#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pgw s LYS 5 N 0.00 1.20 -0.08 1.45 1.02 -1.26 -4.51 119.74 117.56 2pgw s LYS 5 Ca 0.00 -1.53 -0.30 0.00 0.02 0.00 0.00 55.97 54.16 2pgw s LYS 5 Cb 0.00 -0.86 -0.02 0.00 -0.52 0.00 0.00 37.83 36.43 2pgw s LYS 5 CO 0.00 0.12 1.04 0.42 -0.92 0.00 0.00 175.35 176.01 2pgw s ILE 6 N -3.16 4.68 -0.12 2.17 1.01 0.76 -0.50 121.20 126.04 2pgw s ILE 6 Ca 0.20 1.95 0.16 0.00 0.00 0.00 0.00 60.65 62.95 2pgw s ILE 6 Cb 0.01 -4.25 -0.23 0.00 0.01 0.00 0.00 42.46 38.00 2pgw s ILE 6 CO 0.04 0.02 0.17 -1.54 0.00 0.00 0.00 174.94 173.63 2pgw n SER 7 N 4.89 0.96 -3.72 3.58 3.41 0.56 0.02 113.62 123.33 2pgw n SER 7 Ca 0.09 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.59 2pgw n SER 7 Cb 0.48 1.20 -0.06 0.00 -0.26 0.00 0.00 64.21 65.58 2pgw n SER 7 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2pgw s ASN 8 N -4.69 -0.13 -0.05 4.04 0.01 -0.81 -4.89 114.94 108.43 2pgw s ASN 8 Ca -0.08 -0.35 -0.08 0.00 -0.71 0.00 0.00 52.86 51.64 2pgw s ASN 8 Cb 0.07 0.41 0.02 0.00 0.41 0.00 0.00 41.25 42.16 2pgw s ASN 8 CO 0.69 -0.76 0.21 0.68 -1.51 0.00 0.00 177.10 176.41 2pgw s VAL 9 N -3.45 0.03 -0.04 1.60 -7.23 -1.26 -0.16 120.40 109.89 2pgw s VAL 9 Ca 0.01 -0.23 -0.05 0.00 -1.81 0.00 0.00 61.98 59.90 2pgw s VAL 9 Cb 0.02 -0.38 0.01 0.00 0.56 0.00 0.00 36.38 36.59 2pgw s VAL 9 CO -0.09 -0.13 0.14 0.00 -0.31 0.00 0.00 175.10 174.71 2pgw s ARG 10 N -0.43 0.24 -0.16 4.82 1.70 -0.32 -4.98 118.95 119.82 2pgw s ARG 10 Ca -0.05 0.06 -0.01 0.00 -0.47 0.00 0.00 55.73 55.26 2pgw s ARG 10 Cb -0.04 0.11 -0.01 0.00 -0.57 0.00 0.00 34.95 34.45 2pgw s ARG 10 CO 0.01 -0.04 -0.12 0.08 -1.08 0.00 0.00 175.30 174.15 2pgw s VAL 11 N -0.27 2.93 -0.35 4.99 1.01 -1.26 -0.62 120.40 126.83 2pgw s VAL 11 Ca -0.03 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.29 2pgw s VAL 11 Cb -0.03 -2.26 0.10 0.00 0.00 0.00 0.00 36.38 34.20 2pgw s VAL 11 CO 0.00 0.50 0.08 -0.13 0.00 0.00 0.00 175.10 175.56 2pgw s ARG 12 N 0.80 1.34 0.25 2.72 0.52 -0.33 -4.94 118.95 119.31 2pgw s ARG 12 Ca -0.05 -1.76 -0.30 0.00 -0.52 0.00 0.00 55.73 53.10 2pgw s ARG 12 Cb -0.15 -2.92 -0.10 0.00 0.52 0.00 0.00 34.95 32.30 2pgw s ARG 12 CO 0.01 -0.97 1.37 -2.14 0.02 0.00 0.00 175.30 173.59 2pgw s PRO 13 N 0.95 4.33 0.07 3.54 0.02 -1.26 -1.46 135.00 141.18 2pgw s PRO 13 Ca 0.11 2.20 0.04 0.00 0.02 0.00 0.00 61.00 63.38 2pgw s PRO 13 Cb -0.19 -3.13 -0.03 0.00 0.02 0.00 0.00 34.50 31.17 2pgw s PRO 13 CO -0.11 -0.32 -0.13 -0.51 -0.33 0.00 0.00 177.00 175.61 2pgw s LEU 14 N -0.56 2.28 -0.11 -5.54 1.43 0.04 -4.04 118.68 112.19 2pgw s LEU 14 Ca 0.56 -0.61 -0.00 0.00 -1.03 0.00 0.00 54.13 53.05 2pgw s LEU 14 Cb -0.40 -0.43 0.02 0.00 0.03 0.00 0.00 46.19 45.41 2pgw s LEU 14 CO 0.43 -0.11 -0.08 -0.69 0.23 0.00 0.00 176.35 176.13 2pgw s VAL 15 N -1.34 1.05 -0.09 -1.59 1.01 -0.95 -2.45 120.40 116.04 2pgw s VAL 15 Ca -0.03 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.65 2pgw s VAL 15 Cb -0.10 -1.06 0.01 0.00 0.00 0.00 0.00 36.38 35.24 2pgw s VAL 15 CO 0.02 0.37 -0.16 -0.76 0.00 0.00 0.00 175.10 174.57 2pgw s LEU 16 N 1.59 1.76 0.68 3.92 1.43 -0.26 -4.52 118.68 123.27 2pgw s LEU 16 Ca 0.03 -0.40 -0.15 0.00 -1.03 0.00 0.00 54.13 52.57 2pgw s LEU 16 Cb -0.13 -1.05 0.01 0.00 0.03 0.00 0.00 46.19 45.05 2pgw s LEU 16 CO -0.07 0.05 1.15 -2.84 0.23 0.00 0.00 176.35 174.87 2pgw s PRO 17 N 0.75 2.58 0.07 1.29 0.02 -1.26 -0.76 135.00 137.68 2pgw s PRO 17 Ca -0.12 1.56 -0.01 0.00 0.02 0.00 0.00 61.00 62.46 2pgw s PRO 17 Cb -0.16 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.41 2pgw s PRO 17 CO 0.02 -1.45 0.23 -0.51 -0.33 0.00 0.00 177.00 174.96 2pgw s LEU 18 N -4.88 4.35 0.17 -5.54 1.43 -0.61 -1.02 118.68 112.59 2pgw s LEU 18 Ca 0.71 0.32 -0.15 0.00 -1.03 0.00 0.00 54.13 53.97 2pgw s LEU 18 Cb -0.24 -2.98 0.12 0.00 0.03 0.00 0.00 46.19 43.12 2pgw s LEU 18 CO 0.42 0.16 1.71 0.11 0.23 0.00 0.00 176.35 178.97 2pgw h LYS 19 N 3.10 0.14 -4.89 1.70 1.57 -1.47 -3.40 116.57 113.32 2pgw h LYS 19 Ca -0.45 -0.01 -0.32 0.00 -1.87 0.00 0.00 60.65 58.00 2pgw h LYS 19 Cb 1.16 -0.03 -0.15 0.00 0.08 0.00 0.00 32.23 33.30 2pgw h LYS 19 CO 0.75 0.09 -0.65 1.14 -0.57 0.00 0.00 179.45 180.21 2pgw s GLN 20 N -6.17 1.22 0.33 3.15 -2.07 -1.26 -4.95 119.66 109.89 2pgw s GLN 20 Ca -0.13 -1.61 -0.29 0.00 -1.82 0.00 0.00 55.36 51.51 2pgw s GLN 20 Cb 0.14 -0.35 -0.11 0.00 -1.09 0.00 0.00 33.01 31.60 2pgw s GLN 20 CO 0.71 -0.15 1.49 -2.14 -1.32 0.00 0.00 175.29 173.89 2pgw s PRO 21 N -3.92 4.16 -0.26 9.60 0.02 -1.26 -4.88 135.00 138.46 2pgw s PRO 21 Ca 0.27 2.50 -0.08 0.00 0.02 0.00 0.00 61.00 63.71 2pgw s PRO 21 Cb 0.06 -3.02 -0.03 0.00 0.02 0.00 0.00 34.50 31.53 2pgw s PRO 21 CO 0.07 -0.51 0.09 -0.47 -0.33 0.00 0.00 177.00 175.85 2pgw s TYR 22 N -0.60 3.11 0.22 6.54 5.04 0.93 -4.93 117.35 127.67 2pgw s TYR 22 Ca 0.57 -0.32 -0.22 0.00 -2.44 0.00 0.00 57.07 54.65 2pgw s TYR 22 Cb -0.45 -2.27 -0.08 0.00 0.35 0.00 0.00 41.96 39.51 2pgw s TYR 22 CO 0.54 -0.32 0.76 -1.01 -1.34 0.00 0.00 175.55 174.18 2pgw s HIS 23 N 1.64 3.72 0.36 4.97 3.76 -1.26 0.04 115.29 128.52 2pgw s HIS 23 Ca 0.06 1.50 -0.13 0.00 -0.15 0.00 0.00 55.06 56.34 2pgw s HIS 23 Cb -0.15 -2.69 0.04 0.00 1.11 0.00 0.00 32.58 30.88 2pgw s HIS 23 CO 0.05 0.37 0.71 1.67 -0.85 0.00 0.00 174.74 176.68 2pgw s TRP 24 N -1.44 0.30 0.58 1.40 1.48 -1.03 -4.95 118.94 115.27 2pgw s TRP 24 Ca 0.42 -0.85 0.28 0.00 -1.06 0.00 0.00 56.10 54.90 2pgw s TRP 24 Cb -0.18 0.61 1.49 0.00 -1.16 0.00 0.00 33.47 34.23 2pgw s TRP 24 CO 0.22 -1.43 1.94 1.03 -4.06 0.00 0.00 176.95 174.66 2pgw h SER 25 N 2.03 0.00 -2.47 -2.66 0.87 -2.04 -3.19 113.55 106.09 2pgw h SER 25 Ca -0.30 0.00 -0.62 0.00 -1.23 0.00 0.00 61.79 59.64 2pgw h SER 25 Cb 1.25 0.00 -0.41 0.00 -0.44 0.00 0.00 62.40 62.80 2pgw h SER 25 CO 0.38 0.00 -0.49 -1.22 -0.53 0.00 0.00 176.83 174.97 2pgw n TYR 26 N -3.85 3.53 -3.85 2.24 4.01 -1.26 -5.07 117.16 112.91 2pgw n TYR 26 Ca 0.08 -4.11 0.00 0.00 -0.16 0.00 0.00 57.90 53.71 2pgw n TYR 26 Cb 0.63 -0.63 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2pgw n TYR 26 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2pgw n GLY 27 N 1.17 0.60 3.03 2.72 0.00 -1.21 -4.86 105.19 106.65 2pgw n GLY 27 Ca 0.27 -0.87 -0.19 0.00 0.00 0.00 0.00 46.02 45.24 2pgw n GLY 27 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pgw s ILE 28 N 0.00 0.73 -0.04 -0.61 1.09 -1.26 -2.46 121.20 118.64 2pgw s ILE 28 Ca 0.00 -0.43 -0.02 0.00 -1.10 0.00 0.00 60.65 59.10 2pgw s ILE 28 Cb 0.00 -0.62 -0.04 0.00 -1.06 0.00 0.00 42.46 40.74 2pgw s ILE 28 CO 0.00 0.18 0.08 -0.13 -0.10 0.00 0.00 174.94 174.97 2pgw s ARG 29 N -0.28 3.14 -0.05 2.79 0.52 0.11 -4.90 118.95 120.27 2pgw s ARG 29 Ca 0.03 -0.39 0.08 0.00 -0.52 0.00 0.00 55.73 54.93 2pgw s ARG 29 Cb -0.04 -2.92 0.12 0.00 0.52 0.00 0.00 34.95 32.63 2pgw s ARG 29 CO -0.00 0.69 1.00 0.39 0.02 0.00 0.00 175.30 177.39 2pgw n GLU 30 N 1.53 1.40 -3.62 3.54 1.02 -1.26 -0.05 120.64 123.21 2pgw n GLU 30 Ca -0.15 -1.71 -0.08 0.00 -0.02 0.00 0.00 57.16 55.19 2pgw n GLU 30 Cb 0.53 -1.05 -0.06 0.00 -0.02 0.00 0.00 31.44 30.85 2pgw n GLU 30 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2pgw s SER 31 N -1.62 -0.30 0.27 1.62 1.04 -1.26 -1.57 113.70 111.88 2pgw s SER 31 Ca 0.13 0.45 0.06 0.00 0.48 0.00 0.00 55.95 57.07 2pgw s SER 31 Cb 0.11 0.42 -0.02 0.00 0.10 0.00 0.00 66.02 66.63 2pgw s SER 31 CO 0.01 -0.19 0.38 -0.36 0.98 0.00 0.00 173.24 174.07 2pgw s PHE 32 N -0.50 3.30 -0.03 5.02 0.08 0.06 -4.91 117.98 121.00 2pgw s PHE 32 Ca 0.03 -0.10 0.01 0.00 0.12 0.00 0.00 56.93 56.99 2pgw s PHE 32 Cb -0.03 -1.71 0.02 0.00 -0.57 0.00 0.00 43.02 40.74 2pgw s PHE 32 CO -0.05 0.29 -0.03 0.00 -0.10 0.00 0.00 175.22 175.33 2pgw s ALA 33 N -2.07 0.47 0.09 5.36 0.00 -1.26 -1.10 121.76 123.25 2pgw s ALA 33 Ca 0.38 0.00 0.01 0.00 0.00 0.00 0.00 51.96 52.35 2pgw s ALA 33 Cb -0.09 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.68 2pgw s ALA 33 CO 0.29 -0.00 -0.06 0.14 0.00 0.00 0.00 175.76 176.13 2pgw s VAL 34 N 0.71 0.62 -0.25 0.00 -7.23 -1.02 -4.07 120.40 109.15 2pgw s VAL 34 Ca -0.08 -1.88 -0.01 0.00 -1.81 0.00 0.00 61.98 58.20 2pgw s VAL 34 Cb -0.11 -1.61 0.03 0.00 0.56 0.00 0.00 36.38 35.25 2pgw s VAL 34 CO -0.01 -0.87 -0.07 0.20 -0.31 0.00 0.00 175.10 174.05 2pgw s ASN 35 N -2.96 4.32 0.45 4.85 0.01 -0.63 -0.78 114.94 120.22 2pgw s ASN 35 Ca 0.10 -0.96 -0.21 0.00 -0.71 0.00 0.00 52.86 51.08 2pgw s ASN 35 Cb 0.05 -1.65 -0.10 0.00 0.41 0.00 0.00 41.25 39.96 2pgw s ASN 35 CO -0.05 -0.14 0.99 -0.76 -1.51 0.00 0.00 177.10 175.62 2pgw s LEU 36 N 1.29 3.91 -0.09 0.60 1.43 -0.54 -1.26 118.68 124.02 2pgw s LEU 36 Ca -0.01 1.80 -0.00 0.00 -1.03 0.00 0.00 54.13 54.88 2pgw s LEU 36 Cb -0.17 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.54 2pgw s LEU 36 CO -0.05 -0.54 -0.05 -0.51 0.23 0.00 0.00 176.35 175.44 2pgw s ILE 37 N -2.08 0.77 -0.14 -0.59 1.10 -0.47 -1.19 121.20 118.61 2pgw s ILE 37 Ca 0.64 -0.15 -0.00 0.00 -0.51 0.00 0.00 60.65 60.63 2pgw s ILE 37 Cb -0.12 -0.83 -0.01 0.00 0.15 0.00 0.00 42.46 41.64 2pgw s ILE 37 CO 0.16 0.32 -0.13 -1.61 -2.11 0.00 0.00 174.94 171.57 2pgw s GLU 38 N 1.67 3.36 -0.26 3.50 2.02 0.21 -1.06 118.70 128.14 2pgw s GLU 38 Ca 0.02 -0.69 0.01 0.00 0.02 0.00 0.00 54.97 54.33 2pgw s GLU 38 Cb -0.13 -2.64 0.05 0.00 0.10 0.00 0.00 34.13 31.52 2pgw s GLU 38 CO -0.06 0.18 -0.09 0.42 0.02 0.00 0.00 175.26 175.73 2pgw s ILE 39 N 0.44 2.41 -0.18 -1.63 1.01 0.32 -1.17 121.20 122.40 2pgw s ILE 39 Ca -0.10 -1.48 -0.10 0.00 0.00 0.00 0.00 60.65 58.97 2pgw s ILE 39 Cb -0.16 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.90 2pgw s ILE 39 CO 0.05 0.01 0.16 -0.70 0.00 0.00 0.00 174.94 174.46 2pgw s GLU 40 N 1.17 4.12 0.43 2.79 2.12 0.78 -0.31 118.70 129.79 2pgw s GLU 40 Ca -0.06 -0.15 -0.07 0.00 0.36 0.00 0.00 54.97 55.05 2pgw s GLU 40 Cb -0.19 -3.40 -0.05 0.00 0.26 0.00 0.00 34.13 30.76 2pgw s GLU 40 CO -0.05 0.34 0.75 0.00 -0.54 0.00 0.00 175.26 175.76 2pgw s ALA 41 N 0.22 3.42 -1.81 6.30 0.00 0.56 -0.32 121.76 130.12 2pgw s ALA 41 Ca 0.10 -0.43 0.06 0.00 0.00 0.00 0.00 51.96 51.70 2pgw s ALA 41 Cb -0.11 -2.58 0.34 0.00 0.00 0.00 0.00 23.12 20.77 2pgw s ALA 41 CO -0.00 -0.16 0.90 -0.40 0.00 0.00 0.00 175.76 176.10 2pgw n ASP 42 N -1.78 0.00 -0.85 0.00 5.68 0.35 -1.06 116.55 118.88 2pgw n ASP 42 Ca 0.01 -0.06 0.10 0.00 -0.50 0.00 0.00 54.79 54.34 2pgw n ASP 42 Cb 0.55 -0.10 0.10 0.00 -1.14 0.00 0.00 41.12 40.53 2pgw n ASP 42 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2pgw n ASP 43 N -1.10 2.80 0.00 -1.12 5.75 -1.26 -4.96 116.55 116.66 2pgw n ASP 43 Ca 0.04 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 2pgw n ASP 43 Cb 0.03 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 2pgw n ASP 43 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pgw n GLY 44 N 1.17 3.15 3.75 6.12 0.00 -0.22 -5.06 105.19 114.09 2pgw n GLY 44 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2pgw n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pgw s THR 45 N -2.85 2.90 -0.09 2.61 2.01 -1.26 -4.76 115.64 114.21 2pgw s THR 45 Ca 0.00 0.77 0.03 0.00 0.31 0.00 0.00 61.69 62.81 2pgw s THR 45 Cb 0.00 -3.49 0.00 0.00 0.01 0.00 0.00 72.50 69.02 2pgw s THR 45 CO 0.00 0.13 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.17 2pgw s VAL 46 N -0.15 1.78 -0.05 3.82 1.01 -1.26 -0.33 120.40 125.22 2pgw s VAL 46 Ca 0.56 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 2pgw s VAL 46 Cb -0.39 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 2pgw s VAL 46 CO 0.43 0.50 0.24 -0.83 0.00 0.00 0.00 175.10 175.43 2pgw s GLY 47 N 0.45 2.26 -0.02 4.51 0.00 0.57 -4.72 107.32 110.36 2pgw s GLY 47 Ca -0.17 -0.53 0.04 0.00 0.00 0.00 0.00 44.72 44.05 2pgw s GLY 47 CO 0.07 -0.27 -0.13 -0.42 0.00 0.00 0.00 173.10 172.35 2pgw s ILE 48 N -1.13 1.07 0.19 0.90 1.01 -1.26 -0.52 121.20 121.45 2pgw s ILE 48 Ca 0.21 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.33 2pgw s ILE 48 Cb -0.13 -0.91 -0.01 0.00 0.01 0.00 0.00 42.46 41.42 2pgw s ILE 48 CO 0.10 0.31 0.21 0.61 0.00 0.00 0.00 174.94 176.18 2pgw n GLY 49 N 2.98 2.99 3.38 6.18 0.00 -0.22 -3.77 105.19 116.73 2pgw n GLY 49 Ca -0.16 -1.64 -0.15 0.00 0.00 0.00 0.00 46.02 44.07 2pgw n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2pgw s GLU 50 N -2.58 0.95 0.16 1.61 -1.05 -1.26 -1.36 118.70 