#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a5n s ASN 3 N 0.00 0.27 -0.13 4.04 0.01 -1.26 -5.15 114.94 112.72 1a5n s ASN 3 Ca 0.00 -0.58 -0.13 0.00 -0.71 0.00 0.00 52.86 51.44 1a5n s ASN 3 Cb 0.00 0.15 0.03 0.00 0.41 0.00 0.00 41.25 41.84 1a5n s ASN 3 CO 0.00 -0.40 0.36 -0.51 -1.51 0.00 0.00 177.10 175.04 1a5n s ILE 4 N -2.14 0.00 0.56 0.60 2.07 -1.26 -5.15 121.20 115.89 1a5n s ILE 4 Ca -0.09 -0.04 -0.19 0.00 -1.41 0.00 0.00 60.65 58.92 1a5n s ILE 4 Cb -0.05 -0.52 -0.05 0.00 0.13 0.00 0.00 42.46 41.97 1a5n s ILE 4 CO -0.03 -0.02 1.13 -0.94 -1.91 0.00 0.00 174.94 173.17 1a5n s SER 5 N 0.07 5.63 0.25 4.50 1.04 -1.26 -4.87 113.70 119.05 1a5n s SER 5 Ca -0.01 2.17 -0.05 0.00 0.48 0.00 0.00 55.95 58.54 1a5n s SER 5 Cb -0.03 -2.58 0.34 0.00 0.10 0.00 0.00 66.02 63.86 1a5n s SER 5 CO 0.01 -1.28 1.86 0.03 0.98 0.00 0.00 173.24 174.84 1a5n h ARG 6 N 1.06 1.00 -0.22 4.02 3.08 -2.01 -0.68 114.38 120.63 1a5n h ARG 6 Ca -0.50 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.49 1a5n h ARG 6 Cb 1.26 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 1a5n h ARG 6 CO 0.56 0.66 0.12 0.37 -1.07 0.00 0.00 179.97 180.61 1a5n h GLN 7 N 1.03 0.31 -0.60 0.04 5.75 -2.00 -0.18 115.11 119.47 1a5n h GLN 7 Ca 0.39 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.81 1a5n h GLN 7 Cb 0.15 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.62 1a5n h GLN 7 CO -0.17 0.30 0.22 0.00 -2.65 0.00 0.00 178.83 176.53 1a5n h ALA 8 N 0.99 1.26 -0.33 3.38 0.00 -1.87 -1.96 119.26 120.72 1a5n h ALA 8 Ca 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1a5n h ALA 8 Cb 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1a5n h ALA 8 CO -0.01 0.54 0.15 -0.92 0.00 0.00 0.00 179.25 179.01 1a5n h TYR 9 N 0.87 0.49 -0.79 0.00 5.03 -0.63 -2.28 116.97 119.65 1a5n h TYR 9 Ca 0.20 -0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.48 1a5n h TYR 9 Cb 0.20 -0.15 -0.04 0.00 1.55 0.00 0.00 36.73 38.29 1a5n h TYR 9 CO 0.01 0.44 0.47 0.00 -1.32 0.00 0.00 178.16 177.77 1a5n h ALA 10 N 1.00 1.01 0.00 1.82 0.00 -0.59 0.17 119.26 122.68 1a5n h ALA 10 Ca 0.11 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1a5n h ALA 10 Cb 0.14 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1a5n h ALA 10 CO -0.01 0.48 -0.08 -0.44 0.00 0.00 0.00 179.25 179.20 1a5n h ASP 11 N 1.09 0.00 0.02 0.00 5.19 -1.16 0.19 116.42 121.75 1a5n h ASP 11 Ca 0.28 0.00 -0.39 0.00 -0.62 0.00 0.00 57.03 56.30 1a5n h ASP 11 Cb -0.03 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.42 1a5n h ASP 11 CO -0.05 0.08 -2.27 0.80 -3.12 0.00 0.00 179.24 174.68 1a5n n MET 12 N -3.37 0.63 -0.01 3.56 1.56 -0.73 -4.72 117.12 114.05 1a5n n MET 12 Ca -0.01 0.27 0.01 0.00 -0.27 0.00 0.00 57.70 57.70 1a5n n MET 12 Cb 0.25 -1.57 0.01 0.00 2.15 0.00 0.00 33.22 34.07 1a5n n MET 12 CO 0.00 0.00 0.00 1.19 -0.73 0.00 0.00 175.97 176.43 1a5n n PHE 13 N -3.83 0.03 0.00 1.12 3.72 0.51 -4.97 117.46 114.04 1a5n n PHE 13 Ca -0.45 -0.18 0.00 0.00 -0.05 0.00 0.00 57.45 56.77 1a5n n PHE 13 Cb 0.92 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.44 1a5n n PHE 13 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1a5n n GLY 14 N -0.07 0.35 3.71 1.37 0.00 0.68 -4.37 105.19 106.85 1a5n n GLY 14 Ca 0.01 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 43.91 1a5n n GLY 14 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a5n s PRO 15 N -2.54 1.93 0.07 1.61 0.04 -1.26 -4.10 135.00 130.76 1a5n s PRO 15 Ca 0.00 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.86 1a5n s PRO 15 Cb 0.00 -1.80 -0.00 0.00 0.04 0.00 0.00 34.50 32.74 1a5n s PRO 15 CO 0.00 -2.01 0.01 -2.37 0.04 0.00 0.00 177.00 172.67 1a5n n THR 16 N -2.90 0.00 -1.68 1.26 5.66 -1.26 -4.95 114.28 110.41 1a5n n THR 16 Ca 0.14 -0.38 -0.58 0.00 -3.05 0.00 0.00 64.05 60.17 1a5n n THR 16 Cb 0.50 0.11 -0.07 0.00 -1.55 0.00 0.00 70.33 69.31 1a5n n THR 16 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1a5n n VAL 17 N -0.17 0.18 0.00 1.08 0.31 -1.26 -1.24 118.33 117.23 1a5n n VAL 17 Ca -0.02 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1a5n n VAL 17 Cb 0.10 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.07 1a5n n VAL 17 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a5n n GLY 18 N 3.69 3.38 3.79 2.92 0.00 -0.82 -4.97 105.19 113.17 1a5n n GLY 18 Ca 0.25 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.91 1a5n n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a5n s ASP 19 N -0.89 6.90 0.17 1.61 1.01 -0.37 -4.80 116.67 120.30 1a5n s ASP 19 Ca 0.00 1.95 0.07 0.00 0.71 0.00 0.00 52.55 55.28 1a5n s ASP 19 Cb 0.00 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 1a5n s ASP 19 CO 0.00 -0.39 -0.01 -0.54 0.21 0.00 0.00 175.17 174.44 1a5n s LYS 20 N -2.50 2.38 -0.01 8.23 1.02 -1.26 -1.77 119.74 125.82 1a5n s LYS 20 Ca 0.57 -1.11 0.00 0.00 0.02 0.00 0.00 55.97 55.46 1a5n s LYS 20 Cb -0.19 -2.35 0.01 0.00 -0.52 0.00 0.00 37.83 34.78 1a5n s LYS 20 CO 0.25 0.46 -0.00 0.08 -0.92 0.00 0.00 175.35 175.21 1a5n s VAL 21 N -1.71 0.12 0.09 3.17 1.01 -0.34 -4.96 120.40 117.78 1a5n s VAL 21 Ca 0.27 0.02 -0.27 0.00 0.00 0.00 0.00 61.98 62.00 1a5n s VAL 21 Cb -0.09 -0.16 -0.06 0.00 0.00 0.00 0.00 36.38 36.06 1a5n s VAL 21 CO 0.18 0.08 0.85 -0.60 0.00 0.00 0.00 175.10 175.61 1a5n s ARG 22 N 0.46 4.59 -0.47 2.72 3.52 -1.26 -1.19 118.95 127.32 1a5n s ARG 22 Ca -0.04 1.23 -0.24 0.00 -0.13 0.00 0.00 55.73 56.55 1a5n s ARG 22 Cb -0.07 -3.36 0.03 0.00 -1.56 0.00 0.00 34.95 29.99 1a5n s ARG 22 CO -0.01 0.29 0.88 -0.51 -0.81 0.00 0.00 175.30 175.14 1a5n s LEU 23 N -0.15 4.10 0.00 -0.88 1.43 -0.31 -4.74 118.68 118.13 1a5n s LEU 23 Ca 0.42 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.49 1a5n s LEU 23 Cb -0.22 -3.07 0.00 0.00 0.03 0.00 0.00 46.19 42.93 1a5n s LEU 23 CO 0.26 -1.04 0.00 0.00 0.23 0.00 0.00 176.35 175.80 1a5n n ALA 24 N 7.07 0.00 -1.49 4.21 0.00 -0.12 -1.53 120.51 128.65 1a5n n ALA 24 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.36 1a5n n ALA 24 Cb 0.48 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.10 1a5n n ALA 24 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1a5n n ASP 25 N 3.44 3.36 -4.20 0.00 5.75 -1.26 -4.81 116.55 118.82 1a5n n ASP 25 Ca 0.00 -3.77 -0.16 0.00 -0.01 0.00 0.00 54.79 50.85 1a5n n ASP 25 Cb 0.00 -0.66 0.06 0.00 -1.03 0.00 0.00 41.12 39.49 1a5n n ASP 25 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1a5n n THR 26 N -1.07 0.00 0.55 2.12 -2.24 -0.59 -4.78 114.28 108.27 1a5n n THR 26 Ca 0.41 -1.42 0.11 0.00 -2.27 0.00 0.00 64.05 60.87 1a5n n THR 26 Cb 1.08 -0.73 0.27 0.00 -2.10 0.00 0.00 70.33 68.84 1a5n n THR 26 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1a5n n GLU 27 N -2.12 2.24 -2.82 -0.78 -0.58 -1.26 -4.65 120.64 110.67 1a5n n GLU 27 Ca 0.13 -1.88 -0.41 0.00 -0.42 0.00 0.00 57.16 54.57 1a5n n GLU 27 Cb 0.47 -1.46 -0.04 0.00 -0.57 0.00 0.00 31.44 29.84 1a5n n GLU 27 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1a5n s LEU 28 N -1.39 4.31 -0.10 -4.62 1.43 -1.26 -5.00 118.68 112.06 1a5n s LEU 28 Ca 0.37 1.45 0.03 0.00 -1.03 0.00 0.00 54.13 54.94 1a5n s LEU 28 Cb 0.20 -3.39 0.01 0.00 0.03 0.00 0.00 46.19 43.04 1a5n s LEU 28 CO 0.29 -0.27 -0.18 0.26 0.23 0.00 0.00 176.35 176.68 1a5n s TRP 29 N 1.24 2.14 0.26 0.29 0.52 -1.26 -1.17 118.94 120.96 1a5n s TRP 29 Ca 0.46 -0.95 0.07 0.00 0.02 0.00 0.00 56.10 55.70 1a5n s TRP 29 Cb -0.19 -1.49 -0.03 0.00 -1.15 0.00 0.00 33.47 30.60 1a5n s TRP 29 CO 0.22 -0.44 0.23 0.96 0.02 0.00 0.00 176.95 177.94 1a5n s ILE 30 N 0.72 4.54 -0.03 2.03 -4.36 -0.34 -0.88 121.20 122.87 1a5n s ILE 30 Ca -0.12 -1.32 0.01 0.00 -0.26 0.00 0.00 60.65 58.96 1a5n s ILE 30 Cb -0.16 -3.47 0.02 0.00 1.25 0.00 0.00 42.46 40.09 1a5n s ILE 30 CO 0.02 -0.33 -0.05 -0.70 0.24 0.00 0.00 174.94 174.12 1a5n s GLU 31 N -3.88 0.73 -0.10 0.37 2.12 -1.26 -1.19 118.70 115.49 1a5n s GLU 31 Ca 0.34 -0.12 -0.29 0.00 0.36 0.00 0.00 54.97 55.25 1a5n s GLU 31 Cb -0.08 -0.74 -0.06 0.00 0.26 0.00 0.00 34.13 33.51 1a5n s GLU 31 CO 0.26 -0.03 1.91 0.08 -0.54 0.00 0.00 175.26 176.94 1a5n s VAL 32 N 0.69 3.24 0.03 3.70 1.01 -0.73 -4.86 120.40 123.47 1a5n s VAL 32 Ca -0.09 0.27 0.10 0.00 0.00 0.00 0.00 61.98 62.27 1a5n s VAL 32 Cb -0.12 -3.22 -0.16 0.00 0.00 0.00 0.00 36.38 32.87 1a5n s VAL 32 CO 0.00 -0.08 1.17 -0.33 0.00 0.00 0.00 175.10 175.87 1a5n h GLU 33 N 11.62 0.00 -3.17 2.72 5.08 -1.60 -2.18 114.58 127.05 1a5n h GLU 33 Ca -0.43 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.90 1a5n h GLU 33 Cb 1.21 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.34 1a5n h GLU 33 CO 0.96 0.78 0.08 0.34 -1.00 0.00 0.00 179.01 180.17 1a5n s ASP 34 N -6.50 -0.42 -0.05 1.42 -1.08 -1.26 -4.93 116.67 103.86 1a5n s ASP 34 Ca 0.00 -0.13 -0.02 0.00 -0.52 0.00 0.00 52.55 51.88 1a5n s ASP 34 Cb 0.09 0.54 0.03 0.00 -1.46 0.00 0.00 42.92 42.13 1a5n s ASP 34 CO 0.81 -0.91 0.06 -0.62 0.52 0.00 0.00 175.17 175.02 1a5n s ASP 35 N -2.76 1.25 0.00 -0.34 -1.08 -1.26 -0.96 116.67 111.52 1a5n s ASP 35 Ca 0.02 0.02 0.19 0.00 -0.52 0.00 0.00 52.55 52.26 1a5n s ASP 35 Cb 0.00 -0.16 0.88 0.00 -1.46 0.00 0.00 42.92 42.18 1a5n s ASP 35 CO -0.12 -0.25 1.60 0.18 0.52 0.00 0.00 175.17 177.09 1a5n n LEU 36 N 5.29 0.79 -4.93 -1.34 4.32 -0.29 -4.93 117.00 115.91 1a5n n LEU 36 Ca -0.03 -0.34 -0.26 0.00 -0.02 0.00 0.00 56.01 55.36 1a5n n LEU 36 Cb 0.50 -0.05 0.09 0.00 -1.62 0.00 0.00 43.42 42.33 1a5n n LEU 36 CO 0.06 0.17 0.65 0.28 -1.22 0.00 0.00 177.39 177.34 1a5n s THR 37 N -1.89 2.21 -0.29 -5.08 -1.32 -1.26 -4.50 115.64 103.50 1a5n s THR 37 Ca 0.29 -0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.51 1a5n s THR 37 Cb 0.14 -2.95 0.06 0.00 -1.51 0.00 0.00 72.50 68.23 1a5n s THR 37 CO 0.23 0.00 -0.04 -0.89 -2.21 0.00 0.00 174.62 171.71 1a5n s THR 38 N -3.34 2.68 -0.07 5.08 2.01 -1.26 -5.07 115.64 115.67 1a5n s THR 38 Ca 0.63 -1.51 -0.37 0.00 0.31 0.00 0.00 61.69 60.74 1a5n s THR 38 Cb -0.09 -2.56 -0.15 0.00 0.01 0.00 0.00 72.50 69.70 1a5n s THR 38 CO 0.46 -0.10 1.60 -1.22 -0.69 0.00 0.00 174.62 174.67 1a5n n TYR 39 N 4.54 1.92 0.00 4.92 4.01 -1.26 -0.41 117.16 130.89 1a5n n TYR 39 Ca -0.13 0.46 0.00 0.00 -0.16 0.00 0.00 57.90 58.07 1a5n n TYR 39 Cb 0.43 -2.45 0.00 0.00 -0.31 0.00 0.00 39.34 37.01 1a5n n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1a5n n GLY 40 N 3.52 1.37 0.70 2.72 0.00 -1.26 -4.90 105.19 107.34 1a5n n GLY 40 Ca 0.22 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.31 1a5n n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a5n n GLU 41 N -2.00 2.81 -2.06 1.61 -0.58 0.46 -5.03 120.64 115.86 1a5n n GLU 41 Ca 0.00 -2.46 -0.38 0.00 -0.42 0.00 0.00 57.16 53.90 1a5n n GLU 41 Cb 0.00 -1.56 0.01 0.00 -0.57 0.00 0.00 31.44 29.31 1a5n n GLU 41 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1a5n s GLU 42 N -2.05 3.57 -0.09 3.49 8.01 -1.25 -4.85 118.70 125.53 1a5n s GLU 42 Ca 0.32 2.00 -0.17 0.00 0.01 0.00 0.00 54.97 57.13 1a5n s GLU 42 Cb 0.24 -2.41 -0.05 0.00 -4.31 0.00 0.00 34.13 27.60 1a5n s GLU 42 CO 0.11 -0.77 0.43 0.14 0.01 0.00 0.00 175.26 175.18 1a5n s VAL 43 N -1.41 5.16 0.00 2.63 -7.23 -1.26 -4.91 120.40 113.37 1a5n s VAL 43 Ca 0.65 0.87 0.01 0.00 -1.81 0.00 0.00 61.98 61.71 1a5n s VAL 43 Cb -0.34 -3.77 -0.01 0.00 0.56 0.00 0.00 36.38 32.83 1a5n s VAL 43 CO 0.42 0.40 -0.05 -0.75 -0.31 0.00 0.00 175.10 174.81 1a5n s LYS 44 N 0.16 0.39 -0.05 4.82 2.20 -1.26 -4.73 119.74 121.27 1a5n s LYS 44 Ca 0.24 -0.23 -0.02 0.00 -0.36 0.00 0.00 55.97 55.60 1a5n s LYS 44 Cb -0.15 -0.35 -0.04 0.00 -1.51 0.00 0.00 37.83 35.78 1a5n s LYS 44 CO 0.10 0.09 0.06 0.12 -0.36 0.00 0.00 175.35 175.36 1a5n s PHE 45 N -0.26 3.29 0.00 4.03 5.36 -1.26 -1.71 117.98 127.43 1a5n s PHE 45 Ca 0.00 0.25 0.00 0.00 -0.96 0.00 0.00 56.93 56.23 1a5n s PHE 45 Cb -0.03 -1.79 0.00 0.00 -0.34 0.00 0.00 43.02 40.86 1a5n s PHE 45 CO -0.00 0.55 0.00 0.41 -1.46 0.00 0.00 175.22 174.72 1a5n n GLY 46 N 1.68 2.18 3.67 13.12 0.00 -1.26 -4.92 105.19 119.66 1a5n n GLY 46 Ca -0.16 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 1a5n n GLY 46 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a5n s GLY 47 N 0.00 1.50 0.00 -0.02 0.00 -1.26 -1.57 107.32 105.97 1a5n s GLY 47 Ca 0.00 1.18 0.00 0.00 0.00 0.00 0.00 44.72 45.90 1a5n s GLY 47 CO 0.00 3.12 0.00 0.61 0.00 0.00 0.00 173.10 176.83 1a5n n GLY 48 N 4.21 2.06 0.00 0.20 0.00 -1.26 -5.02 105.19 105.39 1a5n n GLY 48 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1a5n n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1a5n n LYS 49 N -2.00 0.03 0.08 1.61 4.76 -0.61 -5.01 118.16 117.02 1a5n n LYS 49 Ca 0.00 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.22 1a5n n LYS 49 Cb 0.00 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 33.05 1a5n n LYS 49 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1a5n h VAL 50 N -0.96 1.40 -0.45 -0.18 2.07 -1.61 -3.42 116.25 113.10 1a5n h VAL 50 Ca 0.00 -2.52 -0.48 0.00 0.82 0.00 0.00 66.70 64.52 1a5n h VAL 50 Cb 0.00 3.01 -0.03 0.00 -1.52 0.00 0.00 31.29 32.75 1a5n h VAL 50 CO 0.00 0.74 1.62 -0.38 0.02 0.00 0.00 177.57 179.56 1a5n n ILE 51 N -3.96 2.40 -3.94 4.57 5.41 -0.78 -0.60 119.36 122.46 1a5n n ILE 51 Ca -0.14 -2.42 -0.10 0.00 1.00 0.00 0.00 62.75 61.09 1a5n n ILE 51 Cb 0.92 -2.25 -0.11 0.00 -0.71 0.00 0.00 39.64 37.49 1a5n n ILE 51 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1a5n s ARG 52 N 5.60 0.38 -0.21 0.38 0.52 -1.26 -4.81 118.95 119.53 1a5n s ARG 52 Ca 0.63 -0.53 -0.43 0.00 -0.52 0.00 0.00 55.73 54.88 1a5n s ARG 52 Cb 0.04 0.14 -0.19 0.00 0.52 0.00 0.00 34.95 35.46 1a5n s ARG 52 CO 0.11 -0.08 1.35 -3.47 0.02 0.00 0.00 175.30 173.24 1a5n n ASP 53 N 1.55 0.79 0.00 0.23 2.03 -1.26 -0.55 116.55 119.34 1a5n n ASP 53 Ca -0.23 1.16 0.00 0.00 0.52 0.00 0.00 54.79 56.24 1a5n n ASP 53 Cb 0.55 -0.94 0.00 0.00 -0.72 0.00 0.00 41.12 40.01 1a5n n ASP 53 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1a5n n GLY 54 N 2.78 2.84 0.00 0.27 0.00 -0.34 -4.88 105.19 105.86 1a5n n GLY 54 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1a5n n GLY 54 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1a5n n MET 55 N -2.00 0.00 0.00 1.61 2.81 0.28 -4.84 117.12 114.98 1a5n n MET 55 Ca 0.00 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.99 1a5n n MET 55 Cb 0.00 0.00 0.51 0.00 -0.71 0.00 0.00 33.22 33.02 1a5n n MET 55 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1a5n n GLY 56 N 5.00 -0.87 3.33 3.03 0.00 0.23 -4.44 105.19 111.47 1a5n n GLY 56 Ca 0.00 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 1a5n n GLY 56 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1a5n s GLN 57 N -2.46 3.32 0.06 1.61 0.74 -1.00 -3.28 119.66 118.66 1a5n s GLN 57 Ca 0.21 -0.71 -0.00 0.00 0.05 0.00 0.00 55.36 54.90 1a5n s GLN 57 Cb 0.13 -2.62 0.01 0.00 1.10 0.00 0.00 33.01 31.64 1a5n s GLN 57 CO 0.28 0.15 0.08 0.41 -0.55 0.00 0.00 175.29 175.66 1a5n n GLY 58 N 3.70 0.11 0.74 2.59 0.00 0.78 -1.20 105.19 111.91 1a5n n GLY 58 Ca -0.18 -1.86 0.06 0.00 0.00 0.00 0.00 46.02 44.04 1a5n n GLY 58 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1a5n n GLN 59 N -1.16 2.86 -1.84 1.61 1.13 -1.26 -4.30 117.38 114.41 1a5n n GLN 59 Ca 0.01 -2.14 -0.32 0.00 -1.94 0.00 0.00 57.00 52.61 1a5n n GLN 59 Cb 0.04 -1.31 0.03 0.00 0.11 0.00 0.00 30.24 29.11 1a5n n GLN 59 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1a5n s MET 60 N -1.00 3.14 0.81 -1.09 0.23 -1.26 -5.02 119.30 115.11 1a5n s MET 60 Ca 0.27 1.11 -0.12 0.00 -1.03 0.00 0.00 55.69 55.92 1a5n s MET 60 Cb 0.14 -2.01 0.08 0.00 -1.53 0.00 0.00 34.83 31.50 1a5n s MET 60 CO 0.18 -0.94 1.12 -0.51 -2.03 0.00 0.00 175.02 172.84 1a5n s LEU 61 N -4.93 2.50 0.34 0.18 1.43 -1.26 -4.46 118.68 112.49 1a5n s LEU 61 Ca 0.61 1.07 0.12 0.00 -1.03 0.00 0.00 54.13 54.90 1a5n s LEU 61 Cb -0.15 -3.63 0.92 0.00 0.03 0.00 0.00 46.19 43.36 1a5n s LEU 61 CO 0.44 -1.95 1.76 0.00 0.23 0.00 0.00 176.35 176.83 1a5n h ALA 62 N -1.08 1.91 0.00 4.21 0.00 -1.97 0.19 119.26 122.52 1a5n h ALA 62 Ca -0.47 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1a5n h ALA 62 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1a5n h ALA 62 CO 0.62 -0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.54 1a5n h ALA 63 N 1.67 1.00 -0.57 0.00 0.00 -2.00 -2.88 119.26 116.49 1a5n h ALA 63 Ca 0.61 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1a5n h ALA 63 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1a5n h ALA 63 CO -0.39 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.61 1a5n n ASP 64 N -3.03 4.16 -3.84 0.00 8.00 0.05 -4.97 116.55 116.91 1a5n n ASP 64 Ca 0.00 -2.33 -0.09 0.00 0.71 0.00 0.00 54.79 53.08 1a5n n ASP 64 Cb 0.27 -0.49 -0.07 0.00 -0.02 0.00 0.00 41.12 40.81 1a5n n ASP 64 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a5n s VAL 66 N -3.88 4.23 0.07 0.00 -7.23 -0.92 -4.88 120.40 107.79 1a5n s VAL 66 Ca 0.08 0.95 -0.01 0.00 -1.81 0.00 0.00 61.98 61.19 1a5n s VAL 66 Cb 0.04 -3.57 -0.26 0.00 0.56 0.00 0.00 36.38 33.14 1a5n s VAL 66 CO -0.08 -0.72 1.10 0.44 -0.31 0.00 0.00 175.10 175.53 1a5n h ASP 67 N 0.31 0.30 -3.95 4.85 3.32 -1.38 -3.31 116.42 116.56 1a5n h ASP 67 Ca -0.46 -0.34 -0.20 0.00 0.02 0.00 0.00 57.03 56.05 1a5n h ASP 67 Cb 1.20 -0.10 -0.26 0.00 0.22 0.00 0.00 39.33 40.39 1a5n h ASP 67 CO 0.59 1.27 -0.62 -0.22 -1.72 0.00 0.00 179.24 178.55 1a5n s LEU 68 N -6.97 1.71 -0.05 1.55 2.96 -0.78 -0.06 118.68 117.04 1a5n s LEU 68 Ca -0.04 0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.98 1a5n s LEU 68 Cb 0.08 0.30 0.01 0.00 0.50 0.00 0.00 46.19 47.09 1a5n s LEU 68 CO 0.86 -0.08 -0.09 0.54 -1.32 0.00 0.00 176.35 176.27 1a5n s VAL 69 N -0.18 0.82 -0.39 1.68 0.11 -0.58 -1.02 120.40 120.84 1a5n s VAL 69 Ca -0.02 -0.32 -0.11 0.00 -2.93 0.00 0.00 61.98 58.59 1a5n s VAL 69 Cb -0.02 -0.77 0.04 0.00 -1.53 0.00 0.00 36.38 34.10 1a5n s VAL 69 CO 0.00 0.28 0.24 -0.76 -3.33 0.00 0.00 175.10 171.52 1a5n s LEU 70 N 0.60 4.89 0.20 2.54 1.02 -0.01 -1.20 118.68 126.72 1a5n s LEU 70 Ca -0.10 -1.10 -0.26 0.00 0.02 0.00 0.00 54.13 52.69 1a5n s LEU 70 Cb -0.13 -2.04 -0.08 0.00 0.02 0.00 0.00 46.19 43.95 1a5n s LEU 70 CO 0.02 -0.44 0.82 0.42 0.02 0.00 0.00 176.35 177.19 1a5n s THR 71 N 1.55 4.31 -1.44 5.49 -4.23 -0.54 -0.97 115.64 119.81 1a5n s THR 71 Ca 0.02 1.76 -0.03 0.00 -1.18 0.00 0.00 61.69 62.27 1a5n s THR 71 Cb -0.20 -4.15 0.02 0.00 1.34 0.00 0.00 72.50 69.51 1a5n s THR 71 CO 0.06 0.47 0.49 0.59 -0.54 0.00 0.00 174.62 175.69 1a5n n ASN 72 N 1.44 -0.82 -4.79 3.99 3.02 -1.26 -0.92 115.26 115.93 1a5n n ASN 72 Ca -0.04 -0.99 -0.38 0.00 -0.03 0.00 0.00 54.58 53.13 1a5n n ASN 72 Cb 0.49 -3.08 -0.06 0.00 -0.61 0.00 0.00 39.78 36.51 1a5n n ASN 72 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a5n s ALA 73 N -3.86 3.47 -0.62 5.41 0.00 -0.10 -3.08 121.76 122.98 1a5n s ALA 73 Ca 0.11 0.24 -0.16 0.00 0.00 0.00 