#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wdl h ILE 2 N 0.00 1.28 -2.03 3.17 2.04 -1.94 -3.44 117.51 116.58 1wdl h ILE 2 Ca 0.00 -1.38 0.03 0.00 1.00 0.00 0.00 64.86 64.51 1wdl h ILE 2 Cb 0.00 1.30 -0.21 0.00 -0.74 0.00 0.00 36.82 37.17 1wdl h ILE 2 CO 0.00 0.45 -0.04 -0.47 0.00 0.00 0.00 178.15 178.09 1wdl s TYR 3 N -4.51 -1.14 -0.51 1.37 5.04 -1.13 -4.98 117.35 111.49 1wdl s TYR 3 Ca -0.09 2.16 0.03 0.00 -2.44 0.00 0.00 57.07 56.74 1wdl s TYR 3 Cb 0.13 0.67 0.15 0.00 0.35 0.00 0.00 41.96 43.26 1wdl s TYR 3 CO 0.83 -0.57 0.33 -2.00 -1.34 0.00 0.00 175.55 172.80 1wdl s GLU 4 N 2.03 1.60 0.00 4.97 2.12 -1.26 -0.88 118.70 127.29 1wdl s GLU 4 Ca -0.09 -2.45 0.00 0.00 0.36 0.00 0.00 54.97 52.79 1wdl s GLU 4 Cb -0.07 -2.55 0.00 0.00 0.26 0.00 0.00 34.13 31.77 1wdl s GLU 4 CO -0.19 -1.23 0.00 0.41 -0.54 0.00 0.00 175.26 173.70 1wdl n GLY 5 N 2.94 0.66 0.00 -1.50 0.00 -0.23 -5.01 105.19 102.06 1wdl n GLY 5 Ca 0.15 -1.91 0.10 0.00 0.00 0.00 0.00 46.02 44.36 1wdl n GLY 5 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wdl n LYS 6 N -0.73 0.01 0.00 1.61 5.02 -1.26 -4.48 118.16 118.33 1wdl n LYS 6 Ca 0.00 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1wdl n LYS 6 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1wdl n LYS 6 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wdl n ALA 7 N -1.49 1.75 -3.60 7.82 0.00 -1.26 -1.55 120.51 122.18 1wdl n ALA 7 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.23 1wdl n ALA 7 Cb 0.33 0.21 -0.17 0.00 0.00 0.00 0.00 19.45 19.82 1wdl n ALA 7 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1wdl s ILE 8 N -1.67 1.17 -0.38 0.00 1.01 -1.26 -0.03 121.20 120.04 1wdl s ILE 8 Ca 0.00 -0.46 0.04 0.00 0.00 0.00 0.00 60.65 60.22 1wdl s ILE 8 Cb 0.00 -1.10 0.11 0.00 0.01 0.00 0.00 42.46 41.48 1wdl s ILE 8 CO 0.00 0.37 0.10 0.42 0.00 0.00 0.00 174.94 175.83 1wdl s THR 9 N 0.96 2.25 -0.72 2.92 -4.23 -0.90 -1.07 115.64 114.85 1wdl s THR 9 Ca -0.09 -2.51 -0.27 0.00 -1.18 0.00 0.00 61.69 57.64 1wdl s THR 9 Cb -0.15 -2.65 0.02 0.00 1.34 0.00 0.00 72.50 71.06 1wdl s THR 9 CO 0.00 -0.65 1.46 -0.69 -0.54 0.00 0.00 174.62 174.19 1wdl s VAL 10 N 0.67 3.63 -0.02 2.29 1.01 -0.06 -3.08 120.40 124.84 1wdl s VAL 10 Ca 0.12 0.28 -0.04 0.00 0.00 0.00 0.00 61.98 62.34 1wdl s VAL 10 Cb -0.21 -4.65 -0.04 0.00 0.00 0.00 0.00 36.38 31.48 1wdl s VAL 10 CO -0.07 -1.59 0.19 -0.89 0.00 0.00 0.00 175.10 172.74 1wdl s THR 11 N 6.68 5.42 0.57 3.92 2.01 -0.56 -2.82 115.64 130.87 1wdl s THR 11 Ca 0.45 -0.04 -0.12 0.00 0.31 0.00 0.00 61.69 62.29 1wdl s THR 11 Cb -0.09 -3.52 -0.05 0.00 0.01 0.00 0.00 72.50 68.85 1wdl s THR 11 CO 0.15 0.38 0.98 0.00 -0.69 0.00 0.00 174.62 175.44 1wdl s ALA 12 N -1.28 3.13 0.00 7.40 0.00 -1.26 0.14 121.76 129.89 1wdl s ALA 12 Ca 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1wdl s ALA 12 Cb -0.13 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 19.97 1wdl s ALA 12 CO 0.16 -0.53 0.00 1.28 0.00 0.00 0.00 175.76 176.67 1wdl n LEU 13 N -2.38 0.00 -4.83 0.00 4.77 0.67 -4.76 117.00 110.48 1wdl n LEU 13 Ca 0.05 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.73 1wdl n LEU 13 Cb 0.54 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.69 1wdl n LEU 13 CO 0.54 0.00 0.72 -1.83 -1.33 0.00 0.00 177.39 175.50 1wdl s GLU 14 N 0.78 2.62 -1.22 3.23 -1.05 -1.26 -4.08 118.70 117.72 1wdl s GLU 14 Ca 0.00 0.70 -0.12 0.00 -0.15 0.00 0.00 54.97 55.40 1wdl s GLU 14 Cb 0.00 -1.97 0.11 0.00 -0.44 0.00 0.00 34.13 31.82 1wdl s GLU 14 CO 0.00 -1.26 0.44 0.43 0.95 0.00 0.00 175.26 175.82 1wdl n SER 15 N -3.20 -2.65 0.00 0.83 7.64 -1.26 -0.24 113.62 114.74 1wdl n SER 15 Ca 0.07 -0.48 0.00 0.00 1.01 0.00 0.00 58.87 59.47 1wdl n SER 15 Cb 0.55 -2.25 0.00 0.00 -1.01 0.00 0.00 64.21 61.50 1wdl n SER 15 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wdl n GLY 16 N -1.02 1.08 3.75 0.23 0.00 -1.26 -4.56 105.19 103.41 1wdl n GLY 16 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1wdl n GLY 16 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wdl s ILE 17 N -2.96 3.47 0.05 -0.61 1.01 0.67 -0.27 121.20 122.55 1wdl s ILE 17 Ca 0.00 1.35 0.09 0.00 0.00 0.00 0.00 60.65 62.09 1wdl s ILE 17 Cb 0.00 -3.86 -0.03 0.00 0.01 0.00 0.00 42.46 38.58 1wdl s ILE 17 CO 0.00 0.27 -0.24 0.54 0.00 0.00 0.00 174.94 175.50 1wdl s VAL 18 N -0.60 2.31 -0.34 2.92 0.11 0.41 -0.23 120.40 124.97 1wdl s VAL 18 Ca 0.49 -1.37 -0.04 0.00 -2.93 0.00 0.00 61.98 58.13 1wdl s VAL 18 Cb -0.33 -1.93 0.06 0.00 -1.53 0.00 0.00 36.38 32.65 1wdl s VAL 18 CO 0.40 0.34 0.09 -0.70 -3.33 0.00 0.00 175.10 171.89 1wdl s GLU 19 N -1.36 2.39 -0.43 1.54 2.12 0.12 -0.29 118.70 122.78 1wdl s GLU 19 Ca 0.13 -1.38 -0.26 0.00 0.36 0.00 0.00 54.97 53.82 1wdl s GLU 19 Cb -0.10 -3.37 0.02 0.00 0.26 0.00 0.00 34.13 30.94 1wdl s GLU 19 CO 0.03 -0.75 0.93 -1.17 -0.54 0.00 0.00 175.26 173.76 1wdl s LEU 20 N 1.27 3.99 -0.10 2.70 0.20 0.15 -1.49 118.68 125.40 1wdl s LEU 20 Ca -0.01 0.26 -0.03 0.00 0.69 0.00 0.00 54.13 55.05 1wdl s LEU 20 Cb -0.21 -3.22 -0.03 0.00 -0.43 0.00 0.00 46.19 42.30 1wdl s LEU 20 CO -0.01 -1.00 0.01 -0.75 -0.29 0.00 0.00 176.35 174.32 1wdl s LYS 21 N 3.68 3.10 -0.39 1.98 2.20 -1.18 -1.76 119.74 127.38 1wdl s LYS 21 Ca 0.38 -0.38 -0.13 0.00 -0.36 0.00 0.00 55.97 55.47 1wdl s LYS 21 Cb -0.11 -2.85 0.02 0.00 -1.51 0.00 0.00 37.83 33.38 1wdl s LYS 21 CO 0.24 0.67 0.26 -0.06 -0.36 0.00 0.00 175.35 176.11 1wdl s PHE 22 N -0.78 3.24 -0.40 4.03 0.08 -0.35 -2.11 117.98 121.69 1wdl s PHE 22 Ca 0.12 -0.66 0.04 0.00 0.12 0.00 0.00 56.93 56.55 1wdl s PHE 22 Cb -0.12 -2.53 0.16 0.00 -0.57 0.00 0.00 43.02 39.97 1wdl s PHE 22 CO 0.02 -0.58 0.43 0.34 -0.10 0.00 0.00 175.22 175.33 1wdl s ASP 23 N 1.65 0.69 -0.88 1.36 3.68 0.95 -1.75 116.67 122.37 1wdl s ASP 23 Ca 0.04 -1.72 -0.25 0.00 2.13 0.00 0.00 52.55 52.75 1wdl s ASP 23 Cb -0.19 0.70 -0.10 0.00 -1.45 0.00 0.00 42.92 41.89 1wdl s ASP 23 CO 0.09 -0.22 2.15 -0.22 0.13 0.00 0.00 175.17 177.10 1wdl s LEU 24 N 1.23 2.98 -0.00 -1.34 2.96 -1.24 -4.23 118.68 119.04 1wdl s LEU 24 Ca 0.20 -0.46 -0.36 0.00 -0.22 0.00 0.00 54.13 53.30 1wdl s LEU 24 Cb -0.11 -2.56 -0.14 0.00 0.50 0.00 0.00 46.19 43.88 1wdl s LEU 24 CO -0.05 -3.36 1.61 0.29 -1.32 0.00 0.00 176.35 173.52 1wdl n LYS 25 N 8.76 1.69 0.00 1.98 4.76 -0.60 -1.88 118.16 132.88 1wdl n LYS 25 Ca 0.43 0.61 0.00 0.00 -2.87 0.00 0.00 58.31 56.49 1wdl n LYS 25 Cb 0.45 -2.35 0.00 0.00 -1.84 0.00 0.00 35.03 31.29 1wdl n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wdl n GLY 26 N 3.55 3.10 3.97 0.72 0.00 -1.26 -4.96 105.19 110.30 1wdl n GLY 26 Ca 0.20 -0.94 -0.22 0.00 0.00 0.00 0.00 46.02 45.07 1wdl n GLY 26 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wdl s GLU 27 N 0.00 2.60 -0.00 1.61 0.41 -0.79 -5.03 118.70 117.49 1wdl s GLU 27 Ca 0.00 -0.68 0.11 0.00 -0.41 0.00 0.00 54.97 53.99 1wdl s GLU 27 Cb 0.00 -2.47 -0.23 0.00 -1.78 0.00 0.00 34.13 29.66 1wdl s GLU 27 CO 0.00 -0.69 0.81 0.66 -0.49 0.00 0.00 175.26 175.55 1wdl h SER 28 N 0.06 0.00 -2.94 -0.19 4.64 -1.97 -3.46 113.55 109.69 1wdl h SER 28 Ca -0.43 -0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.39 1wdl h SER 28 Cb 1.29 -0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.24 1wdl h SER 28 CO 0.54 1.00 -0.64 0.68 -0.87 0.00 0.00 176.83 177.54 1wdl s VAL 29 N -2.62 1.48 -0.16 0.95 -7.23 -1.26 -4.79 120.40 106.77 1wdl s VAL 29 Ca -0.03 -2.06 -0.07 0.00 -1.81 0.00 0.00 61.98 58.01 1wdl s VAL 29 Cb 0.08 -2.65 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 1wdl s VAL 29 CO 0.82 -0.15 0.08 0.20 -0.31 0.00 0.00 175.10 175.75 1wdl s ASN 30 N -3.49 5.87 -0.02 4.85 0.01 -1.26 -4.62 114.94 116.28 1wdl s ASN 30 Ca 0.33 0.21 -0.20 0.00 -0.71 0.00 0.00 52.86 52.50 1wdl s ASN 30 Cb 0.07 -1.94 0.04 0.00 0.41 0.00 0.00 41.25 39.82 1wdl s ASN 30 CO 0.14 0.26 0.42 -1.59 -1.51 0.00 0.00 177.10 174.82 1wdl s LYS 31 N -0.16 0.80 -1.36 -0.60 -2.85 -1.26 -1.42 119.74 112.90 1wdl s LYS 31 Ca 0.08 -0.09 -0.16 0.00 -1.00 0.00 0.00 55.97 54.81 1wdl s LYS 31 Cb -0.12 0.36 0.07 0.00 -2.06 0.00 0.00 37.83 36.08 1wdl s LYS 31 CO 0.01 -0.24 1.92 1.19 0.10 0.00 0.00 175.35 178.33 1wdl n PHE 32 N 1.09 4.15 -2.22 1.78 3.01 -1.25 -4.68 117.46 119.34 1wdl n PHE 32 Ca -0.21 -2.92 -0.19 0.00 1.01 0.00 0.00 57.45 55.14 1wdl n PHE 32 Cb 0.57 -2.55 0.11 0.00 -0.01 0.00 0.00 39.48 37.60 1wdl n PHE 32 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 1wdl n ASN 33 N 7.09 0.68 -0.12 4.37 0.23 -1.26 -4.38 115.26 121.87 1wdl n ASN 33 Ca 0.49 -1.68 -0.04 0.00 -0.53 0.00 0.00 54.58 52.81 1wdl n ASN 33 Cb 0.43 -0.59 0.03 0.00 -2.08 0.00 0.00 39.78 37.57 1wdl n ASN 33 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 1wdl h ARG 34 N 0.00 0.19 -0.17 -3.83 9.65 -1.92 -2.24 114.38 116.07 1wdl h ARG 34 Ca -0.28 -0.01 0.02 0.00 -1.10 0.00 0.00 59.98 58.61 1wdl h ARG 34 Cb 0.91 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.43 1wdl h ARG 34 CO 0.25 0.13 0.05 1.25 2.80 0.00 0.00 179.97 184.45 1wdl h LEU 35 N 0.20 0.04 0.14 3.80 5.85 -1.95 -1.88 115.31 121.51 1wdl h LEU 35 Ca 0.20 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1wdl h LEU 35 Cb 0.25 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1wdl h LEU 35 CO -0.27 0.05 -0.13 0.74 -0.34 0.00 0.00 178.44 178.49 1wdl h THR 36 N 0.12 0.71 -0.69 1.05 2.02 -1.77 -0.68 112.91 113.67 1wdl h THR 36 Ca 0.07 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.30 1wdl h THR 36 Cb 0.05 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1wdl h THR 36 CO -0.08 0.00 0.46 -0.07 0.37 0.00 0.00 175.52 176.19 1wdl h LEU 37 N -0.29 0.66 -0.10 2.58 3.38 -1.37 -0.53 115.31 119.63 1wdl h LEU 37 Ca 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1wdl h LEU 37 Cb 0.27 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1wdl h LEU 37 CO -0.03 0.44 0.02 0.78 0.09 0.00 0.00 178.44 179.74 1wdl h ASN 38 N 0.76 0.16 0.40 -0.43 -0.26 -0.76 -2.72 115.58 112.72 1wdl h ASN 38 Ca 0.29 -0.25 -0.07 0.00 -0.56 0.00 0.00 56.30 55.70 1wdl h ASN 38 Cb 0.19 -0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.40 1wdl h ASN 38 CO -0.09 0.37 -0.35 -0.33 -1.06 0.00 0.00 177.43 175.97 1wdl h GLU 39 N -0.06 0.00 -0.51 0.81 5.08 -0.66 -2.37 114.58 116.87 1wdl h GLU 39 Ca 0.03 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1wdl h GLU 39 Cb 0.28 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1wdl h GLU 39 CO 0.00 0.35 0.30 1.25 -1.00 0.00 0.00 179.01 179.91 1wdl h LEU 40 N 0.00 0.62 -0.06 1.33 6.46 -0.96 0.49 115.31 123.19 1wdl h LEU 40 Ca -0.00 -0.07 0.03 0.00 -0.12 0.00 0.00 57.88 57.72 1wdl h LEU 40 Cb 0.64 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.37 1wdl h LEU 40 CO 0.05 0.51 -0.18 -0.09 -0.62 0.00 0.00 178.44 178.10 1wdl h ARG 41 N 0.68 -0.25 -0.16 1.25 9.65 -1.12 0.32 114.38 124.75 1wdl h ARG 41 Ca 0.18 0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 59.04 1wdl h ARG 41 Cb 0.01 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.63 1wdl h ARG 41 CO -0.03 -0.17 -0.07 1.96 2.80 0.00 0.00 179.97 184.46 1wdl h GLN 42 N -0.26 0.24 0.22 0.20 4.20 -1.10 -0.67 115.11 117.92 1wdl h GLN 42 Ca 0.08 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 1wdl h GLN 42 Cb 0.37 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1wdl h GLN 42 CO -0.22 0.32 -0.10 0.00 -0.67 0.00 0.00 178.83 178.16 1wdl h ALA 43 N 1.71 -0.29 -0.52 3.87 0.00 0.13 -1.89 119.26 122.27 1wdl h ALA 43 Ca 0.05 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1wdl h ALA 43 Cb 0.27 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1wdl h ALA 43 CO 0.01 -0.45 0.31 0.28 0.00 0.00 0.00 179.25 179.40 1wdl h VAL 44 N -0.72 1.05 -0.68 0.00 2.07 -0.26 -1.01 116.25 116.71 1wdl h VAL 44 Ca -0.03 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.30 1wdl h VAL 44 Cb 0.49 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.61 1wdl h VAL 44 CO 0.05 0.11 0.45 0.44 0.02 0.00 0.00 177.57 178.64 1wdl h ASP 45 N 0.61 0.73 0.48 0.57 3.32 -1.16 0.39 116.42 121.36 1wdl h ASP 45 Ca 0.21 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 1wdl h ASP 45 Cb 0.02 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.40 1wdl h ASP 45 CO -0.10 0.52 -0.23 0.00 -1.72 0.00 0.00 179.24 177.71 1wdl h ALA 46 N 1.59 -0.64 -0.28 3.45 0.00 -0.47 0.24 119.26 123.16 1wdl h ALA 46 Ca 0.26 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1wdl h ALA 46 Cb -0.01 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 1wdl h ALA 46 CO -0.07 -0.71 -0.03 0.82 0.00 0.00 0.00 179.25 179.26 1wdl h ILE 47 N -0.94 0.76 -0.32 0.00 2.04 -0.94 0.44 117.51 118.56 1wdl h ILE 47 Ca -0.07 -0.02 0.06 0.00 1.00 0.00 0.00 64.86 65.84 1wdl h ILE 47 Cb 0.59 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.32 1wdl h ILE 47 CO 0.11 0.01 -0.06 0.50 0.00 0.00 0.00 178.15 178.71 1wdl h LYS 48 N 0.05 0.02 -0.56 2.37 3.64 -0.22 -2.18 116.57 119.70 1wdl h LYS 48 Ca 0.14 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 1wdl h LYS 48 Cb 0.19 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1wdl h LYS 48 CO -0.25 0.01 0.10 0.00 -2.27 0.00 0.00 179.45 177.04 1wdl h ALA 49 N 1.31 1.14 -2.02 5.00 0.00 -0.37 -3.41 119.26 120.91 1wdl h ALA 49 Ca 0.15 -0.23 -0.57 0.00 0.00 0.00 0.00 54.91 54.27 1wdl h ALA 49 Cb 0.23 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1wdl h ALA 49 CO -0.31 0.57 1.11 0.34 0.00 0.00 0.00 179.25 180.96 1wdl s ASP 50 N -6.57 6.41 0.00 0.00 3.68 0.09 -4.88 116.67 115.40 1wdl s ASP 50 Ca -0.10 1.54 0.29 0.00 2.13 0.00 0.00 52.55 56.40 1wdl s ASP 50 Cb 0.15 -2.53 1.20 0.00 -1.45 0.00 0.00 42.92 40.29 1wdl s ASP 50 CO 0.81 -1.25 1.83 0.00 0.13 0.00 0.00 175.17 176.70 1wdl n ALA 51 N 8.38 2.74 0.25 3.66 0.00 -1.26 -3.79 120.51 130.49 1wdl n ALA 51 Ca 0.18 -0.34 0.12 0.00 0.00 0.00 0.00 53.44 53.40 1wdl n ALA 51 Cb 0.45 -1.27 0.08 0.00 0.00 0.00 0.00 19.45 18.71 1wdl n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1wdl h SER 52 N 1.21 0.00 -3.41 0.00 4.64 -1.92 -3.47 113.55 110.61 1wdl h SER 52 Ca 0.00 -0.05 -0.54 0.00 -0.47 0.00 0.00 61.79 60.73 1wdl h SER 52 Cb 0.37 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.56 1wdl h SER 52 CO 0.00 0.03 0.83 0.52 -0.87 0.00 0.00 176.83 177.34 1wdl n VAL 53 N -2.59 1.29 -0.40 0.95 0.31 -1.25 -4.72 118.33 111.92 1wdl n VAL 53 Ca 0.02 -0.32 0.03 0.00 -0.01 0.00 0.00 64.34 64.05 1wdl n VAL 53 Cb 0.52 -1.94 0.04 0.00 -0.91 0.00 0.00 33.84 31.55 1wdl n VAL 53 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1wdl n LYS 54 N 1.67 2.27 0.00 5.55 4.76 0.63 -4.98 118.16 128.06 1wdl n LYS 54 Ca 0.07 -1.71 0.00 0.00 -2.87 0.00 0.00 58.31 53.80 1wdl n LYS 54 Cb 0.37 -1.09 0.00 0.00 -1.84 0.00 0.00 35.03 32.47 1wdl n LYS 54 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wdl n GLY 55 N -0.70 2.72 2.85 0.72 0.00 -1.25 -4.59 105.19 104.94 1wdl n GLY 55 Ca 0.04 -0.75 -0.21 0.00 0.00 0.00 0.00 46.02 45.11 1wdl n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wdl s VAL 56 N -2.00 0.47 -0.13 1.61 1.01 0.55 -0.45 120.40 121.45 1wdl s VAL 56 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 61.98 61.93 1wdl s VAL 56 Cb 0.00 -0.