115.16 2pgw s GLU 50 Ca 0.19 -0.11 0.09 0.00 -0.15 0.00 0.00 54.97 54.98 2pgw s GLU 50 Cb 0.00 0.43 -0.04 0.00 -0.44 0.00 0.00 34.13 34.09 2pgw s GLU 50 CO 0.13 -0.31 -0.19 0.00 0.95 0.00 0.00 175.26 175.84 2pgw s THR 52 N -1.88 3.54 -0.42 0.00 -4.23 -1.26 -1.60 115.64 109.79 2pgw s THR 52 Ca 0.15 0.50 0.08 0.00 -1.18 0.00 0.00 61.69 61.24 2pgw s THR 52 Cb -0.07 -3.44 -0.09 0.00 1.34 0.00 0.00 72.50 70.25 2pgw s THR 52 CO 0.07 -0.65 0.37 1.33 -0.54 0.00 0.00 174.62 175.19 2pgw n VAL 53 N -3.06 0.00 -1.66 2.29 0.24 -1.26 -4.76 118.33 110.12 2pgw n VAL 53 Ca 0.07 -0.30 -0.38 0.00 -2.04 0.00 0.00 64.34 61.69 2pgw n VAL 53 Cb 0.57 1.00 0.05 0.00 -1.47 0.00 0.00 33.84 33.99 2pgw n VAL 53 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2pgw n ALA 54 N -1.16 0.64 1.62 2.33 0.00 -1.26 -1.96 120.51 120.71 2pgw n ALA 54 Ca 0.02 0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.64 2pgw n ALA 54 Cb 0.13 -2.20 0.62 0.00 0.00 0.00 0.00 19.45 18.01 2pgw n ALA 54 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2pgw n PRO 55 N -1.09 1.47 -3.35 0.00 -0.04 -1.26 -4.93 135.00 125.80 2pgw n PRO 55 Ca 0.13 -0.69 0.02 0.00 -0.04 0.00 0.00 63.50 62.93 2pgw n PRO 55 Cb 0.46 -1.47 -0.02 0.00 -0.04 0.00 0.00 33.50 32.43 2pgw n PRO 55 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2pgw s ASP 56 N -1.93 -1.17 0.19 3.54 2.15 -0.83 -5.06 116.67 113.56 2pgw s ASP 56 Ca 0.39 1.08 -0.12 0.00 0.43 0.00 0.00 52.55 54.33 2pgw s ASP 56 Cb 0.20 2.12 0.20 0.00 -0.30 0.00 0.00 42.92 45.15 2pgw s ASP 56 CO 0.33 -0.22 1.74 -0.61 -0.17 0.00 0.00 175.17 176.23 2pgw h GLN 57 N 7.96 0.31 -0.30 4.34 4.15 -1.89 0.81 115.11 130.49 2pgw h GLN 57 Ca -0.20 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.20 2pgw h GLN 57 Cb 1.14 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.74 2pgw h GLN 57 CO 0.16 0.21 0.18 1.15 -1.93 0.00 0.00 178.83 178.60 2pgw h THR 58 N 0.32 1.11 -0.32 2.39 2.02 -1.97 0.78 112.91 117.24 2pgw h THR 58 Ca 0.26 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 2pgw h THR 58 Cb 0.31 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2pgw h THR 58 CO -0.29 0.11 0.14 1.23 0.37 0.00 0.00 175.52 177.08 2pgw h GLY 59 N 0.39 0.51 2.00 2.16 0.00 -1.77 -2.27 103.07 104.09 2pgw h GLY 59 Ca 0.11 -0.27 -0.09 0.00 0.00 0.00 0.00 47.33 47.08 2pgw h GLY 59 CO -0.02 0.25 -0.44 -0.91 0.00 0.00 0.00 176.54 175.42 2pgw h THR 60 N 0.37 0.98 -0.54 4.70 1.35 -0.77 -2.42 112.91 116.58 2pgw h THR 60 Ca 0.11 -1.75 -0.11 0.00 -0.55 0.00 0.00 66.41 64.10 2pgw h THR 60 Cb 0.16 2.05 -0.02 0.00 -1.73 0.00 0.00 68.15 68.62 2pgw h THR 60 CO -0.01 0.44 -0.09 0.00 -0.25 0.00 0.00 175.52 175.60 2pgw h ALA 61 N 1.56 0.74 -0.73 6.62 0.00 -0.72 0.23 119.26 126.94 2pgw h ALA 61 Ca -0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 2pgw h ALA 61 Cb 1.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 2pgw h ALA 61 CO 0.06 0.64 0.31 0.00 0.00 0.00 0.00 179.25 180.25 2pgw h ALA 62 N 0.93 1.16 -0.16 0.00 0.00 -1.14 -1.14 119.26 118.90 2pgw h ALA 62 Ca 0.14 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2pgw h ALA 62 Cb 0.66 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2pgw h ALA 62 CO 0.05 0.61 -0.05 0.82 0.00 0.00 0.00 179.25 180.68 2pgw h ILE 63 N 1.06 1.29 -0.78 0.00 2.04 -1.05 -1.76 117.51 118.31 2pgw h ILE 63 Ca 0.25 -1.02 0.06 0.00 1.00 0.00 0.00 64.86 65.15 2pgw h ILE 63 Cb 0.18 1.64 -0.06 0.00 -0.74 0.00 0.00 36.82 37.84 2pgw h ILE 63 CO -0.02 0.30 0.47 0.25 0.00 0.00 0.00 178.15 179.14 2pgw h LEU 64 N 0.01 0.71 -0.50 1.44 5.85 -0.70 -0.91 115.31 121.21 2pgw h LEU 64 Ca 0.04 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 2pgw h LEU 64 Cb 0.49 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 2pgw h LEU 64 CO 0.02 0.45 -0.02 0.22 -0.34 0.00 0.00 178.44 178.76 2pgw h TYR 65 N 0.84 0.99 -0.50 1.25 3.20 -1.12 -0.51 116.97 121.12 2pgw h TYR 65 Ca 0.35 -0.18 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2pgw h TYR 65 Cb 0.20 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 2pgw h TYR 65 CO -0.05 0.93 0.29 -0.09 -1.64 0.00 0.00 178.16 177.59 2pgw h ARG 66 N 0.76 0.69 0.01 1.82 2.43 -0.71 -2.03 114.38 117.35 2pgw h ARG 66 Ca 0.14 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2pgw h ARG 66 Cb 0.55 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2pgw h ARG 66 CO 0.03 0.53 -0.00 -0.07 -1.51 0.00 0.00 179.97 178.94 2pgw h LEU 67 N 0.67 -0.01 -1.66 3.80 4.07 -1.08 -3.17 115.31 117.94 2pgw h LEU 67 Ca 0.18 -0.31 0.10 0.00 0.08 0.00 0.00 57.88 57.93 2pgw h LEU 67 Cb 0.03 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.73 2pgw h LEU 67 CO -0.03 0.30 0.40 0.00 -1.08 0.00 0.00 178.44 178.03 2pgw h ALA 68 N 0.67 2.04 -0.06 1.53 0.00 -1.00 -1.88 119.26 120.56 2pgw h ALA 68 Ca -0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2pgw h ALA 68 Cb 0.31 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2pgw h ALA 68 CO 0.00 -0.17 0.05 0.87 0.00 0.00 0.00 179.25 180.00 2pgw h LYS 69 N 0.39 0.00 0.00 0.00 1.57 -1.33 -1.16 116.57 116.03 2pgw h LYS 69 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2pgw h LYS 69 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2pgw h LYS 69 CO -0.07 0.00 0.00 0.45 -0.57 0.00 0.00 179.45 179.26 2pgw h HIS 70 N 0.00 0.00 0.04 -1.35 3.86 -1.46 -3.05 115.15 113.19 2pgw h HIS 70 Ca 0.03 0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 59.02 2pgw h HIS 70 Cb 0.14 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.59 2pgw h HIS 70 CO 0.00 0.00 -1.04 -0.07 0.86 0.00 0.00 177.93 177.68 2pgw h LEU 71 N 0.00 0.16 -9.48 2.43 3.38 -1.37 -3.46 115.31 106.96 2pgw h LEU 71 Ca 0.00 -0.16 -0.60 0.00 0.09 0.00 0.00 57.88 57.21 2pgw h LEU 71 Cb 0.27 -0.05 0.06 0.00 0.09 0.00 0.00 40.66 41.03 2pgw h LEU 71 CO 0.00 1.09 0.71 0.55 0.09 0.00 0.00 178.44 180.88 2pgw n VAL 72 N -3.47 0.15 -0.27 1.22 3.14 -1.16 -1.36 118.33 116.58 2pgw n VAL 72 Ca -0.03 -0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.31 2pgw n VAL 72 Cb 0.93 -1.42 0.00 0.00 -1.06 0.00 0.00 33.84 32.30 2pgw n VAL 72 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2pgw n GLY 73 N 3.08 0.65 3.64 7.55 0.00 0.10 -4.96 105.19 115.26 2pgw n GLY 73 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 2pgw n GLY 73 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2pgw s HIS 74 N -2.56 2.53 0.05 1.61 4.02 -0.47 -4.77 115.29 115.70 2pgw s HIS 74 Ca 0.00 -0.65 -0.25 0.00 1.02 0.00 0.00 55.06 55.19 2pgw s HIS 74 Cb 0.00 -1.80 -0.06 0.00 -1.02 0.00 0.00 32.58 29.71 2pgw s HIS 74 CO 0.00 0.41 0.76 0.45 1.02 0.00 0.00 174.74 177.38 2pgw s SER 75 N -3.74 7.21 0.10 1.40 0.15 -1.26 -0.17 113.70 117.39 2pgw s SER 75 Ca 0.36 1.44 0.15 0.00 0.70 0.00 0.00 55.95 58.60 2pgw s SER 75 Cb 0.09 -2.47 0.66 0.00 -1.71 0.00 0.00 66.02 62.59 2pgw s SER 75 CO 0.19 0.02 1.47 -0.81 1.20 0.00 0.00 173.24 175.31 2pgw n PRO 76 N 2.77 0.07 0.00 5.44 -0.04 -1.26 -1.20 135.00 140.78 2pgw n PRO 76 Ca -0.03 0.38 0.14 0.00 -0.04 0.00 0.00 63.50 63.96 2pgw n PRO 76 Cb 0.50 -1.65 0.68 0.00 -0.04 0.00 0.00 33.50 33.00 2pgw n PRO 76 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2pgw n HIS 77 N -1.78 0.00 -1.31 0.54 8.25 -1.26 -3.42 115.22 116.24 2pgw n HIS 77 Ca 0.02 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.35 2pgw n HIS 77 Cb 0.14 -0.23 0.20 0.00 1.12 0.00 0.00 29.99 31.23 2pgw n HIS 77 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2pgw n ASP 78 N -1.12 3.28 -0.19 0.41 8.00 -0.34 -4.78 116.55 121.80 2pgw n ASP 78 Ca 0.14 -3.63 0.00 0.00 0.71 0.00 0.00 54.79 52.02 2pgw n ASP 78 Cb 0.26 -0.73 0.10 0.00 -0.02 0.00 0.00 41.12 40.73 2pgw n ASP 78 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 2pgw h VAL 79 N 1.18 0.66 0.72 2.53 3.04 -1.73 -2.06 116.25 120.58 2pgw h VAL 79 Ca 0.40 -0.09 -0.04 0.00 -1.01 0.00 0.00 66.70 65.96 2pgw h VAL 79 Cb 2.24 0.37 0.01 0.00 -2.01 0.00 0.00 31.29 31.89 2pgw h VAL 79 CO 0.72 0.05 -0.34 0.00 -1.01 0.00 0.00 177.57 176.99 2pgw h ALA 80 N 1.47 -0.96 0.00 3.17 0.00 -1.92 -1.64 119.26 119.38 2pgw h ALA 80 Ca 0.31 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2pgw h ALA 80 Cb 0.45 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2pgw h ALA 80 CO -0.39 -1.03 -0.35 -1.00 0.00 0.00 0.00 179.25 176.49 2pgw h PRO 81 N -0.99 0.00 -0.03 0.00 0.13 -1.95 -2.18 132.00 126.97 2pgw h PRO 81 Ca -0.10 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 2pgw h PRO 81 Cb 0.74 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.87 2pgw h PRO 81 CO 0.16 0.35 0.02 -0.07 -0.23 0.00 0.00 178.00 178.23 2pgw h LEU 82 N 0.00 0.04 -0.66 1.56 3.38 -1.26 -0.63 115.31 117.75 2pgw h LEU 82 Ca -0.00 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2pgw h LEU 82 Cb 0.64 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2pgw h LEU 82 CO 0.05 0.11 0.28 0.40 0.09 0.00 0.00 178.44 179.36 2pgw h ILE 83 N -0.03 1.24 -0.59 1.22 2.04 -1.16 -0.89 117.51 119.34 2pgw h ILE 83 Ca 0.01 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.15 2pgw h ILE 83 Cb 0.08 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 2pgw h ILE 83 CO -0.00 0.29 0.37 0.00 0.00 0.00 0.00 178.15 178.81 2pgw h ALA 84 N 1.12 0.75 -0.28 1.87 0.00 -1.20 0.41 119.26 121.93 2pgw h ALA 84 Ca 0.22 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2pgw h ALA 84 Cb 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2pgw h ALA 84 CO -0.02 0.21 0.09 -0.09 0.00 0.00 0.00 179.25 179.44 2pgw h ARG 85 N 0.80 0.44 -0.85 0.00 2.43 -0.85 -0.47 114.38 115.88 2pgw h ARG 85 Ca 0.21 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 2pgw h ARG 85 Cb -0.06 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.39 2pgw h ARG 85 CO -0.04 0.50 0.48 0.82 -1.51 0.00 0.00 179.97 180.22 2pgw h ILE 86 N 0.30 1.24 -0.30 1.20 2.04 -0.86 0.16 117.51 121.29 2pgw h ILE 86 Ca 0.09 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 2pgw h ILE 86 Cb 0.24 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 2pgw h ILE 86 CO -0.00 0.27 0.06 0.15 0.00 0.00 0.00 178.15 178.62 2pgw h PHE 87 N 1.19 0.52 -0.63 1.37 3.57 -0.71 0.41 116.94 122.65 2pgw h PHE 87 Ca 0.30 -0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.69 2pgw h PHE 87 Cb -0.00 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 2pgw h PHE 87 CO 0.01 0.57 0.22 1.25 -2.23 0.00 0.00 178.31 178.12 2pgw h HIS 88 N 0.32 0.99 0.07 0.41 2.76 -0.57 -1.37 115.15 117.76 2pgw h HIS 88 Ca 0.09 -0.09 -0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2pgw h HIS 88 Cb 0.32 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 28.99 2pgw h HIS 88 CO 0.02 0.80 -0.03 0.37 -1.30 0.00 0.00 177.93 177.79 2pgw h GLN 89 N 0.89 -0.09 0.00 5.26 4.15 -0.57 0.26 115.11 125.01 2pgw h GLN 89 Ca 0.20 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.63 2pgw h GLN 89 Cb 0.26 0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.97 2pgw h GLN 89 CO -0.01 0.45 -0.31 0.39 -1.93 0.00 0.00 178.83 177.42 2pgw n GLU 90 N -4.85 0.29 0.00 1.69 -0.58 0.12 -4.27 120.64 113.04 2pgw n GLU 90 Ca -0.08 0.16 -0.00 0.00 -0.42 0.00 0.00 57.16 56.81 2pgw n GLU 90 Cb 0.29 -1.76 -0.00 0.00 -0.57 0.00 0.00 31.44 29.41 2pgw n GLU 90 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2pgw n TYR 91 N -2.21 0.00 -0.31 -0.32 4.01 -0.57 -4.78 117.16 112.98 2pgw n TYR 91 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 2pgw n TYR 91 Cb 0.44 -0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.60 2pgw n TYR 91 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2pgw h LEU 92 N -0.00 0.85 -0.41 7.72 3.38 -1.37 -0.79 115.31 124.68 2pgw h LEU 92 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2pgw h LEU 92 Cb 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2pgw h LEU 92 CO 0.00 0.55 0.00 0.61 0.09 0.00 0.00 178.44 179.69 2pgw n GLY 93 N -1.33 -0.75 0.49 0.83 0.00 0.92 -1.14 105.19 104.21 2pgw n GLY 93 Ca 0.12 0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.23 2pgw n GLY 93 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2pgw n HIS 94 N -1.75 0.35 -0.99 1.61 8.25 -0.37 -4.97 115.22 117.35 2pgw n HIS 94 Ca 0.00 -0.49 0.00 0.00 -0.26 0.00 0.00 57.72 56.98 2pgw n HIS 94 Cb 0.06 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.14 2pgw n HIS 94 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2pgw n GLY 95 N 0.29 0.62 3.19 -1.41 0.00 -0.29 -4.96 