#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nbw s ILE 4 N 0.00 0.72 -0.02 1.96 -1.09 -0.39 -2.38 121.20 120.01 1nbw s ILE 4 Ca 0.00 -0.70 0.08 0.00 -2.23 0.00 0.00 60.65 57.79 1nbw s ILE 4 Cb 0.00 -0.67 -0.02 0.00 -1.58 0.00 0.00 42.46 40.19 1nbw s ILE 4 CO 0.00 -0.02 -0.25 0.00 -1.23 0.00 0.00 174.94 173.44 1nbw s ALA 5 N -0.67 2.11 -0.22 9.38 0.00 -0.52 -1.58 121.76 130.27 1nbw s ALA 5 Ca -0.01 -1.09 -0.05 0.00 0.00 0.00 0.00 51.96 50.81 1nbw s ALA 5 Cb -0.06 -0.54 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 1nbw s ALA 5 CO 0.00 0.51 -0.00 0.20 0.00 0.00 0.00 175.76 176.47 1nbw s GLY 6 N -0.58 1.68 -0.14 0.00 0.00 -0.74 -0.84 107.32 106.70 1nbw s GLY 6 Ca 0.09 -1.08 0.02 0.00 0.00 0.00 0.00 44.72 43.75 1nbw s GLY 6 CO -0.01 0.36 -0.19 -0.42 0.00 0.00 0.00 173.10 172.84 1nbw s ILE 7 N 1.29 1.85 -0.23 0.90 1.01 0.44 -1.19 121.20 125.27 1nbw s ILE 7 Ca 0.04 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 59.83 1nbw s ILE 7 Cb -0.15 -1.67 0.01 0.00 0.01 0.00 0.00 42.46 40.66 1nbw s ILE 7 CO 0.01 0.51 -0.07 -0.62 0.00 0.00 0.00 174.94 174.76 1nbw s ASP 8 N 1.08 4.15 -0.94 3.58 3.68 -0.10 -1.25 116.67 126.89 1nbw s ASP 8 Ca -0.02 -0.63 -0.08 0.00 2.13 0.00 0.00 52.55 53.95 1nbw s ASP 8 Cb -0.14 -1.67 0.24 0.00 -1.45 0.00 0.00 42.92 39.89 1nbw s ASP 8 CO -0.06 -0.07 0.88 -0.63 0.13 0.00 0.00 175.17 175.42 1nbw s ILE 9 N 1.39 5.32 0.97 4.11 1.01 -0.23 0.06 121.20 133.82 1nbw s ILE 9 Ca 0.03 -3.22 -0.15 0.00 0.00 0.00 0.00 60.65 57.32 1nbw s ILE 9 Cb -0.15 -4.26 0.18 0.00 0.01 0.00 0.00 42.46 38.24 1nbw s ILE 9 CO -0.05 -1.09 1.22 -0.83 0.00 0.00 0.00 174.94 174.19 1nbw s GLY 10 N 1.17 1.67 0.30 6.18 0.00 -0.40 -2.46 107.32 113.78 1nbw s GLY 10 Ca 0.25 -0.90 0.06 0.00 0.00 0.00 0.00 44.72 44.13 1nbw s GLY 10 CO -0.09 -0.21 1.71 3.43 0.00 0.00 0.00 173.10 177.94 1nbw h ASN 11 N -1.67 0.26 0.00 1.64 -0.26 -1.91 -3.36 115.58 110.28 1nbw h ASN 11 Ca -0.46 -0.11 -0.22 0.00 -0.56 0.00 0.00 56.30 54.95 1nbw h ASN 11 Cb 1.28 -0.07 -0.03 0.00 -1.06 0.00 0.00 38.32 38.44 1nbw h ASN 11 CO 0.48 0.63 -1.72 0.00 -1.06 0.00 0.00 177.43 175.77 1nbw n ALA 12 N -2.48 1.06 -2.52 -0.83 0.00 -1.26 -4.77 120.51 109.71 1nbw n ALA 12 Ca -0.01 -0.94 -0.24 0.00 0.00 0.00 0.00 53.44 52.24 1nbw n ALA 12 Cb 0.47 0.09 -0.13 0.00 0.00 0.00 0.00 19.45 19.87 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 -2.71 1.71 -0.35 0.00 -4.23 -1.26 -0.67 115.64 108.13 1nbw s THR 13 Ca -0.33 -1.47 -0.10 0.00 -1.18 0.00 0.00 61.69 58.61 1nbw s THR 13 Cb 0.09 -1.54 0.02 0.00 1.34 0.00 0.00 72.50 72.41 1nbw s THR 13 CO 0.45 0.00 0.17 -0.89 -0.54 0.00 0.00 174.62 173.81 1nbw s THR 14 N -1.08 4.41 0.13 3.99 2.01 -0.09 -1.27 115.64 123.74 1nbw s THR 14 Ca 0.07 -0.81 0.07 0.00 0.31 0.00 0.00 61.69 61.32 1nbw s THR 14 Cb -0.10 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 1nbw s THR 14 CO 0.04 -0.15 -0.04 -1.61 -0.69 0.00 0.00 174.62 172.17 1nbw s GLU 15 N 1.54 2.32 -0.03 4.92 2.02 0.11 -2.72 118.70 126.85 1nbw s GLU 15 Ca 0.02 -1.03 0.03 0.00 0.02 0.00 0.00 54.97 54.02 1nbw s GLU 15 Cb -0.19 -2.37 0.00 0.00 0.10 0.00 0.00 34.13 31.67 1nbw s GLU 15 CO 0.06 0.49 -0.13 0.08 0.02 0.00 0.00 175.26 175.78 1nbw s VAL 16 N -1.45 1.09 -0.34 2.63 1.01 0.68 -0.92 120.40 123.11 1nbw s VAL 16 Ca 0.25 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1nbw s VAL 16 Cb -0.10 -0.95 0.10 0.00 0.00 0.00 0.00 36.38 35.43 1nbw s VAL 16 CO 0.17 0.33 0.10 0.00 0.00 0.00 0.00 175.10 175.69 1nbw s ALA 17 N 0.12 2.17 -0.10 5.51 0.00 -0.33 -1.45 121.76 127.67 1nbw s ALA 17 Ca -0.03 -2.14 -0.06 0.00 0.00 0.00 0.00 51.96 49.73 1nbw s ALA 17 Cb -0.10 -1.80 -0.04 0.00 0.00 0.00 0.00 23.12 21.18 1nbw s ALA 17 CO 0.01 -1.73 0.15 -1.17 0.00 0.00 0.00 175.76 173.02 1nbw s LEU 18 N 1.16 4.37 -0.24 0.00 2.96 0.16 -1.79 118.68 125.30 1nbw s LEU 18 Ca 0.11 0.44 -0.27 0.00 -0.22 0.00 0.00 54.13 54.19 1nbw s LEU 18 Cb -0.19 -2.17 0.13 0.00 0.50 0.00 0.00 46.19 44.46 1nbw s LEU 18 CO -0.16 0.38 1.05 0.00 -1.32 0.00 0.00 176.35 176.30 1nbw s ALA 19 N -1.09 -1.98 -0.66 5.97 0.00 -0.61 -1.00 121.76 122.39 1nbw s ALA 19 Ca 0.17 1.76 -0.07 0.00 0.00 0.00 0.00 51.96 53.82 1nbw s ALA 19 Cb -0.12 -1.21 0.17 0.00 0.00 0.00 0.00 23.12 21.96 1nbw s ALA 19 CO 0.07 -0.25 0.52 0.45 0.00 0.00 0.00 175.76 176.55 1nbw s SER 20 N -0.27 5.78 0.57 0.00 0.15 -1.26 -1.26 113.70 117.41 1nbw s SER 20 Ca 0.02 -2.65 -0.18 0.00 0.70 0.00 0.00 55.95 53.84 1nbw s SER 20 Cb -0.03 -1.99 -0.05 0.00 -1.71 0.00 0.00 66.02 62.24 1nbw s SER 20 CO -0.04 -0.48 1.08 -0.62 1.20 0.00 0.00 173.24 174.38 1nbw s ASP 21 N 1.46 5.75 0.20 5.45 3.68 -1.26 -4.83 116.67 127.12 1nbw s ASP 21 Ca 0.15 1.97 0.01 0.00 2.13 0.00 0.00 52.55 56.82 1nbw s ASP 21 Cb -0.18 -2.56 -0.05 0.00 -1.45 0.00 0.00 42.92 38.69 1nbw s ASP 21 CO -0.05 -1.19 0.04 -0.31 0.13 0.00 0.00 175.17 173.79 1nbw s TYR 22 N -2.15 1.29 0.00 -5.34 1.51 -1.26 -4.84 117.35 106.56 1nbw s TYR 22 Ca 0.67 -1.09 0.00 0.00 -1.01 0.00 0.00 57.07 55.64 1nbw s TYR 22 Cb -0.19 -0.74 0.00 0.00 -0.11 0.00 0.00 41.96 40.92 1nbw s TYR 22 CO 0.31 -0.28 0.00 -2.30 -1.11 0.00 0.00 175.55 172.18 1nbw n PRO 23 N -0.30 0.00 -0.05 -1.71 -0.02 -1.26 -3.95 135.00 127.71 1nbw n PRO 23 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 1nbw n PRO 23 Cb 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.12 1nbw n PRO 23 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1nbw n GLN 24 N 0.00 0.00 -3.64 -0.52 1.13 -1.26 -4.63 117.38 108.47 1nbw n GLN 24 Ca 0.00 -0.08 -0.10 0.00 -1.94 0.00 0.00 57.00 54.88 1nbw n GLN 24 Cb 0.00 -1.22 -0.07 0.00 0.11 0.00 0.00 30.24 29.06 1nbw n GLN 24 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1nbw s ALA 25 N 2.20 -1.84 -0.46 -1.58 0.00 -1.25 -5.12 121.76 113.71 1nbw s ALA 25 Ca 0.00 2.25 -0.21 0.00 0.00 0.00 0.00 51.96 54.00 1nbw s ALA 25 Cb 0.00 -1.32 0.03 0.00 0.00 0.00 0.00 23.12 21.83 1nbw s ALA 25 CO 0.00 -0.36 0.69 1.03 0.00 0.00 0.00 175.76 177.12 1nbw s ARG 26 N 1.08 3.29 0.44 0.00 1.81 -1.26 -4.29 118.95 120.01 1nbw s ARG 26 Ca -0.06 -0.37 -0.21 0.00 -1.72 0.00 0.00 55.73 53.37 1nbw s ARG 26 Cb -0.05 -3.97 -0.10 0.00 -0.45 0.00 0.00 34.95 30.37 1nbw s ARG 26 CO -0.11 -1.09 0.97 0.00 -0.68 0.00 0.00 175.30 174.40 1nbw s ALA 27 N 2.97 3.00 0.65 2.13 0.00 -1.26 -5.05 121.76 124.19 1nbw s ALA 27 Ca 0.24 0.46 -0.09 0.00 0.00 0.00 0.00 51.96 52.56 1nbw s ALA 27 Cb -0.14 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1nbw s ALA 27 CO 0.19 0.02 1.02 -0.06 0.00 0.00 0.00 175.76 176.92 1nbw s PHE 28 N -2.11 3.36 -0.04 0.00 0.40 -1.26 -5.02 117.98 113.29 1nbw s PHE 28 Ca 0.63 0.95 0.06 0.00 -0.60 0.00 0.00 56.93 57.97 1nbw s PHE 28 Cb -0.11 -2.89 -0.01 0.00 0.51 0.00 0.00 43.02 40.52 1nbw s PHE 28 CO 0.15 -0.97 -0.24 0.08 0.70 0.00 0.00 175.22 174.95 1nbw s VAL 29 N -3.20 1.93 -0.14 -0.44 1.01 -1.26 -4.59 120.40 113.71 1nbw s VAL 29 Ca 0.56 -1.02 -0.05 0.00 0.00 0.00 0.00 61.98 61.47 1nbw s VAL 29 Cb -0.11 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1nbw s VAL 29 CO 0.50 0.54 0.05 0.00 0.00 0.00 0.00 175.10 176.19 1nbw s ALA 30 N -0.27 3.43 0.37 5.51 0.00 -0.17 -4.94 121.76 125.70 1nbw s ALA 30 Ca 0.01 -0.75 0.08 0.00 0.00 0.00 0.00 51.96 51.30 1nbw s ALA 30 Cb -0.12 -1.77 -0.06 0.00 0.00 0.00 0.00 23.12 21.17 1nbw s ALA 30 CO 0.02 0.39 0.04 -1.12 0.00 0.00 0.00 175.76 175.09 1nbw s SER 31 N -0.29 4.12 -0.10 0.00 0.01 -1.26 0.36 113.70 116.54 1nbw s SER 31 Ca 0.08 -1.12 -0.20 0.00 1.31 0.00 0.00 55.95 56.03 1nbw s SER 31 Cb -0.12 -0.47 0.05 0.00 0.21 0.00 0.00 66.02 65.68 1nbw s SER 31 CO 0.02 -0.35 0.48 -0.83 0.41 0.00 0.00 173.24 172.97 1nbw s GLY 32 N -3.75 -0.35 -0.15 3.44 0.00 -0.53 -3.77 107.32 102.21 1nbw s GLY 32 Ca 0.36 1.05 -0.14 0.00 0.00 0.00 0.00 44.72 45.99 1nbw s GLY 32 CO 0.19 0.82 0.41 -0.42 0.00 0.00 0.00 173.10 174.10 1nbw s ILE 33 N -0.55 -0.00 0.10 0.90 1.01 -1.26 -0.23 121.20 121.18 1nbw s ILE 33 Ca -0.07 0.00 -0.19 0.00 0.00 0.00 0.00 60.65 60.40 1nbw s ILE 33 Cb -0.03 -0.57 0.04 0.00 0.01 0.00 0.00 42.46 41.91 1nbw s ILE 33 CO 0.04 0.00 0.46 0.68 0.00 0.00 0.00 174.94 176.12 1nbw s VAL 34 N 0.24 0.05 0.31 2.92 -7.23 -1.10 -4.89 120.40 110.70 1nbw s VAL 34 Ca -0.00 -0.40 -0.29 0.00 -1.81 0.00 0.00 61.98 59.48 1nbw s VAL 34 Cb -0.03 -1.07 -0.10 0.00 0.56 0.00 0.00 36.38 35.73 1nbw s VAL 34 CO 0.00 -0.22 1.36 0.00 -0.31 0.00 0.00 175.10 175.93 1nbw s ALA 35 N -3.35 3.54 -0.17 1.32 0.00 -1.26 -0.91 121.76 120.91 1nbw s ALA 35 Ca -0.00 1.30 -0.29 0.00 0.00 0.00 0.00 51.96 52.97 1nbw s ALA 35 Cb 0.01 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 1nbw s ALA 35 CO -0.09 -0.70 1.80 0.99 0.00 0.00 0.00 175.76 177.77 1nbw s THR 36 N -0.78 3.43 0.24 0.00 2.01 0.15 -4.65 115.64 116.05 1nbw s THR 36 Ca 0.52 0.48 -0.30 0.00 0.31 0.00 0.00 61.69 62.71 1nbw s THR 36 Cb -0.41 -3.44 -0.09 0.00 0.01 0.00 0.00 72.50 68.57 1nbw s THR 36 CO 0.51 -0.18 1.28 0.42 -0.69 0.00 0.00 174.62 175.95 1nbw s THR 37 N 5.71 3.15 0.36 -0.82 -4.23 -1.26 -4.90 115.64 113.65 1nbw s THR 37 Ca 0.80 1.01 0.00 0.00 -1.18 0.00 0.00 61.69 62.32 1nbw s THR 37 Cb -0.30 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 69.90 1nbw s THR 37 CO 0.33 0.18 0.00 0.61 -0.54 0.00 0.00 174.62 175.20 1nbw n GLY 38 N 1.86 -1.98 3.65 3.99 0.00 -1.26 -2.70 105.19 108.75 1nbw n GLY 38 Ca 0.04 -1.10 -0.48 0.00 0.00 0.00 0.00 46.02 44.48 1nbw n GLY 38 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1nbw n MET 39 N -4.19 1.92 -2.17 1.61 0.00 -1.26 -4.75 117.12 108.29 1nbw n MET 39 Ca -0.00 0.69 -0.39 0.00 -0.00 0.00 0.00 57.70 58.00 1nbw n MET 39 Cb 0.67 -2.44 -0.01 0.00 0.00 0.00 0.00 33.22 31.44 1nbw n MET 39 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1nbw s LYS 40 N 1.11 4.00 0.00 2.12 -0.14 -1.26 -3.11 119.74 122.46 1nbw s LYS 40 Ca 0.81 2.01 0.00 0.00 -1.36 0.00 0.00 55.97 57.43 1nbw s LYS 40 Cb -0.75 -2.72 0.00 0.00 -1.68 0.00 0.00 37.83 32.68 1nbw s LYS 40 CO 0.41 -0.41 0.00 0.41 -0.76 0.00 0.00 175.35 175.00 1nbw n GLY 41 N 0.67 2.82 4.00 -3.33 0.00 -1.26 -4.97 105.19 103.11 1nbw n GLY 41 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.69 2.14 0.52 2.61 -4.23 -1.18 -4.68 115.64 108.14 1nbw s THR 42 Ca 0.00 -0.64 0.28 0.00 -1.18 0.00 0.00 61.69 60.16 1nbw s THR 42 Cb 0.00 -2.50 0.33 0.00 1.34 0.00 0.00 72.50 71.66 1nbw s THR 42 CO 0.00 0.00 2.18 -0.09 -0.54 0.00 0.00 174.62 176.17 1nbw h ARG 43 N -0.45 0.00 0.00 3.99 2.43 -1.97 -2.70 114.38 115.68 1nbw h ARG 43 Ca -0.36 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 58.77 1nbw h ARG 43 Cb 1.27 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.81 1nbw h ARG 43 CO 0.40 0.05 -0.20 -0.44 -1.51 0.00 0.00 179.97 178.27 1nbw h ASP 44 N 0.00 0.00 -0.09 -3.80 5.19 -1.86 -2.40 116.42 113.46 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 0.13 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.64 1nbw h ASP 44 CO 0.01 0.20 0.00 -0.46 -3.12 0.00 0.00 179.24 175.86 1nbw n ASN 45 N -4.25 0.99 0.14 6.45 2.04 -1.02 -2.82 115.26 116.79 1nbw n ASN 45 Ca -0.02 -2.05 0.08 0.00 -0.44 0.00 0.00 54.58 52.15 1nbw n ASN 45 Cb 0.26 -0.25 0.05 0.00 -2.53 0.00 0.00 39.78 37.31 1nbw n ASN 45 CO 0.00 0.00 0.00 0.40 -0.44 0.00 0.00 177.26 177.22 1nbw h ILE 46 N 0.57 0.24 0.63 1.53 2.04 -1.63 -3.10 117.51 117.80 1nbw h ILE 46 Ca 0.00 -1.38 -0.03 0.00 1.00 0.00 0.00 64.86 64.45 1nbw h ILE 46 Cb 0.37 1.94 0.01 0.00 -0.74 0.00 0.00 36.82 38.39 1nbw h ILE 46 CO 0.03 0.14 -0.30 0.00 0.00 0.00 0.00 178.15 178.01 1nbw h ALA 47 N 1.82 -0.85 -0.46 1.87 0.00 -1.73 -2.10 119.26 117.81 1nbw h ALA 47 Ca -0.02 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.75 1nbw h ALA 47 Cb 1.16 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 19.22 1nbw h ALA 47 CO 0.02 -0.86 0.13 0.78 0.00 0.00 0.00 179.25 179.32 1nbw h GLY 48 N -1.09 0.58 -0.07 0.00 0.00 -1.78 -1.15 103.07 99.56 1nbw h GLY 48 Ca -0.09 -0.05 0.20 0.00 0.00 0.00 0.00 47.33 47.39 1nbw h GLY 48 CO 0.14 -0.02 0.42 -0.84 0.00 0.00 0.00 176.54 176.24 1nbw h THR 49 N 0.28 0.55 -0.02 4.70 2.02 -1.49 0.53 112.91 119.48 1nbw h THR 49 Ca 0.22 -0.16 -0.23 0.00 0.77 0.00 0.00 66.41 67.01 1nbw h THR 49 Cb 0.26 0.04 0.01 0.00 -1.74 0.00 0.00 68.15 66.71 1nbw h THR 49 CO -0.26 0.09 -0.92 -0.07 0.37 0.00 0.00 175.52 174.72 1nbw h LEU 50 N 0.48 0.62 -0.08 2.58 3.38 -0.58 -2.08 115.31 119.63 1nbw h LEU 50 Ca 0.54 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1nbw h LEU 50 Cb 0.95 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1nbw h LEU 50 CO -0.48 1.27 0.04 0.00 0.09 0.00 0.00 178.44 179.36 1nbw h ALA 51 N 0.70 0.11 -0.77 1.53 0.00 0.15 -0.06 119.26 120.92 1nbw h ALA 51 Ca -0.08 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.82 1nbw h ALA 51 Cb 1.55 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.24 1nbw h ALA 51 CO 0.16 -0.32 0.45 0.00 0.00 0.00 0.00 179.25 179.54 1nbw h ALA 52 N 0.90 1.06 -0.08 0.00 0.00 -0.05 0.29 119.26 121.38 1nbw h ALA 52 Ca 0.03 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 1nbw h ALA 52 Cb 0.14 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1nbw h ALA 52 CO -0.00 0.13 -0.58 1.25 0.00 0.00 0.00 179.25 180.04 1nbw h LEU 53 N 0.80 0.30 -0.14 0.00 5.85 -1.09 -2.18 115.31 118.85 1nbw h LEU 53 Ca 0.35 -0.17 -0.11 0.00 0.84 0.00 0.00 57.88 58.79 1nbw h LEU 53 Cb 0.24 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1nbw h LEU 53 CO -0.20 0.81 -0.35 -0.33 -0.34 0.00 0.00 178.44 178.03 1nbw h GLU 54 N 0.20 0.49 -0.75 1.25 4.39 -0.16 -1.09 114.58 118.91 1nbw h GLU 54 Ca -0.00 -0.34 0.15 0.00 0.34 0.00 0.00 59.36 59.51 1nbw h GLU 54 Cb 1.08 0.05 -0.10 0.00 -0.10 0.00 0.00 28.75 29.68 1nbw h GLU 54 CO 0.09 0.95 0.26 0.37 -1.16 0.00 0.00 179.01 179.52 1nbw h GLN 55 N 0.10 0.36 -0.31 2.33 4.15 -0.36 0.36 115.11 121.74 1nbw h GLN 55 Ca -0.00 -0.02 -0.12 0.00 0.77 0.00 0.00 58.65 59.27 1nbw h GLN 55 Cb 0.96 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.56 1nbw h GLN 55 CO 0.08 0.24 -0.31 0.00 -1.93 0.00 0.00 178.83 176.91 1nbw h ALA 56 N 1.57 0.88 -0.13 3.38 0.00 -1.29 -3.08 119.26 120.60 1nbw h ALA 56 Ca 0.42 -0.40 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 1nbw h ALA 56 Cb 0.67 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1nbw h ALA 56 CO -0.45 0.63 -0.56 -0.07 0.00 0.00 0.00 179.25 178.81 1nbw h LEU 57 N 0.56 0.43 -1.37 0.00 3.38 0.60 -3.11 115.31 115.80 1nbw h LEU 57 Ca 0.07 -0.23 0.22 0.00 0.09 0.00 0.00 57.88 58.02 1nbw h LEU 57 Cb 0.81 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 41.35 1nbw h LEU 57 CO 0.07 0.90 0.63 0.00 0.09 0.00 0.00 178.44 180.12 1nbw h ALA 58 N 1.11 2.12 0.00 1.53 0.00 -0.34 0.59 119.26 124.26 1nbw h ALA 58 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1nbw h ALA 58 Cb 1.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1nbw h ALA 58 CO 0.09 -0.46 0.00 1.63 0.00 0.00 0.00 179.25 180.52 1nbw n LYS 59 N -4.59 0.29 -4.41 0.00 5.02 -1.18 -4.78 118.16 108.51 1nbw n LYS 59 Ca 0.22 0.11 -0.20 0.00 -2.02 0.00 0.00 58.31 56.42 1nbw n LYS 59 Cb 0.73 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 34.14 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 -2.48 1.06 -1.89 -0.18 -4.23 0.21 -5.03 115.64 103.10 1nbw s THR 60 Ca 0.18 -2.01 0.02 0.00 -1.18 0.00 0.00 61.69 58.70 1nbw s THR 60 Cb 0.11 -2.72 0.06 0.00 1.34 0.00 0.00 72.50 71.29 1nbw s THR 60 CO 0.25 -0.03 1.00 -0.81 -0.54 0.00 0.00 174.62 174.48 1nbw n PRO 61 N -0.62 1.16 -3.96 3.99 -0.04 -1.26 -4.85 135.00 129.42 1nbw n PRO 61 Ca -0.02 -0.23 -0.23 0.00 -0.04 0.00 0.00 63.50 62.99 1nbw n PRO 61 Cb 0.66 -1.10 -0.05 0.00 -0.04 0.00 0.00 33.50 32.97 1nbw n PRO 61 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1nbw s TRP 62 N -1.84 2.72 0.38 0.54 0.52 -1.26 -5.15 118.94 114.85 1nbw s TRP 62 Ca 0.04 -0.43 0.04 0.00 0.02 0.00 0.00 56.10 55.77 1nbw s TRP 62 Cb 0.02 -1.82 -0.04 0.00 -1.15 0.00 0.00 33.47 30.48 1nbw s TRP 62 CO 0.03 0.20 0.09 -1.54 0.02 0.00 0.00 176.95 175.75 1nbw s SER 63 N -3.93 2.68 0.15 2.95 1.04 -1.26 -4.69 113.70 110.63 1nbw s SER 63 Ca 0.41 -1.55 -0.30 0.00 0.48 0.00 0.00 55.95 54.99 1nbw s SER 63 Cb -0.02 0.26 -0.05 0.00 0.10 0.00 0.00 66.02 66.31 1nbw s SER 63 CO 0.24 -0.79 1.56 -0.03 0.98 0.00 0.00 173.24 175.20 1nbw h MET 64 N 1.90 -0.29 0.00 4.02 4.05 -1.97 0.23 114.93 122.86 1nbw h MET 64 Ca -0.38 0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.06 1nbw h MET 64 Cb 1.26 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 32.13 1nbw h MET 64 CO 0.63 -0.20 0.31 -1.13 0.23 0.00 0.00 176.91 176.76 1nbw n SER 65 N -5.38 0.21 0.04 1.39 3.41 -1.26 0.23 113.62 112.26 1nbw n SER 65 Ca -0.01 0.44 0.12 0.00 -0.26 0.00 0.00 58.87 59.16 1nbw n SER 65 Cb 0.34 -0.39 0.21 0.00 -0.26 0.00 0.00 64.21 64.11 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 -1.78 0.60 -4.73 4.04 9.92 0.81 -4.88 116.55 120.53 1nbw n ASP 66 Ca -0.01 0.02 -0.42 0.00 -0.53 0.00 0.00 54.79 53.85 1nbw n ASP 66 Cb 0.32 0.18 -0.03 0.00 -0.64 0.00 0.00 41.12 40.95 1nbw n ASP 66 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1nbw s VAL 67 N -3.11 2.37 -0.19 2.53 1.01 0.13 -4.88 120.40 118.27 1nbw s VAL 67 Ca 0.08 0.27 -0.04 0.00 0.00 0.00 0.00 61.98 62.29 1nbw s VAL 67 Cb 0.15 -3.18 -0.21 0.00 0.00 0.00 0.00 36.38 33.14 1nbw s VAL 67 CO 0.71 0.03 0.08 -0.24 0.00 0.00 0.00 175.10 175.68 1nbw n SER 68 N 3.57 2.05 -3.73 3.32 2.88 -1.00 -4.91 113.62 115.80 1nbw n SER 68 Ca 0.13 0.09 -0.14 0.00 -1.33 0.00 0.00 58.87 57.62 1nbw n SER 68 Cb 0.37 -0.69 -0.09 0.00 -0.75 0.00 0.00 64.21 63.06 1nbw n SER 68 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1nbw s ARG 69 N -2.53 0.61 -0.06 -1.46 0.52 -1.21 -4.15 118.95 110.67 1nbw s ARG 69 Ca -0.29 0.18 0.05 0.00 -0.52 0.00 0.00 55.73 55.15 1nbw s ARG 69 Cb 0.08 0.28 -0.01 0.00 0.52 0.00 0.00 34.95 35.82 1nbw s ARG 69 CO 0.68 -0.14 -0.21 0.42 0.02 0.00 0.00 175.30 176.07 1nbw s ILE 70 N -0.63 1.78 -0.31 1.52 1.01 -0.10 -1.44 121.20 123.03 1nbw s ILE 70 Ca -0.07 -0.91 -0.05 0.00 0.00 0.00 0.00 60.65 59.62 1nbw s ILE 70 Cb -0.04 -1.52 0.04 0.00 0.01 0.00 0.00 42.46 40.95 1nbw s ILE 70 CO 0.03 0.50 0.05 -0.31 0.00 0.00 0.00 174.94 175.22 1nbw s TYR 71 N -0.02 3.23 -0.00 3.97 1.51 -0.02 -0.11 117.35 125.91 1nbw s TYR 71 Ca -0.05 -1.53 -0.01 0.00 -1.01 0.00 0.00 57.07 54.47 1nbw s TYR 71 Cb -0.13 -2.20 -0.04 0.00 -0.11 0.00 0.00 41.96 39.48 1nbw s TYR 71 CO 0.03 -0.74 0.12 -1.17 -1.11 0.00 0.00 175.55 172.69 1nbw s LEU 72 N 1.36 4.08 -0.05 -1.29 2.96 -0.77 -0.42 118.68 124.56 1nbw s LEU 72 Ca -0.02 0.22 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 1nbw s LEU 72 Cb -0.19 -2.41 0.02 0.00 0.50 0.00 0.00 46.19 44.11 1nbw s LEU 72 CO 0.01 0.27 -0.03 0.21 -1.32 0.00 0.00 176.35 175.49 1nbw s ASN 73 N -1.83 1.01 -0.32 3.68 2.47 -0.38 0.32 114.94 119.89 1nbw s ASN 73 Ca 0.25 -0.11 0.03 0.00 0.42 0.00 0.00 52.86 53.44 1nbw s ASN 73 Cb -0.12 -0.42 0.08 0.00 -1.45 0.00 0.00 41.25 39.34 1nbw s ASN 73 CO 0.16 -0.09 0.01 -1.61 -3.72 0.00 0.00 177.10 171.85 1nbw s GLU 74 N 1.14 1.85 0.41 0.43 2.02 -1.26 -1.07 118.70 122.22 1nbw s GLU 74 Ca -0.08 -1.66 -0.26 0.00 0.02 0.00 0.00 54.97 53.00 1nbw s GLU 74 Cb -0.14 -3.14 -0.10 0.00 0.10 0.00 0.00 34.13 30.85 1nbw s GLU 74 CO -0.01 -0.81 1.35 0.00 0.02 0.00 0.00 175.26 175.81 1nbw n ALA 75 N 4.37 1.65 -2.01 5.21 0.00 -1.03 -4.86 120.51 123.85 1nbw n ALA 75 Ca -0.04 0.28 -0.42 0.00 0.00 0.00 0.00 53.44 53.27 1nbw n ALA 75 Cb 0.42 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.52 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 -1.17 3.71 0.34 0.00 0.00 -1.26 -4.84 121.76 118.54 1nbw s ALA 76 Ca 0.59 1.29 -0.29 0.00 0.00 0.00 0.00 51.96 53.55 1nbw s ALA 76 Cb -0.49 -3.59 -0.11 0.00 0.00 0.00 0.00 23.12 18.92 1nbw s ALA 76 CO 0.59 -0.72 1.55 -2.30 0.00 0.00 0.00 175.76 174.88 1nbw n PRO 77 N 3.87 2.73 -4.19 0.00 -0.02 -1.26 -4.78 135.00 131.35 1nbw n PRO 77 Ca 0.13 0.96 -0.28 0.00 -2.02 0.00 0.00 63.50 62.28 1nbw n PRO 77 Cb 0.40 -2.73 -0.17 0.00 -0.02 0.00 0.00 33.50 30.99 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 -0.63 1.40 -0.14 -1.45 1.01 -1.26 -0.56 120.40 118.76 1nbw s VAL 78 Ca 0.58 -0.55 -0.02 0.00 0.00 0.00 0.00 61.98 61.98 1nbw s VAL 78 Cb -0.48 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 1nbw s VAL 78 CO 0.57 0.43 -0.07 -0.63 0.00 0.00 0.00 175.10 175.40 1nbw