#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pup n LEU 8 N 0.00 5.06 -4.67 2.45 7.94 -1.26 -4.93 117.00 121.58 2pup n LEU 8 Ca 0.00 -2.74 -0.43 0.00 -1.11 0.00 0.00 56.01 51.74 2pup n LEU 8 Cb 0.00 -0.61 -0.02 0.00 0.53 0.00 0.00 43.42 43.31 2pup n LEU 8 CO 0.00 0.71 0.95 -0.47 -1.11 0.00 0.00 177.39 177.47 2pup s TYR 9 N -2.38 3.21 -0.08 1.96 5.04 -1.26 -4.67 117.35 119.18 2pup s TYR 9 Ca 0.51 1.32 -0.00 0.00 -2.44 0.00 0.00 57.07 56.46 2pup s TYR 9 Cb 0.37 -3.34 0.02 0.00 0.35 0.00 0.00 41.96 39.36 2pup s TYR 9 CO 0.18 -0.91 -0.04 -1.21 -1.34 0.00 0.00 175.55 172.24 2pup s GLU 10 N 2.91 1.00 0.17 4.97 8.01 -1.26 -5.08 118.70 129.43 2pup s GLU 10 Ca 0.50 -0.09 -0.32 0.00 0.01 0.00 0.00 54.97 55.07 2pup s GLU 10 Cb -0.19 -1.14 -0.11 0.00 -4.31 0.00 0.00 34.13 28.38 2pup s GLU 10 CO 0.13 -0.21 1.65 0.99 0.01 0.00 0.00 175.26 177.83 2pup s THR 11 N 1.51 2.40 0.60 3.63 2.01 -1.26 -4.98 115.64 119.56 2pup s THR 11 Ca -0.01 0.25 -0.14 0.00 0.31 0.00 0.00 61.69 62.11 2pup s THR 11 Cb -0.13 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 2pup s THR 11 CO -0.04 0.02 1.03 -0.76 -0.69 0.00 0.00 174.62 174.18 2pup s LEU 12 N 1.34 3.40 0.54 4.42 1.43 -1.26 -5.10 118.68 123.45 2pup s LEU 12 Ca 0.73 1.63 0.02 0.00 -1.03 0.00 0.00 54.13 55.48 2pup s LEU 12 Cb -0.46 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.27 2pup s LEU 12 CO 0.32 -1.02 0.13 0.54 0.23 0.00 0.00 176.35 176.55 2pup s ASN 13 N -3.35 4.31 0.24 2.29 6.03 -1.26 -4.99 114.94 118.21 2pup s ASN 13 Ca 0.59 -1.57 -0.04 0.00 -1.03 0.00 0.00 52.86 50.81 2pup s ASN 13 Cb -0.13 0.63 0.42 0.00 -3.03 0.00 0.00 41.25 39.14 2pup s ASN 13 CO 0.43 -1.00 1.77 -0.33 -2.03 0.00 0.00 177.10 175.94 2pup h GLU 14 N 1.10 0.60 0.16 3.55 3.07 -1.99 -1.93 114.58 119.13 2pup h GLU 14 Ca -0.41 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.40 2pup h GLU 14 Cb 1.32 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 2pup h GLU 14 CO 0.68 0.40 -0.08 0.77 -1.40 0.00 0.00 179.01 179.38 2pup h SER 15 N 0.62 -0.18 -0.50 1.42 0.02 -1.96 -2.89 113.55 110.07 2pup h SER 15 Ca 0.40 -0.28 0.10 0.00 -0.84 0.00 0.00 61.79 61.17 2pup h SER 15 Cb 0.48 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.04 2pup h SER 15 CO -0.31 0.38 0.35 0.77 -1.14 0.00 0.00 176.83 176.88 2pup h SER 16 N -0.96 0.21 -0.53 3.07 4.64 -1.96 0.31 113.55 118.33 2pup h SER 16 Ca -0.02 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.34 2pup h SER 16 Cb 0.45 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 62.46 2pup h SER 16 CO 0.04 0.13 0.28 0.00 -0.87 0.00 0.00 176.83 176.41 2pup h ALA 17 N 1.75 0.68 -0.36 5.18 0.00 -1.38 1.50 119.26 126.63 2pup h ALA 17 Ca 0.24 0.01 -0.58 0.00 0.00 0.00 0.00 54.91 54.58 2pup h ALA 17 Cb 0.61 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 2pup h ALA 17 CO -0.05 -0.05 1.86 1.55 0.00 0.00 0.00 179.25 182.57 2pup n VAL 18 N -4.85 4.23 -0.51 0.00 3.14 0.11 -1.83 118.33 118.61 2pup n VAL 18 Ca 0.05 -3.14 0.44 0.00 -2.96 0.00 0.00 64.34 58.72 2pup n VAL 18 Cb 0.12 -2.09 0.75 0.00 -1.06 0.00 0.00 33.84 31.56 2pup n VAL 18 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2pup h LEU 20 N 5.46 0.00 -0.70 6.55 4.07 0.19 -3.34 115.31 127.53 2pup h LEU 20 Ca 0.59 0.00 0.14 0.00 0.08 0.00 0.00 57.88 58.70 2pup h LEU 20 Cb 0.59 0.00 -0.13 0.00 1.08 0.00 0.00 40.66 42.20 2pup h LEU 20 CO 1.22 0.00 -0.16 0.00 -1.08 0.00 0.00 178.44 178.42 2pup h ALA 21 N 1.04 0.49 0.49 1.53 0.00 -1.62 0.17 119.26 121.36 2pup h ALA 21 Ca 0.76 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.91 2pup h ALA 21 Cb 3.20 0.52 0.00 0.00 0.00 0.00 0.00 17.79 21.51 2pup h ALA 21 CO -0.01 -0.42 -0.23 -0.24 0.00 0.00 0.00 179.25 178.35 2pup h VAL 22 N 0.01 0.52 0.00 0.00 3.04 -1.84 -2.72 116.25 115.27 2pup h VAL 22 Ca 0.34 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 66.02 2pup h VAL 22 Cb 0.53 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 30.34 2pup h VAL 22 CO -0.71 0.00 0.52 0.07 -1.01 0.00 0.00 177.57 176.44 2pup h LYS 23 N -0.66 0.00 0.00 4.17 5.09 -0.95 -3.54 116.57 120.67 2pup h LYS 23 Ca -0.07 0.00 -0.10 0.00 0.09 0.00 0.00 60.65 60.57 2pup h LYS 23 Cb 0.50 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.82 2pup h LYS 23 CO 0.11 0.00 -0.65 -0.07 -2.09 0.00 0.00 179.45 176.75 2pup h LEU 24 N 0.00 0.00 0.00 7.07 3.38 -1.08 -3.52 115.31 121.16 2pup h LEU 24 Ca 0.00 -0.44 -0.18 0.00 0.09 0.00 0.00 57.88 57.35 2pup h LEU 24 Cb 1.05 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 2pup h LEU 24 CO 0.00 1.09 -1.68 0.18 0.09 0.00 0.00 178.44 178.12 2pup n LEU 33 N -4.56 1.45 -4.18 1.67 4.77 -0.31 -4.98 117.00 110.86 2pup n LEU 33 Ca -0.18 -0.03 -0.22 0.00 -0.03 0.00 0.00 56.01 55.55 2pup n LEU 33 Cb 0.46 -0.09 -0.14 0.00 -2.33 0.00 0.00 43.42 41.32 2pup n LEU 33 CO 0.18 0.47 -0.49 0.42 -1.33 0.00 0.00 177.39 176.64 2pup s THR 34 N -2.24 1.33 -0.01 -5.08 -4.23 -0.65 -4.99 115.64 99.77 2pup s THR 34 Ca -0.11 -1.05 0.03 0.00 -1.18 0.00 0.00 61.69 59.38 2pup s THR 34 Cb 0.04 -1.18 -0.01 0.00 1.34 0.00 0.00 72.50 72.69 2pup s THR 34 CO 0.34 0.10 -0.11 0.00 -0.54 0.00 0.00 174.62 174.42 2pup s GLN 36 N -0.24 0.24 -0.12 0.00 1.11 -0.75 -4.99 119.66 114.92 2pup s GLN 36 Ca 0.04 -0.09 -0.27 0.00 0.01 0.00 0.00 55.36 55.05 2pup s GLN 36 Cb -0.04 -0.25 -0.02 0.00 -1.01 0.00 0.00 33.01 31.69 2pup s GLN 36 CO -0.00 0.04 0.89 -2.00 0.01 0.00 0.00 175.29 174.23 2pup s GLU 37 N 0.04 4.39 -0.06 2.91 -6.30 -1.26 -0.90 118.70 117.51 2pup s GLU 37 Ca -0.00 1.17 0.09 0.00 -2.50 0.00 0.00 54.97 53.73 2pup s GLU 37 Cb -0.02 -3.53 0.14 0.00 0.00 0.00 0.00 34.13 30.71 2pup s GLU 37 CO -0.00 -0.24 1.03 0.44 0.02 0.00 0.00 175.26 176.51 2pup n ILE 38 N 4.45 1.20 -2.06 -3.70 -5.35 0.64 -4.98 119.36 109.57 2pup n ILE 38 Ca 0.05 -1.39 -0.41 0.00 -0.27 0.00 0.00 62.75 60.73 2pup n ILE 38 Cb 0.49 0.18 -0.02 0.00 -1.74 0.00 0.00 39.64 38.55 2pup n ILE 38 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2pup s GLY 39 N -1.83 2.34 0.06 3.28 0.00 -1.24 -4.93 107.32 105.00 2pup s GLY 39 Ca 0.16 1.28 -0.17 0.00 0.00 0.00 0.00 44.72 45.99 2pup s GLY 39 CO 0.01 2.24 1.27 -0.55 0.00 0.00 0.00 173.10 176.07 2pup h ASP 40 N 5.14 0.69 -0.65 1.64 5.19 -1.96 -3.46 116.42 123.00 2pup h ASP 40 Ca -0.46 -0.61 0.00 0.00 -0.62 0.00 0.00 57.03 55.34 2pup h ASP 40 Cb 1.22 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 40.52 2pup h ASP 40 CO 0.78 1.19 0.00 0.61 -3.12 0.00 0.00 179.24 178.69 2pup n GLY 41 N 0.62 -2.42 0.00 2.75 0.00 -1.26 -5.02 105.19 99.87 2pup n GLY 41 Ca -0.07 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.55 2pup n GLY 41 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2pup n ASN 42 N -1.35 0.11 0.10 1.61 6.94 -1.26 -4.79 115.26 116.61 2pup n ASN 42 Ca 0.00 -0.43 0.12 0.00 -0.02 0.00 0.00 54.58 54.25 2pup n ASN 42 Cb 0.00 0.22 0.16 0.00 -2.36 0.00 0.00 39.78 37.81 2pup n ASN 42 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 2pup h LEU 43 N 0.00 0.00 -7.76 -4.53 3.38 -1.95 -3.46 115.31 100.99 2pup h LEU 43 Ca 0.00 -0.10 -0.40 0.00 0.09 0.00 0.00 57.88 57.47 2pup h LEU 43 Cb 0.11 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 40.53 2pup h LEU 43 CO 0.00 0.05 -0.77 0.20 0.09 0.00 0.00 178.44 178.01 2pup s ASN 44 N -4.83 0.86 0.18 -0.43 0.01 -1.26 -2.12 114.94 107.35 2pup s ASN 44 Ca 0.05 -0.12 -0.20 0.00 -0.71 0.00 0.00 52.86 51.88 2pup s ASN 44 Cb 0.11 -0.39 -0.08 0.00 0.41 0.00 0.00 41.25 41.31 2pup s ASN 44 CO 0.71 -0.04 0.70 -0.31 -1.51 0.00 0.00 177.10 176.65 2pup s TYR 45 N 0.76 3.72 -0.18 2.20 4.12 -0.05 -4.59 117.35 123.33 2pup s TYR 45 Ca -0.10 1.40 -0.02 0.00 0.02 0.00 0.00 57.07 58.37 2pup s TYR 45 Cb -0.13 -2.61 0.05 0.00 -1.52 0.00 0.00 41.96 37.75 2pup s TYR 45 CO 0.00 0.41 0.01 0.08 0.02 0.00 0.00 175.55 176.07 2pup s VAL 46 N -1.39 0.73 -0.25 0.71 1.01 -1.26 -1.39 120.40 118.56 2pup s VAL 46 Ca 0.39 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.70 2pup s VAL 46 Cb -0.18 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2pup s VAL 46 CO 0.22 -0.09 0.11 -0.36 0.00 0.00 0.00 175.10 174.97 2pup s PHE 47 N 1.78 3.15 -0.11 5.22 0.08 0.51 -0.26 117.98 128.35 2pup s PHE 47 Ca -0.01 -0.19 -0.15 0.00 0.12 0.00 0.00 56.93 56.70 2pup s PHE 47 Cb -0.17 -2.27 -0.05 0.00 -0.57 0.00 0.00 43.02 39.97 2pup s PHE 47 CO -0.07 -0.24 0.38 -1.58 -0.10 0.00 0.00 175.22 173.60 2pup s HIS 48 N 1.53 3.55 -0.06 0.36 5.65 -0.08 -0.75 115.29 125.49 2pup s HIS 48 Ca 0.06 0.78 0.02 0.00 0.25 0.00 0.00 55.06 56.17 2pup s HIS 48 Cb -0.15 -2.38 0.02 0.00 -1.18 0.00 0.00 32.58 28.88 2pup s HIS 48 CO 0.06 0.33 -0.09 0.42 -0.65 0.00 0.00 174.74 174.80 2pup s ILE 49 N 0.10 0.91 -0.06 0.89 1.01 -0.48 -1.80 121.20 121.77 2pup s ILE 49 Ca 0.21 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.52 2pup s ILE 49 Cb -0.14 -0.86 0.02 0.00 0.01 0.00 0.00 42.46 41.49 2pup s ILE 49 CO 0.08 0.31 -0.03 -0.47 0.00 0.00 0.00 174.94 174.82 2pup s TYR 50 N 0.76 0.83 -0.38 3.97 5.04 -0.30 -0.95 117.35 126.32 2pup s TYR 50 Ca -0.13 -0.27 -0.21 0.00 -2.44 0.00 0.00 57.07 54.02 2pup s TYR 50 Cb -0.15 -0.80 0.01 0.00 0.35 0.00 0.00 41.96 41.37 2pup s TYR 50 CO 0.02 -0.29 0.67 0.16 -1.34 0.00 0.00 175.55 174.78 2pup s ASP 51 N 1.40 6.42 -0.86 4.32 -4.77 -0.47 -1.16 116.67 121.55 2pup s ASP 51 Ca -0.03 0.06 -0.26 0.00 -3.30 0.00 0.00 52.55 49.02 2pup s ASP 51 Cb -0.13 -2.34 -0.15 0.00 -1.09 0.00 0.00 42.92 39.21 2pup s ASP 51 CO -0.03 -0.67 2.32 -1.10 0.70 0.00 0.00 175.17 176.39 2pup s GLN 52 N 2.83 1.55 0.00 2.11 1.11 -1.26 -4.31 119.66 121.69 2pup s GLN 52 Ca 0.25 0.24 0.00 0.00 0.01 0.00 0.00 55.36 55.86 2pup s GLN 52 Cb -0.14 -4.84 0.00 0.00 -1.01 0.00 0.00 33.01 27.02 2pup s GLN 52 CO 0.17 -4.64 0.00 -0.40 0.01 0.00 0.00 175.29 170.43 2pup n ASP 55 N 18.68 -1.63 -0.08 5.90 5.68 -1.26 -5.12 116.55 138.73 2pup n ASP 55 Ca 0.45 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.74 2pup n ASP 55 Cb 0.44 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 2pup n ASP 55 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 2pup n ARG 56 N -0.73 0.00 -4.18 0.11 1.85 -1.26 -5.11 116.66 107.34 2pup n ARG 56 Ca 0.00 0.06 -0.11 0.00 -1.00 0.00 0.00 57.85 56.80 2pup n ARG 56 Cb 0.41 -0.02 -0.10 0.00 -1.05 0.00 0.00 32.46 31.70 2pup n ARG 56 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2pup s ALA 57 N 0.00 1.03 -0.03 2.89 0.00 -1.26 -1.37 121.76 123.02 2pup s ALA 57 Ca 0.00 -1.47 -0.20 0.00 0.00 0.00 0.00 51.96 50.29 2pup s ALA 57 Cb 0.00 0.58 0.04 0.00 0.00 0.00 0.00 23.12 23.74 2pup s ALA 57 CO 0.00 -0.37 0.43 -1.17 0.00 0.00 0.00 175.76 174.65 2pup s LEU 58 N -3.08 0.36 -0.06 0.00 2.96 -0.13 -4.36 118.68 114.37 2pup s LEU 58 Ca 0.20 0.33 0.06 0.00 -0.22 0.00 0.00 54.13 54.50 2pup s LEU 58 Cb 0.07 1.67 -0.01 0.00 0.50 0.00 0.00 46.19 48.41 2pup s LEU 58 CO 0.00 -0.48 -0.25 -0.63 -1.32 0.00 0.00 176.35 173.68 2pup s ILE 59 N -1.19 2.10 -0.22 6.68 -1.09 0.41 -1.38 121.20 126.52 2pup s ILE 59 Ca -0.12 -1.05 0.02 0.00 -2.23 0.00 0.00 60.65 57.27 2pup s ILE 59 Cb -0.04 -1.76 0.04 0.00 -1.58 0.00 0.00 42.46 39.13 2pup s ILE 59 CO 0.06 0.57 -0.16 -0.63 -1.23 0.00 0.00 174.94 173.55 2pup s ILE 60 N -0.19 2.09 -0.11 2.92 1.01 0.07 -0.38 121.20 126.61 2pup s ILE 60 Ca -0.03 -1.26 -0.03 0.00 0.00 0.00 0.00 60.65 59.33 2pup s ILE 60 Cb -0.14 -2.04 -0.03 0.00 0.01 0.00 0.00 42.46 40.26 2pup s ILE 60 CO 0.03 0.27 0.02 -0.75 0.00 0.00 0.00 174.94 174.52 2pup s LYS 61 N 1.21 3.23 -0.02 2.79 2.20 0.31 -0.36 119.74 129.10 2pup s LYS 61 Ca -0.02 -0.38 -0.01 0.00 -0.36 0.00 0.00 55.97 55.21 2pup s LYS 61 Cb -0.16 -2.91 0.01 0.00 -1.51 0.00 0.00 37.83 33.27 2pup s LYS 61 CO -0.09 0.62 0.04 -1.14 -0.36 0.00 0.00 175.35 174.41 2pup s GLN 62 N -0.63 0.01 -0.06 4.03 0.74 -0.49 -0.26 119.66 123.01 2pup s GLN 62 Ca 0.11 0.11 -0.30 0.00 0.05 0.00 0.00 55.36 55.33 2pup s GLN 62 Cb -0.12 -0.08 -0.03 0.00 1.10 0.00 0.00 33.01 33.88 2pup s GLN 62 CO 0.02 -0.07 1.09 0.00 -0.55 0.00 0.00 175.29 175.79 2pup s ALA 63 N 0.43 3.40 0.17 1.58 0.00 -0.67 -0.87 121.76 125.80 2pup s ALA 63 Ca -0.03 0.53 -0.12 0.00 0.00 0.00 0.00 51.96 52.33 2pup s ALA 63 Cb -0.05 -3.45 -0.07 0.00 0.00 0.00 0.00 23.12 19.55 2pup s ALA 63 CO -0.01 -0.59 0.54 0.08 0.00 0.00 0.00 175.76 175.77 2pup s VAL 64 N 1.84 4.90 -0.04 0.00 1.01 -0.90 -4.91 120.40 122.31 2pup s VAL 64 Ca 0.53 0.67 -0.03 0.00 0.00 0.00 0.00 61.98 63.15 2pup s VAL 64 Cb -0.22 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 2pup s VAL 64 CO 0.22 0.14 0.12 -2.16 0.00 0.00 0.00 175.10 173.42 2pup s PRO 65 N -2.25 3.27 0.00 2.72 0.04 -1.26 -4.82 135.00 132.69 2pup s PRO 65 Ca 0.41 -0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.10 2pup s PRO 65 Cb -0.14 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.40 2pup s PRO 65 CO 0.20 0.69 0.00 2.48 0.04 0.00 0.00 177.00 180.41 2pup n TYR 66 N 1.34 0.00 -4.01 0.56 4.11 -1.26 -5.02 117.16 112.88 2pup n TYR 66 Ca -0.14 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.67 