#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ns0 s ILE 3 N 0.00 1.41 0.04 -1.33 1.01 -1.26 -1.64 121.20 119.43 1ns0 s ILE 3 Ca 0.00 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 60.02 1ns0 s ILE 3 Cb 0.00 -1.24 -0.02 0.00 0.01 0.00 0.00 42.46 41.21 1ns0 s ILE 3 CO 0.00 0.41 -0.11 -0.54 0.00 0.00 0.00 174.94 174.71 1ns0 s LYS 4 N 0.36 0.71 0.02 2.79 3.01 -0.43 -4.99 119.74 121.21 1ns0 s LYS 4 Ca -0.11 -0.68 0.02 0.00 -1.01 0.00 0.00 55.97 54.19 1ns0 s LYS 4 Cb -0.15 -0.64 -0.01 0.00 -1.01 0.00 0.00 37.83 36.02 1ns0 s LYS 4 CO 0.04 0.15 -0.07 0.42 0.51 0.00 0.00 175.35 176.40 1ns0 s ILE 5 N -0.93 0.50 0.18 2.17 1.01 -1.26 -0.57 121.20 122.29 1ns0 s ILE 5 Ca -0.02 -0.66 -0.19 0.00 0.00 0.00 0.00 60.65 59.78 1ns0 s ILE 5 Cb -0.08 -0.50 0.04 0.00 0.01 0.00 0.00 42.46 41.93 1ns0 s ILE 5 CO 0.01 -0.12 0.53 0.00 0.00 0.00 0.00 174.94 175.35 1ns0 s ARG 6 N -0.85 1.31 0.37 2.79 1.70 -0.83 -4.98 118.95 118.45 1ns0 s ARG 6 Ca -0.04 -0.74 -0.27 0.00 -0.47 0.00 0.00 55.73 54.21 1ns0 s ARG 6 Cb -0.06 0.53 -0.10 0.00 -0.57 0.00 0.00 34.95 34.76 1ns0 s ARG 6 CO 0.00 -0.56 1.32 0.16 -1.08 0.00 0.00 175.30 175.15 1ns0 s ASP 7 N -2.83 6.51 0.00 -2.89 1.47 -1.26 -0.13 116.67 117.53 1ns0 s ASP 7 Ca 0.06 2.71 0.09 0.00 1.18 0.00 0.00 52.55 56.58 1ns0 s ASP 7 Cb -0.01 -2.65 0.02 0.00 -0.34 0.00 0.00 42.92 39.94 1ns0 s ASP 7 CO -0.07 -0.72 0.63 0.33 0.68 0.00 0.00 175.17 176.03 1ns0 n PHE 8 N 0.44 0.00 0.00 2.11 7.35 0.12 -4.65 117.46 122.82 1ns0 n PHE 8 Ca 0.02 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.71 1ns0 n PHE 8 Cb 0.42 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.25 1ns0 n PHE 8 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1ns0 n GLY 9 N 0.75 3.27 2.64 7.13 0.00 -1.21 -2.13 105.19 115.64 1ns0 n GLY 9 Ca 0.04 -1.75 -0.06 0.00 0.00 0.00 0.00 46.02 44.25 1ns0 n GLY 9 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ns0 n LEU 10 N 0.00 0.14 0.00 0.99 4.77 -1.26 1.00 117.00 122.64 1ns0 n LEU 10 Ca 0.00 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 1ns0 n LEU 10 Cb 0.00 -2.21 0.00 0.00 -2.33 0.00 0.00 43.42 38.88 1ns0 n LEU 10 CO 0.00 -0.83 0.00 0.61 -1.33 0.00 0.00 177.39 175.84 1ns0 n GLY 11 N 0.44 0.54 3.93 -0.72 0.00 -1.26 -5.08 105.19 103.04 1ns0 n GLY 11 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1ns0 n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ns0 s SER 12 N -2.94 5.56 0.26 1.61 1.04 0.28 -4.95 113.70 114.56 1ns0 s SER 12 Ca 0.00 0.55 0.12 0.00 0.48 0.00 0.00 55.95 57.10 1ns0 s SER 12 Cb 0.00 -1.57 -0.05 0.00 0.10 0.00 0.00 66.02 64.50 1ns0 s SER 12 CO 0.00 -1.03 -0.21 -1.81 0.98 0.00 0.00 173.24 171.17 1ns0 s ASP 13 N -4.31 3.49 -0.19 7.02 1.01 -1.26 0.11 116.67 122.53 1ns0 s ASP 13 Ca 0.53 -0.99 -0.02 0.00 0.71 0.00 0.00 52.55 52.78 1ns0 s ASP 13 Cb -0.10 -0.28 -0.00 0.00 1.01 0.00 0.00 42.92 43.55 1ns0 s ASP 13 CO 0.43 0.05 -0.11 -0.22 0.21 0.00 0.00 175.17 175.53 1ns0 s LEU 14 N -3.31 2.62 -0.28 1.23 2.96 0.81 -3.55 118.68 119.16 1ns0 s LEU 14 Ca 0.27 -0.47 -0.07 0.00 -0.22 0.00 0.00 54.13 53.65 1ns0 s LEU 14 Cb -0.05 -1.64 0.00 0.00 0.50 0.00 0.00 46.19 45.00 1ns0 s LEU 14 CO 0.13 0.01 0.07 -0.63 -1.32 0.00 0.00 176.35 174.62 1ns0 s ILE 15 N 1.25 3.97 -0.15 6.68 1.09 0.56 -1.97 121.20 132.62 1ns0 s ILE 15 Ca 0.03 -0.62 -0.01 0.00 -1.10 0.00 0.00 60.65 58.95 1ns0 s ILE 15 Cb -0.14 -3.01 -0.01 0.00 -1.06 0.00 0.00 42.46 38.24 1ns0 s ILE 15 CO -0.05 0.13 -0.11 -0.44 -0.10 0.00 0.00 174.94 174.37 1ns0 s SER 16 N 1.51 4.08 0.00 3.58 0.01 0.26 -0.86 113.70 122.29 1ns0 s SER 16 Ca 0.03 -0.34 0.06 0.00 1.31 0.00 0.00 55.95 57.01 1ns0 s SER 16 Cb -0.17 -1.64 -0.03 0.00 0.21 0.00 0.00 66.02 64.39 1ns0 s SER 16 CO 0.02 0.12 -0.18 -0.76 0.41 0.00 0.00 173.24 172.86 1ns0 s LEU 17 N 0.61 2.59 -0.09 2.44 1.43 0.15 -1.32 118.68 124.49 1ns0 s LEU 17 Ca -0.06 -0.35 0.01 0.00 -1.03 0.00 0.00 54.13 52.70 1ns0 s LEU 17 Cb -0.15 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.57 1ns0 s LEU 17 CO 0.03 0.29 -0.12 -0.89 0.23 0.00 0.00 176.35 175.89 1ns0 s THR 18 N -0.83 1.20 0.81 5.49 2.01 -0.65 -1.19 115.64 122.48 1ns0 s THR 18 Ca 0.13 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.61 1ns0 s THR 18 Cb -0.10 -1.12 0.17 0.00 0.01 0.00 0.00 72.50 71.45 1ns0 s THR 18 CO 0.03 0.38 1.10 -0.46 -0.69 0.00 0.00 174.62 174.98 1ns0 n ASN 19 N 4.23 0.95 0.29 3.53 0.23 -0.34 -1.58 115.26 122.57 1ns0 n ASN 19 Ca -0.19 -1.93 0.15 0.00 -0.53 0.00 0.00 54.58 52.08 1ns0 n ASN 19 Cb 0.51 -0.76 0.89 0.00 -2.08 0.00 0.00 39.78 38.34 1ns0 n ASN 19 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1ns0 h LYS 20 N 0.00 0.00 -0.01 -3.83 3.64 -1.89 -1.19 116.57 113.30 1ns0 h LYS 20 Ca -0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1ns0 h LYS 20 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1ns0 h LYS 20 CO 0.34 0.04 -0.00 0.00 -2.27 0.00 0.00 179.45 177.56 1ns0 n ALA 21 N -2.28 2.64 -0.79 5.00 0.00 -1.26 -4.90 120.51 118.92 1ns0 n ALA 21 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1ns0 n ALA 21 Cb 0.13 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1ns0 n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ns0 n GLY 22 N 1.08 0.74 3.75 0.00 0.00 -0.45 -5.03 105.19 105.29 1ns0 n GLY 22 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1ns0 n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ns0 s VAL 23 N -2.74 4.36 0.01 1.61 1.01 -1.26 -4.81 120.40 118.58 1ns0 s VAL 23 Ca 0.00 1.94 0.07 0.00 0.00 0.00 0.00 61.98 63.99 1ns0 s VAL 23 Cb 0.00 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 1ns0 s VAL 23 CO 0.00 0.43 -0.21 0.42 0.00 0.00 0.00 175.10 175.74 1ns0 s THR 24 N -0.65 2.57 0.02 3.92 -4.23 -1.07 -1.20 115.64 115.01 1ns0 s THR 24 Ca 0.41 -1.13 0.01 0.00 -1.18 0.00 0.00 61.69 59.81 1ns0 s THR 24 Cb -0.24 -2.02 -0.01 0.00 1.34 0.00 0.00 72.50 71.57 1ns0 s THR 24 CO 0.29 0.44 -0.04 -0.51 -0.54 0.00 0.00 174.62 174.25 1ns0 s ILE 25 N -0.81 0.26 0.05 2.99 2.07 -0.33 -1.17 121.20 124.27 1ns0 s ILE 25 Ca 0.13 -0.64 0.02 0.00 -1.41 0.00 0.00 60.65 58.75 1ns0 s ILE 25 Cb -0.10 -0.32 -0.03 0.00 0.13 0.00 0.00 42.46 42.14 1ns0 s ILE 25 CO 0.03 -0.25 -0.08 -0.94 -1.91 0.00 0.00 174.94 171.79 1ns0 s SER 26 N -0.94 0.95 0.14 4.50 1.04 0.87 -0.68 113.70 119.59 1ns0 s SER 26 Ca -0.08 -0.57 0.02 0.00 0.48 0.00 0.00 55.95 55.80 1ns0 s SER 26 Cb -0.06 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 66.04 1ns0 s SER 26 CO -0.00 -0.20 -0.03 -0.36 0.98 0.00 0.00 173.24 173.63 1ns0 s PHE 27 N -1.43 1.09 0.05 5.02 0.40 -0.04 0.55 117.98 123.62 1ns0 s PHE 27 Ca -0.09 -0.97 0.04 0.00 -0.60 0.00 0.00 56.93 55.31 1ns0 s PHE 27 Cb -0.10 -0.62 -0.02 0.00 0.51 0.00 0.00 43.02 42.79 1ns0 s PHE 27 CO 0.00 -0.18 -0.11 -0.08 0.70 0.00 0.00 175.22 175.55 1ns0 s THR 28 N -3.63 0.88 -1.40 0.64 -1.32 0.30 -0.33 115.64 110.77 1ns0 s THR 28 Ca 0.19 -1.06 0.28 0.00 -1.21 0.00 0.00 61.69 59.90 1ns0 s THR 28 Cb 0.06 -0.85 0.47 0.00 -1.51 0.00 0.00 72.50 70.67 1ns0 s THR 28 CO 0.01 -0.18 1.97 -0.46 -2.21 0.00 0.00 174.62 173.75 1ns0 n ASN 29 N 1.66 0.00 -4.55 8.08 6.94 -1.23 -1.38 115.26 124.77 1ns0 n ASN 29 Ca -0.20 -0.07 -0.41 0.00 -0.02 0.00 0.00 54.58 53.88 1ns0 n ASN 29 Cb 0.55 -0.30 -0.03 0.00 -2.36 0.00 0.00 39.78 37.64 1ns0 n ASN 29 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1ns0 s LEU 30 N -2.60 3.20 0.00 -4.53 2.96 -1.26 -0.65 118.68 115.79 1ns0 s LEU 30 Ca 0.26 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.79 1ns0 s LEU 30 Cb 0.19 -2.64 0.00 0.00 0.50 0.00 0.00 46.19 44.24 1ns0 s LEU 30 CO 0.44 -1.80 0.00 0.61 -1.32 0.00 0.00 176.35 174.28 1ns0 n GLY 31 N 5.34 0.58 4.02 7.98 0.00 0.06 -4.11 105.19 119.05 1ns0 n GLY 31 Ca 0.04 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1ns0 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ns0 n ALA 32 N 0.38 -2.65 -2.39 4.61 0.00 -1.19 -1.06 120.51 118.21 1ns0 n ALA 32 Ca 0.00 -0.53 -0.29 0.00 0.00 0.00 0.00 53.44 52.62 1ns0 n ALA 32 Cb 0.00 -2.35 -0.13 0.00 0.00 0.00 0.00 19.45 16.97 1ns0 n ALA 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1ns0 s ARG 33 N -6.98 1.45 0.05 0.00 3.52 -0.48 -3.59 118.95 112.92 1ns0 s ARG 33 Ca 0.41 -1.31 -0.24 0.00 -0.13 0.00 0.00 55.73 54.47 1ns0 s ARG 33 Cb -0.23 -1.89 -0.06 0.00 -1.56 0.00 0.00 34.95 31.22 1ns0 s ARG 33 CO 0.96 0.45 0.73 -1.50 -0.81 0.00 0.00 175.30 175.13 1ns0 s ILE 34 N -1.02 4.73 -0.22 4.11 2.07 -0.29 -0.54 121.20 130.04 1ns0 s ILE 34 Ca 0.13 1.56 0.00 0.00 -1.41 0.00 0.00 60.65 60.93 1ns0 s ILE 34 Cb -0.10 -4.08 -0.14 0.00 0.13 0.00 0.00 42.46 38.27 1ns0 s ILE 34 CO 0.05 0.39 -0.20 0.52 -1.91 0.00 0.00 174.94 173.79 1ns0 n VAL 35 N 2.65 1.25 -3.57 4.00 0.31 0.19 -4.44 118.33 118.72 1ns0 n VAL 35 Ca -0.04 -0.46 -0.12 0.00 -0.01 0.00 0.00 64.34 63.71 1ns0 n VAL 35 Cb 0.50 -1.33 -0.04 0.00 -0.91 0.00 0.00 33.84 32.06 1ns0 n VAL 35 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ns0 s ASP 36 N -6.21 -0.38 -0.23 4.52 2.15 -1.13 -4.16 116.67 111.23 1ns0 s ASP 36 Ca -0.30 -0.07 -0.03 0.00 0.43 0.00 0.00 52.55 52.58 1ns0 s ASP 36 Cb 0.08 0.51 0.12 0.00 -0.30 0.00 0.00 42.92 43.33 1ns0 s ASP 36 CO 0.49 -0.83 0.35 0.86 -0.17 0.00 0.00 175.17 175.88 1ns0 s TRP 37 N -3.28 -0.73 0.05 -5.34 -0.00 -1.26 -0.09 118.94 108.29 1ns0 s TRP 37 Ca -0.01 0.84 0.07 0.00 -0.00 0.00 0.00 56.10 57.00 1ns0 s TRP 37 Cb 0.00 -0.00 -0.03 0.00 -0.00 0.00 0.00 33.47 33.44 1ns0 s TRP 37 CO -0.08 -0.66 -0.19 -0.65 -0.00 0.00 0.00 176.95 175.37 1ns0 s GLN 38 N 2.52 1.27 -0.12 5.86 -0.21 -0.31 -0.14 119.66 128.52 1ns0 s GLN 38 Ca 0.10 -0.92 0.00 0.00 0.02 0.00 0.00 55.36 54.56 1ns0 s GLN 38 Cb -0.15 -1.37 0.02 0.00 1.00 0.00 0.00 33.01 32.51 1ns0 s GLN 38 CO -0.15 0.35 -0.12 0.21 -2.12 0.00 0.00 175.29 173.47 1ns0 s LYS 39 N -1.24 1.92 -1.45 2.91 2.20 -0.60 -2.58 119.74 120.90 1ns0 s LYS 39 Ca 0.06 -0.42 -0.05 0.00 -0.36 0.00 0.00 55.97 55.19 1ns0 s LYS 39 Cb -0.09 -1.80 0.04 0.00 -1.51 0.00 0.00 37.83 34.48 1ns0 s LYS 39 CO 0.02 -0.19 0.65 -0.25 -0.36 0.00 0.00 175.35 175.21 1ns0 n ASP 40 N 4.65 -1.80 0.00 1.43 8.00 -1.26 -0.82 116.55 126.75 1ns0 n ASP 40 Ca -0.16 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.42 1ns0 n ASP 40 Cb 0.50 -3.42 0.00 0.00 -0.02 0.00 0.00 41.12 38.18 1ns0 n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ns0 n GLY 41 N -1.74 0.42 3.46 0.44 0.00 -1.26 -5.01 105.19 101.49 1ns0 n GLY 41 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 1ns0 n GLY 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ns0 s LYS 42 N -0.54 3.33 -0.04 1.61 2.20 -0.00 -5.07 119.74 121.23 1ns0 s LYS 42 Ca 0.00 -0.61 -0.30 0.00 -0.36 0.00 0.00 55.97 54.70 1ns0 s LYS 42 Cb 0.00 -2.71 -0.04 0.00 -1.51 0.00 0.00 37.83 33.57 1ns0 s LYS 42 CO 0.00 0.32 1.31 -1.01 -0.36 0.00 0.00 175.35 175.61 1ns0 s HIS 43 N 0.10 2.98 -0.41 4.03 3.76 -1.26 -1.56 115.29 122.93 1ns0 s HIS 43 Ca -0.03 0.99 0.23 0.00 -0.15 0.00 0.00 55.06 56.10 1ns0 s HIS 43 Cb -0.14 -3.55 0.13 0.00 1.11 0.00 0.00 32.58 30.13 1ns0 s HIS 43 CO 0.04 -1.93 1.15 -0.07 -0.85 0.00 0.00 174.74 173.08 1ns0 h LEU 44 N 8.40 0.00 -9.17 0.89 3.38 -0.78 -3.22 115.31 114.82 1ns0 h LEU 44 Ca -0.36 -0.11 -0.45 0.00 0.09 0.00 0.00 57.88 57.06 1ns0 h LEU 44 Cb 1.17 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.78 1ns0 h LEU 44 CO 0.90 0.05 -0.60 0.27 0.09 0.00 0.00 178.44 179.15 1ns0 s ILE 45 N -3.28 0.98 0.05 1.22 -4.36 -1.26 -1.73 121.20 112.83 1ns0 s ILE 45 Ca 0.02 -2.00 -0.15 0.00 -0.26 0.00 0.00 60.65 58.26 1ns0 s ILE 45 Cb 0.11 -2.72 -0.06 0.00 1.25 0.00 0.00 42.46 41.04 1ns0 s ILE 45 CO 0.76 0.00 0.47 -0.76 0.24 0.00 0.00 174.94 175.65 1ns0 s LEU 46 N -3.46 4.46 0.01 0.37 1.43 -0.60 -4.79 118.68 116.10 1ns0 s LEU 46 Ca 0.36 1.04 -0.29 0.00 -1.03 0.00 0.00 54.13 54.20 1ns0 s LEU 46 Cb 0.08 -2.80 0.11 0.00 0.03 0.00 