#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gms s LEU 1 N 0.00 4.37 0.19 1.04 2.96 -1.26 -4.95 118.68 121.03 3gms s LEU 1 Ca 0.00 2.38 0.11 0.00 -0.22 0.00 0.00 54.13 56.40 3gms s LEU 1 Cb 0.00 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.06 3gms s LEU 1 CO 0.00 -0.70 -0.23 -1.00 -1.32 0.00 0.00 176.35 173.10 3gms s HIS 2 N 1.26 2.23 0.01 5.38 3.76 -1.26 -1.35 115.29 125.32 3gms s HIS 2 Ca 0.66 -0.37 0.03 0.00 -0.15 0.00 0.00 55.06 55.22 3gms s HIS 2 Cb -0.38 -1.10 -0.01 0.00 1.11 0.00 0.00 32.58 32.20 3gms s HIS 2 CO 0.30 0.49 -0.09 0.20 -0.85 0.00 0.00 174.74 174.79 3gms s GLY 3 N -2.71 0.45 0.47 -2.22 0.00 0.07 -4.91 107.32 98.47 3gms s GLY 3 Ca 0.20 -0.46 -0.17 0.00 0.00 0.00 0.00 44.72 44.30 3gms s GLY 3 CO 0.10 -0.42 0.93 1.25 0.00 0.00 0.00 173.10 174.95 3gms s LYS 4 N -0.51 4.00 -0.01 2.90 2.20 -1.26 -0.92 119.74 126.13 3gms s LYS 4 Ca 0.01 0.91 -0.23 0.00 -0.36 0.00 0.00 55.97 56.30 3gms s LYS 4 Cb -0.05 -2.20 0.05 0.00 -1.51 0.00 0.00 37.83 34.12 3gms s LYS 4 CO 0.00 -0.16 0.50 -0.48 -0.36 0.00 0.00 175.35 174.86 3gms s LEU 5 N -3.76 0.04 -0.19 5.43 2.34 0.06 -0.68 118.68 121.92 3gms s LEU 5 Ca 0.58 0.34 -0.09 0.00 0.06 0.00 0.00 54.13 55.02 3gms s LEU 5 Cb -0.10 1.98 -0.05 0.00 -0.56 0.00 0.00 46.19 47.46 3gms s LEU 5 CO 0.26 -0.59 0.12 -0.63 -1.06 0.00 0.00 176.35 174.46 3gms s ILE 6 N -1.61 5.36 0.03 1.48 -1.09 -0.64 -0.96 121.20 123.77 3gms s ILE 6 Ca -0.10 0.17 0.00 0.00 -2.23 0.00 0.00 60.65 58.49 3gms s ILE 6 Cb -0.02 -3.43 -0.02 0.00 -1.58 0.00 0.00 42.46 37.41 3gms s ILE 6 CO 0.05 0.46 -0.04 -1.58 -1.23 0.00 0.00 174.94 172.60 3gms s GLN 7 N 0.19 0.38 0.00 2.79 0.74 -0.65 -4.04 119.66 119.08 3gms s GLN 7 Ca 0.08 -0.70 0.06 0.00 0.05 0.00 0.00 55.36 54.86 3gms s GLN 7 Cb -0.11 0.06 -0.02 0.00 1.10 0.00 0.00 33.01 34.04 3gms s GLN 7 CO -0.01 -0.04 -0.18 -0.59 -0.55 0.00 0.00 175.29 173.92 3gms s PHE 8 N -1.71 1.62 -0.45 1.67 -0.12 -0.84 -0.01 117.98 118.14 3gms s PHE 8 Ca -0.13 -0.32 0.17 0.00 -0.05 0.00 0.00 56.93 56.60 3gms s PHE 8 Cb -0.08 -1.02 -0.22 0.00 -0.63 0.00 0.00 43.02 41.07 3gms s PHE 8 CO -0.02 0.00 0.56 0.72 -0.05 0.00 0.00 175.22 176.44 3gms n HIS 9 N 2.41 0.00 -4.08 3.49 8.25 -1.26 -1.71 115.22 122.31 3gms n HIS 9 Ca -0.16 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.21 3gms n HIS 9 Cb 0.54 -0.18 -0.11 0.00 1.12 0.00 0.00 29.99 31.36 3gms n HIS 9 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3gms s LYS 10 N -2.87 0.59 0.54 -0.41 1.02 -1.26 -4.71 119.74 112.64 3gms s LYS 10 Ca 0.01 -1.02 -0.18 0.00 0.02 0.00 0.00 55.97 54.80 3gms s LYS 10 Cb 0.12 -0.06 -0.06 0.00 -0.52 0.00 0.00 37.83 37.31 3gms s LYS 10 CO 0.71 -0.03 1.04 -0.06 -0.92 0.00 0.00 175.35 176.08 3gms s PHE 11 N -2.70 3.07 -4.65 3.18 0.08 -1.26 -4.86 117.98 110.83 3gms s PHE 11 Ca -0.00 1.53 0.00 0.00 0.12 0.00 0.00 56.93 58.58 3gms s PHE 11 Cb -0.01 -2.99 0.00 0.00 -0.57 0.00 0.00 43.02 39.45 3gms s PHE 11 CO -0.04 -0.86 0.00 0.41 -0.10 0.00 0.00 175.22 174.63 3gms n GLY 12 N -0.80 -1.03 3.72 4.36 0.00 -0.76 -4.92 105.19 105.77 3gms n GLY 12 Ca 0.09 -1.15 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 3gms n GLY 12 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gms s ASN 13 N -4.00 6.39 0.43 1.61 0.01 -1.26 -3.70 114.94 114.42 3gms s ASN 13 Ca 0.00 2.87 0.16 0.00 -0.71 0.00 0.00 52.86 55.18 3gms s ASN 13 Cb 0.00 -2.60 1.07 0.00 0.41 0.00 0.00 41.25 40.12 3gms s ASN 13 CO 0.00 -0.96 1.93 -0.65 -1.51 0.00 0.00 177.10 175.92 3gms h PRO 14 N 6.51 0.38 0.00 -0.60 0.11 -1.93 0.44 132.00 136.91 3gms h PRO 14 Ca -0.44 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 3gms h PRO 14 Cb 1.20 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3gms h PRO 14 CO 0.93 0.25 -0.02 1.57 -0.21 0.00 0.00 178.00 180.53 3gms h LYS 15 N 0.39 0.00 0.00 1.05 2.10 -1.93 -2.15 116.57 116.04 3gms h LYS 15 Ca 0.35 0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 58.72 3gms h LYS 15 Cb 0.81 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.09 3gms h LYS 15 CO -0.10 0.02 -1.61 -0.44 -2.00 0.00 0.00 179.45 175.31 3gms h ASP 16 N 0.00 0.01 0.00 7.07 3.32 -1.29 -3.42 116.42 122.11 3gms h ASP 16 Ca -0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3gms h ASP 16 Cb 0.03 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3gms h ASP 16 CO 0.00 1.02 -1.23 1.33 -1.72 0.00 0.00 179.24 178.64 3gms n VAL 17 N -3.10 0.00 -2.35 -1.35 0.24 -0.97 -4.99 118.33 105.81 3gms n VAL 17 Ca -0.15 -0.22 -0.42 0.00 -2.04 0.00 0.00 64.34 61.52 3gms n VAL 17 Cb 1.04 0.42 -0.03 0.00 -1.47 0.00 0.00 33.84 33.79 3gms n VAL 17 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3gms s LEU 18 N -3.41 4.39 0.04 1.34 1.43 -0.84 -4.27 118.68 117.37 3gms s LEU 18 Ca -0.02 2.16 0.06 0.00 -1.03 0.00 0.00 54.13 55.30 3gms s LEU 18 Cb 0.06 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 3gms s LEU 18 CO 0.36 -0.48 -0.18 -1.10 0.23 0.00 0.00 176.35 175.18 3gms s GLN 19 N 0.65 1.21 -0.22 1.70 -0.21 0.98 -4.98 119.66 118.79 3gms s GLN 19 Ca 0.58 -0.86 -0.17 0.00 0.02 0.00 0.00 55.36 54.93 3gms s GLN 19 Cb -0.32 -1.28 -0.03 0.00 1.00 0.00 0.00 33.01 32.38 3gms s GLN 19 CO 0.32 0.32 0.46 0.08 -2.12 0.00 0.00 175.29 174.36 3gms s VAL 20 N -0.81 5.13 0.29 1.09 1.01 -1.26 -1.63 120.40 124.22 3gms s VAL 20 Ca 0.05 0.82 0.05 0.00 0.00 0.00 0.00 61.98 62.90 3gms s VAL 20 Cb -0.08 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 3gms s VAL 20 CO 0.02 0.18 0.23 -1.61 0.00 0.00 0.00 175.10 173.91 3gms s GLU 21 N 1.72 1.57 0.05 2.72 2.02 -0.13 -5.00 118.70 121.65 3gms s GLU 21 Ca 0.21 -1.89 0.04 0.00 0.02 0.00 0.00 54.97 53.35 3gms s GLU 21 Cb -0.15 0.30 -0.02 0.00 0.10 0.00 0.00 34.13 34.35 3gms s GLU 21 CO 0.09 -0.56 -0.12 0.71 0.02 0.00 0.00 175.26 175.40 3gms s TYR 22 N -3.68 1.02 0.04 1.61 2.02 -1.26 -0.76 117.35 116.34 3gms s TYR 22 Ca 0.40 -0.42 0.02 0.00 -0.37 0.00 0.00 57.07 56.70 3gms s TYR 22 Cb 0.04 -0.60 -0.02 0.00 -0.40 0.00 0.00 41.96 40.98 3gms s TYR 22 CO 0.22 0.01 -0.06 -1.59 -1.57 0.00 0.00 175.55 172.56 3gms s LYS 23 N -1.44 0.48 0.37 -0.62 -2.85 -0.10 -4.95 119.74 110.63 3gms s LYS 23 Ca -0.03 -0.75 -0.26 0.00 -1.00 0.00 0.00 55.97 53.92 3gms s LYS 23 Cb -0.09 -0.17 -0.09 0.00 -2.06 0.00 0.00 37.83 35.42 3gms s LYS 23 CO 0.01 0.02 1.17 1.21 0.10 0.00 0.00 175.35 177.86 3gms s ASN 24 N -1.64 6.71 -0.31 0.03 3.84 -1.26 -0.75 114.94 121.57 3gms s ASN 24 Ca -0.10 2.36 -0.21 0.00 0.21 0.00 0.00 52.86 55.12 3gms s ASN 24 Cb -0.09 -2.62 -0.01 0.00 -0.55 0.00 0.00 41.25 37.98 3gms s ASN 24 CO -0.00 -0.54 0.67 -0.63 -2.79 0.00 0.00 177.10 173.80 3gms s ILE 25 N -1.34 4.90 0.61 -5.21 -1.09 -0.45 -4.87 121.20 113.74 3gms s ILE 25 Ca 0.53 0.94 -0.12 0.00 -2.23 0.00 0.00 60.65 59.78 3gms s ILE 25 Cb -0.32 -4.04 -0.04 0.00 -1.58 0.00 0.00 42.46 36.48 3gms s ILE 25 CO 0.40 -0.17 1.03 -1.61 -1.23 0.00 0.00 174.94 173.36 3gms s GLU 26 N 2.70 3.54 0.71 2.79 2.02 -1.26 -4.88 118.70 124.32 3gms s GLU 26 Ca 0.27 0.84 -0.16 0.00 0.02 0.00 0.00 54.97 55.94 3gms s GLU 26 Cb -0.15 -2.07 0.02 0.00 0.10 0.00 0.00 34.13 32.03 3gms s GLU 26 CO 0.12 -0.61 1.26 -2.30 0.02 0.00 0.00 175.26 173.74 3gms n PRO 27 N -2.57 0.79 -2.82 0.39 -0.02 -1.26 -4.99 135.00 124.52 3gms n PRO 27 Ca 0.06 0.33 -0.38 0.00 -2.02 0.00 0.00 63.50 61.49 3gms n PRO 27 Cb 0.54 -2.50 -0.06 0.00 -0.02 0.00 0.00 33.50 31.46 3gms n PRO 27 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3gms s LEU 28 N -4.78 4.49 0.70 2.45 1.43 -1.26 -5.07 118.68 116.63 3gms s LEU 28 Ca 0.80 1.82 -0.10 0.00 -1.03 0.00 0.00 54.13 55.61 3gms s LEU 28 Cb -0.35 -3.74 0.03 0.00 0.03 0.00 0.00 46.19 42.16 3gms s LEU 28 CO 0.44 0.06 1.07 -0.54 0.23 0.00 0.00 176.35 177.61 3gms s LYS 29 N -1.61 2.68 0.30 1.70 1.02 -1.26 -4.80 119.74 117.78 3gms s LYS 29 Ca 0.44 0.27 0.06 0.00 0.02 0.00 0.00 55.97 56.76 3gms s LYS 29 Cb -0.22 -2.07 0.73 0.00 -0.52 0.00 0.00 37.83 35.76 3gms s LYS 29 CO 0.27 -1.07 1.78 -0.44 -0.92 0.00 0.00 175.35 174.97 3gms h ASP 30 N -0.62 0.80 -0.36 2.83 3.32 -1.97 -2.43 116.42 117.98 3gms h ASP 30 Ca -0.45 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.69 3gms h ASP 30 Cb 1.27 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.77 3gms h ASP 30 CO 0.63 0.29 0.00 -3.20 -1.72 0.00 0.00 179.24 175.24 3gms n ASN 31 N -4.75 4.18 -4.88 6.45 5.15 -1.26 -0.56 115.26 119.59 3gms n ASN 31 Ca 0.23 -2.83 -0.31 0.00 -0.60 0.00 0.00 54.58 51.07 3gms n ASN 31 Cb 0.56 -0.53 -0.05 0.00 -0.53 0.00 0.00 39.78 39.23 3gms n ASN 31 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3gms s GLU 32 N -2.51 3.79 -0.04 1.20 2.02 -0.92 -0.45 118.70 121.79 3gms s GLU 32 Ca 0.43 0.27 0.07 0.00 0.02 0.00 0.00 54.97 55.75 3gms s GLU 32 Cb 0.33 -2.62 -0.01 0.00 0.10 0.00 0.00 34.13 31.92 3gms s GLU 32 CO 0.12 0.27 -0.24 0.08 0.02 0.00 0.00 175.26 175.52 3gms s VAL 33 N -1.90 1.94 -0.22 2.63 1.01 -0.07 -0.56 120.40 123.24 3gms s VAL 33 Ca 0.47 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 3gms s VAL 33 Cb -0.11 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.66 3gms s VAL 33 CO 0.23 0.54 -0.10 0.12 0.00 0.00 0.00 175.10 175.89 3gms s PHE 34 N -0.33 2.96 -0.11 5.22 5.36 -0.10 -2.52 117.98 128.47 3gms s PHE 34 Ca 0.02 -1.49 0.02 0.00 -0.96 0.00 0.00 56.93 54.52 3gms s PHE 34 Cb -0.12 -2.02 0.02 0.00 -0.34 0.00 0.00 43.02 40.56 3gms s PHE 34 CO 0.01 -0.72 -0.14 0.08 -1.46 0.00 0.00 175.22 172.99 3gms s VAL 35 N 1.34 1.44 -0.36 3.12 1.01 0.06 -0.63 120.40 126.37 3gms s VAL 35 Ca 0.03 -0.61 -0.28 0.00 0.00 0.00 0.00 61.98 61.12 3gms s VAL 35 Cb -0.15 -1.32 0.02 0.00 0.00 0.00 0.00 36.38 34.92 3gms s VAL 35 CO -0.07 0.43 1.02 -0.60 0.00 0.00 0.00 175.10 175.88 3gms s ARG 36 N 1.01 3.93 0.41 2.72 3.52 0.13 -0.74 118.95 129.92 3gms s ARG 36 Ca -0.06 0.79 -0.25 0.00 -0.13 0.00 0.00 55.73 56.08 3gms s ARG 36 Cb -0.15 -3.79 -0.08 0.00 -1.56 0.00 0.00 34.95 29.37 3gms s ARG 36 CO -0.02 -0.98 1.17 -1.64 -0.81 0.00 0.00 175.30 173.02 3gms s MET 37 N 3.68 4.02 -0.16 5.12 -1.94 -0.45 -1.00 119.30 128.57 3gms s MET 37 Ca 0.42 1.83 -0.10 0.00 -1.71 0.00 0.00 55.69 56.14 3gms s MET 37 Cb -0.11 -2.64 -0.07 0.00 2.01 0.00 0.00 34.83 34.01 3gms s MET 37 CO 0.19 -0.35 -0.23 1.28 -0.01 0.00 0.00 175.02 175.89 3gms n LEU 38 N 0.00 1.36 -3.74 -0.03 4.77 -0.07 -4.57 117.00 114.72 3gms n LEU 38 Ca 0.05 0.23 -0.12 0.00 -0.03 0.00 0.00 56.01 56.14 3gms n LEU 38 Cb 0.47 -0.55 -0.12 0.00 -2.33 0.00 0.00 43.42 40.88 3gms n LEU 38 CO 0.50 0.21 -0.08 -0.69 -1.33 0.00 0.00 177.39 176.00 3gms s VAL 39 N -2.39 -0.03 0.04 4.08 1.01 -1.07 -0.14 120.40 121.90 3gms s VAL 39 Ca -0.24 0.10 0.05 0.00 0.00 0.00 0.00 61.98 61.88 3gms s VAL 39 Cb 0.08 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 36.03 3gms s VAL 39 CO 0.31 0.04 -0.13 -0.13 0.00 0.00 0.00 175.10 175.19 3gms s ARG 40 N 0.95 0.89 0.62 2.72 3.00 -0.31 -1.37 118.95 125.45 3gms s ARG 40 Ca -0.07 -0.74 -0.12 0.00 0.00 0.00 0.00 55.73 54.80 3gms s ARG 40 Cb -0.08 -0.89 -0.04 0.00 0.00 0.00 0.00 34.95 33.95 3gms s ARG 40 CO -0.06 0.22 1.03 -1.25 0.00 0.00 0.00 175.30 175.23 3gms s PRO 41 N -1.13 3.48 -0.57 3.54 0.04 -1.26 -0.25 135.00 138.84 3gms s PRO 41 Ca 0.01 0.88 -0.16 0.00 0.04 0.00 0.00 61.00 61.76 3gms s PRO 41 Cb -0.08 -2.06 0.13 0.00 0.04 0.00 0.00 34.50 32.53 3gms s PRO 41 CO 0.01 -0.66 0.56 0.42 0.04 0.00 0.00 177.00 177.37 3gms s ILE 42 N -2.98 5.17 0.14 0.56 1.01 -0.28 -4.80 121.20 120.02 3gms s ILE 42 Ca 0.57 -1.49 -0.19 0.00 0.00 0.00 