#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u1x s HIS 2 N 0.00 2.84 0.38 2.03 4.02 -1.06 -4.94 115.29 118.56 1u1x s HIS 2 Ca 0.00 -0.51 -0.25 0.00 1.02 0.00 0.00 55.06 55.32 1u1x s HIS 2 Cb 0.00 -1.84 -0.09 0.00 -1.02 0.00 0.00 32.58 29.63 1u1x s HIS 2 CO 0.00 -0.12 1.07 -0.80 1.02 0.00 0.00 174.74 175.91 1u1x s ASN 3 N 0.21 6.78 0.11 1.40 0.01 -1.26 -0.56 114.94 121.64 1u1x s ASN 3 Ca -0.07 2.12 0.01 0.00 -0.71 0.00 0.00 52.86 54.20 1u1x s ASN 3 Cb -0.15 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 38.87 1u1x s ASN 3 CO 0.05 -0.48 -0.01 -0.72 -1.51 0.00 0.00 177.10 174.43 1u1x s TYR 4 N -1.55 0.87 0.01 2.20 -0.85 0.09 -1.95 117.35 116.19 1u1x s TYR 4 Ca 0.56 -1.05 0.07 0.00 -0.52 0.00 0.00 57.07 56.13 1u1x s TYR 4 Cb -0.25 -0.52 -0.02 0.00 0.38 0.00 0.00 41.96 41.55 1u1x s TYR 4 CO 0.31 -0.30 -0.20 0.08 -1.52 0.00 0.00 175.55 173.92 1u1x s VAL 5 N -3.79 1.58 -0.32 -3.49 1.01 -0.57 -1.50 120.40 113.32 1u1x s VAL 5 Ca 0.16 -1.01 -0.13 0.00 0.00 0.00 0.00 61.98 61.01 1u1x s VAL 5 Cb 0.07 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 1u1x s VAL 5 CO -0.02 0.31 0.26 -0.63 0.00 0.00 0.00 175.10 175.02 1u1x s ILE 6 N -0.63 5.27 -0.17 2.22 1.01 -0.01 -0.99 121.20 127.90 1u1x s ILE 6 Ca 0.07 -0.06 -0.05 0.00 0.00 0.00 0.00 60.65 60.62 1u1x s ILE 6 Cb -0.08 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 1u1x s ILE 6 CO 0.00 0.04 -0.01 -0.63 0.00 0.00 0.00 174.94 174.35 1u1x s ILE 7 N 1.80 4.16 -0.63 2.92 -1.09 -0.39 -0.16 121.20 127.81 1u1x s ILE 7 Ca 0.08 -0.26 -0.24 0.00 -2.23 0.00 0.00 60.65 57.99 1u1x s ILE 7 Cb -0.17 -2.84 0.05 0.00 -1.58 0.00 0.00 42.46 37.92 1u1x s ILE 7 CO 0.11 0.48 1.02 -1.81 -1.23 0.00 0.00 174.94 173.51 1u1x s ASP 8 N 0.39 6.24 0.22 3.58 1.01 0.79 -1.24 116.67 127.67 1u1x s ASP 8 Ca -0.02 -0.62 -0.26 0.00 0.71 0.00 0.00 52.55 52.36 1u1x s ASP 8 Cb -0.14 -2.46 -0.09 0.00 1.01 0.00 0.00 42.92 41.25 1u1x s ASP 8 CO 0.02 -1.44 0.85 0.00 0.21 0.00 0.00 175.17 174.81 1u1x s ALA 9 N 4.37 3.37 -0.77 5.23 0.00 -0.07 -1.60 121.76 132.30 1u1x s ALA 9 Ca 0.28 0.45 -0.04 0.00 0.00 0.00 0.00 51.96 52.65 1u1x s ALA 9 Cb -0.13 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 19.93 1u1x s ALA 9 CO 0.15 0.25 0.51 1.19 0.00 0.00 0.00 175.76 177.85 1u1x n PHE 10 N 1.27 -1.34 -3.75 0.00 3.72 0.27 -1.33 117.46 116.30 1u1x n PHE 10 Ca -0.03 0.43 -0.12 0.00 -0.05 0.00 0.00 57.45 57.68 1u1x n PHE 10 Cb 0.49 -3.04 -0.08 0.00 -0.94 0.00 0.00 39.48 35.91 1u1x n PHE 10 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1u1x s ALA 11 N -3.05 -0.75 -0.90 4.37 0.00 -0.86 -1.88 121.76 118.70 1u1x s ALA 11 Ca 0.25 0.18 0.15 0.00 0.00 0.00 0.00 51.96 52.54 1u1x s ALA 11 Cb -0.11 0.20 -0.13 0.00 0.00 0.00 0.00 23.12 23.08 1u1x s ALA 11 CO 0.31 -0.34 0.70 -1.13 0.00 0.00 0.00 175.76 175.30 1u1x n SER 12 N 0.92 0.93 -3.87 0.00 3.41 -1.26 -2.73 113.62 111.01 1u1x n SER 12 Ca -0.20 -0.96 -0.11 0.00 -0.26 0.00 0.00 58.87 57.33 1u1x n SER 12 Cb 0.58 0.88 -0.11 0.00 -0.26 0.00 0.00 64.21 65.29 1u1x n SER 12 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1u1x s VAL 13 N -2.33 0.05 0.59 -3.33 0.11 -1.26 -4.92 120.40 109.32 1u1x s VAL 13 Ca 0.08 -0.44 -0.20 0.00 -2.93 0.00 0.00 61.98 58.49 1u1x s VAL 13 Cb 0.12 -0.30 -0.03 0.00 -1.53 0.00 0.00 36.38 34.64 1u1x s VAL 13 CO 0.58 -0.24 1.32 -2.84 -3.33 0.00 0.00 175.10 170.59 1u1x s PRO 14 N -0.79 2.88 0.00 1.54 0.02 -1.26 -2.68 135.00 134.71 1u1x s PRO 14 Ca -0.09 2.13 0.00 0.00 0.02 0.00 0.00 61.00 63.06 1u1x s PRO 14 Cb -0.05 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.41 1u1x s PRO 14 CO 0.01 -1.36 0.00 1.28 -0.33 0.00 0.00 177.00 176.60 1u1x n LEU 15 N -1.44 0.00 -4.96 -5.54 4.77 -1.26 -5.02 117.00 103.55 1u1x n LEU 15 Ca 0.13 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.89 1u1x n LEU 15 Cb 0.47 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.58 1u1x n LEU 15 CO 0.50 0.00 0.18 -1.61 -1.33 0.00 0.00 177.39 175.12 1u1x s GLU 16 N -0.24 2.35 3.64 3.23 2.02 -1.09 -4.81 118.70 123.79 1u1x s GLU 16 Ca 0.00 -1.74 0.00 0.00 0.02 0.00 0.00 54.97 53.25 1u1x s GLU 16 Cb 0.00 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.82 1u1x s GLU 16 CO 0.00 -0.64 0.00 0.41 0.02 0.00 0.00 175.26 175.05 1u1x n GLY 17 N -1.95 0.82 2.95 -1.39 0.00 0.23 -4.70 105.19 101.15 1u1x n GLY 17 Ca 0.07 -0.72 -0.28 0.00 0.00 0.00 0.00 46.02 45.09 1u1x n GLY 17 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1u1x s ASN 18 N -4.00 2.38 0.39 1.61 2.47 -0.44 -4.73 114.94 112.62 1u1x s ASN 18 Ca 0.00 -0.38 -0.26 0.00 0.42 0.00 0.00 52.86 52.65 1u1x s ASN 18 Cb 0.00 -0.97 -0.09 0.00 -1.45 0.00 0.00 41.25 38.75 1u1x s ASN 18 CO 0.00 -0.10 1.15 -2.84 -3.72 0.00 0.00 177.10 171.60 1u1x s PRO 19 N 1.63 4.13 -0.00 0.43 0.02 -1.26 -0.89 135.00 139.05 1u1x s PRO 19 Ca 0.05 1.81 0.01 0.00 0.02 0.00 0.00 61.00 62.89 1u1x s PRO 19 Cb -0.13 -2.72 -0.00 0.00 0.02 0.00 0.00 34.50 31.67 1u1x s PRO 19 CO -0.09 -0.25 -0.04 0.54 -0.33 0.00 0.00 177.00 176.83 1u1x s VAL 20 N -1.41 0.32 -0.26 3.83 0.11 -0.37 -4.42 120.40 118.20 1u1x s VAL 20 Ca 0.56 -0.22 -0.12 0.00 -2.93 0.00 0.00 61.98 59.26 1u1x s VAL 20 Cb -0.30 -0.29 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 1u1x s VAL 20 CO 0.38 0.06 0.25 0.00 -3.33 0.00 0.00 175.10 172.46 1u1x s ALA 21 N -0.17 3.56 -0.25 1.54 0.00 -1.23 -1.27 121.76 123.94 1u1x s ALA 21 Ca 0.01 -0.92 -0.04 0.00 0.00 0.00 0.00 51.96 51.02 1u1x s ALA 21 Cb -0.02 -2.52 0.01 0.00 0.00 0.00 0.00 23.12 20.59 1u1x s ALA 21 CO -0.00 -0.47 -0.02 0.08 0.00 0.00 0.00 175.76 175.35 1u1x s VAL 22 N 1.64 3.32 -0.21 0.00 1.01 -0.17 -0.75 120.40 125.23 1u1x s VAL 22 Ca 0.10 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.23 1u1x s VAL 22 Cb -0.15 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1u1x s VAL 22 CO 0.09 0.23 0.08 -0.36 0.00 0.00 0.00 175.10 175.14 1u1x s PHE 23 N 1.42 3.20 0.36 5.22 0.08 0.40 -1.51 117.98 127.15 1u1x s PHE 23 Ca 0.02 -0.05 -0.09 0.00 0.12 0.00 0.00 56.93 56.93 1u1x s PHE 23 Cb -0.16 -2.17 -0.06 0.00 -0.57 0.00 0.00 43.02 40.06 1u1x s PHE 23 CO -0.02 -0.03 0.69 -0.06 -0.10 0.00 0.00 175.22 175.69 1u1x s PHE 24 N 0.92 3.47 -1.26 0.36 0.08 -0.82 -0.97 117.98 119.75 1u1x s PHE 24 Ca 0.04 0.91 -0.06 0.00 0.12 0.00 0.00 56.93 57.94 1u1x s PHE 24 Cb -0.14 -2.32 -0.01 0.00 -0.57 0.00 0.00 43.02 39.98 1u1x s PHE 24 CO 0.03 0.01 0.68 -0.25 -0.10 0.00 0.00 175.22 175.59 1u1x n ASP 25 N -1.11 -2.43 -1.29 1.36 8.00 -1.23 -4.53 116.55 115.32 1u1x n ASP 25 Ca 0.01 -0.90 0.08 0.00 0.71 0.00 0.00 54.79 54.69 1u1x n ASP 25 Cb 0.54 -3.77 0.28 0.00 -0.02 0.00 0.00 41.12 38.15 1u1x n ASP 25 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1u1x n ALA 26 N -4.20 2.86 0.30 2.24 0.00 -0.73 -4.45 120.51 116.54 1u1x n ALA 26 Ca -0.23 -1.22 0.19 0.00 0.00 0.00 0.00 53.44 52.18 1u1x n ALA 26 Cb 0.65 -1.01 0.93 0.00 0.00 0.00 0.00 19.45 20.03 1u1x n ALA 26 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1u1x h ASP 27 N 3.36 0.00 0.48 0.00 3.32 -1.90 -1.44 116.42 120.24 1u1x h ASP 27 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1u1x h ASP 27 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1u1x h ASP 27 CO 0.15 0.02 -0.27 -0.90 -1.72 0.00 0.00 179.24 176.52 1u1x n ASP 28 N -3.18 0.54 -4.69 6.45 5.75 -1.26 -4.84 116.55 115.33 1u1x n ASP 28 Ca -0.01 -0.37 -0.38 0.00 -0.01 0.00 0.00 54.79 54.02 1u1x n ASP 28 Cb 0.19 0.03 -0.07 0.00 -1.03 0.00 0.00 41.12 40.23 1u1x n ASP 28 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1u1x s LEU 29 N -2.75 4.18 0.55 -2.12 1.43 -0.54 -5.07 118.68 114.37 1u1x s LEU 29 Ca 0.19 0.54 -0.19 0.00 -1.03 0.00 0.00 54.13 53.64 1u1x s LEU 29 Cb 0.19 -2.51 -0.05 0.00 0.03 0.00 0.00 46.19 43.85 1u1x s LEU 29 CO 0.57 -0.04 1.14 -2.84 0.23 0.00 0.00 176.35 175.42 1u1x s PRO 30 N 1.09 3.30 0.51 1.29 0.02 -1.26 -4.83 135.00 135.12 1u1x s PRO 30 Ca 0.19 1.66 0.18 0.00 0.02 0.00 0.00 61.00 63.05 1u1x s PRO 30 Cb -0.14 -2.00 1.26 0.00 0.02 0.00 0.00 34.50 33.64 1u1x s PRO 30 CO 0.07 -0.91 2.08 -1.00 -0.33 0.00 0.00 177.00 176.91 1u1x h PRO 31 N 1.16 0.07 -0.25 5.54 0.13 -1.97 -0.72 132.00 135.96 1u1x h PRO 31 Ca -0.50 -0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.56 1u1x h PRO 31 Cb 1.27 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1u1x h PRO 31 CO 0.57 0.05 -0.15 0.00 -0.23 0.00 0.00 178.00 178.24 1u1x h ALA 32 N 1.86 1.29 -0.08 -0.56 0.00 -2.00 -1.73 119.26 118.05 1u1x h ALA 32 Ca 0.12 -0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.55 1u1x h ALA 32 Cb 0.39 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1u1x h ALA 32 CO -0.01 0.47 -0.82 0.37 0.00 0.00 0.00 179.25 179.26 1u1x h GLN 33 N 0.39 0.57 -0.62 0.00 5.75 -1.54 -2.61 115.11 117.04 1u1x h GLN 33 Ca 0.07 -0.51 0.11 0.00 -0.15 0.00 0.00 58.65 58.18 1u1x h GLN 33 Cb 0.49 0.12 -0.08 0.00 1.07 0.00 0.00 27.48 29.08 1u1x h GLN 33 CO 0.03 1.13 0.18 0.52 -2.65 0.00 0.00 178.83 178.04 1u1x h MET 34 N 0.37 0.31 -0.72 1.69 2.86 -0.99 0.14 114.93 118.60 1u1x h MET 34 Ca -0.06 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1u1x h MET 34 Cb 1.43 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.99 1u1x h MET 34 CO 0.15 0.21 0.39 0.37 1.06 0.00 0.00 176.91 179.09 1u1x h GLN 35 N 0.32 1.00 -0.61 1.72 5.75 -1.26 -0.79 115.11 121.24 1u1x h GLN 35 Ca 0.32 -0.12 -0.09 0.00 -0.15 0.00 0.00 58.65 58.61 1u1x h GLN 35 Cb 0.46 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 1u1x h GLN 35 CO -0.38 0.75 0.02 0.00 -2.65 0.00 0.00 178.83 176.57 