s ILE 79 N 1.30 3.63 0.21 2.22 1.01 0.42 -4.97 121.20 125.02 1nbw s ILE 79 Ca -0.00 -0.46 0.05 0.00 0.00 0.00 0.00 60.65 60.24 1nbw s ILE 79 Cb -0.14 -2.57 -0.05 0.00 0.01 0.00 0.00 42.46 39.72 1nbw s ILE 79 CO -0.06 0.51 -0.07 -0.83 0.00 0.00 0.00 174.94 174.49 1nbw s GLY 80 N 0.32 1.46 0.26 6.18 0.00 -1.26 -0.49 107.32 113.79 1nbw s GLY 80 Ca -0.06 -1.71 -0.18 0.00 0.00 0.00 0.00 44.72 42.78 1nbw s GLY 80 CO 0.04 -1.70 0.62 -0.35 0.00 0.00 0.00 173.10 171.70 1nbw s ASP 81 N -3.30 -0.20 0.08 1.64 -1.08 -0.88 -5.00 116.67 107.93 1nbw s ASP 81 Ca 0.25 -0.71 0.00 0.00 -0.52 0.00 0.00 52.55 51.56 1nbw s ASP 81 Cb 0.03 0.66 -0.04 0.00 -1.46 0.00 0.00 42.92 42.12 1nbw s ASP 81 CO 0.07 -1.25 -0.03 0.68 0.52 0.00 0.00 175.17 175.16 1nbw s VAL 82 N -3.95 0.41 0.13 1.11 -7.23 -1.26 -1.74 120.40 107.86 1nbw s VAL 82 Ca 0.15 -1.88 -0.14 0.00 -1.81 0.00 0.00 61.98 58.30 1nbw s VAL 82 Cb -0.04 -1.67 0.02 0.00 0.56 0.00 0.00 36.38 35.26 1nbw s VAL 82 CO 0.07 -0.87 0.36 0.00 -0.31 0.00 0.00 175.10 174.35 1nbw s ALA 83 N -3.81 -0.73 -0.04 1.32 0.00 0.46 -4.92 121.76 114.04 1nbw s ALA 83 Ca 0.11 -0.24 -0.00 0.00 0.00 0.00 0.00 51.96 51.83 1nbw s ALA 83 Cb 0.07 0.68 0.03 0.00 0.00 0.00 0.00 23.12 23.90 1nbw s ALA 83 CO -0.06 -0.64 0.01 1.41 0.00 0.00 0.00 175.76 176.48 1nbw s MET 84 N -3.83 0.33 -0.10 0.00 0.00 -1.26 0.02 119.30 114.46 1nbw s MET 84 Ca 0.05 0.11 0.03 0.00 0.00 0.00 0.00 55.69 55.89 1nbw s MET 84 Cb 0.02 -0.59 -0.00 0.00 0.00 0.00 0.00 34.83 34.26 1nbw s MET 84 CO -0.10 -0.19 -0.22 -1.21 0.00 0.00 0.00 175.02 173.30 1nbw s GLU 85 N 1.33 3.09 -0.07 4.11 0.41 -0.65 -4.85 118.70 122.08 1nbw s GLU 85 Ca -0.05 -0.85 -0.22 0.00 -0.41 0.00 0.00 54.97 53.44 1nbw s GLU 85 Cb -0.13 -2.35 -0.04 0.00 -1.78 0.00 0.00 34.13 29.83 1nbw s GLU 85 CO -0.02 0.19 0.63 0.99 -0.49 0.00 0.00 175.26 176.55 1nbw s THR 86 N 0.33 5.07 -0.49 3.63 2.01 -1.26 -0.91 115.64 124.02 1nbw s THR 86 Ca -0.18 1.29 0.06 0.00 0.31 0.00 0.00 61.69 63.17 1nbw s THR 86 Cb -0.18 -3.97 0.16 0.00 0.01 0.00 0.00 72.50 68.53 1nbw s THR 86 CO 0.08 0.29 1.13 2.30 -0.69 0.00 0.00 174.62 177.74 1nbw n ILE 87 N 3.62 1.00 -3.80 1.82 -5.35 -0.75 -4.75 119.36 111.15 1nbw n ILE 87 Ca -0.03 -1.00 -0.10 0.00 -0.27 0.00 0.00 62.75 61.35 1nbw n ILE 87 Cb 0.51 0.50 -0.06 0.00 -1.74 0.00 0.00 39.64 38.85 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 -1.00 0.08 0.06 7.28 -4.23 -1.25 -1.78 115.64 114.80 1nbw s THR 88 Ca 0.12 -1.00 -0.10 0.00 -1.18 0.00 0.00 61.69 59.54 1nbw s THR 88 Cb 0.06 -1.47 0.00 0.00 1.34 0.00 0.00 72.50 72.44 1nbw s THR 88 CO 0.08 -0.37 0.20 -1.83 -0.54 0.00 0.00 174.62 172.17 1nbw s GLU 89 N -3.88 0.76 -0.09 3.99 -1.05 -0.71 -4.71 118.70 113.01 1nbw s GLU 89 Ca 0.08 -0.73 0.03 0.00 -0.15 0.00 0.00 54.97 54.20 1nbw s GLU 89 Cb 0.03 0.31 0.01 0.00 -0.44 0.00 0.00 34.13 34.03 1nbw s GLU 89 CO -0.07 -0.23 -0.19 0.99 0.95 0.00 0.00 175.26 176.71 1nbw s THR 90 N -3.02 1.69 -0.05 1.83 2.01 -1.26 -1.54 115.64 115.30 1nbw s THR 90 Ca -0.02 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.21 1nbw s THR 90 Cb 0.01 -1.48 0.01 0.00 0.01 0.00 0.00 72.50 71.04 1nbw s THR 90 CO -0.06 0.48 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.59 1nbw s ILE 91 N 0.49 1.08 -0.36 1.82 1.01 0.60 -3.32 121.20 122.52 1nbw s ILE 91 Ca -0.17 -0.48 -0.13 0.00 0.00 0.00 0.00 60.65 59.87 1nbw s ILE 91 Cb -0.17 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.32 1nbw s ILE 91 CO 0.07 0.34 0.25 -0.63 0.00 0.00 0.00 174.94 174.96 1nbw s ILE 92 N 0.47 5.13 0.06 2.92 1.01 -0.33 -1.39 121.20 129.07 1nbw s ILE 92 Ca -0.10 -0.45 -0.10 0.00 0.00 0.00 0.00 60.65 59.99 1nbw s ILE 92 Cb -0.14 -3.73 -0.06 0.00 0.01 0.00 0.00 42.46 38.55 1nbw s ILE 92 CO 0.03 -0.13 0.39 0.42 0.00 0.00 0.00 174.94 175.65 1nbw s THR 93 N 1.68 5.10 -1.43 2.92 -4.23 0.02 -4.27 115.64 115.43 1nbw s THR 93 Ca 0.05 0.49 -0.04 0.00 -1.18 0.00 0.00 61.69 61.01 1nbw s THR 93 Cb -0.18 -3.65 0.00 0.00 1.34 0.00 0.00 72.50 70.02 1nbw s THR 93 CO 0.09 0.34 0.29 -0.62 -0.54 0.00 0.00 174.62 174.19 1nbw n GLU 94 N 1.06 -2.01 -4.08 3.99 -0.58 -1.26 -2.67 120.64 115.09 1nbw n GLU 94 Ca -0.09 0.26 -0.31 0.00 -0.42 0.00 0.00 57.16 56.60 1nbw n GLU 94 Cb 0.52 -3.97 -0.08 0.00 -0.57 0.00 0.00 31.44 27.34 1nbw n GLU 94 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1nbw n SER 95 N -2.87 -0.21 -0.00 1.62 7.64 -1.26 -4.74 113.62 113.80 1nbw n SER 95 Ca -0.29 -1.09 0.14 0.00 1.01 0.00 0.00 58.87 58.65 1nbw n SER 95 Cb 0.68 -1.37 0.67 0.00 -1.01 0.00 0.00 64.21 63.18 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 -3.85 0.00 -3.87 0.44 5.66 -1.09 -4.76 114.28 106.81 1nbw n THR 96 Ca -0.12 -0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.81 1nbw n THR 96 Cb 0.51 -0.49 -0.03 0.00 -1.55 0.00 0.00 70.33 68.76 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 -2.84 1.70 -0.15 1.09 0.23 -1.26 -0.80 119.30 117.26 1nbw s MET 97 Ca 0.19 -1.03 -0.04 0.00 -1.03 0.00 0.00 55.69 53.79 1nbw s MET 97 Cb 0.19 0.57 0.07 0.00 -1.53 0.00 0.00 34.83 34.13 1nbw s MET 97 CO 0.51 -0.76 0.15 0.42 -2.03 0.00 0.00 175.02 173.30 1nbw s ILE 98 N -3.93 -0.21 -0.25 3.16 1.01 -0.62 -4.72 121.20 115.63 1nbw s ILE 98 Ca 0.13 0.03 0.20 0.00 0.00 0.00 0.00 60.65 61.01 1nbw s ILE 98 Cb -0.04 -0.51 0.50 0.00 0.01 0.00 0.00 42.46 42.41 1nbw s ILE 98 CO 0.06 -0.11 1.13 0.61 0.00 0.00 0.00 174.94 176.63 1nbw n GLY 99 N 5.31 2.66 0.01 6.18 0.00 -1.26 -2.12 105.19 115.96 1nbw n GLY 99 Ca -0.06 -1.36 0.11 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.57 0.11 -3.77 1.61 1.44 -1.26 -4.95 115.22 107.83 1nbw n HIS 100 Ca 0.14 0.03 -0.33 0.00 -2.01 0.00 0.00 57.72 55.55 1nbw n HIS 100 Cb 0.85 -0.56 0.03 0.00 0.12 0.00 0.00 29.99 30.44 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 -1.59 -4.59 -4.52 4.39 5.15 -1.26 -4.90 115.26 107.94 1nbw n ASN 101 Ca 0.05 -1.06 -0.37 0.00 -0.60 0.00 0.00 54.58 52.61 1nbw n ASN 101 Cb 0.28 -3.09 0.06 0.00 -0.53 0.00 0.00 39.78 36.50 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 -4.34 0.51 0.11 1.20 -0.04 -1.26 -4.91 135.00 126.27 1nbw n PRO 102 Ca -0.12 0.21 -0.02 0.00 -0.04 0.00 0.00 63.50 63.53 1nbw n PRO 102 Cb 0.60 -1.94 0.05 0.00 -0.04 0.00 0.00 33.50 32.17 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 -0.02 0.00 -2.14 0.54 4.20 -1.97 -3.38 115.11 112.33 1nbw h GLN 103 Ca -0.46 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 57.67 1nbw h GLN 103 Cb 1.36 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 28.73 1nbw h GLN 103 CO 0.46 0.72 -0.80 0.25 -0.67 0.00 0.00 178.83 178.79 1nbw n THR 104 N -3.48 1.43 -1.98 -0.54 -2.24 -1.26 -5.09 114.28 101.12 1nbw n THR 104 Ca -0.00 -4.91 -0.32 0.00 -2.27 0.00 0.00 64.05 56.55 1nbw n THR 104 Cb 0.75 -1.76 0.02 0.00 -2.10 0.00 0.00 70.33 67.24 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 3.25 0.28 -0.78 0.04 -1.26 -4.23 135.00 130.00 1nbw s PRO 105 Ca 0.40 1.18 -0.02 0.00 0.04 0.00 0.00 61.00 62.60 1nbw s PRO 105 Cb 0.20 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 1nbw s PRO 105 CO -0.07 -0.86 0.50 0.20 0.04 0.00 0.00 177.00 176.81 1nbw s GLY 106 N -2.90 1.68 0.00 0.56 0.00 -0.56 -4.61 107.32 101.49 1nbw s GLY 106 Ca 0.63 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.60 1nbw s GLY 106 CO 0.39 -0.67 0.00 0.61 0.00 0.00 0.00 173.10 173.43 1nbw n GLY 107 N -1.10 0.97 3.72 0.20 0.00 -1.25 -1.10 105.19 106.63 1nbw n GLY 107 Ca -0.04 -0.66 -0.04 0.00 0.00 0.00 0.00 46.02 45.29 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 -4.80 120.40 116.07 1nbw s VAL 108 Ca 0.00 -0.57 0.00 0.00 -2.93 0.00 0.00 61.98 58.48 1nbw s VAL 108 Cb 0.00 -1.85 0.00 0.00 -1.53 0.00 0.00 36.38 33.00 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 -0.44 -0.92 3.18 6.54 0.00 -0.50 -2.79 105.19 110.26 1nbw n GLY 109 Ca -0.06 -2.23 -0.19 0.00 0.00 0.00 0.00 46.02 43.54 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 -0.48 1.18 -0.13 1.61 1.01 -1.26 -1.23 120.40 121.10 1nbw s VAL 110 Ca 0.00 -1.24 -0.11 0.00 0.00 0.00 0.00 61.98 60.63 1nbw s VAL 110 Cb 0.00 -1.11 0.04 0.00 0.00 0.00 0.00 36.38 35.31 1nbw s VAL 110 CO 0.00 -0.14 0.34 -0.83 0.00 0.00 0.00 175.10 174.48 1nbw s GLY 111 N -1.58 -0.26 -0.07 4.51 0.00 -0.12 -4.95 107.32 104.86 1nbw s GLY 111 Ca -0.00 1.02 0.03 0.00 0.00 0.00 0.00 44.72 45.77 1nbw s GLY 111 CO 0.02 0.93 -0.16 0.14 0.00 0.00 0.00 173.10 174.03 1nbw s VAL 112 N 0.33 1.40 0.00 1.40 1.01 -1.26 -0.46 120.40 122.82 1nbw s VAL 112 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1nbw s VAL 112 Cb -0.03 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.11 1nbw s VAL 112 CO -0.01 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.11 1nbw n GLY 113 N 3.66 1.88 3.37 4.51 0.00 -0.66 -4.75 105.19 113.20 1nbw n GLY 113 Ca -0.21 -0.43 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.41 2.49 0.32 2.61 2.01 -0.83 -0.53 115.64 120.29 1nbw s THR 114 Ca 0.00 -0.94 -0.28 0.00 0.31 0.00 0.00 61.69 60.79 1nbw s THR 114 Cb 0.00 -1.92 -0.09 0.00 0.01 0.00 0.00 72.50 70.50 1nbw s THR 114 CO 0.00 0.58 1.09 0.42 -0.69 0.00 0.00 174.62 176.02 1nbw s THR 115 N -0.57 3.53 -0.21 -0.82 -4.23 -0.01 -0.73 115.64 112.60 1nbw s THR 115 Ca 0.08 1.41 -0.18 0.00 -1.18 0.00 0.00 61.69 61.83 1nbw s THR 115 Cb -0.11 -3.85 0.06 0.00 1.34 0.00 0.00 72.50 69.94 1nbw s THR 115 CO 0.00 0.24 0.54 -0.51 -0.54 0.00 0.00 174.62 174.35 1nbw s ILE 116 N -1.32 -0.00 0.37 2.99 2.07 -0.60 -0.09 121.20 124.61 1nbw s ILE 116 Ca 0.49 0.01 -0.28 0.00 -1.41 0.00 0.00 60.65 59.46 1nbw s ILE 116 Cb -0.29 -0.76 -0.10 0.00 0.13 0.00 0.00 42.46 41.43 1nbw s ILE 116 CO 0.37 0.00 1.40 0.00 -1.91 0.00 0.00 174.94 174.81 1nbw s ALA 117 N 0.53 3.50 0.31 1.50 0.00 -1.26 -1.70 121.76 124.64 1nbw s ALA 117 Ca -0.02 1.43 0.06 0.00 0.00 0.00 0.00 51.96 53.43 1nbw s ALA 117 Cb -0.04 -3.55 0.73 0.00 0.00 0.00 0.00 23.12 20.25 1nbw s ALA 117 CO -0.03 -0.90 1.81 1.25 0.00 0.00 0.00 175.76 177.90 1nbw h LEU 118 N 3.08 0.78 -1.93 0.00 5.85 -1.59 -0.21 115.31 121.28 1nbw h LEU 118 Ca -0.50 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1nbw h LEU 118 Cb 1.24 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1nbw h LEU 118 CO 0.64 0.33 0.00 1.23 -0.34 0.00 0.00 178.44 180.30 1nbw h GLY 119 N 0.79 0.00 -1.22 3.75 0.00 -1.90 -2.66 103.07 101.83 1nbw h GLY 119 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1nbw h GLY 119 CO -0.31 0.00 -0.15 0.54 0.00 0.00 0.00 176.54 176.62 1nbw n ARG 120 N -2.80 1.58 0.03 4.80 1.74 -0.11 -4.48 116.66 117.43 1nbw n ARG 120 Ca -0.01 -1.31 0.03 0.00 -0.77 0.00 0.00 57.85 55.78 1nbw n ARG 120 Cb 0.15 -1.34 0.39 0.00 -1.02 0.00 0.00 32.46 30.64 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 2.98 0.41 -0.17 0.55 5.85 -1.30 -1.79 115.31 121.84 1nbw h LEU 121 Ca 0.00 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1nbw h LEU 121 Cb 0.71 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.63 1nbw h LEU 121 CO 0.00 0.40 0.00 0.00 -0.34 0.00 0.00 178.44 178.50 1nbw n ALA 122 N -2.48 2.06 0.77 1.25 0.00 -1.26 -3.02 120.51 117.83 1nbw n ALA 122 Ca 0.02 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1nbw n ALA 122 Cb 0.16 -1.42 0.28 0.00 0.00 0.00 0.00 19.45 18.46 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 -1.97 0.21 -1.66 0.00 -2.24 -0.68 -4.94 114.28 103.01 1nbw n THR 123 Ca 0.05 -0.15 -0.52 0.00 -2.27 0.00 0.00 64.05 61.16 1nbw n THR 123 Cb 0.32 -0.09 -0.06 0.00 -2.10 0.00 0.00 70.33 68.41 1nbw n THR 123 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1nbw n LEU 124 N -1.84 2.40 -4.77 3.22 4.77 -1.17 -4.93 117.00 114.69 1nbw n LEU 124 Ca 0.05 1.08 -0.39 0.00 -0.03 0.00 0.00 56.01 56.71 1nbw n LEU 124 Cb 0.39 -1.24 0.01 0.00 -2.33 0.00 0.00 43.42 40.24 1nbw n LEU 124 CO 0.34 -0.57 0.98 -2.84 -1.33 0.00 0.00 177.39 173.97 1nbw s PRO 125 N 2.07 3.79 0.58 3.23 0.02 -1.26 -4.87 135.00 138.55 1nbw s PRO 125 Ca 0.89 2.21 0.29 0.00 0.02 0.00 0.00 61.00 64.40 1nbw s PRO 125 Cb -0.90 -2.65 1.49 0.00 0.02 0.00 0.00 34.50 32.45 1nbw s PRO 125 CO 0.52 -0.66 1.92 0.00 -0.33 0.00 0.00 177.00 178.45 1nbw h ALA 126 N 2.41 2.22 0.00 -1.55 0.00 -2.00 0.36 119.26 120.69 1nbw h ALA 126 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1nbw h ALA 126 Cb 1.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1nbw h ALA 126 CO 0.61 -0.70 0.00 0.00 0.00 0.00 0.00 179.25 179.16 1nbw n ALA 127 N -2.40 1.88 0.40 0.00 0.00 -1.26 -2.96 120.51 116.17 1nbw n ALA 127 Ca 0.09 0.01 0.07 0.00 0.00 0.00 0.00 53.44 53.60 1nbw n ALA 127 Cb 0.65 -1.38 0.09 0.00 0.00 0.00 0.00 19.45 18.81 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 -1.99 1.42 -0.16 0.00 6.02 0.11 -4.68 117.38 118.09 1nbw n GLN 128 Ca 0.04 -1.55 -0.03 0.00 -0.01 0.00 0.00 57.00 55.44 1nbw n GLN 128 Cb 0.28 -1.29 0.03 0.00 1.02 0.00 0.00 30.24 30.28 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 2.74 -0.37 0.00 1.08 -1.99 -1.51 -2.72 116.97 114.19 1nbw h TYR 129 Ca 0.00 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.78 1nbw h TYR 129 Cb 0.64 0.24 0.00 0.00 2.00 0.00 0.00 36.73 39.61 1nbw h TYR 129 CO 0.07 -0.25 -0.13 0.00 -0.00 0.00 0.00 178.16 177.85 1nbw n ALA 130 N -2.92 2.59 -0.31 3.88 0.00 -1.26 0.06 120.51 122.56 1nbw n ALA 130 Ca 0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 53.44 53.31 1nbw n ALA 130 Cb 0.29 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.38 1nbw n ALA 130 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1nbw h GLU 131 N 0.00 -0.06 0.00 0.00 5.08 -1.80 -3.44 114.58 114.36 1nbw h GLU 131 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nbw h GLU 131 Cb 0.54 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1nbw h GLU 131 CO 0.00 -0.04 0.00 0.41 -1.00 0.00 0.00 179.01 178.38 1nbw n GLY 132 N -1.46 2.92 3.22 -3.84 0.00 -1.25 -4.94 105.19 99.84 1nbw n GLY 132 Ca 0.08 -0.88 -0.26 0.00 0.00 0.00 0.00 46.02 44.96 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 1.76 -0.36 1.61 0.52 0.07 -1.97 118.94 120.56 1nbw s TRP 133 Ca 0.00 -0.35 -0.01 0.00 0.02 0.00 0.00 56.10 55.76 1nbw s TRP 133 Cb 0.00 -1.10 0.09 0.00 -1.15 0.00 0.00 33.47 31.31 1nbw s TRP 133 CO 0.00 0.02 0.11 0.42 0.02 0.00 0.00 176.95 177.52 1nbw s ILE 134 N -0.60 2.97 -0.25 2.03 1.01 0.09 -0.51 121.20 125.93 1nbw s ILE 134 Ca 0.07 -1.94 -0.29 0.00 0.00 0.00 0.00 60.65 58.49 1nbw s ILE 134 Cb -0.08 -2.98 0.01 0.00 0.01 0.00 0.00 42.46 39.42 1nbw s ILE 134 CO 0.00 -0.51 1.04 -0.69 0.00 0.00 0.00 174.94 174.78 1nbw s VAL 135 N 1.12 4.65 -0.14 2.92 1.01 -0.79 -1.56 120.40 127.60 1nbw s VAL 135 Ca 0.05 1.95 -0.21 0.00 0.00 0.00 0.00 61.98 63.78 1nbw s VAL 135 Cb -0.21 -4.32 -0.03 0.00 0.00 0.00 0.00 36.38 31.81 1nbw s VAL 135 CO -0.04 -0.24 0.61 -0.76 0.00 0.00 0.00 175.10 174.68 1nbw s LEU 136 N 3.28 4.22 -0.19 3.92 1.43 -0.69 -1.08 118.68 129.56 1nbw s LEU 136 Ca 0.44 0.93 0.01 0.00 -1.03 0.00 0.00 54.13 54.47 1nbw s LEU 136 Cb -0.14 -2.90 0.04 0.00 0.03 0.00 0.00 46.19 43.22 1nbw s LEU 136 CO 0.08 -0.17 -0.09 -0.63 0.23 0.00 0.00 176.35 175.77 1nbw s ILE 137 N 1.31 1.52 0.00 -0.59 1.01 -0.07 -1.42 121.20 122.95 1nbw s ILE 137 Ca 0.31 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 60.03 1nbw s ILE 137 Cb -0.16 -1.62 0.00 0.00 0.01 0.00 0.00 42.46 40.69 1nbw s ILE 137 CO 0.12 0.16 0.00 -0.90 0.00 0.00 0.00 174.94 174.32 1nbw n ASP 138 N 4.73 0.00 -1.39 3.58 5.68 -1.26 -1.74 116.55 126.15 1nbw n ASP 138 Ca -0.14 -0.11 0.08 0.00 -0.50 0.00 0.00 54.79 54.13 1nbw n ASP 138 Cb 0.47 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.77 1nbw n ASP 138 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1nbw n ASP 139 N -0.32 4.63 0.09 -1.12 3.85 -1.26 -4.41 116.55 118.01 1nbw n ASP 139 Ca 0.00 -2.70 0.10 0.00 -0.71 0.00 0.00 54.79 51.49 1nbw n ASP 139 Cb 0.00 -0.57 -0.01 0.00 -1.35 0.00 0.00 41.12 39.19 1nbw n ASP 139 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1nbw n ALA 140 N 0.48 2.47 -2.87 2.12 0.00 -1.26 -4.87 120.51 116.58 1nbw n ALA 140 Ca 0.24 -0.27 -0.34 0.00 0.00 0.00 0.00 53.44 53.07 1nbw n ALA 140 Cb 0.93 -1.09 -0.11 0.00 0.00 0.00 0.00 19.45 19.19 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 -3.33 4.19 0.12 0.00 1.01 -1.26 -5.06 120.40 116.07 1nbw s VAL 141 Ca -0.01 -0.26 -0.35 0.00 0.00 0.00 0.00 61.98 61.37 1nbw s VAL 141 Cb 0.10 -2.84 -0.14 0.00 0.00 0.00 0.00 36.38 33.50 1nbw s VAL 141 CO 0.80 0.51 1.54 -0.67 0.00 0.00 0.00 175.10 177.27 1nbw n ASP 142 N 3.26 2.74 0.17 3.32 -0.08 -1.26 -4.78 116.55 119.91 1nbw n ASP 142 Ca -0.17 1.09 0.17 0.00 -1.51 0.00 0.00 54.79 54.36 1nbw n ASP 142 Cb 0.53 -1.36 0.78 0.00 2.34 0.00 0.00 41.12 43.40 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 5.79 0.00 0.00 -0.67 -5.15 -1.97 0.21 116.94 115.16 1nbw h PHE 143 Ca -0.46 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.27 1nbw h PHE 143 Cb 1.28 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.44 1nbw h PHE 143 CO 0.64 0.00 -0.20 -0.07 -2.00 0.00 0.00 178.31 176.68 1nbw h LEU 144 N 0.00 0.00 0.14 2.10 3.38 -1.99 -0.80 115.31 118.14 1nbw h LEU 144 Ca 0.11 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.77 1nbw h LEU 144 Cb 0.55 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 1nbw h LEU 144 CO -0.00 0.20 -1.53 0.44 0.09 0.00 0.00 178.44 177.63 1nbw h ASP 145 N 0.00 0.46 -0.34 -0.43 3.32 -0.97 -2.65 116.42 115.81 1nbw h ASP 145 Ca -0.00 -0.61 0.02 0.00 0.02 0.00 0.00 57.03 56.45 1nbw h ASP 145 Cb 0.84 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 1nbw h ASP 145 CO 0.03 1.51 0.19 0.00 -1.72 0.00 0.00 179.24 179.24 1nbw h ALA 146 N 0.42 0.43 -0.34 3.45 0.00 -1.02 0.37 119.26 122.57 1nbw h ALA 146 Ca -0.25 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.72 1nbw h ALA 146 Cb 2.04 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 19.69 1nbw h ALA 146 CO 0.18 -0.17 0.03 0.28 0.00 0.00 0.00 179.25 179.57 1nbw h VAL 147 N 0.39 0.79 0.30 0.00 2.07 -1.22 0.12 116.25 118.70 1nbw h VAL 147 Ca 0.14 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1nbw h VAL 147 Cb 0.02 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 1nbw h VAL 147 CO -0.07 0.02 -0.47 -0.25 0.02 0.00 0.00 177.57 176.82 1nbw h TRP 148 N 0.13 -1.31 -0.33 1.57 7.01 -0.83 0.71 115.95 122.90 1nbw h TRP 148 Ca 0.16 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.23 1nbw h TRP 148 Cb 0.21 0.53 -0.04 0.00 -2.10 0.00 0.00 29.16 27.76 1nbw h TRP 148 CO -0.21 -0.60 0.08 -1.49 -2.79 0.00 0.00 178.44 173.43 1nbw h TRP 149 N -0.83 0.13 -0.24 2.65 6.55 0.00 0.47 115.95 124.67 1nbw h TRP 149 Ca -0.02 0.02 -0.00 0.00 0.95 0.00 0.00 58.89 59.84 1nbw h TRP 149 Cb 0.77 -0.01 -0.01 0.00 -0.86 0.00 0.00 29.16 29.05 1nbw h TRP 149 CO -0.32 0.04 0.15 -0.07 -1.05 0.00 0.00 178.44 177.19 1nbw h LEU 150 N 0.20 0.28 -0.05 -4.49 3.38 -0.54 0.12 115.31 114.21 1nbw h LEU 150 Ca 0.15 -0.01 -0.23 0.00 0.09 0.00 0.00 57.88 57.89 1nbw h LEU 150 Cb 0.16 -0.07 0.02 0.00 0.09 0.00 0.00 40.66 40.85 1nbw h LEU 150 CO -0.19 0.22 -0.85 0.78 0.09 0.00 0.00 178.44 178.48 1nbw h ASN 151 N 0.33 0.83 -0.42 -0.43 2.35 0.28 -2.06 115.58 116.47 1nbw h ASN 151 Ca 0.09 -0.71 -0.12 0.00 -0.55 0.00 0.00 56.30 55.01 1nbw h ASN 151 Cb -0.02 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.09 1nbw h ASN 151 CO -0.02 1.42 -0.22 -0.08 -1.65 0.00 0.00 177.43 176.88 1nbw h GLU 152 N 0.32 0.89 -0.43 0.81 4.57 -0.43 -0.41 114.58 119.89 1nbw h GLU 152 Ca -0.09 -0.40 0.08 0.00 -1.18 0.00 0.00 59.36 57.77 1nbw h GLU 152 Cb 1.51 -0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 30.01 1nbw h GLU 152 CO 0.17 1.04 -0.00 0.00 -1.18 0.00 0.00 179.01 179.04 1nbw h ALA 153 N 0.82 0.40 0.00 2.92 0.00 -0.80 0.25 119.26 122.84 1nbw h ALA 153 Ca 0.09 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1nbw h ALA 153 Cb 0.79 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1nbw h ALA 153 CO 0.06 -0.39 -0.32 -0.07 0.00 0.00 0.00 179.25 178.53 1nbw h LEU 154 N 0.10 0.00 -0.22 0.00 3.38 -1.10 0.30 115.31 117.78 1nbw h LEU 154 Ca 0.21 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.97 1nbw h LEU 154 Cb 0.31 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1nbw h LEU 154 CO -0.36 0.32 -0.79 0.44 0.09 0.00 0.00 178.44 178.14 1nbw h ASP 155 N 0.00 0.80 0.87 -0.43 3.32 0.86 -3.03 116.42 118.81 1nbw h ASP 155 Ca -0.00 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.51 1nbw h ASP 155 Cb 0.59 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1nbw h ASP 155 CO 0.04 1.32 0.00 0.03 -1.72 0.00 0.00 179.24 178.92 1nbw h ARG 156 N 0.45 0.00 0.00 3.56 3.08 -0.34 -3.46 114.38 117.67 1nbw h ARG 156 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1nbw h ARG 156 Cb 1.