#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mmu s ILE 3 N 0.00 2.08 0.03 -1.33 1.01 -1.26 -1.45 121.20 120.28 1mmu s ILE 3 Ca 0.00 -1.19 0.01 0.00 0.00 0.00 0.00 60.65 59.47 1mmu s ILE 3 Cb 0.00 -1.74 -0.02 0.00 0.01 0.00 0.00 42.46 40.71 1mmu s ILE 3 CO 0.00 0.52 -0.05 -0.54 0.00 0.00 0.00 174.94 174.87 1mmu s LYS 4 N -0.79 0.40 0.02 2.79 -0.14 -0.39 -4.98 119.74 116.64 1mmu s LYS 4 Ca 0.11 -0.61 0.04 0.00 -1.36 0.00 0.00 55.97 54.14 1mmu s LYS 4 Cb -0.10 -0.12 -0.02 0.00 -1.68 0.00 0.00 37.83 35.92 1mmu s LYS 4 CO -0.00 0.01 -0.11 0.42 -0.76 0.00 0.00 175.35 174.91 1mmu s ILE 5 N -1.24 0.84 0.24 2.17 1.01 -1.26 -0.27 121.20 122.69 1mmu s ILE 5 Ca -0.11 -0.78 -0.22 0.00 0.00 0.00 0.00 60.65 59.54 1mmu s ILE 5 Cb -0.09 -0.77 0.04 0.00 0.01 0.00 0.00 42.46 41.65 1mmu s ILE 5 CO -0.00 -0.00 0.72 0.00 0.00 0.00 0.00 174.94 175.66 1mmu s ARG 6 N -0.88 1.61 0.31 2.79 1.70 -0.63 -4.97 118.95 118.88 1mmu s ARG 6 Ca 0.00 -0.83 -0.29 0.00 -0.47 0.00 0.00 55.73 54.14 1mmu s ARG 6 Cb -0.07 0.58 -0.10 0.00 -0.57 0.00 0.00 34.95 34.80 1mmu s ARG 6 CO 0.01 -0.73 1.20 0.16 -1.08 0.00 0.00 175.30 174.85 1mmu s ASP 7 N -2.88 7.01 0.00 -2.89 1.47 -1.26 -0.06 116.67 118.07 1mmu s ASP 7 Ca 0.09 2.47 0.09 0.00 1.18 0.00 0.00 52.55 56.37 1mmu s ASP 7 Cb -0.04 -2.64 0.00 0.00 -0.34 0.00 0.00 42.92 39.90 1mmu s ASP 7 CO 0.02 -0.35 0.61 0.33 0.68 0.00 0.00 175.17 176.46 1mmu n PHE 8 N 0.96 0.00 0.00 2.11 7.35 0.10 -4.64 117.46 123.33 1mmu n PHE 8 Ca -0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1mmu n PHE 8 Cb 0.43 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.26 1mmu n PHE 8 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1mmu n GLY 9 N 0.82 3.34 2.42 7.13 0.00 -1.21 -1.52 105.19 116.17 1mmu n GLY 9 Ca 0.04 -1.68 -0.13 0.00 0.00 0.00 0.00 46.02 44.24 1mmu n GLY 9 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1mmu n LEU 10 N 0.00 -0.78 0.00 0.99 4.77 -1.26 -0.54 117.00 120.17 1mmu n LEU 10 Ca 0.00 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 1mmu n LEU 10 Cb 0.00 -2.37 0.00 0.00 -2.33 0.00 0.00 43.42 38.72 1mmu n LEU 10 CO 0.00 -0.88 0.00 0.61 -1.33 0.00 0.00 177.39 175.79 1mmu n GLY 11 N -0.06 0.22 3.87 -0.72 0.00 -1.26 -5.07 105.19 102.16 1mmu n GLY 11 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 1mmu n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1mmu s SER 12 N -2.36 6.39 0.28 1.61 1.04 0.29 -4.94 113.70 116.01 1mmu s SER 12 Ca 0.00 1.36 0.11 0.00 0.48 0.00 0.00 55.95 57.90 1mmu s SER 12 Cb 0.00 -2.43 -0.05 0.00 0.10 0.00 0.00 66.02 63.64 1mmu s SER 12 CO 0.00 -0.68 -0.11 -1.81 0.98 0.00 0.00 173.24 171.62 1mmu s ASP 13 N -3.70 3.99 -0.16 7.02 1.01 -1.26 0.00 116.67 123.56 1mmu s ASP 13 Ca 0.55 -0.89 0.00 0.00 0.71 0.00 0.00 52.55 52.91 1mmu s ASP 13 Cb -0.10 -0.52 0.00 0.00 1.01 0.00 0.00 42.92 43.31 1mmu s ASP 13 CO 0.43 -0.00 -0.15 -0.22 0.21 0.00 0.00 175.17 175.43 1mmu s LEU 14 N -3.59 2.44 -0.28 1.23 2.96 0.92 -3.40 118.68 118.96 1mmu s LEU 14 Ca 0.31 -0.50 -0.07 0.00 -0.22 0.00 0.00 54.13 53.66 1mmu s LEU 14 Cb -0.05 -1.56 0.00 0.00 0.50 0.00 0.00 46.19 45.08 1mmu s LEU 14 CO 0.17 0.06 0.07 -0.63 -1.32 0.00 0.00 176.35 174.70 1mmu s ILE 15 N 0.95 3.97 -0.17 6.68 1.09 0.24 -1.60 121.20 132.35 1mmu s ILE 15 Ca -0.03 -0.61 -0.02 0.00 -1.10 0.00 0.00 60.65 58.89 1mmu s ILE 15 Cb -0.15 -3.01 -0.01 0.00 -1.06 0.00 0.00 42.46 38.24 1mmu s ILE 15 CO -0.02 0.14 -0.10 -0.44 -0.10 0.00 0.00 174.94 174.41 1mmu s SER 16 N 1.51 4.10 0.06 3.58 0.01 0.63 -1.67 113.70 121.92 1mmu s SER 16 Ca 0.03 -0.36 0.06 0.00 1.31 0.00 0.00 55.95 56.99 1mmu s SER 16 Cb -0.17 -1.66 -0.04 0.00 0.21 0.00 0.00 66.02 64.37 1mmu s SER 16 CO 0.02 0.09 -0.13 -0.76 0.41 0.00 0.00 173.24 172.87 1mmu s LEU 17 N 0.83 2.89 -0.11 2.44 1.43 0.16 -1.26 118.68 125.05 1mmu s LEU 17 Ca -0.03 -0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 52.71 1mmu s LEU 17 Cb -0.15 -1.70 0.02 0.00 0.03 0.00 0.00 46.19 44.40 1mmu s LEU 17 CO 0.01 0.23 -0.08 -0.89 0.23 0.00 0.00 176.35 175.84 1mmu s THR 18 N -1.06 1.05 0.68 5.49 2.01 -0.53 -0.84 115.64 122.45 1mmu s THR 18 Ca 0.18 -0.31 -0.00 0.00 0.31 0.00 0.00 61.69 61.86 1mmu s THR 18 Cb -0.11 -1.05 0.11 0.00 0.01 0.00 0.00 72.50 71.46 1mmu s THR 18 CO 0.09 0.37 0.95 0.54 -0.69 0.00 0.00 174.62 175.88 1mmu s ASN 19 N 1.59 4.56 0.45 3.53 4.22 -0.41 -0.99 114.94 127.89 1mmu s ASN 19 Ca 0.03 -0.28 0.15 0.00 -2.14 0.00 0.00 52.86 50.61 1mmu s ASN 19 Cb -0.13 -0.21 1.08 0.00 1.28 0.00 0.00 41.25 43.27 1mmu s ASN 19 CO -0.07 -1.70 2.01 0.50 -2.04 0.00 0.00 177.10 175.79 1mmu h LYS 20 N -0.40 0.32 0.00 3.55 3.64 -1.89 -0.27 116.57 121.52 1mmu h LYS 20 Ca -0.38 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 1mmu h LYS 20 Cb 1.27 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1mmu h LYS 20 CO 0.43 0.21 0.00 0.00 -2.27 0.00 0.00 179.45 177.83 1mmu n ALA 21 N -2.53 2.15 -0.38 5.00 0.00 -1.26 -4.86 120.51 118.62 1mmu n ALA 21 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1mmu n ALA 21 Cb 0.33 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1mmu n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mmu n GLY 22 N 0.71 0.70 3.75 0.00 0.00 -0.11 -5.04 105.19 105.19 1mmu n GLY 22 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1mmu n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mmu s VAL 23 N -2.68 3.58 0.10 1.61 1.01 -1.26 -4.79 120.40 117.97 1mmu s VAL 23 Ca 0.00 1.42 0.08 0.00 0.00 0.00 0.00 61.98 63.48 1mmu s VAL 23 Cb 0.00 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1mmu s VAL 23 CO 0.00 0.27 -0.15 0.42 0.00 0.00 0.00 175.10 175.64 1mmu s THR 24 N -0.49 3.02 -0.01 3.92 -4.23 -1.01 -1.29 115.64 115.55 1mmu s THR 24 Ca 0.49 -1.37 -0.13 0.00 -1.18 0.00 0.00 61.69 59.50 1mmu s THR 24 Cb -0.32 -2.37 0.02 0.00 1.34 0.00 0.00 72.50 71.16 1mmu s THR 24 CO 0.38 0.14 0.27 -0.51 -0.54 0.00 0.00 174.62 174.36 1mmu s ILE 25 N -1.13 0.06 0.03 2.99 2.07 -0.02 -1.06 121.20 124.15 1mmu s ILE 25 Ca 0.18 -0.52 -0.03 0.00 -1.41 0.00 0.00 60.65 58.88 1mmu s ILE 25 Cb -0.11 -0.56 -0.02 0.00 0.13 0.00 0.00 42.46 41.90 1mmu s ILE 25 CO 0.10 -0.28 0.04 -0.94 -1.91 0.00 0.00 174.94 171.95 1mmu s SER 26 N -1.30 0.22 0.04 4.50 1.04 0.64 -0.67 113.70 118.17 1mmu s SER 26 Ca -0.14 -0.55 -0.03 0.00 0.48 0.00 0.00 55.95 55.72 1mmu s SER 26 Cb -0.06 0.18 -0.02 0.00 0.10 0.00 0.00 66.02 66.22 1mmu s SER 26 CO 0.03 -0.43 0.04 -0.36 0.98 0.00 0.00 173.24 173.50 1mmu s PHE 27 N -2.23 0.31 0.06 5.02 0.40 -0.67 0.41 117.98 121.28 1mmu s PHE 27 Ca -0.08 -0.70 0.05 0.00 -0.60 0.00 0.00 56.93 55.60 1mmu s PHE 27 Cb -0.04 -0.23 -0.03 0.00 0.51 0.00 0.00 43.02 43.24 1mmu s PHE 27 CO -0.03 -0.35 -0.15 -0.08 0.70 0.00 0.00 175.22 175.31 1mmu s THR 28 N -2.92 1.16 -1.23 0.64 -1.32 0.12 -0.60 115.64 111.49 1mmu s THR 28 Ca -0.02 -1.23 0.23 0.00 -1.21 0.00 0.00 61.69 59.45 1mmu s THR 28 Cb 0.01 -1.09 0.30 0.00 -1.51 0.00 0.00 72.50 70.21 1mmu s THR 28 CO -0.06 -0.14 1.75 -0.46 -2.21 0.00 0.00 174.62 173.49 1mmu n ASN 29 N 1.45 0.00 -4.55 8.08 6.94 -1.22 -1.78 115.26 124.18 1mmu n ASN 29 Ca -0.20 0.21 -0.39 0.00 -0.02 0.00 0.00 54.58 54.17 1mmu n ASN 29 Cb 0.54 -0.39 -0.03 0.00 -2.36 0.00 0.00 39.78 37.55 1mmu n ASN 29 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1mmu s LEU 30 N -2.77 3.27 0.00 -4.53 2.96 -1.26 -0.95 118.68 115.40 1mmu s LEU 30 Ca 0.17 -0.64 0.00 0.00 -0.22 0.00 0.00 54.13 53.44 1mmu s LEU 30 Cb 0.15 -2.56 0.00 0.00 0.50 0.00 0.00 46.19 44.28 1mmu s LEU 30 CO 0.38 -1.90 0.00 0.61 -1.32 0.00 0.00 176.35 174.12 1mmu n GLY 31 N 5.97 0.45 3.98 7.98 0.00 0.17 -4.05 105.19 119.69 1mmu n GLY 31 Ca 0.17 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 44.94 1mmu n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mmu n ALA 32 N -0.13 -2.11 -2.60 4.61 0.00 -1.19 -1.41 120.51 117.69 1mmu n ALA 32 Ca 0.00 -0.43 -0.31 0.00 0.00 0.00 0.00 53.44 52.71 1mmu n ALA 32 Cb 0.24 -1.60 -0.10 0.00 0.00 0.00 0.00 19.45 17.99 1mmu n ALA 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1mmu s ARG 33 N -6.77 2.32 -0.00 0.00 3.52 -0.73 -3.58 118.95 113.70 1mmu s ARG 33 Ca 0.28 -0.91 -0.28 0.00 -0.13 0.00 0.00 55.73 54.70 1mmu s ARG 33 Cb -0.16 -2.40 -0.04 0.00 -1.56 0.00 0.00 34.95 30.80 1mmu s ARG 33 CO 0.74 0.54 0.90 -1.50 -0.81 0.00 0.00 175.30 175.17 1mmu s ILE 34 N -1.16 4.88 -0.22 4.11 2.07 -0.49 -0.71 121.20 129.69 1mmu s ILE 34 Ca 0.21 1.89 0.03 0.00 -1.41 0.00 0.00 60.65 61.37 1mmu s ILE 34 Cb -0.11 -4.24 -0.15 0.00 0.13 0.00 0.00 42.46 38.08 1mmu s ILE 34 CO 0.12 0.21 -0.17 0.52 -1.91 0.00 0.00 174.94 173.71 1mmu n VAL 35 N 3.72 1.26 -3.74 4.00 0.31 0.17 -4.45 118.33 119.60 1mmu n VAL 35 Ca 0.03 -0.52 -0.10 0.00 -0.01 0.00 0.00 64.34 63.75 1mmu n VAL 35 Cb 0.51 -1.19 -0.04 0.00 -0.91 0.00 0.00 33.84 32.20 1mmu n VAL 35 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1mmu s ASP 36 N -6.02 -0.22 -0.28 4.52 2.15 -1.13 -4.10 116.67 111.59 1mmu s ASP 36 Ca -0.27 -0.48 -0.05 0.00 0.43 0.00 0.00 52.55 52.18 1mmu s ASP 36 Cb 0.07 0.53 0.15 0.00 -0.30 0.00 0.00 42.92 43.38 1mmu s ASP 36 CO 0.54 -0.98 0.55 0.86 -0.17 0.00 0.00 175.17 175.97 1mmu s TRP 37 N -3.87 -1.29 0.02 -5.34 -0.00 -1.26 -0.26 118.94 106.94 1mmu s TRP 37 Ca 0.09 1.71 0.06 0.00 -0.00 0.00 0.00 56.10 57.96 1mmu s TRP 37 Cb 0.00 0.50 -0.02 0.00 -0.00 0.00 0.00 33.47 33.96 1mmu s TRP 37 CO -0.05 -0.74 -0.19 -0.65 -0.00 0.00 0.00 176.95 175.33 1mmu s GLN 38 N 2.78 1.35 -0.12 5.86 -0.21 -0.22 0.16 119.66 129.26 1mmu s GLN 38 Ca 0.09 -0.79 -0.00 0.00 0.02 0.00 0.00 55.36 54.67 1mmu s GLN 38 Cb -0.14 -1.38 0.02 0.00 1.00 0.00 0.00 33.01 32.51 1mmu s GLN 38 CO -0.18 0.36 -0.09 0.21 -2.12 0.00 0.00 175.29 173.47 1mmu s LYS 39 N -0.87 1.70 -1.61 2.91 2.20 -0.67 -2.40 119.74 121.00 1mmu s LYS 39 Ca 0.06 -0.32 -0.15 0.00 -0.36 0.00 0.00 55.97 55.20 1mmu s LYS 39 Cb -0.08 -1.70 0.11 0.00 -1.51 0.00 0.00 37.83 34.66 1mmu s LYS 39 CO 0.01 -0.26 0.83 -0.25 -0.36 0.00 0.00 175.35 175.32 1mmu n ASP 40 N 4.89 -3.56 0.00 1.43 8.00 -1.26 -0.71 116.55 125.33 1mmu n ASP 40 Ca -0.14 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.44 1mmu n ASP 40 Cb 0.50 -3.23 0.00 0.00 -0.02 0.00 0.00 41.12 38.37 1mmu n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mmu n GLY 41 N -1.56 0.61 3.61 0.44 0.00 -1.26 -5.02 105.19 102.00 1mmu n GLY 41 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1mmu n GLY 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mmu s LYS 42 N -0.26 3.95 0.20 1.61 2.20 0.11 -5.08 119.74 122.47 1mmu s LYS 42 Ca 0.00 -0.34 -0.30 0.00 -0.36 0.00 0.00 55.97 54.97 1mmu s LYS 42 Cb 0.00 -3.38 -0.09 0.00 -1.51 0.00 0.00 37.83 32.85 1mmu s LYS 42 CO 0.00 0.09 1.30 -1.01 -0.36 0.00 0.00 175.35 175.37 1mmu s HIS 43 N 0.93 3.26 -0.12 4.03 3.76 -1.26 -1.67 115.29 124.22 1mmu s HIS 43 Ca 0.06 1.24 0.22 0.00 -0.15 0.00 0.00 55.06 56.42 1mmu s HIS 43 Cb -0.13 -3.60 -0.20 0.00 1.11 0.00 0.00 32.58 29.76 1mmu s HIS 43 CO 0.03 -1.84 0.69 1.28 -0.85 0.00 0.00 174.74 174.04 1mmu n LEU 44 N 2.59 0.36 -4.46 0.89 4.77 0.12 -3.09 117.00 118.18 1mmu n LEU 44 Ca 0.06 0.14 -0.23 0.00 -0.03 0.00 0.00 56.01 55.96 1mmu n LEU 44 Cb 0.43 0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.43 1mmu n LEU 44 CO 0.58 -0.04 -0.24 0.27 -1.33 0.00 0.00 177.39 176.63 1mmu s ILE 45 N -3.38 0.92 0.14 -0.08 -4.36 -1.25 -1.88 121.20 111.31 1mmu s ILE 45 Ca -0.05 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.22 1mmu s ILE 45 Cb 0.12 -2.62 -0.07 0.00 1.25 0.00 0.00 42.46 41.15 1mmu s ILE 45 CO 0.86 0.00 0.50 -0.76 0.24 0.00 0.00 174.94 175.78 1mmu s LEU 46 N -3.51 4.32 -0.03 0.37 1.43 -0.14 -4.75 118.68 116.36 1mmu s LEU 46 Ca 0.32 0.96 -0.31 0.00 -1.03 0.00 0.00 54.13 54.07 1mmu s LEU 46 Cb 0.06 -3.24 0.11 0.00 0.03 0.00 0.00 