1u1x h ARG 36 N 0.99 1.06 -0.67 1.69 3.08 -1.03 -1.96 114.38 117.54 1u1x h ARG 36 Ca 0.25 -0.32 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 1u1x h ARG 36 Cb 0.04 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 1u1x h ARG 36 CO -0.04 1.02 0.21 0.82 -1.07 0.00 0.00 179.97 180.91 1u1x h ILE 37 N 0.97 1.25 -0.42 2.04 2.04 -0.74 -0.64 117.51 122.00 1u1x h ILE 37 Ca 0.18 -0.86 -0.05 0.00 1.00 0.00 0.00 64.86 65.12 1u1x h ILE 37 Cb 0.54 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1u1x h ILE 37 CO 0.03 0.33 0.05 0.00 0.00 0.00 0.00 178.15 178.56 1u1x h ALA 38 N 1.09 1.30 -0.17 1.87 0.00 -0.90 -0.64 119.26 121.82 1u1x h ALA 38 Ca 0.22 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1u1x h ALA 38 Cb 0.29 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1u1x h ALA 38 CO -0.01 0.48 -0.29 -0.09 0.00 0.00 0.00 179.25 179.35 1u1x h ARG 39 N 0.63 0.32 -0.69 0.00 9.65 -1.03 -1.35 114.38 121.90 1u1x h ARG 39 Ca 0.14 -0.12 -0.02 0.00 -1.10 0.00 0.00 59.98 58.87 1u1x h ARG 39 Cb 0.32 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.85 1u1x h ARG 39 CO 0.01 0.58 0.34 1.49 2.80 0.00 0.00 179.97 185.18 1u1x h GLU 40 N 0.28 1.00 0.01 0.20 4.57 0.21 -2.64 114.58 118.20 1u1x h GLU 40 Ca 0.04 -0.14 -0.19 0.00 -1.18 0.00 0.00 59.36 57.89 1u1x h GLU 40 Cb 0.65 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 1u1x h GLU 40 CO 0.05 0.78 -0.87 0.52 -1.18 0.00 0.00 179.01 178.31 1u1x h MET 41 N 0.97 0.12 -1.33 1.92 2.86 -1.00 -3.47 114.93 114.99 1u1x h MET 41 Ca 0.24 -0.14 -0.39 0.00 -2.06 0.00 0.00 59.70 57.36 1u1x h MET 41 Cb 0.11 0.04 -0.12 0.00 0.06 0.00 0.00 31.60 31.69 1u1x h MET 41 CO -0.03 0.92 -0.38 -1.71 1.06 0.00 0.00 176.91 176.76 1u1x n ASN 42 N -3.61 -5.32 -4.93 1.22 5.15 -0.52 -5.00 115.26 102.24 1u1x n ASN 42 Ca -0.03 0.35 -0.25 0.00 -0.60 0.00 0.00 54.58 54.06 1u1x n ASN 42 Cb 0.81 -4.46 0.02 0.00 -0.53 0.00 0.00 39.78 35.62 1u1x n ASN 42 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1u1x s LEU 43 N -4.58 3.49 0.37 1.20 1.43 -1.26 -4.96 118.68 114.37 1u1x s LEU 43 Ca 0.00 0.52 0.16 0.00 -1.03 0.00 0.00 54.13 53.78 1u1x s LEU 43 Cb 0.00 -3.38 1.03 0.00 0.03 0.00 0.00 46.19 43.87 1u1x s LEU 43 CO 0.00 -0.82 1.76 0.28 0.23 0.00 0.00 176.35 177.80 1u1x h SER 44 N 0.16 0.52 -5.06 2.29 0.02 -1.95 -3.38 113.55 106.16 1u1x h SER 44 Ca -0.46 0.10 -0.10 0.00 -0.84 0.00 0.00 61.79 60.49 1u1x h SER 44 Cb 1.25 0.01 -0.17 0.00 0.14 0.00 0.00 62.40 63.64 1u1x h SER 44 CO 0.59 0.10 -0.28 -1.61 -1.14 0.00 0.00 176.83 174.49 1u1x s GLU 45 N -5.58 0.79 0.09 3.45 8.01 -1.26 -4.19 118.70 120.01 1u1x s GLU 45 Ca -0.09 -0.55 0.10 0.00 0.01 0.00 0.00 54.97 54.43 1u1x s GLU 45 Cb 0.26 0.34 -0.03 0.00 -4.31 0.00 0.00 34.13 30.38 1u1x s GLU 45 CO 0.80 -0.25 -0.25 -1.12 0.01 0.00 0.00 175.26 174.45 1u1x s SER 46 N -2.11 3.06 0.28 -0.19 0.01 -0.58 -3.58 113.70 110.59 1u1x s SER 46 Ca -0.04 -0.67 0.10 0.00 1.31 0.00 0.00 55.95 56.65 1u1x s SER 46 Cb -0.01 -0.23 -0.05 0.00 0.21 0.00 0.00 66.02 65.95 1u1x s SER 46 CO -0.04 0.18 -0.16 0.42 0.41 0.00 0.00 173.24 174.06 1u1x s THR 47 N -0.97 2.22 -0.07 1.44 -4.23 0.07 -1.40 115.64 112.71 1u1x s THR 47 Ca 0.11 -2.31 0.01 0.00 -1.18 0.00 0.00 61.69 58.32 1u1x s THR 47 Cb -0.10 -2.33 0.02 0.00 1.34 0.00 0.00 72.50 71.43 1u1x s THR 47 CO 0.04 -0.39 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.29 1u1x s PHE 48 N -2.66 1.13 -0.26 3.99 0.08 0.09 -0.45 117.98 119.90 1u1x s PHE 48 Ca 0.29 -0.41 -0.11 0.00 0.12 0.00 0.00 56.93 56.82 1u1x s PHE 48 Cb -0.02 -0.92 -0.05 0.00 -0.57 0.00 0.00 43.02 41.46 1u1x s PHE 48 CO 0.13 -0.28 0.17 0.08 -0.10 0.00 0.00 175.22 175.22 1u1x s VAL 49 N 1.02 5.27 0.17 -0.44 1.01 -0.14 -1.77 120.40 125.51 1u1x s VAL 49 Ca -0.09 0.15 0.09 0.00 0.00 0.00 0.00 61.98 62.14 1u1x s VAL 49 Cb -0.14 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1u1x s VAL 49 CO -0.00 0.29 -0.19 -0.76 0.00 0.00 0.00 175.10 174.44 1u1x s LEU 50 N 1.47 2.43 0.37 3.92 1.43 0.70 -1.77 118.68 127.23 1u1x s LEU 50 Ca 0.07 -0.86 -0.26 0.00 -1.03 0.00 0.00 54.13 52.05 1u1x s LEU 50 Cb -0.15 -0.87 -0.12 0.00 0.03 0.00 0.00 46.19 45.08 1u1x s LEU 50 CO 0.08 -0.01 1.08 0.29 0.23 0.00 0.00 176.35 178.02 1u1x n LYS 51 N 0.32 1.54 -2.24 1.70 5.02 -1.26 -1.13 118.16 122.10 1u1x n LYS 51 Ca -0.13 0.55 -0.36 0.00 -2.02 0.00 0.00 58.31 56.34 1u1x n LYS 51 Cb 0.57 -2.06 -0.00 0.00 -0.02 0.00 0.00 35.03 33.52 1u1x n LYS 51 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1u1x s PRO 52 N -1.86 3.54 -0.00 1.97 0.04 -1.26 -4.10 135.00 133.33 1u1x s PRO 52 Ca 0.60 1.71 0.05 0.00 0.04 0.00 0.00 61.00 63.40 1u1x s PRO 52 Cb -0.60 -2.20 -0.05 0.00 0.04 0.00 0.00 34.50 31.68 1u1x s PRO 52 CO 0.59 -0.72 0.20 0.54 0.04 0.00 0.00 177.00 177.65 1u1x n ARG 53 N -0.90 5.16 -2.50 4.56 1.74 -1.26 -4.83 116.66 118.62 1u1x n ARG 53 Ca 0.10 -0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 1u1x n ARG 53 Cb 0.49 -0.74 0.05 0.00 -1.02 0.00 0.00 32.46 31.24 1u1x n ARG 53 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1u1x n ASN 54 N -1.14 0.88 0.00 0.55 5.15 -1.26 -5.01 115.26 114.43 1u1x n ASN 54 Ca 0.01 -2.05 0.00 0.00 -0.60 0.00 0.00 54.58 51.94 1u1x n ASN 54 Cb 0.08 -0.23 0.00 0.00 -0.53 0.00 0.00 39.78 39.10 1u1x n ASN 54 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1u1x n GLY 55 N -0.54 1.31 1.75 8.20 0.00 -1.26 -5.05 105.19 109.61 1u1x n GLY 55 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 1u1x n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u1x n GLY 56 N -2.00 -2.38 0.09 -0.02 0.00 -1.26 -4.97 105.19 94.65 1u1x n GLY 56 Ca 0.00 -1.51 -0.04 0.00 0.00 0.00 0.00 46.02 44.47 1u1x n GLY 56 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1u1x h ASP 57 N -1.68 0.00 -4.99 1.61 3.32 -0.90 -3.44 116.42 110.34 1u1x h ASP 57 Ca -0.20 0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.90 1u1x h ASP 57 Cb 0.61 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.07 1u1x h ASP 57 CO 0.14 0.80 0.29 0.00 -1.72 0.00 0.00 179.24 178.74 1u1x s ALA 58 N -2.78 -1.50 -0.19 3.45 0.00 -1.23 -4.52 121.76 114.99 1u1x s ALA 58 Ca -0.01 0.23 -0.05 0.00 0.00 0.00 0.00 51.96 52.14 1u1x s ALA 58 Cb 0.09 0.79 -0.02 0.00 0.00 0.00 0.00 23.12 23.97 1u1x s ALA 58 CO 0.81 -0.89 -0.01 -1.17 0.00 0.00 0.00 175.76 174.50 1u1x s LEU 59 N -2.80 3.22 -0.20 0.00 2.96 -0.29 -0.58 118.68 120.99 1u1x s LEU 59 Ca 0.06 -0.21 -0.01 0.00 -0.22 0.00 0.00 54.13 53.75 1u1x s LEU 59 Cb -0.03 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.86 1u1x s LEU 59 CO -0.04 0.07 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.31 1u1x s ILE 60 N 0.94 2.65 -0.08 6.68 -1.09 -0.07 -0.21 121.20 130.02 1u1x s ILE 60 Ca 0.01 -0.78 -0.11 0.00 -2.23 0.00 0.00 60.65 57.54 1u1x s ILE 60 Cb -0.14 -2.19 -0.05 0.00 -1.58 0.00 0.00 42.46 38.50 1u1x s ILE 60 CO 0.02 0.46 0.26 -0.13 -1.23 0.00 0.00 174.94 174.32 1u1x s ARG 61 N 1.37 3.76 -0.15 2.79 0.52 -0.73 -4.52 118.95 121.98 1u1x s ARG 61 Ca 0.05 0.10 0.02 0.00 -0.52 0.00 0.00 55.73 55.38 1u1x s ARG 61 Cb -0.14 -3.24 0.01 0.00 0.52 0.00 0.00 34.95 32.10 1u1x s ARG 61 CO -0.08 0.65 -0.21 0.42 0.02 0.00 0.00 175.30 176.10 1u1x s ILE 62 N -0.79 2.05 -0.06 1.52 1.01 -1.26 -0.73 121.20 122.94 1u1x s ILE 62 Ca 0.18 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 59.88 1u1x s ILE 62 Cb -0.14 -1.83 0.02 0.00 0.01 0.00 0.00 42.46 40.52 1u1x s ILE 62 CO 0.07 0.55 -0.08 -0.36 0.00 0.00 0.00 174.94 175.12 1u1x s PHE 63 N 0.97 1.16 1.13 3.97 0.08 -0.49 -1.24 117.98 123.55 1u1x s PHE 63 Ca -0.03 -0.43 -0.18 0.00 0.12 0.00 0.00 56.93 56.41 1u1x s PHE 63 Cb -0.15 -0.93 0.26 0.00 -0.57 0.00 0.00 43.02 41.63 1u1x s PHE 63 CO -0.05 -0.28 1.17 0.95 -0.10 0.00 0.00 175.22 176.90 1u1x s THR 64 N 0.96 1.73 0.60 0.64 -4.23 0.85 -1.52 115.64 114.67 1u1x s THR 64 Ca -0.10 0.00 0.30 0.00 -1.18 0.00 0.00 61.69 60.72 1u1x s THR 64 Cb -0.15 -2.63 0.36 0.00 1.34 0.00 0.00 72.50 71.42 1u1x s THR 64 CO 0.00 0.00 2.09 -0.65 -0.54 0.00 0.00 174.62 175.52 1u1x h PRO 65 N -2.29 0.00 0.00 3.99 0.11 -1.74 -3.33 132.00 128.75 1u1x h PRO 65 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1u1x h PRO 65 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1u1x h PRO 65 CO 0.36 0.00 -0.32 1.33 -0.21 0.00 0.00 178.00 179.16 1u1x n VAL 66 N -3.63 0.00 -3.69 3.15 0.24 -1.26 -4.11 118.33 109.02 1u1x n VAL 66 Ca 0.01 -0.31 -0.10 0.00 -2.04 0.00 0.00 64.34 61.90 1u1x n VAL 66 Cb 0.34 0.82 -0.04 0.00 -1.47 0.00 0.00 33.84 33.49 1u1x n VAL 66 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1u1x s ASN 67 N -1.27 -0.28 0.11 -1.34 4.22 -1.25 -5.06 114.94 110.08 1u1x s ASN 67 Ca 0.00 -0.41 -0.18 0.00 -2.14 0.00 0.00 52.86 50.13 1u1x s ASN 67 Cb 0.00 0.55 -0.07 0.00 1.28 0.00 0.00 41.25 43.01 1u1x s ASN 67 CO 0.00 -1.00 0.59 -0.70 -2.04 0.00 0.00 177.10 173.95 1u1x s GLU 68 N -3.85 4.16 0.01 3.55 2.12 -1.26 -0.10 118.70 123.32 1u1x s GLU 68 Ca 0.07 0.70 0.06 0.00 0.36 0.00 0.00 54.97 56.17 1u1x s GLU 68 Cb -0.00 -3.11 -0.03 0.00 0.26 0.00 0.00 34.13 31.25 1u1x s GLU 68 CO -0.06 0.56 -0.19 -0.51 -0.54 0.00 0.00 175.26 174.53 1u1x s LEU 69 N -1.45 2.54 0.25 2.70 1.43 -0.37 -4.94 118.68 118.84 1u1x s LEU 69 Ca 0.33 -0.37 0.25 0.00 -1.03 0.00 0.00 54.13 53.31 1u1x s LEU 69 Cb -0.18 -1.49 0.55 0.00 0.03 0.00 0.00 46.19 45.09 1u1x s LEU 69 CO 0.20 0.29 1.60 1.55 0.23 0.00 0.00 176.35 180.21 1u1x h PRO 70 N 4.92 0.00 -1.87 1.29 0.13 -1.89 -3.38 132.00 131.20 1u1x h PRO 70 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1u1x