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.46 1nbw h ARG 156 CO 0.15 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.46 1nbw n GLY 157 N -0.13 0.96 3.68 0.04 0.00 -0.98 -5.08 105.19 103.68 1nbw n GLY 157 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.00 3.54 -1.33 -0.61 1.01 0.06 -4.19 121.20 117.67 1nbw s ILE 158 Ca 0.00 0.89 -0.16 0.00 0.00 0.00 0.00 60.65 61.39 1nbw s ILE 158 Cb 0.00 -3.57 0.08 0.00 0.01 0.00 0.00 42.46 38.98 1nbw s ILE 158 CO 0.00 -0.02 1.84 -3.20 0.00 0.00 0.00 174.94 173.57 1nbw n ASN 159 N 5.75 4.70 -4.64 3.58 4.05 0.11 -4.01 115.26 124.80 1nbw n ASN 159 Ca 0.14 -2.92 -0.43 0.00 0.45 0.00 0.00 54.58 51.83 1nbw n ASN 159 Cb 0.43 -1.68 -0.02 0.00 1.23 0.00 0.00 39.78 39.73 1nbw n ASN 159 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1nbw s VAL 160 N 3.34 4.21 -0.68 3.44 1.01 -1.26 -0.75 120.40 129.70 1nbw s VAL 160 Ca 0.50 1.39 0.19 0.00 0.00 0.00 0.00 61.98 64.06 1nbw s VAL 160 Cb 0.06 -4.12 -0.23 0.00 0.00 0.00 0.00 36.38 32.09 1nbw s VAL 160 CO 0.02 -0.37 0.71 1.33 0.00 0.00 0.00 175.10 176.79 1nbw n VAL 161 N 5.94 0.00 -3.77 2.92 0.24 0.33 -4.88 118.33 119.11 1nbw n VAL 161 Ca 0.14 -0.15 -0.02 0.00 -2.04 0.00 0.00 64.34 62.28 1nbw n VAL 161 Cb 0.46 0.78 -0.00 0.00 -1.47 0.00 0.00 33.84 33.61 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 -2.90 -1.86 -0.03 2.33 0.00 -1.18 -4.42 121.76 113.70 1nbw s ALA 162 Ca 0.04 0.15 -0.13 0.00 0.00 0.00 0.00 51.96 52.02 1nbw s ALA 162 Cb 0.14 0.61 0.02 0.00 0.00 0.00 0.00 23.12 23.89 1nbw s ALA 162 CO 0.78 -1.06 0.28 0.00 0.00 0.00 0.00 175.76 175.76 1nbw s ALA 163 N -2.68 -0.71 -0.23 0.00 0.00 -1.14 -1.88 121.76 115.11 1nbw s ALA 163 Ca 0.16 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.51 1nbw s ALA 163 Cb 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 23.12 23.13 1nbw s ALA 163 CO 0.01 -0.23 -0.04 0.42 0.00 0.00 0.00 175.76 175.92 1nbw s ILE 164 N -0.99 1.41 0.12 0.00 1.01 -0.25 -1.41 121.20 121.09 1nbw s ILE 164 Ca -0.11 -1.15 0.02 0.00 0.00 0.00 0.00 60.65 59.41 1nbw s ILE 164 Cb -0.05 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.68 1nbw s ILE 164 CO 0.03 -0.12 0.25 -0.76 0.00 0.00 0.00 174.94 174.34 1nbw s LEU 165 N 1.45 4.31 -0.08 2.97 1.02 -0.03 -0.89 118.68 127.43 1nbw s LEU 165 Ca -0.05 0.19 -0.01 0.00 0.02 0.00 0.00 54.13 54.28 1nbw s LEU 165 Cb -0.19 -2.90 -0.26 0.00 0.02 0.00 0.00 46.19 42.87 1nbw s LEU 165 CO -0.06 0.09 0.52 0.50 0.02 0.00 0.00 176.35 177.42 1nbw h LYS 166 N 2.46 0.19 -6.84 1.70 3.64 -1.53 -0.03 116.57 116.14 1nbw h LYS 166 Ca -0.47 -0.32 -0.44 0.00 -1.27 0.00 0.00 60.65 58.15 1nbw h LYS 166 Cb 1.18 0.12 0.05 0.00 -0.41 0.00 0.00 32.23 33.17 1nbw h LYS 166 CO 0.71 0.99 -0.03 0.15 -2.27 0.00 0.00 179.45 178.99 1nbw s LYS 167 N -2.58 2.50 -0.99 1.90 1.02 -1.26 -3.03 119.74 117.30 1nbw s LYS 167 Ca -0.15 -0.81 -0.07 0.00 0.02 0.00 0.00 55.97 54.95 1nbw s LYS 167 Cb 0.07 -2.48 -0.09 0.00 -0.52 0.00 0.00 37.83 34.81 1nbw s LYS 167 CO 0.80 -0.75 3.03 -3.47 -0.92 0.00 0.00 175.35 174.04 1nbw n ASP 168 N -2.36 7.42 -0.20 2.83 2.03 -1.26 -2.75 116.55 122.26 1nbw n ASP 168 Ca 0.08 -2.72 0.07 0.00 0.52 0.00 0.00 54.79 52.75 1nbw n ASP 168 Cb 0.60 -1.45 0.12 0.00 -0.72 0.00 0.00 41.12 39.67 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 2.65 2.52 -0.11 1.67 8.00 -1.26 -4.82 116.55 125.19 1nbw n ASP 169 Ca 0.63 -2.75 -0.05 0.00 0.71 0.00 0.00 54.79 53.32 1nbw n ASP 169 Cb 0.46 -0.33 0.02 0.00 -0.02 0.00 0.00 41.12 41.25 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 0.37 0.39 1.19 0.44 0.00 -1.81 -0.52 103.07 103.13 1nbw h GLY 170 Ca 0.00 0.03 -0.15 0.00 0.00 0.00 0.00 47.33 47.21 1nbw h GLY 170 CO 0.03 -0.08 -0.34 -2.08 0.00 0.00 0.00 176.54 174.07 1nbw h VAL 171 N 0.12 1.27 -0.37 4.60 2.07 -1.82 -1.98 116.25 120.15 1nbw h VAL 171 Ca 0.19 -1.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 1nbw h VAL 171 Cb 0.25 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1nbw h VAL 171 CO -0.30 0.50 0.18 -0.07 0.02 0.00 0.00 177.57 177.91 1nbw h LEU 172 N 0.74 0.48 -0.04 2.57 3.38 -1.83 -1.17 115.31 119.44 1nbw h LEU 172 Ca 0.07 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1nbw h LEU 172 Cb 0.92 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 1nbw h LEU 172 CO 0.08 0.46 0.00 0.58 0.09 0.00 0.00 178.44 179.66 1nbw h VAL 173 N 0.46 1.23 -0.87 1.22 2.07 -1.09 -3.19 116.25 116.08 1nbw h VAL 173 Ca 0.13 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1nbw h VAL 173 Cb 0.11 1.61 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 1nbw h VAL 173 CO -0.02 0.19 0.55 -1.13 0.02 0.00 0.00 177.57 177.19 1nbw h ASN 174 N -0.20 1.02 0.18 0.57 -1.24 -1.27 -1.55 115.58 113.09 1nbw h ASN 174 Ca 0.01 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 56.98 1nbw h ASN 174 Cb 0.30 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 39.09 1nbw h ASN 174 CO 0.00 0.76 0.00 0.59 -1.29 0.00 0.00 177.43 177.49 1nbw n ASN 175 N -4.38 0.37 -0.27 1.15 3.02 -0.45 -2.36 115.26 112.34 1nbw n ASN 175 Ca 0.10 0.65 0.03 0.00 -0.03 0.00 0.00 54.58 55.33 1nbw n ASN 175 Cb 0.04 -0.71 0.07 0.00 -0.61 0.00 0.00 39.78 38.57 1nbw n ASN 175 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1nbw n ARG 176 N -1.98 2.88 -2.77 3.52 1.74 -0.60 -5.04 116.66 114.41 1nbw n ARG 176 Ca 0.00 -1.79 -0.29 0.00 -0.77 0.00 0.00 57.85 54.99 1nbw n ARG 176 Cb 0.07 -1.15 -0.02 0.00 -1.02 0.00 0.00 32.46 30.34 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 -1.13 3.76 0.28 0.55 1.43 -0.99 -4.95 118.68 117.62 1nbw s LEU 177 Ca 0.11 1.08 -0.01 0.00 -1.03 0.00 0.00 54.13 54.29 1nbw s LEU 177 Cb 0.07 -3.98 0.48 0.00 0.03 0.00 0.00 46.19 42.79 1nbw s LEU 177 CO 0.06 -0.46 1.88 0.03 0.23 0.00 0.00 176.35 178.09 1nbw h ARG 178 N 0.94 1.06 -3.96 1.70 2.47 -1.93 -3.43 114.38 111.24 1nbw h ARG 178 Ca -0.47 -0.06 -0.15 0.00 -1.26 0.00 0.00 59.98 58.04 1nbw h ARG 178 Cb 1.19 -0.24 -0.19 0.00 -1.65 0.00 0.00 29.97 29.08 1nbw h ARG 178 CO 0.63 0.70 -0.64 -1.59 0.56 0.00 0.00 179.97 179.63 1nbw s LYS 179 N -5.98 0.45 0.27 0.04 -2.85 -1.26 -5.14 119.74 105.27 1nbw s LYS 179 Ca -0.12 -0.76 -0.30 0.00 -1.00 0.00 0.00 55.97 53.80 1nbw s LYS 179 Cb 0.21 0.17 -0.10 0.00 -2.06 0.00 0.00 37.83 36.04 1nbw s LYS 179 CO 0.81 -0.09 1.48 0.99 0.10 0.00 0.00 175.35 178.64 1nbw s THR 180 N -2.23 2.45 0.02 3.79 2.01 -1.26 -5.03 115.64 115.38 1nbw s THR 180 Ca -0.09 0.38 0.01 0.00 0.31 0.00 0.00 61.69 62.30 1nbw s THR 180 Cb -0.04 -3.25 -0.02 0.00 0.01 0.00 0.00 72.50 69.21 1nbw s THR 180 CO -0.03 0.06 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.16 1nbw s LEU 181 N -0.57 2.20 0.00 4.42 1.43 -1.26 -4.87 118.68 120.03 1nbw s LEU 181 Ca 0.60 -0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 52.96 1nbw s LEU 181 Cb -0.44 0.02 -0.06 0.00 0.03 0.00 0.00 46.19 45.75 1nbw s LEU 181 CO 0.46 -0.23 1.41 -2.16 0.23 0.00 0.00 176.35 176.07 1nbw s PRO 182 N -1.25 4.28 -0.26 1.29 0.04 -1.12 -3.67 135.00 134.30 1nbw s PRO 182 Ca -0.12 1.98 0.02 0.00 0.04 0.00 0.00 61.00 62.92 1nbw s PRO 182 Cb -0.08 -3.58 0.07 0.00 0.04 0.00 0.00 34.50 30.94 1nbw s PRO 182 CO -0.01 -0.59 -0.05 0.08 0.04 0.00 0.00 177.00 176.48 1nbw s VAL 183 N 2.44 1.77 -0.27 -0.36 1.01 -0.26 -2.88 120.40 121.86 1nbw s VAL 183 Ca 0.64 -1.49 -0.28 0.00 0.00 0.00 0.00 61.98 60.85 1nbw s VAL 183 Cb -0.32 -2.04 0.01 0.00 0.00 0.00 0.00 36.38 34.03 1nbw s VAL 183 CO 0.27 -0.17 1.00 -0.69 0.00 0.00 0.00 175.10 175.51 1nbw s VAL 184 N 1.26 4.66 0.69 2.92 1.01 -0.50 -1.50 120.40 128.93 1nbw s VAL 184 Ca -0.04 1.80 -0.04 0.00 0.00 0.00 0.00 61.98 63.69 1nbw s VAL 184 Cb -0.19 -4.30 0.07 0.00 0.00 0.00 0.00 36.38 31.96 1nbw s VAL 184 CO -0.07 -0.27 0.97 -0.62 0.00 0.00 0.00 175.10 175.11 1nbw s ASP 185 N 1.40 4.74 -1.59 3.32 -1.08 -1.26 -0.85 116.67 121.35 1nbw s ASP 185 Ca 0.42 0.19 -0.05 0.00 -0.52 0.00 0.00 52.55 52.60 1nbw s ASP 185 Cb -0.14 -0.82 0.05 0.00 -1.46 0.00 0.00 42.92 40.55 1nbw s ASP 185 CO 0.10 -1.60 0.12 -0.62 0.52 0.00 0.00 175.17 173.68 1nbw n GLU 186 N -2.82 -0.89 -2.81 4.34 1.02 -1.11 -4.81 120.64 113.56 1nbw n GLU 186 Ca 0.10 0.10 -0.43 0.00 -0.02 0.00 0.00 57.16 56.90 1nbw n GLU 186 Cb 0.60 -3.75 -0.02 0.00 -0.02 0.00 0.00 31.44 28.25 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 -4.13 4.51 0.33 2.62 1.01 -0.03 -4.87 120.40 119.83 1nbw s VAL 187 Ca 0.17 -1.53 0.10 0.00 0.00 0.00 0.00 61.98 60.72 1nbw s VAL 187 Cb -0.10 -4.90 0.34 0.00 0.00 0.00 0.00 36.38 31.72 1nbw s VAL 187 CO 0.99 -1.67 1.62 0.71 0.00 0.00 0.00 175.10 176.75 1nbw h THR 188 N 5.91 0.18 -1.42 3.92 1.35 -1.72 -0.81 112.91 120.32 1nbw h THR 188 Ca 0.21 -0.05 -0.66 0.00 -0.55 0.00 0.00 66.41 65.36 1nbw h THR 188 Cb 0.99 0.01 -0.34 0.00 -1.73 0.00 0.00 68.15 67.08 1nbw h THR 188 CO 1.24 0.03 0.19 0.18 -0.25 0.00 0.00 175.52 176.91 1nbw n LEU 189 N -5.23 6.33 -0.28 3.87 4.77 0.71 -4.80 117.00 122.36 1nbw n LEU 189 Ca 0.28 -4.81 0.08 0.00 -0.03 0.00 0.00 56.01 51.54 1nbw n LEU 189 Cb 0.92 -0.75 0.23 0.00 -2.33 0.00 0.00 43.42 41.49 1nbw n LEU 189 CO 0.04 1.89 1.00 0.25 -1.33 0.00 0.00 177.39 179.24 1nbw h LEU 190 N 2.52 0.21 -0.81 2.23 5.85 -1.31 0.58 115.31 124.57 1nbw h LEU 190 Ca 0.47 0.14 0.00 0.00 0.84 0.00 0.00 57.88 59.33 1nbw h LEU 190 Cb 0.71 0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.89 1nbw h LEU 190 CO 1.19 0.02 0.22 -1.84 -0.34 0.00 0.00 178.44 177.69 1nbw n GLU 191 N -5.07 0.08 0.08 1.25 0.00 -1.26 -0.14 120.64 115.57 1nbw n GLU 191 Ca 0.17 0.54 0.12 0.00 0.00 0.00 0.00 57.16 57.99 1nbw n GLU 191 Cb 0.52 -1.99 0.07 0.00 0.00 0.00 0.00 31.44 30.05 1nbw n GLU 191 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 1nbw h GLN 192 N 0.00 0.00 -6.50 3.44 4.20 -1.27 -3.46 115.11 111.52 1nbw h GLN 192 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 1nbw h GLN 192 Cb 0.44 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.25 1nbw h GLN 192 CO 0.00 0.00 0.99 0.08 -0.67 0.00 0.00 178.83 179.23 1nbw s VAL 193 N -3.26 2.85 0.25 -0.54 1.01 0.80 -4.92 120.40 116.59 1nbw s VAL 193 Ca 0.03 0.41 -0.30 0.00 0.00 0.00 0.00 61.98 62.11 1nbw s VAL 193 Cb 0.12 -3.26 -0.11 0.00 0.00 0.00 0.00 36.38 33.13 1nbw s VAL 193 CO 0.76 0.01 1.56 -2.16 0.00 0.00 0.00 175.10 175.27 1nbw s PRO 194 N 2.28 4.18 0.33 2.72 0.04 -1.26 -5.01 135.00 138.27 1nbw s PRO 194 Ca 0.74 2.47 -0.08 0.00 0.04 0.00 0.00 61.00 64.17 1nbw s PRO 194 Cb -0.42 -3.07 -0.06 0.00 0.04 0.00 0.00 34.50 30.99 1nbw s PRO 194 CO 0.33 -0.58 0.64 -1.21 0.04 0.00 0.00 177.00 176.22 1nbw s GLU 195 N -0.02 3.71 -1.00 4.56 2.02 -1.26 -4.37 118.70 122.34 1nbw s GLU 195 Ca 0.64 0.22 0.00 0.00 0.02 0.00 0.00 54.97 55.85 1nbw s GLU 195 Cb -0.46 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.23 1nbw s GLU 195 CO 0.42 0.12 0.00 0.41 0.02 0.00 0.00 175.26 176.24 1nbw n GLY 196 N -1.00 0.33 3.43 -1.39 0.00 0.87 -4.95 105.19 102.47 1nbw n GLY 196 Ca 0.00 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.32 1nbw n GLY 196 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nbw s VAL 197 N -2.50 2.27 0.19 1.61 -7.23 -1.26 -4.81 120.40 108.66 1nbw s VAL 197 Ca 0.00 -2.26 -0.30 0.00 -1.81 0.00 0.00 61.98 57.61 1nbw s VAL 197 Cb 0.00 -2.18 -0.08 0.00 0.56 0.00 0.00 36.38 34.68 1nbw s VAL 197 CO 0.00 -0.37 1.21 -0.32 -0.31 0.00 0.00 175.10 175.31 1nbw s MET 198 N -3.31 4.48 0.22 4.82 1.75 -1.26 -0.83 119.30 125.17 1nbw s MET 198 Ca 0.26 1.89 -0.11 0.00 -1.25 0.00 0.00 55.69 56.48 1nbw s MET 198 Cb -0.05 -3.24 -0.01 0.00 2.84 0.00 0.00 34.83 34.38 1nbw s MET 198 CO 0.12 -0.11 0.39 0.00 -0.65 0.00 0.00 175.02 174.77 1nbw s ALA 199 N -0.03 -0.07 -0.01 4.11 0.00 0.31 -0.38 121.76 125.70 1nbw s ALA 199 Ca 0.53 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1nbw s ALA 199 Cb -0.33 1.04 0.01 0.00 0.00 0.00 0.00 23.12 23.84 1nbw s ALA 199 CO 0.37 -0.77 -0.00 0.00 0.00 0.00 0.00 175.76 175.36 1nbw s ALA 200 N -4.01 0.15 -0.05 0.00 0.00 0.20 -1.65 121.76 116.40 1nbw s ALA 200 Ca 0.22 0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.32 1nbw s ALA 200 Cb 0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 1nbw s ALA 200 CO 0.06 -0.02 -0.25 0.08 0.00 0.00 0.00 175.76 175.63 1nbw s VAL 201 N 0.44 2.02 -0.03 0.00 1.01 0.39 -1.24 120.40 123.00 1nbw s VAL 201 Ca -0.04 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 60.89 1nbw s VAL 201 Cb -0.06 -1.70 0.02 0.00 0.00 0.00 0.00 36.38 34.64 1nbw s VAL 201 CO -0.01 0.56 -0.00 -0.70 0.00 0.00 0.00 175.10 174.95 1nbw s GLU 202 N -0.26 0.27 -0.16 2.72 2.12 -0.54 -0.94 118.70 121.92 1nbw s GLU 202 Ca -0.01 0.06 -0.02 0.00 0.36 0.00 0.00 54.97 55.36 1nbw s GLU 202 Cb -0.13 -0.44 0.05 0.00 0.26 0.00 0.00 34.13 33.87 1nbw s GLU 202 CO 0.03 -0.12 0.02 0.08 -0.54 0.00 0.00 175.26 174.73 1nbw s VAL 203 N 0.90 0.50 0.77 3.70 1.01 -0.36 -1.47 120.40 125.46 1nbw s VAL 203 Ca -0.09 -0.35 -0.12 0.00 0.00 0.00 0.00 61.98 61.42 1nbw s VAL 203 Cb -0.12 -0.89 0.06 0.00 0.00 0.00 0.00 36.38 35.42 1nbw s VAL 203 CO -0.02 -0.05 1.13 0.00 0.00 0.00 0.00 175.10 176.17 1nbw s ALA 204 N 1.88 2.63 0.96 5.51 0.00 0.71 -1.41 121.76 132.05 1nbw s ALA 204 Ca 0.01 -0.46 -0.12 0.00 0.00 0.00 0.00 51.96 51.39 1nbw s ALA 204 Cb -0.15 -3.01 0.17 0.00 0.00 0.00 0.00 23.12 20.12 1nbw s ALA 204 CO -0.07 -1.51 1.09 0.00 0.00 0.00 0.00 175.76 175.28 1nbw s ALA 205 N -3.41 1.20 0.17 0.00 0.00 -1.26 -4.85 121.76 113.60 1nbw s ALA 205 Ca 0.60 -0.27 -0.33 0.00 0.00 0.00 0.00 51.96 51.96 1nbw s ALA 205 Cb -0.12 -3.14 -0.14 0.00 0.00 0.00 0.00 23.12 19.72 1nbw s ALA 205 CO 0.51 -2.64 1.44 -0.35 0.00 0.00 0.00 175.76 174.72 1nbw n PRO 206 N -4.06 1.83 0.00 0.00 -0.04 -1.26 -1.29 135.00 130.18 1nbw n PRO 206 Ca 0.06 0.66 0.00 0.00 -0.04 0.00 0.00 63.50 64.18 1nbw n PRO 206 Cb 0.57 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.68 1nbw n PRO 206 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nbw n GLY 207 N 2.73 2.59 3.96 0.55 0.00 -1.26 -4.99 105.19 108.76 1nbw n GLY 207 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 2.22 0.27 1.61 -0.21 -0.42 -5.08 119.66 118.05 1nbw s GLN 208 Ca 0.00 -0.62 0.10 0.00 0.02 0.00 0.00 55.36 54.86 1nbw s GLN 208 Cb 0.00 -2.32 -0.05 0.00 1.00 0.00 0.00 33.01 31.64 1nbw s GLN 208 CO 0.00 -1.08 -0.16 0.14 -2.12 0.00 0.00 175.29 172.07 1nbw s VAL 209 N -3.04 2.19 0.41 1.09 -7.23 -1.26 -4.33 120.40 108.23 1nbw s VAL 209 Ca 0.60 -2.31 -0.26 0.00 -1.81 0.00 0.00 61.98 58.20 1nbw s VAL 209 Cb -0.10 -2.29 -0.09 0.00 0.56 0.00 0.00 36.38 34.47 1nbw s VAL 209 CO 0.42 -0.42 1.32 0.68 -0.31 0.00 0.00 175.10 176.80 1nbw s VAL 210 N -2.68 2.53 0.00 1.32 -7.23 0.30 -4.82 120.40 109.82 1nbw s VAL 210 Ca 0.28 0.48 0.00 0.00 -1.81 0.00 0.00 61.98 60.93 1nbw s VAL 210 Cb -0.02 -3.28 0.00 0.00 0.56 0.00 0.00 36.38 33.64 1nbw s VAL 210 CO 0.13 0.07 0.02 -2.11 -0.31 0.00 0.00 175.10 172.90 1nbw n ARG 211 N 0.10 5.14 -0.10 4.82 1.85 -1.26 -4.62 116.66 122.59 1nbw n ARG 211 Ca 0.04 -0.02 -0.20 0.00 -1.00 0.00 0.00 57.85 56.66 1nbw n ARG 211 Cb 0.43 -0.43 -0.07 0.00 -1.05 0.00 0.00 32.46 31.35 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 -0.74 1.24 0.43 8.89 5.41 -1.26 -4.31 119.36 129.02 1nbw n ILE 212 Ca 0.00 -0.20 0.11 0.00 1.00 0.00 0.00 62.75 63.66 1nbw n ILE 212 Cb 0.00 -1.87 0.45 0.00 -0.71 0.00 0.00 39.64 37.51 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 -4.03 0.51 -0.68 1.39 4.77 -1.26 -1.50 117.00 116.21 1nbw n LEU 213 Ca -0.36 0.62 0.11 0.00 -0.03 0.00 0.00 56.01 56.36 1nbw n LEU 213 Cb 0.72 -0.55 0.35 0.00 -2.33 0.00 0.00 43.42 41.61 1nbw n LEU 213 CO 0.05 -0.48 0.77 -1.54 -1.33 0.00 0.00 177.39 174.86 1nbw n SER 214 N -2.06 2.05 -4.26 -1.43 3.41 -1.26 -4.32 113.62 105.73 1nbw n SER 214 Ca 0.03 -1.74 -0.35 0.00 -0.26 0.00 0.00 58.87 56.54 1nbw n SER 214 Cb 0.22 -0.10 -0.14 0.00 -0.26 0.00 0.00 64.21 63.93 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 -1.66 4.26 0.31 4.04 2.47 -0.56 -4.59 114.94 119.21 1nbw s ASN 215 Ca 0.34 -0.59 0.08 0.00 0.42 0.00 0.00 52.86 53.11 1nbw s ASN 215 Cb 0.19 -1.70 0.87 0.00 -1.45 0.00 0.00 41.25 39.15 1nbw s ASN 215 CO 0.29 -0.07 1.70 -0.65 -3.72 0.00 0.00 177.10 174.65 1nbw h PRO 216 N 8.08 0.44 0.00 0.43 0.11 -1.86 0.28 132.00 139.48 1nbw h PRO 216 Ca -0.38 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.59 1nbw h PRO 216 Cb 1.14 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1nbw h PRO 216 CO 0.60 0.29 -0.50 1.88 -0.21 0.00 0.00 178.00 180.06 1nbw h TYR 217 N 0.45 0.00 -0.13 0.65 0.99 -1.95 -0.79 116.97 116.19 1nbw h TYR 217 Ca 0.63 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 61.33 1nbw h TYR 217 Cb 1.26 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.98 1nbw h TYR 217 CO -0.06 0.50 -0.03 0.78 -0.00 0.00 0.00 178.16 179.35 1nbw h GLY 218 N 2.37 0.28 1.01 3.88 0.00 -0.64 -0.16 103.07 109.81 1nbw h GLY 218 Ca -0.01 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.06 1nbw h GLY 218 CO 0.07 0.21 0.25 -2.22 0.00 0.00 0.00 176.54 174.84 1nbw h ILE 219 N -0.05 1.24 0.00 2.60 2.04 -1.20 -2.04 117.51 120.10 1nbw h ILE 219 Ca 0.03 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.10 1nbw h ILE 219 Cb 0.45 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.04 1nbw h ILE 219 CO 0.01 0.30 -0.10 0.00 0.00 0.00 0.00 178.15 178.37 1nbw h ALA 220 N 1.10 1.79 -0.08 1.87 0.00 -0.96 -0.70 119.26 122.28 1nbw h ALA 220 Ca 0.22 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1nbw h ALA 220 Cb 0.23 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1nbw h ALA 220 CO -0.02 0.12 -0.41 1.15 0.00 0.00 0.00 179.25 180.10 1nbw h THR 221 N 0.00 1.40 -0.50 0.00 2.02 -0.35 0.10 112.91 115.58 1nbw h THR 221 Ca -0.00 -1.78 -0.11 0.00 0.77 0.00 0.00 66.41 65.29 1nbw h THR 221 Cb 0.18 2.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.84 1nbw h THR 221 CO 0.01 0.52 -0.11 -0.26 0.37 0.00 0.00 175.52 176.06 1nbw h PHE 222 N -0.02 1.08 -0.02 3.16 0.05 -0.98 -3.19 116.94 117.01 1nbw h PHE 222 Ca -0.03 -0.23 0.00 0.00 3.82 0.00 0.00 57.97 61.54 1nbw h PHE 222 Cb 1.06 -0.26 0.00 0.00 2.00 0.00 0.00 35.95 38.75 1nbw h PHE 222 CO 0.12 1.02 -0.25 1.19 -0.18 0.00 0.00 178.31 180.22 1nbw n PHE 223 N -4.20 0.00 -3.65 -0.55 0.99 -0.31 -4.97 117.46 104.77 1nbw n PHE 223 Ca 0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.23 1nbw n PHE 223 Cb 0.39 -0.04 0.06 0.00 -1.00 0.00 0.00 39.48 38.89 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 1.34 -0.41 3.83 1.37 0.00 0.27 -4.95 105.19 106.63 1nbw n GLY 224 Ca 0.13 0.16 -0.31 0.00 0.00 0.00 0.00 46.02 46.00 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 -6.86 3.17 0.48 0.99 1.43 -0.62 -5.04 118.68 112.24 1nbw s LEU 225 Ca 0.27 1.60 -0.00 0.00 -1.03 0.00 0.00 54.13 54.96 1nbw s LEU 225 Cb -0.13 -4.49 0.00 0.00 0.03 0.00 0.00 46.19 41.60 1nbw s LEU 225 CO 0.77 -1.34 0.72 -0.94 0.23 0.00 0.00 176.35 175.79 1nbw s SER 226 N -3.79 5.71 0.22 2.29 1.04 -1.26 -4.87 113.70 113.04 1nbw s SER 226 Ca 0.58 0.29 -0.09 0.00 0.48 0.00 0.00 55.95 57.22 1nbw s SER 226 Cb -0.14 -1.45 0.33 0.00 0.10 0.00 0.00 66.02 64.87 1nbw s SER 226 CO 0.54 -0.82 1.70 -0.65 0.98 0.00 0.00 173.24 174.99 1nbw h PRO 227 N 0.27 0.26 -0.37 4.02 0.11 -1.99 0.13 132.00 134.43 1nbw h PRO 227 Ca -0.45 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1nbw h PRO 227 Cb 1.26 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1nbw h PRO 227 CO 0.57 0.17 0.22 1.49 -0.21 0.00 0.00 178.00 180.24 1nbw h GLU 228 N 0.27 0.51 -0.16 1.05 4.81 -2.00 -1.31 114.58 117.75 1nbw h GLU 228 Ca 0.34 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.45 1nbw h GLU 228 Cb 0.52 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1nbw h GLU 228 CO -0.43 0.40 -0.19 0.93 -0.73 0.00 0.00 179.01 178.99 1nbw h GLU 229 N 0.48 0.27 -0.25 1.92 5.08 -1.70 -2.59 114.58 117.79 1nbw h GLU 229 Ca 0.13 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1nbw h GLU 229 Cb 0.03 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1nbw h GLU 229 CO -0.02 0.46 0.03 1.15 -1.00 0.00 0.00 179.01 179.62 1nbw h THR 230 N 0.25 1.24 -0.78 1.13 2.02 -0.28 -2.23 112.91 114.26 1nbw h THR 230 Ca 0.05 -0.82 0.17 0.00 0.77 0.00 0.00 66.41 66.57 1nbw h THR 230 Cb 0.48 1.29 -0.05 0.00 -1.74 0.00 0.00 68.15 68.13 1nbw h THR 230 CO 0.03 0.26 0.52 1.56 0.37 0.00 0.00 175.52 178.26 1nbw h GLN 231 N 0.22 0.37 0.00 6.66 4.20 -0.89 -1.25 115.11 124.42 1nbw h GLN 231 Ca 0.07 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 1nbw h GLN 231 Cb 0.36 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 1nbw h GLN 231 CO 0.01 0.24 -0.14 0.00 -0.67 0.00 0.00 178.83 178.27 1nbw h ALA 232 N 1.64 0.92 -0.01 3.87 0.00 -1.05 -3.27 119.26 121.36 1nbw h ALA 232 Ca 0.39 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1nbw h ALA 232 Cb 0.96 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1nbw h ALA 232 CO -0.12 0.18 -0.45 0.44 0.00 0.00 0.00 179.25 179.29 1nbw n ILE 233 N -3.15 0.00 -0.26 0.00 -6.64 -0.49 -4.36 119.36 104.46 1nbw n ILE 233 Ca 0.03 -0.11 0.04 0.00 -1.77 0.00 0.00 62.75 60.95 1nbw n ILE 233 Cb 0.55 0.61 0.15 0.00 -1.44 0.00 0.00 39.64 39.50 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 1.01 0.32 -0.36 7.28 2.07 -1.58 0.29 116.25 125.28 1nbw h VAL 234 Ca 0.00 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.55 1nbw h VAL 234 Cb 0.55 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1nbw h VAL 234 CO 0.00 0.01 0.25 -0.65 0.02 0.00 0.00 177.57 177.20 1nbw h PRO 235 N 0.08 0.22 -0.10 1.57 0.11 -1.84 0.14 132.00 132.17 1nbw h PRO 235 Ca 0.40 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.41 1nbw h PRO 235 Cb 0.70 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1nbw h PRO 235 CO -0.69 0.14 -0.27 0.82 -0.21 0.00 0.00 178.00 177.80 1nbw h ILE 236 N 0.22 1.40 -0.49 4.15 2.04 -0.74 -2.17 117.51 121.92 1nbw h ILE 236 Ca 0.16 -1.60 0.02 0.00 1.00 0.00 0.00 64.86 64.44 1nbw h ILE 236 Cb 0.35 2.