0.00 46.19 43.61 1ns0 s LEU 46 CO 0.15 0.27 1.16 -0.83 0.23 0.00 0.00 176.35 177.32 1ns0 s GLY 47 N -1.25 -0.35 0.53 -3.19 0.00 -1.26 -4.73 107.32 97.07 1ns0 s GLY 47 Ca 0.28 0.67 0.07 0.00 0.00 0.00 0.00 44.72 45.73 1ns0 s GLY 47 CO 0.16 0.15 0.48 -1.36 0.00 0.00 0.00 173.10 172.53 1ns0 s PHE 48 N -2.72 1.74 -2.08 1.90 2.99 -1.26 -4.50 117.98 114.05 1ns0 s PHE 48 Ca 0.12 -0.76 0.20 0.00 0.00 0.00 0.00 56.93 56.49 1ns0 s PHE 48 Cb 0.02 -2.01 0.05 0.00 0.00 0.00 0.00 43.02 41.07 1ns0 s PHE 48 CO -0.03 -0.56 1.05 -0.25 -0.00 0.00 0.00 175.22 175.43 1ns0 n ASP 49 N -1.83 2.16 -3.53 1.36 9.92 -1.26 -4.97 116.55 118.39 1ns0 n ASP 49 Ca 0.03 -1.58 -0.11 0.00 -0.53 0.00 0.00 54.79 52.60 1ns0 n ASP 49 Cb 0.63 0.32 -0.03 0.00 -0.64 0.00 0.00 41.12 41.40 1ns0 n ASP 49 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1ns0 s SER 50 N -2.09 -0.40 0.24 -2.24 1.04 -1.26 -5.05 113.70 103.94 1ns0 s SER 50 Ca 0.19 -0.15 -0.05 0.00 0.48 0.00 0.00 55.95 56.42 1ns0 s SER 50 Cb 0.17 0.53 0.35 0.00 0.10 0.00 0.00 66.02 67.16 1ns0 s SER 50 CO 0.43 -0.90 1.84 0.00 0.98 0.00 0.00 173.24 175.59 1ns0 h ALA 51 N 2.23 1.18 -0.75 5.32 0.00 -1.72 -2.52 119.26 122.99 1ns0 h ALA 51 Ca -0.34 0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.67 1ns0 h ALA 51 Cb 1.28 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 1ns0 h ALA 51 CO 0.43 0.23 0.49 -0.22 0.00 0.00 0.00 179.25 180.18 1ns0 h LYS 52 N 0.92 0.63 -0.78 0.00 3.64 -1.89 -1.62 116.57 117.46 1ns0 h LYS 52 Ca 0.38 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.68 1ns0 h LYS 52 Cb 0.22 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 1ns0 h LYS 52 CO -0.19 0.42 0.32 0.93 -2.27 0.00 0.00 179.45 178.65 1ns0 h GLU 53 N 0.65 1.17 -0.30 1.90 5.08 -1.86 0.57 114.58 121.79 1ns0 h GLU 53 Ca 0.35 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1ns0 h GLU 53 Cb 0.49 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1ns0 h GLU 53 CO -0.13 0.94 0.11 1.88 -1.00 0.00 0.00 179.01 180.82 1ns0 h TYR 54 N 1.13 0.45 -0.21 4.33 -1.99 -1.34 0.95 116.97 120.30 1ns0 h TYR 54 Ca 0.26 -0.04 -0.08 0.00 2.00 0.00 0.00 58.73 60.87 1ns0 h TYR 54 Cb 0.21 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 38.79 1ns0 h TYR 54 CO 0.02 0.45 -0.24 -0.07 -0.00 0.00 0.00 178.16 178.32 1ns0 h LEU 55 N 0.33 0.38 0.00 3.88 3.38 -0.95 -1.78 115.31 120.55 1ns0 h LEU 55 Ca 0.10 -0.12 -0.29 0.00 0.09 0.00 0.00 57.88 57.65 1ns0 h LEU 55 Cb 0.19 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 1ns0 h LEU 55 CO -0.01 0.62 -1.96 -0.62 0.09 0.00 0.00 178.44 176.56 1ns0 n GLU 56 N -4.14 0.66 -0.05 1.13 1.02 0.19 -4.75 120.64 114.70 1ns0 n GLU 56 Ca -0.00 0.14 -0.04 0.00 -0.02 0.00 0.00 57.16 57.24 1ns0 n GLU 56 Cb 0.38 -1.67 -0.01 0.00 -0.02 0.00 0.00 31.44 30.12 1ns0 n GLU 56 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ns0 n LYS 57 N -2.87 0.29 -3.54 3.49 5.02 0.33 -5.00 118.16 115.88 1ns0 n LYS 57 Ca -0.22 0.29 -0.03 0.00 -2.02 0.00 0.00 58.31 56.33 1ns0 n LYS 57 Cb 1.05 -1.20 -0.06 0.00 -0.02 0.00 0.00 35.03 34.80 1ns0 n LYS 57 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ns0 s ASP 58 N -4.96 -0.77 0.00 4.39 -1.08 -1.07 -5.02 116.67 108.16 1ns0 s ASP 58 Ca -0.12 1.15 0.30 0.00 -0.52 0.00 0.00 52.55 53.36 1ns0 s ASP 58 Cb 0.02 1.87 1.60 0.00 -1.46 0.00 0.00 42.92 44.94 1ns0 s ASP 58 CO 0.18 -0.24 2.05 0.00 0.52 0.00 0.00 175.17 177.69 1ns0 n ALA 59 N 5.42 2.65 -0.01 3.66 0.00 -0.69 -4.21 120.51 127.33 1ns0 n ALA 59 Ca -0.08 -0.28 -0.12 0.00 0.00 0.00 0.00 53.44 52.96 1ns0 n ALA 59 Cb 0.50 -1.39 -0.14 0.00 0.00 0.00 0.00 19.45 18.41 1ns0 n ALA 59 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ns0 n TYR 60 N -0.60 1.08 -1.67 0.00 4.02 -1.26 -4.77 117.16 113.96 1ns0 n TYR 60 Ca 0.22 0.34 -0.55 0.00 -0.01 0.00 0.00 57.90 57.90 1ns0 n TYR 60 Cb 0.19 -1.18 -0.07 0.00 -0.02 0.00 0.00 39.34 38.26 1ns0 n TYR 60 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1ns0 n PRO 61 N -3.16 1.24 -0.81 -0.72 -0.02 -1.26 -1.11 135.00 129.16 1ns0 n PRO 61 Ca -0.21 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1ns0 n PRO 61 Cb 1.05 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 1ns0 n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ns0 n GLY 62 N 3.68 0.43 3.83 -1.23 0.00 -0.42 -4.83 105.19 106.65 1ns0 n GLY 62 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1ns0 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ns0 s ALA 63 N -2.22 2.74 -0.19 4.61 0.00 -0.27 -1.13 121.76 125.30 1ns0 s ALA 63 Ca 0.00 -0.02 -0.22 0.00 0.00 0.00 0.00 51.96 51.72 1ns0 s ALA 63 Cb 0.00 -3.13 -0.02 0.00 0.00 0.00 0.00 23.12 19.96 1ns0 s ALA 63 CO 0.00 -1.15 0.68 0.99 0.00 0.00 0.00 175.76 176.28 1ns0 s THR 64 N -3.11 4.99 0.03 0.00 2.01 -0.22 -0.52 115.64 118.82 1ns0 s THR 64 Ca 0.58 1.29 0.08 0.00 0.31 0.00 0.00 61.69 63.95 1ns0 s THR 64 Cb -0.13 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.36 1ns0 s THR 64 CO 0.54 0.09 -0.23 0.68 -0.69 0.00 0.00 174.62 175.02 1ns0 s VAL 65 N 1.95 2.38 -3.67 3.82 -7.23 -0.09 -3.68 120.40 113.86 1ns0 s VAL 65 Ca 0.31 -1.27 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 1ns0 s VAL 65 Cb -0.16 -1.94 0.00 0.00 0.56 0.00 0.00 36.38 34.84 1ns0 s VAL 65 CO 0.11 0.39 0.00 0.61 -0.31 0.00 0.00 175.10 175.90 1ns0 n GLY 66 N 1.79 -0.53 0.34 2.32 0.00 -1.26 -1.41 105.19 106.45 1ns0 n GLY 66 Ca -0.17 -0.89 0.19 0.00 0.00 0.00 0.00 46.02 45.15 1ns0 n GLY 66 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ns0 h PRO 67 N 0.00 0.00 -4.86 1.61 0.11 -1.84 -3.29 132.00 123.72 1ns0 h PRO 67 Ca 0.00 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.48 1ns0 h PRO 67 Cb 0.00 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 30.76 1ns0 h PRO 67 CO 0.00 0.00 -0.85 0.95 -0.21 0.00 0.00 178.00 177.89 1ns0 s THR 68 N -4.30 1.76 0.19 -1.15 -4.23 -1.26 -0.24 115.64 106.42 1ns0 s THR 68 Ca -0.04 -0.76 -0.25 0.00 -1.18 0.00 0.00 61.69 59.46 1ns0 s THR 68 Cb 0.12 -1.61 -0.08 0.00 1.34 0.00 0.00 72.50 72.27 1ns0 s THR 68 CO 0.41 0.49 0.79 0.00 -0.54 0.00 0.00 174.62 175.77 1ns0 s ALA 69 N 1.25 3.42 0.00 3.99 0.00 0.86 -2.30 121.76 128.98 1ns0 s ALA 69 Ca 0.01 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1ns0 s ALA 69 Cb -0.14 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.02 1ns0 s ALA 69 CO -0.08 0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.37 1ns0 n GLY 70 N 1.35 -1.76 3.81 0.00 0.00 -1.26 -4.72 105.19 102.61 1ns0 n GLY 70 Ca -0.04 -1.95 -0.37 0.00 0.00 0.00 0.00 46.02 43.66 1ns0 n GLY 70 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ns0 s ARG 71 N 0.00 3.90 -0.26 1.61 0.52 -1.26 -1.64 118.95 121.82 1ns0 s ARG 71 Ca 0.00 0.14 -0.03 0.00 -0.52 0.00 0.00 55.73 55.32 1ns0 s ARG 71 Cb 0.00 -3.29 0.02 0.00 0.52 0.00 0.00 34.95 32.21 1ns0 s ARG 71 CO 0.00 0.55 -0.03 0.42 0.02 0.00 0.00 175.30 176.27 1ns0 s ILE 72 N -0.50 3.12 -0.03 1.52 1.01 0.21 -4.31 121.20 122.22 1ns0 s ILE 72 Ca 0.18 -0.96 -0.36 0.00 0.00 0.00 0.00 60.65 59.52 1ns0 s ILE 72 Cb -0.14 -2.60 -0.14 0.00 0.01 0.00 0.00 42.46 39.59 1ns0 s ILE 72 CO 0.07 0.16 1.68 1.17 0.00 0.00 0.00 174.94 178.03 1ns0 n LYS 73 N 4.71 1.81 -1.44 2.79 4.81 -1.26 -1.48 118.16 128.09 1ns0 n LYS 73 Ca -0.16 0.66 -0.16 0.00 -0.87 0.00 0.00 58.31 57.78 1ns0 n LYS 73 Cb 0.47 -2.42 -0.07 0.00 0.02 0.00 0.00 35.03 33.04 1ns0 n LYS 73 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1ns0 n ASP 74 N 4.83 -4.50 -1.71 3.14 8.00 -1.12 -2.25 116.55 122.94 1ns0 n ASP 74 Ca 0.21 0.39 -0.19 0.00 0.71 0.00 0.00 54.79 55.91 1ns0 n ASP 74 Cb 0.24 -3.96 -0.07 0.00 -0.02 0.00 0.00 41.12 37.31 1ns0 n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ns0 n GLY 75 N -0.23 1.39 3.57 0.44 0.00 -0.55 -4.85 105.19 104.95 1ns0 n GLY 75 Ca -0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 1ns0 n GLY 75 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ns0 s LEU 76 N -4.78 3.86 0.15 0.99 2.96 -0.96 -0.46 118.68 120.45 1ns0 s LEU 76 Ca 0.00 -0.03 0.07 0.00 -0.22 0.00 0.00 54.13 53.95 1ns0 s LEU 76 Cb 0.00 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 1ns0 s LEU 76 CO 0.00 -0.00 -0.16 0.68 -1.32 0.00 0.00 176.35 175.55 1ns0 s VAL 77 N 1.46 1.59 -0.26 1.68 -7.23 -0.62 -4.81 120.40 112.20 1ns0 s VAL 77 Ca 0.07 -1.89 -0.03 0.00 -1.81 0.00 0.00 61.98 58.31 1ns0 s VAL 77 Cb -0.15 -1.76 0.03 0.00 0.56 0.00 0.00 36.38 35.06 1ns0 s VAL 77 CO 0.07 -0.41 -0.02 -0.54 -0.31 0.00 0.00 175.10 173.88 1ns0 s LYS 78 N -2.92 2.84 -0.23 4.82 1.02 -1.26 0.02 119.74 124.03 1ns0 s LYS 78 Ca 0.14 -0.99 -0.01 0.00 0.02 0.00 0.00 55.97 55.13 1ns0 s LYS 78 Cb -0.04 -3.09 0.02 0.00 -0.52 0.00 0.00 37.83 34.19 1ns0 s LYS 78 CO 0.05 -0.44 -0.08 0.42 -0.92 0.00 0.00 175.35 174.38 1ns0 s ILE 79 N 1.35 2.82 -1.14 2.17 1.01 0.70 -4.71 121.20 123.40 1ns0 s ILE 79 Ca -0.00 -0.93 -0.26 0.00 0.00 0.00 0.00 60.65 59.46 1ns0 s ILE 79 Cb -0.17 -2.37 0.02 0.00 0.01 0.00 0.00 42.46 39.95 1ns0 s ILE 79 CO -0.03 0.29 0.71 -1.20 0.00 0.00 0.00 174.94 174.72 1ns0 n SER 80 N 4.68 -4.70 0.00 3.58 7.64 -1.26 0.03 113.62 123.58 1ns0 n SER 80 Ca -0.17 -1.15 0.00 0.00 1.01 0.00 0.00 58.87 58.56 1ns0 n SER 80 Cb 0.48 -2.31 0.00 0.00 -1.01 0.00 0.00 64.21 61.37 1ns0 n SER 80 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ns0 n GLY 81 N -1.91 1.04 3.61 0.23 0.00 -1.26 -4.97 105.19 101.94 1ns0 n GLY 81 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 1ns0 n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ns0 s LYS 82 N -0.25 2.51 -0.02 1.61 1.02 0.10 -5.09 119.74 119.63 1ns0 s LYS 82 Ca 0.00 -0.77 -0.18 0.00 0.02 0.00 0.00 55.97 55.03 1ns0 s LYS 82 Cb 0.00 -2.49 -0.05 0.00 -0.52 0.00 0.00 37.83 34.76 1ns0 s LYS 82 CO 0.00 0.58 0.51 -0.51 -0.92 0.00 0.00 175.35 175.01 1ns0 s ASP 83 N -1.68 6.87 0.01 2.83 1.01 -1.26 0.25 116.67 124.70 1ns0 s ASP 83 Ca 0.19 1.04 0.04 0.00 0.71 0.00 0.00 52.55 54.53 1ns0 s ASP 83 Cb -0.11 -2.32 -0.01 0.00 1.01 0.00 0.00 42.92 41.49 1ns0 s ASP 83 CO 0.10 0.16 -0.13 -0.31 0.21 0.00 0.00 175.17 175.20 1ns0 s TYR 84 N -0.35 1.18 -0.21 4.23 1.51 0.10 -4.92 117.35 118.90 1ns0 s TYR 84 Ca 0.28 -0.27 -0.05 0.00 -1.01 0.00 0.00 57.07 56.02 1ns0 s TYR 84 Cb -0.17 -0.73 -0.02 0.00 -0.11 0.00 0.00 41.96 40.92 1ns0 s TYR 84 CO 0.15 0.00 -0.01 0.42 -1.11 0.00 0.00 175.55 175.00 1ns0 s ILE 85 N -0.51 3.78 0.42 2.71 1.01 -1.26 -1.60 121.20 125.75 1ns0 s ILE 85 Ca 0.04 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.32 1ns0 s ILE 85 Cb -0.06 -2.71 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1ns0 s ILE 85 CO 0.00 0.42 0.63 -0.76 0.00 0.00 0.00 174.94 175.24 1ns0 s LEU 86 N 1.15 3.76 0.23 2.97 1.43 0.39 -4.64 118.68 123.97 1ns0 s LEU 86 Ca 0.02 0.31 -0.31 0.00 -1.03 0.00 0.00 54.13 53.13 1ns0 s LEU 86 Cb -0.14 -3.19 -0.14 0.00 0.03 0.00 0.00 46.19 42.74 1ns0 s LEU 86 CO 0.01 -0.58 1.33 -3.20 0.23 0.00 0.00 176.35 174.14 1ns0 n ASN 87 N -1.98 2.38 -4.32 2.29 2.85 0.49 -4.75 115.26 112.22 1ns0 n ASN 87 Ca -0.00 1.15 -0.37 0.00 -0.11 0.00 0.00 54.58 55.25 1ns0 n ASN 87 Cb 0.57 -1.38 -0.13 0.00 1.24 0.00 0.00 39.78 40.09 1ns0 n ASN 87 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1ns0 s GLN 88 N -0.50 3.04 0.00 1.20 -0.21 -1.26 -4.25 119.66 117.68 1ns0 s GLN 88 Ca 0.68 -0.88 0.05 0.00 0.02 0.00 0.00 55.36 55.23 1ns0 s GLN 88 Cb -0.69 -3.31 0.04 0.00 1.00 0.00 0.00 33.01 30.05 1ns0 s GLN 88 CO 0.51 -0.44 0.64 0.27 -2.12 0.00 0.00 175.29 174.15 1ns0 n ASN 89 N 4.83 1.37 -3.53 5.90 6.94 0.47 -4.80 115.26 126.44 1ns0 n ASN 89 Ca -0.15 -1.18 -0.29 0.00 -0.02 0.00 0.00 54.58 52.94 1ns0 n ASN 89 Cb 0.48 0.04 -0.12 0.00 -2.36 0.00 0.00 39.78 37.81 1ns0 n ASN 89 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 1ns0 s GLU 90 N -0.45 0.87 6.16 -3.83 2.12 0.66 -4.92 118.70 119.32 1ns0 s GLU 90 Ca 0.06 -1.71 0.00 0.00 0.36 0.00 0.00 54.97 