46.19 43.16 1mmu s LEU 46 CO 0.15 0.10 1.18 -0.83 0.23 0.00 0.00 176.35 177.18 1mmu s GLY 47 N -1.84 -0.36 0.55 -3.19 0.00 -1.26 -4.71 107.32 96.52 1mmu s GLY 47 Ca 0.38 0.87 0.06 0.00 0.00 0.00 0.00 44.72 46.03 1mmu s GLY 47 CO 0.19 0.23 0.52 0.69 0.00 0.00 0.00 173.10 174.73 1mmu n PHE 48 N -0.36 -1.09 0.85 1.90 0.99 -1.26 -4.54 117.46 113.96 1mmu n PHE 48 Ca -0.06 -2.24 0.10 0.00 -0.00 0.00 0.00 57.45 55.25 1mmu n PHE 48 Cb 0.61 -0.47 -0.13 0.00 -1.00 0.00 0.00 39.48 38.49 1mmu n PHE 48 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 1mmu n ASP 49 N -1.98 0.86 -3.75 4.37 9.92 -1.26 -4.96 116.55 119.75 1mmu n ASP 49 Ca 0.03 -0.86 -0.10 0.00 -0.53 0.00 0.00 54.79 53.34 1mmu n ASP 49 Cb 0.61 1.14 -0.04 0.00 -0.64 0.00 0.00 41.12 42.20 1mmu n ASP 49 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1mmu s SER 50 N -3.22 -0.24 0.18 -2.24 1.04 -1.26 -5.04 113.70 102.92 1mmu s SER 50 Ca 0.06 -0.50 -0.13 0.00 0.48 0.00 0.00 55.95 55.85 1mmu s SER 50 Cb 0.16 0.56 0.11 0.00 0.10 0.00 0.00 66.02 66.95 1mmu s SER 50 CO 0.88 -1.03 1.82 0.00 0.98 0.00 0.00 173.24 175.89 1mmu h ALA 51 N 2.23 0.70 -0.74 5.32 0.00 -1.54 -2.62 119.26 122.60 1mmu h ALA 51 Ca -0.29 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 54.75 1mmu h ALA 51 Cb 1.26 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 1mmu h ALA 51 CO 0.39 0.05 0.50 1.57 0.00 0.00 0.00 179.25 181.76 1mmu h LYS 52 N 0.66 0.41 -0.31 0.00 2.10 -1.88 -1.14 116.57 116.41 1mmu h LYS 52 Ca 0.22 -0.02 -0.06 0.00 -2.00 0.00 0.00 60.65 58.78 1mmu h LYS 52 Cb 0.01 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.23 1mmu h LYS 52 CO -0.09 0.27 -0.06 0.93 -2.00 0.00 0.00 179.45 178.50 1mmu h GLU 53 N 0.42 0.51 -0.58 0.07 5.08 -1.88 0.36 114.58 118.56 1mmu h GLU 53 Ca 0.36 -0.13 -0.09 0.00 -1.00 0.00 0.00 59.36 58.50 1mmu h GLU 53 Cb 0.81 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1mmu h GLU 53 CO -0.12 0.58 -0.00 1.88 -1.00 0.00 0.00 179.01 180.35 1mmu h TYR 54 N 0.48 1.12 0.00 4.33 -1.99 -1.28 0.20 116.97 119.83 1mmu h TYR 54 Ca 0.10 -0.19 -0.15 0.00 2.00 0.00 0.00 58.73 60.48 1mmu h TYR 54 Cb 0.41 -0.29 -0.02 0.00 2.00 0.00 0.00 36.73 38.83 1mmu h TYR 54 CO 0.01 1.00 -0.72 -0.07 -0.00 0.00 0.00 178.16 178.38 1mmu h LEU 55 N 0.91 0.00 0.00 3.88 3.38 -1.18 -0.16 115.31 122.15 1mmu h LEU 55 Ca 0.16 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.82 1mmu h LEU 55 Cb 0.55 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.25 1mmu h LEU 55 CO 0.03 0.72 -1.90 -0.62 0.09 0.00 0.00 178.44 176.77 1mmu n GLU 56 N -3.63 0.65 -0.09 1.13 1.02 0.12 -4.71 120.64 115.13 1mmu n GLU 56 Ca -0.01 0.22 -0.11 0.00 -0.02 0.00 0.00 57.16 57.24 1mmu n GLU 56 Cb 0.72 -1.72 -0.04 0.00 -0.02 0.00 0.00 31.44 30.38 1mmu n GLU 56 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1mmu n LYS 57 N -2.99 0.52 -3.47 3.49 5.02 0.70 -5.03 118.16 116.40 1mmu n LYS 57 Ca -0.22 0.21 0.01 0.00 -2.02 0.00 0.00 58.31 56.29 1mmu n LYS 57 Cb 1.08 -1.40 -0.03 0.00 -0.02 0.00 0.00 35.03 34.65 1mmu n LYS 57 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1mmu s ASP 58 N -6.10 -0.98 0.00 4.39 2.15 -0.96 -5.04 116.67 110.12 1mmu s ASP 58 Ca -0.29 1.17 0.29 0.00 0.43 0.00 0.00 52.55 54.15 1mmu s ASP 58 Cb 0.05 2.05 1.29 0.00 -0.30 0.00 0.00 42.92 46.01 1mmu s ASP 58 CO 0.42 -0.19 1.91 0.00 -0.17 0.00 0.00 175.17 177.15 1mmu n ALA 59 N 5.31 2.66 0.06 3.66 0.00 -0.11 -4.21 120.51 127.88 1mmu n ALA 59 Ca -0.09 -0.21 -0.19 0.00 0.00 0.00 0.00 53.44 52.95 1mmu n ALA 59 Cb 0.51 -1.39 -0.14 0.00 0.00 0.00 0.00 19.45 18.42 1mmu n ALA 59 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1mmu h TYR 60 N 0.25 0.55 -1.61 0.00 0.99 -1.93 -3.44 116.97 111.77 1mmu h TYR 60 Ca 0.00 -0.40 -0.71 0.00 2.00 0.00 0.00 58.73 59.62 1mmu h TYR 60 Cb 0.36 -0.02 0.03 0.00 1.00 0.00 0.00 36.73 38.10 1mmu h TYR 60 CO 0.00 1.52 0.70 -2.30 -0.00 0.00 0.00 178.16 178.08 1mmu n PRO 61 N -3.50 1.17 -0.38 4.88 -0.02 -1.26 -1.28 135.00 134.62 1mmu n PRO 61 Ca -0.21 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1mmu n PRO 61 Cb 1.06 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 1mmu n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mmu n GLY 62 N 3.44 0.95 3.83 -1.23 0.00 -0.20 -4.84 105.19 107.15 1mmu n GLY 62 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 1mmu n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mmu s ALA 63 N -2.21 2.53 -0.20 4.61 0.00 -0.40 -1.40 121.76 124.69 1mmu s ALA 63 Ca 0.00 -0.22 -0.23 0.00 0.00 0.00 0.00 51.96 51.50 1mmu s ALA 63 Cb 0.00 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.02 1mmu s ALA 63 CO 0.00 -1.45 0.75 0.99 0.00 0.00 0.00 175.76 176.05 1mmu s THR 64 N -3.22 4.92 -0.02 0.00 2.01 -0.50 -0.37 115.64 118.46 1mmu s THR 64 Ca 0.59 1.44 0.04 0.00 0.31 0.00 0.00 61.69 64.07 1mmu s THR 64 Cb -0.13 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 68.29 1mmu s THR 64 CO 0.53 0.03 -0.12 0.68 -0.69 0.00 0.00 174.62 175.05 1mmu s VAL 65 N 2.29 3.25 -1.59 3.82 -7.23 0.10 -3.49 120.40 117.54 1mmu s VAL 65 Ca 0.33 -0.79 0.00 0.00 -1.81 0.00 0.00 61.98 59.72 1mmu s VAL 65 Cb -0.16 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.45 1mmu s VAL 65 CO 0.10 0.50 0.00 0.61 -0.31 0.00 0.00 175.10 176.00 1mmu n GLY 66 N 1.97 -1.04 0.31 2.32 0.00 -1.26 -1.84 105.19 105.64 1mmu n GLY 66 Ca -0.17 -0.88 0.17 0.00 0.00 0.00 0.00 46.02 45.15 1mmu n GLY 66 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1mmu h PRO 67 N 0.00 0.00 -4.86 1.61 0.11 -1.84 -3.31 132.00 123.71 1mmu h PRO 67 Ca 0.00 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.47 1mmu h PRO 67 Cb 0.00 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 30.75 1mmu h PRO 67 CO 0.00 0.02 -0.84 0.95 -0.21 0.00 0.00 178.00 177.91 1mmu s THR 68 N -4.40 1.84 0.16 -1.15 -4.23 -1.26 0.14 115.64 106.73 1mmu s THR 68 Ca -0.05 -0.84 -0.28 0.00 -1.18 0.00 0.00 61.69 59.35 1mmu s THR 68 Cb 0.14 -1.70 -0.07 0.00 1.34 0.00 0.00 72.50 72.20 1mmu s THR 68 CO 0.51 0.47 0.88 0.00 -0.54 0.00 0.00 174.62 175.94 1mmu s ALA 69 N 1.37 3.35 0.00 3.99 0.00 0.76 -1.51 121.76 129.71 1mmu s ALA 69 Ca 0.04 0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.50 1mmu s ALA 69 Cb -0.13 -3.13 0.00 0.00 0.00 0.00 0.00 23.12 19.86 1mmu s ALA 69 CO -0.12 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.21 1mmu n GLY 70 N 1.83 -2.12 3.75 0.00 0.00 -1.26 -4.70 105.19 102.69 1mmu n GLY 70 Ca -0.02 -2.04 -0.37 0.00 0.00 0.00 0.00 46.02 43.60 1mmu n GLY 70 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mmu s ARG 71 N -0.16 4.18 -0.26 1.61 0.52 -1.26 -1.01 118.95 122.57 1mmu s ARG 71 Ca 0.00 0.15 -0.02 0.00 -0.52 0.00 0.00 55.73 55.34 1mmu s ARG 71 Cb 0.00 -3.39 0.03 0.00 0.52 0.00 0.00 34.95 32.10 1mmu s ARG 71 CO 0.00 0.31 -0.04 0.42 0.02 0.00 0.00 175.30 176.01 1mmu s ILE 72 N 0.23 3.02 0.01 1.52 1.01 -0.10 -4.22 121.20 122.67 1mmu s ILE 72 Ca 0.18 -1.01 -0.33 0.00 0.00 0.00 0.00 60.65 59.49 1mmu s ILE 72 Cb -0.14 -2.55 -0.12 0.00 0.01 0.00 0.00 42.46 39.66 1mmu s ILE 72 CO 0.06 0.16 1.81 1.17 0.00 0.00 0.00 174.94 178.13 1mmu n LYS 73 N 4.69 2.29 -1.27 2.79 4.81 -1.26 -1.61 118.16 128.60 1mmu n LYS 73 Ca -0.16 0.84 -0.12 0.00 -0.87 0.00 0.00 58.31 58.00 1mmu n LYS 73 Cb 0.47 -2.68 -0.05 0.00 0.02 0.00 0.00 35.03 32.79 1mmu n LYS 73 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1mmu n ASP 74 N 5.77 -4.59 0.00 3.14 8.00 -1.10 -1.84 116.55 125.93 1mmu n ASP 74 Ca 0.20 0.29 0.00 0.00 0.71 0.00 0.00 54.79 55.99 1mmu n ASP 74 Cb 0.31 -3.68 0.00 0.00 -0.02 0.00 0.00 41.12 37.73 1mmu n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mmu n GLY 75 N 0.04 0.07 3.67 0.44 0.00 -0.63 -4.74 105.19 104.04 1mmu n GLY 75 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 1mmu n GLY 75 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mmu s LEU 76 N 0.00 4.18 0.15 0.99 2.96 -0.76 -0.48 118.68 125.73 1mmu s LEU 76 Ca 0.00 0.91 0.08 0.00 -0.22 0.00 0.00 54.13 54.90 1mmu s LEU 76 Cb 0.00 -2.93 -0.04 0.00 0.50 0.00 0.00 46.19 43.72 1mmu s LEU 76 CO 0.00 -0.24 -0.17 0.68 -1.32 0.00 0.00 176.35 175.31 1mmu s VAL 77 N 1.65 1.66 -0.22 1.68 -7.23 -0.72 -4.80 120.40 112.43 1mmu s VAL 77 Ca 0.30 -1.87 -0.05 0.00 -1.81 0.00 0.00 61.98 58.56 1mmu s VAL 77 Cb -0.16 -1.76 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 1mmu s VAL 77 CO 0.12 -0.36 -0.01 -0.75 -0.31 0.00 0.00 175.10 173.79 1mmu s LYS 78 N -2.80 3.51 -0.19 4.82 2.20 -1.26 -0.75 119.74 125.27 1mmu s LYS 78 Ca 0.14 -0.56 0.01 0.00 -0.36 0.00 0.00 55.97 55.20 1mmu s LYS 78 Cb -0.05 -3.09 0.02 0.00 -1.51 0.00 0.00 37.83 33.20 1mmu s LYS 78 CO 0.05 -0.12 -0.19 0.42 -0.36 0.00 0.00 175.35 175.16 1mmu s ILE 79 N 1.33 2.11 -1.54 5.43 1.01 1.07 -4.74 121.20 125.88 1mmu s ILE 79 Ca 0.04 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.70 1mmu s ILE 79 Cb -0.15 -1.92 0.00 0.00 0.01 0.00 0.00 42.46 40.41 1mmu s ILE 79 CO 0.00 0.49 0.03 -1.54 0.00 0.00 0.00 174.94 173.92 1mmu n SER 80 N 4.61 0.81 0.00 3.58 3.41 -1.26 0.09 113.62 124.86 1mmu n SER 80 Ca -0.20 -1.27 0.00 0.00 -0.26 0.00 0.00 58.87 57.14 1mmu n SER 80 Cb 0.49 -1.65 0.00 0.00 -0.26 0.00 0.00 64.21 62.79 1mmu n SER 80 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mmu n GLY 81 N -2.56 1.72 3.42 5.00 0.00 -1.26 -5.04 105.19 106.48 1mmu n GLY 81 Ca -0.33 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 1mmu n GLY 81 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mmu s LYS 82 N -0.54 1.67 0.25 1.61 -2.85 0.11 -5.09 119.74 114.89 1mmu s LYS 82 Ca 0.00 -1.21 -0.27 0.00 -1.00 0.00 0.00 55.97 53.49 1mmu s LYS 82 Cb 0.00 -2.02 -0.09 0.00 -2.06 0.00 0.00 37.83 33.66 1mmu s LYS 82 CO 0.00 0.48 0.89 -0.51 0.10 0.00 0.00 175.35 176.31 1mmu s ASP 83 N -1.89 7.45 -0.02 0.03 1.01 -1.26 0.35 116.67 122.34 1mmu s ASP 83 Ca 0.15 1.80 0.01 0.00 0.71 0.00 0.00 52.55 55.22 1mmu s ASP 83 Cb -0.10 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.28 1mmu s ASP 83 CO 0.07 0.09 -0.04 -0.31 0.21 0.00 0.00 175.17 175.19 1mmu s TYR 84 N -1.33 0.50 -0.18 4.23 1.51 0.07 -4.88 117.35 117.27 1mmu s TYR 84 Ca 0.43 -0.10 -0.13 0.00 -1.01 0.00 0.00 57.07 56.26 1mmu s TYR 84 Cb -0.22 -0.41 -0.05 0.00 -0.11 0.00 0.00 41.96 41.17 1mmu s TYR 84 CO 0.27 -0.08 0.26 0.42 -1.11 0.00 0.00 175.55 175.32 1mmu s ILE 85 N 0.38 5.32 0.47 2.71 1.01 -1.26 -1.75 121.20 128.08 1mmu s ILE 85 Ca -0.04 0.47 0.05 0.00 0.00 0.00 0.00 60.65 61.13 1mmu s ILE 85 Cb -0.08 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.81 1mmu s ILE 85 CO -0.00 0.38 0.65 -0.76 0.00 0.00 0.00 174.94 175.20 1mmu s LEU 86 N 0.62 3.50 0.17 2.97 1.43 0.37 -4.68 118.68 123.06 1mmu s LEU 86 Ca 0.14 -0.25 -0.34 0.00 -1.03 0.00 0.00 54.13 52.66 1mmu s LEU 86 Cb -0.13 -2.75 -0.14 0.00 0.03 0.00 0.00 46.19 43.20 1mmu s LEU 86 CO 0.03 -0.91 1.46 -3.20 0.23 0.00 0.00 176.35 173.96 1mmu n ASN 87 N -2.05 2.62 -4.33 2.29 2.85 0.02 -4.75 115.26 111.91 1mmu n ASN 87 Ca 0.08 1.11 -0.40 0.00 -0.11 0.00 0.00 54.58 55.26 1mmu n ASN 87 Cb 0.59 -1.37 -0.11 0.00 1.24 0.00 0.00 39.78 40.14 1mmu n ASN 87 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1mmu s GLN 88 N 0.39 2.74 0.00 1.20 -0.21 -1.26 -4.21 119.66 118.30 1mmu s GLN 88 Ca 0.77 -1.23 0.05 0.00 0.02 0.00 0.00 55.36 54.96 1mmu s GLN 88 Cb -0.73 -3.74 0.04 0.00 1.00 0.00 0.00 33.01 29.58 1mmu s GLN 88 CO 0.44 -0.80 0.68 0.27 -2.12 0.00 0.00 175.29 173.75 1mmu n ASN 89 N 4.96 1.46 -3.44 5.90 6.94 -0.67 -4.82 115.26 125.59 1mmu n ASN 89 Ca -0.11 -1.24 -0.28 0.00 -0.02 0.00 0.00 54.58 52.92 1mmu n ASN 89 Cb 0.45 -0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.75 1mmu n ASN 89 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 1mmu s GLU 90 N -0.44 0.68 5.52 -3.83 2.12 -0.57 -4.93 118.70 117.25 1mmu s GLU 90 Ca 