0.00 51.96 52.15 1a5n s ALA 73 Cb -0.06 -2.85 0.15 0.00 0.00 0.00 0.00 23.12 20.37 1a5n s ALA 73 CO 0.89 0.33 0.59 -1.17 0.00 0.00 0.00 175.76 176.39 1a5n s LEU 74 N -1.35 6.29 0.17 0.00 2.96 -1.01 -1.10 118.68 124.64 1a5n s LEU 74 Ca 0.36 -2.01 -0.30 0.00 -0.22 0.00 0.00 54.13 51.96 1a5n s LEU 74 Cb -0.21 -2.22 -0.07 0.00 0.50 0.00 0.00 46.19 44.19 1a5n s LEU 74 CO 0.23 -0.80 1.08 -0.63 -1.32 0.00 0.00 176.35 174.91 1a5n s ILE 75 N 1.29 3.95 -0.31 6.68 1.01 0.19 -1.28 121.20 132.73 1a5n s ILE 75 Ca 0.08 1.68 0.01 0.00 0.00 0.00 0.00 60.65 62.42 1a5n s ILE 75 Cb -0.24 -4.07 0.09 0.00 0.01 0.00 0.00 42.46 38.25 1a5n s ILE 75 CO -0.00 0.29 0.06 -0.69 0.00 0.00 0.00 174.94 174.60 1a5n s VAL 76 N -0.23 1.46 0.23 2.92 1.01 -0.88 -1.52 120.40 123.39 1a5n s VAL 76 Ca 0.49 -1.71 0.00 0.00 0.00 0.00 0.00 61.98 60.76 1a5n s VAL 76 Cb -0.29 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 1a5n s VAL 76 CO 0.34 -0.57 0.11 -0.62 0.00 0.00 0.00 175.10 174.35 1a5n s ASP 77 N 1.33 0.73 0.61 3.32 2.15 -0.46 -4.62 116.67 119.73 1a5n s ASP 77 Ca 0.08 -1.38 0.31 0.00 0.43 0.00 0.00 52.55 52.00 1a5n s ASP 77 Cb -0.18 0.26 1.79 0.00 -0.30 0.00 0.00 42.92 44.49 1a5n s ASP 77 CO -0.16 -0.77 2.15 1.12 -0.17 0.00 0.00 175.17 177.33 1a5n h HIS 78 N 2.51 0.00 0.00 -5.34 2.07 -1.93 -2.00 115.15 110.45 1a5n h HIS 78 Ca -0.37 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.15 1a5n h HIS 78 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1a5n h HIS 78 CO 0.41 0.00 -0.85 -2.67 -3.07 0.00 0.00 177.93 171.75 1a5n n TRP 79 N -3.62 0.12 0.00 6.12 4.27 -1.26 -4.91 117.44 118.16 1a5n n TRP 79 Ca -0.00 0.04 0.00 0.00 -3.89 0.00 0.00 57.50 53.64 1a5n n TRP 79 Cb 0.25 -0.28 0.00 0.00 -1.36 0.00 0.00 31.31 29.92 1a5n n TRP 79 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1a5n n GLY 80 N 1.44 1.86 2.92 -1.67 0.00 -0.75 -5.06 105.19 103.93 1a5n n GLY 80 Ca 0.04 -0.84 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 1a5n n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a5n s ILE 81 N -2.00 2.24 0.24 -0.61 1.01 -1.26 -1.36 121.20 119.46 1a5n s ILE 81 Ca 0.00 -2.85 0.05 0.00 0.00 0.00 0.00 60.65 57.85 1a5n s ILE 81 Cb 0.00 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.83 1a5n s ILE 81 CO 0.00 -0.75 -0.04 0.68 0.00 0.00 0.00 174.94 174.82 1a5n s VAL 82 N 0.22 1.30 -0.19 2.92 -7.23 -0.57 -1.42 120.40 115.42 1a5n s VAL 82 Ca 0.15 -2.08 -0.07 0.00 -1.81 0.00 0.00 61.98 58.17 1a5n s VAL 82 Cb -0.23 -2.31 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 1a5n s VAL 82 CO -0.03 -0.38 0.05 -0.75 -0.31 0.00 0.00 175.10 173.68 1a5n s LYS 83 N -3.79 3.90 0.00 4.82 2.47 -0.14 0.54 119.74 127.54 1a5n s LYS 83 Ca 0.27 -0.38 -0.30 0.00 -1.56 0.00 0.00 55.97 54.00 1a5n s LYS 83 Cb 0.04 -3.20 0.11 0.00 -1.46 0.00 0.00 37.83 33.32 1a5n s LYS 83 CO 0.09 0.20 1.21 0.00 0.16 0.00 0.00 175.35 177.01 1a5n s ALA 84 N 0.56 -2.10 0.10 3.13 0.00 -0.26 -1.14 121.76 122.05 1a5n s ALA 84 Ca 0.03 0.67 -0.13 0.00 0.00 0.00 0.00 51.96 52.53 1a5n s ALA 84 Cb -0.13 0.37 -0.06 0.00 0.00 0.00 0.00 23.12 23.30 1a5n s ALA 84 CO 0.01 -1.00 0.47 -0.51 0.00 0.00 0.00 175.76 174.73 1a5n s ASP 85 N -2.89 6.76 -0.13 0.00 1.01 -0.71 -0.93 116.67 119.78 1a5n s ASP 85 Ca 0.13 0.96 -0.00 0.00 0.71 0.00 0.00 52.55 54.34 1a5n s ASP 85 Cb 0.03 -2.24 -0.01 0.00 1.01 0.00 0.00 42.92 41.70 1a5n s ASP 85 CO -0.03 0.17 -0.13 -0.63 0.21 0.00 0.00 175.17 174.76 1a5n s ILE 86 N -1.37 3.04 -0.10 0.77 1.01 -0.15 -1.67 121.20 122.74 1a5n s ILE 86 Ca 0.34 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 60.29 1a5n s ILE 86 Cb -0.15 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 1a5n s ILE 86 CO 0.18 0.52 0.05 -0.83 0.00 0.00 0.00 174.94 174.86 1a5n s GLY 87 N 0.41 1.96 -0.08 6.18 0.00 0.31 -0.83 107.32 115.27 1a5n s GLY 87 Ca -0.10 -0.75 0.01 0.00 0.00 0.00 0.00 44.72 43.88 1a5n s GLY 87 CO 0.05 -0.50 -0.08 0.14 0.00 0.00 0.00 173.10 172.72 1a5n s VAL 88 N -0.92 0.90 -0.02 1.40 1.01 -0.18 -0.57 120.40 122.01 1a5n s VAL 88 Ca 0.14 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1a5n s VAL 88 Cb -0.12 -0.89 0.02 0.00 0.00 0.00 0.00 36.38 35.40 1a5n s VAL 88 CO 0.03 0.32 -0.00 -0.75 0.00 0.00 0.00 175.10 174.70 1a5n s LYS 89 N 1.16 0.21 -1.52 2.72 2.20 -0.23 -1.18 119.74 123.11 1a5n s LYS 89 Ca -0.06 0.04 -0.06 0.00 -0.36 0.00 0.00 55.97 55.54 1a5n s LYS 89 Cb -0.14 -0.35 0.01 0.00 -1.51 0.00 0.00 37.83 35.85 1a5n s LYS 89 CO -0.02 -0.08 0.64 -0.25 -0.36 0.00 0.00 175.35 175.29 1a5n n ASP 90 N 3.79 -5.89 0.00 1.43 8.00 -1.26 -1.77 116.55 120.85 1a5n n ASP 90 Ca -0.23 -0.32 0.00 0.00 0.71 0.00 0.00 54.79 54.95 1a5n n ASP 90 Cb 0.53 -4.75 0.00 0.00 -0.02 0.00 0.00 41.12 36.88 1a5n n ASP 90 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a5n n GLY 91 N -1.53 0.55 3.31 0.44 0.00 -1.26 -5.00 105.19 101.70 1a5n n GLY 91 Ca -0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 1a5n n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a5n s ARG 92 N -0.40 1.23 -0.18 1.61 0.52 -0.73 -0.63 118.95 120.37 1a5n s ARG 92 Ca 0.00 -1.44 -0.29 0.00 -0.52 0.00 0.00 55.73 53.48 1a5n s ARG 92 Cb 0.00 -1.11 -0.04 0.00 0.52 0.00 0.00 34.95 34.32 1a5n s ARG 92 CO 0.00 0.20 1.74 0.42 0.02 0.00 0.00 175.30 177.69 1a5n s ILE 93 N -2.50 3.51 -0.14 1.52 1.01 0.19 -1.07 121.20 123.71 1a5n s ILE 93 Ca 0.17 0.58 -0.23 0.00 0.00 0.00 0.00 60.65 61.16 1a5n s ILE 93 Cb -0.03 -3.51 -0.25 0.00 0.01 0.00 0.00 42.46 38.68 1a5n s ILE 93 CO 0.06 -0.21 0.58 0.15 0.00 0.00 0.00 174.94 175.52 1a5n h PHE 94 N 11.22 0.15 -2.35 3.97 3.57 -1.12 0.31 116.94 132.69 1a5n h PHE 94 Ca -0.37 -0.11 0.11 0.00 3.53 0.00 0.00 57.97 61.14 1a5n h PHE 94 Cb 1.18 -0.01 -0.13 0.00 2.79 0.00 0.00 35.95 39.78 1a5n h PHE 94 CO 0.92 1.29 0.47 0.00 -2.23 0.00 0.00 178.31 178.76 1a5n s ALA 95 N -2.34 -1.76 -0.27 2.41 0.00 -1.11 -4.79 121.76 113.91 1a5n s ALA 95 Ca -0.21 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.52 1a5n s ALA 95 Cb 0.01 0.51 0.08 0.00 0.00 0.00 0.00 23.12 23.72 1a5n s ALA 95 CO 0.69 -0.78 0.02 0.42 0.00 0.00 0.00 175.76 176.12 1a5n s ILE 96 N -3.21 1.30 0.00 0.00 1.01 -1.26 -0.53 121.20 118.50 1a5n s ILE 96 Ca 0.06 -1.34 0.00 0.00 0.00 0.00 0.00 60.65 59.37 1a5n s ILE 96 Cb -0.01 -1.78 0.00 0.00 0.01 0.00 0.00 42.46 40.68 1a5n s ILE 96 CO -0.07 -0.36 0.00 0.61 0.00 0.00 0.00 174.94 175.12 1a5n n GLY 97 N 4.72 2.09 3.22 6.18 0.00 -0.67 -4.97 105.19 115.77 1a5n n GLY 97 Ca -0.06 0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1a5n n GLY 97 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1a5n s LYS 98 N 4.28 3.04 0.25 1.61 2.36 -1.26 -1.74 119.74 128.28 1a5n s LYS 98 Ca 0.00 -0.84 -0.02 0.00 -2.55 0.00 0.00 55.97 52.56 1a5n s LYS 98 Cb 0.00 -2.93 -0.04 0.00 -1.05 0.00 0.00 37.83 33.80 1a5n s LYS 98 CO 0.00 -0.31 0.46 0.00 1.55 0.00 0.00 175.35 177.06 1a5n s ALA 99 N 1.37 3.75 0.00 3.13 0.00 -1.26 0.34 121.76 129.09 1a5n s ALA 99 Ca 0.03 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.22 1a5n s ALA 99 Cb -0.15 -2.10 0.00 0.00 0.00 0.00 0.00 23.12 20.87 1a5n s ALA 99 CO -0.05 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.42 1a5n n GLY 100 N -0.93 -0.04 3.17 0.00 0.00 -0.49 -4.63 105.19 102.27 1a5n n GLY 100 Ca -0.04 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 1a5n n GLY 100 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1a5n s ASN 101 N -4.00 4.26 0.44 1.61 2.47 -1.20 -1.64 114.94 116.87 1a5n s ASN 101 Ca 0.00 -0.96 0.30 0.00 0.42 0.00 0.00 52.86 52.61 1a5n s ASN 101 Cb 0.00 -1.63 1.60 0.00 -1.45 0.00 0.00 41.25 39.77 1a5n s ASN 101 CO 0.00 -0.13 1.91 -0.65 -3.72 0.00 0.00 177.10 174.50 1a5n h PRO 102 N 7.97 0.00 -0.44 0.43 0.11 -1.92 0.12 132.00 138.27 1a5n h PRO 102 Ca -0.31 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.70 1a5n h PRO 102 Cb 1.10 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1a5n h PRO 102 CO 0.56 0.00 -0.12 -0.44 -0.21 0.00 0.00 178.00 177.79 1a5n h ASP 103 N 0.00 0.79 0.00 -2.05 3.32 -1.94 -3.38 116.42 113.17 1a5n h ASP 103 Ca 0.00 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1a5n h ASP 103 Cb 0.02 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.36 1a5n h ASP 103 CO 0.00 0.93 -0.39 2.30 -1.72 0.00 0.00 179.24 180.36 1a5n n ILE 104 N -4.16 0.00 -4.11 0.35 -5.35 -0.94 -5.07 119.36 100.08 1a5n n ILE 104 Ca 0.01 -0.15 -0.31 0.00 -0.27 0.00 0.00 62.75 62.03 1a5n n ILE 104 Cb 0.37 0.63 -0.07 0.00 -1.74 0.00 0.00 39.64 38.83 1a5n n ILE 104 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1a5n s GLN 105 N -1.08 2.83 0.37 6.28 -0.21 0.38 -5.07 119.66 123.16 1a5n s GLN 105 Ca 0.00 -0.67 -0.05 0.00 0.02 0.00 0.00 55.36 54.65 1a5n s GLN 105 Cb 0.00 -2.70 -0.05 0.00 1.00 0.00 0.00 33.01 31.26 1a5n s GLN 105 CO 0.00 0.58 0.66 -1.25 -2.12 0.00 0.00 175.29 173.16 1a5n s PRO 106 N -2.13 3.62 -1.56 2.91 0.04 -1.26 -4.41 135.00 132.21 1a5n s PRO 106 Ca 0.26 0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.41 1a5n s PRO 106 Cb -0.12 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1a5n s PRO 106 CO 0.18 0.04 0.00 0.09 0.04 0.00 0.00 177.00 177.35 1a5n n ASN 107 N -1.48 -4.40 -4.66 6.66 5.03 -1.26 -4.93 115.26 110.21 1a5n n ASN 107 Ca -0.01 0.28 -0.43 0.00 0.87 0.00 0.00 54.58 55.30 1a5n n ASN 107 Cb 0.55 -3.88 -0.02 0.00 -1.02 0.00 0.00 39.78 35.40 1a5n n ASN 107 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1a5n s VAL 108 N -2.52 3.96 -0.17 2.41 1.01 -1.26 -4.49 120.40 119.34 1a5n s VAL 108 Ca 0.00 1.19 0.08 0.00 0.00 0.00 0.00 61.98 63.25 1a5n s VAL 108 Cb 0.00 -3.77 -0.11 0.00 0.00 0.00 0.00 36.38 32.51 1a5n s VAL 108 CO 0.00 -0.09 0.25 0.35 0.00 0.00 0.00 175.10 175.60 1a5n n THR 109 N 5.31 0.00 -3.90 3.92 -2.24 0.15 -4.85 114.28 112.67 1a5n n THR 109 Ca 0.15 -0.24 -0.30 0.00 -2.27 0.00 0.00 64.05 61.38 1a5n n THR 109 Cb 0.44 0.62 -0.14 0.00 -2.10 0.00 0.00 70.33 69.15 1a5n n THR 109 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1a5n s ILE 110 N -2.19 1.96 0.04 2.28 1.01 -0.60 -4.91 121.20 118.79 1a5n s ILE 110 Ca -0.00 -2.46 -0.31 0.00 0.00 0.00 0.00 60.65 57.88 1a5n s ILE 110 Cb 0.05 -2.42 -0.06 0.00 0.01 0.00 0.00 42.46 40.04 1a5n s ILE 110 CO 0.33 -0.71 1.40 -2.16 0.00 0.00 0.00 174.94 173.79 1a5n s PRO 111 N 0.63 4.30 -0.22 2.79 0.04 -1.26 -1.40 135.00 139.88 1a5n s PRO 111 Ca 0.13 2.01 -0.09 0.00 0.04 0.00 0.00 61.00 63.09 1a5n s PRO 111 Cb -0.21 -3.46 -0.05 0.00 0.04 0.00 0.00 34.50 30.82 1a5n s PRO 111 CO -0.08 -0.52 0.12 0.42 0.04 0.00 0.00 177.00 176.98 1a5n s ILE 112 N 1.94 5.14 0.00 0.56 1.01 -0.65 -2.16 121.20 127.04 1a5n s ILE 112 Ca 0.64 0.10 0.00 0.00 0.00 0.00 0.00 60.65 61.39 1a5n s ILE 112 Cb -0.33 -3.37 0.00 0.00 0.01 0.00 0.00 42.46 38.76 1a5n s ILE 112 CO 0.28 0.38 0.00 0.61 0.00 0.00 0.00 174.94 176.22 1a5n n GLY 113 N 4.07 4.28 0.31 6.18 0.00 -1.26 -0.16 105.19 118.60 1a5n n GLY 113 Ca -0.16 -1.81 0.13 0.00 0.00 0.00 0.00 46.02 44.18 1a5n n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5n h ALA 114 N 1.00 2.20 -0.15 4.61 0.00 -1.78 -1.03 119.26 124.11 1a5n h ALA 114 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1a5n h ALA 114 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1a5n h ALA 114 CO 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 179.25 178.98 1a5n n ALA 115 N -2.58 2.52 -2.65 0.00 0.00 -1.26 -4.88 120.51 111.67 1a5n n ALA 115 Ca 0.02 -0.42 -0.39 0.00 0.00 0.00 0.00 53.44 52.65 1a5n n ALA 115 Cb 0.31 -1.11 -0.07 0.00 0.00 0.00 0.00 19.45 18.58 1a5n n ALA 115 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1a5n s THR 116 N -1.80 5.11 0.30 0.00 2.01 -0.39 -4.51 115.64 116.35 1a5n s THR 116 Ca 0.28 0.89 -0.07 0.00 0.31 0.00 0.00 61.69 63.09 1a5n s THR 116 Cb 0.14 -3.82 -0.06 0.00 0.01 0.00 0.00 72.50 68.78 1a5n s THR 116 CO 0.22 0.16 0.60 -0.70 -0.69 0.00 0.00 174.62 174.21 1a5n s GLU 117 N 1.81 3.70 -0.04 4.92 2.56 0.91 -4.88 118.70 127.68 1a5n s GLU 117 Ca 0.22 0.17 0.05 0.00 0.00 0.00 0.00 54.97 55.41 1a5n s GLU 117 Cb -0.15 -2.59 -0.01 0.00 2.00 0.00 0.00 34.13 33.38 1a5n s GLU 117 CO 0.09 0.18 -0.18 0.08 -0.56 0.00 0.00 175.26 174.87 1a5n s VAL 118 N -2.09 1.51 -0.15 3.70 1.01 -1.26 -1.53 120.40 121.59 1a5n s VAL 118 Ca 0.46 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.69 1a5n s VAL 118 Cb -0.11 -1.29 0.02 0.00 0.00 0.00 0.00 36.38 35.00 1a5n s VAL 118 CO 0.28 0.43 -0.19 -0.63 0.00 0.00 0.00 175.10 175.00 1a5n s ILE 119 N -0.04 1.87 -0.50 2.22 1.01 -0.34 -4.97 121.20 120.45 1a5n s ILE 119 Ca -0.02 -0.84 -0.25 0.00 0.00 0.00 0.00 60.65 59.54 1a5n s ILE 119 Cb -0.11 -1.70 0.03 0.00 0.01 0.00 0.00 42.46 40.70 1a5n s ILE 119 CO 0.02 0.51 0.92 0.00 0.00 0.00 0.00 174.94 176.39 1a5n s ALA 120 N 1.16 3.20 -1.23 9.38 0.00 -1.26 -1.46 121.76 131.55 1a5n s ALA 120 Ca 0.00 -1.01 0.16 0.00 0.00 0.00 0.00 51.96 51.11 1a5n s ALA 120 Cb -0.14 -3.67 0.51 0.00 0.00 0.00 0.00 23.12 19.82 1a5n s ALA 120 CO -0.08 -2.20 1.43 0.00 0.00 0.00 0.00 175.76 174.91 1a5n n ALA 121 N 7.27 2.48 -1.74 0.00 0.00 -0.10 -4.92 120.51 123.51 1a5n n ALA 121 Ca 0.04 -1.38 -0.42 0.00 0.00 0.00 0.00 53.44 51.68 1a5n n ALA 121 Cb 0.48 -0.72 -0.03 0.00 0.00 0.00 0.00 19.45 19.18 1a5n n ALA 121 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1a5n s GLU 122 N -1.31 4.14 0.00 0.00 1.03 -1.04 -1.04 118.70 120.48 1a5n s GLU 122 Ca 0.38 2.58 0.00 0.00 0.03 0.00 0.00 54.97 57.96 1a5n s GLU 122 Cb 0.22 -3.44 0.00 0.00 -0.80 0.00 0.00 34.13 30.11 1a5n s GLU 122 CO 0.22 -0.81 0.00 0.41 -1.33 0.00 0.00 175.26 173.76 1a5n n GLY 123 N 4.14 0.80 3.62 -3.83 0.00 -1.26 -4.81 105.19 103.85 1a5n n GLY 123 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 1a5n n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a5n s LYS 124 N -0.27 2.16 -0.14 1.61 -0.14 -0.20 -4.31 119.74 118.44 1a5n s LYS 124 Ca 0.00 -1.53 -0.03 0.00 -1.36 0.00 0.00 55.97 53.05 1a5n s LYS 124 Cb 0.00 -2.06 -0.03 0.00 -1.68 0.00 0.00 37.83 34.06 1a5n s LYS 124 CO 0.00 0.31 -0.04 0.42 -0.76 0.00 0.00 175.35 175.29 1a5n s ILE 125 N -2.39 3.93 -0.09 2.17 1.01 0.44 -2.41 121.20 123.86 1a5n s ILE 125 Ca 0.32 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.64 1a5n s ILE 125 Cb -0.05 -2.70 -0.02 0.00 0.01 0.00 0.00 42.46 39.70 1a5n s ILE 125 CO 0.19 0.52 -0.15 -0.69 0.00 0.00 0.00 174.94 174.80 1a5n s VAL 126 N 0.11 2.89 0.15 2.92 1.01 -0.40 -0.24 120.40 126.84 1a5n s VAL 126 Ca -0.01 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.23 1a5n s VAL 126 Cb -0.14 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1a5n s VAL 126 CO 0.03 0.55 0.02 0.42 0.00 0.00 0.00 175.10 176.12 1a5n s THR 127 N -0.09 0.40 0.88 3.92 -4.23 -0.53 -2.07 115.64 113.93 1a5n s THR 127 Ca -0.03 -1.94 -0.12 0.00 -1.18 0.00 0.00 61.69 58.43 1a5n s THR 127 Cb -0.14 -2.04 0.12 0.00 1.34 0.00 0.00 72.50 71.78 1a5n s THR 127 CO 0.04 -0.51 1.10 0.00 -0.54 0.00 0.00 174.62 174.71 1a5n s ALA 128 N -3.84 1.73 0.29 3.99 0.00 -1.26 -0.74 121.76 121.92 1a5n s ALA 128 Ca 0.23 -0.22 -0.27 0.00 0.00 0.00 0.00 51.96 51.69 1a5n s ALA 128 Cb 0.07 -3.13 -0.09 0.00 0.00 0.00 0.00 23.12 19.96 1a5n s ALA 128 CO 0.02 -2.21 0.94 0.20 0.00 0.00 0.00 175.76 174.71 1a5n s GLY 129 N -3.67 2.92 0.86 0.00 0.00 -0.63 -4.53 107.32 102.27 1a5n s GLY 129 Ca 0.63 0.55 -0.11 0.00 0.00 0.00 0.00 44.72 45.79 1a5n s GLY 129 CO 0.56 1.04 1.10 -0.32 0.00 0.00 0.00 173.10 175.48 1a5n s GLY 130 N -1.45 1.65 -0.16 0.20 0.00 0.67 -4.59 107.32 103.65 1a5n s GLY 130 Ca 0.46 0.22 -0.02 0.00 0.00 0.00 0.00 44.72 45.38 1a5n s GLY 130 CO 0.27 0.64 0.03 -0.42 0.00 0.00 0.00 173.10 173.62 1a5n s ILE 131 N -2.83 0.49 -0.27 0.90 1.01 0.11 -0.82 121.20 119.79 1a5n s ILE 131 Ca 0.63 -0.39 -0.12 0.00 0.00 0.00 0.00 60.65 60.78 1a5n s ILE 131 Cb -0.19 -0.91 -0.05 0.00 0.01 0.00 0.00 42.46 41.32 1a5n s ILE 131 CO 0.57 -0.09 0.22 -0.62 0.00 0.00 0.00 174.94 175.03 1a5n s ASP 132 N 1.89 6.08 -0.27 3.58 -1.08 -0.71 -4.74 116.67 121.42 1a5n s ASP 132 Ca 0.01 0.07 0.12 0.00 -0.52 0.00 0.00 52.55 52.23 1a5n s ASP 132 Cb -0.16 -2.14 0.64 0.00 -1.46 0.00 0.00 42.92 39.80 1a5n s ASP 132 CO -0.07 -0.06 1.62 0.35 0.52 0.00 0.00 175.17 177.53 1a5n n THR 133 N 4.95 2.66 -3.12 1.71 -2.24 -1.26 -0.52 114.28 116.46 1a5n n THR 133 Ca -0.13 -1.92 -0.18 0.00 -2.27 0.00 0.00 64.05 59.55 1a5n n THR 133 Cb 0.52 -0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 68.41 1a5n n THR 133 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1a5n n HIS 134 N -0.43 -0.50 -3.94 4.78 -0.00 -1.07 -4.71 115.22 109.35 1a5n n HIS 134 Ca 0.33 -3.45 -0.37 0.00 -0.00 0.00 0.00 57.72 54.23 1a5n n HIS 134 Cb 1.16 -0.07 -0.07 0.00 -0.00 0.00 0.00 29.99 31.02 1a5n n HIS 134 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1a5n s ILE 135 N -1.63 5.35 -0.33 3.57 -1.09 -0.69 -1.44 121.20 124.95 1a5n s ILE 135 Ca 0.36 0.15 -0.05 0.00 -2.23 0.00 0.00 60.65 58.89 1a5n s ILE 135 Cb 0.29 -3.33 0.05 0.00 -1.58 0.00 0.00 42.46 37.89 1a5n s ILE 135 CO -0.09 0.61 0.07 -1.00 -1.23 0.00 0.00 174.94 173.30 1a5n s HIS 136 N -0.96 3.27 -1.15 3.97 3.76 -1.26 -2.03 115.29 120.90 1a5n s HIS 136 Ca 0.14 -1.63 -0.20 0.00 -0.15 0.00 0.00 55.06 53.22 1a5n s HIS 136 Cb -0.12 -2.26 -0.05 0.00 1.11 0.00 0.00 32.58 31.26 1a5n s HIS 136 CO 0.04 -0.77 1.92 0.91 -0.85 0.00 0.00 174.74 175.98 1a5n n TRP 137 N 4.73 3.08 0.06 1.40 7.02 -0.44 -4.55 117.44 128.75 1a5n n TRP 137 Ca -0.12 -2.03 -0.17 0.00 -1.02 0.00 0.00 57.50 54.15 1a5n n TRP 137 Cb 0.44 -2.41 -0.14 0.00 -2.42 0.00 0.00 31.31 26.78 1a5n n TRP 137 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 1a5n h ILE 138 N 5.40 1.13 -2.81 -0.99 2.04 -1.88 -0.88 117.51 119.51 1a5n h ILE 138 Ca 0.36 -2.77 -0.11 0.00 1.00 0.00 0.00 64.86 63.34 1a5n h ILE 138 Cb 0.83 2.75 -0.20 0.00 -0.74 0.00 0.00 36.82 39.46 1a5n h ILE 138 CO 1.52 0.82 -0.18 0.00 0.00 0.00 0.00 178.15 180.31 1a5n h PRO 140 N 3.71 0.00 0.00 0.00 0.13 -1.98 -3.18 132.00 130.68 1a5n h PRO 140 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1a5n h PRO 140 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1a5n h PRO 140 CO 0.40 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.21 1a5n n GLN 141 N -2.48 0.13 0.15 0.86 3.00 -1.26 -2.72 117.38 115.06 1a5n n GLN 141 Ca 0.02 0.42 0.03 0.00 -0.01 0.00 0.00 57.00 57.46 1a5n n GLN 141 Cb 0.28 -1.77 0.39 0.00 0.00 0.00 0.00 30.24 29.13 1a5n n GLN 141 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.06 179.02 1a5n h GLN 142 N 0.00 0.15 -0.72 -1.09 4.20 -1.98 -2.98 115.11 112.69 1a5n h GLN 142 Ca 0.00 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.61 1a5n h GLN 142 Cb 0.26 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 1a5n h GLN 142 CO 0.00 0.36 0.21 0.00 -0.67 0.00 0.00 178.83 178.73 1a5n h ALA 143 N 1.65 1.01 -0.29 3.87 0.00 -1.78 -0.69 119.26 123.04 1a5n h ALA 143 Ca 0.03 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 