53.68 1ns0 s GLU 90 Cb 0.04 -1.66 0.00 0.00 0.26 0.00 0.00 34.13 32.77 1ns0 s GLU 90 CO 0.07 -1.23 0.00 0.41 -0.54 0.00 0.00 175.26 173.97 1ns0 n GLY 91 N 3.64 2.86 0.09 -1.50 0.00 -1.26 -0.12 105.19 108.90 1ns0 n GLY 91 Ca 0.14 -0.37 0.12 0.00 0.00 0.00 0.00 46.02 45.91 1ns0 n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ns0 n PRO 92 N 13.81 1.12 -3.42 1.61 -0.04 -1.26 -4.83 135.00 141.99 1ns0 n PRO 92 Ca 0.00 -0.18 -0.32 0.00 -0.04 0.00 0.00 63.50 62.96 1ns0 n PRO 92 Cb 0.00 -1.38 -0.05 0.00 -0.04 0.00 0.00 33.50 32.03 1ns0 n PRO 92 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1ns0 s GLN 93 N -1.98 3.80 -0.36 0.54 1.11 0.83 -2.16 119.66 121.44 1ns0 s GLN 93 Ca 0.35 0.27 -0.11 0.00 0.01 0.00 0.00 55.36 55.88 1ns0 s GLN 93 Cb 0.17 -2.66 0.01 0.00 -1.01 0.00 0.00 33.01 29.52 1ns0 s GLN 93 CO 0.28 0.33 0.21 0.99 0.01 0.00 0.00 175.29 177.10 1ns0 s THR 94 N -1.80 4.74 -0.16 -0.19 2.01 -1.13 -0.25 115.64 118.87 1ns0 s THR 94 Ca 0.47 -0.67 -0.03 0.00 0.31 0.00 0.00 61.69 61.77 1ns0 s THR 94 Cb -0.11 -3.57 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 1ns0 s THR 94 CO 0.21 -0.15 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.72 1ns0 s LEU 95 N 1.60 3.14 -1.43 4.42 2.96 -1.26 -0.62 118.68 127.49 1ns0 s LEU 95 Ca 0.03 -0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 53.70 1ns0 s LEU 95 Cb -0.18 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.76 1ns0 s LEU 95 CO 0.07 0.15 0.28 1.41 -1.32 0.00 0.00 176.35 176.94 1ns0 n HIS 96 N 3.68 -1.44 -0.99 5.38 8.25 -0.65 -1.71 115.22 127.73 1ns0 n HIS 96 Ca -0.17 0.57 0.00 0.00 -0.26 0.00 0.00 57.72 57.85 1ns0 n HIS 96 Cb 0.52 -3.15 0.00 0.00 1.12 0.00 0.00 29.99 28.49 1ns0 n HIS 96 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ns0 n GLY 97 N -2.27 0.50 0.34 -1.41 0.00 -0.97 -4.23 105.19 97.16 1ns0 n GLY 97 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1ns0 n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ns0 n GLY 98 N -2.35 -3.44 3.78 -0.02 0.00 -0.70 -4.73 105.19 97.73 1ns0 n GLY 98 Ca 0.00 -1.99 -0.34 0.00 0.00 0.00 0.00 46.02 43.69 1ns0 n GLY 98 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ns0 s GLU 99 N -0.75 3.21 -1.49 1.61 -1.05 -1.26 -3.52 118.70 115.46 1ns0 s GLU 99 Ca 0.00 1.50 -0.02 0.00 -0.15 0.00 0.00 54.97 56.30 1ns0 s GLU 99 Cb 0.00 -2.00 0.02 0.00 -0.44 0.00 0.00 34.13 31.71 1ns0 s GLU 99 CO 0.00 -0.94 0.30 0.39 0.95 0.00 0.00 175.26 175.96 1ns0 n GLU 100 N -1.67 -2.42 0.00 -4.83 -0.58 -1.26 -4.94 120.64 104.94 1ns0 n GLU 100 Ca 0.11 0.29 0.00 0.00 -0.42 0.00 0.00 57.16 57.14 1ns0 n GLU 100 Cb 0.51 -4.25 0.00 0.00 -0.57 0.00 0.00 31.44 27.14 1ns0 n GLU 100 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1ns0 n SER 101 N -2.92 -0.01 0.06 1.62 2.88 -1.23 -4.82 113.62 109.21 1ns0 n SER 101 Ca -0.28 -0.96 0.21 0.00 -1.33 0.00 0.00 58.87 56.50 1ns0 n SER 101 Cb 0.67 0.00 0.74 0.00 -0.75 0.00 0.00 64.21 64.87 1ns0 n SER 101 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1ns0 h ILE 102 N -0.96 0.48 0.00 2.46 3.07 -1.89 0.97 117.51 121.64 1ns0 h ILE 102 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 1ns0 h ILE 102 Cb 0.00 0.68 0.00 0.00 -0.27 0.00 0.00 36.82 37.23 1ns0 h ILE 102 CO 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.10 1ns0 n HIS 103 N -3.92 0.14 0.78 0.16 1.44 -1.24 -2.79 115.22 109.78 1ns0 n HIS 103 Ca 0.08 0.05 0.09 0.00 -2.01 0.00 0.00 57.72 55.93 1ns0 n HIS 103 Cb 0.61 -0.58 0.07 0.00 0.12 0.00 0.00 29.99 30.21 1ns0 n HIS 103 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1ns0 n THR 104 N -1.62 0.00 -3.96 0.61 -2.24 0.33 -3.64 114.28 103.77 1ns0 n THR 104 Ca 0.04 -0.47 -0.24 0.00 -2.27 0.00 0.00 64.05 61.11 1ns0 n THR 104 Cb 0.22 1.36 -0.03 0.00 -2.10 0.00 0.00 70.33 69.78 1ns0 n THR 104 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ns0 s LYS 105 N -1.63 3.44 -0.32 -0.78 -0.14 -1.12 -4.83 119.74 114.35 1ns0 s LYS 105 Ca 0.21 -0.66 -0.25 0.00 -1.36 0.00 0.00 55.97 53.90 1ns0 s LYS 105 Cb 0.15 -2.93 0.01 0.00 -1.68 0.00 0.00 37.83 33.38 1ns0 s LYS 105 CO 0.27 0.48 0.88 -0.51 -0.76 0.00 0.00 175.35 175.71 1ns0 s LEU 106 N -3.53 4.04 0.31 3.17 1.43 -1.26 -0.76 118.68 122.08 1ns0 s LEU 106 Ca 0.34 0.73 -0.04 0.00 -1.03 0.00 0.00 54.13 54.13 1ns0 s LEU 106 Cb -0.10 -3.22 -0.05 0.00 0.03 0.00 0.00 46.19 42.85 1ns0 s LEU 106 CO 0.29 -0.73 0.57 0.26 0.23 0.00 0.00 176.35 176.97 1ns0 s TRP 107 N 3.22 3.48 0.63 0.29 0.52 0.17 -4.98 118.94 122.27 1ns0 s TRP 107 Ca 0.36 0.63 -0.07 0.00 0.02 0.00 0.00 56.10 57.04 1ns0 s TRP 107 Cb -0.13 -2.10 0.01 0.00 -1.15 0.00 0.00 33.47 30.10 1ns0 s TRP 107 CO 0.14 0.13 0.96 0.95 0.02 0.00 0.00 176.95 179.15 1ns0 s THR 108 N -2.16 3.57 0.13 2.01 -4.23 -0.83 -4.81 115.64 109.31 1ns0 s THR 108 Ca 0.44 0.13 -0.23 0.00 -1.18 0.00 0.00 61.69 60.85 1ns0 s THR 108 Cb -0.10 -3.45 0.06 0.00 1.34 0.00 0.00 72.50 70.35 1ns0 s THR 108 CO 0.32 -0.50 0.57 -0.72 -0.54 0.00 0.00 174.62 173.75 1ns0 s TYR 109 N -3.10 -0.50 -0.01 3.99 -0.85 -1.26 -0.30 117.35 115.32 1ns0 s TYR 109 Ca 0.55 0.35 0.02 0.00 -0.52 0.00 0.00 57.07 57.47 1ns0 s TYR 109 Cb -0.11 0.49 -0.00 0.00 0.38 0.00 0.00 41.96 42.72 1ns0 s TYR 109 CO 0.47 -0.79 -0.06 -1.21 -1.52 0.00 0.00 175.55 172.44 1ns0 s GLU 110 N -3.44 0.51 -0.17 -3.49 2.02 -0.73 -5.00 118.70 108.39 1ns0 s GLU 110 Ca -0.00 -0.21 -0.07 0.00 0.02 0.00 0.00 54.97 54.70 1ns0 s GLU 110 Cb -0.00 -0.50 -0.04 0.00 0.10 0.00 0.00 34.13 33.69 1ns0 s GLU 110 CO -0.10 0.12 0.06 0.08 0.02 0.00 0.00 175.26 175.45 1ns0 s VAL 111 N -0.10 4.80 -0.21 2.63 1.01 -1.26 -1.60 120.40 125.66 1ns0 s VAL 111 Ca 0.02 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.98 1ns0 s VAL 111 Cb -0.03 -3.15 0.04 0.00 0.00 0.00 0.00 36.38 33.24 1ns0 s VAL 111 CO -0.00 0.48 -0.16 -0.89 0.00 0.00 0.00 175.10 174.52 1ns0 s THR 112 N 0.23 2.11 -0.42 3.92 2.01 0.72 -4.97 115.64 119.23 1ns0 s THR 112 Ca 0.04 -1.24 -0.23 0.00 0.31 0.00 0.00 61.69 60.58 1ns0 s THR 112 Cb -0.12 -2.04 0.02 0.00 0.01 0.00 0.00 72.50 70.37 1ns0 s THR 112 CO 0.00 0.30 0.76 -0.62 -0.69 0.00 0.00 174.62 174.37 1ns0 s ASP 113 N 1.21 6.44 -0.06 3.53 -1.08 -1.26 -0.91 116.67 124.54 1ns0 s ASP 113 Ca -0.01 0.00 0.16 0.00 -0.52 0.00 0.00 52.55 52.18 1ns0 s ASP 113 Cb -0.16 -2.38 0.51 0.00 -1.46 0.00 0.00 42.92 39.44 1ns0 s ASP 113 CO -0.10 -0.84 1.43 0.18 0.52 0.00 0.00 175.17 176.37 1ns0 n LEU 114 N 6.56 3.75 0.00 -1.34 4.77 0.14 -5.01 117.00 125.86 1ns0 n LEU 114 Ca 0.02 -2.27 0.00 0.00 -0.03 0.00 0.00 56.01 53.73 1ns0 n LEU 114 Cb 0.48 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1ns0 n LEU 114 CO 0.56 0.79 0.00 0.61 -1.33 0.00 0.00 177.39 178.03 1ns0 n GLY 115 N 0.73 1.20 0.00 -0.72 0.00 -1.26 -4.02 105.19 101.12 1ns0 n GLY 115 Ca 0.19 -0.45 0.14 0.00 0.00 0.00 0.00 46.02 45.91 1ns0 n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ns0 n ALA 116 N 1.54 2.42 -3.02 4.61 0.00 -1.26 -4.73 120.51 120.07 1ns0 n ALA 116 Ca 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 53.44 53.19 1ns0 n ALA 116 Cb 0.00 -1.48 -0.14 0.00 0.00 0.00 0.00 19.45 17.83 1ns0 n ALA 116 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ns0 s GLU 117 N -2.72 -0.01 -0.07 0.00 2.12 -1.26 -0.68 118.70 116.08 1ns0 s GLU 117 Ca 0.23 0.03 0.04 0.00 0.36 0.00 0.00 54.97 55.63 1ns0 s GLU 117 Cb 0.20 -0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.55 1ns0 s GLU 117 CO 0.48 -0.03 -0.18 0.08 -0.54 0.00 0.00 175.26 175.07 1ns0 s VAL 118 N 0.18 1.58 -0.05 3.70 1.01 -0.70 0.23 120.40 126.35 1ns0 s VAL 118 Ca -0.01 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.24 1ns0 s VAL 118 Cb -0.02 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1ns0 s VAL 118 CO -0.00 0.45 -0.13 -1.10 0.00 0.00 0.00 175.10 174.32 1ns0 s GLN 119 N 0.33 2.54 -0.25 2.72 -0.21 -0.09 -1.98 119.66 122.73 1ns0 s GLN 119 Ca -0.12 -0.67 0.01 0.00 0.02 0.00 0.00 55.36 54.60 1ns0 s GLN 119 Cb -0.15 -2.42 0.07 0.00 1.00 0.00 0.00 33.01 31.50 1ns0 s GLN 119 CO 0.05 0.63 -0.04 0.08 -2.12 0.00 0.00 175.29 173.89 1ns0 s VAL 120 N -0.76 1.60 -0.32 1.09 1.01 0.46 -0.20 120.40 123.28 1ns0 s VAL 120 Ca 0.12 -1.35 -0.11 0.00 0.00 0.00 0.00 61.98 60.64 1ns0 s VAL 120 Cb -0.11 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 1ns0 s VAL 120 CO 0.01 -0.16 0.18 -0.75 0.00 0.00 0.00 175.10 174.38 1ns0 s LYS 121 N 1.34 3.38 -0.07 2.72 2.20 -0.63 -0.21 119.74 128.47 1ns0 s LYS 121 Ca -0.04 -0.70 -0.07 0.00 -0.36 0.00 0.00 55.97 54.80 1ns0 s LYS 121 Cb -0.19 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.45 1ns0 s LYS 121 CO -0.07 -0.43 0.19 -0.06 -0.36 0.00 0.00 175.35 174.62 1ns0 s PHE 122 N 1.65 3.60 0.06 4.03 0.40 0.38 -1.78 117.98 126.32 1ns0 s PHE 122 Ca 0.05 0.54 0.05 0.00 -0.60 0.00 0.00 56.93 56.97 1ns0 s PHE 122 Cb -0.17 -1.96 -0.03 0.00 0.51 0.00 0.00 43.02 41.38 1ns0 s PHE 122 CO 0.08 0.69 -0.13 -1.12 0.70 0.00 0.00 175.22 175.44 1ns0 s SER 123 N -1.31 1.55 -0.12 1.36 0.01 0.59 -0.35 113.70 115.42 1ns0 s SER 123 Ca 0.20 -0.56 -0.30 0.00 1.31 0.00 0.00 55.95 56.60 1ns0 s SER 123 Cb -0.13 -0.05 0.09 0.00 0.21 0.00 0.00 66.02 66.14 1ns0 s SER 123 CO 0.09 -0.07 0.80 -0.22 0.41 0.00 0.00 173.24 174.25 1ns0 s LEU 124 N -1.56 -0.57 -0.20 2.44 2.96 -0.70 -1.96 118.68 119.08 1ns0 s LEU 124 Ca -0.02 0.72 -0.03 0.00 -0.22 0.00 0.00 54.13 54.57 1ns0 s LEU 124 Cb -0.09 2.30 -0.01 0.00 0.50 0.00 0.00 46.19 48.88 1ns0 s LEU 124 CO 0.02 -0.47 -0.06 -0.69 -1.32 0.00 0.00 176.35 173.83 1ns0 s VAL 125 N -0.91 3.37 -0.43 1.68 1.01 -1.26 -0.65 120.40 123.20 1ns0 s VAL 125 Ca -0.06 -0.51 -0.21 0.00 0.00 0.00 0.00 61.98 61.20 1ns0 s VAL 125 Cb -0.01 -2.51 0.02 0.00 0.00 0.00 0.00 36.38 33.89 1ns0 s VAL 125 CO 0.06 0.45 0.65 -0.55 0.00 0.00 0.00 175.10 175.70 1ns0 s SER 126 N 1.17 6.33 0.76 3.32 0.15 0.36 -4.94 113.70 120.86 1ns0 s SER 126 Ca 0.02 -0.30 -0.13 0.00 0.70 0.00 0.00 55.95 56.24 1ns0 s SER 126 Cb -0.14 -2.32 0.06 0.00 -1.71 0.00 0.00 66.02 61.90 1ns0 s SER 126 CO -0.01 -0.77 1.16 0.20 1.20 0.00 0.00 173.24 175.01 1ns0 s ASN 127 N 1.99 4.14 0.26 5.45 -0.87 -1.26 -0.29 114.94 124.36 1ns0 s ASN 127 Ca 0.23 2.17 -0.31 0.00 -1.57 0.00 0.00 52.86 53.38 1ns0 s ASN 127 Cb -0.14 -2.57 -0.12 0.00 -0.02 0.00 0.00 41.25 38.40 1ns0 s ASN 127 CO 0.19 -2.29 1.58 -0.67 -2.57 0.00 0.00 177.10 173.34 1ns0 n ASP 128 N -3.12 3.63 0.00 -1.22 4.64 -1.26 -1.78 116.55 117.43 1ns0 n ASP 128 Ca 0.12 1.13 0.00 0.00 -1.38 0.00 0.00 54.79 54.66 1ns0 n ASP 128 Cb 0.51 -1.55 0.00 0.00 -1.04 0.00 0.00 41.12 39.04 1ns0 n ASP 128 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1ns0 n GLY 129 N 2.52 1.65 3.67 0.27 0.00 0.68 -4.82 105.19 109.16 1ns0 n GLY 129 Ca 0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.69 1ns0 n GLY 129 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ns0 n THR 130 N -2.00 0.69 -1.48 2.61 -1.04 -0.74 -1.28 114.28 111.04 1ns0 n THR 130 Ca 0.00 -0.12 -0.17 0.00 -2.04 0.00 0.00 64.05 61.72 1ns0 n THR 130 Cb 0.00 -2.18 -0.07 0.00 -1.82 0.00 0.00 70.33 66.25 1ns0 n THR 130 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1ns0 n ASN 131 N 7.15 -5.36 0.00 8.00 4.13 -1.26 -1.44 115.26 126.47 1ns0 n ASN 131 Ca 0.21 0.41 0.00 0.00 1.68 0.00 0.00 54.58 56.88 1ns0 n ASN 131 Cb 0.37 -4.47 0.00 0.00 -1.54 0.00 0.00 39.78 34.15 1ns0 n ASN 131 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ns0 n GLY 132 N -0.15 0.80 3.71 7.41 0.00 -0.41 -0.38 105.19 116.18 1ns0 n GLY 132 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1ns0 n GLY 132 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ns0 s TYR 133 N -2.54 3.64 0.43 1.61 1.51 -0.52 -4.79 117.35 116.68 1ns0 s TYR 133 Ca 0.00 1.64 -0.25 0.00 -1.01 0.00 0.00 57.07 57.45 1ns0 s TYR 133 Cb 0.00 -3.09 -0.08 0.00 -0.11 0.00 0.00 41.96 38.68 1ns0 s TYR 133 CO 0.00 -0.02 1.26 -2.14 -1.11 0.00 0.00 