2pup n TYR 66 Cb 0.53 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.76 2pup n TYR 66 CO 0.00 0.00 0.00 0.57 -0.00 0.00 0.00 176.86 177.43 2pup s PRO 75 N 0.00 0.39 -0.30 -3.48 0.08 -1.26 -5.24 135.00 125.19 2pup s PRO 75 Ca 0.00 -0.74 -0.11 0.00 0.08 0.00 0.00 61.00 60.23 2pup s PRO 75 Cb 0.00 0.08 0.18 0.00 0.08 0.00 0.00 34.50 34.84 2pup s PRO 75 CO 0.00 -0.05 1.00 -1.17 0.08 0.00 0.00 177.00 176.87 2pup s LEU 76 N -1.75 -0.55 1.01 0.57 1.98 -1.26 -5.17 118.68 113.52 2pup s LEU 76 Ca -0.11 0.20 -0.14 0.00 -2.89 0.00 0.00 54.13 51.19 2pup s LEU 76 Cb -0.07 1.40 0.08 0.00 0.66 0.00 0.00 46.19 48.26 2pup s LEU 76 CO -0.02 -0.10 0.38 0.35 -1.89 0.00 0.00 176.35 175.06 2pup n THR 77 N 5.32 0.00 1.31 3.68 -2.24 -1.26 -4.71 114.28 116.38 2pup n THR 77 Ca 0.01 -0.22 0.12 0.00 -2.27 0.00 0.00 64.05 61.68 2pup n THR 77 Cb 0.55 -0.66 0.42 0.00 -2.10 0.00 0.00 70.33 68.54 2pup n THR 77 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2pup n ILE 78 N -3.96 0.14 0.30 2.28 -5.35 -1.26 -3.79 119.36 107.72 2pup n ILE 78 Ca 0.05 -0.32 0.19 0.00 -0.27 0.00 0.00 62.75 62.40 2pup n ILE 78 Cb 0.56 0.42 0.88 0.00 -1.74 0.00 0.00 39.64 39.77 2pup n ILE 78 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 2pup h ASP 79 N 2.29 0.00 -0.36 7.28 3.58 -1.92 -2.53 116.42 124.76 2pup h ASP 79 Ca 0.00 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.51 2pup h ASP 79 Cb 0.50 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.53 2pup h ASP 79 CO 0.00 0.01 0.25 0.08 -2.88 0.00 0.00 179.24 176.69 2pup h ARG 80 N 0.00 0.24 -0.12 0.28 0.11 -1.92 -1.26 114.38 111.70 2pup h ARG 80 Ca -0.00 -0.01 -0.07 0.00 0.10 0.00 0.00 59.98 60.00 2pup h ARG 80 Cb 0.32 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.34 2pup h ARG 80 CO 0.00 0.16 -0.23 0.00 0.10 0.00 0.00 179.97 180.00 2pup h ALA 81 N 1.81 1.39 -0.20 0.08 0.00 -1.76 0.18 119.26 120.75 2pup h ALA 81 Ca 0.16 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2pup h ALA 81 Cb 0.33 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2pup h ALA 81 CO -0.03 0.42 -0.14 -0.09 0.00 0.00 0.00 179.25 179.41 2pup h ARG 82 N 0.20 0.45 -0.19 0.00 2.43 -1.40 -1.95 114.38 113.91 2pup h ARG 82 Ca 0.03 -0.22 0.04 0.00 -0.81 0.00 0.00 59.98 59.03 2pup h ARG 82 Cb 0.52 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.02 2pup h ARG 82 CO 0.04 0.77 -0.06 0.82 -1.51 0.00 0.00 179.97 180.03 2pup h ILE 83 N 0.13 0.79 0.15 1.20 1.08 -1.15 -1.43 117.51 118.28 2pup h ILE 83 Ca 0.04 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.50 2pup h ILE 83 Cb 0.66 0.79 0.00 0.00 -3.07 0.00 0.00 36.82 35.20 2pup h ILE 83 CO 0.04 0.00 -0.07 -0.08 -0.69 0.00 0.00 178.15 177.35 2pup h GLU 84 N -0.02 -0.20 -0.44 2.37 4.81 -0.67 -0.18 114.58 120.26 2pup h GLU 84 Ca 0.10 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.43 2pup h GLU 84 Cb 0.16 0.04 -0.09 0.00 0.63 0.00 0.00 28.75 29.49 2pup h GLU 84 CO -0.21 0.03 -0.17 1.03 -0.73 0.00 0.00 179.01 178.97 2pup h SER 85 N -0.40 -0.58 0.13 1.04 0.87 -1.34 -0.74 113.55 112.52 2pup h SER 85 Ca -0.02 0.15 -0.10 0.00 -1.23 0.00 0.00 61.79 60.59 2pup h SER 85 Cb 0.32 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 2pup h SER 85 CO 0.03 -0.20 -0.34 0.28 -0.53 0.00 0.00 176.83 176.07 2pup h SER 86 N -0.07 0.32 -0.16 6.23 0.02 -1.00 -2.45 113.55 116.45 2pup h SER 86 Ca 0.21 -0.12 -0.14 0.00 -0.84 0.00 0.00 61.79 60.90 2pup h SER 86 Cb 0.40 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.85 2pup h SER 86 CO -0.49 0.65 -0.44 0.00 -1.14 0.00 0.00 176.83 175.41 2pup h ALA 87 N 1.37 0.27 -0.37 3.77 0.00 -0.23 -0.32 119.26 123.74 2pup h ALA 87 Ca 0.03 -0.47 0.03 0.00 0.00 0.00 0.00 54.91 54.51 2pup h ALA 87 Cb 0.74 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2pup h ALA 87 CO 0.06 0.40 0.16 -0.07 0.00 0.00 0.00 179.25 179.80 2pup h LEU 88 N 0.23 0.22 -0.07 0.00 3.38 -1.08 0.74 115.31 118.72 2pup h LEU 88 Ca -0.01 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2pup h LEU 88 Cb 1.06 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.75 2pup h LEU 88 CO 0.09 0.16 -0.19 0.40 0.09 0.00 0.00 178.44 179.00 2pup h ILE 89 N 0.34 0.53 -0.33 1.22 2.04 -1.28 0.15 117.51 120.18 2pup h ILE 89 Ca 0.16 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.08 2pup h ILE 89 Cb 0.10 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 36.66 2pup h ILE 89 CO -0.14 0.00 0.02 0.03 0.00 0.00 0.00 178.15 178.06 2pup h ARG 90 N -0.27 0.11 -0.95 2.37 3.08 -0.68 -1.58 114.38 116.45 2pup h ARG 90 Ca 0.08 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.21 2pup h ARG 90 Cb 0.39 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.34 2pup h ARG 90 CO -0.23 0.07 0.61 1.96 -1.07 0.00 0.00 179.97 181.31 2pup h GLN 91 N 0.11 1.00 0.00 0.04 4.20 -0.42 -1.55 115.11 118.50 2pup h GLN 91 Ca 0.16 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 2pup h GLN 91 Cb 0.21 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 2pup h GLN 91 CO -0.25 0.66 -0.14 0.78 -0.67 0.00 0.00 178.83 179.21 2pup h GLY 92 N 1.03 0.00 1.48 3.46 0.00 0.26 -0.61 103.07 108.70 2pup h GLY 92 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 2pup h GLY 92 CO -0.19 0.00 0.00 -1.84 0.00 0.00 0.00 176.54 174.51 2pup n GLU 93 N -3.94 0.31 0.00 4.80 0.00 -0.58 -3.06 120.64 118.18 2pup n GLU 93 Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 57.16 57.23 2pup n GLU 93 Cb 0.23 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.17 2pup n GLU 93 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2pup n HIS 94 N -1.24 0.00 -3.15 -1.84 8.25 -0.91 -4.92 115.22 111.41 2pup n HIS 94 Ca 0.10 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.35 2pup n HIS 94 Cb 0.13 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.21 2pup n HIS 94 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2pup n VAL 95 N -1.48 0.38 0.26 1.59 0.24 -0.28 -4.97 118.33 114.07 2pup n VAL 95 Ca 0.00 -4.72 0.09 0.00 -2.04 0.00 0.00 64.34 57.67 2pup n VAL 95 Cb 0.12 -0.62 0.68 0.00 -1.47 0.00 0.00 33.84 32.55 2pup n VAL 95 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2pup h PRO 96 N 3.10 0.00 0.00 7.34 0.13 -1.70 0.31 132.00 141.18 2pup h PRO 96 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2pup h PRO 96 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2pup h PRO 96 CO 0.56 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 175.94 2pup n HIS 97 N -4.44 0.00 -0.20 1.56 1.44 -1.26 -3.56 115.22 108.75 2pup n HIS 97 Ca -0.03 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.72 2pup n HIS 97 Cb 0.10 -0.44 0.09 0.00 0.12 0.00 0.00 29.99 29.86 2pup n HIS 97 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2pup n LEU 98 N -1.44 2.55 -3.68 2.39 4.77 0.10 -4.77 117.00 116.92 2pup n LEU 98 Ca 0.05 -2.13 -0.15 0.00 -0.03 0.00 0.00 56.01 53.76 2pup n LEU 98 Cb 0.18 -0.16 -0.08 0.00 -2.33 0.00 0.00 43.42 41.03 2pup n LEU 98 CO 0.15 0.63 0.18 0.68 -1.33 0.00 0.00 177.39 177.70 2pup s VAL 99 N -1.23 0.03 0.42 4.08 -7.23 -1.23 -0.22 120.40 115.02 2pup s VAL 99 Ca 0.15 -0.24 -0.26 0.00 -1.81 0.00 0.00 61.98 59.82 2pup s VAL 99 Cb 0.09 -0.74 -0.09 0.00 0.56 0.00 0.00 36.38 36.20 2pup s VAL 99 CO 0.08 -0.13 1.38 -2.16 -0.31 0.00 0.00 175.10 173.96 2pup s PRO 100 N -0.97 3.85 0.36 4.82 0.04 -1.26 -4.88 135.00 136.96 2pup s PRO 100 Ca -0.10 2.33 -0.28 0.00 0.04 0.00 0.00 61.00 62.99 2pup s PRO 100 Cb -0.03 -2.74 -0.11 0.00 0.04 0.00 0.00 34.50 31.66 2pup s PRO 100 CO 0.05 -0.65 1.43 -0.98 0.04 0.00 0.00 177.00 176.89 2pup s ARG 101 N -2.32 4.19 -0.19 4.56 3.03 -1.26 -4.84 118.95 122.12 2pup s ARG 101 Ca 0.58 2.45 -0.06 0.00 2.03 0.00 0.00 55.73 60.74 2pup s ARG 101 Cb -0.42 -3.00 -0.03 0.00 -1.03 0.00 0.00 34.95 30.47 2pup s ARG 101 CO 0.54 -0.42 0.02 0.08 -1.13 0.00 0.00 175.30 174.40 2pup s VAL 102 N -1.11 4.29 -0.12 4.99 1.01 -1.26 -1.09 120.40 127.11 2pup s VAL 102 Ca 0.52 -0.21 0.17 0.00 0.00 0.00 0.00 61.98 62.46 2pup s VAL 102 Cb -0.44 -2.93 -0.20 0.00 0.00 0.00 0.00 36.38 32.81 2pup s VAL 102 CO 0.60 0.45 0.58 0.49 0.00 0.00 0.00 175.10 177.21 2pup n PHE 103 N 3.86 0.66 -3.61 5.22 3.01 0.41 -4.99 117.46 122.01 2pup n PHE 103 Ca -0.17 0.22 -0.07 0.00 1.01 0.00 0.00 57.45 58.45 2pup n PHE 103 Cb 0.52 -1.03 -0.05 0.00 -0.01 0.00 0.00 39.48 38.91 2pup n PHE 103 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 2pup s TYR 104 N -2.82 -0.24 0.10 1.38 6.14 -1.14 -5.04 117.35 115.73 2pup s TYR 104 Ca -0.05 0.44 -0.17 0.00 0.64 0.00 0.00 57.07 57.92 2pup s TYR 104 Cb 0.08 0.46 0.04 0.00 0.42 0.00 0.00 41.96 42.96 2pup s TYR 104 CO 0.83 -0.20 0.42 -1.54 0.64 0.00 0.00 175.55 175.70 2pup s SER 105 N -0.86 -0.28 -0.20 4.32 1.04 -1.26 -0.15 113.70 116.30 2pup s SER 105 Ca 0.03 -0.18 -0.08 0.00 0.48 0.00 0.00 55.95 56.20 2pup s SER 105 Cb -0.01 0.47 0.08 0.00 0.10 0.00 0.00 66.02 66.66 2pup s SER 105 CO -0.04 -0.80 0.45 -0.62 0.98 0.00 0.00 173.24 173.22 2pup s ASP 106 N -2.52 -0.45 0.03 7.02 3.68 -0.76 -5.02 116.67 118.65 2pup s ASP 106 Ca -0.00 1.03 -0.27 0.00 2.13 0.00 0.00 52.55 55.45 2pup s ASP 106 Cb 0.01 1.22 -0.17 0.00 -1.45 0.00 0.00 42.92 42.53 2pup s ASP 106 CO -0.09 -0.22 1.37 0.74 0.13 0.00 0.00 175.17 177.11 2pup h THR 107 N 5.87 0.63 -0.65 1.71 2.02 -1.95 -0.87 112.91 119.68 2pup h THR 107 Ca -0.24 -0.39 0.02 0.00 0.77 0.00 0.00 66.41 66.57 2pup h THR 107 Cb 1.14 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 68.34 2pup h THR 107 CO 0.18 0.07 0.43 -0.33 0.37 0.00 0.00 175.52 176.24 2pup h GLU 108 N -0.72 0.81 -0.00 6.66 3.07 -1.97 0.16 114.58 122.59 2pup h GLU 108 Ca -0.05 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 2pup h GLU 108 Cb 0.50 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 2pup h GLU 108 CO 0.08 0.53 -0.25 -1.33 -1.40 0.00 0.00 179.01 176.64 2pup n MET 109 N -4.45 0.17 -4.07 2.33 2.81 -1.21 -4.16 117.12 108.55 2pup n MET 109 Ca 0.07 -0.07 -0.31 0.00 -1.81 0.00 0.00 57.70 55.58 2pup n MET 109 Cb 0.08 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.08 2pup n MET 109 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2pup n ALA 110 N -1.36 -1.57 -2.56 3.04 0.00 0.56 -4.73 120.51 113.90 2pup n ALA 110 Ca 0.08 -0.08 -0.32 0.00 0.00 0.00 0.00 53.44 53.11 2pup n ALA 110 Cb 0.33 -2.84 -0.11 0.00 0.00 0.00 0.00 19.45 16.83 2pup n ALA 110 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2pup s VAL 111 N -3.56 3.48 -0.13 0.00 -7.23 -0.87 -1.66 120.40 110.43 2pup s VAL 111 Ca 0.43 -0.75 0.01 0.00 -1.81 0.00 0.00 61.98 59.87 2pup s VAL 111 Cb -0.23 -2.47 0.02 0.00 0.56 0.00 0.00 36.38 34.25 2pup s VAL 111 CO 0.90 0.46 -0.17 -0.89 -0.31 0.00 0.00 175.10 175.09 2pup s THR 112 N -0.91 1.69 -0.34 5.32 2.01 0.64 -1.83 115.64 122.23 2pup s THR 112 Ca 0.15 -0.74 -0.11 0.00 0.31 0.00 0.00 61.69 61.30 2pup s THR 112 Cb -0.11 -1.54 -0.00 0.00 0.01 0.00 0.00 72.50 70.85 2pup s THR 112 CO 0.05 0.48 0.20 -0.69 -0.69 0.00 0.00 174.62 173.97 2pup s VAL 113 N 1.14 4.89 0.20 3.82 1.01 0.79 -0.53 120.40 131.71 2pup s VAL 113 Ca -0.02 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.56 2pup s VAL 113 Cb -0.14 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 2pup s VAL 113 CO -0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 175.10 174.97 2pup s MET 114 N 1.65 1.22 0.12 2.72 0.23 0.48 -0.45 119.30 125.27 2pup s MET 114 Ca 0.05 -1.58 -0.34 0.00 -1.03 0.00 0.00 55.69 52.78 2pup s MET 114 Cb -0.18 -0.56 -0.17 0.00 -1.53 0.00 0.00 34.83 32.39 2pup s MET 114 CO 0.08 -0.05 1.05 -1.91 -2.03 0.00 0.00 175.02 172.16 2pup n GLU 115 N -0.32 0.64 -2.48 3.16 2.13 -0.25 -0.44 120.64 123.08 2pup n GLU 115 Ca -0.07 0.23 -0.42 0.00 0.66 0.00 0.00 57.16 57.56 2pup n GLU 115 Cb 0.63 -1.66 -0.03 0.00 0.27 0.00 0.00 31.44 30.65 2pup n GLU 115 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2pup s ASP 116 N -0.12 7.16 -0.17 4.31 3.68 -1.26 -4.56 116.67 125.70 2pup s ASP 116 Ca 0.78 2.01 0.14 0.00 2.13 0.00 0.00 52.55 57.61 2pup s ASP 116 Cb -0.99 -2.59 0.36 0.00 -1.45 0.00 0.00 42.92 38.25 2pup s ASP 116 CO 0.54 -0.37 1.19 0.18 0.13 0.00 0.00 175.17 176.83 2pup n LEU 117 N 3.40 2.49 0.29 -1.34 4.77 -1.26 -4.82 117.00 120.54 2pup n LEU 117 Ca 0.07 -3.50 0.20 0.00 -0.03 0.00 0.00 56.01 52.74 2pup n LEU 117 Cb 0.47 -0.47 1.05 0.00 -2.33 0.00 0.00 43.42 42.13 2pup n LEU 117 CO 0.55 1.09 1.09 0.28 -1.33 0.00 0.00 177.39 179.07 2pup h SER 118 N 0.58 0.00 0.07 -1.43 0.02 -2.02 0.14 113.55 110.91 2pup h SER 118 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2pup h SER 118 Cb 1.