105.19 102.62 2pgw n GLY 95 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 2pgw n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pgw n ALA 96 N 1.00 4.60 -1.36 4.61 0.00 -0.80 -4.89 120.51 123.67 2pgw n ALA 96 Ca 0.00 -4.41 -0.38 0.00 0.00 0.00 0.00 53.44 48.65 2pgw n ALA 96 Cb 0.02 -2.84 -0.02 0.00 0.00 0.00 0.00 19.45 16.61 2pgw n ALA 96 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2pgw n ASN 97 N 4.00 5.86 -4.66 0.00 4.13 -1.26 -4.17 115.26 119.16 2pgw n ASN 97 Ca 0.34 -2.64 -0.32 0.00 1.68 0.00 0.00 54.58 53.64 2pgw n ASN 97 Cb 0.39 -1.48 -0.09 0.00 -1.54 0.00 0.00 39.78 37.05 2pgw n ASN 97 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2pgw s ILE 98 N 3.01 3.99 0.00 2.41 -4.36 -1.26 -5.07 121.20 119.92 2pgw s ILE 98 Ca 0.56 -0.67 0.00 0.00 -0.26 0.00 0.00 60.65 60.28 2pgw s ILE 98 Cb 0.15 -2.77 0.00 0.00 1.25 0.00 0.00 42.46 41.09 2pgw s ILE 98 CO -0.05 0.37 0.00 0.54 0.24 0.00 0.00 174.94 176.04 2pgw n ARG 100 N 1.41 0.00 -0.28 0.37 1.74 -1.26 -1.15 116.66 117.50 2pgw n ARG 100 Ca -0.15 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 56.87 2pgw n ARG 100 Cb 0.53 0.00 0.06 0.00 -1.02 0.00 0.00 32.46 32.02 2pgw n ARG 100 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2pgw h ALA 101 N 0.00 0.99 -0.70 7.54 0.00 -1.96 -1.94 119.26 123.18 2pgw h ALA 101 Ca 0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2pgw h ALA 101 Cb 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 2pgw h ALA 101 CO 0.00 0.60 0.16 0.00 0.00 0.00 0.00 179.25 180.01 2pgw h ALA 102 N 1.16 0.96 -0.73 0.00 0.00 -1.55 -2.43 119.26 116.67 2pgw h ALA 102 Ca 0.25 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.95 2pgw h ALA 102 Cb 0.20 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2pgw h ALA 102 CO -0.02 0.67 0.48 -0.91 0.00 0.00 0.00 179.25 179.46 2pgw h ASN 103 N 1.06 0.75 -0.98 0.00 -0.26 -1.69 -0.76 115.58 113.70 2pgw h ASN 103 Ca 0.22 -0.01 0.10 0.00 -0.56 0.00 0.00 56.30 56.05 2pgw h ASN 103 Cb 0.38 -0.17 -0.08 0.00 -1.06 0.00 0.00 38.32 37.39 2pgw h ASN 103 CO 0.00 0.51 0.62 -0.61 -1.06 0.00 0.00 177.43 176.90 2pgw h GLN 104 N 0.87 0.98 0.09 0.81 4.15 -0.85 -0.42 115.11 120.73 2pgw h GLN 104 Ca 0.29 -0.06 -0.27 0.00 0.77 0.00 0.00 58.65 59.39 2pgw h GLN 104 Cb 0.09 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 2pgw h GLN 104 CO -0.09 0.65 -1.40 0.82 -1.93 0.00 0.00 178.83 176.89 2pgw h ILE 105 N 1.01 1.00 0.00 2.39 5.03 -1.35 -3.35 117.51 122.24 2pgw h ILE 105 Ca 0.46 -2.36 -0.01 0.00 -0.12 0.00 0.00 64.86 62.84 2pgw h ILE 105 Cb 0.40 2.64 -0.00 0.00 -3.03 0.00 0.00 36.82 36.83 2pgw h ILE 105 CO -0.22 0.66 -0.03 -0.26 -0.68 0.00 0.00 178.15 177.62 2pgw h PHE 106 N -0.40 0.00 -0.25 1.37 0.04 -1.05 -2.43 116.94 114.22 2pgw h PHE 106 Ca -0.31 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.50 2pgw h PHE 106 Cb 1.69 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.80 2pgw h PHE 106 CO 0.12 0.03 0.02 1.03 -0.60 0.00 0.00 178.31 178.91 2pgw h SER 107 N 0.00 -0.04 -0.48 2.17 0.87 -1.09 0.25 113.55 115.22 2pgw h SER 107 Ca -0.00 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.57 2pgw h SER 107 Cb 0.11 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 2pgw h SER 107 CO 0.00 0.01 0.15 1.23 -0.53 0.00 0.00 176.83 177.69 2pgw h GLY 108 N 0.11 0.81 0.91 5.77 0.00 -1.52 -3.15 103.07 106.01 2pgw h GLY 108 Ca 0.12 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 2pgw h GLY 108 CO -0.18 0.45 -0.02 -2.22 0.00 0.00 0.00 176.54 174.57 2pgw h ILE 109 N 0.65 1.02 0.00 2.60 2.04 -1.39 -2.00 117.51 120.42 2pgw h ILE 109 Ca 0.16 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.81 2pgw h ILE 109 Cb 0.28 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2pgw h ILE 109 CO -0.00 0.05 0.00 -0.67 0.00 0.00 0.00 178.15 177.53 2pgw n ASP 110 N -5.08 0.00 -0.60 1.72 2.03 0.83 -4.68 116.55 110.77 2pgw n ASP 110 Ca -0.08 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.23 2pgw n ASP 110 Cb 0.09 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.49 2pgw n ASP 110 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2pgw n ALA 112 N 0.83 -0.07 0.00 -1.67 0.00 -0.75 -4.58 120.51 114.26 2pgw n ALA 112 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2pgw n ALA 112 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.41 2pgw n ALA 112 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2pgw n TRP 114 N -0.19 0.00 -0.13 0.00 7.02 -1.26 -0.19 117.44 122.68 2pgw n TRP 114 Ca 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.39 2pgw n TRP 114 Cb 0.04 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 28.92 2pgw n TRP 114 CO 0.00 0.00 0.00 0.22 -2.02 0.00 0.00 177.69 175.89 2pgw h ASP 115 N 0.00 0.53 -0.38 -0.99 3.58 -1.89 0.25 116.42 117.53 2pgw h ASP 115 Ca 0.00 -0.15 -0.02 0.00 0.42 0.00 0.00 57.03 57.28 2pgw h ASP 115 Cb 0.00 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 2pgw h ASP 115 CO 0.00 0.54 0.15 0.25 -2.88 0.00 0.00 179.24 177.31 2pgw h LEU 116 N 0.49 0.51 -0.70 2.28 5.85 -0.87 -1.07 115.31 121.81 2pgw h LEU 116 Ca 0.13 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.72 2pgw h LEU 116 Cb 0.16 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2pgw h LEU 116 CO -0.01 0.54 0.44 1.56 -0.34 0.00 0.00 178.44 180.62 2pgw h GLN 117 N 0.46 0.84 -0.37 1.25 4.20 -1.74 -0.47 115.11 119.28 2pgw h GLN 117 Ca 0.13 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2pgw h GLN 117 Cb 0.18 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 2pgw h GLN 117 CO -0.01 0.56 0.14 0.78 -0.67 0.00 0.00 178.83 179.63 2pgw h GLY 118 N 0.86 0.60 1.29 3.46 0.00 -0.65 -1.33 103.07 107.30 2pgw h GLY 118 Ca 0.28 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.24 2pgw h GLY 118 CO -0.11 0.31 0.21 0.50 0.00 0.00 0.00 176.54 177.45 2pgw h LYS 119 N 0.45 0.90 -0.12 4.80 1.57 -0.82 0.71 116.57 124.07 2pgw h LYS 119 Ca 0.12 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.61 2pgw h LYS 119 Cb 0.20 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2pgw h LYS 119 CO -0.01 0.76 -0.50 -0.07 -0.57 0.00 0.00 179.45 179.07 2pgw h LEU 120 N 0.88 0.33 0.00 2.94 3.38 -0.91 -3.08 115.31 118.86 2pgw h LEU 120 Ca 0.20 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2pgw h LEU 120 Cb 0.22 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2pgw h LEU 120 CO -0.01 0.78 -0.78 0.00 0.09 0.00 0.00 178.44 178.52 2pgw n ALA 121 N -2.48 3.09 -2.91 1.53 0.00 -0.52 -4.96 120.51 114.25 2pgw n ALA 121 Ca -0.02 -0.31 -0.10 0.00 0.00 0.00 0.00 53.44 53.01 2pgw n ALA 121 Cb 0.55 -1.10 0.03 0.00 0.00 0.00 0.00 19.45 18.93 2pgw n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pgw n GLY 122 N 1.35 0.29 3.01 0.00 0.00 0.23 -5.04 105.19 105.03 2pgw n GLY 122 Ca 0.03 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 2pgw n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pgw s LEU 123 N -3.63 2.23 0.45 0.99 1.43 -0.33 -4.78 118.68 115.05 2pgw s LEU 123 Ca 0.23 -0.49 -0.22 0.00 -1.03 0.00 0.00 54.13 52.62 2pgw s LEU 123 Cb -0.10 -0.03 -0.08 0.00 0.03 0.00 0.00 46.19 46.01 2pgw s LEU 123 CO 0.29 -0.24 1.10 -2.16 0.23 0.00 0.00 176.35 175.57 2pgw s PRO 124 N -1.42 3.85 0.28 1.29 0.04 -1.25 -0.31 135.00 137.49 2pgw s PRO 124 Ca -0.12 1.59 0.01 0.00 0.04 0.00 0.00 61.00 62.52 2pgw s PRO 124 Cb -0.09 -2.34 0.64 0.00 0.04 0.00 0.00 34.50 32.74 2pgw s PRO 124 CO -0.00 -0.43 1.72 0.28 0.04 0.00 0.00 177.00 178.61 2pgw h VAL 125 N 1.84 0.57 -0.02 -0.36 2.07 -1.46 -0.64 116.25 118.25 2pgw h VAL 125 Ca -0.49 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 66.87 2pgw h VAL 125 Cb 1.23 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2pgw h VAL 125 CO 0.60 0.09 0.03 1.12 0.02 0.00 0.00 177.57 179.43 2pgw h HIS 126 N 0.47 0.00 -0.09 1.57 2.07 -1.87 0.25 115.15 117.54 2pgw h HIS 126 Ca 0.51 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.03 2pgw h HIS 126 Cb 0.89 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.87 2pgw h HIS 126 CO -0.13 0.00 0.00 1.04 -3.07 0.00 0.00 177.93 175.77 2pgw n GLN 127 N -3.69 1.55 -0.00 5.12 6.02 -0.25 -1.03 117.38 125.10 2pgw n GLN 127 Ca -0.02 -0.82 0.09 0.00 -0.01 0.00 0.00 57.00 56.24 2pgw n GLN 127 Cb 0.11 -1.40 -0.12 0.00 1.02 0.00 0.00 30.24 29.84 2pgw n GLN 127 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2pgw n LEU 128 N 0.02 0.67 -1.07 1.08 4.77 0.84 -4.33 117.00 118.98 2pgw n LEU 128 Ca 0.17 -0.36 0.08 0.00 -0.03 0.00 0.00 56.01 55.87 2pgw n LEU 128 Cb 0.28 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 41.63 2pgw n LEU 128 CO 0.14 0.17 0.72 0.18 -1.33 0.00 0.00 177.39 177.27 2pgw n LEU 129 N -1.66 3.72 0.00 2.23 4.77 -1.05 -4.94 117.00 120.07 2pgw n LEU 129 Ca 0.02 -2.20 0.00 0.00 -0.03 0.00 0.00 56.01 53.80 2pgw n LEU 129 Cb 0.36 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2pgw n LEU 129 CO 0.40 0.82 0.00 0.61 -1.33 0.00 0.00 177.39 177.89 2pgw n GLY 130 N 0.87 2.04 0.00 -0.72 0.00 -1.22 -5.01 105.19 101.15 2pgw n GLY 130 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2pgw n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pgw n GLY 131 N -0.75 2.96 3.72 -0.02 0.00 -0.20 -5.00 105.19 105.90 2pgw n GLY 131 Ca 0.00 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.61 2pgw n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pgw s ALA 132 N -2.83 3.22 -1.73 4.61 0.00 -1.26 -4.24 121.76 119.54 2pgw s ALA 132 Ca 0.00 0.47 0.18 0.00 0.00 0.00 0.00 51.96 52.61 2pgw s ALA 132 Cb 0.00 -3.24 0.56 0.00 0.00 0.00 0.00 23.12 20.44 2pgw s ALA 132 CO 0.00 -0.13 1.46 0.72 0.00 0.00 0.00 175.76 177.81 2pgw n HIS 133 N 3.50 0.96 -3.50 0.00 8.25 1.00 -4.92 115.22 120.52 2pgw n HIS 133 Ca 0.03 -0.44 -0.12 0.00 -0.26 0.00 0.00 57.72 56.94 2pgw n HIS 133 Cb 0.51 -0.07 -0.03 0.00 1.12 0.00 0.00 29.99 31.51 2pgw n HIS 133 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 2pgw s ARG 134 N -1.39 0.96 0.41 -0.41 1.70 -1.26 -5.01 118.95 113.95 2pgw s ARG 134 Ca 0.41 -0.16 0.23 0.00 -0.47 0.00 0.00 55.73 55.74 2pgw s ARG 134 Cb 0.23 0.45 0.59 0.00 -0.57 0.00 0.00 34.95 35.65 2pgw s ARG 134 CO 0.25 -0.38 1.69 0.87 -1.08 0.00 0.00 175.30 176.65 2pgw h LYS 135 N 2.29 0.00 -2.53 3.89 1.57 -1.97 -3.46 116.57 116.37 2pgw h LYS 135 Ca -0.26 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.47 2pgw h LYS 135 Cb 1.23 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 33.37 2pgw h LYS 135 CO 0.35 0.20 0.12 0.00 -0.57 0.00 0.00 179.45 179.55 2pgw s ALA 136 N -3.34 -1.54 -0.12 3.86 0.00 -1.26 -0.94 121.76 118.42 2pgw s ALA 136 Ca 0.03 0.84 -0.14 0.00 0.00 0.00 0.00 51.96 52.70 2pgw s ALA 136 Cb 0.08 0.33 -0.05 0.00 0.00 0.00 0.00 23.12 23.48 2pgw s ALA 136 CO 0.66 -0.50 0.31 0.08 0.00 0.00 0.00 175.76 176.31 2pgw s VAL 137 N -2.20 5.27 0.10 0.00 1.01 -0.55 -4.88 120.40 119.15 2pgw s VAL 137 Ca -0.06 0.60 -0.14 0.00 0.00 0.00 0.00 61.98 62.38 2pgw s VAL 137 Cb -0.01 -3.64 -0.06 0.00 0.00 0.00 0.00 36.38 32.67 2pgw s VAL 137 CO 0.01 0.44 0.49 -0.83 0.00 0.00 0.00 175.10 175.22 2pgw s GLY 138 N 0.03 2.46 0.14 4.51 0.00 -1.26 -1.54 107.32 111.66 2pgw s GLY 138 Ca 0.18 -0.18 0.05 0.00 0.00 0.00 0.00 44.72 44.77 2pgw s GLY 138 CO 0.06 0.11 -0.11 -0.19 0.00 0.00 0.00 173.10 172.97 2pgw s TYR 139 N -1.35 1.28 0.58 1.90 2.02 0.76 -1.47 117.35 121.08 2pgw s TYR 139 Ca 0.33 -0.69 -0.06 0.00 -0.37 0.00 0.00 57.07 56.28 2pgw s TYR 139 Cb -0.16 -0.66 0.13 0.00 -0.40 0.00 0.00 41.96 40.87 2pgw s TYR 139 CO 0.18 0.10 0.79 1.97 -1.57 0.00 0.00 175.55 177.02 2pgw n PHE 140 N 0.05 -3.57 -4.04 2.71 -0.00 -0.36 -4.55 117.46 107.71 2pgw n PHE 140 Ca -0.12 -0.98 -0.32 0.00 -0.00 0.00 0.00 57.45 56.02 2pgw n PHE 140 Cb 0.59 -0.60 -0.15 0.00 -0.00 0.00 0.00 39.48 39.33 2pgw n PHE 140 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.76 176.29 2pgw s TYR 141 N -2.52 3.27 -0.99 2.97 5.04 0.12 -4.88 117.35 120.35 2pgw s TYR 141 Ca 0.48 -2.26 -0.23 0.00 -2.44 0.00 0.00 57.07 52.62 2pgw s TYR 141 Cb -0.02 -1.96 0.02 0.00 0.35 0.00 0.00 41.96 40.35 2pgw s TYR 141 CO 0.33 -0.87 1.60 0.12 -1.34 0.00 0.00 175.55 175.40 2pgw s PHE 142 N 1.12 2.32 0.67 4.97 5.36 -1.26 -1.67 117.98 129.49 2pgw s PHE 142 Ca -0.08 -0.42 -0.17 0.00 -0.96 0.00 0.00 56.93 55.29 2pgw s PHE 142 Cb -0.20 -4.51 -0.01 0.00 -0.34 0.00 0.00 43.02 37.96 2pgw s PHE 142 CO -0.04 -1.87 1.02 1.28 -1.46 0.00 0.00 175.22 174.14 