175.55 173.54 1ns0 s PRO 134 N 1.08 3.85 0.00 -1.71 0.02 -1.26 -0.23 135.00 136.75 1ns0 s PRO 134 Ca 0.50 2.04 0.00 0.00 0.02 0.00 0.00 61.00 63.56 1ns0 s PRO 134 Cb -0.20 -2.62 0.00 0.00 0.02 0.00 0.00 34.50 31.70 1ns0 s PRO 134 CO 0.26 -0.56 0.00 0.41 -0.33 0.00 0.00 177.00 176.78 1ns0 n GLY 135 N 0.63 3.81 3.81 0.52 0.00 -1.26 -4.73 105.19 107.97 1ns0 n GLY 135 Ca 0.05 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 1ns0 n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ns0 s LYS 136 N 2.47 2.80 -0.19 1.61 -2.85 -1.26 -3.57 119.74 118.75 1ns0 s LYS 136 Ca 0.00 0.98 0.01 0.00 -1.00 0.00 0.00 55.97 55.96 1ns0 s LYS 136 Cb 0.00 -1.97 0.02 0.00 -2.06 0.00 0.00 37.83 33.82 1ns0 s LYS 136 CO 0.00 -1.21 -0.19 0.42 0.10 0.00 0.00 175.35 174.47 1ns0 s ILE 137 N -3.03 2.08 -0.40 3.79 1.01 0.60 -1.60 121.20 123.65 1ns0 s ILE 137 Ca 0.59 -1.00 -0.19 0.00 0.00 0.00 0.00 60.65 60.05 1ns0 s ILE 137 Cb -0.15 -1.90 0.01 0.00 0.01 0.00 0.00 42.46 40.44 1ns0 s ILE 137 CO 0.55 0.49 0.56 -1.61 0.00 0.00 0.00 174.94 174.93 1ns0 s GLU 138 N 1.28 3.36 0.13 2.79 2.02 0.79 -0.49 118.70 128.58 1ns0 s GLU 138 Ca 0.04 -0.37 0.07 0.00 0.02 0.00 0.00 54.97 54.72 1ns0 s GLU 138 Cb -0.14 -3.90 -0.04 0.00 0.10 0.00 0.00 34.13 30.15 1ns0 s GLU 138 CO -0.12 -0.85 -0.06 -1.64 0.02 0.00 0.00 175.26 172.61 1ns0 s MET 139 N 2.53 2.26 -0.09 1.61 -1.94 0.17 -2.19 119.30 121.66 1ns0 s MET 139 Ca 0.19 -1.04 -0.08 0.00 -1.71 0.00 0.00 55.69 53.05 1ns0 s MET 139 Cb -0.15 -2.34 0.02 0.00 2.01 0.00 0.00 34.83 34.37 1ns0 s MET 139 CO 0.16 0.49 0.23 -1.54 -0.01 0.00 0.00 175.02 174.35 1ns0 s SER 140 N -2.49 -0.24 -0.16 3.03 1.04 0.04 -1.72 113.70 113.20 1ns0 s SER 140 Ca 0.24 0.47 0.00 0.00 0.48 0.00 0.00 55.95 57.14 1ns0 s SER 140 Cb -0.10 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.52 1ns0 s SER 140 CO 0.16 -0.08 -0.10 -0.69 0.98 0.00 0.00 173.24 173.50 1ns0 s VAL 141 N 0.17 1.43 -0.26 5.02 1.01 0.52 -1.12 120.40 127.18 1ns0 s VAL 141 Ca -0.00 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 1ns0 s VAL 141 Cb -0.02 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 1ns0 s VAL 141 CO -0.00 0.28 0.10 -0.89 0.00 0.00 0.00 175.10 174.59 1ns0 s THR 142 N 1.51 4.51 -0.16 3.92 2.01 -0.06 -0.47 115.64 126.91 1ns0 s THR 142 Ca 0.02 -0.11 -0.06 0.00 0.31 0.00 0.00 61.69 61.85 1ns0 s THR 142 Cb -0.14 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 1ns0 s THR 142 CO -0.09 0.31 0.04 -1.00 -0.69 0.00 0.00 174.62 173.20 1ns0 s HIS 143 N 1.64 3.23 0.06 4.92 3.76 0.70 -1.45 115.29 128.16 1ns0 s HIS 143 Ca 0.06 0.08 0.02 0.00 -0.15 0.00 0.00 55.06 55.07 1ns0 s HIS 143 Cb -0.15 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.51 1ns0 s HIS 143 CO 0.05 0.23 -0.07 -1.54 -0.85 0.00 0.00 174.74 172.56 1ns0 s SER 144 N 0.04 0.96 -0.00 1.40 1.04 0.12 -0.40 113.70 116.85 1ns0 s SER 144 Ca 0.05 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.74 1ns0 s SER 144 Cb -0.12 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.06 1ns0 s SER 144 CO 0.01 -0.32 -0.00 0.12 0.98 0.00 0.00 173.24 174.03 1ns0 s PHE 145 N -2.33 0.07 0.46 5.02 5.36 -0.84 -0.21 117.98 125.51 1ns0 s PHE 145 Ca -0.01 0.00 0.03 0.00 -0.96 0.00 0.00 56.93 55.99 1ns0 s PHE 145 Cb -0.03 -0.08 -0.01 0.00 -0.34 0.00 0.00 43.02 42.56 1ns0 s PHE 145 CO -0.02 -0.02 0.10 0.16 -1.46 0.00 0.00 175.22 173.99 1ns0 s ASP 146 N 0.14 3.30 0.18 6.13 1.47 -1.05 -1.73 116.67 125.12 1ns0 s ASP 146 Ca -0.01 -1.73 0.20 0.00 1.18 0.00 0.00 52.55 52.19 1ns0 s ASP 146 Cb -0.02 0.63 0.86 0.00 -0.34 0.00 0.00 42.92 44.05 1ns0 s ASP 146 CO -0.00 -0.97 1.61 0.47 0.68 0.00 0.00 175.17 176.95 1ns0 n ASP 147 N -1.42 0.45 -1.42 2.11 8.00 0.14 -2.00 116.55 122.42 1ns0 n ASP 147 Ca -0.11 0.62 0.08 0.00 0.71 0.00 0.00 54.79 56.09 1ns0 n ASP 147 Cb 0.65 -0.71 0.31 0.00 -0.02 0.00 0.00 41.12 41.34 1ns0 n ASP 147 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ns0 n ASP 148 N -2.01 4.18 -1.95 -2.24 8.00 -1.26 -4.65 116.55 116.61 1ns0 n ASP 148 Ca 0.02 -2.42 -0.17 0.00 0.71 0.00 0.00 54.79 52.92 1ns0 n ASP 148 Cb 0.18 -0.54 -0.01 0.00 -0.02 0.00 0.00 41.12 40.73 1ns0 n ASP 148 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1ns0 n ASN 149 N 0.86 -5.09 -4.61 -2.24 3.02 -0.84 -4.79 115.26 101.56 1ns0 n ASN 149 Ca 0.22 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.42 1ns0 n ASN 149 Cb 0.80 -4.18 -0.10 0.00 -0.61 0.00 0.00 39.78 35.69 1ns0 n ASN 149 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ns0 s LYS 150 N -4.81 3.95 -0.35 3.52 1.02 -1.26 -2.14 119.74 119.68 1ns0 s LYS 150 Ca 0.00 -0.35 -0.11 0.00 0.02 0.00 0.00 55.97 55.54 1ns0 s LYS 150 Cb 0.00 -3.31 0.01 0.00 -0.52 0.00 0.00 37.83 34.01 1ns0 s LYS 150 CO 0.00 0.15 0.19 -0.46 -0.92 0.00 0.00 175.35 174.31 1ns0 s TRP 151 N 0.73 3.22 -0.01 3.18 -0.00 0.11 -2.53 118.94 123.64 1ns0 s TRP 151 Ca 0.05 -0.78 0.04 0.00 -0.00 0.00 0.00 56.10 55.40 1ns0 s TRP 151 Cb -0.13 -2.41 -0.03 0.00 -0.00 0.00 0.00 33.47 30.89 1ns0 s TRP 151 CO 0.02 -0.57 -0.13 0.21 -0.00 0.00 0.00 176.95 176.48 1ns0 s LYS 152 N 1.58 2.41 -0.19 5.86 2.20 0.71 -1.46 119.74 130.85 1ns0 s LYS 152 Ca 0.03 -0.78 -0.00 0.00 -0.36 0.00 0.00 55.97 54.86 1ns0 s LYS 152 Cb -0.18 -2.37 0.01 0.00 -1.51 0.00 0.00 37.83 33.78 1ns0 s LYS 152 CO 0.07 0.60 -0.16 0.42 -0.36 0.00 0.00 175.35 175.92 1ns0 s ILE 153 N -0.87 2.40 -0.18 5.43 1.01 0.10 0.12 121.20 129.21 1ns0 s ILE 153 Ca 0.14 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.96 1ns0 s ILE 153 Cb -0.11 -2.04 0.03 0.00 0.01 0.00 0.00 42.46 40.35 1ns0 s ILE 153 CO 0.04 0.50 -0.15 -2.28 0.00 0.00 0.00 174.94 173.04 1ns0 s HIS 154 N 1.34 2.52 -0.13 3.97 2.46 -0.53 -1.11 115.29 123.82 1ns0 s HIS 154 Ca 0.05 -1.53 -0.07 0.00 0.47 0.00 0.00 55.06 53.98 1ns0 s HIS 154 Cb -0.13 -1.75 -0.04 0.00 -0.13 0.00 0.00 32.58 30.53 1ns0 s HIS 154 CO -0.10 -0.75 0.13 0.71 -2.47 0.00 0.00 174.74 172.26 1ns0 s TYR 155 N 1.37 3.56 -0.00 3.88 1.51 -0.04 -0.89 117.35 126.75 1ns0 s TYR 155 Ca 0.03 0.50 0.01 0.00 -1.01 0.00 0.00 57.07 56.59 1ns0 s TYR 155 Cb -0.14 -1.95 -0.00 0.00 -0.11 0.00 0.00 41.96 39.76 1ns0 s TYR 155 CO -0.11 0.69 -0.02 -1.21 -1.11 0.00 0.00 175.55 173.79 1ns0 s GLU 156 N -0.90 0.19 -0.10 -0.62 2.02 -0.27 -2.19 118.70 116.83 1ns0 s GLU 156 Ca 0.14 -0.09 -0.27 0.00 0.02 0.00 0.00 54.97 54.77 1ns0 s GLU 156 Cb -0.12 -0.18 0.06 0.00 0.10 0.00 0.00 34.13 33.99 1ns0 s GLU 156 CO 0.03 0.05 0.64 0.00 0.02 0.00 0.00 175.26 176.00 1ns0 s ALA 157 N -0.06 -1.64 -0.02 5.21 0.00 -0.91 -0.78 121.76 123.57 1ns0 s ALA 157 Ca 0.01 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1ns0 s ALA 157 Cb -0.01 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.85 1ns0 s ALA 157 CO -0.00 -0.34 0.02 0.42 0.00 0.00 0.00 175.76 175.86 1ns0 s ILE 158 N -0.79 -0.04 0.01 0.00 1.01 -0.93 0.50 121.20 120.95 1ns0 s ILE 158 Ca -0.08 0.17 0.05 0.00 0.00 0.00 0.00 60.65 60.78 1ns0 s ILE 158 Cb -0.02 -0.07 -0.03 0.00 0.01 0.00 0.00 42.46 42.35 1ns0 s ILE 158 CO 0.07 0.07 -0.12 -0.55 0.00 0.00 0.00 174.94 174.41 1ns0 s SER 159 N 0.84 4.24 0.40 3.58 0.15 -1.26 -0.15 113.70 121.50 1ns0 s SER 159 Ca -0.07 -0.25 0.24 0.00 0.70 0.00 0.00 55.95 56.57 1ns0 s SER 159 Cb -0.10 -0.88 0.44 0.00 -1.71 0.00 0.00 66.02 63.77 1ns0 s SER 159 CO -0.02 0.29 1.65 0.44 1.20 0.00 0.00 173.24 176.79 1ns0 h ASP 160 N 4.68 0.00 -4.47 5.45 5.19 -1.49 0.69 116.42 126.47 1ns0 h ASP 160 Ca -0.48 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 55.63 1ns0 h ASP 160 Cb 1.16 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 40.49 1ns0 h ASP 160 CO 0.51 0.00 -0.73 -0.54 -3.12 0.00 0.00 179.24 175.36 1ns0 s LYS 161 N -3.20 0.80 0.16 3.56 1.02 -1.23 -4.75 119.74 116.10 1ns0 s LYS 161 Ca 0.08 -1.13 -0.31 0.00 0.02 0.00 0.00 55.97 54.62 1ns0 s LYS 161 Cb 0.06 -0.45 -0.11 0.00 -0.52 0.00 0.00 37.83 36.81 1ns0 s LYS 161 CO 0.65 0.06 1.72 -0.51 -0.92 0.00 0.00 175.35 176.36 1ns0 s ASP 162 N -2.41 6.45 0.00 2.83 1.01 -1.26 -4.05 116.67 119.24 1ns0 s ASP 162 Ca 0.04 2.75 0.00 0.00 0.71 0.00 0.00 52.55 56.06 1ns0 s ASP 162 Cb -0.03 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.32 1ns0 s ASP 162 CO -0.01 -0.95 0.00 1.07 0.21 0.00 0.00 175.17 175.50 1ns0 n THR 163 N 4.28 0.00 -4.49 -1.27 5.66 0.10 -4.75 114.28 113.82 1ns0 n THR 163 Ca 0.16 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.94 1ns0 n THR 163 Cb 0.37 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.01 1ns0 n THR 163 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1ns0 s VAL 164 N -1.26 1.31 -0.20 1.08 -7.23 -1.26 -0.40 120.40 112.43 1ns0 s VAL 164 Ca 0.00 -1.03 -0.10 0.00 -1.81 0.00 0.00 61.98 59.04 1ns0 s VAL 164 Cb 0.00 -1.16 0.08 0.00 0.56 0.00 0.00 36.38 35.86 1ns0 s VAL 164 CO 0.00 0.11 0.47 0.12 -0.31 0.00 0.00 175.10 175.49 1ns0 s PHE 165 N -0.78 -0.78 -0.43 2.82 5.36 -0.30 -4.81 117.98 119.07 1ns0 s PHE 165 Ca 0.04 1.55 0.03 0.00 -0.96 0.00 0.00 56.93 57.59 1ns0 s PHE 165 Cb -0.08 0.37 0.26 0.00 -0.34 0.00 0.00 43.02 43.23 1ns0 s PHE 165 CO 0.01 -0.43 1.02 -1.71 -1.46 0.00 0.00 175.22 172.65 1ns0 n ASN 166 N 4.69 -2.33 -4.74 6.13 5.15 0.67 -4.80 115.26 120.03 1ns0 n ASN 166 Ca -0.18 -2.81 -0.28 0.00 -0.60 0.00 0.00 54.58 50.71 1ns0 n ASN 166 Cb 0.54 1.47 0.10 0.00 -0.53 0.00 0.00 39.78 41.36 1ns0 n ASN 166 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1ns0 s PRO 167 N 0.47 1.74 0.30 1.20 0.04 -1.14 -0.10 135.00 137.52 1ns0 s PRO 167 Ca 0.29 -0.13 -0.10 0.00 0.04 0.00 0.00 61.00 61.10 1ns0 s PRO 167 Cb 0.23 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.78 1ns0 s PRO 167 CO -0.19 -1.67 0.54 -0.08 0.04 0.00 0.00 177.00 175.64 1ns0 s THR 168 N -3.54 0.00 -0.18 1.26 -1.32 -0.50 -4.75 115.64 106.61 1ns0 s THR 168 Ca 0.64 -1.39 -0.03 0.00 -1.21 0.00 0.00 61.69 59.70 1ns0 s THR 168 Cb -0.09 -2.45 -0.02 0.00 -1.51 0.00 0.00 72.50 68.43 1ns0 s THR 168 CO 0.49 0.00 -0.05 -0.83 -2.21 0.00 0.00 174.62 172.01 1ns0 s GLY 169 N -3.09 1.65 -0.51 6.08 0.00 -1.26 -0.92 107.32 109.27 1ns0 s GLY 169 Ca 0.23 -0.97 -0.00 0.00 0.00 0.00 0.00 44.72 43.99 1ns0 s GLY 169 CO 0.13 0.11 1.95 1.57 0.00 0.00 0.00 173.10 176.86 1ns0 n HIS 170 N 4.03 2.71 -2.12 1.90 -0.00 0.32 -4.48 115.22 117.58 1ns0 n HIS 170 Ca -0.18 -2.38 -0.35 0.00 0.46 0.00 0.00 57.72 55.28 1ns0 n HIS 170 Cb 0.52 -1.16 0.02 0.00 -0.12 0.00 0.00 29.99 29.24 1ns0 n HIS 170 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1ns0 s VAL 171 N -3.68 3.06 -0.12 3.57 0.11 -1.26 -1.30 120.40 120.78 1ns0 s VAL 171 Ca 0.53 0.63 0.03 0.00 -2.93 0.00 0.00 61.98 60.24 1ns0 s VAL 171 Cb 0.42 -3.22 0.01 0.00 -1.53 0.00 0.00 36.38 32.06 1ns0 s VAL 171 CO 0.02 -0.17 -0.22 -0.31 -3.33 0.00 0.00 175.10 171.09 1ns0 s TYR 172 N -1.83 2.54 0.10 1.54 1.51 -1.26 -4.15 117.35 115.81 1ns0 s TYR 172 Ca 0.73 -1.18 -0.02 0.00 -1.01 0.00 0.00 57.07 55.59 1ns0 s TYR 172 Cb -0.25 -1.72 -0.05 0.00 -0.11 0.00 0.00 41.96 39.83 1ns0 s TYR 172 CO 0.31 -0.52 0.29 -0.06 -1.11 0.00 0.00 175.55 174.46 1ns0 s PHE 173 N 0.63 3.50 -0.39 2.71 0.40 0.54 -1.56 117.98 123.81 1ns0 s PHE 173 Ca -0.12 0.37 0.07 0.00 -0.60 0.00 0.00 56.93 56.65 1ns0 s PHE 173 Cb -0.16 -1.85 0.18 0.00 0.51 0.00 0.00 43.02 41.69 1ns0 s PHE 173 CO 0.03 0.51 0.61 1.21 0.70 0.00 0.00 175.22 178.28 1ns0 s ASN 174 N -2.55 -1.45 0.00 1.36 3.84 -0.70 -1.51 114.94 113.93 1ns0 s ASN 174 Ca 0.37 -0.65 0.08 0.00 0.21 0.00 0.00 52.86 52.87 1ns0 s ASN 174 Cb -0.12 1.92 0.35 0.00 -0.55 0.00 0.00 41.25 42.85 1ns0 s ASN 174 CO 0.27 -0.19 1.25 0.18 -2.79 0.00 0.00 177.10 175.81 1ns0 n LEU 175 N 4.58 0.00 0.22 3.21 4.77 -1.26 -1.19 117.00 127.34 1ns0 n LEU 175 Ca 0.10 0.48 0.10 0.00 -0.03 0.00 0.00 56.01 56.67 1ns0 n LEU 175 Cb 0.56 -0.48 0.48 0.00 -2.33 0.00 0.00 43.42 41.64 1ns0 n LEU 175 CO 0.00 -0.35 0.81 0.78 -1.33 0.00 0.00 177.39 177.30 1ns0 h ASN 