 Cb 0.16 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1hdu h VAL 227 CO -0.02 0.33 -0.07 0.00 0.02 0.00 0.00 177.57 177.83 1hdu h ALA 228 N 1.25 0.59 -0.28 1.67 0.00 -1.03 -1.70 119.26 119.77 1hdu h ALA 228 Ca 0.20 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1hdu h ALA 228 Cb 0.30 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1hdu h ALA 228 CO -0.00 0.44 0.11 0.00 0.00 0.00 0.00 179.25 179.79 1hdu h ALA 229 N 0.87 0.36 -0.90 0.00 0.00 -1.04 -2.36 119.26 116.19 1hdu h ALA 229 Ca 0.11 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1hdu h ALA 229 Cb 0.59 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1hdu h ALA 229 CO 0.04 -0.04 0.59 1.25 0.00 0.00 0.00 179.25 181.09 1hdu h LEU 230 N 0.29 1.04 -1.23 0.00 6.46 -1.14 -2.56 115.31 118.18 1hdu h LEU 230 Ca 0.09 -0.03 -0.08 0.00 -0.12 0.00 0.00 57.88 57.74 1hdu h LEU 230 Cb 0.19 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.85 1hdu h LEU 230 CO -0.01 0.76 -0.38 0.50 -0.62 0.00 0.00 178.44 178.69 1hdu h LYS 231 N 1.23 0.00 0.00 1.25 3.64 -1.15 -3.22 116.57 118.31 1hdu h LYS 231 Ca 0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1hdu h LYS 231 Cb -0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1hdu h LYS 231 CO -0.07 0.38 0.07 0.66 -2.27 0.00 0.00 179.45 178.22 1hdu h SER 232 N 0.00 0.00 0.00 4.20 4.64 -0.98 0.21 113.55 121.62 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 0.68 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.77 1hdu h SER 232 CO 0.05 0.00 -0.07 0.25 -0.87 0.00 0.00 176.83 176.19 1hdu h LEU 233 N 0.00 0.00 -1.33 5.97 6.46 -1.70 -3.43 115.31 121.28 1hdu h LEU 233 Ca 0.00 -0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.64 1hdu h LEU 233 Cb 0.15 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.08 1hdu h LEU 233 CO 0.00 0.60 0.00 -1.22 -0.62 0.00 0.00 178.44 177.20 1hdu n TYR 234 N -4.74 0.00 -0.82 1.25 4.01 -1.22 -5.01 117.16 110.63 1hdu n TYR 234 Ca -0.02 -0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 1hdu n TYR 234 Cb 0.09 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.11 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 -0.11 0.54 3.68 2.72 0.00 0.74 -5.01 105.19 107.76 1hdu n GLY 235 Ca 0.00 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 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 3.23 -0.22 2.61 2.01 -1.25 -4.97 115.64 115.04 1hdu s THR 236 Ca 0.00 0.62 -0.19 0.00 0.31 0.00 0.00 61.69 62.43 1hdu s THR 236 Cb 0.00 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 1hdu s THR 236 CO 0.00 -0.01 0.58 -0.44 -0.69 0.00 0.00 174.62 174.06 1hdu s SER 237 N 2.45 6.58 0.07 3.53 0.01 -1.26 -4.19 113.70 120.88 