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 1nbw h ILE 236 CO -0.03 0.46 0.31 0.00 0.00 0.00 0.00 178.15 178.89 1nbw h ALA 237 N 0.49 0.63 -0.85 1.87 0.00 -0.50 -2.52 119.26 118.39 1nbw h ALA 237 Ca -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1nbw h ALA 237 Cb 0.89 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1nbw h ALA 237 CO 0.06 0.03 0.45 -0.09 0.00 0.00 0.00 179.25 179.70 1nbw h ARG 238 N 0.62 1.19 0.00 0.00 2.43 -0.77 -2.34 114.38 115.51 1nbw h ARG 238 Ca 0.19 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1nbw h ARG 238 Cb -0.02 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.29 1nbw h ARG 238 CO -0.07 0.88 -0.10 0.00 -1.51 0.00 0.00 179.97 179.17 1nbw h ALA 239 N 1.31 1.05 -0.00 2.80 0.00 -0.97 -2.91 119.26 120.54 1nbw h ALA 239 Ca 0.30 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1nbw h ALA 239 Cb 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1nbw h ALA 239 CO -0.05 0.13 -0.61 1.28 0.00 0.00 0.00 179.25 180.00 1nbw n LEU 240 N -3.29 0.74 -4.68 0.00 4.77 -0.90 -4.91 117.00 108.73 1nbw n LEU 240 Ca -0.00 -0.19 -0.45 0.00 -0.03 0.00 0.00 56.01 55.34 1nbw n LEU 240 Cb 0.32 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.21 1nbw n LEU 240 CO 0.29 0.17 1.33 -0.38 -1.33 0.00 0.00 177.39 177.47 1nbw n ILE 241 N -1.36 0.16 -0.05 -0.08 5.41 -1.10 -1.69 119.36 120.65 1nbw n ILE 241 Ca 0.06 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.78 1nbw n ILE 241 Cb 0.34 -1.78 0.00 0.00 -0.71 0.00 0.00 39.64 37.49 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 3.82 1.16 3.82 7.39 0.00 -1.26 -5.05 105.19 115.07 1nbw n GLY 242 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.84 6.90 0.14 1.61 0.02 -0.68 -4.88 114.94 115.21 1nbw s ASN 243 Ca 0.00 1.68 0.20 0.00 -1.02 0.00 0.00 52.86 53.73 1nbw s ASN 243 Cb 0.00 -2.54 -0.06 0.00 0.02 0.00 0.00 41.25 38.67 1nbw s ASN 243 CO 0.00 -0.39 0.94 -1.14 0.02 0.00 0.00 177.10 176.53 1nbw n ARG 244 N -0.73 0.61 -4.08 -0.60 0.63 -1.26 -0.54 116.66 110.70 1nbw n ARG 244 Ca 0.07 0.15 -0.12 0.00 -0.92 0.00 0.00 57.85 57.03 1nbw n ARG 244 Cb 0.54 -1.81 -0.11 0.00 0.45 0.00 0.00 32.46 31.53 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 -5.50 0.88 -0.07 6.15 0.01 -1.26 -0.21 113.70 113.69 1nbw s SER 245 Ca -0.02 -0.67 -0.30 0.00 1.31 0.00 0.00 55.95 56.28 1nbw s SER 245 Cb 0.09 0.06 0.11 0.00 0.21 0.00 0.00 66.02 66.49 1nbw s SER 245 CO 0.80 -0.28 0.93 0.00 0.41 0.00 0.00 173.24 175.10 1nbw s ALA 246 N -2.00 -1.87 -0.02 1.44 0.00 -0.54 -4.49 121.76 114.28 1nbw s ALA 246 Ca -0.05 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1nbw s ALA 246 Cb -0.06 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.05 1nbw s ALA 246 CO -0.01 -0.53 0.01 0.08 0.00 0.00 0.00 175.76 175.31 1nbw s VAL 247 N -2.27 0.02 -0.09 0.00 1.01 -0.90 -1.47 120.40 116.70 1nbw s VAL 247 Ca 0.02 0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.16 1nbw s VAL 247 Cb -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 36.38 36.26 1nbw s VAL 247 CO -0.04 0.08 -0.17 -0.69 0.00 0.00 0.00 175.10 174.28 1nbw s VAL 248 N 0.81 1.56 0.00 2.92 1.01 -0.37 -1.59 120.40 124.74 1nbw s VAL 248 Ca -0.07 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.22 1nbw s VAL 248 Cb -0.10 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1nbw s VAL 248 CO -0.02 0.45 -0.02 -0.76 0.00 0.00 0.00 175.10 174.75 1nbw s LEU 249 N 0.67 3.41 -0.81 3.92 2.01 0.02 -0.63 118.68 127.27 1nbw s LEU 249 Ca -0.13 -0.05 -0.17 0.00 0.01 0.00 0.00 54.13 53.78 1nbw s LEU 249 Cb -0.16 -1.96 0.15 0.00 0.01 0.00 0.00 46.19 44.23 1nbw s LEU 249 CO 0.03 0.28 0.90 -0.75 1.01 0.00 0.00 176.35 177.83 1nbw s LYS 250 N -1.53 3.45 0.17 1.70 2.20 0.49 -4.75 119.74 121.47 1nbw s LYS 250 Ca 0.19 -1.85 0.05 0.00 -0.36 0.00 0.00 55.97 54.00 1nbw s LYS 250 Cb -0.11 -4.58 -0.04 0.00 -1.51 0.00 0.00 37.83 31.59 1nbw s LYS 250 CO 0.09 -1.56 0.15 0.95 -0.36 0.00 0.00 175.35 174.62 1nbw s THR 251 N 1.92 4.53 0.11 3.43 -4.23 -1.26 -4.52 115.64 115.63 1nbw s THR 251 Ca 0.22 -1.06 -0.26 0.00 -1.18 0.00 0.00 61.69 59.41 1nbw s THR 251 Cb -0.12 -3.32 -0.08 0.00 1.34 0.00 0.00 72.50 70.33 1nbw s THR 251 CO -0.05 -0.11 1.44 -0.65 -0.54 0.00 0.00 174.62 174.71 1nbw h PRO 252 N 2.38 -0.19 0.00 3.99 0.11 -1.95 -3.29 132.00 133.04 1nbw h PRO 252 Ca -0.48 0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 1nbw h PRO 252 Cb 1.20 0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1nbw h PRO 252 CO 0.63 -0.13 -1.56 0.00 -0.21 0.00 0.00 178.00 176.74 1nbw n GLN 253 N -4.84 0.75 0.00 1.05 -0.00 -1.26 -5.06 117.38 108.02 1nbw n GLN 253 Ca -0.01 -0.08 0.00 0.00 -0.00 0.00 0.00 57.00 56.91 1nbw n GLN 253 Cb 0.25 -1.27 0.00 0.00 -0.00 0.00 0.00 30.24 29.22 1nbw n GLN 253 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1nbw n GLY 254 N 1.97 0.00 3.74 2.61 0.00 -1.24 -4.93 105.19 107.34 1nbw n GLY 254 Ca -0.05 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 1nbw n GLY 254 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nbw s ASP 255 N 0.00 -0.16 -0.23 1.61 2.15 -1.17 -4.89 116.67 113.97 1nbw s ASP 255 Ca 0.00 -0.78 0.01 0.00 0.43 0.00 0.00 52.55 52.21 1nbw s ASP 255 Cb 0.00 0.67 0.06 0.00 -0.30 0.00 0.00 42.92 43.35 1nbw s ASP 255 CO 0.00 -1.27 -0.04 -0.69 -0.17 0.00 0.00 175.17 172.99 1nbw s VAL 256 N -3.89 1.46 -0.06 1.11 1.01 -1.26 -0.80 120.40 117.98 1nbw s VAL 256 Ca 0.16 -1.19 0.05 0.00 0.00 0.00 0.00 61.98 61.00 1nbw s VAL 256 Cb -0.04 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 1nbw s VAL 256 CO 0.08 -0.12 -0.20 0.00 0.00 0.00 0.00 175.10 174.86 1nbw s GLN 257 N 1.42 2.57 -0.23 2.72 -2.07 -0.49 -4.70 119.66 118.89 1nbw s GLN 257 Ca -0.05 -0.81 0.01 0.00 -1.82 0.00 0.00 55.36 52.69 1nbw s GLN 257 Cb -0.19 -2.28 0.04 0.00 -1.09 0.00 0.00 33.01 29.49 1nbw s GLN 257 CO -0.07 0.47 -0.12 -1.12 -1.32 0.00 0.00 175.29 173.13 1nbw s SER 258 N -0.37 3.99 0.05 12.60 0.01 -1.26 -0.30 113.70 128.43 1nbw s SER 258 Ca 0.03 -1.01 -0.01 0.00 1.31 0.00 0.00 55.95 56.26 1nbw s SER 258 Cb -0.12 -1.56 -0.04 0.00 0.21 0.00 0.00 66.02 64.51 1nbw s SER 258 CO 0.02 -0.11 -0.02 0.00 0.41 0.00 0.00 173.24 173.54 1nbw s ARG 259 N 1.22 0.60 0.52 12.44 1.70 -0.59 -4.96 118.95 129.89 1nbw s ARG 259 Ca -0.02 -1.17 -0.23 0.00 -0.47 0.00 0.00 55.73 53.85 1nbw s ARG 259 Cb -0.17 0.21 -0.06 0.00 -0.57 0.00 0.00 34.95 34.36 1nbw s ARG 259 CO -0.07 -0.11 1.37 0.08 -1.08 0.00 0.00 175.30 175.49 1nbw s VAL 260 N -3.75 2.08 0.03 4.99 1.01 -1.26 -1.74 120.40 121.74 1nbw s VAL 260 Ca 0.05 0.06 0.07 0.00 0.00 0.00 0.00 61.98 62.16 1nbw s VAL 260 Cb 0.07 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 1nbw s VAL 260 CO -0.09 0.00 -0.18 -0.63 0.00 0.00 0.00 175.10 174.20 1nbw s ILE 261 N -1.28 2.81 -0.31 2.22 1.01 -0.73 -4.85 121.20 120.06 1nbw s ILE 261 Ca 0.69 -1.12 -0.29 0.00 0.00 0.00 0.00 60.65 59.94 1nbw s ILE 261 Cb -0.41 -2.17 -0.01 0.00 0.01 0.00 0.00 42.46 39.89 1nbw s ILE 261 CO 0.50 0.38 1.47 -2.84 0.00 0.00 0.00 174.94 174.45 1nbw s PRO 262 N -1.32 3.74 -0.17 2.79 0.02 -1.26 -4.73 135.00 134.06 1nbw s PRO 262 Ca 0.14 1.31 0.17 0.00 0.02 0.00 0.00 61.00 62.64 1nbw s PRO 262 Cb -0.10 -3.99 -0.24 0.00 0.02 0.00 0.00 34.50 30.18 1nbw s PRO 262 CO 0.04 -1.36 0.10 0.00 -0.33 0.00 0.00 177.00 175.45 1nbw n ALA 263 N 8.44 1.65 0.00 -1.55 0.00 -1.26 -5.07 120.51 122.71 1nbw n ALA 263 Ca 0.17 -1.17 0.00 0.00 0.00 0.00 0.00 53.44 52.44 1nbw n ALA 263 Cb 0.47 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.72 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 1.80 0.83 3.39 0.00 0.00 -1.26 -4.88 105.19 105.08 1nbw n GLY 264 Ca -0.28 -2.28 -0.20 0.00 0.00 0.00 0.00 46.02 43.26 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 -0.46 2.74 -0.15 1.61 0.01 -1.26 -1.32 114.94 116.12 1nbw s ASN 265 Ca 0.00 -1.09 0.01 0.00 -0.71 0.00 0.00 52.86 51.06 1nbw s ASN 265 Cb 0.00 -0.16 -0.00 0.00 0.41 0.00 0.00 41.25 41.50 1nbw s ASN 265 CO 0.00 -0.23 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.43 1nbw s LEU 266 N -3.39 2.39 -0.36 0.60 1.43 -0.48 -3.49 118.68 115.39 1nbw s LEU 266 Ca 0.26 -0.49 -0.10 0.00 -1.03 0.00 0.00 54.13 52.76 1nbw s LEU 266 Cb 0.01 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.72 1nbw s LEU 266 CO 0.10 0.09 0.19 -0.31 0.23 0.00 0.00 176.35 176.65 1nbw s TYR 267 N 0.75 3.23 -0.23 0.29 1.51 0.40 -2.13 117.35 121.16 1nbw s TYR 267 Ca -0.07 -0.92 -0.10 0.00 -1.01 0.00 0.00 57.07 54.97 1nbw s TYR 267 Cb -0.16 -2.42 -0.05 0.00 -0.11 0.00 0.00 41.96 39.23 1nbw s TYR 267 CO 0.01 -0.62 0.14 0.42 -1.11 0.00 0.00 175.55 174.39 1nbw s ILE 268 N 1.56 5.17 -0.37 2.71 1.01 0.86 -1.30 121.20 130.82 1nbw s ILE 268 Ca 0.02 0.11 -0.13 0.00 0.00 0.00 0.00 60.65 60.65 1nbw s ILE 268 Cb -0.19 -3.40 0.01 0.00 0.01 0.00 0.00 42.46 38.89 1nbw s ILE 268 CO 0.06 0.36 0.25 -0.44 0.00 0.00 0.00 174.94 175.17 1nbw s SER 269 N 1.04 5.96 0.68 3.58 0.01 -0.07 -0.36 113.70 124.53 1nbw s SER 269 Ca 0.07 -0.76 0.02 0.00 1.31 0.00 0.00 55.95 56.58 1nbw s SER 269 Cb -0.14 -2.11 0.11 0.00 0.21 0.00 0.00 66.02 64.10 1nbw s SER 269 CO 0.04 -0.36 0.93 -0.83 0.41 0.00 0.00 173.24 173.44 1nbw s GLY 270 N 1.66 1.76 0.16 3.44 0.00 0.98 0.53 107.32 115.86 1nbw s GLY 270 Ca 0.05 -1.79 -0.10 0.00 0.00 0.00 0.00 44.72 42.87 1nbw s GLY 270 CO 0.09 -1.27 1.59 -2.09 0.00 0.00 0.00 173.10 171.42 1nbw h GLU 271 N -0.33 1.00 0.00 2.90 4.81 -1.23 -3.39 114.58 118.35 1nbw h GLU 271 Ca -0.35 -0.36 -0.34 0.00 -0.13 0.00 0.00 59.36 58.17 1nbw h GLU 271 Cb 1.27 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.53 1nbw h GLU 271 CO 0.41 1.05 -2.14 1.63 -0.73 0.00 0.00 179.01 179.22 1nbw n LYS 272 N -4.19 0.44 -4.51 1.92 5.02 -1.26 -5.07 118.16 110.51 1nbw n LYS 272 Ca 0.01 0.18 -0.32 0.00 -2.02 0.00 0.00 58.31 56.17 1nbw n LYS 272 Cb 0.39 -1.24 -0.05 0.00 -0.02 0.00 0.00 35.03 34.11 1nbw n LYS 272 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1nbw s ARG 273 N -2.38 2.23 0.25 1.97 1.70 -1.26 -5.15 118.95 116.32 1nbw s ARG 273 Ca -0.28 -2.33 0.10 0.00 -0.47 0.00 0.00 55.73 52.75 1nbw s ARG 273 Cb 0.11 -1.69 -0.05 0.00 -0.57 0.00 0.00 34.95 32.74 1nbw s ARG 273 CO 0.37 -0.50 -0.18 1.03 -1.08 0.00 0.00 175.30 174.94 1nbw s ARG 274 N -4.04 1.56 0.17 3.89 0.52 -1.26 -0.01 118.95 119.78 1nbw s ARG 274 Ca 0.11 -1.71 -0.16 0.00 -0.52 0.00 0.00 55.73 53.44 1nbw s ARG 274 Cb -0.01 -1.54 0.03 0.00 0.52 0.00 0.00 34.95 33.95 1nbw s ARG 274 CO 0.07 0.28 0.46 0.20 0.02 0.00 0.00 175.30 176.33 1nbw s GLY 275 N -3.44 -0.11 0.13 -3.53 0.00 0.51 -4.93 107.32 95.95 1nbw s GLY 275 Ca 0.27 -0.21 0.02 0.00 0.00 0.00 0.00 44.72 44.80 1nbw s GLY 275 CO 0.12 -0.32 -0.04 -0.54 0.00 0.00 0.00 173.10 172.32 1nbw s GLU 276 N -3.86 0.97 -0.20 2.90 2.02 -1.26 -0.10 118.70 119.17 1nbw s GLU 276 Ca 0.08 -1.43 -0.12 0.00 0.02 0.00 0.00 54.97 53.52 1nbw s GLU 276 Cb 0.00 -0.26 0.06 0.00 0.10 0.00 0.00 34.13 34.03 1nbw s GLU 276 CO -0.06 -0.06 0.48 0.00 0.02 0.00 0.00 175.26 175.65 1nbw s ALA 277 N -3.62 -1.25 -0.42 5.21 0.00 -0.91 -4.85 121.76 115.93 1nbw s ALA 277 Ca 0.17 1.71 -0.25 0.00 0.00 0.00 0.00 51.96 53.59 1nbw s ALA 277 Cb 0.05 -1.02 0.02 0.00 0.00 0.00 0.00 23.12 22.17 1nbw s ALA 277 CO -0.01 -0.29 0.91 0.34 0.00 0.00 0.00 175.76 176.72 1nbw s ASP 278 N 1.32 6.57 0.39 0.00 -1.08 -1.26 -1.38 116.67 121.22 1nbw s ASP 278 Ca -0.09 0.31 0.16 0.00 -0.52 0.00 0.00 52.55 52.41 1nbw s ASP 278 Cb -0.07 -2.45 1.02 0.00 -1.46 0.00 0.00 42.92 39.96 1nbw s ASP 278 CO -0.13 -0.95 1.82 0.58 0.52 0.00 0.00 175.17 177.02 1nbw h VAL 279 N 5.95 0.65 0.00 1.11 2.07 -1.54 0.18 116.25 124.67 1nbw h VAL 279 Ca -0.24 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1nbw h VAL 279 Cb 1.08 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1nbw h VAL 279 CO 1.00 0.09 0.00 0.00 0.02 0.00 0.00 177.57 178.67 1nbw n ALA 280 N -2.47 1.41 1.58 1.67 0.00 -1.26 -2.13 120.51 119.30 1nbw n ALA 280 Ca 0.21 0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.83 1nbw n ALA 280 Cb 0.72 -1.23 0.59 0.00 0.00 0.00 0.00 19.45 19.53 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 -1.80 1.54 0.00 0.00 1.02 0.64 -4.98 120.64 117.06 1nbw n GLU 281 Ca 0.02 -0.79 0.00 0.00 -0.02 0.00 0.00 57.16 56.36 1nbw n GLU 281 Cb 0.12 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 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 1.15 2.13 0.21 0.62 0.00 -0.91 -4.58 105.19 103.82 1nbw n GLY 282 Ca 0.20 -1.94 -0.00 0.00 0.00 0.00 0.00 46.02 44.27 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 1.25 -0.65 4.61 0.00 -1.86 -3.00 119.26 119.60 1nbw h ALA 283 Ca 0.00 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 1nbw h ALA 283 Cb 0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1nbw h ALA 283 CO 0.00 0.51 0.29 1.49 0.00 0.00 0.00 179.25 181.54 1nbw h GLU 284 N 0.21 0.95 -0.31 0.00 4.81 -1.88 -0.13 114.58 118.24 1nbw h GLU 284 Ca 0.03 -0.15 -0.07 0.00 -0.13 0.00 0.00 59.36 59.04 1nbw h GLU 284 Cb 0.66 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 1nbw h GLU 284 CO 0.05 0.78 -0.10 0.00 -0.73 0.00 0.00 179.01 179.01 1nbw h ALA 285 N 1.13 1.26 -0.31 2.92 0.00 -1.79 0.17 119.26 122.64 1nbw h ALA 285 Ca 0.22 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1nbw h ALA 285 Cb 0.15 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1nbw h ALA 285 CO -0.02 0.49 -0.07 0.82 0.00 0.00 0.00 179.25 180.46 1nbw h ILE 286 N 0.48 1.28 -0.04 0.00 2.04 -1.23 -2.27 117.51 117.77 1nbw h ILE 286 Ca 0.09 -1.11 -0.14 0.00 1.00 0.00 0.00 64.86 64.70 1nbw h ILE 286 Cb 0.46 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 1nbw h ILE 286 CO 0.03 0.36 -0.62 0.24 0.00 0.00 0.00 178.15 178.15 1nbw h MET 287 N 0.37 0.16 -0.80 2.37 2.86 -0.76 -1.93 114.93 117.19 1nbw h MET 287 Ca 0.08 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1nbw h MET 287 Cb 0.56 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.20 1nbw h MET 287 CO 0.03 0.72 0.39 1.96 1.06 0.00 0.00 176.91 181.07 1nbw h GLN 288 N 0.11 1.15 -0.16 1.72 1.08 -0.88 0.33 115.11 118.46 1nbw h GLN 288 Ca -0.01 -0.17 -0.10 0.00 -1.45 0.00 0.00 58.65 56.93 1nbw h GLN 288 Cb 1.12 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 28.32 1nbw h GLN 288 CO 0.09 0.89 -0.33 0.00 -0.95 0.00 0.00 178.83 178.53 1nbw h ALA 289 N 1.20 1.14 -0.40 3.87 0.00 -1.21 -0.69 119.26 123.18 1nbw h ALA 289 Ca 0.28 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1nbw h ALA 289 Cb 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1nbw h ALA 289 CO -0.04 0.55 -0.10 0.52 0.00 0.00 0.00 179.25 180.19 1nbw h MET 290 N 0.28 0.77 -0.46 0.00 2.86 -0.54 -2.40 114.93 115.44 1nbw h MET 290 Ca 0.04 -0.29 -0.08 0.00 -2.06 0.00 0.00 59.70 57.30 1nbw h MET 290 Cb 0.72 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.32 1nbw h MET 290 CO 0.06 0.90 -0.03 0.77 1.06 0.00 0.00 176.91 179.67 1nbw h SER 291 N 0.58 0.81 0.11 1.22 0.02 -0.72 -2.16 113.55 113.40 1nbw h SER 291 Ca 0.10 -0.32 -0.02 0.00 -0.84 0.00 0.00 61.79 60.71 1nbw h SER 291 Cb 0.62 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.94 1nbw h SER 291 CO 0.04 0.94 -0.10 0.00 -1.14 0.00 0.00 176.83 176.57 1nbw h ALA 292 N 0.90 1.79 -0.19 3.77 0.00 -1.05 -2.46 119.26 122.02 1nbw h ALA 292 Ca 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1nbw h ALA 292 Cb 0.54 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1nbw h ALA 292 CO 0.03 0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1nbw s ALA 294 N -1.77 3.64 0.12 0.00 0.00 -0.83 -3.42 121.76 119.50 1nbw s ALA 294 Ca 0.33 1.58 -0.28 0.00 0.00 0.00 0.00 51.96 53.59 1nbw s ALA 294 Cb 0.21 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 19.64 1nbw s ALA 294 CO 0.31 -1.04 0.90 -1.25 0.00 0.00 0.00 175.76 174.68 1nbw s PRO 295 N -1.52 4.66 0.20 0.00 0.04 -1.26 -4.76 135.00 132.36 1nbw s PRO 295 Ca 0.57 1.35 -0.30 0.00 0.04 0.00 0.00 61.00 62.65 1nbw s PRO 295 Cb -0.47 -3.35 -0.08 0.00 0.04 0.00 0.00 34.50 30.64 1nbw s PRO 295 CO 0.58 0.30 1.13 0.08 0.04 0.00 0.00 177.00 179.13 1nbw s VAL 296 N -0.26 3.69 -0.15 -0.36 1.01 -1.22 -1.15 120.40 121.96 1nbw s VAL 296 Ca 0.43 1.49 0.11 0.00 0.00 0.00 0.00 61.98 64.01 1nbw s VAL 296 Cb -0.23 -3.95 -0.17 0.00 0.00 0.00 0.00 36.38 32.04 1nbw s VAL 296 CO 0.28 0.27 0.01 0.54 0.00 0.00 0.00 175.10 176.21 1nbw n ARG 297 N 2.17 1.46 -3.46 2.72 5.12 0.19 -4.77 116.66 120.10 1nbw n ARG 297 Ca 0.02 0.01 -0.13 0.00 -1.93 0.00 0.00 57.85 55.83 1nbw n ARG 297 Cb 0.45 -1.37 -0.03 0.00 -1.16 0.00 0.00 32.46 30.36 1nbw n ARG 297 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1nbw s ASP 298 N -4.93 -0.56 0.00 0.55 2.15 -1.01 -4.15 116.67 108.73 1nbw s ASP 298 Ca -0.10 0.17 0.01 0.00 0.43 0.00 0.00 52.55 53.06 1nbw s ASP 298 Cb 0.05 0.55 -0.01 0.00 -0.30 0.00 0.00 42.92 43.21 1nbw s ASP 298 CO 0.56 -0.83 -0.03 -0.63 -0.17 0.00 0.00 175.17 174.06 1nbw s ILE 299 N -3.04 0.22 0.05 4.11 1.01 -1.21 -0.89 121.20 121.45 1nbw s ILE 299 Ca -0.01 -0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.41 1nbw s ILE 299 Cb -0.01 -0.22 -0.03 0.00 0.01 0.00 0.00 42.46 42.22 1nbw s ILE 299 CO -0.07 -0.02 -0.08 -0.13 0.00 0.00 0.00 174.94 174.64 1nbw s ARG 300 N -0.29 0.57 0.52 2.79 0.52 -0.42 -4.73 118.95 117.91 1nbw s ARG 300 Ca -0.01 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.38 1nbw s ARG 300 Cb -0.02 -0.30 -0.00 0.00 0.52 0.00 0.00 34.95 35.14 1nbw s ARG 300 CO -0.00 0.05 0.00 0.20 0.02 0.00 0.00 175.30 175.57 1nbw s GLY 301 N -1.72 3.09 0.11 -3.53 0.00 -1.26 -0.45 107.32 103.55 1nbw s GLY 301 Ca -0.08 -0.14 -0.18 0.00 0.00 0.00 0.00 44.72 44.32 1nbw s GLY 301 CO -0.00 -2.20 0.58 -0.54 0.00 0.00 0.00 173.10 170.94 1nbw s GLU 302 N -3.89 4.16 0.47 2.90 2.02 -1.23 -4.80 118.70 118.33 1nbw s GLU 302 Ca 0.02 0.70 -0.23 0.00 0.02 0.00 0.00 54.97 55.48 1nbw s GLU 302 Cb 0.01 -3.13 -0.07 0.00 0.10 0.00 0.00 34.13 31.04 1nbw s GLU 302 CO 0.01 0.58 1.28 -1.25 0.02 0.00 0.00 175.26 175.90 1nbw s PRO 303 N -1.40 3.61 0.00 0.39 0.04 -1.26 -2.84 135.00 133.54 1nbw s PRO 303 Ca 0.33 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.43 1nbw s PRO 303 Cb -0.18 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1nbw s PRO 303 CO 0.19 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 176.88 1nbw n GLY 304 N 0.61 0.79 3.75 0.56 0.00 -1.26 -5.04 105.19 104.60 1nbw n GLY 304 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.02 3.43 0.04 2.61 -4.23 -1.13 -5.01 115.64 108.33 1nbw s THR 305 Ca 0.00 -1.63 -0.20 0.00 -1.18 0.00 