1a5n h ALA 143 Cb 0.45 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1a5n h ALA 143 CO 0.03 0.66 -0.15 1.49 0.00 0.00 0.00 179.25 181.28 1a5n h GLU 144 N 1.07 0.60 -0.19 0.00 4.81 -1.73 0.46 114.58 119.60 1a5n h GLU 144 Ca 0.23 -0.27 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1a5n h GLU 144 Cb 0.32 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1a5n h GLU 144 CO -0.01 0.84 0.09 1.49 -0.73 0.00 0.00 179.01 180.69 1a5n h GLU 145 N 0.35 0.18 -0.48 1.92 4.57 -1.38 -1.04 114.58 118.70 1a5n h GLU 145 Ca 0.06 -0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.17 1a5n h GLU 145 Cb 0.67 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.20 1a5n h GLU 145 CO 0.04 0.12 0.04 0.00 -1.18 0.00 0.00 179.01 178.04 1a5n h ALA 146 N 1.10 0.64 -0.62 2.92 0.00 -1.05 -2.91 119.26 119.33 1a5n h ALA 146 Ca 0.08 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1a5n h ALA 146 Cb 0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1a5n h ALA 146 CO -0.06 0.40 0.38 1.25 0.00 0.00 0.00 179.25 181.23 1a5n h LEU 147 N 0.68 0.74 -1.76 0.00 5.85 -0.62 -1.46 115.31 118.74 1a5n h LEU 147 Ca 0.14 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1a5n h LEU 147 Cb 0.45 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1a5n h LEU 147 CO 0.02 0.58 0.05 0.58 -0.34 0.00 0.00 178.44 179.32 1a5n h VAL 148 N 0.85 1.07 0.00 1.05 2.07 -1.12 -1.79 116.25 118.37 1a5n h VAL 148 Ca 0.22 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.53 1a5n h VAL 148 Cb -0.04 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1a5n h VAL 148 CO -0.04 0.08 -0.07 0.77 0.02 0.00 0.00 177.57 178.32 1a5n h SER 149 N 0.20 0.00 0.00 0.57 4.64 -1.20 -3.38 113.55 114.38 1a5n h SER 149 Ca 0.05 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1a5n h SER 149 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1a5n h SER 149 CO -0.00 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1a5n n GLY 150 N 1.30 1.33 3.57 -0.77 0.00 -0.67 -4.87 105.19 105.09 1a5n n GLY 150 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1a5n n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a5n s VAL 151 N -2.00 5.28 -1.14 1.61 1.01 -0.61 -0.24 120.40 124.30 1a5n s VAL 151 Ca 0.00 0.07 0.19 0.00 0.00 0.00 0.00 61.98 62.24 1a5n s VAL 151 Cb 0.00 -3.64 -0.16 0.00 0.00 0.00 0.00 36.38 32.58 1a5n s VAL 151 CO 0.00 0.12 0.86 0.35 0.00 0.00 0.00 175.10 176.44 1a5n n THR 152 N 5.10 0.00 -4.58 3.92 -2.24 0.00 -3.52 114.28 112.96 1a5n n THR 152 Ca -0.13 -0.10 -0.22 0.00 -2.27 0.00 0.00 64.05 61.33 1a5n n THR 152 Cb 0.51 1.06 -0.15 0.00 -2.10 0.00 0.00 70.33 69.64 1a5n n THR 152 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1a5n s THR 153 N -2.69 1.03 -0.08 4.28 2.01 -1.00 -0.98 115.64 118.21 1a5n s THR 153 Ca 0.10 -0.53 -0.00 0.00 0.31 0.00 0.00 61.69 61.57 1a5n s THR 153 Cb 0.15 -0.88 0.02 0.00 0.01 0.00 0.00 72.50 71.80 1a5n s THR 153 CO 0.72 0.30 -0.04 -0.04 -0.69 0.00 0.00 174.62 174.87 1a5n s MET 154 N -0.08 1.01 -0.07 4.92 -1.94 0.82 -1.74 119.30 122.22 1a5n s MET 154 Ca 0.01 -0.08 0.05 0.00 -1.71 0.00 0.00 55.69 53.96 1a5n s MET 154 Cb -0.07 -1.17 -0.01 0.00 2.01 0.00 0.00 34.83 35.58 1a5n s MET 154 CO 0.00 -0.23 -0.23 0.08 -0.01 0.00 0.00 175.02 174.64 1a5n s VAL 155 N 1.60 2.25 -2.99 -6.03 1.01 0.32 -2.62 120.40 113.94 1a5n s VAL 155 Ca 0.01 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.00 1a5n s VAL 155 Cb -0.13 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.41 1a5n s VAL 155 CO -0.05 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1a5n n GLY 156 N 3.02 -0.55 3.80 4.51 0.00 -1.07 -1.71 105.19 113.19 1a5n n GLY 156 Ca -0.18 -0.82 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 1a5n n GLY 156 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a5n s GLY 157 N 0.00 -0.03 0.00 -0.02 0.00 -0.86 -1.10 107.32 105.31 1a5n s GLY 157 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 44.72 44.37 1a5n s GLY 157 CO 0.00 -0.16 0.00 0.61 0.00 0.00 0.00 173.10 173.55 1a5n n GLY 158 N -0.44 1.28 0.00 0.20 0.00 -1.14 -1.33 105.19 103.76 1a5n n GLY 158 Ca -0.04 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1a5n n GLY 158 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a5n n THR 159 N -1.53 0.17 0.00 2.61 -2.24 -1.23 -4.58 114.28 107.47 1a5n n THR 159 Ca 0.00 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1a5n n THR 159 Cb 0.00 1.24 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 1a5n n THR 159 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a5n n GLY 160 N -0.08 0.63 2.64 3.38 0.00 -0.34 -4.90 105.19 106.52 1a5n n GLY 160 Ca 0.00 -2.13 -0.30 0.00 0.00 0.00 0.00 46.02 43.59 1a5n n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1a5n n PRO 161 N 0.00 2.38 -4.25 1.61 -0.04 -0.73 -4.43 135.00 129.54 1a5n n PRO 161 Ca 0.00 -1.76 -0.26 0.00 -0.04 0.00 0.00 63.50 61.44 1a5n n PRO 161 Cb 0.00 -2.66 -0.08 0.00 -0.04 0.00 0.00 33.50 30.72 1a5n n PRO 161 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a5n s ALA 162 N 3.40 3.13 0.23 0.55 0.00 -1.26 -4.99 121.76 122.82 1a5n s ALA 162 Ca 0.49 -1.47 -0.07 0.00 0.00 0.00 0.00 51.96 50.91 1a5n s ALA 162 Cb 0.13 -0.87 0.37 0.00 0.00 0.00 0.00 23.12 22.74 1a5n s ALA 162 CO -0.02 0.42 1.71 0.00 0.00 0.00 0.00 175.76 177.87 1a5n h ALA 163 N 2.53 0.86 -0.27 0.00 0.00 -2.00 -0.65 119.26 119.74 1a5n h ALA 163 Ca -0.46 0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.63 1a5n h ALA 163 Cb 1.22 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 1a5n h ALA 163 CO 0.58 -0.28 -0.06 0.78 0.00 0.00 0.00 179.25 180.27 1a5n h GLY 164 N 0.32 0.20 1.68 0.00 0.00 -1.94 -2.42 103.07 100.91 1a5n h GLY 164 Ca 0.36 0.08 -0.11 0.00 0.00 0.00 0.00 47.33 47.66 1a5n h GLY 164 CO -0.42 -0.10 -0.36 -0.84 0.00 0.00 0.00 176.54 174.82 1a5n h THR 165 N 0.01 1.29 -0.58 4.70 2.02 -1.56 0.22 112.91 119.02 1a5n h THR 165 Ca 0.13 -1.45 0.03 0.00 0.77 0.00 0.00 66.41 65.89 1a5n h THR 165 Cb 0.19 1.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 1a5n h THR 165 CO -0.27 0.44 0.35 0.45 0.37 0.00 0.00 175.52 176.87 1a5n h HIS 166 N 0.31 0.65 0.03 3.16 3.86 -0.78 -3.23 115.15 119.16 1a5n h HIS 166 Ca 0.03 0.02 -0.28 0.00 -1.16 0.00 0.00 60.37 58.98 1a5n h HIS 166 Cb 0.79 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 29.01 1a5n h HIS 166 CO 0.02 0.37 -1.54 0.00 0.86 0.00 0.00 177.93 177.64 1a5n h ALA 167 N 1.26 0.57 -2.24 2.45 0.00 -1.28 -3.42 119.26 116.59 1a5n h ALA 167 Ca 0.23 -1.27 -0.30 0.00 0.00 0.00 0.00 54.91 53.57 1a5n h ALA 167 Cb 0.03 0.33 -0.15 0.00 0.00 0.00 0.00 17.79 18.00 1a5n h ALA 167 CO -0.10 1.41 -0.68 0.95 0.00 0.00 0.00 179.25 180.82 1a5n s THR 168 N -2.62 0.88 -1.14 0.00 -4.23 0.75 -5.00 115.64 104.28 1a5n s THR 168 Ca -0.06 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.42 1a5n s THR 168 Cb 0.08 -1.98 0.25 0.00 1.34 0.00 0.00 72.50 72.19 1a5n s THR 168 CO 0.82 -0.62 1.95 0.35 -0.54 0.00 0.00 174.62 176.59 1a5n n THR 169 N -0.21 5.66 -4.51 3.99 -2.24 -1.26 -4.20 114.28 111.51 1a5n n THR 169 Ca -0.09 -5.40 -0.23 0.00 -2.27 0.00 0.00 64.05 56.06 1a5n n THR 169 Cb 0.62 -1.82 -0.16 0.00 -2.10 0.00 0.00 70.33 66.87 1a5n n THR 169 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1a5n s THR 171 N 0.52 4.35 -0.26 0.00 2.01 -0.62 -2.87 115.64 118.77 1a5n s THR 171 Ca -0.10 -2.20 -0.28 0.00 0.31 0.00 0.00 61.69 59.41 1a5n s THR 171 Cb -0.14 -3.82 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 1a5n s THR 171 CO 0.02 -0.85 1.91 -2.84 -0.69 0.00 0.00 174.62 172.18 1a5n s PRO 172 N 0.80 3.38 0.29 4.92 0.02 -1.26 -3.85 135.00 139.29 1a5n s PRO 172 Ca 0.11 1.71 0.00 0.00 0.02 0.00 0.00 61.00 62.84 1a5n s PRO 172 Cb -0.22 -4.23 0.00 0.00 0.02 0.00 0.00 34.50 30.08 1a5n s PRO 172 CO -0.03 -1.81 0.00 0.41 -0.33 0.00 0.00 177.00 175.25 1a5n n GLY 173 N 5.38 -2.72 0.28 0.52 0.00 -1.26 -4.09 105.19 103.30 1a5n n GLY 173 Ca 0.24 -1.27 0.05 0.00 0.00 0.00 0.00 46.02 45.05 1a5n n GLY 173 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1a5n h PRO 174 N -0.71 0.08 0.35 1.61 0.11 -1.90 0.54 132.00 132.09 1a5n h PRO 174 Ca -0.08 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 1a5n h PRO 174 Cb 0.69 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.78 1a5n h PRO 174 CO 0.03 0.06 -0.17 2.35 -0.21 0.00 0.00 178.00 180.06 1a5n h TRP 175 N 0.09 -0.44 -0.56 0.65 7.01 -2.00 -0.18 115.95 120.53 1a5n h TRP 175 Ca 0.42 -0.01 -0.07 0.00 2.11 0.00 0.00 58.89 61.34 1a5n h TRP 175 Cb 0.74 0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 27.92 1a5n h TRP 175 CO -0.45 -0.18 0.07 1.88 -2.79 0.00 0.00 178.44 176.98 1a5n h TYR 176 N -0.64 0.95 -0.07 2.65 0.05 -1.64 -1.11 116.97 117.15 1a5n h TYR 176 Ca -0.05 -0.12 0.01 0.00 0.05 0.00 0.00 58.73 58.62 1a5n h TYR 176 Cb 0.46 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 1a5n h TYR 176 CO -0.01 0.83 0.02 0.82 -1.05 0.00 0.00 178.16 178.77 1a5n h ILE 177 N 0.85 0.98 -0.72 -2.88 2.04 -0.80 0.02 117.51 117.00 1a5n h ILE 177 Ca 0.17 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 66.03 1a5n h ILE 177 Cb 0.41 0.92 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 1a5n h ILE 177 CO 0.01 0.01 0.46 0.28 0.00 0.00 0.00 178.15 178.92 1a5n h SER 178 N 0.06 0.78 -0.66 1.72 0.02 -0.79 0.31 113.55 114.99 1a5n h SER 178 Ca 0.03 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 1a5n h SER 178 Cb 0.02 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 1a5n h SER 178 CO -0.03 0.55 0.31 0.03 -1.14 0.00 0.00 176.83 176.54 1a5n h ARG 179 N 0.92 0.95 -0.17 3.45 -0.00 -0.82 -2.18 114.38 116.53 1a5n h ARG 179 Ca 0.28 -0.14 -0.15 0.00 -0.50 0.00 0.00 59.98 59.47 1a5n h ARG 179 Cb -0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 29.97 29.76 1a5n h ARG 179 CO -0.09 0.76 -0.52 0.52 0.00 0.00 0.00 179.97 180.64 1a5n h MET 180 N 0.91 0.49 -0.55 0.04 2.86 -0.51 -1.36 114.93 116.80 1a5n h MET 180 Ca 0.22 -0.29 -0.04 0.00 -2.06 0.00 0.00 59.70 57.53 1a5n h MET 180 Cb 0.13 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 1a5n h MET 180 CO -0.03 0.89 0.17 -0.07 1.06 0.00 0.00 176.91 178.93 1a5n h LEU 181 N 0.38 0.76 -0.17 1.22 3.38 -0.67 -0.39 115.31 119.82 1a5n h LEU 181 Ca 0.01 -0.12 -0.14 0.00 0.09 0.00 0.00 57.88 57.72 1a5n h LEU 181 Cb 1.04 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1a5n h LEU 181 CO 0.09 0.72 -0.46 1.56 0.09 0.00 0.00 178.44 180.45 1a5n h GLN 182 N 0.80 0.61 -0.18 1.13 4.20 -1.20 -3.15 115.11 117.32 1a5n h GLN 182 Ca 0.18 -0.43 -0.05 0.00 0.06 0.00 0.00 58.65 58.42 1a5n h GLN 182 Cb 0.24 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 1a5n h GLN 182 CO -0.01 1.05 -0.09 0.00 -0.67 0.00 0.00 178.83 179.11 1a5n h ALA 183 N 0.56 1.51 -0.47 3.87 0.00 -1.01 -2.95 119.26 120.77 1a5n h ALA 183 Ca -0.01 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 54.81 1a5n h ALA 183 Cb 1.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1a5n h ALA 183 CO 0.10 0.35 0.32 0.00 0.00 0.00 0.00 179.25 180.02 1a5n h ALA 184 N 1.64 2.19 -0.03 0.00 0.00 -1.02 -1.53 119.26 120.50 1a5n h ALA 184 Ca 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1a5n h ALA 184 Cb 0.34 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1a5n h ALA 184 CO 0.02 -0.30 0.06 -0.44 0.00 0.00 0.00 179.25 178.59 1a5n h ASP 185 N 0.19 0.00 0.63 0.00 3.32 -1.62 -0.46 116.42 118.48 1a5n h ASP 185 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1a5n h ASP 185 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1a5n h ASP 185 CO -0.04 0.00 -0.22 -1.20 -1.72 0.00 0.00 179.24 176.07 1a5n n SER 186 N -3.43 0.33 -4.81 6.45 7.64 -0.58 -4.73 113.62 114.49 1a5n n SER 186 Ca -0.02 -0.09 -0.36 0.00 1.01 0.00 0.00 58.87 59.40 1a5n n SER 186 Cb 0.14 -0.10 -0.07 0.00 -1.01 0.00 0.00 64.21 63.18 1a5n n SER 186 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1a5n s LEU 187 N -2.85 4.33 0.00 -3.43 1.43 -0.18 -5.00 118.68 112.97 1a5n s LEU 187 Ca 0.17 0.47 0.00 0.00 -1.03 0.00 0.00 54.13 53.74 1a5n s LEU 187 Cb 0.19 -2.18 0.00 0.00 0.03 0.00 0.00 46.19 44.23 1a5n s LEU 187 CO 0.58 0.29 0.51 -0.81 0.23 0.00 0.00 176.35 177.16 1a5n n PRO 188 N 2.60 0.80 -4.25 1.29 -0.04 -1.26 -4.83 135.00 129.30 1a5n n PRO 188 Ca -0.17 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.15 1a5n n PRO 188 Cb 0.53 -1.31 -0.10 0.00 -0.04 0.00 0.00 33.50 32.58 1a5n n PRO 188 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1a5n s VAL 189 N -0.66 1.16 0.22 0.52 -7.23 -1.26 -5.01 120.40 108.14 1a5n s VAL 189 Ca 0.00 -2.06 -0.30 0.00 -1.81 0.00 0.00 61.98 57.81 1a5n s VAL 189 Cb 0.00 -1.86 -0.09 0.00 0.56 0.00 0.00 36.38 34.99 1a5n s VAL 189 CO 0.00 -0.73 1.14 0.20 -0.31 0.00 0.00 175.10 175.39 1a5n s ASN 190 N -3.17 7.20 0.06 4.85 0.01 -0.15 -4.65 114.94 119.08 1a5n s ASN 190 Ca 0.17 2.22 0.05 0.00 -0.71 0.00 0.00 52.86 54.60 1a5n s ASN 190 Cb 0.03 -2.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.04 1a5n s ASN 190 CO 0.01 -0.25 -0.15 -0.63 -1.51 0.00 0.00 177.10 174.58 1a5n s ILE 191 N -0.57 1.15 -0.10 0.60 1.01 -0.61 -0.13 121.20 122.55 1a5n s ILE 191 Ca 0.48 -1.22 -0.05 0.00 0.00 0.00 0.00 60.65 59.86 1a5n s ILE 191 Cb -0.32 -1.08 0.05 0.00 0.01 0.00 0.00 42.46 41.12 1a5n s ILE 191 CO 0.38 -0.14 0.23 -0.83 0.00 0.00 0.00 174.94 174.59 1a5n s GLY 192 N -1.55 -0.12 0.18 6.18 0.00 -1.08 -0.79 107.32 110.14 1a5n s GLY 192 Ca -0.00 0.95 -0.01 0.00 0.00 0.00 0.00 44.72 45.66 1a5n s GLY 192 CO 0.02 1.28 0.37 1.08 0.00 0.00 0.00 173.10 175.85 1a5n s LEU 193 N 1.35 4.25 -0.02 0.66 1.43 -1.26 -2.60 118.68 122.48 1a5n s LEU 193 Ca -0.08 0.39 0.07 0.00 -1.03 0.00 0.00 54.13 53.48 1a5n s LEU 193 Cb -0.11 -3.15 -0.02 0.00 0.03 0.00 0.00 46.19 42.95 1a5n s LEU 193 CO -0.08 -0.01 -0.23 -0.76 0.23 0.00 0.00 176.35 175.49 1a5n s LEU 194 N -3.21 2.21 0.51 1.79 1.43 -0.26 -0.12 118.68 121.03 1a5n s LEU 194 Ca 0.38 -0.43 0.08 0.00 -1.03 0.00 0.00 54.13 53.13 1a5n s LEU 194 Cb -0.11 -1.38 0.04 0.00 0.03 0.00 0.00 46.19 44.76 1a5n s LEU 194 CO 0.28 0.32 0.56 -0.83 0.23 0.00 0.00 176.35 176.91 1a5n s GLY 195 N -0.73 2.04 -0.39 -3.19 0.00 -0.48 -1.59 107.32 102.98 1a5n s GLY 195 Ca 0.11 -1.77 -0.29 0.00 0.00 0.00 0.00 44.72 42.77 1a5n s GLY 195 CO -0.00 -1.74 1.18 1.25 0.00 0.00 0.00 173.10 173.79 1a5n s LYS 196 N -4.39 3.85 0.00 2.90 2.20 -1.25 -0.88 119.74 122.17 1a5n s LYS 196 Ca 0.50 0.89 0.19 0.00 -0.36 0.00 0.00 55.97 57.20 1a5n s LYS 196 Cb -0.05 -3.86 0.53 0.00 -1.51 0.00 0.00 37.83 32.94 1a5n s LYS 196 CO 0.31 -1.20 1.43 0.41 -0.36 0.00 0.00 175.35 175.94 1a5n n GLY 197 N 4.46 1.35 3.53 5.54 0.00 -0.79 -4.78 105.19 114.50 1a5n n GLY 197 Ca 0.13 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.12 1a5n n GLY 197 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a5n s ASN 198 N -1.24 6.92 -0.04 1.61 -0.87 -1.26 -4.53 114.94 115.53 1a5n s ASN 198 Ca 0.36 -2.64 -0.23 0.00 -1.57 0.00 0.00 52.86 48.79 1a5n s ASN 198 Cb 0.20 -2.50 0.05 0.00 -0.02 0.00 0.00 41.25 38.98 1a5n s ASN 198 CO 0.27 -1.00 0.49 -0.69 -2.57 0.00 0.00 177.10 173.60 1a5n s VAL 199 N 3.07 0.03 -0.33 1.60 1.01 -1.26 -4.98 120.40 119.53 1a5n s VAL 199 Ca 0.48 -0.24 0.15 0.00 0.00 0.00 0.00 61.98 62.38 1a5n s VAL 199 Cb 0.01 -0.80 0.67 0.00 0.00 0.00 0.00 36.38 36.25 1a5n s VAL 199 CO 0.03 -0.13 1.58 -1.20 0.00 0.00 0.00 175.10 175.38 1a5n n SER 200 N 1.14 4.73 -3.91 3.32 7.64 -1.26 -4.55 113.62 120.73 1a5n n SER 200 Ca -0.20 -2.88 -0.30 0.00 1.01 0.00 0.00 58.87 56.49 1a5n n SER 200 Cb 0.56 -0.60 -0.15 0.00 -1.01 0.00 0.00 64.21 63.02 1a5n n SER 200 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1a5n s GLN 201 N -2.63 1.40 0.27 1.43 2.00 -1.26 -5.03 119.66 115.85 1a5n s GLN 201 Ca 0.48 -1.20 0.00 0.00 -2.00 0.00 0.00 55.36 52.65 1a5n s GLN 201 Cb 0.36 -2.60 0.62 0.00 0.80 0.00 0.00 33.01 32.20 1a5n s GLN 201 CO 0.14 -0.75 1.69 -1.35 -0.50 0.00 0.00 175.29 174.52 1a5n h PRO 202 N 7.91 0.35 -0.51 1.67 0.11 -1.90 -1.67 132.00 137.96 1a5n h PRO 202 Ca -0.14 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 66.02 1a5n h PRO 202 Cb 1.05 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.05 1a5n h PRO 202 CO 0.45 0.23 0.34 -0.44 -0.21 0.00 0.00 178.00 178.37 1a5n h ASP 203 N 0.36 0.34 0.74 -2.05 3.32 -1.99 -0.84 116.42 116.30 1a5n h ASP 203 Ca 0.50 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.54 1a5n h ASP 203 Cb 0.92 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.40 1a5n h ASP 203 CO -0.52 0.22 -0.10 0.00 -1.72 0.00 0.00 179.24 177.11 1a5n h ALA 204 N 1.73 1.07 0.10 3.45 0.00 -1.74 -2.24 119.26 121.63 1a5n h ALA 204 Ca 0.23 -0.09 -0.32 0.00 0.00 0.00 0.00 54.91 54.73 1a5n h ALA 204 Cb 0.40 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1a5n h ALA 204 CO -0.06 0.13 -1.70 -0.07 0.00 0.00 0.00 179.25 177.55 1a5n h LEU 205 N 0.00 0.32 -1.49 0.00 3.38 -1.30 -3.34 115.31 112.88 1a5n h LEU 205 Ca -0.00 -0.83 0.10 0.00 0.09 0.00 0.00 57.88 57.24 1a5n h LEU 205 Cb 0.50 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 1a5n h LEU 205 CO 0.01 1.73 0.46 0.03 0.09 0.00 0.00 178.44 180.76 1a5n h ARG 206 N -0.26 0.56 -0.46 1.13 3.08 -1.08 -0.74 114.38 116.61 1a5n h ARG 206 Ca -0.38 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.62 1a5n h ARG 206 Cb 1.81 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.72 1a5n h ARG 206 CO 0.01 0.37 0.24 0.93 -1.07 0.00 0.00 179.97 180.45 1a5n h GLU 207 N 0.57 0.65 -0.49 0.04 5.08 -1.56 0.12 114.58 118.99 1a5n h GLU 207 Ca 0.32 -0.09 -0.08 0.00 -1.00 0.00 0.00 59.36 58.52 1a5n h GLU 207 Cb 0.49 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 1a5n h GLU 207 CO -0.11 0.53 0.01 1.96 -1.00 0.00 0.00 179.01 180.41 1a5n h GLN 208 N 0.60 0.86 -0.64 2.33 4.20 -1.31 0.20 115.11 121.36 1a5n h GLN 208 Ca 0.16 -0.27 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 1a5n h GLN 208 Cb 0.08 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1a5n h GLN 208 CO -0.02 0.89 0.15 0.28 -0.67 0.00 0.00 178.83 179.46 1a5n h VAL 209 N 0.72 1.26 0.00 -0.54 2.07 -1.06 -1.88 116.25 116.81 1a5n h VAL 209 Ca 0.14 -0.94 -0.05 0.00 0.82 0.00 0.00 66.70 66.67 1a5n h VAL 209 Cb 0.50 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1a5n h VAL 209 CO 0.02 0.35 -0.24 0.00 0.02 0.00 0.00 177.57 177.73 1a5n h ALA 210 N 1.05 1.07 0.00 1.67 0.00 -0.54 -2.38 119.26 120.14 1a5n h ALA 210 Ca 0.20 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1a5n h ALA 210 Cb 0.37 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1a5n h ALA 210 CO 0.00 0.30 -0.45 0.00 0.00 0.00 0.00 179.25 179.10 1a5n h ALA 211 N 1.76 0.88 0.00 0.00 0.00 0.16 -3.36 119.26 118.70 1a5n h ALA 211 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1a5n h ALA 211 Cb 0.69 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1a5n h ALA 211 CO 0.03 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1a5n n GLY 212 N 0.54 0.60 3.75 0.00 0.00 -0.84 -4.73 105.19 104.51 1a5n n GLY 212 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1a5n n GLY 212 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1a5n s VAL 213 N 0.00 2.47 -2.19 1.61 -7.23 -1.10 -3.72 120.40 110.24 1a5n s VAL 213 Ca 0.00 0.31 0.21 0.00 -1.81 0.00 0.00 61.98 60.69 1a5n s VAL 213 Cb 0.00 -3.14 0.37 0.00 0.56 0.00 0.00 36.38 34.18 1a5n s VAL 213 CO 0.00 -0.04 1.33 2.30 -0.31 0.00 0.00 175.10 178.37 1a5n n ILE 214 N -1.38 0.50 -3.72 -0.62 -5.35 0.83 -4.01 119.36 105.62 1a5n n ILE 214 Ca 0.12 -0.75 -0.01 0.00 -0.27 0.00 0.00 62.75 61.85 1a5n n ILE 214 Cb 0.48 0.97 -0.00 0.00 -1.74 0.00 0.00 39.64 39.34 1a5n n ILE 214 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1a5n s GLY 215 N -1.37 -0.27 -0.10 3.28 0.00 -1.22 -2.98 107.32 104.65 1a5n s GLY 215 Ca 0.34 0.33 0.01 0.00 0.00 0.00 0.00 44.72 45.40 1a5n s GLY 215 CO 0.28 0.63 -0.10 1.08 0.00 0.00 0.00 173.10 174.99 1a5n s LEU 216 N -3.06 1.40 -0.24 0.66 1.43 -0.40 -1.38 118.68 117.09 1a5n s LEU 216 Ca 0.15 -0.33 -0.14 0.00 -1.03 0.00 0.00 54.13 52.78 1a5n s LEU 216 Cb 0.01 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.30 1a5n s LEU 216 CO -0.00 -0.06 0.32 0.00 0.23 0.00 0.00 176.35 176.84 1a5n s ALA 217 N 1.34 3.57 -0.26 4.21 0.00 -0.06 -1.99 121.76 128.57 1a5n s ALA 217 Ca -0.01 -0.76 -0.14 0.00 0.00 0.00 0.00 51.96 51.04 1a5n s ALA 217 Cb -0.14 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 1a5n s ALA 217 CO -0.05 -0.43 0.34 0.42 0.00 0.00 0.00 175.76 176.03 1a5n s ILE 218 N 1.58 5.21 -0.02 0.00 1.09 0.42 -1.89 121.20 127.60 1a5n s ILE 218 Ca 0.14 0.51 0.05 0.00 -1.10 0.00 0.00 60.65 60.26 1a5n s ILE 218 Cb -0.15 -3.67 -0.01 0.00 -1.06 0.00 0.00 42.46 37.57 1a5n s ILE 218 CO 0.08 0.20 -0.18 -2.28 -0.10 0.00 0.00 174.94 172.66 1a5n s HIS 219 N 1.80 1.67 0.59 3.97 2.46 -1.26 -1.12 115.29 123.40 1a5n s HIS 219 Ca 0.14 -0.35 0.29 0.00 0.47 0.00 0.00 55.06 55.61 1a5n s HIS 219 Cb -0.15 -1.09 1.77 0.00 -0.13 0.00 0.00 32.58 32.98 1a5n s HIS 219 CO 0.09 -0.06 2.21 1.05 -2.47 0.00 0.00 174.74 175.57 1a5n h GLU 220 N 5.79 0.00 0.00 2.88 4.11 -1.66 -1.73 114.58 123.97 1a5n h GLU 220 Ca -0.37 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.06 1a5n h GLU 220 Cb 1.