1hdu s SER 237 Ca 0.72 0.70 0.08 0.00 1.31 0.00 0.00 55.95 58.76 1hdu s SER 237 Cb -0.37 -2.32 -0.03 0.00 0.21 0.00 0.00 66.02 63.50 1hdu s SER 237 CO 0.31 -0.27 -0.18 -0.31 0.41 0.00 0.00 173.24 173.20 1hdu s TYR 238 N 2.05 2.55 0.20 2.43 1.51 -1.26 -4.88 117.35 119.95 1hdu s TYR 238 Ca 0.25 -0.26 0.07 0.00 -1.01 0.00 0.00 57.07 56.12 1hdu s TYR 238 Cb -0.16 -1.42 -0.04 0.00 -0.11 0.00 0.00 41.96 40.23 1hdu s TYR 238 CO 0.09 0.30 0.08 0.15 -1.11 0.00 0.00 175.55 175.07 1hdu s LYS 239 N -1.69 2.66 0.06 -0.62 3.01 -0.97 -4.98 119.74 117.21 1hdu s LYS 239 Ca 0.16 -1.06 -0.04 0.00 -1.01 0.00 0.00 55.97 54.01 1hdu s LYS 239 Cb -0.11 -2.47 -0.02 0.00 -1.01 0.00 0.00 37.83 34.23 1hdu s LYS 239 CO 0.07 0.44 0.07 1.52 0.51 0.00 0.00 175.35 177.96 1hdu s TYR 240 N -1.90 0.34 -5.00 3.18 1.13 -1.26 -1.10 117.35 112.75 1hdu s TYR 240 Ca 0.30 -0.81 0.00 0.00 -1.41 0.00 0.00 57.07 55.15 1hdu s TYR 240 Cb -0.09 -0.23 0.00 0.00 -1.10 0.00 0.00 41.96 40.54 1hdu s TYR 240 CO 0.22 -0.43 0.00 0.41 -2.51 0.00 0.00 175.55 173.23 1hdu n GLY 241 N 0.16 -1.29 3.79 5.49 0.00 -1.02 -4.98 105.19 107.35 1hdu n GLY 241 Ca -0.15 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 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 -2.57 5.50 0.12 1.61 1.04 -1.26 -1.95 113.70 116.18 1hdu s SER 242 Ca 0.00 1.90 -0.27 0.00 0.48 0.00 0.00 55.95 58.06 1hdu s SER 242 Cb 0.00 -2.54 -0.08 0.00 0.10 0.00 0.00 66.02 63.50 1hdu s SER 242 CO 0.00 -1.36 1.63 0.40 0.98 0.00 0.00 173.24 174.88 1hdu h ILE 243 N 0.27 0.36 0.00 -1.02 2.04 -1.06 -1.74 117.51 116.37 1hdu h ILE 243 Ca -0.47 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 1hdu h ILE 243 Cb 1.23 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1hdu h ILE 243 CO 0.56 0.00 -0.14 -0.29 0.00 0.00 0.00 178.15 178.28 1hdu h ILE 244 N -0.49 1.03 0.00 -0.67 2.10 -1.44 -0.62 117.51 117.41 1hdu h ILE 244 Ca 0.04 -0.49 0.00 0.00 1.08 0.00 0.00 64.86 65.48 1hdu h ILE 244 Cb 0.54 1.27 0.00 0.00 -1.09 0.00 0.00 36.82 37.54 1hdu h ILE 244 CO -0.19 0.14 -0.89 0.00 -1.08 0.00 0.00 178.15 176.13 1hdu h THR 245 N 0.00 0.00 0.02 2.19 1.03 -1.80 -3.33 112.91 111.02 1hdu h THR 245 Ca -0.00 -0.92 -0.38 0.00 -0.01 0.00 0.00 66.41 65.09 1hdu h THR 245 Cb 0.26 1.46 -0.06 0.00 -1.07 0.00 0.00 68.15 68.74 1hdu h THR 245 CO 0.02 0.00 -2.37 0.41 -0.01 0.00 0.00 175.52 173.56 1hdu n THR 246 N -2.62 1.54 0.00 0.00 -1.04 -0.67 -4.91 114.28 106.59 1hdu n THR 246 Ca 0.01 -0.61 0.00 0.00 -2.04 0.00 0.00 64.05 61.41 1hdu n THR 246 Cb 0.53 -1.41 0.00 0.00 -1.82 0.00 0.00 70.33 67.64 1hdu n THR 246 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1hdu n ILE 247 N -3.26 0.00 -3.95 12.58 