0.06 -1.62 0.00 0.00 0.36 0.00 0.00 54.97 53.77 1mmu s GLU 90 Cb 0.04 -1.34 0.00 0.00 0.26 0.00 0.00 34.13 33.09 1mmu s GLU 90 CO 0.06 -1.28 0.00 0.41 -0.54 0.00 0.00 175.26 173.92 1mmu n GLY 91 N 3.60 2.42 0.26 -1.50 0.00 -1.26 -0.89 105.19 107.82 1mmu n GLY 91 Ca 0.19 -0.48 0.11 0.00 0.00 0.00 0.00 46.02 45.83 1mmu n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mmu n PRO 92 N 12.72 1.34 -3.27 1.61 -0.04 -1.26 -4.83 135.00 141.27 1mmu n PRO 92 Ca 0.00 -0.51 -0.29 0.00 -0.04 0.00 0.00 63.50 62.65 1mmu n PRO 92 Cb 0.00 -1.36 -0.03 0.00 -0.04 0.00 0.00 33.50 32.07 1mmu n PRO 92 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1mmu s GLN 93 N -1.91 3.67 -0.42 0.54 1.11 -0.07 -2.12 119.66 120.46 1mmu s GLN 93 Ca 0.32 0.11 -0.14 0.00 0.01 0.00 0.00 55.36 55.65 1mmu s GLN 93 Cb 0.16 -2.61 0.04 0.00 -1.01 0.00 0.00 33.01 29.59 1mmu s GLN 93 CO 0.25 0.18 0.30 0.99 0.01 0.00 0.00 175.29 177.03 1mmu s THR 94 N -2.10 5.03 -0.20 -0.19 2.01 -0.67 -1.51 115.64 118.00 1mmu s THR 94 Ca 0.45 -0.87 -0.07 0.00 0.31 0.00 0.00 61.69 61.51 1mmu s THR 94 Cb -0.11 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 1mmu s THR 94 CO 0.29 -0.39 0.05 -0.22 -0.69 0.00 0.00 174.62 173.67 1mmu s LEU 95 N 1.62 3.60 -1.39 4.42 2.96 -1.26 -0.92 118.68 127.72 1mmu s LEU 95 Ca 0.04 -0.05 -0.02 0.00 -0.22 0.00 0.00 54.13 53.88 1mmu s LEU 95 Cb -0.21 -1.92 0.00 0.00 0.50 0.00 0.00 46.19 44.56 1mmu s LEU 95 CO 0.08 0.10 0.44 1.41 -1.32 0.00 0.00 176.35 177.05 1mmu n HIS 96 N 4.01 -1.65 -0.95 5.38 8.25 -0.18 -1.30 115.22 128.79 1mmu n HIS 96 Ca -0.16 0.70 0.00 0.00 -0.26 0.00 0.00 57.72 58.00 1mmu n HIS 96 Cb 0.52 -3.67 0.00 0.00 1.12 0.00 0.00 29.99 27.96 1mmu n HIS 96 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1mmu n GLY 97 N -1.98 0.60 2.01 -1.41 0.00 -0.57 -4.23 105.19 99.61 1mmu n GLY 97 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1mmu n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mmu n GLY 98 N -2.11 -2.55 3.76 -0.02 0.00 -0.42 -4.69 105.19 99.17 1mmu n GLY 98 Ca 0.00 -1.75 -0.37 0.00 0.00 0.00 0.00 46.02 43.90 1mmu n GLY 98 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1mmu s GLU 99 N -0.49 3.32 -1.62 1.61 -1.05 -1.26 -3.51 118.70 115.70 1mmu s GLU 99 Ca 0.00 1.90 -0.08 0.00 -0.15 0.00 0.00 54.97 56.64 1mmu s GLU 99 Cb 0.00 -2.19 0.08 0.00 -0.44 0.00 0.00 34.13 31.58 1mmu s GLU 99 CO 0.00 -0.94 0.20 0.39 0.95 0.00 0.00 175.26 175.86 1mmu n GLU 100 N -1.03 -0.86 0.00 -4.83 -0.58 -1.26 -4.90 120.64 107.18 1mmu n GLU 100 Ca 0.10 0.10 0.00 0.00 -0.42 0.00 0.00 57.16 56.95 1mmu n GLU 100 Cb 0.48 -3.87 0.00 0.00 -0.57 0.00 0.00 31.44 27.48 1mmu n GLU 100 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1mmu n SER 101 N -2.66 -0.09 -0.14 1.62 2.88 -1.23 -4.80 113.62 109.20 1mmu n SER 101 Ca -0.17 -0.53 0.22 0.00 -1.33 0.00 0.00 58.87 57.06 1mmu n SER 101 Cb 0.60 0.00 0.64 0.00 -0.75 0.00 0.00 64.21 64.70 1mmu n SER 101 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1mmu h ILE 102 N -0.66 0.66 0.00 2.46 3.07 -1.89 0.84 117.51 122.00 1mmu h ILE 102 Ca 0.00 -0.05 0.00 0.00 1.55 0.00 0.00 64.86 66.36 1mmu h ILE 102 Cb 0.00 0.50 0.00 0.00 -0.27 0.00 0.00 36.82 37.05 1mmu h ILE 102 CO 0.00 0.03 0.00 0.00 -1.05 0.00 0.00 178.15 177.13 1mmu n HIS 103 N -4.38 0.55 0.78 0.16 1.44 -1.23 -2.75 115.22 109.80 1mmu n HIS 103 Ca 0.16 0.22 0.09 0.00 -2.01 0.00 0.00 57.72 56.18 1mmu n HIS 103 Cb 0.75 -0.85 0.07 0.00 0.12 0.00 0.00 29.99 30.08 1mmu n HIS 103 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1mmu n THR 104 N -2.00 0.00 -3.56 0.61 -2.24 0.29 -3.64 114.28 103.73 1mmu n THR 104 Ca 0.03 -0.47 -0.25 0.00 -2.27 0.00 0.00 64.05 61.08 1mmu n THR 104 Cb 0.21 1.37 -0.02 0.00 -2.10 0.00 0.00 70.33 69.79 1mmu n THR 104 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1mmu s LYS 105 N -1.63 3.50 -0.52 -0.78 -0.14 -1.11 -4.84 119.74 114.22 1mmu s LYS 105 Ca 0.21 -0.37 -0.21 0.00 -1.36 0.00 0.00 55.97 54.24 1mmu s LYS 105 Cb 0.15 -2.75 0.05 0.00 -1.68 0.00 0.00 37.83 33.61 1mmu s LYS 105 CO 0.26 0.27 0.73 -0.51 -0.76 0.00 0.00 175.35 175.34 1mmu s LEU 106 N -3.90 4.69 0.48 3.17 1.43 -1.26 -0.66 118.68 122.63 1mmu s LEU 106 Ca 0.39 -0.73 -0.19 0.00 -1.03 0.00 0.00 54.13 52.57 1mmu s LEU 106 Cb -0.10 -2.57 -0.09 0.00 0.03 0.00 0.00 46.19 43.46 1mmu s LEU 106 CO 0.32 -1.00 0.97 0.26 0.23 0.00 0.00 176.35 177.14 1mmu s TRP 107 N 3.05 3.36 0.79 0.29 0.52 -0.13 -5.00 118.94 121.83 1mmu s TRP 107 Ca 0.20 1.53 -0.12 0.00 0.02 0.00 0.00 56.10 57.73 1mmu s TRP 107 Cb -0.17 -2.83 0.07 0.00 -1.15 0.00 0.00 33.47 29.39 1mmu s TRP 107 CO 0.14 -0.29 1.16 0.95 0.02 0.00 0.00 176.95 178.93 1mmu s THR 108 N -2.40 2.27 0.12 2.01 -4.23 -0.26 -4.79 115.64 108.36 1mmu s THR 108 Ca 0.61 0.09 -0.24 0.00 -1.18 0.00 0.00 61.69 60.96 1mmu s THR 108 Cb -0.10 -3.08 0.07 0.00 1.34 0.00 0.00 72.50 70.73 1mmu s THR 108 CO 0.23 -0.11 0.60 -0.72 -0.54 0.00 0.00 174.62 174.08 1mmu s TYR 109 N -3.53 -0.54 -0.01 3.99 -0.85 -1.26 -0.19 117.35 114.96 1mmu s TYR 109 Ca 0.61 0.44 -0.01 0.00 -0.52 0.00 0.00 57.07 57.60 1mmu s TYR 109 Cb -0.11 0.51 0.00 0.00 0.38 0.00 0.00 41.96 42.74 1mmu s TYR 109 CO 0.50 -0.80 0.02 -1.21 -1.52 0.00 0.00 175.55 172.54 1mmu s GLU 110 N -3.28 0.02 -0.19 -3.49 2.02 -0.70 -5.00 118.70 108.08 1mmu s GLU 110 Ca -0.01 0.03 -0.08 0.00 0.02 0.00 0.00 54.97 54.93 1mmu s GLU 110 Cb -0.01 -0.00 -0.04 0.00 0.10 0.00 0.00 34.13 34.18 1mmu s GLU 110 CO -0.09 -0.01 0.07 0.08 0.02 0.00 0.00 175.26 175.33 1mmu s VAL 111 N 0.06 4.84 -0.23 2.63 1.01 -1.26 -1.36 120.40 126.10 1mmu s VAL 111 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.94 1mmu s VAL 111 Cb -0.01 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.19 1mmu s VAL 111 CO -0.00 0.45 -0.08 -0.89 0.00 0.00 0.00 175.10 174.58 1mmu s THR 112 N 0.45 2.92 -0.43 3.92 2.01 0.15 -4.98 115.64 119.67 1mmu s THR 112 Ca 0.04 -0.80 -0.22 0.00 0.31 0.00 0.00 61.69 61.02 1mmu s THR 112 Cb -0.12 -2.38 0.02 0.00 0.01 0.00 0.00 72.50 70.03 1mmu s THR 112 CO 0.00 0.35 0.70 -0.62 -0.69 0.00 0.00 174.62 174.36 1mmu s ASP 113 N 1.38 6.37 -0.02 3.53 -1.08 -1.26 -1.26 116.67 124.33 1mmu s ASP 113 Ca 0.03 -0.19 0.20 0.00 -0.52 0.00 0.00 52.55 52.07 1mmu s ASP 113 Cb -0.15 -2.35 0.59 0.00 -1.46 0.00 0.00 42.92 39.55 1mmu s ASP 113 CO -0.06 -0.81 1.50 0.18 0.52 0.00 0.00 175.17 176.50 1mmu n LEU 114 N 6.42 3.88 0.00 -1.34 4.77 0.99 -5.02 117.00 126.70 1mmu n LEU 114 Ca 0.00 -2.08 0.00 0.00 -0.03 0.00 0.00 56.01 53.90 1mmu n LEU 114 Cb 0.48 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1mmu n LEU 114 CO 0.55 0.91 0.00 0.61 -1.33 0.00 0.00 177.39 178.13 1mmu n GLY 115 N 1.32 1.64 0.15 -0.72 0.00 -1.26 -4.21 105.19 102.11 1mmu n GLY 115 Ca 0.22 -0.32 0.13 0.00 0.00 0.00 0.00 46.02 46.05 1mmu n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mmu h ALA 116 N 0.00 1.00 -3.69 4.61 0.00 -1.95 -3.43 119.26 115.80 1mmu h ALA 116 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 1mmu h ALA 116 Cb 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 17.48 1mmu h ALA 116 CO 0.00 0.00 -0.75 -2.00 0.00 0.00 0.00 179.25 176.50 1mmu s GLU 117 N -3.33 0.40 -0.12 0.00 2.12 -1.26 -0.44 118.70 116.06 1mmu s GLU 117 Ca 0.05 -0.07 0.03 0.00 0.36 0.00 0.00 54.97 55.34 1mmu s GLU 117 Cb 0.10 -0.45 0.00 0.00 0.26 0.00 0.00 34.13 34.04 1mmu s GLU 117 CO 0.46 -0.00 -0.22 0.08 -0.54 0.00 0.00 175.26 175.03 1mmu s VAL 118 N 0.39 2.13 -0.10 3.70 1.01 -0.04 -0.01 120.40 127.49 1mmu s VAL 118 Ca -0.04 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 1mmu s VAL 118 Cb -0.07 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1mmu s VAL 118 CO -0.01 0.55 -0.06 -1.10 0.00 0.00 0.00 175.10 174.48 1mmu s GLN 119 N 0.55 3.07 -0.37 2.72 -0.21 -0.39 -1.27 119.66 123.77 1mmu s GLN 119 Ca -0.13 -0.55 0.04 0.00 0.02 0.00 0.00 55.36 54.74 1mmu s GLN 119 Cb -0.17 -2.69 0.10 0.00 1.00 0.00 0.00 33.01 31.26 1mmu s GLN 119 CO 0.04 0.51 0.09 0.08 -2.12 0.00 0.00 175.29 173.88 1mmu s VAL 120 N -0.38 2.31 -0.36 1.09 1.01 0.40 0.32 120.40 124.79 1mmu s VAL 120 Ca 0.06 -2.50 -0.18 0.00 0.00 0.00 0.00 61.98 59.36 1mmu s VAL 120 Cb -0.12 -2.69 -0.00 0.00 0.00 0.00 0.00 36.38 33.56 1mmu s VAL 120 CO 0.02 -0.63 0.49 -0.75 0.00 0.00 0.00 175.10 174.23 1mmu s LYS 121 N 0.71 3.55 -0.12 2.72 2.20 -0.46 -1.45 119.74 126.89 1mmu s LYS 121 Ca 0.12 -0.26 -0.12 0.00 -0.36 0.00 0.00 55.97 55.36 1mmu s LYS 121 Cb -0.20 -3.83 -0.05 0.00 -1.51 0.00 0.00 37.83 32.24 1mmu s LYS 121 CO -0.07 -0.66 0.26 -0.06 -0.36 0.00 0.00 175.35 174.46 1mmu s PHE 122 N 2.34 3.55 0.05 4.03 0.40 0.08 -1.71 117.98 126.72 1mmu s PHE 122 Ca 0.17 0.64 0.07 0.00 -0.60 0.00 0.00 56.93 57.21 1mmu s PHE 122 Cb -0.16 -2.20 -0.03 0.00 0.51 0.00 0.00 43.02 41.14 1mmu s PHE 122 CO 0.13 0.47 -0.20 -1.12 0.70 0.00 0.00 175.22 175.20 1mmu s SER 123 N -0.29 2.40 -0.14 1.36 0.01 0.73 0.03 113.70 117.81 1mmu s SER 123 Ca 0.17 -0.55 -0.26 0.00 1.31 0.00 0.00 55.95 56.62 1mmu s SER 123 Cb -0.13 -0.18 0.06 0.00 0.21 0.00 0.00 66.02 65.98 1mmu s SER 123 CO 0.05 0.13 0.64 -0.22 0.41 0.00 0.00 173.24 174.25 1mmu s LEU 124 N -1.32 -0.47 -0.17 2.44 2.96 -0.48 -1.10 118.68 120.54 1mmu s LEU 124 Ca 0.07 0.94 -0.04 0.00 -0.22 0.00 0.00 54.13 54.88 1mmu s LEU 124 Cb -0.09 2.31 -0.02 0.00 0.50 0.00 0.00 46.19 48.89 1mmu s LEU 124 CO 0.02 -0.43 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.90 1mmu s VAL 125 N -0.51 3.76 -0.45 1.68 1.01 -1.26 -0.25 120.40 124.39 1mmu s VAL 125 Ca -0.06 -0.39 -0.19 0.00 0.00 0.00 0.00 61.98 61.34 1mmu s VAL 125 Cb -0.03 -2.67 0.03 0.00 0.00 0.00 0.00 36.38 33.72 1mmu s VAL 125 CO 0.05 0.47 0.54 -0.55 0.00 0.00 0.00 175.10 175.61 1mmu s SER 126 N 0.70 6.24 0.82 3.32 0.15 -0.00 -4.94 113.70 119.99 1mmu s SER 126 Ca -0.02 -0.66 -0.12 0.00 0.70 0.00 0.00 55.95 55.86 1mmu s SER 126 Cb -0.14 -2.26 0.09 0.00 -1.71 0.00 0.00 66.02 61.99 1mmu s SER 126 CO 0.02 -0.71 1.17 0.20 1.20 0.00 0.00 173.24 175.12 1mmu s ASN 127 N 2.09 3.60 0.25 5.45 -0.87 -1.26 0.00 114.94 124.20 1mmu s ASN 127 Ca 0.15 2.23 -0.31 0.00 -1.57 0.00 0.00 52.86 53.36 1mmu s ASN 127 Cb -0.17 -2.57 -0.12 0.00 -0.02 0.00 0.00 41.25 38.37 1mmu s ASN 127 CO 0.15 -2.66 1.63 -0.67 -2.57 0.00 0.00 177.10 172.98 1mmu n ASP 128 N -3.54 3.80 0.00 -1.22 4.64 -1.26 -1.44 116.55 117.53 1mmu n ASP 128 Ca 0.12 1.11 0.00 0.00 -1.38 0.00 0.00 54.79 54.65 1mmu n ASP 128 Cb 0.51 -1.57 0.00 0.00 -1.04 0.00 0.00 41.12 39.03 1mmu n ASP 128 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1mmu n GLY 129 N 2.84 2.22 3.66 0.27 0.00 0.36 -4.83 105.19 109.70 1mmu n GLY 129 Ca 0.12 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.67 1mmu n GLY 129 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1mmu n THR 130 N -2.00 0.59 -1.58 2.61 -1.04 -0.52 -0.63 114.28 111.71 1mmu n THR 130 Ca 0.00 -0.14 -0.20 0.00 -2.04 0.00 0.00 64.05 61.67 1mmu n THR 130 Cb 0.00 -2.00 -0.09 0.00 -1.82 0.00 0.00 70.33 66.43 1mmu n THR 130 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1mmu n ASN 131 N 7.27 -5.48 0.00 8.00 4.13 -1.26 -0.72 115.26 127.21 1mmu n ASN 131 Ca 0.23 0.49 0.00 0.00 1.68 0.00 0.00 54.58 56.99 1mmu n ASN 131 Cb 0.32 -4.78 0.00 0.00 -1.54 0.00 0.00 39.78 33.79 1mmu n ASN 131 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mmu n GLY 132 N -0.33 0.92 3.70 7.41 0.00 0.19 -0.80 105.19 116.28 1mmu n GLY 132 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1mmu n GLY 132 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mmu s TYR 133 N -2.39 3.48 0.62 1.61 1.51 0.11 -4.80 117.35 117.49 1mmu s TYR 133 Ca 0.00 1.52 -0.18 0.00 -1.01 0.00 0.00 57.07 57.40 1mmu s TYR 133 Cb 0.00 -3.24 -0.02 0.00 -0.11 0.00 0.00 41.96 38.59 1mmu s TYR 133 CO 0.00 -0.50 1.20 -2.14 -1.11 0.00 0.00 175.55 173.00 1mmu s