h PRO 70 Cb 1.15 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.06 1u1x h PRO 70 CO 0.48 0.00 0.25 0.12 -0.23 0.00 0.00 178.00 178.62 1u1x s PHE 71 N -3.16 -0.66 -0.11 1.56 5.36 -1.26 -2.11 117.98 117.61 1u1x s PHE 71 Ca 0.08 1.51 -0.27 0.00 -0.96 0.00 0.00 56.93 57.29 1u1x s PHE 71 Cb 0.11 0.33 0.06 0.00 -0.34 0.00 0.00 43.02 43.18 1u1x s PHE 71 CO 0.65 -0.38 0.63 0.00 -1.46 0.00 0.00 175.22 174.67 1u1x s ALA 72 N -0.04 -1.62 -0.13 11.12 0.00 -1.26 -4.24 121.76 125.59 1u1x s ALA 72 Ca -0.01 1.38 -0.10 0.00 0.00 0.00 0.00 51.96 53.23 1u1x s ALA 72 Cb -0.04 -0.33 -0.07 0.00 0.00 0.00 0.00 23.12 22.68 1u1x s ALA 72 CO 0.01 -0.34 0.13 0.78 0.00 0.00 0.00 175.76 176.33 1u1x h GLY 73 N 3.75 0.00 0.89 0.00 0.00 -1.92 -3.15 103.07 102.64 1u1x h GLY 73 Ca -0.28 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.08 1u1x h GLY 73 CO 0.30 0.00 0.58 1.12 0.00 0.00 0.00 176.54 178.54 1u1x h HIS 74 N -1.00 1.09 -0.52 5.60 2.07 -1.87 -0.61 115.15 119.91 1u1x h HIS 74 Ca -0.03 0.03 -0.04 0.00 -2.85 0.00 0.00 60.37 57.47 1u1x h HIS 74 Cb 0.43 -0.36 -0.02 0.00 2.57 0.00 0.00 27.41 30.02 1u1x h HIS 74 CO 0.01 0.64 0.15 -1.35 -3.07 0.00 0.00 177.93 174.31 1u1x h PRO 75 N 1.14 0.81 -0.17 5.12 0.11 -1.93 0.24 132.00 137.32 1u1x h PRO 75 Ca 0.35 -0.18 -0.14 0.00 0.11 0.00 0.00 66.00 66.14 1u1x h PRO 75 Cb -0.01 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 1u1x h PRO 75 CO -0.11 0.76 -0.49 1.25 -0.21 0.00 0.00 178.00 179.20 1u1x h LEU 76 N 0.71 0.50 -0.12 2.35 5.85 -1.45 0.20 115.31 123.36 1u1x h LEU 76 Ca 0.17 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1u1x h LEU 76 Cb 0.30 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1u1x h LEU 76 CO -0.00 0.91 0.04 0.25 -0.34 0.00 0.00 178.44 179.31 1u1x h LEU 77 N 0.37 0.17 -0.89 2.25 5.85 -0.93 0.05 115.31 122.17 1u1x h LEU 77 Ca 0.02 -0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 1u1x h LEU 77 Cb 1.00 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 1u1x h LEU 77 CO 0.09 0.30 0.16 1.23 -0.34 0.00 0.00 178.44 179.88 1u1x h GLY 78 N 0.03 1.05 1.26 3.75 0.00 -0.71 -1.41 103.07 107.04 1u1x h GLY 78 Ca 0.04 -0.62 -0.11 0.00 0.00 0.00 0.00 47.33 46.63 1u1x h GLY 78 CO -0.00 0.58 -0.17 -0.84 0.00 0.00 0.00 176.54 176.11 1u1x h THR 79 N 0.94 1.27 -0.36 4.70 2.02 -0.72 -1.40 112.91 119.35 1u1x h THR 79 Ca 0.20 -1.29 -0.08 0.00 0.77 0.00 0.00 66.41 66.01 1u1x h THR 79 Cb 0.32 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1u1x h THR 79 CO -0.00 0.44 -0.09 0.00 0.37 0.00 0.00 175.52 176.24 1u1x h ALA 80 N 1.05 0.50 -0.47 6.16 0.00 -0.51 -0.43 119.26 125.55 1u1x h ALA 80 Ca 0.11 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1u1x h ALA 80 Cb 0.70 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1u1x h ALA 80 CO 0.05 0.36 0.30 0.82 0.00 0.00 0.00 179.25 180.78 1u1x h ILE 81 N 0.50 1.10 -0.13 0.00 2.04 -1.12 -0.73 117.51 119.17 1u1x h ILE 81 Ca 0.09 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1u1x h ILE 81 Cb 0.60 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1u1x h ILE 81 CO 0.04 0.11 0.05 0.00 0.00 0.00 0.00 178.15 178.35 1u1x h ALA 82 N 1.18 0.17 0.00 1.87 0.00 -1.14 -3.19 119.26 118.16 1u1x h ALA 82 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1u1x h ALA 82 Cb -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1u1x h ALA 82 CO -0.05 -0.23 0.00 1.25 0.00 0.00 0.00 179.25 180.22 1u1x h LEU 83 N 0.05 0.00 -1.72 0.00 5.85 -1.10 -2.55 115.31 115.84 1u1x h LEU 83 Ca 0.04 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.84 1u1x h LEU 83 Cb 0.19 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1u1x h LEU 83 CO -0.00 0.00 0.33 1.23 -0.34 0.00 0.00 178.44 179.66 1u1x h GLY 84 N 3.04 0.44 2.00 3.75 0.00 -1.11 -1.48 103.07 109.72 1u1x h GLY 84 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1u1x h GLY 84 CO 0.00 0.10 -0.07 0.00 0.00 0.00 0.00 176.54 176.56 1u1x h ALA 85 N 1.75 1.23 -0.16 3.60 0.00 -1.52 -3.05 119.26 121.11 1u1x h ALA 85 Ca 0.22 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1u1x h ALA 85 Cb 0.43 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1u1x h ALA 85 CO -0.05 0.09 -0.43 0.45 0.00 0.00 0.00 179.25 179.31 1u1x h HIS 86 N 0.00 0.44 -3.72 0.00 -0.00 -1.43 -3.47 115.15 106.98 1u1x h HIS 86 Ca -0.00 -0.13 -0.21 0.00 -0.00 0.00 0.00 60.37 60.03 1u1x h HIS 86 Cb 0.27 -0.09 -0.05 0.00 -0.00 0.00 0.00 27.41 27.54 1u1x h HIS 86 CO 0.00 0.75 -0.18 0.25 -0.00 0.00 0.00 177.93 178.75 1u1x n THR 87 N -4.01 0.00 0.56 2.45 -2.24 -1.15 -5.06 114.28 104.84 1u1x n THR 87 Ca -0.02 -0.90 0.07 0.00 -2.27 0.00 0.00 64.05 60.93 1u1x n THR 87 Cb 0.51 0.32 0.05 0.00 -2.10 0.00 0.00 70.33 69.11 1u1x n THR 87 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1u1x n ASP 88 N -1.83 2.06 -4.75 3.42 8.00 -1.26 -4.93 116.55 117.26 1u1x n ASP 88 Ca -0.02 -1.53 -0.38 0.00 0.71 0.00 0.00 54.79 53.57 1u1x n ASP 88 Cb 0.23 0.04 0.04 0.00 -0.02 0.00 0.00 41.12 41.41 1u1x n ASP 88 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1u1x s ASN 89 N -1.17 5.26 0.00 -2.24 0.01 -1.26 -4.94 114.94 110.60 1u1x s ASN 89 Ca 0.15 2.68 0.19 0.00 -0.71 0.00 0.00 52.86 55.18 1u1x s ASN 89 Cb 0.11 -2.63 -0.14 0.00 0.41 0.00 0.00 41.25 39.01 1u1x s ASN 89 CO 0.18 -1.57 0.87 0.00 -1.51 0.00 0.00 177.10 175.07 1u1x n HIS 90 N -1.12 0.00 -4.17 2.20 1.44 -1.26 -4.87 115.22 107.43 1u1x n HIS 90 Ca 0.11 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.48 1u1x n HIS 90 Cb 0.46 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.42 1u1x n HIS 90 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 1u1x s ARG 91 N -2.59 3.24 0.12 -1.40 1.81 -1.26 -0.05 118.95 118.83 1u1x s ARG 91 Ca 0.10 -0.71 0.11 0.00 -1.72 0.00 0.00 55.73 53.51 1u1x s ARG 91 Cb 0.15 -2.78 -0.04 0.00 -0.45 0.00 0.00 34.95 31.83 1u1x s ARG 91 CO 0.68 -0.12 -0.27 -0.51 -0.68 0.00 0.00 175.30 174.41 1u1x s LEU 92 N 1.18 2.31 -0.20 2.53 1.43 -0.34 -5.01 118.68 120.58 1u1x s LEU 92 Ca 0.02 -0.74 0.00 0.00 -1.03 0.00 0.00 54.13 52.38 1u1x s LEU 92 Cb -0.14 -1.21 0.05 0.00 0.03 0.00 0.00 46.19 44.91 1u1x s LEU 92 CO -0.04 0.18 -0.07 -0.31 0.23 0.00 0.00 176.35 176.33 1u1x s TYR 93 N -1.05 2.24 -0.22 0.29 2.02 -1.26 -0.53 117.35 118.84 1u1x s TYR 93 Ca 0.14 -1.53 -0.04 0.00 -0.37 0.00 0.00 57.07 55.26 1u1x s TYR 93 Cb -0.10 -1.54 -0.01 0.00 -0.40 0.00 0.00 41.96 39.91 1u1x s TYR 93 CO 0.06 -0.73 -0.03 -0.51 -1.57 0.00 0.00 175.55 172.77 1u1x s LEU 94 N 1.45 2.98 0.28 -1.29 1.43 -0.61 -0.09 118.68 122.83 1u1x s LEU 94 Ca -0.03 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.42 1u1x s LEU 94 Cb -0.17 -1.76 -0.09 0.00 0.03 0.00 0.00 46.19 44.19 1u1x s LEU 94 CO -0.07 -0.01 1.08 -1.61 0.23 0.00 0.00 176.35 175.97 1u1x s GLU 95 N 1.44 4.65 0.31 1.70 2.02 0.25 -0.20 118.70 128.87 1u1x s GLU 95 Ca 0.05 1.77 0.06 0.00 0.02 0.00 0.00 54.97 56.87 1u1x s GLU 95 Cb -0.14 -3.18 -0.03 0.00 0.10 0.00 0.00 34.13 30.87 1u1x s GLU 95 CO -0.02 0.23 0.24 0.95 0.02 0.00 0.00 175.26 176.68 1u1x s THR 96 N -1.18 0.03 0.30 3.63 -4.23 -0.71 -0.89 115.64 112.59 1u1x s THR 96 Ca 0.44 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.94 1u1x s THR 96 Cb -0.31 -2.49 0.23 0.00 1.34 0.00 0.00 72.50 71.26 1u1x s THR 96 CO 0.40 0.00 1.93 -0.61 -0.54 0.00 0.00 174.62 175.80 1u1x h GLN 97 N 2.22 0.98 0.00 3.99 4.15 -1.80 -2.04 115.11 122.61 1u1x h GLN 97 Ca -0.28 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.04 1u1x h GLN 97 Cb 1.24 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.73 1u1x h GLN 97 CO 0.40 0.72 0.00 -1.33 -1.93 0.00 0.00 178.83 176.69 1u1x n MET 98 N -4.37 0.49 0.00 1.69 2.81 -0.90 -5.01 117.12 111.84 1u1x n MET 98 Ca 0.07 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 56.00 1u1x n MET 98 Cb 0.09 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.10 1u1x n MET 98 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1u1x n GLY 99 N 0.33 -0.69 3.66 3.03 0.00 -0.77 -5.03 105.19 105.72 1u1x n GLY 99 Ca 0.13 -2.25 -0.41 0.00 0.00 0.00 0.00 46.02 43.49 1u1x n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u1x s THR 100 N -0.73 4.96 -0.30 2.61 2.01 -1.26 -1.74 115.64 121.20 1u1x s THR 100 Ca 0.00 1.33 -0.12 0.00 0.31 0.00 0.00 61.69 63.21 1u1x s THR 100 Cb 0.00 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 1u1x s THR 100 CO 0.00 0.06 0.22 -0.63 -0.69 0.00 0.00 174.62 173.58 1u1x s ILE 101 N 2.15 5.29 0.13 1.82 -1.09 0.72 -4.92 121.20 125.30 1u1x s ILE 101 Ca 0.31 0.10 -0.28 0.00 -2.23 0.00 0.00 60.65 58.55 1u1x s ILE 101 Cb -0.16 -3.60 -0.07 0.00 -1.58 0.00 0.00 42.46 37.06 1u1x s ILE 101 CO 0.10 0.17 0.87 0.00 -1.23 0.00 0.00 174.94 174.85 1u1x s ALA 102 N 1.78 3.34 -0.02 9.38 0.00 -1.26 -1.57 121.76 133.40 1u1x s ALA 102 Ca 0.07 0.46 0.06 0.00 0.00 0.00 0.00 51.96 52.56 1u1x s ALA 102 Cb -0.16 -3.12 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 1u1x s ALA 102 CO 0.11 0.11 -0.21 -0.06 0.00 0.00 0.00 175.76 175.72 1u1x s PHE 103 N -0.50 1.90 -0.25 0.00 0.08 0.31 -1.89 117.98 117.63 1u1x s PHE 103 Ca 0.41 -0.40 -0.06 0.00 0.12 0.00 0.00 56.93 57.00 1u1x s PHE 103 Cb -0.23 -1.23 -0.01 0.00 -0.57 0.00 0.00 43.02 40.97 1u1x s PHE 103 CO 0.28 -0.06 0.04 -2.00 -0.10 0.00 0.00 175.22 173.37 1u1x s GLU 104 N -0.40 3.43 -0.07 0.44 2.56 -0.40 -1.20 118.70 123.06 1u1x s GLU 104 Ca 0.06 -0.62 -0.16 0.00 0.00 0.00 0.00 54.97 54.25 1u1x s GLU 104 Cb -0.09 -3.25 -0.05 0.00 2.00 0.00 0.00 34.13 32.74 1u1x s GLU 104 CO -0.00 -0.26 0.42 -0.51 -0.56 0.00 0.00 175.26 174.35 