5.41 -0.26 -5.10 119.36 124.77 1hdu n ILE 247 Ca -0.42 0.01 0.01 0.00 1.00 0.00 0.00 62.75 63.35 1hdu n ILE 247 Cb 1.01 -0.75 0.01 0.00 -0.71 0.00 0.00 39.64 39.21 1hdu n ILE 247 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1hdu s TYR 248 N -0.04 0.04 0.02 1.39 -0.85 -1.19 -5.01 117.35 111.71 1hdu s TYR 248 Ca 0.00 -0.22 -0.30 0.00 -0.52 0.00 0.00 57.07 56.03 1hdu s TYR 248 Cb 0.00 0.59 -0.06 0.00 0.38 0.00 0.00 41.96 42.88 1hdu s TYR 248 CO 0.00 -0.43 1.34 -1.14 -1.52 0.00 0.00 175.55 173.81 1hdu s GLN 249 N -2.06 4.32 -0.06 -3.49 0.74 -1.26 -3.86 119.66 113.99 1hdu s GLN 249 Ca 0.27 1.92 -0.02 0.00 0.05 0.00 0.00 55.36 57.57 1hdu s GLN 249 Cb -0.01 -3.48 0.04 0.00 1.10 0.00 0.00 33.01 30.66 1hdu s GLN 249 CO 0.01 -0.49 0.11 0.00 -0.55 0.00 0.00 175.29 174.37 1hdu s ALA 250 N 1.96 -0.03 0.08 1.58 0.00 -0.10 -4.04 121.76 121.20 1hdu s ALA 250 Ca 0.62 0.44 0.03 0.00 0.00 0.00 0.00 51.96 53.05 1hdu s ALA 250 Cb -0.31 -0.63 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 1hdu s ALA 250 CO 0.27 -0.42 0.10 -1.54 0.00 0.00 0.00 175.76 174.17 1hdu s SER 251 N 1.93 5.65 0.00 0.00 1.04 -1.22 -2.12 113.70 118.98 1hdu s SER 251 Ca 0.00 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.46 1hdu s SER 251 Cb -0.12 -1.55 0.00 0.00 0.10 0.00 0.00 66.02 64.45 1hdu s SER 251 CO -0.05 0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.95 1hdu n GLY 252 N 0.41 0.38 3.84 7.32 0.00 -0.13 -4.45 105.19 112.56 1hdu n GLY 252 Ca -0.08 -1.04 -0.33 0.00 0.00 0.00 0.00 46.02 44.58 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 -3.00 2.35 0.15 -0.02 0.00 -1.25 -0.93 107.32 104.62 1hdu s GLY 253 Ca 0.00 0.21 -0.17 0.00 0.00 0.00 0.00 44.72 44.76 1hdu s GLY 253 CO 0.00 0.45 1.78 1.48 0.00 0.00 0.00 173.10 176.81 1hdu h SER 254 N 2.06 0.29 0.39 1.64 4.64 -1.90 -2.76 113.55 117.90 1hdu h SER 254 Ca -0.48 0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 60.80 1hdu h SER 254 Cb 1.18 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 1hdu h SER 254 CO 0.63 0.21 -0.20 0.40 -0.87 0.00 0.00 176.83 177.00 1hdu h ILE 255 N 0.38 0.83 -0.30 0.95 5.03 -1.93 0.61 117.51 123.08 1hdu h ILE 255 Ca 0.14 -0.78 -0.17 0.00 -0.12 0.00 0.00 64.86 63.92 1hdu h ILE 255 Cb 0.02 1.46 -0.00 0.00 -3.03 0.00 0.00 36.82 35.28 1hdu h ILE 255 CO -0.08 0.20 -0.49 0.44 -0.68 0.00 0.00 178.15 177.54 1hdu h ASP 256 N 0.00 0.95 -0.02 1.72 5.19 -1.91 -1.33 116.42 121.02 1hdu h ASP 256 Ca -0.00 -0.52 -0.00 0.00 -0.62 0.00 0.00 57.03 55.89 1hdu h ASP 256 Cb 0.45 -0.27 -0.00 0.00 0.18 0.00 0.00 39.33 39.69 1hdu h ASP 256 CO 0.03 1.28 0.00 -0.25 -3.12 0.00 0.00 179.24 177.18 1hdu h TRP 257 N 0.64 0.03 -0.86 4.55 