#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nbw s LEU 3 N 0.00 3.53 0.03 1.53 2.96 -1.26 -4.24 118.68 121.23 1nbw s LEU 3 Ca 0.00 0.19 -0.01 0.00 -0.22 0.00 0.00 54.13 54.10 1nbw s LEU 3 Cb 0.00 -3.26 -0.04 0.00 0.50 0.00 0.00 46.19 43.39 1nbw s LEU 3 CO 0.00 -1.41 0.17 -0.63 -1.32 0.00 0.00 176.35 173.16 1nbw s ILE 4 N 4.77 5.22 -0.04 6.68 1.01 0.08 -0.77 121.20 138.15 1nbw s ILE 4 Ca 0.44 -0.35 -0.00 0.00 0.00 0.00 0.00 60.65 60.74 1nbw s ILE 4 Cb -0.07 -3.48 0.03 0.00 0.01 0.00 0.00 42.46 38.94 1nbw s ILE 4 CO 0.27 0.23 -0.00 0.00 0.00 0.00 0.00 174.94 175.44 1nbw s ALA 5 N -1.39 0.48 -0.27 9.38 0.00 -0.81 -1.66 121.76 127.49 1nbw s ALA 5 Ca 0.30 0.05 -0.14 0.00 0.00 0.00 0.00 51.96 52.17 1nbw s ALA 5 Cb -0.13 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 1nbw s ALA 5 CO 0.22 -0.19 0.32 0.20 0.00 0.00 0.00 175.76 176.31 1nbw s GLY 6 N 1.31 1.91 -0.17 0.00 0.00 0.71 -0.62 107.32 110.46 1nbw s GLY 6 Ca -0.05 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 43.79 1nbw s GLY 6 CO -0.02 0.86 -0.17 -0.42 0.00 0.00 0.00 173.10 173.35 1nbw s ILE 7 N 1.92 2.40 -0.30 0.90 1.01 0.64 -1.39 121.20 126.38 1nbw s ILE 7 Ca 0.13 -0.85 -0.02 0.00 0.00 0.00 0.00 60.65 59.92 1nbw s ILE 7 Cb -0.16 -2.01 0.05 0.00 0.01 0.00 0.00 42.46 40.36 1nbw s ILE 7 CO 0.10 0.52 0.01 -0.62 0.00 0.00 0.00 174.94 174.95 1nbw s ASP 8 N 1.03 4.90 -0.98 3.58 2.15 0.52 -1.03 116.67 126.85 1nbw s ASP 8 Ca -0.01 -1.32 -0.16 0.00 0.43 0.00 0.00 52.55 51.49 1nbw s ASP 8 Cb -0.15 -1.71 0.17 0.00 -0.30 0.00 0.00 42.92 40.93 1nbw s ASP 8 CO -0.05 -0.27 1.11 -0.63 -0.17 0.00 0.00 175.17 175.15 1nbw s ILE 9 N 1.24 5.08 0.78 4.11 1.01 -0.18 -0.34 121.20 132.91 1nbw s ILE 9 Ca -0.04 -2.13 -0.10 0.00 0.00 0.00 0.00 60.65 58.38 1nbw s ILE 9 Cb -0.20 -4.72 0.08 0.00 0.01 0.00 0.00 42.46 37.63 1nbw s ILE 9 CO -0.01 -1.40 1.13 -0.83 0.00 0.00 0.00 174.94 173.82 1nbw s GLY 10 N 2.97 1.65 0.49 6.18 0.00 0.11 -2.25 107.32 116.47 1nbw s GLY 10 Ca 0.31 -0.82 0.15 0.00 0.00 0.00 0.00 44.72 44.36 1nbw s GLY 10 CO -0.07 -0.34 2.10 3.43 0.00 0.00 0.00 173.10 178.22 1nbw h ASN 11 N -0.92 0.03 0.00 1.64 2.35 -1.92 -3.33 115.58 113.42 1nbw h ASN 11 Ca -0.45 -0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.14 1nbw h ASN 11 Cb 1.32 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 39.65 1nbw h ASN 11 CO 0.61 0.07 -1.55 0.00 -1.65 0.00 0.00 177.43 174.91 1nbw n ALA 12 N -2.53 2.02 -2.52 -0.83 0.00 -1.26 -4.87 120.51 110.52 1nbw n ALA 12 Ca -0.03 -0.40 -0.19 0.00 0.00 0.00 0.00 53.44 52.82 1nbw n ALA 12 Cb 0.13 0.32 -0.11 0.00 0.00 0.00 0.00 19.45 19.78 1nbw n ALA 12 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1nbw s THR 13 N -2.19 1.40 -0.19 0.00 -4.23 -1.25 -1.57 115.64 107.62 1nbw s THR 13 Ca -0.13 -1.67 -0.01 0.00 -1.18 0.00 0.00 61.69 58.69 1nbw s THR 13 Cb 0.04 -1.51 -0.00 0.00 1.34 0.00 0.00 72.50 72.37 1nbw s THR 13 CO 0.20 -0.34 -0.11 -0.89 -0.54 0.00 0.00 174.62 172.94 1nbw s THR 14 N -1.92 2.89 0.12 3.99 2.01 -0.48 0.10 115.64 122.35 1nbw s THR 14 Ca 0.08 -0.67 0.09 0.00 0.31 0.00 0.00 61.69 61.50 1nbw s THR 14 Cb -0.06 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 1nbw s THR 14 CO 0.03 0.48 -0.22 -1.61 -0.69 0.00 0.00 174.62 172.62 1nbw s GLU 15 N 1.15 1.22 -0.01 4.92 2.02 0.54 -2.28 118.70 126.26 1nbw s GLU 15 Ca 0.01 -1.25 0.04 0.00 0.02 0.00 0.00 54.97 53.79 1nbw s GLU 15 Cb -0.14 -1.51 -0.01 0.00 0.10 0.00 0.00 34.13 32.56 1nbw s GLU 15 CO -0.04 0.35 -0.13 0.08 0.02 0.00 0.00 175.26 175.54 1nbw s VAL 16 N -1.28 1.04 -0.19 2.63 1.01 -0.25 -0.35 120.40 123.01 1nbw s VAL 16 Ca 0.10 -0.60 -0.00 0.00 0.00 0.00 0.00 61.98 61.47 1nbw s VAL 16 Cb -0.09 -0.88 0.05 0.00 0.00 0.00 0.00 36.38 35.46 1nbw s VAL 16 CO 0.05 0.26 -0.04 0.00 0.00 0.00 0.00 175.10 175.37 1nbw s ALA 17 N -0.36 1.59 -0.09 5.51 0.00 -0.48 -1.33 121.76 126.59 1nbw s ALA 17 Ca 0.05 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 51.05 1nbw s ALA 17 Cb -0.05 -1.23 -0.01 0.00 0.00 0.00 0.00 23.12 21.83 1nbw s ALA 17 CO -0.00 -0.96 -0.21 -1.17 0.00 0.00 0.00 175.76 173.42 1nbw s LEU 18 N 1.58 2.27 0.18 0.00 2.96 0.45 -0.21 118.68 125.92 1nbw s LEU 18 Ca -0.02 -0.47 -0.20 0.00 -0.22 0.00 0.00 54.13 53.23 1nbw s LEU 18 Cb -0.17 -1.46 0.05 0.00 0.50 0.00 0.00 46.19 45.11 1nbw s LEU 18 CO -0.07 0.20 0.56 0.00 -1.32 0.00 0.00 176.35 175.72 1nbw s ALA 19 N 0.12 -1.26 -0.42 5.97 0.00 -0.67 -0.32 121.76 125.18 1nbw s ALA 19 Ca -0.10 0.10 0.02 0.00 0.00 0.00 0.00 51.96 51.98 1nbw s ALA 19 Cb -0.16 0.84 0.13 0.00 0.00 0.00 0.00 23.12 23.93 1nbw s ALA 19 CO 0.06 -0.79 0.20 0.45 0.00 0.00 0.00 175.76 175.68 1nbw s SER 20 N -2.82 3.92 0.60 0.00 0.15 -1.26 -0.75 113.70 113.55 1nbw s SER 20 Ca 0.05 -2.50 -0.15 0.00 0.70 0.00 0.00 55.95 54.05 1nbw s SER 20 Cb -0.01 -1.17 -0.04 0.00 -1.71 0.00 0.00 66.02 63.10 1nbw s SER 20 CO -0.07 -0.29 1.04 -0.62 1.20 0.00 0.00 173.24 174.50 1nbw s ASP 21 N 0.48 5.88 0.05 5.45 -1.08 -1.26 -4.81 116.67 121.38 1nbw s ASP 21 Ca 0.16 1.72 -0.08 0.00 -0.52 0.00 0.00 52.55 53.83 1nbw s ASP 21 Cb -0.23 -2.52 -0.00 0.00 -1.46 0.00 0.00 42.92 38.71 1nbw s ASP 21 CO -0.04 -1.10 0.16 -0.31 0.52 0.00 0.00 175.17 174.40 1nbw s TYR 22 N -2.62 0.13 1.06 -5.34 1.51 -1.26 -4.63 117.35 106.20 1nbw s TYR 22 Ca 0.61 -0.42 -0.15 0.00 -1.01 0.00 0.00 57.07 56.11 1nbw s TYR 22 Cb -0.14 -0.08 0.22 0.00 -0.11 0.00 0.00 41.96 41.85 1nbw s TYR 22 CO 0.40 -0.43 1.11 -2.14 -1.11 0.00 0.00 175.55 173.38 1nbw s PRO 23 N -2.83 -0.09 -0.49 -1.71 0.02 -1.26 -3.46 135.00 125.18 1nbw s PRO 23 Ca -0.03 0.24 -0.06 0.00 0.02 0.00 0.00 61.00 61.16 1nbw s PRO 23 Cb 0.00 -1.70 0.06 0.00 0.02 0.00 0.00 34.50 32.88 1nbw s PRO 23 CO -0.05 -3.02 0.16 1.04 -0.33 0.00 0.00 177.00 174.79 1nbw n GLN 24 N -4.33 -1.90 -3.63 5.54 6.02 -1.26 -4.84 117.38 112.98 1nbw n GLN 24 Ca 0.08 0.04 -0.04 0.00 -0.01 0.00 0.00 57.00 57.06 1nbw n GLN 24 Cb 0.58 -3.42 -0.06 0.00 1.02 0.00 0.00 30.24 28.37 1nbw n GLN 24 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1nbw s ALA 25 N -1.91 -2.00 -0.50 -1.58 0.00 -1.22 -5.12 121.76 109.43 1nbw s ALA 25 Ca 0.22 2.37 -0.23 0.00 0.00 0.00 0.00 51.96 54.32 1nbw s ALA 25 Cb -0.13 -1.58 0.03 0.00 0.00 0.00 0.00 23.12 21.44 1nbw s ALA 25 CO 0.27 -0.57 0.85 1.03 0.00 0.00 0.00 175.76 177.33 1nbw s ARG 26 N 2.04 3.37 0.36 0.00 1.81 -1.26 -4.21 118.95 121.05 1nbw s ARG 26 Ca -0.08 -0.21 -0.25 0.00 -1.72 0.00 0.00 55.73 53.47 1nbw s ARG 26 Cb -0.07 -4.00 -0.09 0.00 -0.45 0.00 0.00 34.95 30.34 1nbw s ARG 26 CO -0.19 -1.28 1.01 0.00 -0.68 0.00 0.00 175.30 174.15 1nbw s ALA 27 N 3.54 3.16 0.40 2.13 0.00 -1.26 -5.04 121.76 124.69 1nbw s ALA 27 Ca 0.30 0.63 -0.24 0.00 0.00 0.00 0.00 51.96 52.65 1nbw s ALA 27 Cb -0.13 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 1nbw s ALA 27 CO 0.21 -0.04 1.03 -0.06 0.00 0.00 0.00 175.76 176.90 1nbw s PHE 28 N -1.62 3.30 -0.11 0.00 0.40 -1.26 -4.98 117.98 113.70 1nbw s PHE 28 Ca 0.54 1.65 -0.02 0.00 -0.60 0.00 0.00 56.93 58.50 1nbw s PHE 28 Cb -0.21 -3.08 -0.03 0.00 0.51 0.00 0.00 43.02 40.21 1nbw s PHE 28 CO 0.27 -0.51 -0.04 0.08 0.70 0.00 0.00 175.22 175.71 1nbw s VAL 29 N -1.72 3.89 -0.21 -0.44 1.01 -1.26 -4.58 120.40 117.09 1nbw s VAL 29 Ca 0.58 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 62.10 1nbw s VAL 29 Cb -0.20 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 1nbw s VAL 29 CO 0.25 0.56 0.06 0.00 0.00 0.00 0.00 175.10 175.98 1nbw s ALA 30 N -0.34 3.29 0.20 5.51 0.00 0.56 -4.92 121.76 126.05 1nbw s ALA 30 Ca 0.05 -0.92 0.09 0.00 0.00 0.00 0.00 51.96 51.19 1nbw s ALA 30 Cb -0.12 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 1nbw s ALA 30 CO 0.02 -0.11 -0.08 -1.54 0.00 0.00 0.00 175.76 174.05 1nbw s SER 31 N 0.92 4.29 0.04 0.00 1.04 -1.26 -0.41 113.70 118.32 1nbw s SER 31 Ca 0.04 -0.60 0.02 0.00 0.48 0.00 0.00 55.95 55.89 1nbw s SER 31 Cb -0.14 -0.74 -0.02 0.00 0.10 0.00 0.00 66.02 65.22 1nbw s SER 31 CO 0.03 0.09 -0.07 -0.83 0.98 0.00 0.00 173.24 173.44 1nbw s GLY 32 N -2.98 0.44 -0.24 7.32 0.00 -0.44 -4.23 107.32 107.19 1nbw s GLY 32 Ca 0.26 -0.73 -0.12 0.00 0.00 0.00 0.00 44.72 44.13 1nbw s GLY 32 CO 0.16 -0.79 0.56 -1.50 0.00 0.00 0.00 173.10 171.53 1nbw s ILE 33 N -1.43 -0.26 0.20 0.90 2.07 -1.26 -1.09 121.20 120.34 1nbw s ILE 33 Ca -0.11 0.05 -0.01 0.00 -1.41 0.00 0.00 60.65 59.17 1nbw s ILE 33 Cb -0.10 -0.83 -0.04 0.00 0.13 0.00 0.00 42.46 41.62 1nbw s ILE 33 CO -0.00 0.02 0.13 0.68 -1.91 0.00 0.00 174.94 173.86 1nbw s VAL 34 N 1.90 0.02 0.09 4.00 -7.23 -0.97 -4.97 120.40 113.25 1nbw s VAL 34 Ca -0.08 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.79 1nbw s VAL 34 Cb -0.08 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.30 1nbw s VAL 34 CO -0.17 0.00 1.03 0.00 -0.31 0.00 0.00 175.10 175.65 1nbw s ALA 35 N -4.14 3.27 -0.19 1.32 0.00 -1.26 -1.39 121.76 119.37 1nbw s ALA 35 Ca 0.39 0.66 -0.37 0.00 0.00 0.00 0.00 51.96 52.63 1nbw s ALA 35 Cb 0.07 -3.33 -0.14 0.00 0.00 0.00 0.00 23.12 19.72 1nbw s ALA 35 CO 0.12 -0.16 1.80 2.41 0.00 0.00 0.00 175.76 179.93 1nbw n THR 36 N 3.08 0.43 -3.03 0.00 -1.04 -0.61 -4.73 114.28 108.38 1nbw n THR 36 Ca 0.04 -0.08 -0.39 0.00 -2.04 0.00 0.00 64.05 61.58 1nbw n THR 36 Cb 0.49 -1.52 -0.06 0.00 -1.82 0.00 0.00 70.33 67.42 1nbw n THR 36 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1nbw s THR 37 N 3.75 4.48 0.00 12.58 -4.23 -1.26 -4.94 115.64 126.02 1nbw s THR 37 Ca 0.96 1.61 0.00 0.00 -1.18 0.00 0.00 61.69 63.08 1nbw s THR 37 Cb -0.90 -4.10 0.00 0.00 1.34 0.00 0.00 72.50 68.85 1nbw s THR 37 CO 0.59 0.51 0.00 0.61 -0.54 0.00 0.00 174.62 175.79 1nbw n GLY 38 N 1.73 -1.22 3.63 3.99 0.00 -1.26 -2.97 105.19 109.08 1nbw n GLY 38 Ca -0.06 -1.21 -0.43 0.00 0.00 0.00 0.00 46.02 44.32 1nbw n GLY 38 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1nbw s MET 39 N 0.00 4.06 0.12 1.61 1.75 -1.26 -4.92 119.30 120.66 1nbw s MET 39 Ca 0.00 0.97 -0.35 0.00 -1.25 0.00 0.00 55.69 55.06 1nbw s MET 39 Cb 0.00 -3.72 -0.16 0.00 2.84 0.00 0.00 34.83 33.79 1nbw s MET 39 CO 0.00 -0.80 1.31 0.36 -0.65 0.00 0.00 175.02 175.24 1nbw n LYS 40 N 6.60 1.22 0.00 4.11 0.00 -1.26 -2.29 118.16 126.54 1nbw n LYS 40 Ca 0.10 0.44 0.00 0.00 -0.00 0.00 0.00 58.31 58.85 1nbw n LYS 40 Cb 0.47 -2.05 0.00 0.00 -0.00 0.00 0.00 35.03 33.45 1nbw n LYS 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1nbw n GLY 41 N 2.42 0.27 3.70 2.58 0.00 -1.26 -4.95 105.19 107.95 1nbw n GLY 41 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 1nbw n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nbw s THR 42 N -2.00 2.91 0.64 2.61 -4.23 -0.97 -4.82 115.64 109.77 1nbw s THR 42 Ca 0.00 -1.79 0.26 0.00 -1.18 0.00 0.00 61.69 58.98 1nbw s THR 42 Cb 0.00 -2.92 0.26 0.00 1.34 0.00 0.00 72.50 71.18 1nbw s THR 42 CO 0.00 -0.19 1.78 0.08 -0.54 0.00 0.00 174.62 175.75 1nbw h ARG 43 N 1.64 0.00 0.00 3.99 0.11 -1.98 0.28 114.38 118.42 1nbw h ARG 43 Ca -0.43 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.64 1nbw h ARG 43 Cb 1.25 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.33 1nbw h ARG 43 CO 0.64 0.00 -0.03 -0.44 0.10 0.00 0.00 179.97 180.24 1nbw h ASP 44 N 0.00 0.00 1.06 0.08 5.19 -1.85 -1.47 116.42 119.43 1nbw h ASP 44 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1nbw h ASP 44 Cb 0.83 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.34 1nbw h ASP 44 CO 0.00 0.03 0.00 0.59 -3.12 0.00 0.00 179.24 176.74 1nbw n ASN 45 N -3.87 0.75 0.22 6.45 5.03 0.98 -3.21 115.26 121.62 1nbw n ASN 45 Ca -0.03 0.63 0.07 0.00 0.87 0.00 0.00 54.58 56.12 1nbw n ASN 45 Cb 0.12 -0.81 0.51 0.00 -1.02 0.00 0.00 39.78 38.57 1nbw n ASN 45 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 1nbw h ILE 46 N 0.00 0.94 0.02 2.41 2.04 -1.44 -2.59 117.51 118.89 1nbw h ILE 46 Ca 0.00 -0.94 -0.00 0.00 1.00 0.00 0.00 64.86 64.92 1nbw h ILE 46 Cb 0.53 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 1nbw h ILE 46 CO 0.00 0.25 -0.01 0.00 0.00 0.00 0.00 178.15 178.38 1nbw h ALA 47 N 1.75 -0.03 -0.10 1.87 0.00 -1.73 -1.24 119.26 119.78 1nbw h ALA 47 Ca -0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1nbw h ALA 47 Cb 0.52 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1nbw h ALA 47 CO 0.03 -0.47 -0.32 0.78 0.00 0.00 0.00 179.25 179.27 1nbw h GLY 48 N -0.12 0.21 0.92 0.00 0.00 -1.74 -1.87 103.07 100.48 1nbw h GLY 48 Ca -0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 1nbw h GLY 48 CO 0.01 0.16 0.05 -0.84 0.00 0.00 0.00 176.54 175.91 1nbw h THR 49 N 0.17 1.09 -0.67 4.70 2.02 -1.16 0.85 112.91 119.90 1nbw h THR 49 Ca 0.02 -0.26 -0.08 0.00 0.77 0.00 0.00 66.41 66.86 1nbw h THR 49 Cb 0.66 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 68.15 1nbw h THR 49 CO 0.05 0.08 0.11 -0.07 0.37 0.00 0.00 175.52 176.05 1nbw h LEU 50 N 0.05 1.08 -0.80 2.58 4.07 -1.06 -0.84 115.31 120.38 1nbw h LEU 50 Ca 0.03 -0.26 -0.11 0.00 0.08 0.00 0.00 57.88 57.62 1nbw h LEU 50 Cb 0.09 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 41.53 1nbw h LEU 50 CO -0.00 1.07 -0.25 0.00 -1.08 0.00 0.00 178.44 178.17 1nbw h ALA 51 N 1.05 0.98 -0.33 1.53 0.00 -1.20 0.42 119.26 121.71 1nbw h ALA 51 Ca 0.20 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 1nbw h ALA 51 Cb 0.45 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1nbw h ALA 51 CO 0.01 0.60 -0.17 0.00 0.00 0.00 0.00 179.25 179.69 1nbw h ALA 52 N 1.18 0.46 0.20 0.00 0.00 -0.53 -1.02 119.26 119.55 1nbw h ALA 52 Ca 0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1nbw h ALA 52 Cb 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1nbw h ALA 52 CO 0.06 0.39 -0.09 -0.07 0.00 0.00 0.00 179.25 179.53 1nbw h LEU 53 N 0.47 -0.22 -0.80 0.00 3.38 -0.90 -2.08 115.31 115.15 1nbw h LEU 53 Ca 0.07 -0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.08 1nbw h LEU 53 Cb 0.71 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.44 1nbw h LEU 53 CO 0.05 -0.07 0.44 -0.33 0.09 0.00 0.00 178.44 178.61 1nbw h GLU 54 N -0.36 0.70 -0.87 1.13 4.39 -0.93 0.24 114.58 118.88 1nbw h GLU 54 Ca -0.03 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1nbw h GLU 54 Cb 0.28 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.73 1nbw h GLU 54 CO 0.04 0.46 0.56 0.37 -1.16 0.00 0.00 179.01 179.29 1nbw h GLN 55 N 0.72 1.16 0.06 2.33 4.15 -0.96 -0.50 115.11 122.07 1nbw h GLN 55 Ca 0.40 -0.08 -0.00 0.00 0.77 0.00 0.00 58.65 59.73 1nbw h GLN 55 Cb 0.41 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 27.85 1nbw h GLN 55 CO -0.27 0.78 -0.03 0.00 -1.93 0.00 0.00 178.83 177.39 1nbw h ALA 56 N 1.31 -0.08 -0.94 3.38 0.00 -0.44 -3.27 119.26 119.21 1nbw h ALA 56 Ca 0.32 -0.24 0.19 0.00 0.00 0.00 0.00 54.91 55.18 1nbw h ALA 56 Cb -0.11 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 17.60 1nbw h ALA 56 CO -0.07 -0.29 0.52 -0.07 0.00 0.00 0.00 179.25 179.35 1nbw h LEU 57 N -0.59 0.61 -0.34 0.00 3.38 -0.38 -1.84 115.31 116.16 1nbw h LEU 57 Ca -0.01 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1nbw h LEU 57 Cb 0.51 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1nbw h LEU 57 CO 0.01 0.18 0.00 0.00 0.09 0.00 0.00 178.44 178.72 1nbw n ALA 58 N -2.38 1.07 1.16 1.53 0.00 -0.21 -0.20 120.51 121.48 1nbw n ALA 58 Ca 0.22 0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.83 1nbw n ALA 58 Cb 0.58 -1.09 0.24 0.00 0.00 0.00 0.00 19.45 19.18 1nbw n ALA 58 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nbw n LYS 59 N -1.69 2.02 -4.51 0.00 5.02 -0.69 -4.94 118.16 113.38 1nbw n LYS 59 Ca -0.00 -1.54 -0.24 0.00 -2.02 0.00 0.00 58.31 54.51 1nbw n LYS 59 Cb 0.02 -1.47 -0.11 0.00 -0.02 0.00 0.00 35.03 33.46 1nbw n LYS 59 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1nbw s THR 60 N -2.04 1.86 -0.95 -0.18 -4.23 0.72 -5.03 115.64 105.80 1nbw s THR 60 Ca 0.31 -2.11 0.28 0.00 -1.18 0.00 0.00 61.69 58.99 1nbw s THR 60 Cb 0.20 -2.67 0.25 0.00 1.34 0.00 0.00 72.50 71.62 1nbw s THR 60 CO 0.33 -0.17 1.90 -2.65 -0.54 0.00 0.00 174.62 173.49 1nbw n PRO 61 N -0.74 0.05 -1.95 3.99 -0.02 -1.26 -4.88 135.00 130.18 1nbw n PRO 61 Ca -0.05 0.04 -0.29 0.00 -2.02 0.00 0.00 63.50 61.18 1nbw n PRO 61 Cb 0.65 -1.56 0.07 0.00 -0.02 0.00 0.00 33.50 32.64 1nbw n PRO 61 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1nbw s TRP 62 N -3.02 3.12 0.40 6.00 0.52 -1.26 -5.10 118.94 119.60 1nbw s TRP 62 Ca 0.13 0.84 0.04 0.00 0.02 0.00 0.00 56.10 57.13 1nbw s TRP 62 Cb 0.18 -3.24 -0.03 0.00 -1.15 0.00 0.00 33.47 29.23 1nbw s TRP 62 CO 0.54 -1.43 0.12 -1.12 0.02 0.00 0.00 176.95 175.07 1nbw s SER 63 N -4.46 2.79 0.28 2.95 0.01 -1.26 -4.71 113.70 109.30 1nbw s SER 63 Ca 0.60 -1.64 0.02 0.00 1.31 0.00 0.00 55.95 56.24 1nbw s SER 63 Cb -0.11 0.44 0.62 0.00 0.21 0.00 0.00 66.02 67.18 1nbw s SER 63 CO 0.49 -0.89 1.78 -0.03 0.41 0.00 0.00 173.24 175.00 1nbw h MET 64 N 1.81 0.74 0.00 12.44 4.05 -1.97 -0.28 114.93 131.71 1nbw h MET 64 Ca -0.36 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.01 1nbw h MET 64 Cb 1.27 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 31.91 1nbw h MET 64 CO 0.59 0.49 0.00 -1.13 0.23 0.00 0.00 176.91 177.09 1nbw n SER 65 N -4.78 0.00 0.01 1.39 3.41 -1.26 -2.66 113.62 109.73 1nbw n SER 65 Ca 0.20 -0.31 0.11 0.00 -0.26 0.00 0.00 58.87 58.61 1nbw n SER 65 Cb 0.47 -0.17 0.09 0.00 -0.26 0.00 0.00 64.21 64.35 1nbw n SER 65 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1nbw n ASP 66 N -1.17 0.67 -4.64 4.04 8.00 -0.12 -4.88 116.55 118.46 1nbw n ASP 66 Ca 0.13 -0.44 -0.43 0.00 0.71 0.00 0.00 54.79 54.77 1nbw n ASP 66 Cb 0.13 0.59 -0.03 0.00 -0.02 0.00 0.00 41.12 41.80 1nbw n ASP 66 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1nbw s VAL 67 N -3.05 3.55 -0.05 2.53 1.01 -1.09 -4.23 120.40 119.06 1nbw s VAL 67 Ca 0.08 0.63 -0.23 0.00 0.00 0.00 0.00 61.98 62.46 1nbw s VAL 67 Cb 0.16 -3.52 -0.28 0.00 0.00 0.00 0.00 36.38 32.74 1nbw s VAL 67 CO 0.77 -0.18 0.93 0.28 0.00 0.00 0.00 175.10 176.90 1nbw h SER 68 N 10.80 0.38 -5.06 3.32 0.02 -1.29 -3.46 113.55 118.27 1nbw h SER 68 Ca -0.37 -0.90 -0.12 0.00 -0.84 0.00 0.00 61.79 59.55 1nbw h SER 68 Cb 1.17 -0.12 -0.18 0.00 0.14 0.00 0.00 62.40 63.41 1nbw h SER 68 CO 0.98 1.25 -0.46 -0.60 -1.14 0.00 0.00 176.83 176.85 1nbw s ARG 69 N -2.63 0.61 -0.07 3.45 3.52 -1.17 -3.81 118.95 118.83 1nbw s ARG 69 Ca -0.15 -0.62 0.01 0.00 -0.13 0.00 0.00 55.73 54.84 1nbw s ARG 69 Cb 0.01 0.25 0.02 0.00 -1.56 0.00 0.00 34.95 33.66 1nbw s ARG 69 CO 0.80 -0.16 -0.10 0.42 -0.81 0.00 0.00 175.30 175.45 1nbw s ILE 70 N -2.31 1.04 -0.34 4.11 1.01 -0.42 -1.92 121.20 122.37 1nbw s ILE 70 Ca -0.07 -0.39 -0.09 0.00 0.00 0.00 0.00 60.65 60.10 1nbw s ILE 70 Cb -0.03 -0.98 0.01 0.00 0.01 0.00 0.00 42.46 41.48 1nbw s ILE 70 CO -0.03 0.34 0.16 -0.31 0.00 0.00 0.00 174.94 175.10 1nbw s TYR 71 N 0.95 3.21 -0.13 3.97 1.51 0.21 0.32 117.35 127.38 1nbw s TYR 71 Ca -0.09 -0.89 -0.04 0.00 -1.01 0.00 0.00 57.07 55.03 1nbw s TYR 71 Cb -0.15 -2.36 -0.03 0.00 -0.11 0.00 0.00 41.96 39.30 1nbw s TYR 71 CO 0.00 -0.58 0.02 -1.17 -1.11 0.00 0.00 175.55 172.71 1nbw s LEU 72 N 1.55 3.61 -0.12 -1.29 2.96 0.15 -0.26 118.68 125.27 1nbw s LEU 72 Ca 0.02 0.08 0.02 0.00 -0.22 0.00 0.00 54.13 54.03 1nbw s LEU 72 Cb -0.18 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 44.65 1nbw s LEU 72 CO 0.05 0.27 -0.19 0.21 -1.32 0.00 0.00 176.35 175.37 1nbw s ASN 73 N -0.22 2.84 -0.40 3.68 2.47 -0.19 -0.70 114.94 122.41 1nbw s ASN 73 Ca 0.06 -0.53 -0.04 0.00 0.42 0.00 0.00 52.86 52.77 1nbw s ASN 73 Cb -0.12 -1.30 0.10 0.00 -1.45 0.00 0.00 41.25 38.47 1nbw s ASN 73 CO 0.02 0.06 0.20 -1.61 -3.72 0.00 0.00 177.10 172.05 1nbw s GLU 74 N 0.85 2.19 0.36 0.43 2.02 -1.26 -1.01 118.70 122.27 1nbw s GLU 74 Ca -0.08 -1.69 -0.27 0.00 0.02 0.00 0.00 54.97 52.95 1nbw s GLU 74 Cb -0.15 -3.60 -0.12 0.00 0.10 0.00 0.00 34.13 30.36 1nbw s GLU 74 CO -0.01 -1.01 1.24 0.00 0.02 0.00 0.00 175.26 175.50 1nbw n ALA 75 N 4.67 1.07 -2.22 5.21 0.00 -0.96 -4.89 120.51 123.40 1nbw n ALA 75 Ca -0.05 0.33 -0.42 0.00 0.00 0.00 0.00 53.44 53.30 1nbw n ALA 75 Cb 0.42 -2.22 -0.03 0.00 0.00 0.00 0.00 19.45 17.62 1nbw n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nbw s ALA 76 N -1.13 3.58 0.16 0.00 0.00 -1.26 -4.86 121.76 118.25 1nbw s ALA 76 Ca 0.57 0.87 -0.34 0.00 0.00 0.00 0.00 51.96 53.07 1nbw s ALA 76 Cb -0.57 -3.60 -0.15 0.00 0.00 0.00 0.00 23.12 18.80 1nbw s ALA 76 CO 0.61 -0.93 1.37 -2.30 0.00 0.00 0.00 175.76 174.50 1nbw n PRO 77 N 5.44 1.57 -4.01 0.00 -0.02 -1.26 -4.72 135.00 132.00 1nbw n PRO 77 Ca 0.13 0.56 -0.29 0.00 -2.02 0.00 0.00 63.50 61.88 1nbw n PRO 77 Cb 0.44 -2.20 -0.17 0.00 -0.02 0.00 0.00 33.50 31.55 1nbw n PRO 77 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nbw s VAL 78 N 0.30 1.41 -0.12 -1.45 1.01 -1.26 -0.33 120.40 119.96 1nbw s VAL 78 Ca 0.77 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 62.20 1nbw s VAL 78 Cb -0.80 