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 1a5n h GLU 220 CO 0.48 0.00 -0.02 -0.44 0.07 0.00 0.00 179.01 179.10 1a5n h ASP 221 N 0.00 0.00 -0.19 3.06 5.19 -1.93 -1.34 116.42 121.22 1a5n h ASP 221 Ca 0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1a5n h ASP 221 Cb 0.14 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.65 1a5n h ASP 221 CO -0.00 0.02 0.00 0.79 -3.12 0.00 0.00 179.24 176.93 1a5n n TRP 222 N -3.13 0.23 -0.15 4.55 7.02 -0.67 -5.02 117.44 120.27 1a5n n TRP 222 Ca 0.00 -0.16 0.00 0.00 -1.02 0.00 0.00 57.50 56.32 1a5n n TRP 222 Cb 0.29 -0.01 0.00 0.00 -2.42 0.00 0.00 31.31 29.18 1a5n n TRP 222 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1a5n n GLY 223 N 0.96 -0.05 2.78 6.99 0.00 -0.50 -4.90 105.19 110.48 1a5n n GLY 223 Ca 0.12 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 1a5n n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5n n ALA 224 N -0.02 5.68 -2.55 4.61 0.00 -1.23 -4.83 120.51 122.16 1a5n n ALA 224 Ca 0.00 -4.28 -0.27 0.00 0.00 0.00 0.00 53.44 48.89 1a5n n ALA 224 Cb 0.00 -2.92 -0.02 0.00 0.00 0.00 0.00 19.45 16.50 1a5n n ALA 224 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1a5n s THR 225 N -0.01 5.05 0.40 0.00 -4.23 -1.26 -4.35 115.64 111.24 1a5n s THR 225 Ca 0.42 -0.11 0.12 0.00 -1.18 0.00 0.00 61.69 60.94 1a5n s THR 225 Cb 0.11 -3.79 0.33 0.00 1.34 0.00 0.00 72.50 70.50 1a5n s THR 225 CO -0.01 -0.44 1.92 -0.65 -0.54 0.00 0.00 174.62 174.90 1a5n h PRO 226 N 1.28 0.51 -0.32 3.99 0.11 -1.93 0.34 132.00 135.97 1a5n h PRO 226 Ca -0.48 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1a5n h PRO 226 Cb 1.20 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1a5n h PRO 226 CO 0.64 0.34 0.06 0.00 -0.21 0.00 0.00 178.00 178.83 1a5n h ALA 227 N 1.64 0.42 0.05 -0.75 0.00 -1.97 -1.19 119.26 117.46 1a5n h ALA 227 Ca 0.36 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1a5n h ALA 227 Cb 0.69 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1a5n h ALA 227 CO -0.13 0.11 -0.03 0.00 0.00 0.00 0.00 179.25 179.21 1a5n h ALA 228 N 0.89 -0.07 -0.09 0.00 0.00 -1.46 -1.96 119.26 116.57 1a5n h ALA 228 Ca 0.10 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1a5n h ALA 228 Cb 0.33 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1a5n h ALA 228 CO 0.00 -0.45 -0.16 0.82 0.00 0.00 0.00 179.25 179.47 1a5n h ILE 229 N -0.25 0.60 -0.92 0.00 2.04 -0.96 -1.17 117.51 116.85 1a5n h ILE 229 Ca -0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1a5n h ILE 229 Cb 0.22 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 36.85 1a5n h ILE 229 CO 0.01 0.00 0.60 -0.78 0.00 0.00 0.00 178.15 177.99 1a5n h ASP 230 N -0.22 1.00 -0.29 1.72 3.58 -1.22 -1.65 116.42 119.35 1a5n h ASP 230 Ca 0.08 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.49 1a5n h ASP 230 Cb 0.33 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.13 1a5n h ASP 230 CO -0.21 0.69 0.09 0.00 -2.88 0.00 0.00 179.24 176.93 1a5n h ALA 232 N 0.93 0.70 -0.32 0.00 0.00 -0.99 -2.67 119.26 116.91 1a5n h ALA 232 Ca 0.09 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1a5n h ALA 232 Cb 0.24 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1a5n h ALA 232 CO -0.00 0.26 -0.01 -0.07 0.00 0.00 0.00 179.25 179.42 1a5n h LEU 233 N 0.73 0.47 -0.12 0.00 3.38 -1.19 -0.20 115.31 118.38 1a5n h LEU 233 Ca 0.19 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1a5n h LEU 233 Cb 0.12 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1a5n h LEU 233 CO -0.02 0.55 0.04 0.74 0.09 0.00 0.00 178.44 179.84 1a5n h THR 234 N 0.48 1.18 -0.43 0.22 2.02 -0.98 -1.10 112.91 114.30 1a5n h THR 234 Ca 0.10 -0.54 -0.10 0.00 0.77 0.00 0.00 66.41 66.64 1a5n h THR 234 Cb 0.34 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 1a5n h THR 234 CO 0.01 0.16 -0.14 0.58 0.37 0.00 0.00 175.52 176.50 1a5n h VAL 235 N 0.01 1.26 -0.63 3.16 2.07 -1.29 -2.72 116.25 118.11 1a5n h VAL 235 Ca 0.04 -1.22 0.01 0.00 0.82 0.00 0.00 66.70 66.35 1a5n h VAL 235 Cb 0.22 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1a5n h VAL 235 CO -0.00 0.42 0.41 0.00 0.02 0.00 0.00 177.57 178.41 1a5n h ALA 236 N 1.13 0.81 -0.25 1.67 0.00 -0.88 0.27 119.26 122.02 1a5n h ALA 236 Ca 0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1a5n h ALA 236 Cb 0.64 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1a5n h ALA 236 CO 0.04 0.20 0.08 -0.44 0.00 0.00 0.00 179.25 179.13 1a5n h ASP 237 N 0.83 0.31 0.64 0.00 3.32 -0.90 -0.76 116.42 119.85 1a5n h ASP 237 Ca 0.24 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1a5n h ASP 237 Cb -0.06 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.41 1a5n h ASP 237 CO -0.07 0.31 -0.96 -1.84 -1.72 0.00 0.00 179.24 174.96 1a5n n GLU 238 N -4.41 0.37 -0.05 3.56 0.28 -0.75 -4.27 120.64 115.37 1a5n n GLU 238 Ca 0.01 0.04 0.04 0.00 -0.16 0.00 0.00 57.16 57.08 1a5n n GLU 238 Cb 0.14 -1.66 0.06 0.00 1.43 0.00 0.00 31.44 31.41 1a5n n GLU 238 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 1a5n n MET 239 N -2.15 1.11 -3.55 3.44 2.81 0.01 -5.02 117.12 113.77 1a5n n MET 239 Ca 0.02 -1.30 -0.22 0.00 -1.81 0.00 0.00 57.70 54.38 1a5n n MET 239 Cb 0.47 -1.17 0.05 0.00 -0.71 0.00 0.00 33.22 31.86 1a5n n MET 239 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1a5n n ASP 240 N 0.36 -3.84 -4.33 7.83 2.03 -0.32 -4.65 116.55 113.64 1a5n n ASP 240 Ca 0.06 -0.83 -0.17 0.00 0.52 0.00 0.00 54.79 54.37 1a5n n ASP 240 Cb 0.26 -4.28 -0.10 0.00 -0.72 0.00 0.00 41.12 36.28 1a5n n ASP 240 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1a5n s ILE 241 N -3.51 1.40 0.20 5.18 -5.25 -1.18 -4.59 121.20 113.44 1a5n s ILE 241 Ca 0.25 -2.11 -0.02 0.00 -0.99 0.00 0.00 60.65 57.78 1a5n s ILE 241 Cb -0.06 -2.11 -0.05 0.00 2.95 0.00 0.00 42.46 43.19 1a5n s ILE 241 CO 0.80 -0.54 0.41 -1.58 -1.79 0.00 0.00 174.94 172.24 1a5n s GLN 242 N -3.74 3.56 -0.10 0.37 2.00 -1.16 -4.67 119.66 115.93 1a5n s GLN 242 Ca 0.23 -0.22 0.03 0.00 -2.00 0.00 0.00 55.36 53.39 1a5n s GLN 242 Cb 0.02 -2.81 -0.01 0.00 0.80 0.00 0.00 33.01 31.01 1a5n s GLN 242 CO 0.06 0.39 -0.18 0.08 -0.50 0.00 0.00 175.29 175.14 1a5n s VAL 243 N -1.84 2.65 -0.12 1.34 1.01 -1.26 -1.28 120.40 120.90 1a5n s VAL 243 Ca 0.40 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1a5n s VAL 243 Cb -0.11 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 1a5n s VAL 243 CO 0.28 0.55 -0.14 0.00 0.00 0.00 0.00 175.10 175.79 1a5n s ALA 244 N 0.06 2.59 -0.04 5.51 0.00 -0.84 -1.21 121.76 127.82 1a5n s ALA 244 Ca -0.07 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.04 1a5n s ALA 244 Cb -0.15 -1.17 -0.02 0.00 0.00 0.00 0.00 23.12 21.77 1a5n s ALA 244 CO 0.05 0.26 -0.17 -1.17 0.00 0.00 0.00 175.76 174.74 1a5n s LEU 245 N 0.31 2.58 -0.37 0.00 2.96 0.18 -0.44 118.68 123.90 1a5n s LEU 245 Ca -0.11 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.55 1a5n s LEU 245 Cb -0.16 -1.51 0.12 0.00 0.50 0.00 0.00 46.19 45.14 1a5n s LEU 245 CO 0.06 0.34 0.17 -2.28 -1.32 0.00 0.00 176.35 173.32 1a5n s HIS 246 N -0.71 1.79 1.27 5.38 5.65 -0.27 -0.82 115.29 127.58 1a5n s HIS 246 Ca 0.11 -2.07 -0.19 0.00 0.25 0.00 0.00 55.06 53.17 1a5n s HIS 246 Cb -0.10 -1.75 0.31 0.00 -1.18 0.00 0.00 32.58 29.85 1a5n s HIS 246 CO 0.00 -0.83 1.02 -1.54 -0.65 0.00 0.00 174.74 172.73 1a5n s SER 247 N 0.99 0.24 -0.86 9.88 1.04 -1.26 -2.23 113.70 121.49 1a5n s SER 247 Ca 0.14 0.95 -0.25 0.00 0.48 0.00 0.00 55.95 57.27 1a5n s SER 247 Cb -0.21 -1.40 -0.02 0.00 0.10 0.00 0.00 66.02 64.49 1a5n s SER 247 CO -0.11 -4.58 1.82 -0.62 0.98 0.00 0.00 173.24 170.73 1a5n s ASP 248 N -3.26 5.43 0.28 7.02 -1.08 -1.26 -3.88 116.67 119.92 1a5n s ASP 248 Ca 0.69 -0.62 -0.03 0.00 -0.52 0.00 0.00 52.55 52.07 1a5n s ASP 248 Cb -0.15 -2.56 0.39 0.00 -1.46 0.00 0.00 42.92 39.14 1a5n s ASP 248 CO 0.59 -2.44 1.91 0.74 0.52 0.00 0.00 175.17 176.48 1a5n h THR 249 N 7.07 1.22 0.00 1.71 2.02 -1.92 -2.48 112.91 120.53 1a5n h THR 249 Ca 0.04 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.66 1a5n h THR 249 Cb 1.03 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 1a5n h THR 249 CO 1.25 0.25 0.00 0.18 0.37 0.00 0.00 175.52 177.57 1a5n n LEU 250 N -4.36 0.46 -1.82 2.58 4.77 -1.26 -3.00 117.00 114.36 1a5n n LEU 250 Ca 0.08 0.62 -0.19 0.00 -0.03 0.00 0.00 56.01 56.49 1a5n n LEU 250 Cb 0.10 -0.58 -0.04 0.00 -2.33 0.00 0.00 43.42 40.57 1a5n n LEU 250 CO 0.38 -0.52 -0.21 0.59 -1.33 0.00 0.00 177.39 176.30 1a5n n ASN 251 N -2.02 -5.36 -0.14 -1.43 3.02 -0.93 -4.91 115.26 103.50 1a5n n ASN 251 Ca 0.02 0.20 -0.08 0.00 -0.03 0.00 0.00 54.58 54.69 1a5n n ASN 251 Cb 0.18 -4.45 0.01 0.00 -0.61 0.00 0.00 39.78 34.91 1a5n n ASN 251 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1a5n h GLU 252 N 0.00 0.55 0.00 3.52 4.81 -1.89 -3.04 114.58 118.54 1a5n h GLU 252 Ca -0.42 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1a5n h GLU 252 Cb 1.28 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1a5n h GLU 252 CO 0.54 0.37 -0.84 -1.13 -0.73 0.00 0.00 179.01 177.22 1a5n n SER 253 N -4.80 0.68 0.00 1.04 3.41 -1.26 -5.05 113.62 107.64 1a5n n SER 253 Ca 0.01 -0.44 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 1a5n n SER 253 Cb 0.02 0.67 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 1a5n n SER 253 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a5n n GLY 254 N 1.45 -0.51 1.05 5.00 0.00 -1.15 -4.95 105.19 106.09 1a5n n GLY 254 Ca 0.04 -1.43 -0.06 0.00 0.00 0.00 0.00 46.02 44.57 1a5n n GLY 254 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1a5n n PHE 255 N -1.17 -3.29 -0.19 1.61 3.72 -1.26 -4.30 117.46 112.57 1a5n n PHE 255 Ca 0.00 -0.47 0.02 0.00 -0.05 0.00 0.00 57.45 56.95 1a5n n PHE 255 Cb 0.00 -0.20 0.28 0.00 -0.94 0.00 0.00 39.48 38.62 1a5n n PHE 255 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 1a5n h VAL 256 N -0.47 1.14 -0.01 -4.37 3.04 -1.93 -1.96 116.25 111.69 1a5n h VAL 256 Ca -0.09 -0.32 -0.03 0.00 -1.01 0.00 0.00 66.70 65.25 1a5n h VAL 256 Cb 0.33 0.14 -0.00 0.00 -2.01 0.00 0.00 31.29 29.75 1a5n h VAL 256 CO 0.10 0.17 -0.13 1.05 -1.01 0.00 0.00 177.57 177.74 1a5n h GLU 257 N 0.92 0.02 -0.07 4.17 9.09 -1.96 -0.01 114.58 126.75 1a5n h GLU 257 Ca 0.28 -0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.48 1a5n h GLU 257 Cb -0.02 -0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.09 1a5n h GLU 257 CO -0.07 0.15 -0.74 -0.44 0.05 0.00 0.00 179.01 177.96 1a5n h ASP 258 N 0.02 0.76 -0.05 3.06 3.32 -1.72 -0.91 116.42 120.90 1a5n h ASP 258 Ca 0.00 -0.69 0.01 0.00 0.02 0.00 0.00 57.03 56.37 1a5n h ASP 258 Cb 0.25 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1a5n h ASP 258 CO 0.02 1.34 -0.00 0.74 -1.72 0.00 0.00 179.24 179.61 1a5n h THR 259 N 0.25 0.96 -0.96 0.35 2.02 -1.12 0.46 112.91 114.88 1a5n h THR 259 Ca -0.07 -0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.18 1a5n h THR 259 Cb 1.40 0.95 -0.07 0.00 -1.74 0.00 0.00 68.15 68.69 1a5n h THR 259 CO 0.15 0.00 0.62 -0.07 0.37 0.00 0.00 175.52 176.59 1a5n h LEU 260 N 0.01 0.94 -0.73 2.58 3.38 -1.00 -0.29 115.31 120.20 1a5n h LEU 260 Ca 0.02 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1a5n h LEU 260 Cb 0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1a5n h LEU 260 CO -0.04 0.58 0.15 0.00 0.09 0.00 0.00 178.44 179.22 1a5n h ALA 261 N 1.50 0.95 -0.44 1.53 0.00 -0.35 -2.21 119.26 120.25 1a5n h ALA 261 Ca 0.43 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 1a5n h ALA 261 Cb 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1a5n h ALA 261 CO -0.18 0.67 -0.26 0.00 0.00 0.00 0.00 179.25 179.48 1a5n h ALA 262 N 1.10 0.70 -0.60 0.00 0.00 0.60 -2.49 119.26 118.56 1a5n h ALA 262 Ca 0.22 -0.40 0.07 0.00 0.00 0.00 0.00 54.91 54.79 1a5n h ALA 262 Cb 0.39 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1a5n h ALA 262 CO 0.01 0.67 0.40 0.82 0.00 0.00 0.00 179.25 181.14 1a5n h ILE 263 N 0.80 0.98 -6.28 0.00 2.04 -0.79 -3.42 117.51 110.85 1a5n h ILE 263 Ca 0.10 -0.19 -0.46 0.00 1.00 0.00 0.00 64.86 65.31 1a5n h ILE 263 Cb 0.83 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1a5n h ILE 263 CO 0.07 0.10 -0.84 0.61 0.00 0.00 0.00 178.15 178.09 1a5n n GLY 264 N -1.48 -0.30 2.61 5.37 0.00 -0.86 -2.32 105.19 108.20 1a5n n GLY 264 Ca 0.09 0.14 -0.03 0.00 0.00 0.00 0.00 46.02 46.22 1a5n n GLY 264 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a5n n GLY 265 N -1.72 0.42 3.86 -0.02 0.00 -1.26 -5.00 105.19 101.47 1a5n n GLY 265 Ca -0.24 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 1a5n n GLY 265 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a5n s ARG 266 N -1.67 3.91 0.24 1.61 0.52 -0.98 -4.79 118.95 117.79 1a5n s ARG 266 Ca 0.00 0.42 -0.31 0.00 -0.52 0.00 0.00 55.73 55.32 1a5n s ARG 266 Cb 0.00 -2.79 -0.13 0.00 0.52 0.00 0.00 34.95 32.55 1a5n s ARG 266 CO 0.00 0.40 1.52 2.41 0.02 0.00 0.00 175.30 179.65 1a5n n THR 267 N 0.37 0.75 -3.59 0.02 -1.04 -1.26 -4.78 114.28 104.76 1a5n n THR 267 Ca -0.03 -0.19 -0.16 0.00 -2.04 0.00 0.00 64.05 61.64 1a5n n THR 267 Cb 0.52 -1.69 -0.07 0.00 -1.82 0.00 0.00 70.33 67.27 1a5n n THR 267 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1a5n s ILE 268 N 0.21 0.00 -0.32 12.58 2.07 -0.81 -4.73 121.20 130.20 1a5n s ILE 268 Ca 0.69 -0.01 -0.12 0.00 -1.41 0.00 0.00 60.65 59.80 1a5n s ILE 268 Cb -0.59 -0.97 -0.03 0.00 0.13 0.00 0.00 42.46 41.00 1a5n s ILE 268 CO 0.46 -0.01 0.21 -2.28 -1.91 0.00 0.00 174.94 171.41 1a5n s HIS 269 N -0.41 3.22 -0.28 3.50 5.65 -0.35 -1.08 115.29 125.54 1a5n s HIS 269 Ca -0.06 -0.15 -0.19 0.00 0.25 0.00 0.00 55.06 54.91 1a5n s HIS 269 Cb -0.03 -2.43 -0.02 0.00 -1.18 0.00 0.00 32.58 28.93 1a5n s HIS 269 CO 0.05 -0.31 0.59 0.95 -0.65 0.00 0.00 174.74 175.37 1a5n s THR 270 N 1.72 5.00 0.42 0.89 -4.23 -0.54 -0.65 115.64 118.25 1a5n s THR 270 Ca 0.06 0.94 -0.24 0.00 -1.18 0.00 0.00 61.69 61.27 1a5n s THR 270 Cb -0.17 -3.92 -0.08 0.00 1.34 0.00 0.00 72.50 69.66 1a5n s THR 270 CO 0.10 -0.02 1.10 -0.36 -0.54 0.00 0.00 174.62 174.90 1a5n s PHE 271 N 2.48 3.11 -0.44 3.99 0.08 -0.00 -2.56 117.98 124.64 1a5n s PHE 271 Ca 0.24 1.60 -0.10 0.00 0.12 0.00 0.00 56.93 58.79 1a5n s PHE 271 Cb -0.15 -3.24 0.01 0.00 -0.57 0.00 0.00 43.02 39.08 1a5n s PHE 271 CO 0.10 -0.99 0.26 -2.39 -0.10 0.00 0.00 175.22 172.10 1a5n n HIS 272 N -0.21 -0.62 0.24 0.36 1.44 -1.10 -4.75 115.22 110.58 1a5n n HIS 272 Ca 0.06 0.11 0.11 0.00 -2.01 0.00 0.00 57.72 55.99 1a5n n HIS 272 Cb 0.49 -1.10 0.59 0.00 0.12 0.00 0.00 29.99 30.08 1a5n n HIS 272 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 1a5n h THR 273 N 0.70 0.00 -0.04 0.61 2.02 -1.32 -1.37 112.91 113.52 1a5n h THR 273 Ca -0.28 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 66.76 1a5n h THR 273 Cb 0.56 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1a5n h THR 273 CO 0.19 0.00 -0.63 -0.08 0.37 0.00 0.00 175.52 175.37 1a5n h GLU 274 N 0.00 0.14 0.00 6.66 4.22 -1.85 -2.50 114.58 121.25 1a5n h GLU 274 Ca 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 59.36 59.34 1a5n h GLU 274 Cb 0.56 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1a5n h GLU 274 CO 0.00 0.73 0.00 0.41 -2.18 0.00 0.00 179.01 177.97 1a5n n GLY 275 N 0.31 1.68 0.36 1.92 0.00 -0.52 -4.50 105.19 104.43 1a5n n GLY 275 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 1a5n n GLY 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5n h ALA 276 N 0.00 1.98 -0.00 4.61 0.00 -1.82 0.16 119.26 124.19 1a5n h ALA 276 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1a5n h ALA 276 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1a5n h ALA 276 CO 0.00 -0.12 -0.13 0.41 0.00 0.00 0.00 179.25 179.41 1a5n n GLY 277 N -1.51 -0.89 0.00 0.00 0.00 -1.26 -4.86 105.19 96.68 1a5n n GLY 277 Ca 0.11 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1a5n n GLY 277 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a5n n GLY 278 N 1.28 4.49 0.00 -0.02 0.00 0.57 -5.02 105.19 106.49 1a5n n GLY 278 Ca 0.14 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.96 1a5n n GLY 278 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a5n n GLY 279 N -1.52 4.36 3.73 -0.02 0.00 -1.25 -4.38 105.19 106.11 1a5n n GLY 279 Ca 0.00 -1.48 -0.67 0.00 0.00 0.00 0.00 46.02 43.87 1a5n n GLY 279 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1a5n n HIS 280 N -1.89 1.75 -3.05 1.61 8.25 -1.24 -4.05 115.22 116.60 1a5n n HIS 280 Ca 0.00 1.10 -0.40 0.00 -0.26 0.00 0.00 57.72 58.16 1a5n n HIS 280 Cb 0.00 -2.24 -0.05 0.00 1.12 0.00 0.00 29.99 28.82 1a5n n HIS 280 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a5n s ALA 281 N 3.17 3.36 -0.64 -1.41 0.00 -1.16 -1.81 121.76 123.26 1a5n s ALA 281 Ca 1.05 0.10 0.09 0.00 0.00 0.00 0.00 51.96 53.21 1a5n s ALA 281 Cb -1.48 -2.96 0.25 0.00 0.00 0.00 0.00 23.12 18.94 1a5n s ALA 281 CO 0.80 -0.14 1.21 -0.35 0.00 0.00 0.00 175.76 177.28 1a5n n PRO 282 N 3.90 2.87 -0.90 0.00 -0.04 -1.26 -4.95 135.00 134.62 1a5n n PRO 282 Ca -0.01 -2.00 -0.08 0.00 -0.04 0.00 0.00 63.50 61.37 1a5n n PRO 282 Cb 0.51 -1.26 0.21 0.00 -0.04 0.00 0.00 33.50 32.92 1a5n n PRO 282 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1a5n n ASP 283 N 0.17 3.12 0.29 3.54 5.68 -1.10 -4.57 116.55 123.67 1a5n n ASP 283 Ca 0.10 -3.62 0.15 0.00 -0.50 0.00 0.00 54.79 50.92 1a5n n ASP 283 Cb 0.43 -0.69 0.86 0.00 -1.14 0.00 0.00 41.12 40.58 1a5n n ASP 283 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 1a5n h ILE 284 N 1.21 0.49 -0.16 2.12 6.09 -1.63 -2.16 117.51 123.48 1a5n h ILE 284 Ca 0.31 -0.22 0.05 0.00 -1.37 0.00 0.00 64.86 63.62 1a5n h ILE 284 Cb 2.00 1.14 -0.01 0.00 0.47 0.00 0.00 36.82 40.43 1a5n h ILE 284 CO 0.58 0.05 0.17 -0.29 -3.07 0.00 0.00 178.15 175.59 1a5n h ILE 285 N 0.00 0.52 0.00 2.19 2.10 -1.67 -1.70 117.51 118.94 1a5n h ILE 285 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1a5n h ILE 285 Cb 0.14 0.87 0.00 0.00 -1.09 0.00 0.00 36.82 36.74 1a5n h ILE 285 CO 0.01 0.00 0.00 0.71 -1.08 0.00 0.00 178.15 177.79 1a5n h THR 286 N 0.00 0.00 -0.14 2.19 1.35 -1.67 -2.76 112.91 111.87 1a5n h THR 286 Ca 0.08 -0.12 0.04 0.00 -0.55 0.00 0.00 66.41 65.86 1a5n h THR 286 Cb 0.41 0.84 -0.01 0.00 -1.73 0.00 0.00 68.15 67.66 1a5n h THR 286 CO -0.00 0.00 0.12 0.00 -0.25 0.00 0.00 175.52 175.39 1a5n h ALA 287 N 2.06 1.91 0.00 6.62 0.00 -1.52 -2.42 119.26 125.91 1a5n h ALA 287 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1a5n h ALA 287 Cb 0.