7.01 -1.05 -2.26 115.95 124.00 1hdu h TRP 257 Ca 0.02 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.03 1hdu h TRP 257 Cb 1.09 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 28.10 1hdu h TRP 257 CO 0.07 0.27 0.57 0.66 -2.79 0.00 0.00 178.44 177.22 1hdu h SER 258 N -0.21 1.00 -0.59 2.65 4.64 -0.90 -2.10 113.55 118.04 1hdu h SER 258 Ca 0.01 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 1hdu h SER 258 Cb 0.25 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 1hdu h SER 258 CO 0.00 0.73 0.21 0.22 -0.87 0.00 0.00 176.83 177.12 1hdu h TYR 259 N 1.17 0.91 0.00 4.77 3.20 -1.23 -1.63 116.97 124.16 1hdu h TYR 259 Ca 0.32 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.11 1hdu h TYR 259 Cb -0.12 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 37.88 1hdu h TYR 259 CO -0.01 0.75 0.00 0.09 -1.64 0.00 0.00 178.16 177.35 1hdu n ASN 260 N -4.45 0.51 -0.53 -2.11 3.02 -0.86 -1.00 115.26 109.85 1hdu n ASN 260 Ca 0.03 0.66 0.13 0.00 -0.03 0.00 0.00 54.58 55.37 1hdu n ASN 260 Cb 0.18 -0.75 0.46 0.00 -0.61 0.00 0.00 39.78 39.06 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 -2.10 1.72 -0.10 3.52 -0.06 -0.67 -4.91 117.38 114.78 1hdu n GLN 261 Ca 0.01 -1.06 0.00 0.00 -2.00 0.00 0.00 57.00 53.95 1hdu n GLN 261 Cb 0.16 -1.45 0.00 0.00 -4.06 0.00 0.00 30.24 24.88 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 1.17 0.64 3.47 1.69 0.00 -0.17 -5.02 105.19 106.97 1hdu n GLY 262 Ca 0.18 0.00 -0.43 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 -2.15 4.34 0.13 -0.61 1.01 -0.85 -4.91 121.20 118.16 1hdu s ILE 263 Ca 0.00 -0.67 -0.19 0.00 0.00 0.00 0.00 60.65 59.80 1hdu s ILE 263 Cb 0.00 -4.77 -0.04 0.00 0.01 0.00 0.00 42.46 37.67 1hdu s ILE 263 CO 0.00 -1.55 1.76 0.50 0.00 0.00 0.00 174.94 175.64 1hdu h LYS 264 N 9.43 0.22 -4.25 2.79 3.64 -1.85 -3.32 116.57 123.22 1hdu h LYS 264 Ca -0.12 -0.01 -0.73 0.00 -1.27 0.00 0.00 60.65 58.52 1hdu h LYS 264 Cb 1.05 -0.05 -0.12 0.00 -0.41 0.00 0.00 32.23 32.71 1hdu h LYS 264 CO 1.19 0.14 2.23 0.66 -2.27 0.00 0.00 179.45 181.41 1hdu n TYR 265 N -5.01 3.77 -3.75 1.91 4.01 -1.21 -4.91 117.16 111.96 1hdu n TYR 265 Ca -0.02 -2.96 -0.37 0.00 -0.16 0.00 0.00 57.90 54.39 1hdu n TYR 265 Cb 0.08 -2.27 -0.13 0.00 -0.31 0.00 0.00 39.34 36.71 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 2.41 5.13 0.04 7.72 0.01 -1.25 -1.28 113.70 126.48 1hdu s SER 266 Ca 0.44 -0.57 0.01 0.00 1.31 0.00 0.00 55.95 57.15 1hdu s SER 266 Cb 0.07 -1.89 -0.03 0.00 0.21 0.00 0.00 66.02 64.38 1hdu s SER 266 CO -0.01 -0.15 -0.06 -0.36 0.41 0.00 0.00 173.24 173.07 1hdu s PHE 267 N 1.53 0.59 -0.07 2.43 0.08 -0.77 -4.35 117.98 117.42 1hdu s PHE 267 Ca 