176 N 0.00 0.00 0.00 -1.43 2.35 -1.91 -3.47 115.58 111.13 1ns0 h ASN 176 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ns0 h ASN 176 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1ns0 h ASN 176 CO 0.00 0.22 0.00 0.61 -1.65 0.00 0.00 177.43 176.61 1ns0 n GLY 177 N 0.10 0.44 2.69 2.83 0.00 -0.33 -4.96 105.19 105.95 1ns0 n GLY 177 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1ns0 n GLY 177 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ns0 s ASP 178 N -2.13 1.18 0.57 1.61 -1.08 -1.26 -4.55 116.67 111.01 1ns0 s ASP 178 Ca 0.00 0.06 0.38 0.00 -0.52 0.00 0.00 52.55 52.47 1ns0 s ASP 178 Cb 0.00 -0.09 2.02 0.00 -1.46 0.00 0.00 42.92 43.39 1ns0 s ASP 178 CO 0.00 -0.26 2.17 0.00 0.52 0.00 0.00 175.17 177.60 1ns0 h ALA 179 N 8.43 1.00 -0.13 3.66 0.00 -1.86 -1.36 119.26 129.00 1ns0 h ALA 179 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ns0 h ALA 179 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1ns0 h ALA 179 CO 0.16 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.28 1ns0 n SER 180 N -2.89 1.23 -4.29 0.00 3.41 -1.24 -1.16 113.62 108.69 1ns0 n SER 180 Ca -0.02 -1.65 -0.34 0.00 -0.26 0.00 0.00 58.87 56.60 1ns0 n SER 180 Cb 0.09 -0.08 -0.15 0.00 -0.26 0.00 0.00 64.21 63.82 1ns0 n SER 180 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1ns0 s GLU 181 N -1.84 3.28 0.56 4.33 2.02 -0.51 -4.63 118.70 121.91 1ns0 s GLU 181 Ca 0.30 -0.70 -0.21 0.00 0.02 0.00 0.00 54.97 54.39 1ns0 s GLU 181 Cb 0.16 -2.75 -0.04 0.00 0.10 0.00 0.00 34.13 31.59 1ns0 s GLU 181 CO 0.24 -0.04 1.27 0.45 0.02 0.00 0.00 175.26 177.21 1ns0 s SER 182 N 1.00 5.32 -0.00 -0.19 0.15 -1.26 -4.64 113.70 114.08 1ns0 s SER 182 Ca -0.01 2.56 0.09 0.00 0.70 0.00 0.00 55.95 59.29 1ns0 s SER 182 Cb -0.15 -2.62 0.26 0.00 -1.71 0.00 0.00 66.02 61.81 1ns0 s SER 182 CO -0.02 -1.52 1.22 1.33 1.20 0.00 0.00 173.24 175.45 1ns0 n VAL 183 N -1.20 0.40 0.29 4.45 0.24 -0.52 -3.99 118.33 118.00 1ns0 n VAL 183 Ca 0.11 -0.40 0.18 0.00 -2.04 0.00 0.00 64.34 62.20 1ns0 n VAL 183 Cb 0.47 0.20 0.88 0.00 -1.47 0.00 0.00 33.84 33.91 1ns0 n VAL 183 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1ns0 h GLU 184 N 1.73 0.00 -0.11 7.34 4.11 -1.91 -0.50 114.58 125.23 1ns0 h GLU 184 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1ns0 h GLU 184 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1ns0 h GLU 184 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 179.01 179.35 1ns0 n ASN 185 N -2.79 1.21 -4.91 3.06 6.94 -1.26 -2.07 115.26 115.45 1ns0 n ASN 185 Ca -0.01 -1.60 -0.28 0.00 -0.02 0.00 0.00 54.58 52.67 1ns0 n ASN 185 Cb 0.13 -0.07 -0.03 0.00 -2.36 0.00 0.00 39.78 37.45 1ns0 n ASN 185 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 1ns0 s HIS 186 N -1.87 3.48 -0.07 -2.53 3.76 -0.20 -4.89 115.29 112.98 1ns0 s HIS 186 Ca 0.32 0.57 -0.04 0.00 -0.15 0.00 0.00 55.06 55.76 1ns0 s HIS 186 Cb 0.17 -2.04 -0.04 0.00 1.11 0.00 0.00 32.58 31.77 1ns0 s HIS 186 CO 0.26 0.20 0.12 0.20 -0.85 0.00 0.00 174.74 174.67 1ns0 s GLY 187 N -3.24 2.09 -0.04 -2.22 0.00 0.52 -0.64 107.32 103.79 1ns0 s GLY 187 Ca 0.43 -0.73 0.04 0.00 0.00 0.00 0.00 44.72 44.45 1ns0 s GLY 187 CO 0.30 -0.52 -0.14 -2.27 0.00 0.00 0.00 173.10 170.47 1ns0 s LEU 188 N -1.31 1.85 -0.08 0.66 2.96 0.15 -1.21 118.68 121.71 1ns0 s LEU 188 Ca 0.19 -0.30 0.04 0.00 -0.22 0.00 0.00 54.13 53.84 1ns0 s LEU 188 Cb -0.12 -0.83 -0.00 0.00 0.50 0.00 0.00 46.19 45.74 1ns0 s LEU 188 CO 0.08 0.12 -0.21 0.00 -1.32 0.00 0.00 176.35 175.02 1ns0 s ARG 189 N 0.14 2.56 -0.13 1.98 1.70 -0.58 -1.90 118.95 122.73 1ns0 s ARG 189 Ca -0.05 -0.77 -0.05 0.00 -0.47 0.00 0.00 55.73 54.39 1ns0 s ARG 189 Cb -0.11 -2.02 0.06 0.00 -0.57 0.00 0.00 34.95 32.31 1ns0 s ARG 189 CO 0.02 0.20 0.27 -1.17 -1.08 0.00 0.00 175.30 173.54 1ns0 s LEU 190 N 0.26 -0.06 -1.57 -1.89 2.96 0.26 -1.17 118.68 117.47 1ns0 s LEU 190 Ca -0.13 0.61 -0.10 0.00 -0.22 0.00 0.00 54.13 54.28 1ns0 s LEU 190 Cb -0.16 0.79 -0.07 0.00 0.50 0.00 0.00 46.19 47.25 1ns0 s LEU 190 CO 0.06 -0.21 2.83 0.00 -1.32 0.00 0.00 176.35 177.71 1ns0 n ALA 191 N 4.90 7.16 -3.72 5.97 0.00 -0.37 -2.72 120.51 131.73 1ns0 n ALA 191 Ca -0.14 -3.51 -0.13 0.00 0.00 0.00 0.00 53.44 49.65 1ns0 n ALA 191 Cb 0.51 -3.39 -0.14 0.00 0.00 0.00 0.00 19.45 16.43 1ns0 n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ns0 s ALA 192 N 2.38 -0.28 -0.92 0.00 0.00 -1.26 -0.56 121.76 121.12 1ns0 s ALA 192 Ca 0.65 0.69 0.21 0.00 0.00 0.00 0.00 51.96 53.52 1ns0 s ALA 192 Cb 0.17 -0.46 -0.18 0.00 0.00 0.00 0.00 23.12 22.65 1ns0 s ALA 192 CO -0.06 -0.16 0.91 0.43 0.00 0.00 0.00 175.76 176.88 1ns0 n SER 193 N 4.17 0.89 -4.12 0.00 7.64 -1.26 -4.69 113.62 116.26 1ns0 n SER 193 Ca -0.26 -0.86 -0.10 0.00 1.01 0.00 0.00 58.87 58.66 1ns0 n SER 193 Cb 0.52 1.01 -0.10 0.00 -1.01 0.00 0.00 64.21 64.63 1ns0 n SER 193 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1ns0 s ARG 194 N -3.04 0.70 0.16 1.43 0.52 -1.26 -1.00 118.95 116.46 1ns0 s ARG 194 Ca 0.07 -1.18 -0.00 0.00 -0.52 0.00 0.00 55.73 54.10 1ns0 s ARG 194 Cb 0.16 -0.09 -0.04 0.00 0.52 0.00 0.00 34.95 35.50 1ns0 s ARG 194 CO 0.86 -0.03 0.07 -0.59 0.02 0.00 0.00 175.30 175.63 1ns0 s PHE 195 N -3.25 1.04 -0.35 -0.53 -0.00 -0.07 -1.30 117.98 113.52 1ns0 s PHE 195 Ca 0.06 -1.24 -0.09 0.00 -0.00 0.00 0.00 56.93 55.65 1ns0 s PHE 195 Cb 0.03 -0.56 0.02 0.00 -0.00 0.00 0.00 43.02 42.51 1ns0 s PHE 195 CO -0.05 -0.50 0.17 0.08 -0.00 0.00 0.00 175.22 174.92 1ns0 s VAL 196 N -4.00 4.34 0.54 -2.49 1.01 -0.60 -1.58 120.40 117.62 1ns0 s VAL 196 Ca 0.29 -0.86 -0.16 0.00 0.00 0.00 0.00 61.98 61.25 1ns0 s VAL 196 Cb 0.07 -3.39 -0.07 0.00 0.00 0.00 0.00 36.38 32.99 1ns0 s VAL 196 CO 0.06 -0.16 1.00 -2.16 0.00 0.00 0.00 175.10 173.84 1ns0 s PRO 197 N 1.52 3.79 0.06 2.72 0.04 -1.26 -4.39 135.00 137.49 1ns0 s PRO 197 Ca 0.02 1.02 -0.08 0.00 0.04 0.00 0.00 61.00 61.99 1ns0 s PRO 197 Cb -0.19 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 1ns0 s PRO 197 CO 0.05 -0.41 0.36 -0.51 0.04 0.00 0.00 177.00 176.53 1ns0 s LEU 198 N -4.19 4.35 0.09 -3.56 1.43 -1.26 -0.22 118.68 115.32 1ns0 s LEU 198 Ca 0.60 0.70 -0.18 0.00 -1.03 0.00 0.00 54.13 54.22 1ns0 s LEU 198 Cb -0.11 -2.93 -0.07 0.00 0.03 0.00 0.00 46.19 43.11 1ns0 s LEU 198 CO 0.33 0.18 1.55 0.50 0.23 0.00 0.00 176.35 179.14 1ns0 h LYS 199 N 3.70 0.49 0.00 1.70 3.64 -0.64 -3.39 116.57 122.06 1ns0 h LYS 199 Ca -0.49 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 58.74 1ns0 h LYS 199 Cb 1.19 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1ns0 h LYS 199 CO 0.67 0.63 0.00 -0.40 -2.27 0.00 0.00 179.45 178.08 1ns0 n ASP 200 N -4.61 0.00 0.24 4.20 3.85 -1.26 -4.94 116.55 114.02 1ns0 n ASP 200 Ca -0.03 -0.46 0.13 0.00 -0.71 0.00 0.00 54.79 53.72 1ns0 n ASP 200 Cb 0.24 0.00 0.71 0.00 -1.35 0.00 0.00 41.12 40.71 1ns0 n ASP 200 CO 0.00 0.00 0.00 -0.61 -1.01 0.00 0.00 177.20 175.58 1ns0 h GLN 201 N 0.00 0.00 0.00 0.11 -0.00 -1.94 0.62 115.11 113.90 1ns0 h GLN 201 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1ns0 h GLN 201 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.48 1ns0 h GLN 201 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 178.83 179.08 1ns0 n THR 202 N -2.51 0.42 -1.20 2.39 -2.24 -1.26 -4.91 114.28 104.96 1ns0 n THR 202 Ca -0.02 -0.16 -0.07 0.00 -2.27 0.00 0.00 64.05 61.53 1ns0 n THR 202 Cb 0.20 -0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 67.82 1ns0 n THR 202 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ns0 n GLU 203 N -2.00 -0.86 -1.86 -0.78 1.02 0.22 -5.01 120.64 111.36 1ns0 n GLU 203 Ca 0.06 0.66 -0.31 0.00 -0.02 0.00 0.00 57.16 57.55 1ns0 n GLU 203 Cb 0.39 -4.56 0.02 0.00 -0.02 0.00 0.00 31.44 27.27 1ns0 n GLU 203 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1ns0 s ILE 204 N -2.07 4.32 0.45 -3.67 -4.36 -1.26 -4.82 121.20 109.78 1ns0 s ILE 204 Ca 0.00 0.75 -0.23 0.00 -0.26 0.00 0.00 60.65 60.91 1ns0 s ILE 204 Cb 0.00 -3.73 -0.08 0.00 1.25 0.00 0.00 42.46 39.90 1ns0 s ILE 204 CO 0.00 -0.98 1.18 0.68 0.24 0.00 0.00 174.94 176.06 1ns0 s VAL 205 N -3.23 3.04 0.16 8.37 -7.23 -1.26 -0.06 120.40 120.19 1ns0 s VAL 205 Ca 0.56 0.81 -0.12 0.00 -1.81 0.00 0.00 61.98 61.42 1ns0 s VAL 205 Cb -0.11 -3.42 0.04 0.00 0.56 0.00 0.00 36.38 33.45 1ns0 s VAL 205 CO 0.53 0.01 1.66 -0.09 -0.31 0.00 0.00 175.10 176.91 1ns0 h ARG 206 N 2.17 0.86 0.00 4.82 2.43 -0.81 -3.37 114.38 120.48 1ns0 h ARG 206 Ca -0.49 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 58.47 1ns0 h ARG 206 Cb 1.25 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1ns0 h ARG 206 CO 0.61 0.82 0.00 0.41 -1.51 0.00 0.00 179.97 180.30 1ns0 n GLY 207 N -0.60 1.25 3.62 2.80 0.00 -1.26 -4.84 105.19 106.16 1ns0 n GLY 207 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 1ns0 n GLY 207 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ns0 s ASP 208 N -1.09 4.04 -0.12 1.61 3.84 -1.26 -4.86 116.67 118.82 1ns0 s ASP 208 Ca 0.00 -1.13 0.02 0.00 -0.00 0.00 0.00 52.55 51.44 1ns0 s ASP 208 Cb 0.00 -0.45 -0.01 0.00 -1.38 0.00 0.00 42.92 41.08 1ns0 s ASP 208 CO 0.00 -0.31 -0.19 -0.63 -0.00 0.00 0.00 175.17 174.03 1ns0 s ILE 209 N -2.59 2.46 -0.01 2.11 1.01 -1.26 -4.00 121.20 118.92 1ns0 s ILE 209 Ca 0.35 -0.87 0.07 0.00 0.00 0.00 0.00 60.65 60.20 1ns0 s ILE 209 Cb 0.03 -1.99 -0.02 0.00 0.01 0.00 0.00 42.46 40.50 1ns0 s ILE 209 CO 0.19 0.54 -0.23 -0.69 0.00 0.00 0.00 174.94 174.76 1ns0 s VAL 210 N 0.39 1.78 0.02 2.92 1.01 -0.61 -4.96 120.40 120.95 1ns0 s VAL 210 Ca -0.15 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.52 1ns0 s VAL 210 Cb -0.17 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.67 1ns0 s VAL 210 CO 0.07 0.46 1.19 -0.62 0.00 0.00 0.00 175.10 176.20 1ns0 s ASP 211 N -0.64 7.08 -0.00 3.32 -1.08 -1.26 -0.89 116.67 123.19 1ns0 s ASP 211 Ca 0.09 1.93 0.06 0.00 -0.52 0.00 0.00 52.55 54.11 1ns0 s ASP 211 Cb -0.09 -2.57 0.17 0.00 -1.46 0.00 0.00 42.92 38.97 1ns0 s ASP 211 CO -0.00 -0.50 1.14 2.30 0.52 0.00 0.00 175.17 178.62 1ns0 n ILE 212 N 4.17 1.02 -1.67 4.11 -5.35 -0.17 -4.95 119.36 116.53 1ns0 n ILE 212 Ca 0.10 -1.02 -0.44 0.00 -0.27 0.00 0.00 62.75 61.11 1ns0 n ILE 212 Cb 0.46 0.48 -0.02 0.00 -1.74 0.00 0.00 39.64 38.83 1ns0 n ILE 212 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1ns0 n LYS 213 N 0.01 1.98 -1.51 6.28 5.02 -1.25 -1.39 118.16 127.30 1ns0 n LYS 213 Ca 0.06 0.70 -0.16 0.00 -2.02 0.00 0.00 58.31 56.90 1ns0 n LYS 213 Cb 0.35 -2.32 -0.06 0.00 -0.02 0.00 0.00 35.03 32.98 1ns0 n LYS 213 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ns0 n ASN 214 N 1.76 -4.86 -4.91 4.39 3.02 -1.26 -4.98 115.26 108.41 1ns0 n ASN 214 Ca 0.10 0.36 -0.26 0.00 -0.03 0.00 0.00 54.58 54.75 1ns0 n ASN 214 Cb 0.32 -3.75 -0.00 0.00 -0.61 0.00 0.00 39.78 35.74 1ns0 n ASN 214 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ns0 s THR 215 N -2.59 1.68 -1.44 3.41 -4.23 -0.48 -4.98 115.64 107.01 1ns0 s THR 215 Ca 0.00 -1.46 0.12 0.00 -1.18 0.00 0.00 61.69 59.17 1ns0 s THR 215 Cb 0.00 -2.14 0.21 0.00 1.34 0.00 0.00 72.50 71.91 1ns0 s THR 215 CO 0.00 0.00 1.29 0.47 -0.54 0.00 0.00 174.62 175.84 1ns0 n ASP 216 N -1.80 0.00 -1.04 3.99 8.00 -1.26 -1.84 116.55 122.60 1ns0 n ASP 216 Ca -0.00 0.10 0.11 0.00 0.71 0.00 0.00 54.79 55.71 1ns0 n ASP 216 Cb 0.64 -0.28 0.17 0.00 -0.02 0.00 0.00 41.12 41.63 1ns0 n ASP 216 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1ns0 n LEU 217 N -1.28 3.22 -4.55 0.64 4.77 -1.26 -4.09 117.00 114.44 1ns0 n LEU 217 Ca 0.06 -1.33 -0.43 0.00 -0.03 0.00 0.00 56.01 54.28 1ns0 n LEU 217 Cb 0.09 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 40.99 1ns0 n LEU 217 CO 0.09 0.65 0.89 -0.62 -1.33 0.00 0.00 177.39 177.07 1ns0 s ASP 218 N -1.59 6.42 -0.14 -1.43 -1.08 -0.76 -4.87 116.67 113.21 1ns0 s ASP 218 Ca 0.33 -0.06 0.17 0.00 -0.52 0.00 0.00 52.55 52.47 1ns0 s ASP 218 