0.00 60.65 59.55 3gms s ILE 42 Cb -0.12 -4.38 -0.07 0.00 0.01 0.00 0.00 42.46 37.90 3gms s ILE 42 CO 0.49 -0.93 0.63 0.20 0.00 0.00 0.00 174.94 175.32 3gms s ASN 43 N 3.50 7.05 0.46 3.58 0.01 -1.26 -4.65 114.94 123.62 3gms s ASN 43 Ca 0.06 1.30 0.28 0.00 -0.71 0.00 0.00 52.86 53.79 3gms s ASN 43 Cb -0.27 -2.37 1.34 0.00 0.41 0.00 0.00 41.25 40.35 3gms s ASN 43 CO 0.03 0.17 1.73 -0.65 -1.51 0.00 0.00 177.10 176.87 3gms h PRO 44 N 4.03 0.18 0.00 -0.60 0.11 -1.97 0.17 132.00 133.92 3gms h PRO 44 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3gms h PRO 44 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3gms h PRO 44 CO 0.65 0.12 0.00 0.66 -0.21 0.00 0.00 178.00 179.22 3gms h SER 45 N 0.19 0.00 0.88 -2.05 4.64 -2.02 -2.10 113.55 113.08 3gms h SER 45 Ca 0.67 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.88 3gms h SER 45 Cb 2.12 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 64.19 3gms h SER 45 CO -0.24 0.00 -0.52 0.44 -0.87 0.00 0.00 176.83 175.64 3gms h ASP 46 N 0.00 0.00 0.90 4.97 3.32 -1.04 -3.32 116.42 121.25 3gms h ASP 46 Ca 0.00 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.82 3gms h ASP 46 Cb 0.51 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.03 3gms h ASP 46 CO 0.00 0.52 -1.12 -0.07 -1.72 0.00 0.00 179.24 176.85 3gms h LEU 47 N 0.00 0.05 -0.59 1.55 3.38 -1.34 -3.37 115.31 114.98 3gms h LEU 47 Ca -0.01 -0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.03 3gms h LEU 47 Cb 1.10 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.75 3gms h LEU 47 CO 0.07 1.04 0.10 0.40 0.09 0.00 0.00 178.44 180.14 3gms h ILE 48 N 0.01 0.62 0.00 1.22 2.04 -1.64 -1.25 117.51 118.51 3gms h ILE 48 Ca -0.06 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 3gms h ILE 48 Cb 1.82 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 3gms h ILE 48 CO 0.13 0.04 -0.13 -0.65 0.00 0.00 0.00 178.15 177.54 3gms h PRO 49 N 0.22 0.00 -0.62 2.37 0.11 -1.77 -2.18 132.00 130.13 3gms h PRO 49 Ca 0.31 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.37 3gms h PRO 49 Cb 0.47 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.55 3gms h PRO 49 CO -0.42 0.13 0.18 0.82 -0.21 0.00 0.00 178.00 178.51 3gms h ILE 50 N 0.00 1.24 0.00 4.15 2.04 -1.43 -2.74 117.51 120.77 3gms h ILE 50 Ca -0.00 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.03 3gms h ILE 50 Cb 0.26 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.91 3gms h ILE 50 CO 0.02 0.32 0.00 0.35 0.00 0.00 0.00 178.15 178.84 3gms n THR 51 N -4.27 1.01 -0.35 -0.27 -2.24 -0.82 -1.82 114.28 105.52 3gms n THR 51 Ca 0.05 0.25 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 3gms n THR 51 Cb 0.22 -1.02 0.00 0.00 -2.10 0.00 0.00 70.33 67.43 3gms n THR 51 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gms n GLY 52 N -0.03 0.77 0.52 3.38 0.00 -1.03 -4.15 105.19 104.65 3gms n GLY 52 Ca 0.03 0.00 0.34 0.00 0.00 0.00 0.00 46.02 46.39 3gms n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gms h ALA 53 N 0.00 3.02 -1.18 4.61 0.00 -1.80 -1.68 119.26 122.24 3gms h ALA 53 Ca 0.00 -0.04 -0.58 0.00 0.00 0.00 0.00 54.91 54.29 3gms h ALA 53 Cb 0.00 0.08 -0.42 0.00 0.00 0.00 0.00 17.79 17.45 3gms h ALA 53 CO 0.00 -1.44 -0.70 0.66 0.00 0.00 0.00 179.25 177.76 3gms n TYR 54 N -4.01 3.13 -0.32 0.00 0.53 -1.26 -4.91 117.16 110.31 3gms n TYR 54 Ca 0.24 -2.73 0.19 0.00 -1.02 0.00 0.00 57.90 54.58 3gms n TYR 54 Cb 1.24 -0.23 0.39 0.00 -1.03 0.00 0.00 39.34 39.71 3gms n TYR 54 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3gms h ALA 55 N 2.41 1.69 0.00 -0.72 0.00 -1.62 -1.78 119.26 119.24 3gms h ALA 55 Ca 0.34 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.43 3gms h ALA 55 Cb 1.16 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 3gms h ALA 55 CO 0.84 -0.48 -0.06 0.45 0.00 0.00 0.00 179.25 180.00 3gms h HIS 56 N 0.33 0.00 0.00 0.00 3.86 -1.91 -3.29 115.15 114.15 3gms h HIS 56 Ca 0.66 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.87 3gms h HIS 56 Cb 1.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.87 3gms h HIS 56 CO -0.09 0.06 -0.59 2.89 0.86 0.00 0.00 177.93 181.06 3gms n ARG 57 N -3.12 2.95 -3.69 2.45 1.85 -0.74 -4.88 116.66 111.48 3gms n ARG 57 Ca 0.04 -0.00 -0.39 0.00 -1.00 0.00 0.00 57.85 56.50 3gms n ARG 57 Cb 0.54 -1.08 -0.12 0.00 -1.05 0.00 0.00 32.46 30.75 3gms n ARG 57 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 3gms s ILE 58 N -2.16 4.11 0.48 8.89 -1.09 -0.78 -5.08 121.20 125.58 3gms s ILE 58 Ca 0.04 -0.97 -0.22 0.00 -2.23 0.00 0.00 60.65 57.27 3gms s ILE 58 Cb 0.09 -3.29 -0.07 0.00 -1.58 0.00 0.00 42.46 37.61 3gms s ILE 58 CO 0.50 -0.17 1.16 -2.84 -1.23 0.00 0.00 174.94 172.36 3gms s PRO 59 N 1.47 3.64 -0.00 2.79 0.02 -1.26 -4.83 135.00 136.83 3gms s PRO 59 Ca 0.00 1.74 0.02 0.00 0.02 0.00 0.00 61.00 62.78 3gms s PRO 59 Cb -0.19 -2.30 -0.03 0.00 0.02 0.00 0.00 34.50 32.00 3gms s PRO 59 CO 0.04 -0.64 -0.03 -0.51 -0.33 0.00 0.00 177.00 175.53 3gms s LEU 60 N -3.24 3.37 0.76 -5.54 1.43 -1.26 -4.00 118.68 110.21 3gms s LEU 60 Ca 0.66 -0.06 -0.12 0.00 -1.03 0.00 0.00 54.13 53.59 3gms s LEU 60 Cb -0.27 -1.92 0.05 0.00 0.03 0.00 0.00 46.19 44.07 3gms s LEU 60 CO 0.33 0.29 1.10 -2.16 0.23 0.00 0.00 176.35 176.14 3gms s PRO 61 N -1.47 2.38 0.03 1.29 0.04 -1.26 -5.09 135.00 130.92 3gms s PRO 61 Ca 0.18 0.51 0.01 0.00 0.04 0.00 0.00 61.00 61.74 3gms s PRO 61 Cb -0.11 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 3gms s PRO 61 CO 0.09 -1.38 -0.05 1.21 0.04 0.00 0.00 177.00 176.90 3gms s ASN 62 N -4.16 0.52 -0.28 6.66 3.84 -0.70 -4.97 114.94 115.85 3gms s ASN 62 Ca 0.60 -0.55 -0.11 0.00 0.21 0.00 0.00 52.86 53.01 3gms s ASN 62 Cb -0.13 0.08 -0.04 0.00 -0.55 0.00 0.00 41.25 40.61 3gms s ASN 62 CO 0.53 -0.28 0.18 -0.63 -2.79 0.00 0.00 177.10 174.11 3gms s ILE 63 N -1.56 5.19 0.96 -5.21 1.01 -1.26 -1.99 121.20 118.33 3gms s ILE 63 Ca -0.12 0.09 -0.14 0.00 0.00 0.00 0.00 60.65 60.48 3gms s ILE 63 Cb -0.09 -3.49 0.17 0.00 0.01 0.00 0.00 42.46 39.06 3gms s ILE 63 CO -0.01 0.23 1.17 -2.84 0.00 0.00 0.00 174.94 173.49 3gms s PRO 64 N 1.74 0.74 0.00 2.79 0.02 -1.26 -4.06 135.00 134.98 3gms s PRO 64 Ca 0.07 0.11 0.00 0.00 0.02 0.00 0.00 61.00 61.20 3gms s PRO 64 Cb -0.16 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.55 3gms s PRO 64 CO 0.10 -2.43 0.00 0.41 -0.33 0.00 0.00 177.00 174.75 3gms n GLY 65 N -2.33 1.93 0.01 0.52 0.00 -1.26 -1.10 105.19 102.95 3gms n GLY 65 Ca 0.09 -1.18 0.10 0.00 0.00 0.00 0.00 46.02 45.03 3gms n GLY 65 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3gms n TYR 66 N 2.18 0.00 -4.14 1.61 4.01 -1.26 -1.40 117.16 118.16 3gms n TYR 66 Ca 0.00 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.60 3gms n TYR 66 Cb 0.00 -0.27 -0.06 0.00 -0.31 0.00 0.00 39.34 38.69 3gms n TYR 66 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 3gms s GLU 67 N -3.15 1.69 0.00 -0.72 -1.05 -1.26 -4.71 118.70 109.50 3gms s GLU 67 Ca -0.02 -1.72 0.00 0.00 -0.15 0.00 0.00 54.97 53.08 3gms s GLU 67 Cb 0.13 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 34.21 3gms s GLU 67 CO 0.81 -0.66 0.00 0.41 0.95 0.00 0.00 175.26 176.76 3gms n GLY 68 N -0.50 1.59 3.23 -3.83 0.00 -1.26 -4.41 105.19 100.02 3gms n GLY 68 Ca 0.02 -1.77 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 3gms n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gms s VAL 69 N -1.47 1.44 0.11 1.61 0.11 -0.47 -4.11 120.40 117.61 3gms s VAL 69 Ca 0.00 -1.37 -0.04 0.00 -2.93 0.00 0.00 61.98 57.64 3gms s VAL 69 Cb 0.00 -1.32 0.02 0.00 -1.53 0.00 0.00 36.38 33.54 3gms s VAL 69 CO 0.00 -0.08 0.21 0.61 -3.33 0.00 0.00 175.10 172.51 3gms n GLY 70 N 1.32 1.82 3.37 6.54 0.00 -0.50 -0.89 105.19 116.85 3gms n GLY 70 Ca -0.20 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.38 3gms n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gms s ILE 71 N -2.73 3.10 0.06 -0.61 -1.09 -0.17 -1.05 121.20 118.70 3gms s ILE 71 Ca 0.05 -0.64 -0.31 0.00 -2.23 0.00 0.00 60.65 57.52 3gms s ILE 71 Cb -0.01 -2.31 -0.07 0.00 -1.58 0.00 0.00 42.46 38.49 3gms s ILE 71 CO 0.04 0.52 1.50 -0.69 -1.23 0.00 0.00 174.94 175.07 3gms s VAL 72 N 0.41 3.32 -0.04 2.92 1.01 -0.54 -0.69 120.40 126.79 3gms s VAL 72 Ca -0.10 0.81 0.10 0.00 0.00 0.00 0.00 61.98 62.79 3gms s VAL 72 Cb -0.16 -3.52 -0.16 0.00 0.00 0.00 0.00 36.38 32.55 3gms s VAL 72 CO 0.05 0.01 0.19 -0.62 0.00 0.00 0.00 175.10 174.73 3gms n GLU 73 N 5.09 0.85 -3.48 2.72 1.02 0.20 -0.07 120.64 126.96 3gms n GLU 73 Ca 0.14 -0.07 -0.12 0.00 -0.02 0.00 0.00 57.16 57.09 3gms n GLU 73 Cb 0.42 -1.26 -0.03 0.00 -0.02 0.00 0.00 31.44 30.55 3gms n GLU 73 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3gms s ASN 74 N -3.50 -0.48 0.05 1.62 3.84 -1.13 -4.89 114.94 110.46 3gms s ASN 74 Ca -0.04 -0.07 0.00 0.00 0.21 0.00 0.00 52.86 52.97 3gms s ASN 74 Cb 0.06 0.56 -0.03 0.00 -0.55 0.00 0.00 41.25 41.29 3gms s ASN 74 CO 0.44 -0.92 -0.05 0.68 -2.79 0.00 0.00 177.10 174.46 3gms s VAL 75 N -3.68 0.37 0.93 -5.21 -7.23 -1.26 -0.92 120.40 103.39 3gms s VAL 75 Ca 0.01 -1.52 -0.14 0.00 -1.81 0.00 0.00 61.98 58.53 3gms s VAL 75 Cb -0.00 -1.13 0.15 0.00 0.56 0.00 0.00 36.38 35.97 3gms s VAL 75 CO -0.12 -0.75 1.19 -0.83 -0.31 0.00 0.00 175.10 174.27 3gms s GLY 76 N -2.40 1.63 0.42 2.32 0.00 0.28 -4.93 107.32 104.64 3gms s GLY 76 Ca 0.00 -0.75 0.19 0.00 0.00 0.00 0.00 44.72 44.16 3gms s GLY 76 CO -0.05 -0.13 1.84 0.00 0.00 0.00 0.00 173.10 174.76 3gms h ALA 77 N -1.53 2.26 -0.16 3.20 0.00 -1.68 -1.79 119.26 119.55 3gms h ALA 77 Ca -0.47 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3gms h ALA 77 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3gms h ALA 77 CO 0.55 -0.57 0.00 1.19 0.00 0.00 0.00 179.25 180.41 3gms n PHE 78 N -4.51 0.20 -4.05 0.00 3.72 0.28 -4.92 117.46 108.18 3gms n PHE 78 Ca 0.21 -0.10 -0.34 0.00 -0.05 0.00 0.00 57.45 57.17 3gms n PHE 78 Cb 0.76 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.24 3gms n PHE 78 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3gms s VAL 79 N -1.80 4.98 0.15 -4.37 1.01 -0.68 -4.98 120.40 114.71 3gms s VAL 79 Ca 0.34 -0.21 -0.31 0.00 0.00 0.00 0.00 61.98 61.80 3gms s VAL 79 Cb 0.20 -3.25 -0.10 0.00 0.00 0.00 0.00 36.38 33.23 3gms s VAL 79 CO 0.30 0.43 1.72 -0.55 0.00 0.00 0.00 175.10 177.00 3gms s SER 80 N -1.53 6.47 0.00 3.32 0.15 -1.26 -4.83 113.70 116.01 3gms s SER 80 Ca 0.21 2.72 0.27 0.00 0.70 0.00 0.00 55.95 59.86 3gms s SER 80 Cb -0.12 -2.58 1.26 0.00 -1.71 0.00 0.00 66.02 62.87 3gms s SER 80 CO 0.12 -0.95 1.91 0.54 1.20 0.00 0.00 173.24 176.06 3gms n ARG 81 N 4.88 0.15 0.32 5.44 1.74 -1.26 -2.62 116.66 125.31 3gms n ARG 81 Ca 0.16 0.03 0.21 0.00 -0.77 0.00 0.00 57.85 57.48 3gms n ARG 81 Cb 0.38 -1.50 1.08 0.00 -1.02 0.00 0.00 32.46 31.39 3gms n ARG 81 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3gms h GLU 82 N 0.00 0.00 0.00 5.56 4.39 -2.05 -2.00 114.58 120.48 3gms h GLU 82 Ca 0.00 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 3gms h GLU 82 Cb 0.39 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 3gms h GLU 82 CO 0.00 0.01 -0.28 1.25 -1.16 0.00 0.00 179.01 178.83 3gms h LEU 83 N 0.00 0.00 -9.72 1.33 5.85 -1.90 -3.44 115.31 107.43 3gms h LEU 83 Ca -0.00 0.00 -0.53 0.00 0.84 0.00 0.00 57.88 58.19 3gms h LEU 83 Cb 0.12 0.00 0.07 0.00 0.37 0.00 0.00 40.66 41.23 3gms h LEU 83 CO 0.00 0.28 0.92 -0.38 -0.34 0.00 0.00 178.44 178.92 3gms n ILE 84 N -3.77 0.57 0.00 4.05 5.41 -0.76 -1.65 119.36 123.22 3gms n ILE 84 Ca -0.01 -0.14 