PRO 134 N 1.68 2.84 0.00 -1.71 0.02 -1.26 -0.49 135.00 136.08 1mmu s PRO 134 Ca 0.52 1.79 0.00 0.00 0.02 0.00 0.00 61.00 63.33 1mmu s PRO 134 Cb -0.21 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.39 1mmu s PRO 134 CO 0.23 -1.30 0.00 0.41 -0.33 0.00 0.00 177.00 176.01 1mmu n GLY 135 N 0.42 2.61 3.83 0.52 0.00 -1.26 -4.69 105.19 106.62 1mmu n GLY 135 Ca 0.13 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1mmu n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mmu s LYS 136 N 3.52 3.98 -0.20 1.61 2.36 -1.26 -3.28 119.74 126.47 1mmu s LYS 136 Ca 0.00 1.05 -0.01 0.00 -2.55 0.00 0.00 55.97 54.46 1mmu s LYS 136 Cb 0.00 -2.14 0.01 0.00 -1.05 0.00 0.00 37.83 34.65 1mmu s LYS 136 CO 0.00 -0.25 -0.13 0.42 1.55 0.00 0.00 175.35 176.94 1mmu s ILE 137 N -2.44 2.61 -0.46 5.43 1.01 0.10 -1.40 121.20 126.05 1mmu s ILE 137 Ca 0.61 -0.75 -0.21 0.00 0.00 0.00 0.00 60.65 60.30 1mmu s ILE 137 Cb -0.10 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.26 1mmu s ILE 137 CO 0.25 0.49 0.66 -1.61 0.00 0.00 0.00 174.94 174.74 1mmu s GLU 138 N 1.35 3.24 0.14 2.79 2.02 -0.29 -0.82 118.70 127.14 1mmu s GLU 138 Ca 0.05 -0.48 0.07 0.00 0.02 0.00 0.00 54.97 54.63 1mmu s GLU 138 Cb -0.14 -3.99 -0.04 0.00 0.10 0.00 0.00 34.13 30.06 1mmu s GLU 138 CO -0.09 -1.09 -0.04 -1.64 0.02 0.00 0.00 175.26 172.42 1mmu s MET 139 N 2.86 2.30 -0.04 1.61 -1.94 0.66 -2.54 119.30 122.21 1mmu s MET 139 Ca 0.21 -1.07 -0.05 0.00 -1.71 0.00 0.00 55.69 53.07 1mmu s MET 139 Cb -0.15 -2.34 0.01 0.00 2.01 0.00 0.00 34.83 34.36 1mmu s MET 139 CO 0.17 0.48 0.13 -1.54 -0.01 0.00 0.00 175.02 174.26 1mmu s SER 140 N -2.64 -0.10 -0.18 3.03 1.04 -0.35 -1.38 113.70 113.13 1mmu s SER 140 Ca 0.25 0.16 -0.00 0.00 0.48 0.00 0.00 55.95 56.84 1mmu s SER 140 Cb -0.10 0.27 0.04 0.00 0.10 0.00 0.00 66.02 66.33 1mmu s SER 140 CO 0.17 -0.12 -0.07 -0.69 0.98 0.00 0.00 173.24 173.51 1mmu s VAL 141 N -0.28 1.28 -0.32 5.02 1.01 0.10 -1.62 120.40 125.60 1mmu s VAL 141 Ca -0.04 -0.77 -0.10 0.00 0.00 0.00 0.00 61.98 61.08 1mmu s VAL 141 Cb -0.03 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.91 1mmu s VAL 141 CO 0.00 0.13 0.17 -0.89 0.00 0.00 0.00 175.10 174.51 1mmu s THR 142 N 1.56 4.69 -0.26 3.92 2.01 0.46 -0.74 115.64 127.27 1mmu s THR 142 Ca -0.00 -0.42 -0.11 0.00 0.31 0.00 0.00 61.69 61.48 1mmu s THR 142 Cb -0.16 -3.40 -0.05 0.00 0.01 0.00 0.00 72.50 68.90 1mmu s THR 142 CO -0.08 0.04 0.17 -1.00 -0.69 0.00 0.00 174.62 173.06 1mmu s HIS 143 N 1.62 3.25 0.10 4.92 3.76 -0.53 -1.07 115.29 127.34 1mmu s HIS 143 Ca 0.05 0.14 0.06 0.00 -0.15 0.00 0.00 55.06 55.15 1mmu s HIS 143 Cb -0.17 -2.32 -0.03 0.00 1.11 0.00 0.00 32.58 31.16 1mmu s HIS 143 CO 0.07 -0.07 -0.16 -1.54 -0.85 0.00 0.00 174.74 172.19 1mmu s SER 144 N 1.45 1.99 -0.01 1.40 1.04 -0.11 -0.46 113.70 119.00 1mmu s SER 144 Ca 0.07 -0.70 0.03 0.00 0.48 0.00 0.00 55.95 55.82 1mmu s SER 144 Cb -0.15 -0.08 -0.00 0.00 0.10 0.00 0.00 66.02 65.89 1mmu s SER 144 CO 0.08 -0.07 -0.08 0.12 0.98 0.00 0.00 173.24 174.27 1mmu s PHE 145 N -1.56 0.77 0.38 5.02 5.36 -0.39 -0.97 117.98 126.59 1mmu s PHE 145 Ca 0.04 -0.15 0.04 0.00 -0.96 0.00 0.00 56.93 55.89 1mmu s PHE 145 Cb -0.08 -0.51 -0.04 0.00 -0.34 0.00 0.00 43.02 42.04 1mmu s PHE 145 CO 0.03 -0.03 0.07 0.16 -1.46 0.00 0.00 175.22 174.00 1mmu s ASP 146 N -0.11 2.80 0.14 6.13 1.47 -0.97 -0.86 116.67 125.25 1mmu s ASP 146 Ca 0.02 -1.51 0.17 0.00 1.18 0.00 0.00 52.55 52.41 1mmu s ASP 146 Cb -0.04 0.18 0.75 0.00 -0.34 0.00 0.00 42.92 43.47 1mmu s ASP 146 CO -0.00 -0.74 1.53 0.47 0.68 0.00 0.00 175.17 177.11 1mmu n ASP 147 N -0.99 0.33 -0.77 2.11 8.00 0.41 -1.61 116.55 124.04 1mmu n ASP 147 Ca -0.06 0.60 0.07 0.00 0.71 0.00 0.00 54.79 56.11 1mmu n ASP 147 Cb 0.66 -0.66 0.19 0.00 -0.02 0.00 0.00 41.12 41.29 1mmu n ASP 147 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1mmu n ASP 148 N -1.88 2.22 -1.09 -2.24 9.92 -1.26 -4.68 116.55 117.54 1mmu n ASP 148 Ca 0.02 -1.99 -0.12 0.00 -0.53 0.00 0.00 54.79 52.17 1mmu n ASP 148 Cb 0.16 -0.27 -0.04 0.00 -0.64 0.00 0.00 41.12 40.33 1mmu n ASP 148 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1mmu n ASN 149 N 0.71 -4.27 -4.60 -2.24 3.02 -0.63 -4.81 115.26 102.44 1mmu n ASN 149 Ca 0.14 0.20 -0.38 0.00 -0.03 0.00 0.00 54.58 54.50 1mmu n ASN 149 Cb 0.35 -3.06 -0.10 0.00 -0.61 0.00 0.00 39.78 36.36 1mmu n ASN 149 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1mmu s LYS 150 N -3.57 3.99 -0.47 3.52 1.02 -1.26 -2.02 119.74 120.96 1mmu s LYS 150 Ca 0.00 -0.15 -0.15 0.00 0.02 0.00 0.00 55.97 55.70 1mmu s LYS 150 Cb 0.00 -3.65 0.07 0.00 -0.52 0.00 0.00 37.83 33.73 1mmu s LYS 150 CO 0.00 -0.21 0.38 -0.46 -0.92 0.00 0.00 175.35 174.14 1mmu s TRP 151 N 1.86 3.25 -0.01 3.18 -0.00 -0.38 -2.30 118.94 124.53 1mmu s TRP 151 Ca 0.11 -1.00 0.00 0.00 -0.00 0.00 0.00 56.10 55.21 1mmu s TRP 151 Cb -0.16 -3.16 -0.04 0.00 -0.00 0.00 0.00 33.47 30.12 1mmu s TRP 151 CO 0.10 -0.81 0.04 0.21 -0.00 0.00 0.00 176.95 176.49 1mmu s LYS 152 N 1.62 2.93 -0.22 5.86 2.20 -0.15 -1.15 119.74 130.84 1mmu s LYS 152 Ca 0.04 -0.53 0.01 0.00 -0.36 0.00 0.00 55.97 55.13 1mmu s LYS 152 Cb -0.24 -2.77 0.03 0.00 -1.51 0.00 0.00 37.83 33.34 1mmu s LYS 152 CO 0.06 0.65 -0.13 0.42 -0.36 0.00 0.00 175.35 175.98 1mmu s ILE 153 N -1.11 2.36 -0.23 5.43 1.01 0.46 -0.94 121.20 128.19 1mmu s ILE 153 Ca 0.20 -1.13 0.00 0.00 0.00 0.00 0.00 60.65 59.73 1mmu s ILE 153 Cb -0.12 -2.15 0.03 0.00 0.01 0.00 0.00 42.46 40.23 1mmu s ILE 153 CO 0.11 0.30 -0.12 -2.28 0.00 0.00 0.00 174.94 172.95 1mmu s HIS 154 N 1.26 3.01 -0.06 3.97 2.46 -0.23 -1.35 115.29 124.35 1mmu s HIS 154 Ca 0.00 -1.73 -0.06 0.00 0.47 0.00 0.00 55.06 53.74 1mmu s HIS 154 Cb -0.16 -1.99 -0.04 0.00 -0.13 0.00 0.00 32.58 30.26 1mmu s HIS 154 CO -0.08 -0.78 0.19 0.71 -2.47 0.00 0.00 174.74 172.30 1mmu s TYR 155 N 1.27 3.59 -0.02 3.88 1.51 -0.23 -0.40 117.35 126.94 1mmu s TYR 155 Ca 0.00 0.50 -0.03 0.00 -1.01 0.00 0.00 57.07 56.53 1mmu s TYR 155 Cb -0.16 -1.93 0.00 0.00 -0.11 0.00 0.00 41.96 39.77 1mmu s TYR 155 CO -0.07 0.69 0.08 -1.21 -1.11 0.00 0.00 175.55 173.92 1mmu s GLU 156 N -1.45 0.17 -0.12 -0.62 2.02 -0.64 -2.23 118.70 115.83 1mmu s GLU 156 Ca 0.21 -0.03 -0.29 0.00 0.02 0.00 0.00 54.97 54.88 1mmu s GLU 156 Cb -0.13 0.07 0.08 0.00 0.10 0.00 0.00 34.13 34.26 1mmu s GLU 156 CO 0.11 -0.03 0.76 0.00 0.02 0.00 0.00 175.26 176.12 1mmu s ALA 157 N -0.30 -1.81 -0.06 5.21 0.00 -0.76 -1.21 121.76 122.84 1mmu s ALA 157 Ca -0.04 1.52 -0.02 0.00 0.00 0.00 0.00 51.96 53.43 1mmu s ALA 157 Cb -0.02 -0.41 0.04 0.00 0.00 0.00 0.00 23.12 22.72 1mmu s ALA 157 CO 0.00 -0.35 0.11 0.42 0.00 0.00 0.00 175.76 175.95 1mmu s ILE 158 N -0.81 -0.10 0.04 0.00 1.01 -1.05 0.61 121.20 120.89 1mmu s ILE 158 Ca -0.07 0.26 0.02 0.00 0.00 0.00 0.00 60.65 60.86 1mmu s ILE 158 Cb -0.01 -0.20 -0.04 0.00 0.01 0.00 0.00 42.46 42.22 1mmu s ILE 158 CO 0.06 0.11 0.03 -0.55 0.00 0.00 0.00 174.94 174.59 1mmu s SER 159 N 1.51 5.29 0.32 3.58 0.15 -1.26 -1.13 113.70 122.16 1mmu s SER 159 Ca -0.05 -0.02 0.17 0.00 0.70 0.00 0.00 55.95 56.75 1mmu s SER 159 Cb -0.12 -1.39 0.31 0.00 -1.71 0.00 0.00 66.02 63.11 1mmu s SER 159 CO -0.05 0.23 1.56 0.44 1.20 0.00 0.00 173.24 176.62 1mmu h ASP 160 N 3.84 0.00 -4.15 5.45 5.19 -1.38 0.16 116.42 125.53 1mmu h ASP 160 Ca -0.48 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 55.59 1mmu h ASP 160 Cb 1.17 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 40.51 1mmu h ASP 160 CO 0.61 0.43 -0.73 -0.54 -3.12 0.00 0.00 179.24 175.89 1mmu s LYS 161 N -3.18 0.97 0.31 3.56 1.02 -1.20 -4.68 119.74 116.52 1mmu s LYS 161 Ca 0.03 -1.28 -0.30 0.00 0.02 0.00 0.00 55.97 54.44 1mmu s LYS 161 Cb 0.09 -0.65 -0.11 0.00 -0.52 0.00 0.00 37.83 36.63 1mmu s LYS 161 CO 0.72 0.10 1.59 -0.25 -0.92 0.00 0.00 175.35 176.59 1mmu n ASP 162 N 0.28 3.90 -0.05 2.83 8.00 -1.26 -4.09 116.55 126.15 1mmu n ASP 162 Ca -0.14 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.52 1mmu n ASP 162 Cb 0.59 -1.60 0.00 0.00 -0.02 0.00 0.00 41.12 40.08 1mmu n ASP 162 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 1mmu n THR 163 N 1.92 0.00 -4.61 -3.53 5.66 0.16 -4.70 114.28 109.18 1mmu n THR 163 Ca 0.07 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.81 1mmu n THR 163 Cb 0.37 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.01 1mmu n THR 163 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1mmu s VAL 164 N -2.38 1.81 -0.24 1.08 -7.23 -1.26 -0.03 120.40 112.14 1mmu s VAL 164 Ca 0.00 -1.33 -0.09 0.00 -1.81 0.00 0.00 61.98 58.74 1mmu s VAL 164 Cb 0.00 -1.58 0.10 0.00 0.56 0.00 0.00 36.38 35.46 1mmu s VAL 164 CO 0.00 0.18 0.53 0.12 -0.31 0.00 0.00 175.10 175.63 1mmu s PHE 165 N -0.88 -1.02 -0.47 2.82 5.36 0.05 -4.82 117.98 119.01 1mmu s PHE 165 Ca 0.09 1.88 0.05 0.00 -0.96 0.00 0.00 56.93 57.98 1mmu s PHE 165 Cb -0.09 0.53 0.23 0.00 -0.34 0.00 0.00 43.02 43.35 1mmu s PHE 165 CO 0.03 -0.55 0.91 -1.71 -1.46 0.00 0.00 175.22 172.43 1mmu n ASN 166 N 5.21 -2.77 -4.84 6.13 5.15 0.12 -4.79 115.26 119.46 1mmu n ASN 166 Ca -0.12 -2.91 -0.28 0.00 -0.60 0.00 0.00 54.58 50.67 1mmu n ASN 166 Cb 0.51 1.63 0.09 0.00 -0.53 0.00 0.00 39.78 41.47 1mmu n ASN 166 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1mmu s PRO 167 N 0.68 1.92 0.26 1.20 0.04 -1.03 -0.17 135.00 137.90 1mmu s PRO 167 Ca 0.30 -0.06 -0.15 0.00 0.04 0.00 0.00 61.00 61.14 1mmu s PRO 167 Cb 0.17 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.70 1mmu s PRO 167 CO -0.17 -1.56 0.55 -0.08 0.04 0.00 0.00 177.00 175.77 1mmu s THR 168 N -3.50 0.00 -0.24 1.26 -1.32 -0.77 -4.77 115.64 106.30 1mmu s THR 168 Ca 0.62 -1.30 -0.09 0.00 -1.21 0.00 0.00 61.69 59.72 1mmu s THR 168 Cb -0.10 -2.16 -0.04 0.00 -1.51 0.00 0.00 72.50 68.68 1mmu s THR 168 CO 0.48 0.00 0.12 -0.83 -2.21 0.00 0.00 174.62 172.18 1mmu s GLY 169 N -3.00 1.89 -0.43 6.08 0.00 -1.26 -0.72 107.32 109.88 1mmu s GLY 169 Ca 0.19 -0.97 0.02 0.00 0.00 0.00 0.00 44.72 43.96 1mmu s GLY 169 CO 0.09 0.42 1.85 1.57 0.00 0.00 0.00 173.10 177.02 1mmu n HIS 170 N 4.48 2.70 -1.94 1.90 -0.00 0.50 -4.33 115.22 118.53 1mmu n HIS 170 Ca -0.15 -1.92 -0.39 0.00 0.46 0.00 0.00 57.72 55.72 1mmu n HIS 170 Cb 0.52 -0.96 0.01 0.00 -0.12 0.00 0.00 29.99 29.44 1mmu n HIS 170 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1mmu s VAL 171 N -3.16 2.39 -0.14 3.57 0.11 -1.26 -1.03 120.40 120.88 1mmu s VAL 171 Ca 0.51 0.32 0.01 0.00 -2.93 0.00 0.00 61.98 59.89 1mmu s VAL 171 Cb 0.42 -3.18 -0.00 0.00 -1.53 0.00 0.00 36.38 32.09 1mmu s VAL 171 CO 0.07 0.02 -0.17 -0.31 -3.33 0.00 0.00 175.10 171.38 1mmu s TYR 172 N -1.30 2.73 0.23 1.54 1.51 -1.26 -4.20 117.35 116.60 1mmu s TYR 172 Ca 0.64 -1.02 -0.05 0.00 -1.01 0.00 0.00 57.07 55.63 1mmu s TYR 172 Cb -0.39 -1.84 -0.05 0.00 -0.11 0.00 0.00 41.96 39.57 1mmu s TYR 172 CO 0.48 -0.44 0.48 -0.06 -1.11 0.00 0.00 175.55 174.90 1mmu s PHE 173 N 0.65 3.47 -0.39 2.71 0.40 0.20 -0.96 117.98 124.05 1mmu s PHE 173 Ca -0.09 0.59 0.06 0.00 -0.60 0.00 0.00 56.93 56.89 1mmu s PHE 173 Cb -0.16 -2.05 0.18 0.00 0.51 0.00 0.00 43.02 41.50 1mmu s PHE 173 CO 0.02 0.28 0.66 1.21 0.70 0.00 0.00 175.22 178.10 1mmu s ASN 174 N -2.90 -1.45 0.00 1.36 3.84 -0.79 -1.21 114.94 113.79 1mmu s ASN 174 Ca 0.43 -0.62 0.10 0.00 0.21 0.00 0.00 52.86 52.98 1mmu s ASN 174 Cb -0.11 1.86 0.48 0.00 -0.55 0.00 0.00 41.25 42.94 1mmu s ASN 174 CO 0.27 -0.17 1.26 0.18 -2.79 0.00 0.00 177.10 175.84 1mmu n LEU 175 N 4.49 0.00 0.11 3.21 4.77 -1.26 -1.44 117.00 126.89 1mmu n LEU 175 Ca 0.10 0.36 0.13 0.00 -0.03 0.00 0.00 56.01 56.57 1mmu n LEU 175 Cb 0.57 -0.36 0.44 0.00 -2.33 0.00 0.00 43.42 41.74 1mmu n LEU 175 CO -0.01 -0.24 0.88 0.59 -1.33 0.00 0.00 177.39 177.28 1mmu n ASN 176 N -1.36 0.73 -0.03 -1.43 3.02 -1.26 -4.89 115.26 110.03 1mmu n ASN 176 Ca 0.04 0.61 -0.00 0.00 -0.03 0.00 0.00 54.58 55.19 1mmu n ASN 176 Cb 0.09 -0.79 -0.00 0.00 -0.61 0.00 0.00 39.78 38.47 1mmu n ASN 176 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mmu n GLY 177 N 0.81 0.25 2.94 7.41 0.00 -0.52 -4.94 105.19 111.14 1mmu n GLY 177 Ca 0.04 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 45.90 1mmu n GLY 177 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mmu s ASP 178 N -2.03 0.40 0.40 1.61 -1.08 -1.26 -4.51 116.67 110.19 1mmu s ASP 178 Ca 0.00 0.46 0.28 0.00 -0.52 0.00 0.00 52.55 52.77 1mmu s ASP 178 Cb 0.00 0.46 1.36 0.00 -1.46 0.00 0.00 42.92 43.28 1mmu s ASP 178 CO 0.00 -0.23 1.85 0.00 0.52 0.00 0.00 175.17 177.31 1mmu h ALA 179 N 8.11 1.00 -0.15 3.66 0.00 -1.86 -2.05 119.26 127.96 1mmu h ALA 179 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1mmu h ALA 179 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1mmu h ALA 179 CO 0.19 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 1mmu n SER 180 N -2.52 1.20 -4.24 0.00 3.41 -1.25 -0.85 113.62 109.38 1mmu n SER 180 Ca -0.00 -1.71 -0.34 0.00 -0.26 0.00 0.00 58.87 56.56 1mmu n SER 180 Cb 0.14 -0.09 -0.15 0.00 -0.26 0.00 0.00 64.21 63.85 1mmu n SER 180 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1mmu s GLU 181 N -1.81 3.23 0.53 4.33 2.02 -0.77 -4.59 118.70 121.63 1mmu s GLU 181 Ca 0.28 -0.70 -0.22 0.00 0.02 0.00 0.00 54.97 54.34 1mmu s GLU 181 Cb 0.14 -2.84 -0.06 0.00 0.10 0.00 0.00 34.13 31.47 1mmu s GLU 181 CO 0.22 -0.20 1.25 0.45 0.02 0.00 0.00 175.26 177.00 1mmu n SER 182 N 4.72 2.22 -0.28 -0.19 2.88 -1.26 -4.72 113.62 116.99 1mmu n SER 182 Ca -0.19 0.97 0.02 0.00 -1.33 0.00 0.00 58.87 58.34 1mmu n SER 182 Cb 0.51 -1.52 0.06 0.00 -0.75 0.00 0.00 64.21 62.51 1mmu n SER 182 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1mmu n VAL 183 N -0.99 0.20 0.19 2.46 0.24 -0.08 -4.01 118.33 116.34 1mmu n VAL 183 Ca 0.10 -0.19 0.17 0.00 -2.04 0.00 0.00 64.34 62.39 1mmu n VAL 183 Cb 0.44 0.07 0.81 0.00 -1.47 0.00 0.00 33.84 33.69 1mmu n VAL 183 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1mmu h GLU 184 N 0.81 0.00 -0.02 7.34 4.11 -1.91 -0.94 114.58 123.97 1mmu h GLU 184 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1mmu h GLU 184 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1mmu h GLU 184 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 179.01 179.35 1mmu n ASN 185 N -3.83 0.39 -4.90 3.06 6.94 -1.26 -1.55 115.26 114.12 1mmu n ASN 185 Ca 0.02 -1.33 -0.31 0.00 -0.02 0.00 0.00 54.58 52.94 1mmu n ASN 185 Cb 0.35 -0.01 -0.05 0.00 -2.36 0.00 0.00 39.78 37.71 1mmu n ASN 185 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 1mmu s HIS 186 N -1.97 3.47 -0.15 -2.53 3.76 -0.36 -4.90 115.29 112.61 1mmu s HIS 186 Ca 0.36 0.58 -0.08 0.00 -0.15 0.00 0.00 55.06 55.77 1mmu s HIS 186 Cb 0.17 -2.03 -0.04 0.00 1.11 0.00 0.00 32.58 31.79 1mmu s HIS 186 CO 0.29 0.39 0.14 0.20 -0.85 0.00 0.00 174.74 174.90 1mmu s GLY 187 N -2.54 2.11 -0.06 -2.22 0.00 -0.14 -0.81 107.32 103.66 1mmu s GLY 187 Ca 0.42 -0.66 0.06 0.00 0.00 0.00 0.00 44.72 44.54 1mmu s GLY 187 CO 0.25 -0.17 -0.24 -2.27 0.00 0.00 0.00 173.10 170.67 1mmu s LEU 188 N -0.48 2.05 -0.07 0.66 2.96 -0.18 -0.88 118.68 122.73 1mmu s LEU 188 Ca 0.12 -0.50 0.05 0.00 -0.22 0.00 0.00 54.13 53.58 1mmu s LEU 188 Cb -0.12 -1.33 -0.00 0.00 0.50 0.00 0.00 46.19 45.24 1mmu s LEU 188 CO 0.02 0.22 -0.23 0.00 -1.32 0.00 0.00 176.35 175.03 1mmu s ARG 189 N -0.06 2.65 -0.06 1.98 1.70 -0.52 -1.90 118.95 122.74 1mmu s ARG 189 Ca -0.06 -0.85 -0.02 0.00 -0.47 0.00 0.00 55.73 54.33 1mmu s ARG 189 Cb -0.14 -2.13 0.04 0.00 -0.57 0.00 0.00 34.95 32.15 1mmu s ARG 189 CO 0.04 0.27 0.11 -1.17 -1.08 0.00 0.00 175.30 173.47 1mmu s LEU 190 N 0.11 0.25 -1.56 -1.89 2.96 0.18 -0.56 118.68 118.17 1mmu s LEU 190 Ca -0.11 0.21 -0.09 0.00 -0.22 0.00 0.00 54.13 53.92 1mmu s LEU 190 Cb -0.15 0.10 -0.04 0.00 0.50 0.00 0.00 46.19 46.60 1mmu s LEU 190 CO 0.06 -0.22 2.82 0.00 -1.32 0.00 0.00 176.35 177.68 1mmu n ALA 191 N 5.02 7.34 -3.70 5.97 0.00 0.61 -2.97 120.51 132.78 1mmu n ALA 191 Ca -0.10 -3.66 -0.15 0.00 0.00 0.00 0.00 53.44 49.53 1mmu n ALA 191 Cb 0.50 -3.26 -0.16 0.00 0.00 0.00 0.00 19.45 16.53 1mmu n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mmu s ALA 192 N 1.54 0.07 -1.43 0.00 0.00 -1.26 -1.55 121.76 119.13 1mmu s ALA 192 Ca 0.66 0.29 0.17 0.00 0.00 0.00 0.00 51.96 53.08 1mmu s ALA 192 Cb 0.18 -0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 1mmu s ALA 192 CO -0.07 -0.10 0.86 0.43 0.00 0.00 0.00 175.76 176.88 1mmu n SER 193 N 4.10 1.53 -4.05 0.00 7.64 -1.25 -4.65 113.62 116.94 1mmu n SER 193 Ca -0.27 -1.26 -0.10 0.00 1.01 0.00 0.00 58.87 58.24 1mmu n SER 193 Cb 0.51 0.57 -0.11 0.00 -1.01 0.00 0.00 64.21 64.17 1mmu n SER 193 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1mmu s ARG 194 N -2.11 0.49 0.19 1.43 0.52 -1.26 -0.81 118.95 117.40 1mmu s ARG 194 Ca 0.13 -0.82 0.01 0.00 -0.52 0.00 0.00 55.73 54.52 1mmu s ARG 194 Cb 0.14 -0.07 -0.05 0.00 0.52 0.00 0.00 34.95 35.49 1mmu s ARG 194 CO 0.48 -0.01 0.06 -0.59 0.02 0.00 0.00 175.30 175.26 1mmu s PHE 195 N -1.97 1.21 -0.37 -0.53 -0.00 -0.46 -0.38 117.98 115.49 1mmu s PHE 195 Ca -0.08 -1.18 -0.05 0.00 -0.00 0.00 0.00 56.93 55.63 1mmu s PHE 195 Cb -0.06 -0.68 0.07 0.00 -0.00 0.00 0.00 43.02 42.35 1mmu s PHE 195 CO -0.02 -0.39 0.14 0.08 -0.00 0.00 0.00 175.22 175.03 1mmu s VAL 196 N -3.86 3.56 0.52 -2.49 1.01 -0.55 -1.19 120.40 117.40 1mmu s VAL 196 Ca 0.30 -1.50 -0.19 0.00 0.00 0.00 0.00 61.98 60.59 1mmu s VAL 196 Cb 0.07 -3.18 -0.07 0.00 0.00 0.00 0.00 36.38 33.20 1mmu s VAL 196 CO 0.08 -0.38 1.06 -2.16 0.00 0.00 0.00 175.10 173.70 1mmu s PRO 197 N 1.30 3.61 0.10 2.72 0.04 -1.26 -4.34 135.00 137.17 1mmu s PRO 197 Ca 0.01 1.38 -0.02 0.00 0.04 0.00 0.00 61.00 62.41 1mmu s PRO 197 Cb -0.21 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 1mmu s PRO 197 CO -0.00 -0.59 0.29 -0.51 0.04 0.00 0.00 177.00 176.22 1mmu s LEU 198 N -3.75 4.31 0.05 -3.56 1.43 -1.26 -0.79 118.68 115.11 1mmu s LEU 198 Ca 0.68 0.42 -0.24 0.00 -1.03 0.00 0.00 54.13 53.96 1mmu s LEU 198 Cb -0.18 -3.13 -0.17 0.00 0.03 0.00 0.00 46.19 42.74 1mmu s LEU 198 CO 0.25 0.11 1.55 0.50 0.23 0.00 0.00 176.35 178.99 1mmu h LYS 199 N 2.95 -0.06 0.00 1.70 3.64 -0.52 -3.40 116.57 120.88 1mmu h LYS 199 Ca -0.45 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1mmu h LYS 199 Cb 1.16 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1mmu h LYS 199 CO 0.74 0.12 0.00 -0.40 -2.27 0.00 0.00 179.45 177.65 1mmu n ASP 200 N -5.04 0.00 0.30 4.20 3.85 -1.26 -4.98 116.55 113.62 1mmu n ASP 200 Ca -0.08 -0.27 0.18 0.00 -0.71 0.00 0.00 54.79 53.91 1mmu n ASP 200 Cb 0.13 0.00 0.95 0.00 -1.35 0.00 0.00 41.12 40.85 1mmu n ASP 200 CO 0.00 0.00 0.00 1.56 -1.01 0.00 0.00 177.20 177.75 1mmu h GLN 201 N 0.00 0.00 0.00 0.11 1.08 -1.93 0.72 115.11 115.08 1mmu h GLN 201 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1mmu h GLN 201 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1mmu h GLN 201 CO 0.00 0.00 0.00 1.79 -0.95 0.00 0.00 178.83 179.67 1mmu h THR 202 N 0.00 0.00 0.00 -0.54 1.35 -1.99 -3.46 112.91 108.27 1mmu h THR 202 Ca 0.00 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 1mmu h THR 202 Cb 0.24 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 1mmu h THR 202 CO 0.00 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.65 1mmu n GLU 203 N -2.71 -0.59 -1.35 4.72 1.02 0.24 -5.01 120.64 116.96 1mmu n GLU 203 Ca 0.03 0.15 -0.31 0.00 -0.02 0.00 0.00 57.16 57.00 1mmu n GLU 203 Cb 0.35 -3.60 0.08 0.00 -0.02 0.00 0.00 31.44 28.25 1mmu n GLU 203 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1mmu s ILE 204 N -1.79 3.51 0.50 -3.67 -4.36 -1.26 -4.74 121.20 109.38 1mmu s ILE 204 Ca 0.00 0.50 -0.23 0.00 -0.26 0.00 0.00 60.65 60.66 1mmu s ILE 204 Cb 0.00 -3.05 -0.06 0.00 1.25 0.00 0.00 42.46 40.60 1mmu s ILE 204 CO 0.00 -0.64 1.29 0.68 0.24 0.00 0.00 174.94 176.52 1mmu s VAL 205 N -2.93 2.48 0.19 8.37 -7.23 -1.26 0.10 120.40 120.11 1mmu s VAL 205 Ca 0.60 0.37 0.04 0.00 -1.81 0.00 0.00 61.98 61.18 1mmu s VAL 205 Cb -0.16 -3.19 -0.12 0.00 0.56 0.00 0.00 36.38 33.46 1mmu s VAL 205 CO 0.55 0.01 1.43 -0.09 -0.31 0.00 0.00 175.10 176.69 1mmu h ARG 206 N 1.84 0.19 0.00 4.82 2.43 -1.19 -3.37 114.38 119.09 1mmu h ARG 206 Ca -0.50 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.48 1mmu h ARG 206 Cb 1.27 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 1mmu h ARG 206 CO 0.59 0.89 0.00 0.41 -1.51 0.00 0.00 179.97 180.35 1mmu n GLY 207 N 0.71 1.40 3.71 2.80 0.00 -1.26 -4.87 105.19 107.67 1mmu n GLY 207 Ca -0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 1mmu n GLY 207 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1mmu s ASP 208 N -0.83 4.59 -0.24 1.61 -4.77 -1.26 -4.84 116.67 110.94 1mmu s ASP 208 Ca 0.00 -0.79 -0.05 0.00 -3.30 0.00 0.00 52.55 48.42 1mmu s ASP 208 Cb 0.00 -0.72 -0.01 0.00 -1.09 0.00 0.00 42.92 41.10 1mmu s ASP 208 CO 0.00 -0.24 -0.00 -0.63 0.70 0.00 0.00 175.17 174.99 1mmu s ILE 209 N -2.42 3.60 -0.15 2.11 1.01 -1.26 -4.08 121.20 120.00 1mmu s ILE 209 Ca 0.36 -0.52 -0.08 0.00 0.00 0.00 0.00 60.65 60.41 1mmu s ILE 209 Cb -0.03 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 1mmu s ILE 209 CO 0.22 0.32 0.13 -0.69 0.00 0.00 0.00 174.94 174.92 1mmu s VAL 210 N 1.49 5.40 -0.17 2.92 1.01 -0.34 -4.95 120.40 125.77 1mmu s VAL 210 Ca 0.05 0.18 -0.29 0.00 0.00 0.00 0.00 61.98 61.91 1mmu s VAL 210 Cb -0.15 -3.40 -0.00 0.00 0.00 0.00 0.00 36.38 32.83 1mmu s VAL 210 CO -0.01 0.55 1.03 -0.62 0.00 0.00 0.00 175.10 176.05 1mmu s ASP 211 N -0.45 7.17 0.00 3.32 -1.08 -1.26 -1.35 116.67 123.01 1mmu s ASP 211 Ca 0.12 1.46 0.17 0.00 -0.52 0.00 0.00 52.55 53.78 1mmu s ASP 211 Cb -0.12 -2.55 0.35 0.00 -1.46 0.00 0.00 42.92 39.15 1mmu s ASP 211 CO 0.02 -0.56 1.27 2.30 0.52 0.00 0.00 175.17 178.71 1mmu n ILE 212 N 4.95 0.64 -1.61 4.11 -6.64 0.01 -4.97 119.36 115.84 1mmu n ILE 212 Ca 0.10 -0.82 -0.47 0.00 -1.77 0.00 0.00 62.75 59.79 1mmu n ILE 212 Cb 0.47 0.81 -0.04 0.00 -1.44 0.00 0.00 39.64 39.45 1mmu n ILE 212 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 1mmu n LYS 213 N 1.03 1.49 -2.13 6.28 5.02 -1.25 -1.63 118.16 126.97 1mmu n LYS 213 Ca 0.15 0.53 -0.20 0.00 -2.02 0.00 0.00 58.31 56.77 1mmu n LYS 213 Cb 0.49 -2.10 -0.03 0.00 -0.02 0.00 0.00 35.03 33.37 1mmu n LYS 213 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1mmu n ASN 214 N 2.11 -5.70 -4.68 4.39 3.02 -1.26 -4.97 115.26 108.17 1mmu n ASN 214 Ca 0.14 0.15 -0.28 0.00 -0.03 0.00 0.00 54.58 54.56 1mmu n ASN 214 Cb 0.27 -4.80 -0.03 0.00 -0.61 0.00 0.00 39.78 34.61 1mmu n ASN 214 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1mmu n THR 215 N -3.50 0.00 1.01 3.41 -2.24 -0.65 -4.98 114.28 107.34 1mmu n THR 215 Ca -0.23 -2.20 0.09 0.00 -2.27 0.00 0.00 64.05 59.43 1mmu n THR 215 Cb 0.68 0.17 0.50 0.00 -2.10 0.00 0.00 70.33 69.58 1mmu n THR 215 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1mmu n ASP 216 N -1.61 0.00 -0.73 3.42 8.00 -1.26 -1.73 116.55 122.63 1mmu n ASP 216 Ca -0.10 -0.35 0.06 0.00 0.71 0.00 0.00 54.79 55.11 1mmu n ASP 216 Cb 0.61 -0.10 0.18 0.00 -0.02 0.00 0.00 41.12 41.79 1mmu n ASP 216 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1mmu n LEU 217 N -1.10 3.12 -4.43 0.64 4.77 -1.26 -3.90 117.00 114.84 1mmu n LEU 217 Ca 0.12 -2.10 -0.44 0.00 -0.03 0.00 0.00 56.01 53.56 1mmu n LEU 217 Cb 0.09 -0.28 -0.05 0.00 -2.33 0.00 0.00 43.42 40.84 1mmu n LEU 217 CO 0.11 0.75 0.42 -0.62 -1.33 0.00 0.00 177.39 176.71 1mmu s ASP 218 N -1.08 6.22 -0.11 -1.43 2.15 -0.71 -4.89 116.67 116.82 1mmu s ASP 218 Ca 0.27 -1.02 0.15 0.00 0.43 0.00 0.00 52.55 52.38 1mmu s ASP 218 Cb 0.15 -2.31 0.50 0.00 -0.30 0.00 0.00 42.92 40.96 1mmu s ASP 218 CO 0.17 -1.02 1.42 0.49 -0.17 0.00 0.00 175.17 176.05 1mmu n PHE 219 N 6.43 0.92 -0.29 -5.34 3.01 -1.26 -4.69 117.46 116.23 1mmu n PHE 219 Ca -0.06 -0.69 0.09 0.00 1.01 0.00 0.00 57.45 57.79 1mmu n PHE 219 Cb 0.45 -0.21 0.24 0.00 -0.01 0.00 0.00 39.48 39.95 1mmu n PHE 219 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1mmu h ARG 220 N 2.39 0.49 -5.28 -1.08 3.08 -1.80 0.54 114.38 112.73 1mmu h ARG 220 Ca 0.00 -0.03 -0.61 0.00 0.07 0.00 0.00 59.98 59.41 1mmu h ARG 220 Cb 1.22 -0.11 -0.14 0.00 0.08 0.00 0.00 29.97 31.02 1mmu h ARG 220 CO 0.16 0.33 -0.52 -0.65 -1.07 0.00 0.00 179.97 178.21 1mmu s GLN 221 N -5.95 4.10 0.21 0.04 -1.52 -1.26 -4.47 119.66 110.81 1mmu s GLN 221 Ca -0.12 -0.27 -0.31 0.00 -1.95 0.00 0.00 55.36 52.71 1mmu s GLN 221 Cb 0.23 -3.33 -0.15 0.00 -0.22 0.00 0.00 33.01 29.54 1mmu s GLN 221 CO 0.78 0.29 1.17 -1.91 -0.25 0.00 0.00 175.29 175.37 1mmu n GLU 222 N 3.51 1.38 -3.75 2.91 2.13 -1.26 -4.84 120.64 120.73 1mmu n GLU 222 Ca -0.16 0.49 -0.10 0.00 0.66 0.00 0.00 57.16 58.05 1mmu n GLU 222 Cb 0.52 -1.99 -0.07 0.00 0.27 0.00 0.00 31.44 30.18 1mmu n GLU 222 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1mmu s LYS 223 N -0.67 0.89 0.53 5.31 -2.85 -0.80 -4.92 119.74 117.23 1mmu s LYS 223 Ca 0.69 -0.71 -0.21 0.00 -1.00 0.00 0.00 55.97 54.74 1mmu s LYS 223 Cb -0.77 0.38 -0.06 0.00 -2.06 0.00 0.00 37.83 35.32 1mmu s LYS 223 CO 0.54 -0.31 1.18 -0.65 0.10 0.00 0.00 175.35 176.21 1mmu s GLN 224 N -3.33 3.39 0.46 1.78 -1.52 -1.26 -1.01 119.66 118.15 1mmu s GLN 224 Ca 0.00 1.76 0.19 0.00 -1.95 0.00 0.00 55.36 55.37 1mmu s GLN 224 Cb 0.02 -2.14 1.09 0.00 -0.22 0.00 0.00 33.01 31.76 1mmu s GLN 224 CO -0.08 -0.86 1.98 -0.07 -0.25 0.00 0.00 175.29 176.01 1mmu h LEU 225 N 1.43 0.00 -2.02 2.90 3.38 -0.88 -2.05 115.31 118.07 1mmu h LEU 225 Ca -0.50 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.59 1mmu h LEU 225 Cb 1.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 1mmu h LEU 225 CO 0.58 0.21 0.40 0.77 0.09 0.00 0.00 178.44 180.48 1mmu h SER 226 N 0.00 0.00 -0.38 -0.43 4.64 -1.55 -0.47 113.55 115.36 1mmu h SER 226 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.26 1mmu h SER 226 Cb 0.42 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 1mmu h SER 226 CO 0.03 0.00 0.06 0.78 -0.87 0.00 0.00 176.83 176.82 1mmu h ASN 227 N 0.00 0.67 0.06 4.97 2.35 -1.68 0.71 115.58 122.66 1mmu h ASN 227 Ca 0.19 -0.13 -0.13 0.00 -0.55 0.00 0.00 56.30 55.68 1mmu h ASN 227 Cb 1.00 -0.18 0.01 0.00 0.05 0.00 0.00 38.32 39.20 1mmu h ASN 227 CO -0.00 0.70 -0.54 0.00 -1.65 0.00 0.00 177.43 175.95 1mmu h ALA 228 N 1.38 -0.01 -0.37 -0.83 0.00 -1.22 -3.14 119.26 115.06 1mmu h ALA 228 Ca 0.15 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1mmu h ALA 228 Cb 0.34 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1mmu h ALA 228 CO 0.01 0.26 0.13 0.74 0.00 0.00 0.00 179.25 180.39 1mmu h PHE 229 N -0.42 0.52 0.00 0.00 0.05 -1.18 -2.14 116.94 113.77 1mmu h PHE 229 Ca -0.08 -0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.69 1mmu h PHE 229 Cb 1.35 -0.16 0.00 0.00 2.00 0.00 0.00 35.95 39.13 1mmu h PHE 229 CO 0.19 0.43 -0.07 0.09 -0.18 0.00 0.00 178.31 178.77 1mmu n ASN 230 N -4.38 0.33 -4.77 2.17 3.02 0.23 -4.88 115.26 106.98 1mmu n ASN 230 Ca 0.02 0.44 -0.40 0.00 -0.03 0.00 0.00 54.58 54.62 1mmu n ASN 230 Cb 0.15 -0.50 0.01 0.00 -0.61 0.00 0.00 39.78 38.83 1mmu n ASN 230 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1mmu s SER 231 N -3.54 6.08 -0.10 6.41 0.15 -0.81 -4.93 113.70 116.96 1mmu s SER 231 Ca 0.12 2.90 0.17 0.00 0.70 0.00 0.00 55.95 59.84 1mmu s SER 231 Cb 0.17 -2.65 0.63 0.00 -1.71 0.00 0.00 66.02 62.46 1mmu s SER 231 CO 0.57 -1.04 1.55 -0.46 1.20 0.00 0.00 173.24 175.07 1mmu n ASN 232 N 0.03 4.36 -4.53 5.45 0.23 -1.26 -4.56 115.26 114.97 1mmu n ASN 232 Ca 0.04 -2.43 -0.38 0.00 -0.53 0.00 0.00 54.58 51.27 1mmu n ASN 232 Cb 0.42 -0.52 0.04 0.00 -2.08 0.00 0.00 39.78 37.64 1mmu n ASN 232 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 1mmu n MET 233 N 0.85 0.73 -0.17 -3.83 2.81 -1.26 -4.70 117.12 111.54 1mmu n MET 233 Ca 0.23 0.28 -0.02 0.00 -1.81 0.00 0.00 57.70 56.38 1mmu n MET 233 Cb 0.81 -1.89 0.08 0.00 -0.71 0.00 0.00 33.22 31.51 1mmu n MET 233 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1mmu h GLU 234 N 0.47 0.31 -0.34 0.03 4.22 -1.99 -1.58 114.58 115.70 1mmu h GLU 234 Ca -0.46 -0.02 -0.07 0.00 0.08 0.00 0.00 59.36 58.89 1mmu h GLU 234 Cb 1.38 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.54 1mmu h GLU 234 CO 0.49 0.21 -0.09 1.96 -2.18 0.00 0.00 179.01 179.40 1mmu h GLN 235 N 0.32 0.57 -0.09 1.92 1.08 -1.97 -0.72 115.11 116.22 1mmu h GLN 235 Ca 0.27 -0.16 -0.02 0.00 -1.45 0.00 0.00 58.65 57.29 1mmu h GLN 235 Cb 0.33 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.70 1mmu h GLN 235 CO -0.30 0.66 -0.01 0.28 -0.95 0.00 0.00 178.83 178.51 1mmu h VAL 236 N 0.53 1.27 -0.26 -0.54 2.07 -1.63 -3.02 116.25 114.66 1mmu h VAL 236 Ca 0.10 -0.85 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 1mmu h VAL 236 Cb 0.48 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1mmu h VAL 236 CO 0.03 0.24 -0.05 1.56 0.02 0.00 0.00 177.57 179.37 1mmu h GLN 237 N -0.14 0.40 -0.27 1.57 4.20 -1.15 0.28 115.11 120.01 1mmu h GLN 237 Ca 0.02 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.68 1mmu h GLN 237 Cb 0.38 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 1mmu h GLN 237 CO 0.01 0.47 0.08 1.25 -0.67 0.00 0.00 178.83 179.96 1mmu h LEU 238 N 0.38 0.07 -1.72 1.46 5.85 -1.01 -3.09 115.31 117.25 1mmu h LEU 238 Ca 0.08 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1mmu h LEU 238 Cb 0.34 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.40 1mmu h LEU 238 CO 0.01 0.07 -0.09 1.33 -0.34 0.00 0.00 178.44 179.42 1mmu n VAL 239 N -5.05 0.00 -3.58 1.05 0.24 -1.12 -4.90 118.33 104.97 1mmu n VAL 239 Ca -0.01 -0.45 -0.23 0.00 -2.04 0.00 0.00 64.34 61.61 1mmu n VAL 239 Cb 0.10 1.44 0.08 0.00 -1.47 0.00 0.00 33.84 33.99 1mmu n VAL 239 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1mmu n LYS 240 N 1.04 -7.57 0.00 7.34 4.76 0.92 -4.71 118.16 119.94 1mmu n LYS 240 Ca 0.13 0.82 0.00 0.00 -2.87 0.00 0.00 58.31 56.39 1mmu n LYS 240 Cb 0.56 -5.86 0.00 0.00 -1.84 0.00 0.00 35.03 27.89 1mmu n LYS 240 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1mmu n GLY 241 N -1.82 0.17 3.37 0.72 0.00 -0.76 -4.73 105.19 102.13 1mmu n GLY 241 Ca -0.05 -0.96 -0.32 0.00 0.00 0.00 0.00 46.02 44.69 1mmu n GLY 241 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mmu s ILE 242 N -3.34 2.48 -0.42 -0.61 1.01 -1.26 -4.39 121.20 114.66 1mmu s ILE 242 Ca 0.00 -0.94 0.06 0.00 0.00 0.00 0.00 60.65 59.78 1mmu s ILE 242 Cb 0.00 -1.92 0.33 0.00 0.01 0.00 0.00 42.46 40.87 1mmu s ILE 242 CO 0.00 0.58 1.21 -0.67 0.00 0.00 0.00 174.94 176.06 1mmu n ASP 243 N 2.55 -2.04 -3.94 3.58 -0.08 -0.93 -1.43 116.55 114.26 1mmu n ASP 243 Ca -0.17 -3.05 -0.09 0.00 -1.51 0.00 0.00 54.79 49.97 1mmu n ASP 243 Cb 0.52 1.55 -0.09 0.00 2.34 0.00 0.00 41.12 45.44 1mmu n ASP 243 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 1mmu s HIS 244 N 0.21 0.23 0.07 -0.67 3.76 -0.27 -4.94 115.29 113.68 1mmu s HIS 244 Ca 0.21 -0.56 -0.26 0.00 -0.15 0.00 0.00 55.06 54.29 1mmu s HIS 244 Cb 0.31 -0.16 -0.06 0.00 1.11 0.00 0.00 32.58 33.78 1mmu s HIS 244 CO -0.08 -0.37 0.81 -2.14 -0.85 0.00 0.00 174.74 172.11 1mmu s PRO 245 N -2.79 4.55 -0.11 8.40 0.02 -1.26 -0.25 135.00 143.57 1mmu s PRO 245 Ca -0.03 1.17 -0.00 0.00 0.02 0.00 0.00 61.00 62.15 1mmu s PRO 245 Cb -0.00 -3.36 -0.02 0.00 0.02 0.00 0.00 34.50 31.14 1mmu s PRO 245 CO -0.05 0.29 -0.09 -0.06 -0.33 0.00 0.00 177.00 176.76 1mmu s PHE 246 N -0.14 2.89 -0.27 6.54 0.40 -0.04 -1.48 117.98 125.88 1mmu s PHE 246 Ca 0.40 -0.28 -0.18 0.00 -0.60 0.00 0.00 56.93 56.28 1mmu s PHE 246 Cb -0.21 -1.80 -0.03 0.00 0.51 0.00 0.00 43.02 41.49 1mmu s PHE 246 CO 0.25 0.06 0.50 -0.51 0.70 0.00 0.00 175.22 176.22 1mmu s LEU 247 N -0.15 4.08 0.21 -0.37 1.43 0.49 -1.67 118.68 122.70 1mmu s LEU 247 Ca 0.01 0.43 -0.31 0.00 -1.03 0.00 0.00 54.13 53.24 1mmu s LEU 247 Cb -0.13 -2.63 -0.10 0.00 0.03 0.00 0.00 46.19 43.36 1mmu s LEU 247 CO 0.03 -0.30 1.47 -0.76 0.23 0.00 0.00 176.35 177.02 1mmu s LEU 248 N 2.30 4.38 0.19 1.79 1.43 -0.45 -3.96 118.68 124.36 1mmu s LEU 248 Ca 0.20 2.62 -0.03 0.00 -1.03 0.00 0.00 54.13 55.89 1mmu s LEU 248 Cb -0.16 -3.61 0.13 0.00 0.03 0.00 0.00 46.19 42.58 1mmu s LEU 248 CO 0.10 -0.73 1.52 0.44 0.23 0.00 0.00 176.35 177.90 1mmu h ASP 249 N 5.70 0.62 -3.45 2.29 3.32 -1.62 -3.44 116.42 119.85 1mmu h ASP 249 Ca -0.45 -0.32 -0.43 0.00 0.02 0.00 0.00 57.03 55.85 1mmu h ASP 249 Cb 1.21 -0.18 -0.34 0.00 0.22 0.00 0.00 39.33 40.25 1mmu h ASP 249 CO 0.82 1.03 -0.78 -1.10 -1.72 0.00 0.00 179.24 177.49 1mmu s GLN 250 N -4.04 1.01 0.27 3.56 -0.21 -1.26 -5.09 119.66 113.89 1mmu s GLN 250 Ca -0.07 -0.17 -0.06 0.00 0.02 0.00 0.00 55.36 55.08 1mmu s GLN 250 Cb 0.11 -0.96 -0.05 0.00 1.00 0.00 0.00 33.01 33.11 1mmu s GLN 250 CO 0.84 -0.06 0.54 -0.51 -2.12 0.00 0.00 175.29 173.97 1mmu s LEU 251 N 0.89 4.09 0.00 2.90 1.43 -1.26 -5.00 118.68 121.73 1mmu s LEU 251 Ca -0.11 0.73 0.00 0.00 -1.03 0.00 0.00 54.13 53.71 1mmu s LEU 251 Cb -0.15 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.54 1mmu s LEU 251 CO 0.01 -0.15 0.00 0.61 0.23 0.00 0.00 176.35 177.04 1mmu n GLY 252 N -0.73 4.08 0.32 -3.19 0.00 -1.26 -4.92 105.19 99.50 1mmu n GLY 252 Ca -0.01 -1.25 0.19 0.00 0.00 0.00 0.00 46.02 44.95 1mmu n GLY 252 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1mmu h LEU 253 N 0.00 0.00 -0.89 0.99 5.85 -1.86 -2.64 115.31 116.75 1mmu h LEU 253 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1mmu h LEU 253 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1mmu h LEU 253 CO 0.00 0.00 -0.14 -2.24 -0.34 0.00 0.00 178.44 175.72 1mmu h ASP 254 N 0.00 0.00 -3.31 1.25 2.03 -1.92 -3.40 116.42 111.07 1mmu h ASP 254 Ca 0.00 0.00 -0.57 0.00 -0.73 0.00 0.00 57.03 55.73 1mmu h ASP 254 Cb 0.01 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.45 1mmu h ASP 254 CO -0.00 0.14 -0.01 -0.54 -1.03 0.00 0.00 179.24 177.80 1mmu s LYS 255 N -3.50 4.32 -0.65 4.15 1.02 -1.00 -5.01 119.74 119.07 1mmu s LYS 255 Ca 0.02 0.74 -0.27 0.00 0.02 0.00 0.00 55.97 56.48 1mmu s LYS 255 Cb 0.09 -3.34 0.00 0.00 -0.52 0.00 0.00 37.83 34.05 1mmu s LYS 255 CO 0.63 0.36 1.60 -2.00 -0.92 0.00 0.00 175.35 175.02 1mmu s GLU 256 N -0.17 2.90 0.20 1.68 2.12 -1.26 -4.58 118.70 119.60 1mmu s GLU 256 Ca 0.31 0.29 0.09 0.00 0.36 0.00 0.00 54.97 56.02 1mmu s GLU 256 Cb -0.18 -4.29 0.08 0.00 0.26 0.00 0.00 34.13 30.01 1mmu s GLU 256 CO 0.17 -2.44 1.45 1.96 -0.54 0.00 0.00 175.26 175.87 1mmu h GLN 257 N 12.75 0.00 -2.81 4.30 1.08 -1.32 -3.45 115.11 125.67 1mmu h GLN 257 Ca -0.27 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 56.86 1mmu h GLN 257 Cb 1.11 0.00 -0.17 0.00 -0.05 0.00 0.00 27.48 28.38 1mmu h GLN 257 CO 1.24 0.79 -0.00 0.00 -0.95 0.00 0.00 178.83 179.91 1mmu s ALA 258 N -3.16 -1.25 -0.08 3.87 0.00 -1.17 -0.28 121.76 119.69 1mmu s ALA 258 Ca -0.00 0.55 -0.03 0.00 0.00 0.00 0.00 51.96 52.48 1mmu s ALA 258 Cb 0.11 0.35 0.04 0.00 0.00 0.00 0.00 23.12 23.62 1mmu s ALA 258 CO 0.79 -0.48 0.16 0.50 0.00 0.00 0.00 175.76 176.73 1mmu s ARG 259 N -2.35 0.09 -0.21 0.00 3.52 0.28 -0.33 118.95 119.94 1mmu s ARG 259 Ca -0.06 0.45 -0.03 0.00 -0.13 0.00 0.00 55.73 55.95 1mmu s ARG 259 Cb -0.01 -0.19 -0.01 0.00 -1.56 0.00 0.00 34.95 33.18 1mmu s ARG 259 CO -0.01 -0.21 -0.06 -1.17 -0.81 0.00 0.00 175.30 173.04 1mmu s LEU 260 N 1.51 2.82 -0.01 -0.88 2.96 -0.12 -1.43 118.68 123.53 1mmu s LEU 260 Ca -0.06 -0.41 0.06 0.00 -0.22 0.00 0.00 54.13 53.50 1mmu s LEU 260 Cb -0.12 -1.71 -0.02 0.00 0.50 0.00 0.00 46.19 44.85 1mmu s LEU 260 CO -0.06 -0.01 