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2pup h SER 118 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 2pup n HIS 119 N -2.89 0.00 -4.10 3.45 1.44 -1.26 -4.80 115.22 107.06 2pup n HIS 119 Ca -0.02 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.44 2pup n HIS 119 Cb 0.08 -0.04 -0.07 0.00 0.12 0.00 0.00 29.99 30.07 2pup n HIS 119 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2pup s LEU 120 N -2.09 3.14 0.00 2.39 1.43 0.47 -4.95 118.68 119.07 2pup s LEU 120 Ca 0.34 -1.05 0.07 0.00 -1.03 0.00 0.00 54.13 52.46 2pup s LEU 120 Cb 0.17 -1.48 -0.03 0.00 0.03 0.00 0.00 46.19 44.88 2pup s LEU 120 CO 0.29 -0.54 -0.21 -0.75 0.23 0.00 0.00 176.35 175.37 2pup s LYS 121 N -3.92 2.14 0.10 1.70 2.20 -0.27 -4.85 119.74 116.84 2pup s LYS 121 Ca 0.41 -0.92 -0.33 0.00 -0.36 0.00 0.00 55.97 54.77 2pup s LYS 121 Cb 0.03 -2.16 -0.13 0.00 -1.51 0.00 0.00 37.83 34.07 2pup s LYS 121 CO 0.23 0.56 1.71 -0.89 -0.36 0.00 0.00 175.35 176.60 2pup n ILE 122 N 2.04 0.20 -0.28 5.43 2.08 -1.26 0.44 119.36 128.02 2pup n ILE 122 Ca -0.16 -0.04 -0.01 0.00 0.56 0.00 0.00 62.75 63.10 2pup n ILE 122 Cb 0.52 -1.76 0.12 0.00 -0.75 0.00 0.00 39.64 37.77 2pup n ILE 122 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2pup h ALA 123 N 7.24 1.06 -0.07 -1.39 0.00 -0.42 -0.50 119.26 125.17 2pup h ALA 123 Ca -0.46 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.47 2pup h ALA 123 Cb 1.25 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2pup h ALA 123 CO 0.92 0.21 -0.07 -0.09 0.00 0.00 0.00 179.25 180.22 2pup h ARG 124 N 0.88 -0.09 -0.22 0.00 2.43 -1.66 0.43 114.38 116.16 2pup h ARG 124 Ca 0.34 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.54 2pup h ARG 124 Cb 0.14 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 2pup h ARG 124 CO -0.16 -0.06 0.03 -0.22 -1.51 0.00 0.00 179.97 178.05 2pup h LYS 125 N -0.09 0.11 -0.31 0.20 3.64 -1.70 -0.73 116.57 117.68 2pup h LYS 125 Ca 0.05 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2pup h LYS 125 Cb 0.17 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.92 2pup h LYS 125 CO -0.13 0.07 0.00 0.78 -2.27 0.00 0.00 179.45 177.91 2pup h GLY 126 N 0.12 0.30 0.99 5.01 0.00 -0.87 -2.24 103.07 106.37 2pup h GLY 126 Ca 0.10 0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 2pup h GLY 126 CO -0.14 -0.07 0.30 1.41 0.00 0.00 0.00 176.54 178.05 2pup h LEU 127 N 0.09 0.61 -1.97 3.11 3.38 0.16 -2.00 115.31 118.68 2pup h LEU 127 Ca 0.15 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.12 2pup h LEU 127 Cb 0.20 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2pup h LEU 127 CO -0.25 0.48 0.15 0.40 0.09 0.00 0.00 178.44 179.32 2pup h ILE 128 N 0.68 0.91 0.00 1.22 2.04 -0.90 -0.15 117.51 121.31 2pup h ILE 128 Ca 0.18 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 66.03 2pup h ILE 128 Cb -0.01 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 2pup h ILE 128 CO -0.03 0.01 -0.11 -0.62 0.00 0.00 0.00 178.15 177.39 2pup n GLU 129 N -4.48 0.02 0.00 2.37 1.02 -0.84 -4.93 120.64 113.80 2pup n GLU 129 Ca 0.02 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2pup n GLU 129 Cb 0.27 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2pup n GLU 129 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pup n GLY 130 N 1.49 0.68 3.75 0.62 0.00 -0.07 -5.09 105.19 106.57 2pup n GLY 130 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2pup n GLY 130 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pup s GLU 131 N -0.88 3.06 -0.01 1.61 0.41 -0.81 -4.96 118.70 117.12 2pup s GLU 131 Ca 0.00 2.22 0.13 0.00 -0.41 0.00 0.00 54.97 56.91 2pup s GLU 131 Cb 0.00 -2.20 -0.18 0.00 -1.78 0.00 0.00 34.13 29.96 2pup s GLU 131 CO 0.00 -1.25 0.41 0.09 -0.49 0.00 0.00 175.26 174.02 2pup n ASN 132 N -1.14 1.36 -2.64 -0.19 3.02 -1.26 -4.37 115.26 110.04 2pup n ASN 132 Ca 0.11 -0.34 -0.24 0.00 -0.03 0.00 0.00 54.58 54.08 2pup n ASN 132 Cb 0.45 1.36 0.02 0.00 -0.61 0.00 0.00 39.78 41.01 2pup n ASN 132 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2pup n TYR 133 N -1.70 -1.65 0.26 3.10 4.01 -1.26 -4.81 117.16 115.12 2pup n TYR 133 Ca -0.00 0.69 0.18 0.00 -0.16 0.00 0.00 57.90 58.60 2pup n TYR 133 Cb 0.29 -1.14 0.86 0.00 -0.31 0.00 0.00 39.34 39.04 2pup n TYR 133 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2pup h PRO 134 N 1.22 0.00 -0.11 -0.72 0.13 -1.91 -1.22 132.00 129.40 2pup h PRO 134 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2pup h PRO 134 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2pup h PRO 134 CO 0.15 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.64 2pup n HIS 135 N -3.24 0.13 -0.03 1.56 8.25 -1.26 -4.69 115.22 115.93 2pup n HIS 135 Ca 0.00 -0.12 -0.09 0.00 -0.26 0.00 0.00 57.72 57.26 2pup n HIS 135 Cb 0.38 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.45 2pup n HIS 135 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2pup h LEU 136 N 2.47 -0.14 -0.65 2.41 5.85 -1.55 -1.23 115.31 122.47 2pup h LEU 136 Ca 0.00 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2pup h LEU 136 Cb 0.59 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 2pup h LEU 136 CO 0.00 -0.05 0.24 0.77 -0.34 0.00 0.00 178.44 179.06 2pup h SER 137 N 0.01 0.91 -0.18 1.25 4.64 -1.84 0.37 113.55 118.72 2pup h SER 137 Ca 0.08 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 2pup h SER 137 Cb 0.12 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 2pup h SER 137 CO -0.17 0.85 0.12 1.56 -0.87 0.00 0.00 176.83 178.31 2pup h GLN 138 N 0.92 0.24 0.08 4.77 7.50 -1.78 0.99 115.11 127.83 2pup h GLN 138 Ca 0.21 -0.02 -0.00 0.00 0.50 0.00 0.00 58.65 59.34 2pup h GLN 138 Cb 0.24 -0.05 0.00 0.00 0.05 0.00 0.00 27.48 27.71 2pup h GLN 138 CO -0.01 0.16 -0.04 0.45 -1.50 0.00 0.00 178.83 177.89 2pup h HIS 139 N 0.23 -0.10 -0.47 2.96 -0.00 -0.98 -0.83 115.15 115.95 2pup h HIS 139 Ca 0.06 -0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.39 2pup h HIS 139 Cb -0.02 0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.40 2pup h HIS 139 CO -0.06 0.04 0.11 0.82 -0.00 0.00 0.00 177.93 178.84 2pup h ILE 140 N -0.23 1.21 -0.06 2.45 1.08 -0.88 0.21 117.51 121.29 2pup h ILE 140 Ca -0.01 -0.74 0.01 0.00 -0.39 0.00 0.00 64.86 63.72 2pup h ILE 140 Cb 0.20 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 34.66 2pup h ILE 140 CO 0.02 0.27 0.02 1.23 -0.69 0.00 0.00 178.15 179.00 2pup h GLY 141 N 0.90 0.06 0.87 5.37 0.00 -0.42 0.35 103.07 110.20 2pup h GLY 141 Ca 0.16 -0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.43 2pup h GLY 141 CO -0.00 0.01 0.00 -2.09 0.00 0.00 0.00 176.54 174.46 2pup h GLU 142 N 0.04 0.49 -0.81 4.80 4.81 -0.68 -1.36 114.58 121.88 2pup h GLU 142 Ca 0.02 -0.15 0.15 0.00 -0.13 0.00 0.00 59.36 59.25 2pup h GLU 142 Cb 0.01 -0.05 -0.15 0.00 0.63 0.00 0.00 28.75 29.20 2pup h GLU 142 CO -0.03 0.64 -0.27 0.35 -0.73 0.00 0.00 179.01 178.98 2pup h PHE 143 N 0.28 -0.67 -0.17 0.92 3.04 -0.81 -1.01 116.94 118.52 2pup h PHE 143 Ca 0.08 0.08 -0.06 0.00 3.98 0.00 0.00 57.97 62.05 2pup h PHE 143 Cb 0.42 0.42 -0.00 0.00 2.56 0.00 0.00 35.95 39.34 2pup h PHE 143 CO 0.03 -0.37 -0.15 -0.07 -2.02 0.00 0.00 178.31 175.74 2pup h LEU 144 N -0.04 0.41 0.01 0.59 3.38 -0.61 -0.70 115.31 118.36 2pup h LEU 144 Ca 0.35 -0.47 0.03 0.00 0.09 0.00 0.00 57.88 57.88 2pup h LEU 144 Cb 0.59 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 2pup h LEU 144 CO -0.84 0.79 -0.20 1.23 0.09 0.00 0.00 178.44 179.52 2pup h GLY 145 N 0.04 -0.28 0.63 0.83 0.00 -1.06 -0.24 103.07 102.98 2pup h GLY 145 Ca 0.03 0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.56 2pup h GLY 145 CO 0.04 -0.18 -0.06 0.50 0.00 0.00 0.00 176.54 176.84 2pup h LYS 146 N -0.32 0.17 -0.76 4.80 1.57 -1.19 -1.37 116.57 119.46 2pup h LYS 146 Ca 0.05 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2pup h LYS 146 Cb 0.39 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 2pup h LYS 146 CO -0.17 0.59 0.28 1.79 -0.57 0.00 0.00 179.45 181.37 2pup h THR 147 N -0.26 1.26 -0.07 -0.16 1.35 -1.14 -1.65 112.91 112.23 2pup h THR 147 Ca 0.01 -0.85 -0.23 0.00 -0.55 0.00 0.00 66.41 64.80 2pup h THR 147 Cb 0.56 0.39 0.01 0.00 -1.73 0.00 0.00 68.15 67.38 2pup h THR 147 CO 0.02 0.34 -0.86 -0.07 -0.25 0.00 0.00 175.52 174.69 2pup h LEU 148 N 1.10 0.75 0.26 3.87 3.38 -1.09 -3.30 115.31 120.29 2pup h LEU 148 Ca 0.25 -0.54 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 2pup h LEU 148 Cb 0.25 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2pup h LEU 148 CO -0.02 1.33 -0.12 0.15 0.09 0.00 0.00 178.44 179.87 2pup h PHE 149 N 0.39 -0.32 0.00 1.13 3.57 -1.15 -3.36 116.94 117.19 2pup h PHE 149 Ca -0.07 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.42 2pup h PHE 149 Cb 1.49 0.11 0.00 0.00 2.79 0.00 0.00 35.95 40.34 2pup h PHE 149 CO 0.08 0.02 0.00 0.66 -2.23 0.00 0.00 178.31 176.84 2pup n TYR 150 N -5.08 0.00 0.12 0.41 4.01 -0.63 -2.11 117.16 113.88 2pup n TYR 150 Ca -0.09 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.69 2pup n TYR 150 Cb 0.26 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.35 2pup n TYR 150 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2pup n SER 151 N -0.99 2.04 -4.72 7.72 7.64 -1.24 -4.70 113.62 119.36 2pup n SER 151 Ca 0.15 -1.60 -0.23 0.00 1.01 0.00 0.00 58.87 58.19 2pup n SER 151 Cb 0.07 -0.07 0.10 0.00 -1.01 0.00 0.00 64.21 63.30 2pup n SER 151 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2pup s SER 152 N -0.78 4.46 0.41 6.43 1.04 -0.90 -4.21 113.70 120.15 2pup s SER 152 Ca 0.11 -0.33 0.29 0.00 0.48 0.00 0.00 55.95 56.50 2pup s SER 152 Cb 0.07 -0.10 1.26 0.00 0.10 0.00 0.00 66.02 67.35 2pup s SER 152 CO 0.10 -1.78 1.87 0.44 0.98 0.00 0.00 173.24 174.85 2pup h ASP 153 N -0.45 0.00 0.04 7.02 3.32 -1.81 -1.92 116.42 122.62 2pup h ASP 153 Ca -0.37 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.58 2pup h ASP 153 Cb 1.27 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.81 2pup h ASP 153 CO 0.42 0.00 -0.33 1.88 -1.72 0.00 0.00 179.24 179.48 2pup h TYR 154 N 0.00 0.48 0.00 4.55 0.05 -1.92 -3.34 116.97 116.79 2pup h TYR 154 Ca 0.00 -0.12 -0.26 0.00 0.05 0.00 0.00 58.73 58.40 2pup h TYR 154 Cb 0.37 -0.11 -0.05 0.00 1.01 0.00 0.00 36.73 37.95 2pup h TYR 154 CO 0.00 0.70 -2.10 0.00 -1.05 0.00 0.00 178.16 175.71 2pup n ALA 155 N -2.49 1.82 -2.41 3.88 0.00 -0.98 -0.50 120.51 119.84 2pup n ALA 155 Ca -0.01 -1.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.14 2pup n ALA 155 Cb 0.45 -0.48 -0.13 0.00 0.00 0.00 0.00 19.45 19.29 2pup n ALA 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2pup s LEU 156 N -5.40 2.30 0.21 0.00 1.43 -0.76 -4.72 118.68 111.73 2pup s LEU 156 Ca -0.08 -0.72 -0.32 0.00 -1.03 0.00 0.00 54.13 51.98 2pup s LEU 156 Cb 0.08 -1.18 -0.12 0.00 0.03 0.00 0.00 46.19 45.01 2pup s LEU 156 CO 0.84 0.17 1.69 -1.61 0.23 0.00 0.00 176.35 177.68 2pup s GLU 157 N -1.92 4.14 0.33 1.70 2.02 -1.26 -4.56 118.70 119.14 2pup s GLU 157 Ca 0.13 2.57 0.11 0.00 0.02 0.00 0.00 54.97 57.80 2pup s GLU 157 Cb -0.10 -3.08 0.95 0.00 0.10 0.00 0.00 34.13 31.99 2pup s GLU 157 CO 0.05 -0.72 1.72 -1.35 0.02 0.00 0.00 175.26 174.98 2pup h PRO 158 N 6.67 0.50 -0.72 0.39 0.11 -1.95 0.16 132.00 137.16 2pup h PRO 158 Ca -0.43 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.72 2pup h PRO 158 Cb 1.20 -0.11 -0.06 0.00 0.11 0.00 0.00 31.00 32.14 2pup h PRO 158 CO 0.94 0.33 0.39 0.87 -0.21 0.00 0.00 178.00 180.32 2pup h LYS 159 N 0.52 0.67 0.15 1.05 1.57 -2.00 0.12 116.57 118.65 2pup h LYS 159 Ca 0.66 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.39 2pup h LYS 159 Cb 1.34 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2pup h LYS 159 CO -0.49 0.44 -0.07 0.28 -0.57 0.00 0.00 179.45 179.04 2pup h VAL 160 N 0.69 0.92 -0.93 0.50 2.07 -1.21 -3.21 116.25 115.07 2pup h VAL 160 Ca 0.33 -1.11 0.19 0.00 0.82 0.00 0.00 66.70 66.93 2pup h VAL 160 Cb 0.27 1.51 -0.11 0.00 -1.52 0.00 0.00 31.29 31.45 2pup h VAL 160 CO -0.22 0.23 0.51 0.50 0.02 0.00 0.00 177.57 178.61 2pup h LYS 161 N -0.81 0.60 0.00 1.57 3.11 -0.60 0.28 116.57 120.73 2pup h LYS 161 Ca -0.02 -0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 57.76 2pup h LYS 161 Cb 0.53 -0.14 -0.00 0.00 -1.00 0.00 0.00 32.23 31.62 2pup h LYS 161 CO 0.03 0.40 -0.09 0.87 -2.81 0.00 0.00 179.45 177.85 2pup h LYS 162 N 0.62 0.00 -0.24 1.90 1.57 -0.83 -2.13 116.57 117.47 2pup h LYS 162 Ca 0.55 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.25 2pup h LYS 162 Cb 0.89 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 2pup h LYS 162 CO -0.42 0.09 -0.16 1.96 -0.57 0.00 0.00 179.45 180.35 2pup h GLN 163 N 0.00 0.54 -0.69 3.15 1.08 -0.94 -3.12 115.11 115.12 2pup h GLN 163 Ca -0.00 -0.25 0.02 0.00 -1.45 0.00 0.00 58.65 56.97 2pup h GLN 163 Cb 0.17 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.55 2pup h GLN 163 CO 0.01 0.82 0.46 -0.07 -0.95 0.00 0.00 178.83 179.10 2pup h LEU 164 N 0.25 0.75 -1.08 1.46 3.38 -1.22 -0.67 115.31 118.17 2pup h LEU 164 Ca 0.05 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.12 2pup h LEU 164 Cb 0.69 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 2pup h LEU 164 CO 0.04 0.52 0.62 0.58 0.09 0.00 0.00 178.44 180.30 2pup h VAL 165 N 0.87 0.94 0.09 1.22 2.07 -1.35 -0.23 116.25 119.87 2pup h VAL 165 Ca 0.27 -0.33 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 2pup h VAL 165 Cb -0.00 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 29.66 2pup h VAL 165 CO -0.07 0.18 -0.04 0.11 0.02 0.00 