0.00 0.00 1.00 0.00 0.00 62.75 63.59 3gms n ILE 84 Cb 0.38 -1.93 0.00 0.00 -0.71 0.00 0.00 39.64 37.38 3gms n ILE 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3gms n GLY 85 N 2.92 2.28 3.79 7.39 0.00 0.90 -4.98 105.19 117.50 3gms n GLY 85 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3gms n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gms s LYS 86 N -0.76 4.45 -0.05 1.61 -0.14 -0.66 -4.71 119.74 119.49 3gms s LYS 86 Ca 0.00 1.34 -0.25 0.00 -1.36 0.00 0.00 55.97 55.69 3gms s LYS 86 Cb 0.00 -2.66 -0.04 0.00 -1.68 0.00 0.00 37.83 33.45 3gms s LYS 86 CO 0.00 0.15 0.78 1.03 -0.76 0.00 0.00 175.35 176.55 3gms s ARG 87 N -2.30 4.47 0.07 1.68 0.52 -1.26 -1.46 118.95 120.67 3gms s ARG 87 Ca 0.53 1.03 -0.08 0.00 -0.52 0.00 0.00 55.73 56.69 3gms s ARG 87 Cb -0.18 -3.45 -0.00 0.00 0.52 0.00 0.00 34.95 31.84 3gms s ARG 87 CO 0.23 0.04 0.17 0.14 0.02 0.00 0.00 175.30 175.90 3gms s VAL 88 N 0.83 0.14 -0.35 3.52 -7.23 -0.22 -1.35 120.40 115.74 3gms s VAL 88 Ca 0.41 -1.15 -0.17 0.00 -1.81 0.00 0.00 61.98 59.27 3gms s VAL 88 Cb -0.19 -1.21 -0.00 0.00 0.56 0.00 0.00 36.38 35.54 3gms s VAL 88 CO 0.21 -0.63 0.46 -0.76 -0.31 0.00 0.00 175.10 174.06 3gms s LEU 89 N -2.61 4.42 -1.09 1.32 1.43 0.42 -1.41 118.68 121.16 3gms s LEU 89 Ca 0.02 -0.15 -0.16 0.00 -1.03 0.00 0.00 54.13 52.81 3gms s LEU 89 Cb 0.03 -2.49 0.15 0.00 0.03 0.00 0.00 46.19 43.92 3gms s LEU 89 CO -0.09 -0.44 1.31 -2.16 0.23 0.00 0.00 176.35 175.20 3gms s PRO 90 N 2.25 3.89 0.32 1.29 0.04 -1.26 -1.62 135.00 139.92 3gms s PRO 90 Ca 0.16 -2.25 0.05 0.00 0.04 0.00 0.00 61.00 59.00 3gms s PRO 90 Cb -0.16 -5.00 -0.02 0.00 0.04 0.00 0.00 34.50 29.36 3gms s PRO 90 CO 0.13 -1.77 0.46 -0.51 0.04 0.00 0.00 177.00 175.35 3gms s LEU 91 N 2.03 4.04 -1.55 -3.56 1.43 -1.19 -4.50 118.68 115.38 3gms s LEU 91 Ca 0.39 -0.04 -0.05 0.00 -1.03 0.00 0.00 54.13 53.40 3gms s LEU 91 Cb -0.04 -2.85 0.01 0.00 0.03 0.00 0.00 46.19 43.34 3gms s LEU 91 CO -0.04 -0.35 0.54 0.54 0.23 0.00 0.00 176.35 177.27 3gms n ARG 92 N -1.63 -4.45 0.00 1.70 1.74 -1.26 -4.70 116.66 108.07 3gms n ARG 92 Ca -0.03 0.87 0.00 0.00 -0.77 0.00 0.00 57.85 57.93 3gms n ARG 92 Cb 0.58 -5.71 0.00 0.00 -1.02 0.00 0.00 32.46 26.31 3gms n ARG 92 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gms n GLY 93 N -1.44 3.94 3.78 -0.13 0.00 -1.26 -4.72 105.19 105.36 3gms n GLY 93 Ca -0.12 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 3gms n GLY 93 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gms s GLU 94 N 3.92 2.19 0.41 1.61 2.02 -0.65 -4.99 118.70 123.21 3gms s GLU 94 Ca 0.00 0.94 -0.26 0.00 0.02 0.00 0.00 54.97 55.68 3gms s GLU 94 Cb 0.00 -1.91 -0.10 0.00 0.10 0.00 0.00 34.13 32.22 3gms s GLU 94 CO 0.00 -1.63 1.22 0.41 0.02 0.00 0.00 175.26 175.28 3gms n GLY 95 N -1.55 0.39 0.01 -1.39 0.00 -1.26 -4.88 105.19 96.51 3gms n GLY 95 Ca 0.08 0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.42 3gms n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3gms n THR 96 N -0.19 0.07 -1.68 2.61 -2.24 -0.50 -4.41 114.28 107.96 3gms n THR 96 Ca 0.07 -0.07 -0.40 0.00 -2.27 0.00 0.00 64.05 61.37 3gms n THR 96 Cb 0.39 0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.89 3gms n THR 96 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 3gms n TRP 97 N -1.65 2.82 -3.93 4.78 7.02 -0.26 -4.79 117.44 121.43 3gms n TRP 97 Ca 0.04 -2.98 -0.08 0.00 -1.02 0.00 0.00 57.50 53.46 3gms n TRP 97 Cb 0.36 -2.33 -0.04 0.00 -2.42 0.00 0.00 31.31 26.89 3gms n TRP 97 CO 0.00 0.00 0.00 1.14 -2.02 0.00 0.00 177.69 176.81 3gms s GLN 98 N 1.64 1.62 0.08 -0.99 -2.07 -1.26 -1.62 119.66 117.06 3gms s GLN 98 Ca 0.57 -1.13 -0.16 0.00 -1.82 0.00 0.00 55.36 52.82 3gms s GLN 98 Cb 0.16 0.52 -0.09 0.00 -1.09 0.00 0.00 33.01 32.51 3gms s GLN 98 CO -0.07 -0.70 1.42 1.49 -1.32 0.00 0.00 175.29 176.11 3gms h GLU 99 N 2.16 0.59 -5.25 9.60 4.81 -1.21 -3.42 114.58 121.86 3gms h GLU 99 Ca -0.24 -0.29 -0.55 0.00 -0.13 0.00 0.00 59.36 58.15 3gms h GLU 99 Cb 1.25 0.00 -0.31 0.00 0.63 0.00 0.00 28.75 30.32 3gms h GLU 99 CO 0.31 0.88 -0.83 0.71 -0.73 0.00 0.00 179.01 179.35 3gms s TYR 100 N -4.43 1.65 -0.06 0.92 2.02 -1.26 -1.34 117.35 114.85 3gms s TYR 100 Ca -0.13 -0.46 0.04 0.00 -0.37 0.00 0.00 57.07 56.14 3gms s TYR 100 Cb 0.08 -1.11 0.00 0.00 -0.40 0.00 0.00 41.96 40.53 3gms s TYR 100 CO 0.80 -0.16 -0.17 0.08 -1.57 0.00 0.00 175.55 174.53 3gms s VAL 101 N 0.04 1.50 0.04 0.71 1.01 0.08 -4.93 120.40 118.86 3gms s VAL 101 Ca -0.03 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.26 3gms s VAL 101 Cb -0.11 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 3gms s VAL 101 CO 0.02 0.43 -0.02 -0.54 0.00 0.00 0.00 175.10 175.00 3gms s LYS 102 N 0.27 2.61 0.25 2.72 1.02 -1.26 -0.76 119.74 124.59 3gms s LYS 102 Ca -0.10 -0.75 -0.16 0.00 0.02 0.00 0.00 55.97 54.98 3gms s LYS 102 Cb -0.14 -2.57 0.01 0.00 -0.52 0.00 0.00 37.83 34.61 3gms s LYS 102 CO 0.04 0.58 0.56 -0.08 -0.92 0.00 0.00 175.35 175.53 3gms s THR 103 N -1.17 0.01 0.36 2.17 -1.32 -1.05 -1.63 115.64 113.01 3gms s THR 103 Ca 0.22 -1.17 -0.28 0.00 -1.21 0.00 0.00 61.69 59.24 3gms s THR 103 Cb -0.11 -2.03 -0.10 0.00 -1.51 0.00 0.00 72.50 68.75 3gms s THR 103 CO 0.13 -0.03 1.38 -0.55 -2.21 0.00 0.00 174.62 173.35 3gms s SER 104 N -2.96 6.52 0.44 8.08 0.15 -1.26 -0.89 113.70 123.78 3gms s SER 104 Ca 0.17 2.83 0.26 0.00 0.70 0.00 0.00 55.95 59.90 3gms s SER 104 Cb -0.02 -2.66 1.29 0.00 -1.71 0.00 0.00 66.02 62.92 3gms s SER 104 CO 0.06 -0.72 1.73 0.00 1.20 0.00 0.00 173.24 175.51 3gms h ALA 105 N 3.11 2.58 -0.59 5.45 0.00 -1.07 -1.42 119.26 127.32 3gms h ALA 105 Ca -0.50 0.05 0.17 0.00 0.00 0.00 0.00 54.91 54.63 3gms h ALA 105 Cb 1.23 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 3gms h ALA 105 CO 0.64 -1.03 0.46 -0.44 0.00 0.00 0.00 179.25 178.88 3gms h ASP 106 N 0.23 0.00 -0.14 0.00 5.19 -1.91 -2.87 116.42 116.92 3gms h ASP 106 Ca 0.66 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.07 3gms h ASP 106 Cb 1.99 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.50 3gms h ASP 106 CO -0.26 0.00 0.00 0.49 -3.12 0.00 0.00 179.24 176.35 3gms n PHE 107 N -4.20 0.21 -2.56 4.55 3.72 -0.54 -4.90 117.46 113.75 3gms n PHE 107 Ca 0.11 -0.56 -0.43 0.00 -0.05 0.00 0.00 57.45 56.53 3gms n PHE 107 Cb 0.69 -0.06 -0.02 0.00 -0.94 0.00 0.00 39.48 39.15 3gms n PHE 107 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3gms s VAL 108 N -1.23 4.51 -0.37 -4.37 1.01 -1.09 -3.16 120.40 115.70 3gms s VAL 108 Ca 0.13 1.83 -0.13 0.00 0.00 0.00 0.00 61.98 63.80 3gms s VAL 108 Cb 0.08 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.28 3gms s VAL 108 CO 0.06 -0.15 0.25 -0.69 0.00 0.00 0.00 175.10 174.57 3gms s VAL 109 N 3.26 5.17 0.32 2.92 1.01 -0.64 -4.92 120.40 127.51 3gms s VAL 109 Ca 0.49 -0.45 -0.29 0.00 0.00 0.00 0.00 61.98 61.73 3gms s VAL 109 Cb -0.18 -3.76 -0.10 0.00 0.00 0.00 0.00 36.38 32.34 3gms s VAL 109 CO 0.10 -0.14 1.39 -2.84 0.00 0.00 0.00 175.10 173.62 3gms s PRO 110 N 1.69 4.27 -0.13 2.72 0.02 -1.26 -0.43 135.00 141.87 3gms s PRO 110 Ca 0.05 2.33 0.01 0.00 0.02 0.00 0.00 61.00 63.41 3gms s PRO 110 Cb -0.18 -3.06 -0.01 0.00 0.02 0.00 0.00 34.50 31.27 3gms s PRO 110 CO 0.10 -0.34 -0.15 0.42 -0.33 0.00 0.00 177.00 176.70 3gms s ILE 111 N -0.79 2.83 0.63 2.83 -1.09 -0.46 -4.88 121.20 120.26 3gms s ILE 111 Ca 0.53 -0.74 -0.13 0.00 -2.23 0.00 0.00 60.65 58.08 3gms s ILE 111 Cb -0.42 -2.18 -0.02 0.00 -1.58 0.00 0.00 42.46 38.26 3gms s ILE 111 CO 0.52 0.53 1.05 -2.16 -1.23 0.00 0.00 174.94 173.65 3gms s PRO 112 N 0.43 3.26 0.57 2.79 0.04 -1.26 -4.65 135.00 136.19 3gms s PRO 112 Ca -0.11 1.03 0.25 0.00 0.04 0.00 0.00 61.00 62.21 3gms s PRO 112 Cb -0.16 -2.03 1.59 0.00 0.04 0.00 0.00 34.50 33.94 3gms s PRO 112 CO 0.05 -0.84 2.16 -0.44 0.04 0.00 0.00 177.00 177.97 3gms h ASP 113 N -0.04 0.00 0.22 6.66 3.32 -2.00 -2.22 116.42 122.36 3gms h ASP 113 Ca -0.45 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.60 3gms h ASP 113 Cb 1.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.76 3gms h ASP 113 CO 0.58 0.00 -0.00 0.77 -1.72 0.00 0.00 179.24 178.87 3gms h SER 114 N 0.00 0.00 -3.58 6.45 4.64 -2.04 -3.42 113.55 115.60 3gms h SER 114 Ca 0.05 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.72 3gms h SER 114 Cb 0.23 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 62.11 3gms h SER 114 CO -0.00 0.00 -0.61 -0.63 -0.87 0.00 0.00 176.83 174.72 3gms s ILE 115 N -4.06 4.41 0.79 0.95 1.01 -0.84 -5.05 121.20 118.41 3gms s ILE 115 Ca -0.04 -0.14 -0.11 0.00 0.00 0.00 0.00 60.65 60.36 3gms s ILE 115 Cb 0.12 -3.05 0.07 0.00 0.01 0.00 0.00 42.46 39.61 3gms s ILE 115 CO 0.44 0.36 1.09 1.51 0.00 0.00 0.00 174.94 178.34 3gms s ASP 116 N 1.35 4.40 0.32 3.58 1.47 -1.26 -4.79 116.67 121.74 3gms s ASP 116 Ca 0.05 1.71 0.02 0.00 1.18 0.00 0.00 52.55 55.51 3gms s ASP 116 Cb -0.15 -2.43 0.59 0.00 -0.34 0.00 0.00 42.92 40.60 3gms s ASP 116 CO 0.04 -2.08 1.93 0.44 0.68 0.00 0.00 175.17 176.17 3gms h ASP 117 N -1.16 0.84 0.56 2.11 3.32 -1.98 -0.67 116.42 119.44 3gms h ASP 117 Ca -0.45 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.41 3gms h ASP 117 Cb 1.24 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 3gms h ASP 117 CO 0.53 0.54 -0.86 -0.26 -1.72 0.00 0.00 179.24 177.47 3gms h PHE 118 N 0.95 0.30 -0.03 4.55 0.04 -1.97 0.61 116.94 121.39 3gms h PHE 118 Ca 0.36 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 60.97 3gms h PHE 118 Cb 0.21 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.32 3gms h PHE 118 CO -0.00 0.96 -0.01 1.15 -0.60 0.00 0.00 178.31 179.82 3gms h THR 119 N 0.11 1.29 -0.82 -1.55 2.02 -1.90 -3.14 112.91 108.93 3gms h THR 119 Ca -0.04 -0.89 0.07 0.00 0.77 0.00 0.00 66.41 66.31 3gms h THR 119 Cb 1.48 1.83 -0.05 0.00 -1.74 0.00 0.00 68.15 69.67 3gms h THR 119 CO 0.13 0.24 0.54 0.00 0.37 0.00 0.00 175.52 176.80 3gms h ALA 120 N 0.65 1.61 0.00 6.16 0.00 -0.98 -1.60 119.26 125.10 3gms h ALA 120 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3gms h ALA 120 Cb 0.39 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3gms h ALA 120 CO 0.00 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.52 3gms n ALA 121 N -2.42 1.51 -0.15 0.00 0.00 0.19 -1.91 120.51 117.73 3gms n ALA 121 Ca 0.12 -0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.56 3gms n ALA 121 Cb 0.22 -1.16 0.10 0.00 0.00 0.00 0.00 19.45 18.61 3gms n ALA 121 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3gms n GLN 122 N -1.43 2.90 0.23 0.00 6.02 -0.61 -4.05 117.38 120.45 3gms n GLN 122 Ca 0.03 -1.89 0.13 0.00 -0.01 0.00 0.00 57.00 55.25 3gms n GLN 122 Cb 0.10 -1.20 0.37 0.00 1.02 0.00 0.00 30.24 30.54 3gms n GLN 122 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 177.06 178.03 3gms h MET 123 N 1.32 0.00 0.00 -1.09 4.05 -1.39 -3.40 114.93 114.42 3gms h MET 123 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3gms h MET 123 Cb 0.68 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.48 3gms h MET 123 CO 0.01 0.08 0.00 0.98 0.23 0.00 0.00 176.91 178.21 3gms n TYR 124 N -3.15 0.00 0.30 1.39 9.36 -1.26 -4.10 117.16 119.70 3gms n TYR 124 Ca 0.02 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.09 3gms n TYR 124 Cb 0.46 -0.08 -0.08 0.00 -0.63 0.00 0.00 39.34 39.01 3gms n TYR 124 CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 3gms h ILE 125 N 0.00 0.37 -0.20 2.97 1.08 -1.94 -0.95 117.51 118.83 3gms h ILE 125 Ca 0.00 -0.28 -0.07 0.00 -0.39 0.00 0.00 64.86 64.12 3gms h ILE 