1u1x s LEU 105 N 1.55 4.36 -0.36 2.70 1.43 0.93 -1.68 118.68 127.61 1u1x s LEU 105 Ca 0.05 0.84 -0.18 0.00 -1.03 0.00 0.00 54.13 53.81 1u1x s LEU 105 Cb -0.15 -2.60 0.00 0.00 0.03 0.00 0.00 46.19 43.46 1u1x s LEU 105 CO 0.01 0.16 0.52 -0.70 0.23 0.00 0.00 176.35 176.58 1u1x s GLU 106 N -0.16 3.55 0.10 1.70 2.56 -0.12 -4.87 118.70 121.46 1u1x s GLU 106 Ca 0.24 -0.22 0.09 0.00 0.00 0.00 0.00 54.97 55.08 1u1x s GLU 106 Cb -0.16 -3.83 -0.03 0.00 2.00 0.00 0.00 34.13 32.11 1u1x s GLU 106 CO 0.11 -0.70 -0.24 1.03 -0.56 0.00 0.00 175.26 174.90 1u1x s ARG 107 N 2.43 1.33 -0.12 4.30 0.52 -1.26 -0.52 118.95 125.62 1u1x s ARG 107 Ca 0.19 -1.19 -0.00 0.00 -0.52 0.00 0.00 55.73 54.21 1u1x s ARG 107 Cb -0.15 -1.65 0.03 0.00 0.52 0.00 0.00 34.95 33.70 1u1x s ARG 107 CO 0.14 0.40 -0.08 -1.14 0.02 0.00 0.00 175.30 174.63 1u1x s GLN 108 N -1.77 1.61 -1.40 3.54 0.74 -0.19 -4.78 119.66 117.40 1u1x s GLN 108 Ca 0.10 -0.32 -0.04 0.00 0.05 0.00 0.00 55.36 55.15 1u1x s GLN 108 Cb -0.10 -1.70 0.00 0.00 1.10 0.00 0.00 33.01 32.31 1u1x s GLN 108 CO 0.04 -0.28 0.50 -1.71 -0.55 0.00 0.00 175.29 173.29 1u1x n ASN 109 N 4.91 -5.62 0.00 6.67 2.85 -1.26 -0.95 115.26 121.86 1u1x n ASN 109 Ca -0.13 -0.24 0.00 0.00 -0.11 0.00 0.00 54.58 54.10 1u1x n ASN 109 Cb 0.50 -4.47 0.00 0.00 1.24 0.00 0.00 39.78 37.05 1u1x n ASN 109 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1u1x n GLY 110 N -1.41 1.97 3.69 8.20 0.00 -1.26 -5.01 105.19 111.36 1u1x n GLY 110 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 1u1x n GLY 110 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1u1x s SER 111 N -3.42 6.64 0.04 1.61 0.15 -0.12 -4.95 113.70 113.65 1u1x s SER 111 Ca 0.00 0.77 -0.30 0.00 0.70 0.00 0.00 55.95 57.12 1u1x s SER 111 Cb 0.00 -2.30 -0.05 0.00 -1.71 0.00 0.00 66.02 61.96 1u1x s SER 111 CO 0.00 -0.12 1.21 -0.69 1.20 0.00 0.00 173.24 174.84 1u1x s VAL 112 N 1.25 4.07 -0.10 4.45 1.01 -1.26 -1.03 120.40 128.78 1u1x s VAL 112 Ca 0.26 1.47 0.06 0.00 0.00 0.00 0.00 61.98 63.77 1u1x s VAL 112 Cb -0.15 -3.94 -0.11 0.00 0.00 0.00 0.00 36.38 32.18 1u1x s VAL 112 CO 0.10 0.09 -0.01 -0.38 0.00 0.00 0.00 175.10 174.90 1u1x n ILE 113 N 4.08 0.68 -3.69 2.22 5.41 0.32 -4.96 119.36 123.42 1u1x n ILE 113 Ca 0.09 -0.37 -0.07 0.00 1.00 0.00 0.00 62.75 63.40 1u1x n ILE 113 Cb 0.46 -0.80 -0.02 0.00 -0.71 0.00 0.00 39.64 38.57 1u1x n ILE 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1u1x s ALA 114 N -2.24 -1.50 0.13 -1.39 0.00 -1.14 -2.76 121.76 112.86 1u1x s ALA 114 Ca -0.09 0.16 -0.13 0.00 0.00 0.00 0.00 51.96 51.90 1u1x s ALA 114 Cb 0.03 0.75 0.02 0.00 0.00 0.00 0.00 23.12 23.92 1u1x s ALA 114 CO 0.36 -0.93 0.34 0.00 0.00 0.00 0.00 175.76 175.53 1u1x s ALA 115 N -3.61 -0.59 -0.03 0.00 0.00 -0.68 -0.94 121.76 115.90 1u1x s ALA 115 Ca 0.08 -0.36 0.01 0.00 0.00 0.00 0.00 51.96 51.70 1u1x s ALA 115 Cb -0.03 0.68 0.02 0.00 0.00 0.00 0.00 23.12 23.79 1u1x s ALA 115 CO -0.01 -0.63 -0.05 0.45 0.00 0.00 0.00 175.76 175.53 1u1x s SER 116 N -2.85 0.83 0.19 0.00 0.15 -0.67 -1.63 113.70 109.72 1u1x s SER 116 Ca 0.06 -0.12 0.10 0.00 0.70 0.00 0.00 55.95 56.70 1u1x s SER 116 Cb 0.03 -0.33 -0.04 0.00 -1.71 0.00 0.00 66.02 63.96 1u1x s SER 116 CO -0.09 -0.02 -0.15 0.00 1.20 0.00 0.00 173.24 174.18 1u1x s MET 117 N 0.63 1.84 -0.40 5.44 0.23 0.17 -1.28 119.30 125.93 1u1x s MET 117 Ca -0.08 -1.39 -0.15 0.00 -1.03 0.00 0.00 55.69 53.04 1u1x s MET 117 Cb -0.11 -2.02 0.01 0.00 -1.53 0.00 0.00 34.83 31.18 1u1x s MET 117 CO 0.00 0.42 0.33 -0.51 -2.03 0.00 0.00 175.02 173.23 1u1x s ASP 118 N -2.80 6.13 0.63 -1.18 1.11 -0.79 -1.65 116.67 118.12 1u1x s ASP 118 Ca 0.24 -0.74 -0.10 0.00 0.18 0.00 0.00 52.55 52.13 1u1x s ASP 118 Cb -0.08 -2.18 -0.02 0.00 1.07 0.00 0.00 42.92 41.71 1u1x s ASP 118 CO 0.13 -0.45 1.01 -1.10 1.18 0.00 0.00 175.17 175.94 1u1x s GLN 119 N 1.83 3.31 0.45 8.23 -0.21 0.32 -4.39 119.66 129.19 1u1x s GLN 119 Ca 0.07 0.54 -0.25 0.00 0.02 0.00 0.00 55.36 55.74 1u1x s GLN 119 Cb -0.18 -2.11 -0.08 0.00 1.00 0.00 0.00 33.01 31.64 1u1x s GLN 119 CO 0.11 -0.69 1.38 -2.14 -2.12 0.00 0.00 175.29 171.83 1u1x s PRO 120 N -5.17 3.70 -0.14 2.91 0.02 -1.26 -4.54 135.00 130.51 1u1x s PRO 120 Ca 0.55 2.31 -0.29 0.00 0.02 0.00 0.00 61.00 63.58 1u1x s PRO 120 Cb -0.11 -2.63 -0.03 0.00 0.02 0.00 0.00 34.50 31.75 1u1x s PRO 120 CO 0.52 -0.77 1.48 0.42 -0.33 0.00 0.00 177.00 178.32 1u1x s ILE 121 N -1.24 3.89 0.63 2.83 -1.09 -1.26 -4.93 121.20 120.03 1u1x s ILE 121 Ca 0.61 1.06 -0.15 0.00 -2.23 0.00 0.00 60.65 59.95 1u1x s ILE 121 Cb -0.41 -3.75 -0.02 0.00 -1.58 0.00 0.00 42.46 36.70 1u1x s ILE 121 CO 0.53 -0.16 1.07 -2.16 -1.23 0.00 0.00 174.94 172.98 1u1x s PRO 122 N 3.98 3.12 0.35 2.79 0.04 -1.26 -4.89 135.00 139.13 1u1x s PRO 122 Ca 0.65 1.20 0.07 0.00 0.04 0.00 0.00 61.00 62.96 1u1x s PRO 122 Cb -0.26 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 1u1x s PRO 122 CO 0.24 -0.97 0.36 0.95 0.04 0.00 0.00 177.00 177.62 1u1x s THR 123 N -2.55 3.58 0.14 1.26 -4.23 -0.98 -4.93 115.64 107.93 1u1x s THR 123 Ca 0.63 -1.24 -0.11 0.00 -1.18 0.00 0.00 61.69 59.79 1u1x s THR 123 Cb -0.17 -3.22 0.01 0.00 1.34 0.00 0.00 72.50 70.46 1u1x s THR 123 CO 0.41 -0.14 0.32 -1.66 -0.54 0.00 0.00 174.62 173.01 1u1x s TRP 124 N -2.29 0.16 0.32 3.99 -2.14 -1.26 -0.32 118.94 117.40 1u1x s TRP 124 Ca 0.43 -0.53 -0.18 0.00 2.66 0.00 0.00 56.10 58.49 1u1x s TRP 124 Cb -0.07 0.06 0.03 0.00 -3.10 0.00 0.00 33.47 30.40 1u1x s TRP 124 CO 0.28 -0.70 0.72 -0.08 -2.66 0.00 0.00 176.95 174.51 1u1x s THR 125 N -3.90 0.00 0.27 0.66 -1.32 -0.74 -4.99 115.64 105.62 1u1x s THR 125 Ca 0.10 -1.05 -0.29 0.00 -1.21 0.00 0.00 61.69 59.24 1u1x s THR 125 Cb 0.03 -2.37 -0.10 0.00 -1.51 0.00 0.00 72.50 68.55 1u1x s THR 125 CO -0.05 0.00 1.33 0.00 -2.21 0.00 0.00 174.62 173.68 1u1x s ALA 126 N -3.28 3.53 0.13 11.08 0.00 -1.26 -0.65 121.76 131.31 1u1x s ALA 126 Ca 0.14 1.22 -0.19 0.00 0.00 0.00 0.00 51.96 53.13 1u1x s ALA 126 Cb -0.05 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 1u1x s ALA 126 CO 0.09 -0.61 1.79 1.25 0.00 0.00 0.00 175.76 178.28 1u1x h LEU 127 N 4.33 0.30 0.14 0.00 5.85 -1.69 -3.44 115.31 120.80 1u1x h LEU 127 Ca -0.47 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.18 1u1x h LEU 127 Cb 1.22 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 1u1x h LEU 127 CO 0.72 0.22 -0.05 0.61 -0.34 0.00 0.00 178.44 179.59 1u1x n GLY 128 N -1.17 0.61 2.71 3.75 0.00 -1.26 -4.92 105.19 104.92 1u1x n GLY 128 Ca -0.02 -0.71 -0.06 0.00 0.00 0.00 0.00 46.02 45.23 1u1x n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u1x n ARG 129 N -2.76 1.68 0.10 1.61 1.74 -1.26 -4.98 116.66 112.78 1u1x n ARG 129 Ca -0.03 -3.49 -0.13 0.00 -0.77 0.00 0.00 57.85 53.43 1u1x n ARG 129 Cb 0.12 -1.53 -0.08 0.00 -1.02 0.00 0.00 32.46 29.94 1u1x n ARG 129 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1u1x h ASP 130 N 2.73 -0.22 -0.69 0.55 5.19 -1.96 -1.44 116.42 120.58 1u1x h ASP 130 Ca -0.08 -0.23 0.14 0.00 -0.62 0.00 0.00 57.03 56.25 1u1x h ASP 130 Cb 1.24 0.06 -0.10 0.00 0.18 0.00 0.00 39.33 40.70 1u1x h ASP 130 CO 0.36 0.12 0.15 0.00 -3.12 0.00 0.00 179.24 176.76 1u1x h ALA 131 N 0.14 0.86 -0.57 3.45 0.00 -1.97 -0.03 119.26 121.14 1u1x h ALA 131 Ca -0.03 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1u1x h ALA 131 Cb 0.43 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1u1x h ALA 131 CO 0.04 -0.33 0.08 1.49 0.00 0.00 0.00 179.25 180.54 1u1x h GLU 132 N 0.26 0.94 -0.13 0.00 4.81 -1.93 -1.53 114.58 117.01 1u1x h GLU 132 Ca 0.38 -0.26 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 1u1x h GLU 132 Cb 0.62 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1u1x h GLU 132 CO -0.48 0.91 -0.24 1.25 -0.73 0.00 0.00 179.01 179.71 1u1x h LEU 133 N 0.84 0.44 -0.78 1.64 5.85 -0.59 -1.54 115.31 121.16 1u1x h LEU 133 Ca 0.17 -0.55 -0.09 0.00 0.84 0.00 0.00 57.88 58.24 1u1x h LEU 133 Cb 0.43 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1u1x h LEU 133 CO 0.01 0.91 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.86 1u1x h LEU 134 N -0.02 0.81 -0.24 2.25 3.38 -1.01 -0.33 115.31 120.16 1u1x h LEU 134 Ca 0.01 -0.24 0.06 0.00 0.09 0.00 0.00 57.88 57.79 1u1x h LEU 134 Cb 0.83 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 1u1x h LEU 134 CO 0.05 0.93 -0.14 0.50 0.09 0.00 0.00 178.44 179.87 1u1x h LYS 135 N 0.75 -0.12 -0.91 1.13 3.64 -1.19 0.86 116.57 120.73 1u1x h LYS 135 Ca 0.13 0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.66 1u1x h LYS 135 Cb 0.59 0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 32.34 1u1x h LYS 135 CO 0.04 -0.08 0.51 0.00 -2.27 0.00 0.00 179.45 177.65 1u1x h ALA 136 N 1.04 1.39 0.00 5.00 0.00 -0.50 -2.37 119.26 123.82 1u1x h ALA 136 Ca 0.13 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1u1x h ALA 136 Cb 0.32 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1u1x h ALA 136 CO -0.31 0.00 -0.32 -0.07 0.00 0.00 0.00 179.25 178.54 1u1x h LEU 137 N 0.74 0.00 0.00 0.00 3.38 -0.66 -0.46 115.31 118.31 1u1x h LEU 137 Ca 0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.46 1u1x h LEU 137 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1u1x h LEU 137 CO -0.33 0.32 0.00 0.61 0.09 0.00 0.00 178.44 179.13 1u1x n GLY 138 N 1.12 1.40 3.28 0.83 0.00 0.14 -4.23 105.19 107.74 1u1x n GLY 138 Ca 0.03 -0.32 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 1u1x n GLY 138 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1u1x s ILE 139 N -2.00 0.50 -0.10 -0.61 -4.36 -0.30 -5.02 121.20 