0.00 177.57 177.76 2pup h LYS 166 N 0.97 -0.12 0.00 1.57 1.57 -1.08 -2.07 116.57 117.41 2pup h LYS 166 Ca 0.47 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.24 2pup h LYS 166 Cb 0.46 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 2pup h LYS 166 CO -0.23 0.19 -0.07 -0.56 -0.57 0.00 0.00 179.45 178.22 2pup h GLN 167 N -0.44 0.00 -0.46 3.15 3.07 -1.11 -2.36 115.11 116.96 2pup h GLN 167 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.73 2pup h GLN 167 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.93 2pup h GLN 167 CO 0.02 0.07 0.00 1.19 0.09 0.00 0.00 178.83 180.20 2pup n PHE 168 N -3.22 0.60 -1.67 0.06 3.72 -0.13 -4.92 117.46 111.90 2pup n PHE 168 Ca -0.00 -0.38 -0.46 0.00 -0.05 0.00 0.00 57.45 56.57 2pup n PHE 168 Cb 0.31 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 38.80 2pup n PHE 168 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2pup n THR 169 N 1.22 0.62 -3.26 4.37 -1.04 -0.79 -4.17 114.28 111.23 2pup n THR 169 Ca 0.18 -0.11 -0.26 0.00 -2.04 0.00 0.00 64.05 61.82 2pup n THR 169 Cb 0.54 -2.04 -0.07 0.00 -1.82 0.00 0.00 70.33 66.94 2pup n THR 169 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2pup n ASN 170 N 6.81 3.03 -0.23 8.00 2.85 -1.26 -4.98 115.26 129.48 2pup n ASN 170 Ca 0.21 -3.32 -0.03 0.00 -0.11 0.00 0.00 54.58 51.32 2pup n ASN 170 Cb 0.34 -0.64 0.07 0.00 1.24 0.00 0.00 39.78 40.80 2pup n ASN 170 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2pup h PRO 171 N 3.82 0.75 -0.03 1.20 0.11 -1.97 -1.52 132.00 134.36 2pup h PRO 171 Ca 0.15 -0.05 -0.24 0.00 0.11 0.00 0.00 66.00 65.98 2pup h PRO 171 Cb 0.69 -0.17 0.01 0.00 0.11 0.00 0.00 31.00 31.64 2pup h PRO 171 CO 0.74 0.50 -0.95 0.93 -0.21 0.00 0.00 178.00 179.01 2pup h GLU 172 N 0.77 0.61 0.00 1.05 5.08 -1.99 -1.92 114.58 118.18 2pup h GLU 172 Ca 0.27 -0.61 -0.15 0.00 -1.00 0.00 0.00 59.36 57.87 2pup h GLU 172 Cb 0.05 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2pup h GLU 172 CO -0.12 1.22 -0.72 -0.07 -1.00 0.00 0.00 179.01 178.33 2pup h LEU 173 N 0.36 0.00 -0.55 1.33 -0.00 -1.91 -2.71 115.31 111.83 2pup h LEU 173 Ca -0.09 0.00 -0.15 0.00 -0.00 0.00 0.00 57.88 57.63 2pup h LEU 173 Cb 1.58 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 42.24 2pup h LEU 173 CO 0.18 0.72 -0.49 0.00 -0.00 0.00 0.00 178.44 178.84 2pup h ASP 175 N 0.47 1.08 -0.13 0.00 -0.00 -1.15 0.43 116.42 117.12 2pup h ASP 175 Ca 0.02 -0.22 0.05 0.00 -0.00 0.00 0.00 57.03 56.87 2pup h ASP 175 Cb 1.03 -0.29 -0.05 0.00 -0.00 0.00 0.00 39.33 40.02 2pup h ASP 175 CO 0.10 1.03 -0.22 0.40 -0.00 0.00 0.00 179.24 180.55 2pup h ILE 176 N 1.09 0.47 -0.47 2.25 2.04 -1.33 -2.11 117.51 119.45 2pup h ILE 176 Ca 0.23 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 66.01 2pup h ILE 176 Cb 0.35 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 2pup h ILE 176 CO -0.00 0.00 -0.03 0.74 0.00 0.00 0.00 178.15 178.86 2pup h THR 177 N -0.27 1.27 -0.75 -0.27 2.02 -1.19 0.48 112.91 114.20 2pup h THR 177 Ca 0.10 -1.12 0.07 0.00 0.77 0.00 0.00 66.41 66.24 2pup h THR 177 Cb 0.42 1.04 -0.05 0.00 -1.74 0.00 0.00 68.15 67.82 2pup h THR 177 CO -0.29 0.39 0.49 -0.33 0.37 0.00 0.00 175.52 176.15 2pup h GLU 178 N 0.71 0.73 0.04 6.66 5.08 -0.08 0.15 114.58 127.87 2pup h GLU 178 Ca 0.13 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.30 2pup h GLU 178 Cb 0.55 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2pup h GLU 178 CO 0.03 0.49 -0.76 0.00 -1.00 0.00 0.00 179.01 177.76 2pup h ARG 179 N 0.76 0.09 0.20 2.33 3.08 -1.03 -3.22 114.38 116.58 2pup h ARG 179 Ca 0.33 -0.15 -0.33 0.00 0.07 0.00 0.00 59.98 59.90 2pup h ARG 179 Cb 0.30 0.06 0.02 0.00 0.08 0.00 0.00 29.97 30.43 2pup h ARG 179 CO -0.11 1.07 -1.59 -0.07 -1.07 0.00 0.00 179.97 178.20 2pup h LEU 180 N -0.78 0.66 0.17 3.04 3.38 -0.77 0.27 115.31 121.29 2pup h LEU 180 Ca -0.18 -0.93 -0.25 0.00 0.09 0.00 0.00 57.88 56.61 2pup h LEU 180 Cb 1.33 -0.21 0.03 0.00 0.09 0.00 0.00 40.66 41.89 2pup h LEU 180 CO -0.03 1.73 -1.07 0.58 0.09 0.00 0.00 178.44 179.74 2pup h VAL 181 N 0.05 1.41 -0.01 1.22 2.07 -0.90 -3.41 116.25 116.69 2pup h VAL 181 Ca -0.31 -2.56 0.00 0.00 0.82 0.00 0.00 66.70 64.65 2pup h VAL 181 Cb 2.06 3.08 0.00 0.00 -1.52 0.00 0.00 31.29 34.91 2pup h VAL 181 CO 0.19 0.75 -0.48 0.49 0.02 0.00 0.00 177.57 178.54 2pup n PHE 182 N -3.96 0.00 0.02 1.57 3.72 -1.16 -4.75 117.46 112.89 2pup n PHE 182 Ca -0.15 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 2pup n PHE 182 Cb 0.93 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.47 2pup n PHE 182 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2pup n THR 183 N -0.43 0.07 -0.27 4.37 -1.04 -0.92 -4.81 114.28 111.26 2pup n THR 183 Ca 0.06 0.02 0.06 0.00 -2.04 0.00 0.00 64.05 62.16 2pup n THR 183 Cb 0.35 -0.48 0.20 0.00 -1.82 0.00 0.00 70.33 68.58 2pup n THR 183 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2pup h ASP 184 N 0.00 0.42 0.63 8.00 5.19 -0.73 0.10 116.42 130.03 2pup h ASP 184 Ca 0.00 0.10 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 2pup h ASP 184 Cb 0.00 0.04 -0.00 0.00 0.18 0.00 0.00 39.33 39.55 2pup h ASP 184 CO 0.00 0.18 -0.05 -0.65 -3.12 0.00 0.00 179.24 175.59 2pup h PRO 185 N 0.55 0.00 -0.06 3.56 0.11 -1.79 -2.76 132.00 131.61 2pup h PRO 185 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.54 2pup h PRO 185 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 2pup h PRO 185 CO -0.37 0.05 0.00 1.19 -0.21 0.00 0.00 178.00 178.66 2pup n PHE 186 N -3.25 0.06 -4.30 0.65 3.72 0.35 -4.86 117.46 109.84 2pup n PHE 186 Ca -0.01 -0.03 -0.20 0.00 -0.05 0.00 0.00 57.45 57.16 2pup n PHE 186 Cb 0.25 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.71 2pup n PHE 186 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2pup s PHE 187 N -1.94 1.74 -1.30 1.38 0.40 -1.04 -4.57 117.98 112.66 2pup s PHE 187 Ca 0.36 -1.63 -0.12 0.00 -0.60 0.00 0.00 56.93 54.94 2pup s PHE 187 Cb 0.19 -0.74 0.13 0.00 0.51 0.00 0.00 43.02 43.11 2pup s PHE 187 CO 0.30 -0.82 1.80 -3.47 0.70 0.00 0.00 175.22 173.73 2pup n ASP 188 N -1.48 4.89 -4.73 1.36 4.64 -1.26 -4.94 116.55 115.02 2pup n ASP 188 Ca 0.06 -3.00 -0.26 0.00 -1.38 0.00 0.00 54.79 50.21 2pup n ASP 188 Cb 0.63 -1.57 -0.06 0.00 -1.04 0.00 0.00 41.12 39.07 2pup n ASP 188 CO 0.00 0.00 0.00 -1.00 -0.82 0.00 0.00 177.20 175.38 2pup s HIS 189 N 1.71 3.00 0.12 -0.67 3.76 -1.26 -5.05 115.29 116.90 2pup s HIS 189 Ca 0.44 -0.08 -0.23 0.00 -0.15 0.00 0.00 55.06 55.03 2pup s HIS 189 Cb 0.06 -1.44 -0.05 0.00 1.11 0.00 0.00 32.58 32.26 2pup s HIS 189 CO -0.00 0.52 1.20 -0.25 -0.85 0.00 0.00 174.74 175.36 2pup n ASP 190 N -0.30 -0.79 0.00 1.40 8.00 -1.26 -2.03 116.55 121.58 2pup n ASP 190 Ca -0.09 1.37 0.06 0.00 0.71 0.00 0.00 54.79 56.85 2pup n ASP 190 Cb 0.55 -0.20 0.27 0.00 -0.02 0.00 0.00 41.12 41.73 2pup n ASP 190 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2pup n THR 191 N -4.85 1.06 -1.70 -3.53 -2.24 -1.26 -4.79 114.28 96.97 2pup n THR 191 Ca 0.01 0.26 -0.34 0.00 -2.27 0.00 0.00 64.05 61.72 2pup n THR 191 Cb 0.19 -1.05 0.06 0.00 -2.10 0.00 0.00 70.33 67.43 2pup n THR 191 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2pup s ASN 192 N -2.92 4.86 -0.29 3.42 0.01 -0.86 -1.49 114.94 117.68 2pup s ASN 192 Ca 0.07 2.13 0.02 0.00 -0.71 0.00 0.00 52.86 54.37 2pup s ASN 192 Cb 0.08 -2.57 0.16 0.00 0.41 0.00 0.00 41.25 39.33 2pup s ASN 192 CO 0.22 -1.80 0.40 -0.62 -1.51 0.00 0.00 177.10 173.78 2pup s ASP 193 N -2.33 0.53 0.01 -1.22 3.68 -0.16 -4.77 116.67 112.40 2pup s ASP 193 Ca 0.70 -0.41 -0.06 0.00 2.13 0.00 0.00 52.55 54.91 2pup s ASP 193 Cb -0.24 1.04 -0.00 0.00 -1.45 0.00 0.00 42.92 42.27 2pup s ASP 193 CO 0.41 -0.36 0.11 0.72 0.13 0.00 0.00 175.17 176.19 2pup s PHE 194 N 2.52 0.09 0.50 -5.34 -0.71 -1.26 -4.37 117.98 109.42 2pup s PHE 194 Ca 0.10 -0.24 -0.23 0.00 -1.04 0.00 0.00 56.93 55.52 2pup s PHE 194 Cb -0.13 -0.08 -0.07 0.00 -1.21 0.00 0.00 43.02 41.54 2pup s PHE 194 CO -0.30 -0.28 1.29 0.39 -1.34 0.00 0.00 175.22 174.98 2pup n GLU 195 N 1.38 1.73 0.12 1.99 4.71 -1.26 -4.90 120.64 124.40 2pup n GLU 195 Ca -0.22 0.63 0.05 0.00 -0.01 0.00 0.00 57.16 57.60 2pup n GLU 195 Cb 0.56 -2.47 0.50 0.00 -1.01 0.00 0.00 31.44 29.01 2pup n GLU 195 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 2pup h GLU 196 N 1.61 0.28 0.00 3.49 4.57 -2.01 -1.49 114.58 121.03 2pup h GLU 196 Ca -0.50 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 57.65 2pup h GLU 196 Cb 1.30 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.84 2pup h GLU 196 CO 0.58 0.23 -0.04 0.93 -1.18 0.00 0.00 179.01 179.53 2pup h GLU 197 N 0.28 0.00 0.00 1.92 3.07 -2.03 -1.15 114.58 116.68 2pup h GLU 197 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 2pup h GLU 197 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 2pup h GLU 197 CO -0.01 0.04 -0.63 1.25 -1.40 0.00 0.00 179.01 178.26 2pup h LEU 198 N 0.00 0.00 -0.69 1.33 5.85 -1.63 -3.40 115.31 116.77 2pup h LEU 198 Ca -0.00 -0.15 0.13 0.00 0.84 0.00 0.00 57.88 58.70 2pup h LEU 198 Cb 0.28 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 41.18 2pup h LEU 198 CO 0.00 0.07 -0.28 -0.09 -0.34 0.00 0.00 178.44 177.81 2pup h ARG 199 N 0.00 -0.08 -0.94 1.25 2.43 -1.20 -1.86 114.38 113.98 2pup h ARG 199 Ca 0.00 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.31 2pup h ARG 199 Cb 0.81 0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 30.30 2pup h ARG 199 CO 0.00 -0.05 0.60 -1.35 -1.51 0.00 0.00 179.97 177.66 2pup h PRO 200 N -0.08 0.82 -0.13 0.20 0.11 -1.80 0.84 132.00 131.97 2pup h PRO 200 Ca 0.30 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 66.19 2pup h PRO 200 Cb 0.55 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.49 2pup h PRO 200 CO -0.75 0.54 -0.58 0.74 -0.21 0.00 0.00 178.00 177.74 2pup h PHE 201 N 0.84 0.83 -0.21 0.65 -1.00 -1.67 -2.04 116.94 114.34 2pup h PHE 201 Ca 0.47 -0.36 0.06 0.00 2.81 0.00 0.00 57.97 60.94 2pup h PHE 201 Cb 0.60 -0.13 -0.07 0.00 3.61 0.00 0.00 35.95 39.96 2pup h PHE 201 CO -0.00 1.16 -0.31 0.28 -1.61 0.00 0.00 178.31 177.82 2pup h VAL 202 N 0.27 0.29 -0.97 -0.55 2.07 -0.83 -1.21 116.25 115.31 2pup h VAL 202 Ca -0.04 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.63 2pup h VAL 202 Cb 1.22 0.29 -0.08 0.00 -1.52 0.00 0.00 31.29 31.19 2pup h VAL 202 CO 0.12 0.00 0.61 -0.33 0.02 0.00 0.00 177.57 177.99 2pup h GLU 203 N -0.34 0.81 -0.87 1.57 5.08 -0.86 0.15 114.58 120.12 2pup h GLU 203 Ca 0.12 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2pup h GLU 203 Cb 0.53 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 2pup h GLU 203 CO -0.40 0.54 0.54 -0.22 -1.00 0.00 0.00 179.01 178.47 2pup h LYS 204 N 0.84 1.16 -0.51 2.33 3.64 -0.66 -0.39 116.57 122.98 2pup h LYS 204 Ca 0.50 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.66 2pup h LYS 204 Cb 0.67 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2pup h LYS 204 CO -0.27 0.80 -0.17 1.25 -2.27 0.00 0.00 179.45 178.79 2pup h LEU 205 N 1.18 1.03 -1.72 5.20 5.85 0.08 -2.87 115.31 124.06 2pup h LEU 205 Ca 0.31 -0.38 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 2pup h LEU 205 Cb -0.08 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.66 2pup h LEU 205 CO -0.06 1.17 -0.17 -0.50 -0.34 0.00 0.00 178.44 178.54 2pup h TRP 206 N 0.88 0.00 -0.01 1.25 6.55 -0.31 -2.46 115.95 121.86 2pup h TRP 206 Ca 0.12 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.96 2pup h TRP 206 Cb 0.75 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.05 2pup h TRP 206 CO 0.05 0.17 -0.23 0.09 -1.05 0.00 0.00 178.44 177.48 2pup n ASN 207 N -3.82 0.94 -4.46 -3.49 3.02 -0.20 -4.74 115.26 102.52 2pup n ASN 207 Ca -0.02 -0.85 -0.43 0.00 -0.03 0.00 0.00 54.58 53.25 2pup n ASN 207 Cb 0.28 0.10 -0.03 0.00 -0.61 0.00 0.00 39.78 39.51 2pup n ASN 207 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2pup s ASN 208 N -2.49 6.48 0.22 6.41 3.84 -0.93 -4.90 114.94 123.58 2pup s ASN 208 Ca 0.25 -1.69 -0.08 0.00 0.21 0.00 0.00 52.86 51.55 2pup s ASN 208 Cb 0.19 -2.42 0.25 0.00 -0.55 0.00 0.00 41.25 38.73 2pup s ASN 208 CO 0.51 -1.21 1.84 0.44 -2.79 0.00 0.00 177.10 175.89 2pup h ASP 209 N 9.13 0.75 0.70 -4.21 3.32 -1.86 -2.63 116.42 121.62 2pup h ASP 209 Ca 0.03 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 2pup h ASP 209 Cb 1.04 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 2pup h ASP 209 CO 1.16 0.50 -0.51 0.77 -1.72 0.00 0.00 179.24 179.44 2pup h SER 210 N 0.88 0.00 0.01 6.45 4.64 -1.98 -0.63 113.55 122.92 2pup h SER 210 Ca 0.32 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.42 2pup h SER 210 Cb 0.10 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.21 2pup h SER 210 CO -0.14 0.51 -0.88 0.58 -0.87 0.00 0.00 176.83 176.02 2pup h VAL 211 N 0.00 1.34 -0.15 0.95 2.07 -1.94 -3.09 116.25 115.42 2pup h VAL 211 Ca -0.01 -2.19 0.01 0.00 0.82 0.00 0.00 66.70 65.33 2pup h VAL 211 Cb 0.99 2.48 -0.01 0.00 -1.52 0.00 0.00 31.29 33.24 2pup h VAL 211 CO 0.07 0.66 0.08 0.11 0.02 0.00 0.00 177.57 