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.83 1wdl s VAL 56 CO 0.00 0.23 -0.11 -0.63 0.00 0.00 0.00 175.10 174.59 1wdl s ILE 57 N 1.23 3.27 -0.20 2.22 1.01 0.60 -1.34 121.20 127.98 1wdl s ILE 57 Ca -0.06 -0.58 -0.07 0.00 0.00 0.00 0.00 60.65 59.93 1wdl s ILE 57 Cb -0.14 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 1wdl s ILE 57 CO -0.02 0.52 0.06 -0.69 0.00 0.00 0.00 174.94 174.81 1wdl s VAL 58 N 0.31 4.57 0.12 2.92 1.01 0.51 0.29 120.40 130.12 1wdl s VAL 58 Ca -0.09 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 61.81 1wdl s VAL 58 Cb -0.15 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 1wdl s VAL 58 CO 0.05 0.42 0.09 -1.54 0.00 0.00 0.00 175.10 174.12 1wdl n SER 59 N 3.97 0.05 -3.84 3.32 3.41 -0.72 -0.84 113.62 118.98 1wdl n SER 59 Ca -0.16 -1.75 -0.12 0.00 -0.26 0.00 0.00 58.87 56.58 1wdl n SER 59 Cb 0.52 0.52 -0.12 0.00 -0.26 0.00 0.00 64.21 64.87 1wdl n SER 59 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wdl s SER 60 N -1.81 -0.10 -0.32 4.04 0.15 -1.26 -1.21 113.70 113.19 1wdl s SER 60 Ca 0.12 0.15 0.10 0.00 0.70 0.00 0.00 55.95 57.02 1wdl s SER 60 Cb 0.01 0.27 0.76 0.00 -1.71 0.00 0.00 66.02 65.35 1wdl s SER 60 CO 0.09 -0.14 1.82 0.61 1.20 0.00 0.00 173.24 176.82 1wdl n GLY 61 N 2.58 3.60 2.67 9.45 0.00 -0.71 -4.91 105.19 117.87 1wdl n GLY 61 Ca -0.15 -0.99 -0.23 0.00 0.00 0.00 0.00 46.02 44.65 1wdl n GLY 61 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1wdl n LYS 62 N -0.09 0.97 0.14 1.61 0.00 -1.26 -5.01 118.16 114.51 1wdl n LYS 62 Ca 0.41 -2.73 0.01 0.00 -0.00 0.00 0.00 58.31 56.00 1wdl n LYS 62 Cb 1.39 0.93 0.13 0.00 -0.00 0.00 0.00 35.03 37.48 1wdl n LYS 62 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1wdl h ASP 63 N 1.00 0.00 -2.06 -5.58 3.32 -1.92 -3.45 116.42 107.73 1wdl h ASP 63 Ca -0.30 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.21 1wdl h ASP 63 Cb 0.95 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.42 1wdl h ASP 63 CO 0.48 0.57 -0.58 0.68 -1.72 0.00 0.00 179.24 178.67 1wdl s VAL 64 N -3.23 3.44 0.00 -1.35 -7.23 -1.26 -4.08 120.40 106.69 1wdl s VAL 64 Ca 0.01 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 58.45 1wdl s VAL 64 Cb 0.10 -2.99 0.00 0.00 0.56 0.00 0.00 36.38 34.05 1wdl s VAL 64 CO 0.74 -0.29 0.04 0.33 -0.31 0.00 0.00 175.10 175.61 1wdl n PHE 65 N -1.05 0.00 -3.46 2.82 7.35 0.55 -4.68 117.46 118.99 1wdl n PHE 65 Ca -0.05 0.00 -0.17 0.00 -0.76 0.00 0.00 57.45 56.47 1wdl n PHE 65 Cb 0.60 0.00 -0.12 0.00 0.35 0.00 0.00 39.48 40.31 1wdl n PHE 65 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1wdl s ILE 66 N -0.08 -0.37 1.22 -2.13 1.01 -0.60 -4.49 121.20 115.76 1wdl s ILE 66 Ca 0.00 -0.15 -0.20 0.00 0.00 0.00 0.00 60.65 60.29 1wdl s ILE 66 Cb 0.00 -0.73 0.30 0.00 0.01 0.00 0.00 42.46 42.04 1wdl s ILE 66 CO 0.00 -0.23 1.14 0.68 0.00 0.00 0.00 174.94 176.53 1wdl s VAL 67 N 2.36 1.56 0.00 2.92 -7.23 -0.51 -2.55 120.40 116.95 1wdl s VAL 67 Ca 0.08 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.25 1wdl s VAL 67 Cb -0.16 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 34.25 1wdl s VAL 67 CO -0.15 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.25 1wdl n GLY 68 N -1.21 -1.67 3.80 2.32 0.00 -1.17 -3.94 105.19 103.32 1wdl n GLY 68 Ca 0.15 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.30 1wdl n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdl s ALA 69 N -2.18 3.64 -0.87 4.61 0.00 -1.26 -3.96 121.76 121.74 1wdl s ALA 69 Ca 0.00 -0.92 -0.20 0.00 0.00 0.00 0.00 51.96 50.85 1wdl s ALA 69 Cb 0.00 -1.57 0.12 0.00 0.00 0.00 0.00 23.12 21.67 1wdl s ALA 69 CO 0.00 0.73 1.09 0.34 0.00 0.00 0.00 175.76 177.92 1wdl s ASP 70 N -2.07 6.52 0.43 0.00 -1.08 -1.26 -4.87 116.67 114.33 1wdl s ASP 70 Ca 0.27 -1.80 0.29 0.00 -0.52 0.00 0.00 52.55 50.79 1wdl s ASP 70 Cb -0.12 -2.41 1.54 0.00 -1.46 0.00 0.00 42.92 40.48 1wdl s ASP 70 CO 0.19 -1.15 1.89 -0.29 0.52 0.00 0.00 175.17 176.32 1wdl h ILE 71 N 5.90 0.00 -0.87 4.11 2.10 -1.95 -3.25 117.51 123.54 1wdl h ILE 71 Ca 0.06 -0.03 0.23 0.00 1.08 0.00 0.00 64.86 66.20 1wdl h ILE 71 Cb 1.03 0.69 -0.05 0.00 -1.09 0.00 0.00 36.82 37.41 1wdl h ILE 71 CO 1.13 0.00 0.61 0.71 -1.08 0.00 0.00 178.15 179.52 1wdl h THR 72 N 0.00 0.61 0.00 2.19 1.35 -2.00 0.18 112.91 115.25 1wdl h THR 72 Ca 0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 1wdl h THR 72 Cb 0.04 0.44 0.00 0.00 -1.73 0.00 0.00 68.15 66.90 1wdl h THR 72 CO 0.00 0.03 -0.20 -0.33 -0.25 0.00 0.00 175.52 174.77 1wdl h GLU 73 N 0.16 0.00 0.00 4.72 5.08 -2.00 -3.28 114.58 119.26 1wdl h GLU 73 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1wdl h GLU 73 Cb 1.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.70 1wdl h GLU 73 CO -0.08 0.00 -0.82 0.34 -1.00 0.00 0.00 179.01 177.45 1wdl n PHE 74 N -2.56 0.22 -0.20 4.33 7.35 0.61 -4.38 117.46 122.84 1wdl n PHE 74 Ca 0.04 0.06 -0.02 0.00 -0.76 0.00 0.00 57.45 56.77 1wdl n PHE 74 Cb 0.48 -0.38 0.08 0.00 0.35 0.00 0.00 39.48 40.00 1wdl n PHE 74 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1wdl h VAL 75 N 0.00 0.91 0.00 -2.13 2.07 -1.52 -1.26 116.25 114.32 1wdl h VAL 75 Ca 0.00 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1wdl h VAL 75 Cb 0.65 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1wdl h VAL 75 CO 0.00 0.10 0.00 -0.33 0.02 0.00 0.00 177.57 177.36 1wdl h GLU 76 N 0.53 0.00 -0.33 1.57 5.08 -1.81 -2.16 114.58 117.47 1wdl h GLU 76 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1wdl h GLU 76 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1wdl h GLU 76 CO -0.20 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 177.90 1wdl n ASN 77 N -2.66 2.63 -0.00 1.42 4.13 -0.48 -4.10 115.26 116.20 1wdl n ASN 77 Ca -0.00 -1.89 0.04 0.00 1.68 0.00 0.00 54.58 54.41 1wdl n ASN 77 Cb 0.17 -0.21 -0.05 0.00 -1.54 0.00 0.00 39.78 38.14 1wdl n ASN 77 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1wdl n PHE 78 N 0.95 0.00 1.54 3.10 3.01 -0.81 -4.52 117.46 120.72 1wdl n PHE 78 Ca 0.18 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.77 1wdl n PHE 78 Cb 0.47 -0.02 0.56 0.00 -0.01 0.00 0.00 39.48 40.47 1wdl n PHE 78 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1wdl n LYS 79 N -1.27 1.54 -2.33 -1.08 2.85 -1.24 -4.30 118.16 112.31 1wdl n LYS 79 Ca 0.01 -0.79 -0.26 0.00 -1.05 0.00 0.00 58.31 56.22 1wdl n LYS 79 Cb 0.15 -1.45 0.15 0.00 -0.65 0.00 0.00 35.03 33.23 1wdl n LYS 79 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1wdl s LEU 80 N -1.87 2.86 0.80 -5.58 1.43 -1.26 -4.79 118.68 110.27 1wdl s LEU 80 Ca 0.38 -0.20 -0.12 0.00 -1.03 0.00 0.00 54.13 53.15 1wdl s LEU 80 Cb 0.20 -1.94 0.08 0.00 0.03 0.00 0.00 46.19 44.56 1wdl s LEU 80 CO 0.32 -2.34 1.16 -2.84 0.23 0.00 0.00 176.35 172.88 1wdl s PRO 81 N -5.49 1.76 0.64 1.29 0.02 -1.26 -4.77 135.00 127.19 1wdl s PRO 81 Ca 0.71 1.58 0.37 0.00 0.02 0.00 0.00 61.00 63.68 1wdl s PRO 81 Cb -0.04 -1.81 2.04 0.00 0.02 0.00 0.00 34.50 34.72 1wdl s PRO 81 CO 0.49 -2.08 2.22 -0.44 -0.33 0.00 0.00 177.00 176.85 1wdl h ASP 82 N -0.99 0.00 0.00 2.53 5.19 -1.96 0.00 116.42 121.20 1wdl h ASP 82 Ca -0.45 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 55.96 1wdl h ASP 82 Cb 1.27 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.78 1wdl h ASP 82 CO 0.47 0.00 -0.00 0.00 -3.12 0.00 0.00 179.24 176.59 1wdl h ALA 83 N 1.83 -0.01 0.00 3.45 0.00 -1.99 -0.57 119.26 121.97 1wdl h ALA 83 Ca 0.02 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1wdl h ALA 83 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1wdl h ALA 83 CO -0.00 -0.03 0.00 0.39 0.00 0.00 0.00 179.25 179.61 1wdl n GLU 84 N -4.65 0.74 -0.03 0.00 1.02 -0.57 -1.84 120.64 115.31 1wdl n GLU 84 Ca -0.09 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.00 1wdl n GLU 84 Cb 0.42 -1.01 -0.02 0.00 -0.02 0.00 0.00 31.44 30.81 1wdl n GLU 84 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1wdl n LEU 85 N -0.49 1.18 -0.05 -4.62 7.94 -0.12 -4.24 117.00 116.61 1wdl n LEU 85 Ca 0.00 0.04 -0.11 0.00 -1.11 0.00 0.00 56.01 54.83 1wdl n LEU 85 Cb 0.00 -0.17 -0.05 0.00 0.53 0.00 0.00 43.42 43.73 1wdl n LEU 85 CO 0.00 0.26 0.81 0.40 -1.11 0.00 0.00 177.39 177.75 1wdl h ILE 86 N -0.14 1.19 0.00 1.96 2.04 -1.00 -1.01 117.51 120.55 1wdl h ILE 86 Ca -0.14 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.13 1wdl h ILE 86 Cb 1.14 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.50 1wdl h ILE 86 CO -0.07 0.18 0.00 0.00 0.00 0.00 0.00 178.15 178.27 1wdl h ALA 87 N 0.86 1.00 0.01 1.87 0.00 -1.60 0.98 119.26 122.38 1wdl h ALA 87 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1wdl h ALA 87 Cb 0.24 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1wdl h ALA 87 CO -0.00 0.00 -0.29 0.78 0.00 0.00 0.00 179.25 179.74 1wdl h GLY 88 N 1.62 0.21 2.00 0.00 0.00 -1.41 -2.52 103.07 102.97 1wdl h GLY 88 Ca 0.00 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 46.84 1wdl h GLY 88 CO 0.00 0.33 -0.52 3.43 0.00 0.00 0.00 176.54 179.78 1wdl h ASN 89 N -0.50 0.00 -0.22 0.19 2.35 -0.92 -2.85 115.58 113.63 1wdl h ASN 89 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1wdl h ASN 89 Cb 1.07 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.43 1wdl h ASN 89 CO 0.06 0.52 0.14 0.25 -1.65 0.00 0.00 177.43 176.75 1wdl h LEU 90 N 0.00 0.26 -0.96 1.61 5.85 -0.84 0.83 115.31 122.06 1wdl h LEU 90 Ca -0.01 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 1wdl h LEU 90 Cb 1.15 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 1wdl h LEU 90 CO 0.07 0.20 0.05 -0.08 -0.34 0.00 0.00 178.44 178.35 1wdl h GLU 91 N 0.29 0.81 -0.60 1.25 4.81 -1.36 -1.66 114.58 118.11 1wdl h GLU 91 Ca 0.08 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 59.04 1wdl h GLU 91 Cb -0.01 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 1wdl h GLU 91 CO -0.02 0.78 0.06 0.00 -0.73 0.00 0.00 179.01 179.10 1wdl h ALA 92 N 1.29 0.97 0.00 2.92 0.00 -1.19 -2.16 119.26 121.09 1wdl h ALA 92 Ca 0.16 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1wdl h ALA 92 Cb 0.39 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1wdl h ALA 92 CO 0.01 0.64 -0.02 -0.91 0.00 0.00 0.00 179.25 178.97 1wdl h ASN 93 N 0.93 0.00 -0.10 0.00 2.35 -0.31 -2.86 115.58 115.60 1wdl h ASN 93 Ca 0.18 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1wdl h ASN 93 Cb 0.46 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1wdl h ASN 93 CO 0.02 0.02 0.06 0.11 -1.65 0.00 0.00 177.43 175.98 1wdl h LYS 94 N 0.00 0.14 0.41 0.81 1.57 -0.62 0.92 116.57 119.80 1wdl h LYS 94 Ca -0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1wdl h LYS 94 Cb 0.55 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1wdl h LYS 94 CO 0.00 0.11 -0.20 0.82 -0.57 0.00 0.00 179.45 179.62 1wdl h ILE 95 N 0.15 0.00 -0.93 1.86 2.04 -1.60 -0.06 117.51 118.97 1wdl h ILE 95 Ca 0.04 -0.07 0.08 0.00 1.00 0.00 0.00 64.86 65.91 1wdl h ILE 95 Cb 0.01 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.02 1wdl h ILE 95 CO -0.01 0.00 0.60 -0.26 0.00 0.00 0.00 178.15 178.48 1wdl h PHE 96 N -0.63 1.05 -0.78 1.37 -1.00 -1.67 -0.10 116.94 115.18 1wdl h PHE 96 Ca -0.06 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.75 1wdl h PHE 96 Cb 0.42 -0.34 -0.04 0.00 3.61 0.00 0.00 35.95 39.61 1wdl h PHE 96 CO 0.10 0.51 0.49 0.77 -1.61 0.00 0.00 178.31 178.57 1wdl h SER 97 N 0.99 0.91 -0.43 2.17 0.02 -0.79 -0.09 113.55 116.34 1wdl h SER 97 Ca 0.42 -0.04 -0.10 0.00 -0.84 0.00 0.00 61.79 61.23 1wdl h SER 97 Cb 0.31 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1wdl h SER 97 CO -0.18 0.68 -0.12 0.44 -1.14 0.00 0.00 176.83 176.51 1wdl h ASP 98 N 1.06 0.85 -0.55 3.07 3.32 0.39 -1.34 116.42 123.22 1wdl h ASP 98 Ca 0.28 -0.37 0.03 0.00 0.02 0.00 0.00 57.03 56.99 1wdl h ASP 98 Cb -0.08 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.20 1wdl h ASP 98 CO -0.06 1.03 0.37 0.15 -1.72 0.00 0.00 179.24 179.01 1wdl h PHE 99 N 0.67 0.62 0.00 4.55 3.04 -0.58 0.22 116.94 125.46 1wdl h PHE 99 Ca 0.11 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.06 1wdl h PHE 99 Cb 0.66 -0.21 -0.00 0.00 2.56 0.00 0.00 35.95 38.96 1wdl h PHE 99 CO 0.05 0.37 -0.07 1.49 -2.02 0.00 0.00 178.31 178.13 1wdl h GLU 100 N 0.65 0.00 -0.25 1.11 4.81 -0.56 -2.99 114.58 117.36 1wdl h GLU 100 Ca 0.22 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1wdl h GLU 100 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1wdl h GLU 100 CO -0.06 0.07 0.00 -0.25 -0.73 0.00 0.00 179.01 178.04 1wdl n ASP 101 N -3.15 2.59 -4.68 1.04 8.00 0.69 -4.94 116.55 116.10 1wdl n ASP 101 Ca 0.02 -1.86 -0.43 0.00 0.71 0.00 0.00 54.79 53.23 1wdl n ASP 101 Cb 0.44 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.35 1wdl n ASP 101 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1wdl n LEU 102 N 0.94 3.91 -2.87 0.64 4.32 -0.71 -4.81 117.00 118.43 1wdl n LEU 102 Ca 0.17 0.98 -0.20 0.00 -0.02 0.00 0.00 56.01 56.94 1wdl n