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1nbw s VAL 78 CO 0.47 0.43 -0.06 -0.63 0.00 0.00 0.00 175.10 175.31 1nbw s ILE 79 N 1.52 3.74 0.20 2.22 -1.09 0.63 -4.97 121.20 123.45 1nbw s ILE 79 Ca 0.04 -0.43 0.04 0.00 -2.23 0.00 0.00 60.65 58.07 1nbw s ILE 79 Cb -0.13 -2.59 -0.05 0.00 -1.58 0.00 0.00 42.46 38.11 1nbw s ILE 79 CO -0.09 0.54 -0.04 -0.83 -1.23 0.00 0.00 174.94 173.28 1nbw s GLY 80 N -0.06 1.40 0.24 6.18 0.00 -1.26 -0.19 107.32 113.63 1nbw s GLY 80 Ca 0.01 -1.68 -0.19 0.00 0.00 0.00 0.00 44.72 42.85 1nbw s GLY 80 CO 0.03 -1.65 0.62 -0.35 0.00 0.00 0.00 173.10 171.75 1nbw s ASP 81 N -3.27 -0.29 0.10 1.64 2.15 -0.94 -5.00 116.67 111.07 1nbw s ASP 81 Ca 0.25 -0.53 0.03 0.00 0.43 0.00 0.00 52.55 52.73 1nbw s ASP 81 Cb 0.04 0.66 -0.04 0.00 -0.30 0.00 0.00 42.92 43.28 1nbw s ASP 81 CO 0.06 -1.19 -0.09 0.68 -0.17 0.00 0.00 175.17 174.46 1nbw s VAL 82 N -3.89 0.90 0.03 1.11 -7.23 -1.26 -1.48 120.40 108.58 1nbw s VAL 82 Ca 0.10 -1.74 -0.15 0.00 -1.81 0.00 0.00 61.98 58.38 1nbw s VAL 82 Cb -0.03 -1.47 0.02 0.00 0.56 0.00 0.00 36.38 35.46 1nbw s VAL 82 CO 0.02 -0.65 0.33 0.00 -0.31 0.00 0.00 175.10 174.49 1nbw s ALA 83 N -2.78 -0.77 -0.06 1.32 0.00 0.10 -4.94 121.76 114.64 1nbw s ALA 83 Ca 0.08 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.18 1nbw s ALA 83 Cb -0.01 0.27 0.02 0.00 0.00 0.00 0.00 23.12 23.41 1nbw s ALA 83 CO -0.01 -0.39 -0.07 1.41 0.00 0.00 0.00 175.76 176.70 1nbw s MET 84 N -2.28 1.19 -0.12 0.00 1.75 -1.26 0.49 119.30 119.07 1nbw s MET 84 Ca -0.07 -0.21 0.03 0.00 -1.25 0.00 0.00 55.69 54.19 1nbw s MET 84 Cb -0.02 -1.12 0.01 0.00 2.84 0.00 0.00 34.83 36.54 1nbw s MET 84 CO -0.01 -0.08 -0.20 -1.21 -0.65 0.00 0.00 175.02 172.86 1nbw s GLU 85 N 0.99 2.75 0.01 4.11 0.41 -0.55 -4.84 118.70 121.58 1nbw s GLU 85 Ca -0.09 -0.76 -0.25 0.00 -0.41 0.00 0.00 54.97 53.45 1nbw s GLU 85 Cb -0.14 -2.19 -0.05 0.00 -1.78 0.00 0.00 34.13 29.96 1nbw s GLU 85 CO 0.00 0.03 0.77 0.99 -0.49 0.00 0.00 175.26 176.56 1nbw s THR 86 N 0.71 4.83 -0.71 3.63 2.01 -1.26 -0.79 115.64 124.06 1nbw s THR 86 Ca -0.11 1.62 0.07 0.00 0.31 0.00 0.00 61.69 63.58 1nbw s THR 86 Cb -0.16 -4.11 0.13 0.00 0.01 0.00 0.00 72.50 68.37 1nbw s THR 86 CO 0.02 0.32 0.97 2.30 -0.69 0.00 0.00 174.62 177.53 1nbw n ILE 87 N 3.16 0.57 -3.93 1.82 -5.35 -0.37 -4.75 119.36 110.51 1nbw n ILE 87 Ca -0.01 -0.78 -0.09 0.00 -0.27 0.00 0.00 62.75 61.59 1nbw n ILE 87 Cb 0.51 0.78 -0.07 0.00 -1.74 0.00 0.00 39.64 39.11 1nbw n ILE 87 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1nbw s THR 88 N -0.82 0.09 0.02 7.28 -4.23 -1.23 -1.67 115.64 115.08 1nbw s THR 88 Ca 0.12 -1.33 -0.11 0.00 -1.18 0.00 0.00 61.69 59.19 1nbw s THR 88 Cb 0.07 -1.70 0.01 0.00 1.34 0.00 0.00 72.50 72.22 1nbw s THR 88 CO 0.09 -0.40 0.23 -1.83 -0.54 0.00 0.00 174.62 172.17 1nbw s GLU 89 N -3.94 0.66 -0.11 3.99 -1.05 -0.59 -4.71 118.70 112.95 1nbw s GLU 89 Ca 0.14 -0.47 0.03 0.00 -0.15 0.00 0.00 54.97 54.52 1nbw s GLU 89 Cb 0.04 0.28 0.01 0.00 -0.44 0.00 0.00 34.13 34.02 1nbw s GLU 89 CO -0.03 -0.19 -0.20 0.99 0.95 0.00 0.00 175.26 176.78 1nbw s THR 90 N -2.05 1.84 -0.02 1.83 2.01 -1.26 -1.36 115.64 116.63 1nbw s THR 90 Ca -0.09 -0.86 0.05 0.00 0.31 0.00 0.00 61.69 61.10 1nbw s THR 90 Cb -0.03 -1.63 -0.01 0.00 0.01 0.00 0.00 72.50 70.84 1nbw s THR 90 CO -0.01 0.51 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.62 1nbw s ILE 91 N 0.72 1.46 -0.29 1.82 1.01 0.31 -3.40 121.20 122.83 1nbw s ILE 91 Ca -0.11 -0.78 -0.08 0.00 0.00 0.00 0.00 60.65 59.68 1nbw s ILE 91 Cb -0.16 -1.22 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 1nbw s ILE 91 CO 0.02 0.41 0.10 -0.63 0.00 0.00 0.00 174.94 174.84 1nbw s ILE 92 N -0.35 4.28 -0.06 2.92 1.01 -0.16 -1.47 121.20 127.36 1nbw s ILE 92 Ca 0.05 -0.45 -0.05 0.00 0.00 0.00 0.00 60.65 60.21 1nbw s ILE 92 Cb -0.08 -3.14 -0.04 0.00 0.01 0.00 0.00 42.46 39.22 1nbw s ILE 92 CO -0.00 0.15 0.16 0.42 0.00 0.00 0.00 174.94 175.67 1nbw s THR 93 N 1.57 5.44 -1.50 2.92 -4.23 0.20 -4.24 115.64 115.80 1nbw s THR 93 Ca 0.04 0.00 -0.06 0.00 -1.18 0.00 0.00 61.69 60.49 1nbw s THR 93 Cb -0.16 -3.46 0.02 0.00 1.34 0.00 0.00 72.50 70.24 1nbw s THR 93 CO 0.04 0.47 0.70 -0.62 -0.54 0.00 0.00 174.62 174.67 1nbw n GLU 94 N 1.44 -5.25 -4.16 3.99 1.02 -1.26 -2.73 120.64 113.69 1nbw n GLU 94 Ca -0.15 0.83 -0.36 0.00 -0.02 0.00 0.00 57.16 57.47 1nbw n GLU 94 Cb 0.54 -5.71 -0.04 0.00 -0.02 0.00 0.00 31.44 26.20 1nbw n GLU 94 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1nbw n SER 95 N -2.59 -2.71 0.01 1.62 7.64 -1.26 -4.78 113.62 111.54 1nbw n SER 95 Ca -0.08 -0.95 0.09 0.00 1.01 0.00 0.00 58.87 58.95 1nbw n SER 95 Cb 0.60 -2.27 0.40 0.00 -1.01 0.00 0.00 64.21 61.93 1nbw n SER 95 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1nbw n THR 96 N -4.12 0.74 -3.67 0.44 5.66 -1.10 -4.74 114.28 107.48 1nbw n THR 96 Ca 0.08 0.17 -0.09 0.00 -3.05 0.00 0.00 64.05 61.16 1nbw n THR 96 Cb 0.48 -0.88 -0.02 0.00 -1.55 0.00 0.00 70.33 68.36 1nbw n THR 96 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nbw s MET 97 N -3.03 1.55 -0.16 1.09 0.23 -1.26 -0.99 119.30 116.74 1nbw s MET 97 Ca 0.09 -0.77 -0.03 0.00 -1.03 0.00 0.00 55.69 53.95 1nbw s MET 97 Cb 0.12 0.60 0.05 0.00 -1.53 0.00 0.00 34.83 34.07 1nbw s MET 97 CO 0.35 -0.70 0.05 0.42 -2.03 0.00 0.00 175.02 173.11 1nbw s ILE 98 N -3.85 0.30 -0.14 3.16 1.01 -0.26 -4.71 121.20 116.71 1nbw s ILE 98 Ca 0.07 -0.27 0.20 0.00 0.00 0.00 0.00 60.65 60.65 1nbw s ILE 98 Cb -0.04 -0.77 0.45 0.00 0.01 0.00 0.00 42.46 42.12 1nbw s ILE 98 CO -0.02 -0.12 1.16 0.61 0.00 0.00 0.00 174.94 176.57 1nbw n GLY 99 N 5.14 2.54 0.00 6.18 0.00 -1.26 -2.11 105.19 115.69 1nbw n GLY 99 Ca -0.08 -1.19 0.08 0.00 0.00 0.00 0.00 46.02 44.83 1nbw n GLY 99 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1nbw n HIS 100 N -0.22 0.02 -3.70 1.61 1.44 -1.26 -4.92 115.22 108.18 1nbw n HIS 100 Ca 0.13 0.01 -0.27 0.00 -2.01 0.00 0.00 57.72 55.58 1nbw n HIS 100 Cb 0.95 -0.51 0.01 0.00 0.12 0.00 0.00 29.99 30.57 1nbw n HIS 100 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 1nbw n ASN 101 N -1.52 -5.31 -4.69 4.39 5.15 -1.26 -4.90 115.26 107.12 1nbw n ASN 101 Ca 0.04 -0.90 -0.35 0.00 -0.60 0.00 0.00 54.58 52.77 1nbw n ASN 101 Cb 0.18 -2.66 0.10 0.00 -0.53 0.00 0.00 39.78 36.88 1nbw n ASN 101 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1nbw n PRO 102 N -3.32 0.57 0.04 1.20 -0.04 -1.26 -4.93 135.00 127.26 1nbw n PRO 102 Ca -0.18 0.26 -0.08 0.00 -0.04 0.00 0.00 63.50 63.46 1nbw n PRO 102 Cb 0.61 -2.43 0.06 0.00 -0.04 0.00 0.00 33.50 31.71 1nbw n PRO 102 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1nbw h GLN 103 N -0.29 0.41 -2.15 0.54 4.20 -1.96 -3.37 115.11 112.48 1nbw h GLN 103 Ca -0.48 -0.29 -0.59 0.00 0.06 0.00 0.00 58.65 57.35 1nbw h GLN 103 Cb 1.32 0.05 -0.41 0.00 0.30 0.00 0.00 27.48 28.73 1nbw h GLN 103 CO 0.49 0.91 -0.72 0.25 -0.67 0.00 0.00 178.83 179.09 1nbw n THR 104 N -3.89 1.74 -1.41 -0.54 -2.24 -1.26 -5.09 114.28 101.59 1nbw n THR 104 Ca -0.03 -4.99 -0.31 0.00 -2.27 0.00 0.00 64.05 56.44 1nbw n THR 104 Cb 0.65 -1.95 0.07 0.00 -2.10 0.00 0.00 70.33 67.00 1nbw n THR 104 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1nbw s PRO 105 N -2.31 2.55 0.06 -0.78 0.04 -1.26 -4.22 135.00 129.07 1nbw s PRO 105 Ca 0.40 1.10 -0.01 0.00 0.04 0.00 0.00 61.00 62.54 1nbw s PRO 105 Cb 0.17 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.74 1nbw s PRO 105 CO -0.04 -1.41 0.22 0.20 0.04 0.00 0.00 177.00 176.00 1nbw s GLY 106 N -3.48 2.19 0.00 0.56 0.00 -0.42 -4.57 107.32 101.60 1nbw s GLY 106 Ca 0.60 -0.81 0.00 0.00 0.00 0.00 0.00 44.72 44.51 1nbw s GLY 106 CO 0.54 -0.78 0.00 0.61 0.00 0.00 0.00 173.10 173.48 1nbw n GLY 107 N 0.37 0.67 3.72 0.20 0.00 -1.25 -0.41 105.19 108.47 1nbw n GLY 107 Ca -0.06 -0.79 -0.07 0.00 0.00 0.00 0.00 46.02 45.11 1nbw n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nbw s VAL 108 N 0.00 0.00 0.00 1.61 0.11 -1.24 -4.82 120.40 116.06 1nbw s VAL 108 Ca 0.00 -0.62 0.00 0.00 -2.93 0.00 0.00 61.98 58.43 1nbw s VAL 108 Cb 0.00 -1.74 0.00 0.00 -1.53 0.00 0.00 36.38 33.11 1nbw s VAL 108 CO 0.00 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.38 1nbw n GLY 109 N -0.43 -1.04 3.16 6.54 0.00 -0.49 -2.87 105.19 110.07 1nbw n GLY 109 Ca -0.07 -2.24 -0.19 0.00 0.00 0.00 0.00 46.02 43.51 1nbw n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nbw s VAL 110 N -0.80 1.14 -0.16 1.61 1.01 -1.26 -1.31 120.40 120.64 1nbw s VAL 110 Ca 0.00 -1.17 -0.10 0.00 0.00 0.00 0.00 61.98 60.71 1nbw s VAL 110 Cb 0.00 -1.07 0.05 0.00 0.00 0.00 0.00 36.38 35.37 1nbw s VAL 110 CO 0.00 -0.11 0.39 -0.83 0.00 0.00 0.00 175.10 174.55 1nbw s GLY 111 N -1.46 -0.30 -0.08 4.51 0.00 -0.22 -4.95 107.32 104.82 1nbw s GLY 111 Ca 0.00 1.38 0.02 0.00 0.00 0.00 0.00 44.72 46.12 1nbw s GLY 111 CO 0.02 1.48 -0.15 0.14 0.00 0.00 0.00 173.10 174.59 1nbw s VAL 112 N 1.15 2.97 0.00 1.40 1.01 -1.26 -0.66 120.40 125.00 1nbw s VAL 112 Ca -0.08 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1nbw s VAL 112 Cb -0.07 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1nbw s VAL 112 CO -0.10 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.18 1nbw n GLY 113 N 2.80 0.80 3.47 4.51 0.00 -0.25 -4.70 105.19 111.82 1nbw n GLY 113 Ca -0.18 -0.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.85 1nbw n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nbw s THR 114 N -2.08 3.51 0.36 2.61 2.01 -0.86 0.07 115.64 121.25 1nbw s THR 114 Ca 0.00 -0.51 -0.27 0.00 0.31 0.00 0.00 61.69 61.22 1nbw s THR 114 Cb 0.00 -2.49 -0.09 0.00 0.01 0.00 0.00 72.50 69.93 1nbw s THR 114 CO 0.00 0.53 1.27 0.42 -0.69 0.00 0.00 174.62 176.15 1nbw s THR 115 N 0.09 2.81 -0.09 -0.82 -4.23 -0.20 -1.73 115.64 111.48 1nbw s THR 115 Ca -0.03 0.77 -0.13 0.00 -1.18 0.00 0.00 61.69 61.12 1nbw s THR 115 Cb -0.14 -3.47 0.03 0.00 1.34 0.00 0.00 72.50 70.26 1nbw s THR 115 CO 0.04 0.15 0.33 -0.51 -0.54 0.00 0.00 174.62 174.08 1nbw s ILE 116 N -1.22 0.02 0.10 2.99 2.07 -0.56 -0.25 121.20 124.35 1nbw s ILE 116 Ca 0.52 -0.16 -0.30 0.00 -1.41 0.00 0.00 60.65 59.30 1nbw s ILE 116 Cb -0.37 -0.52 -0.06 0.00 0.13 0.00 0.00 42.46 41.63 1nbw s ILE 116 CO 0.49 -0.09 1.20 0.00 -1.91 0.00 0.00 174.94 174.63 1nbw s ALA 117 N -0.33 3.41 0.36 1.50 0.00 -1.26 -0.59 121.76 124.85 1nbw s ALA 117 Ca -0.05 0.88 0.19 0.00 0.00 0.00 0.00 51.96 52.99 1nbw s ALA 117 Cb -0.03 -3.44 1.30 0.00 0.00 0.00 0.00 23.12 20.95 1nbw s ALA 117 CO 0.02 -0.42 1.58 -0.11 0.00 0.00 0.00 175.76 176.83 1nbw n LEU 118 N 3.52 0.31 0.00 0.00 7.94 -0.89 0.63 117.00 128.51 1nbw n LEU 118 Ca 0.08 1.66 0.08 0.00 -1.11 0.00 0.00 56.01 56.72 1nbw n LEU 118 Cb 0.46 -0.79 0.42 0.00 0.53 0.00 0.00 43.42 44.03 1nbw n LEU 118 CO 0.56 -1.85 0.74 0.61 -1.11 0.00 0.00 177.39 176.34 1nbw n GLY 119 N -1.28 -0.86 0.16 -3.96 0.00 -1.26 -2.76 105.19 95.23 1nbw n GLY 119 Ca 0.37 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.35 1nbw n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nbw n ARG 120 N -1.30 2.35 -0.28 1.61 1.74 0.20 -4.61 116.66 116.37 1nbw n ARG 120 Ca 0.08 -0.50 0.03 0.00 -0.77 0.00 0.00 57.85 56.68 1nbw n ARG 120 Cb 0.14 -1.00 0.16 0.00 -1.02 0.00 0.00 32.46 30.74 1nbw n ARG 120 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1nbw h LEU 121 N 0.80 0.61 0.00 0.55 5.85 -1.39 -1.00 115.31 120.74 1nbw h LEU 121 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1nbw h LEU 121 Cb 0.25 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1nbw h LEU 121 CO 0.00 0.35 0.00 0.00 -0.34 0.00 0.00 178.44 178.45 1nbw n ALA 122 N -2.39 2.16 0.13 1.25 0.00 -1.26 -2.58 120.51 117.81 1nbw n ALA 122 Ca 0.13 -0.11 0.06 0.00 0.00 0.00 0.00 53.44 53.52 1nbw n ALA 122 Cb 0.28 -1.31 0.12 0.00 0.00 0.00 0.00 19.45 18.53 1nbw n ALA 122 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1nbw n THR 123 N -1.09 0.55 -2.08 0.00 -2.24 -0.38 -5.01 114.28 104.03 1nbw n THR 123 Ca 0.13 -0.77 -0.41 0.00 -2.27 0.00 0.00 64.05 60.72 1nbw n THR 123 Cb 0.09 0.84 -0.02 0.00 -2.10 0.00 0.00 70.33 69.14 1nbw n THR 123 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1nbw s LEU 124 N -1.01 4.40 0.42 3.22 1.43 -1.07 -4.99 118.68 121.08 1nbw s LEU 124 Ca 0.20 2.60 -0.22 0.00 -1.03 0.00 0.00 54.13 55.69 1nbw s LEU 124 Cb 0.12 -3.62 -0.10 0.00 0.03 0.00 0.00 46.19 42.62 1nbw s LEU 124 CO 0.16 -0.63 0.99 -2.16 0.23 0.00 0.00 176.35 174.95 1nbw s PRO 125 N -0.58 4.18 0.40 1.29 0.04 -1.26 -4.92 135.00 134.14 1nbw s PRO 125 Ca 0.57 1.30 0.24 0.00 0.04 0.00 0.00 61.00 63.15 1nbw s PRO 125 Cb -0.40 -2.35 1.32 0.00 0.04 0.00 0.00 34.50 33.11 1nbw s PRO 125 CO 0.44 -0.09 1.63 0.00 0.04 0.00 0.00 177.00 179.02 1nbw h ALA 126 N 2.18 2.42 0.00 8.56 0.00 -2.01 0.22 119.26 130.62 1nbw h ALA 126 Ca -0.49 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1nbw h ALA 126 Cb 1.20 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1nbw h ALA 126 CO 0.62 -1.07 0.00 0.00 0.00 0.00 0.00 179.25 178.80 1nbw n ALA 127 N -2.42 1.45 -0.06 0.00 0.00 -1.26 -2.50 120.51 115.71 1nbw n ALA 127 Ca 0.35 0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.91 1nbw n ALA 127 Cb 1.27 -1.30 0.09 0.00 0.00 0.00 0.00 19.45 19.51 1nbw n ALA 127 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1nbw n GLN 128 N -2.03 2.60 0.14 0.00 6.02 0.75 -4.74 117.38 120.13 1nbw n GLN 128 Ca 0.01 -1.73 -0.14 0.00 -0.01 0.00 0.00 57.00 55.13 1nbw n GLN 128 Cb 0.15 -1.16 -0.08 0.00 1.02 0.00 0.00 30.24 30.17 1nbw n GLN 128 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.06 177.93 1nbw h TYR 129 N 1.24 -0.28 -0.05 1.08 -1.99 -1.50 -3.25 116.97 112.21 1nbw h TYR 129 Ca 0.00 -0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.66 1nbw h TYR 129 Cb 0.60 0.09 -0.01 0.00 2.00 0.00 0.00 36.73 39.41 1nbw h TYR 129 CO 0.13 -0.13 -0.27 0.00 -0.00 0.00 0.00 178.16 177.88 1nbw h ALA 130 N 0.40 1.45 -0.68 3.88 0.00 -1.82 0.88 119.26 123.38 1nbw h ALA 130 Ca -0.03 -0.28 0.22 0.00 0.00 0.00 0.00 54.91 54.82 1nbw h ALA 130 Cb 0.28 -0.06 -0.12 0.00 0.00 0.00 0.00 17.79 17.88 1nbw h ALA 130 CO 0.05 0.40 0.13 -1.91 0.00 0.00 0.00 179.25 177.92 1nbw n GLU 131 N -4.18 -0.05 0.00 0.00 2.13 -1.23 -4.60 120.64 112.71 1nbw n GLU 131 Ca -0.02 0.99 0.00 0.00 0.66 0.00 0.00 57.16 58.79 1nbw n GLU 131 Cb 0.34 -1.63 0.00 0.00 0.27 0.00 0.00 31.44 30.42 1nbw n GLU 131 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nbw n GLY 132 N -1.28 2.26 3.09 8.31 0.00 -1.25 -4.87 105.19 111.45 1nbw n GLY 132 Ca 0.19 -1.01 -0.23 0.00 0.00 0.00 0.00 46.02 44.97 1nbw n GLY 132 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1nbw s TRP 133 N 0.00 1.30 -0.39 1.61 0.52 0.12 -2.02 118.94 120.08 1nbw s TRP 133 Ca 0.00 -0.29 -0.06 0.00 0.02 0.00 0.00 56.10 55.77 1nbw s TRP 133 Cb 0.00 -0.86 0.08 0.00 -1.15 0.00 0.00 33.47 31.54 1nbw s TRP 133 CO 0.00 -0.07 0.19 0.42 0.02 0.00 0.00 176.95 177.51 1nbw s ILE 134 N -0.13 3.73 -0.09 2.03 1.01 -0.70 -0.85 121.20 126.20 1nbw s ILE 134 Ca 0.02 -1.54 -0.28 0.00 0.00 0.00 0.00 60.65 58.84 1nbw s ILE 134 Cb -0.07 -3.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 1nbw s ILE 134 CO 0.00 -0.46 0.94 -0.69 0.00 0.00 0.00 174.94 174.73 1nbw s VAL 135 N 1.32 4.85 -0.32 2.92 1.01 -0.66 -1.50 120.40 128.03 1nbw s VAL 135 Ca 0.03 1.91 -0.17 0.00 0.00 0.00 0.00 61.98 63.75 1nbw s VAL 135 Cb -0.22 -4.25 -0.02 0.00 0.00 0.00 0.00 36.38 31.89 1nbw s VAL 135 CO -0.00 0.07 0.46 -0.76 0.00 0.00 0.00 175.10 174.87 1nbw s LEU 136 N 1.66 4.25 -0.27 3.92 1.43 0.24 -0.86 118.68 129.05 1nbw s LEU 136 Ca 0.46 0.08 -0.04 0.00 -1.03 0.00 0.00 54.13 53.60 1nbw s LEU 136 Cb -0.19 -2.52 0.01 0.00 0.03 0.00 0.00 46.19 43.53 1nbw s LEU 136 CO 0.19 -0.36 0.00 -0.63 0.23 0.00 0.00 176.35 175.78 1nbw s ILE 137 N 2.24 3.39 0.01 -0.59 1.01 0.50 -2.10 121.20 125.66 1nbw s ILE 137 Ca 0.17 -0.83 -0.00 0.00 0.00 0.00 0.00 60.65 59.99 1nbw s ILE 137 Cb -0.16 -2.72 0.00 0.00 0.01 0.00 0.00 42.46 39.60 1nbw s ILE 137 CO 0.12 0.17 0.01 -0.67 0.00 0.00 0.00 174.94 174.57 1nbw n ASP 138 N 4.77 -0.71 -1.09 3.58 4.64 -1.26 -1.53 116.55 124.94 1nbw n ASP 138 Ca -0.16 -0.66 0.05 0.00 -1.38 0.00 0.00 54.79 52.65 1nbw n ASP 138 Cb 0.48 -0.01 0.26 0.00 -1.04 0.00 0.00 41.12 40.81 1nbw n ASP 138 CO 0.00 0.00 0.00 -0.90 -0.82 0.00 0.00 177.20 175.48 1nbw n ASP 139 N -3.02 3.89 0.03 1.67 5.75 -1.26 -4.45 116.55 119.17 1nbw n ASP 139 Ca 0.00 -3.14 0.11 0.00 -0.01 0.00 0.00 54.79 51.75 1nbw n ASP 139 Cb 0.01 -0.59 -0.12 0.00 -1.03 0.00 0.00 41.12 39.39 1nbw n ASP 139 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nbw n ALA 140 N -0.50 2.72 -2.82 2.12 0.00 -1.26 -4.91 120.51 115.86 1nbw n ALA 140 Ca 0.25 -0.43 -0.35 0.00 0.00 0.00 0.00 53.44 52.92 1nbw n ALA 140 Cb 0.98 -0.86 -0.10 0.00 0.00 0.00 0.00 19.45 19.47 1nbw n ALA 140 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1nbw s VAL 141 N -3.47 4.70 0.19 0.00 1.01 -1.26 -5.06 120.40 116.51 1nbw s VAL 141 Ca -0.06 -0.07 -0.33 0.00 0.00 0.00 0.00 61.98 61.52 1nbw s VAL 141 Cb 0.13 -3.09 -0.14 0.00 0.00 0.00 0.00 36.38 33.28 1nbw s VAL 141 CO 0.87 0.50 1.52 -0.67 0.00 0.00 0.00 175.10 177.32 1nbw n ASP 142 N 3.21 2.97 0.28 3.32 -0.08 -1.26 -4.80 116.55 120.18 1nbw n ASP 142 Ca -0.17 1.10 0.14 0.00 -1.51 0.00 0.00 54.79 54.35 1nbw n ASP 142 Cb 0.53 -1.42 0.87 0.00 2.34 0.00 0.00 41.12 43.43 1nbw n ASP 142 CO 0.00 0.00 0.00 2.19 0.12 0.00 0.00 177.20 179.51 1nbw h PHE 143 N 5.34 0.00 -0.02 -0.67 -5.15 -1.97 0.19 116.94 114.66 1nbw h PHE 143 Ca -0.45 0.00 -0.14 0.00 -0.20 0.00 0.00 57.97 57.18 1nbw h PHE 143 Cb 1.26 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.41 1nbw h PHE 143 CO 0.60 0.00 -0.62 -0.07 -2.00 0.00 0.00 178.31 176.22 1nbw h LEU 144 N 0.00 0.07 -0.27 2.10 3.38 -1.98 -0.86 115.31 117.75 1nbw h LEU 144 Ca 0.01 -0.04 -0.21 0.00 0.09 0.00 0.00 57.88 57.74 1nbw h LEU 144 Cb 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1nbw h LEU 144 CO -0.00 0.67 -0.75 0.44 0.09 0.00 0.00 178.44 178.89 1nbw h ASP 145 N 0.04 0.76 -0.58 -0.43 3.32 -1.35 -1.52 116.42 116.65 1nbw h ASP 145 Ca -0.01 -0.49 -0.01 0.00 0.02 0.00 0.00 57.03 56.53 1nbw h ASP 145 Cb 1.11 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.41 1nbw h ASP 145 CO 0.08 1.27 0.31 0.00 -1.72 0.00 0.00 179.24 179.18 1nbw h ALA 146 N 0.72 0.75 -0.14 3.45 0.00 -1.07 0.18 119.26 123.15 1nbw h ALA 146 Ca -0.04 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.78 1nbw h ALA 146 Cb 1.36 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1nbw h ALA 146 CO 0.15 0.28 0.01 0.28 0.00 0.00 0.00 179.25 179.96 1nbw h VAL 147 N 0.79 0.91 0.14 0.00 2.07 -1.06 -0.67 116.25 118.42 1nbw h VAL 147 Ca 0.20 -0.02 0.02 0.00 0.82 0.00 0.00 66.70 67.72 1nbw h VAL 147 Cb 0.07 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 1nbw h VAL 147 CO -0.03 0.01 -0.46 -0.25 0.02 0.00 0.00 177.57 176.86 1nbw h TRP 148 N 0.05 -1.31 -0.94 1.57 7.01 -0.58 0.29 115.95 122.05 1nbw h TRP 148 Ca 0.06 0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.13 1nbw h TRP 148 Cb 0.07 0.56 -0.06 0.00 -2.10 0.00 0.00 29.16 27.63 1nbw h TRP 148 CO -0.14 -0.56 0.61 -1.49 -2.79 0.00 0.00 178.44 174.07 1nbw h TRP 149 N -0.71 1.14 -0.52 2.65 4.06 -0.54 0.48 115.95 122.52 1nbw h TRP 149 Ca 0.01 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 60.94 1nbw h TRP 149 Cb 0.72 -0.38 -0.02 0.00 -1.00 0.00 0.00 29.16 28.48 1nbw h TRP 149 CO -0.39 0.66 0.13 -0.07 -3.56 0.00 0.00 178.44 175.21 1nbw h LEU 150 N 1.18 0.79 -0.44 -4.49 3.38 -0.80 -0.44 115.31 114.49 1nbw h LEU 150 Ca 0.37 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 1nbw h LEU 150 Cb 0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1nbw h LEU 150 CO -0.12 0.82 -0.06 0.78 0.09 0.00 0.00 178.44 179.94 1nbw h ASN 151 N 0.73 0.82 -0.58 -0.43 2.35 -0.20 -0.51 115.58 117.76 1nbw h ASN 151 Ca 0.16 -0.34 -0.04 0.00 -0.55 0.00 0.00 56.30 55.53 1nbw h ASN 151 Cb 0.33 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 1nbw h ASN 151 CO 0.00 0.97 0.20 -0.08 -1.65 0.00 0.00 177.43 176.87 1nbw h GLU 152 N 0.66 0.89 -0.53 0.81 4.57 -0.82 0.13 114.58 120.30 1nbw h GLU 152 Ca 0.12 -0.18 0.04 0.00 -1.18 0.00 0.00 59.36 58.16 1nbw h GLU 152 Cb 0.58 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.99 1nbw h GLU 152 CO 0.03 0.79 0.28 0.00 -1.18 0.00 0.00 179.01 178.93 1nbw h ALA 153 N 1.06 0.68 -0.60 2.92 0.00 -0.87 0.13 119.26 122.58 1nbw h ALA 153 Ca 0.19 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1nbw h ALA 153 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1nbw h ALA 153 CO -0.01 -0.06 0.17 -0.07 0.00 0.00 0.00 179.25 179.29 1nbw h LEU 154 N 0.54 0.88 -0.85 0.00 3.38 -0.51 0.62 115.31 119.37 1nbw h LEU 154 Ca 0.23 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1nbw h LEU 154 Cb 0.12 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1nbw