178.51 2pup h LYS 212 N 0.19 0.17 -0.75 1.57 1.57 -1.11 -0.61 116.57 117.60 2pup h LYS 212 Ca -0.11 -0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.79 2pup h LYS 212 Cb 1.56 -0.04 -0.14 0.00 0.08 0.00 0.00 32.23 33.70 2pup h LYS 212 CO 0.17 0.11 -0.32 0.82 -0.57 0.00 0.00 179.45 179.66 2pup h ILE 213 N 0.17 0.12 -0.46 1.86 2.04 -1.22 0.32 117.51 120.34 2pup h ILE 213 Ca 0.06 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.94 2pup h ILE 213 Cb 0.00 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.18 2pup h ILE 213 CO -0.04 0.00 0.29 -0.33 0.00 0.00 0.00 178.15 178.07 2pup h GLU 214 N -0.08 0.56 -0.99 2.37 4.39 -1.35 -1.09 114.58 118.38 2pup h GLU 214 Ca 0.30 -0.03 0.04 0.00 0.34 0.00 0.00 59.36 60.00 2pup h GLU 214 Cb 0.57 -0.13 -0.06 0.00 -0.10 0.00 0.00 28.75 29.04 2pup h GLU 214 CO -0.80 0.37 0.65 0.00 -1.16 0.00 0.00 179.01 178.07 2pup h ALA 215 N 1.19 1.31 -0.28 3.43 0.00 -0.21 -1.02 119.26 123.69 2pup h ALA 215 Ca 0.18 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2pup h ALA 215 Cb -0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.40 2pup h ALA 215 CO -0.07 0.54 0.16 0.00 0.00 0.00 0.00 179.25 179.89 2pup h ALA 216 N 1.40 0.35 -0.44 0.00 0.00 0.22 0.26 119.26 121.05 2pup h ALA 216 Ca 0.39 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.37 2pup h ALA 216 Cb -0.00 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 2pup h ALA 216 CO -0.12 -0.22 0.09 0.87 0.00 0.00 0.00 179.25 179.87 2pup h LYS 217 N 0.33 0.22 -0.52 0.00 1.57 -0.80 0.76 116.57 118.13 2pup h LYS 217 Ca 0.11 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.89 2pup h LYS 217 Cb -0.00 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 2pup h LYS 217 CO -0.05 0.15 0.33 -0.07 -0.57 0.00 0.00 179.45 179.23 2pup h LEU 218 N 0.23 0.55 -0.48 2.94 3.38 -0.93 0.19 115.31 121.19 2pup h LEU 218 Ca 0.22 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.21 2pup h LEU 218 Cb 0.27 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2pup h LEU 218 CO -0.28 0.39 0.26 0.50 0.09 0.00 0.00 178.44 179.40 2pup h LYS 219 N 0.66 0.50 -0.52 1.13 3.64 0.09 -0.93 116.57 121.14 2pup h LYS 219 Ca 0.20 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 2pup h LYS 219 Cb -0.03 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 2pup h LYS 219 CO -0.07 0.33 0.12 -0.22 -2.27 0.00 0.00 179.45 177.34 2pup h LYS 220 N 0.51 0.80 -0.37 1.90 3.11 -0.33 0.40 116.57 122.59 2pup h LYS 220 Ca 0.20 -0.16 -0.03 0.00 -2.81 0.00 0.00 60.65 57.85 2pup h LYS 220 Cb 0.08 -0.12 -0.02 0.00 -1.00 0.00 0.00 32.23 31.17 2pup h LYS 220 CO -0.12 0.73 0.12 1.03 -2.81 0.00 0.00 179.45 178.40 2pup h SER 221 N 0.77 0.53 -0.94 4.20 0.87 -0.67 -1.94 113.55 116.37 2pup h SER 221 Ca 0.17 -0.20 0.05 0.00 -1.23 0.00 0.00 61.79 60.58 2pup h SER 221 Cb 0.29 -0.14 -0.06 0.00 -0.44 0.00 0.00 62.40 62.06 2pup h SER 221 CO -0.00 0.59 0.60 0.15 -0.53 0.00 0.00 176.83 177.64 2pup h PHE 222 N 0.45 1.13 0.00 2.24 3.57 0.34 0.13 116.94 124.80 2pup h PHE 222 Ca 0.12 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.59 2pup h PHE 222 Cb 0.24 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 2pup h PHE 222 CO 0.01 0.62 -0.26 -0.07 -2.23 0.00 0.00 178.31 176.38 2pup h LEU 223 N 1.14 0.00 0.00 0.59 3.38 -0.01 -3.40 115.31 117.01 2pup h LEU 223 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2pup h LEU 223 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2pup h LEU 223 CO -0.14 0.26 -0.47 0.35 0.09 0.00 0.00 178.44 178.52 2pup n THR 224 N -3.61 0.00 -1.82 0.22 -2.24 -0.75 -4.93 114.28 101.14 2pup n THR 224 Ca -0.01 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.38 2pup n THR 224 Cb 0.39 -0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.29 2pup n THR 224 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2pup n SER 225 N -1.09 3.51 -3.79 3.42 7.64 0.42 -4.89 113.62 118.84 2pup n SER 225 Ca 0.00 -2.78 -0.42 0.00 1.01 0.00 0.00 58.87 56.69 2pup n SER 225 Cb 0.18 -1.53 -0.03 0.00 -1.01 0.00 0.00 64.21 61.82 2pup n SER 225 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2pup n ALA 226 N 8.95 4.25 0.01 -0.43 0.00 -1.26 -2.05 120.51 129.99 2pup n ALA 226 Ca 0.49 -3.59 -0.22 0.00 0.00 0.00 0.00 53.44 50.12 2pup n ALA 226 Cb 0.43 -3.58 -0.14 0.00 0.00 0.00 0.00 19.45 16.15 2pup n ALA 226 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2pup h GLU 227 N 7.12 0.27 -3.53 0.00 5.08 -1.57 -3.45 114.58 118.50 2pup h GLU 227 Ca 0.48 -0.46 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2pup h GLU 227 Cb 0.68 0.17 -0.09 0.00 0.50 0.00 0.00 28.75 30.02 2pup h GLU 227 CO 1.85 1.22 -0.06 0.99 -1.00 0.00 0.00 179.01 182.02 2pup s THR 228 N -2.53 0.00 -0.58 1.13 2.01 -0.91 -4.00 115.64 110.77 2pup s THR 228 Ca -0.21 -1.31 -0.27 0.00 0.31 0.00 0.00 61.69 60.21 2pup s THR 228 Cb 0.06 -2.13 0.03 0.00 0.01 0.00 0.00 72.50 70.47 2pup s THR 228 CO 0.77 -0.01 1.11 -0.22 -0.69 0.00 0.00 174.62 175.58 2pup s LEU 229 N -2.99 3.67 0.34 4.42 2.96 -1.26 -0.86 118.68 124.95 2pup s LEU 229 Ca 0.20 -0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 53.99 2pup s LEU 229 Cb -0.02 -3.00 -0.04 0.00 0.50 0.00 0.00 46.19 43.64 2pup s LEU 229 CO 0.08 -1.42 0.57 0.27 -1.32 0.00 0.00 176.35 174.53 2pup s ILE 230 N 4.65 5.07 0.04 6.68 -4.36 -0.12 -4.70 121.20 128.45 2pup s ILE 230 Ca 0.38 -0.27 -0.18 0.00 -0.26 0.00 0.00 60.65 60.32 2pup s ILE 230 Cb -0.09 -3.83 -0.18 0.00 1.25 0.00 0.00 42.46 39.61 2pup s ILE 230 CO 0.22 -0.51 1.22 -0.74 0.24 0.00 0.00 174.94 175.37 2pup h HIS 231 N 0.99 0.67 0.00 1.37 -0.00 -1.90 -3.16 115.15 113.12 2pup h HIS 231 Ca -0.49 -0.30 0.00 0.00 -0.00 0.00 0.00 60.37 59.59 2pup h HIS 231 Cb 1.21 -0.10 0.00 0.00 -0.00 0.00 0.00 27.41 28.52 2pup h HIS 231 CO 0.54 1.07 0.00 0.41 -0.00 0.00 0.00 177.93 179.94 2pup n GLY 232 N 0.71 1.43 2.70 5.26 0.00 -1.26 -2.37 105.19 111.66 2pup n GLY 232 Ca -0.08 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.89 2pup n GLY 232 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2pup n ASP 233 N 0.00 -1.12 -3.69 1.61 4.64 -1.26 -4.83 116.55 111.90 2pup n ASP 233 Ca 0.00 -2.34 -0.42 0.00 -1.38 0.00 0.00 54.79 50.65 2pup n ASP 233 Cb 0.00 0.61 -0.00 0.00 -1.04 0.00 0.00 41.12 40.69 2pup n ASP 233 CO 0.00 0.00 0.00 -0.11 -0.82 0.00 0.00 177.20 176.27 2pup n LEU 234 N -0.96 7.21 -5.02 -2.67 -0.00 -1.26 -4.74 117.00 109.56 2pup n LEU 234 Ca -0.07 -4.49 -0.20 0.00 -0.00 0.00 0.00 56.01 51.25 2pup n LEU 234 Cb 0.86 -1.53 0.05 0.00 -0.00 0.00 0.00 43.42 42.80 2pup n LEU 234 CO -0.07 1.49 0.31 -1.38 -0.00 0.00 0.00 177.39 177.74 2pup s HIS 235 N 1.26 1.53 -0.17 1.96 -3.43 -1.26 -2.81 115.29 112.38 2pup s HIS 235 Ca 0.48 -0.71 0.29 0.00 -0.80 0.00 0.00 55.06 54.32 2pup s HIS 235 Cb 0.13 -2.20 0.99 0.00 -1.43 0.00 0.00 32.58 30.07 2pup s HIS 235 CO -0.05 -1.05 1.83 1.79 -2.00 0.00 0.00 174.74 175.27 2pup h THR 236 N 0.26 0.00 0.00 -5.38 1.35 -1.91 -0.15 112.91 107.08 2pup h THR 236 Ca -0.31 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 2pup h THR 236 Cb 1.29 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 2pup h THR 236 CO 0.42 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.30 2pup n GLY 237 N 0.43 -0.70 0.72 5.82 0.00 -1.26 -1.93 105.19 108.27 2pup n GLY 237 Ca 0.02 -0.14 0.04 0.00 0.00 0.00 0.00 46.02 45.94 2pup n GLY 237 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2pup n SER 238 N -0.99 1.96 -3.76 1.61 7.64 -0.07 -4.92 113.62 115.09 2pup n SER 238 Ca 0.16 -3.82 -0.13 0.00 1.01 0.00 0.00 58.87 56.09 2pup n SER 238 Cb 0.08 -0.55 -0.13 0.00 -1.01 0.00 0.00 64.21 62.59 2pup n SER 238 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2pup s ILE 239 N -3.22 -0.03 -0.02 0.44 1.01 -1.21 -1.97 121.20 116.21 2pup s ILE 239 Ca 0.39 0.12 -0.07 0.00 0.00 0.00 0.00 60.65 61.09 2pup s ILE 239 Cb 0.37 -0.28 -0.05 0.00 0.01 0.00 0.00 42.46 42.51 2pup s ILE 239 CO -0.05 0.05 0.26 -0.36 0.00 0.00 0.00 174.94 174.84 2pup s PHE 240 N 0.91 3.60 -0.06 3.97 0.08 0.10 -0.12 117.98 126.45 2pup s PHE 240 Ca -0.07 0.60 -0.15 0.00 0.12 0.00 0.00 56.93 57.43 2pup s PHE 240 Cb -0.08 -2.00 0.03 0.00 -0.57 0.00 0.00 43.02 40.39 2pup s PHE 240 CO -0.05 0.64 0.36 0.00 -0.10 0.00 0.00 175.22 176.07 2pup s ALA 241 N -1.23 -0.90 0.19 5.36 0.00 0.17 -1.03 121.76 124.32 2pup s ALA 241 Ca 0.25 0.66 0.04 0.00 0.00 0.00 0.00 51.96 52.91 2pup s ALA 241 Cb -0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 2pup s ALA 241 CO 0.14 -0.24 0.14 -1.13 0.00 0.00 0.00 175.76 174.67 2pup n SER 242 N 1.84 -0.11 -0.32 0.00 3.41 -0.97 -1.12 113.62 116.36 2pup n SER 242 Ca -0.18 -2.22 0.14 0.00 -0.26 0.00 0.00 58.87 56.35 2pup n SER 242 Cb 0.57 0.86 0.33 0.00 -0.26 0.00 0.00 64.21 65.71 2pup n SER 242 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2pup h GLU 243 N 0.00 0.47 -0.00 4.33 4.81 -1.99 -3.17 114.58 119.03 2pup h GLU 243 Ca -0.14 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 2pup h GLU 243 Cb 0.67 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2pup h GLU 243 CO 0.21 0.31 -0.21 0.72 -0.73 0.00 0.00 179.01 179.30 2pup n HIS 244 N -4.98 0.00 -4.22 0.92 8.25 -1.26 -4.41 115.22 109.52 2pup n HIS 244 Ca 0.24 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.52 2pup n HIS 244 Cb 0.67 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.67 2pup n HIS 244 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2pup s GLU 245 N -1.32 0.96 -0.09 -0.41 2.02 -1.20 -5.06 118.70 113.60 2pup s GLU 245 Ca 0.04 -1.17 -0.04 0.00 0.02 0.00 0.00 54.97 53.82 2pup s GLU 245 Cb 0.05 -0.85 0.05 0.00 0.10 0.00 0.00 34.13 33.47 2pup s GLU 245 CO 0.21 0.17 0.20 0.99 0.02 0.00 0.00 175.26 176.84 2pup s THR 246 N -1.97 -0.13 -0.07 3.63 2.01 -1.26 -2.28 115.64 115.56 2pup s THR 246 Ca 0.06 0.21 0.03 0.00 0.31 0.00 0.00 61.69 62.30 2pup s THR 246 Cb -0.06 -0.33 0.01 0.00 0.01 0.00 0.00 72.50 72.14 2pup s THR 246 CO 0.03 0.09 -0.15 -0.54 -0.69 0.00 0.00 174.62 173.35 2pup s LYS 247 N 1.57 2.05 -0.26 4.92 -0.14 -0.20 -4.43 119.74 123.25 2pup s LYS 247 Ca -0.06 -0.53 -0.12 0.00 -1.36 0.00 0.00 55.97 53.90 2pup s LYS 247 Cb -0.11 -1.64 -0.05 0.00 -1.68 0.00 0.00 37.83 34.35 2pup s LYS 247 CO -0.07 0.06 0.25 0.08 -0.76 0.00 0.00 175.35 174.91 2pup s VAL 248 N 0.59 5.27 0.46 3.17 1.01 0.69 0.01 120.40 131.60 2pup s VAL 248 Ca -0.16 0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.22 2pup s VAL 248 Cb -0.16 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 2pup s VAL 248 CO 0.05 0.24 0.30 0.27 0.00 0.00 0.00 175.10 175.96 2pup s ILE 249 N 1.68 2.15 -0.80 2.22 -4.36 -0.83 -4.47 121.20 116.78 2pup s ILE 249 Ca 0.10 -1.55 -0.03 0.00 -0.26 0.00 0.00 60.65 58.91 2pup s ILE 249 Cb -0.15 -2.70 0.00 0.00 1.25 0.00 0.00 42.46 40.86 2pup s ILE 249 CO 0.09 0.00 0.69 -0.67 0.24 0.00 0.00 174.94 175.29 2pup n ASP 250 N -1.49 -3.63 -1.86 4.36 2.03 -1.26 -4.79 116.55 109.91 2pup n ASP 250 Ca -0.01 -0.36 -0.07 0.00 0.52 0.00 0.00 54.79 54.88 2pup n ASP 250 Cb 0.64 -3.34 -0.10 0.00 -0.72 0.00 0.00 41.12 37.60 2pup n ASP 250 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2pup n PRO 251 N -3.16 1.52 0.08 -0.67 -0.04 -1.26 -4.44 135.00 127.03 2pup n PRO 251 Ca -0.07 -0.59 0.13 0.00 -0.04 0.00 0.00 63.50 62.93 2pup n PRO 251 Cb 0.56 -1.63 0.46 0.00 -0.04 0.00 0.00 33.50 32.85 2pup n PRO 251 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2pup n GLU 252 N 2.18 0.19 -0.06 0.54 0.28 -1.26 -2.08 120.64 120.43 2pup n GLU 252 Ca 0.25 0.19 0.11 0.00 -0.16 0.00 0.00 57.16 57.55 2pup n GLU 252 Cb 0.71 -1.74 0.42 0.00 1.43 0.00 0.00 31.44 32.26 2pup n GLU 252 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2pup n PHE 253 N -2.07 0.16 -1.67 -1.84 3.01 -1.25 -4.73 117.46 109.07 2pup n PHE 253 Ca 0.05 -0.08 -0.45 0.00 1.01 0.00 0.00 57.45 57.98 2pup n PHE 253 Cb 0.38 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.82 2pup n PHE 253 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2pup n ALA 254 N 0.14 1.30 -3.80 4.37 0.00 -0.88 -4.49 120.51 117.14 2pup n ALA 254 Ca 0.16 0.43 -0.09 0.00 0.00 0.00 0.00 53.44 53.94 2pup n ALA 254 Cb 0.29 -2.32 0.03 0.00 0.00 0.00 0.00 19.45 17.44 2pup n ALA 254 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2pup s PHE 255 N 0.52 0.15 -0.63 0.00 -0.12 -1.19 -4.63 117.98 112.08 2pup s PHE 255 Ca 0.74 -0.85 -0.26 0.00 -0.05 0.00 0.00 56.93 56.51 2pup s PHE 255 Cb -0.66 0.85 0.04 0.00 -0.63 0.00 0.00 43.02 42.62 2pup s PHE 255 CO 0.43 -1.60 1.15 0.71 -0.05 0.00 0.00 175.22 175.85 2pup s TYR 256 N -2.13 2.55 0.00 3.49 2.02 -1.25 -0.95 117.35 121.08 2pup s TYR 256 Ca 0.16 0.09 0.00 0.00 -0.37 0.00 0.00 57.07 56.95 2pup s TYR 256 Cb -0.05 -4.45 0.00 0.00 -0.40 0.00 0.00 41.96 37.06 2pup s TYR 256 CO 0.12 -1.70 0.00 0.41 -1.57 0.00 0.00 175.55 172.80 2pup n GLY 257 N 5.20 4.44 3.75 0.71 0.00 -0.04 -4.28 105.19 114.98 2pup n GLY 257 Ca 0.04 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 2pup n GLY 257 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2pup s