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1a5n h ALA 287 CO 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.05 1a5n n ALA 289 N -1.14 3.22 -2.33 0.00 0.00 -0.91 -4.36 120.51 114.99 1a5n n ALA 289 Ca 0.04 -0.31 -0.36 0.00 0.00 0.00 0.00 53.44 52.81 1a5n n ALA 289 Cb 0.04 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.31 1a5n n ALA 289 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1a5n s HIS 290 N -3.11 3.65 0.26 0.00 3.76 -0.80 -4.67 115.29 114.38 1a5n s HIS 290 Ca 0.08 1.12 0.21 0.00 -0.15 0.00 0.00 55.06 56.32 1a5n s HIS 290 Cb 0.15 -2.41 0.94 0.00 1.11 0.00 0.00 32.58 32.38 1a5n s HIS 290 CO 0.72 0.46 1.86 -1.00 -0.85 0.00 0.00 174.74 175.93 1a5n h PRO 291 N 3.78 0.00 -0.01 8.40 0.13 -1.91 -3.11 132.00 139.28 1a5n h PRO 291 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1a5n h PRO 291 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1a5n h PRO 291 CO 0.65 0.28 -0.31 0.27 -0.23 0.00 0.00 178.00 178.65 1a5n n ASN 292 N -3.63 1.08 -4.69 1.44 6.94 -1.26 -0.56 115.26 114.58 1a5n n ASN 292 Ca -0.01 -0.89 -0.38 0.00 -0.02 0.00 0.00 54.58 53.28 1a5n n ASN 292 Cb 0.40 0.20 -0.07 0.00 -2.36 0.00 0.00 39.78 37.95 1a5n n ASN 292 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1a5n s ILE 293 N -2.55 5.21 -0.44 1.53 -1.09 -1.18 -1.92 121.20 120.76 1a5n s ILE 293 Ca 0.22 0.72 -0.06 0.00 -2.23 0.00 0.00 60.65 59.30 1a5n s ILE 293 Cb 0.19 -3.73 0.11 0.00 -1.58 0.00 0.00 42.46 37.45 1a5n s ILE 293 CO 0.55 0.28 0.27 -0.76 -1.23 0.00 0.00 174.94 174.05 1a5n s LEU 294 N 1.10 5.44 0.03 2.97 1.43 -0.25 -4.34 118.68 125.06 1a5n s LEU 294 Ca 0.20 -1.92 -0.19 0.00 -1.03 0.00 0.00 54.13 51.19 1a5n s LEU 294 Cb -0.14 -1.93 -0.06 0.00 0.03 0.00 0.00 46.19 44.09 1a5n s LEU 294 CO 0.08 -0.61 0.55 -2.16 0.23 0.00 0.00 176.35 174.44 1a5n s PRO 295 N 1.27 4.22 0.16 1.29 0.04 -1.26 -1.46 135.00 139.26 1a5n s PRO 295 Ca 0.06 0.68 0.04 0.00 0.04 0.00 0.00 61.00 61.82 1a5n s PRO 295 Cb -0.24 -3.28 -0.05 0.00 0.04 0.00 0.00 34.50 30.97 1a5n s PRO 295 CO -0.02 0.53 -0.06 -1.54 0.04 0.00 0.00 177.00 175.95 1a5n s SER 296 N -0.71 1.63 0.16 6.66 1.04 -1.06 -1.65 113.70 119.77 1a5n s SER 296 Ca 0.29 -1.07 0.10 0.00 0.48 0.00 0.00 55.95 55.75 1a5n s SER 296 Cb -0.19 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 65.92 1a5n s SER 296 CO 0.17 -0.42 -0.21 -0.44 0.98 0.00 0.00 173.24 173.32 1a5n s SER 297 N -3.18 3.64 0.31 7.02 0.01 -0.61 -1.20 113.70 119.69 1a5n s SER 297 Ca 0.19 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 56.73 1a5n s SER 297 Cb 0.04 -0.39 -0.04 0.00 0.21 0.00 0.00 66.02 65.85 1a5n s SER 297 CO 0.02 0.14 0.50 0.42 0.41 0.00 0.00 173.24 174.73 1a5n s THR 298 N -1.44 5.13 -0.46 1.44 -4.23 -1.26 -0.44 115.64 114.39 1a5n s THR 298 Ca 0.19 -0.47 0.25 0.00 -1.18 0.00 0.00 61.69 60.48 1a5n s THR 298 Cb -0.09 -3.83 0.33 0.00 1.34 0.00 0.00 72.50 70.25 1a5n s THR 298 CO 0.10 -0.46 1.68 -0.55 -0.54 0.00 0.00 174.62 174.85 1a5n h ASN 299 N 1.06 0.00 0.25 3.99 7.08 -1.11 -3.35 115.58 123.50 1a5n h ASN 299 Ca -0.50 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.72 1a5n h ASN 299 Cb 1.21 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.45 1a5n h ASN 299 CO 0.63 0.00 0.00 1.55 -2.08 0.00 0.00 177.43 177.53 1a5n h PRO 300 N 0.00 0.00 -0.41 4.14 0.13 -1.81 -1.50 132.00 132.54 1a5n h PRO 300 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1a5n h PRO 300 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1a5n h PRO 300 CO 0.00 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.02 1a5n n THR 301 N -2.83 0.54 -3.95 1.56 -2.24 -1.26 -4.86 114.28 101.23 1a5n n THR 301 Ca -0.02 -0.73 -0.35 0.00 -2.27 0.00 0.00 64.05 60.69 1a5n n THR 301 Cb 0.12 0.82 -0.14 0.00 -2.10 0.00 0.00 70.33 69.03 1a5n n THR 301 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1a5n s LEU 302 N -1.41 3.16 0.50 3.22 1.43 -0.57 -3.59 118.68 121.43 1a5n s LEU 302 Ca 0.39 -0.82 0.09 0.00 -1.03 0.00 0.00 54.13 52.76 1a5n s LEU 302 Cb 0.22 -1.67 0.05 0.00 0.03 0.00 0.00 46.19 44.82 1a5n s LEU 302 CO 0.31 -0.12 0.69 -2.16 0.23 0.00 0.00 176.35 175.30 1a5n s PRO 303 N 1.34 2.54 -0.06 1.29 0.04 -1.26 -4.81 135.00 134.08 1a5n s PRO 303 Ca 0.01 -1.45 -0.30 0.00 0.04 0.00 0.00 61.00 59.30 1a5n s PRO 303 Cb -0.16 -2.70 -0.06 0.00 0.04 0.00 0.00 34.50 31.62 1a5n s PRO 303 CO -0.04 -0.59 1.78 -0.47 0.04 0.00 0.00 177.00 177.72 1a5n s TYR 304 N -2.53 1.73 0.37 0.56 5.04 -1.24 -4.95 117.35 116.34 1a5n s TYR 304 Ca 0.59 0.06 0.03 0.00 -2.44 0.00 0.00 57.07 55.31 1a5n s TYR 304 Cb -0.08 -4.03 -0.01 0.00 0.35 0.00 0.00 41.96 38.20 1a5n s TYR 304 CO 0.36 -4.28 0.12 0.25 -1.34 0.00 0.00 175.55 170.66 1a5n n THR 305 N 5.77 0.00 -0.08 4.34 -2.24 -1.26 -1.34 114.28 119.47 1a5n n THR 305 Ca 0.19 -2.12 -0.01 0.00 -2.27 0.00 0.00 64.05 59.83 1a5n n THR 305 Cb 0.43 0.73 0.24 0.00 -2.10 0.00 0.00 70.33 69.62 1a5n n THR 305 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1a5n h LEU 306 N 0.00 0.67 -0.29 3.22 3.38 -1.37 -3.20 115.31 117.72 1a5n h LEU 306 Ca -0.29 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1a5n h LEU 306 Cb 1.09 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1a5n h LEU 306 CO 0.47 0.67 -0.54 0.59 0.09 0.00 0.00 178.44 179.71 1a5n n ASN 307 N -4.29 0.99 -0.18 -0.43 3.02 -1.26 -4.59 115.26 108.53 1a5n n ASN 307 Ca 0.03 -0.79 -0.08 0.00 -0.03 0.00 0.00 54.58 53.71 1a5n n ASN 307 Cb 0.22 0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 39.78 1a5n n ASN 307 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1a5n h THR 308 N 0.70 0.12 0.18 3.41 2.02 -1.94 -1.89 112.91 115.52 1a5n h THR 308 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1a5n h THR 308 Cb 0.54 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1a5n h THR 308 CO 0.00 0.00 -0.09 0.40 0.37 0.00 0.00 175.52 176.20 1a5n h ILE 309 N -0.24 0.87 -0.68 3.11 1.08 -1.82 -2.11 117.51 117.73 1a5n h ILE 309 Ca 0.18 -0.26 0.11 0.00 -0.39 0.00 0.00 64.86 64.51 1a5n h ILE 309 Cb 0.56 1.03 -0.08 0.00 -3.07 0.00 0.00 36.82 35.26 1a5n h ILE 309 CO -0.65 0.06 0.26 0.44 -0.69 0.00 0.00 178.15 177.57 1a5n h ASP 310 N -0.37 0.25 -0.44 1.72 5.19 -1.81 -2.41 116.42 118.53 1a5n h ASP 310 Ca -0.03 0.09 -0.03 0.00 -0.62 0.00 0.00 57.03 56.44 1a5n h ASP 310 Cb 0.29 0.07 -0.02 0.00 0.18 0.00 0.00 39.33 39.85 1a5n h ASP 310 CO 0.04 0.12 0.15 -0.08 -3.12 0.00 0.00 179.24 176.35 1a5n h GLU 311 N 0.43 0.68 0.00 3.56 4.81 -1.27 -3.29 114.58 119.50 1a5n h GLU 311 Ca 0.36 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 1a5n h GLU 311 Cb 0.49 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1a5n h GLU 311 CO -0.35 0.65 -0.10 0.45 -0.73 0.00 0.00 179.01 178.93 1a5n h HIS 312 N 0.58 0.00 -0.84 0.92 3.86 -0.85 -3.23 115.15 115.58 1a5n h HIS 312 Ca 0.14 0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.44 1a5n h HIS 312 Cb 0.25 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.66 1a5n h HIS 312 CO 0.01 0.10 0.55 -0.07 0.86 0.00 0.00 177.93 179.38 1a5n h LEU 313 N 0.00 0.77 0.06 2.43 3.38 -1.62 -3.07 115.31 117.27 1a5n h LEU 313 Ca -0.00 0.01 -0.34 0.00 0.09 0.00 0.00 57.88 57.64 1a5n h LEU 313 Cb 0.21 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1a5n h LEU 313 CO 0.01 0.48 -1.94 0.47 0.09 0.00 0.00 178.44 177.55 1a5n n ASP 314 N -4.50 1.47 0.00 -0.43 8.00 -1.22 -5.08 116.55 114.79 1a5n n ASP 314 Ca 0.13 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.89 1a5n n ASP 314 Cb 0.26 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.98 1a5n n ASP 314 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 1a5n n MET 315 N -3.24 0.00 -0.16 -1.24 1.56 -1.16 -5.22 117.12 107.66 1a5n n MET 315 Ca -0.27 0.25 0.15 0.00 -0.27 0.00 0.00 57.70 57.56 1a5n n MET 315 Cb 1.05 -1.61 0.26 0.00 2.15 0.00 0.00 33.22 35.07 1a5n n MET 315 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1a5n n ALA 331 N -1.21 0.49 1.39 -5.12 0.00 -1.26 -4.86 120.51 109.94 1a5n n ALA 331 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1a5n n ALA 331 Cb 0.11 -0.44 0.02 0.00 0.00 0.00 0.00 19.45 19.14 1a5n n ALA 331 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1a5n n PHE 332 N -3.82 0.08 -0.01 0.00 -1.74 -1.26 -3.77 117.46 106.94 1a5n n PHE 332 Ca 0.17 -0.03 -0.12 0.00 -0.56 0.00 0.00 57.45 56.90 1a5n n PHE 332 Cb 0.59 -0.06 -0.10 0.00 1.52 0.00 0.00 39.48 41.43 1a5n n PHE 332 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1a5n h ALA 333 N 2.57 -0.07 0.00 1.98 0.00 -1.98 -2.15 119.26 119.62 1a5n h ALA 333 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1a5n h ALA 333 Cb 0.31 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1a5n h ALA 333 CO 0.01 -0.20 0.00 0.93 0.00 0.00 0.00 179.25 179.99 1a5n h GLU 334 N -0.75 0.00 0.00 0.00 5.08 -1.84 -0.47 114.58 116.60 1a5n h GLU 334 Ca -0.01 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 1a5n h GLU 334 Cb 0.62 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1a5n h GLU 334 CO 0.01 0.00 -0.61 0.66 -1.00 0.00 0.00 179.01 178.07 1a5n h SER 335 N 0.00 0.00 0.08 1.42 4.64 -1.72 -3.37 113.55 114.60 1a5n h SER 335 Ca 0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 1a5n h SER 335 Cb 0.59 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.65 1a5n h SER 335 CO 0.00 0.34 -1.92 -1.14 -0.87 0.00 0.00 176.83 173.24 1a5n n ARG 336 N -3.07 0.70 -3.21 4.77 0.63 -0.81 -4.59 116.66 111.07 1a5n n ARG 336 Ca 0.00 0.32 -0.44 0.00 -0.92 0.00 0.00 57.85 56.81 1a5n n ARG 336 Cb 0.68 -1.69 -0.07 0.00 0.45 0.00 0.00 32.46 31.84 1a5n n ARG 336 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1a5n s ILE 337 N -2.51 4.96 -0.16 5.15 1.01 -0.22 -3.84 121.20 125.58 1a5n s ILE 337 Ca -0.26 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 59.81 1a5n s ILE 337 Cb 0.07 -4.25 0.03 0.00 0.01 0.00 0.00 42.46 38.33 1a5n s ILE 337 CO 0.70 -0.73 -0.11 -0.13 0.00 0.00 0.00 174.94 174.67 1a5n s ARG 338 N 2.41 1.98 0.29 2.79 0.52 -1.26 -4.69 118.95 120.99 1a5n s ARG 338 Ca 0.13 -0.59 0.04 0.00 -0.52 0.00 0.00 55.73 54.79 1a5n s ARG 338 Cb -0.20 -2.11 0.71 0.00 0.52 0.00 0.00 34.95 33.88 1a5n s ARG 338 CO 0.11 -0.33 1.75 -0.09 0.02 0.00 0.00 175.30 176.76 1a5n h ARG 339 N 8.06 0.60 -0.23 3.54 2.43 -1.95 -1.46 114.38 125.36 1a5n h ARG 339 Ca -0.32 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 58.84 1a5n h ARG 339 Cb 1.12 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.51 1a5n h ARG 339 CO 0.48 0.40 0.07 0.93 -1.51 0.00 0.00 179.97 180.34 1a5n h GLU 340 N 0.62 0.17 -0.01 0.20 3.07 -1.93 -1.16 114.58 115.55 1a5n h GLU 340 Ca 0.56 -0.01 -0.17 0.00 -0.50 0.00 0.00 59.36 59.24 1a5n h GLU 340 Cb 0.94 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.79 1a5n h GLU 340 CO -0.43 0.11 -0.79 1.79 -1.40 0.00 0.00 179.01 178.30 1a5n h THR 341 N 0.18 1.51 -0.60 1.13 1.35 -1.59 -2.65 112.91 112.23 1a5n h THR 341 Ca 0.10 -2.54 -0.04 0.00 -0.55 0.00 0.00 66.41 63.39 1a5n h THR 341 Cb 0.08 2.38 -0.03 0.00 -1.73 0.00 0.00 68.15 68.85 1a5n h THR 341 CO -0.11 0.73 0.23 0.40 -0.25 0.00 0.00 175.52 176.53 1a5n h ILE 342 N 0.07 1.23 -0.23 6.82 2.04 -1.01 -1.61 117.51 124.82 1a5n h ILE 342 Ca -0.02 -0.73 -0.12 0.00 1.00 0.00 0.00 64.86 64.99 1a5n h ILE 342 Cb 1.39 0.58 -0.00 0.00 -0.74 0.00 0.00 36.82 38.05 1a5n h ILE 342 CO 0.11 0.28 -0.32 0.00 0.00 0.00 0.00 178.15 178.23 1a5n h ALA 343 N 1.08 0.35 -0.87 1.87 0.00 -1.23 -3.23 119.26 117.24 1a5n h ALA 343 Ca 0.20 -0.41 0.04 0.00 0.00 0.00 0.00 54.91 54.73 1a5n h ALA 343 Cb 0.21 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 1a5n h ALA 343 CO -0.02 0.38 0.56 0.00 0.00 0.00 0.00 179.25 180.17 1a5n h ALA 344 N 0.64 1.16 -0.89 0.00 0.00 -1.33 -2.86 119.26 115.99 1a5n h ALA 344 Ca 0.03 -0.03 0.20 0.00 0.00 0.00 0.00 54.91 55.11 1a5n h ALA 344 Cb 0.90 -0.29 -0.12 0.00 0.00 0.00 0.00 17.79 18.28 1a5n h ALA 344 CO 0.07 0.39 0.41 1.49 0.00 0.00 0.00 179.25 181.61 1a5n h GLU 345 N 1.07 0.45 -0.61 0.00 4.81 -1.30 0.42 114.58 119.41 1a5n h GLU 345 Ca 0.35 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.54 1a5n h GLU 345 Cb 0.04 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 1a5n h GLU 345 CO -0.13 0.29 0.30 -0.44 -0.73 0.00 0.00 179.01 178.31 1a5n h ASP 346 N 0.46 0.79 -0.23 1.04 5.19 -1.62 -1.50 116.42 120.55 1a5n h ASP 346 Ca 0.54 -0.12 -0.07 0.00 -0.62 0.00 0.00 57.03 56.76 1a5n h ASP 346 Cb 0.96 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 40.26 1a5n h ASP 346 CO -0.49 0.69 -0.12 0.58 -3.12 0.00 0.00 179.24 176.79 1a5n h VAL 347 N 0.83 1.30 -0.13 -1.35 2.07 -1.16 -2.38 116.25 115.43 1a5n h VAL 347 Ca 0.21 -1.19 0.04 0.00 0.82 0.00 0.00 66.70 66.58 1a5n h VAL 347 Cb 0.10 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1a5n h VAL 347 CO -0.03 0.37 0.12 -0.07 0.02 0.00 0.00 177.57 177.98 1a5n h LEU 348 N 0.20 0.00 -0.03 2.57 3.38 -0.77 0.31 115.31 120.96 1a5n h LEU 348 Ca 0.05 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.85 1a5n h LEU 348 Cb 0.62 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.38 1a5n h LEU 348 CO 0.03 0.00 -0.67 0.45 0.09 0.00 0.00 178.44 178.35 1a5n h HIS 349 N 0.00 0.73 0.00 1.13 3.86 -1.07 0.21 115.15 120.01 1a5n h HIS 349 Ca 0.06 -0.38 -0.04 0.00 -1.16 0.00 0.00 60.37 58.86 1a5n h HIS 349 Cb 0.30 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 1a5n h HIS 349 CO 0.00 1.19 -0.18 0.22 0.86 0.00 0.00 177.93 180.01 1a5n h ASP 350 N 0.07 0.00 1.00 2.45 3.58 -0.50 -2.31 116.42 120.71 1a5n h ASP 350 Ca -0.07 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.38 1a5n h ASP 350 Cb 1.35 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.40 1a5n h ASP 350 CO 0.13 0.18 -0.48 0.18 -2.88 0.00 0.00 179.24 176.38 1a5n n LEU 351 N -4.29 0.73 0.00 2.28 4.77 -0.15 -4.95 117.00 115.39 1a5n n LEU 351 Ca -0.02 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1a5n n LEU 351 Cb 0.25 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1a5n n LEU 351 CO 0.36 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1a5n n GLY 352 N 1.33 0.77 0.09 -0.72 0.00 -0.87 -4.69 105.19 101.10 1a5n n GLY 352 Ca 0.04 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 1a5n n GLY 352 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5n h ALA 353 N 0.00 0.29 -3.28 4.61 0.00 -0.80 -1.91 119.26 118.17 1a5n h ALA 353 Ca 0.00 -1.02 -0.62 0.00 0.00 0.00 0.00 54.91 53.27 1a5n h ALA 353 Cb 0.00 0.09 -0.16 0.00 0.00 0.00 0.00 17.79 17.72 1a5n h ALA 353 CO 0.00 1.17 -0.56 -0.06 0.00 0.00 0.00 179.25 179.79 1a5n s PHE 354 N -2.65 3.25 -0.58 0.00 0.40 -0.98 -4.83 117.98 112.58 1a5n s PHE 354 Ca -0.04 0.07 0.17 0.00 -0.60 0.00 0.00 56.93 56.52 1a5n s PHE 354 Cb 0.08 -2.07 -0.20 0.00 0.51 0.00 0.00 43.02 41.34 1a5n s PHE 354 CO 0.85 0.16 0.62 0.43 0.70 0.00 0.00 175.22 177.98 1a5n n SER 355 N 3.49 0.86 -4.16 1.36 7.64 -0.66 -4.68 113.62 117.47 1a5n n SER 355 Ca -0.17 -0.66 -0.10 0.00 1.01 0.00 0.00 58.87 58.95 1a5n n SER 355 Cb 0.52 1.20 -0.10 0.00 -1.01 0.00 0.00 64.21 64.82 1a5n n SER 355 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1a5n s LEU 356 N -3.13 2.42 0.01 -3.43 1.02 -0.90 -4.32 118.68 110.34 1a5n s LEU 356 Ca 0.03 -1.04 0.03 0.00 0.02 0.00 0.00 54.13 53.17 1a5n s LEU 356 Cb 0.12 -0.01 -0.01 0.00 0.02 0.00 0.00 46.19 46.31 1a5n s LEU 356 CO 0.68 -0.51 -0.09 0.42 0.02 0.00 0.00 176.35 176.87 1a5n s THR 357 N -3.70 0.73 0.35 5.49 -4.23 -1.10 -1.57 115.64 111.61 1a5n s THR 357 Ca 0.13 -0.55 0.00 0.00 -1.18 0.00 0.00 61.69 60.10 1a5n s THR 357 Cb 0.06 -0.64 -0.00 0.00 1.34 0.00 0.00 72.50 73.26 1a5n s THR 357 CO -0.04 0.10 0.44 -0.94 -0.54 0.00 0.00 174.62 173.64 1a5n s SER 358 N -0.51 1.17 -0.13 3.99 1.04 0.42 -4.70 113.70 114.99 1a5n s SER 358 Ca 0.02 -1.58 -0.11 0.00 0.48 0.00 0.00 55.95 54.75 1a5n s SER 358 Cb -0.05 0.65 -0.04 0.00 0.10 0.00 0.00 66.02 66.69 1a5n s SER 358 CO 0.00 -1.27 -0.22 -1.54 0.98 0.00 0.00 173.24 171.19 1a5n n SER 359 N -1.54 1.47 -0.96 7.02 3.41 -1.26 -1.22 113.62 120.54 1a5n n SER 359 Ca 0.02 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1a5n n SER 359 Cb 0.62 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 1a5n n SER 359 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1a5n n ASP 360 N -4.06 -1.61 -4.54 4.04 -0.08 -0.52 -3.15 116.55 106.63 1a5n n ASP 360 Ca -0.09 0.00 -0.59 0.00 -1.51 0.00 0.00 54.79 52.60 1a5n n ASP 360 Cb 0.32 -0.40 -0.09 0.00 2.34 0.00 0.00 41.12 43.28 1a5n n ASP 360 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1a5n n SER 361 N -0.96 1.61 -1.91 1.67 3.41 -1.18 -1.83 113.62 114.43 1a5n n SER 361 Ca 0.00 0.87 -0.17 0.00 -0.26 0.00 0.00 58.87 59.31 1a5n n SER 361 Cb 0.40 -1.04 -0.04 0.00 -0.26 0.00 0.00 64.21 63.28 1a5n n SER 361 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a5n n GLN 362 N 6.19 -1.63 -2.80 4.33 6.02 -0.81 -4.15 117.38 124.53 1a5n n GLN 362 Ca 0.38 0.91 -0.11 0.00 -0.01 0.00 0.00 57.00 58.18 1a5n n GLN 362 Cb 0.06 -5.37 0.05 0.00 1.02 0.00 0.00 30.24 25.99 1a5n n GLN 362 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1a5n n ALA 363 N -0.47 2.03 -1.64 -1.58 