0.04 -0.58 0.05 0.00 0.12 0.00 0.00 56.93 56.56 1hdu s PHE 267 Cb -0.17 -0.36 -0.00 0.00 -0.57 0.00 0.00 43.02 41.92 1hdu s PHE 267 CO 0.03 -0.13 -0.23 0.99 -0.10 0.00 0.00 175.22 175.77 1hdu s THR 268 N -1.77 1.96 -0.15 0.64 2.01 -0.15 -1.98 115.64 116.20 1hdu s THR 268 Ca -0.08 -0.99 -0.05 0.00 0.31 0.00 0.00 61.69 60.87 1hdu s THR 268 Cb -0.07 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.72 1hdu s THR 268 CO -0.01 0.54 0.04 -0.36 -0.69 0.00 0.00 174.62 174.14 1hdu s PHE 269 N 0.08 3.23 -0.30 4.92 0.08 -0.87 -0.53 117.98 124.59 1hdu s PHE 269 Ca -0.10 0.10 -0.01 0.00 0.12 0.00 0.00 56.93 57.04 1hdu s PHE 269 Cb -0.15 -1.97 0.06 0.00 -0.57 0.00 0.00 43.02 40.39 1hdu s PHE 269 CO 0.06 0.27 -0.01 -1.21 -0.10 0.00 0.00 175.22 174.23 1hdu s GLU 270 N -0.11 2.33 0.06 0.44 0.41 0.42 0.03 118.70 122.28 1hdu s GLU 270 Ca 0.06 -1.34 -0.01 0.00 -0.41 0.00 0.00 54.97 53.27 1hdu s GLU 270 Cb -0.12 -3.14 0.01 0.00 -1.78 0.00 0.00 34.13 29.10 1hdu s GLU 270 CO 0.01 -0.65 0.08 1.28 -0.49 0.00 0.00 175.26 175.49 1hdu n LEU 271 N 4.57 0.00 -4.76 1.80 4.32 0.44 -1.27 117.00 122.10 1hdu n LEU 271 Ca -0.12 -0.08 -0.34 0.00 -0.02 0.00 0.00 56.01 55.44 1hdu n LEU 271 Cb 0.43 -0.06 0.04 0.00 -1.62 0.00 0.00 43.42 42.21 1hdu n LEU 271 CO 0.25 -0.69 0.78 -0.13 -1.22 0.00 0.00 177.39 176.38 1hdu s ARG 272 N -3.17 2.83 0.00 3.23 0.52 -1.26 -1.83 118.95 119.27 1hdu s ARG 272 Ca 0.04 1.59 0.00 0.00 -0.52 0.00 0.00 55.73 56.85 1hdu s ARG 272 Cb -0.00 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.53 1hdu s ARG 272 CO 0.03 -1.26 0.00 -0.40 0.02 0.00 0.00 175.30 173.69 1hdu n ASP 273 N -2.07 0.63 -2.07 0.23 5.68 -1.26 -4.69 116.55 113.00 1hdu n ASP 273 Ca 0.12 0.00 -0.09 0.00 -0.50 0.00 0.00 54.79 54.32 1hdu n ASP 273 Cb 0.51 0.00 0.29 0.00 -1.14 0.00 0.00 41.12 40.78 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 3.00 0.00 2.12 -2.24 -1.26 -0.32 114.28 115.57 1hdu n THR 274 Ca 0.00 -1.67 0.00 0.00 -2.27 0.00 0.00 64.05 60.11 1hdu n THR 274 Cb 0.00 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 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 -0.28 1.26 0.25 3.38 0.00 -1.26 -4.93 105.19 103.61 1hdu n GLY 275 Ca 0.44 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.32 0.00 1.61 2.43 -2.03 -3.29 114.38 112.79 1hdu h ARG 276 Ca 0.00 0.02 -0.21 0.00 -0.81 0.00 0.00 59.98 58.98 1hdu h ARG 276 Cb 0.00 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 1hdu h ARG 276 CO 0.00 -0.21 -2.02 0.66 -1.51 0.00 0.00 179.97 176.89 1hdu n TYR 277 N -5.34 0.00 0.00 2.20 4.01 -1.26 -5.07 117.16 111.70 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 0.26 -0.68 0.00 0.00 -0.31 0.00 