125 Cb 0.00 0.46 -0.00 0.00 -3.07 0.00 0.00 36.82 34.21 3gms h ILE 125 CO 0.00 0.04 -0.16 0.78 -0.69 0.00 0.00 178.15 178.12 3gms h ASN 126 N -0.95 0.49 -0.20 1.72 2.35 -1.88 -2.61 115.58 114.51 3gms h ASN 126 Ca -0.08 -0.45 -0.05 0.00 -0.55 0.00 0.00 56.30 55.17 3gms h ASN 126 Cb 0.64 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 3gms h ASN 126 CO 0.13 0.84 -0.07 -0.65 -1.65 0.00 0.00 177.43 176.02 3gms h PRO 127 N 0.14 0.40 -0.79 0.81 0.11 -1.75 -0.38 132.00 130.55 3gms h PRO 127 Ca 0.04 -0.16 -0.00 0.00 0.11 0.00 0.00 66.00 65.98 3gms h PRO 127 Cb 0.68 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.74 3gms h PRO 127 CO 0.04 0.67 0.48 1.25 -0.21 0.00 0.00 178.00 180.23 3gms h LEU 128 N 0.10 0.95 -0.21 2.35 5.85 -1.28 0.70 115.31 123.78 3gms h LEU 128 Ca 0.05 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 3gms h LEU 128 Cb 0.54 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3gms h LEU 128 CO 0.02 0.74 0.13 0.74 -0.34 0.00 0.00 178.44 179.73 3gms h THR 129 N 1.09 1.08 -0.35 1.05 2.02 -1.41 -0.56 112.91 115.82 3gms h THR 129 Ca 0.28 -0.17 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 3gms h THR 129 Cb -0.04 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 3gms h THR 129 CO -0.05 0.07 0.11 0.00 0.37 0.00 0.00 175.52 176.02 3gms h ALA 130 N 1.04 0.46 -0.02 6.16 0.00 -0.84 -1.56 119.26 124.51 3gms h ALA 130 Ca 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3gms h ALA 130 Cb 0.01 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3gms h ALA 130 CO -0.01 0.10 0.01 2.35 0.00 0.00 0.00 179.25 181.69 3gms h TRP 131 N 0.42 0.03 -0.01 0.00 2.91 -0.76 -2.18 115.95 116.36 3gms h TRP 131 Ca 0.11 -0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.13 3gms h TRP 131 Cb 0.25 -0.01 -0.00 0.00 -0.51 0.00 0.00 29.16 28.89 3gms h TRP 131 CO 0.01 0.22 0.00 0.28 -1.03 0.00 0.00 178.44 177.92 3gms h VAL 132 N -0.17 1.09 -0.65 2.65 2.07 -1.12 -0.16 116.25 119.96 3gms h VAL 132 Ca 0.01 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 67.29 3gms h VAL 132 Cb 0.20 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 3gms h VAL 132 CO -0.00 0.07 0.40 0.71 0.02 0.00 0.00 177.57 178.77 3gms h THR 133 N -0.10 1.07 -0.38 2.57 1.35 -1.31 0.21 112.91 116.32 3gms h THR 133 Ca 0.00 -0.27 -0.05 0.00 -0.55 0.00 0.00 66.41 65.55 3gms h THR 133 Cb 0.11 0.23 -0.01 0.00 -1.73 0.00 0.00 68.15 66.75 3gms h THR 133 CO -0.00 0.14 0.04 0.00 -0.25 0.00 0.00 175.52 175.45 3gms n THR 135 N -4.51 0.13 0.04 0.00 -2.24 -0.08 -1.18 114.28 106.43 3gms n THR 135 Ca -0.01 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 3gms n THR 135 Cb 0.25 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 3gms n THR 135 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gms n GLU 136 N -2.34 0.00 -0.07 -0.78 1.02 0.67 -4.18 120.64 114.95 3gms n GLU 136 Ca -0.03 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.97 3gms n GLU 136 Cb 0.57 -0.49 -0.06 0.00 -0.02 0.00 0.00 31.44 31.44 3gms n GLU 136 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3gms h THR 137 N 0.00 1.33 0.00 2.62 2.02 -1.34 -3.17 112.91 114.38 3gms h THR 137 Ca 0.00 -1.51 -0.09 0.00 0.77 0.00 0.00 66.41 65.58 3gms h THR 137 Cb 0.26 1.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.48 3gms h THR 137 CO 0.00 0.46 -1.70 0.18 0.37 0.00 0.00 175.52 174.84 3gms n LEU 138 N -4.34 0.39 -3.99 2.58 4.77 0.52 -5.01 117.00 111.91 3gms n LEU 138 Ca -0.06 0.16 -0.41 0.00 -0.03 0.00 0.00 56.01 55.67 3gms n LEU 138 Cb 0.47 0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.66 3gms n LEU 138 CO 0.44 0.07 -0.17 -3.20 -1.33 0.00 0.00 177.39 173.19 3gms n ASN 139 N -2.57 -4.38 -4.77 -1.43 5.15 -1.12 -4.84 115.26 101.30 3gms n ASN 139 Ca -0.09 -1.21 -0.40 0.00 -0.60 0.00 0.00 54.58 52.28 3gms n ASN 139 Cb 0.72 -1.78 -0.01 0.00 -0.53 0.00 0.00 39.78 38.17 3gms n ASN 139 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3gms s LEU 140 N -6.89 4.32 0.25 1.20 1.43 -0.32 -4.99 118.68 113.67 3gms s LEU 140 Ca 0.39 2.73 0.06 0.00 -1.03 0.00 0.00 54.13 56.29 3gms s LEU 140 Cb -0.21 -3.76 -0.03 0.00 0.03 0.00 0.00 46.19 42.21 3gms s LEU 140 CO 0.95 -0.73 0.25 -1.10 0.23 0.00 0.00 176.35 175.95 3gms s GLN 141 N -2.04 3.09 -0.01 1.70 -1.52 -1.26 -4.97 119.66 114.66 3gms s GLN 141 Ca 0.53 -0.96 -0.38 0.00 -1.95 0.00 0.00 55.36 52.60 3gms s GLN 141 Cb -0.40 -2.67 -0.17 0.00 -0.22 0.00 0.00 33.01 29.55 3gms s GLN 141 CO 0.53 0.41 1.37 -2.13 -0.25 0.00 0.00 175.29 175.22 3gms n ARG 142 N -1.26 0.91 -0.90 2.91 0.63 -1.26 -1.36 116.66 116.33 3gms n ARG 142 Ca -0.08 0.33 0.00 0.00 -0.92 0.00 0.00 57.85 57.18 3gms n ARG 142 Cb 0.58 -1.95 0.00 0.00 0.45 0.00 0.00 32.46 31.54 3gms n ARG 142 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3gms n ASN 143 N 2.86 -1.59 -4.71 6.15 3.02 0.08 -4.98 115.26 116.08 3gms n ASN 143 Ca 0.20 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.40 3gms n ASN 143 Cb 0.15 -1.07 0.10 0.00 -0.61 0.00 0.00 39.78 38.35 3gms n ASN 143 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3gms s ASP 144 N -2.41 4.12 -0.33 6.41 1.01 -0.46 -4.54 116.67 120.47 3gms s ASP 144 Ca 0.00 2.50 -0.10 0.00 0.71 0.00 0.00 52.55 55.66 3gms s ASP 144 Cb 0.00 -2.60 -0.00 0.00 1.01 0.00 0.00 42.92 41.32 3gms s ASP 144 CO 0.00 -2.32 0.17 -0.69 0.21 0.00 0.00 175.17 172.54 3gms s VAL 145 N -1.75 4.67 -0.16 -1.27 1.01 -1.26 -0.20 120.40 121.45 3gms s VAL 145 Ca 0.78 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 62.23 3gms s VAL 145 Cb -0.33 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 3gms s VAL 145 CO 0.45 0.00 0.00 -0.22 0.00 0.00 0.00 175.10 175.33 3gms s LEU 146 N 1.61 3.47 -0.14 3.92 2.96 0.05 -0.91 118.68 129.65 3gms s LEU 146 Ca 0.04 -0.04 -0.09 0.00 -0.22 0.00 0.00 54.13 53.82 3gms s LEU 146 Cb -0.17 -1.85 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 3gms s LEU 146 CO 0.07 0.18 0.17 -0.76 -1.32 0.00 0.00 176.35 174.69 3gms s LEU 147 N 0.29 4.32 -0.11 -0.68 1.43 0.04 -0.47 118.68 123.50 3gms s LEU 147 Ca -0.01 0.42 -0.02 0.00 -1.03 0.00 0.00 54.13 53.50 3gms s LEU 147 Cb -0.13 -2.15 0.04 0.00 0.03 0.00 0.00 46.19 43.98 3gms s LEU 147 CO 0.02 0.29 0.01 -0.69 0.23 0.00 0.00 176.35 176.20 3gms s VAL 148 N -0.37 0.45 0.76 -1.59 1.01 -1.01 0.03 120.40 119.68 3gms s VAL 148 Ca 0.13 -0.08 -0.03 0.00 0.00 0.00 0.00 61.98 62.00 3gms s VAL 148 Cb -0.12 -0.70 0.14 0.00 0.00 0.00 0.00 36.38 35.70 3gms s VAL 148 CO 0.02 0.14 1.04 0.54 0.00 0.00 0.00 175.10 176.85 3gms s ASN 149 N 1.93 4.16 -1.73 3.32 2.20 -1.02 -0.78 114.94 123.02 3gms s ASN 149 Ca 0.03 -0.26 -0.16 0.00 -0.94 0.00 0.00 52.86 51.53 3gms s ASN 149 Cb -0.14 -0.07 0.15 0.00 -2.00 0.00 0.00 41.25 39.20 3gms s ASN 149 CO -0.06 -2.00 0.57 0.00 -2.94 0.00 0.00 177.10 172.67 3gms n ALA 150 N -2.98 -1.42 1.06 3.54 0.00 -0.96 -4.58 120.51 115.17 3gms n ALA 150 Ca 0.15 -0.17 0.13 0.00 0.00 0.00 0.00 53.44 53.55 3gms n ALA 150 Cb 0.60 -2.54 0.62 0.00 0.00 0.00 0.00 19.45 18.14 3gms n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gms n GLY 152 N 1.25 -1.03 3.57 0.00 0.00 -1.26 -3.74 105.19 103.98 3gms n GLY 152 Ca 0.09 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 3gms n GLY 152 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gms s SER 153 N -2.61 1.64 0.18 1.61 1.04 -0.89 -4.84 113.70 109.84 3gms s SER 153 Ca 0.20 1.32 -0.14 0.00 0.48 0.00 0.00 55.95 57.82 3gms s SER 153 Cb 0.15 -2.06 0.15 0.00 0.10 0.00 0.00 66.02 64.35 3gms s SER 153 CO 0.34 -3.76 1.74 0.00 0.98 0.00 0.00 173.24 172.54 3gms h ALA 154 N -2.32 0.55 -0.27 5.32 0.00 -1.90 -2.26 119.26 118.38 3gms h ALA 154 Ca -0.59 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.29 3gms h ALA 154 Cb 1.34 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 3gms h ALA 154 CO 0.54 -0.25 -0.24 0.97 0.00 0.00 0.00 179.25 180.28 3gms h ILE 155 N 0.31 1.26 -0.66 0.00 2.10 -1.91 -2.70 117.51 115.91 3gms h ILE 155 Ca 0.22 -1.26 0.09 0.00 1.08 0.00 0.00 64.86 64.99 3gms h ILE 155 Cb 0.24 1.32 -0.07 0.00 -1.09 0.00 0.00 36.82 37.23 3gms h ILE 155 CO -0.24 0.40 0.31 1.23 -1.08 0.00 0.00 178.15 178.77 3gms h GLY 156 N 1.01 0.97 2.00 8.18 0.00 -1.58 -0.27 103.07 113.38 3gms h GLY 156 Ca 0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 3gms h GLY 156 CO 0.05 0.04 -0.21 0.45 0.00 0.00 0.00 176.54 176.87 3gms h HIS 157 N 0.54 0.00 -0.08 5.60 3.86 -1.12 -2.40 115.15 121.55 3gms h HIS 157 Ca 0.33 0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 59.31 3gms h HIS 157 Cb 0.35 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.83 3gms h HIS 157 CO -0.12 0.21 -0.81 -0.07 0.86 0.00 0.00 177.93 178.00 3gms h LEU 158 N 0.00 0.85 -1.20 2.43 3.38 -0.88 -2.97 115.31 116.92 3gms h LEU 158 Ca -0.00 -0.68 0.05 0.00 0.09 0.00 0.00 57.88 57.34 3gms h LEU 158 Cb 0.38 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 3gms h LEU 158 CO 0.03 1.41 0.56 -0.26 0.09 0.00 0.00 178.44 180.26 3gms h PHE 159 N 0.36 0.99 -0.39 1.13 0.04 -0.84 0.15 116.94 118.38 3gms h PHE 159 Ca -0.08 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.72 3gms h PHE 159 Cb 1.46 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 39.27 3gms h PHE 159 CO 0.10 0.54 0.26 0.00 -0.60 0.00 0.00 178.31 178.61 3gms h ALA 160 N 1.53 0.49 -0.33 2.45 0.00 -1.42 -0.55 119.26 121.43 3gms h ALA 160 Ca 0.36 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 3gms h ALA 160 Cb 0.15 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3gms h ALA 160 CO -0.12 -0.05 -0.11 1.96 0.00 0.00 0.00 179.25 180.93 3gms h GLN 161 N 0.52 0.65 -0.20 0.00 4.20 -1.23 -2.93 115.11 116.13 3gms h GLN 161 Ca 0.14 -0.26 0.06 0.00 0.06 0.00 0.00 58.65 58.65 3gms h GLN 161 Cb -0.06 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 3gms h GLN 161 CO -0.03 0.84 0.14 -0.07 -0.67 0.00 0.00 178.83 179.04 3gms h LEU 162 N 0.42 0.01 -1.43 1.46 3.38 -0.46 -1.60 115.31 117.08 3gms h LEU 162 Ca 0.08 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.06 3gms h LEU 162 Cb 0.61 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 3gms h LEU 162 CO 0.04 0.00 0.39 0.77 0.09 0.00 0.00 178.44 179.73 3gms h SER 163 N 0.01 0.66 -0.03 -0.43 4.64 -0.90 0.32 113.55 117.81 3gms h SER 163 Ca 0.09 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.28 3gms h SER 163 Cb 0.36 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 62.30 3gms h SER 163 CO -0.00 0.47 -0.44 1.56 -0.87 0.00 0.00 176.83 177.55 3gms h GLN 164 N 0.77 0.35 -0.67 4.77 1.08 -1.39 -0.07 115.11 119.96 3gms h GLN 164 Ca 0.22 -0.34 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 3gms h GLN 164 Cb -0.05 0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 3gms h GLN 164 CO -0.05 1.01 0.37 0.82 -0.95 0.00 0.00 178.83 180.02 3gms h ILE 165 N -0.18 1.21 -0.31 2.54 2.04 -0.99 -3.17 117.51 118.64 3gms h ILE 165 Ca -0.05 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.29 3gms h ILE 165 Cb 1.14 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3gms h ILE 165 CO 0.09 0.23 0.00 0.18 0.00 0.00 0.00 178.15 178.65 3gms n LEU 166 N -4.52 3.18 -3.46 1.44 4.77 0.11 -5.00 117.00 113.52 3gms n LEU 166 Ca 0.05 -1.46 -0.19 0.00 -0.03 0.00 0.00 56.01 54.38 3gms n LEU 166 Cb 0.09 -0.20 0.06 0.00 -2.33 0.00 0.00 43.42 41.05 3gms n LEU 166 CO 0.37 0.68 0.02 0.59 -1.33 0.00 0.00 177.39 177.72 3gms n ASN 167 N 1.27 -3.72 -4.42 -1.43 3.02 -0.16 -4.59 115.26 105.24 3gms n ASN 167 Ca 0.16 -0.74 -0.21 0.00 -0.03 0.00 0.00 54.58 53.76 3gms n ASN 167 