0.00 61.69 58.67 1nbw s THR 305 Cb 0.00 -3.05 -0.14 0.00 1.34 0.00 0.00 72.50 70.65 1nbw s THR 305 CO 0.00 -0.25 1.37 0.45 -0.54 0.00 0.00 174.62 175.65 1nbw h HIS 306 N 1.55 0.40 -0.01 3.99 3.86 -1.88 -1.07 115.15 121.98 1nbw h HIS 306 Ca -0.45 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 58.65 1nbw h HIS 306 Cb 1.25 -0.09 -0.00 0.00 1.06 0.00 0.00 27.41 29.63 1nbw h HIS 306 CO 0.61 0.70 0.01 0.00 0.86 0.00 0.00 177.93 180.10 1nbw h ALA 307 N 0.64 0.02 -0.27 2.45 0.00 -1.91 -0.54 119.26 119.64 1nbw h ALA 307 Ca 0.03 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1nbw h ALA 307 Cb 0.61 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1nbw h ALA 307 CO 0.03 -0.48 0.10 0.78 0.00 0.00 0.00 179.25 179.68 1nbw h GLY 308 N 0.01 0.34 0.92 0.00 0.00 -1.70 -0.27 103.07 102.37 1nbw h GLY 308 Ca 0.01 -0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.29 1nbw h GLY 308 CO -0.00 0.04 0.36 -1.33 0.00 0.00 0.00 176.54 175.61 1nbw h GLY 309 N 0.23 0.82 0.99 4.60 0.00 -1.02 -1.90 103.07 106.79 1nbw h GLY 309 Ca 0.12 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1nbw h GLY 309 CO -0.12 0.25 0.23 1.98 0.00 0.00 0.00 176.54 178.88 1nbw h MET 310 N 0.72 0.51 -0.54 4.80 1.85 -0.66 0.16 114.93 121.77 1nbw h MET 310 Ca 0.23 -0.04 -0.00 0.00 -0.61 0.00 0.00 59.70 59.27 1nbw h MET 310 Cb -0.01 -0.11 -0.03 0.00 0.43 0.00 0.00 31.60 31.88 1nbw h MET 310 CO -0.08 0.37 0.33 -0.07 -0.40 0.00 0.00 176.91 177.06 1nbw h LEU 311 N 0.50 0.64 -0.13 3.39 3.38 -0.77 -0.43 115.31 121.88 1nbw h LEU 311 Ca 0.14 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.90 1nbw h LEU 311 Cb -0.01 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1nbw h LEU 311 CO -0.03 0.49 -0.83 -0.33 0.09 0.00 0.00 178.44 177.83 1nbw h GLU 312 N 0.74 0.00 0.19 1.13 4.39 -0.84 -2.25 114.58 117.94 1nbw h GLU 312 Ca 0.19 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.89 1nbw h GLU 312 Cb -0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 1nbw h GLU 312 CO -0.04 0.83 -0.09 0.00 -1.16 0.00 0.00 179.01 178.55 1nbw h ARG 313 N 0.00 -0.25 -0.54 2.33 3.08 0.36 -0.59 114.38 118.78 1nbw h ARG 313 Ca -0.01 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.11 1nbw h ARG 313 Cb 1.58 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 31.64 1nbw h ARG 313 CO 0.11 -0.05 0.27 0.28 -1.07 0.00 0.00 179.97 179.51 1nbw h VAL 314 N -0.40 0.94 -0.21 2.04 2.07 -1.16 -1.51 116.25 118.02 1nbw h VAL 314 Ca -0.03 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.35 1nbw h VAL 314 Cb 0.31 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1nbw h VAL 314 CO 0.04 0.09 0.03 -0.09 0.02 0.00 0.00 177.57 177.67 1nbw h ARG 315 N 0.52 0.10 -0.35 1.57 2.43 -1.21 -2.10 114.38 115.33 1nbw h ARG 315 Ca 0.24 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.31 1nbw h ARG 315 Cb 0.16 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1nbw h ARG 315 CO -0.17 0.07 -0.16 -0.22 -1.51 0.00 0.00 179.97 177.98 1nbw h LYS 316 N 0.11 0.64 -0.26 0.20 3.64 -0.72 -0.73 116.57 119.44 1nbw h LYS 316 Ca 0.10 -0.22 -0.03 0.00 -1.27 0.00 0.00 60.65 59.23 1nbw h LYS 316 Cb 0.10 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1nbw h LYS 316 CO -0.14 0.77 0.05 0.28 -2.27 0.00 0.00 179.45 178.13 1nbw h VAL 317 N 0.58 1.23 -0.65 2.00 2.07 -1.04 -0.49 116.25 119.95 1nbw h VAL 317 Ca 0.10 -0.76 -0.08 0.00 0.82 0.00 0.00 66.70 66.78 1nbw h VAL 317 Cb 0.60 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1nbw h VAL 317 CO 0.04 0.24 0.11 -0.03 0.02 0.00 0.00 177.57 177.95 1nbw h MET 318 N 0.25 1.07 -0.36 1.57 1.85 -1.26 0.42 114.93 118.47 1nbw h MET 318 Ca 0.08 -0.28 -0.02 0.00 -0.61 0.00 0.00 59.70 58.87 1nbw h MET 318 Cb 0.32 -0.13 -0.02 0.00 0.43 0.00 0.00 31.60 32.21 1nbw h MET 318 CO 0.00 0.98 0.13 0.00 -0.40 0.00 0.00 176.91 177.62 1nbw h ALA 319 N 1.11 0.47 -0.34 0.39 0.00 -1.01 0.17 119.26 120.04 1nbw h ALA 319 Ca 0.20 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1nbw h ALA 319 Cb 0.42 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1nbw h ALA 319 CO 0.01 0.08 -0.12 1.03 0.00 0.00 0.00 179.25 180.25 1nbw h SER 320 N 0.43 0.57 -0.27 0.00 0.87 -0.87 0.19 113.55 114.48 1nbw h SER 320 Ca 0.12 -0.15 -0.16 0.00 -1.23 0.00 0.00 61.79 60.37 1nbw h SER 320 Cb 0.21 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1nbw h SER 320 CO -0.01 0.72 -0.41 0.25 -0.53 0.00 0.00 176.83 176.85 1nbw h LEU 321 N 0.53 0.88 -2.52 2.23 5.85 -0.53 -3.13 115.31 118.62 1nbw h LEU 321 Ca 0.10 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1nbw h LEU 321 Cb 0.52 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1nbw h LEU 321 CO 0.03 1.17 0.00 0.35 -0.34 0.00 0.00 178.44 179.65 1nbw n THR 322 N -4.04 0.88 -2.02 1.05 -2.24 0.01 -4.95 114.28 102.97 1nbw n THR 322 Ca -0.02 -0.91 -0.18 0.00 -2.27 0.00 0.00 64.05 60.67 1nbw n THR 322 Cb 0.55 0.53 -0.04 0.00 -2.10 0.00 0.00 70.33 69.26 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 1.59 0.48 3.99 3.38 0.00 0.44 -4.97 105.19 110.11 1nbw n GLY 323 Ca 0.23 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.73 2.25 0.26 1.61 3.76 0.21 -5.00 115.29 115.65 1nbw s HIS 324 Ca 0.00 -0.55 -0.15 0.00 -0.15 0.00 0.00 55.06 54.21 1nbw s HIS 324 Cb 0.00 -2.26 -0.08 0.00 1.11 0.00 0.00 32.58 31.34 1nbw s HIS 324 CO 0.00 -0.63 0.68 -1.21 -0.85 0.00 0.00 174.74 172.74 1nbw s GLU 325 N -4.42 4.04 0.13 1.40 2.02 -1.26 -4.51 118.70 116.09 1nbw s GLU 325 Ca 0.55 0.65 0.08 0.00 0.02 0.00 0.00 54.97 56.27 1nbw s GLU 325 Cb -0.07 -2.64 0.45 0.00 0.10 0.00 0.00 34.13 31.96 1nbw s GLU 325 CO 0.33 0.28 1.24 -1.33 0.02 0.00 0.00 175.26 175.81 1nbw n MET 326 N 0.11 0.05 0.11 1.61 2.81 -1.26 -0.72 117.12 119.83 1nbw n MET 326 Ca 0.00 0.55 0.12 0.00 -1.81 0.00 0.00 57.70 56.56 1nbw n MET 326 Cb 0.52 -1.69 0.26 0.00 -0.71 0.00 0.00 33.22 31.61 1nbw n MET 326 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 1nbw h SER 327 N 0.00 0.00 -0.14 7.83 0.02 -1.98 -3.20 113.55 116.09 1nbw h SER 327 Ca 0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1nbw h SER 327 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 1nbw h SER 327 CO 0.00 0.03 0.00 0.00 -1.14 0.00 0.00 176.83 175.72 1nbw n ALA 328 N -1.88 2.44 -2.79 3.77 0.00 0.11 -4.89 120.51 117.27 1nbw n ALA 328 Ca 0.04 -0.78 -0.37 0.00 0.00 0.00 0.00 53.44 52.34 1nbw n ALA 328 Cb 0.46 -0.76 -0.11 0.00 0.00 0.00 0.00 19.45 19.04 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 -1.69 4.90 0.03 0.00 -1.09 -1.21 -4.98 121.20 117.16 1nbw s ILE 329 Ca 0.29 0.03 0.09 0.00 -2.23 0.00 0.00 60.65 58.83 1nbw s ILE 329 Cb 0.19 -3.31 -0.03 0.00 -1.58 0.00 0.00 42.46 37.74 1nbw s ILE 329 CO 0.28 0.31 -0.26 -0.31 -1.23 0.00 0.00 174.94 173.73 1nbw s TYR 330 N 1.54 2.34 -0.43 3.97 1.51 -1.26 -4.99 117.35 120.03 1nbw s TYR 330 Ca 0.06 -0.41 -0.19 0.00 -1.01 0.00 0.00 57.07 55.52 1nbw s TYR 330 Cb -0.15 -1.42 0.02 0.00 -0.11 0.00 0.00 41.96 40.30 1nbw s TYR 330 CO 0.07 0.10 0.56 0.42 -1.11 0.00 0.00 175.55 175.59 1nbw s ILE 331 N -0.78 4.93 0.15 2.71 1.01 -1.26 -4.76 121.20 123.21 1nbw s ILE 331 Ca 0.12 -0.03 0.12 0.00 0.00 0.00 0.00 60.65 60.85 1nbw s ILE 331 Cb -0.10 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 38.22 1nbw s ILE 331 CO 0.02 -0.51 1.54 1.56 0.00 0.00 0.00 174.94 177.55 1nbw h GLN 332 N 8.79 0.00 -3.40 2.79 7.50 -1.76 -3.19 115.11 125.85 1nbw h GLN 332 Ca -0.26 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 58.81 1nbw h GLN 332 Cb 1.10 0.00 -0.16 0.00 0.05 0.00 0.00 27.48 28.48 1nbw h GLN 332 CO 0.85 0.63 -0.23 0.34 -1.50 0.00 0.00 178.83 178.92 1nbw s ASP 333 N -6.65 -0.11 -0.14 1.46 2.15 -1.19 -4.60 116.67 107.59 1nbw s ASP 333 Ca 0.00 -0.29 -0.14 0.00 0.43 0.00 0.00 52.55 52.55 1nbw s ASP 333 Cb 0.11 0.38 0.04 0.00 -0.30 0.00 0.00 42.92 43.14 1nbw s ASP 333 CO 0.75 -0.68 0.40 -0.22 -0.17 0.00 0.00 175.17 175.25 1nbw s LEU 334 N -2.34 0.49 -0.06 -1.34 0.20 -1.26 -1.51 118.68 112.86 1nbw s LEU 334 Ca -0.02 0.75 0.06 0.00 0.69 0.00 0.00 54.13 55.61 1nbw s LEU 334 Cb 0.01 1.37 -0.01 0.00 -0.43 0.00 0.00 46.19 47.13 1nbw s LEU 334 CO -0.06 -0.16 -0.24 -0.22 -0.29 0.00 0.00 176.35 175.38 1nbw s LEU 335 N 0.09 2.05 -0.04 -0.68 2.96 -0.06 -4.88 118.68 118.12 1nbw s LEU 335 Ca -0.01 -0.49 0.07 0.00 -0.22 0.00 0.00 54.13 53.47 1nbw s LEU 335 Cb -0.03 -1.32 -0.01 0.00 0.50 0.00 0.00 46.19 45.33 1nbw s LEU 335 CO 0.01 0.22 -0.25 0.00 -1.32 0.00 0.00 176.35 175.01 1nbw s ALA 336 N -0.08 2.12 0.04 5.97 0.00 -1.26 -1.38 121.76 127.17 1nbw s ALA 336 Ca -0.05 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 50.87 1nbw s ALA 336 Cb -0.14 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.36 1nbw s ALA 336 CO 0.04 0.47 -0.09 0.14 0.00 0.00 0.00 175.76 176.32 1nbw s VAL 337 N -0.38 0.65 0.05 0.00 -7.23 -0.20 -4.84 120.40 108.45 1nbw s VAL 337 Ca 0.03 -1.01 -0.19 0.00 -1.81 0.00 0.00 61.98 59.00 1nbw s VAL 337 Cb -0.12 -0.68 -0.06 0.00 0.56 0.00 0.00 36.38 36.08 1nbw s VAL 337 CO 0.01 -0.28 0.54 -1.81 -0.31 0.00 0.00 175.10 173.26 1nbw s ASP 338 N -1.41 7.00 0.00 4.85 1.01 -1.26 -0.52 116.67 126.34 1nbw s ASP 338 Ca -0.07 1.19 0.00 0.00 0.71 0.00 0.00 52.55 54.38 1nbw s ASP 338 Cb -0.09 -2.34 0.00 0.00 1.01 0.00 0.00 42.92 41.50 1nbw s ASP 338 CO 0.01 0.26 0.00 1.07 0.21 0.00 0.00 175.17 176.71 1nbw n THR 339 N 1.90 0.00 -4.11 -1.27 5.66 -0.37 -4.92 114.28 111.18 1nbw n THR 339 Ca -0.10 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.75 1nbw n THR 339 Cb 0.51 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.17 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 -4.64 0.67 -0.06 1.09 0.40 -1.26 -1.27 117.98 112.91 1nbw s PHE 340 Ca 0.00 -0.38 0.03 0.00 -0.60 0.00 0.00 56.93 55.98 1nbw s PHE 340 Cb 0.00 -0.40 0.00 0.00 0.51 0.00 0.00 43.02 43.13 1nbw s PHE 340 CO 0.00 -0.05 -0.16 0.42 0.70 0.00 0.00 175.22 176.13 1nbw s ILE 341 N -1.01 1.40 0.11 0.64 1.09 0.20 -2.91 121.20 120.72 1nbw s ILE 341 Ca -0.06 -0.66 -0.30 0.00 -1.10 0.00 0.00 60.65 58.53 1nbw s ILE 341 Cb -0.08 -1.23 -0.06 0.00 -1.06 0.00 0.00 42.46 40.03 1nbw s ILE 341 CO 0.00 0.41 1.11 -2.16 -0.10 0.00 0.00 174.94 174.20 1nbw s PRO 342 N 0.36 4.54 0.02 2.79 0.04 -1.26 -0.72 135.00 140.76 1nbw s PRO 342 Ca -0.11 1.67 0.03 0.00 0.04 0.00 0.00 61.00 62.64 1nbw s PRO 342 Cb -0.14 -3.33 -0.01 0.00 0.04 0.00 0.00 34.50 31.05 1nbw s PRO 342 CO 0.04 -0.05 -0.10 1.03 0.04 0.00 0.00 177.00 177.96 1nbw s ARG 343 N 0.34 0.74 0.21 4.56 1.81 -0.00 -4.92 118.95 121.68 1nbw s ARG 343 Ca 0.53 -0.52 -0.30 0.00 -1.72 0.00 0.00 55.73 53.72 1nbw s ARG 343 Cb -0.28 -0.69 -0.10 0.00 -0.45 0.00 0.00 34.95 33.43 1nbw s ARG 343 CO 0.32 0.18 1.44 0.21 -0.68 0.00 0.00 175.30 176.76 1nbw s LYS 344 N -0.71 4.28 -0.38 3.54 2.20 -1.26 -1.87 119.74 125.54 1nbw s LYS 344 Ca 0.01 2.25 -0.29 0.00 -0.36 0.00 0.00 55.97 57.57 1nbw s LYS 344 Cb -0.06 -3.15 0.02 0.00 -1.51 0.00 0.00 37.83 33.14 1nbw s LYS 344 CO 0.00 -0.43 1.10 0.08 -0.36 0.00 0.00 175.35 175.74 1nbw s VAL 345 N 0.38 4.39 0.22 4.02 1.01 -0.17 -4.91 120.40 125.35 1nbw s VAL 345 Ca 0.62 1.54 -0.30 0.00 0.00 0.00 0.00 61.98 63.83 1nbw s VAL 345 Cb -0.41 -4.48 -0.10 0.00 0.00 0.00 0.00 36.38 31.39 1nbw s VAL 345 CO 0.38 -0.68 1.45 -1.58 0.00 0.00 0.00 175.10 174.67 1nbw s GLN 346 N 3.97 4.27 0.00 2.72 2.00 -1.21 -1.74 119.66 129.66 1nbw s GLN 346 Ca 0.47 2.28 0.00 0.00 -2.00 0.00 0.00 55.36 56.11 1nbw s GLN 346 Cb -0.10 -3.13 0.00 0.00 0.80 0.00 0.00 33.01 30.58 1nbw s GLN 346 CO 0.22 -0.44 0.00 0.41 -0.50 0.00 0.00 175.29 174.97 1nbw n GLY 347 N 2.54 1.19 3.76 2.59 0.00 -1.26 -1.19 105.19 112.82 1nbw n GLY 347 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.28 2.79 0.00 -0.02 0.00 -0.71 -4.65 107.32 102.45 1nbw s GLY 348 Ca 0.00 1.04 0.07 0.00 0.00 0.00 0.00 44.72 45.83 1nbw s GLY 348 CO 0.00 1.49 1.01 1.03 0.00 0.00 0.00 173.10 176.63 1nbw n MET 349 N -0.87 1.87 -0.78 2.90 0.00 -1.26 -4.59 117.12 114.39 1nbw n MET 349 Ca 0.09 -1.52 0.02 0.00 0.00 0.00 0.00 57.70 56.29 1nbw n MET 349 Cb 0.48 -1.16 0.01 0.00 0.00 0.00 0.00 33.22 32.55 1nbw n MET 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1nbw n ALA 350 N 0.24 2.14 -1.60 3.04 0.00 -1.26 -0.21 120.51 122.85 1nbw n ALA 350 Ca 0.06 -1.49 -0.05 0.00 0.00 0.00 0.00 53.44 51.96 1nbw n ALA 350 Cb 0.30 -0.56 -0.01 0.00 0.00 0.00 0.00 19.45 19.17 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 0.08 0.49 3.67 0.00 0.00 -1.26 -4.67 105.19 103.49 1nbw n GLY 351 Ca 0.03 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.21 1.80 -4.42 1.61 4.71 -1.26 -4.87 120.64 116.00 1nbw n GLU 352 Ca -0.06 0.64 -0.21 0.00 -0.01 0.00 0.00 57.16 57.52 1nbw n GLU 352 Cb 0.35 -2.23 -0.10 0.00 -1.01 0.00 0.00 31.44 28.45 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 -3.02 -1.77 -0.33 0.00 0.00 -0.78 -4.84 121.76 111.01 1nbw s ALA 354 Ca 0.29 1.30 -0.25 0.00 0.00 0.00 0.00 51.96 53.30 1nbw s ALA 354 Cb 0.03 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.17 1nbw s ALA 354 CO 0.11 -0.38 0.85 -1.64 0.00 0.00 0.00 175.76 174.70 1nbw s MET 355 N -1.27 3.90 0.11 0.00 -1.94 -1.26 -0.82 119.30 118.02 1nbw s MET 355 Ca -0.10 0.58 0.01 0.00 -1.71 0.00 0.00 55.69 54.46 1nbw s MET 355 Cb -0.00 -3.76 -0.04 0.00 2.01 0.00 0.00 34.83 33.04 1nbw s MET 355 CO 0.09 -0.80 0.26 -1.21 -0.01 0.00 0.00 175.02 173.35 1nbw s GLU 356 N 3.17 3.45 0.57 2.03 0.41 0.10 -4.86 118.70 123.58 1nbw s GLU 356 Ca 0.35 -0.48 -0.18 0.00 -0.41 0.00 0.00 54.97 54.24 1nbw s GLU 356 Cb -0.13 -2.99 -0.04 0.00 -1.78 0.00 0.00 34.13 29.19 1nbw s GLU 356 CO 0.15 0.55 1.13 -0.80 -0.49 0.00 0.00 175.26 175.80 1nbw s ASN 357 N -2.84 5.55 0.14 -0.19 0.01 -1.26 -0.63 114.94 115.72 1nbw s ASN 357 Ca 0.35 2.15 -0.14 0.00 -0.71 0.00 0.00 52.86 54.51 1nbw s ASN 357 Cb -0.12 -2.58 0.02 0.00 0.41 0.00 0.00 41.25 38.98 1nbw s ASN 357 CO 0.28 -1.33 0.37 0.00 -1.51 0.00 0.00 177.10 174.91 1nbw s ALA 358 N -1.89 -0.66 -0.15 0.60 0.00 -0.39 -1.80 121.76 117.47 1nbw s ALA 358 Ca 0.72 -0.32 -0.00 0.00 0.00 0.00 0.00 51.96 52.36 1nbw s ALA 358 Cb -0.23 0.72 0.03 0.00 0.00 0.00 0.00 23.12 23.64 1nbw s ALA 358 CO 0.31 -0.66 -0.07 0.08 0.00 0.00 0.00 175.76 175.42 1nbw s VAL 359 N -3.85 1.17 0.00 0.00 1.01 -0.08 -1.23 120.40 117.41 1nbw s VAL 359 Ca 0.07 -0.55 -0.17 0.00 0.00 0.00 0.00 61.98 61.34 1nbw s VAL 359 Cb 0.02 -1.26 -0.06 0.00 0.00 0.00 0.00 36.38 35.08 1nbw s VAL 359 CO -0.08 0.25 0.46 -0.83 0.00 0.00 0.00 175.10 174.90 1nbw s GLY 360 N 1.62 2.52 0.05 4.51 0.00 0.32 -1.63 107.32 114.72 1nbw s GLY 360 Ca 0.02 -0.14 0.05 0.00 0.00 0.00 0.00 44.72 44.65 1nbw s GLY 360 CO -0.08 0.34 -0.15 1.06 0.00 0.00 0.00 173.10 174.27 1nbw s MET 361 N -0.80 0.93 -0.02 2.90 -1.94 0.10 -1.03 119.30 119.43 1nbw s MET 361 Ca 0.26 -0.86 0.02 0.00 -1.71 0.00 0.00 55.69 53.40 1nbw s MET 361 Cb -0.17 -0.96 0.00 0.00 2.01 0.00 0.00 34.83 35.71 1nbw s MET 361 CO 0.14 0.23 -0.08 0.00 -0.01 0.00 0.00 175.02 175.30 1nbw s ALA 362 N -1.00 0.79 0.06 3.03 0.00 -0.48 -0.40 121.76 123.76 1nbw s ALA 362 Ca 0.01 -0.29 0.08 0.00 0.00 0.00 0.00 51.96 51.76 1nbw s ALA 362 Cb -0.09 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 1nbw s ALA 362 CO 0.02 0.12 -0.23 0.00 0.00 0.00 0.00 175.76 175.67 1nbw s ALA 363 N 0.22 1.97 -0.03 0.00 0.00 -0.71 -0.88 121.76 122.32 1nbw s ALA 363 Ca -0.03 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.77 1nbw s ALA 363 Cb -0.08 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.67 1nbw s ALA 363 CO 0.00 0.45 -0.07 1.41 0.00 0.00 0.00 175.76 177.55 1nbw s MET 364 N -1.35 0.86 -0.12 0.00 0.00 -0.57 -2.06 119.30 116.06 1nbw s MET 364 Ca 0.09 -0.21 0.01 0.00 0.00 0.00 0.00 55.69 55.58 1nbw s MET 364 Cb -0.09 -0.82 0.02 0.00 0.00 0.00 0.00 34.83 33.93 1nbw s MET 364 CO 0.02 0.03 -0.14 0.54 0.00 0.00 0.00 175.02 175.48 1nbw s VAL 365 N 0.45 1.46 -0.10 10.11 0.11 0.35 -3.04 120.40 129.74 1nbw s VAL 365 Ca -0.06 -0.59 -0.04 0.00 -2.93 0.00 0.00 61.98 58.35 1nbw s VAL 365 Cb -0.10 -1.37 -0.04 0.00 -1.53 0.00 0.00 36.38 33.34 1nbw s VAL 365 CO 0.00 0.44 0.06 -0.75 -3.33 0.00 0.00 175.10 171.52 1nbw s LYS 366 N 1.28 3.21 -0.73 1.54 2.20 -1.26 -0.43 119.74 125.55 1nbw s LYS 366 Ca -0.01 -0.29 -0.26 0.00 -0.36 0.00 0.00 55.97 55.05 1nbw s LYS 366 Cb -0.14 -2.98 0.01 0.00 -1.51 0.00 0.00 37.83 33.21 1nbw s LYS 366 CO -0.06 0.72 1.56 0.00 -0.36 0.00 0.00 175.35 177.21 1nbw s ALA 367 N -0.89 2.45 -0.16 3.13 0.00 0.27 -4.84 121.76 121.72 1nbw s ALA 367 Ca 0.14 -1.18 -0.08 0.00 0.00 0.00 0.00 51.96 50.84 1nbw s ALA 367 Cb -0.12 -4.32 -0.08 0.00 0.00 0.00 0.00 23.12 18.60 1nbw s ALA 367 CO 0.03 -3.66 1.07 -3.47 0.00 0.00 0.00 175.76 169.73 1nbw n ASP 368 N 10.96 -0.80 -1.29 0.00 -0.08 -1.26 -4.45 116.55 119.61 1nbw n ASP 368 Ca 0.15 -1.39 0.00 0.00 -1.51 0.00 0.00 54.79 52.03 1nbw n ASP 368 Cb 0.50 -0.55 0.00 0.00 2.34 0.00 0.00 41.12 43.41 1nbw n ASP 368 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1nbw n ARG 369 N 5.12 -1.85 -0.29 -0.67 1.74 -1.26 -4.78 116.66 114.67 1nbw n ARG 369 Ca 0.12 1.38 0.00 0.00 -0.77 0.00 0.00 57.85 58.58 1nbw n ARG 369 Cb 0.40 -1.86 0.00 0.00 -1.02 0.00 0.00 32.46 29.98 1nbw n ARG 369 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1nbw n LEU 370 N -0.89 -0.33 -3.94 0.55 7.99 -1.26 -4.80 117.00 114.33 1nbw n LEU 370 Ca 0.00 -0.19 -0.30 0.00 -0.01 0.00 0.00 56.01 55.51 1nbw n LEU 370 Cb 0.00 -0.03 -0.14 0.00 -0.11 0.00 0.00 43.42 43.14 1nbw n LEU 370 CO 0.00 -0.31 -0.24 -1.10 -1.51 0.00 0.00 177.39 174.22 1nbw s GLN 371 N 0.95 1.67 0.00 3.23 -0.21 -1.26 -4.47 119.66 119.58 1nbw s GLN 371 Ca 0.00 -2.23 0.00 0.00 0.02 0.00 0.00 55.36 53.15 1nbw s GLN 371 Cb 0.00 -3.11 0.00 0.00 1.00 0.00 0.00 33.01 30.90 1nbw s GLN 371 CO 0.00 -1.05 0.00 -0.12 -2.12 0.00 0.00 175.29 172.00 1nbw n MET 372 N 3.62 0.00 0.00 2.91 1.56 -1.26 -5.14 117.12 118.80 1nbw n MET 372 Ca 0.05 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.48 1nbw n MET 372 Cb 0.36 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.73 1nbw n MET 372 CO 0.00 0.00 0.00 0.94 -0.73 0.00 0.00 175.97 176.18 1nbw n GLN 373 N 0.00 0.00 0.00 2.12 -0.06 -1.26 -4.99 117.38 113.19 1nbw n GLN 373 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1nbw n GLN 373 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1nbw n GLN 373 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 1nbw n VAL 374 N -0.40 0.00 0.00 1.69 0.31 -1.26 -4.96 118.33 113.71 1nbw n VAL 374 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1nbw n VAL 374 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1nbw n VAL 374 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1nbw n ILE 375 N 0.00 0.00 -0.09 2.52 2.08 -1.26 -0.83 119.36 121.78 1nbw n ILE 375 Ca 0.00 0.00 -0.05 0.00 0.56 0.00 0.00 62.75 63.26 1nbw n ILE 375 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 39.64 38.85 1nbw n ILE 375 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1nbw h ALA 376 N 0.00 -0.40 0.19 -1.39 0.00 -1.99 0.34 119.26 116.02 1nbw h ALA 376 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1nbw h ALA 376 Cb 0.00 0.97 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1nbw h ALA 376 CO 0.00 -0.52 -0.17 -0.09 0.00 0.00 0.00 179.25 178.47 1nbw h ARG 377 N -0.11 -0.37 0.00 0.00 2.43 -1.36 -1.95 114.38 113.03 1nbw h ARG 377 Ca 0.04 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1nbw h ARG 377 Cb 0.21 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1nbw h ARG 377 CO -0.28 -0.24 0.00 1.49 -1.51 0.00 0.00 179.97 179.42 1nbw h GLU 378 N -0.38 0.00 0.01 0.20 4.81 -1.53 -2.40 114.58 115.29 1nbw h GLU 378 Ca -0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1nbw h GLU 378 Cb 0.