2pgw n LEU 143 N 10.40 4.03 -3.98 6.12 4.77 -1.02 -5.02 117.00 132.30 2pgw n LEU 143 Ca 0.36 0.74 -0.10 0.00 -0.03 0.00 0.00 56.01 56.97 2pgw n LEU 143 Cb 0.50 -1.43 -0.12 0.00 -2.33 0.00 0.00 43.42 40.04 2pgw n LEU 143 CO 0.65 -1.81 -0.37 -1.10 -1.33 0.00 0.00 177.39 173.43 2pgw s GLN 144 N -3.16 0.30 0.00 3.23 -1.52 -1.26 -4.89 119.66 112.36 2pgw s GLN 144 Ca 0.76 -0.53 0.00 0.00 -1.95 0.00 0.00 55.36 53.64 2pgw s GLN 144 Cb -0.37 0.01 0.00 0.00 -0.22 0.00 0.00 33.01 32.43 2pgw s GLN 144 CO 0.47 -0.02 0.00 0.41 -0.25 0.00 0.00 175.29 175.90 2pgw n GLY 145 N 1.85 4.67 0.00 3.09 0.00 -1.26 -4.23 105.19 109.31 2pgw n GLY 145 Ca -0.22 -1.11 0.07 0.00 0.00 0.00 0.00 46.02 44.77 2pgw n GLY 145 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2pgw n GLU 146 N -1.91 1.07 -4.48 1.61 -0.58 -1.26 -4.79 120.64 110.29 2pgw n GLU 146 Ca 0.00 -0.09 -0.26 0.00 -0.42 0.00 0.00 57.16 56.39 2pgw n GLU 146 Cb 0.00 -1.29 -0.10 0.00 -0.57 0.00 0.00 31.44 29.48 2pgw n GLU 146 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2pgw s THR 147 N -2.80 2.27 0.17 2.62 -4.23 -1.26 -5.04 115.64 107.38 2pgw s THR 147 Ca -0.02 -2.05 -0.14 0.00 -1.18 0.00 0.00 61.69 58.30 2pgw s THR 147 Cb 0.10 -2.81 0.06 0.00 1.34 0.00 0.00 72.50 71.19 2pgw s THR 147 CO 0.61 -0.13 1.80 0.00 -0.54 0.00 0.00 174.62 176.36 2pgw h ALA 148 N 1.85 0.62 0.00 3.99 0.00 -1.94 -2.14 119.26 121.65 2pgw h ALA 148 Ca -0.43 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.39 2pgw h ALA 148 Cb 1.25 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2pgw h ALA 148 CO 0.73 -0.05 -0.46 1.05 0.00 0.00 0.00 179.25 180.51 2pgw h GLU 149 N 0.54 0.00 -0.24 0.00 4.11 -1.96 -0.01 114.58 117.01 2pgw h GLU 149 Ca 0.20 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.57 2pgw h GLU 149 Cb 0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2pgw h GLU 149 CO -0.11 0.46 -0.10 0.93 0.07 0.00 0.00 179.01 180.26 2pgw h GLU 150 N 0.00 0.49 -0.56 1.06 5.08 -1.86 0.03 114.58 118.81 2pgw h GLU 150 Ca -0.00 -0.21 -0.11 0.00 -1.00 0.00 0.00 59.36 58.04 2pgw h GLU 150 Cb 1.00 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 2pgw h GLU 150 CO 0.06 0.75 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.67 2pgw h LEU 151 N 0.21 1.04 -0.66 1.33 3.38 -1.30 -0.71 115.31 118.61 2pgw h LEU 151 Ca 0.05 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.71 2pgw h LEU 151 Cb 0.59 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 2pgw h LEU 151 CO 0.03 1.13 0.43 0.00 0.09 0.00 0.00 178.44 180.12 2pgw h ALA 152 N 0.95 0.85 -0.14 1.53 0.00 -0.89 0.15 119.26 121.71 2pgw h ALA 152 Ca 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2pgw h ALA 152 Cb 0.64 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2pgw h ALA 152 CO 0.04 0.22 0.06 -0.09 0.00 0.00 0.00 179.25 179.48 2pgw h ARG 153 N 0.85 0.21 -0.47 0.00 2.43 -0.68 -0.94 114.38 115.78 2pgw h ARG 153 Ca 0.25 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.32 2pgw h ARG 153 Cb -0.04 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 2pgw h ARG 153 CO -0.08 0.30 0.02 0.22 -1.51 0.00 0.00 179.97 178.92 2pgw h ASP 154 N 0.07 0.72 -0.65 -3.80 3.58 -0.77 -2.21 116.42 113.37 2pgw h ASP 154 Ca 0.05 -0.16 -0.08 0.00 0.42 0.00 0.00 57.03 57.26 2pgw h ASP 154 Cb 0.16 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.00 2pgw h ASP 154 CO -0.00 0.78 0.09 0.00 -2.88 0.00 0.00 179.24 177.22 2pgw h ALA 155 N 1.31 0.92 -0.57 -0.78 0.00 -0.53 -1.80 119.26 117.81 2pgw h ALA 155 Ca 0.15 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2pgw h ALA 155 Cb 0.40 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2pgw h ALA 155 CO 0.01 0.67 0.33 0.00 0.00 0.00 0.00 179.25 180.26 2pgw h ALA 156 N 1.07 0.74 -0.47 0.00 0.00 -0.66 -0.16 119.26 119.78 2pgw h ALA 156 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2pgw h ALA 156 Cb 0.46 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2pgw h ALA 156 CO 0.02 0.03 0.28 0.28 0.00 0.00 0.00 179.25 179.85 2pgw h VAL 157 N 0.64 1.15 -0.30 0.00 2.07 -1.09 -1.36 116.25 117.36 2pgw h VAL 157 Ca 0.24 -0.35 0.02 0.00 0.82 0.00 0.00 66.70 67.43 2pgw h VAL 157 Cb 0.08 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2pgw h VAL 157 CO -0.13 0.15 0.14 1.23 0.02 0.00 0.00 177.57 178.98 2pgw h GLY 158 N 0.62 0.39 1.00 2.17 0.00 -0.52 -2.58 103.07 104.15 2pgw h GLY 158 Ca 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2pgw h GLY 158 CO -0.03 0.07 0.27 0.84 0.00 0.00 0.00 176.54 177.69 2pgw h HIS 159 N 0.29 0.51 -0.19 5.60 2.76 -0.87 -2.01 115.15 121.23 2pgw h HIS 159 Ca 0.13 0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.36 2pgw h HIS 159 Cb 0.06 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.84 2pgw h HIS 159 CO -0.11 0.32 0.21 0.00 -1.30 0.00 0.00 177.93 177.06 2pgw h ALA 160 N 1.15 1.83 -0.46 5.26 0.00 -0.92 -1.63 119.26 124.49 2pgw h ALA 160 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2pgw h ALA 160 Cb -0.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2pgw h ALA 160 CO -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 179.25 178.91 2pgw n GLN 161 N -3.81 3.99 -1.13 0.00 10.64 -0.83 -4.96 117.38 121.28 2pgw n GLN 161 Ca 0.02 -2.99 -0.02 0.00 -1.83 0.00 0.00 57.00 52.18 2pgw n GLN 161 Cb 0.34 -2.05 -0.01 0.00 -0.86 0.00 0.00 30.24 27.66 2pgw n GLN 161 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2pgw n GLY 162 N 0.23 0.53 3.77 2.61 0.00 -0.61 -4.18 105.19 107.54 2pgw n GLY 162 Ca 0.25 -0.97 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 2pgw n GLY 162 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pgw s GLU 163 N -2.32 3.93 -0.15 1.61 0.41 -0.82 -4.33 118.70 117.03 2pgw s GLU 163 Ca 0.00 2.24 0.14 0.00 -0.41 0.00 0.00 54.97 56.93 2pgw s GLU 163 Cb 0.00 -2.76 -0.19 0.00 -1.78 0.00 0.00 34.13 29.40 2pgw s GLU 163 CO 0.00 -0.55 0.07 0.54 -0.49 0.00 0.00 175.26 174.83 2pgw n ARG 164 N 0.11 1.44 -3.80 1.61 1.74 -1.26 -4.78 116.66 111.72 2pgw n ARG 164 Ca 0.04 -0.01 -0.29 0.00 -0.77 0.00 0.00 57.85 56.82 2pgw n ARG 164 Cb 0.43 -1.40 -0.16 0.00 -1.02 0.00 0.00 32.46 30.31 2pgw n ARG 164 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2pgw s VAL 165 N -2.41 0.86 -0.02 1.55 1.01 -1.26 -3.19 120.40 116.94 2pgw s VAL 165 Ca -0.08 -0.80 -0.20 0.00 0.00 0.00 0.00 61.98 60.91 2pgw s VAL 165 Cb 0.05 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 2pgw s VAL 165 CO 0.63 -0.18 0.56 -0.36 0.00 0.00 0.00 175.10 175.75 2pgw s PHE 166 N 1.70 3.67 -0.24 5.22 0.08 -0.38 0.12 117.98 128.14 2pgw s PHE 166 Ca -0.02 1.14 -0.01 0.00 0.12 0.00 0.00 56.93 58.16 2pgw s PHE 166 Cb -0.18 -2.57 0.03 0.00 -0.57 0.00 0.00 43.02 39.73 2pgw s PHE 166 CO -0.08 0.36 -0.08 -0.47 -0.10 0.00 0.00 175.22 174.85 2pgw s TYR 167 N -0.19 3.07 -0.08 0.36 5.04 -0.67 -0.13 117.35 124.75 2pgw s TYR 167 Ca 0.30 -1.67 0.05 0.00 -2.44 0.00 0.00 57.07 53.31 2pgw s TYR 167 Cb -0.18 -2.03 -0.01 0.00 0.35 0.00 0.00 41.96 40.09 2pgw s TYR 167 CO 0.16 -0.76 -0.23 -1.17 -1.34 0.00 0.00 175.55 172.21 2pgw s LEU 168 N 1.29 2.16 -0.09 6.97 2.96 0.03 -2.44 118.68 129.56 2pgw s LEU 168 Ca -0.01 -0.50 -0.23 0.00 -0.22 0.00 0.00 54.13 53.17 2pgw s LEU 168 Cb -0.17 -1.41 -0.03 0.00 0.50 0.00 0.00 46.19 45.07 2pgw s LEU 168 CO -0.05 0.21 0.69 -0.75 -1.32 0.00 0.00 176.35 175.13 2pgw s LYS 169 N 0.04 4.41 0.00 1.98 2.20 -1.26 -0.57 119.74 126.53 2pgw s LYS 169 Ca -0.09 0.84 0.00 0.00 -0.36 0.00 0.00 55.97 56.36 2pgw s LYS 169 Cb -0.15 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 2pgw s LYS 169 CO 0.06 0.03 0.00 1.33 -0.36 0.00 0.00 175.35 176.40 2pgw n VAL 170 N 3.89 0.00 -1.56 4.02 0.24 -0.17 -4.87 118.33 119.88 2pgw n VAL 170 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 2pgw n VAL 170 Cb 0.51 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.88 2pgw n VAL 170 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2pgw n GLY 171 N 4.83 0.48 1.62 7.63 0.00 -1.26 -4.62 105.19 113.88 2pgw n GLY 171 Ca 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 46.02 45.22 2pgw n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pgw n ARG 172 N -1.58 4.36 0.00 1.61 1.74 -1.26 -4.98 116.66 116.55 2pgw n ARG 172 Ca 0.00 -3.08 0.00 0.00 -0.77 0.00 0.00 57.85 54.00 2pgw n ARG 172 Cb 0.32 -2.15 0.00 0.00 -1.02 0.00 0.00 32.46 29.61 2pgw n ARG 172 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2pgw n GLY 173 N 0.35 2.48 0.40 -0.13 0.00 -1.26 -4.63 105.19 102.39 2pgw n GLY 173 Ca 0.26 -1.62 -0.13 0.00 0.00 0.00 0.00 46.02 44.53 2pgw n GLY 173 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2pgw h GLU 174 N 0.00 -0.51 0.01 1.61 4.81 -1.99 -0.08 114.58 118.43 2pgw h GLU 174 Ca 0.00 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 2pgw h GLU 174 Cb 0.00 0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.44 2pgw h GLU 174 CO 0.00 -0.34 -0.47 -0.22 -0.73 0.00 0.00 179.01 177.26 2pgw h LYS 175 N -0.53 -0.60 -0.57 1.92 3.64 -2.01 -2.05 116.57 116.38 2pgw h LYS 175 Ca 0.06 0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.42 2pgw h LYS 175 Cb 0.63 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.56 2pgw h LYS 175 CO -0.35 -0.40 0.10 1.25 -2.27 0.00 0.00 179.45 177.79 2pgw h LEU 176 N -0.62 0.86 -0.15 5.20 5.85 -1.80 -2.49 115.31 122.15 2pgw h LEU 176 Ca 0.03 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.59 2pgw h LEU 176 Cb 0.69 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 2pgw h LEU 176 CO -0.33 0.86 0.04 0.44 -0.34 0.00 0.00 178.44 179.11 2pgw h ASP 177 N 0.86 0.04 -0.62 1.25 3.32 -0.67 -0.26 116.42 120.35 2pgw h ASP 177 Ca 0.18 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.19 2pgw h ASP 177 Cb 0.36 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 2pgw h ASP 177 CO 0.01 0.05 0.16 -0.07 -1.72 0.00 0.00 179.24 177.67 2pgw h LEU 178 N 0.11 0.93 -0.28 1.55 3.38 -1.33 -0.69 115.31 118.99 2pgw h LEU 178 Ca 0.06 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 2pgw h LEU 178 Cb 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2pgw h LEU 178 CO -0.07 0.92 0.15 -0.33 0.09 0.00 0.00 178.44 179.20 2pgw h GLU 179 N 0.91 0.40 -0.14 1.13 5.08 -1.20 0.12 114.58 120.87 2pgw h GLU 179 Ca 0.20 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.36 2pgw h GLU 179 Cb 0.34 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2pgw h GLU 179 CO -0.00 0.36 -0.53 -0.84 -1.00 0.00 0.00 179.01 177.00 2pgw h ILE 180 N 0.33 1.34 -0.33 3.13 3.07 -0.96 0.08 117.51 124.18 2pgw h ILE 180 Ca 0.10 -1.79 -0.06 0.00 1.55 0.00 0.00 64.86 64.66 2pgw h ILE 180 Cb 0.08 1.81 -0.01 0.00 -0.27 0.00 0.00 36.82 38.43 2pgw h ILE 180 CO -0.01 0.54 -0.04 0.74 -1.05 0.00 0.00 178.15 178.33 2pgw h THR 181 N 0.31 1.27 -0.21 0.16 2.02 -0.90 -0.22 112.91 115.34 2pgw h THR 181 Ca 0.01 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.14 2pgw h THR 181 Cb 1.03 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 68.72 2pgw h THR 181 CO 0.09 0.34 0.13 0.00 0.37 0.00 0.00 175.52 176.45 2pgw h ALA 182 N 0.83 0.27 -0.48 6.16 0.00 -0.69 -0.70 119.26 124.66 2pgw h ALA 182 Ca 0.09 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.04 2pgw h ALA 182 Cb 0.51 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.14 2pgw h ALA 182 CO 0.02 -0.21 0.05 0.00 0.00 0.00 0.00 179.25 179.11 2pgw h ALA 183 N 1.03 0.49 -0.26 0.00 0.00 -0.72 -1.68 119.26 118.13 2pgw h ALA 183 Ca 0.08 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 2pgw h ALA 183 Cb 0.03 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2pgw h ALA 183 CO -0.01 -0.35 -0.13 0.28 0.00 0.00 0.00 179.25 179.03 2pgw h VAL 184 N 0.17 1.30 -0.79 0.00 2.07 -0.80 -3.09 116.25 115.11 2pgw h VAL 184 Ca 0.24 -1.22 0.09 0.00 0.82 0.00 0.00 66.70 66.63 2pgw h VAL 184 Cb 0.34 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.59 2pgw h VAL 184 CO -0.35 0.38 0.52 -0.09 0.02 0.00 0.00 177.57 178.05 2pgw h ARG 185 N 0.29 0.73 0.00 1.57 9.65 -0.78 -1.08 114.38 124.75 2pgw h ARG 185 Ca 0.06 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 2pgw h ARG 185 Cb 0.65 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 29.06 2pgw h ARG 185 CO 0.04 0.48 0.00 0.78 2.80 0.00 0.00 179.97 184.07 2pgw h GLY 186 N 0.75 0.00 0.00 2.80 0.00 -1.23 -2.95 103.07 102.45 2pgw h GLY 186 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2pgw h GLY 186 CO -0.14 0.00 -1.15 