PRO 258 N -1.47 4.46 0.51 1.61 0.04 -0.87 -1.70 135.00 137.60 2pup s PRO 258 Ca 0.00 2.00 0.18 0.00 0.04 0.00 0.00 61.00 63.22 2pup s PRO 258 Cb 0.00 -3.17 1.27 0.00 0.04 0.00 0.00 34.50 32.65 2pup s PRO 258 CO 0.00 -0.08 2.10 0.82 0.04 0.00 0.00 177.00 179.88 2pup h ILE 259 N 3.37 0.93 -0.01 0.56 2.04 -1.91 -2.75 117.51 119.74 2pup h ILE 259 Ca -0.46 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.38 2pup h ILE 259 Cb 1.22 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 2pup h ILE 259 CO 0.71 0.01 -0.18 0.61 0.00 0.00 0.00 178.15 179.30 2pup n GLY 260 N -1.56 -0.58 0.18 5.37 0.00 -1.26 -4.25 105.19 103.09 2pup n GLY 260 Ca 0.01 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.51 2pup n GLY 260 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2pup h PHE 261 N 1.25 -0.35 -0.62 1.61 3.04 -1.81 0.04 116.94 120.10 2pup h PHE 261 Ca 0.00 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 2pup h PHE 261 Cb 0.47 0.12 -0.03 0.00 2.56 0.00 0.00 35.95 39.06 2pup h PHE 261 CO 0.00 -0.09 0.34 -0.44 -2.02 0.00 0.00 178.31 176.10 2pup h ASP 262 N -0.58 0.77 -0.71 0.41 3.32 -1.81 0.14 116.42 117.97 2pup h ASP 262 Ca -0.04 -0.09 0.11 0.00 0.02 0.00 0.00 57.03 57.02 2pup h ASP 262 Cb 0.42 -0.20 -0.08 0.00 0.22 0.00 0.00 39.33 39.70 2pup h ASP 262 CO 0.06 0.64 0.32 0.58 -1.72 0.00 0.00 179.24 179.13 2pup h VAL 263 N 0.84 0.79 -0.13 -1.35 2.07 -1.73 -0.40 116.25 116.33 2pup h VAL 263 Ca 0.22 -0.18 -0.22 0.00 0.82 0.00 0.00 66.70 67.33 2pup h VAL 263 Cb 0.04 0.21 0.01 0.00 -1.52 0.00 0.00 31.29 30.04 2pup h VAL 263 CO -0.03 0.10 -0.79 1.23 0.02 0.00 0.00 177.57 178.09 2pup h GLY 264 N 0.53 0.85 1.04 2.17 0.00 0.01 -1.76 103.07 105.92 2pup h GLY 264 Ca 0.36 -1.24 -0.12 0.00 0.00 0.00 0.00 47.33 46.34 2pup h GLY 264 CO -0.31 1.10 -0.20 -1.61 0.00 0.00 0.00 176.54 175.52 2pup h GLN 265 N 0.49 0.87 -0.03 4.80 4.15 -0.30 -0.18 115.11 124.92 2pup h GLN 265 Ca -0.06 -0.38 -0.00 0.00 0.77 0.00 0.00 58.65 58.98 2pup h GLN 265 Cb 1.43 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 29.09 2pup h GLN 265 CO 0.16 1.02 0.01 0.35 -1.93 0.00 0.00 178.83 178.45 2pup h PHE 266 N 0.69 0.04 0.01 3.99 3.04 -0.91 -2.46 116.94 121.33 2pup h PHE 266 Ca 0.09 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.06 2pup h PHE 266 Cb 0.76 -0.01 -0.02 0.00 2.56 0.00 0.00 35.95 39.24 2pup h PHE 266 CO 0.06 0.14 -0.10 0.82 -2.02 0.00 0.00 178.31 177.20 2pup h ILE 267 N -0.07 0.75 -0.86 1.41 2.04 -1.12 -1.83 117.51 117.83 2pup h ILE 267 Ca 0.01 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.09 2pup h ILE 267 Cb 0.11 0.75 -0.13 0.00 -0.74 0.00 0.00 36.82 36.81 2pup h ILE 267 CO -0.00 0.00 0.25 0.00 0.00 0.00 0.00 178.15 178.40 2pup h ALA 268 N 0.79 1.25 -0.13 1.87 0.00 -0.96 0.13 119.26 122.21 2pup h ALA 268 Ca 0.04 0.21 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 2pup h ALA 268 Cb 0.22 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2pup h ALA 268 CO -0.10 -0.43 -0.33 -0.91 0.00 0.00 0.00 179.25 177.48 2pup h ASN 269 N 0.24 0.26 -0.28 0.00 2.35 -0.89 0.33 115.58 117.60 2pup h ASN 269 Ca 0.53 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 56.18 2pup h ASN 269 Cb 1.04 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.32 2pup h ASN 269 CO -0.62 0.59 0.16 -0.07 -1.65 0.00 0.00 177.43 175.84 2pup h LEU 270 N 0.23 0.35 -0.90 1.61 3.38 0.01 -1.64 115.31 118.34 2pup h LEU 270 Ca 0.03 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2pup h LEU 270 Cb 0.70 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 2pup h LEU 270 CO 0.05 0.32 0.42 -0.26 0.09 0.00 0.00 178.44 179.07 2pup h PHE 271 N 0.34 1.21 -0.71 1.13 0.04 -0.77 -1.46 116.94 116.72 2pup h PHE 271 Ca 0.10 -0.05 0.09 0.00 2.80 0.00 0.00 57.97 60.90 2pup h PHE 271 Cb 0.05 -0.38 -0.07 0.00 2.20 0.00 0.00 35.95 37.75 2pup h PHE 271 CO -0.04 0.86 0.37 -0.07 -0.60 0.00 0.00 178.31 178.84 2pup h LEU 272 N 1.21 0.50 -0.70 1.54 3.38 -0.09 -0.65 115.31 120.50 2pup h LEU 272 Ca 0.29 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 2pup h LEU 272 Cb 0.09 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2pup h LEU 272 CO -0.04 0.30 0.40 -1.13 0.09 0.00 0.00 178.44 178.06 2pup h ASN 273 N 0.64 0.85 -0.61 -0.43 -0.73 -1.01 -2.92 115.58 111.37 2pup h ASN 273 Ca 0.34 -0.08 0.08 0.00 1.87 0.00 0.00 56.30 58.52 2pup h ASN 273 Cb 0.33 -0.22 -0.07 0.00 0.27 0.00 0.00 38.32 38.63 2pup h ASN 273 CO -0.25 0.68 0.26 0.00 -0.37 0.00 0.00 177.43 177.75 2pup h ALA 274 N 1.21 0.79 -0.03 1.57 0.00 -0.19 0.62 119.26 123.23 2pup h ALA 274 Ca 0.25 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.23 2pup h ALA 274 Cb 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2pup h ALA 274 CO -0.04 -0.14 0.06 -0.07 0.00 0.00 0.00 179.25 179.05 2pup h LEU 275 N 0.46 0.00 -0.47 0.00 3.38 -0.98 -0.57 115.31 117.13 2pup h LEU 275 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2pup h LEU 275 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2pup h LEU 275 CO -0.27 0.00 -0.23 -1.54 0.09 0.00 0.00 178.44 176.49 2pup n SER 276 N -3.47 0.96 -4.91 -0.43 3.41 0.19 -4.89 113.62 104.49 2pup n SER 276 Ca -0.02 -0.86 -0.23 0.00 -0.26 0.00 0.00 58.87 57.50 2pup n SER 276 Cb 0.14 0.10 -0.01 0.00 -0.26 0.00 0.00 64.21 64.18 2pup n SER 276 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2pup s ARG 277 N -2.49 2.39 0.01 4.33 0.52 -0.22 -4.99 118.95 118.50 2pup s ARG 277 Ca 0.25 -1.74 0.07 0.00 -0.52 0.00 0.00 55.73 53.78 2pup s ARG 277 Cb 0.19 -2.30 -0.02 0.00 0.52 0.00 0.00 34.95 33.34 2pup s ARG 277 CO 0.51 -0.45 -0.20 -0.51 0.02 0.00 0.00 175.30 174.67 2pup s ASP 278 N -4.26 2.35 0.99 0.23 -0.00 -1.26 -4.93 116.67 109.79 2pup s ASP 278 Ca 0.44 -0.44 0.00 0.00 -0.00 0.00 0.00 52.55 52.56 2pup s ASP 278 Cb -0.03 -0.23 0.00 0.00 -0.00 0.00 0.00 42.92 42.66 2pup s ASP 278 CO 0.27 0.19 0.00 0.61 -0.00 0.00 0.00 175.17 176.24 2pup n GLY 279 N 2.22 3.11 0.30 0.21 0.00 -1.26 -2.17 105.19 107.61 2pup n GLY 279 Ca -0.16 0.01 0.09 0.00 0.00 0.00 0.00 46.02 45.96 2pup n GLY 279 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pup h ALA 280 N -0.50 2.01 0.00 4.61 0.00 -2.03 -1.86 119.26 121.48 2pup h ALA 280 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2pup h ALA 280 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2pup h ALA 280 CO 0.00 -0.05 0.00 -0.25 0.00 0.00 0.00 179.25 178.95 2pup n ASP 281 N -4.49 0.15 0.19 0.00 10.43 -0.92 -2.03 116.55 119.88 2pup n ASP 281 Ca 0.02 0.56 0.10 0.00 2.57 0.00 0.00 54.79 58.04 2pup n ASP 281 Cb 0.19 -0.58 0.13 0.00 1.84 0.00 0.00 41.12 42.69 2pup n ASP 281 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 2pup h ARG 282 N 0.00 0.00 -0.71 -1.24 3.08 -1.47 -3.38 114.38 110.66 2pup h ARG 282 Ca 0.00 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.18 2pup h ARG 282 Cb 0.04 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.00 2pup h ARG 282 CO 0.00 0.13 0.27 0.93 -1.07 0.00 0.00 179.97 180.22 2pup h GLU 283 N 0.00 0.40 -0.82 0.04 4.39 -1.60 0.15 114.58 117.15 2pup h GLU 283 Ca -0.00 -0.02 0.08 0.00 0.34 0.00 0.00 59.36 59.75 2pup h GLU 283 Cb 1.10 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.60 2pup h GLU 283 CO 0.02 0.27 0.54 -1.35 -1.16 0.00 0.00 179.01 177.32 2pup h PRO 284 N 0.42 0.82 -0.16 2.33 0.11 -1.81 0.13 132.00 133.82 2pup h PRO 284 Ca 0.39 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.37 2pup h PRO 284 Cb 0.57 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.49 2pup h PRO 284 CO -0.39 0.54 -0.19 -0.07 -0.21 0.00 0.00 178.00 177.68 2pup h LEU 285 N 0.84 0.45 -0.51 2.35 -0.00 -0.98 0.18 115.31 117.64 2pup h LEU 285 Ca 0.37 -0.49 0.08 0.00 -0.00 0.00 0.00 57.88 57.84 2pup h LEU 285 Cb 0.33 -0.13 -0.07 0.00 -0.00 0.00 0.00 40.66 40.79 2pup h LEU 285 CO -0.14 0.85 0.12 1.88 -0.00 0.00 0.00 178.44 181.16 2pup h TYR 286 N 0.06 0.21 -1.00 1.13 0.99 -1.18 0.23 116.97 117.41 2pup h TYR 286 Ca 0.02 0.03 0.04 0.00 2.00 0.00 0.00 58.73 60.82 2pup h TYR 286 Cb 0.73 -0.02 -0.06 0.00 1.00 0.00 0.00 36.73 38.39 2pup h TYR 286 CO 0.09 0.02 0.65 0.93 -0.00 0.00 0.00 178.16 179.85 2pup h GLU 287 N 0.27 1.22 -0.65 4.88 5.08 -0.39 0.55 114.58 125.54 2pup h GLU 287 Ca 0.25 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.48 2pup h GLU 287 Cb 0.32 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2pup h GLU 287 CO -0.31 0.80 0.18 0.45 -1.00 0.00 0.00 179.01 179.13 2pup h HIS 288 N 1.25 1.04 -0.35 4.33 3.86 0.01 0.99 115.15 126.29 2pup h HIS 288 Ca 0.40 -0.10 -0.04 0.00 -1.16 0.00 0.00 60.37 59.46 2pup h HIS 288 Cb 0.01 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.17 2pup h HIS 288 CO -0.00 0.84 0.04 0.28 0.86 0.00 0.00 177.93 179.95 2pup h VAL 289 N 0.96 1.24 -0.87 2.45 2.07 -0.38 0.08 116.25 121.81 2pup h VAL 289 Ca 0.21 -0.87 0.03 0.00 0.82 0.00 0.00 66.70 66.89 2pup h VAL 289 Cb 0.31 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 2pup h VAL 289 CO -0.00 0.29 0.56 -1.13 0.02 0.00 0.00 177.57 177.31 2pup h ASN 290 N 0.41 0.94 0.46 0.57 -1.24 -0.58 -3.02 115.58 113.13 2pup h ASN 290 Ca 0.10 -0.01 -0.30 0.00 0.71 0.00 0.00 56.30 56.80 2pup h ASN 290 Cb 0.38 -0.21 0.01 0.00 0.73 0.00 0.00 38.32 39.22 2pup h ASN 290 CO 0.01 0.65 -1.44 -0.61 -1.29 0.00 0.00 177.43 174.75 2pup h GLN 291 N 1.10 0.32 -0.17 6.67 5.75 -0.57 -2.45 115.11 125.76 2pup h GLN 291 Ca 0.34 -0.55 -0.01 0.00 -0.15 0.00 0.00 58.65 58.28 2pup h GLN 291 Cb -0.01 0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.74 2pup h GLN 291 CO -0.11 1.23 0.06 -0.24 -2.65 0.00 0.00 178.83 177.12 2pup h VAL 292 N 0.09 1.17 -0.20 2.39 3.04 -0.99 0.81 116.25 122.56 2pup h VAL 292 Ca -0.22 -0.51 0.04 0.00 -1.01 0.00 0.00 66.70 65.01 2pup h VAL 292 Cb 2.04 1.18 -0.04 0.00 -2.01 0.00 0.00 31.29 32.46 2pup h VAL 292 CO 0.20 0.16 -0.04 -0.25 -1.01 0.00 0.00 177.57 176.63 2pup h TRP 293 N 0.12 -0.09 -0.30 3.17 2.91 -1.61 0.51 115.95 120.65 2pup h TRP 293 Ca 0.06 0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.09 2pup h TRP 293 Cb 0.19 0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.89 2pup h TRP 293 CO -0.01 -0.08 0.18 0.93 -1.03 0.00 0.00 178.44 178.44 2pup h GLU 294 N 0.01 0.41 -0.62 2.65 4.39 -1.04 0.07 114.58 120.45 2pup h GLU 294 Ca 0.09 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.68 2pup h GLU 294 Cb 0.14 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 2pup h GLU 294 CO -0.19 0.32 0.08 1.15 -1.16 0.00 0.00 179.01 179.20 2pup h THR 295 N 0.39 1.26 -0.72 1.13 2.02 -0.68 -0.35 112.91 115.95 2pup h THR 295 Ca 0.11 -1.03 0.03 0.00 0.77 0.00 0.00 66.41 66.29 2pup h THR 295 Cb 0.01 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.08 2pup h THR 295 CO -0.02 0.38 0.45 0.15 0.37 0.00 0.00 175.52 176.85 2pup h PHE 296 N 0.95 0.85 -0.12 3.16 3.57 0.52 -0.50 116.94 125.38 2pup h PHE 296 Ca 0.19 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.66 2pup h PHE 296 Cb 0.45 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 38.91 2pup h PHE 296 CO 0.03 0.49 -0.11 1.49 -2.23 0.00 0.00 178.31 177.98 2pup h GLU 297 N 0.89 0.28 -0.95 1.11 4.81 -0.16 -0.99 114.58 119.58 2pup h GLU 297 Ca 0.29 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2pup h GLU 297 Cb 0.01 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.35 2pup h GLU 297 CO -0.11 0.68 0.63 0.93 -0.73 0.00 0.00 179.01 180.42 2pup h GLU 298 N -0.11 1.24 -0.19 1.92 5.08 -1.01 0.83 114.58 122.34 2pup h GLU 298 Ca 0.02 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.19 2pup h GLU 298 Cb 0.63 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2pup h GLU 298 CO 0.03 0.82 -0.34 1.15 -1.00 0.00 0.00 179.01 179.67 2pup h THR 299 N 1.28 1.34 -0.09 1.13 2.02 -0.95 0.23 112.91 117.87 2pup h THR 299 Ca 0.35 -1.57 -0.00 0.00 0.77 0.00 0.00 66.41 65.96 2pup h THR 299 Cb -0.14 1.87 -0.00 0.00 -1.74 0.00 0.00 68.15 68.14 2pup h THR 299 CO -0.08 0.48 0.04 0.15 0.37 0.00 0.00 175.52 176.48 2pup h PHE 300 N 0.23 0.13 -0.08 3.16 3.04 -1.09 -2.36 116.94 119.98 2pup h PHE 300 Ca 0.01 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.98 2pup h PHE 300 Cb 0.93 -0.04 -0.04 0.00 2.56 0.00 0.00 35.95 39.37 2pup h PHE 300 CO 0.09 0.23 -0.12 0.77 -2.02 0.00 0.00 178.31 177.25 2pup h SER 301 N -0.00 -0.37 -0.28 0.41 0.02 -0.56 0.78 113.55 113.54 2pup h SER 301 Ca 0.03 0.07 0.01 0.00 -0.84 0.00 0.00 61.79 61.05 2pup h SER 301 Cb 0.15 0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 2pup h SER 301 CO -0.00 -0.17 0.19 -0.33 -1.14 0.00 0.00 176.83 175.38 2pup h GLU 302 N -0.17 0.35 0.03 3.45 3.07 -0.53 -0.40 114.58 120.38 2pup h GLU 302 Ca 0.07 -0.02 -0.16 0.00 -0.50 0.00 0.00 59.36 58.75 2pup h GLU 302 Cb 0.27 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 28.12 2pup h GLU 302 CO -0.18 0.23 -0.63 0.00 -1.40 0.00 0.00 179.01 177.03 2pup h ALA 303 N 1.83 0.04 -0.55 3.43 0.00 -0.98 -2.15 119.26 120.87 2pup h ALA 303 Ca 0.11 -0.59 0.11 0.00 0.00 0.00 0.00 54.91 54.53 2pup h ALA 303 Cb -0.01 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 