0.00 39.34 38.60 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 1.87 3.24 0.23 2.72 0.00 -1.24 -1.98 105.19 110.04 1hdu n GLY 278 Ca -0.20 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.14 1.61 0.04 -1.93 -3.29 116.94 112.23 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 -0.17 0.00 2.20 0.00 0.00 35.95 37.98 1hdu h PHE 279 CO 0.00 0.18 0.86 1.28 -0.60 0.00 0.00 178.31 180.03 1hdu n LEU 280 N -3.32 6.86 -4.72 1.54 4.77 -0.84 -4.53 117.00 116.78 1hdu n LEU 280 Ca 0.00 -4.29 -0.42 0.00 -0.03 0.00 0.00 56.01 51.27 1hdu n LEU 280 Cb 0.42 -1.25 -0.03 0.00 -2.33 0.00 0.00 43.42 40.23 1hdu n LEU 280 CO 0.32 1.81 1.10 -0.22 -1.33 0.00 0.00 177.39 179.07 1hdu s LEU 281 N -2.27 4.37 0.35 2.23 0.20 -1.24 -4.85 118.68 117.47 1hdu s LEU 281 Ca 0.57 2.41 -0.28 0.00 0.69 0.00 0.00 54.13 57.52 1hdu s LEU 281 Cb 0.34 -3.59 -0.12 0.00 -0.43 0.00 0.00 46.19 42.39 1hdu s LEU 281 CO -0.20 -0.69 1.32 -2.65 -0.29 0.00 0.00 176.35 173.84 1hdu n PRO 282 N 3.83 2.20 0.12 0.98 -0.02 -1.26 -4.87 135.00 135.98 1hdu n PRO 282 Ca 0.12 0.77 0.18 0.00 -2.02 0.00 0.00 63.50 62.54 1hdu n PRO 282 Cb 0.41 -2.38 0.75 0.00 -0.02 0.00 0.00 33.50 32.26 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 2.59 2.11 0.00 3.55 0.00 -1.93 -0.25 119.26 125.33 1hdu h ALA 283 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1hdu h ALA 283 Cb 1.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1hdu h ALA 283 CO 0.63 -0.44 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 1hdu n SER 284 N -4.07 0.16 -0.76 0.00 3.41 -1.26 -1.76 113.62 109.33 1hdu n SER 284 Ca 0.05 0.55 0.10 0.00 -0.26 0.00 0.00 58.87 59.31 1hdu n SER 284 Cb 0.44 -0.58 0.07 0.00 -0.26 0.00 0.00 64.21 63.88 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 -1.69 1.80 0.42 4.33 6.02 -0.11 -4.64 117.38 123.51 1hdu n GLN 285 Ca 0.01 -1.59 -0.19 0.00 -0.01 0.00 0.00 57.00 55.22 1hdu n GLN 285 Cb 0.10 -1.39 -0.10 0.00 1.02 0.00 0.00 30.24 29.87 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 3.74 0.06 -0.29 5.09 2.04 -1.46 -1.32 117.51 125.37 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 0.83 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1hdu h ILE 286 CO 0.00 0.00 0.18 0.40 0.00 0.00 0.00 178.15 178.73 1hdu h ILE 287 N -1.16 1.10 -0.93 -0.67 2.04 -1.82 -0.15 117.51 115.91 1hdu h ILE 287 Ca -0.10 -0.22 0.03 0.00 1.00 0.00 0.00 64.86 65.57 1hdu h ILE 287 Cb 0.93 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 1hdu h ILE 287 CO 0.11 0.09 0.61 -0.65 0.00 0.00 0.00 178.15 178.31 1hdu h PRO 288 N 0.37 1.16 -0.26 2.37 0.11 -1.83 0.24 132.00 134.17 1hdu h PRO 288 Ca 0.10 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.10 