0.00 -0.90 -4.89 120.51 113.06 1a5n n ALA 363 Ca -0.18 -2.54 0.00 0.00 0.00 0.00 0.00 53.44 50.72 1a5n n ALA 363 Cb 0.60 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1a5n n ALA 363 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1a5n n MET 364 N -0.06 0.00 -3.61 0.00 2.81 -1.24 -4.93 117.12 110.10 1a5n n MET 364 Ca 0.09 0.00 -0.05 0.00 -1.81 0.00 0.00 57.70 55.93 1a5n n MET 364 Cb 0.78 -1.92 -0.03 0.00 -0.71 0.00 0.00 33.22 31.33 1a5n n MET 364 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1a5n s GLY 365 N -2.60 -0.15 -0.34 3.03 0.00 -0.76 -4.40 107.32 102.11 1a5n s GLY 365 Ca 0.00 2.14 -0.05 0.00 0.00 0.00 0.00 44.72 46.80 1a5n s GLY 365 CO 0.00 0.85 0.09 0.50 0.00 0.00 0.00 173.10 174.54 1a5n s ARG 366 N -1.62 2.56 0.43 2.90 0.52 -1.26 -1.93 118.95 120.54 1a5n s ARG 366 Ca 0.07 -1.23 0.21 0.00 -0.52 0.00 0.00 55.73 54.26 1a5n s ARG 366 Cb -0.01 -3.41 1.17 0.00 0.52 0.00 0.00 34.95 33.21 1a5n s ARG 366 CO -0.04 -0.68 1.80 -0.24 0.02 0.00 0.00 175.30 176.16 1a5n h VAL 367 N 6.24 0.56 -0.57 3.52 3.04 -1.90 -1.60 116.25 125.55 1a5n h VAL 367 Ca -0.22 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.35 1a5n h VAL 367 Cb 1.08 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 30.55 1a5n h VAL 367 CO 0.60 0.06 0.00 0.61 -1.01 0.00 0.00 177.57 177.83 1a5n n GLY 368 N -1.53 3.04 0.12 3.17 0.00 -1.26 -4.39 105.19 104.34 1a5n n GLY 368 Ca 0.23 -0.93 0.05 0.00 0.00 0.00 0.00 46.02 45.37 1a5n n GLY 368 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a5n n GLU 369 N 0.60 1.39 -0.00 1.61 1.02 -0.60 -4.78 120.64 119.88 1a5n n GLU 369 Ca 0.28 -1.88 -0.12 0.00 -0.02 0.00 0.00 57.16 55.41 1a5n n GLU 369 Cb 1.17 -1.13 -0.07 0.00 -0.02 0.00 0.00 31.44 31.39 1a5n n GLU 369 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1a5n h VAL 370 N 1.40 1.17 -0.05 2.62 2.07 -1.77 -1.31 116.25 120.39 1a5n h VAL 370 Ca 0.00 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 1a5n h VAL 370 Cb 0.94 1.43 -0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1a5n h VAL 370 CO 0.00 0.14 -0.07 0.40 0.02 0.00 0.00 177.57 178.06 1a5n h ILE 371 N -0.12 1.40 -0.53 4.57 2.04 -1.89 -2.73 117.51 120.25 1a5n h ILE 371 Ca 0.02 -1.31 0.08 0.00 1.00 0.00 0.00 64.86 64.64 1a5n h ILE 371 Cb 0.22 2.17 -0.06 0.00 -0.74 0.00 0.00 36.82 38.40 1a5n h ILE 371 CO -0.00 0.36 0.19 0.25 0.00 0.00 0.00 178.15 178.95 1a5n h LEU 372 N -0.35 0.19 -0.43 1.44 6.46 -1.62 -2.61 115.31 118.39 1a5n h LEU 372 Ca 0.01 0.07 -0.18 0.00 -0.12 0.00 0.00 57.88 57.65 1a5n h LEU 372 Cb 0.61 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 1a5n h LEU 372 CO 0.02 0.13 -0.73 0.03 -0.62 0.00 0.00 178.44 177.26 1a5n h ARG 373 N 0.37 0.34 -0.92 1.25 3.08 -1.31 -2.64 114.38 114.56 1a5n h ARG 373 Ca 0.26 -0.28 0.04 0.00 0.07 0.00 0.00 59.98 60.07 1a5n h ARG 373 Cb 0.29 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.35 1a5n h ARG 373 CO -0.27 0.93 0.59 1.15 -1.07 0.00 0.00 179.97 181.30 1a5n h THR 374 N 0.23 1.15 0.00 2.04 2.02 -1.14 -0.98 112.91 116.22 1a5n h THR 374 Ca -0.03 -0.39 -0.13 0.00 0.77 0.00 0.00 66.41 66.63 1a5n h THR 374 Cb 1.30 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1a5n h THR 374 CO 0.12 0.21 -0.63 -0.50 0.37 0.00 0.00 175.52 175.09 1a5n h TRP 375 N 1.15 0.00 -0.36 3.16 4.06 -1.41 -2.44 115.95 120.10 1a5n h TRP 375 Ca 0.37 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 61.21 1a5n h TRP 375 Cb 0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.16 1a5n h TRP 375 CO -0.01 0.63 -0.20 1.96 -3.56 0.00 0.00 178.44 177.26 1a5n h GLN 376 N 0.00 0.68 0.06 0.49 4.20 -0.92 -1.25 115.11 118.36 1a5n h GLN 376 Ca -0.01 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.45 1a5n h GLN 376 Cb 1.14 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1a5n h GLN 376 CO 0.08 0.83 -0.03 0.28 -0.67 0.00 0.00 178.83 179.33 1a5n h VAL 377 N 0.60 1.11 -0.66 -0.54 2.07 -1.03 -1.61 116.25 116.19 1a5n h VAL 377 Ca 0.09 -0.54 0.11 0.00 0.82 0.00 0.00 66.70 67.18 1a5n h VAL 377 Cb 0.67 1.46 -0.08 0.00 -1.52 0.00 0.00 31.29 31.82 1a5n h VAL 377 CO 0.05 0.14 0.24 0.00 0.02 0.00 0.00 177.57 178.02 1a5n h ALA 378 N 0.61 0.88 0.30 1.67 0.00 -1.25 0.11 119.26 121.58 1a5n h ALA 378 Ca -0.01 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1a5n h ALA 378 Cb 0.28 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1a5n h ALA 378 CO 0.01 -0.21 -0.14 1.25 0.00 0.00 0.00 179.25 180.16 1a5n h HIS 379 N 0.41 -0.37 -0.12 0.00 6.17 -1.14 -0.72 115.15 119.38 1a5n h HIS 379 Ca 0.35 -0.01 -0.03 0.00 0.71 0.00 0.00 60.37 61.39 1a5n h HIS 379 Cb 0.48 0.12 -0.01 0.00 2.52 0.00 0.00 27.41 30.52 1a5n h HIS 379 CO -0.18 -0.21 -0.04 0.00 0.71 0.00 0.00 177.93 178.21 1a5n h ARG 380 N -0.43 0.17 -0.02 5.26 2.47 -0.63 -0.98 114.38 120.22 1a5n h ARG 380 Ca -0.04 -0.02 -0.23 0.00 -1.26 0.00 0.00 59.98 58.42 1a5n h ARG 380 Cb 0.33 -0.03 0.01 0.00 -1.65 0.00 0.00 29.97 28.62 1a5n h ARG 380 CO 0.07 0.23 -0.93 0.52 0.56 0.00 0.00 179.97 180.42 1a5n h MET 381 N 0.17 0.53 -0.23 0.04 2.86 -0.56 -1.36 114.93 116.38 1a5n h MET 381 Ca 0.04 -0.54 -0.02 0.00 -2.06 0.00 0.00 59.70 57.12 1a5n h MET 381 Cb 0.19 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 1a5n h MET 381 CO 0.01 1.17 0.06 -0.22 1.06 0.00 0.00 176.91 178.99 1a5n h LYS 382 N 0.31 0.36 -0.68 1.72 3.64 -0.58 0.32 116.57 121.67 1a5n h LYS 382 Ca -0.08 -0.08 0.06 0.00 -1.27 0.00 0.00 60.65 59.27 1a5n h LYS 382 Cb 1.56 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 33.28 1a5n h LYS 382 CO 0.17 0.46 0.39 0.28 -2.27 0.00 0.00 179.45 178.47 1a5n h VAL 383 N 0.20 0.98 0.12 2.00 2.07 -1.18 0.17 116.25 120.60 1a5n h VAL 383 Ca 0.07 -0.25 -0.32 0.00 0.82 0.00 0.00 66.70 67.03 1a5n h VAL 383 Cb 0.25 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1a5n h VAL 383 CO -0.00 0.13 -1.61 1.56 0.02 0.00 0.00 177.57 177.67 1a5n h GLN 384 N 0.72 0.26 -0.01 1.57 4.20 -1.07 -3.40 115.11 117.38 1a5n h GLN 384 Ca 0.30 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 58.57 1a5n h GLN 384 Cb 0.17 0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1a5n h GLN 384 CO -0.18 1.12 -0.05 0.54 -0.67 0.00 0.00 178.83 179.59 1a5n n ARG 385 N -3.45 0.96 0.00 1.46 1.74 0.11 -5.08 116.66 112.40 1a5n n ARG 385 Ca -0.19 -0.68 0.00 0.00 -0.77 0.00 0.00 57.85 56.22 1a5n n ARG 385 Cb 1.05 -1.04 0.00 0.00 -1.02 0.00 0.00 32.46 31.45 1a5n n ARG 385 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1a5n n GLY 386 N 0.50 -0.33 3.77 -0.13 0.00 0.58 -4.86 105.19 104.72 1a5n n GLY 386 Ca 0.03 -1.06 -0.36 0.00 0.00 0.00 0.00 46.02 44.63 1a5n n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5n s ALA 387 N -1.41 2.80 0.57 4.61 0.00 -1.26 -4.54 121.76 122.53 1a5n s ALA 387 Ca 0.00 0.90 -0.14 0.00 0.00 0.00 0.00 51.96 52.72 1a5n s ALA 387 Cb 0.00 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 1a5n s ALA 387 CO 0.00 -0.77 1.01 -0.51 0.00 0.00 0.00 175.76 175.49 1a5n s LEU 388 N -3.50 3.42 0.62 0.00 1.43 -1.26 -4.93 118.68 114.46 1a5n s LEU 388 Ca 0.69 1.48 0.35 0.00 -1.03 0.00 0.00 54.13 55.63 1a5n s LEU 388 Cb -0.27 -4.48 2.04 0.00 0.03 0.00 0.00 46.19 43.51 1a5n s LEU 388 CO 0.31 -0.73 2.30 0.00 0.23 0.00 0.00 176.35 178.45 1a5n h ALA 389 N 0.27 1.33 -0.00 4.21 0.00 -1.99 -1.27 119.26 121.82 1a5n h ALA 389 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1a5n h ALA 389 Cb 1.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1a5n h ALA 389 CO 0.62 0.00 -0.33 0.39 0.00 0.00 0.00 179.25 179.93 1a5n n GLU 390 N -3.57 0.07 -1.93 0.00 4.71 -1.26 -4.92 120.64 113.75 1a5n n GLU 390 Ca -0.03 -0.03 -0.38 0.00 -0.01 0.00 0.00 57.16 56.71 1a5n n GLU 390 Cb 0.08 -1.50 0.02 0.00 -1.01 0.00 0.00 31.44 29.04 1a5n n GLU 390 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1a5n s GLU 391 N -2.95 3.39 -0.01 3.49 0.41 -0.48 -4.91 118.70 117.64 1a5n s GLU 391 Ca 0.13 2.12 0.01 0.00 -0.41 0.00 0.00 54.97 56.82 1a5n s GLU 391 Cb 0.18 -2.35 0.01 0.00 -1.78 0.00 0.00 34.13 30.19 1a5n s GLU 391 CO 0.63 -0.96 -0.03 -0.08 -0.49 0.00 0.00 175.26 174.34 1a5n s THR 392 N -1.36 0.30 0.04 3.63 -1.32 -1.26 -5.00 115.64 110.67 1a5n s THR 392 Ca 0.68 -0.10 0.00 0.00 -1.21 0.00 0.00 61.69 61.06 1a5n s THR 392 Cb -0.37 -0.29 0.00 0.00 -1.51 0.00 0.00 72.50 70.32 1a5n s THR 392 CO 0.45 0.11 0.00 0.61 -2.21 0.00 0.00 174.62 173.58 1a5n n GLY 393 N 3.37 -1.74 2.72 6.08 0.00 -1.26 -4.45 105.19 109.91 1a5n n GLY 393 Ca -0.18 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 1a5n n GLY 393 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a5n n ASP 394 N -2.14 6.78 -3.14 1.61 -0.08 -1.26 -4.90 116.55 113.42 1a5n n ASP 394 Ca -0.00 -3.30 -0.13 0.00 -1.51 0.00 0.00 54.79 49.84 1a5n n ASP 394 Cb 0.07 -1.34 -0.02 0.00 2.34 0.00 0.00 41.12 42.17 1a5n n ASP 394 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1a5n s ASN 395 N -0.29 0.74 -0.21 1.67 6.03 -1.26 -5.02 114.94 116.59 1a5n s ASN 395 Ca 0.42 -1.42 0.14 0.00 -1.03 0.00 0.00 52.86 50.98 1a5n s ASN 395 Cb 0.13 0.72 0.47 0.00 -3.03 0.00 0.00 41.25 39.54 1a5n s ASN 395 CO -0.03 -1.40 1.37 0.47 -2.03 0.00 0.00 177.10 175.48 1a5n n ASP 396 N -1.45 3.04 -0.21 3.54 8.00 -0.06 -4.79 116.55 124.62 1a5n n ASP 396 Ca -0.01 -3.31 0.01 0.00 0.71 0.00 0.00 54.79 52.19 1a5n n ASP 396 Cb 0.61 -0.55 0.10 0.00 -0.02 0.00 0.00 41.12 41.26 1a5n n ASP 396 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1a5n h ASN 397 N 1.16 -0.35 -0.73 -2.24 4.21 -1.91 -0.72 115.58 115.00 1a5n h ASN 397 Ca 0.07 0.17 -0.03 0.00 1.21 0.00 0.00 56.30 57.71 1a5n h ASN 397 Cb 1.40 0.30 -0.03 0.00 -1.12 0.00 0.00 38.32 38.88 1a5n h ASN 397 CO 0.22 -0.14 0.33 0.15 -1.29 0.00 0.00 177.43 176.70 1a5n h PHE 398 N 0.09 1.07 -0.26 1.19 3.57 -1.91 -0.84 116.94 119.86 1a5n h PHE 398 Ca 0.33 -0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.70 1a5n h PHE 398 Cb 0.54 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1a5n h PHE 398 CO -0.40 0.80 -0.12 -0.09 -2.23 0.00 0.00 178.31 176.27 1a5n h ARG 399 N 1.03 0.42 -0.42 1.11 2.43 -1.67 -0.54 114.38 116.75 1a5n h ARG 399 Ca 0.25 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.19 1a5n h ARG 399 Cb 0.15 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1a5n h ARG 399 CO -0.03 0.54 -0.21 0.28 -1.51 0.00 0.00 179.97 179.05 1a5n h VAL 400 N 0.40 1.28 -0.46 0.20 2.07 -0.60 -1.56 116.25 117.58 1a5n h VAL 400 Ca 0.08 -1.36 -0.11 0.00 0.82 0.00 0.00 66.70 66.13 1a5n h VAL 400 Cb 0.45 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1a5n h VAL 400 CO 0.03 0.46 -0.16 0.11 0.02 0.00 0.00 177.57 178.02 1a5n h LYS 401 N 0.70 0.87 -0.37 1.57 1.57 -0.75 -0.12 116.57 120.05 1a5n h LYS 401 Ca 0.09 -0.33 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 1a5n h LYS 401 Cb 0.77 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 1a5n h LYS 401 CO 0.06 0.97 0.07 -0.09 -0.57 0.00 0.00 179.45 179.90 1a5n h ARG 402 N 0.77 0.60 0.03 3.15 2.43 -0.99 -2.80 114.38 117.56 1a5n h ARG 402 Ca 0.12 -0.15 -0.22 0.00 -0.81 0.00 0.00 59.98 58.91 1a5n h ARG 402 Cb 0.69 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1a5n h ARG 402 CO 0.05 0.65 -0.97 1.88 -1.51 0.00 0.00 179.97 180.08 1a5n h TYR 403 N 0.45 0.43 -0.04 2.20 -1.99 -1.21 -3.25 116.97 113.56 1a5n h TYR 403 Ca 0.11 -0.25 -0.10 0.00 2.00 0.00 0.00 58.73 60.49 1a5n h TYR 403 Cb 0.34 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 39.01 1a5n h TYR 403 CO 0.02 1.09 -0.45 0.97 -0.00 0.00 0.00 178.16 179.80 1a5n h ILE 404 N 0.14 1.32 0.00 -2.88 2.10 -1.05 -2.27 117.51 114.87 1a5n h ILE 404 Ca -0.07 -1.56 -0.02 0.00 1.08 0.00 0.00 64.86 64.29 1a5n h ILE 404 Cb 1.63 1.80 -0.00 0.00 -1.09 0.00 0.00 36.82 39.15 1a5n h ILE 404 CO 0.16 0.45 -0.09 0.00 -1.08 0.00 0.00 178.15 177.59 1a5n h ALA 405 N 1.48 1.29 -0.23 0.18 0.00 -1.52 -2.77 119.26 117.69 1a5n h ALA 405 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1a5n h ALA 405 Cb 0.82 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1a5n h ALA 405 CO 0.06 0.11 -0.01 0.87 0.00 0.00 0.00 179.25 180.28 1a5n h LYS 406 N 0.00 0.34 -0.08 0.00 1.57 -1.47 -2.08 116.57 114.85 1a5n h LYS 406 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1a5n h LYS 406 Cb 0.26 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1a5n h LYS 406 CO 0.01 0.38 0.00 2.48 -0.57 0.00 0.00 179.45 181.75 1a5n n TYR 407 N -4.34 0.21 0.00 -1.35 0.18 -1.06 -2.73 117.16 108.08 1a5n n TYR 407 Ca 0.00 -0.77 0.00 0.00 1.88 0.00 0.00 57.90 59.01 1a5n n TYR 407 Cb 0.21 -0.13 0.00 0.00 -0.38 0.00 0.00 39.34 39.03 1a5n n TYR 407 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1a5n n THR 408 N -0.78 0.00 -0.19 -3.48 -2.24 -1.14 -0.71 114.28 105.74 1a5n n THR 408 Ca 0.12 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.82 1a5n n THR 408 Cb 0.54 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.79 1a5n n THR 408 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1a5n h ILE 409 N 0.00 1.20 -0.57 2.28 6.09 -1.37 -2.90 117.51 122.24 1a5n h ILE 409 Ca 0.00 -0.57 -0.00 0.00 -1.37 0.00 0.00 64.86 62.92 1a5n h ILE 409 Cb 0.00 0.56 -0.03 0.00 0.47 0.00 0.00 36.82 37.83 1a5n h ILE 409 CO 0.00 0.23 0.36 0.78 -3.07 0.00 0.00 178.15 176.45 1a5n h ASN 410 N 0.74 0.68 -0.25 2.19 2.35 -1.67 0.59 115.58 120.20 1a5n h ASN 410 Ca 0.19 -0.05 -0.06 0.00 -0.55 0.00 0.00 56.30 55.84 1a5n h ASN 410 Cb 0.12 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1a5n h ASN 410 CO -0.02 0.52 -0.01 -0.65 -1.65 0.00 0.00 177.43 175.62 1a5n h PRO 411 N 0.78 0.58 -0.26 0.81 0.11 -1.75 -1.13 132.00 131.13 1a5n h PRO 411 Ca 0.21 -0.13 -0.10 0.00 0.11 0.00 0.00 66.00 66.08 1a5n h PRO 411 Cb -0.04 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 1a5n h PRO 411 CO -0.04 0.61 -0.28 0.00 -0.21 0.00 0.00 178.00 178.08 1a5n h ALA 412 N 1.44 1.03 -0.09 -0.75 0.00 -1.13 -2.60 119.26 117.15 1a5n h ALA 412 Ca 0.11 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1a5n h ALA 412 Cb 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1a5n h ALA 412 CO 0.01 0.59 -0.25 -0.07 0.00 0.00 0.00 179.25 179.53 1a5n h LEU 413 N 0.45 0.39 -1.33 0.00 3.38 -0.48 -0.57 115.31 117.15 1a5n h LEU 413 Ca 0.06 -0.59 0.11 0.00 0.09 0.00 0.00 57.88 57.55 1a5n h LEU 413 Cb 0.73 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 1a5n h LEU 413 CO 0.06 0.91 0.54 0.74 0.09 0.00 0.00 178.44 180.77 1a5n h THR 414 N -0.12 0.91 -0.58 0.22 2.02 -1.14 -2.68 112.91 111.54 1a5n h THR 414 Ca -0.00 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1a5n h THR 414 Cb 0.87 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1a5n h THR 414 CO 0.05 0.13 0.00 1.41 0.37 0.00 0.00 175.52 177.49 1a5n n HIS 415 N -4.52 0.81 -3.06 3.16 8.25 -0.99 -4.86 115.22 114.01 1a5n n HIS 415 Ca 0.14 -0.51 -0.15 0.00 -0.26 0.00 0.00 57.72 56.94 1a5n n HIS 415 Cb 0.37 -0.03 0.04 0.00 1.12 0.00 0.00 29.99 31.50 1a5n n HIS 415 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a5n n GLY 416 N 1.18 -0.06 0.00 -1.41 0.00 -1.01 -4.75 105.19 99.13 1a5n n GLY 416 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1a5n n GLY 416 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1a5n n ILE 417 N -4.13 0.55 0.22 -0.61 -5.35 -0.30 -2.11 119.36 107.63 1a5n n ILE 417 Ca -0.02 -0.61 0.05 0.00 -0.27 0.00 0.00 62.75 61.90 1a5n n ILE 417 Cb 0.55 0.78 0.26 0.00 -1.74 0.00 0.00 39.64 39.49 1a5n n ILE 417 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1a5n n ALA 418 N -0.28 1.28 0.45 -1.28 0.00 -0.72 -1.21 120.51 118.76 1a5n n ALA 418 Ca 0.00 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.60 1a5n n ALA 418 Cb 0.29 -1.17 0.28 0.00 0.00 0.00 0.00 19.45 18.85 1a5n n ALA 418 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1a5n h HIS 419 N 0.00 0.00 0.00 0.00 2.07 -1.88 -3.37 115.15 111.96 1a5n h HIS 419 Ca 0.00 0.00 -0.31 0.00 -2.85 0.00 0.00 60.37 57.21 1a5n h HIS 419 Cb 0.12 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.05 1a5n h HIS 419 CO 0.00 0.00 -2.09 0.39 -3.07 0.00 0.00 177.93 173.16 1a5n n GLU 420 N -2.55 0.44 -1.75 5.12 -0.58 -0.35 -4.76 120.64 116.21 1a5n n GLU 420 Ca 0.04 0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.93 1a5n n GLU 420 Cb 0.47 -1.29 0.00 0.00 -0.57 0.00 0.00 31.44 30.05 1a5n n GLU 420 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1a5n n VAL 421 N -3.49 0.00 0.00 2.62 0.24 -0.86 -0.56 118.33 116.28 1a5n n VAL 421 Ca -0.36 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 1a5n n VAL 421 Cb 0.81 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 1a5n n VAL 421 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1a5n n GLY 422 N 0.44 2.70 3.71 7.63 0.00 -1.26 -4.32 105.19 114.09 1a5n n GLY 422 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1a5n n GLY 422 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a5n s SER 423 N -0.84 -0.33 -1.07 1.61 1.04 -1.26 -1.74 113.70 111.12 1a5n s SER 423 Ca 0.00 -0.38 -0.17 0.00 0.48 0.00 0.00 55.95 55.88 1a5n s SER 423 Cb 0.00 0.63 0.14 0.00 0.10 0.00 0.00 66.02 66.88 1a5n s SER 423 CO 0.00 -1.12 1.31 -0.63 0.98 0.00 0.00 173.24 173.78 1a5n s ILE 424 N -3.70 4.76 0.05 -1.02 1.01 -1.26 -4.92 121.20 116.12 1a5n s ILE 424 Ca 0.08 -1.97 0.03 0.00 0.00 0.00 0.00 60.65 58.80 1a5n s ILE 424 Cb -0.04 -4.87 -0.02 0.00 0.01 0.00 0.00 42.46 37.54 1a5n s ILE 424 CO 0.00 -1.61 -0.11 -1.61 0.00 0.00 0.00 174.94 171.61 1a5n s GLU 425 N 2.48 0.67 0.52 2.79 2.02 -1.26 -5.10 118.70 120.82 1a5n s GLU 425 Ca 0.39 -0.78 -0.23 0.00 0.02 0.00 0.00 54.97 54.37 1a5n s GLU 425 Cb -0.03 -0.57 -0.06 0.00 0.10 0.00 0.00 34.13 33.57 1a5n s GLU 425 CO -0.05 0.12 1.34 1.33 0.02 0.00 0.00 175.26 178.03 1a5n n VAL 426 N 1.58 3.48 0.00 2.63 0.24 -1.26 -2.29 118.33 122.71 1a5n n VAL 426 Ca -0.21 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.59 1a5n n VAL 426 Cb 0.55 -1.66 0.00 0.00 -1.47 0.00 0.00 33.84 31.26 1a5n n VAL 426 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1a5n n GLY 427 N 0.76 2.44 3.88 7.63 0.00 0.10 -4.96 105.19 115.04 1a5n n GLY 427 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 1a5n n GLY 427 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a5n s LYS 428 N -0.40 3.70 0.34 1.61 1.02 -0.97 -4.77 119.74 120.27 1a5n s LYS 428 Ca 0.00 0.43 -0.29 0.00 0.02 0.00 0.00 55.97 56.13 1a5n s LYS 428 Cb 0.00 -2.35 -0.11 0.00 -0.52 0.00 0.00 37.83 34.84 1a5n s LYS 428 CO 0.00 -0.13 1.52 -1.17 -0.92 0.00 0.00 175.35 174.65 1a5n s LEU 429 N -4.21 4.33 -1.18 3.17 2.96 0.27 -0.64 118.68 123.38 1a5n s LEU 429 Ca 0.51 3.00 -0.17 0.00 -0.22 0.00 0.00 54.13 57.24 1a5n s LEU 429 Cb -0.10 -3.65 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 1a5n s LEU 429 CO 0.37 -0.88 2.09 0.00 -1.32 0.00 0.00 176.35 176.61 1a5n n ALA 430 N 1.15 4.54 -3.34 5.97 0.00 0.19 -4.68 120.51 124.34 1a5n n ALA 430 Ca 0.04 -3.64 -0.44 0.00 0.00 0.00 0.00 53.44 49.39 1a5n n ALA 430 Cb 