h LEU 154 CO -0.15 0.86 0.56 0.44 0.09 0.00 0.00 178.44 180.24 1nbw h ASP 155 N 0.85 0.97 0.00 -0.43 3.32 0.03 -1.79 116.42 119.38 1nbw h ASP 155 Ca 0.19 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1nbw h ASP 155 Cb 0.30 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1nbw h ASP 155 CO -0.00 0.70 0.00 0.54 -1.72 0.00 0.00 179.24 178.76 1nbw n ARG 156 N -4.50 0.75 -0.25 3.56 1.74 -0.04 -4.85 116.66 113.06 1nbw n ARG 156 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 1nbw n ARG 156 Cb 0.02 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 1nbw n ARG 156 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nbw n GLY 157 N 0.48 0.75 3.67 -0.13 0.00 -0.67 -5.04 105.19 104.24 1nbw n GLY 157 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1nbw n GLY 157 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nbw s ILE 158 N -2.26 4.35 -1.19 -0.61 1.01 0.18 -3.99 121.20 118.70 1nbw s ILE 158 Ca 0.00 1.64 -0.20 0.00 0.00 0.00 0.00 60.65 62.09 1nbw s ILE 158 Cb 0.00 -4.06 0.05 0.00 0.01 0.00 0.00 42.46 38.46 1nbw s ILE 158 CO 0.00 -0.10 1.67 0.21 0.00 0.00 0.00 174.94 176.72 1nbw s ASN 159 N 1.71 6.55 -0.38 3.58 2.47 0.31 -3.97 114.94 125.21 1nbw s ASN 159 Ca 0.53 -2.03 -0.24 0.00 0.42 0.00 0.00 52.86 51.54 1nbw s ASN 159 Cb -0.21 -2.58 0.01 0.00 -1.45 0.00 0.00 41.25 37.02 1nbw s ASN 159 CO 0.15 -1.46 0.83 -0.69 -3.72 0.00 0.00 177.10 172.22 1nbw s VAL 160 N 5.12 4.66 -0.57 -5.21 1.01 -1.26 0.15 120.40 124.31 1nbw s VAL 160 Ca 0.53 0.91 0.22 0.00 0.00 0.00 0.00 61.98 63.64 1nbw s VAL 160 Cb 0.02 -4.27 -0.24 0.00 0.00 0.00 0.00 36.38 31.89 1nbw s VAL 160 CO 0.03 -0.52 0.79 1.33 0.00 0.00 0.00 175.10 176.72 1nbw n VAL 161 N 5.92 0.04 -3.77 2.92 0.24 -0.03 -4.89 118.33 118.77 1nbw n VAL 161 Ca 0.04 -0.23 -0.02 0.00 -2.04 0.00 0.00 64.34 62.09 1nbw n VAL 161 Cb 0.48 0.46 -0.00 0.00 -1.47 0.00 0.00 33.84 33.31 1nbw n VAL 161 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nbw s ALA 162 N -3.23 -1.77 -0.06 2.33 0.00 -1.19 -4.36 121.76 113.48 1nbw s ALA 162 Ca 0.01 0.09 -0.14 0.00 0.00 0.00 0.00 51.96 51.93 1nbw s ALA 162 Cb 0.15 0.63 0.03 0.00 0.00 0.00 0.00 23.12 23.93 1nbw s ALA 162 CO 0.87 -1.06 0.33 0.00 0.00 0.00 0.00 175.76 175.90 1nbw s ALA 163 N -2.78 -0.82 -0.21 0.00 0.00 -1.10 -1.65 121.76 115.22 1nbw s ALA 163 Ca 0.16 0.60 0.01 0.00 0.00 0.00 0.00 51.96 52.73 1nbw s ALA 163 Cb -0.01 -0.20 0.04 0.00 0.00 0.00 0.00 23.12 22.96 1nbw s ALA 163 CO 0.02 -0.22 -0.12 0.42 0.00 0.00 0.00 175.76 175.86 1nbw s ILE 164 N -0.69 1.81 0.06 0.00 1.01 -0.04 -1.46 121.20 121.89 1nbw s ILE 164 Ca -0.08 -1.13 0.03 0.00 0.00 0.00 0.00 60.65 59.47 1nbw s ILE 164 Cb -0.04 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.54 1nbw s ILE 164 CO 0.03 0.18 0.05 -0.76 0.00 0.00 0.00 174.94 174.43 1nbw s LEU 165 N 1.32 3.69 -0.07 2.97 1.43 -0.14 -0.37 118.68 127.52 1nbw s LEU 165 Ca -0.02 -0.03 -0.24 0.00 -1.03 0.00 0.00 54.13 52.81 1nbw s LEU 165 Cb -0.17 -2.33 -0.29 0.00 0.03 0.00 0.00 46.19 43.43 1nbw s LEU 165 CO -0.08 0.20 0.88 0.50 0.23 0.00 0.00 176.35 178.08 1nbw h LYS 166 N 3.56 0.22 -7.58 1.70 3.64 -1.46 -0.21 116.57 116.44 1nbw h LYS 166 Ca -0.47 -0.35 -0.46 0.00 -1.27 0.00 0.00 60.65 58.09 1nbw h LYS 166 Cb 1.17 0.13 0.11 0.00 -0.41 0.00 0.00 32.23 33.22 1nbw h LYS 166 CO 0.63 1.15 0.37 0.15 -2.27 0.00 0.00 179.45 179.48 1nbw s LYS 167 N -2.47 1.74 -1.36 1.90 1.02 -1.26 -2.68 119.74 116.64 1nbw s LYS 167 Ca -0.15 -0.10 -0.07 0.00 0.02 0.00 0.00 55.97 55.67 1nbw s LYS 167 Cb -0.00 -1.99 0.05 0.00 -0.52 0.00 0.00 37.83 35.37 1nbw s LYS 167 CO 0.79 -1.68 2.59 -3.47 -0.92 0.00 0.00 175.35 172.66 1nbw n ASP 168 N -3.31 8.17 -0.06 2.83 2.03 -1.26 -2.42 116.55 122.53 1nbw n ASP 168 Ca 0.10 -2.96 0.02 0.00 0.52 0.00 0.00 54.79 52.46 1nbw n ASP 168 Cb 0.61 -1.42 0.04 0.00 -0.72 0.00 0.00 41.12 39.63 1nbw n ASP 168 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1nbw n ASP 169 N 2.25 2.14 -0.20 1.67 8.00 -1.26 -4.83 116.55 124.32 1nbw n ASP 169 Ca 0.67 -2.22 -0.02 0.00 0.71 0.00 0.00 54.79 53.92 1nbw n ASP 169 Cb 0.26 -0.10 0.04 0.00 -0.02 0.00 0.00 41.12 41.31 1nbw n ASP 169 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1nbw h GLY 170 N 0.13 0.27 1.71 0.44 0.00 -1.82 0.81 103.07 104.63 1nbw h GLY 170 Ca 0.00 0.27 -0.14 0.00 0.00 0.00 0.00 47.33 47.46 1nbw h GLY 170 CO 0.00 -0.23 -0.57 -2.08 0.00 0.00 0.00 176.54 173.67 1nbw h VAL 171 N -0.06 1.36 -0.55 4.60 2.07 -1.81 -1.99 116.25 119.87 1nbw h VAL 171 Ca 0.27 -1.88 -0.07 0.00 0.82 0.00 0.00 66.70 65.85 1nbw h VAL 171 Cb 0.48 1.91 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1nbw h VAL 171 CO -0.64 0.56 0.09 -0.07 0.02 0.00 0.00 177.57 177.54 1nbw h LEU 172 N 0.23 0.88 0.09 2.57 3.38 -1.58 -1.66 115.31 119.22 1nbw h LEU 172 Ca -0.00 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1nbw h LEU 172 Cb 1.06 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1nbw h LEU 172 CO 0.09 0.92 -0.04 0.58 0.09 0.00 0.00 178.44 180.08 1nbw h VAL 173 N 0.81 1.12 -0.86 1.22 2.07 -0.84 -3.28 116.25 116.50 1nbw h VAL 173 Ca 0.17 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 66.84 1nbw h VAL 173 Cb 0.41 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.81 1nbw h VAL 173 CO 0.01 0.21 0.56 -1.13 0.02 0.00 0.00 177.57 177.24 1nbw h ASN 174 N -0.53 0.95 0.00 0.57 -1.24 -1.34 -1.30 115.58 112.69 1nbw h ASN 174 Ca -0.01 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.98 1nbw h ASN 174 Cb 0.44 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 39.27 1nbw h ASN 174 CO 0.02 0.67 0.17 0.78 -1.29 0.00 0.00 177.43 177.78 1nbw h ASN 175 N 1.11 0.00 -0.11 1.15 2.35 -1.37 -2.16 115.58 116.56 1nbw h ASN 175 Ca 0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.08 1nbw h ASN 175 Cb -0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.32 1nbw h ASN 175 CO -0.10 0.00 0.00 0.54 -1.65 0.00 0.00 177.43 176.22 1nbw n ARG 176 N -2.97 1.31 -2.13 0.81 1.74 -0.51 -5.03 116.66 109.88 1nbw n ARG 176 Ca -0.02 -1.49 -0.31 0.00 -0.77 0.00 0.00 57.85 55.26 1nbw n ARG 176 Cb 0.23 -1.27 -0.00 0.00 -1.02 0.00 0.00 32.46 30.39 1nbw n ARG 176 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1nbw s LEU 177 N -1.09 3.39 0.45 0.55 1.43 -0.81 -4.95 118.68 117.65 1nbw s LEU 177 Ca 0.18 1.35 0.13 0.00 -1.03 0.00 0.00 54.13 54.77 1nbw s LEU 177 Cb 0.12 -4.36 1.04 0.00 0.03 0.00 0.00 46.19 43.02 1nbw s LEU 177 CO 0.17 -0.75 2.04 0.03 0.23 0.00 0.00 176.35 178.07 1nbw h ARG 178 N 0.06 0.35 -3.08 1.70 2.47 -1.93 -3.42 114.38 110.52 1nbw h ARG 178 Ca -0.45 -0.02 -0.13 0.00 -1.26 0.00 0.00 59.98 58.12 1nbw h ARG 178 Cb 1.19 -0.08 -0.21 0.00 -1.65 0.00 0.00 29.97 29.22 1nbw h ARG 178 CO 0.62 0.23 -0.31 -1.59 0.56 0.00 0.00 179.97 179.47 1nbw s LYS 179 N -5.34 0.60 0.27 0.04 -2.85 -1.26 -5.14 119.74 106.05 1nbw s LYS 179 Ca -0.07 -0.11 -0.30 0.00 -1.00 0.00 0.00 55.97 54.48 1nbw s LYS 179 Cb 0.18 0.27 -0.11 0.00 -2.06 0.00 0.00 37.83 36.11 1nbw s LYS 179 CO 0.73 -0.15 1.53 -0.08 0.10 0.00 0.00 175.35 177.48 1nbw s THR 180 N -1.09 2.33 0.05 3.79 -1.32 -1.26 -5.03 115.64 113.12 1nbw s THR 180 Ca -0.11 0.28 0.02 0.00 -1.21 0.00 0.00 61.69 60.66 1nbw s THR 180 Cb -0.05 -3.18 -0.03 0.00 -1.51 0.00 0.00 72.50 67.74 1nbw s THR 180 CO 0.03 0.04 -0.07 -0.76 -2.21 0.00 0.00 174.62 171.66 1nbw s LEU 181 N -0.37 2.31 -0.05 9.08 1.43 -1.26 -4.87 118.68 124.96 1nbw s LEU 181 Ca 0.62 -0.65 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 1nbw s LEU 181 Cb -0.45 -0.08 -0.04 0.00 0.03 0.00 0.00 46.19 45.64 1nbw s LEU 181 CO 0.45 -0.29 1.40 -2.16 0.23 0.00 0.00 176.35 175.98 1nbw s PRO 182 N -2.12 4.26 -0.27 1.29 0.04 -1.14 -3.72 135.00 133.35 1nbw s PRO 182 Ca -0.06 1.92 0.02 0.00 0.04 0.00 0.00 61.00 62.92 1nbw s PRO 182 Cb -0.06 -3.68 0.07 0.00 0.04 0.00 0.00 34.50 30.86 1nbw s PRO 182 CO -0.01 -0.64 -0.06 0.08 0.04 0.00 0.00 177.00 176.41 1nbw s VAL 183 N 2.89 1.93 -0.30 -0.36 1.01 0.45 -2.69 120.40 123.33 1nbw s VAL 183 Ca 0.63 -1.61 -0.24 0.00 0.00 0.00 0.00 61.98 60.76 1nbw s VAL 183 Cb -0.29 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 33.92 1nbw s VAL 183 CO 0.24 -0.17 0.81 -0.69 0.00 0.00 0.00 175.10 175.29 1nbw s VAL 184 N 1.18 4.78 0.66 2.92 1.01 -0.54 -1.30 120.40 129.12 1nbw s VAL 184 Ca -0.04 1.25 -0.07 0.00 0.00 0.00 0.00 61.98 63.13 1nbw s VAL 184 Cb -0.19 -4.16 0.04 0.00 0.00 0.00 0.00 36.38 32.07 1nbw s VAL 184 CO -0.07 -0.24 0.98 -1.81 0.00 0.00 0.00 175.10 173.96 1nbw s ASP 185 N 1.59 5.12 -1.73 3.32 1.01 -1.26 -0.96 116.67 123.76 1nbw s ASP 185 Ca 0.33 0.59 -0.16 0.00 0.71 0.00 0.00 52.55 54.01 1nbw s ASP 185 Cb -0.14 -1.36 0.15 0.00 1.01 0.00 0.00 42.92 42.58 1nbw s ASP 185 CO 0.12 -1.39 0.57 -0.62 0.21 0.00 0.00 175.17 174.06 1nbw n GLU 186 N -2.81 -1.92 -2.64 8.23 1.02 -1.02 -4.77 120.64 116.74 1nbw n GLU 186 Ca 0.07 0.25 -0.42 0.00 -0.02 0.00 0.00 57.16 57.04 1nbw n GLU 186 Cb 0.59 -4.69 -0.03 0.00 -0.02 0.00 0.00 31.44 27.30 1nbw n GLU 186 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1nbw s VAL 187 N -3.49 4.06 0.31 2.62 1.01 -0.10 -4.87 120.40 119.94 1nbw s VAL 187 Ca 0.61 -0.75 0.08 0.00 0.00 0.00 0.00 61.98 61.92 1nbw s VAL 187 Cb -0.34 -4.98 0.32 0.00 0.00 0.00 0.00 36.38 31.38 1nbw s VAL 187 CO 0.97 -1.83 1.66 0.74 0.00 0.00 0.00 175.10 176.65 1nbw h THR 188 N 6.49 0.33 -1.78 3.92 2.02 -1.74 -1.71 112.91 120.45 1nbw h THR 188 Ca 0.11 -0.10 -0.68 0.00 0.77 0.00 0.00 66.41 66.51 1nbw h THR 188 Cb 1.02 0.01 -0.35 0.00 -1.74 0.00 0.00 68.15 67.09 1nbw h THR 188 CO 1.34 0.05 0.11 0.18 0.37 0.00 0.00 175.52 177.58 1nbw n LEU 189 N -5.12 6.02 -0.31 2.58 4.77 0.14 -4.82 117.00 120.27 1nbw n LEU 189 Ca 0.26 -5.08 0.05 0.00 -0.03 0.00 0.00 56.01 51.21 1nbw n LEU 189 Cb 0.82 -0.75 0.19 0.00 -2.33 0.00 0.00 43.42 41.35 1nbw n LEU 189 CO 0.09 2.03 1.15 0.25 -1.33 0.00 0.00 177.39 179.57 1nbw h LEU 190 N 2.83 0.69 -1.02 2.23 5.85 -1.47 -1.30 115.31 123.11 1nbw h LEU 190 Ca 0.42 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.20 1nbw h LEU 190 Cb 0.49 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1nbw h LEU 190 CO 1.12 0.36 0.20 -0.62 -0.34 0.00 0.00 178.44 179.16 1nbw n GLU 191 N -4.75 0.10 0.04 1.25 4.71 -1.26 -0.46 120.64 120.27 1nbw n GLU 191 Ca 0.15 0.58 0.11 0.00 -0.01 0.00 0.00 57.16 58.00 1nbw n GLU 191 Cb 0.33 -2.03 0.05 0.00 -1.01 0.00 0.00 31.44 28.78 1nbw n GLU 191 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1nbw n GLN 192 N -2.09 0.33 -1.90 3.49 6.02 -0.49 -4.88 117.38 117.86 1nbw n GLN 192 Ca -0.01 0.02 -0.42 0.00 -0.01 0.00 0.00 57.00 56.58 1nbw n GLN 192 Cb 0.22 -1.63 -0.03 0.00 1.02 0.00 0.00 30.24 29.82 1nbw n GLN 192 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1nbw s VAL 193 N -3.22 2.95 0.28 5.09 1.01 0.40 -4.93 120.40 121.98 1nbw s VAL 193 Ca 0.03 0.42 -0.29 0.00 0.00 0.00 0.00 61.98 62.14 1nbw s VAL 193 Cb 0.14 -3.27 -0.10 0.00 0.00 0.00 0.00 36.38 33.14 1nbw s VAL 193 CO 0.79 -0.00 1.39 -2.16 0.00 0.00 0.00 175.10 175.11 1nbw s PRO 194 N 2.59 4.30 0.27 2.72 0.04 -1.26 -5.02 135.00 138.63 1nbw s PRO 194 Ca 0.75 2.27 -0.07 0.00 0.04 0.00 0.00 61.00 63.99 1nbw s PRO 194 Cb -0.41 -3.09 -0.06 0.00 0.04 0.00 0.00 34.50 30.98 1nbw s PRO 194 CO 0.33 -0.33 0.55 -1.21 0.04 0.00 0.00 177.00 176.38 1nbw s GLU 195 N -0.93 3.70 -0.65 4.56 2.02 -1.26 -4.38 118.70 121.76 1nbw s GLU 195 Ca 0.55 0.13 -0.00 0.00 0.02 0.00 0.00 54.97 55.67 1nbw s GLU 195 Cb -0.41 -2.64 0.00 0.00 0.10 0.00 0.00 34.13 31.18 1nbw s GLU 195 CO 0.47 0.25 0.03 0.41 0.02 0.00 0.00 175.26 176.45 1nbw n GLY 196 N -0.60 0.07 3.27 -1.39 0.00 0.66 -4.97 105.19 102.23 1nbw n GLY 196 Ca -0.01 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.22 1nbw n GLY 196 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nbw s VAL 197 N -2.44 1.71 0.46 1.61 1.01 -1.26 -4.85 120.40 116.64 1nbw s VAL 197 Ca 0.02 -1.31 -0.24 0.00 0.00 0.00 0.00 61.98 60.44 1nbw s VAL 197 Cb -0.01 -1.50 -0.07 0.00 0.00 0.00 0.00 36.38 34.80 1nbw s VAL 197 CO 0.02 0.14 1.35 -0.32 0.00 0.00 0.00 175.10 176.28 1nbw s MET 198 N -1.39 3.65 0.15 2.72 1.75 -1.26 -1.04 119.30 123.88 1nbw s MET 198 Ca 0.07 2.23 -0.24 0.00 -1.25 0.00 0.00 55.69 56.51 1nbw s MET 198 Cb -0.09 -2.57 0.07 0.00 2.84 0.00 0.00 34.83 35.08 1nbw s MET 198 CO 0.03 -0.78 0.70 0.00 -0.65 0.00 0.00 175.02 174.32 1nbw s ALA 199 N -1.28 -1.57 -0.02 4.11 0.00 0.11 -1.38 121.76 121.73 1nbw s ALA 199 Ca 0.62 0.41 0.02 0.00 0.00 0.00 0.00 51.96 53.01 1nbw s ALA 199 Cb -0.40 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.50 1nbw s ALA 199 CO 0.50 -0.83 -0.05 0.00 0.00 0.00 0.00 175.76 175.38 1nbw s ALA 200 N -3.63 0.54 -0.05 0.00 0.00 0.13 -1.08 121.76 117.67 1nbw s ALA 200 Ca 0.04 -0.18 0.06 0.00 0.00 0.00 0.00 51.96 51.88 1nbw s ALA 200 Cb -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1nbw s ALA 200 CO -0.07 0.08 -0.22 0.08 0.00 0.00 0.00 175.76 175.63 1nbw s VAL 201 N 0.19 1.81 -0.03 0.00 1.01 0.16 -1.27 120.40 122.28 1nbw s VAL 201 Ca -0.02 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.04 1nbw s VAL 201 Cb -0.06 -1.54 0.01 0.00 0.00 0.00 0.00 36.38 34.79 1nbw s VAL 201 CO -0.00 0.51 -0.05 -0.70 0.00 0.00 0.00 175.10 174.85 1nbw s GLU 202 N -0.14 0.72 -0.15 2.72 2.12 -0.55 -1.06 118.70 122.36 1nbw s GLU 202 Ca -0.02 -0.16 -0.03 0.00 0.36 0.00 0.00 54.97 55.12 1nbw s GLU 202 Cb -0.12 -0.72 0.05 0.00 0.26 0.00 0.00 34.13 33.60 1nbw s GLU 202 CO 0.03 0.01 0.05 0.08 -0.54 0.00 0.00 175.26 174.88 1nbw s VAL 203 N 0.49 0.23 0.86 3.70 1.01 -0.42 -1.70 120.40 124.57 1nbw s VAL 203 Ca -0.06 -0.19 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 1nbw s VAL 203 Cb -0.10 -0.69 0.11 0.00 0.00 0.00 0.00 36.38 35.70 1nbw s VAL 203 CO 0.00 -0.10 1.17 0.00 0.00 0.00 0.00 175.10 176.17 1nbw s ALA 204 N 2.00 2.29 0.78 5.51 0.00 0.21 -1.40 121.76 131.16 1nbw s ALA 204 Ca 0.02 -0.63 -0.11 0.00 0.00 0.00 0.00 51.96 51.23 1nbw s ALA 204 Cb -0.15 -2.98 0.06 0.00 0.00 0.00 0.00 23.12 20.05 1nbw s ALA 204 CO -0.07 -1.96 1.10 0.00 0.00 0.00 0.00 175.76 174.83 1nbw s ALA 205 N -3.48 2.36 0.08 0.00 0.00 -1.26 -4.84 121.76 114.61 1nbw s ALA 205 Ca 0.63 -0.23 -0.37 0.00 0.00 0.00 0.00 51.96 51.99 1nbw s ALA 205 Cb -0.12 -3.09 -0.17 0.00 0.00 0.00 0.00 23.12 19.74 1nbw s ALA 205 CO 0.51 -1.64 1.29 -2.30 0.00 0.00 0.00 175.76 173.62 1nbw n PRO 206 N -3.36 0.96 -0.77 0.00 -0.02 -1.26 -0.56 135.00 129.99 1nbw n PRO 206 Ca 0.07 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1nbw n PRO 206 Cb 0.56 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1nbw n PRO 206 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nbw n GLY 207 N 2.34 0.50 3.98 -1.23 0.00 -1.26 -4.98 105.19 104.54 1nbw n GLY 207 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1nbw n GLY 207 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nbw s GLN 208 N -0.51 3.07 0.31 1.61 -1.52 0.27 -5.11 119.66 117.78 1nbw s GLN 208 Ca 0.00 -0.92 0.10 0.00 -1.95 0.00 0.00 55.36 52.59 1nbw s GLN 208 Cb 0.00 -2.76 -0.05 0.00 -0.22 0.00 0.00 33.01 29.98 1nbw s GLN 208 CO 0.00 -0.05 -0.06 0.14 -0.25 0.00 0.00 175.29 175.07 1nbw s VAL 209 N -2.28 2.72 0.49 1.09 -7.23 -1.26 -4.35 120.40 109.58 1nbw s VAL 209 Ca 0.47 -2.11 -0.22 0.00 -1.81 0.00 0.00 61.98 58.31 1nbw s VAL 209 Cb -0.10 -2.65 -0.07 0.00 0.56 0.00 0.00 36.38 34.12 1nbw s VAL 209 CO 0.33 -0.29 1.18 0.68 -0.31 0.00 0.00 175.10 176.68 1nbw s VAL 210 N -2.49 3.00 0.00 1.32 -7.23 -0.06 -4.80 120.40 110.14 1nbw s VAL 210 Ca 0.32 0.72 0.00 0.00 -1.81 0.00 0.00 61.98 61.21 1nbw s VAL 210 Cb -0.02 -3.34 0.00 0.00 0.56 0.00 0.00 36.38 33.57 1nbw s VAL 210 CO 0.18 -0.04 0.15 -2.11 -0.31 0.00 0.00 175.10 172.96 1nbw n ARG 211 N -0.76 2.11 -0.07 4.82 1.85 -1.26 -4.68 116.66 118.68 1nbw n ARG 211 Ca 0.09 -0.15 -0.14 0.00 -1.00 0.00 0.00 57.85 56.65 1nbw n ARG 211 Cb 0.48 -0.55 -0.05 0.00 -1.05 0.00 0.00 32.46 31.30 1nbw n ARG 211 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1nbw n ILE 212 N -0.34 1.14 0.88 8.89 5.41 -1.26 -4.44 119.36 129.63 1nbw n ILE 212 Ca 0.00 -0.06 0.09 0.00 1.00 0.00 0.00 62.75 63.78 1nbw n ILE 212 Cb 0.04 -1.87 0.47 0.00 -0.71 0.00 0.00 39.64 37.57 1nbw n ILE 212 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1nbw n LEU 213 N -3.92 0.00 -1.27 1.39 4.77 -1.26 -1.46 117.00 115.26 1nbw n LEU 213 Ca -0.25 0.28 0.09 0.00 -0.03 0.00 0.00 56.01 56.10 1nbw n LEU 213 Cb 0.58 -0.28 0.30 0.00 -2.33 0.00 0.00 43.42 41.70 1nbw n LEU 213 CO 0.06 -0.11 0.76 -1.54 -1.33 0.00 0.00 177.39 175.23 1nbw n SER 214 N -1.28 4.12 -4.09 -1.43 3.41 -1.26 -4.31 113.62 108.78 1nbw n SER 214 Ca 0.09 -2.31 -0.32 0.00 -0.26 0.00 0.00 58.87 56.07 1nbw n SER 214 Cb 0.14 -0.48 -0.16 0.00 -0.26 0.00 0.00 64.21 63.45 1nbw n SER 214 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1nbw s ASN 215 N -1.05 3.19 0.30 4.04 3.84 -0.53 -4.72 114.94 120.00 1nbw s ASN 215 Ca 0.44 -0.70 0.05 0.00 0.21 0.00 0.00 52.86 52.85 1nbw s ASN 215 Cb 0.27 -1.42 0.72 0.00 -0.55 0.00 0.00 41.25 40.27 1nbw s ASN 215 CO 0.23 -0.04 1.76 -0.65 -2.79 0.00 0.00 177.10 175.61 1nbw h PRO 216 N 7.95 0.64 0.00 0.43 0.11 -1.89 0.12 132.00 139.36 1nbw h PRO 216 Ca -0.41 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.53 1nbw h PRO 216 Cb 1.13 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 1nbw h PRO 216 CO 0.59 0.42 -0.63 1.88 -0.21 0.00 0.00 178.00 180.06 1nbw h TYR 217 N 0.66 0.00 -0.57 0.65 0.99 -1.95 -0.10 116.97 116.65 1nbw h TYR 217 Ca 0.56 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 61.24 1nbw h TYR 217 Cb 0.92 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 38.63 1nbw h TYR 217 CO -0.04 0.63 0.13 0.78 -0.00 0.00 0.00 178.16 179.66 1nbw h GLY 218 N 1.92 0.99 1.04 3.88 0.00 -0.96 0.10 103.07 110.05 1nbw h GLY 218 Ca -0.01 -0.63 -0.17 0.00 0.00 0.00 0.00 47.33 46.52 1nbw h GLY 218 CO 0.08 0.59 -0.53 -2.22 0.00 0.00 0.00 176.54 174.46 1nbw h ILE 219 N 0.83 1.30 -0.94 2.60 2.04 -1.11 -2.77 117.51 119.46 1nbw h ILE 219 Ca 0.18 -1.74 0.05 0.00 1.00 0.00 0.00 64.86 64.35 1nbw h ILE 219 Cb 0.36 1.84 -0.06 0.00 -0.74 0.00 0.00 36.82 38.22 1nbw h ILE 219 CO 0.00 0.55 0.61 0.00 0.00 0.00 0.00 178.15 179.32 1nbw h ALA 220 N 0.60 1.44 0.32 1.87 0.00 -0.72 -0.72 119.26 122.06 1nbw h ALA 220 Ca -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1nbw h ALA 220 Cb 1.14 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1nbw h ALA 220 CO 0.11 0.43 -0.15 1.15 0.00 0.00 0.00 179.25 180.79 1nbw h THR 221 N 1.12 0.70 -0.42 0.00 2.02 -0.74 0.48 112.91 116.08 1nbw h THR 221 Ca 0.39 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.46 1nbw h THR 221 Cb 0.12 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1nbw h THR 221 CO -0.14 0.02 0.27 -0.26 0.37 0.00 0.00 175.52 175.79 1nbw h PHE 222 N -0.49 0.52 -0.27 3.16 0.05 -1.15 -3.01 116.94 115.75 1nbw h PHE 222 Ca -0.04 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.76 1nbw h PHE 222 Cb 0.37 -0.18 0.00 0.00 2.00 0.00 0.00 35.95 38.14 1nbw h PHE 222 CO -0.04 0.33 0.00 1.19 -0.18 0.00 0.00 178.31 179.61 1nbw n PHE 223 N -4.80 0.34 -3.82 -0.55 0.99 -0.32 -4.97 117.46 104.34 1nbw n PHE 223 Ca 0.01 -0.17 -0.28 0.00 -0.00 0.00 0.00 57.45 57.01 1nbw n PHE 223 Cb 0.02 0.00 0.01 0.00 -1.00 0.00 0.00 39.48 38.52 1nbw n PHE 223 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nbw n GLY 224 N 1.29 -0.56 3.86 1.37 0.00 0.16 -4.93 105.19 106.38 1nbw n GLY 224 Ca 0.17 0.27 -0.31 0.00 0.00 0.00 0.00 46.02 46.15 1nbw n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nbw s LEU 225 N -6.74 3.87 0.54 0.99 1.43 -0.56 -5.04 118.68 113.16 1nbw s LEU 225 Ca 0.21 1.29 -0.09 0.00 -1.03 0.00 0.00 54.13 54.50 1nbw s LEU 225 Cb -0.08 -4.16 -0.04 0.00 0.03 0.00 0.00 46.19 41.94 1nbw s LEU 225 CO 0.87 -0.38 0.92 -0.94 0.23 0.00 0.00 176.35 177.05 1nbw s SER 226 N -2.83 6.30 0.29 2.29 1.04 -1.26 -4.81 113.70 114.71 1nbw s SER 226 Ca 0.54 1.23 0.03 0.00 0.48 0.00 0.00 55.95 58.23 1nbw s SER 226 Cb -0.10 -2.38 0.66 0.00 0.10 0.00 0.00 66.02 64.30 1nbw s SER 226 CO 0.26 -0.70 1.78 -0.65 0.98 0.00 0.00 173.24 174.91 1nbw h PRO 227 N 0.11 0.74 -0.47 4.02 0.11 -1.99 0.23 132.00 134.76 1nbw h PRO 227 Ca -0.46 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 1nbw h PRO 227 Cb 1.19 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1nbw h PRO 227 CO 0.62 0.49 0.07 1.49 -0.21 0.00 0.00 178.00 180.46 1nbw h GLU 228 N 0.77 0.78 -0.01 1.05 4.81 -2.00 -1.77 114.58 118.20 1nbw h GLU 228 Ca 0.54 -0.21 -0.09 0.00 -0.13 0.00 0.00 59.36 59.47 1nbw h GLU 228 Cb 0.77 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1nbw h GLU 228 CO -0.36 0.80 -0.42 0.93 -0.73 0.00 0.00 179.01 179.22 1nbw h GLU 229 N 0.65 0.03 -0.22 1.92 5.08 -1.47 -2.78 114.58 117.78 1nbw h GLU 229 Ca 0.14 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1nbw h GLU 229 Cb 0.39 