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1nbw h GLU 378 CO -0.03 0.00 -0.01 1.25 -0.73 0.00 0.00 179.01 179.49 1nbw h LEU 379 N 0.00 -0.01 -0.06 1.64 6.46 0.40 -3.11 115.31 120.63 1nbw h LEU 379 Ca 0.00 -0.57 0.00 0.00 -0.12 0.00 0.00 57.88 57.19 1nbw h LEU 379 Cb 0.15 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.08 1nbw h LEU 379 CO 0.00 0.76 0.00 -1.54 -0.62 0.00 0.00 178.44 177.04 1nbw n SER 380 N -4.70 0.03 0.01 1.25 3.41 -0.86 -1.95 113.62 110.82 1nbw n SER 380 Ca -0.06 0.51 -0.02 0.00 -0.26 0.00 0.00 58.87 59.05 1nbw n SER 380 Cb 0.28 -0.52 -0.01 0.00 -0.26 0.00 0.00 64.21 63.70 1nbw n SER 380 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nbw h ALA 381 N 2.19 -0.14 0.00 7.33 0.00 -1.46 0.48 119.26 127.67 1nbw h ALA 381 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1nbw h ALA 381 Cb 0.10 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1nbw h ALA 381 CO 0.00 -0.13 -0.00 -0.09 0.00 0.00 0.00 179.25 179.03 1nbw h ARG 382 N -0.73 0.00 0.00 0.00 2.43 -1.44 -2.46 114.38 112.18 1nbw h ARG 382 Ca -0.01 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1nbw h ARG 382 Cb 0.08 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1nbw h ARG 382 CO 0.02 0.00 -1.53 -0.11 -1.51 0.00 0.00 179.97 176.84 1nbw n LEU 383 N -4.14 0.47 -3.70 3.80 -0.00 -0.82 -4.98 117.00 107.64 1nbw n LEU 383 Ca -0.03 0.19 -0.27 0.00 -0.00 0.00 0.00 56.01 55.90 1nbw n LEU 383 Cb 0.08 0.01 0.04 0.00 -0.00 0.00 0.00 43.42 43.56 1nbw n LEU 383 CO 0.30 -0.03 0.14 1.67 -0.00 0.00 0.00 177.39 179.47 1nbw n GLN 384 N -2.55 -6.20 -4.07 1.96 -0.06 0.15 -4.97 117.38 101.64 1nbw n GLN 384 Ca -0.05 0.70 -0.09 0.00 -2.00 0.00 0.00 57.00 55.56 1nbw n GLN 384 Cb 0.63 -5.64 -0.11 0.00 -4.06 0.00 0.00 30.24 21.07 1nbw n GLN 384 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 1nbw s THR 385 N -3.27 0.34 0.00 1.69 2.01 -1.14 -5.05 115.64 110.22 1nbw s THR 385 Ca 0.60 -1.45 -0.30 0.00 0.31 0.00 0.00 61.69 60.85 1nbw s THR 385 Cb -0.28 -1.03 -0.07 0.00 0.01 0.00 0.00 72.50 71.13 1nbw s THR 385 CO 0.73 -0.72 1.70 -0.70 -0.69 0.00 0.00 174.62 174.94 1nbw s GLU 386 N -2.78 4.18 -0.20 4.92 2.12 -1.26 -4.40 118.70 121.28 1nbw s GLU 386 Ca -0.02 2.29 -0.02 0.00 0.36 0.00 0.00 54.97 57.59 1nbw s GLU 386 Cb -0.01 -3.88 0.00 0.00 0.26 0.00 0.00 34.13 30.50 1nbw s GLU 386 CO -0.05 -0.82 -0.10 0.08 -0.54 0.00 0.00 175.26 173.84 1nbw s VAL 387 N 3.62 2.94 -0.24 3.70 1.01 -1.26 -0.93 120.40 129.24 1nbw s VAL 387 Ca 0.76 -0.64 -0.03 0.00 0.00 0.00 0.00 61.98 62.06 1nbw s VAL 387 Cb -0.37 -2.31 0.01 0.00 0.00 0.00 0.00 36.38 33.72 1nbw s VAL 387 CO 0.32 0.47 -0.04 -0.69 0.00 0.00 0.00 175.10 175.15 1nbw s VAL 388 N 1.36 3.16 -0.11 2.92 1.01 0.85 -4.97 120.40 124.61 1nbw s VAL 388 Ca 0.05 -0.79 -0.32 0.00 0.00 0.00 0.00 61.98 60.92 1nbw s VAL 388 Cb -0.14 -2.54 -0.10 0.00 0.00 0.00 0.00 36.38 33.61 1nbw s VAL 388 CO -0.06 0.28 2.00 0.52 0.00 0.00 0.00 175.10 177.84 1nbw n VAL 389 N 4.74 0.55 -0.28 2.92 0.31 -1.26 -1.84 118.33 123.47 1nbw n VAL 389 Ca -0.17 -0.20 -0.29 0.00 -0.01 0.00 0.00 64.34 63.67 1nbw n VAL 389 Cb 0.49 -2.10 0.28 0.00 -0.91 0.00 0.00 33.84 31.59 1nbw n VAL 389 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nbw n GLY 390 N 4.92 -3.60 0.00 2.92 0.00 0.15 -4.87 105.19 104.70 1nbw n GLY 390 Ca 0.25 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1nbw n GLY 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nbw n GLY 391 N 1.83 0.91 3.67 -0.02 0.00 -1.26 -4.95 105.19 105.37 1nbw n GLY 391 Ca 0.12 -1.44 -0.43 0.00 0.00 0.00 0.00 46.02 44.27 1nbw n GLY 391 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nbw s VAL 392 N 0.03 4.39 0.27 1.61 1.01 -1.26 -4.92 120.40 121.53 1nbw s VAL 392 Ca 0.00 1.69 -0.01 0.00 0.00 0.00 0.00 61.98 63.66 1nbw s VAL 392 Cb 0.00 -4.09 0.29 0.00 0.00 0.00 0.00 36.38 32.58 1nbw s VAL 392 CO 0.00 -0.10 1.65 -0.08 0.00 0.00 0.00 175.10 176.58 1nbw h GLU 393 N 7.77 0.20 -0.97 2.72 4.81 -1.99 0.23 114.58 127.35 1nbw h GLU 393 Ca -0.27 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.03 1nbw h GLU 393 Cb 1.11 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.38 1nbw h GLU 393 CO 0.94 0.13 0.62 0.00 -0.73 0.00 0.00 179.01 179.98 1nbw h ALA 394 N 1.73 1.49 -0.32 2.92 0.00 -1.95 0.05 119.26 123.18 1nbw h ALA 394 Ca 0.50 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.36 1nbw h ALA 394 Cb 0.95 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1nbw h ALA 394 CO -0.63 0.34 0.03 -0.91 0.00 0.00 0.00 179.25 178.09 1nbw h ASN 395 N 1.07 0.52 -0.12 0.00 2.35 -0.96 -1.63 115.58 116.80 1nbw h ASN 395 Ca 0.44 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1nbw h ASN 395 Cb 0.28 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1nbw h ASN 395 CO -0.19 0.66 0.06 0.24 -1.65 0.00 0.00 177.43 176.56 1nbw h MET 396 N 0.35 0.17 -0.54 0.81 2.86 -0.74 -1.59 114.93 116.25 1nbw h MET 396 Ca 0.09 -0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.80 1nbw h MET 396 Cb 0.38 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 31.93 1nbw h MET 396 CO 0.01 0.21 0.14 0.00 1.06 0.00 0.00 176.91 178.33 1nbw h ALA 397 N 0.96 0.64 -0.85 6.32 0.00 -0.91 -0.75 119.26 124.66 1nbw h ALA 397 Ca 0.04 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1nbw h ALA 397 Cb 0.09 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1nbw h ALA 397 CO -0.01 -0.27 0.46 0.82 0.00 0.00 0.00 179.25 180.25 1nbw h ILE 398 N 0.30 1.25 -0.02 0.00 1.08 -1.04 -0.80 117.51 118.28 1nbw h ILE 398 Ca 0.27 -0.63 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 1nbw h ILE 398 Cb 0.36 0.12 -0.00 0.00 -3.07 0.00 0.00 36.82 34.23 1nbw h ILE 398 CO -0.32 0.28 0.01 0.00 -0.69 0.00 0.00 178.15 177.43 1nbw h ALA 399 N 1.24 0.02 -0.14 1.87 0.00 -0.27 -2.03 119.26 119.96 1nbw h ALA 399 Ca 0.30 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1nbw h ALA 399 Cb 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1nbw h ALA 399 CO -0.05 -0.45 0.06 0.78 0.00 0.00 0.00 179.25 179.60 1nbw h GLY 400 N -0.03 0.18 0.82 0.00 0.00 -0.88 -2.72 103.07 100.45 1nbw h GLY 400 Ca 0.01 -0.05 0.10 0.00 0.00 0.00 0.00 47.33 47.39 1nbw h GLY 400 CO -0.00 0.04 0.53 0.00 0.00 0.00 0.00 176.54 177.10 1nbw h ALA 401 N 1.07 1.75 0.00 3.60 0.00 -1.03 -0.44 119.26 124.21 1nbw h ALA 401 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1nbw h ALA 401 Cb 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1nbw h ALA 401 CO -0.04 0.09 0.00 1.28 0.00 0.00 0.00 179.25 180.57 1nbw n LEU 402 N -4.51 0.04 -0.00 0.00 4.77 -0.77 -1.33 117.00 115.19 1nbw n LEU 402 Ca 0.14 0.51 0.14 0.00 -0.03 0.00 0.00 56.01 56.76 1nbw n LEU 402 Cb 0.32 -0.51 0.55 0.00 -2.33 0.00 0.00 43.42 41.45 1nbw n LEU 402 CO 0.32 -0.36 0.85 0.35 -1.33 0.00 0.00 177.39 177.22 1nbw n THR 403 N -1.54 0.00 -2.10 -5.08 -2.24 -0.17 -4.79 114.28 98.35 1nbw n THR 403 Ca 0.02 -0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.38 1nbw n THR 403 Cb 0.11 -0.33 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 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 -2.96 3.15 0.39 4.28 2.01 -0.45 -3.36 115.64 118.71 1nbw s THR 404 Ca 0.15 0.80 -0.26 0.00 0.31 0.00 0.00 61.69 62.69 1nbw s THR 404 Cb 0.19 -3.51 -0.11 0.00 0.01 0.00 0.00 72.50 69.08 1nbw s THR 404 CO 0.56 0.06 1.27 -2.65 -0.69 0.00 0.00 174.62 173.17 1nbw n PRO 405 N 4.13 1.99 -0.71 4.92 -0.02 -1.26 -2.98 135.00 141.07 1nbw n PRO 405 Ca 0.12 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 1nbw n PRO 405 Cb 0.41 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1nbw n PRO 405 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nbw n GLY 406 N 0.80 1.55 3.87 -1.23 0.00 -1.26 -5.03 105.19 103.89 1nbw n GLY 406 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.59 -2.26 0.59 0.00 0.00 -1.26 -4.98 121.76 111.26 1nbw s ALA 408 Ca 0.44 0.99 -0.16 0.00 0.00 0.00 0.00 51.96 53.23 1nbw s ALA 408 Cb -0.02 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 1nbw s ALA 408 CO 0.26 -0.94 1.06 0.00 0.00 0.00 0.00 175.76 176.14 1nbw s ALA 409 N -2.32 2.73 0.19 0.00 0.00 -1.26 -4.03 121.76 117.07 1nbw s ALA 409 Ca 0.13 0.43 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 1nbw s ALA 409 Cb 0.04 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 19.83 1nbw s ALA 409 CO -0.04 -0.80 1.33 -1.25 0.00 0.00 0.00 175.76 174.99 1nbw s PRO 410 N -3.99 4.37 0.04 0.00 0.04 -1.26 -4.94 135.00 129.26 1nbw s PRO 410 Ca 0.64 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.75 1nbw s PRO 410 Cb -0.16 -3.20 -0.03 0.00 0.04 0.00 0.00 34.50 31.15 1nbw s PRO 410 CO 0.36 -0.29 -0.04 -1.17 0.04 0.00 0.00 177.00 175.90 1nbw s LEU 411 N 0.05 2.37 -0.04 -3.56 1.98 -1.04 -1.84 118.68 116.59 1nbw s LEU 411 Ca 0.58 -0.75 0.03 0.00 -2.89 0.00 0.00 54.13 51.10 1nbw s LEU 411 Cb -0.37 0.09 0.00 0.00 0.66 0.00 0.00 46.19 46.58 1nbw s LEU 411 CO 0.37 -0.42 -0.13 0.00 -1.89 0.00 0.00 176.35 174.28 1nbw s ALA 412 N -2.63 1.22 -0.31 5.97 0.00 -0.23 -0.82 121.76 124.95 1nbw s ALA 412 Ca -0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.39 1nbw s ALA 412 Cb -0.01 -0.43 0.05 0.00 0.00 0.00 0.00 23.12 22.73 1nbw s ALA 412 CO -0.05 0.20 0.03 0.42 0.00 0.00 0.00 175.76 176.36 1nbw s ILE 413 N 0.17 3.10 -0.25 0.00 1.01 0.03 -0.46 121.20 124.80 1nbw s ILE 413 Ca -0.05 -1.42 -0.12 0.00 0.00 0.00 0.00 60.65 59.07 1nbw s ILE 413 Cb -0.11 -2.81 -0.05 0.00 0.01 0.00 0.00 42.46 39.51 1nbw s ILE 413 CO 0.02 -0.17 0.22 -0.76 0.00 0.00 0.00 174.94 174.25 1nbw s LEU 414 N 1.26 4.08 -0.67 2.97 1.43 -0.24 -2.19 118.68 125.32 1nbw s LEU 414 Ca -0.04 0.13 -0.18 0.00 -1.03 0.00 0.00 54.13 53.02 1nbw s LEU 414 Cb -0.20 -2.19 0.12 0.00 0.03 0.00 0.00 46.19 43.95 1nbw s LEU 414 CO -0.01 -0.02 0.77 -0.62 0.23 0.00 0.00 176.35 176.71 1nbw s ASP 415 N 1.35 6.32 -0.77 2.29 -1.08 0.18 -0.51 116.67 124.45 1nbw s ASP 415 Ca 0.09 -1.68 -0.26 0.00 -0.52 0.00 0.00 52.55 50.19 1nbw s ASP 415 Cb -0.15 -2.30 0.04 0.00 -1.46 0.00 0.00 42.92 39.04 1nbw s ASP 415 CO 0.08 -1.04 1.28 -0.76 0.52 0.00 0.00 175.17 175.24 1nbw s LEU 416 N 2.38 3.30 0.00 -1.34 1.43 0.67 -2.40 118.68 122.72 1nbw s LEU 416 Ca 0.15 -0.62 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 1nbw s LEU 416 Cb -0.20 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.47 1nbw s LEU 416 CO 0.02 -1.77 0.00 0.61 0.23 0.00 0.00 176.35 175.45 1nbw n GLY 417 N 5.56 2.21 0.13 -3.19 0.00 -0.80 -1.27 105.19 107.83 1nbw n GLY 417 Ca 0.06 -1.95 -0.26 0.00 0.00 0.00 0.00 46.02 43.87 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 1.12 1.00 4.61 0.00 -1.26 -1.07 120.51 121.91 1nbw n ALA 418 Ca 0.00 -0.94 0.11 0.00 0.00 0.00 0.00 53.44 52.61 1nbw n ALA 418 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.36 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 1.45 -1.03 3.70 0.00 0.00 -1.26 -1.05 105.19 107.00 1nbw n GLY 419 Ca -0.47 -0.52 -0.05 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.97 -0.22 -0.28 1.61 1.04 -1.26 -4.25 113.70 107.36 1nbw s SER 420 Ca 0.10 -0.32 0.02 0.00 0.48 0.00 0.00 55.95 56.23 1nbw s SER 420 Cb 0.17 0.47 0.06 0.00 0.10 0.00 0.00 66.02 66.82 1nbw s SER 420 CO 0.80 -0.85 -0.06 -0.89 0.98 0.00 0.00 173.24 173.22 1nbw s THR 421 N -3.26 2.40 -0.01 2.02 2.01 -0.57 -1.91 115.64 116.32 1nbw s THR 421 Ca 0.11 -1.66 0.01 0.00 0.31 0.00 0.00 61.69 60.45 1nbw s THR 421 Cb -0.01 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.01 1nbw s THR 421 CO -0.00 -0.12 0.03 -1.81 -0.69 0.00 0.00 174.62 172.03 1nbw s ASP 422 N 1.14 5.32 0.05 3.53 1.01 -1.01 -1.13 116.67 125.58 1nbw s ASP 422 Ca -0.06 0.06 0.03 0.00 0.71 0.00 0.00 52.55 53.29 1nbw s ASP 422 Cb -0.20 -1.45 -0.02 0.00 1.01 0.00 0.00 42.92 42.26 1nbw s ASP 422 CO -0.04 0.29 -0.09 0.00 0.21 0.00 0.00 175.17 175.53 1nbw s ALA 423 N -1.10 0.73 -0.06 5.23 0.00 0.84 0.51 121.76 127.89 1nbw s ALA 423 Ca 0.20 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.38 1nbw s ALA 423 Cb -0.12 0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.01 1nbw s ALA 423 CO 0.11 0.03 -0.17 0.00 0.00 0.00 0.00 175.76 175.73 1nbw s ALA 424 N -1.32 1.54 0.02 0.00 0.00 -0.93 -0.26 121.76 120.81 1nbw s ALA 424 Ca -0.08 -0.65 0.03 0.00 0.00 0.00 0.00 51.96 51.26 1nbw s ALA 424 Cb -0.10 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.44 1nbw s ALA 424 CO 0.01 0.24 -0.10 0.42 0.00 0.00 0.00 175.76 176.32 1nbw s ILE 425 N 0.25 0.80 -0.16 0.00 1.01 0.20 -0.79 121.20 122.52 1nbw s ILE 425 Ca -0.09 -0.71 0.01 0.00 0.00 0.00 0.00 60.65 59.86 1nbw s ILE 425 Cb -0.14 -0.72 0.02 0.00 0.01 0.00 0.00 42.46 41.63 1nbw s ILE 425 CO 0.04 0.02 -0.18 0.54 0.00 0.00 0.00 174.94 175.36 1nbw s VAL 426 N -0.63 1.86 1.10 2.92 0.11 -0.00 0.63 120.40 126.38 1nbw s VAL 426 Ca 0.00 -0.82 -0.13 0.00 -2.93 0.00 0.00 61.98 58.10 1nbw s VAL 426 Cb -0.06 -1.69 0.25 0.00 -1.53 0.00 0.00 36.38 33.35 1nbw s VAL 426 CO 0.00 0.51 1.06 0.21 -3.33 0.00 0.00 175.10 173.55 1nbw s ASN 427 N 1.25 1.62 0.41 3.54 3.04 0.61 -2.51 114.94 122.91 1nbw s ASN 427 Ca 0.02 1.29 0.21 0.00 0.04 0.00 0.00 52.86 54.42 1nbw s ASN 427 Cb -0.13 -2.01 0.83 0.00 -1.54 0.00 0.00 41.25 38.40 1nbw s ASN 427 CO -0.10 -3.77 1.80 0.00 -3.04 0.00 0.00 177.10 172.00 1nbw h ALA 428 N -2.33 1.05 0.00 1.71 0.00 -1.90 -1.54 119.26 116.25 1nbw h ALA 428 Ca -0.58 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1nbw h ALA 428 Cb 1.34 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1nbw h ALA 428 CO 0.54 0.37 -0.03 0.39 0.00 0.00 0.00 179.25 180.53 1nbw n GLU 429 N -3.52 0.14 -0.20 0.00 4.71 -1.26 -4.92 120.64 115.59 1nbw n GLU 429 Ca -0.00 0.11 0.00 0.00 -0.01 0.00 0.00 57.16 57.26 1nbw n GLU 429 Cb 0.45 -1.66 0.00 0.00 -1.01 0.00 0.00 31.44 29.22 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 1.40 0.80 3.68 0.62 0.00 -0.58 -5.05 105.19 106.05 1nbw n GLY 430 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.80 4.34 -0.15 1.61 0.74 -1.26 -4.68 119.66 119.46 1nbw s GLN 431 Ca 0.00 1.17 -0.16 0.00 0.05 0.00 0.00 55.36 56.42 1nbw s GLN 431 Cb 0.00 -3.56 -0.04 0.00 1.10 0.00 0.00 33.01 30.50 1nbw s GLN 431 CO 0.00 -0.34 0.39 0.42 -0.55 0.00 0.00 175.29 175.21 1nbw s ILE 432 N 2.15 5.24 0.16 -2.34 1.01 -1.26 -0.28 121.20 125.89 1nbw s ILE 432 Ca 0.42 0.75 0.09 0.00 0.00 0.00 0.00 60.65 61.90 1nbw s ILE 432 Cb -0.17 -3.73 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 1nbw s ILE 432 CO 0.14 0.33 -0.19 -0.89 0.00 0.00 0.00 174.94 174.33 1nbw s THR 433 N 0.72 1.86 0.01 2.92 2.01 0.20 -4.94 115.64 118.41 1nbw s THR 433 Ca 0.21 -1.90 0.08 0.00 0.31 0.00 0.00 61.69 60.38 1nbw s THR 433 Cb -0.14 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.50 1nbw s THR 433 CO 0.07 -0.28 -0.25 0.00 -0.69 0.00 0.00 174.62 173.47 1nbw s ALA 434 N -1.96 2.07 -0.02 7.40 0.00 -1.26 0.62 121.76 128.62 1nbw s ALA 434 Ca 0.16 -1.12 0.03 0.00 0.00 0.00 0.00 51.96 51.03 1nbw s ALA 434 Cb -0.06 -0.49 -0.00 0.00 0.00 0.00 0.00 23.12 22.57 1nbw s ALA 434 CO 0.07 0.50 -0.11 0.08 0.00 0.00 0.00 175.76 176.30 1nbw s VAL 435 N -0.66 0.87 -0.16 0.00 1.01 0.64 -4.99 120.40 117.11 1nbw s VAL 435 Ca 0.10 -0.45 -0.00 0.00 0.00 0.00 0.00 61.98 61.63 1nbw s VAL 435 Cb -0.10 -0.74 0.04 0.00 0.00 0.00 0.00 36.38 35.58 1nbw s VAL 435 CO 0.00 0.25 -0.06 -1.00 0.00 0.00 0.00 175.10 174.30 1nbw s HIS 436 N -0.10 1.68 0.10 5.22 3.76 -1.26 -0.12 115.29 124.57 1nbw s HIS 436 Ca 0.01 -1.03 0.10 0.00 -0.15 0.00 0.00 55.06 53.99 1nbw s HIS 436 Cb -0.06 -1.31 -0.04 0.00 1.11 0.00 0.00 32.58 32.29 1nbw s HIS 436 CO -0.00 -0.60 -0.24 -0.51 -0.85 0.00 0.00 174.74 172.54 1nbw s LEU 437 N 1.64 2.40 0.48 0.89 1.43 -0.28 -4.86 118.68 120.38 1nbw s LEU 437 Ca 0.02 -0.64 -0.14 0.00 -1.03 0.00 0.00 54.13 52.34 1nbw s LEU 437 Cb -0.15 -1.34 -0.07 0.00 0.03 0.00 0.00 46.19 44.66 1nbw s LEU 437 CO -0.08 0.21 0.91 0.00 0.23 0.00 0.00 176.35 177.61 1nbw s ALA 438 N -1.01 3.17 0.00 4.21 0.00 -1.26 -1.51 121.76 125.37 1nbw s ALA 438 Ca 0.14 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1nbw s ALA 438 Cb -0.10 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.05 1nbw s ALA 438 CO 0.06 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.07 1nbw n GLY 439 N -1.50 0.15 0.00 0.00 0.00 -1.26 -4.51 105.19 98.07 1nbw n GLY 439 Ca 0.05 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.15 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 2.35 0.00 -0.27 4.61 0.00 -1.26 -3.95 120.51 121.99 1nbw n ALA 440 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 1nbw n ALA 440 Cb 0.00 0.00 0.37 0.00 0.00 0.00 0.00 19.45 19.82 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 1.22 1.73 0.00 0.00 -0.88 -2.01 103.07 103.13 1nbw h GLY 441 Ca 0.00 -0.31 -0.14 0.00 0.00 0.00 0.00 47.33 46.88 1nbw h GLY 441 CO 0.00 0.10 -0.56 3.43 0.00 0.00 0.00 176.54 179.51 1nbw h ASN 442 N 0.71 0.31 0.11 0.19 2.35 -1.35 -2.50 115.58 115.40 1nbw h ASN 442 Ca 0.45 -0.17 -0.19 0.00 -0.55 0.00 0.00 56.30 55.84 1nbw h ASN 442 Cb 0.69 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.97 1nbw h ASN 442 CO -0.21 0.81 -0.72 -0.03 -1.65 0.00 0.00 177.43 175.63 1nbw h MET 443 N 0.22 0.54 -0.07 0.81 4.05 -1.61 -1.45 114.93 117.42 1nbw h MET 443 Ca 0.00 -0.42 -0.00 0.00 -0.28 0.00 0.00 59.70 59.00 1nbw h MET 443 Cb 1.05 0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 31.93 1nbw h MET 443 CO 0.09 1.05 0.04 0.28 0.23 0.00 0.00 176.91 178.60 1nbw h VAL 444 N 0.37 1.05 -0.54 -5.77 2.07 -1.33 0.59 116.25 112.69 1nbw h VAL 444 Ca -0.03 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.41 1nbw h VAL 444 Cb 1.31 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 1nbw h VAL 444 CO 0.13 0.04 0.28 0.28 0.02 0.00 0.00 177.57 178.32 1nbw h SER 445 N 0.05 0.39 -0.60 0.57 0.02 -1.38 -0.93 113.55 111.67 1nbw h SER 445 Ca 0.02 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1nbw h SER 445 Cb 0.03 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 1nbw h SER 445 CO -0.00 0.27 0.30 0.25 -1.14 0.00 0.00 176.83 176.50 1nbw h LEU 446 N 0.53 0.81 -1.17 5.07 5.85 -0.77 -0.71 115.31 124.91 1nbw h LEU 446 Ca 0.24 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 1nbw h LEU 446 Cb 0.16 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1nbw h LEU 446 CO -0.17 0.69 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.28 1nbw h LEU 447 N 0.89 0.22 -0.04 2.25 3.38 -0.02 -1.36 115.31 120.63 1nbw h LEU 447 Ca 0.22 -0.07 -0.23 0.00 0.09 0.00 0.00 57.88 57.89 1nbw h LEU 447 Cb 0.10 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 40.81 1nbw h LEU 447 CO -0.03 0.50 -0.87 0.40 0.09 0.00 0.00 178.44 178.54 1nbw h ILE 448 N 0.20 1.31 -0.61 1.22 2.04 -0.40 -2.88 117.51 118.38 1nbw h ILE 448 Ca 0.03 -2.12 -0.05 0.00 1.00 0.00 0.00 64.86 63.72 1nbw h ILE 448 Cb 0.60 2.31 -0.03 0.00 -0.74 0.00 0.00 36.82 38.96 1nbw h ILE 448 CO 0.04 0.65 0.17 0.50 0.00 0.00 0.00 178.15 179.52 1nbw h LYS 449 N 0.32 0.94 0.43 2.37 3.64 -0.98 -2.99 116.57 120.31 1nbw h LYS 449 Ca -0.10 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.07 1nbw h LYS 449 Cb 1.53 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 33.21 1nbw h LYS 449 CO 0.17 0.82 -0.21 1.15 -2.27 0.00 0.00 179.45 179.12 1nbw h THR 450 N 0.91 0.23 0.00 1.00 2.02 -1.27 -1.09 112.91 114.71 1nbw h THR 450 Ca 0.20 -0.61 -0.04 0.00 0.77 0.00 0.00 66.41 66.74 1nbw h THR 450 Cb 0.29 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 1nbw h THR 450 CO -0.00 0.05 -0.17 -0.08 0.37 0.00 0.00 175.52 175.69 1nbw h GLU 451 N -1.07 0.00 0.00 6.66 4.81 -1.38 -2.58 114.58 121.02 1nbw h GLU 451 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1nbw h GLU 451 Cb 0.52 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1nbw h GLU 451 CO 0.10 0.17 -1.01 1.28 -0.73 0.00 0.00 179.01 178.81 1nbw n LEU 452 N -4.00 0.74 -0.56 1.64 4.32 -1.13 -4.56 117.00 113.45 1nbw n LEU 452 Ca -0.02 0.25 -0.04 0.00 -0.02 0.00 0.00 56.01 56.18 1nbw n LEU 452 Cb 0.25 -0.08 0.00 0.00 -1.62 0.00 0.00 43.42 41.97 1nbw n LEU 452 CO 0.34 -0.13 -0.02 0.61 -1.22 0.00 0.00 177.39 176.97 1nbw n GLY 453 N 1.24 0.35 3.80 -0.72 0.00 -0.76 -4.90 105.19 104.19 1nbw n GLY 453 Ca 0.00 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.29 3.41 -0.02 0.99 1.43 -0.49 -4.99 118.68 117.73 1nbw s LEU 454 Ca 0.03 1.80 0.01 0.00 -1.03 0.00 0.00 54.13 54.93 1nbw s LEU 454 Cb -0.01 -4.53 -0.26 0.00 0.03 0.00 0.00 46.19 41.42 1nbw s LEU 454 CO 0.03 -1.29 0.77 -0.33 0.23 0.00 0.00 176.35 175.76 1nbw h GLU 455 N 0.14 0.18 -6.63 1.70 5.08 -1.93 -3.46 114.58 109.65 1nbw h GLU 455 Ca -0.46 -0.30 -0.68 0.00 -1.00 0.00 0.00 59.36 56.92 1nbw h GLU 455 Cb 1.22 0.11 -0.20 0.00 0.50 0.00 0.00 28.75 30.38 1nbw h GLU 455 CO 0.57 0.98 -0.80 -0.51 -1.00 0.00 0.00 179.01 178.24 1nbw s ASP 456 N -6.76 3.86 0.20 1.42 1.11 -1.26 -5.02 116.67 110.22 1nbw s ASP 456 Ca -0.09 -0.47 -0.04 0.00 0.18 0.00 0.00 52.55 52.12 1nbw s ASP 456 Cb 0.07 -0.59 0.15 0.00 1.07 0.00 0.00 42.92 43.62 1nbw s ASP 456 CO 0.83 0.22 1.56 -0.07 1.18 0.00 0.00 175.17 178.90 1nbw h LEU 457 N 4.20 0.70 -1.59 1.23 