LEU 102 Cb 0.48 -1.51 -0.05 0.00 -1.62 0.00 0.00 43.42 40.72 1wdl n LEU 102 CO 0.15 0.11 2.19 -3.20 -1.22 0.00 0.00 177.39 175.42 1wdl n ASN 103 N 5.85 5.17 -3.56 -1.43 5.15 -1.26 -4.69 115.26 120.49 1wdl n ASN 103 Ca 0.19 -2.31 -0.09 0.00 -0.60 0.00 0.00 54.58 51.76 1wdl n ASN 103 Cb 0.36 -1.14 -0.04 0.00 -0.53 0.00 0.00 39.78 38.44 1wdl n ASN 103 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1wdl s VAL 104 N 2.61 0.00 0.39 3.44 0.11 -1.26 -5.01 120.40 120.67 1wdl s VAL 104 Ca 0.47 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 59.25 1wdl s VAL 104 Cb 0.15 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.91 1wdl s VAL 104 CO -0.03 0.00 1.34 -2.84 -3.33 0.00 0.00 175.10 170.24 1wdl s PRO 105 N -1.83 4.05 -0.03 1.54 0.02 -1.26 -4.83 135.00 132.65 1wdl s PRO 105 Ca 0.01 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.29 1wdl s PRO 105 Cb -0.01 -2.85 0.03 0.00 0.02 0.00 0.00 34.50 31.69 1wdl s PRO 105 CO -0.02 -0.46 0.01 0.95 -0.33 0.00 0.00 177.00 177.15 1wdl s THR 106 N -1.21 0.16 0.06 0.99 -4.23 -1.26 -0.33 115.64 109.83 1wdl s THR 106 Ca 0.55 0.11 0.08 0.00 -1.18 0.00 0.00 61.69 61.25 1wdl s THR 106 Cb -0.40 -0.28 -0.03 0.00 1.34 0.00 0.00 72.50 73.13 1wdl s THR 106 CO 0.53 0.15 -0.22 -0.69 -0.54 0.00 0.00 174.62 173.85 1wdl s VAL 107 N 1.16 1.74 -0.36 2.29 1.01 -0.45 -1.01 120.40 124.78 1wdl s VAL 107 Ca -0.08 -1.30 -0.04 0.00 0.00 0.00 0.00 61.98 60.56 1wdl s VAL 107 Cb -0.13 -1.53 0.07 0.00 0.00 0.00 0.00 36.38 34.79 1wdl s VAL 107 CO -0.02 0.17 0.13 0.00 0.00 0.00 0.00 175.10 175.37 1wdl s ALA 108 N -0.88 3.04 -1.07 5.51 0.00 0.15 -0.36 121.76 128.15 1wdl s ALA 108 Ca 0.08 -2.10 -0.20 0.00 0.00 0.00 0.00 51.96 49.74 1wdl s ALA 108 Cb -0.09 -2.26 0.09 0.00 0.00 0.00 0.00 23.12 20.86 1wdl s ALA 108 CO 0.02 -1.53 1.40 0.00 0.00 0.00 0.00 175.76 175.65 1wdl s ALA 109 N 1.26 3.18 -0.32 0.00 0.00 -0.02 -0.95 121.76 124.92 1wdl s ALA 109 Ca 0.02 -2.67 -0.29 0.00 0.00 0.00 0.00 51.96 49.01 1wdl s ALA 109 Cb -0.21 -4.36 -0.01 0.00 0.00 0.00 0.00 23.12 18.55 1wdl s ALA 109 CO -0.01 -3.26 1.51 0.42 0.00 0.00 0.00 175.76 174.42 1wdl s ILE 110 N 3.72 3.82 -0.09 0.00 1.01 0.84 -4.62 121.20 125.88 1wdl s ILE 110 Ca 0.43 0.88 0.02 0.00 0.00 0.00 0.00 60.65 61.98 1wdl s ILE 110 Cb -0.01 -3.96 -0.25 0.00 0.01 0.00 0.00 42.46 38.25 1wdl s ILE 110 CO -0.05 -0.51 0.46 -0.46 0.00 0.00 0.00 174.94 174.38 1wdl n ASN 111 N 8.72 1.57 0.00 3.58 6.94 -1.26 -1.82 115.26 132.99 1wdl n ASN 111 Ca 0.18 0.28 0.00 0.00 -0.02 0.00 0.00 54.58 55.02 1wdl n ASN 111 Cb 0.47 -0.48 0.00 0.00 -2.36 0.00 0.00 39.78 37.40 1wdl n ASN 111 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1wdl n GLY 112 N 1.82 4.34 3.61 4.83 0.00 -1.26 -4.60 105.19 113.93 1wdl n GLY 112 Ca -0.26 -0.85 -0.60 0.00 0.00 0.00 0.00 46.02 44.30 1wdl n GLY 112 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wdl n ILE 113 N 0.00 0.03 -3.30 -0.61 2.08 -1.26 -3.74 119.36 112.57 1wdl n ILE 113 Ca 0.00 -0.01 -0.25 0.00 0.56 0.00 0.00 62.75 63.05 1wdl n ILE 113 Cb 0.00 -0.41 -0.08 0.00 -0.75 0.00 0.00 39.64 38.40 1wdl n ILE 113 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1wdl n ALA 114 N 2.80 2.72 -2.92 -1.39 0.00 -0.77 -0.33 120.51 120.62 1wdl n ALA 114 Ca 0.24 -3.42 -0.23 0.00 0.00 0.00 0.00 53.44 50.03 1wdl n ALA 114 Cb 0.06 -0.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.69 1wdl n ALA 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wdl s LEU 115 N -0.84 4.28 0.00 0.00 1.43 -1.06 -3.06 118.68 119.44 1wdl s LEU 115 Ca 0.34 0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 1wdl s LEU 115 Cb 0.12 -2.94 0.00 0.00 0.03 0.00 0.00 46.19 43.40 1wdl s LEU 115 CO -0.14 -0.07 0.00 0.61 0.23 0.00 0.00 176.35 176.98 1wdl n GLY 116 N -1.24 3.11 0.33 -3.19 0.00 -0.64 -0.07 105.19 103.48 1wdl n GLY 116 Ca -0.08 0.11 0.21 0.00 0.00 0.00 0.00 46.02 46.26 1wdl n GLY 116 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wdl h GLY 117 N 0.00 0.00 1.16 -0.02 0.00 -1.86 -1.74 103.07 100.61 1wdl h GLY 117 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1wdl h GLY 117 CO 0.00 0.00 0.24 -1.33 0.00 0.00 0.00 176.54 175.45 1wdl h GLY 118 N 0.00 1.14 1.37 4.60 0.00 -0.55 -2.36 103.07 107.27 1wdl h GLY 118 Ca 0.00 -0.64 -0.29 0.00 0.00 0.00 0.00 47.33 46.41 1wdl h GLY 118 CO -0.00 0.60 -1.21 -2.00 0.00 0.00 0.00 176.54 173.92 1wdl h LEU 119 N 1.03 0.73 -1.97 3.11 6.46 -1.33 -3.22 115.31 120.12 1wdl h LEU 119 Ca 0.23 -0.69 0.13 0.00 -0.12 0.00 0.00 57.88 57.43 1wdl h LEU 119 Cb 0.26 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 39.93 1wdl h LEU 119 CO -0.01 1.51 0.33 -0.33 -0.62 0.00 0.00 178.44 179.32 1wdl h GLU 120 N 0.22 0.03 -0.29 1.25 5.08 -1.25 0.32 114.58 119.95 1wdl h GLU 120 Ca -0.17 -0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.02 1wdl h GLU 120 Cb 1.89 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 31.13 1wdl h GLU 120 CO 0.22 0.02 -0.51 1.98 -1.00 0.00 0.00 179.01 179.72 1wdl h MET 121 N 0.03 0.83 -0.30 2.33 4.05 -1.44 -2.99 114.93 117.43 1wdl h MET 121 Ca 0.22 -0.50 -0.06 0.00 -0.28 0.00 0.00 59.70 59.07 1wdl h MET 121 Cb 0.85 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.69 1wdl h MET 121 CO -0.01 1.14 -0.06 0.00 0.23 0.00 0.00 176.91 178.20 1wdl h LEU 123 N 0.35 0.00 -0.31 0.00 3.38 -0.78 -1.48 115.31 116.47 1wdl h LEU 123 Ca 0.08 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.85 1wdl h LEU 123 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1wdl h LEU 123 CO 0.03 0.00 -0.68 0.00 0.09 0.00 0.00 178.44 177.88 1wdl h ALA 124 N 1.89 0.48 -2.32 1.53 0.00 -1.33 -3.46 119.26 116.05 1wdl h ALA 124 Ca 0.01 -0.57 -0.46 0.00 0.00 0.00 0.00 54.91 53.89 1wdl h ALA 124 Cb 0.14 -0.05 0.16 0.00 0.00 0.00 0.00 17.79 18.04 1wdl h ALA 124 CO -0.00 0.70 0.18 0.00 0.00 0.00 0.00 179.25 180.13 1wdl s ALA 125 N -3.85 0.92 -0.09 0.00 0.00 -0.56 -4.37 121.76 113.81 1wdl s ALA 125 Ca -0.09 -0.22 -0.16 0.00 0.00 0.00 0.00 51.96 51.50 1wdl s ALA 125 Cb 0.10 -3.17 -0.13 0.00 0.00 0.00 0.00 23.12 19.92 1wdl s ALA 125 CO 0.88 -2.85 0.53 -0.44 0.00 0.00 0.00 175.76 173.87 1wdl h ASP 126 N -1.91 -0.08 -2.43 0.00 3.32 -1.36 -3.47 116.42 110.49 1wdl h ASP 126 Ca -0.54 -0.40 -0.57 0.00 0.02 0.00 0.00 57.03 55.54 1wdl h ASP 126 Cb 1.32 0.02 -0.10 0.00 0.22 0.00 0.00 39.33 40.79 1wdl h ASP 126 CO 0.55 0.57 -0.65 -0.36 -1.72 0.00 0.00 179.24 177.64 1wdl s PHE 127 N -2.43 2.75 -0.08 4.55 0.40 -0.55 -4.86 117.98 117.77 1wdl s PHE 127 Ca -0.10 -0.20 -0.03 0.00 -0.60 0.00 0.00 56.93 56.01 1wdl s PHE 127 Cb -0.01 -1.25 0.04 0.00 0.51 0.00 0.00 43.02 42.31 1wdl s PHE 127 CO 0.36 0.58 0.11 1.03 0.70 0.00 0.00 175.22 178.00 1wdl s ARG 128 N -3.44 -0.01 -0.03 0.44 0.52 -1.26 -0.67 118.95 114.50 1wdl s ARG 128 Ca 0.30 0.42 -0.02 0.00 -0.52 0.00 0.00 55.73 55.90 1wdl s ARG 128 Cb -0.07 -0.55 -0.04 0.00 0.52 0.00 0.00 34.95 34.81 1wdl s ARG 128 CO 0.19 -0.36 0.12 0.08 0.02 0.00 0.00 175.30 175.36 1wdl s VAL 129 N 2.23 5.08 0.00 3.52 1.01 -0.12 -1.28 120.40 130.84 1wdl s VAL 129 Ca 0.04 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1wdl s VAL 129 Cb -0.12 -3.32 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 1wdl s VAL 129 CO -0.05 0.39 -0.03 -0.32 0.00 0.00 0.00 175.10 175.09 1wdl s MET 130 N -1.67 0.24 0.10 2.72 0.00 0.40 -0.11 119.30 120.98 1wdl s MET 130 Ca 0.23 -0.21 -0.30 0.00 0.00 0.00 0.00 55.69 55.41 1wdl s MET 130 Cb -0.12 -0.17 -0.05 0.00 0.00 0.00 0.00 34.83 34.49 1wdl s MET 130 CO 0.14 0.04 0.96 0.00 0.00 0.00 0.00 175.02 176.16 1wdl s ALA 131 N -0.34 3.24 0.65 4.11 0.00 -0.75 -0.99 121.76 127.67 1wdl s ALA 131 Ca -0.02 0.57 0.29 0.00 0.00 0.00 0.00 51.96 52.81 1wdl s ALA 131 Cb -0.03 -3.29 1.59 0.00 0.00 0.00 0.00 23.12 21.40 1wdl s ALA 131 CO -0.00 -0.05 1.89 0.38 0.00 0.00 0.00 175.76 177.98 1wdl h ASP 132 N 5.71 0.00 -0.65 0.00 -0.00 -1.28 -0.03 116.42 120.17 1wdl h ASP 132 Ca -0.43 0.00 -0.15 0.00 -0.00 0.00 0.00 57.03 56.45 1wdl h ASP 132 Cb 1.21 0.00 -0.09 0.00 -0.00 0.00 0.00 39.33 40.45 1wdl h ASP 132 CO 0.72 0.00 0.18 -1.54 -0.00 0.00 0.00 179.24 178.60 1wdl n SER 133 N -2.86 4.82 -4.90 4.15 3.41 -1.26 -4.41 113.62 112.57 1wdl n SER 133 Ca -0.02 -3.18 -0.23 0.00 -0.26 0.00 0.00 58.87 55.18 1wdl n SER 133 Cb 0.38 -0.71 -0.01 0.00 -0.26 0.00 0.00 64.21 63.61 1wdl n SER 133 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wdl s ALA 134 N -2.96 4.27 0.00 7.33 0.00 -0.03 -4.94 121.76 125.44 1wdl s ALA 134 Ca 0.54 -1.71 -0.06 0.00 0.00 0.00 0.00 51.96 50.73 1wdl s ALA 134 Cb 0.43 -0.97 -0.00 0.00 0.00 0.00 0.00 23.12 22.58 1wdl s ALA 134 CO 0.13 -0.38 0.10 0.15 0.00 0.00 0.00 175.76 175.76 1wdl s LYS 135 N -4.25 0.41 0.01 0.00 1.02 -1.26 -3.48 119.74 112.20 1wdl s LYS 135 Ca 0.45 -0.38 -0.09 0.00 0.02 0.00 0.00 55.97 55.97 1wdl s LYS 135 Cb -0.03 0.17 0.00 0.00 -0.52 0.00 0.00 37.83 37.45 1wdl s LYS 135 CO 0.27 -0.09 0.18 0.96 -0.92 0.00 0.00 175.35 175.74 1wdl s ILE 136 N -1.24 0.09 -1.25 2.17 -4.36 -0.51 -1.84 121.20 114.25 1wdl s ILE 136 Ca -0.13 -0.75 0.00 0.00 -0.26 0.00 0.00 60.65 59.51 1wdl s ILE 136 Cb -0.07 -0.63 0.00 0.00 1.25 0.00 0.00 42.46 43.00 1wdl s ILE 136 CO 0.01 -0.41 0.00 0.61 0.24 0.00 0.00 174.94 175.39 1wdl n GLY 137 N 1.15 -1.50 2.54 6.27 0.00 -1.17 0.10 105.19 112.57 1wdl n GLY 137 Ca -0.21 -1.06 -0.28 0.00 0.00 0.00 0.00 46.02 44.47 1wdl n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wdl s LEU 138 N 0.00 2.09 -0.01 0.99 1.43 -1.26 -1.62 118.68 120.29 1wdl s LEU 138 Ca 0.00 -2.94 0.00 0.00 -1.03 0.00 0.00 54.13 50.16 1wdl s LEU 138 Cb 0.00 -0.72 0.03 0.00 0.03 0.00 0.00 46.19 45.52 1wdl s LEU 138 CO 0.00 -0.20 0.56 -0.81 0.23 0.00 0.00 176.35 176.13 1wdl n PRO 139 N 3.06 1.12 -0.32 1.29 -0.04 -1.25 -4.00 135.00 134.87 1wdl n PRO 139 Ca 0.21 -0.10 0.15 0.00 -0.04 0.00 0.00 63.50 63.71 1wdl n PRO 139 Cb 0.41 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.75 1wdl n PRO 139 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1wdl h GLU 140 N 0.13 0.65 -0.42 0.54 4.39 -1.88 -1.40 114.58 116.58 1wdl h GLU 140 Ca 0.00 -0.04 0.12 0.00 0.34 0.00 0.00 59.36 59.78 1wdl h GLU 140 Cb 0.57 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 1wdl h GLU 140 CO 0.02 0.43 0.38 -0.39 -1.16 0.00 0.00 179.01 178.29 1wdl h VAL 141 N 0.67 0.52 0.00 3.13 -1.51 -1.62 0.30 116.25 117.74 1wdl h VAL 141 Ca 0.54 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 66.01 1wdl h VAL 141 Cb 0.97 0.71 0.00 0.00 -2.13 0.00 0.00 31.29 30.84 1wdl h VAL 141 CO -0.31 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 176.32 1wdl n LYS 142 N -3.97 0.17 0.00 5.19 4.01 -0.53 -2.14 118.16 120.89 1wdl n LYS 142 Ca 0.07 0.40 0.09 0.00 -0.51 0.00 0.00 58.31 58.36 1wdl n LYS 142 Cb 0.57 -1.82 -0.07 0.00 -0.51 0.00 0.00 35.03 33.20 1wdl n LYS 142 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1wdl n LEU 143 N -2.13 1.19 0.00 -0.35 4.77 0.10 -4.97 117.00 115.62 1wdl n LEU 143 Ca 0.02 -0.58 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 1wdl n LEU 143 Cb 0.22 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1wdl n LEU 143 CO 0.19 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1wdl n GLY 144 N 1.40 0.85 3.20 -0.72 0.00 -0.91 -4.95 105.19 104.06 1wdl n GLY 144 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 1wdl n GLY 144 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wdl s ILE 145 N -2.01 0.51 0.31 -0.61 -4.36 -1.20 -4.06 121.20 109.79 1wdl s ILE 145 Ca 0.00 -1.95 0.09 0.00 -0.26 0.00 0.00 60.65 58.53 1wdl s ILE 145 Cb 0.00 -2.04 -0.05 0.00 1.25 0.00 0.00 42.46 41.62 1wdl s ILE 145 CO 0.00 -0.53 0.03 -0.72 0.24 0.00 0.00 174.94 173.97 1wdl s TYR 146 N -3.77 2.63 -0.11 1.37 -0.85 -1.26 -2.05 117.35 113.31 1wdl s TYR 146 Ca 0.22 -0.34 -0.35 0.00 -0.52 0.00 0.00 57.07 56.08 1wdl s TYR 146 Cb 0.06 -1.40 -0.17 0.00 0.38 0.00 0.00 41.96 40.83 1wdl s TYR 146 CO 0.02 0.50 1.02 -2.30 -1.52 0.00 0.00 175.55 173.27 1wdl n PRO 147 N -0.97 0.00 0.00 -3.49 -0.02 -1.26 -4.88 135.00 124.38 1wdl n PRO 147 Ca -0.05 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.49 1wdl n PRO 147 Cb 0.61 -1.27 0.01 0.00 -0.02 0.00 0.00 33.50 32.82 1wdl n PRO 147 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wdl n GLY 148 N 1.81 -0.16 2.65 -1.23 0.00 -1.26 -4.40 105.19 102.59 1wdl n GLY 148 Ca 0.19 -0.32 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 1wdl n GLY 148 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wdl n PHE 149 N -0.12 3.32 -0.90 1.61 3.72 -1.26 -4.84 117.46 118.99 1wdl n PHE 149 Ca 0.05 -2.94 0.00 0.00 -0.05 0.00 0.00 57.45 54.51 1wdl n PHE 149 Cb 0.24 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.30 1wdl n PHE 149 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wdl n GLY 150 N -0.46 0.66 0.33 1.37 0.00 -1.26 -4.86 105.19 100.97 1wdl n GLY 150 Ca 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.41 1wdl n GLY 150 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wdl h GLY 151 N 0.00 1.23 1.35 -0.02 0.00 -1.89 -0.09 103.07 103.66 1wdl h GLY 151 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1wdl h GLY 151 CO 0.00 0.50 -0.01 -1.30 0.00 0.00 0.00 176.54 175.72 1wdl n THR 152 N -4.43 0.00 -0.12 4.70 -2.24 -1.26 -2.97 114.28 107.95 1wdl n THR 152 Ca 0.09 -0.01 -0.25 0.00 -2.27 0.00 0.00 64.05 61.61 1wdl n THR 152 Cb 0.06 -0.45 -0.09 0.00 -2.10 0.00 0.00 70.33 67.74 1wdl n THR 152 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1wdl n VAL 153 N -1.17 1.37 0.05 2.28 0.31 -0.70 -4.54 118.33 115.93 1wdl n VAL 153 Ca 0.17 -0.38 -0.20 0.00 -0.01 0.00 0.00 64.34 63.92 1wdl n VAL 153 Cb 0.21 -1.76 -0.14 0.00 -0.91 0.00 0.00 33.84 31.24 1wdl n VAL 153 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1wdl h ARG 154 N -0.76 0.33 -0.27 5.55 3.08 -1.16 -3.32 114.38 117.82 1wdl h ARG 154 Ca -0.62 -0.53 0.01 0.00 0.07 0.00 0.00 59.98 58.91 1wdl h ARG 154 Cb 1.60 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.82 1wdl h ARG 154 CO -0.34 1.24 0.16 1.25 -1.07 0.00 0.00 