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1nbw h GLU 229 CO 0.01 0.44 0.01 1.15 -1.00 0.00 0.00 179.01 179.63 1nbw h THR 230 N 0.02 1.24 -0.70 1.13 2.02 -0.32 -2.47 112.91 113.84 1nbw h THR 230 Ca -0.00 -0.84 0.13 0.00 0.77 0.00 0.00 66.41 66.48 1nbw h THR 230 Cb 0.75 1.36 -0.04 0.00 -1.74 0.00 0.00 68.15 68.48 1nbw h THR 230 CO 0.06 0.26 0.47 1.56 0.37 0.00 0.00 175.52 178.24 1nbw h GLN 231 N 0.17 0.39 0.00 6.66 4.20 -1.07 -1.33 115.11 124.13 1nbw h GLN 231 Ca 0.07 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1nbw h GLN 231 Cb 0.37 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 1nbw h GLN 231 CO 0.01 0.26 -0.13 0.00 -0.67 0.00 0.00 178.83 178.29 1nbw h ALA 232 N 1.66 0.96 -0.01 3.87 0.00 -1.21 -3.22 119.26 121.30 1nbw h ALA 232 Ca 0.34 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1nbw h ALA 232 Cb 0.77 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1nbw h ALA 232 CO -0.10 0.16 -0.28 0.44 0.00 0.00 0.00 179.25 179.47 1nbw n ILE 233 N -3.19 0.00 -0.34 0.00 -6.64 -0.51 -4.28 119.36 104.40 1nbw n ILE 233 Ca 0.02 -0.23 0.17 0.00 -1.77 0.00 0.00 62.75 60.94 1nbw n ILE 233 Cb 0.48 0.85 0.39 0.00 -1.44 0.00 0.00 39.64 39.91 1nbw n ILE 233 CO 0.00 0.00 0.00 0.58 -1.77 0.00 0.00 176.55 175.36 1nbw h VAL 234 N 2.16 0.57 -0.63 7.28 2.07 -1.54 0.23 116.25 126.40 1nbw h VAL 234 Ca 0.00 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1nbw h VAL 234 Cb 0.65 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 1nbw h VAL 234 CO 0.00 0.11 0.35 -0.65 0.02 0.00 0.00 177.57 177.40 1nbw h PRO 235 N 0.60 0.86 -0.20 1.57 0.11 -1.84 0.73 132.00 133.83 1nbw h PRO 235 Ca 0.63 -0.09 -0.06 0.00 0.11 0.00 0.00 66.00 66.59 1nbw h PRO 235 Cb 1.19 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1nbw h PRO 235 CO -0.44 0.63 -0.11 0.82 -0.21 0.00 0.00 178.00 178.69 1nbw h ILE 236 N 0.87 1.31 -0.47 4.15 2.04 -0.86 -0.76 117.51 123.79 1nbw h ILE 236 Ca 0.22 -1.20 0.00 0.00 1.00 0.00 0.00 64.86 64.89 1nbw h ILE 236 Cb 0.02 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 1nbw h ILE 236 CO -0.04 0.36 0.30 0.00 0.00 0.00 0.00 178.15 178.78 1nbw h ALA 237 N 0.69 0.59 -0.46 1.87 0.00 -0.94 -2.32 119.26 118.69 1nbw h ALA 237 Ca 0.04 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1nbw h ALA 237 Cb 0.61 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1nbw h ALA 237 CO 0.03 0.06 0.24 -0.09 0.00 0.00 0.00 179.25 179.49 1nbw h ARG 238 N 0.63 0.47 0.00 0.00 2.43 -0.77 -1.78 114.38 115.36 1nbw h ARG 238 Ca 0.17 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1nbw h ARG 238 Cb -0.05 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1nbw h ARG 238 CO -0.04 0.31 -0.05 0.00 -1.51 0.00 0.00 179.97 178.68 1nbw h ALA 239 N 1.23 1.58 -0.00 2.80 0.00 -0.73 -2.26 119.26 121.88 1nbw h ALA 239 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1nbw h ALA 239 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1nbw h ALA 239 CO -0.12 0.07 -0.47 1.28 0.00 0.00 0.00 179.25 180.01 1nbw n LEU 240 N -3.99 0.61 -4.66 0.00 4.77 -0.71 -4.89 117.00 108.13 1nbw n LEU 240 Ca -0.03 -0.06 -0.46 0.00 -0.03 0.00 0.00 56.01 55.43 1nbw n LEU 240 Cb 0.14 -0.22 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 1nbw n LEU 240 CO 0.30 0.14 1.08 -0.38 -1.33 0.00 0.00 177.39 177.21 1nbw n ILE 241 N -1.35 0.41 0.00 -0.08 5.41 -0.85 -1.42 119.36 121.48 1nbw n ILE 241 Ca 0.07 -0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.71 1nbw n ILE 241 Cb 0.34 -1.44 0.00 0.00 -0.71 0.00 0.00 39.64 37.83 1nbw n ILE 241 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1nbw n GLY 242 N 2.79 2.87 3.77 7.39 0.00 -1.26 -5.04 105.19 115.71 1nbw n GLY 242 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1nbw n GLY 242 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nbw s ASN 243 N -1.38 4.83 -0.01 1.61 -0.87 -0.51 -4.83 114.94 113.78 1nbw s ASN 243 Ca 0.00 1.91 0.22 0.00 -1.57 0.00 0.00 52.86 53.42 1nbw s ASN 243 Cb 0.00 -2.54 -0.30 0.00 -0.02 0.00 0.00 41.25 38.39 1nbw s ASN 243 CO 0.00 -1.81 0.56 -1.14 -2.57 0.00 0.00 177.10 172.13 1nbw n ARG 244 N -2.93 0.60 -4.01 -0.60 0.63 -1.26 -0.88 116.66 108.21 1nbw n ARG 244 Ca 0.10 -0.16 -0.09 0.00 -0.92 0.00 0.00 57.85 56.78 1nbw n ARG 244 Cb 0.52 -1.54 -0.11 0.00 0.45 0.00 0.00 32.46 31.79 1nbw n ARG 244 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1nbw s SER 245 N -4.44 0.35 -0.04 6.15 0.01 -1.26 -0.62 113.70 113.85 1nbw s SER 245 Ca -0.06 -0.59 -0.29 0.00 1.31 0.00 0.00 55.95 56.32 1nbw s SER 245 Cb 0.14 0.11 0.10 0.00 0.21 0.00 0.00 66.02 66.58 1nbw s SER 245 CO 0.90 -0.34 0.85 0.00 0.41 0.00 0.00 173.24 175.06 1nbw s ALA 246 N -1.87 -1.82 -0.03 1.44 0.00 -0.69 -4.48 121.76 114.31 1nbw s ALA 246 Ca -0.11 1.17 -0.01 0.00 0.00 0.00 0.00 51.96 53.00 1nbw s ALA 246 Cb -0.07 0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.16 1nbw s ALA 246 CO -0.02 -0.54 0.06 0.08 0.00 0.00 0.00 175.76 175.34 1nbw s VAL 247 N -2.31 -0.05 -0.06 0.00 1.01 -0.90 -1.49 120.40 116.60 1nbw s VAL 247 Ca 0.00 0.20 0.05 0.00 0.00 0.00 0.00 61.98 62.23 1nbw s VAL 247 Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 36.38 36.24 1nbw s VAL 247 CO -0.03 0.08 -0.22 -0.69 0.00 0.00 0.00 175.10 174.24 1nbw s VAL 248 N 1.05 1.79 -0.02 2.92 1.01 -0.39 -1.10 120.40 125.65 1nbw s VAL 248 Ca -0.09 -0.91 0.06 0.00 0.00 0.00 0.00 61.98 61.04 1nbw s VAL 248 Cb -0.12 -1.53 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 1nbw s VAL 248 CO -0.04 0.50 -0.20 -0.76 0.00 0.00 0.00 175.10 174.61 1nbw s LEU 249 N -0.01 2.42 -0.67 3.92 1.02 -0.16 -0.69 118.68 124.50 1nbw s LEU 249 Ca -0.06 -0.35 -0.21 0.00 0.02 0.00 0.00 54.13 53.53 1nbw s LEU 249 Cb -0.13 -1.45 0.09 0.00 0.02 0.00 0.00 46.19 44.71 1nbw s LEU 249 CO 0.04 0.32 0.91 -0.75 0.02 0.00 0.00 176.35 176.89 1nbw s LYS 250 N -0.79 3.15 0.15 1.70 2.20 -0.48 -4.75 119.74 120.92 1nbw s LYS 250 Ca 0.11 -1.08 0.07 0.00 -0.36 0.00 0.00 55.97 54.72 1nbw s LYS 250 Cb -0.10 -4.31 -0.04 0.00 -1.51 0.00 0.00 37.83 31.86 1nbw s LYS 250 CO 0.01 -1.73 -0.05 0.95 -0.36 0.00 0.00 175.35 174.17 1nbw s THR 251 N 3.52 3.54 0.02 3.43 -4.23 -1.26 -4.47 115.64 116.18 1nbw s THR 251 Ca 0.20 -1.41 -0.04 0.00 -1.18 0.00 0.00 61.69 59.26 1nbw s THR 251 Cb -0.18 -2.74 -0.01 0.00 1.34 0.00 0.00 72.50 70.92 1nbw s THR 251 CO 0.07 -0.04 0.89 -2.65 -0.54 0.00 0.00 174.62 172.34 1nbw n PRO 252 N 0.15 -0.06 -0.00 3.99 -0.02 -1.26 -3.48 135.00 134.32 1nbw n PRO 252 Ca -0.11 0.89 0.03 0.00 -2.02 0.00 0.00 63.50 62.29 1nbw n PRO 252 Cb 0.54 -1.32 -0.04 0.00 -0.02 0.00 0.00 33.50 32.66 1nbw n PRO 252 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1nbw n GLN 253 N -3.17 3.99 -0.50 -0.52 1.13 -1.26 -5.06 117.38 111.99 1nbw n GLN 253 Ca 0.00 -0.01 -0.19 0.00 -1.94 0.00 0.00 57.00 54.86 1nbw n GLN 253 Cb 0.03 -0.87 -0.02 0.00 0.11 0.00 0.00 30.24 29.49 1nbw n GLN 253 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nbw n GLY 254 N 1.34 -0.18 3.75 1.08 0.00 -1.23 -4.92 105.19 105.04 1nbw n GLY 254 Ca 0.01 0.23 -0.05 0.00 0.00 0.00 0.00 46.02 46.21 1nbw n GLY 254 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1nbw s ASP 255 N -0.05 -0.23 -0.17 1.61 -4.77 -1.15 -4.86 116.67 107.05 1nbw s ASP 255 Ca 0.29 -0.41 -0.01 0.00 -3.30 0.00 0.00 52.55 49.13 1nbw s ASP 255 Cb -0.41 0.54 -0.00 0.00 -1.09 0.00 0.00 42.92 41.96 1nbw s ASP 255 CO 0.19 -0.99 -0.12 -0.69 0.70 0.00 0.00 175.17 174.26 1nbw s VAL 256 N -3.45 2.87 -0.03 2.11 1.01 -1.26 -0.63 120.40 121.03 1nbw s VAL 256 Ca 0.11 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.43 1nbw s VAL 256 Cb -0.02 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1nbw s VAL 256 CO 0.02 0.50 -0.11 0.00 0.00 0.00 0.00 175.10 175.51 1nbw s GLN 257 N 0.93 1.13 -0.19 2.72 -2.07 -0.54 -4.72 119.66 116.92 1nbw s GLN 257 Ca -0.02 -0.36 -0.02 0.00 -1.82 0.00 0.00 55.36 53.13 1nbw s GLN 257 Cb -0.15 -1.03 -0.01 0.00 -1.09 0.00 0.00 33.01 30.73 1nbw s GLN 257 CO -0.01 0.13 -0.08 -1.12 -1.32 0.00 0.00 175.29 172.89 1nbw s SER 258 N 0.18 4.10 0.04 12.60 0.01 -1.26 -0.53 113.70 128.84 1nbw s SER 258 Ca -0.03 -0.40 -0.08 0.00 1.31 0.00 0.00 55.95 56.74 1nbw s SER 258 Cb -0.09 -1.68 -0.00 0.00 0.21 0.00 0.00 66.02 64.46 1nbw s SER 258 CO 0.01 0.03 0.17 0.00 0.41 0.00 0.00 173.24 173.86 1nbw s ARG 259 N 1.15 0.68 0.49 12.44 1.70 -0.46 -4.98 118.95 129.96 1nbw s ARG 259 Ca 0.01 -0.69 -0.23 0.00 -0.47 0.00 0.00 55.73 54.35 1nbw s ARG 259 Cb -0.14 0.28 -0.07 0.00 -0.57 0.00 0.00 34.95 34.45 1nbw s ARG 259 CO -0.02 -0.19 1.33 0.08 -1.08 0.00 0.00 175.30 175.42 1nbw s VAL 260 N -2.69 2.33 0.00 4.99 1.01 -1.26 -1.54 120.40 123.24 1nbw s VAL 260 Ca -0.04 0.27 0.06 0.00 0.00 0.00 0.00 61.98 62.27 1nbw s VAL 260 Cb -0.01 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 1nbw s VAL 260 CO -0.05 0.01 -0.18 0.27 0.00 0.00 0.00 175.10 175.15 1nbw s ILE 261 N -1.31 1.45 -0.07 2.22 -4.36 -0.67 -4.86 121.20 113.60 1nbw s ILE 261 Ca 0.65 -0.88 -0.34 0.00 -0.26 0.00 0.00 60.65 59.83 1nbw s ILE 261 Cb -0.39 -1.23 -0.11 0.00 1.25 0.00 0.00 42.46 41.98 1nbw s ILE 261 CO 0.48 0.33 1.89 -0.81 0.24 0.00 0.00 174.94 177.07 1nbw n PRO 262 N 2.41 2.26 -0.00 0.37 -0.04 -1.26 -4.74 135.00 133.99 1nbw n PRO 262 Ca -0.16 0.83 0.03 0.00 -0.04 0.00 0.00 63.50 64.17 1nbw n PRO 262 Cb 0.54 -2.69 -0.05 0.00 -0.04 0.00 0.00 33.50 31.26 1nbw n PRO 262 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nbw n ALA 263 N 6.74 2.27 0.00 0.55 0.00 -1.26 -5.04 120.51 123.76 1nbw n ALA 263 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1nbw n ALA 263 Cb 0.31 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.53 1nbw n ALA 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nbw n GLY 264 N 2.09 -0.37 3.24 0.00 0.00 -1.26 -4.86 105.19 104.03 1nbw n GLY 264 Ca -0.01 -2.27 -0.14 0.00 0.00 0.00 0.00 46.02 43.60 1nbw n GLY 264 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nbw s ASN 265 N -0.98 1.63 -0.13 1.61 0.01 -1.26 -1.31 114.94 114.51 1nbw s ASN 265 Ca 0.00 -1.05 0.01 0.00 -0.71 0.00 0.00 52.86 51.11 1nbw s ASN 265 Cb 0.00 0.02 -0.01 0.00 0.41 0.00 0.00 41.25 41.67 1nbw s ASN 265 CO 0.00 -0.40 -0.16 -0.76 -1.51 0.00 0.00 177.10 174.27 1nbw s LEU 266 N -3.16 2.51 -0.42 0.60 1.43 -0.07 -3.41 118.68 116.15 1nbw s LEU 266 Ca 0.18 -0.42 -0.08 0.00 -1.03 0.00 0.00 54.13 52.78 1nbw s LEU 266 Cb 0.04 -1.55 0.09 0.00 0.03 0.00 0.00 46.19 44.79 1nbw s LEU 266 CO 0.01 0.15 0.26 -0.31 0.23 0.00 0.00 176.35 176.68 1nbw s TYR 267 N 0.45 3.37 -0.22 0.29 1.51 0.64 -1.78 117.35 121.61 1nbw s TYR 267 Ca -0.12 -1.68 -0.17 0.00 -1.01 0.00 0.00 57.07 54.09 1nbw s TYR 267 Cb -0.16 -3.05 -0.03 0.00 -0.11 0.00 0.00 41.96 38.61 1nbw s TYR 267 CO 0.05 -0.88 0.46 0.42 -1.11 0.00 0.00 175.55 174.49 1nbw s ILE 268 N 1.38 5.13 -0.44 2.71 1.01 -0.26 -1.97 121.20 128.76 1nbw s ILE 268 Ca 0.04 0.82 -0.13 0.00 0.00 0.00 0.00 60.65 61.37 1nbw s ILE 268 Cb -0.23 -3.79 0.07 0.00 0.01 0.00 0.00 42.46 38.52 1nbw s ILE 268 CO 0.01 0.17 0.33 -0.44 0.00 0.00 0.00 174.94 175.01 1nbw s SER 269 N 1.27 5.93 0.76 3.58 0.01 -0.10 -0.10 113.70 125.06 1nbw s SER 269 Ca 0.21 -1.35 -0.06 0.00 1.31 0.00 0.00 55.95 56.06 1nbw s SER 269 Cb -0.15 -2.10 0.12 0.00 0.21 0.00 0.00 66.02 64.10 1nbw s SER 269 CO 0.09 -0.58 1.06 -0.83 0.41 0.00 0.00 173.24 173.40 1nbw s GLY 270 N 2.30 1.75 0.35 3.44 0.00 -0.89 0.18 107.32 114.44 1nbw s GLY 270 Ca 0.04 -1.34 0.14 0.00 0.00 0.00 0.00 44.72 43.55 1nbw s GLY 270 CO 0.05 -0.79 1.76 -2.09 0.00 0.00 0.00 173.10 172.03 1nbw h GLU 271 N -0.78 0.00 0.00 2.90 4.81 -1.17 -3.38 114.58 116.97 1nbw h GLU 271 Ca -0.41 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.72 1nbw h GLU 271 Cb 1.28 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.64 1nbw h GLU 271 CO 0.46 0.44 -1.33 1.63 -0.73 0.00 0.00 179.01 179.48 1nbw n LYS 272 N -3.90 0.13 -0.31 1.92 5.02 -1.26 -5.08 118.16 114.68 1nbw n LYS 272 Ca -0.01 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1nbw n LYS 272 Cb 0.48 -0.84 0.00 0.00 -0.02 0.00 0.00 35.03 34.65 1nbw n LYS 272 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1nbw n ARG 273 N -3.09 2.56 -3.78 1.97 1.74 -1.26 -5.15 116.66 109.65 1nbw n ARG 273 Ca -0.11 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.84 1nbw n ARG 273 Cb 0.59 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.94 1nbw n ARG 273 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1nbw s ARG 274 N 1.42 0.60 0.20 5.56 3.52 -1.26 -2.11 118.95 126.89 1nbw s ARG 274 Ca 0.00 -0.18 -0.09 0.00 -0.13 0.00 0.00 55.73 55.34 1nbw s ARG 274 Cb 0.00 0.27 -0.01 0.00 -1.56 0.00 0.00 34.95 33.64 1nbw s ARG 274 CO 0.00 -0.16 0.32 0.20 -0.81 0.00 0.00 175.30 174.85 1nbw s GLY 275 N -1.20 0.70 0.02 8.12 0.00 0.86 -4.93 107.32 110.89 1nbw s GLY 275 Ca -0.13 -1.05 -0.06 0.00 0.00 0.00 0.00 44.72 43.48 1nbw s GLY 275 CO 0.03 -0.88 0.10 -0.54 0.00 0.00 0.00 173.10 171.81 1nbw s GLU 276 N -4.02 0.50 -0.06 2.90 2.02 -1.26 -1.10 118.70 117.67 1nbw s GLU 276 Ca 0.23 -0.56 -0.04 0.00 0.02 0.00 0.00 54.97 54.63 1nbw s GLU 276 Cb 0.03 0.20 0.03 0.00 0.10 0.00 0.00 34.13 34.48 1nbw s GLU 276 CO 0.06 -0.12 0.14 0.00 0.02 0.00 0.00 175.26 175.36 1nbw s ALA 277 N -1.83 -0.30 -0.51 5.21 0.00 -0.73 -4.90 121.76 118.70 1nbw s ALA 277 Ca -0.12 0.54 -0.21 0.00 0.00 0.00 0.00 51.96 52.18 1nbw s ALA 277 Cb -0.06 -0.35 0.05 0.00 0.00 0.00 0.00 23.12 22.76 1nbw s ALA 277 CO -0.01 -0.11 0.75 0.34 0.00 0.00 0.00 175.76 176.73 1nbw s ASP 278 N 0.67 6.29 0.38 0.00 -1.08 -1.26 -0.89 116.67 120.77 1nbw s ASP 278 Ca -0.05 -0.59 0.18 0.00 -0.52 0.00 0.00 52.55 51.58 1nbw s ASP 278 Cb -0.07 -2.35 1.14 0.00 -1.46 0.00 0.00 42.92 40.18 1nbw s ASP 278 CO -0.03 -1.00 1.70 0.58 0.52 0.00 0.00 175.17 176.93 1nbw h VAL 279 N 5.93 0.36 0.00 1.11 2.07 -1.54 0.42 116.25 124.59 1nbw h VAL 279 Ca -0.27 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1nbw h VAL 279 Cb 1.09 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1nbw h VAL 279 CO 1.00 0.06 0.00 0.00 0.02 0.00 0.00 177.57 178.65 1nbw n ALA 280 N -2.40 1.68 0.31 1.67 0.00 -1.26 -2.25 120.51 118.27 1nbw n ALA 280 Ca 0.30 -0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.80 1nbw n ALA 280 Cb 1.02 -1.18 0.26 0.00 0.00 0.00 0.00 19.45 19.55 1nbw n ALA 280 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1nbw n GLU 281 N -1.28 2.38 0.00 0.00 1.02 0.15 -4.97 120.64 117.93 1nbw n GLU 281 Ca 0.05 -2.11 0.00 0.00 -0.02 0.00 0.00 57.16 55.09 1nbw n GLU 281 Cb 0.09 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 1nbw n GLU 281 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nbw n GLY 282 N 1.45 1.72 0.25 0.62 0.00 -0.95 -4.51 105.19 103.77 1nbw n GLY 282 Ca 0.20 -1.86 -0.03 0.00 0.00 0.00 0.00 46.02 44.33 1nbw n GLY 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nbw h ALA 283 N 0.00 1.16 -0.25 4.61 0.00 -1.87 -3.04 119.26 119.87 1nbw h ALA 283 Ca 0.00 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.64 1nbw h ALA 283 Cb 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1nbw h ALA 283 CO 0.00 0.53 0.07 1.49 0.00 0.00 0.00 179.25 181.34 1nbw h GLU 284 N 0.49 0.17 0.00 0.00 4.81 -1.87 0.47 114.58 118.64 1nbw h GLU 284 Ca 0.08 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1nbw h GLU 284 Cb 0.56 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 1nbw h GLU 284 CO 0.04 0.11 -0.11 0.00 -0.73 0.00 0.00 179.01 178.31 1nbw h ALA 285 N 1.17 1.81 -0.19 2.92 0.00 -1.77 0.17 119.26 123.36 1nbw h ALA 285 Ca 0.11 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 1nbw h ALA 285 Cb 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1nbw h ALA 285 CO -0.13 0.14 -0.56 0.82 0.00 0.00 0.00 179.25 179.52 1nbw h ILE 286 N 0.00 1.31 -0.20 0.00 2.04 -1.11 -2.58 117.51 116.97 1nbw h ILE 286 Ca -0.00 -1.78 -0.15 0.00 1.00 0.00 0.00 64.86 63.93 1nbw h ILE 286 Cb 0.20 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 1nbw h ILE 286 CO 0.01 0.56 -0.50 0.24 0.00 0.00 0.00 178.15 178.46 1nbw h MET 287 N 0.43 0.54 -0.88 2.37 2.86 -0.33 -1.68 114.93 118.24 1nbw h MET 287 Ca -0.02 -0.32 0.01 0.00 -2.06 0.00 0.00 59.70 57.32 1nbw h MET 287 Cb 1.18 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.82 1nbw h MET 287 CO 0.12 0.92 0.58 1.96 1.06 0.00 0.00 176.91 181.55 1nbw h GLN 288 N 0.42 1.15 -0.23 1.72 1.08 -0.68 0.17 115.11 118.74 1nbw h GLN 288 Ca 0.02 -0.07 -0.15 0.00 -1.45 0.00 0.00 58.65 57.00 1nbw h GLN 288 Cb 1.03 -0.26 -0.01 0.00 -0.05 0.00 0.00 27.48 28.19 1nbw h GLN 288 CO 0.09 0.76 -0.48 0.00 -0.95 0.00 0.00 178.83 178.25 1nbw h ALA 289 N 1.46 0.74 -0.06 3.87 0.00 -1.24 -1.09 119.26 122.94 1nbw h ALA 289 Ca 0.32 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1nbw h ALA 289 Cb -0.12 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1nbw h ALA 289 CO -0.07 0.67 0.03 0.52 0.00 0.00 0.00 179.25 180.39 1nbw h MET 290 N 0.48 0.06 -0.72 0.00 2.86 -0.21 -1.76 114.93 115.63 1nbw h MET 290 Ca 0.03 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1nbw h MET 290 Cb 1.01 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.63 1nbw h MET 290 CO 0.09 0.04 0.43 1.03 1.06 0.00 0.00 176.91 179.56 1nbw h SER 291 N 0.06 0.88 0.35 1.22 0.87 -0.62 -1.87 113.55 114.44 1nbw h SER 291 Ca 0.02 -0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 1nbw h SER 291 Cb 0.00 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 61.74 1nbw h SER 291 CO -0.02 0.70 -0.16 0.00 -0.53 0.00 0.00 176.83 176.82 1nbw h ALA 292 N 1.22 1.36 -0.22 6.23 0.00 -0.87 -2.69 119.26 124.29 1nbw h ALA 292 Ca 0.26 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1nbw h ALA 292 Cb -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1nbw h ALA 292 CO -0.05 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1nbw n ALA 294 N 1.25 2.21 -2.53 0.00 0.00 -0.75 -3.38 120.51 117.31 1nbw n ALA 294 Ca 0.15 0.38 -0.41 0.00 0.00 0.00 0.00 53.44 53.56 1nbw n ALA 294 Cb 0.54 -2.42 -0.04 0.00 0.00 0.00 0.00 19.45 17.53 1nbw n ALA 294 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1nbw s PRO 295 N -0.53 4.58 0.30 0.00 0.02 -1.26 -4.78 135.00 133.33 1nbw s PRO 295 Ca 0.65 1.32 -0.29 0.00 0.02 0.00 0.00 61.00 62.70 1nbw s PRO 295 Cb -0.53 -3.42 -0.10 0.00 0.02 0.00 0.00 34.50 30.47 1nbw s PRO 295 CO 0.49 0.09 1.11 0.08 -0.33 0.00 0.00 177.00 178.44 1nbw s VAL 296 N 0.53 3.43 -0.16 3.83 1.01 -1.22 -1.01 120.40 126.81 1nbw s VAL 296 Ca 0.47 1.40 0.02 0.00 0.00 0.00 0.00 61.98 63.88 1nbw s VAL 296 Cb -0.21 -3.87 -0.11 0.00 0.00 0.00 0.00 36.38 32.18 1nbw s VAL 296 CO 0.27 0.30 -0.13 -1.14 0.00 0.00 0.00 175.10 174.41 1nbw n ARG 297 N 1.00 0.58 -3.55 2.72 3.00 0.13 -4.80 116.66 115.74 1nbw n ARG 297 Ca -0.00 0.08 -0.12 0.00 -0.00 0.00 0.00 57.85 57.81 1nbw n ARG 297 Cb 0.45 -1.33 -0.04 0.00 0.00 0.00 0.00 32.46 31.54 1nbw n ARG 297 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1nbw s ASP 298 N -5.49 -0.42 0.01 6.15 2.15 -1.01 -4.12 116.67 113.93 1nbw s ASP 298 Ca -0.21 -0.00 0.00 0.00 0.43 0.00 0.00 52.55 52.77 1nbw s ASP 298 Cb 0.06 0.52 -0.01 0.00 -0.30 0.00 0.00 42.92 43.18 1nbw s ASP 298 CO 0.40 -0.83 -0.03 -0.63 -0.17 0.00 0.00 175.17 173.92 1nbw s ILE 299 N -3.18 0.15 0.01 4.11 1.01 -1.21 -0.92 121.20 121.17 1nbw s ILE 299 Ca -0.01 -0.48 -0.03 0.00 0.00 0.00 0.00 60.65 60.13 1nbw s ILE 299 Cb -0.00 -0.21 -0.01 0.00 0.01 0.00 0.00 42.46 42.25 1nbw s ILE 299 CO -0.08 -0.21 0.04 -0.60 0.00 0.00 0.00 174.94 174.09 1nbw s ARG 300 N -0.72 0.39 0.46 2.79 3.52 -0.83 -4.71 118.95 119.84 1nbw s ARG 300 Ca -0.07 -0.55 0.03 0.00 -0.13 0.00 0.00 55.73 55.02 1nbw s ARG 300 Cb -0.05 0.15 -0.04 0.00 -1.56 0.00 0.00 34.95 33.45 1nbw s ARG 300 CO -0.00 -0.08 0.02 0.20 -0.81 0.00 0.00 175.30 174.63 1nbw s GLY 301 N -1.48 2.77 0.20 8.12 0.00 -1.26 -0.26 107.32 115.40 1nbw s GLY 301 Ca -0.15 -1.17 -0.29 0.00 0.00 0.00 0.00 44.72 43.12 1nbw s GLY 301 CO -0.00 -2.11 0.89 -0.54 0.00 0.00 0.00 173.10 171.34 1nbw s GLU 302 N -3.81 4.76 0.73 2.90 2.02 -1.22 -4.78 118.70 119.30 1nbw s GLU 302 Ca 0.18 1.39 -0.14 0.00 0.02 0.00 0.00 54.97 56.42 1nbw s GLU 302 Cb 0.05 -3.29 0.04 0.00 0.10 0.00 0.00 34.13 31.03 1nbw s GLU 302 CO 0.10 0.49 1.17 -2.14 0.02 0.00 0.00 175.26 174.90 1nbw s PRO 303 N -1.01 2.20 0.00 0.39 0.02 -1.26 -2.90 135.00 132.44 1nbw s PRO 303 Ca 0.40 1.63 0.00 0.00 0.02 0.00 0.00 61.00 63.05 1nbw s PRO 303 Cb -0.25 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.42 1nbw s PRO 303 CO 0.30 -1.76 0.00 0.41 -0.33 0.00 0.00 177.00 175.62 1nbw n GLY 304 N 0.10 1.58 3.89 0.52 0.00 -1.26 -5.02 105.19 105.00 1nbw n GLY 304 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 1nbw n GLY 304 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nbw s THR 305 N -3.59 3.40 -0.00 2.61 -4.23 -1.14 -5.01 115.64 107.69 1nbw s THR 305 Ca 0.00 -1.28 -0.23 0.00 -1.18 0.00 0.00 61.69 