1hdu h PRO 288 Cb -0.00 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 30.84 1hdu h PRO 288 CO -0.02 0.77 0.00 1.15 -0.21 0.00 0.00 178.00 179.69 1hdu h THR 289 N 1.20 1.25 -0.39 -1.15 2.02 -0.92 -2.52 112.91 112.40 1hdu h THR 289 Ca 0.36 -0.90 -0.01 0.00 0.77 0.00 0.00 66.41 66.63 1hdu h THR 289 Cb -0.05 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1hdu h THR 289 CO -0.10 0.28 0.19 0.00 0.37 0.00 0.00 175.52 176.27 1hdu h ALA 290 N 0.82 0.51 -0.10 6.16 0.00 -0.42 -1.61 119.26 124.62 1hdu h ALA 290 Ca 0.07 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1hdu h ALA 290 Cb 0.41 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1hdu h ALA 290 CO 0.01 0.06 -0.03 1.96 0.00 0.00 0.00 179.25 181.26 1hdu h GLN 291 N 0.50 -0.00 -0.16 0.00 4.20 -0.48 -1.13 115.11 118.03 1hdu h GLN 291 Ca 0.14 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.71 1hdu h GLN 291 Cb 0.11 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1hdu h GLN 291 CO -0.02 -0.00 -0.49 1.05 -0.67 0.00 0.00 178.83 178.70 1hdu h GLU 292 N -0.00 0.42 -0.43 1.46 4.11 -1.44 -3.00 114.58 115.70 1hdu h GLU 292 Ca 0.05 -0.24 -0.07 0.00 0.07 0.00 0.00 59.36 59.17 1hdu h GLU 292 Cb 0.08 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1hdu h GLU 292 CO -0.11 0.82 -0.02 1.15 0.07 0.00 0.00 179.01 180.92 1hdu h THR 293 N 0.33 1.24 -0.93 -1.06 2.02 -1.08 -2.51 112.91 110.91 1hdu h THR 293 Ca 0.02 -0.98 0.04 0.00 0.77 0.00 0.00 66.41 66.25 1hdu h THR 293 Cb 0.98 0.93 -0.06 0.00 -1.74 0.00 0.00 68.15 68.27 1hdu h THR 293 CO 0.09 0.34 0.60 -0.25 0.37 0.00 0.00 175.52 176.67 1hdu h TRP 294 N 0.66 1.13 -0.78 3.16 -0.00 -1.06 -0.97 115.95 118.10 1hdu h TRP 294 Ca 0.13 0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 59.02 1hdu h TRP 294 Cb 0.45 -0.37 -0.04 0.00 -0.00 0.00 0.00 29.16 29.20 1hdu h TRP 294 CO 0.02 0.64 0.39 -0.07 -0.00 0.00 0.00 178.44 179.42 1hdu h LEU 295 N 1.16 0.99 -0.31 0.65 3.38 -1.42 0.26 115.31 120.01 1hdu h LEU 295 Ca 0.38 -0.10 -0.19 0.00 0.09 0.00 0.00 57.88 58.06 1hdu h LEU 295 Cb 0.03 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.53 1hdu h LEU 295 CO -0.13 0.83 -0.57 1.23 0.09 0.00 0.00 178.44 179.88 1hdu h GLY 296 N 1.13 0.90 0.88 0.83 0.00 -1.32 -2.52 103.07 102.98 1hdu h GLY 296 Ca 0.27 -1.08 -0.07 0.00 0.00 0.00 0.00 47.33 46.46 1hdu h GLY 296 CO -0.04 0.97 -0.08 -2.08 0.00 0.00 0.00 176.54 175.31 1hdu h VAL 297 N 0.62 1.28 -1.00 4.60 2.07 -0.77 -2.80 116.25 120.25 1hdu h VAL 297 Ca 0.01 -1.12 0.05 0.00 0.82 0.00 0.00 66.70 66.46 1hdu h VAL 297 Cb 1.18 1.42 -0.06 0.00 -1.52 0.00 0.00 31.29 32.31 1hdu h VAL 297 CO 0.12 0.35 0.65 0.25 0.02 0.00 0.00 