17.72 2pup h ALA 303 CO -0.02 0.35 -0.22 2.35 0.00 0.00 0.00 179.25 181.70 2pup h TRP 304 N -0.18 -0.55 -0.15 0.00 2.91 -0.62 0.23 115.95 117.59 2pup h TRP 304 Ca -0.09 0.06 0.04 0.00 1.13 0.00 0.00 58.89 60.03 2pup h TRP 304 Cb 1.37 0.33 -0.04 0.00 -0.51 0.00 0.00 29.16 30.31 2pup h TRP 304 CO 0.16 -0.31 -0.12 1.96 -1.03 0.00 0.00 178.44 179.10 2pup h GLN 305 N -0.09 -0.12 0.04 2.65 1.08 -1.04 -2.97 115.11 114.66 2pup h GLN 305 Ca 0.25 0.01 -0.27 0.00 -1.45 0.00 0.00 58.65 57.20 2pup h GLN 305 Cb 0.49 0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.91 2pup h GLN 305 CO -0.61 -0.08 -1.40 0.87 -0.95 0.00 0.00 178.83 176.66 2pup h LYS 306 N -0.13 0.07 0.00 1.46 1.57 -1.15 -3.41 116.57 114.99 2pup h LYS 306 Ca 0.10 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2pup h LYS 306 Cb 0.27 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2pup h LYS 306 CO -0.23 0.87 -0.36 -0.25 -0.57 0.00 0.00 179.45 178.90 2pup n ASP 307 N -3.28 0.33 -4.78 0.86 10.43 0.80 -5.05 116.55 115.86 2pup n ASP 307 Ca -0.11 -1.99 -0.37 0.00 2.57 0.00 0.00 54.79 54.89 2pup n ASP 307 Cb 1.01 -0.19 -0.06 0.00 1.84 0.00 0.00 41.12 43.71 2pup n ASP 307 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 2pup s SER 308 N -1.08 7.33 0.01 -2.24 0.15 -1.12 -4.56 113.70 112.19 2pup s SER 308 Ca 0.04 1.85 0.22 0.00 0.70 0.00 0.00 55.95 58.76 2pup s SER 308 Cb 0.03 -2.58 -0.08 0.00 -1.71 0.00 0.00 66.02 61.68 2pup s SER 308 CO 0.00 -0.07 0.94 0.18 1.20 0.00 0.00 173.24 175.49 2pup n LEU 309 N 0.57 0.71 -4.67 3.45 4.77 0.34 -4.96 117.00 117.22 2pup n LEU 309 Ca 0.02 -0.26 -0.43 0.00 -0.03 0.00 0.00 56.01 55.32 2pup n LEU 309 Cb 0.50 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.51 2pup n LEU 309 CO 0.45 0.15 1.00 -0.62 -1.33 0.00 0.00 177.39 177.04 2pup s ASP 310 N -3.42 7.02 0.60 -1.43 3.68 -1.26 -4.92 116.67 116.95 2pup s ASP 310 Ca 0.05 1.62 0.32 0.00 2.13 0.00 0.00 52.55 56.67 2pup s ASP 310 Cb 0.16 -2.54 1.85 0.00 -1.45 0.00 0.00 42.92 40.94 2pup s ASP 310 CO 0.84 -0.69 2.21 -0.37 0.13 0.00 0.00 175.17 177.30 2pup h VAL 311 N 5.37 0.42 0.00 1.11 -1.51 -1.98 -0.87 116.25 118.78 2pup h VAL 311 Ca -0.26 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.21 2pup h VAL 311 Cb 1.11 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.20 2pup h VAL 311 CO 0.95 0.00 -0.00 -1.22 -1.23 0.00 0.00 177.57 176.06 2pup n TYR 312 N -3.69 0.02 -0.05 5.19 4.02 -1.26 -4.39 117.16 117.01 2pup n TYR 312 Ca -0.02 0.01 0.16 0.00 -0.01 0.00 0.00 57.90 58.04 2pup n TYR 312 Cb 0.17 -0.51 0.59 0.00 -0.02 0.00 0.00 39.34 39.57 2pup n TYR 312 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2pup h ALA 313 N 2.99 2.24 -0.38 -0.72 0.00 -1.55 -2.63 119.26 119.21 2pup h ALA 313 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2pup h ALA 313 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2pup h ALA 313 CO 0.00 -0.39 0.00 0.27 0.00 0.00 0.00 179.25 179.13 2pup n ASN 314 N -4.44 3.10 -4.67 0.00 2.04 -1.26 -4.56 115.26 105.47 2pup n ASN 314 Ca 0.10 -1.91 -0.42 0.00 -0.44 0.00 0.00 54.58 51.90 2pup n ASN 314 Cb 0.49 -0.25 -0.03 0.00 -2.53 0.00 0.00 39.78 37.46 2pup n ASN 314 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 2pup s ILE 315 N -1.12 3.78 -0.11 1.53 1.01 -0.99 -4.92 121.20 120.38 2pup s ILE 315 Ca 0.30 1.02 -0.37 0.00 0.00 0.00 0.00 60.65 61.60 2pup s ILE 315 Cb 0.17 -3.65 -0.14 0.00 0.01 0.00 0.00 42.46 38.84 2pup s ILE 315 CO 0.23 -0.06 1.73 -0.90 0.00 0.00 0.00 174.94 175.94 2pup n ASP 316 N 6.48 2.80 0.00 3.58 5.75 -1.26 -2.07 116.55 131.83 2pup n ASP 316 Ca 0.15 1.04 0.00 0.00 -0.01 0.00 0.00 54.79 55.97 2pup n ASP 316 Cb 0.43 -1.27 0.00 0.00 -1.03 0.00 0.00 41.12 39.25 2pup n ASP 316 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pup n GLY 317 N 3.99 1.77 0.06 6.12 0.00 -1.26 -4.95 105.19 110.92 2pup n GLY 317 Ca 0.23 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2pup n GLY 317 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2pup h TYR 318 N 0.00 -0.04 -0.41 1.61 3.20 -1.76 -0.35 116.97 119.22 2pup h TYR 318 Ca 0.00 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.94 2pup h TYR 318 Cb 0.00 0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.23 2pup h TYR 318 CO 0.00 0.15 0.07 1.25 -1.64 0.00 0.00 178.16 177.99 2pup h LEU 319 N -0.23 -0.03 -0.39 2.82 5.85 -1.80 -0.24 115.31 121.29 2pup h LEU 319 Ca -0.00 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.83 2pup h LEU 319 Cb 0.21 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 2pup h LEU 319 CO 0.01 0.02 0.15 0.74 -0.34 0.00 0.00 178.44 179.02 2pup h THR 320 N 0.19 0.91 -0.39 1.05 2.02 -1.89 0.11 112.91 114.91 2pup h THR 320 Ca 0.20 -0.11 -0.05 0.00 0.77 0.00 0.00 66.41 67.23 2pup h THR 320 Cb 0.25 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 2pup h THR 320 CO -0.28 0.06 0.06 0.44 0.37 0.00 0.00 175.52 176.17 2pup h ASP 321 N 0.32 0.62 -0.49 4.18 3.32 -0.63 -1.43 116.42 122.29 2pup h ASP 321 Ca 0.18 -0.26 0.09 0.00 0.02 0.00 0.00 57.03 57.06 2pup h ASP 321 Cb 0.14 -0.16 -0.08 0.00 0.22 0.00 0.00 39.33 39.45 2pup h ASP 321 CO -0.17 0.72 0.05 0.74 -1.72 0.00 0.00 179.24 178.86 2pup h THR 322 N 0.49 0.66 0.00 0.35 2.02 -0.61 -1.12 112.91 114.70 2pup h THR 322 Ca 0.12 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 2pup h THR 322 Cb 0.37 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 2pup h THR 322 CO 0.01 0.03 -0.12 -0.07 0.37 0.00 0.00 175.52 175.73 2pup h LEU 323 N 0.17 0.00 -0.43 2.58 3.38 -0.48 -0.72 115.31 119.80 2pup h LEU 323 Ca 0.25 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.05 2pup h LEU 323 Cb 0.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2pup h LEU 323 CO -0.37 0.12 -0.55 0.28 0.09 0.00 0.00 178.44 178.01 2pup h SER 324 N 0.00 0.75 -0.19 -0.43 0.02 -0.14 -1.29 113.55 112.27 2pup h SER 324 Ca -0.00 -0.40 -0.14 0.00 -0.84 0.00 0.00 61.79 60.41 2pup h SER 324 Cb 0.26 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.59 2pup h SER 324 CO 0.02 1.15 -0.41 -0.74 -1.14 0.00 0.00 176.83 175.70 2pup h HIS 325 N 0.52 0.78 -0.92 3.45 -0.00 -0.71 -1.36 115.15 116.90 2pup h HIS 325 Ca 0.01 -0.29 0.00 0.00 -0.00 0.00 0.00 60.37 60.09 2pup h HIS 325 Cb 1.12 -0.14 -0.05 0.00 -0.00 0.00 0.00 27.41 28.35 2pup h HIS 325 CO 0.06 1.05 0.59 0.82 -0.00 0.00 0.00 177.93 180.45 2pup h ILE 326 N 0.28 1.24 -0.21 6.26 2.04 -1.15 -1.71 117.51 124.26 2pup h ILE 326 Ca 0.00 -0.47 -0.09 0.00 1.00 0.00 0.00 64.86 65.30 2pup h ILE 326 Cb 1.02 -0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 2pup h ILE 326 CO 0.09 0.24 -0.21 0.15 0.00 0.00 0.00 178.15 178.42 2pup h PHE 327 N 1.26 0.62 -0.84 1.37 3.57 -0.98 0.17 116.94 122.11 2pup h PHE 327 Ca 0.34 -0.19 0.01 0.00 3.53 0.00 0.00 57.97 61.66 2pup h PHE 327 Cb -0.12 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.45 2pup h PHE 327 CO 0.00 0.87 0.56 1.49 -2.23 0.00 0.00 178.31 178.99 2pup h GLU 328 N 0.20 1.10 -0.20 1.11 4.81 -1.15 -2.07 114.58 118.39 2pup h GLU 328 Ca 0.03 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 2pup h GLU 328 Cb 0.76 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2pup h GLU 328 CO 0.05 0.73 -0.04 0.93 -0.73 0.00 0.00 179.01 179.95 2pup h GLU 329 N 1.14 0.38 -0.69 1.92 5.08 -1.09 -2.59 114.58 118.72 2pup h GLU 329 Ca 0.31 -0.14 0.14 0.00 -1.00 0.00 0.00 59.36 58.67 2pup h GLU 329 Cb -0.13 -0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.00 2pup h GLU 329 CO -0.07 0.63 0.15 0.00 -1.00 0.00 0.00 179.01 178.72 2pup h ALA 330 N 0.74 0.85 -0.55 3.43 0.00 -0.40 0.10 119.26 123.44 2pup h ALA 330 Ca 0.05 0.16 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 2pup h ALA 330 Cb 0.48 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2pup h ALA 330 CO 0.02 -0.33 -0.05 0.82 0.00 0.00 0.00 179.25 179.70 2pup h ILE 331 N 0.25 1.27 -0.40 0.00 1.08 -1.21 -0.45 117.51 118.06 2pup h ILE 331 Ca 0.38 -1.20 -0.00 0.00 -0.39 0.00 0.00 64.86 63.65 2pup h ILE 331 Cb 0.62 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 35.28 2pup h ILE 331 CO -0.48 0.43 0.23 1.23 -0.69 0.00 0.00 178.15 178.87 2pup h GLY 332 N 0.89 0.58 1.01 5.37 0.00 -0.96 -1.02 103.07 108.94 2pup h GLY 332 Ca 0.15 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.22 2pup h GLY 332 CO 0.04 0.24 0.40 0.74 0.00 0.00 0.00 176.54 177.96 2pup h PHE 333 N 0.52 1.06 -0.76 5.60 0.04 -0.53 -2.05 116.94 120.82 2pup h PHE 333 Ca 0.14 -0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.93 2pup h PHE 333 Cb 0.01 -0.33 -0.05 0.00 2.20 0.00 0.00 35.95 37.77 2pup h PHE 333 CO -0.03 0.75 0.46 0.00 -0.60 0.00 0.00 178.31 178.89 2pup h ALA 334 N 1.21 1.02 -0.27 2.45 0.00 -0.70 0.48 119.26 123.44 2pup h ALA 334 Ca 0.27 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.23 2pup h ALA 334 Cb 0.06 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 2pup h ALA 334 CO -0.04 0.19 -0.14 0.78 0.00 0.00 0.00 179.25 180.04 2pup h GLY 335 N 0.85 0.08 0.67 0.00 0.00 -0.72 0.15 103.07 104.10 2pup h GLY 335 Ca 0.33 0.17 0.04 0.00 0.00 0.00 0.00 47.33 47.87 2pup h GLY 335 CO -0.16 -0.15 -0.02 0.00 0.00 0.00 0.00 176.54 176.21 2pup h GLU 337 N 0.04 0.91 0.12 0.00 4.57 -0.52 0.57 114.58 120.27 2pup h GLU 337 Ca 0.09 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 2pup h GLU 337 Cb 0.13 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.51 2pup h GLU 337 CO -0.17 0.60 -0.06 -0.07 -1.18 0.00 0.00 179.01 178.13 2pup h LEU 338 N 0.94 -0.14 -0.44 1.64 3.38 -0.10 -0.73 115.31 119.87 2pup h LEU 338 Ca 0.29 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 2pup h LEU 338 Cb -0.00 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2pup h LEU 338 CO -0.08 -0.02 0.16 0.40 0.09 0.00 0.00 178.44 178.99 2pup h ILE 339 N -0.25 1.21 -0.40 1.22 2.04 -1.21 -3.10 117.51 117.02 2pup h ILE 339 Ca -0.02 -0.67 -0.12 0.00 1.00 0.00 0.00 64.86 65.06 2pup h ILE 339 Cb 0.20 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 2pup h ILE 339 CO 0.03 0.24 -0.24 -0.09 0.00 0.00 0.00 178.15 178.09 2pup h ARG 340 N 0.56 0.82 0.00 2.37 1.12 -0.66 -2.03 114.38 116.57 2pup h ARG 340 Ca 0.14 -0.34 -0.02 0.00 -1.11 0.00 0.00 59.98 58.65 2pup h ARG 340 Cb 0.22 -0.03 -0.00 0.00 -0.01 0.00 0.00 29.97 30.15 2pup h ARG 340 CO -0.01 0.97 -0.11 0.00 -3.11 0.00 0.00 179.97 177.71 2pup h ARG 341 N 0.71 0.00 0.09 0.20 2.47 -1.17 -1.84 114.38 114.85 2pup h ARG 341 Ca 0.09 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.67 2pup h ARG 341 Cb 0.77 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.10 2pup h ARG 341 CO 0.06 0.11 -0.67 1.15 0.56 0.00 0.00 179.97 181.19 2pup h THR 342 N 0.00 1.52 0.00 2.04 2.02 -1.30 -3.29 112.91 113.90 2pup h THR 342 Ca -0.00 -2.46 0.00 0.00 0.77 0.00 0.00 66.41 64.72 2pup h THR 342 Cb 0.76 3.17 0.00 0.00 -1.74 0.00 0.00 68.15 70.34 2pup h THR 342 CO 0.01 0.67 0.00 2.30 0.37 0.00 0.00 175.52 178.88 2pup n ILE 343 N -4.25 0.23 -2.51 3.11 -5.35 -0.93 -4.85 119.36 104.81 2pup n ILE 343 Ca -0.15 -0.52 -0.24 0.00 -0.27 0.00 0.00 62.75 61.57 2pup n ILE 343 Cb 0.73 1.02 0.13 0.00 -1.74 0.00 0.00 39.64 39.79 2pup n ILE 343 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2pup n GLY 344 N -0.12 0.33 0.23 3.28 0.00 -0.69 -0.99 105.19 107.24 2pup n GLY 344 Ca 0.00 -1.98 -0.01 0.00 0.00 0.00 0.00 46.02 44.03 2pup n GLY 344 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2pup h LEU 345 N 0.00 -0.53 -8.32 0.99 5.85 -1.51 -3.33 115.31 108.47 2pup h LEU 345 Ca -0.35 0.18 -0.71 0.00 0.84 0.00 0.00 57.88 57.84 2pup h LEU 345 Cb 1.23 0.36 -0.25 0.00 0.37 0.00 0.00 40.66 42.37 2pup h LEU 345 CO 0.35 -0.19 -0.50 0.00 -0.34 0.00 0.00 178.44 177.76 2pup s ALA 346 N -6.22 3.29 0.60 1.25 0.00 -1.26 -4.90 121.76 114.51 2pup s ALA 346 Ca -0.14 -1.81 -0.01 0.00 0.00 0.00 0.00 51.96 50.00 2pup s ALA 346 Cb 0.19 -2.62 0.05 0.00 0.00 0.00 0.00 23.12 20.73 2pup s ALA 346 CO 0.73 -1.45 0.85 -1.01 0.00 0.00 0.00 175.76 174.88 2pup s HIS 347 N 1.53 2.79 0.07 0.00 3.76 -1.26 -4.41 115.29 117.77 2pup s HIS 347 Ca 0.02 0.09 0.05 0.00 -0.15 0.00 0.00 55.06 55.07 2pup s HIS 347 Cb -0.20 -2.89 -0.04 0.00 1.11 0.00 0.00 32.58 30.56 2pup s HIS 347 CO 0.06 -1.07 -0.07 0.14 -0.85 0.00 0.00 174.74 172.95 2pup s VAL 348 N -2.92 3.58 0.33 -0.90 -7.23 -1.24 -5.02 120.40 107.01 2pup s VAL 348 Ca 0.59 -1.06 0.05 0.00 -1.81 0.00 0.00 61.98 59.75 2pup s VAL 348 Cb -0.10 -2.64 0.30 0.00 0.56 0.00 0.00 36.38 34.50 2pup s VAL 348 CO 0.40 0.20 1.88 0.00 -0.31 0.00 0.00 175.10 177.27 2pup h ALA 349 N 3.87 1.69 -0.57 1.32 0.00 -1.97 -2.05 119.26 121.55 2pup h ALA 349 Ca -0.48 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.54 2pup h ALA 349 Cb 1.17 -0.18 -0.11 0.00 0.00 0.00 0.00 17.79 18.67 2pup h ALA 349 CO 0.54 0.10 -0.30 -0.44 0.00 0.00 0.00 179.25 179.16 2pup h ASP 350 N 0.83 -1.03 0.03 0.00 3.32 -1.94 0.36 116.42 117.99 2pup h ASP 350 Ca 0.44 0.21 -0.00 0.00 0.02 0.00 0.00 57.03 57.70 2pup h ASP 350 Cb 0.53 0.53 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2pup