59.00 1nbw s THR 305 Cb 0.00 -3.17 -0.18 0.00 1.34 0.00 0.00 72.50 70.49 1nbw s THR 305 CO 0.00 -0.12 1.24 0.45 -0.54 0.00 0.00 174.62 175.64 1nbw h HIS 306 N 1.11 0.27 -0.12 3.99 3.86 -1.88 -1.73 115.15 120.64 1nbw h HIS 306 Ca -0.44 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 58.68 1nbw h HIS 306 Cb 1.26 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 29.67 1nbw h HIS 306 CO 0.50 0.73 0.08 0.00 0.86 0.00 0.00 177.93 180.10 1nbw h ALA 307 N 0.49 0.16 0.01 2.45 0.00 -1.91 -0.51 119.26 119.95 1nbw h ALA 307 Ca 0.00 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1nbw h ALA 307 Cb 0.72 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1nbw h ALA 307 CO 0.03 -0.35 -0.20 0.78 0.00 0.00 0.00 179.25 179.52 1nbw h GLY 308 N 0.15 -0.28 0.81 0.00 0.00 -1.70 -0.08 103.07 101.98 1nbw h GLY 308 Ca 0.04 0.23 0.06 0.00 0.00 0.00 0.00 47.33 47.66 1nbw h GLY 308 CO -0.01 -0.18 0.63 -1.33 0.00 0.00 0.00 176.54 175.66 1nbw h GLY 309 N -0.32 1.45 0.93 4.60 0.00 -1.14 -2.04 103.07 106.55 1nbw h GLY 309 Ca 0.05 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.87 1nbw h GLY 309 CO -0.17 0.35 0.03 1.98 0.00 0.00 0.00 176.54 178.73 1nbw h MET 310 N 1.16 0.64 -0.76 4.80 1.85 -0.45 0.37 114.93 122.54 1nbw h MET 310 Ca 0.41 -0.19 0.06 0.00 -0.61 0.00 0.00 59.70 59.37 1nbw h MET 310 Cb 0.13 -0.06 -0.06 0.00 0.43 0.00 0.00 31.60 32.03 1nbw h MET 310 CO -0.15 0.72 0.45 -0.07 -0.40 0.00 0.00 176.91 177.46 1nbw h LEU 311 N 0.46 0.69 -0.38 3.39 3.38 -0.48 -0.18 115.31 122.19 1nbw h LEU 311 Ca 0.11 0.02 -0.19 0.00 0.09 0.00 0.00 57.88 57.92 1nbw h LEU 311 Cb 0.42 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1nbw h LEU 311 CO 0.01 0.44 -0.75 -0.33 0.09 0.00 0.00 178.44 177.91 1nbw h GLU 312 N 0.82 0.41 -0.55 1.13 4.39 -1.19 -1.28 114.58 118.31 1nbw h GLU 312 Ca 0.34 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1nbw h GLU 312 Cb 0.19 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 1nbw h GLU 312 CO -0.18 0.98 0.35 -0.09 -1.16 0.00 0.00 179.01 178.91 1nbw h ARG 313 N 0.27 0.73 -0.28 2.33 2.43 -0.20 0.26 114.38 119.91 1nbw h ARG 313 Ca -0.03 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1nbw h ARG 313 Cb 1.33 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.71 1nbw h ARG 313 CO 0.13 0.50 0.11 0.28 -1.51 0.00 0.00 179.97 179.48 1nbw h VAL 314 N 0.74 1.18 0.18 0.20 2.07 -0.96 -1.57 116.25 118.09 1nbw h VAL 314 Ca 0.20 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.17 1nbw h VAL 314 Cb -0.05 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1nbw h VAL 314 CO -0.04 0.19 -0.33 -0.09 0.02 0.00 0.00 177.57 177.32 1nbw h ARG 315 N 0.30 -0.57 -0.43 1.57 2.43 -0.55 -2.06 114.38 115.07 1nbw h ARG 315 Ca 0.09 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.38 1nbw h ARG 315 Cb 0.20 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 29.80 1nbw h ARG 315 CO -0.01 -0.38 -0.02 -0.22 -1.51 0.00 0.00 179.97 177.84 1nbw h LYS 316 N -0.59 0.09 -0.68 0.20 3.64 -0.40 0.63 116.57 119.47 1nbw h LYS 316 Ca 0.02 -0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1nbw h LYS 316 Cb 0.60 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.32 1nbw h LYS 316 CO -0.15 0.06 0.30 0.28 -2.27 0.00 0.00 179.45 177.67 1nbw h VAL 317 N 0.09 0.80 -0.17 2.00 2.07 -0.92 0.21 116.25 120.33 1nbw h VAL 317 Ca 0.21 -0.18 -0.21 0.00 0.82 0.00 0.00 66.70 67.35 1nbw h VAL 317 Cb 0.31 0.24 0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1nbw h VAL 317 CO -0.37 0.09 -0.71 -0.03 0.02 0.00 0.00 177.57 176.57 1nbw h MET 318 N 0.52 0.74 0.56 1.57 1.85 -0.67 -1.57 114.93 117.93 1nbw h MET 318 Ca 0.34 -0.57 -0.02 0.00 -0.61 0.00 0.00 59.70 58.84 1nbw h MET 318 Cb 0.39 0.11 -0.01 0.00 0.43 0.00 0.00 31.60 32.52 1nbw h MET 318 CO -0.29 1.18 -0.42 0.00 -0.40 0.00 0.00 176.91 176.98 1nbw h ALA 319 N 0.67 -1.16 -1.01 0.39 0.00 -0.18 0.12 119.26 118.09 1nbw h ALA 319 Ca -0.03 -0.19 0.24 0.00 0.00 0.00 0.00 54.91 54.93 1nbw h ALA 319 Cb 1.32 0.59 -0.10 0.00 0.00 0.00 0.00 17.79 19.60 1nbw h ALA 319 CO 0.14 -1.15 0.63 1.03 0.00 0.00 0.00 179.25 179.91 1nbw h SER 320 N -0.94 0.58 0.01 0.00 0.87 -0.65 0.31 113.55 113.73 1nbw h SER 320 Ca -0.07 0.09 -0.14 0.00 -1.23 0.00 0.00 61.79 60.44 1nbw h SER 320 Cb 0.78 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.73 1nbw h SER 320 CO 0.02 0.14 -0.46 0.25 -0.53 0.00 0.00 176.83 176.25 1nbw h LEU 321 N 0.53 0.58 -3.43 2.23 5.85 -0.49 -3.15 115.31 117.43 1nbw h LEU 321 Ca 0.59 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.98 1nbw h LEU 321 Cb 1.26 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 1nbw h LEU 321 CO -0.35 0.96 0.04 0.35 -0.34 0.00 0.00 178.44 179.10 1nbw n THR 322 N -4.00 2.55 -4.27 1.05 -2.24 0.36 -4.97 114.28 102.76 1nbw n THR 322 Ca -0.02 -1.79 -0.32 0.00 -2.27 0.00 0.00 64.05 59.65 1nbw n THR 322 Cb 0.55 -0.28 -0.08 0.00 -2.10 0.00 0.00 70.33 68.42 1nbw n THR 322 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nbw n GLY 323 N -0.21 -0.20 3.55 3.38 0.00 0.90 -4.95 105.19 107.65 1nbw n GLY 323 Ca 0.27 0.15 -0.25 0.00 0.00 0.00 0.00 46.02 46.20 1nbw n GLY 323 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1nbw s HIS 324 N -4.07 2.43 0.44 1.61 3.76 -0.84 -5.02 115.29 113.60 1nbw s HIS 324 Ca 0.17 -0.42 -0.22 0.00 -0.15 0.00 0.00 55.06 54.44 1nbw s HIS 324 Cb -0.10 -1.30 -0.10 0.00 1.11 0.00 0.00 32.58 32.20 1nbw s HIS 324 CO 0.98 0.59 1.00 -1.21 -0.85 0.00 0.00 174.74 175.25 1nbw s GLU 325 N -3.62 4.09 0.17 1.40 0.41 -1.26 -4.45 118.70 115.44 1nbw s GLU 325 Ca 0.32 1.28 0.16 0.00 -0.41 0.00 0.00 54.97 56.33 1nbw s GLU 325 Cb -0.01 -2.25 0.75 0.00 -1.78 0.00 0.00 34.13 30.85 1nbw s GLU 325 CO 0.17 -0.17 1.50 -1.33 -0.49 0.00 0.00 175.26 174.94 1nbw n MET 326 N -0.58 0.10 0.23 1.61 2.81 -1.26 -1.12 117.12 118.90 1nbw n MET 326 Ca 0.07 0.46 0.12 0.00 -1.81 0.00 0.00 57.70 56.54 1nbw n MET 326 Cb 0.53 -1.74 0.38 0.00 -0.71 0.00 0.00 33.22 31.67 1nbw n MET 326 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1nbw h SER 327 N 0.00 0.00 -0.24 7.83 4.64 -2.00 -2.92 113.55 120.86 1nbw h SER 327 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1nbw h SER 327 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1nbw h SER 327 CO 0.00 0.13 0.00 0.00 -0.87 0.00 0.00 176.83 176.09 1nbw n ALA 328 N -2.15 2.45 -2.95 5.18 0.00 -0.27 -4.87 120.51 117.91 1nbw n ALA 328 Ca 0.02 -0.84 -0.36 0.00 0.00 0.00 0.00 53.44 52.26 1nbw n ALA 328 Cb 0.47 -0.89 -0.12 0.00 0.00 0.00 0.00 19.45 18.91 1nbw n ALA 328 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1nbw s ILE 329 N -1.70 4.52 0.05 0.00 -1.09 -1.11 -4.98 121.20 116.89 1nbw s ILE 329 Ca 0.35 -0.10 0.08 0.00 -2.23 0.00 0.00 60.65 58.74 1nbw s ILE 329 Cb 0.21 -3.11 -0.03 0.00 -1.58 0.00 0.00 42.46 37.95 1nbw s ILE 329 CO 0.31 0.35 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.86 1nbw s TYR 330 N 1.43 2.52 -0.39 3.97 1.51 -1.26 -4.99 117.35 120.14 1nbw s TYR 330 Ca 0.06 -0.28 -0.17 0.00 -1.01 0.00 0.00 57.07 55.67 1nbw s TYR 330 Cb -0.15 -1.44 0.01 0.00 -0.11 0.00 0.00 41.96 40.27 1nbw s TYR 330 CO 0.04 0.25 0.46 0.42 -1.11 0.00 0.00 175.55 175.61 1nbw s ILE 331 N -0.93 5.06 -0.19 2.71 1.01 -1.26 -4.73 121.20 122.88 1nbw s ILE 331 Ca 0.14 -0.07 0.18 0.00 0.00 0.00 0.00 60.65 60.91 1nbw s ILE 331 Cb -0.10 -3.99 0.16 0.00 0.01 0.00 0.00 42.46 38.54 1nbw s ILE 331 CO 0.05 -0.33 1.54 1.56 0.00 0.00 0.00 174.94 177.77 1nbw h GLN 332 N 8.63 0.00 -2.89 2.79 7.50 -1.74 -3.20 115.11 126.20 1nbw h GLN 332 Ca -0.27 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 58.79 1nbw h GLN 332 Cb 1.12 0.00 -0.18 0.00 0.05 0.00 0.00 27.48 28.47 1nbw h GLN 332 CO 0.78 0.33 -0.10 0.34 -1.50 0.00 0.00 178.83 178.68 1nbw s ASP 333 N -6.35 -0.32 -0.11 1.46 2.15 -1.20 -4.62 116.67 107.68 1nbw s ASP 333 Ca 0.04 0.12 -0.10 0.00 0.43 0.00 0.00 52.55 53.04 1nbw s ASP 333 Cb 0.07 0.41 0.03 0.00 -0.30 0.00 0.00 42.92 43.14 1nbw s ASP 333 CO 0.71 -0.61 0.29 -0.22 -0.17 0.00 0.00 175.17 175.17 1nbw s LEU 334 N -1.74 0.82 -0.09 -1.34 0.20 -1.26 -1.13 118.68 114.13 1nbw s LEU 334 Ca -0.08 0.60 0.04 0.00 0.69 0.00 0.00 54.13 55.38 1nbw s LEU 334 Cb -0.02 1.00 -0.01 0.00 -0.43 0.00 0.00 46.19 46.74 1nbw s LEU 334 CO 0.01 -0.11 -0.22 -0.22 -0.29 0.00 0.00 176.35 175.52 1nbw s LEU 335 N 0.26 2.22 -0.08 -0.68 2.96 -0.10 -4.89 118.68 118.36 1nbw s LEU 335 Ca -0.01 -0.49 0.02 0.00 -0.22 0.00 0.00 54.13 53.43 1nbw s LEU 335 Cb -0.03 -1.44 -0.02 0.00 0.50 0.00 0.00 46.19 45.20 1nbw s LEU 335 CO -0.01 0.19 -0.15 0.00 -1.32 0.00 0.00 176.35 175.06 1nbw s ALA 336 N 0.18 2.59 -0.01 5.97 0.00 -1.26 -1.56 121.76 127.67 1nbw s ALA 336 Ca -0.13 -0.95 0.03 0.00 0.00 0.00 0.00 51.96 50.91 1nbw s ALA 336 Cb -0.16 -1.03 -0.01 0.00 0.00 0.00 0.00 23.12 21.92 1nbw s ALA 336 CO 0.07 0.42 -0.09 0.08 0.00 0.00 0.00 175.76 176.24 1nbw s VAL 337 N -0.24 0.73 -0.09 0.00 1.01 0.24 -4.82 120.40 117.23 1nbw s VAL 337 Ca 0.01 -0.39 -0.21 0.00 0.00 0.00 0.00 61.98 61.39 1nbw s VAL 337 Cb -0.13 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 1nbw s VAL 337 CO 0.03 0.21 0.59 -1.81 0.00 0.00 0.00 175.10 174.12 1nbw s ASP 338 N -0.19 6.84 0.00 3.32 1.01 -1.26 0.09 116.67 126.48 1nbw s ASP 338 Ca 0.03 1.01 0.00 0.00 0.71 0.00 0.00 52.55 54.30 1nbw s ASP 338 Cb -0.04 -2.35 0.00 0.00 1.01 0.00 0.00 42.92 41.54 1nbw s ASP 338 CO -0.00 -0.05 0.00 1.07 0.21 0.00 0.00 175.17 176.39 1nbw n THR 339 N 3.69 0.00 -3.99 -1.27 5.66 -0.01 -4.95 114.28 113.41 1nbw n THR 339 Ca -0.04 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.85 1nbw n THR 339 Cb 0.51 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.18 1nbw n THR 339 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1nbw s PHE 340 N -2.42 0.33 -0.05 1.09 0.40 -1.26 -1.17 117.98 114.90 1nbw s PHE 340 Ca 0.00 -0.42 0.04 0.00 -0.60 0.00 0.00 56.93 55.94 1nbw s PHE 340 Cb 0.00 -0.22 0.00 0.00 0.51 0.00 0.00 43.02 43.31 1nbw s PHE 340 CO 0.00 -0.13 -0.16 0.96 0.70 0.00 0.00 175.22 176.60 1nbw s ILE 341 N -1.16 1.33 0.04 0.64 -5.25 -0.12 -3.06 121.20 113.62 1nbw s ILE 341 Ca -0.11 -0.64 -0.30 0.00 -0.99 0.00 0.00 60.65 58.60 1nbw s ILE 341 Cb -0.08 -1.16 -0.04 0.00 2.95 0.00 0.00 42.46 44.13 1nbw s ILE 341 CO -0.00 0.39 1.00 -2.16 -1.79 0.00 0.00 174.94 172.38 1nbw s PRO 342 N 0.20 4.59 0.05 0.37 0.04 -1.26 -0.67 135.00 138.32 1nbw s PRO 342 Ca -0.07 1.48 0.06 0.00 0.04 0.00 0.00 61.00 62.50 1nbw s PRO 342 Cb -0.12 -3.42 -0.02 0.00 0.04 0.00 0.00 34.50 30.97 1nbw s PRO 342 CO 0.03 0.01 -0.16 1.03 0.04 0.00 0.00 177.00 177.95 1nbw s ARG 343 N 0.67 1.02 0.28 4.56 1.81 -0.22 -4.93 118.95 122.14 1nbw s ARG 343 Ca 0.51 -0.85 -0.29 0.00 -1.72 0.00 0.00 55.73 53.38 1nbw s ARG 343 Cb -0.23 -1.07 -0.10 0.00 -0.45 0.00 0.00 34.95 33.11 1nbw s ARG 343 CO 0.29 0.26 1.31 0.21 -0.68 0.00 0.00 175.30 176.69 1nbw s LYS 344 N -1.27 4.38 -0.40 3.54 2.20 -1.26 -1.82 119.74 125.10 1nbw s LYS 344 Ca 0.03 2.15 -0.27 0.00 -0.36 0.00 0.00 55.97 57.52 1nbw s LYS 344 Cb -0.08 -3.12 0.02 0.00 -1.51 0.00 0.00 37.83 33.14 1nbw s LYS 344 CO 0.02 -0.20 0.99 0.08 -0.36 0.00 0.00 175.35 175.87 1nbw s VAL 345 N -0.68 4.47 0.30 4.02 1.01 -0.37 -4.90 120.40 124.26 1nbw s VAL 345 Ca 0.52 1.17 -0.30 0.00 0.00 0.00 0.00 61.98 63.37 1nbw s VAL 345 Cb -0.39 -4.42 -0.11 0.00 0.00 0.00 0.00 36.38 31.46 1nbw s VAL 345 CO 0.47 -0.69 1.56 -1.10 0.00 0.00 0.00 175.10 175.34 1nbw s GLN 346 N 3.76 4.14 0.00 2.72 -1.52 -1.22 -1.42 119.66 126.11 1nbw s GLN 346 Ca 0.41 2.54 0.00 0.00 -1.95 0.00 0.00 55.36 56.36 1nbw s GLN 346 Cb -0.11 -3.03 0.00 0.00 -0.22 0.00 0.00 33.01 29.66 1nbw s GLN 346 CO 0.23 -0.59 0.00 0.41 -0.25 0.00 0.00 175.29 175.09 1nbw n GLY 347 N 1.93 3.37 3.76 3.09 0.00 -1.26 -0.99 105.19 115.09 1nbw n GLY 347 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1nbw n GLY 347 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nbw s GLY 348 N -2.85 2.90 0.00 -0.02 0.00 -0.51 -4.69 107.32 102.16 1nbw s GLY 348 Ca 0.00 1.41 0.08 0.00 0.00 0.00 0.00 44.72 46.21 1nbw s GLY 348 CO 0.00 1.97 0.95 1.03 0.00 0.00 0.00 173.10 177.05 1nbw n MET 349 N -0.72 1.40 -1.05 2.90 2.81 -1.26 -4.56 117.12 116.63 1nbw n MET 349 Ca 0.08 -1.41 0.03 0.00 -1.81 0.00 0.00 57.70 54.60 1nbw n MET 349 Cb 0.44 -1.17 0.04 0.00 -0.71 0.00 0.00 33.22 31.81 1nbw n MET 349 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1nbw n ALA 350 N 0.36 2.36 -1.68 3.04 0.00 -1.26 0.25 120.51 123.57 1nbw n ALA 350 Ca 0.06 -2.03 -0.08 0.00 0.00 0.00 0.00 53.44 51.39 1nbw n ALA 350 Cb 0.28 -0.62 -0.02 0.00 0.00 0.00 0.00 19.45 19.10 1nbw n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nbw n GLY 351 N 0.12 0.55 3.68 0.00 0.00 -1.26 -4.68 105.19 103.61 1nbw n GLY 351 Ca 0.06 -0.60 -0.40 0.00 0.00 0.00 0.00 46.02 45.08 1nbw n GLY 351 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nbw n GLU 352 N -2.30 1.60 -4.27 1.61 4.71 -1.26 -4.87 120.64 115.85 1nbw n GLU 352 Ca -0.09 0.58 -0.15 0.00 -0.01 0.00 0.00 57.16 57.49 1nbw n GLU 352 Cb 0.42 -2.35 -0.10 0.00 -1.01 0.00 0.00 31.44 28.40 1nbw n GLU 352 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1nbw s ALA 354 N -3.32 -1.17 -0.30 0.00 0.00 -0.75 -4.86 121.76 111.36 1nbw s ALA 354 Ca 0.19 0.57 -0.26 0.00 0.00 0.00 0.00 51.96 52.46 1nbw s ALA 354 Cb 0.03 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.38 1nbw s ALA 354 CO 0.03 -0.40 0.94 -1.64 0.00 0.00 0.00 175.76 174.69 1nbw s MET 355 N -1.94 4.05 0.10 0.00 -1.94 -1.26 -1.05 119.30 117.25 1nbw s MET 355 Ca -0.08 0.90 0.02 0.00 -1.71 0.00 0.00 55.69 54.81 1nbw s MET 355 Cb -0.02 -3.72 -0.04 0.00 2.01 0.00 0.00 34.83 33.07 1nbw s MET 355 CO 0.02 -0.76 0.20 -1.21 -0.01 0.00 0.00 175.02 173.26 1nbw s GLU 356 N 3.28 3.30 0.42 2.03 0.41 0.16 -4.89 118.70 123.41 1nbw s GLU 356 Ca 0.39 -0.56 -0.24 0.00 -0.41 0.00 0.00 54.97 54.15 1nbw s GLU 356 Cb -0.13 -2.93 -0.08 0.00 -1.78 0.00 0.00 34.13 29.20 1nbw s GLU 356 CO 0.13 0.57 1.15 -0.80 -0.49 0.00 0.00 175.26 175.82 1nbw s ASN 357 N -2.75 6.45 0.08 -0.19 0.01 -1.26 -0.95 114.94 116.34 1nbw s ASN 357 Ca 0.34 2.30 -0.09 0.00 -0.71 0.00 0.00 52.86 54.69 1nbw s ASN 357 Cb -0.12 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 38.93 1nbw s ASN 357 CO 0.27 -0.72 0.21 0.00 -1.51 0.00 0.00 177.10 175.35 1nbw s ALA 358 N -1.48 -0.30 -0.15 0.60 0.00 -0.32 -1.23 121.76 118.88 1nbw s ALA 358 Ca 0.59 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.02 1nbw s ALA 358 Cb -0.29 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.33 1nbw s ALA 358 CO 0.36 -0.50 -0.14 0.08 0.00 0.00 0.00 175.76 175.56 1nbw s VAL 359 N -3.70 1.57 -0.05 0.00 1.01 0.03 -0.83 120.40 118.44 1nbw s VAL 359 Ca 0.04 -0.63 -0.13 0.00 0.00 0.00 0.00 61.98 61.25 1nbw s VAL 359 Cb 0.04 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 1nbw s VAL 359 CO -0.10 0.46 0.35 -0.83 0.00 0.00 0.00 175.10 174.98 1nbw s GLY 360 N 1.48 2.38 0.02 4.51 0.00 0.11 -1.49 107.32 114.34 1nbw s GLY 360 Ca 0.05 -0.32 0.04 0.00 0.00 0.00 0.00 44.72 44.49 1nbw s GLY 360 CO -0.11 0.13 -0.12 1.06 0.00 0.00 0.00 173.10 174.06 1nbw s MET 361 N -0.77 0.85 -0.05 2.90 -1.94 0.18 -0.59 119.30 119.88 1nbw s MET 361 Ca 0.21 -0.59 0.03 0.00 -1.71 0.00 0.00 55.69 53.64 1nbw s MET 361 Cb -0.15 -0.82 0.01 0.00 2.01 0.00 0.00 34.83 35.88 1nbw s MET 361 CO 0.10 0.21 -0.12 0.00 -0.01 0.00 0.00 175.02 175.20 1nbw s ALA 362 N -0.63 1.19 0.12 3.03 0.00 -0.60 0.02 121.76 124.89 1nbw s ALA 362 Ca 0.01 -0.45 0.09 0.00 0.00 0.00 0.00 51.96 51.62 1nbw s ALA 362 Cb -0.06 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.54 1nbw s ALA 362 CO 0.00 0.16 -0.16 0.00 0.00 0.00 0.00 175.76 175.77 1nbw s ALA 363 N 0.38 2.76 -0.04 0.00 0.00 -0.55 -0.93 121.76 123.38 1nbw s ALA 363 Ca -0.08 -1.36 0.00 0.00 0.00 0.00 0.00 51.96 50.52 1nbw s ALA 363 Cb -0.13 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.32 1nbw s ALA 363 CO 0.02 0.58 -0.02 1.41 0.00 0.00 0.00 175.76 177.76 1nbw s MET 364 N -2.26 0.53 -0.14 0.00 0.00 -0.29 -2.22 119.30 114.93 1nbw s MET 364 Ca 0.20 0.01 0.01 0.00 0.00 0.00 0.00 55.69 55.91 1nbw s MET 364 Cb -0.10 -0.67 0.02 0.00 0.00 0.00 0.00 34.83 34.07 1nbw s MET 364 CO 0.11 -0.13 -0.16 0.08 0.00 0.00 0.00 175.02 174.92 1nbw s VAL 365 N 1.10 1.65 -0.13 10.11 1.01 0.73 -2.97 120.40 131.90 1nbw s VAL 365 Ca -0.09 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.14 1nbw s VAL 365 Cb -0.14 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 1nbw s VAL 365 CO -0.01 0.47 0.05 -0.75 0.00 0.00 0.00 175.10 174.86 1nbw s LYS 366 N 1.29 3.50 -1.02 2.72 2.20 -1.26 -0.27 119.74 126.90 1nbw s LYS 366 Ca 0.01 -0.33 -0.23 0.00 -0.36 0.00 0.00 55.97 55.06 1nbw s LYS 366 Cb -0.14 -3.05 0.02 0.00 -1.51 0.00 0.00 37.83 33.16 1nbw s LYS 366 CO -0.08 0.53 1.61 0.00 -0.36 0.00 0.00 175.35 177.05 1nbw s ALA 367 N -0.36 2.47 -0.83 3.13 0.00 0.55 -4.84 121.76 121.87 1nbw s ALA 367 Ca 0.09 -2.12 -0.23 0.00 0.00 0.00 0.00 51.96 49.70 1nbw s ALA 367 Cb -0.12 -4.55 -0.17 0.00 0.00 0.00 0.00 23.12 18.28 1nbw s ALA 367 CO 0.02 -3.95 2.37 -0.25 0.00 0.00 0.00 175.76 173.95 1nbw n ASP 368 N 10.30 1.25 0.00 0.00 9.92 -1.26 -4.34 116.55 132.42 1nbw n ASP 368 Ca 0.36 -1.35 0.00 0.00 -0.53 0.00 0.00 54.79 53.28 1nbw n ASP 368 Cb 0.49 -1.48 0.00 0.00 -0.64 0.00 0.00 41.12 39.50 1nbw n ASP 368 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1nbw n ARG 369 N 8.24 0.00 -1.29 -1.24 0.63 -1.26 -4.89 116.66 116.85 1nbw n ARG 369 Ca 0.50 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.43 1nbw n ARG 369 Cb 0.38 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.29 1nbw n ARG 369 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1nbw n LEU 370 N 0.00 -0.82 -4.01 6.15 4.77 -1.26 -5.01 117.00 116.82 1nbw n LEU 370 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 1nbw n LEU 370 Cb 0.00 -0.29 -0.15 0.00 -2.33 0.00 0.00 43.42 40.65 1nbw n LEU 370 CO 0.00 0.00 -0.30 -1.58 -1.33 0.00 0.00 177.39 174.18 1nbw s GLN 371 N -2.83 1.57 0.00 3.23 2.00 -1.26 -4.34 119.66 118.02 1nbw s GLN 371 Ca 0.00 -1.99 0.00 0.00 -2.00 0.00 0.00 55.36 51.37 1nbw s GLN 371 Cb 0.00 -3.23 0.00 0.00 0.80 0.00 0.00 33.01 30.58 1nbw s GLN 371 CO 0.00 -0.97 0.00 0.00 -0.50 0.00 0.00 175.29 173.82 1nbw n MET 372 N 4.08 0.00 0.00 1.67 0.00 -1.26 -5.15 117.12 116.46 1nbw n MET 372 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.74 1nbw n MET 372 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.62 1nbw n MET 372 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1nbw n GLN 373 N 0.00 0.00 0.00 3.17 6.02 -1.26 -4.94 117.38 120.37 1nbw n GLN 373 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1nbw n GLN 373 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1nbw n GLN 373 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1nbw n VAL 374 N 0.00 0.00 -0.00 5.09 0.24 -1.26 -5.01 118.33 117.39 1nbw n VAL 374 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1nbw n VAL 374 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1nbw n VAL 374 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1nbw n ILE 375 N -1.61 -0.00 0.01 1.34 5.41 -1.26 -0.82 119.36 122.43 1nbw n ILE 375 Ca 0.00 0.02 -0.04 0.00 1.00 0.00 0.00 62.75 63.73 1nbw n ILE 375 Cb 0.00 -0.03 -0.03 0.00 -0.71 0.00 0.00 39.64 38.87 1nbw n ILE 375 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1nbw h ALA 376 N 0.02 -0.60 -0.81 -1.39 0.00 -1.98 0.28 119.26 114.78 1nbw h ALA 376 Ca 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1nbw h ALA 376 Cb 0.01 0.64 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1nbw h ALA 376 CO -0.01 -0.65 0.54 0.00 0.00 0.00 0.00 179.25 179.13 1nbw h ARG 377 N -0.17 1.06 0.00 0.00 3.08 -1.34 -1.21 114.38 115.79 1nbw h ARG 377 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1nbw h ARG 377 Cb 0.19 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1nbw h ARG 377 CO -0.10 0.70 0.00 1.49 -1.07 0.00 0.00 179.97 180.99 1nbw h GLU 378 N 1.09 0.00 0.09 0.04 4.81 -1.40 -2.70 114.58 116.51 1nbw h GLU 378 Ca 0.30 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1nbw h GLU 378 Cb -0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1nbw h GLU 378 CO -0.07 0.00 -0.04 1.25 -0.73 0.00 0.00 179.01 179.42 1nbw h LEU 379 N 0.00 -0.10 -2.22 1.64 6.46 0.73 -3.05 115.31 118.78 1nbw h LEU 379 Ca 0.00 -0.36 0.00 0.00 -0.12 0.00 0.00 57.88 57.40 1nbw h LEU 379 Cb 0.49 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.44 1nbw h LEU 379 CO 0.00 0.54 0.04 0.77 -0.62 0.00 0.00 178.44 179.17 1nbw h SER 380 N -0.97 0.00 0.14 1.25 4.64 -1.34 -2.08 113.55 115.19 1nbw h SER 380 Ca -0.01 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 1nbw h SER 380 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1nbw h SER 380 CO 0.02 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 175.91 1nbw h ALA 381 N 1.90 -0.19 0.00 5.18 0.00 -1.49 0.30 119.26 124.97 1nbw h ALA 381 Ca 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1nbw h ALA 381 Cb 0.08 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1nbw h ALA 381 CO 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 179.25 178.98 1nbw h ARG 382 N -0.94 0.00 0.00 0.00 3.08 -1.31 -3.07 114.38 112.14 1nbw h ARG 382 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1nbw h ARG 382 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1nbw h ARG 382 CO 0.03 0.04 -1.31 1.28 -1.07 0.00 0.00 179.97 178.94 1nbw n LEU 383 N -3.19 0.28 -3.70 3.04 4.77 -0.83 -5.01 117.00 112.36 1nbw n LEU 383 Ca -0.00 -0.20 -0.23 0.00 -0.03 0.00 0.00 56.01 55.55 1nbw n LEU 383 Cb 0.26 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.38 1nbw n LEU 383 CO 0.27 0.07 -0.08 0.00 -1.33 0.00 0.00 177.39 176.31 1nbw n GLN 384 N -1.76 -4.06 -3.82 3.23 1.13 0.10 -4.98 117.38 107.22 1nbw n GLN 384 Ca -0.01 0.59 -0.12 0.00 -1.94 0.00 0.00 57.00 55.52 1nbw n GLN 384 Cb 0.33 -4.99 -0.09 0.00 0.11 0.00 0.00 30.24 25.60 1nbw n GLN 384 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 1nbw s THR 385 N -3.66 0.08 0.22 5.09 -1.32 -1.12 -5.06 115.64 109.86 1nbw s THR 385 Ca 0.09 -0.64 -0.31 0.00 -1.21 0.00 0.00 61.69 59.62 1nbw s THR 385 Cb -0.03 -0.59 -0.11 0.00 -1.51 0.00 0.00 72.50 70.26 1nbw s THR 385 CO 0.82 -0.35 1.60 -0.70 -2.21 0.00 0.00 174.62 173.78 1nbw s GLU 386 N -1.58 4.18 -0.21 7.08 2.12 -1.25 -4.38 118.70 124.66 1nbw s GLU 386 Ca -0.13 2.47 0.01 0.00 0.36 0.00 0.00 54.97 57.69 1nbw s GLU 386 Cb -0.05 -3.10 0.04 0.00 0.26 0.00 0.00 34.13 31.28 1nbw s GLU 386 CO 0.02 -0.63 -0.10 0.08 -0.54 0.00 0.00 175.26 174.08 1nbw s VAL 387 N 0.75 1.70 -0.17 3.70 1.01 -1.26 -1.29 120.40 124.84 1nbw s VAL 387 Ca 0.69 -1.07 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 1nbw s VAL 387 Cb -0.46 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1nbw s VAL 387 CO 0.37 0.15 -0.00 -0.69 0.00 0.00 0.00 175.10 174.92 1nbw s VAL 388 N 1.37 4.14 -0.02 2.92 1.01 0.15 -4.94 120.40 125.02 1nbw s VAL 388 Ca -0.02 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1nbw s VAL 388 Cb -0.17 -2.84 -0.06 0.00 0.00 0.00 0.00 36.38 33.31 1nbw s VAL 388 CO -0.08 0.47 1.62 -0.69 0.00 0.00 0.00 175.10 176.43 1nbw s VAL 389 N 0.46 3.49 0.94 2.92 1.01 -1.26 -0.67 120.40 127.29 1nbw s VAL 389 Ca -0.01 0.71 -0.12 0.00 0.00 0.00 0.00 61.98 62.56 1nbw s VAL 389 Cb -0.14 -3.46 0.16 0.00 0.00 0.00 0.00 36.38 32.94 1nbw s VAL 389 CO 0.02 -0.04 1.10 -0.83 0.00 0.00 0.00 175.10 175.34 1nbw s GLY 390 N 2.97 1.59 0.00 4.51 0.00 0.12 -4.85 107.32 111.66 1nbw s GLY 390 Ca 0.72 -0.24 0.00 0.00 0.00 0.00 0.00 44.72 45.20 1nbw s GLY 390 CO 0.30 0.31 0.00 0.61 0.00 0.00 0.00 173.10 174.32 1nbw n GLY 391 N -1.22 -1.68 3.67 0.20 0.00 -1.26 -4.89 105.19 100.01 1nbw n GLY 391 Ca 0.06 -1.49 -0.44 0.00 0.00 0.00 0.00 46.02 44.15 1nbw n GLY 391 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1nbw n VAL 392 N -0.58 0.71 -0.26 1.61 0.31 -1.26 -4.86 118.33 114.00 1nbw n VAL 392 Ca 0.00 -0.13 0.05 0.00 -0.01 0.00 0.00 64.34 64.25 1nbw n VAL 392 Cb 0.00 -2.19 0.15 0.00 -0.91 0.00 0.00 33.84 30.90 1nbw n VAL 392 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1nbw h GLU 393 N 10.17 0.09 -0.93 5.55 4.81 -2.00 0.13 114.58 132.40 1nbw h GLU 393 Ca -0.49 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 58.81 1nbw h GLU 393 Cb 1.25 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.55 1nbw h GLU 393 CO 0.94 0.06 0.60 0.00 -0.73 0.00 0.00 179.01 179.88 1nbw h ALA 394 N 1.72 1.52 -0.62 2.92 0.00 -1.94 -0.33 119.26 122.53 1nbw h ALA 394 Ca 0.41 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.23 1nbw h ALA 394 Cb 0.72 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1nbw h ALA 394 CO -0.68 0.32 0.09 -0.91 0.00 0.00 0.00 179.25 178.07 1nbw h ASN 395 N 1.02 1.00 -0.36 0.00 4.21 -1.14 -0.92 115.58 119.40 1nbw h ASN 395 Ca 0.41 -0.27 -0.11 0.00 1.21 0.00 0.00 56.30 57.55 1nbw h ASN 395 Cb 0.27 -0.27 -0.02 0.00 -1.12 0.00 0.00 38.32 37.18 1nbw h ASN 395 CO -0.17 1.01 -0.15 0.24 -1.29 0.00 0.00 177.43 177.07 1nbw h MET 396 N 0.95 0.82 -0.30 0.81 2.86 -0.67 -1.86 114.93 117.53 1nbw h MET 396 Ca 0.19 -0.30 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 1nbw h MET 396 Cb 0.45 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 1nbw h MET 396 CO 0.01 0.92 0.06 0.00 1.06 0.00 0.00 176.91 178.97 1nbw h ALA 397 N 1.09 0.40 -0.33 6.32 0.00 -0.86 -2.17 119.26 123.71 1nbw h ALA 397 Ca 0.11 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1nbw h ALA 397 Cb 0.66 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1nbw h ALA 397 CO 0.05 0.08 0.21 0.82 0.00 0.00 0.00 179.25 180.41 1nbw h ILE 398 N 0.33 1.10 -0.79 0.00 1.08 -1.04 -0.73 117.51 117.46 1nbw h ILE 398 Ca 0.09 -0.21 0.08 0.00 -0.39 0.00 0.00 64.86 64.43 1nbw h ILE 398 Cb 0.32 0.64 -0.06 0.00 -3.07 0.00 0.00 36.82 34.65 1nbw h ILE 398 CO 0.00 0.10 0.46 0.00 -0.69 0.00 0.00 178.15 178.02 1nbw h ALA 399 N 1.10 1.09 -0.29 1.87 0.00 -1.23 -0.91 119.26 120.90 1nbw h ALA 399 Ca 0.12 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 1nbw h ALA 399 Cb -0.02 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1nbw h ALA 399 CO -0.02 0.13 -0.49 0.78 0.00 0.00 0.00 179.25 179.65 1nbw h GLY 400 N 0.81 0.86 1.33 0.00 0.00 -1.06 -3.16 103.07 101.84 1nbw h GLY 400 Ca 0.36 -0.95 -0.05 0.00 0.00 0.00 0.00 47.33 46.69 1nbw h GLY 400 CO -0.21 0.85 0.14 0.00 0.00 0.00 0.00 176.54 177.32 1nbw h ALA 401 N 0.82 1.20 0.00 3.60 0.00 -0.56 -2.01 119.26 122.32 1nbw h ALA 401 Ca 0.03 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1nbw h ALA 401 Cb 1.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1nbw h ALA 401 CO 0.11 0.55 0.00 1.28 0.00 0.00 0.00 179.25 181.18 1nbw n LEU 402 N -4.27 0.05 -0.22 0.00 4.77 -0.40 -1.08 117.00 115.84 1nbw n LEU 402 Ca 0.04 0.52 0.14 0.00 -0.03 0.00 0.00 56.01 56.68 1nbw n LEU 402 Cb 0.22 -0.52 0.65 0.00 -2.33 0.00 0.00 43.42 41.45 1nbw n LEU 402 CO 0.40 -0.45 0.92 0.35 -1.33 0.00 0.00 177.39 177.28 1nbw n THR 403 N -1.56 0.00 -2.52 -5.08 -2.24 -0.75 -4.79 114.28 97.34 1nbw n THR 403 Ca 0.01 -0.11 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 1nbw n THR 403 Cb 0.06 0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 1nbw n THR 403 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1nbw s THR 404 N -2.19 4.31 0.32 4.28 2.01 -0.24 -2.49 115.64 121.64 1nbw s THR 404 Ca 0.37 1.66 -0.29 0.00 0.31 0.00 0.00 61.69 63.73 1nbw s THR 404 Cb 0.21 -4.06 -0.11 0.00 0.01 0.00 0.00 72.50 68.54 1nbw s THR 404 CO 0.40 0.13 1.56 -2.84 -0.69 0.00 0.00 174.62 173.18 1nbw s PRO 405 N 1.06 4.12 0.00 4.92 0.02 -1.26 -3.09 135.00 140.77 1nbw s PRO 405 Ca 0.56 2.57 0.00 0.00 0.02 0.00 0.00 61.00 64.16 1nbw s PRO 405 Cb -0.27 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.25 1nbw s PRO 405 CO 0.29 -0.60 0.00 0.41 -0.33 0.00 0.00 177.00 176.76 1nbw n GLY 406 N 1.67 0.77 3.69 0.52 0.00 -1.26 -5.05 105.19 105.53 1nbw n GLY 406 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1nbw n GLY 406 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nbw s ALA 408 N -2.64 -2.19 0.54 0.00 0.00 -1.26 -4.97 121.76 111.24 1nbw s ALA 408 Ca 0.39 0.63 -0.16 0.00 0.00 0.00 0.00 51.96 52.81 1nbw s ALA 408 Cb 0.06 0.39 -0.07 0.00 0.00 0.00 0.00 23.12 23.51 1nbw s ALA 408 CO 0.21 -1.06 1.01 0.00 0.00 0.00 0.00 175.76 175.92 1nbw s ALA 409 N -2.50 2.98 0.26 0.00 0.00 -1.26 -4.03 121.76 117.22 1nbw s ALA 409 Ca 0.14 0.23 -0.30 0.00 0.00 0.00 0.00 51.96 52.04 1nbw s ALA 409 Cb 0.04 -3.15 -0.10 0.00 0.00 0.00 0.00 23.12 19.91 1nbw s ALA 409 CO -0.03 -0.39 1.40 -1.25 0.00 0.00 0.00 175.76 175.49 1nbw s PRO 410 N -4.09 4.29 0.01 0.00 0.04 -1.26 -4.96 135.00 129.03 1nbw s PRO 410 Ca 0.60 2.27 -0.06 0.00 0.04 0.00 0.00 61.00 63.84 1nbw s PRO 410 Cb -0.12 -3.11 -0.00 0.00 0.04 0.00 0.00 34.50 31.31 1nbw s PRO 410 CO 0.33 -0.37 0.12 -1.17 0.04 0.00 0.00 177.00 175.95 1nbw s LEU 411 N -0.62 1.64 -0.01 -3.56 0.20 -1.03 -2.19 118.68 113.12 1nbw s LEU 411 Ca 0.57 -0.28 0.06 0.00 0.69 0.00 0.00 54.13 55.17 1nbw s LEU 411 Cb -0.41 0.62 -0.01 0.00 -0.43 0.00 0.00 46.19 45.95 1nbw s LEU 411 CO 0.45 -0.38 -0.18 0.00 -0.29 0.00 0.00 176.35 175.94 1nbw s ALA 412 N -1.54 1.50 -0.20 5.97 0.00 -0.03 -0.93 121.76 126.52 1nbw s ALA 412 Ca -0.14 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.04 1nbw s ALA 412 Cb -0.07 -0.37 0.04 0.00 0.00 0.00 0.00 23.12 22.72 1nbw s ALA 412 CO 0.01 0.36 -0.15 -1.50 0.00 0.00 0.00 175.76 174.49 1nbw s ILE 413 N -0.47 1.94 -0.21 0.00 2.07 -0.14 -0.78 121.20 123.62 1nbw s ILE 413 Ca 0.07 -1.12 -0.08 0.00 -1.41 0.00 0.00 60.65 58.11 1nbw s ILE 413 Cb -0.07 -1.91 -0.04 0.00 0.13 0.00 0.00 42.46 40.58 1nbw s ILE 413 CO -0.00 0.28 0.07 -0.76 -1.91 0.00 0.00 174.94 172.62 1nbw s LEU 414 N 1.28 3.71 -0.51 8.50 1.02 -0.25 -1.69 118.68 130.74 1nbw s LEU 414 Ca -0.00 -0.02 -0.19 0.00 0.02 0.00 0.00 54.13 53.94 1nbw s LEU 414 Cb -0.16 -1.96 0.06 0.00 0.02 0.00 0.00 46.19 44.15 1nbw s LEU 414 CO -0.09 0.09 0.60 -0.62 0.02 0.00 0.00 176.35 176.35 1nbw s ASP 415 N 0.86 6.21 -0.86 2.29 -1.08 0.16 -0.75 116.67 123.50 1nbw s ASP 415 Ca 0.04 -0.99 -0.20 0.00 -0.52 0.00 0.00 52.55 50.88 1nbw s ASP 415 Cb -0.14 -2.28 0.12 0.00 -1.46 0.00 0.00 42.92 39.16 1nbw s ASP 415 CO 0.03 -0.87 1.08 -0.76 0.52 0.00 0.00 175.17 175.17 1nbw s LEU 416 N 2.50 4.89 0.00 -1.34 1.43 0.50 -1.90 118.68 124.77 1nbw s LEU 416 Ca 0.13 -1.78 0.00 0.00 -1.03 0.00 0.00 54.13 51.45 1nbw s LEU 416 Cb -0.20 -2.40 0.00 0.00 0.03 0.00 0.00 46.19 43.62 1nbw s LEU 416 CO 0.11 -1.16 0.00 0.61 0.23 0.00 0.00 176.35 176.14 1nbw n GLY 417 N 5.48 1.56 0.13 -3.19 0.00 -0.83 -0.57 105.19 107.79 1nbw n GLY 417 Ca 0.17 -1.87 -0.25 0.00 0.00 0.00 0.00 46.02 44.07 1nbw n GLY 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nbw n ALA 418 N -3.00 1.14 0.15 4.61 0.00 -1.26 -0.99 120.51 121.16 1nbw n ALA 418 Ca 0.00 -0.95 0.11 0.00 0.00 0.00 0.00 53.44 52.61 1nbw n ALA 418 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 19.45 19.33 1nbw n ALA 418 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nbw n GLY 419 N 1.53 -1.38 3.71 0.00 0.00 -1.26 -1.29 105.19 106.52 1nbw n GLY 419 Ca -0.47 -0.29 -0.08 0.00 0.00 0.00 0.00 46.02 45.19 1nbw n GLY 419 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nbw s SER 420 N -5.06 -0.32 -0.31 1.61 1.04 -1.26 -4.05 113.70 105.35 1nbw s SER 420 Ca -0.01 -0.39 -0.02 0.00 0.48 0.00 0.00 55.95 56.01 1nbw s SER 420 Cb 0.11 0.63 0.05 0.00 0.10 0.00 0.00 66.02 66.91 1nbw s SER 420 CO 0.80 -1.13 0.02 -0.89 0.98 0.00 0.00 173.24 173.02 1nbw s THR 421 N -3.71 3.10 0.06 2.02 2.01 -0.68 -1.96 115.64 116.48 1nbw s THR 421 Ca 0.09 -1.38 0.04 0.00 0.31 0.00 0.00 61.69 60.74 1nbw s THR 421 Cb -0.04 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 1nbw s THR 421 CO 0.00 -0.14 0.01 -1.81 -0.69 0.00 0.00 174.62 171.99 1nbw s ASP 422 N 1.29 5.10 0.03 3.53 1.01 -0.80 -0.79 116.67 126.05 1nbw s ASP 422 Ca -0.04 -0.11 0.02 0.00 0.71 0.00 0.00 52.55 53.12 1nbw s ASP 422 Cb -0.20 -1.27 -0.02 0.00 1.01 0.00 0.00 42.92 42.45 1nbw s ASP 422 CO -0.01 0.21 -0.06 0.00 0.21 0.00 0.00 175.17 175.52 1nbw s ALA 423 N -1.25 0.42 -0.04 5.23 0.00 0.18 0.40 121.76 126.70 1nbw s ALA 423 Ca 0.24 -0.65 0.05 0.00 0.00 0.00 0.00 51.96 51.61 1nbw s ALA 423 Cb -0.12 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 1nbw s ALA 423 CO 0.16 -0.04 -0.19 0.00 0.00 0.00 0.00 175.76 175.69 1nbw s ALA 424 N -1.24 1.69 -0.00 0.00 0.00 -0.68 -0.49 121.76 121.04 1nbw s ALA 424 Ca -0.10 -0.79 0.02 0.00 0.00 0.00 0.00 51.96 51.08 1nbw s ALA 424 Cb -0.09 -0.54 -0.00 0.00 0.00 0.00 0.00 23.12 22.49 1nbw s ALA 424 CO -0.00 0.32 -0.05 0.42 0.00 0.00 0.00 175.76 176.45 1nbw s ILE 425 N -0.06 0.43 -0.18 0.00 1.01 0.15 -0.97 121.20 121.58 1nbw s ILE 425 Ca -0.03 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.41 1nbw s ILE 425 Cb -0.12 -0.37 0.02 0.00 0.01 0.00 0.00 42.46 42.01 1nbw s ILE 425 CO 0.02 0.12 -0.20 0.54 0.00 0.00 0.00 174.94 175.43 1nbw s VAL 426 N -0.11 2.10 1.25 2.92 0.11 -0.11 0.55 120.40 127.10 1nbw s VAL 426 Ca 0.02 -0.93 -0.17 0.00 -2.93 0.00 0.00 61.98 57.97 1nbw s VAL 426 Cb -0.02 -1.88 0.28 0.00 -1.53 0.00 0.00 36.38 33.23 1nbw s VAL 426 CO -0.00 0.54 0.74 0.59 -3.33 0.00 0.00 175.10 173.63 1nbw n ASN 427 N 4.58 -2.67 0.18 3.54 3.02 0.17 -2.45 115.26 121.63 1nbw n ASN 427 Ca -0.21 -0.38 0.06 0.00 -0.03 0.00 0.00 54.58 54.02 1nbw n ASN 427 Cb 0.50 -1.09 0.18 0.00 -0.61 0.00 0.00 39.78 38.76 1nbw n ASN 427 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nbw h ALA 428 N -2.88 0.83 -0.00 5.41 0.00 -1.89 -2.64 119.26 118.09 1nbw h ALA 428 Ca -0.53 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1nbw h ALA 428 Cb 1.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1nbw h ALA 428 CO 0.39 0.44 -0.21 0.39 0.00 0.00 0.00 179.25 180.26 1nbw n GLU 429 N -3.27 0.46 -0.26 0.00 4.71 -1.26 -4.90 120.64 116.11 1nbw n GLU 429 Ca 0.02 -0.19 0.00 0.00 -0.01 0.00 0.00 57.16 56.97 1nbw n GLU 429 Cb 0.61 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.55 1nbw n GLU 429 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1nbw n GLY 430 N 1.37 0.75 3.74 0.62 0.00 -0.99 -5.06 105.19 105.62 1nbw n GLY 430 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1nbw n GLY 430 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1nbw s GLN 431 N -0.74 4.54 -0.21 1.61 0.74 -1.26 -4.67 119.66 119.67 1nbw s GLN 431 Ca 0.00 1.17 -0.08 0.00 0.05 0.00 0.00 55.36 56.50 1nbw s GLN 431 Cb 0.00 -3.38 -0.04 0.00 1.10 0.00 0.00 33.01 30.69 1nbw s GLN 431 CO 0.00 0.22 0.08 0.42 -0.55 0.00 0.00 175.29 175.46 1nbw s ILE 432 N 0.10 4.70 0.24 -2.34 1.01 -1.26 0.43 121.20 124.09 1nbw s ILE 432 Ca 0.41 -0.05 0.07 0.00 0.00 0.00 0.00 60.65 61.08 1nbw s ILE 432 Cb -0.21 -3.15 -0.05 0.00 0.01 0.00 0.00 42.46 39.06 1nbw s ILE 432 CO 0.25 0.41 -0.10 0.42 0.00 0.00 0.00 174.94 175.91 1nbw s THR 433 N 0.85 1.66 -0.00 2.92 -4.23 0.19 -4.94 115.64 112.10 1nbw s THR 433 Ca 0.04 -2.17 0.07 0.00 -1.18 0.00 0.00 61.69 58.45 1nbw s THR 433 Cb -0.14 -2.22 -0.02 0.00 1.34 0.00 0.00 72.50 71.46 1nbw s THR 433 CO 0.02 -0.46 -0.21 0.00 -0.54 0.00 0.00 174.62 173.44 1nbw s ALA 434 N -3.01 1.72 -0.03 3.99 0.00 -1.26 0.32 121.76 123.49 1nbw s ALA 434 Ca 0.26 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 51.31 1nbw s ALA 434 Cb 0.01 -0.41 0.01 0.00 0.00 0.00 0.00 23.12 22.73 1nbw s ALA 434 CO 0.09 0.41 -0.08 0.08 0.00 0.00 0.00 175.76 176.26 1nbw s VAL 435 N -0.56 0.71 -0.19 0.00 1.01 0.36 -4.98 120.40 116.74 1nbw s VAL 435 Ca 0.08 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1nbw s VAL 435 Cb -0.08 -0.65 0.05 0.00 0.00 0.00 0.00 36.38 35.69 1nbw s VAL 435 CO -0.00 0.23 -0.08 -1.00 0.00 0.00 0.00 175.10 174.26 1nbw s HIS 436 N 0.34 2.18 0.13 5.22 3.76 -1.26 0.51 115.29 126.17 1nbw s HIS 436 Ca -0.05 -1.46 0.08 0.00 -0.15 0.00 0.00 55.06 53.48 1nbw s HIS 436 Cb -0.10 -1.52 -0.04 0.00 1.11 0.00 0.00 32.58 32.03 1nbw s HIS 436 CO 0.01 -0.71 -0.10 -0.51 -0.85 0.00 0.00 174.74 172.58 1nbw s LEU 437 N 1.47 3.00 0.43 0.89 1.43 0.03 -4.84 118.68 121.10 1nbw s LEU 437 Ca -0.01 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.50 1nbw s LEU 437 Cb -0.16 -1.76 -0.07 0.00 0.03 0.00 0.00 46.19 44.23 1nbw s LEU 437 CO -0.08 0.15 0.82 0.00 0.23 0.00 0.00 176.35 177.47 1nbw s ALA 438 N -1.40 3.29 0.00 4.21 0.00 -1.26 -1.69 121.76 124.90 1nbw s ALA 438 Ca 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1nbw s ALA 438 Cb -0.10 -2.80 0.00 0.00 0.00 0.00 0.00 23.12 20.22 1nbw s ALA 438 CO 0.14 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.24 1nbw n GLY 439 N -1.40 -0.74 0.00 0.00 0.00 -1.26 -4.52 105.19 97.28 1nbw n GLY 439 Ca 0.03 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1nbw n GLY 439 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nbw n ALA 440 N 1.74 0.00 -0.16 4.61 0.00 -1.26 -3.90 120.51 121.54 1nbw n ALA 440 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1nbw n ALA 440 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.52 1nbw n ALA 440 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1nbw h GLY 441 N 0.00 0.64 1.00 0.00 0.00 -0.79 -2.13 103.07 101.79 1nbw h GLY 441 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 1nbw h GLY 441 CO 0.00 -0.06 0.31 3.43 0.00 0.00 0.00 176.54 180.23 1nbw h ASN 442 N 0.27 0.85 -0.37 0.19 2.35 -1.45 -2.12 115.58 115.28 1nbw h ASN 442 Ca 0.26 -0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.83 1nbw h ASN 442 Cb 0.33 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 1nbw h ASN 442 CO -0.32 0.74 0.08 -0.03 -1.65 0.00 0.00 177.43 176.25 1nbw h MET 443 N 0.90 0.70 -0.57 0.81 4.05 -1.70 -0.18 114.93 118.93 1nbw h MET 443 Ca 0.22 -0.14 -0.04 0.00 -0.28 0.00 0.00 59.70 59.46 1nbw h MET 443 Cb 0.11 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 30.79 1nbw h MET 443 CO -0.03 0.66 0.19 0.28 0.23 0.00 0.00 176.91 178.24 1nbw h VAL 444 N 0.67 1.24 -0.16 -5.77 2.07 -0.94 -0.44 116.25 112.91 1nbw h VAL 444 Ca 0.15 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1nbw h VAL 444 Cb 0.30 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1nbw h VAL 444 CO 0.00 0.30 0.04 0.28 0.02 0.00 0.00 177.57 178.21 1nbw h SER 445 N 0.79 0.24 -0.80 0.57 0.02 -0.86 -2.05 113.55 111.45 1nbw h SER 445 Ca 0.18 -0.23 0.10 0.00 -0.84 0.00 0.00 61.79 61.00 1nbw h SER 445 Cb 0.27 -0.06 -0.07 0.00 0.14 0.00 0.00 62.40 62.67 1nbw h SER 445 CO -0.01 0.42 0.44 0.25 -1.14 0.00 0.00 176.83 176.79 1nbw h LEU 446 N 0.06 0.62 -1.53 5.07 5.85 -0.84 0.91 115.31 125.45 1nbw h LEU 446 Ca 0.05 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 1nbw h LEU 446 Cb 0.27 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1nbw h LEU 446 CO 0.00 0.34 -0.08 0.25 -0.34 0.00 0.00 178.44 178.62 1nbw h LEU 447 N 0.74 0.19 0.12 2.25 5.85 -0.88 -0.56 115.31 123.03 1nbw h LEU 447 Ca 0.39 -0.03 -0.26 0.00 0.84 0.00 0.00 57.88 58.83 1nbw h LEU 447 Cb 0.39 -0.05 0.03 0.00 0.37 0.00 0.00 40.66 41.40 1nbw h LEU 447 CO -0.26 0.30 -1.08 0.40 -0.34 0.00 0.00 178.44 177.46 1nbw h ILE 448 N 0.20 1.35 -0.78 4.05 2.04 -0.19 -2.95 117.51 121.23 1nbw h ILE 448 Ca 0.04 -2.44 -0.01 0.00 1.00 0.00 0.00 64.86 63.45 1nbw h ILE 448 Cb 0.28 2.83 -0.04 0.00 -0.74 0.00 0.00 36.82 39.15 1nbw h ILE 448 CO 0.01 0.73 0.46 0.50 0.00 0.00 0.00 178.15 179.85 1nbw h LYS 449 N 0.06 1.07 0.67 2.37 3.64 -0.64 -2.82 116.57 120.92 1nbw h LYS 449 Ca -0.17 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.07 1nbw h LYS 449 Cb 1.80 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 33.40 1nbw h LYS 449 CO 0.21 0.76 -0.32 1.15 -2.27 0.00 0.00 179.45 178.98 1nbw h THR 450 N 1.07 0.24 0.00 1.00 2.02 -1.17 -0.53 112.91 115.54 1nbw h THR 450 Ca 0.28 -0.21 -0.08 0.00 0.77 0.00 0.00 66.41 67.17 1nbw h THR 450 Cb -0.02 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 1nbw h THR 450 CO -0.05 0.02 -0.37 -0.08 0.37 0.00 0.00 175.52 175.41 1nbw h GLU 451 N -1.06 0.00 0.00 6.66 4.81 -1.44 -2.92 114.58 120.63 1nbw h GLU 451 Ca -0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1nbw h GLU 451 Cb 0.72 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1nbw h GLU 451 CO 0.15 0.37 -0.80 1.28 -0.73 0.00 0.00 179.01 179.28 1nbw n LEU 452 N -3.91 0.63 -2.02 1.64 4.77 -1.06 -4.58 117.00 112.46 1nbw n LEU 452 Ca -0.02 -0.02 -0.11 0.00 -0.03 0.00 0.00 56.01 55.83 1nbw n LEU 452 Cb 0.43 -0.15 0.04 0.00 -2.33 0.00 0.00 43.42 41.41 1nbw n LEU 452 CO 0.38 0.07 0.11 0.61 -1.33 0.00 0.00 177.39 177.23 1nbw n GLY 453 N 1.42 0.20 3.83 -0.72 0.00 -0.35 -4.89 105.19 104.67 1nbw n GLY 453 Ca 0.03 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 1nbw n GLY 453 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nbw s LEU 454 N -4.03 3.88 0.09 0.99 1.43 -0.36 -5.00 118.68 115.68 1nbw s LEU 454 Ca 0.22 1.56 -0.09 0.00 -1.03 0.00 0.00 54.13 54.79 1nbw s LEU 454 Cb -0.10 -4.42 -0.19 0.00 0.03 0.00 0.00 46.19 41.51 1nbw s LEU 454 CO 0.35 -0.39 1.22 -0.33 0.23 0.00 0.00 176.35 177.43 1nbw h GLU 455 N 1.69 0.54 -5.42 1.70 4.39 -1.93 -3.46 114.58 112.08 1nbw h GLU 455 Ca -0.48 -0.62 -0.43 0.00 0.34 0.00 0.00 59.36 58.17 1nbw h GLU 455 Cb 1.18 0.19 -0.22 0.00 -0.10 0.00 0.00 28.75 29.80 1nbw h GLU 455 CO 0.62 1.24 -0.78 0.16 -1.16 0.00 0.00 179.01 179.08 1nbw s ASP 456 N -7.22 1.76 0.24 1.42 1.47 -1.26 -5.04 116.67 108.04 1nbw s ASP 456 Ca -0.08 -0.61 -0.07 0.00 1.18 0.00 0.00 52.55 52.97 1nbw s ASP 456 Cb 0.07 -0.06 0.24 0.00 -0.34 0.00 0.00 42.92 42.84 1nbw s ASP 456 CO 0.90 -0.06 1.91 -0.07 0.68 0.00 0.00 175.17 178.53 1nbw h LEU 457 N 4.31 1.05 -0.65 2.11 3.38 -1.97 -2.96 115.31 120.58 1nbw h LEU 457 Ca -0.41 -0.02 0.12 0.00 0.09 0.00 