3.38 -1.96 -3.08 115.31 118.19 1nbw h LEU 457 Ca -0.49 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 57.22 1nbw h LEU 457 Cb 1.16 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 1nbw h LEU 457 CO 0.47 1.02 0.35 0.77 0.09 0.00 0.00 178.44 181.14 1nbw h SER 458 N 0.54 0.45 -0.31 -0.43 4.64 -1.98 0.26 113.55 116.72 1nbw h SER 458 Ca 0.04 -0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.22 1nbw h SER 458 Cb 0.93 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1nbw h SER 458 CO 0.08 0.30 -0.38 0.25 -0.87 0.00 0.00 176.83 176.22 1nbw h LEU 459 N 0.52 0.87 -0.59 5.97 5.85 -1.97 -1.86 115.31 124.10 1nbw h LEU 459 Ca 0.22 -0.49 -0.00 0.00 0.84 0.00 0.00 57.88 58.45 1nbw h LEU 459 Cb 0.23 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 1nbw h LEU 459 CO -0.06 1.19 0.36 0.00 -0.34 0.00 0.00 178.44 179.58 1nbw h ALA 460 N 0.71 0.75 -0.34 1.25 0.00 -1.03 0.17 119.26 120.77 1nbw h ALA 460 Ca 0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1nbw h ALA 460 Cb 0.97 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1nbw h ALA 460 CO 0.09 0.23 0.21 1.49 0.00 0.00 0.00 179.25 181.27 1nbw h GLU 461 N 0.79 0.46 -0.27 0.00 4.57 -0.42 -0.12 114.58 119.60 1nbw h GLU 461 Ca 0.21 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1nbw h GLU 461 Cb -0.03 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.45 1nbw h GLU 461 CO -0.04 0.34 0.16 0.00 -1.18 0.00 0.00 179.01 178.29 1nbw h ALA 462 N 1.10 0.34 -0.48 2.92 0.00 -0.94 -2.09 119.26 120.10 1nbw h ALA 462 Ca 0.12 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1nbw h ALA 462 Cb -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1nbw h ALA 462 CO -0.02 -0.16 0.32 0.82 0.00 0.00 0.00 179.25 180.21 1nbw h ILE 463 N 0.34 1.09 -0.60 0.00 2.04 -0.71 -1.19 117.51 118.49 1nbw h ILE 463 Ca 0.10 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 1nbw h ILE 463 Cb 0.01 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 1nbw h ILE 463 CO -0.02 0.11 0.26 0.50 0.00 0.00 0.00 178.15 179.01 1nbw h LYS 464 N 0.60 0.88 -0.08 2.37 3.64 -0.33 -3.30 116.57 120.35 1nbw h LYS 464 Ca 0.18 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1nbw h LYS 464 Cb 0.00 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1nbw h LYS 464 CO -0.04 0.73 0.00 0.36 -2.27 0.00 0.00 179.45 178.23 1nbw n LYS 465 N -4.49 1.96 -4.68 1.90 2.85 -0.90 -4.94 118.16 109.86 1nbw n LYS 465 Ca 0.04 -1.81 -0.24 0.00 -1.05 0.00 0.00 58.31 55.25 1nbw n LYS 465 Cb 0.15 -1.41 -0.16 0.00 -0.65 0.00 0.00 35.03 32.96 1nbw n LYS 465 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1nbw s TYR 466 N -1.66 1.43 0.80 5.58 1.51 -0.50 -4.74 117.35 119.76 1nbw s TYR 466 Ca 0.26 -0.38 -0.14 0.00 -1.01 0.00 0.00 57.07 55.80 1nbw s TYR 466 Cb 0.18 -0.97 0.08 0.00 -0.11 0.00 0.00 41.96 41.13 1nbw s TYR 466 CO 0.26 -0.12 1.21 -0.35 -1.11 0.00 0.00 175.55 175.44 1nbw n PRO 467 N 3.13 0.26 -3.14 -1.71 -0.04 -1.26 -4.59 135.00 127.65 1nbw n PRO 467 Ca -0.18 0.16 -0.19 0.00 -0.04 0.00 0.00 63.50 63.25 1nbw n PRO 467 Cb 0.54 -2.45 0.03 0.00 -0.04 0.00 0.00 33.50 31.58 1nbw n PRO 467 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1nbw s LEU 468 N -5.57 3.27 -0.28 1.53 1.43 -1.26 -0.38 118.68 117.42 1nbw s LEU 468 Ca 0.74 -0.74 -0.25 0.00 -1.03 0.00 0.00 54.13 52.85 1nbw s LEU 468 Cb -0.30 -1.95 0.15 0.00 0.03 0.00 0.00 46.19 44.11 1nbw s LEU 468 CO 0.50 -1.08 1.17 0.00 0.23 0.00 0.00 176.35 177.17 1nbw s ALA 469 N -2.56 -2.06 -0.31 4.21 0.00 -0.25 -2.83 121.76 117.95 1nbw s ALA 469 Ca 0.56 1.80 -0.10 0.00 0.00 0.00 0.00 51.96 54.22 1nbw s ALA 469 Cb -0.07 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.52 1nbw s ALA 469 CO 0.35 -0.19 0.17 0.21 0.00 0.00 0.00 175.76 176.29 1nbw s LYS 470 N 0.07 3.40 -0.57 0.00 2.47 0.39 -0.63 119.74 124.87 1nbw s LYS 470 Ca 0.04 -0.68 -0.27 0.00 -1.56 0.00 0.00 55.97 53.50 1nbw s LYS 470 Cb -0.05 -3.61 -0.01 0.00 -1.46 0.00 0.00 37.83 32.70 1nbw s LYS 470 CO -0.09 -0.41 1.73 0.08 0.16 0.00 0.00 175.35 176.82 1nbw s VAL 471 N 1.64 3.48 -0.13 4.02 1.01 -1.09 -0.41 120.40 128.92 1nbw s VAL 471 Ca 0.05 0.34 0.16 0.00 0.00 0.00 0.00 61.98 62.53 1nbw s VAL 471 Cb -0.17 -4.05 -0.06 0.00 0.00 0.00 0.00 36.38 32.10 1nbw s VAL 471 CO 0.07 -0.94 1.08 -0.33 0.00 0.00 0.00 175.10 174.98 1nbw h GLU 472 N 13.62 0.00 0.00 2.72 5.08 -1.84 -2.95 114.58 131.21 1nbw h GLU 472 Ca -0.27 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 57.90 1nbw h GLU 472 Cb 1.14 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 1nbw h GLU 472 CO 1.19 0.40 0.01 -1.13 -1.00 0.00 0.00 179.01 178.48 1nbw n SER 473 N -3.03 -1.77 0.00 1.42 3.41 -1.11 -4.88 113.62 107.65 1nbw n SER 473 Ca -0.05 -2.83 0.10 0.00 -0.26 0.00 0.00 58.87 55.83 1nbw n SER 473 Cb 0.80 3.12 0.47 0.00 -0.26 0.00 0.00 64.21 68.34 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 -3.31 117.00 118.24 1nbw n LEU 474 Ca -0.03 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1nbw n LEU 474 Cb 0.61 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1nbw n LEU 474 CO 0.29 -0.12 -0.02 0.49 -1.33 0.00 0.00 177.39 176.70 1nbw n PHE 475 N -1.37 0.00 -4.16 -1.77 3.01 -1.26 0.58 117.46 112.49 1nbw n PHE 475 Ca 0.08 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.40 1nbw n PHE 475 Cb 0.19 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.55 1nbw n PHE 475 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1nbw s SER 476 N -0.97 1.28 -0.05 4.37 0.15 -1.21 -0.08 113.70 117.19 1nbw s SER 476 Ca 0.00 -0.82 -0.02 0.00 0.70 0.00 0.00 55.95 55.80 1nbw s SER 476 Cb 0.00 0.04 0.03 0.00 -1.71 0.00 0.00 66.02 64.38 1nbw s SER 476 CO 0.00 -0.31 0.11 0.27 1.20 0.00 0.00 173.24 174.51 1nbw s ILE 477 N -2.60 -0.04 -0.44 6.45 -4.36 -1.03 -2.46 121.20 116.72 1nbw s ILE 477 Ca 0.05 0.16 -0.22 0.00 -0.26 0.00 0.00 60.65 60.38 1nbw s ILE 477 Cb -0.02 -0.18 0.02 0.00 1.25 0.00 0.00 42.46 43.53 1nbw s ILE 477 CO -0.01 0.07 0.73 -0.60 0.24 0.00 0.00 174.94 175.37 1nbw s ARG 478 N 0.99 3.38 0.89 0.37 3.52 0.45 -1.75 118.95 126.79 1nbw s ARG 478 Ca -0.08 -0.18 -0.11 0.00 -0.13 0.00 0.00 55.73 55.23 1nbw s ARG 478 Cb -0.10 -3.94 0.13 0.00 -1.56 0.00 0.00 34.95 29.48 1nbw s ARG 478 CO -0.04 -1.06 1.11 -1.01 -0.81 0.00 0.00 175.30 173.49 1nbw s HIS 479 N 3.10 2.00 -0.19 5.12 3.76 0.06 -0.46 115.29 128.68 1nbw s HIS 479 Ca 0.27 1.60 0.27 0.00 -0.15 0.00 0.00 55.06 57.05 1nbw s HIS 479 Cb -0.13 -3.20 1.25 0.00 1.11 0.00 0.00 32.58 31.61 1nbw s HIS 479 CO 0.21 -2.51 1.81 1.05 -0.85 0.00 0.00 174.74 174.45 1nbw h GLU 480 N -1.65 0.00 0.00 1.40 4.11 -1.83 -1.36 114.58 115.25 1nbw h GLU 480 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1nbw h GLU 480 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1nbw h GLU 480 CO 0.47 0.00 0.00 -2.95 0.07 0.00 0.00 179.01 176.60 1nbw h ASN 481 N 0.00 0.00 0.00 3.06 7.08 -1.90 -3.47 115.58 120.35 1nbw h ASN 481 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1nbw h ASN 481 Cb 0.25 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.49 1nbw h ASN 481 CO 0.00 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.96 1nbw n GLY 482 N 0.83 2.37 3.77 9.14 0.00 -0.51 -5.08 105.19 115.71 1nbw n GLY 482 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.39 3.24 -0.16 4.61 0.00 -1.26 -4.78 121.76 121.03 1nbw s ALA 483 Ca 0.00 0.59 -0.06 0.00 0.00 0.00 0.00 51.96 52.49 1nbw s ALA 483 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 1nbw s ALA 483 CO 0.00 0.11 0.06 0.08 0.00 0.00 0.00 175.76 176.02 1nbw s VAL 484 N -1.50 4.82 -0.13 0.00 1.01 -1.26 -0.76 120.40 122.58 1nbw s VAL 484 Ca 0.49 -0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.41 1nbw s VAL 484 Cb -0.22 -3.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 1nbw s VAL 484 CO 0.27 0.51 -0.06 -0.70 0.00 0.00 0.00 175.10 175.12 1nbw s GLU 485 N -0.05 3.45 -0.05 2.72 2.12 -0.72 -4.98 118.70 121.20 1nbw s GLU 485 Ca 0.07 -0.56 -0.08 0.00 0.36 0.00 0.00 54.97 54.76 1nbw s GLU 485 Cb -0.12 -2.80 -0.05 0.00 0.26 0.00 0.00 34.13 31.42 1nbw s GLU 485 CO 0.01 0.31 0.24 0.12 -0.54 0.00 0.00 175.26 175.40 1nbw s PHE 486 N 0.15 3.62 -0.12 5.30 5.36 -1.26 -2.46 117.98 128.56 1nbw s PHE 486 Ca -0.03 0.63 0.02 0.00 -0.96 0.00 0.00 56.93 56.59 1nbw s PHE 486 Cb -0.14 -2.02 -0.01 0.00 -0.34 0.00 0.00 43.02 40.51 1nbw s PHE 486 CO 0.03 0.67 -0.18 -0.06 -1.46 0.00 0.00 175.22 174.22 1nbw s PHE 487 N -1.15 2.69 -1.35 10.12 0.40 0.88 -5.00 117.98 124.58 1nbw s PHE 487 Ca 0.22 -0.90 0.08 0.00 -0.60 0.00 0.00 56.93 55.72 1nbw s PHE 487 Cb -0.13 -1.79 0.38 0.00 0.51 0.00 0.00 43.02 41.98 1nbw s PHE 487 CO 0.11 -0.35 1.13 0.54 0.70 0.00 0.00 175.22 177.35 1nbw n ARG 488 N 3.62 0.09 -4.39 0.44 1.74 -1.26 -4.58 116.66 112.32 1nbw n ARG 488 Ca -0.19 0.24 -0.19 0.00 -0.77 0.00 0.00 57.85 56.94 1nbw n ARG 488 Cb 0.53 -1.50 -0.15 0.00 -1.02 0.00 0.00 32.46 30.32 1nbw n ARG 488 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1nbw s GLU 489 N -2.65 0.77 0.31 5.56 2.02 -1.26 -5.12 118.70 118.34 1nbw s GLU 489 Ca 0.07 -0.34 -0.29 0.00 0.02 0.00 0.00 54.97 54.43 1nbw s GLU 489 Cb 0.05 -0.75 -0.13 0.00 0.10 0.00 0.00 34.13 33.41 1nbw s GLU 489 CO 0.12 0.20 1.27 0.00 0.02 0.00 0.00 175.26 176.87 1nbw n ALA 490 N 2.86 0.98 -1.61 5.21 0.00 -1.26 -4.84 120.51 121.86 1nbw n ALA 490 Ca -0.14 0.38 -0.29 0.00 0.00 0.00 0.00 53.44 53.39 1nbw n ALA 490 Cb 0.57 -2.22 0.12 0.00 0.00 0.00 0.00 19.45 17.92 1nbw n ALA 490 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1nbw s LEU 491 N -0.52 2.19 0.35 0.00 1.43 0.20 -5.02 118.68 117.31 1nbw s LEU 491 Ca 0.59 0.99 -0.25 0.00 -1.03 0.00 0.00 54.13 54.42 1nbw s LEU 491 Cb -0.61 -3.39 -0.10 0.00 0.03 0.00 0.00 46.19 42.12 1nbw s LEU 491 CO 0.59 -2.34 0.98 -0.55 0.23 0.00 0.00 176.35 175.27 1nbw s SER 492 N -4.11 7.15 0.52 2.29 0.15 -1.26 -4.95 113.70 113.48 1nbw s SER 492 Ca 0.63 1.90 0.16 0.00 0.70 0.00 0.00 55.95 59.34 1nbw s SER 492 Cb -0.14 -2.58 1.26 0.00 -1.71 0.00 0.00 66.02 62.84 1nbw s SER 492 CO 0.53 -0.21 2.14 -0.65 1.20 0.00 0.00 173.24 176.25 1nbw h PRO 493 N 2.93 0.02 0.00 5.44 0.11 -1.99 -2.11 132.00 136.41 1nbw h PRO 493 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1nbw h PRO 493 Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1nbw h PRO 493 CO 0.64 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.45 1nbw n ALA 494 N -2.54 1.41 0.35 -0.75 0.00 -1.26 -2.29 120.51 115.43 1nbw n ALA 494 Ca -0.02 0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.56 1nbw n ALA 494 Cb 0.11 -1.31 0.03 0.00 0.00 0.00 0.00 19.45 18.28 1nbw n ALA 494 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1nbw n VAL 495 N -2.09 0.00 -1.68 0.00 0.24 -0.80 -4.77 118.33 109.24 1nbw n VAL 495 Ca 0.01 -0.50 -0.45 0.00 -2.04 0.00 0.00 64.34 61.37 1nbw n VAL 495 Cb 0.14 1.17 -0.04 0.00 -1.47 0.00 0.00 33.84 33.64 1nbw n VAL 495 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1nbw n PHE 496 N 0.43 2.45 -1.11 6.34 -0.00 -0.97 -1.88 117.46 122.73 1nbw n PHE 496 Ca 0.05 -0.10 -0.04 0.00 -0.00 0.00 0.00 57.45 57.36 1nbw n PHE 496 Cb 0.21 -2.70 -0.02 0.00 -0.00 0.00 0.00 39.48 36.97 1nbw n PHE 496 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1nbw n ALA 497 N 6.15 -0.06 -2.86 3.13 0.00 -1.11 -4.97 120.51 120.79 1nbw n ALA 497 Ca 0.20 0.06 -0.27 0.00 0.00 0.00 0.00 53.44 53.43 1nbw n ALA 497 Cb 0.34 -1.42 -0.04 0.00 0.00 0.00 0.00 19.45 18.32 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 -2.11 3.16 0.32 0.00 1.02 -0.79 -4.86 119.74 116.48 1nbw s LYS 498 Ca 0.00 -0.71 -0.27 0.00 0.02 0.00 0.00 55.97 55.01 1nbw s LYS 498 Cb 0.00 -2.81 -0.10 0.00 -0.52 0.00 0.00 37.83 34.40 1nbw s LYS 498 CO 0.00 0.52 0.98 0.08 -0.92 0.00 0.00 175.35 176.01 1nbw s VAL 499 N -1.70 4.00 0.08 3.17 1.01 -1.26 -2.67 120.40 123.03 1nbw s VAL 499 Ca 0.33 1.72 0.02 0.00 0.00 0.00 0.00 61.98 64.05 1nbw s VAL 499 Cb -0.11 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 1nbw s VAL 499 CO 0.26 0.19 -0.07 -0.69 0.00 0.00 0.00 175.10 174.79 1nbw s VAL 500 N -1.51 0.62 0.03 2.92 1.01 0.20 -1.88 120.40 121.79 1nbw s VAL 500 Ca 0.50 -1.62 0.06 0.00 0.00 0.00 0.00 61.98 60.92 1nbw s VAL 500 Cb -0.22 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 1nbw s VAL 500 CO 0.28 -0.70 -0.17 -0.72 0.00 0.00 0.00 175.10 173.79 1nbw s TYR 501 N -2.82 2.60 -0.30 5.22 -0.85 -0.48 -1.10 117.35 119.62 1nbw s TYR 501 Ca 0.04 -0.23 -0.10 0.00 -0.52 0.00 0.00 57.07 56.26 1nbw s TYR 501 Cb -0.00 -1.50 -0.02 0.00 0.38 0.00 0.00 41.96 40.83 1nbw s TYR 501 CO -0.03 0.25 0.16 0.42 -1.52 0.00 0.00 175.55 174.82 1nbw s ILE 502 N -0.90 4.73 -0.51 -3.49 -1.09 0.49 -1.47 121.20 118.96 1nbw s ILE 502 Ca 0.14 -0.30 0.04 0.00 -2.23 0.00 0.00 60.65 58.30 1nbw s ILE 502 Cb -0.11 -3.37 0.13 0.00 -1.58 0.00 0.00 42.46 37.53 1nbw s ILE 502 CO 0.05 0.11 0.26 -0.75 -1.23 0.00 0.00 174.94 173.38 1nbw s LYS 503 N 1.64 1.86 -0.45 2.79 2.20 -0.92 -4.27 119.74 122.59 1nbw s LYS 503 Ca 0.05 -2.52 -0.02 0.00 -0.36 0.00 0.00 55.97 53.12 1nbw s LYS 503 Cb -0.17 -3.15 -0.03 0.00 -1.51 0.00 0.00 37.83 32.98 1nbw s LYS 503 CO 0.07 -1.12 0.40 0.39 -0.36 0.00 0.00 175.35 174.73 1nbw n GLU 504 N 3.17 -0.96 0.00 4.03 1.02 -1.26 -3.39 120.64 123.25 1nbw n GLU 504 Ca 0.06 0.47 0.00 0.00 -0.02 0.00 0.00 57.16 57.67 1nbw n GLU 504 Cb 0.32 -3.45 0.00 0.00 -0.02 0.00 0.00 31.44 28.29 1nbw n GLU 504 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nbw n GLY 505 N -1.37 0.36 3.66 0.62 0.00 -1.26 -4.92 105.19 102.27 1nbw n GLY 505 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1nbw n GLY 505 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nbw s GLU 506 N 0.00 4.16 -0.16 1.61 2.12 -1.22 -5.05 118.70 120.16 1nbw s GLU 506 Ca 0.00 0.29 -0.29 0.00 0.36 0.00 0.00 54.97 55.34 1nbw s GLU 506 Cb 0.00 -3.57 -0.00 0.00 0.26 0.00 0.00 34.13 30.82 1nbw s GLU 506 CO 0.00 -0.14 0.99 -0.51 -0.54 0.00 0.00 175.26 175.06 1nbw s LEU 507 N 1.62 4.18 -0.14 2.70 1.02 -1.26 -2.16 118.68 124.65 1nbw s LEU 507 Ca 0.21 1.42 0.01 0.00 0.02 0.00 0.00 54.13 55.79 1nbw s LEU 507 Cb -0.15 -3.49 -0.00 0.00 0.02 0.00 0.00 46.19 42.56 1nbw s LEU 507 CO 0.09 -0.51 -0.17 -0.69 0.02 0.00 0.00 176.35 175.09 1nbw s VAL 508 N 2.44 2.62 0.30 -1.59 1.01 -0.54 -4.96 120.40 119.68 1nbw s VAL 508 Ca 0.45 -0.80 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 1nbw s VAL 508 Cb -0.17 -2.08 -0.10 0.00 0.00 0.00 0.00 36.38 34.03 1nbw s VAL 508 CO 0.13 0.53 1.22 -2.16 0.00 0.00 0.00 175.10 174.82 1nbw s PRO 509 N 0.60 4.47 -0.34 2.72 0.04 -1.26 -1.38 135.00 139.85 1nbw s PRO 509 Ca -0.10 2.04 -0.02 0.00 0.04 0.00 0.00 61.00 62.97 1nbw s PRO 509 Cb -0.16 -3.13 0.08 0.00 0.04 0.00 0.00 34.50 31.33 1nbw s PRO 509 CO 0.03 -0.03 0.08 0.42 0.04 0.00 0.00 177.00 177.54 1nbw s ILE 510 N -1.06 3.03 -1.19 0.56 1.01 -0.79 -4.93 121.20 117.82 1nbw s ILE 510 Ca 0.48 -1.72 -0.21 0.00 0.00 0.00 0.00 60.65 59.20 1nbw s ILE 510 Cb -0.36 -2.91 0.01 0.00 0.01 0.00 0.00 42.46 39.21 1nbw s ILE 510 CO 0.47 -0.37 1.77 -1.81 0.00 0.00 0.00 174.94 175.00 1nbw s ASP 511 N 1.42 6.15 -0.25 3.58 1.11 -1.26 -4.56 116.67 122.87 1nbw s ASP 511 Ca 0.01 -1.94 -0.26 0.00 0.18 0.00 0.00 52.55 50.55 1nbw s ASP 511 Cb -0.21 -2.58 0.08 0.00 1.07 0.00 0.00 42.92 41.28 1nbw s ASP 511 CO -0.03 -1.88 0.77 0.21 1.18 0.00 0.00 175.17 175.42 1nbw s ASN 512 N 5.27 -0.69 0.47 0.27 2.47 -1.26 -4.98 114.94 116.50 1nbw s ASN 512 Ca 0.58 1.27 0.27 0.00 0.42 0.00 0.00 52.86 55.39 1nbw s ASN 512 Cb 0.01 1.26 1.04 0.00 -1.45 0.00 0.00 41.25 42.12 1nbw s ASN 512 CO 0.06 -0.27 1.87 0.00 -3.72 0.00 0.00 177.10 175.04 1nbw h ALA 513 N 4.63 1.02 -2.78 1.71 0.00 -1.92 -3.46 119.26 118.47 1nbw h ALA 513 Ca -0.28 -0.14 -0.53 0.00 0.00 0.00 0.00 54.91 53.96 1nbw h ALA 513 Cb 1.16 -0.02 0.07 0.00 0.00 0.00 0.00 17.79 19.00 1nbw h ALA 513 CO 0.10 0.19 0.86 -1.54 0.00 0.00 0.00 179.25 178.86 1nbw s SER 514 N -6.05 6.45 1.09 0.00 1.04 -1.26 -4.97 113.70 109.99 1nbw s SER 514 Ca 0.01 2.87 -0.13 0.00 0.48 0.00 0.00 55.95 59.17 1nbw s SER 514 Cb 0.10 -2.63 0.24 0.00 0.10 0.00 0.00 66.02 63.83 1nbw s SER 514 CO 0.61 -0.86 1.07 -2.16 0.98 0.00 0.00 173.24 172.87 1nbw s PRO 515 N -0.36 -0.32 0.35 4.02 0.04 -1.26 -4.79 135.00 132.68 1nbw s PRO 515 Ca 0.63 0.55 0.04 0.00 0.04 0.00 0.00 61.00 62.26 1nbw s PRO 515 Cb -0.46 -1.65 0.64 0.00 0.04 0.00 0.00 34.50 33.07 1nbw s PRO 515 CO 0.46 -3.24 1.92 1.25 0.04 0.00 0.00 177.00 177.42 1nbw h LEU 516 N -2.27 0.52 -0.80 -3.56 6.46 -1.97 -2.34 115.31 111.35 1nbw h LEU 516 Ca -0.57 -0.08 -0.08 0.00 -0.12 0.00 0.00 57.88 57.04 1nbw h LEU 516 Cb 1.33 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 41.11 1nbw h LEU 516 CO 0.54 0.53 0.07 -0.33 -0.62 0.00 0.00 178.44 178.63 1nbw h GLU 517 N 0.56 0.97 -0.19 1.25 3.07 -1.99 -1.23 114.58 117.01 1nbw h GLU 517 Ca 0.13 -0.26 -0.08 0.00 -0.50 0.00 0.00 59.36 58.65 1nbw h GLU 517 Cb 0.22 -0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.02 1nbw h GLU 517 CO -0.00 0.92 -0.20 -0.22 -1.40 0.00 0.00 179.01 178.11 1nbw h LYS 518 N 0.91 0.47 -0.74 2.33 1.63 -1.85 -1.21 116.57 118.11 1nbw h LYS 518 Ca 0.18 -0.25 -0.03 0.00 -0.85 0.00 0.00 60.65 59.70 1nbw h LYS 518 Cb 0.44 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.04 1nbw h LYS 518 CO 0.01 0.83 0.33 0.82 -3.45 0.00 0.00 179.45 177.99 1nbw h ILE 519 N 0.14 1.24 -0.16 2.00 2.04 -1.32 -0.40 117.51 121.05 1nbw h ILE 519 Ca 0.03 -0.71 -0.03 0.00 1.00 0.00 0.00 64.86 65.15 1nbw h ILE 519 Cb 0.74 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1nbw h ILE 519 CO 0.05 0.29 -0.02 -0.09 0.00 0.00 0.00 178.15 178.39 1nbw h ARG 520 N 1.06 0.30 -0.09 2.37 2.43 -1.14 -1.98 114.38 117.32 1nbw h ARG 520 Ca 0.25 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.34 1nbw h ARG 520 Cb 0.14 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1nbw h ARG 520 CO -0.03 0.55 -0.04 1.25 -1.51 0.00 0.00 179.97 180.19 1nbw h LEU 521 N 0.02 -0.13 -1.05 3.80 5.85 -0.87 -1.33 115.31 121.59 1nbw h LEU 521 Ca 0.04 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1nbw h LEU 521 Cb 0.42 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1nbw h LEU 521 CO 0.01 -0.05 0.55 0.58 -0.34 0.00 0.00 178.44 179.19 1nbw h VAL 522 N -0.03 1.24 -0.07 1.05 2.07 -1.09 -0.68 116.25 118.75 1nbw h VAL 522 Ca 0.05 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 1nbw h VAL 522 Cb 0.10 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 29.84 1nbw h VAL 522 CO -0.11 0.25 0.03 -0.09 0.02 0.00 0.00 177.57 177.67 1nbw h ARG 523 N 1.22 0.10 -0.36 1.57 2.43 -0.88 -0.82 114.38 117.63 1nbw h ARG 523 Ca 0.32 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.41 1nbw h ARG 523 Cb -0.07 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1nbw h ARG 523 CO -0.06 0.21 -0.01 0.00 -1.51 0.00 0.00 179.97 178.60 1nbw h ARG 524 N -0.03 0.65 -0.57 0.20 3.08 -1.00 -2.70 114.38 113.99 1nbw h ARG 524 Ca 0.02 -0.21 0.01 0.00 0.07 0.00 0.00 59.98 59.88 1nbw h ARG 524 Cb 0.15 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 1nbw h ARG 524 CO -0.00 0.76 0.37 1.96 -1.07 0.00 0.00 179.97 181.99 1nbw h GLN 525 N 0.46 0.73 -0.86 0.04 4.20 -1.10 -0.91 115.11 117.66 1nbw h GLN 525 Ca 0.10 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.80 1nbw h GLN 525 Cb 0.47 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 28.04 1nbw h GLN 525 CO 0.02 0.48 0.57 0.00 -0.67 0.00 0.00 178.83 179.23 1nbw h ALA 526 N 1.22 1.45 -0.17 3.87 0.00 -1.07 0.47 119.26 125.03 1nbw h ALA 526 Ca 0.22 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1nbw h ALA 526 Cb -0.05 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.43 1nbw h ALA 526 CO -0.06 0.47 -0.20 0.87 0.00 0.00 0.00 179.25 180.32 1nbw h LYS 527 N 1.09 0.44 0.21 0.00 1.57 -1.05 -2.79 116.57 116.04 1nbw h LYS 527 Ca 0.34 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1nbw h LYS 527 Cb 0.01 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1nbw h LYS 527 CO -0.10 0.82 -0.10 0.93 -0.57 0.00 0.00 179.45 180.43 1nbw h GLU 528 N 0.09 -0.27 -0.71 3.15 5.08 -0.83 -0.68 114.58 120.40 1nbw h GLU 528 Ca 0.02 0.02 0.19 0.00 -1.00 0.00 0.00 59.36 58.59 1nbw h GLU 528 Cb 0.75 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.03 1nbw h GLU 528 CO 0.05 -0.08 0.50 0.87 -1.00 0.00 0.00 179.01 179.35 1nbw h LYS 529 N -0.41 0.09 0.00 2.33 1.57 -0.97 -0.79 116.57 118.40 1nbw