Cb 0.55 -4.71 -0.10 0.00 -0.61 0.00 0.00 39.78 34.91 3gms n ASN 167 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3gms s PHE 168 N -3.46 1.92 -0.29 3.10 -0.12 -0.50 -0.74 117.98 117.90 3gms s PHE 168 Ca 0.21 -1.00 -0.09 0.00 -0.05 0.00 0.00 56.93 56.00 3gms s PHE 168 Cb -0.04 -1.24 -0.02 0.00 -0.63 0.00 0.00 43.02 41.09 3gms s PHE 168 CO 0.77 -0.04 0.13 0.50 -0.05 0.00 0.00 175.22 176.52 3gms s ARG 169 N -3.89 3.50 -0.23 1.99 3.52 0.72 -4.55 118.95 120.02 3gms s ARG 169 Ca 0.36 -0.60 -0.13 0.00 -0.13 0.00 0.00 55.73 55.23 3gms s ARG 169 Cb 0.08 -3.49 -0.04 0.00 -1.56 0.00 0.00 34.95 29.94 3gms s ARG 169 CO 0.15 -0.32 0.27 -1.17 -0.81 0.00 0.00 175.30 173.43 3gms s LEU 170 N 1.63 4.12 -0.47 -0.88 2.96 -1.26 -0.77 118.68 124.01 3gms s LEU 170 Ca 0.05 0.28 -0.14 0.00 -0.22 0.00 0.00 54.13 54.10 3gms s LEU 170 Cb -0.16 -2.29 0.08 0.00 0.50 0.00 0.00 46.19 44.31 3gms s LEU 170 CO 0.06 -0.02 0.38 -0.63 -1.32 0.00 0.00 176.35 174.82 3gms s ILE 171 N 1.26 5.03 0.08 6.68 1.01 0.38 -1.18 121.20 134.46 3gms s ILE 171 Ca 0.13 -1.19 -0.30 0.00 0.00 0.00 0.00 60.65 59.29 3gms s ILE 171 Cb -0.14 -4.05 -0.06 0.00 0.01 0.00 0.00 42.46 38.23 3gms s ILE 171 CO 0.07 -0.60 1.13 0.00 0.00 0.00 0.00 174.94 175.54 3gms s ALA 172 N 1.59 3.34 -0.20 9.38 0.00 -0.26 -2.41 121.76 133.20 3gms s ALA 172 Ca 0.04 0.78 -0.02 0.00 0.00 0.00 0.00 51.96 52.75 3gms s ALA 172 Cb -0.25 -3.40 -0.00 0.00 0.00 0.00 0.00 23.12 19.47 3gms s ALA 172 CO 0.05 -0.34 -0.09 0.08 0.00 0.00 0.00 175.76 175.46 3gms s VAL 173 N 0.74 3.02 0.17 0.00 1.01 0.04 0.92 120.40 126.30 3gms s VAL 173 Ca 0.55 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.98 3gms s VAL 173 Cb -0.28 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 3gms s VAL 173 CO 0.30 0.46 -0.14 0.42 0.00 0.00 0.00 175.10 176.15 3gms s THR 174 N 1.29 1.53 -0.61 3.92 -4.23 0.25 -1.95 115.64 115.85 3gms s THR 174 Ca 0.03 -2.05 0.25 0.00 -1.18 0.00 0.00 61.69 58.75 3gms s THR 174 Cb -0.14 -1.87 0.30 0.00 1.34 0.00 0.00 72.50 72.13 3gms s THR 174 CO -0.04 -0.56 1.70 0.03 -0.54 0.00 0.00 174.62 175.20 3gms h ARG 175 N 2.88 0.00 0.00 3.99 -0.00 -1.96 -0.45 114.38 118.84 3gms h ARG 175 Ca -0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.10 3gms h ARG 175 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.18 3gms h ARG 175 CO 0.59 0.00 0.08 0.27 0.00 0.00 0.00 179.97 180.90 3gms n ASN 176 N -2.61 -0.46 -1.30 7.04 0.23 -1.26 -3.81 115.26 113.10 3gms n ASN 176 Ca 0.05 -1.30 0.12 0.00 -0.53 0.00 0.00 54.58 52.92 3gms n ASN 176 Cb 0.47 0.75 0.30 0.00 -2.08 0.00 0.00 39.78 39.23 3gms n ASN 176 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3gms n ASN 177 N -1.01 3.85 0.16 0.53 6.94 -1.26 -4.59 115.26 119.88 3gms n ASN 177 Ca -0.02 -2.00 0.07 0.00 -0.02 0.00 0.00 54.58 52.62 3gms n ASN 177 Cb 0.12 -0.45 0.57 0.00 -2.36 0.00 0.00 39.78 37.66 3gms n ASN 177 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 3gms h LYS 178 N 4.23 0.19 -0.17 -3.83 1.57 -2.01 -2.69 116.57 113.86 3gms h LYS 178 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3gms h LYS 178 Cb 0.98 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.25 3gms h LYS 178 CO 0.00 0.13 0.00 0.72 -0.57 0.00 0.00 179.45 179.73 3gms n HIS 179 N -4.51 0.22 0.02 -1.35 8.25 -1.26 -4.78 115.22 111.80 3gms n HIS 179 Ca -0.01 -0.24 -0.10 0.00 -0.26 0.00 0.00 57.72 57.12 3gms n HIS 179 Cb 0.09 -0.01 -0.04 0.00 1.12 0.00 0.00 29.99 31.15 3gms n HIS 179 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3gms h THR 180 N 2.06 0.68 -0.40 1.59 2.02 -1.77 0.70 112.91 117.80 3gms h THR 180 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3gms h THR 180 Cb 0.58 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 3gms h THR 180 CO 0.00 0.00 0.26 -0.08 0.37 0.00 0.00 175.52 176.07 3gms h GLU 181 N -0.16 0.52 -0.23 6.66 4.57 -1.86 -0.62 114.58 123.46 3gms h GLU 181 Ca 0.07 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 3gms h GLU 181 Cb 0.26 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 3gms h GLU 181 CO -0.18 0.34 0.11 0.93 -1.18 0.00 0.00 179.01 179.03 3gms h GLU 182 N 0.53 0.32 -0.35 1.92 3.07 -1.78 -1.09 114.58 117.21 3gms h GLU 182 Ca 0.15 -0.05 0.03 0.00 -0.50 0.00 0.00 59.36 58.98 3gms h GLU 182 Cb -0.06 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 27.76 3gms h GLU 182 CO -0.03 0.33 0.17 -0.07 -1.40 0.00 0.00 179.01 178.01 3gms h LEU 183 N 0.24 0.25 -0.39 1.33 3.38 -0.54 -0.10 115.31 119.47 3gms h LEU 183 Ca 0.08 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.09 3gms h LEU 183 Cb 0.11 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 3gms h LEU 183 CO -0.01 0.19 0.21 -0.07 0.09 0.00 0.00 178.44 178.84 3gms h LEU 184 N 0.36 0.31 -0.86 1.67 3.38 -0.95 -1.01 115.31 118.22 3gms h LEU 184 Ca 0.15 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.25 3gms h LEU 184 Cb 0.06 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.68 3gms h LEU 184 CO -0.10 0.22 0.48 0.03 0.09 0.00 0.00 178.44 179.16 3gms h ARG 185 N 0.42 0.72 0.00 1.13 3.08 -0.72 -1.38 114.38 117.62 3gms h ARG 185 Ca 0.17 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.17 3gms h ARG 185 Cb 0.06 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 29.95 3gms h ARG 185 CO -0.11 0.47 0.00 1.28 -1.07 0.00 0.00 179.97 180.55 3gms n LEU 186 N -4.78 0.72 0.00 3.04 4.77 -0.09 -4.90 117.00 115.75 3gms n LEU 186 Ca 0.16 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.74 3gms n LEU 186 Cb 0.36 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 3gms n LEU 186 CO 0.24 -0.32 0.00 0.61 -1.33 0.00 0.00 177.39 176.60 3gms n GLY 187 N 0.81 0.52 3.73 -0.72 0.00 -0.52 -3.60 105.19 105.41 3gms n GLY 187 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3gms n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gms s ALA 188 N -1.39 3.65 0.34 4.61 0.00 -0.48 -4.73 121.76 123.76 3gms s ALA 188 Ca 0.00 1.27 0.12 0.00 0.00 0.00 0.00 51.96 53.35 3gms s ALA 188 Cb 0.00 -3.56 0.62 0.00 0.00 0.00 0.00 23.12 20.17 3gms s ALA 188 CO 0.00 -0.70 1.76 0.00 0.00 0.00 0.00 175.76 176.82 3gms h ALA 189 N 5.98 1.27 -2.11 0.00 0.00 -1.49 -3.41 119.26 119.49 3gms h ALA 189 Ca -0.44 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.04 3gms h ALA 189 Cb 1.21 -0.07 -0.18 0.00 0.00 0.00 0.00 17.79 18.75 3gms h ALA 189 CO 0.84 0.55 0.26 -0.47 0.00 0.00 0.00 179.25 180.43 3gms s TYR 190 N -4.02 -0.59 -0.16 0.00 5.04 -1.18 -5.04 117.35 111.40 3gms s TYR 190 Ca -0.02 0.89 0.00 0.00 -2.44 0.00 0.00 57.07 55.51 3gms s TYR 190 Cb 0.14 0.44 0.03 0.00 0.35 0.00 0.00 41.96 42.92 3gms s TYR 190 CO 0.74 -0.61 -0.12 0.08 -1.34 0.00 0.00 175.55 174.29 3gms s VAL 191 N -1.66 1.55 -0.42 3.14 1.01 -1.26 -1.11 120.40 121.65 3gms s VAL 191 Ca -0.07 -0.73 -0.20 0.00 0.00 0.00 0.00 61.98 60.98 3gms s VAL 191 Cb -0.00 -1.52 0.02 0.00 0.00 0.00 0.00 36.38 34.87 3gms s VAL 191 CO 0.04 0.36 0.59 -0.63 0.00 0.00 0.00 175.10 175.46 3gms s ILE 192 N 1.47 4.90 -0.47 2.22 1.01 0.26 -4.98 121.20 125.61 3gms s ILE 192 Ca 0.03 0.06 -0.19 0.00 0.00 0.00 0.00 60.65 60.55 3gms s ILE 192 Cb -0.14 -4.15 0.04 0.00 0.01 0.00 0.00 42.46 38.23 3gms s ILE 192 CO -0.10 -0.52 0.58 -0.62 0.00 0.00 0.00 174.94 174.29 3gms s ASP 193 N 1.93 6.24 0.00 3.58 -1.08 -1.26 -0.59 116.67 125.49 3gms s ASP 193 Ca 0.20 -0.76 0.23 0.00 -0.52 0.00 0.00 52.55 51.71 3gms s ASP 193 Cb -0.15 -2.28 1.15 0.00 -1.46 0.00 0.00 42.92 40.18 3gms s ASP 193 CO 0.17 -0.80 1.76 0.35 0.52 0.00 0.00 175.17 177.17 3gms n THR 194 N 5.62 0.29 0.73 1.71 -2.24 -0.18 -0.03 114.28 120.17 3gms n THR 194 Ca -0.06 0.07 0.13 0.00 -2.27 0.00 0.00 64.05 61.92 3gms n THR 194 Cb 0.46 -0.69 0.48 0.00 -2.10 0.00 0.00 70.33 68.49 3gms n THR 194 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3gms n SER 195 N -1.31 0.49 0.00 3.42 3.41 -1.25 -4.31 113.62 114.06 3gms n SER 195 Ca 0.10 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.27 3gms n SER 195 Cb 0.20 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 3gms n SER 195 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3gms n THR 196 N -1.96 0.00 -4.42 6.66 -1.04 -0.40 -5.09 114.28 108.03 3gms n THR 196 Ca 0.06 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.85 3gms n THR 196 Cb 0.37 -0.80 -0.13 0.00 -1.82 0.00 0.00 70.33 67.95 3gms n THR 196 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3gms s ALA 197 N -1.86 1.30 0.10 2.41 0.00 0.95 -5.05 121.76 119.61 3gms s ALA 197 Ca 0.00 -0.88 -0.30 0.00 0.00 0.00 0.00 51.96 50.78 3gms s ALA 197 Cb 0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 23.12 22.84 3gms s ALA 197 CO 0.00 0.26 1.11 -1.25 0.00 0.00 0.00 175.76 175.88 3gms s PRO 198 N -1.14 4.53 0.03 0.00 0.04 -1.26 -4.14 135.00 133.05 3gms s PRO 198 Ca 0.03 1.68 -0.25 0.00 0.04 0.00 0.00 61.00 62.50 3gms s PRO 198 Cb -0.08 -3.34 -0.14 0.00 0.04 0.00 0.00 34.50 30.99 3gms s PRO 198 CO 0.01 -0.07 1.23 1.25 0.04 0.00 0.00 177.00 179.46 3gms h LEU 199 N 6.04 -0.77 -0.11 -3.56 5.85 -1.95 -2.74 115.31 118.08 3gms h LEU 199 Ca -0.43 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.36 3gms h LEU 199 Cb 1.21 0.20 -0.05 0.00 0.37 0.00 0.00 40.66 42.39 3gms h LEU 199 CO 0.76 -0.49 -0.18 0.22 -0.34 0.00 0.00 178.44 178.41 3gms h TYR 200 N -1.02 -0.48 -0.50 1.25 3.20 -1.94 -2.10 116.97 115.37 3gms h TYR 200 Ca -0.09 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.78 3gms h TYR 200 Cb 0.69 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.17 3gms h TYR 200 CO 0.04 -0.26 0.22 0.93 -1.64 0.00 0.00 178.16 177.45 3gms h GLU 201 N -0.24 0.71 -0.28 1.82 4.39 -2.00 -1.48 114.58 117.51 3gms h GLU 201 Ca 0.09 -0.09 -0.15 0.00 0.34 0.00 0.00 59.36 59.54 3gms h GLU 201 Cb 0.38 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.89 3gms h GLU 201 CO -0.25 0.58 -0.43 1.15 -1.16 0.00 0.00 179.01 178.89 3gms h THR 202 N 0.71 1.29 -0.88 1.13 2.02 -1.17 -0.70 112.91 115.31 3gms h THR 202 Ca 0.17 -1.62 -0.00 0.00 0.77 0.00 0.00 66.41 65.73 3gms h THR 202 Cb 0.12 1.65 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 3gms h THR 202 CO -0.02 0.52 0.54 0.58 0.37 0.00 0.00 175.52 177.52 3gms h VAL 203 N 0.54 1.24 -0.58 3.16 2.07 -1.08 0.77 116.25 122.38 3gms h VAL 203 Ca 0.02 -0.51 0.02 0.00 0.82 0.00 0.00 66.70 67.05 3gms h VAL 203 Cb 1.03 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3gms h VAL 203 CO 0.10 0.25 0.36 0.24 0.02 0.00 0.00 177.57 178.54 3gms h MET 204 N 1.21 0.70 -0.50 1.57 2.07 -1.03 0.11 114.93 119.06 3gms h MET 204 Ca 0.32 -0.04 -0.02 0.00 -2.07 0.00 0.00 59.70 57.89 3gms h MET 204 Cb -0.07 -0.16 -0.02 0.00 -1.87 0.00 0.00 31.60 29.48 3gms h MET 204 CO -0.06 0.46 0.25 1.49 1.07 0.00 0.00 176.91 180.12 3gms h GLU 205 N 0.72 0.71 0.00 1.72 4.81 -0.57 0.38 114.58 122.37 3gms h GLU 205 Ca 0.22 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.31 3gms h GLU 205 Cb -0.02 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 3gms h GLU 205 CO -0.08 0.59 -0.21 -0.07 -0.73 0.00 0.00 179.01 178.51 3gms h LEU 206 N 0.66 0.00 -3.02 1.64 3.38 -0.24 -2.71 115.31 115.03 3gms h LEU 206 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3gms h LEU 206 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3gms h LEU 206 CO -0.02 0.21 0.00 0.35 0.09 0.00 0.00 178.44 179.07 3gms n THR 207 N -3.42 1.48 -3.73 0.22 -2.24 0.31 -4.98 114.28 101.91 3gms n THR 207 Ca -0.00 -1.25 -0.26 0.00 -2.27 0.00 0.00 64.05 60.26 3gms n THR 207 Cb 0.40 0.24 0.05 0.00 -2.10 0.00 0.00 70.33 