0.00 57.88 57.65 1nbw h LEU 457 Cb 1.19 -0.26 -0.12 0.00 0.09 0.00 0.00 40.66 41.56 1nbw h LEU 457 CO 0.40 0.75 -0.30 0.28 0.09 0.00 0.00 178.44 179.66 1nbw h SER 458 N 1.24 -1.06 -0.39 -0.43 0.02 -1.99 0.49 113.55 111.43 1nbw h SER 458 Ca 0.35 0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 61.51 1nbw h SER 458 Cb -0.11 0.56 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 1nbw h SER 458 CO -0.09 -0.29 0.19 0.25 -1.14 0.00 0.00 176.83 175.76 1nbw h LEU 459 N -0.11 0.54 -0.62 5.07 5.85 -1.96 -0.47 115.31 123.61 1nbw h LEU 459 Ca 0.27 -0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.82 1nbw h LEU 459 Cb 0.55 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 1nbw h LEU 459 CO -0.72 0.48 -0.23 0.00 -0.34 0.00 0.00 178.44 177.63 1nbw h ALA 460 N 1.61 0.81 -0.16 1.25 0.00 -0.20 -0.29 119.26 122.27 1nbw h ALA 460 Ca 0.15 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1nbw h ALA 460 Cb 0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1nbw h ALA 460 CO -0.02 0.65 0.06 1.49 0.00 0.00 0.00 179.25 181.43 1nbw h GLU 461 N 0.74 0.24 -0.29 0.00 4.57 0.78 -1.15 114.58 119.46 1nbw h GLU 461 Ca 0.10 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 1nbw h GLU 461 Cb 0.76 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.30 1nbw h GLU 461 CO 0.06 0.33 0.13 0.00 -1.18 0.00 0.00 179.01 178.36 1nbw h ALA 462 N 0.90 0.38 0.00 2.92 0.00 -1.02 -1.44 119.26 121.01 1nbw h ALA 462 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1nbw h ALA 462 Cb 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1nbw h ALA 462 CO -0.00 -0.05 -0.03 0.82 0.00 0.00 0.00 179.25 179.99 1nbw h ILE 463 N 0.33 0.40 -0.16 0.00 2.04 -0.93 -1.45 117.51 117.75 1nbw h ILE 463 Ca 0.10 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.76 1nbw h ILE 463 Cb 0.14 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1nbw h ILE 463 CO -0.01 0.02 -0.20 0.50 0.00 0.00 0.00 178.15 178.46 1nbw h LYS 464 N 0.00 0.42 -0.02 2.37 3.64 -0.11 -3.36 116.57 119.51 1nbw h LYS 464 Ca -0.00 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1nbw h LYS 464 Cb 0.09 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1nbw h LYS 464 CO 0.00 0.81 -0.27 0.36 -2.27 0.00 0.00 179.45 178.08 1nbw n LYS 465 N -4.48 1.62 -5.05 1.90 0.00 -0.89 -4.95 118.16 106.31 1nbw n LYS 465 Ca -0.06 -1.31 -0.28 0.00 -0.00 0.00 0.00 58.31 56.66 1nbw n LYS 465 Cb 0.40 -1.47 -0.16 0.00 -0.00 0.00 0.00 35.03 33.80 1nbw n LYS 465 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1nbw s TYR 466 N -2.28 1.94 0.74 5.58 4.12 -0.60 -4.68 117.35 122.17 1nbw s TYR 466 Ca 0.23 -0.42 -0.13 0.00 0.02 0.00 0.00 57.07 56.77 1nbw s TYR 466 Cb 0.19 -1.26 0.04 0.00 -1.52 0.00 0.00 41.96 39.41 1nbw s TYR 466 CO 0.46 -0.07 1.13 -1.25 0.02 0.00 0.00 175.55 175.83 1nbw s PRO 467 N -0.38 2.28 0.32 -1.71 0.04 -1.26 -4.65 135.00 129.63 1nbw s PRO 467 Ca 0.05 1.40 0.06 0.00 0.04 0.00 0.00 61.00 62.56 1nbw s PRO 467 Cb -0.09 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 1nbw s PRO 467 CO 0.00 -1.66 0.44 -0.51 0.04 0.00 0.00 177.00 175.31 1nbw s LEU 468 N -5.48 4.01 -0.00 -3.56 1.43 -1.26 -0.93 118.68 112.89 1nbw s LEU 468 Ca 0.66 -0.16 -0.24 0.00 -1.03 0.00 0.00 54.13 53.36 1nbw s LEU 468 Cb -0.21 -2.74 0.05 0.00 0.03 0.00 0.00 46.19 43.32 1nbw s LEU 468 CO 0.49 -0.36 0.53 0.00 0.23 0.00 0.00 176.35 177.24 1nbw s ALA 469 N -2.15 -1.37 -0.30 4.21 0.00 -0.10 -1.83 121.76 120.22 1nbw s ALA 469 Ca 0.43 0.81 -0.03 0.00 0.00 0.00 0.00 51.96 53.16 1nbw s ALA 469 Cb -0.09 0.17 0.04 0.00 0.00 0.00 0.00 23.12 23.24 1nbw s ALA 469 CO 0.30 -0.40 0.03 0.21 0.00 0.00 0.00 175.76 175.90 1nbw s LYS 470 N -1.72 2.59 -0.09 0.00 2.47 -0.82 -0.65 119.74 121.51 1nbw s LYS 470 Ca -0.09 -1.17 -0.29 0.00 -1.56 0.00 0.00 55.97 52.85 1nbw s LYS 470 Cb -0.01 -3.25 -0.06 0.00 -1.46 0.00 0.00 37.83 33.05 1nbw s LYS 470 CO 0.04 -0.59 1.82 0.08 0.16 0.00 0.00 175.35 176.86 1nbw s VAL 471 N 1.32 3.35 -0.07 4.02 1.01 -0.87 -1.01 120.40 128.16 1nbw s VAL 471 Ca -0.03 0.41 0.21 0.00 0.00 0.00 0.00 61.98 62.58 1nbw s VAL 471 Cb -0.19 -3.31 -0.33 0.00 0.00 0.00 0.00 36.38 32.55 1nbw s VAL 471 CO -0.00 -0.09 0.49 -0.62 0.00 0.00 0.00 175.10 174.87 1nbw n GLU 472 N 7.62 0.62 -3.80 2.72 1.02 -0.37 -3.68 120.64 124.77 1nbw n GLU 472 Ca 0.20 -0.19 -0.07 0.00 -0.02 0.00 0.00 57.16 57.08 1nbw n GLU 472 Cb 0.43 -1.51 0.03 0.00 -0.02 0.00 0.00 31.44 30.37 1nbw n GLU 472 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1nbw n SER 473 N -2.21 -2.14 0.00 1.62 3.41 -0.97 -4.94 113.62 108.39 1nbw n SER 473 Ca -0.04 -2.40 0.11 0.00 -0.26 0.00 0.00 58.87 56.29 1nbw n SER 473 Cb 0.54 3.55 0.58 0.00 -0.26 0.00 0.00 64.21 68.62 1nbw n SER 473 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1nbw n LEU 474 N 0.00 0.00 0.00 1.04 4.77 -1.26 -3.28 117.00 118.27 1nbw n LEU 474 Ca -0.07 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1nbw n LEU 474 Cb 0.59 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1nbw n LEU 474 CO 0.26 -0.07 0.03 0.49 -1.33 0.00 0.00 177.39 176.77 1nbw n PHE 475 N -1.27 0.00 -3.86 -1.77 3.01 -1.26 0.33 117.46 112.64 1nbw n PHE 475 Ca 0.11 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.45 1nbw n PHE 475 Cb 0.17 0.00 -0.12 0.00 -0.01 0.00 0.00 39.48 39.52 1nbw n PHE 475 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1nbw s SER 476 N -0.66 -0.04 0.04 4.37 1.04 -1.21 -0.35 113.70 116.89 1nbw s SER 476 Ca 0.00 0.04 0.07 0.00 0.48 0.00 0.00 55.95 56.54 1nbw s SER 476 Cb 0.00 0.20 -0.02 0.00 0.10 0.00 0.00 66.02 66.29 1nbw s SER 476 CO 0.00 -0.13 -0.20 0.27 0.98 0.00 0.00 173.24 174.16 1nbw s ILE 477 N -0.41 1.59 -0.48 -1.02 -4.36 -1.00 -1.24 121.20 114.28 1nbw s ILE 477 Ca -0.05 -1.15 -0.09 0.00 -0.26 0.00 0.00 60.65 59.10 1nbw s ILE 477 Cb -0.03 -1.39 0.12 0.00 1.25 0.00 0.00 42.46 42.41 1nbw s ILE 477 CO 0.00 0.19 0.36 -0.60 0.24 0.00 0.00 174.94 175.14 1nbw s ARG 478 N -1.13 2.51 0.85 0.37 3.52 -0.18 -1.13 118.95 123.76 1nbw s ARG 478 Ca 0.07 -1.79 -0.15 0.00 -0.13 0.00 0.00 55.73 53.73 1nbw s ARG 478 Cb -0.09 -3.95 -0.01 0.00 -1.56 0.00 0.00 34.95 29.35 1nbw s ARG 478 CO 0.02 -1.20 0.40 0.72 -0.81 0.00 0.00 175.30 174.42 1nbw n HIS 479 N 4.88 -1.35 0.29 5.12 8.25 0.16 -1.95 115.22 130.62 1nbw n HIS 479 Ca -0.07 0.27 0.11 0.00 -0.26 0.00 0.00 57.72 57.77 1nbw n HIS 479 Cb 0.41 -1.83 0.52 0.00 1.12 0.00 0.00 29.99 30.21 1nbw n HIS 479 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1nbw n GLU 480 N -1.03 0.17 0.00 -0.41 0.28 -0.76 -0.90 120.64 117.98 1nbw n GLU 480 Ca 0.08 0.52 0.15 0.00 -0.16 0.00 0.00 57.16 57.74 1nbw n GLU 480 Cb 0.52 -1.90 0.72 0.00 1.43 0.00 0.00 31.44 32.21 1nbw n GLU 480 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1nbw n ASN 481 N -2.23 0.25 0.00 -1.84 0.23 -1.26 -4.90 115.26 105.52 1nbw n ASN 481 Ca 0.01 -0.52 0.00 0.00 -0.53 0.00 0.00 54.58 53.53 1nbw n ASN 481 Cb 0.14 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1nbw n ASN 481 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1nbw n GLY 482 N 1.23 1.37 3.79 4.83 0.00 -0.07 -5.06 105.19 111.28 1nbw n GLY 482 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1nbw n GLY 482 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nbw s ALA 483 N -2.37 3.15 -0.19 4.61 0.00 -1.26 -4.82 121.76 120.88 1nbw s ALA 483 Ca 0.00 0.48 -0.07 0.00 0.00 0.00 0.00 51.96 52.37 1nbw s ALA 483 Cb 0.00 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 1nbw s ALA 483 CO 0.00 0.15 0.05 0.08 0.00 0.00 0.00 175.76 176.05 1nbw s VAL 484 N -1.81 4.64 -0.09 0.00 1.01 -1.26 -0.66 120.40 122.22 1nbw s VAL 484 Ca 0.54 -0.09 -0.03 0.00 0.00 0.00 0.00 61.98 62.41 1nbw s VAL 484 Cb -0.15 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 1nbw s VAL 484 CO 0.20 0.45 0.02 -0.70 0.00 0.00 0.00 175.10 175.07 1nbw s GLU 485 N 0.54 3.05 -0.10 2.72 2.12 -0.29 -4.98 118.70 121.77 1nbw s GLU 485 Ca 0.03 -0.36 -0.02 0.00 0.36 0.00 0.00 54.97 54.97 1nbw s GLU 485 Cb -0.13 -2.85 -0.03 0.00 0.26 0.00 0.00 34.13 31.37 1nbw s GLU 485 CO 0.01 0.72 0.01 0.12 -0.54 0.00 0.00 175.26 175.57 1nbw s PHE 486 N -0.91 3.17 -0.07 5.30 5.36 -1.26 -2.38 117.98 127.19 1nbw s PHE 486 Ca 0.14 0.16 0.01 0.00 -0.96 0.00 0.00 56.93 56.28 1nbw s PHE 486 Cb -0.11 -1.82 -0.03 0.00 -0.34 0.00 0.00 43.02 40.72 1nbw s PHE 486 CO 0.03 0.42 -0.08 -0.06 -1.46 0.00 0.00 175.22 174.06 1nbw s PHE 487 N -0.72 2.89 0.15 10.12 0.40 0.53 -5.01 117.98 126.34 1nbw s PHE 487 Ca 0.11 -0.04 0.25 0.00 -0.60 0.00 0.00 56.93 56.65 1nbw s PHE 487 Cb -0.12 -1.71 0.98 0.00 0.51 0.00 0.00 43.02 42.69 1nbw s PHE 487 CO 0.02 0.28 1.85 0.00 0.70 0.00 0.00 175.22 178.07 1nbw h ARG 488 N 5.35 0.00 -6.64 0.44 2.47 -1.99 -3.44 114.38 110.58 1nbw h ARG 488 Ca -0.47 0.00 -0.69 0.00 -1.26 0.00 0.00 59.98 57.56 1nbw h ARG 488 Cb 1.17 0.00 -0.24 0.00 -1.65 0.00 0.00 29.97 29.25 1nbw h ARG 488 CO 0.52 0.20 -0.83 -1.21 0.56 0.00 0.00 179.97 179.21 1nbw s GLU 489 N -3.68 1.97 0.43 0.04 0.41 -1.26 -5.11 118.70 111.50 1nbw s GLU 489 Ca 0.00 -1.03 -0.26 0.00 -0.41 0.00 0.00 54.97 53.27 1nbw s GLU 489 Cb 0.10 -2.11 -0.09 0.00 -1.78 0.00 0.00 34.13 30.26 1nbw s GLU 489 CO 0.63 0.53 1.43 0.00 -0.49 0.00 0.00 175.26 177.35 1nbw s ALA 490 N -0.88 3.31 0.73 5.21 0.00 -1.26 -4.82 121.76 124.05 1nbw s ALA 490 Ca 0.13 1.46 -0.11 0.00 0.00 0.00 0.00 51.96 53.44 1nbw s ALA 490 Cb -0.10 -3.58 0.03 0.00 0.00 0.00 0.00 23.12 19.46 1nbw s ALA 490 CO 0.04 -1.13 1.09 -0.51 0.00 0.00 0.00 175.76 175.25 1nbw s LEU 491 N -2.57 2.83 0.44 0.00 1.43 0.15 -5.02 118.68 115.95 1nbw s LEU 491 Ca 0.59 1.27 -0.23 0.00 -1.03 0.00 0.00 54.13 54.73 1nbw s LEU 491 Cb -0.44 -4.02 -0.08 0.00 0.03 0.00 0.00 46.19 41.68 1nbw s LEU 491 CO 0.57 -1.55 1.08 -0.94 0.23 0.00 0.00 176.35 175.74 1nbw s SER 492 N -4.12 6.44 0.42 2.29 1.04 -1.26 -4.94 113.70 113.57 1nbw s SER 492 Ca 0.59 2.09 0.09 0.00 0.48 0.00 0.00 55.95 59.19 1nbw s SER 492 Cb -0.13 -2.58 0.89 0.00 0.10 0.00 0.00 66.02 64.30 1nbw s SER 492 CO 0.53 -0.71 2.03 -0.65 0.98 0.00 0.00 173.24 175.42 1nbw h PRO 493 N 2.08 0.41 -0.14 4.02 0.11 -1.99 -2.31 132.00 134.17 1nbw h PRO 493 Ca -0.49 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.62 1nbw h PRO 493 Cb 1.23 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1nbw h PRO 493 CO 0.61 0.32 0.18 0.00 -0.21 0.00 0.00 178.00 178.90 1nbw h ALA 494 N 1.74 1.70 0.00 -0.75 0.00 -2.03 -1.47 119.26 118.46 1nbw h ALA 494 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1nbw h ALA 494 Cb 0.05 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1nbw h ALA 494 CO -0.01 -0.25 -0.95 1.55 0.00 0.00 0.00 179.25 179.58 1nbw n VAL 495 N -3.70 0.01 -1.64 0.00 3.14 -0.87 -4.84 118.33 110.42 1nbw n VAL 495 Ca 0.01 -0.03 -0.52 0.00 -2.96 0.00 0.00 64.34 60.84 1nbw n VAL 495 Cb 0.29 0.78 -0.06 0.00 -1.06 0.00 0.00 33.84 33.80 1nbw n VAL 495 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 1nbw n PHE 496 N -1.55 1.88 -0.87 1.45 7.35 -0.55 -1.45 117.46 123.71 1nbw n PHE 496 Ca 0.04 0.47 0.00 0.00 -0.76 0.00 0.00 57.45 57.20 1nbw n PHE 496 Cb 0.35 -2.44 0.00 0.00 0.35 0.00 0.00 39.48 37.74 1nbw n PHE 496 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1nbw n ALA 497 N 3.80 0.00 -2.20 3.13 0.00 -1.24 -4.95 120.51 119.05 1nbw n ALA 497 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.41 1nbw n ALA 497 Cb 0.21 -1.32 0.02 0.00 0.00 0.00 0.00 19.45 18.36 1nbw n ALA 497 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1nbw s LYS 498 N -1.73 2.91 -0.06 0.00 -0.14 -0.53 -4.82 119.74 115.37 1nbw s LYS 498 Ca 0.00 -0.48 -0.12 0.00 -1.36 0.00 0.00 55.97 54.00 1nbw s LYS 498 Cb 0.00 -2.50 -0.05 0.00 -1.68 0.00 0.00 37.83 33.60 1nbw s LYS 498 CO 0.00 -0.45 0.32 0.08 -0.76 0.00 0.00 175.35 174.54 1nbw s VAL 499 N -2.68 5.21 0.17 3.17 1.01 -1.26 -2.05 120.40 123.98 1nbw s VAL 499 Ca 0.51 0.62 0.04 0.00 0.00 0.00 0.00 61.98 63.16 1nbw s VAL 499 Cb -0.10 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.62 1nbw s VAL 499 CO 0.39 0.57 -0.08 0.68 0.00 0.00 0.00 175.10 176.66 1nbw s VAL 500 N -0.86 1.17 0.15 2.92 -7.23 0.18 -1.94 120.40 114.80 1nbw s VAL 500 Ca 0.20 -2.07 0.09 0.00 -1.81 0.00 0.00 61.98 58.40 1nbw s VAL 500 Cb -0.15 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.75 1nbw s VAL 500 CO 0.09 -0.62 -0.15 -0.72 -0.31 0.00 0.00 175.10 173.40 1nbw s TYR 501 N -3.33 2.56 -0.32 2.82 -0.85 -0.69 -0.92 117.35 116.64 1nbw s TYR 501 Ca 0.20 -0.25 -0.04 0.00 -0.52 0.00 0.00 57.07 56.47 1nbw s TYR 501 Cb 0.03 -1.30 0.05 0.00 0.38 0.00 0.00 41.96 41.12 1nbw s TYR 501 CO 0.03 0.46 0.04 0.42 -1.52 0.00 0.00 175.55 174.98 1nbw s ILE 502 N -1.45 3.32 -0.45 -3.49 1.01 -0.10 -1.45 121.20 118.58 1nbw s ILE 502 Ca 0.21 -1.29 -0.04 0.00 0.00 0.00 0.00 60.65 59.53 1nbw s ILE 502 Cb -0.10 -2.90 0.12 0.00 0.01 0.00 0.00 42.46 39.60 1nbw s ILE 502 CO 0.12 -0.14 0.27 -0.75 0.00 0.00 0.00 174.94 174.44 1nbw s LYS 503 N 1.31 2.18 -0.81 2.79 2.20 -0.86 -4.42 119.74 122.13 1nbw s LYS 503 Ca -0.04 -1.88 -0.02 0.00 -0.36 0.00 0.00 55.97 53.67 1nbw s LYS 503 Cb -0.20 -3.69 -0.00 0.00 -1.51 0.00 0.00 37.83 32.43 1nbw s LYS 503 CO 0.01 -1.11 0.69 0.39 -0.36 0.00 0.00 175.35 174.96 1nbw n GLU 504 N 4.55 -1.42 0.00 4.03 -0.58 -1.26 -2.85 120.64 123.11 1nbw n GLU 504 Ca -0.02 1.19 0.00 0.00 -0.42 0.00 0.00 57.16 57.90 1nbw n GLU 504 Cb 0.41 -4.71 0.00 0.00 -0.57 0.00 0.00 31.44 26.57 1nbw n GLU 504 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nbw n GLY 505 N -1.70 0.79 3.70 0.62 0.00 -1.26 -4.94 105.19 102.40 1nbw n GLY 505 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1nbw n GLY 505 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nbw s GLU 506 N 0.00 4.28 -0.15 1.61 0.41 -1.13 -5.00 118.70 118.72 1nbw s GLU 506 Ca 0.00 2.10 -0.20 0.00 -0.41 0.00 0.00 54.97 56.46 1nbw s GLU 506 Cb 0.00 -3.38 -0.03 0.00 -1.78 0.00 0.00 34.13 28.94 1nbw s GLU 506 CO 0.00 -0.53 0.58 -0.51 -0.49 0.00 0.00 175.26 174.31 1nbw s LEU 507 N 1.68 4.21 -0.14 1.80 1.43 -1.26 -2.03 118.68 124.38 1nbw s LEU 507 Ca 0.66 0.86 0.01 0.00 -1.03 0.00 0.00 54.13 54.62 1nbw s LEU 507 Cb -0.36 -2.83 -0.01 0.00 0.03 0.00 0.00 46.19 43.02 1nbw s LEU 507 CO 0.30 -0.15 -0.16 -0.69 0.23 0.00 0.00 176.35 175.88 1nbw s VAL 508 N 1.30 2.72 0.37 -1.59 1.01 -0.53 -4.96 120.40 118.72 1nbw s VAL 508 Ca 0.28 -0.77 -0.27 0.00 0.00 0.00 0.00 61.98 61.23 1nbw s VAL 508 Cb -0.16 -2.13 -0.09 0.00 0.00 0.00 0.00 36.38 34.00 1nbw s VAL 508 CO 0.11 0.53 1.20 -2.84 0.00 0.00 0.00 175.10 174.10 1nbw s PRO 509 N 0.54 4.19 -0.35 2.72 0.02 -1.26 -1.70 135.00 139.17 1nbw s PRO 509 Ca -0.10 1.95 -0.00 0.00 0.02 0.00 0.00 61.00 62.86 1nbw s PRO 509 Cb -0.16 -2.84 0.09 0.00 0.02 0.00 0.00 34.50 31.61 1nbw s PRO 509 CO 0.04 -0.24 0.08 0.42 -0.33 0.00 0.00 177.00 176.97 1nbw s ILE 510 N -1.31 2.85 -1.17 2.83 1.01 -0.82 -4.92 121.20 119.68 1nbw s ILE 510 Ca 0.54 -1.89 -0.19 0.00 0.00 0.00 0.00 60.65 59.11 1nbw s ILE 510 Cb -0.34 -2.87 0.09 0.00 0.01 0.00 0.00 42.46 39.35 1nbw s ILE 510 CO 0.43 -0.44 1.54 -1.81 0.00 0.00 0.00 174.94 174.67 1nbw s ASP 511 N 1.37 6.76 -0.20 3.58 1.01 -1.26 -4.55 116.67 123.39 1nbw s ASP 511 Ca 0.03 -2.22 -0.26 0.00 0.71 0.00 0.00 52.55 50.81 1nbw s ASP 511 Cb -0.21 -2.53 0.07 0.00 1.01 0.00 0.00 42.92 41.26 1nbw s ASP 511 CO -0.04 -1.18 0.70 0.21 0.21 0.00 0.00 175.17 175.06 1nbw s ASN 512 N 4.14 -0.71 0.40 0.27 3.84 -1.26 -4.98 114.94 116.64 1nbw s ASN 512 Ca 0.48 1.19 0.27 0.00 0.21 0.00 0.00 52.86 55.01 1nbw s ASN 512 Cb 0.01 1.15 0.85 0.00 -0.55 0.00 0.00 41.25 42.71 1nbw s ASN 512 CO -0.00 -0.36 1.77 0.00 -2.79 0.00 0.00 177.10 175.72 1nbw h ALA 513 N 4.38 1.00 -2.66 1.71 0.00 -1.92 -3.46 119.26 118.31 1nbw h ALA 513 Ca -0.28 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.10 1nbw h ALA 513 Cb 1.15 0.00 0.06 0.00 0.00 0.00 0.00 17.79 19.00 1nbw h ALA 513 CO 0.16 0.00 0.95 -1.12 0.00 0.00 0.00 179.25 179.24 1nbw s SER 514 N -5.39 6.45 0.63 0.00 0.01 -1.26 -4.97 113.70 109.17 1nbw s SER 514 Ca 0.06 2.79 -0.16 0.00 1.31 0.00 0.00 55.95 59.94 1nbw s SER 514 Cb 0.08 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 1nbw s SER 514 CO 0.57 -0.91 1.11 -2.16 0.41 0.00 0.00 173.24 172.26 1nbw s PRO 515 N 0.95 2.97 0.27 12.44 0.04 -1.26 -4.75 135.00 145.66 1nbw s PRO 515 Ca 0.72 1.44 -0.05 0.00 0.04 0.00 0.00 61.00 63.15 1nbw s PRO 515 Cb -0.47 -1.97 0.53 0.00 0.04 0.00 0.00 34.50 32.63 1nbw s PRO 515 CO 0.34 -1.12 1.59 1.25 0.04 0.00 0.00 177.00 179.09 1nbw h LEU 516 N 0.36 -0.60 -1.70 -3.56 6.46 -1.96 0.28 115.31 114.60 1nbw h LEU 516 Ca -0.48 0.26 0.04 0.00 -0.12 0.00 0.00 57.88 57.58 1nbw h LEU 516 Cb 1.25 0.48 -0.02 0.00 -0.73 0.00 0.00 40.66 41.64 1nbw h LEU 516 CO 0.55 -0.29 0.28 -0.33 -0.62 0.00 0.00 178.44 178.03 1nbw h GLU 517 N 0.03 0.38 0.03 1.25 3.07 -1.99 0.33 114.58 117.67 1nbw h GLU 517 Ca 0.49 -0.02 -0.25 0.00 -0.50 0.00 0.00 59.36 59.08 1nbw h GLU 517 Cb 0.88 -0.08 0.02 0.00 -0.84 0.00 0.00 28.75 28.72 1nbw h GLU 517 CO -0.87 0.25 -0.98 -0.22 -1.40 0.00 0.00 179.01 175.79 1nbw h LYS 518 N 0.39 0.61 -0.18 2.33 1.63 -0.80 -2.06 116.57 118.49 1nbw h LYS 518 Ca 0.17 -0.70 -0.00 0.00 -0.85 0.00 0.00 60.65 59.27 1nbw h LYS 518 Cb 0.20 0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 1nbw h LYS 518 CO -0.04 1.29 0.09 0.82 -3.45 0.00 0.00 179.45 178.16 1nbw h ILE 519 N 0.24 1.11 -0.36 2.00 2.04 -0.84 -0.31 117.51 121.39 1nbw h ILE 519 Ca -0.13 -0.30 0.06 0.00 1.00 0.00 0.00 64.86 65.50 1nbw h ILE 519 Cb 1.66 0.98 -0.06 0.00 -0.74 0.00 0.00 36.82 38.66 1nbw h ILE 519 CO 0.19 0.10 0.02 -0.09 0.00 0.00 0.00 178.15 178.37 1nbw h ARG 520 N 0.18 0.12 -0.69 2.37 2.43 -1.00 0.02 114.38 117.80 1nbw h ARG 520 Ca 0.06 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1nbw h ARG 520 Cb 0.08 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 1nbw h ARG 520 CO -0.01 0.08 0.36 1.25 -1.51 0.00 0.00 179.97 180.14 1nbw h LEU 521 N 0.12 0.88 -0.72 3.80 5.85 -1.06 -1.70 115.31 122.48 1nbw h LEU 521 Ca 0.18 -0.11 -0.14 0.00 0.84 0.00 0.00 57.88 58.65 1nbw h LEU 521 Cb 0.24 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1nbw h LEU 521 CO -0.28 0.75 -0.54 0.58 -0.34 0.00 0.00 178.44 178.60 1nbw h VAL 522 N 0.96 1.36 0.09 1.05 2.07 -0.59 -1.85 116.25 119.33 1nbw h VAL 522 Ca 0.24 -1.83 -0.00 0.00 0.82 0.00 0.00 66.70 65.92 1nbw h VAL 522 Cb 0.08 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1nbw h VAL 522 CO -0.03 0.55 -0.04 -0.09 0.02 0.00 0.00 177.57 177.97 1nbw h ARG 523 N 0.21 -0.12 -0.23 1.57 2.43 -0.71 -1.53 114.38 116.01 1nbw h ARG 523 Ca 0.00 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.08 1nbw h ARG 523 Cb 1.02 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 1nbw h ARG 523 CO 0.09 0.13 -0.31 0.00 -1.51 0.00 0.00 179.97 178.37 1nbw h ARG 524 N -0.36 0.46 -0.20 0.20 3.08 -1.32 -2.42 114.38 113.83 1nbw h ARG 524 Ca -0.01 -0.19 -0.17 0.00 0.07 0.00 0.00 59.98 59.68 1nbw h ARG 524 Cb 0.30 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 1nbw h ARG 524 CO 0.02 0.72 -0.57 1.96 -1.07 0.00 0.00 179.97 181.02 1nbw h GLN 525 N 0.40 0.62 -0.69 0.04 4.20 -1.32 -1.82 115.11 116.53 1nbw h GLN 525 Ca 0.05 -0.40 -0.02 0.00 0.06 0.00 0.00 58.65 58.34 1nbw h GLN 525 Cb 0.74 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.54 1nbw h GLN 525 CO 0.06 1.02 0.35 0.00 -0.67 0.00 0.00 178.83 179.59 1nbw h ALA 526 N 0.89 0.89 -0.34 3.87 0.00 -1.10 0.44 119.26 123.93 1nbw h ALA 526 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1nbw h ALA 526 Cb 1.14 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1nbw h ALA 526 CO 0.11 0.44 0.15 0.87 0.00 0.00 0.00 179.25 180.82 1nbw h LYS 527 N 0.96 0.49 -0.06 0.00 1.57 -1.30 -2.39 116.57 115.85 1nbw h LYS 527 Ca 0.24 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 1nbw h LYS 527 Cb 0.09 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1nbw h LYS 527 CO -0.03 0.46 0.01 0.93 -0.57 0.00 0.00 179.45 180.25 1nbw h GLU 528 N 0.41 0.10 -0.06 3.15 5.08 -1.05 -1.82 114.58 120.37 1nbw h GLU 528 Ca 0.11 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1nbw h GLU 528 Cb 0.14 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1nbw h GLU 528 CO -0.01 0.33 0.06 0.87 -1.00 0.00 0.00 179.01 179.25 1nbw h LYS 529 N -0.15 0.00 0.00 2.33 1.57 -0.86 -1.89 116.57 117.57 1nbw h LYS 529 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1nbw h LYS 529 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1nbw h LYS 529 CO 0.00 0.00 -0.28 0.28 -0.57 0.00 0.00 179.45 178.88 1nbw n VAL 530 N -4.18 0.57 -0.11 0.50 0.31 -0.90 -4.33 118.33 110.18 1nbw n VAL 530 Ca -0.01 0.38 -0.12 0.00 -0.01 0.00 0.00 64.34 64.57 1nbw n VAL 530 Cb 0.16 -1.84 -0.03 0.00 -0.91 0.00 0.00 33.84 31.22 1nbw n VAL 530 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1nbw h PHE 531 N -0.39 0.82 -0.47 3.52 0.05 -1.42 -1.04 116.94 118.01 1nbw h PHE 531 Ca 0.00 -0.21 -0.10 0.00 3.82 0.00 0.00 57.97 61.48 1nbw h PHE 531 Cb 0.28 -0.19 -0.02 0.00 2.00 0.00 0.00 35.95 38.03 1nbw h PHE 531 CO -0.12 0.92 -0.12 0.28 -0.18 0.00 0.00 178.31 179.09 1nbw h VAL 532 N 0.48 1.26 -0.39 -0.55 2.07 -1.44 -0.83 116.25 116.85 1nbw h VAL 532 Ca 0.07 -1.23 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 1nbw h VAL 532 Cb 0.71 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1nbw h VAL 532 CO 0.05 0.43 0.14 0.74 0.02 0.00 0.00 177.57 178.95 1nbw h THR 533 N 0.79 1.20 -0.18 2.57 2.02 -1.46 -2.47 112.91 115.37 1nbw h THR 533 Ca 0.13 -0.63 -0.12 0.00 0.77 0.00 0.00 66.41 66.55 1nbw h THR 533 Cb 0.64 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1nbw h THR 533 CO 0.04 0.22 -0.42 0.78 0.37 0.00 0.00 175.52 176.52 1nbw h ASN 534 N 0.48 0.45 0.04 4.18 2.35 -0.95 -0.63 115.58 121.50 1nbw h ASN 534 Ca 0.13 -0.20 0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1nbw h ASN 534 Cb 0.21 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1nbw h ASN 534 CO -0.01 0.82 -0.12 0.00 -1.65 0.00 0.00 177.43 176.47 1nbw h LEU 536 N -0.22 0.26 -0.65 0.00 3.38 -1.23 -1.47 115.31 115.38 1nbw h LEU 536 Ca 0.03 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 1nbw h LEU 536 Cb 0.25 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1nbw h LEU 536 CO -0.09 0.22 -0.58 -0.09 0.09 0.00 0.00 178.44 177.99 1nbw h ARG 537 N 0.30 0.30 -0.05 1.13 2.43 0.10 -1.70 114.38 116.89 1nbw h ARG 537 Ca 0.08 -0.20 -0.24 0.00 -0.81 0.00 0.00 59.98 58.81 1nbw h ARG 537 Cb 0.02 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1nbw h ARG 537 CO -0.01 0.79 -0.92 0.00 -1.51 0.00 0.00 179.97 178.32 1nbw h ALA 538 N 1.16 0.25 0.00 2.80 0.00 0.13 -3.06 119.26 120.55 1nbw h ALA 538 Ca -0.00 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1nbw h ALA 538 Cb 1.09 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1nbw h ALA 538 CO 0.09 0.71 0.00 -0.07 0.00 0.00 0.00 179.25 179.98 1nbw h LEU 539 N 0.41 0.00 -0.34 0.00 3.38 -1.28 -3.09 115.31 114.39 1nbw h LEU 539 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1nbw h LEU 539 Cb 1.