Cb 0.21 -2.49 0.39 0.00 -1.46 0.00 0.00 42.92 39.56 1ns0 s ASP 218 CO 0.30 -1.30 1.27 0.49 0.52 0.00 0.00 175.17 176.45 1ns0 n PHE 219 N 7.80 0.43 -0.27 -5.34 3.01 -1.26 -4.69 117.46 117.14 1ns0 n PHE 219 Ca 0.06 -0.91 0.19 0.00 1.01 0.00 0.00 57.45 57.79 1ns0 n PHE 219 Cb 0.48 -0.21 0.49 0.00 -0.01 0.00 0.00 39.48 40.23 1ns0 n PHE 219 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ns0 h ARG 220 N 0.86 0.43 -5.35 -1.08 3.08 -1.79 0.76 114.38 111.30 1ns0 h ARG 220 Ca 0.00 -0.03 -0.65 0.00 0.07 0.00 0.00 59.98 59.38 1ns0 h ARG 220 Cb 1.17 -0.10 -0.23 0.00 0.08 0.00 0.00 29.97 30.89 1ns0 h ARG 220 CO 0.10 0.29 -0.70 -0.65 -1.07 0.00 0.00 179.97 177.93 1ns0 s GLN 221 N -5.48 3.53 0.21 0.04 -0.21 -1.26 -4.52 119.66 111.97 1ns0 s GLN 221 Ca -0.09 -0.58 -0.32 0.00 0.02 0.00 0.00 55.36 54.40 1ns0 s GLN 221 Cb 0.23 -2.80 -0.15 0.00 1.00 0.00 0.00 33.01 31.29 1ns0 s GLN 221 CO 0.79 0.25 1.22 -1.91 -2.12 0.00 0.00 175.29 173.52 1ns0 n GLU 222 N 3.46 1.45 -3.82 2.91 2.13 -1.26 -4.84 120.64 120.68 1ns0 n GLU 222 Ca -0.18 0.51 -0.09 0.00 0.66 0.00 0.00 57.16 58.07 1ns0 n GLU 222 Cb 0.53 -2.04 -0.07 0.00 0.27 0.00 0.00 31.44 30.12 1ns0 n GLU 222 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1ns0 s LYS 223 N -0.54 0.92 0.50 5.31 -2.85 -0.80 -4.92 119.74 117.36 1ns0 s LYS 223 Ca 0.70 -0.93 -0.22 0.00 -1.00 0.00 0.00 55.97 54.52 1ns0 s LYS 223 Cb -0.77 0.37 -0.06 0.00 -2.06 0.00 0.00 37.83 35.31 1ns0 s LYS 223 CO 0.52 -0.31 1.19 -0.65 0.10 0.00 0.00 175.35 176.20 1ns0 s GLN 224 N -3.86 3.52 0.50 1.78 -1.52 -1.26 -0.67 119.66 118.15 1ns0 s GLN 224 Ca 0.06 1.81 0.27 0.00 -1.95 0.00 0.00 55.36 55.54 1ns0 s GLN 224 Cb 0.04 -2.26 1.31 0.00 -0.22 0.00 0.00 33.01 31.88 1ns0 s GLN 224 CO -0.10 -0.76 2.00 -0.07 -0.25 0.00 0.00 175.29 176.11 1ns0 h LEU 225 N 1.69 0.00 -1.84 2.90 3.38 -0.83 -2.75 115.31 117.86 1ns0 h LEU 225 Ca -0.50 0.00 0.25 0.00 0.09 0.00 0.00 57.88 57.72 1ns0 h LEU 225 Cb 1.26 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.96 1ns0 h LEU 225 CO 0.59 0.15 0.64 0.77 0.09 0.00 0.00 178.44 180.67 1ns0 h SER 226 N 0.00 0.13 -0.99 -0.43 4.64 -1.69 -0.75 113.55 114.46 1ns0 h SER 226 Ca -0.00 0.02 0.02 0.00 -0.47 0.00 0.00 61.79 61.35 1ns0 h SER 226 Cb 0.46 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.49 1ns0 h SER 226 CO 0.02 0.04 0.65 0.78 -0.87 0.00 0.00 176.83 177.46 1ns0 h ASN 227 N 0.12 1.12 -0.03 4.97 4.21 -1.81 0.19 115.58 124.36 1ns0 h ASN 227 Ca 0.45 -0.03 -0.04 0.00 1.21 0.00 0.00 56.30 57.89 1ns0 h ASN 227 Cb 1.57 -0.28 0.00 0.00 -1.12 0.00 0.00 38.32 38.50 1ns0 h ASN 227 CO -0.07 0.80 -0.14 0.00 -1.29 0.00 0.00 177.43 176.73 1ns0 h ALA 228 N 1.39 0.06 -0.03 -0.83 0.00 -1.30 -2.95 119.26 115.60 1ns0 h ALA 228 Ca 0.37 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ns0 h ALA 228 Cb -0.12 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ns0 h ALA 228 CO -0.09 -0.01 -0.03 0.74 0.00 0.00 0.00 179.25 179.86 1ns0 h PHE 229 N -0.45 0.04 0.00 0.00 0.05 -1.01 -0.73 116.94 114.84 1ns0 h PHE 229 Ca -0.01 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.78 1ns0 h PHE 229 Cb 0.80 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 38.74 1ns0 h PHE 229 CO 0.15 0.08 -0.39 0.09 -0.18 0.00 0.00 178.31 178.05 1ns0 n ASN 230 N -4.47 0.42 -4.76 2.17 3.02 0.63 -4.91 115.26 107.36 1ns0 n ASN 230 Ca -0.02 -0.02 -0.38 0.00 -0.03 0.00 0.00 54.58 54.13 1ns0 n ASN 230 Cb 0.13 0.05 0.02 0.00 -0.61 0.00 0.00 39.78 39.37 1ns0 n ASN 230 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ns0 s SER 231 N -3.19 5.72 -0.10 6.41 0.15 -0.28 -4.93 113.70 117.48 1ns0 s SER 231 Ca 0.11 2.57 0.16 0.00 0.70 0.00 0.00 55.95 59.48 1ns0 s SER 231 Cb 0.17 -2.62 0.55 0.00 -1.71 0.00 0.00 66.02 62.41 1ns0 s SER 231 CO 0.66 -1.24 1.47 -0.46 1.20 0.00 0.00 173.24 174.87 1ns0 n ASN 232 N -0.72 4.02 -4.72 5.45 0.23 -1.26 -4.58 115.26 113.68 1ns0 n ASN 232 Ca 0.09 -2.46 -0.41 0.00 -0.53 0.00 0.00 54.58 51.27 1ns0 n ASN 232 Cb 0.46 -0.47 0.01 0.00 -2.08 0.00 0.00 39.78 37.71 1ns0 n ASN 232 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 1ns0 n MET 233 N 0.54 2.03 -0.26 -3.83 2.81 -1.26 -4.74 117.12 112.41 1ns0 n MET 233 Ca 0.21 0.72 0.07 0.00 -1.81 0.00 0.00 57.70 56.89 1ns0 n MET 233 Cb 0.76 -2.47 0.20 0.00 -0.71 0.00 0.00 33.22 31.00 1ns0 n MET 233 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1ns0 h GLU 234 N 2.14 0.20 -0.12 0.03 4.22 -1.98 0.11 114.58 119.18 1ns0 h GLU 234 Ca -0.49 -0.01 -0.06 0.00 0.08 0.00 0.00 59.36 58.87 1ns0 h GLU 234 Cb 1.29 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1ns0 h GLU 234 CO 0.60 0.14 -0.22 1.96 -2.18 0.00 0.00 179.01 179.31 1ns0 h GLN 235 N 0.21 0.20 -0.13 1.92 1.08 -1.97 0.11 115.11 116.53 1ns0 h GLN 235 Ca 0.45 -0.06 -0.21 0.00 -1.45 0.00 0.00 58.65 57.38 1ns0 h GLN 235 Cb 0.82 -0.02 0.01 0.00 -0.05 0.00 0.00 27.48 28.24 1ns0 h GLN 235 CO -0.59 0.42 -0.75 0.28 -0.95 0.00 0.00 178.83 177.24 1ns0 h VAL 236 N 0.18 1.29 -0.11 -0.54 2.07 -1.24 -3.00 116.25 114.91 1ns0 h VAL 236 Ca 0.03 -1.97 -0.10 0.00 0.82 0.00 0.00 66.70 65.49 1ns0 h VAL 236 Cb 0.50 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1ns0 h VAL 236 CO 0.03 0.62 -0.37 1.56 0.02 0.00 0.00 177.57 179.43 1ns0 h GLN 237 N 0.45 0.23 -0.71 1.57 4.20 -0.93 0.32 115.11 120.23 1ns0 h GLN 237 Ca -0.06 -0.10 0.02 0.00 0.06 0.00 0.00 58.65 58.58 1ns0 h GLN 237 Cb 1.38 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 29.12 1ns0 h GLN 237 CO 0.15 0.57 0.46 1.25 -0.67 0.00 0.00 178.83 180.59 1ns0 h LEU 238 N 0.20 0.76 -1.09 1.46 5.85 -0.64 -3.14 115.31 118.70 1ns0 h LEU 238 Ca 0.02 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1ns0 h LEU 238 Cb 0.75 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1ns0 h LEU 238 CO 0.06 0.54 -0.27 1.33 -0.34 0.00 0.00 178.44 179.75 1ns0 n VAL 239 N -4.63 0.00 -3.32 1.05 0.24 -1.14 -4.88 118.33 105.65 1ns0 n VAL 239 Ca 0.07 -0.37 -0.18 0.00 -2.04 0.00 0.00 64.34 61.83 1ns0 n VAL 239 Cb 0.06 1.24 0.06 0.00 -1.47 0.00 0.00 33.84 33.73 1ns0 n VAL 239 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1ns0 n LYS 240 N 0.16 -5.99 0.00 7.34 4.01 0.11 -4.76 118.16 119.03 1ns0 n LYS 240 Ca 0.08 0.63 0.00 0.00 -0.51 0.00 0.00 58.31 58.51 1ns0 n LYS 240 Cb 0.38 -5.07 0.00 0.00 -0.51 0.00 0.00 35.03 29.83 1ns0 n LYS 240 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ns0 n GLY 241 N -1.64 -0.02 3.28 0.72 0.00 -0.90 -4.78 105.19 101.85 1ns0 n GLY 241 Ca 0.00 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 1ns0 n GLY 241 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ns0 s ILE 242 N -2.67 1.94 -0.46 -0.61 1.01 -1.26 -4.43 121.20 114.72 1ns0 s ILE 242 Ca 0.00 -1.05 0.06 0.00 0.00 0.00 0.00 60.65 59.66 1ns0 s ILE 242 Cb 0.00 -1.62 0.32 0.00 0.01 0.00 0.00 42.46 41.18 1ns0 s ILE 242 CO 0.00 0.55 1.13 -0.67 0.00 0.00 0.00 174.94 175.95 1ns0 n ASP 243 N 2.52 -2.33 -3.98 3.58 -0.08 -1.00 -1.09 116.55 114.17 1ns0 n ASP 243 Ca -0.16 -3.65 -0.08 0.00 -1.51 0.00 0.00 54.79 49.39 1ns0 n ASP 243 Cb 0.52 1.90 -0.09 0.00 2.34 0.00 0.00 41.12 45.79 1ns0 n ASP 243 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 1ns0 s HIS 244 N 0.27 0.34 0.04 -0.67 3.76 -0.35 -4.93 115.29 113.75 1ns0 s HIS 244 Ca 0.22 -0.81 -0.25 0.00 -0.15 0.00 0.00 55.06 54.07 1ns0 s HIS 244 Cb 0.29 -0.24 -0.05 0.00 1.11 0.00 0.00 32.58 33.69 1ns0 s HIS 244 CO -0.05 -0.43 0.77 -2.14 -0.85 0.00 0.00 174.74 172.03 1ns0 s PRO 245 N -3.67 4.50 -0.13 8.40 0.02 -1.26 -0.95 135.00 141.90 1ns0 s PRO 245 Ca 0.04 1.07 -0.01 0.00 0.02 0.00 0.00 61.00 62.11 1ns0 s PRO 245 Cb 0.05 -3.36 -0.02 0.00 0.02 0.00 0.00 34.50 31.19 1ns0 s PRO 245 CO -0.09 0.28 -0.09 -0.06 -0.33 0.00 0.00 177.00 176.71 1ns0 s PHE 246 N -0.04 2.91 -0.27 6.54 0.40 -0.06 -1.56 117.98 125.90 1ns0 s PHE 246 Ca 0.39 -0.43 -0.17 0.00 -0.60 0.00 0.00 56.93 56.11 1ns0 s PHE 246 Cb -0.20 -1.88 -0.03 0.00 0.51 0.00 0.00 43.02 41.42 1ns0 s PHE 246 CO 0.23 -0.09 0.49 -0.51 0.70 0.00 0.00 175.22 176.05 1ns0 s LEU 247 N 0.24 4.06 0.36 -0.37 1.43 -0.42 -1.71 118.68 122.28 1ns0 s LEU 247 Ca -0.06 0.46 -0.28 0.00 -1.03 0.00 0.00 54.13 53.22 1ns0 s LEU 247 Cb -0.15 -2.62 -0.10 0.00 0.03 0.00 0.00 46.19 43.35 1ns0 s LEU 247 CO 0.04 -0.28 1.31 -0.76 0.23 0.00 0.00 176.35 176.89 1ns0 s LEU 248 N 2.28 4.35 0.11 1.79 1.43 -0.60 -3.98 118.68 124.06 1ns0 s LEU 248 Ca 0.20 2.69 -0.11 0.00 -1.03 0.00 0.00 54.13 55.88 1ns0 s LEU 248 Cb -0.16 -3.74 -0.13 0.00 0.03 0.00 0.00 46.19 42.20 1ns0 s LEU 248 CO 0.09 -0.66 1.32 0.44 0.23 0.00 0.00 176.35 177.78 1ns0 h ASP 249 N 3.11 0.90 -3.36 2.29 3.32 -1.17 -3.44 116.42 118.07 1ns0 h ASP 249 Ca -0.49 -0.59 -0.54 0.00 0.02 0.00 0.00 57.03 55.44 1ns0 h ASP 249 Cb 1.23 -0.27 -0.34 0.00 0.22 0.00 0.00 39.33 40.18 1ns0 h ASP 249 CO 0.64 1.38 -0.82 -1.10 -1.72 0.00 0.00 179.24 177.62 1ns0 s GLN 250 N -3.75 1.83 0.33 3.56 -0.21 -1.26 -5.08 119.66 115.08 1ns0 s GLN 250 Ca -0.10 -0.44 -0.07 0.00 0.02 0.00 0.00 55.36 54.77 1ns0 s GLN 250 Cb 0.09 -1.55 -0.06 0.00 1.00 0.00 0.00 33.01 32.49 1ns0 s GLN 250 CO 0.90 -0.01 0.63 -0.51 -2.12 0.00 0.00 175.29 174.18 1ns0 s LEU 251 N 0.82 3.97 0.00 2.90 1.43 -1.26 -4.98 118.68 121.56 1ns0 s LEU 251 Ca -0.11 0.86 0.00 0.00 -1.03 0.00 0.00 54.13 53.85 1ns0 s LEU 251 Cb -0.15 -3.70 0.00 0.00 0.03 0.00 0.00 46.19 42.36 1ns0 s LEU 251 CO 0.02 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 176.94 1ns0 n GLY 252 N -1.08 4.40 0.21 -3.19 0.00 -1.26 -4.91 105.19 99.36 1ns0 n GLY 252 Ca -0.00 -1.00 0.15 0.00 0.00 0.00 0.00 46.02 45.16 1ns0 n GLY 252 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ns0 h LEU 253 N 0.00 0.00 -0.39 0.99 5.85 -1.90 -2.88 115.31 116.98 1ns0 h LEU 253 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1ns0 h LEU 253 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1ns0 h LEU 253 CO 0.00 0.00 -0.09 -2.24 -0.34 0.00 0.00 178.44 175.77 1ns0 h ASP 254 N 0.00 0.00 -3.19 1.25 2.03 -1.91 -3.40 116.42 111.20 1ns0 h ASP 254 Ca 0.00 0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 55.72 1ns0 h ASP 254 Cb 0.33 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.78 1ns0 h ASP 254 CO 0.00 0.09 -0.08 -0.75 -1.03 0.00 0.00 179.24 177.47 1ns0 s LYS 255 N -3.31 4.15 -0.53 4.15 2.36 -1.09 -5.01 119.74 120.46 1ns0 s LYS 255 Ca 0.05 0.65 -0.28 0.00 -2.55 0.00 0.00 55.97 53.84 1ns0 s LYS 255 Cb 0.07 -3.25 0.03 0.00 -1.05 0.00 0.00 37.83 33.62 1ns0 s LYS 255 CO 0.65 0.62 1.22 -2.00 1.55 0.00 0.00 175.35 177.40 1ns0 s GLU 256 N -0.99 3.56 0.03 4.03 2.12 -1.26 -4.57 118.70 121.61 1ns0 s GLU 256 Ca 0.28 0.43 0.09 0.00 0.36 0.00 0.00 54.97 56.13 1ns0 s GLU 256 Cb -0.19 -4.00 -0.23 0.00 0.26 0.00 0.00 34.13 29.98 1ns0 s GLU 256 CO 0.17 -1.61 0.92 1.96 -0.54 0.00 0.00 175.26 176.16 1ns0 h GLN 257 N 9.75 0.02 -3.40 4.30 1.08 -1.44 -3.45 115.11 121.97 1ns0 h GLN 257 Ca -0.25 -0.03 -0.12 0.00 -1.45 0.00 0.00 58.65 56.80 1ns0 h GLN 257 Cb 1.07 0.01 -0.19 0.00 -0.05 0.00 0.00 27.48 28.32 1ns0 h GLN 257 CO 1.16 0.74 -0.38 0.00 -0.95 0.00 0.00 178.83 179.41 1ns0 s ALA 258 N -2.64 -0.48 -0.07 3.87 0.00 -1.19 -1.23 121.76 120.01 1ns0 s ALA 258 Ca -0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 1ns0 s ALA 258 Cb 0.09 0.19 0.04 0.00 0.00 0.00 0.00 23.12 23.44 1ns0 s ALA 258 CO 0.82 -0.30 0.14 0.50 0.00 0.00 0.00 175.76 176.93 1ns0 s ARG 259 N -1.95 0.07 -0.17 0.00 3.52 -0.32 0.14 118.95 120.25 1ns0 s ARG 259 Ca -0.10 0.41 -0.01 0.00 -0.13 0.00 0.00 55.73 55.90 1ns0 s ARG 259 Cb -0.04 -0.21 -0.00 0.00 -1.56 0.00 0.00 34.95 33.14 1ns0 s ARG 259 CO -0.00 -0.20 -0.13 -1.17 -0.81 0.00 0.00 175.30 172.99 1ns0 s LEU 260 N 1.43 2.56 0.03 -0.88 2.96 0.08 -1.52 118.68 123.34 1ns0 s LEU 260 Ca -0.06 -0.46 0.05 0.00 -0.22 0.00 0.00 54.13 53.44 1ns0 s LEU 260 Cb -0.12 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 