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.88 1mmu s THR 261 N 1.40 1.54 -0.13 3.68 2.01 -0.06 -0.12 115.64 123.95 1mmu s THR 261 Ca 0.05 -0.86 -0.04 0.00 0.31 0.00 0.00 61.69 61.15 1mmu s THR 261 Cb -0.14 -1.28 0.05 0.00 0.01 0.00 0.00 72.50 71.14 1mmu s THR 261 CO -0.04 0.41 0.06 -0.22 -0.69 0.00 0.00 174.62 174.14 1mmu s LEU 262 N -0.52 0.46 0.00 4.42 2.96 0.72 -0.97 118.68 125.74 1mmu s LEU 262 Ca 0.07 -0.42 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1mmu s LEU 262 Cb -0.08 -0.30 0.00 0.00 0.50 0.00 0.00 46.19 46.32 1mmu s LEU 262 CO -0.01 -0.30 0.00 0.47 -1.32 0.00 0.00 176.35 175.19 1mmu n ASP 263 N 5.23 0.00 0.02 3.68 8.00 -1.24 -0.83 116.55 131.42 1mmu n ASP 263 Ca -0.06 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.57 1mmu n ASP 263 Cb 0.49 0.00 0.45 0.00 -0.02 0.00 0.00 41.12 42.04 1mmu n ASP 263 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1mmu n ASP 264 N 5.53 0.32 -4.78 -2.24 8.00 -1.26 -4.18 116.55 117.95 1mmu n ASP 264 Ca 0.00 0.29 -0.37 0.00 0.71 0.00 0.00 54.79 55.42 1mmu n ASP 264 Cb 0.00 -0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 40.74 1mmu n ASP 264 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1mmu s THR 265 N -3.03 5.21 0.01 -3.53 2.01 -0.01 0.58 115.64 116.89 1mmu s THR 265 Ca 0.12 0.68 -0.01 0.00 0.31 0.00 0.00 61.69 62.79 1mmu s THR 265 Cb 0.17 -3.67 -0.01 0.00 0.01 0.00 0.00 72.50 69.00 1mmu s THR 265 CO 0.60 0.46 -0.00 -0.94 -0.69 0.00 0.00 174.62 174.05 1mmu s SER 266 N -0.16 0.18 -0.18 3.53 1.04 -0.68 -0.20 113.70 117.23 1mmu s SER 266 Ca 0.20 -0.40 -0.00 0.00 0.48 0.00 0.00 55.95 56.23 1mmu s SER 266 Cb -0.14 0.11 0.01 0.00 0.10 0.00 0.00 66.02 66.09 1mmu s SER 266 CO 0.08 -0.28 -0.15 -0.63 0.98 0.00 0.00 173.24 173.24 1mmu s ILE 267 N -1.30 2.56 -0.03 -1.02 -1.09 0.83 -1.54 121.20 119.62 1mmu s ILE 267 Ca -0.14 -0.78 -0.02 0.00 -2.23 0.00 0.00 60.65 57.47 1mmu s ILE 267 Cb -0.09 -2.10 -0.04 0.00 -1.58 0.00 0.00 42.46 38.66 1mmu s ILE 267 CO -0.01 0.51 0.11 -0.44 -1.23 0.00 0.00 174.94 173.88 1mmu s SER 268 N 1.13 5.93 -0.15 3.58 0.01 0.10 -0.94 113.70 123.36 1mmu s SER 268 Ca 0.01 0.24 0.01 0.00 1.31 0.00 0.00 55.95 57.52 1mmu s SER 268 Cb -0.14 -1.78 0.00 0.00 0.21 0.00 0.00 66.02 64.31 1mmu s SER 268 CO -0.06 0.30 -0.18 -0.69 0.41 0.00 0.00 173.24 173.02 1mmu s VAL 269 N -1.19 2.38 0.08 3.43 1.01 0.55 -0.54 120.40 126.13 1mmu s VAL 269 Ca 0.22 -0.87 0.08 0.00 0.00 0.00 0.00 61.98 61.41 1mmu s VAL 269 Cb -0.12 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1mmu s VAL 269 CO 0.13 0.53 -0.21 -0.36 0.00 0.00 0.00 175.10 175.19 1mmu s PHE 270 N 0.80 1.80 0.15 5.22 0.40 -0.14 -0.76 117.98 125.45 1mmu s PHE 270 Ca -0.06 -0.40 -0.23 0.00 -0.60 0.00 0.00 56.93 55.63 1mmu s PHE 270 Cb -0.15 -1.01 0.07 0.00 0.51 0.00 0.00 43.02 42.43 1mmu s PHE 270 CO -0.01 0.17 0.62 -0.08 0.70 0.00 0.00 175.22 176.63 1mmu s THR 271 N -1.04 0.00 -2.60 0.64 -1.32 -1.26 -0.43 115.64 109.64 1mmu s THR 271 Ca 0.07 -0.01 0.24 0.00 -1.21 0.00 0.00 61.69 60.78 1mmu s THR 271 Cb -0.10 -1.01 0.15 0.00 -1.51 0.00 0.00 72.50 70.04 1mmu s THR 271 CO 0.03 0.00 1.25 -0.90 -2.21 0.00 0.00 174.62 172.80 1mmu n ASP 272 N -0.37 2.49 -4.86 8.08 5.75 -0.41 -2.76 116.55 124.48 1mmu n ASP 272 Ca -0.16 -1.76 -0.31 0.00 -0.01 0.00 0.00 54.79 52.55 1mmu n ASP 272 Cb 0.65 0.16 -0.01 0.00 -1.03 0.00 0.00 41.12 40.89 1mmu n ASP 272 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1mmu s GLN 273 N -2.18 3.75 0.10 0.11 -1.52 -1.26 -4.75 119.66 113.90 1mmu s GLN 273 Ca 0.25 0.83 0.24 0.00 -1.95 0.00 0.00 55.36 54.74 1mmu s GLN 273 Cb 0.19 -2.11 0.33 0.00 -0.22 0.00 0.00 33.01 31.20 1mmu s GLN 273 CO 0.40 -0.43 1.29 -0.35 -0.25 0.00 0.00 175.29 175.95 1mmu n PRO 274 N -2.23 0.26 -4.15 2.91 -0.04 -1.25 -4.80 135.00 125.70 1mmu n PRO 274 Ca 0.06 0.06 -0.11 0.00 -0.04 0.00 0.00 63.50 63.48 1mmu n PRO 274 Cb 0.54 -1.65 -0.09 0.00 -0.04 0.00 0.00 33.50 32.25 1mmu n PRO 274 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1mmu s SER 275 N -4.04 0.20 -0.10 3.54 1.04 -0.83 -1.34 113.70 112.16 1mmu s SER 275 Ca 0.06 -1.24 -0.01 0.00 0.48 0.00 0.00 55.95 55.25 1mmu s SER 275 Cb 0.14 0.36 0.03 0.00 0.10 0.00 0.00 66.02 66.65 1mmu s SER 275 CO 0.73 -0.81 -0.04 -0.63 0.98 0.00 0.00 173.24 173.47 1mmu s ILE 276 N -4.08 0.73 -0.21 -1.02 1.01 -0.67 -2.02 121.20 114.94 1mmu s ILE 276 Ca 0.29 -0.15 -0.18 0.00 0.00 0.00 0.00 60.65 60.61 1mmu s ILE 276 Cb 0.06 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.66 1mmu s ILE 276 CO 0.06 0.27 0.52 -0.69 0.00 0.00 0.00 174.94 175.10 1mmu s VAL 277 N 1.82 5.10 -0.16 2.92 1.01 0.21 -0.86 120.40 130.45 1mmu s VAL 277 Ca 0.04 0.95 -0.02 0.00 0.00 0.00 0.00 61.98 62.95 1mmu s VAL 277 Cb -0.13 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 1mmu s VAL 277 CO -0.07 0.17 -0.07 -0.63 0.00 0.00 0.00 175.10 174.49 1mmu s ILE 278 N 1.71 3.45 -0.10 2.22 1.01 0.65 -1.51 121.20 128.64 1mmu s ILE 278 Ca 0.24 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.39 1mmu s ILE 278 Cb -0.15 -2.50 0.02 0.00 0.01 0.00 0.00 42.46 39.83 1mmu s ILE 278 CO 0.09 0.49 -0.12 0.12 0.00 0.00 0.00 174.94 175.53 1mmu s PHE 279 N 0.59 1.65 -0.58 3.97 5.36 -1.26 -1.11 117.98 126.60 1mmu s PHE 279 Ca -0.05 -0.75 0.00 0.00 -0.96 0.00 0.00 56.93 55.18 1mmu s PHE 279 Cb -0.15 -1.25 0.47 0.00 -0.34 0.00 0.00 43.02 41.75 1mmu s PHE 279 CO 0.03 -0.43 1.86 0.25 -1.46 0.00 0.00 175.22 175.47 1mmu n THR 280 N 4.33 3.38 -3.97 0.12 -2.24 -0.52 -0.71 114.28 114.68 1mmu n THR 280 Ca -0.18 -3.10 -0.43 0.00 -2.27 0.00 0.00 64.05 58.07 1mmu n THR 280 Cb 0.51 -1.09 0.03 0.00 -2.10 0.00 0.00 70.33 67.67 1mmu n THR 280 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mmu n ALA 281 N -0.90 -2.59 -1.15 6.98 0.00 -1.22 -3.52 120.51 118.11 1mmu n ALA 281 Ca 0.59 -0.49 -0.19 0.00 0.00 0.00 0.00 53.44 53.35 1mmu n ALA 281 Cb 0.79 -3.03 -0.13 0.00 0.00 0.00 0.00 19.45 17.08 1mmu n ALA 281 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1mmu n ASN 282 N -2.31 6.02 -0.13 0.00 3.02 -1.26 -1.10 115.26 119.50 1mmu n ASN 282 Ca -0.11 -2.63 0.14 0.00 -0.03 0.00 0.00 54.58 51.95 1mmu n ASN 282 Cb 0.57 -1.41 0.77 0.00 -0.61 0.00 0.00 39.78 39.10 1mmu n ASN 282 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1mmu n PHE 283 N 2.37 0.01 -0.13 3.10 3.01 -1.26 -4.95 117.46 119.60 1mmu n PHE 283 Ca 0.50 -0.01 0.00 0.00 1.01 0.00 0.00 57.45 58.95 1mmu n PHE 283 Cb 0.74 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.21 1mmu n PHE 283 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1mmu n GLY 284 N 1.01 3.54 0.94 1.37 0.00 -1.26 -1.93 105.19 108.86 1mmu n GLY 284 Ca 0.21 -0.12 0.07 0.00 0.00 0.00 0.00 46.02 46.18 1mmu n GLY 284 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mmu n ASP 285 N 4.93 2.72 -0.19 1.61 8.00 -1.26 -3.42 116.55 128.94 1mmu n ASP 285 Ca 0.00 -2.06 -0.03 0.00 0.71 0.00 0.00 54.79 53.42 1mmu n ASP 285 Cb 0.00 -0.35 0.04 0.00 -0.02 0.00 0.00 41.12 40.79 1mmu n ASP 285 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1mmu h LEU 286 N 2.79 -0.77 0.27 0.64 5.85 -1.71 -3.47 115.31 118.91 1mmu h LEU 286 Ca 0.00 0.19 -0.25 0.00 0.84 0.00 0.00 57.88 58.67 1mmu h LEU 286 Cb 0.72 0.44 0.04 0.00 0.37 0.00 0.00 40.66 42.23 1mmu h LEU 286 CO 0.03 -0.24 -0.37 0.61 -0.34 0.00 0.00 178.44 178.12 1mmu n GLY 287 N -1.43 -0.04 3.65 3.75 0.00 -1.24 -4.96 105.19 104.93 1mmu n GLY 287 Ca 0.06 -0.22 -0.45 0.00 0.00 0.00 0.00 46.02 45.40 1mmu n GLY 287 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1mmu n THR 288 N -4.01 1.09 -2.73 2.61 -1.04 -1.26 -3.97 114.28 104.97 1mmu n THR 288 Ca -0.06 -0.27 -0.42 0.00 -2.04 0.00 0.00 64.05 61.25 1mmu n THR 288 Cb 0.57 -1.33 -0.03 0.00 -1.82 0.00 0.00 70.33 67.73 1mmu n THR 288 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1mmu s LEU 289 N 0.14 4.21 -0.28 -4.42 1.43 -1.26 -0.92 118.68 117.58 1mmu s LEU 289 Ca 0.67 1.44 0.03 0.00 -1.03 0.00 0.00 54.13 55.24 1mmu s LEU 289 Cb -0.69 -3.49 0.07 0.00 0.03 0.00 0.00 46.19 42.11 1mmu s LEU 289 CO 0.52 -0.47 -0.08 -0.31 0.23 0.00 0.00 176.35 176.24 1mmu s TYR 290 N 2.20 3.34 -1.43 0.29 1.51 0.04 -4.64 117.35 118.65 1mmu s TYR 290 Ca 0.46 -2.40 -0.11 0.00 -1.01 0.00 0.00 57.07 54.01 1mmu s TYR 290 Cb -0.17 -2.09 0.04 0.00 -0.11 0.00 0.00 41.96 39.62 1mmu s TYR 290 CO 0.15 -0.89 1.09 0.72 -1.11 0.00 0.00 175.55 175.51 1mmu n HIS 291 N 4.42 -2.63 -1.04 2.71 8.25 -1.26 -0.46 115.22 125.20 1mmu n HIS 291 Ca -0.11 0.95 -0.01 0.00 -0.26 0.00 0.00 57.72 58.29 1mmu n HIS 291 Cb 0.42 -4.60 -0.01 0.00 1.12 0.00 0.00 29.99 26.93 1mmu n HIS 291 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1mmu n GLU 292 N -4.85 -1.06 -3.83 -0.41 -0.58 -1.26 -5.00 120.64 103.66 1mmu n GLU 292 Ca 0.02 0.35 -0.35 0.00 -0.42 0.00 0.00 57.16 56.75 1mmu n GLU 292 Cb 0.55 -4.19 -0.10 0.00 -0.57 0.00 0.00 31.44 27.13 1mmu n GLU 292 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1mmu s LYS 293 N -1.32 3.99 -0.39 3.49 -0.14 0.39 -5.04 119.74 120.72 1mmu s LYS 293 Ca 0.00 -0.32 -0.28 0.00 -1.36 0.00 0.00 55.97 54.01 1mmu s LYS 293 Cb 0.00 -3.36 -0.02 0.00 -1.68 0.00 0.00 37.83 32.77 1mmu s LYS 293 CO 0.00 0.15 1.76 0.21 -0.76 0.00 0.00 175.35 176.71 1mmu s LYS 294 N 0.76 3.23 0.27 1.68 2.20 -1.26 -0.78 119.74 125.83 1mmu s LYS 294 Ca 0.05 1.22 -0.31 0.00 -0.36 0.00 0.00 55.97 56.58 1mmu s LYS 294 Cb -0.13 -4.21 -0.12 0.00 -1.51 0.00 0.00 37.83 31.86 1mmu s LYS 294 CO 0.02 -1.98 1.55 0.94 -0.36 0.00 0.00 175.35 175.51 1mmu n GLN 295 N 8.52 2.48 -3.52 4.03 7.27 -0.10 -3.74 117.38 132.32 1mmu n GLN 295 Ca 0.22 0.89 -0.27 0.00 0.07 0.00 0.00 57.00 57.90 1mmu n GLN 295 Cb 0.48 -2.63 -0.03 0.00 2.41 0.00 0.00 30.24 30.47 1mmu n GLN 295 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1mmu s VAL 296 N 0.10 5.12 0.16 1.69 0.11 -0.03 -3.59 120.40 123.96 1mmu s VAL 296 Ca 0.67 -0.22 -0.34 0.00 -2.93 0.00 0.00 61.98 59.15 1mmu s VAL 296 Cb -0.55 -3.75 -0.14 0.00 -1.53 0.00 0.00 36.38 30.41 1mmu s VAL 296 CO 0.47 -0.28 1.57 1.57 -3.33 0.00 0.00 175.10 175.10 1mmu n HIS 297 N -0.91 2.25 -2.10 1.54 -0.00 -1.22 0.50 115.22 115.27 1mmu n HIS 297 Ca -0.04 0.28 -0.10 0.00 0.46 0.00 0.00 57.72 58.33 1mmu n HIS 297 Cb 0.54 -2.54 -0.01 0.00 -0.12 0.00 0.00 29.99 27.87 1mmu n HIS 297 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 1mmu n HIS 298 N 3.36 -0.42 0.70 1.57 8.25 -0.26 -4.73 115.22 123.69 1mmu n HIS 298 Ca 0.17 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.61 1mmu n HIS 298 Cb 0.29 -2.33 0.04 0.00 1.12 0.00 0.00 29.99 29.10 1mmu n HIS 298 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1mmu n GLY 299 N -1.08 2.12 0.00 -1.41 0.00 0.18 -0.90 105.19 104.10 1mmu n GLY 299 Ca -0.11 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1mmu n GLY 299 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mmu n GLY 300 N 0.20 0.87 3.14 -0.02 0.00 -1.26 -4.79 105.19 103.34 1mmu n GLY 300 Ca 0.07 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 1mmu n GLY 300 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1mmu s ILE 301 N -2.00 -0.03 0.42 -0.61 2.07 -0.35 -3.39 121.20 117.31 1mmu s ILE 301 Ca 0.00 0.10 0.06 0.00 -1.41 0.00 0.00 60.65 59.40 1mmu s ILE 301 Cb 0.00 -0.45 0.01 0.00 0.13 0.00 0.00 42.46 42.15 1mmu s ILE 301 CO 0.00 0.04 0.58 0.42 -1.91 0.00 0.00 174.94 174.07 1mmu s THR 302 N 1.04 3.33 -0.44 4.00 -4.23 0.11 -0.63 115.64 118.83 1mmu s THR 302 Ca -0.07 -0.91 0.06 0.00 -1.18 0.00 0.00 61.69 59.59 1mmu s THR 302 Cb -0.08 -3.15 0.22 0.00 1.34 0.00 0.00 72.50 70.83 1mmu s THR 302 CO -0.08 -0.07 0.60 0.49 -0.54 0.00 0.00 174.62 175.03 1mmu n PHE 303 N -1.88 -1.70 -2.64 3.99 3.01 -1.26 -4.05 117.46 112.94 1mmu n PHE 303 Ca 0.05 -2.76 -0.42 0.00 1.01 0.00 0.00 57.45 55.33 1mmu n PHE 303 Cb 0.59 0.51 -0.03 