h LYS 529 Ca -0.03 -0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.50 1nbw h LYS 529 Cb 0.31 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 1nbw h LYS 529 CO 0.05 0.06 -1.59 0.28 -0.57 0.00 0.00 179.45 177.67 1nbw n VAL 530 N -4.37 1.51 0.06 0.50 0.31 -1.05 -4.29 118.33 111.00 1nbw n VAL 530 Ca 0.14 -0.10 -0.16 0.00 -0.01 0.00 0.00 64.34 64.21 1nbw n VAL 530 Cb 0.72 -2.09 -0.14 0.00 -0.91 0.00 0.00 33.84 31.42 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 -1.00 0.41 -0.39 3.52 -1.00 -1.14 -2.41 116.94 114.93 1nbw h PHE 531 Ca -0.37 -0.30 -0.12 0.00 2.81 0.00 0.00 57.97 59.99 1nbw h PHE 531 Cb 1.25 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.78 1nbw h PHE 531 CO -0.12 1.35 -0.21 0.28 -1.61 0.00 0.00 178.31 178.00 1nbw h VAL 532 N 0.06 1.28 -0.40 -0.55 2.07 -1.23 -1.45 116.25 116.02 1nbw h VAL 532 Ca -0.23 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 65.94 1nbw h VAL 532 Cb 2.00 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 33.06 1nbw h VAL 532 CO 0.16 0.45 0.26 0.74 0.02 0.00 0.00 177.57 179.20 1nbw h THR 533 N 0.65 1.11 -0.03 2.57 2.02 -1.62 -2.19 112.91 115.41 1nbw h THR 533 Ca 0.09 -0.20 -0.13 0.00 0.77 0.00 0.00 66.41 66.93 1nbw h THR 533 Cb 0.77 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 1nbw h THR 533 CO 0.06 0.10 -0.58 0.78 0.37 0.00 0.00 175.52 176.26 1nbw h ASN 534 N 0.54 0.12 -0.26 4.18 2.35 -1.34 -1.64 115.58 119.53 1nbw h ASN 534 Ca 0.15 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.80 1nbw h ASN 534 Cb -0.05 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 1nbw h ASN 534 CO -0.03 0.67 0.06 0.00 -1.65 0.00 0.00 177.43 176.48 1nbw h LEU 536 N 0.25 0.85 -0.59 0.00 3.38 -1.33 -2.01 115.31 115.86 1nbw h LEU 536 Ca 0.08 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1nbw h LEU 536 Cb 0.29 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1nbw h LEU 536 CO 0.00 0.76 0.20 0.03 0.09 0.00 0.00 178.44 179.53 1nbw h ARG 537 N 0.92 0.91 -0.30 1.13 3.08 -0.95 -0.85 114.38 118.31 1nbw h ARG 537 Ca 0.22 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1nbw h ARG 537 Cb 0.18 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1nbw h ARG 537 CO -0.02 0.80 0.14 0.00 -1.07 0.00 0.00 179.97 179.82 1nbw h ALA 538 N 1.06 0.39 0.00 0.04 0.00 -0.78 -2.72 119.26 117.26 1nbw h ALA 538 Ca 0.19 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1nbw h ALA 538 Cb 0.26 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1nbw h ALA 538 CO -0.01 -0.03 -0.07 -0.07 0.00 0.00 0.00 179.25 179.06 1nbw h LEU 539 N 0.35 0.00 0.00 0.00 3.38 -1.23 -3.02 115.31 114.79 1nbw h LEU 539 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1nbw h LEU 539 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1nbw h LEU 539 CO -0.01 0.07 -0.33 0.03 0.09 0.00 0.00 178.44 178.29 1nbw h ARG 540 N 0.00 0.00 -0.82 1.13 3.08 -0.90 -3.32 114.38 113.54 1nbw h ARG 540 Ca -0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.58 1nbw h ARG 540 Cb 0.66 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 30.45 1nbw h ARG 540 CO 0.01 0.00 0.43 0.00 -1.07 0.00 0.00 179.97 179.34 1nbw n GLN 541 N -2.63 2.32 0.00 0.04 10.64 -1.05 -4.12 117.38 122.58 1nbw n GLN 541 Ca 0.03 -3.19 0.11 0.00 -1.83 0.00 0.00 57.00 52.12 1nbw n GLN 541 Cb 0.49 -2.12 -0.00 0.00 -0.86 0.00 0.00 30.24 27.75 1nbw n GLN 541 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 1nbw n VAL 542 N -1.07 0.00 0.00 -0.39 0.31 -1.25 -4.95 118.33 110.98 1nbw n VAL 542 Ca 0.53 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.59 1nbw n VAL 542 Cb 1.26 1.25 0.00 0.00 -0.91 0.00 0.00 33.84 35.44 1nbw n VAL 542 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1nbw n SER 543 N -0.02 0.00 -4.39 4.52 3.41 -1.26 -5.12 113.62 110.76 1nbw n SER 543 Ca 0.09 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.38 1nbw n SER 543 Cb 0.45 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.57 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 -0.13 -1.22 0.00 4.33 -0.04 -1.26 -3.60 135.00 133.08 1nbw n PRO 544 Ca 0.00 -0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.14 1nbw n PRO 544 Cb 0.00 -1.88 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 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 1.54 2.95 0.00 0.55 0.00 -1.26 -4.68 105.19 104.30 1nbw n GLY 545 Ca 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 2.53 0.00 -0.02 0.00 -1.24 -5.00 105.19 101.46 1nbw n GLY 546 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1nbw n GLY 546 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nbw n SER 547 N 1.54 0.00 0.25 1.61 7.64 -1.26 -4.42 113.62 118.98 1nbw n SER 547 Ca 0.00 0.00 0.16 0.00 1.01 0.00 0.00 58.87 60.04 1nbw n SER 547 Cb 0.00 0.00 0.66 0.00 -1.01 0.00 0.00 64.21 63.86 1nbw n SER 547 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1nbw h ILE 548 N 0.00 0.00 0.00 0.44 3.07 -1.94 -2.28 117.51 116.80 1nbw h ILE 548 Ca 0.00 -0.45 0.00 0.00 1.55 0.00 0.00 64.86 65.96 1nbw h ILE 548 Cb 0.00 1.40 0.00 0.00 -0.27 0.00 0.00 36.82 37.95 1nbw h ILE 548 CO 0.00 0.00 0.00 -2.11 -1.05 0.00 0.00 178.15 174.99 1nbw n ARG 549 N -2.93 0.52 0.29 0.16 1.85 -1.26 -2.01 116.66 113.28 1nbw n ARG 549 Ca 0.01 0.00 0.18 0.00 -1.00 0.00 0.00 57.85 57.04 1nbw n ARG 549 Cb 0.29 -1.46 0.85 0.00 -1.05 0.00 0.00 32.46 31.09 1nbw n ARG 549 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1nbw h ASP 550 N 0.00 0.00 -3.64 2.89 3.32 -1.77 -3.38 116.42 113.84 1nbw h ASP 550 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 1nbw h ASP 550 Cb 0.00 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 39.36 1nbw h ASP 550 CO 0.00 0.02 -0.58 -0.63 -1.72 0.00 0.00 179.24 176.33 1nbw s ILE 551 N -3.87 4.70 -0.02 0.35 -1.09 -0.85 -4.80 121.20 115.62 1nbw s ILE 551 Ca -0.01 -0.04 -0.16 0.00 -2.23 0.00 0.00 60.65 58.21 1nbw s ILE 551 Cb 0.11 -3.20 -0.33 0.00 -1.58 0.00 0.00 42.46 37.46 1nbw s ILE 551 CO 0.51 0.34 0.84 0.00 -1.23 0.00 0.00 174.94 175.40 1nbw h ALA 552 N 7.94 -0.03 -4.15 9.38 0.00 -1.55 -3.45 119.26 127.40 1nbw h ALA 552 Ca -0.37 -0.93 -0.63 0.00 0.00 0.00 0.00 54.91 52.98 1nbw h ALA 552 Cb 1.18 0.27 -0.26 0.00 0.00 0.00 0.00 17.79 18.98 1nbw h ALA 552 CO 0.60 0.73 -0.86 -0.06 0.00 0.00 0.00 179.25 179.66 1nbw s PHE 553 N -2.55 2.03 -0.10 0.00 0.40 -1.02 -0.81 117.98 115.93 1nbw s PHE 553 Ca -0.13 -0.39 -0.00 0.00 -0.60 0.00 0.00 56.93 55.81 1nbw s PHE 553 Cb 0.04 -1.21 0.02 0.00 0.51 0.00 0.00 43.02 42.39 1nbw s PHE 553 CO 0.88 0.11 -0.06 0.08 0.70 0.00 0.00 175.22 176.94 1nbw s VAL 554 N -0.82 0.85 -0.24 -0.44 1.01 0.20 -1.07 120.40 119.89 1nbw s VAL 554 Ca 0.09 -0.19 -0.07 0.00 0.00 0.00 0.00 61.98 61.81 1nbw s VAL 554 Cb -0.09 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 1nbw s VAL 554 CO 0.02 0.33 0.06 -0.69 0.00 0.00 0.00 175.10 174.82 1nbw s VAL 555 N 1.67 4.28 -0.09 2.92 1.01 0.40 -2.39 120.40 128.20 1nbw s VAL 555 Ca 0.03 -0.19 -0.17 0.00 0.00 0.00 0.00 61.98 61.65 1nbw s VAL 555 Cb -0.13 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 1nbw s VAL 555 CO -0.06 0.36 0.45 -0.76 0.00 0.00 0.00 175.10 175.08 1nbw s LEU 556 N 1.49 4.33 0.30 3.92 1.43 0.44 -1.07 118.68 129.51 1nbw s LEU 556 Ca 0.06 0.84 0.03 0.00 -1.03 0.00 0.00 54.13 54.03 1nbw s LEU 556 Cb -0.15 -2.65 -0.03 0.00 0.03 0.00 0.00 46.19 43.40 1nbw s LEU 556 CO 0.03 0.10 0.27 0.54 0.23 0.00 0.00 176.35 177.52 1nbw s VAL 557 N 0.13 0.00 0.00 -1.59 0.11 0.33 0.47 120.40 119.85 1nbw s VAL 557 Ca 0.25 -1.93 0.00 0.00 -2.93 0.00 0.00 61.98 57.36 1nbw s VAL 557 Cb -0.15 -2.51 0.00 0.00 -1.53 0.00 0.00 36.38 32.19 1nbw s VAL 557 CO 0.11 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.49 1nbw n GLY 558 N -0.52 0.61 0.23 6.54 0.00 -1.22 -0.24 105.19 110.60 1nbw n GLY 558 Ca 0.05 -1.82 0.01 0.00 0.00 0.00 0.00 46.02 44.26 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 0.68 1.57 -0.02 0.00 -1.83 -0.73 103.07 102.74 1nbw h GLY 559 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1nbw h GLY 559 CO 0.00 -0.18 0.00 1.44 0.00 0.00 0.00 176.54 177.80 1nbw n SER 560 N -5.25 0.00 -0.08 0.19 7.64 -0.40 -2.22 113.62 113.50 1nbw n SER 560 Ca 0.09 -0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.12 1nbw n SER 560 Cb 0.35 -0.29 0.69 0.00 -1.01 0.00 0.00 64.21 63.96 1nbw n SER 560 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1nbw n SER 561 N -1.29 0.33 -1.19 6.43 3.41 -0.28 -2.59 113.62 118.43 1nbw n SER 561 Ca 0.10 -0.56 0.12 0.00 -0.26 0.00 0.00 58.87 58.26 1nbw n SER 561 Cb 0.16 -0.11 0.24 0.00 -0.26 0.00 0.00 64.21 64.23 1nbw n SER 561 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1nbw n LEU 562 N -1.00 3.57 -4.77 1.04 4.77 -0.94 -4.73 117.00 114.94 1nbw n LEU 562 Ca 0.16 -1.61 -0.34 0.00 -0.03 0.00 0.00 56.01 54.19 1nbw n LEU 562 Cb 0.25 -0.30 0.02 0.00 -2.33 0.00 0.00 43.42 41.06 1nbw n LEU 562 CO 0.22 0.80 0.78 -0.62 -1.33 0.00 0.00 177.39 177.24 1nbw s ASP 563 N -1.38 5.44 0.00 -1.43 2.15 -1.07 -4.91 116.67 115.47 1nbw s ASP 563 Ca 0.41 2.15 0.28 0.00 0.43 0.00 0.00 52.55 55.81 1nbw s ASP 563 Cb 0.23 -2.57 1.57 0.00 -0.30 0.00 0.00 42.92 41.84 1nbw s ASP 563 CO 0.32 -1.41 1.98 2.22 -0.17 0.00 0.00 175.17 178.11 1nbw n PHE 564 N -1.70 0.00 0.00 -5.34 1.16 -1.26 -4.23 117.46 106.09 1nbw n PHE 564 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.69 1nbw n PHE 564 Cb 0.51 -0.09 0.00 0.00 -1.61 0.00 0.00 39.48 38.29 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 -1.09 0.00 -0.25 3.97 1.02 -1.26 -4.87 120.64 118.15 1nbw n GLU 565 Ca 0.18 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.34 1nbw n GLU 565 Cb 0.13 -0.70 0.09 0.00 -0.02 0.00 0.00 31.44 30.94 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 0.26 -0.05 -3.67 2.04 -1.85 -0.84 117.51 113.40 1nbw h ILE 566 Ca 0.00 -0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1nbw h ILE 566 Cb 0.41 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1nbw h ILE 566 CO 0.00 0.00 0.03 -0.65 0.00 0.00 0.00 178.15 177.53 1nbw h PRO 567 N 0.00 0.07 -0.50 2.37 0.11 -1.83 -2.42 132.00 129.80 1nbw h PRO 567 Ca 0.35 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.52 1nbw h PRO 567 Cb 0.54 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 31.58 1nbw h PRO 567 CO -0.76 0.08 0.21 1.96 -0.21 0.00 0.00 178.00 179.28 1nbw h GLN 568 N 0.04 0.39 -0.88 1.05 7.50 -1.74 0.46 115.11 121.92 1nbw h GLN 568 Ca 0.02 -0.02 0.12 0.00 0.50 0.00 0.00 58.65 59.26 1nbw h GLN 568 Cb 0.03 -0.09 -0.08 0.00 0.05 0.00 0.00 27.48 27.39 1nbw h GLN 568 CO -0.00 0.26 0.51 -0.07 -1.50 0.00 0.00 178.83 178.03 1nbw h LEU 569 N 0.40 0.71 -0.49 1.46 3.38 -0.98 0.16 115.31 119.95 1nbw h LEU 569 Ca 0.24 0.06 -0.16 0.00 0.09 0.00 0.00 57.88 58.10 1nbw h LEU 569 Cb 0.22 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1nbw h LEU 569 CO -0.22 0.37 -0.58 0.40 0.09 0.00 0.00 178.44 178.51 1nbw h ILE 570 N 0.81 1.33 -0.20 1.22 2.04 -0.82 -1.61 117.51 120.27 1nbw h ILE 570 Ca 0.44 -1.84 -0.00 0.00 1.00 0.00 0.00 64.86 64.46 1nbw h ILE 570 Cb 0.48 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 1nbw h ILE 570 CO -0.28 0.57 0.12 0.74 0.00 0.00 0.00 178.15 179.30 1nbw h THR 571 N 0.41 1.08 0.90 -0.27 2.02 0.64 -1.30 112.91 116.39 1nbw h THR 571 Ca 0.00 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 66.93 1nbw h THR 571 Cb 1.13 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 1nbw h THR 571 CO 0.11 0.08 -0.47 -0.08 0.37 0.00 0.00 175.52 175.53 1nbw h GLU 572 N 0.24 -1.21 -0.13 6.66 4.57 -0.68 -2.33 114.58 121.70 1nbw h GLU 572 Ca 0.07 0.08 0.04 0.00 -1.18 0.00 0.00 59.36 58.38 1nbw h GLU 572 Cb 0.03 0.28 -0.05 0.00 -0.16 0.00 0.00 28.75 28.84 1nbw h GLU 572 CO -0.01 -0.81 -0.21 0.00 -1.18 0.00 0.00 179.01 176.80 1nbw h ALA 573 N -1.19 -0.16 0.00 2.92 0.00 -1.26 -2.62 119.26 116.95 1nbw h ALA 573 Ca -0.12 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1nbw h ALA 573 Cb 0.98 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1nbw h ALA 573 CO 0.17 -0.66 0.00 -0.07 0.00 0.00 0.00 179.25 178.69 1nbw h LEU 574 N -0.26 0.00 -1.58 0.00 3.38 -1.28 -3.00 115.31 112.56 1nbw h LEU 574 Ca 0.10 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1nbw h LEU 574 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1nbw h LEU 574 CO -0.28 0.00 -0.21 0.77 0.09 0.00 0.00 178.44 178.81 1nbw h SER 575 N 0.00 0.00 0.38 -0.43 4.64 -1.01 -1.80 113.55 115.33 1nbw h SER 575 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1nbw h SER 575 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1nbw h SER 575 CO 0.00 0.21 0.00 1.41 -0.87 0.00 0.00 176.83 177.58 1nbw n HIS 576 N -4.26 0.22 -0.17 4.77 8.25 -1.13 -0.75 115.22 122.14 1nbw n HIS 576 Ca -0.02 0.09 0.07 0.00 -0.26 0.00 0.00 57.72 57.60 1nbw n HIS 576 Cb 0.27 -0.65 0.17 0.00 1.12 0.00 0.00 29.99 30.90 1nbw n HIS 576 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1nbw n TYR 577 N -1.71 0.52 -1.69 4.41 4.02 -0.73 -4.95 117.16 117.04 1nbw n TYR 577 Ca 0.02 -0.48 -0.09 0.00 -0.01 0.00 0.00 57.90 57.34 1nbw n TYR 577 Cb 0.13 -0.02 -0.02 0.00 -0.02 0.00 0.00 39.34 39.40 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 0.69 0.57 3.75 2.72 0.00 0.07 -4.57 105.19 108.42 1nbw n GLY 578 Ca 0.13 -0.57 -0.36 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.39 4.85 -0.17 1.61 1.01 -0.88 -4.93 120.40 119.50 1nbw s VAL 579 Ca 0.00 -0.04 -0.18 0.00 0.00 0.00 0.00 61.98 61.76 1nbw s VAL 579 Cb 0.00 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 1nbw s VAL 579 CO 0.00 0.58 0.50 -0.69 0.00 0.00 0.00 175.10 175.49 1nbw s VAL 580 N -0.69 5.14 0.02 2.92 1.01 0.01 -3.61 120.40 125.18 1nbw s VAL 580 Ca 0.12 0.95 0.00 0.00 0.00 0.00 0.00 61.98 63.05 1nbw s VAL 580 Cb -0.12 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 1nbw s VAL 580 CO 0.02 0.23 -0.03 0.00 0.00 0.00 0.00 175.10 175.33 1nbw s ALA 581 N 1.25 0.17 0.00 5.51 0.00 -1.26 0.60 121.76 128.03 1nbw s ALA 581 Ca 0.25 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.80 1nbw s ALA 581 Cb -0.15 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.04 1nbw s ALA 581 CO 0.10 -0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.20 1nbw n GLY 582 N 2.13 0.08 3.73 0.00 0.00 -1.00 -4.43 105.19 105.69 1nbw n GLY 582 Ca -0.19 -0.90 -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 4.21 0.80 1.61 0.74 -1.26 -0.42 119.66 123.34 1nbw s GLN 583 Ca 0.00 2.39 -0.11 0.00 0.05 0.00 0.00 55.36 57.69 1nbw s GLN 583 Cb 0.00 -3.12 0.07 0.00 1.10 0.00 0.00 33.01 31.06 1nbw s GLN 583 CO 0.00 -0.57 1.09 0.20 -0.55 0.00 0.00 175.29 175.46 1nbw s GLY 584 N 0.87 1.67 -0.45 2.59 0.00 0.18 -4.72 107.32 107.45 1nbw s GLY 584 Ca 0.67 0.24 0.06 0.00 0.00 0.00 0.00 44.72 45.69 1nbw s GLY 584 CO 0.36 0.61 0.56 -2.01 0.00 0.00 0.00 173.10 172.63 1nbw n ASN 585 N -3.62 -1.62 -4.68 1.64 5.15 -1.09 -0.98 115.26 110.05 1nbw n ASN 585 Ca 0.09 -2.72 -0.45 0.00 -0.60 0.00 0.00 54.58 50.90 1nbw n ASN 585 Cb 0.53 0.47 -0.04 0.00 -0.53 0.00 0.00 39.78 40.21 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 2.47 0.10 -1.12 -1.44 -0.00 -0.31 -1.24 119.36 117.82 1nbw n ILE 586 Ca 0.22 -0.02 -0.05 0.00 -0.00 0.00 0.00 62.75 62.89 1nbw n ILE 586 Cb 0.53 -1.66 -0.02 0.00 -0.00 0.00 0.00 39.64 38.49 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 3.42 -1.85 -0.98 0.38 1.74 -1.21 -1.40 116.66 116.76 1nbw n ARG 587 Ca 0.16 0.66 0.00 0.00 -0.77 0.00 0.00 57.85 57.90 1nbw n ARG 587 Cb 0.31 -5.05 0.00 0.00 -1.02 0.00 0.00 32.46 26.70 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 0.59 0.42 0.00 -0.13 0.00 -0.37 -4.78 105.19 100.93 1nbw n GLY 588 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.63 0.00 0.48 2.61 -2.24 -0.77 -4.90 114.28 106.83 1nbw n THR 589 Ca 0.00 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 1nbw n THR 589 Cb 0.11 0.68 0.08 0.00 -2.10 0.00 0.00 70.33 69.10 1nbw n THR 589 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nbw n GLU 590 N 0.00 0.35 0.00 -0.78 -0.58 -0.49 -4.99 120.64 114.15 1nbw n GLU 590 Ca 0.00 0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 1nbw n GLU 590 Cb 0.00 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.20 1nbw n GLU 590 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nbw n GLY 591 N 1.32 -0.78 2.29 0.62 0.00 -1.26 -4.07 105.19 103.31 1nbw n GLY 591 Ca 0.02 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.55 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 3.39 -3.83 1.61 -0.04 -0.16 -1.16 135.00 134.81 1nbw n PRO 592 Ca 0.00 -2.19 -0.09 0.00 -0.04 0.00 0.00 63.50 61.18 1nbw n PRO 592 Cb 0.00 -2.53 0.01 0.00 -0.04 0.00 0.00 33.50 30.95 1nbw n PRO 592 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1nbw s ARG 593 N 0.91 2.16 -1.45 0.54 1.70 -1.26 -3.41 118.95 118.14 1nbw s ARG 593 Ca 0.65 -1.38 0.00 0.00 -0.47 0.00 0.00 55.73 54.53 1nbw s ARG 593 Cb 0.23 0.62 0.00 0.00 -0.57 0.00 0.00 34.95 35.23 1nbw s ARG 593 CO -0.07 -1.00 0.00 -1.71 -1.08 0.00 0.00 175.30 171.44 1nbw n ASN 594 N -1.26 -4.65 0.29 -2.89 5.15 -1.26 -4.39 115.26 106.24 1nbw n ASN 594 Ca -0.07 0.24 -0.13 0.00 -0.60 0.00 0.00 54.58 54.02 1nbw n ASN 594 Cb 0.60 -3.56 -0.06 0.00 -0.53 0.00 0.00 39.78 36.23 1nbw n ASN 594 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nbw h ALA 595 N 0.23 -0.78 -0.08 5.20 0.00 -1.92 -1.51 119.26 120.40 1nbw h ALA 595 Ca -0.31 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 1nbw h ALA 595 Cb 1.05 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1nbw h ALA 595 CO 0.43 -0.74 0.03 0.28 0.00 0.00 0.00 179.25 179.25 1nbw h VAL 596 N -1.17 1.14 -0.77 0.00 2.07 -1.83 -1.31 116.25 114.38 1nbw h VAL 596 Ca -0.08 -0.41 0.15 0.00 0.82 0.00 0.00 66.70 67.18 1nbw h VAL 596 Cb 0.62 1.27 -0.10 0.00 -1.52 0.00 0.00 31.29 31.56 1nbw h VAL 596 CO 0.13 0.12 0.30 0.00 0.02 0.00 0.00 177.57 178.15 1nbw h ALA 597 N 0.88 1.09 -0.62 1.67 0.00 -1.87 0.10 119.26 120.50 1nbw h ALA 597 Ca 0.03 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1nbw h ALA 597 Cb 0.16 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1nbw h ALA 597 CO -0.00 -0.22 0.05 1.15 0.00 0.00 0.00 179.25 180.22 1nbw h THR 598 N 0.44 1.26 -0.73 0.00 2.02 -0.95 -1.72 112.91 113.23 1nbw h THR 598 Ca 0.43 -1.09 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 1nbw h THR 598 Cb 0.66 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 1nbw h THR 598 CO -0.42 0.40 0.44 1.23 0.37 0.00 0.00 175.52 177.54 1nbw h GLY 599 N 1.02 1.07 0.89 2.16 0.00 0.28 0.05 103.07 108.53 1nbw h GLY 599 Ca 0.18 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 1nbw h GLY 599 CO 0.02 0.43 -0.40 1.41 0.00 0.00 0.00 176.54 178.00 1nbw h LEU 600 N 1.00 -0.99 -0.55 3.11 3.38 -0.64 -1.37 115.31 119.24 1nbw h LEU 600 Ca 0.26 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.39 1nbw h LEU 600 Cb -0.03 0.28 -0.11 0.00 0.09 0.00 0.00 40.66 40.89 1nbw h LEU 600 CO -0.05 -0.64 -0.30 0.25 0.09 0.00 0.00 178.44 177.79 1nbw h LEU 601 N -1.03 -1.04 -1.13 1.67 5.85 -1.01 0.35 115.31 118.97 1nbw h LEU 601 Ca -0.09 0.21 0.11 0.00 0.84 0.00 0.00 57.88 58.95 1nbw h LEU 601 Cb 0.82 0.53 -0.07 0.00 0.37 0.00 0.00 40.66 42.30 1nbw h LEU 601 CO 0.11 -0.29 0.60 -0.07 -0.34 0.00 0.00 178.44 178.45 1nbw h LEU 602 N -0.16 0.85 -0.15 2.25 3.38 -0.84 0.24 115.31 120.89 1nbw h LEU 602 Ca 0.23 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.21 1nbw h LEU 602 Cb 0.53 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1nbw h LEU 602 CO -0.64 0.48 -0.01 0.00 0.09 0.00 0.00 178.44 178.36 1nbw h ALA 603 N 1.55 0.20 -0.34 1.53 0.00 0.69 -2.79 119.26 120.10 1nbw h ALA 603 Ca 0.45 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 55.21 1nbw h ALA 603 Cb 0.45 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1nbw h ALA 603 CO -0.21 -0.08 0.01 0.78 0.00 0.00 0.00 179.25 179.76 1nbw h GLY 604 N -0.01 0.34 1.75 0.00 0.00 0.31 -0.18 103.07 105.28 1nbw h GLY 604 Ca 0.04 0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.41 1nbw h GLY 604 CO 0.01 -0.07 0.11 1.46 0.00 0.00 0.00 176.54 178.06 1nbw h GLN 605 N 0.11 0.00 -0.02 4.80 4.20 -0.93 -3.51 115.11 119.76 1nbw h GLN 605 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1nbw h GLN 605 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1nbw h GLN 605 CO -0.26 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 177.90