179.97 181.21 1wdl h LEU 155 N -0.31 0.27 -1.52 3.04 5.85 -1.74 0.61 115.31 121.50 1wdl h LEU 155 Ca -0.14 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.63 1wdl h LEU 155 Cb 1.63 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.57 1wdl h LEU 155 CO 0.16 0.19 0.38 -0.65 -0.34 0.00 0.00 178.44 178.18 1wdl h PRO 156 N 0.33 0.59 0.00 5.25 0.11 -1.78 -0.21 132.00 136.29 1wdl h PRO 156 Ca 0.11 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1wdl h PRO 156 Cb -0.01 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 30.97 1wdl h PRO 156 CO -0.05 0.39 -0.76 0.00 -0.21 0.00 0.00 178.00 177.38 1wdl h ARG 157 N 0.60 0.00 0.04 1.05 3.08 -1.59 -2.11 114.38 115.45 1wdl h ARG 157 Ca 0.24 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.12 1wdl h ARG 157 Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1wdl h ARG 157 CO -0.07 0.00 -0.88 -0.07 -1.07 0.00 0.00 179.97 177.88 1wdl h LEU 158 N 0.00 0.13 0.00 3.04 3.38 -0.13 -3.42 115.31 118.31 1wdl h LEU 158 Ca 0.00 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.19 1wdl h LEU 158 Cb 0.97 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1wdl h LEU 158 CO 0.00 1.37 -1.21 2.30 0.09 0.00 0.00 178.44 180.99 1wdl n ILE 159 N -4.33 0.00 0.00 1.22 -5.35 -0.16 -4.89 119.36 105.85 1wdl n ILE 159 Ca -0.22 -0.26 0.00 0.00 -0.27 0.00 0.00 62.75 62.00 1wdl n ILE 159 Cb 0.68 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 39.11 1wdl n ILE 159 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1wdl n GLY 160 N 1.55 3.00 0.09 3.28 0.00 -0.80 -4.67 105.19 107.63 1wdl n GLY 160 Ca -0.00 -1.69 -0.03 0.00 0.00 0.00 0.00 46.02 44.30 1wdl n GLY 160 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1wdl h VAL 161 N 0.00 0.00 -0.77 1.61 2.07 -1.86 0.11 116.25 117.41 1wdl h VAL 161 Ca 0.00 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.70 1wdl h VAL 161 Cb 0.00 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.64 1wdl h VAL 161 CO 0.00 0.00 0.09 0.44 0.02 0.00 0.00 177.57 178.12 1wdl h ASP 162 N -0.08 -0.19 -0.11 0.57 3.32 -1.92 0.25 116.42 118.25 1wdl h ASP 162 Ca 0.01 0.18 -0.10 0.00 0.02 0.00 0.00 57.03 57.14 1wdl h ASP 162 Cb 0.11 0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1wdl h ASP 162 CO -0.11 -0.14 -0.26 0.78 -1.72 0.00 0.00 179.24 177.80 1wdl h ASN 163 N 0.16 0.57 -0.04 6.45 2.35 -1.74 -2.22 115.58 121.11 1wdl h ASN 163 Ca 0.43 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.96 1wdl h ASN 163 Cb 0.78 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1wdl h ASN 163 CO -0.62 0.81 -0.09 0.00 -1.65 0.00 0.00 177.43 175.89 1wdl h ALA 164 N 1.23 0.06 -0.96 -0.83 0.00 0.11 -1.81 119.26 117.06 1wdl h ALA 164 Ca 0.07 -0.33 0.14 0.00 0.00 0.00 0.00 54.91 54.79 1wdl h ALA 164 Cb 0.70 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.39 1wdl h ALA 164 CO 0.05 -0.08 0.58 0.28 0.00 0.00 0.00 179.25 180.09 1wdl h VAL 165 N -0.41 0.84 -0.04 0.00 2.07 -0.55 0.29 116.25 118.44 1wdl h VAL 165 Ca -0.00 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 1wdl h VAL 165 Cb 0.68 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1wdl h VAL 165 CO 0.02 0.16 -0.03 -0.08 0.02 0.00 0.00 177.57 177.65 1wdl h GLU 166 N 0.86 0.10 -0.79 1.57 4.81 -1.38 0.12 114.58 119.86 1wdl h GLU 166 Ca 0.50 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.69 1wdl h GLU 166 Cb 0.60 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.95 1wdl h GLU 166 CO -0.31 0.53 0.52 -1.49 -0.73 0.00 0.00 179.01 177.53 1wdl h TRP 167 N -0.34 1.00 0.22 0.92 4.06 -0.58 -2.46 115.95 118.78 1wdl h TRP 167 Ca 0.01 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.97 1wdl h TRP 167 Cb 0.51 -0.34 0.00 0.00 -1.00 0.00 0.00 29.16 28.33 1wdl h TRP 167 CO 0.08 0.63 -0.11 0.82 -3.56 0.00 0.00 178.44 176.31 1wdl h ILE 168 N 1.08 0.00 -0.84 1.49 2.04 -0.47 -2.04 117.51 118.77 1wdl h ILE 168 Ca 0.29 -0.76 0.17 0.00 1.00 0.00 0.00 64.86 65.55 1wdl h ILE 168 Cb -0.12 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 35.86 1wdl h ILE 168 CO -0.06 0.00 0.39 0.00 0.00 0.00 0.00 178.15 178.48 1wdl h ALA 169 N -1.10 1.27 0.19 1.87 0.00 -1.05 -2.43 119.26 118.01 1wdl h ALA 169 Ca -0.03 0.11 -0.29 0.00 0.00 0.00 0.00 54.91 54.71 1wdl h ALA 169 Cb 0.23 0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.11 1wdl h ALA 169 CO 0.05 -0.19 -1.24 0.66 0.00 0.00 0.00 179.25 178.53 1wdl h SER 170 N 0.51 0.76 -0.60 0.00 4.64 -1.59 -3.42 113.55 113.85 1wdl h SER 170 Ca 0.48 -0.90 -0.13 0.00 -0.47 0.00 0.00 61.79 60.77 1wdl h SER 170 Cb 0.76 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.58 1wdl h SER 170 CO -0.42 1.60 -0.14 0.61 -0.87 0.00 0.00 176.83 177.61 1wdl n GLY 171 N 1.60 0.47 3.82 -0.77 0.00 -0.77 -4.89 105.19 104.66 1wdl n GLY 171 Ca -0.15 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 1wdl n GLY 171 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wdl s LYS 172 N -3.46 4.02 0.54 1.61 -2.85 -1.25 -3.75 119.74 114.59 1wdl s LYS 172 Ca 0.00 1.14 -0.12 0.00 -1.00 0.00 0.00 55.97 55.99 1wdl s LYS 172 Cb 0.00 -2.14 -0.06 0.00 -2.06 0.00 0.00 37.83 33.57 1wdl s LYS 172 CO 0.00 -0.22 0.95 -1.21 0.10 0.00 0.00 175.35 174.97 1wdl s GLU 173 N -3.45 3.73 -0.04 1.78 2.02 -1.26 -4.29 118.70 117.19 1wdl s GLU 173 Ca 0.62 0.70 0.01 0.00 0.02 0.00 0.00 54.97 56.33 1wdl s GLU 173 Cb -0.11 -2.18 0.02 0.00 0.10 0.00 0.00 34.13 31.95 1wdl s GLU 173 CO 0.20 -0.35 -0.05 -0.80 0.02 0.00 0.00 175.26 174.29 1wdl s ASN 174 N -3.66 0.89 0.71 -0.19 0.01 0.12 -4.92 114.94 107.90 1wdl s ASN 174 Ca 0.55 -0.12 -0.11 0.00 -0.71 0.00 0.00 52.86 52.46 1wdl s ASN 174 Cb -0.10 -0.40 0.01 0.00 0.41 0.00 0.00 41.25 41.17 1wdl s ASN 174 CO 0.42 -0.03 1.07 -0.13 -1.51 0.00 0.00 177.10 176.92 1wdl s ARG 175 N 0.75 2.84 0.23 -0.60 0.52 -1.26 -1.42 118.95 120.01 1wdl s ARG 175 Ca -0.10 0.70 -0.10 0.00 -0.52 0.00 0.00 55.73 55.71 1wdl s ARG 175 Cb -0.13 -2.00 0.34 0.00 0.52 0.00 0.00 34.95 33.68 1wdl s ARG 175 CO 0.00 -1.10 1.64 0.00 0.02 0.00 0.00 175.30 175.86 1wdl h ALA 176 N -0.71 0.63 -0.33 2.13 0.00 -1.76 0.46 119.26 119.68 1wdl h ALA 176 Ca -0.45 0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.77 1wdl h ALA 176 Cb 1.23 0.42 -0.08 0.00 0.00 0.00 0.00 17.79 19.36 1wdl h ALA 176 CO 0.60 -0.42 -0.24 1.49 0.00 0.00 0.00 179.25 180.69 1wdl h GLU 177 N 0.07 -0.20 -0.25 0.00 4.81 -1.93 0.20 114.58 117.29 1wdl h GLU 177 Ca 0.36 0.01 -0.20 0.00 -0.13 0.00 0.00 59.36 59.41 1wdl h GLU 177 Cb 0.60 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1wdl h GLU 177 CO -0.64 -0.13 -0.61 -0.44 -0.73 0.00 0.00 179.01 176.46 1wdl h ASP 178 N -0.20 0.96 0.16 1.04 3.32 -1.70 -2.58 116.42 117.42 1wdl h ASP 178 Ca 0.17 -0.55 -0.03 0.00 0.02 0.00 0.00 57.03 56.63 1wdl h ASP 178 Cb 0.46 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1wdl h ASP 178 CO -0.45 1.35 -0.16 0.00 -1.72 0.00 0.00 179.24 178.26 1wdl h ALA 179 N 0.66 1.73 0.08 3.45 0.00 -0.60 -2.61 119.26 121.96 1wdl h ALA 179 Ca -0.00 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 1wdl h ALA 179 Cb 1.23 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 19.01 1wdl h ALA 179 CO 0.13 0.20 -0.81 1.25 0.00 0.00 0.00 179.25 180.02 1wdl h LEU 180 N 0.00 0.57 -0.88 0.00 6.46 -0.90 0.25 115.31 120.81 1wdl h LEU 180 Ca -0.00 -0.85 -0.00 0.00 -0.12 0.00 0.00 57.88 56.90 1wdl h LEU 180 Cb 0.28 -0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 39.99 1wdl h LEU 180 CO 0.02 1.36 0.54 0.11 -0.62 0.00 0.00 178.44 179.85 1wdl h LYS 181 N -0.15 1.19 -0.00 1.25 1.57 -1.23 -0.78 116.57 118.42 1wdl h LYS 181 Ca -0.12 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1wdl h LYS 181 Cb 1.56 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1wdl h LYS 181 CO 0.15 0.82 -0.01 1.33 -0.57 0.00 0.00 179.45 181.18 1wdl n VAL 182 N -4.42 0.00 -2.35 0.50 0.24 -1.00 -4.90 118.33 106.39 1wdl n VAL 182 Ca 0.09 -0.01 -0.09 0.00 -2.04 0.00 0.00 64.34 62.29 1wdl n VAL 182 Cb 0.05 -0.46 0.00 0.00 -1.47 0.00 0.00 33.84 31.96 1wdl n VAL 182 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1wdl n SER 183 N -1.14 -3.28 0.09 -1.34 7.64 -0.30 -4.58 113.62 110.71 1wdl n SER 183 Ca 0.18 -0.06 -0.12 0.00 1.01 0.00 0.00 58.87 59.88 1wdl n SER 183 Cb 0.20 -2.40 -0.09 0.00 -1.01 0.00 0.00 64.21 60.91 1wdl n SER 183 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wdl h ALA 184 N 0.43 0.27 -3.25 -0.43 0.00 -0.75 -3.43 119.26 112.10 1wdl h ALA 184 Ca -0.22 -0.83 -0.65 0.00 0.00 0.00 0.00 54.91 53.21 1wdl h ALA 184 Cb 1.16 -0.04 -0.16 0.00 0.00 0.00 0.00 17.79 18.74 1wdl h ALA 184 CO 0.25 0.99 -0.76 0.08 0.00 0.00 0.00 179.25 179.81 1wdl s VAL 185 N -2.86 2.95 -0.54 0.00 1.01 -0.81 -4.89 120.40 115.26 1wdl s VAL 185 Ca -0.03 -1.67 0.20 0.00 0.00 0.00 0.00 61.98 60.47 1wdl s VAL 185 Cb 0.08 -2.42 -0.25 0.00 0.00 0.00 0.00 36.38 33.79 1wdl s VAL 185 CO 0.86 -0.05 0.66 0.47 0.00 0.00 0.00 175.10 177.04 1wdl n ASP 186 N 0.30 0.71 -3.64 3.32 8.00 -0.40 -4.57 116.55 120.28 1wdl n ASP 186 Ca -0.12 -0.56 -0.05 0.00 0.71 0.00 0.00 54.79 54.77 1wdl n ASP 186 Cb 0.55 1.38 -0.07 0.00 -0.02 0.00 0.00 41.12 42.96 1wdl n ASP 186 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wdl s ALA 187 N -3.06 -1.99 -0.17 2.24 0.00 -1.18 -5.03 121.76 112.57 1wdl s ALA 187 Ca 0.01 2.37 -0.03 0.00 0.00 0.00 0.00 51.96 54.32 1wdl s ALA 187 Cb 0.14 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.71 1wdl s ALA 187 CO 0.81 -0.44 -0.07 0.08 0.00 0.00 0.00 175.76 176.14 1wdl s VAL 188 N 1.71 3.44 0.19 0.00 1.01 -1.26 -0.45 120.40 125.04 1wdl s VAL 188 Ca -0.09 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 1wdl s VAL 188 Cb -0.05 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 1wdl s VAL 188 CO -0.19 0.48 0.11 0.68 0.00 0.00 0.00 175.10 176.18 1wdl s VAL 189 N 0.73 0.05 0.65 2.92 -7.23 -0.16 -4.90 120.40 112.46 1wdl s VAL 189 Ca -0.03 -1.98 -0.16 0.00 -1.81 0.00 0.00 61.98 57.99 1wdl s VAL 189 Cb -0.15 -2.42 -0.00 0.00 0.56 0.00 0.00 36.38 34.37 1wdl s VAL 189 CO 0.02 -0.09 1.17 0.42 -0.31 0.00 0.00 175.10 176.31 1wdl s THR 190 N -4.11 2.77 0.25 5.32 -4.23 -1.26 -0.80 115.64 113.57 1wdl s THR 190 Ca 0.36 0.40 -0.04 0.00 -1.18 0.00 0.00 61.69 61.24 1wdl s THR 190 Cb 0.07 -3.01 0.22 0.00 1.34 0.00 0.00 72.50 71.13 1wdl s THR 190 CO 0.10 -0.17 1.74 0.00 -0.54 0.00 0.00 174.62 175.75 1wdl h ALA 191 N 0.25 1.11 -0.75 3.99 0.00 -1.93 -2.29 119.26 119.64 1wdl h ALA 191 Ca -0.48 0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.54 1wdl h ALA 191 Cb 1.28 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 1wdl h ALA 191 CO 0.53 -0.17 0.50 -0.44 0.00 0.00 0.00 179.25 179.67 1wdl h ASP 192 N 0.49 0.86 -0.72 0.00 3.32 -2.02 -2.78 116.42 115.57 1wdl h ASP 192 Ca 0.42 -0.02 -0.20 0.00 0.02 0.00 0.00 57.03 57.25 1wdl h ASP 192 Cb 0.62 -0.21 -0.12 0.00 0.22 0.00 0.00 39.33 39.84 1wdl h ASP 192 CO -0.39 0.62 0.26 0.29 -1.72 0.00 0.00 179.24 178.30 1wdl n LYS 193 N -4.42 3.74 0.22 3.56 5.02 -0.87 -4.54 118.16 120.87 1wdl n LYS 193 Ca 0.08 -3.00 -0.13 0.00 -2.02 0.00 0.00 58.31 53.25 1wdl n LYS 193 Cb 0.04 -2.20 -0.07 0.00 -0.02 0.00 0.00 35.03 32.78 1wdl n LYS 193 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1wdl h LEU 194 N 2.71 -0.51 -1.17 -0.35 6.46 -1.35 -2.54 115.31 118.57 1wdl h LEU 194 Ca 0.25 -0.10 0.14 0.00 -0.12 0.00 0.00 57.88 58.06 1wdl h LEU 194 Cb 2.30 0.13 -0.08 0.00 -0.73 0.00 0.00 40.66 42.28 1wdl h LEU 194 CO 0.72 -0.12 0.60 1.23 -0.62 0.00 0.00 178.44 180.25 1wdl h GLY 195 N -0.97 1.42 1.18 3.75 0.00 -1.82 -0.82 103.07 105.81 1wdl h GLY 195 Ca -0.06 -0.35 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 1wdl h GLY 195 CO 0.10 0.09 0.03 0.00 0.00 0.00 0.00 176.54 176.76 1wdl h ALA 196 N 1.59 0.95 0.05 3.60 0.00 -1.85 -1.69 119.26 121.90 1wdl h ALA 196 Ca 0.48 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1wdl h ALA 196 Cb 0.69 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1wdl h ALA 196 CO -0.25 0.64 -0.02 0.00 0.00 0.00 0.00 179.25 179.62 1wdl h ALA 197 N 1.10 -0.07 -0.93 0.00 0.00 -0.73 0.25 119.26 118.88 1wdl h ALA 197 Ca 0.17 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1wdl h ALA 197 Cb 0.49 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1wdl h ALA 197 CO 0.02 -0.43 0.62 0.00 0.00 0.00 0.00 179.25 179.46 1wdl h ALA 198 N 0.66 1.35 0.03 0.00 0.00 -1.30 0.24 119.26 120.25 1wdl h ALA 198 Ca -0.01 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1wdl h ALA 198 Cb 0.25 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1wdl h ALA 198 CO 0.01 0.59 -0.01 1.25 0.00 0.00 0.00 179.25 181.09 1wdl h LEU 199 N 1.24 -0.03 -1.54 0.00 7.12 -1.16 -1.93 115.31 119.01 1wdl h LEU 199 Ca 0.35 -0.49 -0.01 0.00 0.13 0.00 0.00 57.88 57.86 1wdl h LEU 199 Cb -0.11 0.01 -0.02 0.00 -0.53 0.00 0.00 40.66 40.02 1wdl h LEU 199 CO -0.08 0.48 0.16 -0.78 -0.13 0.00 0.00 178.44 178.08 1wdl h ASP 200 N -0.55 0.41 0.02 1.25 1.82 -0.26 -2.46 116.42 116.66 1wdl h ASP 200 Ca -0.00 -0.03 -0.00 0.00 -0.39 0.00 0.00 57.03 56.61 1wdl h ASP 200 Cb 0.51 -0.10 0.00 0.00 0.68 0.00 0.00 39.33 40.42 1wdl h ASP 200 CO 0.01 0.36 -0.01 0.25 -1.61 0.00 0.00 179.24 178.23 1wdl h LEU 201 N 0.47 -0.03 -0.71 2.28 6.46 -0.50 -2.90 115.31 120.39 1wdl h LEU 201 Ca 0.12 -0.48 0.11 0.00 -0.12 0.00 0.00 57.88 57.51 1wdl h LEU 201 Cb 0.06 0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 39.92 1wdl h LEU 201 CO -0.02 0.48 0.32 0.40 -0.62 0.00 0.00 178.44 179.00 1wdl h ILE 202 N -0.54 0.77 -0.08 4.05 1.08 -1.15 -0.34 117.51 121.30 1wdl h ILE 202 Ca -0.00 -0.18 -0.03 0.00 -0.39 0.00 0.00 64.86 64.26 1wdl h ILE 202 Cb 0.51 0.21 -0.01 0.00 -3.07 0.00 0.00 36.82 34.46 1wdl h ILE 202 CO 0.01 0.10 -0.09 0.11 -0.69 0.00 0.00 178.15 177.58 1wdl h LYS 203 N 0.52 0.12 0.00 2.37 1.57 -1.47 -0.57 116.57 119.11 1wdl h LYS 203 Ca 0.36 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1wdl h LYS 203 Cb 0.46 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1wdl h LYS 203 CO -0.32 0.22 0.00 0.54 -0.57 0.00 0.00 179.45 179.32 