1.18 0.00 0.00 0.00 176.54 176.43 2pgw n GLU 187 N -2.94 0.38 -0.22 4.80 -0.58 -0.43 -4.51 120.64 117.14 2pgw n GLU 187 Ca -0.01 -0.04 0.06 0.00 -0.42 0.00 0.00 57.16 56.76 2pgw n GLU 187 Cb 0.20 -1.46 0.16 0.00 -0.57 0.00 0.00 31.44 29.76 2pgw n GLU 187 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 2pgw n ILE 188 N -1.62 1.61 0.00 -3.67 -5.35 -1.10 -4.60 119.36 104.62 2pgw n ILE 188 Ca 0.02 -1.54 0.00 0.00 -0.27 0.00 0.00 62.75 60.96 2pgw n ILE 188 Cb 0.36 0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.36 2pgw n ILE 188 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2pgw n GLY 189 N -0.38 3.85 1.28 3.28 0.00 -1.21 -1.30 105.19 110.70 2pgw n GLY 189 Ca 0.14 0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.36 2pgw n GLY 189 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2pgw n ASP 190 N 6.84 4.32 -4.69 1.61 8.00 -1.26 -4.87 116.55 126.49 2pgw n ASP 190 Ca 0.00 -2.54 -0.32 0.00 0.71 0.00 0.00 54.79 52.64 2pgw n ASP 190 Cb 0.00 -0.52 0.15 0.00 -0.02 0.00 0.00 41.12 40.73 2pgw n ASP 190 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pgw s ALA 191 N -2.00 1.68 0.28 2.24 0.00 -0.42 -4.93 121.76 118.60 2pgw s ALA 191 Ca 0.44 0.60 -0.29 0.00 0.00 0.00 0.00 51.96 52.71 2pgw s ALA 191 Cb 0.30 -3.43 -0.10 0.00 0.00 0.00 0.00 23.12 19.89 2pgw s ALA 191 CO 0.19 -2.50 1.37 1.03 0.00 0.00 0.00 175.76 175.84 2pgw s ARG 192 N -4.57 4.32 -0.09 0.00 0.52 -1.19 -4.95 118.95 112.98 2pgw s ARG 192 Ca 0.67 2.24 0.01 0.00 -0.52 0.00 0.00 55.73 58.13 2pgw s ARG 192 Cb -0.23 -3.10 0.02 0.00 0.52 0.00 0.00 34.95 32.16 2pgw s ARG 192 CO 0.56 -0.30 -0.09 -1.17 0.02 0.00 0.00 175.30 174.31 2pgw s LEU 193 N -0.96 1.37 -0.03 2.53 2.96 -1.26 -1.25 118.68 122.04 2pgw s LEU 193 Ca 0.54 -0.29 0.06 0.00 -0.22 0.00 0.00 54.13 54.22 2pgw s LEU 193 Cb -0.40 -0.81 -0.02 0.00 0.50 0.00 0.00 46.19 45.45 2pgw s LEU 193 CO 0.47 -0.06 -0.20 -0.13 -1.32 0.00 0.00 176.35 175.12 2pgw s ARG 194 N 1.25 2.28 -0.05 1.98 0.52 0.82 -0.51 118.95 125.24 2pgw s ARG 194 Ca -0.04 -0.83 0.04 0.00 -0.52 0.00 0.00 55.73 54.38 2pgw s ARG 194 Cb -0.14 -2.21 -0.02 0.00 0.52 0.00 0.00 34.95 33.10 2pgw s ARG 194 CO -0.03 0.59 -0.16 -0.51 0.02 0.00 0.00 175.30 175.20 2pgw s LEU 195 N -0.76 2.62 -0.35 2.53 1.43 -0.57 -0.79 118.68 122.80 2pgw s LEU 195 Ca 0.11 -0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 52.94 2pgw s LEU 195 Cb -0.10 -1.52 0.07 0.00 0.03 0.00 0.00 46.19 44.67 2pgw s LEU 195 CO 0.00 0.34 0.10 -0.62 0.23 0.00 0.00 176.35 176.40 2pgw s ASP 196 N -0.68 5.12 0.00 2.29 2.15 0.26 0.52 116.67 126.34 2pgw s ASP 196 Ca 0.10 -1.54 0.26 0.00 0.43 0.00 0.00 52.55 51.81 2pgw s ASP 196 Cb -0.11 -1.79 1.17 0.00 -0.30 0.00 0.00 42.92 41.89 2pgw s ASP 196 CO 0.00 -0.39 1.85 0.00 -0.17 0.00 0.00 175.17 176.47 2pgw n ALA 197 N 4.65 2.22 -4.06 3.66 0.00 -0.67 -1.00 120.51 125.31 2pgw n ALA 197 Ca -0.09 -0.10 -0.30 0.00 0.00 0.00 0.00 53.44 52.95 2pgw n ALA 197 Cb 0.43 -1.42 -0.04 0.00 0.00 0.00 0.00 19.45 18.42 2pgw n ALA 197 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2pgw n ASN 198 N -1.44 -0.78 -1.59 0.00 5.15 -1.22 -0.35 115.26 115.03 2pgw n ASN 198 Ca 0.08 -1.13 -0.15 0.00 -0.60 0.00 0.00 54.58 52.78 2pgw n ASN 198 Cb 0.28 -2.46 -0.06 0.00 -0.53 0.00 0.00 39.78 37.01 2pgw n ASN 198 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2pgw n GLU 199 N -4.51 -1.44 0.00 1.20 1.02 0.66 -4.86 120.64 112.70 2pgw n GLU 199 Ca -0.28 0.87 0.13 0.00 -0.02 0.00 0.00 57.16 57.87 2pgw n GLU 199 Cb 0.67 -5.21 0.36 0.00 -0.02 0.00 0.00 31.44 27.25 2pgw n GLU 199 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pgw n GLY 200 N -0.37 -0.88 3.53 0.62 0.00 0.53 -4.08 105.19 104.54 2pgw n GLY 200 Ca -0.16 -0.36 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 2pgw n GLY 200 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2pgw s TRP 201 N -2.68 2.79 1.02 1.61 0.51 -0.14 -5.03 118.94 117.03 2pgw s TRP 201 Ca 0.20 -0.09 -0.15 0.00 -2.12 0.00 0.00 56.10 53.94 2pgw s TRP 201 Cb 0.19 -1.64 0.20 0.00 -0.81 0.00 0.00 33.47 31.41 2pgw s TRP 201 CO 0.58 0.26 1.16 -1.54 -0.51 0.00 0.00 176.95 176.90 2pgw s SER 202 N -0.91 2.53 0.11 2.95 1.04 -1.26 -4.12 113.70 114.04 2pgw s SER 202 Ca 0.13 0.77 -0.21 0.00 0.48 0.00 0.00 55.95 57.11 2pgw s SER 202 Cb -0.11 -1.16 -0.09 0.00 0.10 0.00 0.00 66.02 64.76 2pgw s SER 202 CO 0.02 -3.14 1.73 0.58 0.98 0.00 0.00 173.24 173.41 2pgw h VAL 203 N -1.91 0.92 0.00 5.02 2.07 -1.95 -1.22 116.25 119.19 2pgw h VAL 203 Ca -0.48 -0.01 -0.12 0.00 0.82 0.00 0.00 66.70 66.90 2pgw h VAL 203 Cb 1.30 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 2pgw h VAL 203 CO 0.49 0.00 -0.59 1.12 0.02 0.00 0.00 177.57 178.62 2pgw h HIS 204 N 0.03 0.00 -0.25 1.57 2.07 -2.00 -2.39 115.15 114.18 2pgw h HIS 204 Ca 0.05 0.00 -0.15 0.00 -2.85 0.00 0.00 60.37 57.42 2pgw h HIS 204 Cb 0.06 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.03 2pgw h HIS 204 CO -0.13 0.59 -0.46 -0.44 -3.07 0.00 0.00 177.93 174.41 2pgw h ASP 205 N 0.00 0.71 -0.70 3.10 3.32 -1.90 -1.90 116.42 119.05 2pgw h ASP 205 Ca -0.01 -0.34 -0.06 0.00 0.02 0.00 0.00 57.03 56.64 2pgw h ASP 205 Cb 1.16 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.48 2pgw h ASP 205 CO 0.08 1.06 0.20 0.00 -1.72 0.00 0.00 179.24 178.86 2pgw h ALA 206 N 0.96 0.91 -0.06 3.45 0.00 -1.02 -2.94 119.26 120.56 2pgw h ALA 206 Ca 0.03 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2pgw h ALA 206 Cb 1.00 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2pgw h ALA 206 CO 0.09 0.61 0.02 0.82 0.00 0.00 0.00 179.25 180.79 2pgw h ILE 207 N 1.03 1.16 0.00 0.00 2.04 -1.28 -1.22 117.51 119.25 2pgw h ILE 207 Ca 0.22 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.61 2pgw h ILE 207 Cb 0.33 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 2pgw h ILE 207 CO -0.00 0.13 0.00 0.59 0.00 0.00 0.00 178.15 178.87 2pgw n ASN 208 N -4.94 0.92 0.00 1.72 3.02 -0.73 -2.03 115.26 113.22 2pgw n ASN 208 Ca -0.06 -0.70 0.00 0.00 -0.03 0.00 0.00 54.58 53.79 2pgw n ASN 208 Cb 0.12 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 2pgw n ASN 208 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2pgw h ARG 211 N 0.00 0.68 0.00 0.00 2.43 -1.66 -2.06 114.38 113.78 2pgw h ARG 211 Ca 0.00 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 2pgw h ARG 211 Cb 0.00 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.39 2pgw h ARG 211 CO 0.00 0.45 -0.08 0.87 -1.51 0.00 0.00 179.97 179.70 2pgw h LYS 212 N 0.70 0.00 0.00 0.20 1.57 -1.46 -3.16 116.57 114.42 2pgw h LYS 212 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 2pgw h LYS 212 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2pgw h LYS 212 CO -0.09 0.08 -0.84 1.28 -0.57 0.00 0.00 179.45 179.31 2pgw n LEU 213 N -3.16 0.67 -0.32 2.94 4.77 -1.01 -4.38 117.00 116.52 2pgw n LEU 213 Ca 0.02 0.14 0.17 0.00 -0.03 0.00 0.00 56.01 56.30 2pgw n LEU 213 Cb 0.44 -0.13 0.36 0.00 -2.33 0.00 0.00 43.42 41.75 2pgw n LEU 213 CO 0.32 -0.03 1.06 -0.33 -1.33 0.00 0.00 177.39 177.07 2pgw h GLU 214 N 0.00 0.35 0.00 3.23 5.08 -1.35 -1.16 114.58 120.73 2pgw h GLU 214 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2pgw h GLU 214 Cb 0.77 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2pgw h GLU 214 CO 0.00 0.23 0.01 0.36 -1.00 0.00 0.00 179.01 178.62 2pgw n LYS 215 N -5.06 0.13 -0.27 2.33 2.85 -1.26 -2.24 118.16 114.63 2pgw n LYS 215 Ca 0.25 0.62 0.08 0.00 -1.05 0.00 0.00 58.31 58.22 2pgw n LYS 215 Cb 0.76 -1.93 0.23 0.00 -0.65 0.00 0.00 35.03 33.45 2pgw n LYS 215 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2pgw n TYR 216 N -2.18 0.72 -3.24 5.58 4.01 -0.44 -4.98 117.16 116.63 2pgw n TYR 216 Ca -0.01 -0.36 -0.10 0.00 -0.16 0.00 0.00 57.90 57.27 2pgw n TYR 216 Cb 0.04 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 2pgw n TYR 216 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2pgw n ASP 217 N 1.03 -6.93 -4.68 7.72 2.03 -0.95 -4.96 116.55 109.82 2pgw n ASP 217 Ca 0.18 -0.20 -0.38 0.00 0.52 0.00 0.00 54.79 54.90 2pgw n ASP 217 Cb 0.45 -4.16 -0.07 0.00 -0.72 0.00 0.00 41.12 36.62 2pgw n ASP 217 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2pgw s ILE 218 N -2.82 5.17 0.20 5.18 -1.09 -1.26 -4.38 121.20 122.19 2pgw s ILE 218 Ca 0.07 0.83 -0.07 0.00 -2.23 0.00 0.00 60.65 59.25 2pgw s ILE 218 Cb -0.01 -3.78 0.07 0.00 -1.58 0.00 0.00 42.46 37.15 2pgw s ILE 218 CO 0.80 0.25 1.66 -0.08 -1.23 0.00 0.00 174.94 176.33 2pgw h GLU 219 N 7.25 0.99 -1.66 2.79 4.81 -1.18 -3.45 114.58 124.13 2pgw h GLU 219 Ca -0.36 -0.32 0.21 0.00 -0.13 0.00 0.00 59.36 58.76 2pgw h GLU 219 Cb 1.16 -0.09 -0.18 0.00 0.63 0.00 0.00 28.75 30.27 2pgw h GLU 219 CO 0.73 0.99 0.73 -0.59 -0.73 0.00 0.00 179.01 180.15 2pgw s PHE 220 N -4.94 -0.19 -0.15 0.92 -0.12 -1.26 -4.39 117.98 107.86 2pgw s PHE 220 Ca -0.11 0.13 -0.01 0.00 -0.05 0.00 0.00 56.93 56.89 2pgw s PHE 220 Cb 0.14 0.52 -0.01 0.00 -0.63 0.00 0.00 43.02 43.03 2pgw s PHE 220 CO 0.85 -0.28 -0.12 0.42 -0.05 0.00 0.00 175.22 176.04 2pgw s ILE 221 N -2.49 3.06 -0.14 -4.49 1.01 -0.60 -1.51 121.20 116.04 2pgw s ILE 221 Ca 0.08 -0.65 -0.16 0.00 0.00 0.00 0.00 60.65 59.92 2pgw s ILE 221 Cb -0.01 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 2pgw s ILE 221 CO -0.06 0.51 0.41 -0.70 0.00 0.00 0.00 174.94 175.10 2pgw s GLU 222 N 0.61 4.30 -0.79 2.79 2.12 0.19 -1.46 118.70 126.46 2pgw s GLU 222 Ca -0.07 0.31 -0.04 0.00 0.36 0.00 0.00 54.97 55.53 2pgw s GLU 222 Cb -0.15 -3.44 0.01 0.00 0.26 0.00 0.00 34.13 30.80 2pgw s GLU 222 CO 0.03 0.17 0.54 0.94 -0.54 0.00 0.00 175.26 176.40 2pgw n GLN 223 N 3.71 -1.24 -0.19 4.30 -0.06 0.11 -1.67 117.38 122.34 2pgw n GLN 223 Ca -0.09 0.57 -0.07 0.00 -2.00 0.00 0.00 57.00 55.41 2pgw n GLN 223 Cb 0.52 -1.98 0.07 0.00 -4.06 0.00 0.00 30.24 24.79 2pgw n GLN 223 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 2pgw h PRO 224 N -0.41 1.01 -6.32 3.69 0.13 -1.84 0.19 132.00 128.44 2pgw h PRO 224 Ca -0.59 -0.29 -0.45 0.00 -0.87 0.00 0.00 66.00 63.81 2pgw h PRO 224 Cb 1.26 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 2pgw h PRO 224 CO 0.35 0.96 -0.33 0.95 -0.23 0.00 0.00 178.00 179.70 2pgw s THR 225 N -5.08 3.28 0.03 1.56 -4.23 -1.26 -0.96 115.64 108.99 2pgw s THR 225 Ca -0.11 -1.12 -0.36 0.00 -1.18 0.00 0.00 61.69 58.92 2pgw s THR 225 Cb 0.14 -3.13 -0.15 0.00 1.34 0.00 0.00 72.50 70.70 2pgw s THR 225 CO 0.84 -0.06 1.56 0.55 -0.54 0.00 0.00 174.62 176.97 2pgw n VAL 226 N -1.67 0.14 0.29 2.29 3.14 -1.26 -4.30 118.33 116.96 2pgw n VAL 226 Ca 0.04 -0.02 0.15 0.00 -2.96 0.00 0.00 64.34 61.54 2pgw n VAL 226 Cb 0.59 -1.29 0.90 0.00 -1.06 0.00 0.00 33.84 32.99 2pgw n VAL 226 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 2pgw h SER 227 N 6.14 0.00 0.35 6.55 4.64 -1.90 -3.11 113.55 126.22 2pgw h SER 227 Ca -0.47 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.81 2pgw h SER 227 Cb 1.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 2pgw h SER 227 CO 0.87 0.02 -0.21 -0.50 -0.87 0.00 0.00 176.83 176.14 2pgw h TRP 228 N 0.00 0.00 -3.40 4.77 4.06 -1.89 -3.38 115.95 116.11 2pgw h TRP 228 Ca -0.00 0.00 -0.72 0.00 2.06 0.00 0.00 58.89 60.22 2pgw h TRP 228 Cb 0.07 0.00 -0.26 0.00 -1.00 0.00 0.00 29.16 27.97 2pgw h TRP 228 CO 0.00 0.21 -0.41 0.45 -3.56 0.00 0.00 178.44 175.13 2pgw s SER 229 N -6.58 5.85 0.15 -3.49 0.15 -1.18 -4.93 113.70 103.67 2pgw s SER 229 Ca -0.03 -1.41 -0.10 0.00 0.70 0.00 0.00 55.95 55.11 2pgw s SER 229 Cb 0.14 -2.07 -0.03 0.00 -1.71 0.00 0.00 66.02 62.35 2pgw s SER 229 CO 0.65 -0.58 1.48 0.40 1.20 0.00 0.00 173.24 176.40 2pgw h ILE 230 N 5.94 1.27 -0.63 6.45 2.04 -1.87 -3.04 117.51 127.67 2pgw h ILE 230 Ca -0.25 -1.55 -0.02 0.00 1.00 0.00 0.00 64.86 64.03 2pgw h ILE 230 Cb 1.09 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 38.52 2pgw h ILE 230 CO 0.80 0.52 0.30 -0.65 0.00 0.00 0.00 178.15 179.13 2pgw h PRO 231 N 0.76 0.89 -0.98 2.37 0.11 -1.98 -1.70 132.00 131.48 2pgw h PRO 231 Ca 0.06 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 66.06 2pgw h PRO 231 Cb 0.97 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.91 2pgw h PRO 231 CO 0.09 0.69 0.00 0.00 -0.21 0.00 0.00 178.00 178.57 2pgw n ALA 232 N -2.44 1.30 0.00 -0.75 0.00 -1.15 -0.91 120.51 116.56 2pgw n ALA 232 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2pgw n ALA 232 Cb 0.13 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.58 2pgw n ALA 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pgw n ALA 234 N 0.72 0.00 -0.00 0.00 0.00 -0.64 -2.08 120.51 118.51 2pgw n ALA 234 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2pgw n ALA 234 Cb 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.44 2pgw n ALA 234 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2pgw h HIS 235 N 0.00 -0.48 -0.28 0.00 6.17 -1.29 -0.13 115.15 119.15 2pgw h HIS 235 Ca 0.00 0.03 -0.03 0.00 0.71 0.00 0.00 60.37 61.08 2pgw h HIS 235 Cb 0.00 0.23 -0.01 0.00 2.52 0.00 0.00 27.41 30.15 2pgw h HIS 235 CO 0.00 -0.26 0.07 0.28 0.71 0.00 0.00 177.93 178.73 2pgw h VAL 236 N -0.23 1.21 -0.60 5.26 2.07 -1.69 -3.09 116.25 119.19 2pgw h VAL 236 Ca 0.10 -0.71 0.08 0.00 0.82 0.00 0.00 66.70 66.99 2pgw h VAL 236 Cb 0.38 1.