0.39 -3.58 -0.06 0.00 0.00 0.00 0.00 19.45 16.19 1a5n n ALA 430 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1a5n s ASP 431 N 4.00 6.05 0.14 0.00 1.01 -1.26 -1.90 116.67 124.70 1a5n s ASP 431 Ca 0.52 -1.78 0.07 0.00 0.71 0.00 0.00 52.55 52.07 1a5n s ASP 431 Cb 0.13 -2.15 -0.04 0.00 1.01 0.00 0.00 42.92 41.88 1a5n s ASP 431 CO 0.00 -0.79 -0.16 -0.76 0.21 0.00 0.00 175.17 173.67 1a5n s LEU 432 N 1.54 2.41 -0.06 1.23 1.43 -0.44 -1.61 118.68 123.18 1a5n s LEU 432 Ca 0.04 -0.82 0.02 0.00 -1.03 0.00 0.00 54.13 52.33 1a5n s LEU 432 Cb -0.28 -0.66 0.02 0.00 0.03 0.00 0.00 46.19 45.29 1a5n s LEU 432 CO 0.02 -0.10 -0.09 -0.69 0.23 0.00 0.00 176.35 175.72 1a5n s VAL 433 N -2.07 0.94 -0.16 -1.59 1.01 0.08 -0.24 120.40 118.37 1a5n s VAL 433 Ca 0.11 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 61.67 1a5n s VAL 433 Cb -0.05 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1a5n s VAL 433 CO 0.04 0.32 0.09 -0.69 0.00 0.00 0.00 175.10 174.86 1a5n s VAL 434 N 0.85 5.10 0.04 2.92 1.01 0.02 -1.45 120.40 128.89 1a5n s VAL 434 Ca -0.12 0.07 0.05 0.00 0.00 0.00 0.00 61.98 61.99 1a5n s VAL 434 Cb -0.15 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 1a5n s VAL 434 CO 0.01 0.51 -0.15 0.26 0.00 0.00 0.00 175.10 175.73 1a5n s TRP 435 N -0.09 1.28 -0.01 5.22 0.52 0.67 -0.33 118.94 126.21 1a5n s TRP 435 Ca 0.08 -0.37 -0.19 0.00 0.02 0.00 0.00 56.10 55.64 1a5n s TRP 435 Cb -0.12 -0.75 -0.05 0.00 -1.15 0.00 0.00 33.47 31.39 1a5n s TRP 435 CO 0.01 0.04 0.56 0.45 0.02 0.00 0.00 176.95 178.03 1a5n s SER 436 N -1.22 6.93 0.47 2.95 0.15 -1.26 -0.42 113.70 121.30 1a5n s SER 436 Ca 0.02 1.11 0.27 0.00 0.70 0.00 0.00 55.95 58.05 1a5n s SER 436 Cb -0.08 -2.34 1.33 0.00 -1.71 0.00 0.00 66.02 63.22 1a5n s SER 436 CO 0.01 0.14 1.79 -0.65 1.20 0.00 0.00 173.24 175.73 1a5n h PRO 437 N 5.52 0.18 0.00 5.44 0.11 -1.92 -0.55 132.00 140.79 1a5n h PRO 437 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1a5n h PRO 437 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1a5n h PRO 437 CO 0.69 0.12 0.00 0.00 -0.21 0.00 0.00 178.00 178.60 1a5n n ALA 438 N -2.62 1.98 -0.99 -0.75 0.00 -1.26 -0.94 120.51 115.93 1a5n n ALA 438 Ca 0.25 0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.76 1a5n n ALA 438 Cb 1.05 -1.42 0.08 0.00 0.00 0.00 0.00 19.45 19.16 1a5n n ALA 438 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1a5n n PHE 439 N -2.14 0.00 -1.67 0.00 3.01 -0.27 -4.56 117.46 111.83 1a5n n PHE 439 Ca 0.04 -0.66 -0.45 0.00 1.01 0.00 0.00 57.45 57.39 1a5n n PHE 439 Cb 0.32 -0.10 -0.03 0.00 -0.01 0.00 0.00 39.48 39.66 1a5n n PHE 439 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1a5n n PHE 440 N -0.90 2.14 -0.03 1.38 7.35 -0.88 -1.28 117.46 125.25 1a5n n PHE 440 Ca 0.09 0.42 0.00 0.00 -0.76 0.00 0.00 57.45 57.19 1a5n n PHE 440 Cb 0.56 -2.47 0.00 0.00 0.35 0.00 0.00 39.48 37.92 1a5n n PHE 440 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1a5n n GLY 441 N 2.39 2.05 0.48 7.13 0.00 -1.26 -4.60 105.19 111.38 1a5n n GLY 441 Ca 0.13 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 1a5n n GLY 441 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1a5n n VAL 442 N -2.00 1.29 -3.64 1.61 0.31 -0.40 -3.65 118.33 111.85 1a5n n VAL 442 Ca 0.00 0.15 -0.24 0.00 -0.01 0.00 0.00 64.34 64.23 1a5n n VAL 442 Cb 0.00 -1.97 -0.17 0.00 -0.91 0.00 0.00 33.84 30.78 1a5n n VAL 442 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1a5n s LYS 443 N -2.49 0.07 0.40 5.55 1.02 -0.85 -4.89 119.74 118.54 1a5n s LYS 443 Ca -0.18 0.04 -0.25 0.00 0.02 0.00 0.00 55.97 55.60 1a5n s LYS 443 Cb 0.04 -1.45 -0.09 0.00 -0.52 0.00 0.00 37.83 35.81 1a5n s LYS 443 CO 0.26 -0.56 1.10 -2.14 -0.92 0.00 0.00 175.35 173.09 1a5n s PRO 444 N 2.13 4.11 0.01 -1.68 0.02 -1.26 -4.68 135.00 133.64 1a5n s PRO 444 Ca 0.03 1.66 -0.18 0.00 0.02 0.00 0.00 61.00 62.54 1a5n s PRO 444 Cb -0.15 -2.61 -0.33 0.00 0.02 0.00 0.00 34.50 31.44 1a5n s PRO 444 CO -0.07 -0.23 1.00 0.00 -0.33 0.00 0.00 177.00 177.37 1a5n h ALA 445 N 2.57 -0.10 -2.98 -1.55 0.00 -1.03 -3.41 119.26 112.75 1a5n h ALA 445 Ca -0.48 -0.78 -0.15 0.00 0.00 0.00 0.00 54.91 53.49 1a5n h ALA 445 Cb 1.23 0.14 -0.24 0.00 0.00 0.00 0.00 17.79 18.91 1a5n h ALA 445 CO 0.62 0.58 -0.40 0.99 0.00 0.00 0.00 179.25 181.05 1a5n s THR 446 N -2.66 0.02 -0.28 0.00 2.01 -1.03 -4.10 115.64 109.59 1a5n s THR 446 Ca -0.11 -0.13 0.01 0.00 0.31 0.00 0.00 61.69 61.77 1a5n s THR 446 Cb 0.03 -0.41 0.08 0.00 0.01 0.00 0.00 72.50 72.21 1a5n s THR 446 CO 0.91 -0.07 0.01 -0.69 -0.69 0.00 0.00 174.62 174.09 1a5n s VAL 447 N -0.21 1.49 -0.16 3.82 1.01 -0.90 -0.80 120.40 124.65 1a5n s VAL 447 Ca -0.03 -1.50 -0.15 0.00 0.00 0.00 0.00 61.98 60.29 1a5n s VAL 447 Cb -0.03 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 1a5n s VAL 447 CO 0.01 -0.37 0.36 -0.63 0.00 0.00 0.00 175.10 174.47 1a5n s ILE 448 N 1.36 5.25 -0.16 2.22 1.01 0.67 -1.06 121.20 130.49 1a5n s ILE 448 Ca 0.02 0.68 0.01 0.00 0.00 0.00 0.00 60.65 61.36 1a5n s ILE 448 Cb -0.18 -3.70 0.02 0.00 0.01 0.00 0.00 42.46 38.61 1a5n s ILE 448 CO -0.12 0.34 -0.17 -0.54 0.00 0.00 0.00 174.94 174.45 1a5n s LYS 449 N 0.74 2.63 -1.46 2.79 1.02 0.17 -1.32 119.74 124.31 1a5n s LYS 449 Ca 0.19 -0.69 0.00 0.00 0.02 0.00 0.00 55.97 55.49 1a5n s LYS 449 Cb -0.14 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.85 1a5n s LYS 449 CO 0.06 -0.21 0.00 0.41 -0.92 0.00 0.00 175.35 174.69 1a5n n GLY 450 N 4.66 -0.18 0.56 -3.33 0.00 -0.80 -1.53 105.19 104.57 1a5n n GLY 450 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1a5n n GLY 450 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a5n n GLY 451 N -0.81 0.59 3.16 -0.02 0.00 -1.09 -4.24 105.19 102.77 1a5n n GLY 451 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 1a5n n GLY 451 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1a5n s MET 452 N -0.81 0.98 -0.02 1.61 -1.94 -0.58 -4.96 119.30 113.58 1a5n s MET 452 Ca 0.00 -0.79 -0.30 0.00 -1.71 0.00 0.00 55.69 52.89 1a5n s MET 452 Cb 0.00 -1.00 -0.05 0.00 2.01 0.00 0.00 34.83 35.79 1a5n s MET 452 CO 0.00 0.25 1.37 0.42 -0.01 0.00 0.00 175.02 177.05 1a5n s ILE 453 N -0.86 3.81 -0.22 2.53 1.01 -1.26 0.44 121.20 126.65 1a5n s ILE 453 Ca 0.02 1.17 0.11 0.00 0.00 0.00 0.00 60.65 61.96 1a5n s ILE 453 Cb -0.08 -3.76 -0.21 0.00 0.01 0.00 0.00 42.46 38.42 1a5n s ILE 453 CO 0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 174.94 174.89 1a5n n ALA 454 N 5.44 1.48 -3.38 9.38 0.00 -0.22 -1.53 120.51 131.67 1a5n n ALA 454 Ca 0.13 -1.23 -0.14 0.00 0.00 0.00 0.00 53.44 52.19 1a5n n ALA 454 Cb 0.44 -0.14 -0.08 0.00 0.00 0.00 0.00 19.45 19.67 1a5n n ALA 454 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1a5n s ILE 455 N -2.50 0.02 0.15 0.00 2.07 -1.20 -0.44 121.20 119.30 1a5n s ILE 455 Ca -0.20 -0.15 -0.24 0.00 -1.41 0.00 0.00 60.65 58.65 1a5n s ILE 455 Cb 0.07 -0.75 0.07 0.00 0.13 0.00 0.00 42.46 41.98 1a5n s ILE 455 CO 0.73 -0.08 0.70 0.00 -1.91 0.00 0.00 174.94 174.38 1a5n s ALA 456 N -0.58 -1.58 0.18 1.50 0.00 -1.18 -2.12 121.76 117.98 1a5n s ALA 456 Ca -0.07 0.43 -0.30 0.00 0.00 0.00 0.00 51.96 52.03 1a5n s ALA 456 Cb -0.03 0.77 -0.08 0.00 0.00 0.00 0.00 23.12 23.78 1a5n s ALA 456 CO 0.04 -0.82 1.13 -2.14 0.00 0.00 0.00 175.76 173.97 1a5n s PRO 457 N -3.62 4.56 -0.02 0.00 0.02 -1.26 -2.13 135.00 132.56 1a5n s PRO 457 Ca 0.04 1.77 0.01 0.00 0.02 0.00 0.00 61.00 62.84 1a5n s PRO 457 Cb -0.02 -3.26 0.01 0.00 0.02 0.00 0.00 34.50 31.25 1a5n s PRO 457 CO -0.08 0.03 -0.04 1.41 -0.33 0.00 0.00 177.00 177.99 1a5n s MET 458 N -0.35 0.46 0.00 5.54 1.75 -0.24 -4.91 119.30 121.55 1a5n s MET 458 Ca 0.50 -0.10 0.00 0.00 -1.25 0.00 0.00 55.69 54.85 1a5n s MET 458 Cb -0.30 -0.50 0.00 0.00 2.84 0.00 0.00 34.83 36.87 1a5n s MET 458 CO 0.36 0.01 0.00 0.41 -0.65 0.00 0.00 175.02 175.14 1a5n n GLY 459 N 3.48 0.46 3.59 2.11 0.00 -0.61 -2.24 105.19 111.98 1a5n n GLY 459 Ca -0.19 -1.87 -0.64 0.00 0.00 0.00 0.00 46.02 43.32 1a5n n GLY 459 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a5n n ASP 460 N -1.71 1.19 0.24 1.61 -0.08 -0.19 -4.82 116.55 112.80 1a5n n ASP 460 Ca 0.00 1.01 0.09 0.00 -1.51 0.00 0.00 54.79 54.38 1a5n n ASP 460 Cb 0.00 -0.92 0.61 0.00 2.34 0.00 0.00 41.12 43.16 1a5n n ASP 460 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1a5n h ILE 461 N 5.68 0.83 -0.02 5.18 1.08 -1.92 -2.09 117.51 126.25 1a5n h ILE 461 Ca -0.34 -0.63 0.00 0.00 -0.39 0.00 0.00 64.86 63.50 1a5n h ILE 461 Cb 1.38 1.37 0.00 0.00 -3.07 0.00 0.00 36.82 36.50 1a5n h ILE 461 CO 1.01 0.16 -0.01 -3.20 -0.69 0.00 0.00 178.15 175.43 1a5n n ASN 462 N -3.93 2.29 -4.74 1.72 5.15 -1.26 -4.98 115.26 109.51 1a5n n ASN 462 Ca -0.02 -1.76 -0.30 0.00 -0.60 0.00 0.00 54.58 51.91 1a5n n ASN 462 Cb 0.26 0.01 0.13 0.00 -0.53 0.00 0.00 39.78 39.64 1a5n n ASN 462 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1a5n s ALA 463 N -2.01 1.72 -1.18 5.20 0.00 -0.79 -4.94 121.76 119.77 1a5n s ALA 463 Ca 0.32 -0.14 0.27 0.00 0.00 0.00 0.00 51.96 52.41 1a5n s ALA 463 Cb 0.20 -3.16 1.24 0.00 0.00 0.00 0.00 23.12 21.41 1a5n s ALA 463 CO 0.32 -2.20 1.89 -1.13 0.00 0.00 0.00 175.76 174.64 1a5n n SER 464 N -3.77 0.00 -3.76 0.00 3.41 -1.26 -4.80 113.62 103.44 1a5n n SER 464 Ca 0.07 0.24 -0.10 0.00 -0.26 0.00 0.00 58.87 58.82 1a5n n SER 464 Cb 0.56 -0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 64.04 1a5n n SER 464 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1a5n s ILE 465 N -2.82 0.09 -2.00 -1.33 -4.36 -1.26 -5.05 121.20 104.47 1a5n s ILE 465 Ca 0.18 -0.90 0.24 0.00 -0.26 0.00 0.00 60.65 59.91 1a5n s ILE 465 Cb 0.18 -1.34 0.67 0.00 1.25 0.00 0.00 42.46 43.22 1a5n s ILE 465 CO 0.45 -0.41 1.82 -0.81 0.24 0.00 0.00 174.94 176.24 1a5n n PRO 466 N -0.18 0.86 0.04 0.37 -0.04 -1.26 -4.09 135.00 130.70 1a5n n PRO 466 Ca -0.14 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.36 1a5n n PRO 466 Cb 0.63 -1.43 -0.08 0.00 -0.04 0.00 0.00 33.50 32.59 1a5n n PRO 466 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1a5n n THR 467 N -0.93 0.83 -1.83 0.52 -2.24 -1.26 -1.57 114.28 107.80 1a5n n THR 467 Ca 0.18 -0.63 -0.37 0.00 -2.27 0.00 0.00 64.05 60.95 1a5n n THR 467 Cb 0.08 -0.47 0.05 0.00 -2.10 0.00 0.00 70.33 67.89 1a5n n THR 467 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 1a5n s PRO 468 N -3.12 2.92 0.74 -0.78 0.02 -1.26 -4.80 135.00 128.71 1a5n s PRO 468 Ca -0.04 2.08 -0.13 0.00 0.02 0.00 0.00 61.00 62.93 1a5n s PRO 468 Cb 0.10 -2.05 0.04 0.00 0.02 0.00 0.00 34.50 32.61 1a5n s PRO 468 CO 0.82 -1.32 1.14 -0.65 -0.33 0.00 0.00 177.00 176.66 1a5n s GLN 469 N -3.15 2.27 0.10 5.54 -1.52 -1.26 -1.02 119.66 120.63 1a5n s GLN 469 Ca 0.76 1.47 -0.25 0.00 -1.95 0.00 0.00 55.36 55.39 1a5n s GLN 469 Cb -0.37 -1.88 -0.07 0.00 -0.22 0.00 0.00 33.01 30.48 1a5n s GLN 469 CO 0.41 -1.67 0.78 -1.25 -0.25 0.00 0.00 175.29 173.31 1a5n s PRO 470 N -4.28 4.54 -0.27 2.91 0.04 -1.26 -4.22 135.00 132.47 1a5n s PRO 470 Ca 0.68 1.13 -0.08 0.00 0.04 0.00 0.00 61.00 62.77 1a5n s PRO 470 Cb -0.22 -3.32 -0.03 0.00 0.04 0.00 0.00 34.50 30.97 1a5n s PRO 470 CO 0.48 0.41 0.10 0.08 0.04 0.00 0.00 177.00 178.11 1a5n s VAL 471 N -0.55 4.46 0.13 -0.36 1.01 -1.26 -3.61 120.40 120.21 1a5n s VAL 471 Ca 0.38 -0.20 -0.09 0.00 0.00 0.00 0.00 61.98 62.06 1a5n s VAL 471 Cb -0.22 -3.14 -0.00 0.00 0.00 0.00 0.00 36.38 33.02 1a5n s VAL 471 CO 0.25 0.27 0.24 -1.38 0.00 0.00 0.00 175.10 174.47 1a5n s HIS 472 N 1.63 0.27 0.02 5.22 -3.43 -0.95 -4.86 115.29 113.19 1a5n s HIS 472 Ca 0.06 -0.67 -0.30 0.00 -0.80 0.00 0.00 55.06 53.35 1a5n s HIS 472 Cb -0.16 -0.06 -0.06 0.00 -1.43 0.00 0.00 32.58 30.87 1a5n s HIS 472 CO 0.05 -0.63 1.48 0.71 -2.00 0.00 0.00 174.74 174.35 1a5n s TYR 473 N -3.91 2.71 0.05 0.38 1.51 -1.26 -1.08 117.35 115.75 1a5n s TYR 473 Ca 0.11 0.66 0.05 0.00 -1.01 0.00 0.00 57.07 56.88 1a5n s TYR 473 Cb 0.04 -3.76 -0.03 0.00 -0.11 0.00 0.00 41.96 38.10 1a5n s TYR 473 CO -0.06 -2.91 -0.15 1.03 -1.11 0.00 0.00 175.55 172.36 1a5n s ARG 474 N 2.48 0.91 0.43 -0.62 0.52 -0.90 -4.94 118.95 116.83 1a5n s ARG 474 Ca 0.67 -0.86 -0.25 0.00 -0.52 0.00 0.00 55.73 54.77 1a5n s ARG 474 Cb -0.34 -0.94 -0.08 0.00 0.52 0.00 0.00 34.95 34.11 1a5n s ARG 474 CO 0.28 0.22 1.28 -2.14 0.02 0.00 0.00 175.30 174.97 1a5n s PRO 475 N -1.41 3.85 0.31 3.54 0.02 -1.26 -3.09 135.00 136.96 1a5n s PRO 475 Ca 0.01 2.09 0.01 0.00 0.02 0.00 0.00 61.00 63.13 1a5n s PRO 475 Cb -0.09 -2.65 0.01 0.00 0.02 0.00 0.00 34.50 31.80 1a5n s PRO 475 CO 0.02 -0.57 0.11 -1.33 -0.33 0.00 0.00 177.00 174.90 1a5n n MET 476 N -0.09 1.16 -0.24 5.54 2.81 0.42 -4.95 117.12 121.77 1a5n n MET 476 Ca 0.05 -2.07 0.16 0.00 -1.81 0.00 0.00 57.70 54.03 1a5n n MET 476 Cb 0.45 0.40 0.46 0.00 -0.71 0.00 0.00 33.22 33.81 1a5n n MET 476 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 1a5n h PHE 477 N 0.89 0.65 0.00 2.03 0.04 -1.84 0.16 116.94 118.87 1a5n h PHE 477 Ca -0.22 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.57 1a5n h PHE 477 Cb 0.74 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.68 1a5n h PHE 477 CO 0.00 0.21 0.00 0.41 -0.60 0.00 0.00 178.31 178.33 1a5n n GLY 478 N -1.48 -0.79 0.87 -1.45 0.00 -0.59 -1.17 105.19 100.58 1a5n n GLY 478 Ca 0.18 0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.28 1a5n n GLY 478 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5n n ALA 479 N -1.55 2.26 -2.82 4.61 0.00 0.04 -3.74 120.51 119.31 1a5n n ALA 479 Ca 0.01 -1.15 -0.36 0.00 0.00 0.00 0.00 53.44 51.94 1a5n n ALA 479 Cb 0.09 -0.60 -0.07 0.00 0.00 0.00 0.00 19.45 18.87 1a5n n ALA 479 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1a5n s LEU 480 N -1.02 4.21 0.00 0.00 1.43 -0.31 -4.81 118.68 118.17 1a5n s LEU 480 Ca 0.31 0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.76 1a5n s LEU 480 Cb 0.16 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.35 1a5n s LEU 480 CO 0.22 0.34 0.00 0.61 0.23 0.00 0.00 176.35 177.74 1a5n n GLY 481 N 2.47 0.00 0.26 -3.19 0.00 -1.26 -0.76 105.19 102.71 1a5n n GLY 481 Ca -0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.95 1a5n n GLY 481 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1a5n h SER 482 N 0.00 0.00 -0.48 1.61 0.02 -1.96 -2.37 113.55 110.37 1a5n h SER 482 Ca 0.00 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 1a5n h SER 482 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1a5n h SER 482 CO 0.00 0.13 -0.16 0.00 -1.14 0.00 0.00 176.83 175.66 1a5n h ALA 483 N 1.87 0.67 -0.57 3.77 0.00 -1.40 -2.31 119.26 121.29 1a5n h ALA 483 Ca -0.00 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1a5n h ALA 483 Cb 0.36 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1a5n h ALA 483 CO 0.02 0.61 0.29 -0.09 0.00 0.00 0.00 179.25 180.07 1a5n h ARG 484 N 0.80 0.80 -0.82 0.00 2.43 -0.42 -2.08 114.38 115.10 1a5n h ARG 484 Ca 0.12 -0.11 0.06 0.00 -0.81 0.00 0.00 59.98 59.24 1a5n h ARG 484 Cb 0.72 -0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 30.06 1a5n h ARG 484 CO 0.06 0.64 0.50 0.45 -1.51 0.00 0.00 179.97 180.10 1a5n h HIS 485 N 0.76 0.93 0.00 2.20 3.86 -1.31 -0.92 115.15 120.68 1a5n h HIS 485 Ca 0.20 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.43 1a5n h HIS 485 Cb 0.08 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.26 1a5n h HIS 485 CO -0.01 0.47 0.00 1.25 0.86 0.00 0.00 177.93 180.51 1a5n h HIS 486 N 0.92 0.00 -0.22 2.45 -0.00 -0.86 -2.98 115.15 114.46 1a5n h HIS 486 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.72 1a5n h HIS 486 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.57 1a5n h HIS 486 CO -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 177.93 177.89 1a5n s ARG 488 N -0.96 1.35 -0.01 0.00 1.70 -0.78 -3.60 118.95 116.65 1a5n s ARG 488 Ca 0.19 -1.56 0.08 0.00 -0.47 0.00 0.00 55.73 53.97 1a5n s ARG 488 Cb 0.11 -1.24 -0.02 0.00 -0.57 0.00 0.00 34.95 33.23 1a5n s ARG 488 CO 0.14 0.22 -0.26 -0.51 -1.08 0.00 0.00 175.30 173.82 1a5n s LEU 489 N -3.16 2.09 -0.24 -1.89 1.43 -1.26 -2.67 118.68 112.99 1a5n s LEU 489 Ca 0.21 -0.48 -0.03 0.00 -1.03 0.00 0.00 54.13 52.80 1a5n s LEU 489 Cb -0.02 -1.34 0.01 0.00 0.03 0.00 0.00 46.19 44.87 1a5n s LEU 489 CO 0.08 0.31 -0.05 -0.89 0.23 0.00 0.00 176.35 176.03 1a5n s THR 490 N -0.65 3.14 -0.09 5.49 2.01 -0.22 -1.57 115.64 123.76 1a5n s THR 490 Ca 0.10 -0.77 -0.25 0.00 0.31 0.00 0.00 61.69 61.08 1a5n s THR 490 Cb -0.10 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.86 1a5n s THR 490 CO -0.00 0.29 0.81 -0.36 -0.69 0.00 0.00 174.62 174.67 1a5n s PHE 491 N 1.40 3.54 0.32 4.92 0.08 0.03 -1.90 117.98 126.39 1a5n s PHE 491 Ca 0.03 1.35 0.09 0.00 0.12 0.00 0.00 56.93 58.52 1a5n s PHE 491 Cb -0.15 -2.94 -0.05 0.00 -0.57 0.00 0.00 43.02 39.30 1a5n s PHE 491 CO -0.04 -0.04 -0.03 -0.51 -0.10 0.00 0.00 175.22 174.50 1a5n s LEU 492 N 1.30 2.94 0.40 -0.37 1.43 0.38 -4.52 118.68 120.23 1a5n s LEU 492 Ca 0.41 -0.97 -0.13 0.00 -1.03 0.00 0.00 54.13 52.40 1a5n s LEU 492 Cb -0.18 -1.33 -0.08 0.00 0.03 0.00 0.00 46.19 44.63 1a5n s LEU 492 CO 0.18 -0.17 0.81 -0.94 0.23 0.00 0.00 176.35 176.46 1a5n s SER 493 N -3.68 6.63 0.38 2.29 1.04 -1.24 -2.11 113.70 117.02 1a5n s SER 493 Ca 0.34 1.28 0.13 0.00 0.48 0.00 0.00 55.95 58.18 1a5n s SER 493 Cb -0.01 -2.38 0.96 0.00 0.10 0.00 0.00 66.02 64.68 1a5n s SER 493 CO 0.19 -0.38 1.83 1.56 0.98 0.00 0.00 173.24 177.42 1a5n h GLN 494 N 1.50 0.53 -0.24 4.02 4.20 -1.82 -1.09 115.11 122.20 1a5n h GLN 494 Ca -0.47 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.14 1a5n h GLN 494 Cb 1.18 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.84 1a5n h GLN 494 CO 0.64 0.35 -0.10 0.00 -0.67 0.00 0.00 178.83 179.04 1a5n h ALA 495 N 1.61 0.34 -0.83 3.87 0.00 -1.87 -1.79 119.26 120.59 1a5n h ALA 495 Ca 0.50 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1a5n h ALA 495 Cb 1.05 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 1a5n h ALA 495 CO -0.24 0.18 0.41 0.00 0.00 0.00 0.00 179.25 179.61 1a5n h ALA 496 N 0.73 1.07 -0.50 0.00 0.00 -1.43 0.01 119.26 119.14 1a5n h ALA 496 Ca 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1a5n h ALA 496 Cb 0.59 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1a5n h ALA 496 CO 0.03 0.62 0.25 0.00 0.00 0.00 0.00 179.25 180.15 1a5n h ALA 497 N 1.22 0.65 -0.44 0.00 0.00 -1.17 -2.11 119.26 117.41 1a5n h ALA 497 Ca 0.29 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1a5n h ALA 497 Cb 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1a5n h ALA 497 CO -0.04 0.20 -0.09 0.00 0.00 0.00 0.00 179.25 179.33 1a5n h ALA 498 N 1.09 1.02 0.00 0.00 0.00 -0.75 -2.62 119.26 118.00 1a5n h ALA 498 Ca 0.17 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1a5n h ALA 498 Cb 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1a5n h ALA 498 CO -0.02 0.59 0.00 0.09 0.00 0.00 0.00 179.25 179.91 1a5n n ASN 499 N -4.18 0.00 -1.16 0.00 3.02 -0.06 -4.88 