1ns0 s LEU 260 CO -0.06 0.05 -0.16 -0.89 -1.32 0.00 0.00 176.35 173.98 1ns0 s THR 261 N 1.00 1.24 -0.15 3.68 2.01 -0.35 -0.36 115.64 122.72 1ns0 s THR 261 Ca -0.01 -0.97 -0.04 0.00 0.31 0.00 0.00 61.69 60.98 1ns0 s THR 261 Cb -0.15 -1.10 0.07 0.00 0.01 0.00 0.00 72.50 71.33 1ns0 s THR 261 CO -0.02 0.11 0.17 -0.22 -0.69 0.00 0.00 174.62 173.97 1ns0 s LEU 262 N -0.99 -0.02 0.00 4.42 2.96 0.07 -0.36 118.68 124.76 1ns0 s LEU 262 Ca 0.04 -0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.91 1ns0 s LEU 262 Cb -0.08 0.24 0.00 0.00 0.50 0.00 0.00 46.19 46.85 1ns0 s LEU 262 CO 0.01 -0.29 0.00 0.47 -1.32 0.00 0.00 176.35 175.22 1ns0 n ASP 263 N 5.32 0.00 -0.62 3.68 8.00 -1.23 -0.82 116.55 130.87 1ns0 n ASP 263 Ca -0.05 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.56 1ns0 n ASP 263 Cb 0.50 0.00 0.37 0.00 -0.02 0.00 0.00 41.12 41.97 1ns0 n ASP 263 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ns0 n ASP 264 N 6.49 1.88 -4.50 -2.24 8.00 -1.26 -4.15 116.55 120.78 1ns0 n ASP 264 Ca 0.00 -1.71 -0.33 0.00 0.71 0.00 0.00 54.79 53.45 1ns0 n ASP 264 Cb 0.00 -0.10 -0.13 0.00 -0.02 0.00 0.00 41.12 40.88 1ns0 n ASP 264 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ns0 s THR 265 N -1.81 3.34 0.04 -3.53 2.01 -0.00 0.10 115.64 115.79 1ns0 s THR 265 Ca 0.34 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 61.76 1ns0 s THR 265 Cb 0.19 -2.35 -0.02 0.00 0.01 0.00 0.00 72.50 70.32 1ns0 s THR 265 CO 0.28 0.58 -0.08 -0.44 -0.69 0.00 0.00 174.62 174.27 1ns0 s SER 266 N -0.54 0.94 -0.13 3.53 0.01 -0.33 -0.75 113.70 116.43 1ns0 s SER 266 Ca 0.08 -0.53 0.02 0.00 1.31 0.00 0.00 55.95 56.82 1ns0 s SER 266 Cb -0.12 0.02 0.01 0.00 0.21 0.00 0.00 66.02 66.15 1ns0 s SER 266 CO 0.02 -0.18 -0.18 -0.63 0.41 0.00 0.00 173.24 172.68 1ns0 s ILE 267 N -1.30 1.73 -0.06 1.44 -1.09 0.52 -1.25 121.20 121.18 1ns0 s ILE 267 Ca -0.08 -0.77 -0.02 0.00 -2.23 0.00 0.00 60.65 57.55 1ns0 s ILE 267 Cb -0.10 -1.56 -0.03 0.00 -1.58 0.00 0.00 42.46 39.19 1ns0 s ILE 267 CO 0.01 0.49 0.03 -0.44 -1.23 0.00 0.00 174.94 173.79 1ns0 s SER 268 N 0.98 5.40 -0.14 3.58 0.01 0.55 -0.74 113.70 123.35 1ns0 s SER 268 Ca -0.05 0.16 -0.02 0.00 1.31 0.00 0.00 55.95 57.35 1ns0 s SER 268 Cb -0.15 -1.54 -0.02 0.00 0.21 0.00 0.00 66.02 64.52 1ns0 s SER 268 CO -0.03 0.35 -0.09 -0.69 0.41 0.00 0.00 173.24 173.19 1ns0 s VAL 269 N -0.98 3.41 0.04 3.43 1.01 0.12 -0.81 120.40 126.63 1ns0 s VAL 269 Ca 0.16 -0.53 0.06 0.00 0.00 0.00 0.00 61.98 61.67 1ns0 s VAL 269 Cb -0.12 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 1ns0 s VAL 269 CO 0.05 0.51 -0.18 -0.36 0.00 0.00 0.00 175.10 175.13 1ns0 s PHE 270 N 0.36 1.54 0.05 5.22 0.40 0.26 -0.99 117.98 124.82 1ns0 s PHE 270 Ca -0.08 -0.37 -0.27 0.00 -0.60 0.00 0.00 56.93 55.61 1ns0 s PHE 270 Cb -0.15 -0.91 0.09 0.00 0.51 0.00 0.00 43.02 42.56 1ns0 s PHE 270 CO 0.05 0.07 0.83 -0.08 0.70 0.00 0.00 175.22 176.79 1ns0 s THR 271 N -0.84 0.00 -2.88 0.64 -1.32 -1.26 0.04 115.64 110.02 1ns0 s THR 271 Ca 0.05 -0.08 0.24 0.00 -1.21 0.00 0.00 61.69 60.69 1ns0 s THR 271 Cb -0.08 -1.11 0.23 0.00 -1.51 0.00 0.00 72.50 70.03 1ns0 s THR 271 CO 0.02 0.00 1.28 -0.90 -2.21 0.00 0.00 174.62 172.80 1ns0 n ASP 272 N -0.30 3.07 -4.89 8.08 5.68 -0.83 -3.17 116.55 124.19 1ns0 n ASP 272 Ca -0.10 -1.99 -0.29 0.00 -0.50 0.00 0.00 54.79 51.91 1ns0 n ASP 272 Cb 0.62 -0.04 -0.00 0.00 -1.14 0.00 0.00 41.12 40.56 1ns0 n ASP 272 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 1ns0 s GLN 273 N -1.89 3.60 0.19 0.11 -1.52 -1.26 -4.76 119.66 114.13 1ns0 s GLN 273 Ca 0.30 0.48 0.24 0.00 -1.95 0.00 0.00 55.36 54.43 1ns0 s GLN 273 Cb 0.20 -2.25 0.45 0.00 -0.22 0.00 0.00 33.01 31.19 1ns0 s GLN 273 CO 0.30 -0.34 1.46 -1.00 -0.25 0.00 0.00 175.29 175.46 1ns0 h PRO 274 N 0.13 0.00 -4.40 2.91 0.13 -1.94 -3.45 132.00 125.38 1ns0 h PRO 274 Ca -0.46 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.47 1ns0 h PRO 274 Cb 1.20 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 1ns0 h PRO 274 CO 0.62 0.00 -0.51 -1.54 -0.23 0.00 0.00 178.00 176.34 1ns0 s SER 275 N -4.63 0.12 -0.06 1.44 1.04 -0.88 -1.55 113.70 109.17 1ns0 s SER 275 Ca 0.07 -1.30 -0.03 0.00 0.48 0.00 0.00 55.95 55.18 1ns0 s SER 275 Cb 0.12 0.43 0.04 0.00 0.10 0.00 0.00 66.02 66.70 1ns0 s SER 275 CO 0.69 -0.91 0.06 -0.63 0.98 0.00 0.00 173.24 173.44 1ns0 s ILE 276 N -4.12 -0.10 -0.27 -1.02 1.01 -0.69 -1.93 121.20 114.08 1ns0 s ILE 276 Ca 0.36 0.32 -0.21 0.00 0.00 0.00 0.00 60.65 61.11 1ns0 s ILE 276 Cb 0.05 -0.23 -0.01 0.00 0.01 0.00 0.00 42.46 42.28 1ns0 s ILE 276 CO 0.12 0.10 0.66 -0.69 0.00 0.00 0.00 174.94 175.13 1ns0 s VAL 277 N 2.16 4.94 -0.26 2.92 1.01 0.48 -0.88 120.40 130.77 1ns0 s VAL 277 Ca 0.04 1.12 -0.07 0.00 0.00 0.00 0.00 61.98 63.08 1ns0 s VAL 277 Cb -0.13 -3.98 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 1ns0 s VAL 277 CO -0.04 -0.04 0.06 -0.63 0.00 0.00 0.00 175.10 174.45 1ns0 s ILE 278 N 2.60 4.16 -0.14 2.22 1.01 -0.12 -1.68 121.20 129.25 1ns0 s ILE 278 Ca 0.27 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.62 1ns0 s ILE 278 Cb -0.15 -2.98 0.02 0.00 0.01 0.00 0.00 42.46 39.36 1ns0 s ILE 278 CO 0.09 0.29 -0.14 0.12 0.00 0.00 0.00 174.94 175.31 1ns0 s PHE 279 N 1.58 2.04 -0.64 3.97 5.36 -1.26 -1.21 117.98 127.82 1ns0 s PHE 279 Ca 0.06 -1.10 -0.02 0.00 -0.96 0.00 0.00 56.93 54.91 1ns0 s PHE 279 Cb -0.15 -1.51 0.39 0.00 -0.34 0.00 0.00 43.02 41.40 1ns0 s PHE 279 CO 0.03 -0.61 2.06 0.25 -1.46 0.00 0.00 175.22 175.49 1ns0 n THR 280 N 4.67 3.50 -3.86 0.12 -2.24 -0.25 -2.12 114.28 114.10 1ns0 n THR 280 Ca -0.17 -2.96 -0.33 0.00 -2.27 0.00 0.00 64.05 58.32 1ns0 n THR 280 Cb 0.50 -1.21 0.02 0.00 -2.10 0.00 0.00 70.33 67.54 1ns0 n THR 280 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ns0 n ALA 281 N -0.62 -2.41 -0.80 6.98 0.00 -1.22 -3.38 120.51 119.05 1ns0 n ALA 281 Ca 0.57 -0.33 -0.08 0.00 0.00 0.00 0.00 53.44 53.59 1ns0 n ALA 281 Cb 0.58 -3.01 -0.11 0.00 0.00 0.00 0.00 19.45 16.91 1ns0 n ALA 281 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ns0 n ASN 282 N -2.64 4.97 -0.09 0.00 3.02 -1.26 -0.72 115.26 118.53 1ns0 n ASN 282 Ca -0.16 -2.40 0.11 0.00 -0.03 0.00 0.00 54.58 52.11 1ns0 n ASN 282 Cb 0.61 -1.26 0.62 0.00 -0.61 0.00 0.00 39.78 39.15 1ns0 n ASN 282 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1ns0 n PHE 283 N 2.23 0.02 -2.09 3.10 3.01 -1.26 -4.96 117.46 117.52 1ns0 n PHE 283 Ca 0.28 -0.01 0.00 0.00 1.01 0.00 0.00 57.45 58.73 1ns0 n PHE 283 Cb 0.75 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.22 1ns0 n PHE 283 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ns0 n GLY 284 N 0.89 3.29 0.83 1.37 0.00 -1.26 -1.75 105.19 108.56 1ns0 n GLY 284 Ca 0.17 -0.21 0.05 0.00 0.00 0.00 0.00 46.02 46.03 1ns0 n GLY 284 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ns0 n ASP 285 N 3.08 2.37 -0.29 1.61 9.92 -1.26 -3.43 116.55 128.55 1ns0 n ASP 285 Ca 0.00 -2.13 0.11 0.00 -0.53 0.00 0.00 54.79 52.25 1ns0 n ASP 285 Cb 0.00 -0.34 0.27 0.00 -0.64 0.00 0.00 41.12 40.41 1ns0 n ASP 285 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1ns0 h LEU 286 N 2.13 0.18 -1.44 0.64 5.85 -1.66 -3.46 115.31 117.55 1ns0 h LEU 286 Ca 0.00 0.16 -0.38 0.00 0.84 0.00 0.00 57.88 58.50 1ns0 h LEU 286 Cb 0.70 0.18 0.12 0.00 0.37 0.00 0.00 40.66 42.03 1ns0 h LEU 286 CO 0.07 -0.04 -0.76 0.61 -0.34 0.00 0.00 178.44 177.97 1ns0 n GLY 287 N -1.35 -0.40 3.76 3.75 0.00 -1.24 -4.94 105.19 104.77 1ns0 n GLY 287 Ca 0.20 0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.96 1ns0 n GLY 287 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ns0 s THR 288 N -3.41 2.17 -0.14 2.61 2.01 -1.26 -4.14 115.64 113.48 1ns0 s THR 288 Ca 0.19 0.16 -0.25 0.00 0.31 0.00 0.00 61.69 62.10 1ns0 s THR 288 Cb -0.09 -3.10 -0.02 0.00 0.01 0.00 0.00 72.50 69.30 1ns0 s THR 288 CO 0.76 0.03 0.80 -0.76 -0.69 0.00 0.00 174.62 174.76 1ns0 s LEU 289 N -1.14 4.21 -0.26 4.42 1.43 -1.26 -0.19 118.68 125.89 1ns0 s LEU 289 Ca 0.58 1.17 -0.00 0.00 -1.03 0.00 0.00 54.13 54.85 1ns0 s LEU 289 Cb -0.46 -3.20 0.04 0.00 0.03 0.00 0.00 46.19 42.60 1ns0 s LEU 289 CO 0.53 -0.33 -0.06 -0.31 0.23 0.00 0.00 176.35 176.41 1ns0 s TYR 290 N 1.83 3.16 -1.50 0.29 1.51 0.44 -4.61 117.35 118.46 1ns0 s TYR 290 Ca 0.38 -1.84 -0.12 0.00 -1.01 0.00 0.00 57.07 54.48 1ns0 s TYR 290 Cb -0.17 -2.03 0.07 0.00 -0.11 0.00 0.00 41.96 39.72 1ns0 s TYR 290 CO 0.14 -0.79 0.93 0.72 -1.11 0.00 0.00 175.55 175.43 1ns0 n HIS 291 N 4.59 -2.22 -0.87 2.71 8.25 -1.26 -0.21 115.22 126.21 1ns0 n HIS 291 Ca -0.15 0.89 0.00 0.00 -0.26 0.00 0.00 57.72 58.20 1ns0 n HIS 291 Cb 0.45 -4.02 0.00 0.00 1.12 0.00 0.00 29.99 27.54 1ns0 n HIS 291 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1ns0 n GLU 292 N -4.62 -0.39 -3.82 -0.41 -0.58 -1.26 -4.99 120.64 104.57 1ns0 n GLU 292 Ca -0.02 0.10 -0.35 0.00 -0.42 0.00 0.00 57.16 56.47 1ns0 n GLU 292 Cb 0.55 -3.63 -0.08 0.00 -0.57 0.00 0.00 31.44 27.72 1ns0 n GLU 292 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1ns0 s LYS 293 N -0.65 3.98 -0.07 3.49 -0.14 0.71 -5.04 119.74 122.01 1ns0 s LYS 293 Ca 0.00 -0.22 -0.30 0.00 -1.36 0.00 0.00 55.97 54.09 1ns0 s LYS 293 Cb 0.00 -3.33 -0.04 0.00 -1.68 0.00 0.00 37.83 32.79 1ns0 s LYS 293 CO 0.00 0.41 1.33 0.15 -0.76 0.00 0.00 175.35 176.47 1ns0 s LYS 294 N 0.04 4.28 0.23 1.68 1.02 -1.26 -0.42 119.74 125.30 1ns0 s LYS 294 Ca 0.09 1.82 -0.30 0.00 0.02 0.00 0.00 55.97 57.60 1ns0 s LYS 294 Cb -0.11 -3.66 -0.09 0.00 -0.52 0.00 0.00 37.83 33.45 1ns0 s LYS 294 CO -0.00 -0.60 1.30 -1.14 -0.92 0.00 0.00 175.35 173.99 1ns0 s GLN 295 N 2.80 4.39 0.33 1.68 0.74 0.73 -3.62 119.66 126.72 1ns0 s GLN 295 Ca 0.60 2.07 -0.02 0.00 0.05 0.00 0.00 55.36 58.06 1ns0 s GLN 295 Cb -0.27 -3.17 -0.04 0.00 1.10 0.00 0.00 33.01 30.63 1ns0 s GLN 295 CO 0.22 -0.22 0.56 0.14 -0.55 0.00 0.00 175.29 175.45 1ns0 s VAL 296 N -0.17 5.06 0.20 1.34 -7.23 -0.31 -3.70 120.40 115.59 1ns0 s VAL 296 Ca 0.55 -0.21 -0.33 0.00 -1.81 0.00 0.00 61.98 60.18 1ns0 s VAL 296 Cb -0.37 -3.81 -0.13 0.00 0.56 0.00 0.00 36.38 32.63 1ns0 s VAL 296 CO 0.41 -0.48 1.56 1.57 -0.31 0.00 0.00 175.10 177.85 1ns0 n HIS 297 N -1.46 2.36 -1.20 2.82 -0.00 -1.22 0.11 115.22 116.62 1ns0 n HIS 297 Ca -0.03 0.27 -0.07 0.00 0.46 0.00 0.00 57.72 58.35 1ns0 n HIS 297 Cb 0.55 -2.55 -0.03 0.00 -0.12 0.00 0.00 29.99 27.85 1ns0 n HIS 297 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 1ns0 n HIS 298 N 3.05 -0.00 0.81 1.57 8.25 0.10 -4.77 115.22 124.23 1ns0 n HIS 298 Ca 0.15 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.60 1ns0 n HIS 298 Cb 0.31 -1.45 0.03 0.00 1.12 0.00 0.00 29.99 30.00 1ns0 n HIS 298 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ns0 n GLY 299 N -2.17 1.95 0.00 -1.41 0.00 0.30 -1.44 105.19 102.42 1ns0 n GLY 299 Ca -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1ns0 n GLY 299 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ns0 n GLY 300 N 0.21 0.53 3.15 -0.02 0.00 -1.26 -4.78 105.19 103.01 1ns0 n GLY 300 Ca 0.04 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 1ns0 n GLY 300 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1ns0 s ILE 301 N -2.00 -0.01 0.29 -0.61 2.07 -0.57 -3.46 121.20 116.92 1ns0 s ILE 301 Ca 0.00 0.03 0.06 0.00 -1.41 0.00 0.00 60.65 59.33 1ns0 s ILE 301 Cb 0.00 -0.40 -0.02 0.00 0.13 0.00 0.00 42.46 42.17 1ns0 s ILE 301 CO 0.00 0.01 0.38 0.42 -1.91 0.00 0.00 174.94 173.84 1ns0 s THR 302 N 0.41 4.50 -0.41 4.00 -4.23 -0.90 -0.34 115.64 118.67 1ns0 s THR 302 Ca -0.02 -1.08 0.04 0.00 -1.18 0.00 0.00 61.69 59.45 1ns0 s THR 302 Cb -0.04 -3.55 0.18 0.00 1.34 0.00 0.00 72.50 70.43 1ns0 s THR 302 CO -0.02 -0.25 0.36 0.49 -0.54 0.00 0.00 174.62 174.66 1ns0 n PHE 303 N -1.47 -0.85 -2.85 3.99 3.01 -1.25 -4.13 117.46 113.90 1ns0 n PHE 303 Ca -0.05 -3.33 -0.43 0.00 1.01 0.00 0.00 57.45 54.65 