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 2pgw h VAL 236 CO -0.27 0.23 0.27 -0.09 0.02 0.00 0.00 177.57 177.73 2pgw h ARG 237 N 0.28 0.48 0.00 1.57 2.43 -1.73 -0.80 114.38 116.60 2pgw h ARG 237 Ca 0.09 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2pgw h ARG 237 Cb 0.29 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2pgw h ARG 237 CO 0.00 0.32 0.00 0.93 -1.51 0.00 0.00 179.97 179.71 2pgw h GLU 238 N 0.49 0.00 0.01 0.20 5.08 -0.99 -3.21 114.58 116.17 2pgw h GLU 238 Ca 0.29 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 58.27 2pgw h GLU 238 Cb 0.29 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.47 2pgw h GLU 238 CO -0.24 0.00 -2.37 1.17 -1.00 0.00 0.00 179.01 176.57 2pgw n LYS 239 N -2.74 0.67 -2.68 2.33 3.00 -0.43 -5.01 118.16 113.29 2pgw n LYS 239 Ca -0.00 0.12 -0.31 0.00 -0.00 0.00 0.00 58.31 58.12 2pgw n LYS 239 Cb 0.19 -1.55 -0.03 0.00 0.00 0.00 0.00 35.03 33.64 2pgw n LYS 239 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2pgw s VAL 240 N -2.52 4.71 -0.62 3.15 -7.23 -0.46 -5.00 120.40 112.43 2pgw s VAL 240 Ca -0.25 0.81 0.25 0.00 -1.81 0.00 0.00 61.98 60.97 2pgw s VAL 240 Cb 0.08 -3.73 0.17 0.00 0.56 0.00 0.00 36.38 33.45 2pgw s VAL 240 CO 0.69 -0.60 1.50 1.23 -0.31 0.00 0.00 175.10 177.62 2pgw h GLY 241 N 1.09 0.00 -5.50 2.32 0.00 -1.91 -3.45 103.07 95.61 2pgw h GLY 241 Ca -0.47 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.26 2pgw h GLY 241 CO 0.63 0.00 -0.26 -0.42 0.00 0.00 0.00 176.54 176.49 2pgw s ILE 242 N -3.16 5.21 0.54 2.60 1.01 -1.26 -5.05 121.20 121.09 2pgw s ILE 242 Ca 0.07 0.70 -0.21 0.00 0.00 0.00 0.00 60.65 61.21 2pgw s ILE 242 Cb 0.12 -3.68 -0.06 0.00 0.01 0.00 0.00 42.46 38.85 2pgw s ILE 242 CO 0.67 0.46 1.19 -2.65 0.00 0.00 0.00 174.94 174.61 2pgw n PRO 243 N 2.86 1.39 -4.83 2.79 -0.02 -1.26 -4.79 135.00 131.14 2pgw n PRO 243 Ca -0.12 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.55 2pgw n PRO 243 Cb 0.52 -2.37 -0.14 0.00 -0.02 0.00 0.00 33.50 31.49 2pgw n PRO 243 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2pgw s ILE 244 N -1.35 2.97 -0.10 4.25 -1.09 -1.26 -1.55 121.20 123.07 2pgw s ILE 244 Ca 0.72 -0.70 0.00 0.00 -2.23 0.00 0.00 60.65 58.44 2pgw s ILE 244 Cb -0.44 -2.23 -0.03 0.00 -1.58 0.00 0.00 42.46 38.19 2pgw s ILE 244 CO 0.50 0.53 -0.09 -0.69 -1.23 0.00 0.00 174.94 173.96 2pgw s VAL 245 N 0.24 3.51 0.11 2.92 1.01 -0.53 -0.47 120.40 127.18 2pgw s VAL 245 Ca -0.09 -0.53 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 2pgw s VAL 245 Cb -0.16 -2.46 -0.07 0.00 0.00 0.00 0.00 36.38 33.70 2pgw s VAL 245 CO 0.05 0.56 0.77 0.00 0.00 0.00 0.00 175.10 176.48 2pgw s ALA 246 N -0.31 3.41 0.00 5.51 0.00 -1.26 0.07 121.76 129.18 2pgw s ALA 246 Ca 0.04 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.31 2pgw s ALA 246 Cb -0.13 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2pgw s ALA 246 CO 0.02 0.19 0.00 -3.47 0.00 0.00 0.00 175.76 172.50 2pgw n ASP 247 N 2.17 0.00 0.26 0.00 -0.08 -1.26 0.77 116.55 118.41 2pgw n ASP 247 Ca -0.04 0.00 0.17 0.00 -1.51 0.00 0.00 54.79 53.41 2pgw n ASP 247 Cb 0.49 0.00 0.91 0.00 2.34 0.00 0.00 41.12 44.87 2pgw n ASP 247 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 2pgw h GLN 248 N 0.00 0.00 0.00 -0.67 7.50 -1.94 0.08 115.11 120.08 2pgw h GLN 248 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2pgw h GLN 248 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.53 2pgw h GLN 248 CO 0.00 0.00 0.00 0.00 -1.50 0.00 0.00 178.83 177.33 2pgw h ALA 249 N 1.96 1.00 -3.02 3.87 0.00 -1.90 -3.41 119.26 117.75 2pgw h ALA 249 Ca 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.21 2pgw h ALA 249 Cb 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 17.79 17.49 2pgw h ALA 249 CO 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 179.25 178.79 2pgw s ALA 250 N -3.42 3.31 -0.09 0.00 0.00 0.02 -4.85 121.76 116.72 2pgw s ALA 250 Ca 0.04 -2.70 -0.07 0.00 0.00 0.00 0.00 51.96 49.24 2pgw s ALA 250 Cb 0.07 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 2pgw s ALA 250 CO 0.61 -1.89 -0.16 1.19 0.00 0.00 0.00 175.76 175.51 2pgw n PHE 251 N 4.44 0.00 -2.89 0.00 3.01 -1.26 -4.76 117.46 116.00 2pgw n PHE 251 Ca -0.01 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.26 2pgw n PHE 251 Cb 0.41 -0.36 0.02 0.00 -0.01 0.00 0.00 39.48 39.53 2pgw n PHE 251 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2pgw s THR 252 N -2.28 2.85 0.38 4.37 -4.23 -1.26 -2.54 115.64 112.94 2pgw s THR 252 Ca -0.16 -0.89 0.05 0.00 -1.18 0.00 0.00 61.69 59.52 2pgw s THR 252 Cb 0.05 -2.97 0.26 0.00 1.34 0.00 0.00 72.50 71.18 2pgw s THR 252 CO 0.20 0.00 2.03 0.25 -0.54 0.00 0.00 174.62 176.56 2pgw h LEU 253 N 0.43 0.57 -0.41 4.79 5.85 -1.94 -1.61 115.31 122.99 2pgw h LEU 253 Ca -0.40 -0.02 -0.18 0.00 0.84 0.00 0.00 57.88 58.12 2pgw h LEU 253 Cb 1.29 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 2pgw h LEU 253 CO 0.47 0.43 -0.58 1.88 -0.34 0.00 0.00 178.44 180.30 2pgw h TYR 254 N 0.67 0.85 -0.63 1.25 0.05 -1.99 -1.90 116.97 115.28 2pgw h TYR 254 Ca 0.18 -0.32 -0.02 0.00 0.05 0.00 0.00 58.73 58.63 2pgw h TYR 254 Cb -0.05 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.50 2pgw h TYR 254 CO 0.00 1.09 0.32 -0.44 -1.05 0.00 0.00 178.16 178.09 2pgw h ASP 255 N 0.51 0.80 0.07 3.88 3.32 -1.72 -0.35 116.42 122.92 2pgw h ASP 255 Ca 0.00 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 2pgw h ASP 255 Cb 1.16 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.50 2pgw h ASP 255 CO 0.12 0.68 -0.03 0.58 -1.72 0.00 0.00 179.24 178.86 2pgw h VAL 256 N 0.85 0.93 -0.73 -1.35 2.07 -1.20 -0.03 116.25 116.80 2pgw h VAL 256 Ca 0.22 -0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.80 2pgw h VAL 256 Cb 0.08 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 2pgw h VAL 256 CO -0.03 0.00 0.41 0.22 0.02 0.00 0.00 177.57 178.19 2pgw h TYR 257 N -0.09 0.76 -0.48 1.57 3.20 -1.10 -0.81 116.97 120.02 2pgw h TYR 257 Ca -0.01 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 2pgw h TYR 257 Cb 0.07 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.09 2pgw h TYR 257 CO -0.07 0.35 0.19 0.93 -1.64 0.00 0.00 178.16 177.91 2pgw h GLU 258 N 0.74 0.73 -0.72 1.82 4.39 -0.71 0.55 114.58 121.38 2pgw h GLU 258 Ca 0.33 -0.14 -0.03 0.00 0.34 0.00 0.00 59.36 59.86 2pgw h GLU 258 Cb 0.22 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 2pgw h GLU 258 CO -0.20 0.66 0.33 0.82 -1.16 0.00 0.00 179.01 179.46 2pgw h ILE 259 N 0.64 1.24 0.23 3.13 2.04 -0.45 -2.22 117.51 122.12 2pgw h ILE 259 Ca 0.16 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 2pgw h ILE 259 Cb 0.21 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2pgw h ILE 259 CO -0.01 0.29 -0.11 0.00 0.00 0.00 0.00 178.15 178.31 2pgw h ARG 261 N -0.56 0.00 -0.23 0.00 0.11 -0.85 -1.10 114.38 111.74 2pgw h ARG 261 Ca -0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2pgw h ARG 261 Cb 0.41 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.49 2pgw h ARG 261 CO 0.05 0.07 0.00 1.04 0.10 0.00 0.00 179.97 181.24 2pgw n GLN 262 N -3.62 2.38 -4.05 0.08 6.02 -0.84 -4.95 117.38 112.41 2pgw n GLN 262 Ca -0.02 -2.06 -0.28 0.00 -0.01 0.00 0.00 57.00 54.63 2pgw n GLN 262 Cb 0.19 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.93 2pgw n GLN 262 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2pgw n ARG 263 N 1.35 -3.03 0.09 -1.09 5.12 -0.42 -4.85 116.66 113.83 2pgw n ARG 263 Ca 0.17 0.36 0.13 0.00 -1.93 0.00 0.00 57.85 56.59 2pgw n ARG 263 Cb 0.59 -4.54 0.45 0.00 -1.16 0.00 0.00 32.46 27.79 2pgw n ARG 263 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2pgw n ALA 264 N -4.42 2.19 -2.98 7.54 0.00 0.09 -4.89 120.51 118.05 2pgw n ALA 264 Ca -0.23 -0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.09 2pgw n ALA 264 Cb 0.65 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.59 2pgw n ALA 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pgw s ALA 265 N -3.11 -0.38 -2.31 0.00 0.00 -1.26 -3.85 121.76 110.85 2pgw s ALA 265 Ca 0.10 -0.63 0.21 0.00 0.00 0.00 0.00 51.96 51.64 2pgw s ALA 265 Cb 0.13 0.87 0.55 0.00 0.00 0.00 0.00 23.12 24.67 2pgw s ALA 265 CO 0.55 -0.72 1.45 -0.25 0.00 0.00 0.00 175.76 176.79 2pgw n ASP 266 N -0.28 2.68 -3.68 0.00 8.00 0.38 -5.00 116.55 118.66 2pgw n ASP 266 Ca -0.08 -1.90 -0.18 0.00 0.71 0.00 0.00 54.79 53.35 2pgw n ASP 266 Cb 0.63 -0.22 -0.17 0.00 -0.02 0.00 0.00 41.12 41.34 2pgw n ASP 266 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2pgw s ILE 268 N -1.56 -0.15 -0.42 0.53 1.01 -0.97 -4.66 121.20 114.98 2pgw s ILE 268 Ca 0.36 0.37 -0.15 0.00 0.00 0.00 0.00 60.65 61.23 2pgw s ILE 268 Cb 0.20 -0.20 0.04 0.00 0.01 0.00 0.00 42.46 42.51 2pgw s ILE 268 CO 0.28 0.15 0.32 0.00 0.00 0.00 0.00 174.94 175.69 2pgw s ILE 270 N 1.65 0.13 0.23 0.00 2.07 -0.76 -4.15 121.20 120.36 2pgw s ILE 270 Ca 0.04 -1.05 0.00 0.00 -1.41 0.00 0.00 60.65 58.23 2pgw s ILE 270 Cb -0.21 -0.71 -0.04 0.00 0.13 0.00 0.00 42.46 41.63 2pgw s ILE 270 CO 0.09 -0.58 0.12 -0.83 -1.91 0.00 0.00 174.94 171.82 2pgw s GLY 271 N -1.91 1.58 0.48 1.50 0.00 -1.23 -1.48 107.32 106.26 2pgw s GLY 271 Ca -0.08 -1.78 0.21 0.00 0.00 0.00 0.00 44.72 43.08 2pgw s GLY 271 CO -0.03 -1.49 1.95 -0.56 0.00 0.00 0.00 173.10 172.98 2pgw h PRO 272 N 2.51 0.18 -0.61 2.90 0.13 -1.79 -1.79 132.00 133.53 2pgw h PRO 272 Ca -0.37 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 2pgw h PRO 272 Cb 1.25 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 2pgw h PRO 272 CO 0.56 0.12 0.36 -0.09 -0.23 0.00 0.00 178.00 178.73 2pgw h ARG 273 N 0.19 0.84 -0.02 0.86 1.12 -1.88 0.62 114.38 116.11 2pgw h ARG 273 Ca 0.32 -0.08 -0.12 0.00 -1.11 0.00 0.00 59.98 58.98 2pgw h ARG 273 Cb 0.99 -0.17 0.01 0.00 -0.01 0.00 0.00 29.97 30.79 2pgw h ARG 273 CO -0.06 0.61 -0.47 0.93 -3.11 0.00 0.00 179.97 177.87 2pgw h GLU 274 N 0.83 0.35 0.00 0.20 3.07 -1.64 -3.26 114.58 114.14 2pgw h GLU 274 Ca 0.22 -0.36 0.00 0.00 -0.50 0.00 0.00 59.36 58.72 2pgw h GLU 274 Cb -0.01 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 2pgw h GLU 274 CO -0.04 1.03 -0.32 0.97 -1.40 0.00 0.00 179.01 179.25 2pgw h ILE 275 N -0.18 0.00 0.00 3.13 6.09 -1.14 -3.40 117.51 122.01 2pgw h ILE 275 Ca -0.05 -0.84 0.00 0.00 -1.37 0.00 0.00 64.86 62.59 2pgw h ILE 275 Cb 1.18 1.67 0.00 0.00 0.47 0.00 0.00 36.82 40.14 2pgw h ILE 275 CO 0.09 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 175.78 2pgw n GLY 276 N 1.19 1.35 0.00 8.18 0.00 -0.11 -4.82 105.19 110.98 2pgw n GLY 276 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2pgw n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pgw n GLY 277 N -1.16 0.53 0.23 -0.02 0.00 0.02 -3.41 105.19 101.39 2pgw n GLY 277 Ca 0.00 -2.17 -0.11 0.00 0.00 0.00 0.00 46.02 43.74 2pgw n GLY 277 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2pgw h ILE 278 N 0.00 0.36 -0.68 -0.61 2.04 -1.87 -3.32 117.51 113.43 2pgw h ILE 278 Ca 0.00 -0.67 0.05 0.00 1.00 0.00 0.00 64.86 65.24 2pgw h ILE 278 Cb 0.00 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 36.60 2pgw h ILE 278 CO 0.00 0.08 0.39 -0.61 0.00 0.00 0.00 178.15 178.01 2pgw h GLN 279 N -1.01 0.71 -5.32 2.37 4.15 -1.93 -3.45 115.11 110.63 2pgw h GLN 279 Ca -0.05 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 2pgw h GLN 279 Cb 0.52 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 28.05 2pgw h GLN 279 CO 0.09 0.47 0.05 -2.30 -1.93 0.00 0.00 178.83 175.20 2pgw n PRO 280 N -4.75 0.52 0.00 -2.39 -0.02 -1.25 -4.78 135.00 122.33 2pgw n PRO 280 Ca 0.08 -0.89 0.00 