68.93 3gms n THR 207 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3gms n ASN 208 N 0.47 -5.04 0.00 3.42 3.02 -0.68 -2.14 115.26 114.30 3gms n ASN 208 Ca 0.18 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 54.06 3gms n ASN 208 Cb 0.65 -4.47 0.00 0.00 -0.61 0.00 0.00 39.78 35.34 3gms n ASN 208 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gms n GLY 209 N -1.79 0.41 0.09 7.41 0.00 0.04 -4.89 105.19 106.46 3gms n GLY 209 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 3gms n GLY 209 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3gms n ILE 210 N -2.67 1.56 0.00 -0.61 2.08 -0.91 -5.06 119.36 113.75 3gms n ILE 210 Ca 0.00 -0.79 0.00 0.00 0.56 0.00 0.00 62.75 62.52 3gms n ILE 210 Cb 0.12 -0.97 0.00 0.00 -0.75 0.00 0.00 39.64 38.04 3gms n ILE 210 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3gms n GLY 211 N 1.68 -0.41 3.89 7.39 0.00 -1.26 -3.89 105.19 112.58 3gms n GLY 211 Ca -0.24 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 43.80 3gms n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gms s ALA 212 N -2.57 2.81 0.01 4.61 0.00 -0.37 -4.32 121.76 121.93 3gms s ALA 212 Ca 0.00 -0.43 -0.05 0.00 0.00 0.00 0.00 51.96 51.48 3gms s ALA 212 Cb 0.00 -3.01 -0.29 0.00 0.00 0.00 0.00 23.12 19.82 3gms s ALA 212 CO 0.00 -1.31 0.89 -0.44 0.00 0.00 0.00 175.76 174.90 3gms h ASP 213 N -0.78 0.46 -5.09 0.00 3.32 -1.36 0.49 116.42 113.45 3gms h ASP 213 Ca -0.45 -0.61 -0.08 0.00 0.02 0.00 0.00 57.03 55.91 3gms h ASP 213 Cb 1.28 -0.15 -0.15 0.00 0.22 0.00 0.00 39.33 40.52 3gms h ASP 213 CO 0.64 1.50 -0.25 0.00 -1.72 0.00 0.00 179.24 179.41 3gms s ALA 214 N -2.62 -0.59 -0.03 3.45 0.00 -0.85 -1.87 121.76 119.25 3gms s ALA 214 Ca -0.09 -0.21 -0.05 0.00 0.00 0.00 0.00 51.96 51.62 3gms s ALA 214 Cb 0.06 0.45 0.01 0.00 0.00 0.00 0.00 23.12 23.65 3gms s ALA 214 CO 0.87 -0.49 0.12 0.00 0.00 0.00 0.00 175.76 176.25 3gms s ALA 215 N -3.23 -0.28 -0.22 0.00 0.00 -0.38 -0.78 121.76 116.87 3gms s ALA 215 Ca -0.00 0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.16 3gms s ALA 215 Cb 0.02 -0.11 0.04 0.00 0.00 0.00 0.00 23.12 23.06 3gms s ALA 215 CO -0.08 -0.10 -0.14 0.42 0.00 0.00 0.00 175.76 175.86 3gms s ILE 216 N -0.36 2.04 -0.23 0.00 1.01 0.10 -0.60 121.20 123.17 3gms s ILE 216 Ca -0.04 -1.27 -0.09 0.00 0.00 0.00 0.00 60.65 59.24 3gms s ILE 216 Cb -0.03 -2.03 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 3gms s ILE 216 CO 0.00 0.22 0.12 -0.62 0.00 0.00 0.00 174.94 174.66 3gms s ASP 217 N 1.22 5.79 0.00 3.58 2.15 0.02 -2.44 116.67 126.99 3gms s ASP 217 Ca -0.02 0.04 0.16 0.00 0.43 0.00 0.00 52.55 53.15 3gms s ASP 217 Cb -0.17 -2.03 -0.15 0.00 -0.30 0.00 0.00 42.92 40.27 3gms s ASP 217 CO -0.09 0.07 0.69 -1.20 -0.17 0.00 0.00 175.17 174.48 3gms n SER 218 N 4.24 0.86 -0.09 -0.34 7.64 -1.26 -0.08 113.62 124.59 3gms n SER 218 Ca -0.16 -0.93 -0.16 0.00 1.01 0.00 0.00 58.87 58.64 3gms n SER 218 Cb 0.52 0.93 -0.07 0.00 -1.01 0.00 0.00 64.21 64.58 3gms n SER 218 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3gms n ILE 219 N -1.20 0.97 -4.01 0.44 5.41 -1.25 -1.29 119.36 118.43 3gms n ILE 219 Ca 0.03 -0.30 0.00 0.00 1.00 0.00 0.00 62.75 63.48 3gms n ILE 219 Cb 0.26 -1.45 0.00 0.00 -0.71 0.00 0.00 39.64 37.74 3gms n ILE 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3gms n GLY 220 N 2.25 -1.80 7.00 7.39 0.00 -1.26 -1.02 105.19 117.75 3gms n GLY 220 Ca -0.33 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.33 3gms n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gms n GLY 221 N 0.00 1.23 0.37 -0.02 0.00 0.85 -1.01 105.19 106.60 3gms n GLY 221 Ca 0.00 -0.56 0.07 0.00 0.00 0.00 0.00 46.02 45.53 3gms n GLY 221 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3gms h PRO 222 N 0.00 0.96 0.09 1.61 0.11 -1.90 -1.72 132.00 131.15 3gms h PRO 222 Ca 0.00 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 3gms h PRO 222 Cb 0.00 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 30.89 3gms h PRO 222 CO 0.00 0.63 -0.04 -0.44 -0.21 0.00 0.00 178.00 177.94 3gms h ASP 223 N 0.99 -0.11 -0.93 -2.05 3.32 -1.94 -0.85 116.42 114.86 3gms h ASP 223 Ca 0.46 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.47 3gms h ASP 223 Cb 0.41 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.94 3gms h ASP 223 CO -0.22 -0.02 0.61 1.23 -1.72 0.00 0.00 179.24 179.13 3gms h GLY 224 N -0.18 1.30 0.97 2.75 0.00 -0.69 -1.54 103.07 105.69 3gms h GLY 224 Ca -0.01 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 3gms h GLY 224 CO 0.02 0.48 0.22 3.43 0.00 0.00 0.00 176.54 180.69 3gms h ASN 225 N 1.26 0.64 -0.31 0.19 2.35 -1.13 -0.33 115.58 118.25 3gms h ASN 225 Ca 0.34 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 55.89 3gms h ASN 225 Cb -0.15 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.04 3gms h ASN 225 CO -0.07 0.60 -0.00 -0.08 -1.65 0.00 0.00 177.43 176.23 3gms h GLU 226 N 0.63 0.66 -0.62 0.81 4.81 -1.02 -1.13 114.58 118.72 3gms h GLU 226 Ca 0.16 -0.16 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 3gms h GLU 226 Cb 0.14 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 3gms h GLU 226 CO -0.02 0.68 0.21 1.25 -0.73 0.00 0.00 179.01 180.40 3gms h LEU 227 N 0.62 0.90 -0.51 1.64 5.85 -0.54 -2.48 115.31 120.80 3gms h LEU 227 Ca 0.13 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 3gms h LEU 227 Cb 0.39 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 3gms h LEU 227 CO 0.01 0.86 0.14 0.00 -0.34 0.00 0.00 178.44 179.12 3gms h ALA 228 N 1.08 0.66 0.00 1.25 0.00 -0.76 -2.50 119.26 118.98 3gms h ALA 228 Ca 0.20 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3gms h ALA 228 Cb 0.27 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3gms h ALA 228 CO -0.01 0.34 0.00 1.19 0.00 0.00 0.00 179.25 180.77 3gms n PHE 229 N -4.48 0.29 1.32 0.00 3.01 -0.45 -1.80 117.46 115.34 3gms n PHE 229 Ca 0.02 0.12 0.09 0.00 1.01 0.00 0.00 57.45 58.69 3gms n PHE 229 Cb 0.21 -0.69 0.35 0.00 -0.01 0.00 0.00 39.48 39.34 3gms n PHE 229 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3gms n SER 230 N -1.77 1.38 -4.91 4.37 7.64 -0.94 -4.88 113.62 114.51 3gms n SER 230 Ca 0.02 -1.72 -0.29 0.00 1.01 0.00 0.00 58.87 57.89 3gms n SER 230 Cb 0.15 -0.11 -0.04 0.00 -1.01 0.00 0.00 64.21 63.20 3gms n SER 230 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3gms s LEU 231 N -1.46 4.13 0.75 -3.43 1.43 -0.74 -1.23 118.68 118.13 3gms s LEU 231 Ca 0.29 0.66 -0.14 0.00 -1.03 0.00 0.00 54.13 53.91 3gms s LEU 231 Cb 0.15 -3.45 0.05 0.00 0.03 0.00 0.00 46.19 42.98 3gms s LEU 231 CO 0.23 -0.12 1.19 0.00 0.23 0.00 0.00 176.35 177.88 3gms s ARG 232 N -3.32 2.03 0.31 1.70 1.70 0.16 -4.71 118.95 116.82 3gms s ARG 232 Ca 0.43 1.68 -0.29 0.00 -0.47 0.00 0.00 55.73 57.09 3gms s ARG 232 Cb -0.11 -1.83 -0.13 0.00 -0.57 0.00 0.00 34.95 32.31 3gms s ARG 232 CO 0.28 -1.90 1.26 -2.30 -1.08 0.00 0.00 175.30 171.55 3gms n PRO 233 N -2.95 1.96 -1.13 3.89 -0.02 -1.26 -1.07 135.00 134.43 3gms n PRO 233 Ca 0.13 0.69 -0.04 0.00 -2.02 0.00 0.00 63.50 62.26 3gms n PRO 233 Cb 0.51 -2.24 -0.02 0.00 -0.02 0.00 0.00 33.50 31.72 3gms n PRO 233 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3gms n ASN 234 N 1.08 -4.51 -4.67 2.55 5.03 0.81 -4.98 115.26 110.57 3gms n ASN 234 Ca 0.07 0.11 -0.29 0.00 0.87 0.00 0.00 54.58 55.33 3gms n ASN 234 Cb 0.34 -2.39 0.13 0.00 -1.02 0.00 0.00 39.78 36.85 3gms n ASN 234 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3gms s GLY 235 N -2.34 1.61 -0.19 7.41 0.00 -0.23 -4.71 107.32 108.88 3gms s GLY 235 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 44.03 3gms s GLY 235 CO 0.00 -0.11 -0.17 -1.58 0.00 0.00 0.00 173.10 171.24 3gms s HIS 236 N -3.46 2.81 -0.19 1.90 2.46 -0.78 -1.05 115.29 116.98 3gms s HIS 236 Ca 0.65 -1.53 -0.06 0.00 0.47 0.00 0.00 55.06 54.59 3gms s HIS 236 Cb -0.11 -1.95 -0.03 0.00 -0.13 0.00 0.00 32.58 30.35 3gms s HIS 236 CO 0.52 -0.77 0.03 0.12 -2.47 0.00 0.00 174.74 172.17 3gms s PHE 237 N 1.32 3.14 -0.07 3.88 5.36 0.11 -1.25 117.98 130.48 3gms s PHE 237 Ca 0.05 -0.15 0.02 0.00 -0.96 0.00 0.00 56.93 55.90 3gms s PHE 237 Cb -0.13 -2.07 0.01 0.00 -0.34 0.00 0.00 43.02 40.49 3gms s PHE 237 CO -0.11 -0.01 -0.13 -1.17 -1.46 0.00 0.00 175.22 172.34 3gms s LEU 238 N 0.60 1.66 -0.07 6.12 2.96 0.23 -1.03 118.68 129.15 3gms s LEU 238 Ca 0.01 -0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 53.55 3gms s LEU 238 Cb -0.13 -0.85 -0.04 0.00 0.50 0.00 0.00 46.19 45.66 3gms s LEU 238 CO 0.02 0.04 0.17 0.42 -1.32 0.00 0.00 176.35 175.67 3gms s THR 239 N 0.66 5.46 0.00 3.68 -4.23 -0.28 -0.80 115.64 120.12 3gms s THR 239 Ca -0.15 0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.47 3gms s THR 239 Cb -0.16 -3.46 0.00 0.00 1.34 0.00 0.00 72.50 70.22 3gms s THR 239 CO 0.04 0.51 0.10 2.30 -0.54 0.00 0.00 174.62 177.03 3gms n ILE 240 N 1.59 0.00 -3.83 2.99 -5.35 0.89 -0.76 119.36 114.89 3gms n ILE 240 Ca -0.16 -0.40 -0.06 0.00 -0.27 0.00 0.00 62.75 61.85 3gms n ILE 240 Cb 0.54 1.05 -0.01 0.00 -1.74 0.00 0.00 39.64 39.47 3gms n ILE 240 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3gms s GLY 241 N -0.61 -0.07 -0.36 3.28 0.00 -1.17 -4.97 107.32 103.42 3gms s GLY 241 Ca 0.00 -0.25 0.13 0.00 0.00 0.00 0.00 44.72 44.61 3gms s GLY 241 CO 0.00 -0.01 0.81 -0.10 0.00 0.00 0.00 173.10 173.80 3gms n LEU 242 N -0.48 0.84 0.07 0.66 7.94 -0.95 -3.85 117.00 121.24 3gms n LEU 242 Ca -0.05 -4.60 0.11 0.00 -1.11 0.00 0.00 56.01 50.36 3gms n LEU 242 Cb 0.60 0.64 0.58 0.00 0.53 0.00 0.00 43.42 45.77 3gms n LEU 242 CO 0.16 2.09 1.14 -0.07 -1.11 0.00 0.00 177.39 179.60 3gms h LEU 243 N 2.99 0.17 -0.16 -1.96 3.38 -1.01 -0.07 115.31 118.64 3gms h LEU 243 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3gms h LEU 243 Cb 1.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.75 3gms h LEU 243 CO 0.48 0.11 0.00 0.77 0.09 0.00 0.00 178.44 179.89 3gms h SER 244 N 0.19 0.00 0.00 -0.43 4.64 -1.35 -3.47 113.55 113.13 3gms h SER 244 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3gms h SER 244 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3gms h SER 244 CO -0.03 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 3gms n GLY 245 N 1.01 0.73 3.09 -0.77 0.00 -0.04 -5.01 105.19 104.21 3gms n GLY 245 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 3gms n GLY 245 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gms s ILE 246 N -2.93 1.77 0.43 -0.61 1.01 -1.26 -5.05 121.20 114.55 3gms s ILE 246 Ca 0.00 -0.79 -0.26 0.00 0.00 0.00 0.00 60.65 59.60 3gms s ILE 246 Cb 0.00 -1.60 -0.09 0.00 0.01 0.00 0.00 42.46 40.78 3gms s ILE 246 CO 0.00 0.49 1.40 0.00 0.00 0.00 0.00 174.94 176.84 3gms n GLN 247 N 4.32 2.26 -1.03 2.79 1.13 -1.26 -0.11 117.38 125.48 3gms n GLN 247 Ca -0.19 0.80 -0.31 0.00 -1.94 0.00 0.00 57.00 55.36 3gms n GLN 247 Cb 0.51 -2.57 0.13 0.00 0.11 0.00 0.00 30.24 28.42 3gms n GLN 247 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 3gms s VAL 248 N -1.18 2.75 -1.30 5.09 -7.23 -1.26 -3.97 120.40 113.30 3gms s VAL 248 Ca 0.59 0.24 -0.18 0.00 -1.81 0.00 0.00 61.98 60.82 3gms s VAL 248 Cb -0.47 -2.55 0.04 0.00 0.56 0.00 0.00 36.38 33.96 3gms s VAL 248 CO 0.59 -0.32 1.82 -3.20 -0.31 0.00 0.00 175.10 173.69 3gms n ASN 249 N -3.89 4.56 -0.27 4.85 2.85 -1.26 -4.83 115.26 117.27 3gms n ASN 249 Ca 0.09 -2.88 0.08 0.00 -0.11 0.00 0.00 54.58 51.76 3gms n ASN 249 Cb 0.53 -1.73 0.23 0.00 1.24 0.00 0.00 39.78 40.05 3gms n ASN 249 CO 0.00 0.00 0.00 -0.50 -2.11 0.00 0.00 