h ASP 350 CO -0.20 -0.29 -0.01 -0.07 -1.72 0.00 0.00 179.24 176.95 2pup h LEU 351 N -0.15 -0.03 -2.23 1.55 4.07 -1.79 -3.30 115.31 113.43 2pup h LEU 351 Ca 0.24 -0.65 0.00 0.00 0.08 0.00 0.00 57.88 57.55 2pup h LEU 351 Cb 0.53 0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.28 2pup h LEU 351 CO -0.65 0.75 0.07 0.44 -1.08 0.00 0.00 178.44 177.97 2pup h ASP 352 N -0.93 0.00 -0.02 -0.43 3.45 -1.20 -1.63 116.42 115.65 2pup h ASP 352 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2pup h ASP 352 Cb 0.68 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.45 2pup h ASP 352 CO 0.01 0.00 0.00 0.35 -1.57 0.00 0.00 179.24 178.03 2pup n THR 353 N -2.73 0.00 -1.64 0.35 -2.24 0.10 -4.98 114.28 103.14 2pup n THR 353 Ca -0.02 -0.50 -0.43 0.00 -2.27 0.00 0.00 64.05 60.82 2pup n THR 353 Cb 0.13 1.33 -0.01 0.00 -2.10 0.00 0.00 70.33 69.68 2pup n THR 353 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2pup n ILE 354 N 0.89 2.07 -3.80 2.28 5.41 -0.62 -5.02 119.36 120.57 2pup n ILE 354 Ca 0.09 -0.50 -0.12 0.00 1.00 0.00 0.00 62.75 63.22 2pup n ILE 354 Cb 0.40 -1.27 -0.11 0.00 -0.71 0.00 0.00 39.64 37.95 2pup n ILE 354 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2pup s VAL 355 N -1.11 0.03 1.00 1.39 0.11 -1.26 -4.57 120.40 116.00 2pup s VAL 355 Ca 0.58 -0.25 -0.16 0.00 -2.93 0.00 0.00 61.98 59.21 2pup s VAL 355 Cb -0.62 -0.42 0.21 0.00 -1.53 0.00 0.00 36.38 34.01 2pup s VAL 355 CO 0.61 -0.14 1.25 -2.16 -3.33 0.00 0.00 175.10 171.33 2pup s PRO 356 N -0.50 0.35 0.17 1.54 0.04 -1.26 -4.87 135.00 130.46 2pup s PRO 356 Ca -0.06 -0.25 -0.30 0.00 0.04 0.00 0.00 61.00 60.43 2pup s PRO 356 Cb -0.04 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 2pup s PRO 356 CO 0.01 -2.64 1.54 0.35 0.04 0.00 0.00 177.00 176.31 2pup h PHE 357 N -1.80 -1.82 -0.39 0.56 3.57 -2.00 -1.57 116.94 113.48 2pup h PHE 357 Ca -0.45 0.13 0.06 0.00 3.53 0.00 0.00 57.97 61.24 2pup h PHE 357 Cb 1.26 0.93 -0.02 0.00 2.79 0.00 0.00 35.95 40.91 2pup h PHE 357 CO -1.18 -0.37 0.27 -0.44 -2.23 0.00 0.00 178.31 174.35 2pup h ASP 358 N -0.00 0.25 0.65 0.41 3.32 -1.97 0.48 116.42 119.56 2pup h ASP 358 Ca 0.18 -0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.07 2pup h ASP 358 Cb 0.43 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 2pup h ASP 358 CO -0.94 0.16 -0.72 0.50 -1.72 0.00 0.00 179.24 176.52 2pup h LYS 359 N 0.29 0.06 0.20 3.56 3.64 -1.66 -2.46 116.57 120.19 2pup h LYS 359 Ca 0.17 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2pup h LYS 359 Cb 0.32 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2pup h LYS 359 CO -0.04 0.75 -0.09 -0.09 -2.27 0.00 0.00 179.45 177.71 2pup h ARG 360 N 0.04 -0.25 -0.91 1.90 2.43 0.66 -1.71 114.38 116.54 2pup h ARG 360 Ca -0.01 0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.30 2pup h ARG 360 Cb 1.27 0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 30.79 2pup h ARG 360 CO 0.10 -0.02 0.53 0.82 -1.51 0.00 0.00 179.97 179.89 2pup h ILE 361 N -0.46 0.84 -0.26 1.20 1.08 -1.23 0.10 117.51 118.78 2pup h ILE 361 Ca -0.03 -0.28 -0.05 0.00 -0.39 0.00 0.00 64.86 64.12 2pup h ILE 361 Cb 0.35 -0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.06 2pup h ILE 361 CO 0.04 0.15 -0.02 1.23 -0.69 0.00 0.00 178.15 178.87 2pup h GLY 362 N 0.81 0.50 1.80 5.37 0.00 -1.19 -0.16 103.07 110.20 2pup h GLY 362 Ca 0.47 -0.38 -0.13 0.00 0.00 0.00 0.00 47.33 47.29 2pup h GLY 362 CO -0.30 0.35 -0.52 3.21 0.00 0.00 0.00 176.54 179.28 2pup h ARG 363 N 0.24 0.21 -0.36 4.80 2.47 -0.93 -1.92 114.38 118.88 2pup h ARG 363 Ca 0.07 -0.12 -0.07 0.00 -1.26 0.00 0.00 59.98 58.60 2pup h ARG 363 Cb 0.45 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.76 2pup h ARG 363 CO 0.02 0.68 -0.06 0.87 0.56 0.00 0.00 179.97 182.04 2pup h LYS 364 N 0.17 0.60 -0.27 0.04 1.57 -0.45 -1.31 116.57 116.92 2pup h LYS 364 Ca 0.00 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 2pup h LYS 364 Cb 0.98 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 2pup h LYS 364 CO 0.08 0.66 0.03 -0.09 -0.57 0.00 0.00 179.45 179.57 2pup h ARG 365 N 0.56 0.45 -0.67 3.15 2.43 -0.62 -2.65 114.38 117.03 2pup h ARG 365 Ca 0.11 -0.13 0.07 0.00 -0.81 0.00 0.00 59.98 59.22 2pup h ARG 365 Cb 0.44 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.88 2pup h ARG 365 CO 0.02 0.58 0.36 -0.07 -1.51 0.00 0.00 179.97 179.35 2pup h LEU 366 N 0.26 0.51 -0.61 3.80 3.38 -1.01 -0.80 115.31 120.84 2pup h LEU 366 Ca 0.08 0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.19 2pup h LEU 366 Cb 0.35 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 2pup h LEU 366 CO 0.01 0.32 0.21 0.00 0.09 0.00 0.00 178.44 179.06 2pup h ALA 367 N 1.37 0.77 -0.14 1.53 0.00 -1.05 0.34 119.26 122.08 2pup h ALA 367 Ca 0.31 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.34 2pup h ALA 367 Cb 0.24 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2pup h ALA 367 CO -0.21 -0.22 -0.04 -0.07 0.00 0.00 0.00 179.25 178.71 2pup h LEU 368 N 0.37 -0.14 -0.40 0.00 3.38 -0.98 0.80 115.31 118.33 2pup h LEU 368 Ca 0.31 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 58.22 2pup h LEU 368 Cb 0.41 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2pup h LEU 368 CO -0.33 -0.05 -0.18 -0.33 0.09 0.00 0.00 178.44 177.64 2pup h GLU 369 N -0.01 0.83 -0.39 1.13 5.08 -0.39 0.68 114.58 121.51 2pup h GLU 369 Ca 0.07 -0.35 -0.14 0.00 -1.00 0.00 0.00 59.36 57.93 2pup h GLU 369 Cb 0.11 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2pup h GLU 369 CO -0.15 0.99 -0.31 1.79 -1.00 0.00 0.00 179.01 180.33 2pup h THR 370 N 0.64 1.28 -0.01 1.13 1.35 -0.32 -1.54 112.91 115.43 2pup h THR 370 Ca 0.09 -1.48 0.03 0.00 -0.55 0.00 0.00 66.41 64.50 2pup h THR 370 Cb 0.73 1.36 -0.04 0.00 -1.73 0.00 0.00 68.15 68.47 2pup h THR 370 CO 0.06 0.49 -0.19 1.23 -0.25 0.00 0.00 175.52 176.86 2pup h GLY 371 N 0.70 -0.26 0.43 5.82 0.00 -0.47 0.52 103.07 109.81 2pup h GLY 371 Ca 0.07 0.23 0.08 0.00 0.00 0.00 0.00 47.33 47.71 2pup h GLY 371 CO 0.08 -0.18 0.14 -0.84 0.00 0.00 0.00 176.54 175.75 2pup h THR 372 N -0.31 0.77 -0.10 4.70 2.02 -0.77 -1.55 112.91 117.67 2pup h THR 372 Ca 0.06 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.15 2pup h THR 372 Cb 0.39 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 2pup h THR 372 CO -0.19 0.05 0.01 0.00 0.37 0.00 0.00 175.52 175.77 2pup h ALA 373 N 1.37 0.09 -0.22 6.16 0.00 -0.76 -1.96 119.26 123.94 2pup h ALA 373 Ca 0.25 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.24 2pup h ALA 373 Cb 0.31 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 2pup h ALA 373 CO -0.29 -0.45 -0.16 0.74 0.00 0.00 0.00 179.25 179.09 2pup h PHE 374 N 0.05 -0.41 -0.27 0.00 -1.00 -0.20 0.70 116.94 115.81 2pup h PHE 374 Ca 0.04 0.03 0.05 0.00 2.81 0.00 0.00 57.97 60.91 2pup h PHE 374 Cb 0.04 0.22 -0.05 0.00 3.61 0.00 0.00 35.95 39.77 2pup h PHE 374 CO -0.12 -0.24 -0.05 0.82 -1.61 0.00 0.00 178.31 177.12 2pup h ILE 375 N -0.16 0.75 -0.05 -0.55 2.04 -1.13 -1.43 117.51 116.98 2pup h ILE 375 Ca 0.13 -0.01 -0.22 0.00 1.00 0.00 0.00 64.86 65.76 2pup h ILE 375 Cb 0.35 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 2pup h ILE 375 CO -0.32 0.00 -0.86 -0.33 0.00 0.00 0.00 178.15 176.64 2pup h GLU 376 N 0.02 0.50 -0.66 2.37 5.08 -0.69 -3.22 114.58 117.98 2pup h GLU 376 Ca 0.13 -0.48 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2pup h GLU 376 Cb 0.19 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2pup h GLU 376 CO -0.26 1.11 0.00 1.63 -1.00 0.00 0.00 179.01 180.49 2pup n LYS 377 N -3.82 2.69 -0.20 2.33 5.02 0.18 -4.61 118.16 119.76 2pup n LYS 377 Ca -0.07 -2.58 0.16 0.00 -2.02 0.00 0.00 58.31 53.81 2pup n LYS 377 Cb 0.79 -1.55 0.50 0.00 -0.02 0.00 0.00 35.03 34.74 2pup n LYS 377 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 2pup h ARG 378 N 4.29 0.42 -0.00 1.97 0.11 -1.27 -1.03 114.38 118.87 2pup h ARG 378 Ca 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2pup h ARG 378 Cb 0.99 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.97 2pup h ARG 378 CO 0.00 0.28 -0.30 -1.13 0.10 0.00 0.00 179.97 178.92 2pup n SER 379 N -4.49 0.61 0.09 0.08 3.41 -1.26 -3.90 113.62 108.16 2pup n SER 379 Ca 0.16 -0.44 0.09 0.00 -0.26 0.00 0.00 58.87 58.42 2pup n SER 379 Cb 0.58 0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.59 2pup n SER 379 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2pup h GLU 380 N 0.49 0.00 -6.68 4.33 5.08 -1.52 -3.47 114.58 112.81 2pup h GLU 380 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 2pup h GLU 380 Cb 0.47 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.75 2pup h GLU 380 CO 0.00 0.06 0.61 -0.06 -1.00 0.00 0.00 179.01 178.63 2pup s PHE 381 N -3.27 3.32 -0.10 4.33 0.40 -1.22 -4.93 117.98 116.51 2pup s PHE 381 Ca -0.01 1.32 0.04 0.00 -0.60 0.00 0.00 56.93 57.68 2pup s PHE 381 Cb 0.09 -3.53 -0.24 0.00 0.51 0.00 0.00 43.02 39.85 2pup s PHE 381 CO 0.79 -1.59 0.44 1.63 0.70 0.00 0.00 175.22 177.19 2pup n LYS 382 N 2.46 0.69 -4.32 0.44 5.02 -1.26 -5.00 118.16 116.20 2pup n LYS 382 Ca 0.05 0.25 -0.16 0.00 -2.02 0.00 0.00 58.31 56.43 2pup n LYS 382 Cb 0.43 -1.72 -0.10 0.00 -0.02 0.00 0.00 35.03 33.62 2pup n LYS 382 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2pup s THR 383 N -2.57 0.55 0.25 -0.18 -4.23 -1.26 -5.03 115.64 103.18 2pup s THR 383 Ca -0.14 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.31 2pup s THR 383 Cb 0.07 -2.64 0.26 0.00 1.34 0.00 0.00 72.50 71.54 2pup s THR 383 CO 0.79 -0.00 1.93 -0.29 -0.54 0.00 0.00 174.62 176.51 2pup h ILE 384 N 2.39 1.25 -1.00 2.99 6.09 -1.96 -2.52 117.51 124.74 2pup h ILE 384 Ca -0.38 -0.46 0.13 0.00 -1.37 0.00 0.00 64.86 62.78 2pup h ILE 384 Cb 1.25 -0.21 -0.09 0.00 0.47 0.00 0.00 36.82 38.24 2pup h ILE 384 CO 0.61 0.25 0.63 0.74 -3.07 0.00 0.00 178.15 177.30 2pup h THR 385 N 1.34 0.88 -0.88 2.19 2.02 -1.96 0.52 112.91 117.03 2pup h THR 385 Ca 0.37 -0.32 0.06 0.00 0.77 0.00 0.00 66.41 67.28 2pup h THR 385 Cb -0.14 -0.14 -0.06 0.00 -1.74 0.00 0.00 68.15 66.06 2pup h THR 385 CO -0.08 0.17 0.55 0.44 0.37 0.00 0.00 175.52 176.97 2pup h ASP 386 N 0.94 0.87 0.18 4.18 3.32 -1.85 0.92 116.42 124.99 2pup h ASP 386 Ca 0.51 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.56 2pup h ASP 386 Cb 0.57 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2pup h ASP 386 CO -0.28 0.57 -0.09 0.58 -1.72 0.00 0.00 179.24 178.30 2pup h VAL 387 N 1.01 0.91 -0.53 -1.35 2.07 -0.89 -1.87 116.25 115.60 2pup h VAL 387 Ca 0.38 -0.47 0.08 0.00 0.82 0.00 0.00 66.70 67.50 2pup h VAL 387 Cb 0.14 1.20 -0.07 0.00 -1.52 0.00 0.00 31.29 31.05 2pup h VAL 387 CO -0.16 0.11 0.16 0.40 0.02 0.00 0.00 177.57 178.10 2pup h ILE 388 N -0.47 0.77 -0.42 4.57 2.04 -0.89 -1.81 117.51 121.30 2pup h ILE 388 Ca -0.02 -0.11 -0.10 0.00 1.00 0.00 0.00 64.86 65.62 2pup h ILE 388 Cb 0.36 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 2pup h ILE 388 CO 0.04 0.06 -0.16 -0.33 0.00 0.00 0.00 178.15 177.76 2pup h GLU 389 N 0.32 0.79 -0.43 2.37 4.39 -0.69 0.83 114.58 122.17 2pup h GLU 389 Ca 0.26 -0.29 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 2pup h GLU 389 Cb 0.32 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 2pup h GLU 389 CO -0.30 0.90 0.20 1.25 -1.16 0.00 0.00 179.01 179.90 2pup h LEU 390 N 0.70 0.56 0.65 1.33 5.85 -1.05 -2.08 115.31 121.26 2pup h LEU 390 Ca 0.11 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2pup h LEU 390 Cb 0.66 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2pup h LEU 390 CO 0.05 0.54 -0.42 0.15 -0.34 0.00 0.00 178.44 178.42 2pup h PHE 391 N 0.55 -1.13 -0.92 1.25 3.04 -0.70 -0.80 116.94 118.23 2pup h PHE 391 Ca 0.15 -0.01 0.25 0.00 3.98 0.00 0.00 57.97 62.33 2pup h PHE 391 Cb 0.13 0.41 -0.16 0.00 2.56 0.00 0.00 35.95 38.89 2pup h PHE 391 CO -0.01 -0.63 0.09 0.87 -2.02 0.00 0.00 178.31 176.61 2pup h LYS 392 N -1.02 0.07 -0.64 1.11 1.57 -0.84 0.20 116.57 117.03 2pup h LYS 392 Ca -0.08 -0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.60 2pup h LYS 392 Cb 0.83 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 2pup h LYS 392 CO 0.06 0.05 0.04 -0.07 -0.57 0.00 0.00 179.45 178.96 2pup h LEU 393 N 0.07 1.07 -0.38 2.94 3.38 -0.90 -2.84 115.31 118.66 2pup h LEU 393 Ca 0.56 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2pup h LEU 393 Cb 1.13 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2pup h LEU 393 CO -0.80 1.10 0.00 -0.07 0.09 0.00 0.00 178.44 178.75 2pup h LEU 394 N 1.01 0.00 -2.56 1.67 3.38 0.84 -3.25 115.31 116.40 2pup h LEU 394 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2pup h LEU 394 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2pup h LEU 394 CO 0.03 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.89 2pup n VAL 395 N -2.88 0.77 0.65 1.22 0.24 -0.72 -5.00 118.33 112.61 2pup n VAL 395 Ca 0.03 -0.89 0.05 0.00 -2.04 0.00 0.00 64.34 61.50 2pup n VAL 395 Cb 0.44 0.70 0.31 0.00 -1.47 0.00 0.00 33.84 33.83 2pup n VAL 395 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98