0.00 -2.02 0.00 0.00 63.50 60.68 2pgw n PRO 280 Cb 0.16 -3.66 0.00 0.00 -0.02 0.00 0.00 33.50 29.98 2pgw n PRO 280 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2pgw n LYS 283 N 8.70 0.00 -0.09 -0.52 5.02 -1.26 -4.62 118.16 125.39 2pgw n LYS 283 Ca 0.47 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.74 2pgw n LYS 283 Cb 0.43 -0.01 0.23 0.00 -0.02 0.00 0.00 35.03 35.66 2pgw n LYS 283 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2pgw h ALA 284 N 0.00 1.29 -0.43 7.82 0.00 -1.95 -1.71 119.26 124.29 2pgw h ALA 284 Ca 0.00 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 2pgw h ALA 284 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2pgw h ALA 284 CO 0.00 0.50 -0.19 0.00 0.00 0.00 0.00 179.25 179.56 2pgw h ALA 285 N 1.41 0.86 -0.66 0.00 0.00 -1.97 -1.94 119.26 116.97 2pgw h ALA 285 Ca 0.16 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 2pgw h ALA 285 Cb 0.27 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2pgw h ALA 285 CO -0.00 0.64 0.10 0.00 0.00 0.00 0.00 179.25 179.98 2pgw h ALA 286 N 1.05 0.93 -0.05 0.00 0.00 -1.81 0.12 119.26 119.49 2pgw h ALA 286 Ca 0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2pgw h ALA 286 Cb 0.71 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2pgw h ALA 286 CO 0.05 0.66 0.01 0.28 0.00 0.00 0.00 179.25 180.25 2pgw h VAL 287 N 1.02 1.22 -0.57 0.00 2.07 -1.13 -1.52 116.25 117.34 2pgw h VAL 287 Ca 0.20 -0.68 0.04 0.00 0.82 0.00 0.00 66.70 67.08 2pgw h VAL 287 Cb 0.45 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 2pgw h VAL 287 CO 0.01 0.19 0.32 0.00 0.02 0.00 0.00 177.57 178.11 2pgw h ALA 288 N 0.75 0.74 -0.41 1.67 0.00 -1.20 -1.95 119.26 118.86 2pgw h ALA 288 Ca 0.02 0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2pgw h ALA 288 Cb 0.29 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2pgw h ALA 288 CO 0.00 0.01 0.18 1.49 0.00 0.00 0.00 179.25 180.93 2pgw h GLU 289 N 0.62 0.36 0.00 0.00 4.81 -0.60 0.15 114.58 119.92 2pgw h GLU 289 Ca 0.25 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 2pgw h GLU 289 Cb 0.10 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 2pgw h GLU 289 CO -0.14 0.24 -0.03 0.00 -0.73 0.00 0.00 179.01 178.34 2pgw h ALA 290 N 1.24 1.60 -0.27 2.92 0.00 -0.71 -0.93 119.26 123.12 2pgw h ALA 290 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2pgw h ALA 290 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2pgw h ALA 290 CO -0.15 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.14 2pgw n ALA 291 N -2.38 2.47 -1.86 0.00 0.00 -0.32 -4.93 120.51 113.50 2pgw n ALA 291 Ca -0.03 -0.72 -0.06 0.00 0.00 0.00 0.00 53.44 52.64 2pgw n ALA 291 Cb 0.12 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 2pgw n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pgw n GLY 292 N 1.27 0.31 3.44 0.00 0.00 -0.35 -5.04 105.19 104.82 2pgw n GLY 292 Ca 0.17 -0.68 -0.25 0.00 0.00 0.00 0.00 46.02 45.26 2pgw n GLY 292 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pgw s LEU 293 N -1.60 2.50 0.32 0.99 1.43 0.36 -5.00 118.68 117.67 2pgw s LEU 293 Ca 0.00 -0.94 0.07 0.00 -1.03 0.00 0.00 54.13 52.24 2pgw s LEU 293 Cb 0.00 -1.13 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 2pgw s LEU 293 CO 0.00 0.08 0.31 -0.54 0.23 0.00 0.00 176.35 176.43 2pgw s LYS 294 N -3.03 2.86 -0.09 1.70 1.02 -1.26 -3.37 119.74 117.57 2pgw s LYS 294 Ca 0.24 -1.18 0.01 0.00 0.02 0.00 0.00 55.97 55.06 2pgw s LYS 294 Cb -0.07 -2.57 -0.02 0.00 -0.52 0.00 0.00 37.83 34.65 2pgw s LYS 294 CO 0.12 0.15 -0.10 0.42 -0.92 0.00 0.00 175.35 175.02 2pgw s ILE 295 N -2.24 3.41 -0.10 2.17 -1.09 0.37 -2.28 121.20 121.44 2pgw s ILE 295 Ca 0.40 -0.57 0.03 0.00 -2.23 0.00 0.00 60.65 58.29 2pgw s ILE 295 Cb -0.07 -2.41 -0.00 0.00 -1.58 0.00 0.00 42.46 38.40 2pgw s ILE 295 CO 0.27 0.56 -0.22 0.00 -1.23 0.00 0.00 174.94 174.33 2pgw s ILE 297 N 0.26 4.44 -0.17 0.00 1.01 -1.26 -1.84 121.20 123.64 2pgw s ILE 297 Ca -0.15 1.74 -0.14 0.00 0.00 0.00 0.00 60.65 62.10 2pgw s ILE 297 Cb -0.17 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.14 2pgw s ILE 297 CO 0.08 -0.03 0.32 -2.28 0.00 0.00 0.00 174.94 173.03 2pgw s HIS 298 N 2.40 3.43 0.00 3.97 5.65 -0.55 -1.41 115.29 128.78 2pgw s HIS 298 Ca 0.53 0.60 0.00 0.00 0.25 0.00 0.00 55.06 56.43 2pgw s HIS 298 Cb -0.22 -2.40 0.00 0.00 -1.18 0.00 0.00 32.58 28.79 2pgw s HIS 298 CO 0.19 0.16 0.00 0.45 -0.65 0.00 0.00 174.74 174.89 2pgw n SER 299 N 3.85 0.00 -2.81 9.88 2.88 -1.26 -3.56 113.62 122.60 2pgw n SER 299 Ca -0.11 -0.02 -0.11 0.00 -1.33 0.00 0.00 58.87 57.30 2pgw n SER 299 Cb 0.52 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.97 2pgw n SER 299 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2pgw n SER 300 N -0.06 -1.72 -3.61 -3.46 3.41 -1.26 -4.97 113.62 101.95 2pgw n SER 300 Ca 0.00 -2.67 -0.41 0.00 -0.26 0.00 0.00 58.87 55.53 2pgw n SER 300 Cb 0.00 3.00 -0.01 0.00 -0.26 0.00 0.00 64.21 66.94 2pgw n SER 300 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2pgw n PHE 301 N -0.53 2.98 -2.89 7.33 3.72 -1.26 -4.87 117.46 121.93 2pgw n PHE 301 Ca -0.04 -2.95 0.00 0.00 -0.05 0.00 0.00 57.45 54.42 2pgw n PHE 301 Cb 0.56 -2.31 0.00 0.00 -0.94 0.00 0.00 39.48 36.79 2pgw n PHE 301 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2pgw n THR 302 N 3.85 0.00 -3.59 4.37 -2.24 -1.26 -4.56 114.28 110.85 2pgw n THR 302 Ca 0.58 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 62.29 2pgw n THR 302 Cb 0.32 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 2pgw n THR 302 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2pgw n THR 303 N 0.00 0.00 0.31 4.28 -2.24 -1.26 -4.53 114.28 110.83 2pgw n THR 303 Ca 0.00 -0.54 0.20 0.00 -2.27 0.00 0.00 64.05 61.44 2pgw n THR 303 Cb 0.00 -0.39 1.01 0.00 -2.10 0.00 0.00 70.33 68.85 2pgw n THR 303 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2pgw h GLY 304 N 0.16 0.00 0.93 3.38 0.00 -1.96 -2.35 103.07 103.23 2pgw h GLY 304 Ca -0.09 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 2pgw h GLY 304 CO 0.13 0.00 0.14 -2.22 0.00 0.00 0.00 176.54 174.60 2pgw h ILE 305 N 0.00 1.17 -0.29 2.60 2.04 -1.96 -0.89 117.51 120.19 2pgw h ILE 305 Ca 0.00 -0.51 -0.10 0.00 1.00 0.00 0.00 64.86 65.25 2pgw h ILE 305 Cb 0.13 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 2pgw h ILE 305 CO 0.00 0.18 -0.24 0.74 0.00 0.00 0.00 178.15 178.83 2pgw h THR 306 N 0.39 1.27 -0.96 -0.27 2.02 -1.81 -2.37 112.91 111.17 2pgw h THR 306 Ca 0.11 -1.29 0.03 0.00 0.77 0.00 0.00 66.41 66.04 2pgw h THR 306 Cb 0.15 1.32 -0.05 0.00 -1.74 0.00 0.00 68.15 67.83 2pgw h THR 306 CO -0.01 0.41 0.62 0.74 0.37 0.00 0.00 175.52 177.66 2pgw h THR 307 N 0.49 1.17 -0.38 3.16 2.02 -1.25 0.48 112.91 118.60 2pgw h THR 307 Ca 0.07 -0.42 -0.16 0.00 0.77 0.00 0.00 66.41 66.67 2pgw h THR 307 Cb 0.69 -0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 2pgw h THR 307 CO 0.05 0.22 -0.39 0.00 0.37 0.00 0.00 175.52 175.78 2pgw h ALA 309 N 0.79 -0.07 0.00 0.00 0.00 -1.00 -2.00 119.26 116.98 2pgw h ALA 309 Ca 0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2pgw h ALA 309 Cb 0.98 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 2pgw h ALA 309 CO 0.09 -0.43 -0.04 0.93 0.00 0.00 0.00 179.25 179.80 2pgw h GLU 310 N -0.28 0.00 -0.12 0.00 5.08 -0.91 -0.55 114.58 117.80 2pgw h GLU 310 Ca -0.01 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2pgw h GLU 310 Cb 0.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2pgw h GLU 310 CO 0.01 0.04 -0.12 1.25 -1.00 0.00 0.00 179.01 179.19 2pgw h HIS 311 N 0.00 0.35 -0.29 4.33 2.76 -0.88 -1.30 115.15 120.11 2pgw h HIS 311 Ca -0.00 -0.11 -0.10 0.00 -2.20 0.00 0.00 60.37 57.96 2pgw h HIS 311 Cb 0.08 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 2pgw h HIS 311 CO 0.00 0.70 -0.25 0.45 -1.30 0.00 0.00 177.93 177.53 2pgw h HIS 312 N -0.10 0.65 -0.44 5.26 3.86 -0.78 -1.62 115.15 121.98 2pgw h HIS 312 Ca 0.02 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.08 2pgw h HIS 312 Cb 0.64 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 2pgw h HIS 312 CO 0.09 0.78 0.24 0.82 0.86 0.00 0.00 177.93 180.71 2pgw h ILE 313 N 0.51 1.16 -0.26 2.45 2.04 -1.08 -2.12 117.51 120.21 2pgw h ILE 313 Ca 0.07 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.51 2pgw h ILE 313 Cb 0.70 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 2pgw h ILE 313 CO 0.05 0.17 0.16 1.23 0.00 0.00 0.00 178.15 179.77 2pgw h GLY 314 N 0.58 0.36 1.13 5.37 0.00 -0.86 -2.47 103.07 107.17 2pgw h GLY 314 Ca 0.15 -0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.38 2pgw h GLY 314 CO -0.02 0.12 0.54 1.41 0.00 0.00 0.00 176.54 178.59 2pgw h LEU 315 N 0.33 0.91 0.00 3.11 3.38 -1.11 -2.47 115.31 119.46 2pgw h LEU 315 Ca 0.10 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2pgw h LEU 315 Cb -0.03 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.51 2pgw h LEU 315 CO -0.03 0.64 0.00 0.00 0.09 0.00 0.00 178.44 179.14 2pgw n ALA 316 N -2.41 2.35 -2.62 1.53 0.00 -0.81 -0.00 120.51 118.54 2pgw n ALA 316 Ca 0.10 -0.12 -0.38 0.00 0.00 0.00 0.00 53.44 53.05 2pgw n ALA 316 Cb 0.07 -1.46 -0.10 0.00 0.00 0.00 0.00 19.45 17.96 2pgw n ALA 316 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2pgw s ILE 317 N -2.79 5.27 0.10 0.00 1.01 -0.93 -4.85 121.20 119.01 2pgw s ILE 317 Ca 0.20 0.34 -0.15 0.00 0.00 0.00 0.00 60.65 61.04 2pgw s ILE 317 Cb 0.19 -3.59 -0.11 0.00 0.01 0.00 0.00 42.46 38.96 2pgw s ILE 317 CO 0.48 0.25 1.37 1.55 0.00 0.00 0.00 174.94 178.59 2pgw h PRO 318 N 8.00 0.72 -3.18 2.79 0.13 -1.85 -3.34 132.00 135.27 2pgw h PRO 318 Ca -0.35 -0.44 -0.77 0.00 -0.87 0.00 0.00 66.00 63.57 2pgw h PRO 318 Cb 1.17 0.05 -0.19 0.00 0.13 0.00 0.00 31.00 32.16 2pgw h PRO 318 CO 0.62 1.06 1.66 0.27 -0.23 0.00 0.00 178.00 181.38 2pgw n ASN 319 N -4.18 5.88 -4.53 1.44 6.94 -1.26 -4.98 115.26 114.57 2pgw n ASN 319 Ca -0.05 -3.23 -0.32 0.00 -0.02 0.00 0.00 54.58 50.96 2pgw n ASN 319 Cb 0.55 -1.39 -0.12 0.00 -2.36 0.00 0.00 39.78 36.46 2pgw n ASN 319 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2pgw s LEU 320 N -1.32 2.91 1.02 -4.53 2.96 -1.26 -0.48 118.68 117.99 2pgw s LEU 320 Ca 0.38 -0.25 -0.14 0.00 -0.22 0.00 0.00 54.13 53.90 2pgw s LEU 320 Cb 0.10 -1.68 0.20 0.00 0.50 0.00 0.00 46.19 45.31 2pgw s LEU 320 CO 0.02 0.28 1.12 -0.62 -1.32 0.00 0.00 176.35 175.84 2pgw s ASP 321 N -1.33 2.48 -0.12 3.68 2.15 0.91 -4.86 116.67 119.57 2pgw s ASP 321 Ca 0.15 0.92 0.16 0.00 0.43 0.00 0.00 52.55 54.22 2pgw s ASP 321 Cb -0.11 -1.43 0.27 0.00 -0.30 0.00 0.00 42.92 41.35 2pgw s ASP 321 CO 0.06 -3.19 1.14 -0.90 -0.17 0.00 0.00 175.17 172.10 2pgw n ASP 322 N -4.18 1.99 -2.59 -0.34 5.75 -1.26 -4.63 116.55 111.29 2pgw n ASP 322 Ca 0.08 -3.01 -0.11 0.00 -0.01 0.00 0.00 54.79 51.74 2pgw n ASP 322 Cb 0.59 -0.41 0.03 0.00 -1.03 0.00 0.00 41.12 40.30 2pgw n ASP 322 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pgw n GLY 323 N -1.21 3.13 3.74 6.12 0.00 -1.23 -3.30 105.19 112.44 2pgw n GLY 323 Ca 0.14 -1.66 -0.35 0.00 0.00 0.00 0.00 46.02 44.15 2pgw n GLY 323 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pgw s ASN 324 N -3.53 4.64 0.44 1.61 0.01 -0.54 -3.88 114.94 113.70 2pgw s ASN 324 Ca 0.34 2.40 -0.21 0.00 -0.71 0.00 0.00 52.86 54.68 2pgw s ASN 324 Cb 0.39 -2.60 -0.10 0.00 0.41 0.00 0.00 41.25 39.35 2pgw s ASN 324 CO -0.02 -1.97 0.98 -1.10 -1.51 0.00 0.00 177.10 173.48 2pgw s GLN 325 N -3.64 4.10 0.18 -0.60 -0.21 -0.50 -1.22 119.66 117.77 2pgw s GLN 325 Ca 0.76 1.21 -0.12 0.00 0.02 0.00 0.00 55.36 57.23 2pgw s GLN 325 Cb -0.31 -2.17 0.01 0.00 1.00 0.00 0.00 33.01 31.54 2pgw s GLN 325 CO 0.40 -0.15 0.38 -1.50 -2.12 0.00 0.00 175.29 172.30 2pgw s ILE 326 N -2.10 0.05 0.00 1.08 2.07 -1.26 -4.63 121.20 116.41 2pgw s ILE 326 Ca 0.63 -1.14 0.00 0.00 -1.41 0.00 0.00 60.65 58.74 2pgw s ILE 326 Cb -0.12 -1.73 0.00 0.00 0.13 0.00 0.00 42.46 40.75 2pgw s ILE 326 CO 0.16 -0.23 0.00 -2.67 -1.91 0.00 0.00 174.94 170.29 2pgw n TRP 328 N -0.26 0.00 0.39 3.50 4.27 -1.26 -4.85 117.44 119.22 2pgw n TRP 328 Ca -0.09 0.00 0.05 0.00 -3.89 0.00 0.00 57.50 53.57 2pgw n TRP 328 Cb 0.63 -0.01 0.22 0.00 -1.36 0.00 0.00 31.31 30.78 2pgw n TRP 328 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2pgw n GLN 329 N -0.03 0.07 0.12 -2.67 0.00 -1.26 -2.52 117.38 111.09 2pgw n GLN 329 Ca 0.00 0.27 0.12 0.00 0.00 0.00 0.00 57.00 57.39 2pgw n GLN 329 Cb 