1ns0 n PHE 303 Cb 0.58 0.21 -0.04 0.00 -0.01 0.00 0.00 39.48 40.22 1ns0 n PHE 303 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1ns0 s GLN 304 N -0.06 3.28 -0.19 -1.08 -0.21 -0.68 -4.88 119.66 115.84 1ns0 s GLN 304 Ca 0.33 -0.40 -0.20 0.00 0.02 0.00 0.00 55.36 55.11 1ns0 s GLN 304 Cb 0.05 -4.09 -0.03 0.00 1.00 0.00 0.00 33.01 29.94 1ns0 s GLN 304 CO -0.19 -1.55 0.59 0.00 -2.12 0.00 0.00 175.29 172.02 1ns0 n GLN 306 N 4.88 0.27 -2.55 0.00 10.64 -0.81 -4.65 117.38 125.15 1ns0 n GLN 306 Ca -0.03 -0.75 -0.41 0.00 -1.83 0.00 0.00 57.00 53.99 1ns0 n GLN 306 Cb 0.50 1.10 -0.04 0.00 -0.86 0.00 0.00 30.24 30.94 1ns0 n GLN 306 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1ns0 s VAL 307 N -2.13 4.13 0.37 -0.39 1.01 -1.26 -2.07 120.40 120.04 1ns0 s VAL 307 Ca 0.18 1.71 -0.27 0.00 0.00 0.00 0.00 61.98 63.60 1ns0 s VAL 307 Cb -0.01 -4.09 -0.12 0.00 0.00 0.00 0.00 36.38 32.16 1ns0 s VAL 307 CO 0.01 0.23 1.25 -0.24 0.00 0.00 0.00 175.10 176.36 1ns0 n SER 308 N 2.97 2.54 -4.73 3.32 2.88 -1.26 -4.95 113.62 114.39 1ns0 n SER 308 Ca 0.04 1.17 -0.34 0.00 -1.33 0.00 0.00 58.87 58.42 1ns0 n SER 308 Cb 0.47 -1.47 0.09 0.00 -0.75 0.00 0.00 64.21 62.55 1ns0 n SER 308 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 1ns0 s PRO 309 N -1.97 2.14 0.00 -1.46 0.02 -1.26 -3.69 135.00 128.78 1ns0 s PRO 309 Ca 0.58 1.65 0.00 0.00 0.02 0.00 0.00 61.00 63.25 1ns0 s PRO 309 Cb -0.56 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.12 1ns0 s PRO 309 CO 0.61 -1.81 0.00 0.41 -0.33 0.00 0.00 177.00 175.88 1ns0 n GLY 310 N 0.16 0.64 0.16 0.52 0.00 -1.26 -4.93 105.19 100.46 1ns0 n GLY 310 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.25 1ns0 n GLY 310 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ns0 n SER 311 N 0.00 0.56 -0.22 1.61 3.41 -1.24 -0.12 113.62 117.61 1ns0 n SER 311 Ca 0.00 0.75 -0.08 0.00 -0.26 0.00 0.00 58.87 59.28 1ns0 n SER 311 Cb 0.00 -0.83 0.05 0.00 -0.26 0.00 0.00 64.21 63.17 1ns0 n SER 311 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1ns0 h GLU 312 N 0.00 1.08 0.02 4.33 3.07 -1.92 -3.17 114.58 118.00 1ns0 h GLU 312 Ca 0.00 -0.30 -0.33 0.00 -0.50 0.00 0.00 59.36 58.23 1ns0 h GLU 312 Cb 0.03 -0.12 -0.05 0.00 -0.84 0.00 0.00 28.75 27.77 1ns0 h GLU 312 CO 0.00 1.01 -2.00 1.04 -1.40 0.00 0.00 179.01 177.66 1ns0 n GLN 313 N -4.20 0.67 -3.89 2.33 3.00 0.17 -4.68 117.38 110.77 1ns0 n GLN 313 Ca 0.04 0.20 -0.29 0.00 -0.01 0.00 0.00 57.00 56.94 1ns0 n GLN 313 Cb 0.31 -1.69 -0.12 0.00 0.00 0.00 0.00 30.24 28.74 1ns0 n GLN 313 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1ns0 s ILE 314 N -2.56 2.95 0.56 5.09 1.01 0.83 -4.95 121.20 124.13 1ns0 s ILE 314 Ca -0.12 -4.07 0.33 0.00 0.00 0.00 0.00 60.65 56.79 1ns0 s ILE 314 Cb 0.07 -2.94 0.48 0.00 0.01 0.00 0.00 42.46 40.07 1ns0 s ILE 314 CO 0.80 -0.97 1.79 -0.65 0.00 0.00 0.00 174.94 175.91 1ns0 h PRO 315 N 5.66 0.00 0.00 2.79 0.10 -1.81 0.11 132.00 138.85 1ns0 h PRO 315 Ca 0.10 0.00 -0.02 0.00 0.10 0.00 0.00 66.00 66.18 1ns0 h PRO 315 Cb 0.78 0.00 -0.00 0.00 0.10 0.00 0.00 31.00 31.88 1ns0 h PRO 315 CO 0.72 0.00 -0.10 0.93 0.10 0.00 0.00 178.00 179.65 1ns0 h GLU 316 N 0.00 0.00 0.00 1.05 3.07 -1.92 -2.51 114.58 114.27 1ns0 h GLU 316 Ca 0.43 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.27 1ns0 h GLU 316 Cb 1.93 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.84 1ns0 h GLU 316 CO -0.00 0.10 -0.10 -0.07 -1.40 0.00 0.00 179.01 177.53 1ns0 h LEU 317 N 0.00 0.00 0.00 1.33 3.38 -1.13 -3.49 115.31 115.41 1ns0 h LEU 317 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ns0 h LEU 317 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1ns0 h LEU 317 CO 0.01 0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.26 1ns0 n GLY 318 N -0.54 0.98 2.91 0.83 0.00 -0.95 -4.49 105.19 103.92 1ns0 n GLY 318 Ca -0.01 -1.98 -0.28 0.00 0.00 0.00 0.00 46.02 43.75 1ns0 n GLY 318 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ns0 s ASP 319 N -1.42 2.63 -0.12 1.61 2.15 -1.26 -4.79 116.67 115.46 1ns0 s ASP 319 Ca 0.00 -0.54 0.18 0.00 0.43 0.00 0.00 52.55 52.62 1ns0 s ASP 319 Cb 0.00 -0.92 0.70 0.00 -0.30 0.00 0.00 42.92 42.40 1ns0 s ASP 319 CO 0.00 -0.15 1.61 2.30 -0.17 0.00 0.00 175.17 178.76 1ns0 n ILE 320 N 4.88 1.87 -1.83 4.11 -5.35 -1.26 -4.95 119.36 116.83 1ns0 n ILE 320 Ca -0.12 -1.24 -0.34 0.00 -0.27 0.00 0.00 62.75 60.78 1ns0 n ILE 320 Cb 0.49 0.11 0.04 0.00 -1.74 0.00 0.00 39.64 38.54 1ns0 n ILE 320 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1ns0 s SER 321 N -0.97 5.09 -0.13 7.28 1.04 -1.26 -1.15 113.70 123.59 1ns0 s SER 321 Ca 0.50 2.13 -0.02 0.00 0.48 0.00 0.00 55.95 59.04 1ns0 s SER 321 Cb 0.33 -2.57 0.04 0.00 0.10 0.00 0.00 66.02 63.92 1ns0 s SER 321 CO 0.23 -1.65 0.00 -0.22 0.98 0.00 0.00 173.24 172.59 1ns0 s LEU 322 N -4.63 0.99 0.39 2.42 2.96 0.46 -4.75 118.68 116.51 1ns0 s LEU 322 Ca 0.70 -0.46 -0.24 0.00 -0.22 0.00 0.00 54.13 53.91 1ns0 s LEU 322 Cb -0.23 -0.59 -0.10 0.00 0.50 0.00 0.00 46.19 45.77 1ns0 s LEU 322 CO 0.38 -0.23 0.99 -0.54 -1.32 0.00 0.00 176.35 175.64 1ns0 s LYS 323 N 1.87 4.28 0.22 1.98 1.02 -1.26 0.00 119.74 127.85 1ns0 s LYS 323 Ca 0.02 1.36 -0.32 0.00 0.02 0.00 0.00 55.97 57.05 1ns0 s LYS 323 Cb -0.15 -2.51 -0.14 0.00 -0.52 0.00 0.00 37.83 34.51 1ns0 s LYS 323 CO -0.07 -0.01 1.30 0.00 -0.92 0.00 0.00 175.35 175.66 1ns0 n ALA 324 N -0.07 0.38 0.00 5.17 0.00 -1.26 -0.29 120.51 124.44 1ns0 n ALA 324 Ca 0.05 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1ns0 n ALA 324 Cb 0.51 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1ns0 n ALA 324 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ns0 n GLY 325 N 2.06 2.87 3.77 0.00 0.00 0.24 -4.95 105.19 109.17 1ns0 n GLY 325 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1ns0 n GLY 325 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ns0 s GLU 326 N 0.00 4.43 -0.34 1.61 -1.05 0.60 -4.95 118.70 119.00 1ns0 s GLU 326 Ca 0.00 0.97 -0.24 0.00 -0.15 0.00 0.00 54.97 55.55 1ns0 s GLU 326 Cb 0.00 -3.31 0.01 0.00 -0.44 0.00 0.00 34.13 30.39 1ns0 s GLU 326 CO 0.00 0.44 0.83 0.21 0.95 0.00 0.00 175.26 177.69 1ns0 s LYS 327 N -0.55 3.87 0.30 -4.83 2.36 -1.26 -4.46 119.74 115.17 1ns0 s LYS 327 Ca 0.35 0.52 -0.16 0.00 -2.55 0.00 0.00 55.97 54.12 1ns0 s LYS 327 Cb -0.21 -3.77 -0.09 0.00 -1.05 0.00 0.00 37.83 32.71 1ns0 s LYS 327 CO 0.22 -0.81 0.74 -0.47 1.55 0.00 0.00 175.35 176.58 1ns0 s TYR 328 N 3.16 3.45 -0.08 4.03 5.04 0.18 -4.91 117.35 128.22 1ns0 s TYR 328 Ca 0.34 1.28 -0.15 0.00 -2.44 0.00 0.00 57.07 56.10 1ns0 s TYR 328 Cb -0.13 -2.57 0.03 0.00 0.35 0.00 0.00 41.96 39.64 1ns0 s TYR 328 CO 0.16 0.15 0.37 -0.65 -1.34 0.00 0.00 175.55 174.24 1ns0 s GLN 329 N -2.71 0.59 -0.03 4.97 -0.21 -1.26 -2.14 119.66 118.88 1ns0 s GLN 329 Ca 0.51 0.18 -0.18 0.00 0.02 0.00 0.00 55.36 55.90 1ns0 s GLN 329 Cb -0.12 0.27 0.03 0.00 1.00 0.00 0.00 33.01 34.20 1ns0 s GLN 329 CO 0.18 -0.13 0.39 0.00 -2.12 0.00 0.00 175.29 173.61 1ns0 s ALA 330 N -0.59 -1.00 -0.05 6.09 0.00 -0.93 -4.97 121.76 120.31 1ns0 s ALA 330 Ca -0.07 0.58 -0.02 0.00 0.00 0.00 0.00 51.96 52.45 1ns0 s ALA 330 Cb -0.04 0.02 0.04 0.00 0.00 0.00 0.00 23.12 23.14 1ns0 s ALA 330 CO 0.03 -0.28 0.10 0.99 0.00 0.00 0.00 175.76 176.60 1ns0 s THR 331 N -1.22 -0.08 -0.02 0.00 2.01 -1.26 -0.86 115.64 114.22 1ns0 s THR 331 Ca -0.12 0.23 0.04 0.00 0.31 0.00 0.00 61.69 62.14 1ns0 s THR 331 Cb -0.04 -0.18 -0.00 0.00 0.01 0.00 0.00 72.50 72.28 1ns0 s THR 331 CO 0.05 0.09 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.06 1ns0 s THR 332 N 1.31 1.04 -0.04 -0.82 2.01 -0.26 -1.97 115.64 116.90 1ns0 s THR 332 Ca -0.07 -0.53 0.02 0.00 0.31 0.00 0.00 61.69 61.43 1ns0 s THR 332 Cb -0.12 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.51 1ns0 s THR 332 CO -0.05 0.30 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.46 1ns0 s ILE 333 N -0.06 0.85 -0.18 1.82 1.01 0.11 -0.72 121.20 124.01 1ns0 s ILE 333 Ca 0.00 -0.36 -0.00 0.00 0.00 0.00 0.00 60.65 60.29 1ns0 s ILE 333 Cb -0.08 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.63 1ns0 s ILE 333 CO 0.00 0.27 -0.16 -0.31 0.00 0.00 0.00 174.94 174.74 1ns0 s TYR 334 N 0.40 2.81 -0.02 3.97 1.51 -0.53 -0.57 117.35 124.92 1ns0 s TYR 334 Ca -0.07 -1.42 0.07 0.00 -1.01 0.00 0.00 57.07 54.64 1ns0 s TYR 334 Cb -0.11 -1.95 -0.02 0.00 -0.11 0.00 0.00 41.96 39.77 1ns0 s TYR 334 CO 0.01 -0.71 -0.24 -1.54 -1.11 0.00 0.00 175.55 171.96 1ns0 s SER 335 N 1.27 2.88 -0.14 2.29 1.04 0.01 -0.71 113.70 120.33 1ns0 s SER 335 Ca 0.04 -0.45 -0.08 0.00 0.48 0.00 0.00 55.95 55.94 1ns0 s SER 335 Cb -0.14 -0.36 -0.04 0.00 0.10 0.00 0.00 66.02 65.58 1ns0 s SER 335 CO -0.09 0.29 0.14 -0.22 0.98 0.00 0.00 173.24 174.34 1ns0 s LEU 336 N -0.53 4.33 0.04 2.42 2.96 -0.91 -0.33 118.68 126.66 1ns0 s LEU 336 Ca 0.08 0.40 -0.00 0.00 -0.22 0.00 0.00 54.13 54.38 1ns0 s LEU 336 Cb -0.10 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.49 1ns0 s LEU 336 CO -0.01 0.34 -0.03 -1.00 -1.32 0.00 0.00 176.35 174.33 1ns0 s HIS 337 N -0.62 0.45 -0.03 5.38 3.76 -0.38 -4.82 115.29 119.02 1ns0 s HIS 337 Ca 0.13 -0.86 0.06 0.00 -0.15 0.00 0.00 55.06 54.24 1ns0 s HIS 337 Cb -0.12 -0.32 -0.01 0.00 1.11 0.00 0.00 32.58 33.24 1ns0 s HIS 337 CO 0.02 -0.30 -0.21 0.99 -0.85 0.00 0.00 174.74 174.39 1ns0 s THR 338 N -2.97 1.73 -1.47 1.30 2.01 -1.26 -1.19 115.64 113.79 1ns0 s THR 338 Ca -0.01 -0.91 -0.11 0.00 0.31 0.00 0.00 61.69 60.96 1ns0 s THR 338 Cb 0.01 -1.45 0.06 0.00 0.01 0.00 0.00 72.50 71.12 1ns0 s THR 338 CO -0.06 0.49 0.98 0.29 -0.69 0.00 0.00 174.62 175.62 1ns0 n LYS 339 N 2.79 -6.05 0.14 4.92 5.02 0.28 -4.88 118.16 120.37 1ns0 n LYS 339 Ca -0.17 0.69 -0.00 0.00 -2.02 0.00 0.00 58.31 56.81 1ns0 n LYS 339 Cb 0.52 -5.61 0.25 0.00 -0.02 0.00 0.00 35.03 30.17 1ns0 n LYS 339 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1ns0 h LEU 340 N -2.13 0.10 -8.13 -0.35 5.85 -1.85 -3.46 115.31 105.33 1ns0 h LEU 340 Ca -0.56 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.06 1ns0 h LEU 340 Cb 1.37 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 1ns0 h LEU 340 CO 0.62 0.55 0.12 -1.83 -0.34 0.00 0.00 178.44 177.56 1ns0 s GLU 341 N -4.01 2.00 -0.43 1.25 -1.05 -1.26 -5.13 118.70 110.08 1ns0 s GLU 341 Ca -0.03 -1.39 -0.18 0.00 -0.15 0.00 0.00 54.97 53.22 1ns0 s GLU 341 Cb 0.13 0.57 0.03 0.00 -0.44 0.00 0.00 34.13 34.42 1ns0 s GLU 341 CO 0.75 -0.90 0.47 -1.01 0.95 0.00 0.00 175.26 175.52 1ns0 s HIS 342 N -2.98 3.15 -0.38 4.83 3.76 -1.26 -4.87 115.29 117.54 1ns0 s HIS 342 Ca 0.18 -0.40 0.01 0.00 -0.15 0.00 0.00 55.06 54.71 1ns0 s HIS 342 Cb -0.04 -3.01 0.12 0.00 1.11 0.00 0.00 32.58 30.76 1ns0 s HIS 342 CO 0.12 -0.76 0.18 -1.58 -0.85 0.00 0.00 174.74 171.85 1ns0 s HIS 343 N 2.22 1.91 -0.39 1.40 5.04 -1.26 -5.04 115.29 119.17 1ns0 s HIS 343 Ca 0.13 -2.17 0.02 0.00 -1.54 0.00 0.00 55.06 51.50 1ns0 s HIS 343 Cb -0.17 -1.83 0.12 0.00 0.04 0.00 0.00 32.58 30.73 1ns0 s HIS 343 CO 0.13 -0.83 0.17 -1.01 -2.34 0.00 0.00 174.74 170.87 1ns0 s HIS 344 N 0.88 2.28 0.43 3.88 3.76 -1.26 -3.49 115.29 121.76 1ns0 s HIS 344 Ca 0.14 -2.37 0.04 0.00 -0.15 0.00 0.00 55.06 52.72 1ns0 s HIS 344 Cb -0.22 -2.08 -0.04 0.00 1.11 0.00 0.00 32.58 31.35 1ns0 s HIS 344 CO -0.09 -0.83 0.04 -1.01 -0.85 0.00 0.00 174.74 171.99 1ns0 s HIS 345 N 0.77 2.06 -0.03 1.40 3.76 -1.26 -5.14 115.29 116.85 1ns0 s HIS 345 Ca 0.14 -0.93 -0.01 0.00 -0.15 0.00 0.00 55.06 54.11 1ns0 s HIS 345 Cb -0.22 -1.53 0.02 0.00 1.11 0.00 0.00 32.58 31.97 1ns0 s HIS 345 CO -0.09 0.17 0.06 -3.38 -0.85 0.00 0.00 174.74 170.65 1ns0 s HIS 346 N -2.96 -0.05 0.00 1.40 -3.43 -1.26 -5.09 115.29 103.90 1ns0 s HIS 346 Ca 0.23 0.19 0.00 0.00 -0.80 0.00 0.00 55.06 54.68 1ns0 s HIS 346 Cb 0.06 -0.07 0.00 0.00 -1.43 0.00 0.00 32.58 31.14 1ns0 s HIS 346 CO 0.12 -0.07 0.36 0.72 -2.00 0.00 0.00 174.74 173.87