115.26 108.01 1a5n n ASN 499 Ca 0.02 -0.36 -0.08 0.00 -0.03 0.00 0.00 54.58 54.12 1a5n n ASN 499 Cb 0.35 -0.14 0.01 0.00 -0.61 0.00 0.00 39.78 39.38 1a5n n ASN 499 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a5n n GLY 500 N 0.47 0.17 0.36 7.41 0.00 -0.99 -4.94 105.19 107.68 1a5n n GLY 500 Ca 0.13 -0.48 -0.01 0.00 0.00 0.00 0.00 46.02 45.67 1a5n n GLY 500 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1a5n h VAL 501 N -0.36 1.18 -0.96 1.61 2.07 -1.60 -1.12 116.25 117.07 1a5n h VAL 501 Ca -0.19 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1a5n h VAL 501 Cb 1.14 -0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 1a5n h VAL 501 CO 0.21 0.22 0.61 0.00 0.02 0.00 0.00 177.57 178.64 1a5n h ALA 502 N 1.38 1.26 -0.06 1.67 0.00 -1.89 -0.54 119.26 121.07 1a5n h ALA 502 Ca 0.37 -0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.97 1a5n h ALA 502 Cb -0.03 -0.39 0.01 0.00 0.00 0.00 0.00 17.79 17.38 1a5n h ALA 502 CO -0.11 0.66 -0.88 0.93 0.00 0.00 0.00 179.25 179.85 1a5n h GLU 503 N 1.31 0.61 -0.35 0.00 3.07 -1.77 0.86 114.58 118.31 1a5n h GLU 503 Ca 0.35 -0.57 -0.06 0.00 -0.50 0.00 0.00 59.36 58.58 1a5n h GLU 503 Cb -0.11 0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.93 1a5n h GLU 503 CO -0.07 1.18 -0.00 -0.09 -1.40 0.00 0.00 179.01 178.63 1a5n h ARG 504 N 0.38 0.62 -0.00 2.33 2.43 -0.87 -2.81 114.38 116.46 1a5n h ARG 504 Ca -0.07 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 1a5n h ARG 504 Cb 1.50 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 31.00 1a5n h ARG 504 CO 0.17 0.74 -0.14 1.28 -1.51 0.00 0.00 179.97 180.50 1a5n n LEU 505 N -4.50 0.15 -3.38 3.80 4.77 -0.24 -4.93 117.00 112.66 1a5n n LEU 505 Ca -0.02 0.35 -0.17 0.00 -0.03 0.00 0.00 56.01 56.15 1a5n n LEU 505 Cb 0.27 -0.42 0.09 0.00 -2.33 0.00 0.00 43.42 41.03 1a5n n LEU 505 CO 0.40 0.04 0.10 -3.20 -1.33 0.00 0.00 177.39 173.39 1a5n n ASN 506 N -1.49 -2.63 -4.74 -1.43 2.85 -0.46 -4.94 115.26 102.44 1a5n n ASN 506 Ca 0.07 -0.62 -0.41 0.00 -0.11 0.00 0.00 54.58 53.50 1a5n n ASN 506 Cb 0.34 -5.09 -0.03 0.00 1.24 0.00 0.00 39.78 36.24 1a5n n ASN 506 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1a5n s LEU 507 N -6.19 4.43 0.10 1.20 1.02 0.17 -4.95 118.68 114.47 1a5n s LEU 507 Ca 0.06 2.26 0.23 0.00 0.02 0.00 0.00 54.13 56.70 1a5n s LEU 507 Cb -0.01 -3.60 -0.05 0.00 0.02 0.00 0.00 46.19 42.54 1a5n s LEU 507 CO 0.72 -0.43 0.92 0.54 0.02 0.00 0.00 176.35 178.12 1a5n n ARG 508 N 2.68 0.51 -2.16 1.70 3.00 -1.26 -4.87 116.66 116.25 1a5n n ARG 508 Ca 0.05 0.01 -0.26 0.00 -0.01 0.00 0.00 57.85 57.64 1a5n n ARG 508 Cb 0.44 -1.68 0.08 0.00 0.00 0.00 0.00 32.46 31.30 1a5n n ARG 508 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1a5n s SER 509 N -4.70 4.61 0.55 0.55 0.01 -1.26 -4.72 113.70 108.73 1a5n s SER 509 Ca -0.01 0.43 -0.20 0.00 1.31 0.00 0.00 55.95 57.49 1a5n s SER 509 Cb 0.12 -1.00 -0.05 0.00 0.21 0.00 0.00 66.02 65.30 1a5n s SER 509 CO 0.82 -1.75 1.16 0.00 0.41 0.00 0.00 173.24 173.88 1a5n s ALA 510 N -3.33 2.69 -0.02 1.44 0.00 -1.09 -4.86 121.76 116.59 1a5n s ALA 510 Ca 0.62 0.90 0.04 0.00 0.00 0.00 0.00 51.96 53.52 1a5n s ALA 510 Cb -0.10 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 1a5n s ALA 510 CO 0.46 -0.87 -0.14 0.42 0.00 0.00 0.00 175.76 175.63 1a5n s ILE 511 N -1.69 3.07 0.04 0.00 -1.09 -1.26 -1.06 121.20 119.22 1a5n s ILE 511 Ca 0.73 -0.83 0.03 0.00 -2.23 0.00 0.00 60.65 58.35 1a5n s ILE 511 Cb -0.26 -2.24 -0.02 0.00 -1.58 0.00 0.00 42.46 38.35 1a5n s ILE 511 CO 0.30 0.51 -0.10 0.00 -1.23 0.00 0.00 174.94 174.41 1a5n s ALA 512 N -0.81 0.84 -0.01 9.38 0.00 -0.80 -4.90 121.76 125.46 1a5n s ALA 512 Ca 0.13 -0.77 0.05 0.00 0.00 0.00 0.00 51.96 51.37 1a5n s ALA 512 Cb -0.11 -0.06 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 1a5n s ALA 512 CO 0.02 0.09 -0.15 0.08 0.00 0.00 0.00 175.76 175.80 1a5n s VAL 513 N -1.09 2.98 0.27 0.00 1.01 -1.26 -0.47 120.40 121.84 1a5n s VAL 513 Ca -0.04 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 60.91 1a5n s VAL 513 Cb -0.09 -2.20 -0.08 0.00 0.00 0.00 0.00 36.38 34.01 1a5n s VAL 513 CO 0.01 0.49 0.66 0.68 0.00 0.00 0.00 175.10 176.95 1a5n s VAL 514 N -0.81 4.76 -0.07 2.92 -7.23 -0.90 -4.92 120.40 114.16 1a5n s VAL 514 Ca 0.13 0.84 -0.30 0.00 -1.81 0.00 0.00 61.98 60.83 1a5n s VAL 514 Cb -0.11 -3.65 0.09 0.00 0.56 0.00 0.00 36.38 33.27 1a5n s VAL 514 CO 0.03 -0.07 0.77 -1.59 -0.31 0.00 0.00 175.10 173.93 1a5n s LYS 515 N -2.72 0.94 0.00 4.82 -2.85 -0.90 -4.42 119.74 114.60 1a5n s LYS 515 Ca 0.49 0.16 0.00 0.00 -1.00 0.00 0.00 55.97 55.63 1a5n s LYS 515 Cb -0.12 0.44 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 1a5n s LYS 515 CO 0.19 -0.31 0.00 0.41 0.10 0.00 0.00 175.35 175.74 1a5n n GLY 516 N 0.74 0.55 0.12 0.59 0.00 -1.26 -4.46 105.19 101.47 1a5n n GLY 516 Ca -0.16 -0.83 -0.14 0.00 0.00 0.00 0.00 46.02 44.88 1a5n n GLY 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5n h ARG 518 N 0.11 0.00 0.00 0.00 2.47 -1.90 -3.33 114.38 111.73 1a5n h ARG 518 Ca -0.11 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.61 1a5n h ARG 518 Cb 1.83 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.15 1a5n h ARG 518 CO 0.18 0.84 -0.34 1.79 0.56 0.00 0.00 179.97 183.00 1a5n h THR 519 N 0.00 0.00 -3.99 2.04 1.35 -1.99 -3.41 112.91 106.90 1a5n h THR 519 Ca -0.01 -0.52 -0.49 0.00 -0.55 0.00 0.00 66.41 64.85 1a5n h THR 519 Cb 1.61 1.29 0.04 0.00 -1.73 0.00 0.00 68.15 69.36 1a5n h THR 519 CO 0.11 0.00 0.44 0.68 -0.25 0.00 0.00 175.52 176.49 1a5n s VAL 520 N -3.14 3.49 0.24 6.82 -7.23 -1.25 -5.04 120.40 114.30 1a5n s VAL 520 Ca 0.08 1.10 -0.02 0.00 -1.81 0.00 0.00 61.98 61.34 1a5n s VAL 520 Cb 0.12 -3.55 -0.03 0.00 0.56 0.00 0.00 36.38 33.49 1a5n s VAL 520 CO 0.67 -0.03 0.25 0.00 -0.31 0.00 0.00 175.10 175.68 1a5n s GLN 521 N -2.67 1.43 0.39 4.82 -2.07 -1.26 -4.84 119.66 115.45 1a5n s GLN 521 Ca 0.61 -1.64 0.16 0.00 -1.82 0.00 0.00 55.36 52.67 1a5n s GLN 521 Cb -0.24 0.33 1.04 0.00 -1.09 0.00 0.00 33.01 33.06 1a5n s GLN 521 CO 0.29 -0.52 1.79 -0.22 -1.32 0.00 0.00 175.29 175.31 1a5n h LYS 522 N 2.42 0.44 0.00 9.60 1.63 -1.02 0.28 116.57 129.92 1a5n h LYS 522 Ca -0.32 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.46 1a5n h LYS 522 Cb 1.25 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 1a5n h LYS 522 CO 0.46 0.29 0.00 0.00 -3.45 0.00 0.00 179.45 176.75 1a5n h ALA 523 N 1.62 1.00 -0.00 5.00 0.00 -1.82 -2.25 119.26 122.81 1a5n h ALA 523 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1a5n h ALA 523 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1a5n h ALA 523 CO -0.29 0.00 -0.31 -0.25 0.00 0.00 0.00 179.25 178.40 1a5n n ASP 524 N -3.00 0.40 -4.62 0.00 8.00 0.09 -4.82 116.55 112.60 1a5n n ASP 524 Ca -0.01 -0.13 -0.43 0.00 0.71 0.00 0.00 54.79 54.93 1a5n n ASP 524 Cb 0.19 0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.28 1a5n n ASP 524 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1a5n s MET 525 N -2.91 3.75 -0.05 -1.24 -1.94 -0.84 -4.94 119.30 111.13 1a5n s MET 525 Ca 0.15 1.29 -0.32 0.00 -1.71 0.00 0.00 55.69 55.09 1a5n s MET 525 Cb 0.18 -3.98 -0.11 0.00 2.01 0.00 0.00 34.83 32.94 1a5n s MET 525 CO 0.62 -1.33 1.93 0.28 -0.01 0.00 0.00 175.02 176.51 1a5n n VAL 526 N 6.57 0.65 -0.73 -6.03 0.31 -1.26 -2.09 118.33 115.76 1a5n n VAL 526 Ca 0.17 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1a5n n VAL 526 Cb 0.47 -2.06 0.00 0.00 -0.91 0.00 0.00 33.84 31.33 1a5n n VAL 526 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1a5n n HIS 527 N 7.14 0.00 -3.19 3.52 8.25 -1.26 -4.80 115.22 124.88 1a5n n HIS 527 Ca 0.22 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.46 1a5n n HIS 527 Cb 0.34 -1.35 -0.05 0.00 1.12 0.00 0.00 29.99 30.05 1a5n n HIS 527 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1a5n n ASN 528 N -0.26 0.58 -0.28 0.41 3.02 -0.89 -4.67 115.26 113.16 1a5n n ASN 528 Ca 0.00 -2.85 0.02 0.00 -0.03 0.00 0.00 54.58 51.72 1a5n n ASN 528 Cb 0.13 -0.63 0.07 0.00 -0.61 0.00 0.00 39.78 38.74 1a5n n ASN 528 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1a5n n SER 529 N 0.91 2.37 -4.74 6.41 3.41 -1.16 -4.56 113.62 116.26 1a5n n SER 529 Ca 0.23 -1.97 -0.42 0.00 -0.26 0.00 0.00 58.87 56.46 1a5n n SER 529 Cb 0.58 -0.10 -0.02 0.00 -0.26 0.00 0.00 64.21 64.41 1a5n n SER 529 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1a5n s LEU 530 N -0.98 4.37 -0.45 1.04 2.96 -0.73 -4.64 118.68 120.25 1a5n s LEU 530 Ca 0.10 2.70 0.03 0.00 -0.22 0.00 0.00 54.13 56.74 1a5n s LEU 530 Cb 0.05 -3.62 0.12 0.00 0.50 0.00 0.00 46.19 43.25 1a5n s LEU 530 CO 0.07 -0.77 0.20 -1.10 -1.32 0.00 0.00 176.35 173.43 1a5n s GLN 531 N 0.01 1.67 0.38 1.98 -0.21 -1.26 -4.38 119.66 117.85 1a5n s GLN 531 Ca 0.63 -2.25 -0.13 0.00 0.02 0.00 0.00 55.36 53.63 1a5n s GLN 531 Cb -0.43 -3.04 -0.08 0.00 1.00 0.00 0.00 33.01 30.46 1a5n s GLN 531 CO 0.41 -1.07 0.78 -1.25 -2.12 0.00 0.00 175.29 172.04 1a5n s PRO 532 N 0.21 3.89 -1.21 2.91 0.04 -1.26 -4.96 135.00 134.62 1a5n s PRO 532 Ca 0.15 0.60 -0.18 0.00 0.04 0.00 0.00 61.00 61.62 1a5n s PRO 532 Cb -0.24 -2.38 0.10 0.00 0.04 0.00 0.00 34.50 32.03 1a5n s PRO 532 CO -0.03 0.01 1.57 1.21 0.04 0.00 0.00 177.00 179.80 1a5n s ASN 533 N -2.79 6.84 -0.12 6.66 2.47 -1.26 -4.42 114.94 122.32 1a5n s ASN 533 Ca 0.53 -2.42 -0.07 0.00 0.42 0.00 0.00 52.86 51.32 1a5n s ASN 533 Cb -0.10 -2.52 -0.04 0.00 -1.45 0.00 0.00 41.25 37.14 1a5n s ASN 533 CO 0.26 -1.10 0.15 -0.51 -3.72 0.00 0.00 177.10 172.18 1a5n s ILE 534 N 3.50 5.49 0.08 -5.21 2.07 -1.26 -1.11 121.20 124.76 1a5n s ILE 534 Ca 0.48 0.23 0.04 0.00 -1.41 0.00 0.00 60.65 59.99 1a5n s ILE 534 Cb 0.01 -3.41 -0.03 0.00 0.13 0.00 0.00 42.46 39.15 1a5n s ILE 534 CO 0.02 0.61 -0.11 0.42 -1.91 0.00 0.00 174.94 173.98 1a5n s THR 535 N -1.00 0.92 -0.07 4.00 -4.23 0.70 -4.88 115.64 111.07 1a5n s THR 535 Ca 0.15 -1.46 0.02 0.00 -1.18 0.00 0.00 61.69 59.22 1a5n s THR 535 Cb -0.12 -1.16 0.01 0.00 1.34 0.00 0.00 72.50 72.58 1a5n s THR 535 CO 0.04 -0.44 -0.12 -0.69 -0.54 0.00 0.00 174.62 172.88 1a5n s VAL 536 N -1.95 1.11 -0.32 2.29 1.01 -1.26 -0.84 120.40 120.45 1a5n s VAL 536 Ca 0.01 -0.45 -0.29 0.00 0.00 0.00 0.00 61.98 61.25 1a5n s VAL 536 Cb -0.06 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.29 1a5n s VAL 536 CO 0.01 0.35 1.31 -0.62 0.00 0.00 0.00 175.10 176.15 1a5n s ASP 537 N 0.79 6.64 0.48 3.32 -1.08 -0.22 -4.91 116.67 121.69 1a5n s ASP 537 Ca -0.12 1.14 0.30 0.00 -0.52 0.00 0.00 52.55 53.35 1a5n s ASP 537 Cb -0.15 -2.54 1.39 0.00 -1.46 0.00 0.00 42.92 40.16 1a5n s ASP 537 CO 0.02 -1.12 1.75 0.00 0.52 0.00 0.00 175.17 176.34 1a5n h ALA 538 N 9.43 2.81 0.00 3.66 0.00 -1.95 0.49 119.26 133.71 1a5n h ALA 538 Ca -0.26 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1a5n h ALA 538 Cb 1.10 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1a5n h ALA 538 CO 1.04 -1.24 -0.32 1.04 0.00 0.00 0.00 179.25 179.78 1a5n n GLN 539 N -4.39 0.23 0.06 0.00 6.02 -1.26 -4.57 117.38 113.46 1a5n n GLN 539 Ca 0.29 0.29 0.11 0.00 -0.01 0.00 0.00 57.00 57.68 1a5n n GLN 539 Cb 1.21 -1.12 0.43 0.00 1.02 0.00 0.00 30.24 31.78 1a5n n GLN 539 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1a5n n THR 540 N -3.40 0.72 -1.05 5.09 -2.24 -1.21 -4.90 114.28 107.29 1a5n n THR 540 Ca -0.04 0.13 -0.02 0.00 -2.27 0.00 0.00 64.05 61.85 1a5n n THR 540 Cb 0.16 -0.91 -0.01 0.00 -2.10 0.00 0.00 70.33 67.48 1a5n n THR 540 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1a5n n TYR 541 N -1.84 0.00 -2.11 4.78 4.01 0.17 -4.95 117.16 117.23 1a5n n TYR 541 Ca 0.04 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.37 1a5n n TYR 541 Cb 0.25 -1.59 -0.02 0.00 -0.31 0.00 0.00 39.34 37.67 1a5n n TYR 541 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1a5n s GLU 542 N -1.66 4.34 -0.20 -0.72 2.02 -1.26 -4.39 118.70 116.83 1a5n s GLU 542 Ca 0.00 2.21 -0.11 0.00 0.02 0.00 0.00 54.97 57.09 1a5n s GLU 542 Cb 0.00 -3.11 -0.05 0.00 0.10 0.00 0.00 34.13 31.07 1a5n s GLU 542 CO 0.00 -0.27 0.18 0.08 0.02 0.00 0.00 175.26 175.27 1a5n s VAL 543 N -0.51 5.38 -0.02 2.63 1.01 -1.26 -1.05 120.40 126.57 1a5n s VAL 543 Ca 0.54 0.29 0.03 0.00 0.00 0.00 0.00 61.98 62.83 1a5n s VAL 543 Cb -0.40 -3.52 -0.00 0.00 0.00 0.00 0.00 36.38 32.47 1a5n s VAL 543 CO 0.47 0.41 -0.09 -0.13 0.00 0.00 0.00 175.10 175.76 1a5n s ARG 544 N 0.49 0.85 -0.21 2.72 0.52 -0.02 -1.70 118.95 121.60 1a5n s ARG 544 Ca 0.10 -0.30 0.00 0.00 -0.52 0.00 0.00 55.73 55.01 1a5n s ARG 544 Cb -0.12 -0.81 0.02 0.00 0.52 0.00 0.00 34.95 34.56 1a5n s ARG 544 CO 0.00 0.14 -0.14 0.08 0.02 0.00 0.00 175.30 175.40 1a5n s VAL 545 N 0.06 2.40 -1.76 3.52 1.01 -0.08 -0.22 120.40 125.33 1a5n s VAL 545 Ca -0.01 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 61.00 1a5n s VAL 545 Cb -0.07 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.20 1a5n s VAL 545 CO 0.00 0.40 0.00 0.47 0.00 0.00 0.00 175.10 175.97 1a5n n ASP 546 N 4.63 -5.85 0.00 3.32 8.00 -0.26 -1.57 116.55 124.82 1a5n n ASP 546 Ca -0.19 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.30 1a5n n ASP 546 Cb 0.49 -4.87 0.00 0.00 -0.02 0.00 0.00 41.12 36.72 1a5n n ASP 546 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a5n n GLY 547 N -1.01 2.76 3.76 0.44 0.00 -1.26 -5.01 105.19 104.87 1a5n n GLY 547 Ca -0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 1a5n n GLY 547 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1a5n s GLU 548 N -0.04 4.55 0.15 1.61 -1.05 -0.61 -4.94 118.70 118.37 1a5n s GLU 548 Ca 0.00 1.81 -0.30 0.00 -0.15 0.00 0.00 54.97 56.33 1a5n s GLU 548 Cb 0.00 -3.10 -0.07 0.00 -0.44 0.00 0.00 34.13 30.52 1a5n s GLU 548 CO 0.00 0.13 1.07 -1.17 0.95 0.00 0.00 175.26 176.24 1a5n s LEU 549 N -1.62 4.48 -0.16 1.83 2.96 -1.26 -0.90 118.68 124.01 1a5n s LEU 549 Ca 0.46 2.01 -0.05 0.00 -0.22 0.00 0.00 54.13 56.34 1a5n s LEU 549 Cb -0.32 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 42.74 1a5n s LEU 549 CO 0.41 -0.20 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.61 1a5n s ILE 550 N -0.10 4.19 0.06 6.68 -1.09 -0.69 -4.92 121.20 125.33 1a5n s ILE 550 Ca 0.49 -0.26 -0.28 0.00 -2.23 0.00 0.00 60.65 58.38 1a5n s ILE 550 Cb -0.28 -2.84 0.10 0.00 -1.58 0.00 0.00 42.46 37.85 1a5n s ILE 550 CO 0.33 0.49 1.15 0.28 -1.23 0.00 0.00 174.94 175.97 1a5n s THR 551 N 0.25 0.00 0.22 2.92 -1.32 -1.26 -4.53 115.64 111.92 1a5n s THR 551 Ca -0.01 -0.41 -0.19 0.00 -1.21 0.00 0.00 61.69 59.88 1a5n s THR 551 Cb -0.13 -2.10 0.03 0.00 -1.51 0.00 0.00 72.50 68.79 1a5n s THR 551 CO 0.02 0.00 0.58 -0.94 -2.21 0.00 0.00 174.62 172.07 1a5n s SER 552 N -3.03 -0.28 0.03 8.08 1.04 -1.26 -4.88 113.70 113.40 1a5n s SER 552 Ca 0.15 -0.50 -0.06 0.00 0.48 0.00 0.00 55.95 56.02 1a5n s SER 552 Cb 0.02 0.62 -0.05 0.00 0.10 0.00 0.00 66.02 66.71 1a5n s SER 552 CO -0.01 -1.13 0.28 -1.61 0.98 0.00 0.00 173.24 171.75 1a5n s GLU 553 N -3.88 3.58 0.07 4.02 0.41 -1.26 -4.89 118.70 116.75 1a5n s GLU 553 Ca 0.10 -0.10 -0.31 0.00 -0.41 0.00 0.00 54.97 54.25 1a5n s GLU 553 Cb -0.02 -3.04 -0.06 0.00 -1.78 0.00 0.00 34.13 29.22 1a5n s GLU 553 CO -0.00 0.62 1.27 -1.25 -0.49 0.00 0.00 175.26 175.40 1a5n s PRO 554 N -1.95 4.39 0.25 0.39 0.04 -1.26 -4.86 135.00 131.99 1a5n s PRO 554 Ca 0.30 1.87 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 1a5n s PRO 554 Cb -0.13 -3.34 -0.09 0.00 0.04 0.00 0.00 34.50 30.98 1a5n s PRO 554 CO 0.18 -0.34 1.04 0.00 0.04 0.00 0.00 177.00 177.93 1a5n s ALA 555 N 1.19 3.38 -0.11 8.56 0.00 -0.45 -4.56 121.76 129.78 1a5n s ALA 555 Ca 0.61 0.78 0.16 0.00 0.00 0.00 0.00 51.96 53.51 1a5n s ALA 555 Cb -0.32 -3.29 -0.20 0.00 0.00 0.00 0.00 23.12 19.31 1a5n s ALA 555 CO 0.29 -0.03 0.60 -0.40 0.00 0.00 0.00 175.76 176.21 1a5n n ASP 556 N 1.48 0.64 -3.90 0.00 5.75 -1.26 -1.13 116.55 118.13 1a5n n ASP 556 Ca -0.01 0.29 -0.11 0.00 -0.01 0.00 0.00 54.79 54.96 1a5n n ASP 556 Cb 0.46 0.36 -0.12 0.00 -1.03 0.00 0.00 41.12 40.78 1a5n n ASP 556 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1a5n s VAL 557 N -2.76 0.05 0.11 2.12 1.01 -1.26 -4.91 120.40 114.75 1a5n s VAL 557 Ca -0.05 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.60 1a5n s VAL 557 Cb 0.08 -0.15 -0.04 0.00 0.00 0.00 0.00 36.38 36.27 1a5n s VAL 557 CO 0.83 -0.20 -0.12 -0.76 0.00 0.00 0.00 175.10 174.84 1a5n s LEU 558 N -0.61 2.41 0.00 3.92 1.43 -1.26 -5.14 118.68 119.43 1a5n s LEU 558 Ca -0.07 -0.81 -0.15 0.00 -1.03 0.00 0.00 54.13 52.07 1a5n s LEU 558 Cb -0.04 -0.43 0.22 0.00 0.03 0.00 0.00 46.19 45.97 1a5n s LEU 558 CO -0.00 -0.20 1.31 -2.65 0.23 0.00 0.00 176.35 175.04 1a5n n PRO 559 N 0.53 -1.20 -3.56 1.29 -0.02 -1.26 -4.10 135.00 126.69 1a5n n PRO 559 Ca -0.16 -2.15 -0.26 0.00 -2.02 0.00 0.00 63.50 58.91 1a5n n PRO 559 Cb 0.57 -1.32 0.01 0.00 -0.02 0.00 0.00 33.50 32.75 1a5n n PRO 559 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1a5n n MET 560 N -3.76 -4.27 0.00 -0.52 2.81 -1.26 -4.88 117.12 105.25 1a5n n MET 560 Ca 0.17 0.57 0.00 0.00 -1.81 0.00 0.00 57.70 56.62 1a5n n MET 560 Cb 0.59 -5.36 0.00 0.00 -0.71 0.00 0.00 33.22 27.74 1a5n n MET 560 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1a5n n ALA 561 N -3.96 0.00 0.17 3.04 0.00 -1.26 -4.94 120.51 113.57 1a5n n ALA 561 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 1a5n n ALA 561 Cb 0.54 0.00 0.60 0.00 0.00 0.00 0.00 19.45 20.60 1a5n n ALA 561 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1a5n h GLN 562 N 0.00 0.00 0.00 0.00 4.20 -1.90 -1.84 115.11 115.57 1a5n h GLN 562 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1a5n h GLN 562 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1a5n h GLN 562 CO 0.00 0.00 -0.07 -0.09 -0.67 0.00 0.00 178.83 178.00 1a5n h ARG 563 N 0.00 0.00 0.00 1.46 2.43 -1.93 -3.37 114.38 112.97 1a5n h ARG 563 Ca 0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1a5n h ARG 563 Cb 0.04 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1a5n h ARG 563 CO 0.00 0.00 -1.58 0.66 -1.51 0.00 0.00 179.97 177.54 1a5n n TYR 564 N -2.85 0.00 -3.85 2.20 4.01 -0.70 -5.04 117.16 110.93 1a5n n TYR 564 Ca 0.04 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.42 1a5n n TYR 564 Cb 0.50 -0.38 -0.06 0.00 -0.31 0.00 0.00 39.34 39.10 1a5n n TYR 564 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1a5n s PHE 565 N -2.42 3.60 -0.11 -0.72 0.08 -1.14 -4.99 117.98 112.28 1a5n s PHE 565 Ca -0.04 0.55 0.22 0.00 0.12 0.00 0.00 56.93 57.78 1a5n s PHE 565 Cb 0.04 -1.96 0.54 0.00 -0.57 0.00 0.00 43.02 41.08 1a5n s PHE 565 CO 0.40 0.72 1.67 1.25 -0.10 0.00 0.00 175.22 179.16 1a5n h LEU 566 N 4.81 0.00 -0.03 -0.37 5.85 -1.94 -3.46 115.31 120.17 1a5n h LEU 566 Ca -0.54 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.18 1a5n h LEU 566 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1a5n h LEU 566 CO 0.60 0.23 0.00 0.49 -0.34 0.00 0.00 178.44 179.42