0.00 -0.01 0.00 0.00 39.48 40.53 1mmu n PHE 303 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1mmu s GLU 304 N -0.17 3.28 -0.03 -1.08 2.02 -0.57 -4.87 118.70 117.29 1mmu s GLU 304 Ca 0.33 -0.21 -0.26 0.00 0.02 0.00 0.00 54.97 54.86 1mmu s GLU 304 Cb 0.13 -4.13 -0.04 0.00 0.10 0.00 0.00 34.13 30.19 1mmu s GLU 304 CO -0.16 -1.91 0.79 0.00 0.02 0.00 0.00 175.26 174.01 1mmu n GLN 306 N 3.62 0.13 -2.62 0.00 10.64 -0.86 -4.64 117.38 123.66 1mmu n GLN 306 Ca 0.01 -0.44 -0.41 0.00 -1.83 0.00 0.00 57.00 54.32 1mmu n GLN 306 Cb 0.51 0.70 -0.04 0.00 -0.86 0.00 0.00 30.24 30.55 1mmu n GLN 306 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1mmu s VAL 307 N -2.13 4.30 0.40 -0.39 1.01 -1.26 -1.96 120.40 120.37 1mmu s VAL 307 Ca 0.14 1.85 -0.25 0.00 0.00 0.00 0.00 61.98 63.73 1mmu s VAL 307 Cb -0.01 -4.18 -0.11 0.00 0.00 0.00 0.00 36.38 32.08 1mmu s VAL 307 CO 0.00 0.26 0.98 -0.24 0.00 0.00 0.00 175.10 176.10 1mmu n SER 308 N 2.97 1.13 -4.76 3.32 2.88 -1.26 -4.93 113.62 112.97 1mmu n SER 308 Ca 0.04 1.05 -0.32 0.00 -1.33 0.00 0.00 58.87 58.30 1mmu n SER 308 Cb 0.48 -1.33 0.07 0.00 -0.75 0.00 0.00 64.21 62.68 1mmu n SER 308 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 1mmu s PRO 309 N -1.91 2.51 0.00 -1.46 0.02 -1.26 -3.83 135.00 129.07 1mmu s PRO 309 Ca 0.62 1.35 0.00 0.00 0.02 0.00 0.00 61.00 62.99 1mmu s PRO 309 Cb -0.58 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.02 1mmu s PRO 309 CO 0.57 -1.47 0.00 0.41 -0.33 0.00 0.00 177.00 176.18 1mmu n GLY 310 N -0.66 0.58 0.15 0.52 0.00 -1.26 -4.95 105.19 99.56 1mmu n GLY 310 Ca 0.10 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.22 1mmu n GLY 310 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mmu n SER 311 N 0.00 0.52 0.04 1.61 3.41 -1.25 -0.23 113.62 117.72 1mmu n SER 311 Ca 0.00 0.73 -0.02 0.00 -0.26 0.00 0.00 58.87 59.32 1mmu n SER 311 Cb 0.00 -0.80 0.25 0.00 -0.26 0.00 0.00 64.21 63.40 1mmu n SER 311 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1mmu h GLU 312 N 0.00 0.42 0.00 4.33 3.07 -1.92 -3.06 114.58 117.43 1mmu h GLU 312 Ca 0.00 -0.14 -0.11 0.00 -0.50 0.00 0.00 59.36 58.61 1mmu h GLU 312 Cb 0.04 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 1mmu h GLU 312 CO 0.00 0.61 -1.89 1.04 -1.40 0.00 0.00 179.01 177.37 1mmu n GLN 313 N -4.16 0.85 -3.47 2.33 3.00 0.14 -4.77 117.38 111.29 1mmu n GLN 313 Ca -0.00 -0.10 -0.27 0.00 -0.01 0.00 0.00 57.00 56.62 1mmu n GLN 313 Cb 0.36 -1.41 -0.09 0.00 0.00 0.00 0.00 30.24 29.11 1mmu n GLN 313 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1mmu n ILE 314 N -2.28 1.77 -0.34 5.09 5.41 0.69 -4.95 119.36 124.74 1mmu n ILE 314 Ca -0.11 -4.97 0.36 0.00 1.00 0.00 0.00 62.75 59.03 1mmu n ILE 314 Cb 0.66 -2.08 0.62 0.00 -0.71 0.00 0.00 39.64 38.12 1mmu n ILE 314 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1mmu h PRO 315 N 4.39 0.00 -0.00 0.38 0.13 -1.79 0.53 132.00 135.64 1mmu h PRO 315 Ca 0.18 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.26 1mmu h PRO 315 Cb 0.71 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.83 1mmu h PRO 315 CO 0.76 0.00 -0.24 1.49 -0.23 0.00 0.00 178.00 179.78 1mmu h GLU 316 N 0.00 0.00 0.00 0.86 4.81 -1.92 -1.91 114.58 116.41 1mmu h GLU 316 Ca 0.60 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.82 1mmu h GLU 316 Cb 2.94 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 32.31 1mmu h GLU 316 CO -0.01 0.24 -0.06 -0.07 -0.73 0.00 0.00 179.01 178.38 1mmu h LEU 317 N 0.00 0.00 0.00 1.64 3.38 -0.28 -3.48 115.31 116.57 1mmu h LEU 317 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1mmu h LEU 317 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1mmu h LEU 317 CO 0.03 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.23 1mmu n GLY 318 N -1.07 0.95 2.70 0.83 0.00 -0.72 -4.57 105.19 103.30 1mmu n GLY 318 Ca -0.03 -1.93 -0.26 0.00 0.00 0.00 0.00 46.02 43.81 1mmu n GLY 318 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mmu s ASP 319 N -4.00 2.35 0.00 1.61 2.15 -1.26 -4.76 116.67 112.77 1mmu s ASP 319 Ca 0.00 -0.55 0.13 0.00 0.43 0.00 0.00 52.55 52.55 1mmu s ASP 319 Cb 0.00 -0.42 0.38 0.00 -0.30 0.00 0.00 42.92 42.58 1mmu s ASP 319 CO 0.00 -0.29 1.31 2.30 -0.17 0.00 0.00 175.17 178.31 1mmu n ILE 320 N 5.16 0.44 -1.65 4.11 -5.35 -1.26 -4.94 119.36 115.87 1mmu n ILE 320 Ca -0.08 -0.46 -0.34 0.00 -0.27 0.00 0.00 62.75 61.60 1mmu n ILE 320 Cb 0.48 0.26 0.07 0.00 -1.74 0.00 0.00 39.64 38.71 1mmu n ILE 320 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1mmu s SER 321 N -1.08 4.68 -0.10 7.28 1.04 -1.26 -0.77 113.70 123.48 1mmu s SER 321 Ca 0.25 2.24 -0.01 0.00 0.48 0.00 0.00 55.95 58.91 1mmu s SER 321 Cb 0.13 -2.58 0.03 0.00 0.10 0.00 0.00 66.02 63.70 1mmu s SER 321 CO 0.18 -1.93 -0.04 -0.22 0.98 0.00 0.00 173.24 172.22 1mmu s LEU 322 N -4.86 0.96 0.26 2.42 2.96 0.95 -4.72 118.68 116.65 1mmu s LEU 322 Ca 0.72 -0.26 -0.30 0.00 -0.22 0.00 0.00 54.13 54.08 1mmu s LEU 322 Cb -0.26 -0.66 -0.09 0.00 0.50 0.00 0.00 46.19 45.67 1mmu s LEU 322 CO 0.42 -0.16 0.98 -0.54 -1.32 0.00 0.00 176.35 175.72 1mmu s LYS 323 N 1.82 4.78 0.14 1.98 3.01 -1.26 0.40 119.74 130.61 1mmu s LYS 323 Ca 0.04 1.56 -0.34 0.00 -1.01 0.00 0.00 55.97 56.23 1mmu s LYS 323 Cb -0.13 -3.22 -0.16 0.00 -1.01 0.00 0.00 37.83 33.32 1mmu s LYS 323 CO -0.07 0.42 1.30 0.00 0.51 0.00 0.00 175.35 177.51 1mmu n ALA 324 N 1.34 -0.43 -0.45 5.17 0.00 -1.26 -1.32 120.51 123.56 1mmu n ALA 324 Ca -0.01 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1mmu n ALA 324 Cb 0.47 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1mmu n ALA 324 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mmu n GLY 325 N 2.37 2.08 3.80 0.00 0.00 0.58 -4.94 105.19 109.09 1mmu n GLY 325 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1mmu n GLY 325 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mmu s GLU 326 N -0.01 4.34 -0.39 1.61 2.02 -0.43 -4.94 118.70 120.90 1mmu s GLU 326 Ca 0.00 0.93 -0.23 0.00 0.02 0.00 0.00 54.97 55.69 1mmu s GLU 326 Cb 0.00 -3.08 0.01 0.00 0.10 0.00 0.00 34.13 31.17 1mmu s GLU 326 CO 0.00 0.50 0.76 0.21 0.02 0.00 0.00 175.26 176.76 1mmu s LYS 327 N -1.53 3.63 0.29 1.61 2.20 -1.26 -4.40 119.74 120.28 1mmu s LYS 327 Ca 0.38 0.14 -0.23 0.00 -0.36 0.00 0.00 55.97 55.90 1mmu s LYS 327 Cb -0.19 -3.85 -0.09 0.00 -1.51 0.00 0.00 37.83 32.18 1mmu s LYS 327 CO 0.22 -0.92 0.85 -0.47 -0.36 0.00 0.00 175.35 174.67 1mmu s TYR 328 N 3.11 3.63 -0.03 4.03 5.04 0.20 -4.90 117.35 128.44 1mmu s TYR 328 Ca 0.30 1.59 -0.09 0.00 -2.44 0.00 0.00 57.07 56.44 1mmu s TYR 328 Cb -0.13 -2.78 0.01 0.00 0.35 0.00 0.00 41.96 39.41 1mmu s TYR 328 CO 0.18 0.23 0.19 -0.65 -1.34 0.00 0.00 175.55 174.16 1mmu s GLN 329 N -2.16 0.45 -0.03 4.97 -0.21 -1.26 -1.83 119.66 119.58 1mmu s GLN 329 Ca 0.49 -0.15 -0.20 0.00 0.02 0.00 0.00 55.36 55.51 1mmu s GLN 329 Cb -0.17 0.20 0.04 0.00 1.00 0.00 0.00 33.01 34.08 1mmu s GLN 329 CO 0.21 -0.10 0.44 0.00 -2.12 0.00 0.00 175.29 173.73 1mmu s ALA 330 N -0.93 -1.14 -0.04 6.09 0.00 -0.95 -4.97 121.76 119.82 1mmu s ALA 330 Ca -0.10 0.72 -0.02 0.00 0.00 0.00 0.00 51.96 52.56 1mmu s ALA 330 Cb -0.05 0.01 0.03 0.00 0.00 0.00 0.00 23.12 23.11 1mmu s ALA 330 CO 0.02 -0.30 0.08 0.99 0.00 0.00 0.00 175.76 176.55 1mmu s THR 331 N -1.20 -0.10 -0.04 0.00 2.01 -1.26 -1.07 115.64 113.98 1mmu s THR 331 Ca -0.12 0.28 0.02 0.00 0.31 0.00 0.00 61.69 62.18 1mmu s THR 331 Cb -0.03 -0.16 0.01 0.00 0.01 0.00 0.00 72.50 72.32 1mmu s THR 331 CO 0.06 0.12 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.13 1mmu s THR 332 N 1.53 0.78 -0.04 -0.82 2.01 -0.46 -1.29 115.64 117.36 1mmu s THR 332 Ca -0.04 -0.30 0.04 0.00 0.31 0.00 0.00 61.69 61.70 1mmu s THR 332 Cb -0.12 -0.74 -0.00 0.00 0.01 0.00 0.00 72.50 71.65 1mmu s THR 332 CO -0.04 0.27 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.35 1mmu s ILE 333 N 0.58 1.45 -0.19 1.82 1.01 0.43 -0.40 121.20 125.90 1mmu s ILE 333 Ca -0.09 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 59.82 1mmu s ILE 333 Cb -0.13 -1.25 0.01 0.00 0.01 0.00 0.00 42.46 41.10 1mmu s ILE 333 CO 0.01 0.42 -0.14 -0.31 0.00 0.00 0.00 174.94 174.92 1mmu s TYR 334 N 0.05 2.84 -0.09 3.97 1.51 -0.30 -0.97 117.35 124.36 1mmu s TYR 334 Ca -0.04 -1.34 0.04 0.00 -1.01 0.00 0.00 57.07 54.72 1mmu s TYR 334 Cb -0.12 -1.98 -0.00 0.00 -0.11 0.00 0.00 41.96 39.75 1mmu s TYR 334 CO 0.02 -0.68 -0.23 -1.54 -1.11 0.00 0.00 175.55 172.01 1mmu s SER 335 N 1.29 3.15 -0.01 2.29 1.04 0.30 -1.25 113.70 120.50 1mmu s SER 335 Ca 0.04 -0.53 -0.16 0.00 0.48 0.00 0.00 55.95 55.77 1mmu s SER 335 Cb -0.14 -1.29 -0.06 0.00 0.10 0.00 0.00 66.02 64.64 1mmu s SER 335 CO -0.08 0.18 0.46 -0.22 0.98 0.00 0.00 173.24 174.56 1mmu s LEU 336 N 0.21 4.44 0.11 2.42 2.96 -0.86 0.00 118.68 127.97 1mmu s LEU 336 Ca -0.15 0.99 -0.07 0.00 -0.22 0.00 0.00 54.13 54.68 1mmu s LEU 336 Cb -0.17 -2.67 -0.01 0.00 0.50 0.00 0.00 46.19 43.83 1mmu s LEU 336 CO 0.07 0.24 0.17 -1.00 -1.32 0.00 0.00 176.35 174.51 1mmu s HIS 337 N -0.66 0.38 -0.01 5.38 3.76 -0.59 -4.79 115.29 118.75 1mmu s HIS 337 Ca 0.25 -0.79 0.04 0.00 -0.15 0.00 0.00 55.06 54.41 1mmu s HIS 337 Cb -0.17 -0.16 -0.01 0.00 1.11 0.00 0.00 32.58 33.35 1mmu s HIS 337 CO 0.14 -0.58 -0.14 0.95 -0.85 0.00 0.00 174.74 174.26 1mmu s THR 338 N -3.93 1.11 -1.43 1.30 -4.23 -1.26 -1.68 115.64 105.52 1mmu s THR 338 Ca 0.12 -0.59 -0.08 0.00 -1.18 0.00 0.00 61.69 59.95 1mmu s THR 338 Cb 0.05 -0.92 0.05 0.00 1.34 0.00 0.00 72.50 73.01 1mmu s THR 338 CO -0.06 0.31 0.90 0.29 -0.54 0.00 0.00 174.62 175.53 1mmu n LYS 339 N 2.77 -5.58 0.04 3.99 5.02 0.20 -4.90 118.16 119.69 1mmu n LYS 339 Ca -0.14 0.63 -0.13 0.00 -2.02 0.00 0.00 58.31 56.65 1mmu n LYS 339 Cb 0.55 -5.43 -0.03 0.00 -0.02 0.00 0.00 35.03 30.11 1mmu n LYS 339 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1mmu h LEU 340 N -2.07 0.64 0.00 -0.35 5.85 -1.89 -3.47 115.31 114.02 1mmu h LEU 340 Ca -0.59 -0.45 0.00 0.00 0.84 0.00 0.00 57.88 57.68 1mmu h LEU 340 Cb 1.37 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1mmu h LEU 340 CO 0.62 1.23 0.00 1.21 -0.34 0.00 0.00 178.44 181.16 1mmu n GLU 341 N -3.84 0.56 -3.47 1.25 2.13 -1.26 -5.12 120.64 110.90 1mmu n GLU 341 Ca -0.06 0.00 -0.27 0.00 0.66 0.00 0.00 57.16 57.49 1mmu n GLU 341 Cb 0.77 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 32.38 1mmu n GLU 341 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1mmu n HIS 342 N 0.00 0.40 -3.07 4.31 8.25 -1.26 -5.02 115.22 118.82 1mmu n HIS 342 Ca 0.00 -3.63 -0.45 0.00 -0.26 0.00 0.00 57.72 53.39 1mmu n HIS 342 Cb 0.00 -0.09 -0.04 0.00 1.12 0.00 0.00 29.99 30.98 1mmu n HIS 342 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1mmu s HIS 343 N -0.67 3.05 -0.37 4.41 2.46 -1.26 -4.97 115.29 117.94 1mmu s HIS 343 Ca 0.32 -1.09 0.01 0.00 0.47 0.00 0.00 55.06 54.77 1mmu s HIS 343 Cb 0.05 -4.07 0.12 0.00 -0.13 0.00 0.00 32.58 28.55 1mmu s HIS 343 CO -0.16 -1.34 0.17 -1.01 -2.47 0.00 0.00 174.74 169.92 1mmu s HIS 344 N 2.60 1.81 0.27 3.88 3.76 -1.26 -3.58 115.29 122.77 1mmu s HIS 344 Ca 0.17 -2.08 0.03 0.00 -0.15 0.00 0.00 55.06 53.02 1mmu s HIS 344 Cb -0.19 -1.77 -0.06 0.00 1.11 0.00 0.00 32.58 31.68 1mmu s HIS 344 CO 0.03 -0.83 0.06 -1.01 -0.85 0.00 0.00 174.74 172.13 1mmu s HIS 345 N 0.97 1.68 0.03 1.40 3.76 -1.26 -5.14 115.29 116.72 1mmu s HIS 345 Ca 0.14 -1.04 0.01 0.00 -0.15 0.00 0.00 55.06 54.02 1mmu s HIS 345 Cb -0.21 -1.02 -0.02 0.00 1.11 0.00 0.00 32.58 32.44 1mmu s HIS 345 CO -0.11 -0.15 -0.05 -3.38 -0.85 0.00 0.00 174.74 170.21 1mmu s HIS 346 N -3.52 0.40 0.00 1.40 -3.43 -1.26 -5.06 115.29 103.81 1mmu s HIS 346 Ca 0.35 -0.48 0.00 0.00 -0.80 0.00 0.00 55.06 54.13 1mmu s HIS 346 Cb 0.08 -0.26 0.00 0.00 -1.43 0.00 0.00 32.58 30.96 1mmu s HIS 346 CO 0.13 -0.14 0.00 0.72 -2.00 0.00 0.00 174.74 173.45