177.26 174.65 3gms h TRP 250 N 7.63 0.49 -0.29 1.20 4.06 -2.00 -1.65 115.95 125.39 3gms h TRP 250 Ca 0.44 0.04 -0.01 0.00 2.06 0.00 0.00 58.89 61.42 3gms h TRP 250 Cb 0.85 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.90 3gms h TRP 250 CO 1.41 -0.01 0.15 0.00 -3.56 0.00 0.00 178.44 176.42 3gms h ALA 251 N 1.62 0.37 -0.43 1.49 0.00 -2.01 -2.85 119.26 117.46 3gms h ALA 251 Ca 0.46 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 55.15 3gms h ALA 251 Cb 0.79 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3gms h ALA 251 CO -0.48 -0.08 -0.27 0.93 0.00 0.00 0.00 179.25 179.35 3gms h GLU 252 N 0.34 0.94 -0.96 0.00 5.08 -1.86 -1.15 114.58 116.97 3gms h GLU 252 Ca 0.10 -0.44 0.15 0.00 -1.00 0.00 0.00 59.36 58.17 3gms h GLU 252 Cb 0.10 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.24 3gms h GLU 252 CO -0.01 1.10 0.57 0.82 -1.00 0.00 0.00 179.01 180.49 3gms h ILE 253 N 0.77 0.80 -0.02 3.13 2.04 -1.27 0.29 117.51 123.25 3gms h ILE 253 Ca 0.09 -0.28 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 3gms h ILE 253 Cb 0.85 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 3gms h ILE 253 CO 0.08 0.15 -0.27 0.58 0.00 0.00 0.00 178.15 178.69 3gms h VAL 254 N 0.82 1.51 0.15 1.67 2.07 -1.25 -2.30 116.25 118.91 3gms h VAL 254 Ca 0.51 -1.87 -0.34 0.00 0.82 0.00 0.00 66.70 65.83 3gms h VAL 254 Cb 0.67 2.63 -0.00 0.00 -1.52 0.00 0.00 31.29 33.06 3gms h VAL 254 CO -0.33 0.52 -1.76 0.71 0.02 0.00 0.00 177.57 176.73 3gms h THR 255 N -0.40 0.85 0.07 2.57 1.35 -0.92 -2.85 112.91 113.58 3gms h THR 255 Ca -0.03 -2.42 -0.21 0.00 -0.55 0.00 0.00 66.41 63.20 3gms h THR 255 Cb 0.99 2.65 -0.01 0.00 -1.73 0.00 0.00 68.15 70.05 3gms h THR 255 CO 0.05 0.83 -1.06 0.11 -0.25 0.00 0.00 175.52 175.20 3gms h LYS 256 N -0.02 0.16 0.00 4.72 1.57 -0.64 -3.38 116.57 118.98 3gms h LYS 256 Ca -0.37 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.14 3gms h LYS 256 Cb 1.99 0.10 0.00 0.00 0.08 0.00 0.00 32.23 34.40 3gms h LYS 256 CO 0.11 1.13 -0.75 0.00 -0.57 0.00 0.00 179.45 179.37 3gms n ALA 257 N -2.96 3.39 -2.89 3.86 0.00 -1.00 -4.98 120.51 115.93 3gms n ALA 257 Ca -0.22 -0.36 -0.21 0.00 0.00 0.00 0.00 53.44 52.65 3gms n ALA 257 Cb 0.77 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 19.19 3gms n ALA 257 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3gms n LYS 258 N -1.83 -4.23 -4.15 0.00 4.01 -0.89 -4.43 118.16 106.64 3gms n LYS 258 Ca 0.03 0.87 -0.27 0.00 -0.51 0.00 0.00 58.31 58.44 3gms n LYS 258 Cb 0.40 -5.59 -0.07 0.00 -0.51 0.00 0.00 35.03 29.26 3gms n LYS 258 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 3gms s VAL 259 N -3.12 4.04 -0.00 -0.18 -7.23 -1.13 -0.13 120.40 112.64 3gms s VAL 259 Ca 0.25 -1.25 -0.27 0.00 -1.81 0.00 0.00 61.98 58.90 3gms s VAL 259 Cb -0.11 -3.03 -0.04 0.00 0.56 0.00 0.00 36.38 33.76 3gms s VAL 259 CO 0.31 -0.09 0.85 -1.00 -0.31 0.00 0.00 175.10 174.86 3gms s HIS 260 N -1.70 3.66 -0.03 2.82 3.76 -0.21 -4.34 115.29 119.26 3gms s HIS 260 Ca 0.29 1.52 0.05 0.00 -0.15 0.00 0.00 55.06 56.76 3gms s HIS 260 Cb -0.10 -2.95 -0.01 0.00 1.11 0.00 0.00 32.58 30.63 3gms s HIS 260 CO 0.20 0.10 -0.17 0.00 -0.85 0.00 0.00 174.74 174.03 3gms s ALA 261 N 0.64 1.44 0.16 -1.40 0.00 -1.26 0.06 121.76 121.40 3gms s ALA 261 Ca 0.44 -0.68 -0.03 0.00 0.00 0.00 0.00 51.96 51.69 3gms s ALA 261 Cb -0.20 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 3gms s ALA 261 CO 0.24 0.29 0.13 -0.80 0.00 0.00 0.00 175.76 175.62 3gms s ASN 262 N -0.11 0.20 -0.12 0.00 -0.87 -0.20 -4.98 114.94 108.87 3gms s ASN 262 Ca 0.00 -1.19 0.02 0.00 -1.57 0.00 0.00 52.86 50.11 3gms s ASN 262 Cb -0.09 0.35 -0.01 0.00 -0.02 0.00 0.00 41.25 41.48 3gms s ASN 262 CO 0.01 -0.80 -0.19 -0.63 -2.57 0.00 0.00 177.10 172.92 3gms s ILE 263 N -4.07 2.53 -0.15 0.60 1.09 -1.26 -1.13 121.20 118.81 3gms s ILE 263 Ca 0.27 -0.85 -0.07 0.00 -1.10 0.00 0.00 60.65 58.91 3gms s ILE 263 Cb 0.06 -2.02 -0.04 0.00 -1.06 0.00 0.00 42.46 39.40 3gms s ILE 263 CO 0.05 0.54 0.08 0.12 -0.10 0.00 0.00 174.94 175.62 3gms s PHE 264 N 0.40 3.33 -0.12 3.97 5.36 0.06 -4.92 117.98 126.07 3gms s PHE 264 Ca -0.14 0.22 -0.01 0.00 -0.96 0.00 0.00 56.93 56.05 3gms s PHE 264 Cb -0.17 -2.01 0.03 0.00 -0.34 0.00 0.00 43.02 40.53 3gms s PHE 264 CO 0.07 0.35 -0.06 -1.01 -1.46 0.00 0.00 175.22 173.11 3gms s HIS 265 N -0.15 1.37 0.37 10.12 3.76 -1.26 -4.63 115.29 124.88 3gms s HIS 265 Ca 0.08 -0.70 0.08 0.00 -0.15 0.00 0.00 55.06 54.38 3gms s HIS 265 Cb -0.12 -1.17 0.81 0.00 1.11 0.00 0.00 32.58 33.21 3gms s HIS 265 CO 0.01 -0.50 1.92 1.25 -0.85 0.00 0.00 174.74 176.57 3gms h LEU 266 N 8.20 0.62 -0.94 0.89 5.85 -1.98 -0.67 115.31 127.27 3gms h LEU 266 Ca -0.27 0.02 0.18 0.00 0.84 0.00 0.00 57.88 58.65 3gms h LEU 266 Cb 1.13 -0.11 -0.18 0.00 0.37 0.00 0.00 40.66 41.87 3gms h LEU 266 CO 0.38 0.36 -0.25 -0.09 -0.34 0.00 0.00 178.44 178.50 3gms h ARG 267 N 0.68 -0.00 -0.02 1.25 2.43 -2.00 -0.40 114.38 116.33 3gms h ARG 267 Ca 0.36 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.47 3gms h ARG 267 Cb 0.49 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3gms h ARG 267 CO -0.14 -0.00 -0.24 0.45 -1.51 0.00 0.00 179.97 178.53 3gms h HIS 268 N -0.00 0.28 -0.53 2.20 3.86 -1.58 -3.26 115.15 116.12 3gms h HIS 268 Ca 0.44 -0.14 0.09 0.00 -1.16 0.00 0.00 60.37 59.60 3gms h HIS 268 Cb 0.68 -0.04 -0.08 0.00 1.06 0.00 0.00 27.41 29.04 3gms h HIS 268 CO -0.74 0.91 0.11 2.35 0.86 0.00 0.00 177.93 181.41 3gms h TRP 269 N -0.43 0.17 -1.07 2.45 7.01 -0.84 -0.04 115.95 123.19 3gms h TRP 269 Ca -0.03 0.03 0.30 0.00 2.11 0.00 0.00 58.89 61.31 3gms h TRP 269 Cb 0.96 0.01 -0.12 0.00 -2.10 0.00 0.00 29.16 27.91 3gms h TRP 269 CO 0.16 -0.02 0.66 -0.91 -2.79 0.00 0.00 178.44 175.54 3gms h ASN 270 N 0.24 0.49 0.66 2.65 2.35 -1.17 -0.35 115.58 120.44 3gms h ASN 270 Ca 0.27 0.13 0.00 0.00 -0.55 0.00 0.00 56.30 56.15 3gms h ASN 270 Cb 0.38 0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.81 3gms h ASN 270 CO -0.35 -0.01 -0.51 0.47 -1.65 0.00 0.00 177.43 175.38 3gms n ASP 271 N -4.80 0.53 -0.02 5.81 8.00 -0.09 -4.00 116.55 121.97 3gms n ASP 271 Ca 0.29 -0.07 0.12 0.00 0.71 0.00 0.00 54.79 55.84 3gms n ASP 271 Cb 0.96 0.17 0.17 0.00 -0.02 0.00 0.00 41.12 42.40 3gms n ASP 271 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3gms n GLU 272 N -1.71 0.07 -4.37 -1.24 1.02 -0.17 -4.92 120.64 109.32 3gms n GLU 272 Ca 0.05 -0.04 -0.23 0.00 -0.02 0.00 0.00 57.16 56.92 3gms n GLU 272 Cb 0.37 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.18 3gms n GLU 272 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3gms s VAL 273 N -2.96 2.01 0.75 2.62 -7.23 -1.04 -5.09 120.40 109.46 3gms s VAL 273 Ca 0.11 -2.07 -0.11 0.00 -1.81 0.00 0.00 61.98 58.11 3gms s VAL 273 Cb 0.17 -2.00 0.04 0.00 0.56 0.00 0.00 36.38 35.15 3gms s VAL 273 CO 0.73 -0.34 1.08 -0.94 -0.31 0.00 0.00 175.10 175.32 3gms s SER 274 N -2.91 4.74 0.41 4.85 1.04 -1.26 -4.84 113.70 115.73 3gms s SER 274 Ca 0.20 1.76 0.11 0.00 0.48 0.00 0.00 55.95 58.50 3gms s SER 274 Cb -0.05 -2.51 0.95 0.00 0.10 0.00 0.00 66.02 64.51 3gms s SER 274 CO 0.09 -1.88 1.98 -0.65 0.98 0.00 0.00 173.24 173.76 3gms h PRO 275 N -1.02 0.49 0.01 4.02 0.11 -1.93 -0.30 132.00 133.39 3gms h PRO 275 Ca -0.44 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 3gms h PRO 275 Cb 1.23 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3gms h PRO 275 CO 0.53 0.32 -0.01 -0.92 -0.21 0.00 0.00 178.00 177.72 3gms h TYR 276 N 0.50 -0.02 -0.73 0.65 3.20 -1.92 0.92 116.97 119.57 3gms h TYR 276 Ca 0.28 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.08 3gms h TYR 276 Cb 0.43 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 3gms h TYR 276 CO -0.00 0.07 0.21 -0.22 -1.64 0.00 0.00 178.16 176.58 3gms h LYS 277 N -0.10 1.15 0.01 1.82 3.64 -1.75 -0.33 116.57 121.01 3gms h LYS 277 Ca -0.00 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 3gms h LYS 277 Cb 0.09 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.75 3gms h LYS 277 CO 0.00 0.99 -0.02 2.35 -2.27 0.00 0.00 179.45 180.51 3gms h TRP 278 N 1.10 -0.05 -0.67 1.91 7.01 -0.77 0.13 115.95 124.61 3gms h TRP 278 Ca 0.23 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.24 3gms h TRP 278 Cb 0.33 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.38 3gms h TRP 278 CO 0.03 -0.03 0.43 1.96 -2.79 0.00 0.00 178.44 178.04 3gms h GLN 279 N -0.04 0.89 -0.69 2.65 1.08 -0.63 -2.22 115.11 116.15 3gms h GLN 279 Ca 0.00 -0.06 0.01 0.00 -1.45 0.00 0.00 58.65 57.15 3gms h GLN 279 Cb 0.04 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.24 3gms h GLN 279 CO -0.01 0.61 0.46 0.93 -0.95 0.00 0.00 178.83 179.86 3gms h GLU 280 N 0.91 0.89 -0.50 1.46 4.39 -0.86 -0.30 114.58 120.57 3gms h GLU 280 Ca 0.24 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.80 3gms h GLU 280 Cb -0.08 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.35 3gms h GLU 280 CO -0.05 0.59 -0.05 1.15 -1.16 0.00 0.00 179.01 179.49 3gms h THR 281 N 0.92 1.27 -0.52 1.13 2.02 -0.55 -1.98 112.91 115.20 3gms h THR 281 Ca 0.26 -1.17 -0.06 0.00 0.77 0.00 0.00 66.41 66.21 3gms h THR 281 Cb -0.08 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 3gms h THR 281 CO -0.06 0.41 0.07 -0.26 0.37 0.00 0.00 175.52 176.05 3gms h PHE 282 N 0.78 0.87 -0.33 3.16 -1.00 -0.79 -1.95 116.94 117.68 3gms h PHE 282 Ca 0.14 -0.10 -0.01 0.00 2.81 0.00 0.00 57.97 60.81 3gms h PHE 282 Cb 0.59 -0.25 -0.02 0.00 3.61 0.00 0.00 35.95 39.89 3gms h PHE 282 CO 0.04 0.76 0.17 0.00 -1.61 0.00 0.00 178.31 177.68 3gms h ARG 283 N 0.79 0.45 -0.17 1.51 3.08 -0.61 -0.26 114.38 119.18 3gms h ARG 283 Ca 0.16 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.12 3gms h ARG 283 Cb 0.37 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 3gms h ARG 283 CO 0.01 0.35 -0.10 1.25 -1.07 0.00 0.00 179.97 180.40 3gms h HIS 284 N 0.46 0.44 -0.79 3.04 2.76 -0.87 -1.93 115.15 118.26 3gms h HIS 284 Ca 0.12 -0.11 -0.02 0.00 -2.20 0.00 0.00 60.37 58.16 3gms h HIS 284 Cb 0.03 -0.10 -0.04 0.00 1.55 0.00 0.00 27.41 28.86 3gms h HIS 284 CO 0.00 0.70 0.43 -0.07 -1.30 0.00 0.00 177.93 177.69 3gms h LEU 285 N 0.04 1.00 -0.48 0.26 3.38 -0.86 -1.79 115.31 116.86 3gms h LEU 285 Ca 0.04 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3gms h LEU 285 Cb 0.60 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3gms h LEU 285 CO 0.03 0.81 0.30 0.40 0.09 0.00 0.00 178.44 180.08 3gms h ILE 286 N 1.10 1.13 -0.76 1.22 2.04 -1.01 -0.60 117.51 120.64 3gms h ILE 286 Ca 0.28 -0.27 0.06 0.00 1.00 0.00 0.00 64.86 65.92 3gms h ILE 286 Cb 0.04 0.46 -0.06 0.00 -0.74 0.00 0.00 36.82 36.53 3gms h ILE 286 CO -0.04 0.13 0.45 0.03 0.00 0.00 0.00 178.15 178.72 3gms h ARG 287 N 0.64 0.81 -0.79 2.37 3.08 -1.05 0.80 114.38 120.23 3gms h ARG 287 Ca 0.17 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 3gms h ARG 287 Cb -0.04 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 29.79 3gms h ARG 287 CO -0.04 0.53 0.37 -0.07 -1.07 0.00 0.00 179.97 179.70 3gms h LEU 288 N 0.83 1.04 -0.17 3.04 3.38 -0.44 0.12 115.31 123.12 3gms h LEU 288 Ca 0.33 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 3gms h LEU 288 Cb 0.17 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 3gms h LEU 288 CO -0.17 0.89 -0.08 0.58 0.09 0.00 0.00 178.44 179.74 3gms h VAL 289 N 1.13 1.31 -0.87 1.22 2.07 -0.78 -0.25 116.25 120.09 3gms h VAL 289 Ca 0.27 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.71 3gms h VAL 289 Cb 0.13 1.