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.31 1nbw h LEU 539 CO 0.18 0.00 -0.39 -1.14 0.09 0.00 0.00 178.44 177.18 1nbw n ARG 540 N -2.92 0.55 -0.08 1.13 0.63 -0.64 -3.86 116.66 111.46 1nbw n ARG 540 Ca 0.04 -0.34 0.12 0.00 -0.92 0.00 0.00 57.85 56.75 1nbw n ARG 540 Cb 0.46 -1.49 0.20 0.00 0.45 0.00 0.00 32.46 32.08 1nbw n ARG 540 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 1nbw n GLN 541 N -0.93 2.30 -1.19 -0.14 7.27 -1.16 -4.33 117.38 119.21 1nbw n GLN 541 Ca 0.09 -1.93 -0.22 0.00 0.07 0.00 0.00 57.00 55.02 1nbw n GLN 541 Cb 0.35 -1.48 0.19 0.00 2.41 0.00 0.00 30.24 31.71 1nbw n GLN 541 CO 0.00 0.00 0.00 1.33 0.07 0.00 0.00 177.06 178.46 1nbw n VAL 542 N 1.23 3.15 0.00 1.69 0.24 -1.25 -4.87 118.33 118.52 1nbw n VAL 542 Ca 0.17 -1.86 0.00 0.00 -2.04 0.00 0.00 64.34 60.61 1nbw n VAL 542 Cb 0.56 -0.47 0.00 0.00 -1.47 0.00 0.00 33.84 32.46 1nbw n VAL 542 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1nbw n SER 543 N -1.04 0.00 -4.32 -1.34 3.41 -1.26 -5.11 113.62 103.96 1nbw n SER 543 Ca 0.57 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.85 1nbw n SER 543 Cb 1.64 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 65.72 1nbw n SER 543 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1nbw n PRO 544 N 0.00 -0.83 0.00 4.33 -0.04 -1.26 -3.49 135.00 133.71 1nbw n PRO 544 Ca 0.00 -0.21 0.00 0.00 -0.04 0.00 0.00 63.50 63.25 1nbw n PRO 544 Cb 0.00 -1.71 0.00 0.00 -0.04 0.00 0.00 33.50 31.75 1nbw n PRO 544 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nbw n GLY 545 N 1.91 3.08 0.96 0.55 0.00 -1.26 -4.55 105.19 105.87 1nbw n GLY 545 Ca 0.03 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1nbw n GLY 545 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nbw n GLY 546 N 0.00 0.98 0.37 -0.02 0.00 -1.23 -5.02 105.19 100.27 1nbw n GLY 546 Ca 0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 46.02 45.58 1nbw n GLY 546 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1nbw h SER 547 N 0.00 1.10 0.00 1.61 0.02 -1.80 -3.46 113.55 111.02 1nbw h SER 547 Ca 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1nbw h SER 547 Cb 0.62 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1nbw h SER 547 CO 0.00 0.77 0.00 -0.38 -1.14 0.00 0.00 176.83 176.08 1nbw n ILE 548 N -4.43 0.00 0.96 3.27 5.41 -1.26 -3.98 119.36 119.33 1nbw n ILE 548 Ca 0.12 0.00 0.09 0.00 1.00 0.00 0.00 62.75 63.96 1nbw n ILE 548 Cb 0.06 0.00 0.48 0.00 -0.71 0.00 0.00 39.64 39.46 1nbw n ILE 548 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1nbw n ARG 549 N 0.00 0.41 -0.07 0.38 1.74 -1.26 -2.38 116.66 115.47 1nbw n ARG 549 Ca 0.00 0.06 0.02 0.00 -0.77 0.00 0.00 57.85 57.16 1nbw n ARG 549 Cb 0.00 -1.50 0.35 0.00 -1.02 0.00 0.00 32.46 30.29 1nbw n ARG 549 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1nbw h ASP 550 N 0.00 0.61 -3.29 0.55 5.19 -1.92 -3.39 116.42 114.16 1nbw h ASP 550 Ca 0.00 -0.02 -0.59 0.00 -0.62 0.00 0.00 57.03 55.80 1nbw h ASP 550 Cb 0.07 -0.15 -0.10 0.00 0.18 0.00 0.00 39.33 39.34 1nbw h ASP 550 CO 0.00 0.45 -0.29 -0.63 -3.12 0.00 0.00 179.24 175.66 1nbw s ILE 551 N -5.58 5.28 -0.07 0.35 1.09 -1.00 -4.82 121.20 116.45 1nbw s ILE 551 Ca -0.09 0.63 0.02 0.00 -1.10 0.00 0.00 60.65 60.12 1nbw s ILE 551 Cb 0.17 -3.67 -0.25 0.00 -1.06 0.00 0.00 42.46 37.65 1nbw s ILE 551 CO 0.75 0.38 0.57 0.00 -0.10 0.00 0.00 174.94 176.54 1nbw h ALA 552 N 6.64 0.57 -4.08 9.38 0.00 -1.64 -3.44 119.26 126.68 1nbw h ALA 552 Ca -0.41 -1.39 -0.50 0.00 0.00 0.00 0.00 54.91 52.61 1nbw h ALA 552 Cb 1.17 0.55 -0.30 0.00 0.00 0.00 0.00 17.79 19.21 1nbw h ALA 552 CO 0.75 1.42 -0.81 -0.06 0.00 0.00 0.00 179.25 180.54 1nbw s PHE 553 N -2.58 1.33 -0.11 0.00 0.40 -1.02 -1.43 117.98 114.57 1nbw s PHE 553 Ca -0.13 -0.30 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 1nbw s PHE 553 Cb 0.07 -0.88 0.02 0.00 0.51 0.00 0.00 43.02 42.74 1nbw s PHE 553 CO 0.81 -0.07 -0.14 0.08 0.70 0.00 0.00 175.22 176.59 1nbw s VAL 554 N -0.16 1.47 -0.20 -0.44 1.01 0.19 -0.85 120.40 121.42 1nbw s VAL 554 Ca 0.02 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 61.35 1nbw s VAL 554 Cb -0.07 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 1nbw s VAL 554 CO 0.00 0.44 -0.03 -0.69 0.00 0.00 0.00 175.10 174.82 1nbw s VAL 555 N 1.11 3.67 -0.18 2.92 1.01 0.04 -2.59 120.40 126.38 1nbw s VAL 555 Ca -0.04 -0.41 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 1nbw s VAL 555 Cb -0.14 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 1nbw s VAL 555 CO -0.03 0.44 0.27 -0.76 0.00 0.00 0.00 175.10 175.02 1nbw s LEU 556 N 1.04 4.22 0.35 3.92 1.43 0.12 -1.09 118.68 128.67 1nbw s LEU 556 Ca 0.01 0.43 0.07 0.00 -1.03 0.00 0.00 54.13 53.61 1nbw s LEU 556 Cb -0.15 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 43.72 1nbw s LEU 556 CO 0.01 0.09 0.25 0.54 0.23 0.00 0.00 176.35 177.46 1nbw s VAL 557 N 0.61 0.11 0.00 -1.59 0.11 0.07 0.11 120.40 119.81 1nbw s VAL 557 Ca 0.15 -2.00 0.00 0.00 -2.93 0.00 0.00 61.98 57.20 1nbw s VAL 557 Cb -0.13 -2.46 0.00 0.00 -1.53 0.00 0.00 36.38 32.27 1nbw s VAL 557 CO 0.03 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.41 1nbw n GLY 558 N -0.69 0.42 0.34 6.54 0.00 -1.22 -0.37 105.19 110.21 1nbw n GLY 558 Ca 0.05 -1.78 0.11 0.00 0.00 0.00 0.00 46.02 44.40 1nbw n GLY 558 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1nbw h GLY 559 N 0.00 1.66 2.00 -0.02 0.00 -1.87 -0.41 103.07 104.43 1nbw h GLY 559 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1nbw h GLY 559 CO 0.00 -0.04 0.00 1.44 0.00 0.00 0.00 176.54 177.94 1nbw n SER 560 N -4.79 0.21 0.00 0.19 7.64 0.27 -2.64 113.62 114.50 1nbw n SER 560 Ca 0.21 0.53 0.12 0.00 1.01 0.00 0.00 58.87 60.74 1nbw n SER 560 Cb 0.52 -0.59 0.54 0.00 -1.01 0.00 0.00 64.21 63.67 1nbw n SER 560 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1nbw n SER 561 N -1.71 0.00 -0.54 6.43 7.64 -0.16 -2.30 113.62 122.98 1nbw n SER 561 Ca 0.05 0.34 0.12 0.00 1.01 0.00 0.00 58.87 60.40 1nbw n SER 561 Cb 0.27 -0.44 0.25 0.00 -1.01 0.00 0.00 64.21 63.28 1nbw n SER 561 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1nbw n LEU 562 N -1.44 1.88 -4.76 -3.43 4.77 -1.08 -4.70 117.00 108.23 1nbw n LEU 562 Ca 0.07 -0.63 -0.39 0.00 -0.03 0.00 0.00 56.01 55.04 1nbw n LEU 562 Cb 0.25 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.33 1nbw n LEU 562 CO 0.21 0.33 1.00 -0.62 -1.33 0.00 0.00 177.39 176.98 1nbw s ASP 563 N -2.25 5.86 0.00 -1.43 -1.08 -0.97 -4.88 116.67 111.92 1nbw s ASP 563 Ca 0.27 2.76 0.12 0.00 -0.52 0.00 0.00 52.55 55.17 1nbw s ASP 563 Cb 0.20 -2.64 0.55 0.00 -1.46 0.00 0.00 42.92 39.56 1nbw s ASP 563 CO 0.44 -1.17 1.32 2.22 0.52 0.00 0.00 175.17 178.50 1nbw n PHE 564 N -0.35 0.00 0.00 -5.34 1.16 -1.26 -3.98 117.46 107.69 1nbw n PHE 564 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.64 1nbw n PHE 564 Cb 0.44 -0.38 0.00 0.00 -1.61 0.00 0.00 39.48 37.93 1nbw n PHE 564 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 1nbw n GLU 565 N -1.38 0.71 -0.19 3.97 1.02 -1.26 -4.85 120.64 118.65 1nbw n GLU 565 Ca 0.04 0.00 -0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1nbw n GLU 565 Cb 0.11 -0.78 0.09 0.00 -0.02 0.00 0.00 31.44 30.84 1nbw n GLU 565 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1nbw h ILE 566 N 0.00 0.52 -0.65 -3.67 2.04 -1.85 -1.03 117.51 112.87 1nbw h ILE 566 Ca 0.00 -0.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.76 1nbw h ILE 566 Cb 0.55 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1nbw h ILE 566 CO 0.00 0.02 0.17 1.55 0.00 0.00 0.00 178.15 179.89 1nbw h PRO 567 N 0.11 1.02 -0.05 2.37 0.13 -1.83 -2.31 132.00 131.43 1nbw h PRO 567 Ca 0.30 -0.22 -0.13 0.00 -0.87 0.00 0.00 66.00 65.08 1nbw h PRO 567 Cb 0.47 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 1nbw h PRO 567 CO -0.50 0.89 -0.55 -0.56 -0.23 0.00 0.00 178.00 177.05 1nbw h GLN 568 N 0.97 0.16 -0.91 0.86 -0.00 -1.76 -0.64 115.11 113.80 1nbw h GLN 568 Ca 0.21 -0.10 0.02 0.00 -0.00 0.00 0.00 58.65 58.77 1nbw h GLN 568 Cb 0.32 0.01 -0.05 0.00 -0.00 0.00 0.00 27.48 27.77 1nbw h GLN 568 CO -0.00 0.67 0.60 -0.07 -0.00 0.00 0.00 178.83 180.03 1nbw h LEU 569 N 0.12 1.03 -0.55 0.06 3.38 -0.86 0.50 115.31 118.99 1nbw h LEU 569 Ca -0.00 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 1nbw h LEU 569 Cb 1.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1nbw h LEU 569 CO 0.08 0.74 -0.65 0.40 0.09 0.00 0.00 178.44 179.09 1nbw h ILE 570 N 1.21 1.39 -0.44 1.22 2.04 -1.08 -1.17 117.51 120.68 1nbw h ILE 570 Ca 0.34 -2.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.12 1nbw h ILE 570 Cb -0.10 2.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 1nbw h ILE 570 CO -0.09 0.61 0.25 0.74 0.00 0.00 0.00 178.15 179.66 1nbw h THR 571 N 0.21 1.16 0.83 -0.27 2.02 -0.30 -0.98 112.91 115.58 1nbw h THR 571 Ca -0.01 -0.41 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 1nbw h THR 571 Cb 1.19 0.62 0.01 0.00 -1.74 0.00 0.00 68.15 68.23 1nbw h THR 571 CO 0.10 0.17 -0.40 -0.08 0.37 0.00 0.00 175.52 175.68 1nbw h GLU 572 N 0.58 -1.08 -0.15 6.66 4.57 -0.77 -2.32 114.58 122.08 1nbw h GLU 572 Ca 0.16 0.07 0.04 0.00 -1.18 0.00 0.00 59.36 58.45 1nbw h GLU 572 Cb 0.05 0.24 -0.07 0.00 -0.16 0.00 0.00 28.75 28.82 1nbw h GLU 572 CO -0.03 -0.72 -0.46 0.00 -1.18 0.00 0.00 179.01 176.63 1nbw h ALA 573 N -1.33 -0.67 0.00 2.92 0.00 -1.19 -2.13 119.26 116.86 1nbw h ALA 573 Ca -0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1nbw h ALA 573 Cb 0.86 0.86 -0.00 0.00 0.00 0.00 0.00 17.79 19.51 1nbw h ALA 573 CO 0.19 -0.97 -0.03 -0.07 0.00 0.00 0.00 179.25 178.37 1nbw h LEU 574 N -0.51 0.00 -1.52 0.00 4.07 -1.26 -2.80 115.31 113.28 1nbw h LEU 574 Ca 0.07 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.98 1nbw h LEU 574 Cb 0.64 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.38 1nbw h LEU 574 CO -0.42 0.03 -0.24 0.77 -1.08 0.00 0.00 178.44 177.50 1nbw h SER 575 N 0.00 0.00 0.37 -0.43 4.64 -0.79 -1.92 113.55 115.42 1nbw h SER 575 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1nbw h SER 575 Cb 0.20 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1nbw h SER 575 CO 0.00 0.24 -0.05 0.45 -0.87 0.00 0.00 176.83 176.60 1nbw h HIS 576 N 0.00 0.00 -0.60 4.77 3.86 -1.56 0.13 115.15 121.75 1nbw h HIS 576 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1nbw h HIS 576 Cb 0.43 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.90 1nbw h HIS 576 CO 0.00 0.05 0.00 0.66 0.86 0.00 0.00 177.93 179.50 1nbw n TYR 577 N -3.38 1.08 -1.08 2.45 4.02 -0.78 -4.91 117.16 114.57 1nbw n TYR 577 Ca -0.02 -0.47 -0.03 0.00 -0.01 0.00 0.00 57.90 57.37 1nbw n TYR 577 Cb 0.19 -0.12 -0.01 0.00 -0.02 0.00 0.00 39.34 39.38 1nbw n TYR 577 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1nbw n GLY 578 N 1.25 0.55 3.86 2.72 0.00 0.44 -4.56 105.19 109.45 1nbw n GLY 578 Ca 0.22 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1nbw n GLY 578 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nbw s VAL 579 N -1.86 4.96 -0.25 1.61 1.01 -0.89 -4.97 120.40 120.02 1nbw s VAL 579 Ca 0.00 0.63 -0.12 0.00 0.00 0.00 0.00 61.98 62.49 1nbw s VAL 579 Cb 0.00 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 1nbw s VAL 579 CO 0.00 0.22 0.25 -0.69 0.00 0.00 0.00 175.10 174.88 1nbw s VAL 580 N -1.49 5.28 0.03 2.92 1.01 -0.51 -3.71 120.40 123.94 1nbw s VAL 580 Ca 0.37 0.35 0.02 0.00 0.00 0.00 0.00 61.98 62.72 1nbw s VAL 580 Cb -0.14 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1nbw s VAL 580 CO 0.19 0.27 -0.08 0.00 0.00 0.00 0.00 175.10 175.48 1nbw s ALA 581 N 1.47 0.59 0.00 5.51 0.00 -1.26 0.53 121.76 128.60 1nbw s ALA 581 Ca 0.11 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.42 1nbw s ALA 581 Cb -0.15 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 22.97 1nbw s ALA 581 CO 0.08 0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.27 1nbw n GLY 582 N 1.82 0.46 3.70 0.00 0.00 -1.07 -4.42 105.19 105.68 1nbw n GLY 582 Ca -0.20 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 1nbw n GLY 582 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1nbw s GLN 583 N -2.00 4.17 0.98 1.61 0.74 -1.26 -0.70 119.66 123.20 1nbw s GLN 583 Ca 0.00 2.47 -0.11 0.00 0.05 0.00 0.00 55.36 57.77 1nbw s GLN 583 Cb 0.00 -3.39 0.18 0.00 1.10 0.00 0.00 33.01 30.90 1nbw s GLN 583 CO 0.00 -0.74 1.09 0.20 -0.55 0.00 0.00 175.29 175.29 1nbw s GLY 584 N 1.97 1.62 -0.47 2.59 0.00 0.12 -4.76 107.32 108.39 1nbw s GLY 584 Ca 0.75 0.13 0.06 0.00 0.00 0.00 0.00 44.72 45.66 1nbw s GLY 584 CO 0.33 0.66 0.70 -2.01 0.00 0.00 0.00 173.10 172.79 1nbw n ASN 585 N -4.32 -2.09 -4.62 1.64 5.15 -1.19 -1.67 115.26 108.16 1nbw n ASN 585 Ca 0.07 -2.97 -0.49 0.00 -0.60 0.00 0.00 54.58 50.59 1nbw n ASN 585 Cb 0.54 1.00 -0.05 0.00 -0.53 0.00 0.00 39.78 40.74 1nbw n ASN 585 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1nbw n ILE 586 N 2.06 0.10 -1.24 -1.44 -0.00 -0.59 -0.88 119.36 117.37 1nbw n ILE 586 Ca 0.16 -0.03 -0.11 0.00 -0.00 0.00 0.00 62.75 62.78 1nbw n ILE 586 Cb 0.57 -1.10 -0.05 0.00 -0.00 0.00 0.00 39.64 39.06 1nbw n ILE 586 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1nbw n ARG 587 N 2.76 -1.61 -1.05 0.38 1.74 -1.04 -1.43 116.66 116.41 1nbw n ARG 587 Ca 0.17 0.79 -0.02 0.00 -0.77 0.00 0.00 57.85 58.02 1nbw n ARG 587 Cb 0.23 -5.04 -0.01 0.00 -1.02 0.00 0.00 32.46 26.63 1nbw n ARG 587 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nbw n GLY 588 N 0.11 0.41 0.00 -0.13 0.00 -0.06 -4.76 105.19 100.76 1nbw n GLY 588 Ca -0.11 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1nbw n GLY 588 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1nbw n THR 589 N -2.56 0.00 0.50 2.61 -2.24 -0.61 -4.92 114.28 107.06 1nbw n THR 589 Ca -0.02 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.89 1nbw n THR 589 Cb 0.25 0.00 0.22 0.00 -2.10 0.00 0.00 70.33 68.70 1nbw n THR 589 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1nbw h GLU 590 N 0.00 0.00 0.00 -0.78 4.39 -1.51 -3.49 114.58 113.19 1nbw h GLU 590 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1nbw h GLU 590 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1nbw h GLU 590 CO 0.00 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.26 1nbw n GLY 591 N 1.29 -1.29 2.32 -3.84 0.00 -1.26 -4.09 105.19 98.31 1nbw n GLY 591 Ca 0.04 -1.27 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 1nbw n GLY 591 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nbw n PRO 592 N 0.00 3.43 -3.94 1.61 -0.04 -0.67 -1.54 135.00 133.84 1nbw n PRO 592 Ca 0.00 -2.04 -0.10 0.00 -0.04 0.00 0.00 63.50 61.33 1nbw n PRO 592 Cb 0.00 -2.71 -0.03 0.00 -0.04 0.00 0.00 33.50 30.72 1nbw n PRO 592 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1nbw s ARG 593 N 2.21 1.81 0.00 0.54 0.52 -1.26 -3.44 118.95 119.33 1nbw s ARG 593 Ca 0.67 -1.32 0.00 0.00 -0.52 0.00 0.00 55.73 54.56 1nbw s ARG 593 Cb 0.18 0.53 0.00 0.00 0.52 0.00 0.00 34.95 36.18 1nbw s ARG 593 CO -0.05 -0.79 0.00 -1.71 0.02 0.00 0.00 175.30 172.76 1nbw n ASN 594 N -0.79 -4.81 0.19 0.23 2.85 -1.26 -4.42 115.26 107.25 1nbw n ASN 594 Ca -0.03 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.29 1nbw n ASN 594 Cb 0.61 -2.47 -0.08 0.00 1.24 0.00 0.00 39.78 39.08 1nbw n ASN 594 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1nbw h ALA 595 N 0.00 -0.77 -0.42 5.20 0.00 -1.92 0.28 119.26 121.63 1nbw h ALA 595 Ca 0.00 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1nbw h ALA 595 Cb 0.64 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1nbw h ALA 595 CO 0.00 -0.98 -0.30 0.28 0.00 0.00 0.00 179.25 178.24 1nbw h VAL 596 N -0.72 1.27 -0.70 0.00 2.07 -1.83 -1.66 116.25 114.67 1nbw h VAL 596 Ca -0.01 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.03 1nbw h VAL 596 Cb 0.68 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 1nbw h VAL 596 CO -0.13 0.50 0.39 0.00 0.02 0.00 0.00 177.57 178.34 1nbw h ALA 597 N 0.87 1.36 -0.27 1.67 0.00 -1.82 -0.93 119.26 120.14 1nbw h ALA 597 Ca 0.08 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1nbw h ALA 597 Cb 0.88 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1nbw h ALA 597 CO 0.08 0.53 -0.32 1.15 0.00 0.00 0.00 179.25 180.69 1nbw h THR 598 N 0.98 1.31 -0.86 0.00 2.02 -0.26 -2.35 112.91 113.75 1nbw h THR 598 Ca 0.25 -1.50 0.05 0.00 0.77 0.00 0.00 66.41 65.98 1nbw h THR 598 Cb 0.02 1.64 -0.06 0.00 -1.74 0.00 0.00 68.15 68.01 1nbw h THR 598 CO -0.04 0.48 0.54 1.23 0.37 0.00 0.00 175.52 178.10 1nbw h GLY 599 N 0.42 1.27 1.33 2.16 0.00 -0.69 0.64 103.07 108.20 1nbw h GLY 599 Ca 0.04 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 1nbw h GLY 599 CO 0.08 0.31 -0.02 1.41 0.00 0.00 0.00 176.54 178.32 1nbw h LEU 600 N 1.02 0.78 0.06 3.11 3.38 -1.13 -1.27 115.31 121.27 1nbw h LEU 600 Ca 0.36 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1nbw h LEU 600 Cb 0.09 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1nbw h LEU 600 CO -0.15 0.86 -0.03 0.25 0.09 0.00 0.00 178.44 179.47 1nbw h LEU 601 N 0.75 -0.07 -0.43 1.67 6.46 -0.71 -0.71 115.31 122.28 1nbw h LEU 601 Ca 0.14 -0.21 0.07 0.00 -0.12 0.00 0.00 57.88 57.77 1nbw h LEU 601 Cb 0.48 0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 40.37 1nbw h LEU 601 CO 0.02 0.17 0.05 -0.07 -0.62 0.00 0.00 178.44 178.00 1nbw h LEU 602 N -0.31 -0.07 -0.26 2.25 3.38 -0.75 -0.79 115.31 118.76 1nbw h LEU 602 Ca -0.01 0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.08 1nbw h LEU 602 Cb 0.28 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 1nbw h LEU 602 CO 0.01 0.00 0.07 0.00 0.09 0.00 0.00 178.44 178.61 1nbw h ALA 603 N 1.35 0.28 0.00 1.53 0.00 -1.10 -2.18 119.26 119.13 1nbw h ALA 603 Ca 0.21 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 1nbw h ALA 603 Cb 0.28 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1nbw h ALA 603 CO -0.30 -0.35 -0.16 0.78 0.00 0.00 0.00 179.25 179.22 1nbw h GLY 604 N 0.17 0.00 2.00 0.00 0.00 -0.38 -0.66 103.07 104.21 1nbw h GLY 604 Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.37 1nbw h GLY 604 CO -0.14 0.00 -0.37 1.46 0.00 0.00 0.00 176.54 177.49 1nbw h GLN 605 N 0.00 0.00 0.00 4.80 4.20 -0.54 -3.01 115.11 120.56 1nbw h GLN 605 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1nbw h GLN 605 Cb 0.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1nbw h GLN 605 CO 0.02 0.37 -1.06 0.00 -0.67 0.00 0.00 178.83 177.48 1nbw n ALA 606 N -2.23 2.67 0.64 3.87 0.00 -0.87 -5.09 120.51 119.50 1nbw n ALA 606 Ca 0.01 -0.28 0.05 0.00 0.00 0.00 0.00 53.44 53.23 1nbw n ALA 606 Cb 0.59 -1.07 0.30 0.00 0.00 0.00 0.00 19.45 19.27 1nbw n ALA 606 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79