109.31 1u1x s ILE 139 Ca 0.00 -1.99 -0.14 0.00 -0.26 0.00 0.00 60.65 58.25 1u1x s ILE 139 Cb 0.00 -2.47 -0.27 0.00 1.25 0.00 0.00 42.46 40.96 1u1x s ILE 139 CO 0.00 -0.13 0.55 0.77 0.24 0.00 0.00 174.94 176.37 1u1x h SER 140 N 2.51 0.41 -5.09 4.36 4.64 -1.99 -3.36 113.55 115.03 1u1x h SER 140 Ca -0.37 -0.87 -0.06 0.00 -0.47 0.00 0.00 61.79 60.02 1u1x h SER 140 Cb 1.24 -0.13 -0.13 0.00 -0.31 0.00 0.00 62.40 63.06 1u1x h SER 140 CO 0.60 1.66 -0.11 -1.81 -0.87 0.00 0.00 176.83 176.30 1u1x s ASP 141 N -7.07 -0.19 -0.06 4.97 1.01 -1.26 -5.01 116.67 109.06 1u1x s ASP 141 Ca -0.20 -0.36 -0.02 0.00 0.71 0.00 0.00 52.55 52.69 1u1x s ASP 141 Cb 0.05 0.46 -0.04 0.00 1.01 0.00 0.00 42.92 44.40 1u1x s ASP 141 CO 0.78 -0.84 0.06 -0.55 0.21 0.00 0.00 175.17 174.83 1u1x s SER 142 N -2.81 5.65 0.54 0.27 0.15 -1.26 -4.92 113.70 111.31 1u1x s SER 142 Ca 0.03 0.20 0.30 0.00 0.70 0.00 0.00 55.95 57.19 1u1x s SER 142 Cb 0.02 -1.65 1.49 0.00 -1.71 0.00 0.00 66.02 64.17 1u1x s SER 142 CO -0.12 0.34 2.06 0.71 1.20 0.00 0.00 173.24 177.43 1u1x h THR 143 N 3.70 0.39 -3.89 6.45 1.35 -1.68 -3.44 112.91 115.78 1u1x h THR 143 Ca -0.51 -0.54 -0.23 0.00 -0.55 0.00 0.00 66.41 64.58 1u1x h THR 143 Cb 1.19 1.39 -0.17 0.00 -1.73 0.00 0.00 68.15 68.84 1u1x h THR 143 CO 0.59 0.10 -0.70 -0.36 -0.25 0.00 0.00 175.52 174.89 1u1x s PHE 144 N -4.02 0.79 0.24 4.73 0.08 -1.26 -5.03 117.98 113.52 1u1x s PHE 144 Ca -0.02 -0.82 -0.29 0.00 0.12 0.00 0.00 56.93 55.92 1u1x s PHE 144 Cb 0.12 -0.47 -0.15 0.00 -0.57 0.00 0.00 43.02 41.95 1u1x s PHE 144 CO 0.56 -0.15 0.88 -2.30 -0.10 0.00 0.00 175.22 174.11 1u1x n PRO 145 N 0.38 0.89 -2.96 0.24 -0.02 -1.26 -4.60 135.00 127.66 1u1x n PRO 145 Ca -0.15 0.31 -0.43 0.00 -2.02 0.00 0.00 63.50 61.21 1u1x n PRO 145 Cb 0.59 -1.59 -0.05 0.00 -0.02 0.00 0.00 33.50 32.43 1u1x n PRO 145 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1u1x s ILE 146 N -0.92 4.62 0.22 4.25 1.01 -1.26 -4.91 121.20 124.20 1u1x s ILE 146 Ca 0.62 0.24 0.10 0.00 0.00 0.00 0.00 60.65 61.61 1u1x s ILE 146 Cb -0.80 -4.37 -0.05 0.00 0.01 0.00 0.00 42.46 37.25 1u1x s ILE 146 CO 0.58 -0.83 -0.20 -1.61 0.00 0.00 0.00 174.94 172.88 1u1x s GLU 147 N 3.35 1.47 -0.08 2.79 2.02 -1.25 -1.89 118.70 125.11 1u1x s GLU 147 Ca 0.27 -1.58 0.03 0.00 0.02 0.00 0.00 54.97 53.72 1u1x s GLU 147 Cb -0.13 -1.56 0.00 0.00 0.10 0.00 0.00 34.13 32.54 1u1x s GLU 147 CO 0.20 0.31 -0.19 -1.50 0.02 0.00 0.00 175.26 174.10 1u1x s ILE 148 N -2.26 1.63 -0.03 -1.63 2.07 0.17 -2.08 121.20 119.08 1u1x s ILE 148 Ca 0.23 -0.78 0.05 0.00 -1.41 0.00 0.00 60.65 58.73 1u1x s ILE 148 Cb -0.05 -1.43 -0.03 0.00 0.13 0.00 0.00 42.46 41.08 1u1x s ILE 148 CO 0.10 0.46 -0.16 -0.31 -1.91 0.00 0.00 174.94 173.12 1u1x s TYR 149 N 0.40 2.64 -0.16 3.50 2.02 0.12 -1.79 117.35 124.08 1u1x s TYR 149 Ca -0.15 -0.20 0.01 0.00 -0.37 0.00 0.00 57.07 56.36 1u1x s TYR 149 Cb -0.16 -1.59 0.02 0.00 -0.40 0.00 0.00 41.96 39.83 1u1x s TYR 149 CO 0.06 0.17 -0.16 -1.58 -1.57 0.00 0.00 175.55 172.47 1u1x s HIS 150 N -0.75 2.42 -0.07 2.71 5.65 0.57 -1.28 115.29 124.54 1u1x s HIS 150 Ca 0.12 -1.41 0.21 0.00 0.25 0.00 0.00 55.06 54.23 1u1x s HIS 150 Cb -0.11 -1.73 0.42 0.00 -1.18 0.00 0.00 32.58 29.99 1u1x s HIS 150 CO 0.01 -0.73 1.18 0.27 -0.65 0.00 0.00 174.74 174.83 1u1x n ASN 151 N 4.71 1.23 0.00 9.88 0.23 -1.26 -2.33 115.26 127.71 1u1x n ASN 151 Ca -0.18 -2.63 0.00 0.00 -0.53 0.00 0.00 54.58 51.24 1u1x n ASN 151 Cb 0.50 -0.37 0.00 0.00 -2.08 0.00 0.00 39.78 37.82 1u1x n ASN 151 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1u1x n GLY 152 N -0.04 2.00 3.67 4.83 0.00 -1.26 -4.75 105.19 109.63 1u1x n GLY 152 Ca 0.10 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 1u1x n GLY 152 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1u1x s PRO 153 N 0.00 -1.00 0.09 1.61 0.04 -1.26 -4.85 135.00 129.62 1u1x s PRO 153 Ca 0.00 -0.23 0.09 0.00 0.04 0.00 0.00 61.00 60.89 1u1x s PRO 153 Cb 0.00 -1.64 -0.03 0.00 0.04 0.00 0.00 34.50 32.87 1u1x s PRO 153 CO 0.00 -3.54 -0.22 1.03 0.04 0.00 0.00 177.00 174.31 1u1x s ARG 154 N -5.58 1.31 -0.04 4.56 0.52 -1.26 -4.42 118.95 114.03 1u1x s ARG 154 Ca 0.73 -1.13 -0.01 0.00 -0.52 0.00 0.00 55.73 54.80 1u1x s ARG 154 Cb -0.07 -1.56 0.03 0.00 0.52 0.00 0.00 34.95 33.87 1u1x s ARG 154 CO 0.55 0.38 0.03 -1.01 0.02 0.00 0.00 175.30 175.27 1u1x s HIS 155 N -1.01 0.23 -0.07 -0.53 3.76 -0.41 -0.89 115.29 116.38 1u1x s HIS 155 Ca 0.09 0.08 -0.03 0.00 -0.15 0.00 0.00 55.06 55.04 1u1x s HIS 155 Cb -0.10 -0.46 -0.04 0.00 1.11 0.00 0.00 32.58 33.09 1u1x s HIS 155 CO 0.04 -0.17 0.08 0.08 -0.85 0.00 0.00 174.74 173.91 1u1x s VAL 156 N 1.55 4.89 -0.12 -0.90 1.01 -0.44 -0.70 120.40 125.70 1u1x s VAL 156 Ca -0.03 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 61.86 1u1x s VAL 156 Cb -0.13 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1u1x s VAL 156 CO -0.03 0.53 -0.23 -0.36 0.00 0.00 0.00 175.10 175.01 1u1x s PHE 157 N -1.04 2.60 -0.10 5.22 0.08 -0.88 -0.47 117.98 123.39 1u1x s PHE 157 Ca 0.17 -1.17 0.01 0.00 0.12 0.00 0.00 56.93 56.06 1u1x s PHE 157 Cb -0.12 -1.75 0.02 0.00 -0.57 0.00 0.00 43.02 40.60 1u1x s PHE 157 CO 0.07 -0.50 -0.10 0.08 -0.10 0.00 0.00 175.22 174.67 1u1x s VAL 158 N 0.52 1.15 0.02 -0.44 1.01 -0.59 -3.94 120.40 118.14 1u1x s VAL 158 Ca -0.14 -0.41 -0.17 0.00 0.00 0.00 0.00 61.98 61.26 1u1x s VAL 158 Cb -0.17 -1.12 -0.06 0.00 0.00 0.00 0.00 36.38 35.03 1u1x s VAL 158 CO 0.05 0.38 0.49 -0.83 0.00 0.00 0.00 175.10 175.19 1u1x s GLY 159 N 1.34 2.56 0.11 4.51 0.00 -1.26 -1.37 107.32 113.20 1u1x s GLY 159 Ca -0.01 -0.10 0.06 0.00 0.00 0.00 0.00 44.72 44.67 1u1x s GLY 159 CO -0.05 0.37 -0.03 1.08 0.00 0.00 0.00 173.10 174.47 1u1x s LEU 160 N -0.86 3.30 0.00 0.66 2.01 0.12 -1.70 118.68 122.21 1u1x s LEU 160 Ca 0.26 -0.29 0.28 0.00 0.01 0.00 0.00 54.13 54.40 1u1x s LEU 160 Cb -0.18 -2.03 1.28 0.00 0.01 0.00 0.00 46.19 45.27 1u1x s LEU 160 CO 0.15 0.16 1.93 -0.81 1.01 0.00 0.00 176.35 178.79 1u1x n PRO 161 N 0.45 0.13 -3.54 1.29 -0.04 -1.26 -4.51 135.00 127.52 1u1x n PRO 161 Ca -0.11 0.02 -0.09 0.00 -0.04 0.00 0.00 63.50 63.27 1u1x n PRO 161 Cb 0.53 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.47 1u1x n PRO 161 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1u1x s SER 162 N -2.87 -0.41 0.17 3.54 1.04 -1.26 -4.95 113.70 108.96 1u1x s SER 162 Ca 0.18 -0.12 -0.10 0.00 0.48 0.00 0.00 55.95 56.38 1u1x s SER 162 Cb 0.19 0.52 0.05 0.00 0.10 0.00 0.00 66.02 66.88 1u1x s SER 162 CO 0.49 -0.88 1.63 0.40 0.98 0.00 0.00 173.24 175.85 1u1x h ILE 163 N 2.00 1.27 -0.82 -1.02 2.04 -1.90 -1.26 117.51 117.81 1u1x h ILE 163 Ca -0.27 -1.14 0.06 0.00 1.00 0.00 0.00 64.86 64.52 1u1x h ILE 163 Cb 1.27 0.86 -0.06 0.00 -0.74 0.00 0.00 36.82 38.15 1u1x h ILE 163 CO 0.32 0.41 0.50 0.44 0.00 0.00 0.00 178.15 179.82 1u1x h ASP 164 N 0.90 0.77 -0.46 1.72 3.32 -1.98 0.27 116.42 120.96 1u1x h ASP 164 Ca 0.16 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.14 1u1x h ASP 164 Cb 0.55 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1u1x h ASP 164 CO 0.03 0.49 -0.07 0.00 -1.72 0.00 0.00 179.24 177.97 1u1x h ALA 165 N 1.40 0.92 -0.35 3.45 0.00 -1.85 -0.01 119.26 122.82 1u1x h ALA 165 Ca 0.36 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1u1x h ALA 165 Cb 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1u1x h ALA 165 CO -0.18 0.63 0.21 1.25 0.00 0.00 0.00 179.25 181.16 1u1x h LEU 166 N 0.82 0.42 -1.40 0.00 5.85 -0.71 -2.77 115.31 117.52 1u1x h LEU 166 Ca 0.14 -0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.75 1u1x h LEU 166 Cb 0.59 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1u1x h LEU 166 CO 0.04 0.35 -0.28 0.28 -0.34 0.00 0.00 178.44 178.48 1u1x h SER 167 N 0.45 0.00 1.04 1.25 0.02 -0.72 -2.94 113.55 112.65 1u1x h SER 167 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1u1x h SER 167 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1u1x h SER 167 CO -0.02 0.28 0.00 0.00 -1.14 0.00 0.00 176.83 175.95 1u1x n ALA 168 N -2.37 1.94 -1.71 3.77 0.00 -0.04 -4.86 120.51 117.25 1u1x n ALA 168 Ca -0.01 0.03 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 1u1x n ALA 168 Cb 0.37 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.38 1u1x n ALA 168 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1u1x n LEU 169 N -2.19 3.75 -3.51 0.00 4.77 -1.11 -4.97 117.00 113.73 1u1x n LEU 169 Ca 0.04 1.16 -0.27 0.00 -0.03 0.00 0.00 56.01 56.90 1u1x n LEU 169 Cb 0.31 -1.51 -0.10 0.00 -2.33 0.00 0.00 43.42 39.79 1u1x n LEU 169 CO 0.24 -0.20 -0.25 1.41 -1.33 0.00 0.00 177.39 177.26 1u1x n HIS 170 N 1.75 0.06 -1.82 -1.77 8.25 -1.26 -5.11 115.22 115.32 1u1x n HIS 170 Ca 0.09 -3.54 -0.33 0.00 -0.26 0.00 0.00 57.72 53.67 1u1x n HIS 170 Cb 0.34 0.05 0.04 0.00 1.12 0.00 0.00 29.99 31.55 1u1x n HIS 170 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 1u1x s PRO 171 N -0.32 2.89 -0.72 -0.41 0.02 -1.26 -4.81 135.00 130.40 1u1x s PRO 171 Ca 0.31 1.39 -0.26 0.00 0.02 0.00 0.00 61.00 62.46 1u1x s PRO 171 Cb 0.02 -1.96 0.04 0.00 0.02 0.00 0.00 34.50 32.62 1u1x s PRO 171 CO -0.19 -1.18 1.19 0.34 -0.33 0.00 0.00 177.00 176.83 1u1x s ASP 172 N -2.55 6.17 0.30 2.53 -1.08 -0.18 -4.92 116.67 116.94 1u1x s ASP 172 Ca 0.67 -0.59 0.00 0.00 -0.52 0.00 0.00 52.55 52.11 1u1x s ASP 172 Cb -0.20 -2.52 0.48 0.00 -1.46 0.00 0.00 42.92 39.21 1u1x s ASP 172 CO 0.40 -1.73 1.89 -0.74 0.52 0.00 0.00 175.17 175.51 1u1x h HIS 173 N 9.90 0.83 -0.20 -5.34 -0.00 -1.93 0.34 115.15 118.74 1u1x h HIS 173 Ca -0.28 -0.05 -0.04 0.00 -0.00 0.00 0.00 60.37 60.00 1u1x h HIS 173 Cb 1.06 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 28.21 1u1x h HIS 173 CO 1.08 0.64 -0.05 -0.09 -0.00 0.00 0.00 177.93 179.52 1u1x h ARG 174 N 0.81 0.38 -0.99 5.26 2.43 -1.98 -0.15 114.38 120.15 1u1x h ARG 174 Ca 0.19 -0.15 0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1u1x h ARG 174 Cb 0.17 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 1u1x h ARG 174 CO -0.02 0.64 0.65 0.00 -1.51 0.00 0.00 179.97 179.73 1u1x h ALA 175 N 0.73 1.31 0.00 2.80 0.00 -1.81 -2.31 119.26 119.99 1u1x h ALA 175 Ca 0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1u1x h ALA 175 Cb 0.50 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1u1x h ALA 175 CO 0.02 0.54 -0.07 -0.07 0.00 0.00 0.00 179.25 179.67 1u1x h LEU 176 N 1.25 0.00 -1.06 0.00 3.38 -0.49 -2.81 115.31 115.57 1u1x h LEU 176 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1u1x h LEU 176 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1u1x h LEU 176 CO -0.13 0.07 0.00 -1.20 0.09 0.00 0.00 178.44 177.27 1u1x n SER 177 N -4.12 0.55 -0.34 -0.43 7.64 -0.11 -1.07 113.62 115.75 1u1x n SER 177 Ca -0.03 0.71 0.14 0.00 1.01 0.00 0.00 58.87 60.70 1u1x n SER 177 Cb 0.16 -0.80 0.59 0.00 -1.01 0.00 0.00 64.21 63.14 1u1x n SER 177 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1u1x n ASN 178 N -2.19 1.11 -4.36 6.43 3.02 -1.06 -4.56 115.26 113.65 1u1x n ASN 178 Ca 0.00 -1.27 -0.45 0.00 -0.03 0.00 0.00 54.58 52.83 1u1x n ASN 178 Cb 0.10 0.01 -0.04 0.00 -0.61 0.00 0.00 39.78 39.25 1u1x n ASN 178 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1u1x s PHE 179 N -2.10 3.28 0.40 3.10 0.08 -0.23 -5.05 117.98 117.45 1u1x s PHE 179 Ca 0.37 -1.38 -0.10 0.00 0.12 0.00 0.00 56.93 55.95 1u1x s PHE 179 Cb 0.21 -3.96 -0.06 0.00 -0.57 0.00 0.00 43.02 38.63 1u1x s PHE 179 CO 0.37 -1.19 0.75 -1.01 -0.10 0.00 0.00 175.22 174.04 1u1x s HIS 180 N 1.78 3.48 -1.48 0.36 3.76 -1.26 -4.27 115.29 117.66 1u1x s HIS 180 Ca 0.15 0.99 -0.05 0.00 -0.15 0.00 0.00 55.06 56.00 1u1x s HIS 180 Cb -0.18 -2.40 0.01 0.00 1.11 0.00 0.00 32.58 31.11 1u1x s HIS 180 CO -0.01 -0.09 0.17 -3.47 -0.85 0.00 0.00 174.74 170.49 1u1x n ASP 181 N -1.31 -0.04 -3.48 1.40 2.03 -1.26 -4.94 116.55 108.95 1u1x n ASP 181 Ca 0.02 -1.24 -0.13 0.00 0.52 0.00 0.00 54.79 53.96 1u1x n ASP 181 Cb 0.54 -1.84 -0.04 0.00 -0.72 0.00 0.00 41.12 39.06 1u1x n ASP 181 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1u1x s MET 182 N -7.25 1.06 0.11 -0.67 0.23 -1.26 -4.06 119.30 107.46 1u1x s MET 182 Ca 0.08 -0.14 0.10 0.00 -1.03 0.00 0.00 55.69 54.70 1u1x s MET 182 Cb -0.04 0.49 -0.04 0.00 -1.53 0.00 0.00 34.83 33.71 1u1x s MET 182 CO 0.98 -0.41 -0.22 0.00 -2.03 0.00 0.00 175.02 173.34 1u1x s ALA 183 N -2.52 2.54 -0.31 3.16 0.00 -0.07 -4.42 121.76 120.14 1u1x s ALA 183 Ca -0.03 -1.38 -0.07 0.00 0.00 0.00 0.00 51.96 50.49 1u1x s ALA 183 Cb -0.01 -0.54 0.02 0.00 0.00 0.00 0.00 23.12 22.59 1u1x s ALA 183 CO -0.03 0.57 0.09 0.42 0.00 0.00 0.00 175.76 176.80 1u1x s ILE 184 N -1.08 3.88 -0.34 0.00 1.09 0.30 -1.32 121.20 123.72 1u1x s ILE 184 Ca 0.16 -0.85 -0.08 0.00 -1.10 0.00 0.00 60.65 58.77 1u1x s ILE 184 Cb -0.10 -3.07 0.03 0.00 -1.06 0.00 0.00 42.46 38.26 1u1x s ILE 184 CO 0.08 -0.01 0.14 0.20 -0.10 0.00 0.00 174.94 175.25 1u1x s ASN 185 N 1.46 5.46 -0.11 3.58 0.01 0.38 -1.44 114.94 124.29 1u1x s ASN 185 Ca 0.01 -0.98 -0.12 0.00 -0.71 0.00 0.00 52.86 51.06 1u1x s ASN 185 Cb -0.18 -1.94 -0.05 0.00 0.41 0.00 0.00 41.25 39.50 1u1x s ASN 185 CO 0.02 -0.32 0.28 0.00 -1.51 0.00 0.00 177.10 175.57 1u1x s PHE 187 N -0.37 1.10 0.07 0.00 -0.12 -0.47 -0.83 117.98 117.35 1u1x s PHE 187 Ca 0.18 -0.54 -0.16 0.00 -0.05 0.00 0.00 56.93 56.36 1u1x s PHE 187 Cb -0.14 -0.61 0.03 0.00 -0.63 0.00 0.00 43.02 41.67 1u1x s PHE 187 CO 0.06 0.03 0.37 0.00 -0.05 0.00 0.00 175.22 175.63 1u1x s ALA 188 N -1.75 -0.85 0.00 1.99 0.00 -0.54 0.14 121.76 120.75 1u1x s ALA 188 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1u1x s ALA 188 Cb -0.07 0.43 0.00 0.00 0.00 0.00 0.00 23.12 23.48 1u1x s ALA 188 CO 0.01 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.69 1u1x n GLY 189 N 0.31 0.19 3.64 0.00 0.00 -1.26 -0.21 105.19 107.86 1u1x n GLY 189 Ca -0.18 -1.51 -0.10 0.00 0.00 0.00 0.00 46.02 44.23 1u1x n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u1x s ALA 190 N -1.00 -1.94 0.00 4.61 0.00 -0.81 -5.01 121.76 117.62 1u1x s ALA 190 Ca 0.00 1.99 0.00 0.00 0.00 0.00 0.00 51.96 53.95 1u1x s ALA 190 Cb 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.73 1u1x s ALA 190 CO 0.00 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.88 1u1x n GLY 191 N 2.62 3.43 0.44 0.00 0.00 -1.26 -2.12 105.19 108.30 1u1x n GLY 191 Ca -0.14 0.13 0.13 0.00 0.00 0.00 0.00 46.02 46.14 1u1x n GLY 191 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1u1x n ARG 192 N 10.34 1.39 -3.98 1.61 1.85 -1.26 -4.84 116.66 121.77 1u1x n ARG 192 Ca 0.00 -0.88 -0.30 0.00 -1.00 0.00 0.00 57.85 55.67 1u1x n ARG 192 Cb 0.00 -1.48 -0.16 0.00 -1.05 0.00 0.00 32.46 29.77 1u1x n ARG 192 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1u1x s ARG 193 N -2.22 1.96 0.06 2.89 1.81 -0.90 -0.55 118.95 122.00 1u1x s ARG 193 Ca 0.31 -0.76 0.06 0.00 -1.72 0.00 0.00 55.73 53.61 1u1x s ARG 193 Cb 0.20 -2.32 -0.03 0.00 -0.45 0.00 0.00 34.95 32.35 1u1x s ARG 193 CO 0.42 -0.41 -0.16 -1.58 -0.68 0.00 0.00 175.30 172.89 1u1x s TRP 194 N 1.44 1.39 0.05 -0.53 0.52 -0.50 -1.93 118.94 119.38 1u1x s TRP 194 Ca -0.00 -0.40 0.04 0.00 0.02 0.00 0.00 56.10 55.75 1u1x s TRP 194 Cb -0.16 -0.80 -0.04 0.00 -1.15 0.00 0.00 33.47 31.33 1u1x s TRP 194 CO -0.08 0.08 -0.05 1.03 0.02 0.00 0.00 176.95 177.95 1u1x s ARG 195 N -1.50 2.49 0.08 4.98 1.81 0.71 -0.77 118.95 126.77 1u1x s ARG 195 Ca 0.02 -0.80 0.00 0.00 -1.72 0.00 0.00 55.73 53.23 1u1x s ARG 195 Cb -0.09 -2.49 -0.04 0.00 -0.45 0.00 0.00 34.95 31.87 1u1x s ARG 195 CO 0.02 0.57 -0.03 -1.54 -0.68 0.00 0.00 175.30 173.64 1u1x s SER 196 N -1.86 0.77 -0.01 0.23 1.04 -0.38 -1.47 113.70 112.02 1u1x s SER 196 Ca 0.21 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1u1x s SER 196 Cb -0.11 0.16 0.01 0.00 0.10 0.00 0.00 66.02 66.18 1u1x s SER 196 CO 0.12 -0.56 -0.00 -0.13 0.98 0.00 0.00 173.24 173.65 1u1x s ARG 197 N -3.90 0.07 -0.05 4.02 0.52 -0.01 -3.57 118.95 116.02 1u1x s ARG 197 Ca 0.12 0.01 0.05 0.00 -0.52 0.00 0.00 55.73 55.39 1u1x s ARG 197 Cb 0.07 -0.13 -0.01 0.00 0.52 0.00 0.00 34.95 35.40 1u1x s ARG 197 CO -0.06 -0.02 -0.21 1.41 0.02 0.00 0.00 175.30 176.44 1u1x s MET 198 N 0.24 2.17 -0.08 3.54 1.75 -1.26 -0.06 119.30 125.59 1u1x s MET 198 Ca -0.02 -0.75 0.01 0.00 -1.25 0.00 0.00 55.69 53.68 1u1x s MET 198 Cb -0.03 -1.85 0.02 0.00 2.84 0.00 0.00 34.83 35.81 1u1x s MET 198 CO -0.01 0.30 -0.09 -0.06 -0.65 0.00 0.00 175.02 174.52 1u1x s PHE 199 N -0.04 1.32 -0.44 4.11 0.08 -0.52 -1.06 117.98 121.44 1u1x s PHE 199 Ca -0.04 -0.54 0.06 0.00 0.12 0.00 0.00 56.93 56.53 1u1x s PHE 199 Cb -0.13 -1.05 0.18 0.00 -0.57 0.00 0.00 43.02 41.45 1u1x s PHE 199 CO 0.03 -0.35 0.56 0.45 -0.10 0.00 0.00 175.22 175.82 1u1x s SER 200 N 1.12 -0.46 0.45 1.36 0.15 -0.87 -0.54 113.70 114.90 1u1x s SER 200 Ca -0.06 -1.60 0.18 0.00 0.70 0.00 0.00 55.95 55.17 1u1x s SER 200 Cb -0.14 1.29 1.13 0.00 -1.71 0.00 0.00 66.02 66.58 1u1x s SER 200 CO -0.01 -0.15 1.92 1.55 1.20 0.00 0.00 173.24 177.74 1u1x h PRO 201 N 6.16 0.33 0.00 5.44 0.13 -1.85 -0.72 132.00 141.49 1u1x h PRO 201 Ca 0.08 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.19 1u1x h PRO 201 Cb 1.09 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 1u1x h PRO 201 CO 0.13 0.22 -0.03 0.00 -0.23 0.00 0.00 178.00 178.08 1u1x h ALA 202 N 1.64 1.87 -0.25 -0.56 0.00 -1.79 -2.19 119.26 118.00 1u1x h ALA 202 Ca 0.38 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1u1x h ALA 202 Cb 0.98 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1u1x h ALA 202 CO -0.11 0.04 0.00 0.66 0.00 0.00 0.00 179.25 179.84 1u1x n TYR 203 N -4.40 0.73 -1.29 0.00 4.01 -0.74 -4.80 117.16 110.67 1u1x n TYR 203 Ca -0.03 -0.79 0.00 0.00 -0.16 0.00 0.00 57.90 56.92 1u1x n TYR 203 Cb 0.12 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 38.92 1u1x n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1u1x n GLY 204 N -0.36 0.49 2.85 2.72 0.00 -0.75 -4.54 105.19 105.60 1u1x n GLY 204 Ca 0.18 -0.90 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 1u1x n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u1x s VAL 205 N -2.00 -0.06 0.08 1.61 1.01 -0.35 -4.79 120.40 115.90 1u1x s VAL 205 Ca 0.00 0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.89 1u1x s VAL 205 Cb 0.00 -0.17 -0.17 0.00 0.00 0.00 0.00 36.38 36.04 1u1x s VAL 205 CO 0.00 0.08 1.67 0.58 0.00 0.00 0.00 175.10 177.43 1u1x h VAL 206 N 6.18 0.59 -2.84 2.92 2.07 -1.93 -2.30 116.25 120.94 1u1x h VAL 206 Ca -0.44 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 66.91 1u1x h VAL 206 Cb 1.13 0.59 -0.29 0.00 -1.52 0.00 0.00 31.29 31.20 1u1x h VAL 206 CO 0.45 0.00 -0.43 -0.70 0.02 0.00 0.00 177.57 176.90 1u1x s GLU 207 N -6.11 0.25 0.11 1.57 2.12 -1.26 -3.90 118.70 111.49 1u1x s GLU 207 Ca -0.16 0.69 -0.06 0.00 0.36 0.00 0.00 54.97 55.81 1u1x s GLU 207 Cb 0.04 -0.03 -0.05 0.00 0.26 0.00 0.00 34.13 34.34 1u1x s GLU 207 CO 0.64 -0.20 0.36 0.34 -0.54 0.00 0.00 175.26 175.86 1u1x s ASP 208 N 1.68 6.51 0.10 -1.70 2.15 -0.22 -5.00 116.67 120.19 1u1x s ASP 208 Ca -0.06 0.61 0.01 0.00 0.43 0.00 0.00 52.55 53.53 1u1x s ASP 208 Cb -0.10 -2.10 -0.22 0.00 -0.30 0.00 0.00 42.92 40.19 1u1x s ASP 208 CO -0.10 0.10 1.22 0.00 -0.17 0.00 0.00 175.17 176.22 1u1x h ALA 209 N 3.13 0.24 -1.48 3.66 0.00 -1.89 -3.38 119.26 119.54 1u1x h ALA 209 Ca -0.47 -0.87 -0.07 0.00 0.00 0.00 0.00 54.91 53.50 1u1x h ALA 209 Cb 1.17 -0.07 -0.26 0.00 0.00 0.00 0.00 17.79 18.64 1u1x h ALA 209 CO 0.71 1.07 -0.42 0.00 0.00 0.00 0.00 179.25 180.61 1u1x s ALA 210 N -2.75 -1.63 -0.82 0.00 0.00 -1.26 -3.21 121.76 112.09 1u1x s ALA 210 Ca -0.02 1.03 -0.13 0.00 0.00 0.00 0.00 51.96 52.84 1u1x s ALA 210 Cb 0.09 -2.03 0.22 0.00 0.00 0.00 0.00 23.12 21.39 1u1x s ALA 210 CO 0.85 -1.48 0.75 0.99 0.00 0.00 0.00 175.76 176.88 1u1x s THR 211 N 2.67 5.46 0.31 0.00 2.01 -1.26 -4.52 115.64 120.31 1u1x s THR 211 Ca 0.14 -2.56 0.05 0.00 0.31 0.00 0.00 61.69 59.63 1u1x s THR 211 Cb -0.14 -4.38 0.08 0.00 0.01 0.00 0.00 72.50 68.07 1u1x s THR 211 CO -0.22 -1.02 1.76 1.23 -0.69 0.00 0.00 174.62 175.67 1u1x h GLY 212 N 7.66 0.40 2.00 4.40 0.00 -1.94 -0.85 103.07 114.74 1u1x h GLY 212 Ca 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1u1x h GLY 212 CO 0.75 0.30 0.00 -1.14 0.00 0.00 0.00 176.54 176.45 1u1x n SER 213 N -4.13 0.42 0.13 0.19 3.41 -1.26 -2.46 113.62 109.92 1u1x n SER 213 Ca -0.01 0.59 0.08 0.00 -0.26 0.00 0.00 58.87 59.27 1u1x n SER 213 Cb 0.40 -0.68 0.03 0.00 -0.26 0.00 0.00 64.21 63.69 1u1x n SER 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u1x h ALA 214 N 2.43 0.69 -0.26 7.33 0.00 -1.57 -3.40 119.26 124.49 1u1x h ALA 214 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1u1x h ALA 214 Cb 0.39 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1u1x h ALA 214 CO 0.00 0.30 0.07 0.00 0.00 0.00 0.00 179.25 179.62 1u1x h ALA 215 N 1.79 0.34 -0.04 0.00 0.00 -1.36 -0.83 119.26 119.17 1u1x h ALA 215 Ca -0.03 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1u1x h ALA 215 Cb 1.19 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1u1x h ALA 215 CO 0.02 -0.02 0.02 0.78 0.00 0.00 0.00 179.25 180.05 1u1x h GLY 216 N 0.25 0.06 1.14 0.00 0.00 -1.79 -2.65 103.07 100.09 1u1x h GLY 216 Ca 0.08 -0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.42 1u1x h GLY 216 CO -0.00 0.03 0.48 -2.55 0.00 0.00 0.00 176.54 174.50 1u1x h PRO 217 N -0.09 0.82 -0.56 4.80 0.11 -1.77 -1.80 132.00 133.51 1u1x h PRO 217 Ca 0.01 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.09 1u1x h PRO 217 Cb 0.16 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.05 1u1x h PRO 217 CO -0.00 0.54 0.35 1.25 -0.21 0.00 0.00 178.00 179.94 1u1x h LEU 218 N 0.85 0.59 -0.76 2.35 5.85 -0.93 0.51 115.31 123.77 1u1x h LEU 218 Ca 0.29 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 59.06 1u1x h LEU 218 Cb 0.11 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 1u1x h LEU 218 CO -0.09 0.42 0.46 0.00 -0.34 0.00 0.00 178.44 178.90 1u1x h ALA 219 N 1.22 1.02 -0.14 1.25 0.00 -1.09 0.22 119.26 121.75 1u1x h ALA 219 Ca 0.21 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.14 1u1x h ALA 219 Cb -0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1u1x h ALA 219 CO -0.07 0.21 -0.02 0.82 0.00 0.00 0.00 179.25 180.18 1u1x h ILE 220 N 0.87 0.88 -0.39 0.00 2.04 -0.94 -2.72 117.51 117.24 1u1x h ILE 220 Ca 0.32 -0.01 0.08 0.00 1.00 0.00 0.00 64.86 66.25 1u1x h ILE 220 Cb 0.12 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 36.99 1u1x h ILE 220 CO -0.15 0.00 -0.04 -0.74 0.00 0.00 0.00 178.15 177.22 1u1x h HIS 221 N 0.02 -0.10 -0.25 1.37 2.76 -0.12 0.14 115.15 118.96 1u1x h HIS 221 Ca 0.07 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.17 1u1x h HIS 221 Cb 0.09 0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.14 1u1x h HIS 221 CO -0.17 -0.12 -0.25 -0.07 -1.30 0.00 0.00 177.93 176.03 1u1x h LEU 222 N 0.06 0.48 0.12 0.26 3.38 -0.58 -1.95 115.31 117.08 1u1x h LEU 222 Ca 0.19 -0.16 -0.30 0.00 0.09 0.00 0.00 57.88 57.70 1u1x h LEU 222 Cb 0.28 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 40.93 1u1x h LEU 222 CO -0.36 0.73 -1.27 0.00 0.09 0.00 0.00 178.44 177.63 1u1x h ALA 223 N 1.31 0.02 -0.00 1.53 0.00 -1.12 0.38 119.26 121.37 1u1x h ALA 223 Ca 0.06 -0.81 -0.02 0.00 0.00 0.00 0.00 54.91 54.14 1u1x h ALA 223 Cb 0.66 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1u1x h ALA 223 CO 0.05 0.76 -0.12 0.00 0.00 0.00 0.00 179.25 179.94 1u1x h ARG 224 N 0.21 0.01 -0.54 0.00 3.08 -0.57 -2.47 114.38 114.09 1u1x h ARG 224 Ca -0.18 -0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.77 1u1x h ARG 224 Cb 1.95 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 31.95 1u1x h ARG 224 CO 0.23 0.12 0.10 0.72 -1.07 0.00 0.00 179.97 180.07 1u1x n HIS 225 N -4.40 1.87 -1.00 3.04 8.25 -0.75 -4.97 115.22 117.27 1u1x n HIS 225 Ca -0.03 -1.00 0.00 0.00 -0.26 0.00 0.00 57.72 56.43 1u1x n HIS 225 Cb 0.19 -0.53 0.00 0.00 1.12 0.00 0.00 29.99 30.77 1u1x n HIS 225 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1u1x n GLY 226 N -0.08 0.49 0.09 -1.41 0.00 -0.85 -4.90 105.19 98.54 1u1x n GLY 226 Ca 0.31 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.30 1u1x n GLY 226 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1u1x h GLN 227 N 1.03 0.00 -4.81 1.61 1.08 -1.18 -3.47 115.11 109.37 1u1x h GLN 227 Ca 0.00 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 56.85 1u1x h GLN 227 Cb 0.06 0.00 -0.14 0.00 -0.05 0.00 0.00 27.48 27.35 1u1x h GLN 227 CO 0.00 0.39 -0.59 0.96 -0.95 0.00 0.00 178.83 178.64 1u1x s ILE 228 N -2.78 0.31 0.03 2.54 -4.36 -1.20 -4.52 121.20 111.22 1u1x s ILE 228 Ca -0.03 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.28 1u1x s ILE 228 Cb 0.08 -2.55 -0.05 0.00 1.25 0.00 0.00 42.46 41.19 1u1x s ILE 228 CO 0.82 0.00 0.32 -0.70 0.24 0.00 0.00 174.94 175.62 1u1x s GLU 229 N -3.97 3.66 0.26 0.37 2.56 -1.26 -4.24 118.70 116.08 1u1x s GLU 229 Ca 0.37 0.03 -0.31 0.00 0.00 0.00 0.00 54.97 55.07 1u1x s GLU 229 Cb 0.06 -3.05 -0.13 0.00 2.00 0.00 0.00 34.13 33.01 1u1x s GLU 229 CO 0.15 0.62 1.39 1.19 -0.56 0.00 0.00 175.26 178.05 1u1x n PHE 230 N 1.06 2.21 -0.20 5.30 3.72 -1.26 -2.41 117.46 125.89 1u1x n PHE 230 Ca -0.10 0.44 0.00 0.00 -0.05 0.00 0.00 57.45 57.74 1u1x n PHE 230 Cb 0.53 -2.46 0.00 0.00 -0.94 0.00 0.00 39.48 36.61 1u1x n PHE 230 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1u1x n GLY 231 N 1.92 1.09 3.63 1.37 0.00 -0.30 -4.89 105.19 108.01 1u1x n GLY 231 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1u1x n GLY 231 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1u1x s GLN 232 N -0.54 4.11 0.31 1.61 0.74 -1.01 -4.89 119.66 119.99 1u1x s GLN 232 Ca 0.00 0.69 -0.29 0.00 0.05 0.00 0.00 55.36 55.81 1u1x s GLN 232 Cb 0.00 -3.66 -0.10 0.00 1.10 0.00 0.00 33.01 30.35 1u1x s GLN 232 CO 0.00 -0.49 1.38 -2.14 -0.55 0.00 0.00 175.29 173.49 1u1x s PRO 233 N 2.68 4.29 0.15 1.67 0.02 -1.26 -4.65 135.00 137.89 1u1x s PRO 233 Ca 0.30 2.30 0.09 0.00 0.02 0.00 0.00 61.00 63.71 1u1x s PRO 233 Cb -0.15 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.26 1u1x s PRO 233 CO 0.09 -0.32 -0.19 0.14 -0.33 0.00 0.00 177.00 176.38 1u1x s VAL 234 N -0.75 1.82 -0.20 3.83 -7.23 -0.42 -4.85 120.40 112.59 1u1x s VAL 234 Ca 0.53 -1.82 -0.09 0.00 -1.81 0.00 0.00 61.98 58.79 1u1x s VAL 234 Cb -0.41 -1.78 -0.05 0.00 0.56 0.00 0.00 36.38 34.70 1u1x s VAL 234 CO 0.51 -0.23 0.11 -1.61 -0.31 0.00 0.00 175.10 173.57 1u1x s GLU 235 N -2.53 4.07 -0.24 4.82 2.02 0.28 -1.69 118.70 125.43 1u1x s GLU 235 Ca 0.13 -0.28 -0.02 0.00 0.02 0.00 0.00 54.97 54.82 1u1x s GLU 235 Cb -0.07 -3.37 0.02 0.00 0.10 0.00 0.00 34.13 30.81 1u1x s GLU 235 CO 0.06 0.22 -0.06 0.42 0.02 0.00 0.00 175.26 175.93 1u1x s ILE 236 N 0.56 2.99 -0.30 -1.63 1.01 0.12 -1.41 121.20 122.54 1u1x s ILE 236 Ca 0.06 -0.90 -0.11 0.00 0.00 0.00 0.00 60.65 59.71 1u1x s ILE 236 Cb -0.12 -2.48 -0.02 0.00 0.01 0.00 0.00 42.46 39.85 1u1x s ILE 236 CO 0.00 0.25 0.18 -0.22 0.00 0.00 0.00 174.94 175.15 1u1x s LEU 237 N 1.36 4.12 0.28 2.97 2.96 0.05 -1.06 118.68 129.37 1u1x s LEU 237 Ca 0.02 -0.31 0.12 0.00 -0.22 0.00 0.00 54.13 53.73 1u1x s LEU 237 Cb -0.16 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.42 1u1x s LEU 237 CO -0.04 -0.15 -0.19 -1.58 -1.32 0.00 0.00 176.35 173.07 1u1x s GLN 238 N 1.69 1.70 0.00 1.98 0.74 -0.55 -1.26 119.66 123.96 1u1x s GLN 238 Ca 0.06 -1.76 0.00 0.00 0.05 0.00 0.00 55.36 53.71 1u1x s GLN 238 Cb -0.17 -1.79 0.00 0.00 1.10 0.00 0.00 33.01 32.16 1u1x s GLN 238 CO 0.08 0.33 0.00 0.41 -0.55 0.00 0.00 175.29 175.57 1u1x n GLY 239 N -0.63 0.66 0.18 2.59 0.00 -1.20 -0.82 105.19 105.97 1u1x n GLY 239 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 1u1x n GLY 239 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1u1x h VAL 240 N 0.00 1.28 -0.02 1.61 2.07 -1.86 0.24 116.25 119.58 1u1x h VAL 240 Ca 0.00 -1.09 -0.06 0.00 0.82 0.00 0.00 66.70 66.37 1u1x h VAL 240 Cb 0.00 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1u1x h VAL 240 CO 0.00 0.35 -0.27 -0.33 0.02 0.00 0.00 177.57 177.34 1u1x h GLU 241 N 0.28 0.03 -0.57 1.57 3.07 -1.94 -1.66 114.58 115.37 1u1x h GLU 241 Ca 0.07 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1u1x h GLU 241 Cb 0.55 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 1u1x h GLU 241 CO 0.03 0.30 0.00 0.44 -1.40 0.00 0.00 179.01 178.38 1u1x n ILE 242 N -4.21 1.01 -0.95 3.13 -5.35 -1.12 -4.92 119.36 106.96 1u1x n ILE 242 Ca -0.02 -0.76 0.00 0.00 -0.27 0.00 0.00 62.75 61.70 1u1x n ILE 242 Cb 0.33 0.15 0.00 0.00 -1.74 0.00 0.00 39.64 38.38 1u1x n ILE 242 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1u1x