0.00 -1.50 0.21 0.00 0.00 0.00 0.00 30.24 28.95 2pgw n GLN 329 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2pgw h LEU 330 N 0.00 0.00 -9.73 2.61 3.38 -1.94 -3.47 115.31 106.17 2pgw h LEU 330 Ca 0.00 -0.06 -0.53 0.00 0.09 0.00 0.00 57.88 57.38 2pgw h LEU 330 Cb 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2pgw h LEU 330 CO 0.00 0.03 0.18 0.68 0.09 0.00 0.00 178.44 179.42 2pgw s VAL 331 N -3.19 4.37 0.16 1.22 -7.23 -1.05 -1.47 120.40 113.21 2pgw s VAL 331 Ca 0.07 1.70 -0.23 0.00 -1.81 0.00 0.00 61.98 61.70 2pgw s VAL 331 Cb 0.10 -4.14 0.04 0.00 0.56 0.00 0.00 36.38 32.95 2pgw s VAL 331 CO 0.68 0.52 1.61 -0.61 -0.31 0.00 0.00 175.10 176.99 2pgw h GLN 332 N 4.33 -0.27 -2.95 4.82 5.75 -1.29 -3.39 115.11 122.11 2pgw h GLN 332 Ca -0.47 0.02 -0.44 0.00 -0.15 0.00 0.00 58.65 57.61 2pgw h GLN 332 Cb 1.21 0.06 -0.40 0.00 1.07 0.00 0.00 27.48 29.42 2pgw h GLN 332 CO 0.66 -0.18 -0.73 -1.21 -2.65 0.00 0.00 178.83 174.72 2pgw s GLU 333 N -6.01 0.09 0.59 1.69 2.02 -1.26 -4.86 118.70 110.96 2pgw s GLU 333 Ca -0.15 -0.05 -0.17 0.00 0.02 0.00 0.00 54.97 54.62 2pgw s GLU 333 Cb 0.13 -1.70 -0.03 0.00 0.10 0.00 0.00 34.13 32.62 2pgw s GLU 333 CO 0.67 -0.68 1.10 0.34 0.02 0.00 0.00 175.26 176.71 2pgw s ASP 334 N 2.17 5.57 0.00 -0.19 2.15 -1.26 -4.96 116.67 120.15 2pgw s ASP 334 Ca 0.03 2.00 0.28 0.00 0.43 0.00 0.00 52.55 55.29 2pgw s ASP 334 Cb -0.16 -2.56 1.15 0.00 -0.30 0.00 0.00 42.92 41.06 2pgw s ASP 334 CO -0.11 -1.32 1.80 2.30 -0.17 0.00 0.00 175.17 177.68 2pgw n ILE 335 N -1.86 0.00 -3.35 4.11 -5.35 -1.26 -4.75 119.36 106.91 2pgw n ILE 335 Ca 0.10 -0.12 -0.39 0.00 -0.27 0.00 0.00 62.75 62.07 2pgw n ILE 335 Cb 0.52 0.13 -0.08 0.00 -1.74 0.00 0.00 39.64 38.47 2pgw n ILE 335 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2pgw s VAL 336 N -2.29 5.15 -0.00 7.28 1.01 -1.26 -0.11 120.40 130.18 2pgw s VAL 336 Ca 0.33 0.70 0.11 0.00 0.00 0.00 0.00 61.98 63.12 2pgw s VAL 336 Cb 0.20 -3.74 -0.20 0.00 0.00 0.00 0.00 36.38 32.64 2pgw s VAL 336 CO 0.43 0.17 0.93 0.77 0.00 0.00 0.00 175.10 177.40 2pgw h SER 337 N 7.87 0.00 -4.86 3.32 4.64 -0.78 -3.46 113.55 120.28 2pgw h SER 337 Ca -0.32 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.90 2pgw h SER 337 Cb 1.16 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.05 2pgw h SER 337 CO 0.69 0.93 -0.09 -0.94 -0.87 0.00 0.00 176.83 176.55 2pgw s SER 338 N -6.29 -0.40 0.89 4.97 1.04 -1.20 -4.78 113.70 107.93 2pgw s SER 338 Ca -0.02 0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.84 2pgw s SER 338 Cb 0.09 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.69 2pgw s SER 338 CO 0.82 -0.47 0.00 -0.81 0.98 0.00 0.00 173.24 173.76 2pgw n PRO 339 N 1.33 0.12 -2.78 4.02 -0.04 -1.26 -0.99 135.00 135.41 2pgw n PRO 339 Ca -0.20 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.84 2pgw n PRO 339 Cb 0.56 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.99 2pgw n PRO 339 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2pgw s ASP 340 N -1.00 6.75 -0.02 3.54 2.15 -1.26 -4.91 116.67 121.92 2pgw s ASP 340 Ca 0.00 0.73 0.09 0.00 0.43 0.00 0.00 52.55 53.80 2pgw s ASP 340 Cb 0.00 -2.48 0.30 0.00 -0.30 0.00 0.00 42.92 40.44 2pgw s ASP 340 CO 0.00 -0.83 1.21 0.18 -0.17 0.00 0.00 175.17 175.56 2pgw n LEU 341 N 6.72 2.00 -4.63 -1.34 4.77 -1.26 -4.87 117.00 118.39 2pgw n LEU 341 Ca 0.08 -1.00 -0.43 0.00 -0.03 0.00 0.00 56.01 54.63 2pgw n LEU 341 Cb 0.48 -0.28 -0.02 0.00 -2.33 0.00 0.00 43.42 41.26 2pgw n LEU 341 CO 0.57 0.44 0.94 -0.89 -1.33 0.00 0.00 177.39 177.12 2pgw s THR 342 N -1.60 4.49 0.41 -5.08 2.01 -1.26 -5.00 115.64 109.61 2pgw s THR 342 Ca 0.22 1.61 -0.25 0.00 0.31 0.00 0.00 61.69 63.59 2pgw s THR 342 Cb 0.13 -4.42 -0.08 0.00 0.01 0.00 0.00 72.50 68.13 2pgw s THR 342 CO 0.14 -0.54 1.19 -2.84 -0.69 0.00 0.00 174.62 171.87 2pgw s PRO 343 N 3.71 3.97 -0.28 4.92 0.02 -1.26 -4.94 135.00 141.13 2pgw s PRO 343 Ca 0.45 1.87 -0.05 0.00 0.02 0.00 0.00 61.00 63.29 2pgw s PRO 343 Cb -0.12 -2.63 0.02 0.00 0.02 0.00 0.00 34.50 31.80 2pgw s PRO 343 CO 0.17 -0.40 0.03 0.21 -0.33 0.00 0.00 177.00 176.69 2pgw s LYS 344 N -2.38 2.89 -1.45 5.54 2.20 -0.05 -4.49 119.74 122.00 2pgw s LYS 344 Ca 0.58 -0.97 -0.10 0.00 -0.36 0.00 0.00 55.97 55.13 2pgw s LYS 344 Cb -0.31 -3.24 0.04 0.00 -1.51 0.00 0.00 37.83 32.81 2pgw s LYS 344 CO 0.39 -0.47 0.94 0.09 -0.36 0.00 0.00 175.35 175.94 2pgw n ASN 345 N 4.77 -5.67 -0.80 1.43 3.02 -1.26 -1.76 115.26 115.00 2pgw n ASN 345 Ca -0.15 -0.54 -0.10 0.00 -0.03 0.00 0.00 54.58 53.76 2pgw n ASN 345 Cb 0.47 -4.51 -0.04 0.00 -0.61 0.00 0.00 39.78 35.09 2pgw n ASN 345 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2pgw n GLY 346 N -1.74 1.00 3.17 7.41 0.00 -1.26 -4.56 105.19 109.21 2pgw n GLY 346 Ca -0.01 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.25 2pgw n GLY 346 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2pgw s TRP 347 N -2.38 1.24 -0.21 1.61 0.52 -0.72 -0.17 118.94 118.83 2pgw s TRP 347 Ca 0.00 -0.42 -0.01 0.00 0.02 0.00 0.00 56.10 55.69 2pgw s TRP 347 Cb 0.00 -0.71 0.06 0.00 -1.15 0.00 0.00 33.47 31.67 2pgw s TRP 347 CO 0.00 0.06 -0.01 -0.51 0.02 0.00 0.00 176.95 176.50 2pgw s LEU 348 N -1.55 1.89 0.74 2.99 1.43 -0.59 -0.87 118.68 122.72 2pgw s LEU 348 Ca -0.01 -0.98 -0.15 0.00 -1.03 0.00 0.00 54.13 51.96 2pgw s LEU 348 Cb -0.09 -0.90 0.04 0.00 0.03 0.00 0.00 46.19 45.27 2pgw s LEU 348 CO 0.02 -0.26 1.24 -1.81 0.23 0.00 0.00 176.35 175.77 2pgw s ASP 349 N 1.62 4.01 0.16 2.29 1.01 -1.26 -1.47 116.67 123.02 2pgw s ASP 349 Ca -0.03 2.48 -0.34 0.00 0.71 0.00 0.00 52.55 55.37 2pgw s ASP 349 Cb -0.18 -2.60 -0.14 0.00 1.01 0.00 0.00 42.92 41.01 2pgw s ASP 349 CO -0.07 -2.39 1.48 0.00 0.21 0.00 0.00 175.17 174.40 2pgw n ALA 350 N -2.72 0.75 -1.85 5.23 0.00 -0.11 -4.83 120.51 116.98 2pgw n ALA 350 Ca 0.14 0.46 -0.40 0.00 0.00 0.00 0.00 53.44 53.64 2pgw n ALA 350 Cb 0.49 -2.27 -0.06 0.00 0.00 0.00 0.00 19.45 17.62 2pgw n ALA 350 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2pgw s PHE 351 N 0.61 3.96 -0.08 0.00 0.08 -1.26 -4.98 117.98 116.31 2pgw s PHE 351 Ca 0.78 1.90 0.01 0.00 0.12 0.00 0.00 56.93 59.74 2pgw s PHE 351 Cb -0.74 -3.00 -0.00 0.00 -0.57 0.00 0.00 43.02 38.71 2pgw s PHE 351 CO 0.42 0.41 0.27 0.54 -0.10 0.00 0.00 175.22 176.76 2pgw n ARG 352 N 1.73 3.19 -1.12 0.44 5.12 -1.26 -4.92 116.66 119.84 2pgw n ARG 352 Ca -0.01 -0.26 -0.31 0.00 -1.93 0.00 0.00 57.85 55.34 2pgw n ARG 352 Cb 0.47 -0.76 0.11 0.00 -1.16 0.00 0.00 32.46 31.12 2pgw n ARG 352 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2pgw s LYS 353 N -0.61 1.94 0.51 5.56 -0.14 -1.26 -4.23 119.74 121.51 2pgw s LYS 353 Ca 0.01 1.25 -0.22 0.00 -1.36 0.00 0.00 55.97 55.65 2pgw s LYS 353 Cb 0.01 -1.86 -0.07 0.00 -1.68 0.00 0.00 37.83 34.23 2pgw s LYS 353 CO 0.02 -1.89 1.09 -2.30 -0.76 0.00 0.00 175.35 171.51 2pgw n PRO 354 N -3.70 1.33 0.00 -1.68 -0.02 -1.26 -3.77 135.00 125.90 2pgw n PRO 354 Ca 0.10 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2pgw n PRO 354 Cb 0.53 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2pgw n PRO 354 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pgw n GLY 355 N 1.09 2.46 0.00 -1.23 0.00 0.58 -1.44 105.19 106.66 2pgw n GLY 355 Ca 0.11 -0.47 0.11 0.00 0.00 0.00 0.00 46.02 45.77 2pgw n GLY 355 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pgw n LEU 356 N 0.00 0.00 -0.66 0.99 4.77 -1.26 -1.30 117.00 119.54 2pgw n LEU 356 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 2pgw n LEU 356 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 2pgw n LEU 356 CO 0.00 0.00 -0.08 0.61 -1.33 0.00 0.00 177.39 176.59 2pgw n GLY 357 N 0.51 1.01 3.72 -0.72 0.00 -0.52 -4.77 105.19 104.42 2pgw n GLY 357 Ca 0.17 -0.41 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 2pgw n GLY 357 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2pgw s PHE 358 N -2.20 2.66 -0.03 1.61 -0.12 -1.26 -4.15 117.98 114.49 2pgw s PHE 358 Ca 0.00 -0.43 0.05 0.00 -0.05 0.00 0.00 56.93 56.49 2pgw s PHE 358 Cb 0.00 -1.68 -0.01 0.00 -0.63 0.00 0.00 43.02 40.70 2pgw s PHE 358 CO 0.00 0.33 -0.17 -0.65 -0.05 0.00 0.00 175.22 174.68 2pgw s GLN 359 N -3.84 1.54 0.05 1.99 -1.52 -0.16 -4.98 119.66 112.74 2pgw s GLN 359 Ca 0.38 -0.59 -0.02 0.00 -1.95 0.00 0.00 55.36 53.18 2pgw s GLN 359 Cb -0.01 -1.41 -0.04 0.00 -0.22 0.00 0.00 33.01 31.33 2pgw s GLN 359 CO 0.22 0.30 0.22 -0.51 -0.25 0.00 0.00 175.29 175.27 2pgw s LEU 360 N -0.18 4.35 -0.91 2.90 1.43 -1.26 -0.10 118.68 124.91 2pgw s LEU 360 Ca 0.02 0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 53.27 2pgw s LEU 360 Cb -0.09 -2.89 0.14 0.00 0.03 0.00 0.00 46.19 43.39 2pgw s LEU 360 CO 0.01 0.19 1.08 0.00 0.23 0.00 0.00 176.35 177.85 2pgw s ALA 361 N -1.46 3.46 0.34 4.21 0.00 0.85 -4.68 121.76 124.47 2pgw s ALA 361 Ca 0.33 -2.84 0.12 0.00 0.00 0.00 0.00 51.96 49.58 2pgw s ALA 361 Cb -0.13 -3.98 0.96 0.00 0.00 0.00 0.00 23.12 19.97 2pgw s ALA 361 CO 0.25 -2.89 1.74 1.49 0.00 0.00 0.00 175.76 176.35 2pgw h GLU 362 N 8.70 0.50 -0.60 0.00 4.57 -1.96 0.26 114.58 126.06 2pgw h GLU 362 Ca 0.15 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 2pgw h GLU 362 Cb 1.03 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.47 2pgw h GLU 362 CO 1.06 0.33 0.33 0.38 -1.18 0.00 0.00 179.01 179.93 2pgw h ASP 363 N 0.52 0.75 -0.04 1.04 2.03 -1.98 0.12 116.42 118.86 2pgw h ASP 363 Ca 0.63 -0.09 -0.12 0.00 -0.73 0.00 0.00 57.03 56.72 2pgw h ASP 363 Cb 1.33 -0.19 -0.01 0.00 -0.83 0.00 0.00 39.33 39.63 2pgw h ASP 363 CO -0.42 0.63 -0.35 -0.07 -1.03 0.00 0.00 179.24 177.99 2pgw h LEU 364 N 0.81 0.55 0.40 0.15 3.38 -1.38 -1.55 115.31 117.67 2pgw h LEU 364 Ca 0.21 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2pgw h LEU 364 Cb 0.05 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2pgw h LEU 364 CO -0.03 0.86 -0.19 0.58 0.09 0.00 0.00 178.44 179.74 2pgw h VAL 365 N 0.44 0.56 -0.91 1.22 2.07 -0.90 -1.00 116.25 117.73 2pgw h VAL 365 Ca 0.05 -0.44 0.15 0.00 0.82 0.00 0.00 66.70 67.28 2pgw h VAL 365 Cb 0.83 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 31.28 2pgw h VAL 365 CO 0.07 0.08 0.59 0.00 0.02 0.00 0.00 177.57 178.32 2pgw h ALA 366 N -0.35 1.83 -0.35 1.67 0.00 -0.97 0.40 119.26 121.48 2pgw h ALA 366 Ca -0.06 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 2pgw h ALA 366 Cb 0.54 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2pgw h ALA 366 CO 0.09 -0.08 -0.11 1.49 0.00 0.00 0.00 179.25 180.64 2pgw h GLU 367 N 0.70 0.61 -0.56 0.00 4.81 -1.06 -1.17 114.58 117.92 2pgw h GLU 367 Ca 0.47 -0.18 -0.10 0.00 -0.13 0.00 0.00 59.36 59.41 2pgw h GLU 367 Cb 0.76 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 2pgw h GLU 367 CO -0.22 0.71 -0.04 0.78 -0.73 0.00 0.00 179.01 179.50 2pgw h GLY 368 N 0.95 1.09 1.13 1.92 0.00 0.11 -1.71 103.07 106.57 2pgw h GLY 368 Ca 0.10 -0.84 -0.02 0.00 0.00 0.00 0.00 47.33 46.58 2pgw h GLY 368 CO 0.03 0.77 0.45 0.83 0.00 0.00 0.00 176.54 178.62 2pgw h GLU 369 N 0.89 1.14 -0.56 4.80 5.08 -0.66 -1.56 114.58 123.72 2pgw h GLU 369 Ca 0.15 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2pgw h GLU 369 Cb 0.60 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2pgw h GLU 369 CO 0.04 0.83 0.36 0.78 -1.00 0.00 0.00 179.01 180.02 2pgw h GLY 370 N 1.17 0.79 1.60 -3.84 0.00 -0.69 -0.27 103.07 101.83 2pgw h GLY 370 Ca 0.29 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.29 2pgw h GLY 370 CO -0.05 0.26 -0.05 3.21 0.00 0.00 0.00 176.54 179.92 2pgw h ARG 371 N 0.72 0.49 -0.55 4.80 3.08 -0.73 -2.08 114.38 120.12 2pgw h ARG 371 Ca 0.21 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 2pgw h ARG 371 Cb -0.05 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2pgw h ARG 371 CO -0.06 0.56 0.17 -0.92 -1.07 0.00 0.00 179.97 178.64 2pgw h TYR 372 N 0.47 0.89 -1.21 3.04 3.20 -0.41 -2.79 116.97 120.16 2pgw h TYR 372 Ca 0.10 -0.09 0.40 0.00 3.14 0.00 0.00 58.73 62.27 2pgw h TYR 372 Cb 0.38 -0.26 -0.13 0.00 1.54 0.00 0.00 36.73 38.26 2pgw h TYR 372 CO 0.01 0.75 0.75 0.00 -1.64 0.00 0.00 178.16 178.04 2pgw h ALA 373 N 1.03 2.50 -0.02 1.82 0.00 -0.34 -3.50 119.26 120.75 2pgw h ALA 373 Ca 0.18 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2pgw h ALA 373 Cb 0.29 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2pgw h ALA 373 CO -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 179.25 178.13