1wdl n ARG 204 N -4.37 0.15 -0.02 3.15 1.74 -0.20 -1.93 116.66 115.19 1wdl n ARG 204 Ca -0.02 0.15 -0.16 0.00 -0.77 0.00 0.00 57.85 57.06 1wdl n ARG 204 Cb 0.20 -1.68 -0.14 0.00 -1.02 0.00 0.00 32.46 29.82 1wdl n ARG 204 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wdl n ALA 205 N -1.67 1.18 -0.05 7.54 0.00 -0.36 -0.04 120.51 127.12 1wdl n ALA 205 Ca 0.06 -0.72 -0.13 0.00 0.00 0.00 0.00 53.44 52.65 1wdl n ALA 205 Cb 0.38 -0.69 -0.08 0.00 0.00 0.00 0.00 19.45 19.06 1wdl n ALA 205 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1wdl h ILE 206 N 0.04 1.36 -0.00 0.00 2.04 -1.12 -3.00 117.51 116.82 1wdl h ILE 206 Ca -0.38 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.19 1wdl h ILE 206 Cb 2.03 1.95 -0.00 0.00 -0.74 0.00 0.00 36.82 40.06 1wdl h ILE 206 CO 0.07 0.37 0.01 0.77 0.00 0.00 0.00 178.15 179.37 1wdl h SER 207 N -0.11 0.00 0.00 1.72 4.64 -1.57 -3.45 113.55 114.78 1wdl h SER 207 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1wdl h SER 207 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1wdl h SER 207 CO 0.03 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 1wdl n GLY 208 N -1.19 0.44 0.09 -0.77 0.00 -1.13 -4.96 105.19 97.66 1wdl n GLY 208 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 1wdl n GLY 208 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1wdl h GLU 209 N 4.05 -0.02 -5.35 1.61 4.81 -1.67 -3.40 114.58 114.61 1wdl h GLU 209 Ca 0.00 0.00 -0.62 0.00 -0.13 0.00 0.00 59.36 58.62 1wdl h GLU 209 Cb 0.00 0.01 -0.12 0.00 0.63 0.00 0.00 28.75 29.27 1wdl h GLU 209 CO 0.00 -0.02 -0.50 -0.51 -0.73 0.00 0.00 179.01 177.25 1wdl s LEU 210 N -10.31 4.17 -1.24 1.64 1.43 0.94 -5.01 118.68 110.30 1wdl s LEU 210 Ca -0.13 0.25 -0.15 0.00 -1.03 0.00 0.00 54.13 53.06 1wdl s LEU 210 Cb 0.08 -2.06 0.14 0.00 0.03 0.00 0.00 46.19 44.37 1wdl s LEU 210 CO 0.67 0.22 1.55 -0.62 0.23 0.00 0.00 176.35 178.40 1wdl s ASP 211 N 0.10 6.99 0.61 2.29 -1.08 -1.26 -4.51 116.67 119.82 1wdl s ASP 211 Ca 0.09 -2.81 0.34 0.00 -0.52 0.00 0.00 52.55 49.64 1wdl s ASP 211 Cb -0.11 -2.46 1.98 0.00 -1.46 0.00 0.00 42.92 40.87 1wdl s ASP 211 CO -0.01 -0.89 2.27 0.10 0.52 0.00 0.00 175.17 177.16 1wdl h TYR 212 N 7.28 0.00 -0.07 -5.34 -0.00 -1.95 -1.31 116.97 115.59 1wdl h TYR 212 Ca 0.37 0.00 -0.20 0.00 0.00 0.00 0.00 58.73 58.90 1wdl h TYR 212 Cb 0.87 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.61 1wdl h TYR 212 CO 1.22 0.00 -0.72 0.87 -0.00 0.00 0.00 178.16 179.53 1wdl h LYS 213 N 0.00 0.62 0.00 0.10 1.79 -1.96 -2.84 116.57 114.27 1wdl h LYS 213 Ca 0.01 -0.57 -0.06 0.00 -2.18 0.00 0.00 60.65 57.85 1wdl h LYS 213 Cb 0.05 0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 1wdl h LYS 213 CO -0.00 1.18 -0.31 0.00 -1.08 0.00 0.00 179.45 179.25 1wdl h ALA 214 N 0.44 1.11 0.00 3.86 0.00 -1.67 -2.65 119.26 120.35 1wdl h ALA 214 Ca -0.07 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.46 1wdl h ALA 214 Cb 1.38 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1wdl h ALA 214 CO 0.15 0.38 -0.59 -0.22 0.00 0.00 0.00 179.25 178.97 1wdl h LYS 215 N 0.00 0.00 0.15 0.00 3.64 -1.39 -3.31 116.57 115.67 1wdl h LYS 215 Ca -0.00 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.08 1wdl h LYS 215 Cb 0.74 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.58 1wdl h LYS 215 CO 0.04 0.44 -1.28 -0.09 -2.27 0.00 0.00 179.45 176.29 1wdl h ARG 216 N 0.00 0.45 -0.88 1.90 2.43 -1.27 -3.38 114.38 113.62 1wdl h ARG 216 Ca -0.02 -0.68 0.15 0.00 -0.81 0.00 0.00 59.98 58.62 1wdl h ARG 216 Cb 1.38 0.24 -0.16 0.00 -0.42 0.00 0.00 29.97 31.02 1wdl h ARG 216 CO 0.06 1.31 -0.32 0.37 -1.51 0.00 0.00 179.97 179.88 1wdl h GLN 217 N 0.16 -0.03 -1.58 0.20 5.75 -1.56 -2.42 115.11 115.62 1wdl h GLN 217 Ca -0.18 0.00 0.47 0.00 -0.15 0.00 0.00 58.65 58.80 1wdl h GLN 217 Cb 1.97 0.01 -0.08 0.00 1.07 0.00 0.00 27.48 30.45 1wdl h GLN 217 CO 0.23 -0.02 1.11 -1.35 -2.65 0.00 0.00 178.83 176.15 1wdl h PRO 218 N -0.03 0.03 -0.56 -2.39 0.11 -1.76 0.24 132.00 127.64 1wdl h PRO 218 Ca 0.36 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.40 1wdl h PRO 218 Cb 0.61 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 31.68 1wdl h PRO 218 CO -0.91 0.02 0.07 0.36 -0.21 0.00 0.00 178.00 177.34 1wdl n LYS 219 N -4.22 4.16 -0.00 1.05 2.85 -0.91 -4.09 118.16 117.00 1wdl n LYS 219 Ca 0.37 -3.10 0.00 0.00 -1.05 0.00 0.00 58.31 54.54 1wdl n LYS 219 Cb 1.64 -2.17 -0.01 0.00 -0.65 0.00 0.00 35.03 33.84 1wdl n LYS 219 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1wdl n LEU 220 N 0.15 0.00 0.00 -5.58 4.77 0.82 -4.44 117.00 112.73 1wdl n LEU 220 Ca 0.30 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 56.12 1wdl n LEU 220 Cb 1.20 0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 42.29 1wdl n LEU 220 CO 0.32 0.01 0.03 -1.84 -1.33 0.00 0.00 177.39 174.58 1wdl n GLU 221 N -1.66 1.01 -0.82 3.23 0.28 -1.12 -2.13 120.64 119.42 1wdl n GLU 221 Ca -0.01 -2.15 -0.29 0.00 -0.16 0.00 0.00 57.16 54.55 1wdl n GLU 221 Cb 0.15 0.26 0.19 0.00 1.43 0.00 0.00 31.44 33.48 1wdl n GLU 221 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 1wdl s LYS 222 N -3.38 0.25 0.61 3.44 -2.85 -1.23 -4.56 119.74 112.02 1wdl s LYS 222 Ca 0.18 0.97 -0.16 0.00 -1.00 0.00 0.00 55.97 55.96 1wdl s LYS 222 Cb -0.01 -1.68 -0.02 0.00 -2.06 0.00 0.00 37.83 34.05 1wdl s LYS 222 CO 0.11 -2.97 1.08 -0.51 0.10 0.00 0.00 175.35 173.16 1wdl s LEU 223 N -6.73 3.48 0.00 2.77 1.43 -0.75 -4.93 118.68 113.94 1wdl s LEU 223 Ca 0.66 1.90 0.31 0.00 -1.03 0.00 0.00 54.13 55.97 1wdl s LEU 223 Cb -0.22 -4.54 1.63 0.00 0.03 0.00 0.00 46.19 43.09 1wdl s LEU 223 CO 0.60 -1.33 2.10 0.29 0.23 0.00 0.00 176.35 178.24 1wdl n LYS 224 N -2.12 0.71 -2.45 1.70 5.02 -1.26 -4.88 118.16 114.87 1wdl n LYS 224 Ca 0.09 -0.05 -0.37 0.00 -2.02 0.00 0.00 58.31 55.97 1wdl n LYS 224 Cb 0.52 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 1wdl n LYS 224 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1wdl s LEU 225 N -2.32 4.11 0.78 -0.35 1.02 -1.26 -5.04 118.68 115.61 1wdl s LEU 225 Ca 0.36 2.12 -0.11 0.00 0.02 0.00 0.00 54.13 56.53 1wdl s LEU 225 Cb 0.21 -4.20 0.06 0.00 0.02 0.00 0.00 46.19 42.28 1wdl s LEU 225 CO 0.42 -0.62 1.08 0.21 0.02 0.00 0.00 176.35 177.47 1wdl s ASN 226 N -1.49 4.60 0.27 2.29 3.84 -1.26 -4.80 114.94 118.38 1wdl s ASN 226 Ca 0.59 1.52 -0.04 0.00 0.21 0.00 0.00 52.86 55.14 1wdl s ASN 226 Cb -0.24 -2.28 0.34 0.00 -0.55 0.00 0.00 41.25 38.52 1wdl s ASN 226 CO 0.30 -1.93 1.89 0.00 -2.79 0.00 0.00 177.10 174.57 1wdl h ALA 227 N -1.06 1.26 -0.08 1.71 0.00 -1.99 0.20 119.26 119.31 1wdl h ALA 227 Ca -0.46 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.26 1wdl h ALA 227 Cb 1.25 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1wdl h ALA 227 CO 0.56 0.59 -0.20 0.82 0.00 0.00 0.00 179.25 181.03 1wdl h ILE 228 N 1.10 1.41 0.00 0.00 1.08 -2.00 -2.60 117.51 116.50 1wdl h ILE 228 Ca 0.28 -1.53 -0.00 0.00 -0.39 0.00 0.00 64.86 63.22 1wdl h ILE 228 Cb 0.04 2.21 -0.00 0.00 -3.07 0.00 0.00 36.82 36.00 1wdl h ILE 228 CO -0.04 0.43 -0.00 -0.33 -0.69 0.00 0.00 178.15 177.52 1wdl h GLU 229 N -0.20 0.00 0.07 2.37 4.39 -1.80 -2.36 114.58 117.05 1wdl h GLU 229 Ca -0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1wdl h GLU 229 Cb 0.80 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 1wdl h GLU 229 CO 0.04 0.00 -0.04 1.96 -1.16 0.00 0.00 179.01 179.82 1wdl h GLN 230 N 0.00 -0.10 -0.62 2.33 4.20 -0.46 -2.31 115.11 118.16 1wdl h GLN 230 Ca -0.00 0.01 0.13 0.00 0.06 0.00 0.00 58.65 58.85 1wdl h GLN 230 Cb 0.01 0.02 -0.10 0.00 0.30 0.00 0.00 27.48 27.70 1wdl h GLN 230 CO 0.00 0.47 0.01 1.98 -0.67 0.00 0.00 178.83 180.62 1wdl h MET 231 N -0.81 0.13 0.63 1.46 4.05 -1.04 0.29 114.93 119.64 1wdl h MET 231 Ca -0.01 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.37 1wdl h MET 231 Cb 0.61 -0.03 0.01 0.00 -0.80 0.00 0.00 31.60 31.39 1wdl h MET 231 CO 0.02 0.08 -0.30 1.98 0.23 0.00 0.00 176.91 178.92 1wdl h MET 232 N 0.13 -0.82 -0.12 0.39 1.85 -1.55 -0.65 114.93 114.16 1wdl h MET 232 Ca 0.33 0.06 0.04 0.00 -0.61 0.00 0.00 59.70 59.51 1wdl h MET 232 Cb 0.53 0.19 -0.05 0.00 0.43 0.00 0.00 31.60 32.69 1wdl h MET 232 CO -0.52 -0.52 -0.19 0.00 -0.40 0.00 0.00 176.91 175.27 1wdl h ALA 233 N -0.59 -0.14 -0.05 0.39 0.00 -0.76 -2.04 119.26 116.07 1wdl h ALA 233 Ca -0.09 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1wdl h ALA 233 Cb 0.68 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1wdl h ALA 233 CO 0.14 -0.65 -0.04 0.74 0.00 0.00 0.00 179.25 179.44 1wdl h PHE 234 N -0.25 0.15 -0.84 0.00 0.05 -0.49 -2.69 116.94 112.87 1wdl h PHE 234 Ca 0.10 -0.04 0.04 0.00 3.82 0.00 0.00 57.97 61.88 1wdl h PHE 234 Cb 0.39 -0.03 -0.05 0.00 2.00 0.00 0.00 35.95 38.25 1wdl h PHE 234 CO -0.30 0.55 0.54 0.93 -0.18 0.00 0.00 178.31 179.85 1wdl h GLU 235 N -0.30 1.00 -0.18 1.51 4.39 -1.10 0.32 114.58 120.21 1wdl h GLU 235 Ca 0.01 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1wdl h GLU 235 Cb 0.53 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1wdl h GLU 235 CO 0.01 0.66 0.04 1.79 -1.16 0.00 0.00 179.01 180.35 1wdl h THR 236 N 1.03 1.21 0.36 1.13 1.35 -1.43 0.40 112.91 116.95 1wdl h THR 236 Ca 0.34 -0.69 -0.01 0.00 -0.55 0.00 0.00 66.41 65.50 1wdl h THR 236 Cb 0.05 1.33 -0.01 0.00 -1.73 0.00 0.00 68.15 67.79 1wdl h THR 236 CO -0.13 0.21 -0.25 0.00 -0.25 0.00 0.00 175.52 175.10 1wdl h ALA 237 N 0.83 -0.59 -0.26 6.62 0.00 -1.09 0.43 119.26 125.20 1wdl h ALA 237 Ca 0.05 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1wdl h ALA 237 Cb 0.29 0.32 -0.07 0.00 0.00 0.00 0.00 17.79 18.33 1wdl h ALA 237 CO 0.00 -0.85 -0.17 0.87 0.00 0.00 0.00 179.25 179.10 1wdl h LYS 238 N -0.60 -0.15 0.64 0.00 1.57 -0.31 -0.93 116.57 116.79 1wdl h LYS 238 Ca -0.03 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1wdl h LYS 238 Cb 0.51 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1wdl h LYS 238 CO 0.02 -0.10 -0.38 0.78 -0.57 0.00 0.00 179.45 179.20 1wdl h GLY 239 N -0.16 -1.03 -0.47 3.86 0.00 -0.74 0.49 103.07 105.02 1wdl h GLY 239 Ca 0.14 0.42 0.16 0.00 0.00 0.00 0.00 47.33 48.05 1wdl h GLY 239 CO -0.36 -0.37 -0.12 -2.75 0.00 0.00 0.00 176.54 172.94 1wdl h PHE 240 N -0.96 -0.28 -0.01 5.60 3.57 -0.70 -0.10 116.94 124.06 1wdl h PHE 240 Ca -0.08 0.06 -0.20 0.00 3.53 0.00 0.00 57.97 61.28 1wdl h PHE 240 Cb 0.77 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.74 1wdl h PHE 240 CO -0.09 -0.30 -0.87 0.28 -2.23 0.00 0.00 178.31 175.11 1wdl h VAL 241 N 0.03 1.46 -0.82 1.41 2.07 -1.03 -3.20 116.25 116.16 1wdl h VAL 241 Ca 0.38 -2.50 0.03 0.00 0.82 0.00 0.00 66.70 65.43 1wdl h VAL 241 Cb 0.62 2.40 -0.05 0.00 -1.52 0.00 0.00 31.29 32.75 1wdl h VAL 241 CO -0.74 0.74 0.54 0.00 0.02 0.00 0.00 177.57 178.12 1wdl h ALA 242 N 0.93 1.48 0.00 1.67 0.00 0.18 0.31 119.26 123.83 1wdl h ALA 242 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1wdl h ALA 242 Cb 1.48 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1wdl h ALA 242 CO 0.14 0.44 -0.30 0.78 0.00 0.00 0.00 179.25 180.31 1wdl h GLY 243 N 1.04 0.00 0.00 0.00 0.00 -1.43 -2.53 103.07 100.15 1wdl h GLY 243 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1wdl h GLY 243 CO -0.09 0.00 -1.43 -0.18 0.00 0.00 0.00 176.54 174.84 1wdl n GLN 244 N -2.68 0.43 -0.10 4.80 7.27 -0.89 -4.45 117.38 121.76 1wdl n GLN 244 Ca 0.03 -0.09 -0.10 0.00 0.07 0.00 0.00 57.00 56.91 1wdl n GLN 244 Cb 0.50 -1.48 -0.14 0.00 2.41 0.00 0.00 30.24 31.53 1wdl n GLN 244 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1wdl n ALA 245 N -1.83 1.54 -0.63 1.69 0.00 0.10 -5.08 120.51 116.30 1wdl n ALA 245 Ca 0.00 -1.17 0.08 0.00 0.00 0.00 0.00 53.44 52.35 1wdl n ALA 245 Cb 0.43 -0.12 -0.03 0.00 0.00 0.00 0.00 19.45 19.73 1wdl n ALA 245 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wdl n GLY 246 N 1.96 -2.04 0.40 0.00 0.00 -0.95 -4.35 105.19 100.21 1wdl n GLY 246 Ca -0.32 -1.34 0.36 0.00 0.00 0.00 0.00 46.02 44.72 1wdl n GLY 246 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1wdl n PRO 247 N -3.03 -0.05 -2.94 1.61 -0.02 -1.26 -3.44 135.00 125.88 1wdl n PRO 247 Ca -0.01 1.29 -0.44 0.00 -2.02 0.00 0.00 63.50 62.32 1wdl n PRO 247 Cb 0.29 -2.44 -0.01 0.00 -0.02 0.00 0.00 33.50 31.32 1wdl n PRO 247 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1wdl s ASN 248 N -4.38 6.88 -0.71 2.55 4.22 -1.10 -4.76 114.94 117.64 1wdl s ASN 248 Ca -0.08 -2.59 -0.16 0.00 -2.14 0.00 0.00 52.86 47.88 1wdl s ASN 248 Cb 0.32 -2.40 0.16 0.00 1.28 0.00 0.00 41.25 40.60 1wdl s ASN 248 CO 0.79 -0.88 0.74 -0.31 -2.04 0.00 0.00 177.10 175.40 1wdl s TYR 249 N 2.06 3.35 0.00 1.54 4.12 -1.22 -4.92 117.35 122.28 1wdl s TYR 249 Ca 0.39 -1.47 0.00 0.00 0.02 0.00 0.00 57.07 56.01 1wdl s TYR 249 Cb -0.04 -3.94 0.00 0.00 -1.52 0.00 0.00 41.96 36.47 1wdl s TYR 249 CO -0.04 -1.15 0.00 -2.30 0.02 0.00 0.00 175.55 172.08 1wdl n PRO 250 N 5.27 0.00 0.02 -1.71 -0.02 -1.26 -4.67 135.00 132.63 1wdl n PRO 250 Ca 0.03 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.40 1wdl n PRO 250 Cb 0.44 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.79 1wdl n PRO 250 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wdl h ALA 251 N -2.00 0.52 -0.02 3.55 0.00 -1.81 -3.38 119.26 116.12 1wdl h ALA 251 Ca 0.00 -1.23 0.01 0.00 0.00 0.00 0.00 54.91 53.68 1wdl h ALA 251 Cb 0.00 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1wdl h ALA 251 CO 0.00 1.37 -0.11 -1.35 0.00 0.00 0.00 179.25 179.16 1wdl h PRO 252 N 0.02 -0.12 0.00 0.00 0.11 -1.87 0.99 132.00 131.13 1wdl h PRO 252 Ca -0.22 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.89 1wdl h PRO 252 Cb 1.96 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 33.09 1wdl h PRO 252 CO 0.11 -0.08 -0.05 0.28 -0.21 0.00 0.00 178.00 178.05 1wdl h VAL 253 N -0.13 0.13 0.19 3.15 2.07 -1.86 -3.17 116.25 116.64 1wdl h VAL 253 Ca 0.01 -0.64 -0.35 0.00 0.82 0.00 0.00 66.70 66.54 1wdl h VAL 253 Cb 0.14 1.56 0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1wdl h VAL 253 CO -0.09 0.05 -1.73 -0.33 0.02 0.00 0.00 177.57 175.49 1wdl h GLU 254 N 0.00 0.40 -0.79 1.57 4.39 -1.71 -3.24 114.58 115.19 1wdl h GLU 254 Ca -0.00 -0.68 0.14 0.00 0.34 0.00 0.00 59.36 59.16 1wdl h GLU 254 Cb 0.55 0.25 -0.09 0.00 -0.10 0.00 0.00 28.75 29.36 1wdl h GLU 254 CO 0.01 1.32 0.36 0.00 -1.16 0.00 0.00 179.01 179.54 1wdl h ALA 255 N 0.13 1.16 -0.36 3.43 0.00 -0.77 -0.00 119.26 122.85 1wdl h ALA 255 Ca -0.34 0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1wdl h ALA 255 Cb 2.10 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.92 1wdl h ALA 255 CO 0.18 -0.16 -0.23 0.82 0.00 0.00 0.00 179.25 179.86 1wdl h ILE 256 N 0.52 1.27 -0.10 0.00 2.04 -1.69 -2.09 117.51 117.46 1wdl h ILE 256 Ca 0.44 -1.33 -0.07 0.00 1.00 0.00 0.00 64.86 64.90 1wdl h ILE 256 Cb 0.64 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 1wdl h ILE 256 CO -0.39 0.44 -0.26 0.11 0.00 0.00 0.00 178.15 178.06 1wdl h LYS 257 N 0.61 0.17 -0.06 2.37 1.57 -1.08 0.38 116.57 120.53 1wdl h LYS 257 Ca 0.09 -0.05 -0.22 0.00 -1.87 0.00 0.00 60.65 58.59 1wdl h LYS 257 Cb 0.73 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 33.03 1wdl h LYS 257 CO 0.06 0.42 -0.87 1.15 -0.57 0.00 0.00 179.45 179.64 1wdl h THR 258 N 0.16 1.34 -0.10 -0.16 2.02 -0.86 -2.70 112.91 112.61 1wdl h THR 258 Ca 0.03 -2.22 -0.20 0.00 0.77 0.00 0.00 66.41 64.78 1wdl h THR 258 Cb 0.54 2.23 0.00 0.00 -1.74 0.00 0.00 68.15 69.18 1wdl h THR 258 CO 0.04 0.68 -0.77 0.40 0.37 0.00 0.00 175.52 176.23 1wdl h ILE 259 N 0.35 1.34 -0.20 3.11 2.04 -1.07 -1.64 117.51 121.43 1wdl h ILE 259 Ca -0.07 -2.10 -0.07 0.00 1.00 0.00 0.00 64.86 63.62 1wdl h ILE 259 Cb 1.49 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 39.65 1wdl h ILE 259 CO 0.16 0.65 -0.18 -0.61 0.00 0.00 0.00 178.15 178.17 1wdl h GLN 260 N 0.37 0.35 0.13 2.37 4.15 -0.95 -1.37 115.11 120.15 1wdl h GLN 260 Ca -0.05 -0.10 -0.19 0.00 0.77 0.00 0.00 58.65 59.08 1wdl h GLN 260 Cb 1.37 -0.04 0.02 0.00 0.21 0.00 0.00 27.48 29.04 1wdl h GLN 260 CO 0.14 0.52 -0.88 0.87 -1.93 0.00 0.00 178.83 177.55 1wdl h LYS 261 N 0.32 0.27 -0.40 1.69 1.57 -1.45 -3.29 116.57 115.28 1wdl h LYS 261 Ca 0.06 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1wdl h LYS 261 Cb 0.50 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1wdl h LYS 261 CO 0.03 1.22 0.00 0.00 -0.57 0.00 0.00 179.45 180.13 1wdl n ALA 262 N -2.73 2.56 0.10 3.86 0.00 -0.62 -4.26 120.51 119.42 1wdl n ALA 262 Ca -0.16 -0.24 -0.13 0.00 0.00 0.00 0.00 53.44 52.91 1wdl n ALA 262 Cb 0.82 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.19 1wdl n ALA 262 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wdl h ALA 263 N 2.90 -0.16 -0.14 0.00 0.00 -1.32 -2.85 119.26 117.68 1wdl h ALA 263 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1wdl h ALA 263 Cb 0.35 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1wdl h ALA 263 CO 0.03 -0.58 0.00 0.09 0.00 0.00 0.00 179.25 178.78 1wdl n ASN 264 N -5.15 0.86 -4.90 0.00 3.02 -1.26 -1.82 115.26 106.01 1wdl n ASN 264 Ca -0.08 -1.89 -0.20 0.00 -0.03 0.00 0.00 54.58 52.38 1wdl n ASN 264 Cb 0.10 -0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 1wdl n ASN 264 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1wdl s PHE 265 N -1.81 2.96 0.11 3.10 2.99 -1.08 -4.71 117.98 119.55 1wdl s PHE 265 Ca 0.16 -0.28 -0.00 0.00 0.00 0.00 0.00 56.93 56.80 1wdl s PHE 265 Cb 0.08 -1.89 0.02 0.00 0.00 0.00 0.00 43.02 41.24 1wdl s PHE 265 CO 0.12 0.10 0.16 0.41 -0.00 0.00 0.00 175.22 176.00 1wdl n GLY 266 N -1.48 0.72 0.16 4.36 0.00 -1.26 -3.50 105.19 104.20 1wdl n GLY 266 Ca -0.01 -1.96 -0.06 0.00 0.00 0.00 0.00 46.02 43.99 1wdl n GLY 266 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1wdl h ARG 267 N 0.00 -0.26 -0.81 1.61 2.43 -1.64 0.04 114.38 115.74 1wdl h ARG 267 Ca -0.05 0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.27 1wdl h ARG 267 Cb 0.19 0.06 -0.14 0.00 -0.42 0.00 0.00 29.97 29.66 1wdl h ARG 267 CO 0.05 -0.17 -0.35 -0.44 -1.51 0.00 0.00 179.97 177.55 1wdl h ASP 268 N -0.27 -1.26 0.25 -3.80 3.32 -1.94 0.34 116.42 113.06 1wdl h ASP 268 Ca -0.00 0.27 -0.12 0.00 0.02 0.00 0.00 57.03 57.19 1wdl h ASP 268 Cb 0.26 0.66 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 1wdl h ASP 268 CO -0.09 -0.29 -0.48 0.11 -1.72 0.00 0.00 179.24 176.77 1wdl h LYS 269 N -0.07 0.28 -0.49 3.56 1.57 -1.93 -2.91 116.57 116.58 1wdl h LYS 269 Ca 0.30 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.83 1wdl h LYS 269 Cb 0.58 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 1wdl h LYS 269 CO -0.85 0.70 -0.12 0.00 -0.57 0.00 0.00 179.45 178.61 1wdl h ALA 270 N 1.28 0.87 -0.95 3.86 0.00 0.11 -2.68 119.26 121.75 1wdl h ALA 270 Ca 0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1wdl h ALA 270 Cb 0.93 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 1wdl h ALA 270 CO 0.08 0.64 0.57 -0.07 0.00 0.00 0.00 179.25 180.47 1wdl h LEU 271 N 0.82 1.14 -0.92 0.00 3.38 -0.28 -0.93 115.31 118.52 1wdl h LEU 271 Ca 0.13 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1wdl h LEU 271 Cb 0.65 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 1wdl h LEU 271 CO 0.04 0.88 0.53 -0.33 0.09 0.00 0.00 178.44 179.65 1wdl h GLU 272 N 1.31 1.26 -0.20 1.13 5.08 -1.30 0.74 114.58 122.60 1wdl h GLU 272 Ca 0.34 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1wdl h GLU 272 Cb -0.05 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 28.93 1wdl h GLU 272 CO -0.06 0.90 0.04 0.28 -1.00 0.00 0.00 179.01 179.17 1wdl h VAL 273 N 1.27 1.22 -0.47 3.13 2.07 -1.07 -1.06 116.25 121.33 1wdl h VAL 273 Ca 0.33 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 67.18 1wdl h VAL 273 Cb -0.02 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1wdl h VAL 273 CO -0.06 0.22 0.22 -0.08 0.02 0.00 0.00 177.57 177.89 1wdl h GLU 274 N 0.14 0.42 -0.26 1.57 4.81 -0.72 -1.75 114.58 118.79 1wdl h GLU 274 Ca 0.06 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1wdl h GLU 274 Cb 0.30 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1wdl h GLU 274 CO 0.00 0.28 0.12 0.00 -0.73 0.00 0.00 179.01 178.68 1wdl h ALA 275 N 1.27 0.34 0.26 2.92 0.00 -0.72 -1.01 119.26 122.33 1wdl h ALA 275 Ca 0.21 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1wdl h ALA 275 Cb 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1wdl h ALA 275 CO -0.17 -0.09 -0.22 0.00 0.00 0.00 0.00 179.25 178.77 1wdl h ALA 276 N 0.97 -0.48 -0.11 0.00 0.00 -0.90 -1.74 119.26 117.00 1wdl h ALA 276 Ca 0.09 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1wdl h ALA 276 Cb 0.14 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1wdl h ALA 276 CO -0.01 -0.80 -0.10 0.78 0.00 0.00 0.00 179.25 179.13 1wdl h GLY 277 N -0.50 0.17 1.58 0.00 0.00 -1.32 -2.05 103.07 100.94 1wdl h GLY 277 Ca -0.01 -0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 1wdl h GLY 277 CO -0.02 0.09 -0.04 -2.75 0.00 0.00 0.00 176.54 173.82 1wdl h PHE 278 N 0.16 0.54 -0.17 5.60 3.57 -0.67 -2.55 116.94 123.41 1wdl h PHE 278 Ca 0.03 -0.06 -0.17 0.00 3.53 0.00 0.00 57.97 61.30 1wdl h PHE 278 Cb 0.28 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.86 1wdl h PHE 278 CO 0.00 0.56 -0.61 0.00 -2.23 0.00 0.00 178.31 176.03 1wdl h ALA 279 N 1.47 0.62 -0.02 2.41 0.00 -0.62 -2.71 119.26 120.42 1wdl h ALA 279 Ca 0.10 -0.54 0.01 0.00 0.00 0.00 0.00 54.91 54.48 1wdl h ALA 279 Cb 0.38 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1wdl h ALA 279 CO 0.02 0.70 0.02 -0.22 0.00 0.00 0.00 179.25 179.77 1wdl h LYS 280 N 0.43 0.00 0.00 0.00 3.64 -1.15 0.46 116.57 119.95 1wdl h LYS 280 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1wdl h LYS 280 Cb 1.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1wdl h LYS 280 CO 0.11 0.00 -1.04 1.28 -2.27 0.00 0.00 179.45 177.53 1wdl n LEU 281 N -3.98 0.61 -0.00 5.20 4.77 -1.12 -4.44 117.00 118.03 1wdl n LEU 281 Ca -0.03 -0.04 0.03 0.00 -0.03 0.00 0.00 56.01 55.94 1wdl n LEU 281 Cb 0.11 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.07 1wdl n LEU 281 CO 0.29 0.05 -0.24 0.00 -1.33 0.00 0.00 177.39 176.16 1wdl n ALA 282 N -1.82 2.50 -0.35 -1.18 0.00 -0.39 -4.71 120.51 114.56 1wdl n ALA 282 Ca 0.02 -0.14 -0.28 0.00 0.00 0.00 0.00 53.44 53.04 1wdl n ALA 282 Cb 0.43 -0.19 0.26 0.00 0.00 0.00 0.00 19.45 19.95 1wdl n ALA 282 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1wdl n LYS 283 N -1.36 -3.81 0.00 0.00 0.00 0.15 -4.73 118.16 108.42 1wdl n LYS 283 Ca 0.00 -1.12 0.00 0.00 -0.00 0.00 0.00 58.31 57.19 1wdl n LYS 283 Cb 0.11 -1.88 0.00 0.00 -0.00 0.00 0.00 35.03 33.25 1wdl n LYS 283 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1wdl n THR 284 N -5.37 0.00 -1.26 0.58 -2.24 -1.26 -4.57 114.28 100.16 1wdl n THR 284 Ca 0.09 0.00 -0.48 0.00 -2.27 0.00 0.00 64.05 61.39 1wdl n THR 284 Cb 0.55 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.66 1wdl n THR 284 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1wdl n SER 285 N 0.00 0.52 0.00 3.42 7.64 -1.26 -3.99 113.62 119.95 1wdl n SER 285 Ca 0.00 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.32 1wdl n SER 285 Cb 0.00 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 1wdl n SER 285 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wdl n ALA 286 N 8.14 0.00 -2.56 -0.43 0.00 -1.26 -4.94 120.51 119.45 1wdl n ALA 286 Ca 0.55 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.98 1wdl n ALA 286 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1wdl n ALA 286 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wdl n SER 287 N 0.00 -6.13 -2.69 0.00 2.88 -1.26 -5.02 113.62 101.40 1wdl n SER 287 Ca 0.00 0.06 -0.07 0.00 -1.33 0.00 0.00 58.87 57.53 1wdl n SER 287 Cb 0.00 -4.07 0.10 0.00 -0.75 0.00 0.00 64.21 59.49 1wdl n SER 287 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1wdl n ASN 288 N -1.23 -1.01 -4.37 -3.46 5.15 -1.26 -4.81 115.26 104.28 1wdl n ASN 288 Ca 0.02 -2.50 -0.38 0.00 -0.60 0.00 0.00 54.58 51.12 1wdl n ASN 288 Cb 0.45 0.60 -0.03 0.00 -0.53 0.00 0.00 39.78 40.28 1wdl n ASN 288 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wdl n LEU 290 N 10.00 1.55 -0.07 0.00 0.00 -1.12 -2.70 117.00 124.65 1wdl n LEU 290 Ca 0.48 -0.75 -0.14 0.00 0.00 0.00 0.00 56.01 55.60 1wdl n LEU 290 Cb 0.45 -0.18 -0.11 0.00 0.00 0.00 0.00 43.42 43.58 1wdl n LEU 290 CO 0.79 0.38 0.18 0.40 0.00 0.00 0.00 177.39 179.13 1wdl h ILE 291 N 1.75 1.44 -0.39 1.96 2.04 -1.87 -3.32 117.51 119.12 1wdl h ILE 291 Ca 0.00 -2.17 0.11 0.00 1.00 0.00 0.00 64.86 63.81 1wdl h ILE 291 Cb 0.40 2.81 -0.02 0.00 -0.74 0.00 0.00 36.82 39.27 1wdl h ILE 291 CO 0.00 0.49 0.33 1.23 0.00 0.00 0.00 178.15 180.20 1wdl h GLY 292 N -1.00 0.00 0.45 5.37 0.00 -1.93 -1.50 103.07 104.46 1wdl h GLY 292 Ca -0.06 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.33 1wdl h GLY 292 CO -0.04 0.00 -0.04 1.41 0.00 0.00 0.00 176.54 177.87 1wdl h LEU 293 N 0.00 -0.21 -0.50 3.11 3.38 -1.72 0.18 115.31 119.55 1wdl h LEU 293 Ca 0.19 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.13 1wdl h LEU 293 Cb 0.84 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 1wdl h LEU 293 CO -0.00 -0.07 -0.52 -0.26 0.09 0.00 0.00 178.44 177.68 1wdl h PHE 294 N 0.04 0.00 0.00 1.13 -1.00 -1.46 0.83 116.94 116.48 1wdl h PHE 294 Ca 0.15 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.88 1wdl h PHE 294 Cb 0.21 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.77 1wdl h PHE 294 CO -0.26 0.52 -0.24 1.25 -1.61 0.00 0.00 178.31 177.97 1wdl h LEU 295 N 0.00 0.00 0.06 1.54 6.46 -0.74 0.28 115.31 122.91 1wdl h LEU 295 Ca -0.01 0.00 -0.38 0.00 -0.12 0.00 0.00 57.88 57.38 1wdl h LEU 295 Cb 1.19 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 41.07 1wdl h LEU 295 CO 0.07 0.24 -2.21 0.59 -0.62 0.00 0.00 178.44 176.51 1wdl n ASN 296 N -3.57 2.05 -0.06 1.25 5.03 0.53 -4.29 115.26 116.21 1wdl n ASN 296 Ca -0.01 0.06 -0.11 0.00 0.87 0.00 0.00 54.58 55.39 1wdl n ASN 296 Cb 0.39 -0.66 -0.05 0.00 -1.02 0.00 0.00 39.78 38.44 1wdl n ASN 296 CO 0.00 0.00 0.00 -0.78 -1.83 0.00 0.00 177.26 174.65 1wdl h ASP 297 N -0.00 0.33 0.00 6.41 1.82 0.84 -1.64 116.42 124.18 1wdl h ASP 297 Ca -0.50 -0.29 0.00 0.00 -0.39 0.00 0.00 57.03 55.85 1wdl h ASP 297 Cb 1.95 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 41.87 1wdl h ASP 297 CO -0.01 0.54 0.00 0.00 -1.61 0.00 0.00 179.24 178.16 1wdl n GLN 298 N -4.71 0.49 -0.03 0.28 1.13 0.96 -0.81 117.38 114.68 1wdl n GLN 298 Ca -0.04 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.01 1wdl n GLN 298 Cb 0.21 -1.47 -0.07 0.00 0.11 0.00 0.00 30.24 29.02 1wdl n GLN 298 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1wdl n GLU 299 N -0.97 1.55 0.03 -1.09 1.02 -1.01 -4.29 120.64 115.88 1wdl n GLU 299 Ca 0.11 -0.04 -0.22 0.00 -0.02 0.00 0.00 57.16 56.99 1wdl n GLU 299 Cb 0.05 -1.24 -0.14 0.00 -0.02 0.00 0.00 31.44 30.09 1wdl n GLU 299 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1wdl h LEU 300 N 0.00 0.49 -2.12 -4.62 3.38 -0.71 -2.18 115.31 109.55 1wdl h LEU 300 Ca -0.14 -0.92 -0.00 0.00 0.09 0.00 0.00 57.88 56.91 1wdl h LEU 300 Cb 1.09 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 1wdl h LEU 300 CO 0.01 1.77 -0.00 0.11 0.09 0.00 0.00 178.44 180.42 1wdl h LYS 301 N -0.02 0.00 0.08 1.13 1.79 -1.23 0.35 116.57 118.66 1wdl h LYS 301 Ca -0.36 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 57.82 1wdl h LYS 301 Cb 1.99 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.62 1wdl h LYS 301 CO 0.11 0.00 -1.56 0.87 -1.08 0.00 0.00 179.45 177.79 1wdl h LYS 302 N 0.00 0.17 -0.80 3.15 1.79 -1.75 -3.12 116.57 116.01 1wdl h LYS 302 Ca -0.00 -0.29 -0.02 0.00 -2.18 0.00 0.00 60.65 58.16 1wdl h LYS 302 Cb 0.00 0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 30.72 1wdl h LYS 302 CO 0.00 1.14 0.41 -0.22 -1.08 0.00 0.00 179.45 179.70 1wdl h LYS 303 N -0.41 1.13 -0.20 3.15 3.64 -1.02 -2.28 116.57 120.59 1wdl h LYS 303 Ca -0.36 -0.15 -0.06 0.00 -1.27 0.00 0.00 60.65 58.81 1wdl h LYS 303 Cb 1.70 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 33.30 1wdl h LYS 303 CO -0.02 0.86 -0.10 0.00 -2.27 0.00 0.00 179.45 177.92 1wdl h ALA 304 N 1.21 0.28 -0.91 5.00 0.00 -0.49 -2.99 119.26 121.35 1wdl h ALA 304 Ca 0.28 -0.29 0.11 0.00 0.00 0.00 0.00 54.91 55.00 1wdl h ALA 304 Cb 0.08 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.72 1wdl h ALA 304 CO -0.04 0.11 0.55 -0.22 0.00 0.00 0.00 179.25 179.65 1wdl h LYS 305 N 0.11 0.87 -0.16 0.00 3.64 -1.45 0.25 116.57 119.83 1wdl h LYS 305 Ca 0.04 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1wdl h LYS 305 Cb 0.59 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1wdl h LYS 305 CO 0.03 0.58 -0.03 0.28 -2.27 0.00 0.00 179.45 178.04 1wdl h VAL 306 N 0.90 1.13 0.00 2.00 2.07 -1.36 -0.87 116.25 120.11 1wdl h VAL 306 Ca 0.44 -0.50 -0.16 0.00 0.82 0.00 0.00 66.70 67.30 1wdl h VAL 306 Cb 0.41 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1wdl h VAL 306 CO -0.25 0.16 -0.77 1.88 0.02 0.00 0.00 177.57 178.61 1wdl h TYR 307 N 0.24 0.00 0.00 1.57 0.99 -0.49 -3.28 116.97 115.99 1wdl h TYR 307 Ca 0.06 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.75 1wdl h TYR 307 Cb 0.21 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 37.94 1wdl h TYR 307 CO 0.00 0.77 -0.15 -0.44 -0.00 0.00 0.00 178.16 178.34 1wdl h ASP 308 N 0.00 0.00 -0.41 3.88 3.32 0.64 -2.00 116.42 121.86 1wdl h ASP 308 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1wdl h ASP 308 Cb 1.