n GLY 243 N 1.07 0.47 2.59 3.28 0.00 -0.62 -4.96 105.19 107.02 1u1x n GLY 243 Ca 0.18 -0.53 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 1u1x n GLY 243 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u1x n ARG 244 N -2.95 2.26 -1.73 1.61 5.12 0.06 -4.87 116.66 116.16 1u1x n ARG 244 Ca 0.00 -4.24 -0.42 0.00 -1.93 0.00 0.00 57.85 51.26 1u1x n ARG 244 Cb 0.00 -2.00 -0.03 0.00 -1.16 0.00 0.00 32.46 29.28 1u1x n ARG 244 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1u1x n PRO 245 N 0.12 2.70 -3.82 5.56 -0.04 -1.20 -4.24 135.00 134.07 1u1x n PRO 245 Ca 0.28 0.97 -0.20 0.00 -0.04 0.00 0.00 63.50 64.51 1u1x n PRO 245 Cb 0.49 -2.78 -0.17 0.00 -0.04 0.00 0.00 33.50 31.00 1u1x n PRO 245 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1u1x s SER 246 N 0.88 0.98 -0.30 3.54 0.01 0.00 -0.60 113.70 118.21 1u1x s SER 246 Ca 0.71 -0.02 -0.08 0.00 1.31 0.00 0.00 55.95 57.87 1u1x s SER 246 Cb -0.51 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 65.44 1u1x s SER 246 CO 0.39 -0.16 0.10 -0.22 0.41 0.00 0.00 173.24 173.76 1u1x s LEU 247 N 1.59 3.92 -0.13 2.44 2.96 -0.79 -1.49 118.68 127.20 1u1x s LEU 247 Ca -0.02 -0.65 -0.03 0.00 -0.22 0.00 0.00 54.13 53.21 1u1x s LEU 247 Cb -0.13 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1u1x s LEU 247 CO -0.03 -0.19 -0.03 -0.04 -1.32 0.00 0.00 176.35 174.74 1u1x s MET 248 N 1.53 3.40 -0.16 1.98 -1.94 -0.22 -4.67 119.30 119.22 1u1x s MET 248 Ca 0.03 -0.48 -0.06 0.00 -1.71 0.00 0.00 55.69 53.47 1u1x s MET 248 Cb -0.17 -2.86 -0.04 0.00 2.01 0.00 0.00 34.83 33.77 1u1x s MET 248 CO 0.04 0.42 0.05 -0.06 -0.01 0.00 0.00 175.02 175.45 1u1x s PHE 249 N -0.11 3.25 0.04 -0.03 0.08 -0.60 0.15 117.98 120.76 1u1x s PHE 249 Ca 0.03 0.11 0.02 0.00 0.12 0.00 0.00 56.93 57.21 1u1x s PHE 249 Cb -0.13 -2.00 -0.02 0.00 -0.57 0.00 0.00 43.02 40.30 1u1x s PHE 249 CO 0.02 0.26 -0.07 0.00 -0.10 0.00 0.00 175.22 175.33 1u1x s ALA 250 N -0.02 0.56 -0.18 5.36 0.00 -0.68 -0.90 121.76 125.90 1u1x s ALA 250 Ca 0.05 -0.70 -0.07 0.00 0.00 0.00 0.00 51.96 51.25 1u1x s ALA 250 Cb -0.12 0.02 0.08 0.00 0.00 0.00 0.00 23.12 23.10 1u1x s ALA 250 CO 0.01 -0.00 0.40 0.21 0.00 0.00 0.00 175.76 176.37 1u1x s LYS 251 N -1.39 0.32 -0.26 0.00 2.20 -0.10 -1.30 119.74 119.21 1u1x s LYS 251 Ca -0.08 0.92 -0.04 0.00 -0.36 0.00 0.00 55.97 56.40 1u1x s LYS 251 Cb -0.09 0.17 0.01 0.00 -1.51 0.00 0.00 37.83 36.41 1u1x s LYS 251 CO 0.00 -0.22 -0.00 0.00 -0.36 0.00 0.00 175.35 174.77 1u1x s ALA 252 N 2.18 2.87 -0.03 3.13 0.00 -1.26 -1.03 121.76 127.61 1u1x s ALA 252 Ca -0.04 -1.38 -0.04 0.00 0.00 0.00 0.00 51.96 50.50 1u1x s ALA 252 Cb -0.11 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.10 1u1x s ALA 252 CO -0.12 -0.75 0.18 -1.21 0.00 0.00 0.00 175.76 173.86 1u1x s GLU 253 N 1.43 3.46 0.00 0.00 2.02 0.18 -1.15 118.70 124.64 1u1x s GLU 253 Ca 0.03 -0.25 0.00 0.00 0.02 0.00 0.00 54.97 54.77 1u1x s GLU 253 Cb -0.16 -3.12 0.00 0.00 0.10 0.00 0.00 34.13 30.95 1u1x s GLU 253 CO -0.02 0.70 0.00 0.41 0.02 0.00 0.00 175.26 176.37 1u1x n GLY 254 N 1.22 0.48 3.23 -1.39 0.00 -1.26 -0.47 105.19 107.00 1u1x n GLY 254 Ca -0.13 -1.61 -0.09 0.00 0.00 0.00 0.00 46.02 44.19 1u1x n GLY 254 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1u1x s ARG 255 N 0.00 0.95 0.23 1.61 1.70 -0.86 -4.82 118.95 117.76 1u1x s ARG 255 Ca 0.00 -1.15 -0.13 0.00 -0.47 0.00 0.00 55.73 53.98 1u1x s ARG 255 Cb 0.00 0.32 0.28 0.00 -0.57 0.00 0.00 34.95 34.99 1u1x s ARG 255 CO 0.00 -0.31 1.60 0.00 -1.08 0.00 0.00 175.30 175.51 1u1x h ALA 256 N 2.74 0.40 0.00 7.88 0.00 -1.97 0.11 119.26 128.41 1u1x h ALA 256 Ca -0.33 0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1u1x h ALA 256 Cb 1.20 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 19.62 1u1x h ALA 256 CO 0.55 -0.46 -0.17 0.93 0.00 0.00 0.00 179.25 180.10 1u1x h GLU 257 N -0.03 0.00 -1.91 0.00 3.07 -2.02 -3.38 114.58 110.31 1u1x h GLU 257 Ca 0.35 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.87 1u1x h GLU 257 Cb 0.56 0.00 -0.30 0.00 -0.84 0.00 0.00 28.75 28.17 1u1x h GLU 257 CO -0.78 0.17 -0.66 -1.14 -1.40 0.00 0.00 179.01 175.20 1u1x s GLN 258 N -3.57 0.60 0.27 2.33 0.74 0.35 -5.12 119.66 115.27 1u1x s GLN 258 Ca 0.02 -0.70 -0.27 0.00 0.05 0.00 0.00 55.36 54.45 1u1x s GLN 258 Cb 0.09 -0.65 -0.09 0.00 1.10 0.00 0.00 33.01 33.46 1u1x s GLN 258 CO 0.62 -1.17 0.91 -0.51 -0.55 0.00 0.00 175.29 174.60 1u1x s LEU 259 N 1.61 4.48 -0.05 3.68 1.43 -1.08 -2.03 118.68 126.72 1u1x s LEU 259 Ca 0.16 1.84 0.13 0.00 -1.03 0.00 0.00 54.13 55.22 1u1x s LEU 259 Cb -0.14 -3.78 -0.19 0.00 0.03 0.00 0.00 46.19 42.11 1u1x s LEU 259 CO -0.08 0.05 0.21 0.35 0.23 0.00 0.00 176.35 177.11 1u1x n THR 260 N 1.01 0.28 -3.59 5.49 -2.24 0.38 -4.94 114.28 110.68 1u1x n THR 260 Ca -0.00 -0.38 -0.14 0.00 -2.27 0.00 0.00 64.05 61.25 1u1x n THR 260 Cb 0.49 -0.09 -0.06 0.00 -2.10 0.00 0.00 70.33 68.56 1u1x n THR 260 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1u1x s ARG 261 N -2.73 0.83 -0.33 -0.78 3.52 -1.16 -4.99 118.95 113.32 1u1x s ARG 261 Ca -0.05 0.59 -0.01 0.00 -0.13 0.00 0.00 55.73 56.12 1u1x s ARG 261 Cb 0.07 0.40 0.11 0.00 -1.56 0.00 0.00 34.95 33.97 1u1x s ARG 261 CO 0.55 -0.18 0.15 0.08 -0.81 0.00 0.00 175.30 175.09 1u1x s VAL 262 N -0.34 0.41 -0.20 7.11 1.01 -1.26 -0.65 120.40 126.49 1u1x s VAL 262 Ca -0.03 -1.37 -0.09 0.00 0.00 0.00 0.00 61.98 60.49 1u1x s VAL 262 Cb -0.03 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.99 1u1x s VAL 262 CO 0.03 -0.80 0.10 -0.70 0.00 0.00 0.00 175.10 173.74 1u1x s GLU 263 N 1.52 4.06 -0.04 2.72 2.12 -0.20 -0.52 118.70 128.35 1u1x s GLU 263 Ca 0.12 -0.29 0.05 0.00 0.36 0.00 0.00 54.97 55.21 1u1x s GLU 263 Cb -0.19 -3.35 -0.01 0.00 0.26 0.00 0.00 34.13 30.85 1u1x s GLU 263 CO -0.20 0.23 -0.18 0.08 -0.54 0.00 0.00 175.26 174.64 1u1x s VAL 264 N 0.53 1.51 0.09 3.70 1.01 -0.66 -0.92 120.40 125.65 1u1x s VAL 264 Ca 0.06 -0.78 -0.05 0.00 0.00 0.00 0.00 61.98 61.21 1u1x s VAL 264 Cb -0.12 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.95 1u1x s VAL 264 CO 0.00 0.43 0.10 -0.94 0.00 0.00 0.00 175.10 174.70 1u1x s SER 265 N -0.10 0.27 0.01 3.32 1.04 -0.08 -0.66 113.70 117.51 1u1x s SER 265 Ca -0.01 -0.87 -0.29 0.00 0.48 0.00 0.00 55.95 55.25 1u1x s SER 265 Cb -0.11 0.29 0.10 0.00 0.10 0.00 0.00 66.02 66.41 1u1x s SER 265 CO 0.02 -0.70 1.12 -0.83 0.98 0.00 0.00 173.24 173.82 1u1x s GLY 266 N -2.92 -0.35 0.60 7.32 0.00 -0.65 -1.56 107.32 109.77 1u1x s GLY 266 Ca 0.09 0.73 -0.15 0.00 0.00 0.00 0.00 44.72 45.40 1u1x s GLY 266 CO -0.08 0.19 1.05 -1.31 0.00 0.00 0.00 173.10 172.95 1u1x s ASN 267 N -2.75 5.85 0.01 1.64 0.01 -1.26 -1.69 114.94 116.74 1u1x s ASN 267 Ca 0.11 1.72 -0.12 0.00 -0.71 0.00 0.00 52.86 53.87 1u1x s ASN 267 Cb 0.01 -2.52 0.01 0.00 0.41 0.00 0.00 41.25 39.17 1u1x s ASN 267 CO -0.03 -1.12 0.24 -0.83 -1.51 0.00 0.00 177.10 173.85 1u1x s GLY 268 N -3.10 -0.06 0.05 0.66 0.00 -1.11 0.96 107.32 104.72 1u1x s GLY 268 Ca 0.61 0.04 0.02 0.00 0.00 0.00 0.00 44.72 45.40 1u1x s GLY 268 CO 0.41 -0.14 -0.07 -1.34 0.00 0.00 0.00 173.10 171.95 1u1x s VAL 269 N -1.75 0.55 -0.03 1.40 -7.23 -0.62 -4.67 120.40 108.05 1u1x s VAL 269 Ca -0.11 -1.20 -0.30 0.00 -1.81 0.00 0.00 61.98 58.56 1u1x s VAL 269 Cb -0.04 -0.75 -0.03 0.00 0.56 0.00 0.00 36.38 36.11 1u1x s VAL 269 CO 0.01 -0.46 1.10 -0.89 -0.31 0.00 0.00 175.10 174.55 1u1x s THR 270 N -1.71 4.48 -0.17 5.32 2.01 -1.26 -0.15 115.64 124.16 1u1x s THR 270 Ca -0.07 1.78 -0.06 0.00 0.31 0.00 0.00 61.69 63.65 1u1x s THR 270 Cb -0.08 -4.14 -0.23 0.00 0.01 0.00 0.00 72.50 68.06 1u1x s THR 270 CO -0.00 0.07 0.17 0.33 -0.69 0.00 0.00 174.62 174.49 1u1x n PHE 271 N 4.55 0.87 -3.83 4.92 7.35 0.78 -4.84 117.46 127.25 1u1x n PHE 271 Ca 0.09 0.20 -0.06 0.00 -0.76 0.00 0.00 57.45 56.92 1u1x n PHE 271 Cb 0.48 -1.11 0.01 0.00 0.35 0.00 0.00 39.48 39.21 1u1x n PHE 271 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1u1x s GLY 272 N -5.76 0.17 -0.12 7.13 0.00 -1.18 -5.00 107.32 102.57 1u1x s GLY 272 Ca -0.27 -0.49 -0.17 0.00 0.00 0.00 0.00 44.72 43.79 1u1x s GLY 272 CO 0.70 0.46 0.44 -1.60 0.00 0.00 0.00 173.10 173.10 1u1x s ARG 273 N -2.61 0.62 0.00 2.90 3.52 -1.26 -0.83 118.95 121.29 1u1x s ARG 273 Ca 0.16 0.41 0.00 0.00 -0.13 0.00 0.00 55.73 56.17 1u1x s ARG 273 Cb -0.04 0.29 0.00 0.00 -1.56 0.00 0.00 34.95 33.64 1u1x s ARG 273 CO 0.08 -0.12 0.00 0.41 -0.81 0.00 0.00 175.30 174.87 1u1x n GLY 274 N 2.29 1.77 3.12 8.12 0.00 -0.56 -5.02 105.19 114.90 1u1x n GLY 274 Ca -0.16 -0.43 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 1u1x n GLY 274 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u1x s THR 275 N -1.43 -0.00 0.17 2.61 2.01 -1.26 -0.73 115.64 117.01 1u1x s THR 275 Ca 0.00 0.01 0.04 0.00 0.31 0.00 0.00 61.69 62.05 1u1x s THR 275 Cb 0.00 -0.34 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 1u1x s THR 275 CO 0.00 0.00 0.22 0.27 -0.69 0.00 0.00 174.62 174.43 1u1x s ILE 276 N 0.17 4.91 -2.04 1.82 -4.36 0.28 -4.95 121.20 117.03 1u1x s ILE 276 Ca -0.00 -0.93 0.27 0.00 -0.26 0.00 0.00 60.65 59.73 1u1x s ILE 276 Cb -0.02 -3.54 0.75 0.00 1.25 0.00 0.00 42.46 40.90 1u1x s ILE 276 CO -0.00 -0.14 2.01 1.33 0.24 0.00 0.00 174.94 178.38 1u1x n VAL 277 N -0.59 0.01 -0.73 8.37 0.24 -1.26 -2.56 118.33 121.81 1u1x n VAL 277 Ca -0.08 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1u1x n VAL 277 Cb 0.55 -0.34 0.00 0.00 -1.47 0.00 0.00 33.84 32.58 1u1x n VAL 277 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69