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.55 3gms h VAL 289 CO -0.03 0.34 0.55 -0.33 0.02 0.00 0.00 177.57 178.11 3gms h GLU 290 N 0.03 0.99 -0.00 1.57 5.08 -0.47 -1.10 114.58 120.67 3gms h GLU 290 Ca 0.04 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3gms h GLU 290 Cb 0.56 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3gms h GLU 290 CO 0.03 0.65 0.00 0.09 -1.00 0.00 0.00 179.01 178.78 3gms n ASN 291 N -4.59 0.06 -1.77 1.42 3.02 -0.00 -4.90 115.26 108.49 3gms n ASN 291 Ca 0.12 -1.27 -0.19 0.00 -0.03 0.00 0.00 54.58 53.21 3gms n ASN 291 Cb 0.16 -0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.28 3gms n ASN 291 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3gms n GLU 292 N -0.83 -1.40 0.08 3.52 1.02 -0.42 -4.87 120.64 117.74 3gms n GLU 292 Ca 0.18 1.05 -0.02 0.00 -0.02 0.00 0.00 57.16 58.34 3gms n GLU 292 Cb 0.09 -5.46 -0.06 0.00 -0.02 0.00 0.00 31.44 25.99 3gms n GLU 292 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 3gms h GLN 293 N 0.00 0.00 -4.87 3.49 4.20 -1.29 -3.44 115.11 113.19 3gms h GLN 293 Ca -0.41 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 57.70 3gms h GLN 293 Cb 1.28 0.00 -0.34 0.00 0.30 0.00 0.00 27.48 28.72 3gms h GLN 293 CO 0.55 0.65 -0.84 -1.17 -0.67 0.00 0.00 178.83 177.34 3gms s LEU 294 N -6.41 1.82 0.04 1.46 2.96 -0.90 -4.87 118.68 112.77 3gms s LEU 294 Ca 0.01 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.53 3gms s LEU 294 Cb 0.09 -1.12 -0.02 0.00 0.50 0.00 0.00 46.19 45.63 3gms s LEU 294 CO 0.79 0.06 -0.14 -0.13 -1.32 0.00 0.00 176.35 175.61 3gms s ARG 295 N 0.71 0.96 0.45 1.98 0.52 -1.26 -4.26 118.95 118.04 3gms s ARG 295 Ca -0.12 -0.76 0.07 0.00 -0.52 0.00 0.00 55.73 54.39 3gms s ARG 295 Cb -0.16 -0.97 0.07 0.00 0.52 0.00 0.00 34.95 34.40 3gms s ARG 295 CO 0.03 0.24 0.56 1.19 0.02 0.00 0.00 175.30 177.34 3gms n PHE 296 N 1.91 -2.11 -1.91 -0.53 3.72 -1.26 -4.90 117.46 112.37 3gms n PHE 296 Ca -0.18 -1.68 -0.39 0.00 -0.05 0.00 0.00 57.45 55.15 3gms n PHE 296 Cb 0.55 -0.41 0.01 0.00 -0.94 0.00 0.00 39.48 38.68 3gms n PHE 296 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 3gms s MET 297 N -3.99 3.74 0.82 -1.08 -1.94 -1.26 -5.02 119.30 110.57 3gms s MET 297 Ca 0.43 2.27 -0.11 0.00 -1.71 0.00 0.00 55.69 56.57 3gms s MET 297 Cb -0.03 -2.64 0.08 0.00 2.01 0.00 0.00 34.83 34.25 3gms s MET 297 CO 0.27 -0.72 1.09 -1.59 -0.01 0.00 0.00 175.02 174.06 3gms s LYS 298 N -2.43 1.87 -0.09 2.03 -2.85 -1.26 -4.76 119.74 112.25 3gms s LYS 298 Ca 0.61 1.05 -0.30 0.00 -1.00 0.00 0.00 55.97 56.33 3gms s LYS 298 Cb -0.40 -1.86 -0.03 0.00 -2.06 0.00 0.00 37.83 33.47 3gms s LYS 298 CO 0.52 -1.88 1.26 0.08 0.10 0.00 0.00 175.35 175.43 3gms s VAL 299 N -2.91 4.18 -0.07 1.79 1.01 -1.26 -1.89 120.40 121.25 3gms s VAL 299 Ca 0.62 1.48 -0.17 0.00 0.00 0.00 0.00 61.98 63.91 3gms s VAL 299 Cb -0.18 -3.95 -0.13 0.00 0.00 0.00 0.00 36.38 32.13 3gms s VAL 299 CO 0.56 -0.05 0.66 -0.74 0.00 0.00 0.00 175.10 175.53 3gms h HIS 300 N 7.86 -0.20 -2.32 5.22 2.76 -1.20 -3.45 115.15 123.82 3gms h HIS 300 Ca -0.32 -0.00 0.14 0.00 -2.20 0.00 0.00 60.37 57.99 3gms h HIS 300 Cb 1.14 0.07 -0.12 0.00 1.55 0.00 0.00 27.41 30.05 3gms h HIS 300 CO 0.76 0.17 0.48 -1.54 -1.30 0.00 0.00 177.93 176.51 3gms s SER 301 N -5.47 -0.28 0.00 3.26 1.04 -1.23 -5.01 113.70 106.02 3gms s SER 301 Ca -0.10 -0.19 0.02 0.00 0.48 0.00 0.00 55.95 56.16 3gms s SER 301 Cb 0.00 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.55 3gms s SER 301 CO 0.37 -0.76 -0.08 0.42 0.98 0.00 0.00 173.24 174.17 3gms s THR 302 N -3.21 0.63 0.00 2.02 -4.23 -1.26 -1.62 115.64 107.97 3gms s THR 302 Ca 0.08 -0.42 -0.01 0.00 -1.18 0.00 0.00 61.69 60.16 3gms s THR 302 Cb -0.01 -0.54 -0.01 0.00 1.34 0.00 0.00 72.50 73.28 3gms s THR 302 CO -0.04 0.12 0.01 -0.31 -0.54 0.00 0.00 174.62 173.86 3gms s TYR 303 N -0.31 0.07 0.65 3.99 2.02 -0.19 -4.98 117.35 118.61 3gms s TYR 303 Ca 0.02 -0.14 -0.17 0.00 -0.37 0.00 0.00 57.07 56.40 3gms s TYR 303 Cb -0.04 -0.06 -0.00 0.00 -0.40 0.00 0.00 41.96 41.46 3gms s TYR 303 CO -0.00 -0.08 1.20 -1.21 -1.57 0.00 0.00 175.55 173.90 3gms s GLU 304 N -0.51 2.64 0.30 -0.62 2.02 -1.26 0.46 118.70 121.73 3gms s GLU 304 Ca -0.06 1.77 0.05 0.00 0.02 0.00 0.00 54.97 56.76 3gms s GLU 304 Cb -0.04 -1.89 0.80 0.00 0.10 0.00 0.00 34.13 33.10 3gms s GLU 304 CO -0.00 -1.45 1.67 1.25 0.02 0.00 0.00 175.26 176.74 3gms h LEU 305 N 0.36 0.24 -2.41 1.80 5.85 -1.88 -0.35 115.31 118.92 3gms h LEU 305 Ca -0.49 0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.42 3gms h LEU 305 Cb 1.29 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 42.51 3gms h LEU 305 CO 0.53 -0.09 0.03 0.00 -0.34 0.00 0.00 178.44 178.56 3gms h ALA 306 N 1.77 1.59 -0.75 1.25 0.00 -1.92 -2.14 119.26 119.06 3gms h ALA 306 Ca 0.59 -0.00 -0.33 0.00 0.00 0.00 0.00 54.91 55.17 3gms h ALA 306 Cb 1.21 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.80 3gms h ALA 306 CO -0.60 -0.04 0.42 -0.25 0.00 0.00 0.00 179.25 178.78 3gms n ASP 307 N -3.88 3.95 -0.36 0.00 8.00 -0.14 -4.63 116.55 119.49 3gms n ASP 307 Ca -0.02 -3.21 0.03 0.00 0.71 0.00 0.00 54.79 52.29 3gms n ASP 307 Cb 0.11 -0.75 0.19 0.00 -0.02 0.00 0.00 41.12 40.64 3gms n ASP 307 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 3gms h VAL 308 N 1.44 1.09 -0.75 2.53 3.04 -1.47 -2.41 116.25 119.71 3gms h VAL 308 Ca 0.41 -0.40 0.02 0.00 -1.01 0.00 0.00 66.70 65.72 3gms h VAL 308 Cb 2.38 -0.17 -0.04 0.00 -2.01 0.00 0.00 31.29 31.44 3gms h VAL 308 CO 0.81 0.21 0.49 0.11 -1.01 0.00 0.00 177.57 178.18 3gms h LYS 309 N 1.16 0.95 -0.66 4.17 1.57 -1.87 0.85 116.57 122.73 3gms h LYS 309 Ca 0.43 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 59.11 3gms h LYS 309 Cb 0.17 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 3gms h LYS 309 CO -0.17 0.63 0.24 0.00 -0.57 0.00 0.00 179.45 179.58 3gms h ALA 310 N 1.30 0.86 -0.52 3.86 0.00 -1.82 -2.07 119.26 120.86 3gms h ALA 310 Ca 0.29 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3gms h ALA 310 Cb -0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3gms h ALA 310 CO -0.08 0.50 0.25 0.00 0.00 0.00 0.00 179.25 179.92 3gms h ALA 311 N 1.10 0.67 -0.66 0.00 0.00 -0.88 -2.56 119.26 116.92 3gms h ALA 311 Ca 0.22 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 3gms h ALA 311 Cb 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3gms h ALA 311 CO -0.01 0.22 0.10 0.28 0.00 0.00 0.00 179.25 179.84 3gms h VAL 312 N 0.69 1.26 -1.01 0.00 2.07 -0.66 -2.20 116.25 116.41 3gms h VAL 312 Ca 0.18 -1.05 0.08 0.00 0.82 0.00 0.00 66.70 66.72 3gms h VAL 312 Cb 0.11 0.65 -0.07 0.00 -1.52 0.00 0.00 31.29 30.45 3gms h VAL 312 CO -0.02 0.39 0.65 -0.78 0.02 0.00 0.00 177.57 177.83 3gms h ASP 313 N 1.03 1.02 -0.31 0.57 3.58 -1.11 -0.26 116.42 120.94 3gms h ASP 313 Ca 0.20 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 3gms h ASP 313 Cb 0.45 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 3gms h ASP 313 CO 0.01 0.63 0.15 0.58 -2.88 0.00 0.00 179.24 177.73 3gms h VAL 314 N 1.14 1.15 -0.93 2.25 2.07 -1.05 -1.61 116.25 119.27 3gms h VAL 314 Ca 0.45 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 3gms h VAL 314 Cb 0.24 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 3gms h VAL 314 CO -0.19 0.15 0.55 0.58 0.02 0.00 0.00 177.57 178.68 3gms h VAL 315 N 0.36 1.26 0.00 2.57 2.07 -0.68 -2.48 116.25 119.35 3gms h VAL 315 Ca 0.11 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.05 3gms h VAL 315 Cb 0.11 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 3gms h VAL 315 CO -0.01 0.27 -0.08 0.00 0.02 0.00 0.00 177.57 177.77 3gms n GLN 316 N -4.35 0.01 -2.16 1.57 6.02 -0.21 -4.92 117.38 113.35 3gms n GLN 316 Ca 0.10 0.01 -0.41 0.00 -0.01 0.00 0.00 57.00 56.69 3gms n GLN 316 Cb 0.07 -1.51 -0.03 0.00 1.02 0.00 0.00 30.24 29.79 3gms n GLN 316 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3gms s SER 317 N -3.07 6.83 0.40 1.08 0.15 -0.62 -4.94 113.70 113.53 3gms s SER 317 Ca 0.13 2.55 0.19 0.00 0.70 0.00 0.00 55.95 59.52 3gms s SER 317 Cb 0.18 -2.63 0.81 0.00 -1.71 0.00 0.00 66.02 62.68 3gms s SER 317 CO 0.56 -0.54 1.80 0.00 1.20 0.00 0.00 173.24 176.26 3gms h ALA 318 N 4.53 1.11 -0.00 5.45 0.00 -1.91 -2.75 119.26 125.68 3gms h ALA 318 Ca -0.47 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.14 3gms h ALA 318 Cb 1.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3gms h ALA 318 CO 0.73 0.42 -0.14 0.39 0.00 0.00 0.00 179.25 180.65 3gms n GLU 319 N -3.64 0.52 -1.59 0.00 4.71 -1.26 -4.96 120.64 114.42 3gms n GLU 319 Ca -0.01 -0.17 -0.53 0.00 -0.01 0.00 0.00 57.16 56.44 3gms n GLU 319 Cb 0.45 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 29.32 3gms n GLU 319 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 3gms n LYS 320 N -1.09 1.07 -1.16 3.49 4.81 -1.04 -4.98 118.16 119.26 3gms n LYS 320 Ca 0.12 0.39 -0.15 0.00 -0.87 0.00 0.00 58.31 57.80 3gms n LYS 320 Cb 0.29 -2.02 0.10 0.00 0.02 0.00 0.00 35.03 33.42 3gms n LYS 320 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3gms n THR 321 N 2.50 0.00 -2.65 3.15 -2.24 -1.26 -5.04 114.28 108.74 3gms n THR 321 Ca 0.19 -0.60 -0.33 0.00 -2.27 0.00 0.00 64.05 61.03 3gms n THR 321 Cb 0.18 -1.61 -0.05 0.00 -2.10 0.00 0.00 70.33 66.75 3gms n THR 321 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3gms s LYS 322 N -4.45 3.98 0.00 -0.78 0.00 -1.26 -4.95 119.74 112.28 3gms s LYS 322 Ca 0.40 1.24 0.00 0.00 0.00 0.00 0.00 55.97 57.62 3gms s LYS 322 Cb -0.01 -2.13 0.00 0.00 0.00 0.00 0.00 37.83 35.69 3gms s LYS 322 CO 0.28 -0.26 0.00 0.41 0.00 0.00 0.00 175.35 175.78 3gms n GLY 323 N -0.47 2.33 3.77 0.59 0.00 -1.26 -4.50 105.19 105.65 3gms n GLY 323 Ca 0.08 -2.06 -0.38 0.00 0.00 0.00 0.00 46.02 43.66 3gms n GLY 323 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gms s LYS 324 N -2.26 4.19 -0.01 1.61 2.47 -0.79 -4.52 119.74 120.42 3gms s LYS 324 Ca 0.00 0.49 -0.16 0.00 -1.56 0.00 0.00 55.97 54.74 3gms s LYS 324 Cb 0.00 -3.33 -0.06 0.00 -1.46 0.00 0.00 37.83 32.98 3gms s LYS 324 CO 0.00 0.41 0.45 0.08 0.16 0.00 0.00 175.35 176.45 3gms s VAL 325 N -0.21 5.00 0.16 4.02 1.01 -1.26 -0.80 120.40 128.31 3gms s VAL 325 Ca 0.26 0.92 0.09 0.00 0.00 0.00 0.00 61.98 63.25 3gms s VAL 325 Cb -0.16 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 3gms s VAL 325 CO 0.13 0.53 -0.19 -0.36 0.00 0.00 0.00 175.10 175.21 3gms s PHE 326 N -0.78 1.84 -0.25 5.22 0.08 -0.64 -1.13 117.98 122.32 3gms s PHE 326 Ca 0.25 -0.46 -0.08 0.00 0.12 0.00 0.00 56.93 56.77 3gms s PHE 326 Cb -0.17 -0.93 -0.03 0.00 -0.57 0.00 0.00 43.02 41.32 3gms s PHE 326 CO 0.14 0.32 0.09 -0.51 -0.10 0.00 0.00 175.22 175.15 3gms s LEU 327 N -2.55 3.53 0.23 -0.37 1.43 0.65 -1.02 118.68 120.57 3gms s LEU 327 Ca 0.15 -0.17 0.11 0.00 -1.03 0.00 0.00 54.13 53.19 3gms s LEU 327 Cb -0.06 -1.95 -0.05 0.00 0.03 0.00 0.00 46.19 44.16 3gms s LEU 327 CO 0.06 -0.03 -0.20 0.42 0.23 0.00 0.00 176.35 176.83 3gms s THR 328 N 1.60 2.54 -0.30 5.49 -4.23 0.17 -1.16 115.64 119.76 3gms s THR 328 Ca 0.06 -2.12 0.20 0.00 -1.18 0.00 0.00 61.69 58.65 3gms s THR 328 Cb -0.15 -2.27 0.48 0.00 1.34 0.00 0.00 72.50 71.89 3gms s THR 328 CO 0.05 -0.23 1.08 -1.20 -0.54 0.00 0.00 174.62 173.78 3gms n SER 329 N -0.14 1.14 0.00 3.99 7.64 0.80 -3.07 113.62 123.99 3gms n SER 329 Ca -0.09 -2.35 0.11 0.00 1.01 0.00 0.00 58.87 57.55 3gms n SER 329 Cb 0.57 -0.35 0.67 0.00 -1.01 0.00 0.00 64.21 64.09 3gms n SER 329 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81