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.97 1wdl h ASP 308 CO 0.10 0.15 0.00 0.29 -1.72 0.00 0.00 179.24 178.06 1wdl n LYS 309 N -3.32 2.30 -0.07 3.56 5.02 -1.07 -4.19 118.16 120.40 1wdl n LYS 309 Ca 0.00 -1.98 -0.14 0.00 -2.02 0.00 0.00 58.31 54.17 1wdl n LYS 309 Cb 0.39 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 1wdl n LYS 309 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1wdl n ILE 310 N 1.16 0.82 -1.54 -0.18 5.41 -1.06 -5.04 119.36 118.93 1wdl n ILE 310 Ca 0.19 -0.24 -0.41 0.00 1.00 0.00 0.00 62.75 63.29 1wdl n ILE 310 Cb 0.51 -1.49 0.01 0.00 -0.71 0.00 0.00 39.64 37.97 1wdl n ILE 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1wdl n ALA 311 N -3.44 -0.56 -1.54 -1.39 0.00 -0.78 -4.97 120.51 107.83 1wdl n ALA 311 Ca -0.28 0.18 -0.30 0.00 0.00 0.00 0.00 53.44 53.04 1wdl n ALA 311 Cb 0.73 -1.95 0.10 0.00 0.00 0.00 0.00 19.45 18.33 1wdl n ALA 311 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1wdl s LYS 312 N -1.90 1.85 0.32 0.00 1.02 -1.26 -4.94 119.74 114.82 1wdl s LYS 312 Ca 0.64 0.56 -0.28 0.00 0.02 0.00 0.00 55.97 56.91 1wdl s LYS 312 Cb -0.56 -1.90 -0.09 0.00 -0.52 0.00 0.00 37.83 34.75 1wdl s LYS 312 CO 0.56 -1.77 1.13 0.16 -0.92 0.00 0.00 175.35 174.52 1wdl s ASP 313 N -3.93 7.04 -0.65 2.83 1.47 -1.26 -4.89 116.67 117.29 1wdl s ASP 313 Ca 0.62 2.32 0.03 0.00 1.18 0.00 0.00 52.55 56.70 1wdl s ASP 313 Cb -0.15 -2.62 0.37 0.00 -0.34 0.00 0.00 42.92 40.18 1wdl s ASP 313 CO 0.54 -0.31 1.31 1.33 0.68 0.00 0.00 175.17 178.72 1wdl n VAL 314 N 0.85 3.41 0.22 2.11 0.24 -1.26 -4.79 118.33 119.11 1wdl n VAL 314 Ca 0.00 -5.23 0.07 0.00 -2.04 0.00 0.00 64.34 57.14 1wdl n VAL 314 Cb 0.45 -1.36 0.52 0.00 -1.47 0.00 0.00 33.84 31.99 1wdl n VAL 314 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1wdl h LYS 315 N 3.04 0.00 -3.94 7.34 1.57 -1.94 -3.42 116.57 119.22 1wdl h LYS 315 Ca 0.32 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.67 1wdl h LYS 315 Cb 0.54 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 32.49 1wdl h LYS 315 CO 0.98 0.23 -0.77 -1.14 -0.57 0.00 0.00 179.45 178.17 1wdl s GLN 316 N -4.31 0.84 0.40 3.15 2.00 -1.26 -4.14 119.66 116.33 1wdl s GLN 316 Ca -0.03 -0.05 0.03 0.00 -2.00 0.00 0.00 55.36 53.31 1wdl s GLN 316 Cb 0.14 -0.96 -0.03 0.00 0.80 0.00 0.00 33.01 32.96 1wdl s GLN 316 CO 0.67 -0.17 0.10 0.00 -0.50 0.00 0.00 175.29 175.39 1wdl s ALA 317 N 1.34 2.90 -0.13 1.58 0.00 -0.66 0.11 121.76 126.90 1wdl s ALA 317 Ca -0.04 -1.34 -0.30 0.00 0.00 0.00 0.00 51.96 50.27 1wdl s ALA 317 Cb -0.13 0.67 0.11 0.00 0.00 0.00 0.00 23.12 23.77 1wdl s ALA 317 CO -0.02 -0.30 0.92 0.00 0.00 0.00 0.00 175.76 176.35 1wdl s ALA 318 N -3.20 -1.89 0.01 0.00 0.00 -1.12 -2.15 121.76 113.41 1wdl s ALA 318 Ca 0.25 1.52 0.06 0.00 0.00 0.00 0.00 51.96 53.79 1wdl s ALA 318 Cb 0.04 -0.53 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 1wdl s ALA 318 CO 0.14 -0.33 -0.18 0.54 0.00 0.00 0.00 175.76 175.93 1wdl s VAL 319 N -1.14 1.42 -0.47 0.00 0.11 0.40 -0.97 120.40 119.76 1wdl s VAL 319 Ca -0.04 -0.94 -0.18 0.00 -2.93 0.00 0.00 61.98 57.89 1wdl s VAL 319 Cb -0.00 -1.22 0.04 0.00 -1.53 0.00 0.00 36.38 33.67 1wdl s VAL 319 CO 0.04 0.26 0.55 -0.76 -3.33 0.00 0.00 175.10 171.86 1wdl s LEU 320 N -0.79 4.92 0.00 2.54 1.43 0.17 -1.54 118.68 125.41 1wdl s LEU 320 Ca 0.06 -0.79 0.00 0.00 -1.03 0.00 0.00 54.13 52.37 1wdl s LEU 320 Cb -0.08 -2.45 0.00 0.00 0.03 0.00 0.00 46.19 43.69 1wdl s LEU 320 CO 0.00 -0.76 0.00 0.61 0.23 0.00 0.00 176.35 176.44 1wdl n GLY 321 N 5.13 2.05 0.00 -3.19 0.00 0.22 -0.46 105.19 108.94 1wdl n GLY 321 Ca -0.06 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1wdl n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdl n ALA 322 N 2.33 0.00 0.00 4.61 0.00 -1.26 -3.70 120.51 122.49 1wdl n ALA 322 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wdl n ALA 322 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1wdl n ALA 322 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wdl n GLY 323 N 5.00 1.37 0.00 0.00 0.00 -1.25 -4.03 105.19 106.28 1wdl n GLY 323 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1wdl n GLY 323 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wdl n ILE 324 N 0.00 0.00 0.04 -0.61 5.41 -1.26 -3.09 119.36 119.85 1wdl n ILE 324 Ca 0.00 0.48 -0.04 0.00 1.00 0.00 0.00 62.75 64.19 1wdl n ILE 324 Cb 0.00 -1.03 0.17 0.00 -0.71 0.00 0.00 39.64 38.07 1wdl n ILE 324 CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 1wdl h MET 325 N 0.00 0.41 -0.46 0.38 2.86 -1.92 -3.09 114.93 113.10 1wdl h MET 325 Ca 0.00 -0.19 -0.08 0.00 -2.06 0.00 0.00 59.70 57.37 1wdl h MET 325 Cb 0.00 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1wdl h MET 325 CO 0.00 0.73 -0.03 0.78 1.06 0.00 0.00 176.91 179.45 1wdl h GLY 326 N 1.12 0.90 2.00 8.32 0.00 -1.70 -1.82 103.07 111.89 1wdl h GLY 326 Ca 0.04 -0.69 -0.02 0.00 0.00 0.00 0.00 47.33 46.66 1wdl h GLY 326 CO 0.07 0.63 -0.11 -1.33 0.00 0.00 0.00 176.54 175.79 1wdl h GLY 327 N 0.68 0.00 0.07 4.60 0.00 -1.51 -1.36 103.07 105.55 1wdl h GLY 327 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 1wdl h GLY 327 CO 0.03 0.00 -0.15 -1.33 0.00 0.00 0.00 176.54 175.09 1wdl h GLY 328 N 0.81 0.04 1.50 4.60 0.00 -1.41 -1.98 103.07 106.64 1wdl h GLY 328 Ca -0.00 -0.09 0.02 0.00 0.00 0.00 0.00 47.33 47.26 1wdl h GLY 328 CO 0.01 0.08 0.29 -2.22 0.00 0.00 0.00 176.54 174.71 1wdl h ILE 329 N -0.93 1.07 -0.09 2.60 2.04 -1.20 0.21 117.51 121.21 1wdl h ILE 329 Ca -0.03 -0.18 -0.23 0.00 1.00 0.00 0.00 64.86 65.41 1wdl h ILE 329 Cb 1.08 0.50 0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1wdl h ILE 329 CO 0.01 0.10 -0.86 0.00 0.00 0.00 0.00 178.15 177.39 1wdl h ALA 330 N 1.74 0.23 0.48 1.87 0.00 -1.34 -2.19 119.26 120.04 1wdl h ALA 330 Ca 0.17 -0.63 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1wdl h ALA 330 Cb 0.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1wdl h ALA 330 CO -0.04 0.66 -0.23 -0.92 0.00 0.00 0.00 179.25 178.72 1wdl h TYR 331 N 0.45 -0.60 -0.69 0.00 3.20 -0.44 -0.42 116.97 118.47 1wdl h TYR 331 Ca -0.08 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.81 1wdl h TYR 331 Cb 1.50 0.20 -0.05 0.00 1.54 0.00 0.00 36.73 39.92 1wdl h TYR 331 CO 0.10 -0.32 0.42 1.96 -1.64 0.00 0.00 178.16 178.67 1wdl h GLN 332 N -0.74 0.78 0.00 1.82 1.08 -0.72 0.18 115.11 117.51 1wdl h GLN 332 Ca -0.07 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.03 1wdl h GLN 332 Cb 0.54 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 1wdl h GLN 332 CO 0.11 0.52 -0.25 1.03 -0.95 0.00 0.00 178.83 179.28 1wdl h SER 333 N 0.81 0.00 0.26 1.46 0.87 -1.33 -2.93 113.55 112.68 1wdl h SER 333 Ca 0.29 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.51 1wdl h SER 333 Cb 0.07 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1wdl h SER 333 CO -0.13 0.25 -1.64 0.00 -0.53 0.00 0.00 176.83 174.78 1wdl h ALA 334 N 1.75 0.09 0.00 6.23 0.00 -0.08 -0.32 119.26 126.92 1wdl h ALA 334 Ca -0.00 -1.06 0.00 0.00 0.00 0.00 0.00 54.91 53.85 1wdl h ALA 334 Cb 0.65 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1wdl h ALA 334 CO 0.03 0.96 0.00 0.43 0.00 0.00 0.00 179.25 180.67 1wdl n SER 335 N -3.60 0.00 -0.30 0.00 7.64 0.53 -3.07 113.62 114.82 1wdl n SER 335 Ca -0.21 0.03 0.08 0.00 1.01 0.00 0.00 58.87 59.78 1wdl n SER 335 Cb 1.08 -0.30 0.15 0.00 -1.01 0.00 0.00 64.21 64.13 1wdl n SER 335 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1wdl n LYS 336 N -1.30 2.01 -2.48 1.43 4.76 -1.12 -5.00 118.16 116.47 1wdl n LYS 336 Ca 0.10 -2.47 -0.03 0.00 -2.87 0.00 0.00 58.31 53.03 1wdl n LYS 336 Cb 0.17 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.87 1wdl n LYS 336 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wdl n GLY 337 N -0.97 0.55 2.53 0.72 0.00 -1.17 -4.90 105.19 101.94 1wdl n GLY 337 Ca 0.15 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.41 1wdl n GLY 337 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wdl s THR 338 N -3.05 -0.04 -0.14 2.61 2.01 -0.13 -5.02 115.64 111.87 1wdl s THR 338 Ca 0.05 -0.88 -0.37 0.00 0.31 0.00 0.00 61.69 60.80 1wdl s THR 338 Cb -0.02 -1.00 -0.14 0.00 0.01 0.00 0.00 72.50 71.35 1wdl s THR 338 CO 0.11 -0.76 1.78 -2.65 -0.69 0.00 0.00 174.62 172.41 1wdl n PRO 339 N 5.09 1.71 -4.68 4.92 -0.02 -1.26 -3.89 135.00 136.87 1wdl n PRO 339 Ca -0.04 0.63 -0.25 0.00 -2.02 0.00 0.00 63.50 61.82 1wdl n PRO 339 Cb 0.41 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.36 1wdl n PRO 339 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1wdl s ILE 340 N 3.49 1.60 -0.18 4.25 2.07 -0.59 -1.66 121.20 130.18 1wdl s ILE 340 Ca 0.94 -1.11 -0.09 0.00 -1.41 0.00 0.00 60.65 58.98 1wdl s ILE 340 Cb -0.86 -1.38 -0.05 0.00 0.13 0.00 0.00 42.46 40.30 1wdl s ILE 340 CO 0.56 0.24 0.12 -0.76 -1.91 0.00 0.00 174.94 173.18 1wdl s LEU 341 N -1.03 4.14 -0.78 8.50 1.43 -0.91 -0.88 118.68 129.14 1wdl s LEU 341 Ca 0.07 0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 53.25 1wdl s LEU 341 Cb -0.08 -2.06 0.19 0.00 0.03 0.00 0.00 46.19 44.27 1wdl s LEU 341 CO 0.01 0.21 0.76 -0.04 0.23 0.00 0.00 176.35 177.52 1wdl s MET 342 N 0.17 3.49 0.18 1.70 -1.94 -0.73 -0.45 119.30 121.72 1wdl s MET 342 Ca 0.08 -2.24 -0.23 0.00 -1.71 0.00 0.00 55.69 51.59 1wdl s MET 342 Cb -0.11 -4.45 -0.08 0.00 2.01 0.00 0.00 34.83 32.20 1wdl s MET 342 CO -0.01 -1.35 0.74 0.21 -0.01 0.00 0.00 175.02 174.60 1wdl s LYS 343 N 0.71 4.42 0.36 2.03 2.36 -0.59 -2.25 119.74 126.79 1wdl s LYS 343 Ca 0.17 1.02 -0.16 0.00 -2.55 0.00 0.00 55.97 54.45 1wdl s LYS 343 Cb -0.13 -3.11 0.04 0.00 -1.05 0.00 0.00 37.83 33.58 1wdl s LYS 343 CO -0.07 0.51 0.76 0.34 1.55 0.00 0.00 175.35 178.44 1wdl s ASP 344 N -1.33 0.00 -0.15 1.43 -1.08 -0.96 0.69 116.67 115.27 1wdl s ASP 344 Ca 0.38 -1.06 0.16 0.00 -0.52 0.00 0.00 52.55 51.50 1wdl s ASP 344 Cb -0.20 0.82 -0.22 0.00 -1.46 0.00 0.00 42.92 41.85 1wdl s ASP 344 CO 0.24 -1.60 0.10 2.30 0.52 0.00 0.00 175.17 176.72 1wdl n ILE 345 N -0.52 1.04 -4.59 4.11 -5.35 -1.26 -4.35 119.36 108.44 1wdl n ILE 345 Ca -0.07 -0.69 -0.26 0.00 -0.27 0.00 0.00 62.75 61.46 1wdl n ILE 345 Cb 0.60 -0.48 -0.14 0.00 -1.74 0.00 0.00 39.64 37.88 1wdl n ILE 345 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1wdl s ASN 346 N -4.99 2.57 0.48 7.28 2.20 -1.26 -5.02 114.94 116.20 1wdl s ASN 346 Ca -0.08 -0.56 0.19 0.00 -0.94 0.00 0.00 52.86 51.46 1wdl s ASN 346 Cb 0.06 -0.20 1.21 0.00 -2.00 0.00 0.00 41.25 40.31 1wdl s ASN 346 CO 0.71 0.15 2.01 -0.33 -2.94 0.00 0.00 177.10 176.70 1wdl h GLU 347 N 4.69 0.19 0.00 3.55 5.08 -2.00 -0.48 114.58 125.61 1wdl h GLU 347 Ca -0.44 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 57.90 1wdl h GLU 347 Cb 1.16 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 1wdl h GLU 347 CO 0.43 0.12 -0.06 0.45 -1.00 0.00 0.00 179.01 178.95 1wdl h HIS 348 N 0.19 0.00 0.06 4.33 3.86 -2.00 -2.61 115.15 118.98 1wdl h HIS 348 Ca 0.23 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.44 1wdl h HIS 348 Cb 0.65 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.12 1wdl h HIS 348 CO -0.00 0.06 -0.03 0.78 0.86 0.00 0.00 177.93 179.60 1wdl h GLY 349 N 0.45 -0.09 0.94 2.45 0.00 -1.50 -3.10 103.07 102.22 1wdl h GLY 349 Ca -0.00 0.03 0.12 0.00 0.00 0.00 0.00 47.33 47.48 1wdl h GLY 349 CO 0.01 -0.03 0.43 -2.22 0.00 0.00 0.00 176.54 174.72 1wdl h ILE 350 N -0.80 0.86 -0.17 2.60 2.04 -1.55 -0.99 117.51 119.50 1wdl h ILE 350 Ca -0.01 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1wdl h ILE 350 Cb 0.63 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1wdl h ILE 350 CO 0.01 0.07 0.09 -0.33 0.00 0.00 0.00 178.15 177.99 1wdl h GLU 351 N 0.38 0.24 -0.11 2.37 4.39 -1.51 -0.40 114.58 119.94 1wdl h GLU 351 Ca 0.30 -0.03 0.02 0.00 0.34 0.00 0.00 59.36 59.99 1wdl h GLU 351 Cb 0.66 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 1wdl h GLU 351 CO -0.08 0.25 -0.00 1.96 -1.16 0.00 0.00 179.01 179.98 1wdl h GLN 352 N 0.17 0.03 0.66 2.33 1.08 -1.13 -0.10 115.11 118.14 1wdl h GLN 352 Ca 0.06 -0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.23 1wdl h GLN 352 Cb 0.09 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1wdl h GLN 352 CO -0.01 0.02 -0.35 0.78 -0.95 0.00 0.00 178.83 178.32 1wdl h GLY 353 N 0.03 -0.99 0.77 3.46 0.00 -1.21 -1.46 103.07 103.67 1wdl h GLY 353 Ca 0.05 0.39 0.10 0.00 0.00 0.00 0.00 47.33 47.87 1wdl h GLY 353 CO -0.09 -0.36 0.54 1.41 0.00 0.00 0.00 176.54 178.04 1wdl h LEU 354 N -0.93 0.67 0.62 3.11 3.38 -1.02 -1.03 115.31 120.11 1wdl h LEU 354 Ca -0.09 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1wdl h LEU 354 Cb 0.73 