177.57 178.97 1hdu h LEU 298 N 0.31 1.07 -0.60 2.57 6.46 -0.51 -0.99 115.31 123.63 1hdu h LEU 298 Ca 0.07 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 57.87 1hdu h LEU 298 Cb 0.56 -0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 40.22 1hdu h LEU 298 CO 0.03 0.70 0.35 0.74 -0.62 0.00 0.00 178.44 179.65 1hdu h THR 299 N 1.22 1.04 -0.40 1.05 2.02 -1.29 0.67 112.91 117.22 1hdu h THR 299 Ca 0.42 -0.23 -0.05 0.00 0.77 0.00 0.00 66.41 67.31 1hdu h THR 299 Cb 0.09 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 1hdu h THR 299 CO -0.15 0.12 0.04 0.40 0.37 0.00 0.00 175.52 176.30 1hdu h ILE 300 N 0.68 1.25 -0.65 3.11 2.04 -1.09 -2.70 117.51 120.16 1hdu h ILE 300 Ca 0.25 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 65.20 1hdu h ILE 300 Cb 0.06 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 1hdu h ILE 300 CO -0.12 0.32 0.41 0.24 0.00 0.00 0.00 178.15 178.99 1hdu h MET 301 N 0.53 0.78 -0.92 2.37 2.86 -0.59 -1.68 114.93 118.28 1hdu h MET 301 Ca 0.12 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.76 1hdu h MET 301 Cb 0.41 -0.18 -0.06 0.00 0.06 0.00 0.00 31.60 31.84 1hdu h MET 301 CO 0.01 0.52 0.59 0.93 1.06 0.00 0.00 176.91 180.02 1hdu h GLU 302 N 0.80 1.09 -0.38 1.72 5.08 -0.74 -1.50 114.58 120.64 1hdu h GLU 302 Ca 0.26 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.51 1hdu h GLU 302 Cb -0.00 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 1hdu h GLU 302 CO -0.09 0.72 0.07 1.25 -1.00 0.00 0.00 179.01 179.95 1hdu h HIS 303 N 1.12 0.67 -0.76 4.33 2.76 -1.12 -2.82 115.15 119.32 1hdu h HIS 303 Ca 0.38 -0.09 0.03 0.00 -2.20 0.00 0.00 60.37 58.49 1hdu h HIS 303 Cb 0.06 -0.18 -0.05 0.00 1.55 0.00 0.00 27.41 28.79 1hdu h HIS 303 CO -0.02 0.66 0.48 1.15 -1.30 0.00 0.00 177.93 178.91 1hdu h THR 304 N 0.48 1.11 -0.53 6.26 2.02 -0.67 -2.09 112.91 119.49 1hdu h THR 304 Ca 0.12 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 1hdu h THR 304 Cb 0.35 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 1hdu h THR 304 CO 0.01 0.17 0.24 0.58 0.37 0.00 0.00 175.52 176.89 1hdu h VAL 305 N 0.94 1.20 -0.13 3.16 2.07 -1.21 -2.30 116.25 119.99 1hdu h VAL 305 Ca 0.31 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1hdu h VAL 305 Cb 0.02 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1hdu h VAL 305 CO -0.11 0.23 0.00 0.59 0.02 0.00 0.00 177.57 178.30 1hdu n ASN 306 N -4.57 0.81 0.00 0.57 3.02 -1.03 -5.13 115.26 108.93 1hdu n ASN 306 Ca 0.02 -2.02 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 1hdu n ASN 306 Cb 0.13 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1hdu n ASN 306 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23