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.37 1wdl h LEU 354 CO 0.12 0.39 -0.30 0.00 0.09 0.00 0.00 178.44 178.74 1wdl h ALA 355 N 1.59 -0.83 -0.87 1.53 0.00 -0.73 -0.92 119.26 119.03 1wdl h ALA 355 Ca 0.39 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1wdl h ALA 355 Cb 0.49 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1wdl h ALA 355 CO -0.16 -0.90 0.56 0.93 0.00 0.00 0.00 179.25 179.69 1wdl h GLU 356 N -0.96 1.04 -0.10 0.00 4.39 -0.91 0.24 114.58 118.28 1wdl h GLU 356 Ca -0.08 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.51 1wdl h GLU 356 Cb 0.67 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1wdl h GLU 356 CO 0.14 0.69 -0.16 0.00 -1.16 0.00 0.00 179.01 178.52 1wdl h ALA 357 N 1.37 1.56 0.04 3.43 0.00 -1.16 -2.17 119.26 122.33 1wdl h ALA 357 Ca 0.36 -0.20 -0.23 0.00 0.00 0.00 0.00 54.91 54.84 1wdl h ALA 357 Cb 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1wdl h ALA 357 CO -0.13 0.32 -1.01 0.00 0.00 0.00 0.00 179.25 178.43 1wdl h ALA 358 N 1.70 0.35 -0.06 0.00 0.00 0.33 -2.93 119.26 118.65 1wdl h ALA 358 Ca 0.03 -0.80 -0.08 0.00 0.00 0.00 0.00 54.91 54.06 1wdl h ALA 358 Cb 0.37 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1wdl h ALA 358 CO 0.02 0.98 -0.34 1.57 0.00 0.00 0.00 179.25 181.48 1wdl h LYS 359 N 0.09 0.11 0.16 0.00 2.10 0.00 -1.62 116.57 117.42 1wdl h LYS 359 Ca -0.07 -0.04 -0.28 0.00 -2.00 0.00 0.00 60.65 58.26 1wdl h LYS 359 Cb 1.70 -0.01 0.03 0.00 -0.90 0.00 0.00 32.23 33.05 1wdl h LYS 359 CO 0.16 0.45 -1.19 -0.07 -2.00 0.00 0.00 179.45 176.79 1wdl h LEU 360 N 0.10 0.77 -0.30 7.07 3.38 -1.46 -2.41 115.31 122.46 1wdl h LEU 360 Ca 0.01 -0.88 -0.03 0.00 0.09 0.00 0.00 57.88 57.08 1wdl h LEU 360 Cb 0.66 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1wdl h LEU 360 CO 0.05 1.58 0.07 -0.07 0.09 0.00 0.00 178.44 180.15 1wdl h LEU 361 N 0.08 0.46 -1.15 1.67 3.38 -1.43 -2.59 115.31 115.73 1wdl h LEU 361 Ca -0.19 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.46 1wdl h LEU 361 Cb 1.90 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.52 1wdl h LEU 361 CO 0.23 0.57 -0.25 0.58 0.09 0.00 0.00 178.44 179.66 1wdl h VAL 362 N 0.32 1.24 -0.91 1.22 2.07 -1.41 -2.71 116.25 116.07 1wdl h VAL 362 Ca 0.09 -1.14 0.12 0.00 0.82 0.00 0.00 66.70 66.60 1wdl h VAL 362 Cb 0.30 1.40 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 1wdl h VAL 362 CO 0.00 0.35 0.59 1.23 0.02 0.00 0.00 177.57 179.76 1wdl h GLY 363 N 0.97 1.33 1.50 2.17 0.00 -1.03 0.33 103.07 108.36 1wdl h GLY 363 Ca 0.04 -0.35 -0.27 0.00 0.00 0.00 0.00 47.33 46.75 1wdl h GLY 363 CO 0.04 0.15 -1.34 3.21 0.00 0.00 0.00 176.54 178.60 1wdl h ARG 364 N 0.83 0.15 -0.10 4.80 3.08 -1.36 -3.33 114.38 118.45 1wdl h ARG 364 Ca 0.44 -0.26 -0.18 0.00 0.07 0.00 0.00 59.98 60.06 1wdl h ARG 364 Cb 0.54 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 1wdl h ARG 364 CO -0.21 1.02 -0.69 0.28 -1.07 0.00 0.00 179.97 179.31 1wdl h VAL 365 N 0.04 1.36 0.00 2.04 2.07 -1.10 0.95 116.25 121.61 1wdl h VAL 365 Ca -0.16 -2.04 0.00 0.00 0.82 0.00 0.00 66.70 65.32 1wdl h VAL 365 Cb 1.94 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 33.73 1wdl h VAL 365 CO 0.15 0.62 0.00 0.47 0.02 0.00 0.00 177.57 178.83 1wdl n ASP 366 N -3.87 1.60 0.00 0.57 9.92 0.11 -2.76 116.55 122.12 1wdl n ASP 366 Ca -0.04 -1.61 0.00 0.00 -0.53 0.00 0.00 54.79 52.61 1wdl n ASP 366 Cb 0.68 -0.40 0.00 0.00 -0.64 0.00 0.00 41.12 40.76 1wdl n ASP 366 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1wdl n LYS 367 N 0.34 1.10 0.00 -1.24 3.00 -1.17 -5.03 118.16 115.17 1wdl n LYS 367 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1wdl n LYS 367 Cb 0.30 -0.26 0.00 0.00 0.00 0.00 0.00 35.03 35.07 1wdl n LYS 367 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1wdl n GLY 368 N 0.01 1.00 0.11 3.14 0.00 -0.73 -5.01 105.19 103.71 1wdl n GLY 368 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1wdl n GLY 368 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1wdl h ARG 369 N 0.97 0.00 -6.12 1.61 3.08 -1.12 -3.46 114.38 109.34 1wdl h ARG 369 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1wdl h ARG 369 Cb 0.00 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 29.76 1wdl h ARG 369 CO 0.00 0.77 -0.86 1.41 -1.07 0.00 0.00 179.97 180.22 1wdl s MET 370 N -3.25 1.65 0.20 0.04 0.00 -1.05 -4.95 119.30 111.94 1wdl s MET 370 Ca -0.00 -0.82 -0.30 0.00 0.00 0.00 0.00 55.69 54.57 1wdl s MET 370 Cb 0.12 -1.64 -0.08 0.00 0.00 0.00 0.00 34.83 33.22 1wdl s MET 370 CO 0.78 0.44 1.00 0.99 0.00 0.00 0.00 175.02 178.24 1wdl s THR 371 N -0.59 4.03 0.48 10.11 2.01 -1.26 -4.17 115.64 126.26 1wdl s THR 371 Ca 0.08 1.89 0.19 0.00 0.31 0.00 0.00 61.69 64.16 1wdl s THR 371 Cb -0.08 -4.21 0.35 0.00 0.01 0.00 0.00 72.50 68.57 1wdl s THR 371 CO -0.00 0.39 2.00 -0.65 -0.69 0.00 0.00 174.62 175.67 1wdl h PRO 372 N 4.61 0.20 0.00 4.92 0.11 -1.99 0.36 132.00 140.21 1wdl h PRO 372 Ca -0.45 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 1wdl h PRO 372 Cb 1.21 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1wdl h PRO 372 CO 0.70 0.13 -0.47 0.00 -0.21 0.00 0.00 178.00 178.14 1wdl h ALA 373 N 1.75 1.04 0.04 -0.75 0.00 -2.00 -2.79 119.26 116.54 1wdl h ALA 373 Ca 0.24 -0.43 -0.26 0.00 0.00 0.00 0.00 54.91 54.45 1wdl h ALA 373 Cb 0.67 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.40 1wdl h ALA 373 CO -0.04 0.59 -1.04 1.57 0.00 0.00 0.00 179.25 180.33 1wdl h LYS 374 N 0.00 0.64 -0.17 0.00 2.10 -0.73 -3.01 116.57 115.40 1wdl h LYS 374 Ca -0.00 -0.74 0.01 0.00 -2.00 0.00 0.00 60.65 57.92 1wdl h LYS 374 Cb 0.94 0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 32.49 1wdl h LYS 374 CO 0.06 1.32 0.12 1.98 -2.00 0.00 0.00 179.45 180.92 1wdl h MET 375 N 0.28 0.19 -0.05 0.07 -1.53 -1.02 -1.50 114.93 111.38 1wdl h MET 375 Ca -0.14 -0.01 -0.01 0.00 -3.44 0.00 0.00 59.70 56.10 1wdl h MET 375 Cb 1.71 -0.04 -0.00 0.00 -0.55 0.00 0.00 31.60 32.72 1wdl h MET 375 CO 0.20 0.13 -0.01 0.00 0.14 0.00 0.00 176.91 177.37 1wdl h ALA 376 N 1.90 0.06 -0.13 0.39 0.00 -1.46 -2.09 119.26 117.93 1wdl h ALA 376 Ca 0.07 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1wdl h ALA 376 Cb 0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1wdl h ALA 376 CO -0.01 -0.23 -0.08 0.93 0.00 0.00 0.00 179.25 179.85 1wdl h GLU 377 N -0.25 -0.08 -0.22 0.00 5.08 -1.22 -1.05 114.58 116.83 1wdl h GLU 377 Ca 0.01 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.42 1wdl h GLU 377 Cb 0.39 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 1wdl h GLU 377 CO 0.00 -0.05 -0.07 0.28 -1.00 0.00 0.00 179.01 178.17 1wdl h VAL 378 N -0.08 0.73 -0.51 3.13 2.07 -1.31 -0.76 116.25 119.53 1wdl h VAL 378 Ca 0.08 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 1wdl h VAL 378 Cb 0.20 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1wdl h VAL 378 CO -0.18 0.00 0.27 -0.07 0.02 0.00 0.00 177.57 177.61 1wdl h LEU 379 N -0.03 0.62 -0.84 2.57 3.38 -1.08 -1.53 115.31 118.40 1wdl h LEU 379 Ca 0.11 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1wdl h LEU 379 Cb 0.20 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1wdl h LEU 379 CO -0.25 0.50 -0.54 0.78 0.09 0.00 0.00 178.44 179.03 1wdl h ASN 380 N 0.70 0.00 -0.13 -0.43 2.35 -0.56 -2.90 115.58 114.61 1wdl h ASN 380 Ca 0.18 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.87 1wdl h ASN 380 Cb 0.03 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 1wdl h ASN 380 CO -0.03 0.54 -0.09 1.23 -1.65 0.00 0.00 177.43 177.43 1wdl h GLY 381 N 1.86 0.49 -5.53 2.83 0.00 -0.11 -3.40 103.07 99.21 1wdl h GLY 381 Ca -0.01 -0.31 -0.59 0.00 0.00 0.00 0.00 47.33 46.43 1wdl h GLY 381 CO 0.07 0.29 0.45 -0.42 0.00 0.00 0.00 176.54 176.93 1wdl s ILE 382 N -4.80 4.85 -0.27 2.60 1.01 -1.08 -1.55 121.20 121.96 1wdl s ILE 382 Ca -0.07 1.63 0.01 0.00 0.00 0.00 0.00 60.65 62.22 1wdl s ILE 382 Cb 0.15 -4.14 0.07 0.00 0.01 0.00 0.00 42.46 38.56 1wdl s ILE 382 CO 0.76 -0.03 -0.02 -0.13 0.00 0.00 0.00 174.94 175.53 1wdl s ARG 383 N 2.49 1.54 0.85 2.79 0.52 -0.06 -4.94 118.95 122.13 1wdl s ARG 383 Ca 0.37 -1.22 -0.12 0.00 -0.52 0.00 0.00 55.73 54.24 1wdl s ARG 383 Cb -0.16 -2.67 0.11 0.00 0.52 0.00 0.00 34.95 32.75 1wdl s ARG 383 CO 0.10 -0.72 1.19 -2.14 0.02 0.00 0.00 175.30 173.75 1wdl s PRO 384 N 1.29 1.39 -0.28 3.54 0.02 -1.26 -1.77 135.00 137.93 1wdl s PRO 384 Ca -0.01 1.71 -0.27 0.00 0.02 0.00 0.00 61.00 62.45 1wdl s PRO 384 Cb -0.19 -1.75 0.18 0.00 0.02 0.00 0.00 34.50 32.76 1wdl s PRO 384 CO -0.09 -2.39 1.33 -0.08 -0.33 0.00 0.00 177.00 175.44 1wdl s THR 385 N -2.30 0.00 -0.27 0.99 -1.32 -0.96 -4.78 115.64 107.01 1wdl s THR 385 Ca 0.71 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 61.26 1wdl s THR 385 Cb -0.27 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 69.87 1wdl s THR 385 CO 0.53 0.00 1.11 0.18 -2.21 0.00 0.00 174.62 174.23 1wdl n LEU 386 N 1.15 2.41 0.00 9.08 4.77 -1.26 -2.27 117.00 130.88 1wdl n LEU 386 Ca -0.07 -2.21 -0.10 0.00 -0.03 0.00 0.00 56.01 53.60 1wdl n LEU 386 Cb 0.58 -0.15 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 1wdl n LEU 386 CO 0.05 0.60 -0.05 -1.54 -1.33 0.00 0.00 177.39 175.12 1wdl n SER 387 N -0.36 -0.16 -0.43 -1.43 3.41 -1.26 -4.82 113.62 108.56 1wdl n SER 387 Ca 0.07 -2.12 0.06 0.00 -0.26 0.00 0.00 58.87 56.61 1wdl n SER 387 Cb 0.39 0.81 0.14 0.00 -0.26 0.00 0.00 64.21 65.29 1wdl n SER 387 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1wdl n TYR 388 N -0.34 0.37 -0.15 7.33 4.02 -1.26 -4.74 117.16 122.39 1wdl n TYR 388 Ca 0.03 -0.68 0.15 0.00 -0.01 0.00 0.00 57.90 57.39 1wdl n TYR 388 Cb 0.31 -0.12 0.52 0.00 -0.02 0.00 0.00 39.34 40.02 1wdl n TYR 388 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1wdl h GLY 389 N 1.08 0.65 -2.20 2.72 0.00 -1.97 -1.98 103.07 101.37 1wdl h GLY 389 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1wdl h GLY 389 CO 0.05 0.06 0.00 1.22 0.00 0.00 0.00 176.54 177.87 1wdl n ASP 390 N -4.47 3.30 -0.11 0.19 8.00 -1.26 -4.35 116.55 117.85 1wdl n ASP 390 Ca 0.14 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.67 1wdl n ASP 390 Cb 0.52 -0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 1wdl n ASP 390 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1wdl n PHE 391 N 1.35 0.00 -0.05 1.24 3.01 -0.74 -4.05 117.46 118.21 1wdl n PHE 391 Ca 0.20 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.64 1wdl n PHE 391 Cb 0.56 -0.02 0.22 0.00 -0.01 0.00 0.00 39.48 40.23 1wdl n PHE 391 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1wdl h GLY 392 N 5.01 0.70 -1.13 1.37 0.00 -1.76 -3.24 103.07 104.02 1wdl h GLY 392 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1wdl h GLY 392 CO 0.00 0.42 0.00 1.16 0.00 0.00 0.00 176.54 178.12 1wdl n ASN 393 N -4.24 3.06 -4.73 0.19 6.94 -1.26 -4.40 115.26 110.82 1wdl n ASN 393 Ca 0.02 -2.37 -0.41 0.00 -0.02 0.00 0.00 54.58 51.79 1wdl n ASN 393 Cb 0.28 -0.31 -0.03 0.00 -2.36 0.00 0.00 39.78 37.36 1wdl n ASN 393 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1wdl s VAL 394 N -1.66 3.70 -0.18 3.53 1.01 -1.22 -4.56 120.40 121.02 1wdl s VAL 394 Ca 0.26 1.34 -0.18 0.00 0.00 0.00 0.00 61.98 63.41 1wdl s VAL 394 Cb 0.18 -3.86 -0.21 0.00 0.00 0.00 0.00 36.38 32.49 1wdl s VAL 394 CO 0.11 0.17 0.26 0.44 0.00 0.00 0.00 175.10 176.08 1wdl h ASP 395 N 5.85 0.11 -3.69 3.32 3.32 -0.66 -3.42 116.42 121.25 1wdl h ASP 395 Ca -0.43 -0.62 -0.55 0.00 0.02 0.00 0.00 57.03 55.44 1wdl h ASP 395 Cb 1.21 -0.04 -0.32 0.00 0.22 0.00 0.00 39.33 40.41 1wdl h ASP 395 CO 0.77 1.59 -0.83 -0.22 -1.72 0.00 0.00 179.24 178.83 1wdl s LEU 396 N -7.66 1.84 -0.07 1.55 0.20 -1.19 -0.71 118.68 112.63 1wdl s LEU 396 Ca -0.27 -0.34 0.04 0.00 0.69 0.00 0.00 54.13 54.25 1wdl s LEU 396 Cb 0.06 -0.94 -0.01 0.00 -0.43 0.00 0.00 46.19 44.87 1wdl s LEU 396 CO 0.64 0.11 -0.21 -0.69 -0.29 0.00 0.00 176.35 175.91 1wdl s VAL 397 N 0.27 2.44 -0.04 1.68 1.01 0.90 -2.79 120.40 123.87 1wdl s VAL 397 Ca -0.09 -0.93 0.06 0.00 0.00 0.00 0.00 61.98 61.03 1wdl s VAL 397 Cb -0.13 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.30 1wdl s VAL 397 CO 0.03 0.57 -0.20 -0.69 0.00 0.00 0.00 175.10 174.81 1wdl s VAL 398 N -0.18 2.58 -0.11 2.92 1.01 -0.14 -0.03 120.40 126.45 1wdl s VAL 398 Ca -0.02 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.02 1wdl s VAL 398 Cb -0.14 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1wdl s VAL 398 CO 0.03 0.59 0.03 -0.70 0.00 0.00 0.00 175.10 175.05 1wdl s GLU 399 N -0.65 3.26 -0.03 2.72 -6.30 0.14 0.46 118.70 118.30 1wdl s GLU 399 Ca 0.10 -0.36 0.14 0.00 -2.50 0.00 0.00 54.97 52.35 1wdl s GLU 399 Cb -0.10 -2.93 0.25 0.00 0.00 0.00 0.00 34.13 31.34 1wdl s GLU 399 CO -0.00 0.62 1.11 0.00 0.02 0.00 0.00 175.26 177.01 1wdl n ALA 400 N 2.42 2.34 -0.99 6.30 0.00 0.39 -1.34 120.51 129.63 1wdl n ALA 400 Ca -0.18 -1.94 -0.31 0.00 0.00 0.00 0.00 53.44 51.01 1wdl n ALA 400 Cb 0.54 -0.58 0.13 0.00 0.00 0.00 0.00 19.45 19.54 1wdl n ALA 400 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wdl s VAL 401 N -0.57 2.68 0.57 0.00 1.01 -1.20 -4.78 120.40 118.10 1wdl s VAL 401 Ca 0.21 0.22 -0.18 0.00 0.00 0.00 0.00 61.98 62.23 1wdl s VAL 401 Cb 0.23 -2.50 -0.08 0.00 0.00 0.00 0.00 36.38 34.03 1wdl s VAL 401 CO -0.08 -0.29 0.61 0.52 0.00 0.00 0.00 175.10 175.86 1wdl n VAL 402 N -3.92 2.49 -1.68 2.92 0.31 -1.26 -4.77 118.33 112.42 1wdl n VAL 402 Ca 0.10 -0.50 -0.23 0.00 -0.01 0.00 0.00 64.34 63.69 1wdl n VAL 402 Cb 0.53 -0.76 -0.05 0.00 -0.91 0.00 0.00 33.84 32.65 1wdl n VAL 402 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1wdl s GLU 403 N -2.17 1.96 -0.30 5.55 0.41 -1.26 -4.65 118.70 118.24 1wdl s GLU 403 Ca 0.70 0.61 -0.04 0.00 -0.41 0.00 0.00 54.97 55.82 1wdl s GLU 403 Cb -0.45 -4.75 0.18 0.00 -1.78 0.00 0.00 34.13 27.33 1wdl s GLU 403 CO 0.53 -3.84 0.67 1.21 -0.49 0.00 0.00 175.26 173.33 1wdl s ASN 404 N 10.55 -1.22 0.21 -0.19 3.84 -1.26 -5.06 114.94 121.81 1wdl s ASN 404 Ca 0.88 0.96 -0.13 0.00 0.21 0.00 0.00 52.86 54.79 1wdl s ASN 404 Cb -0.13 2.11 0.26 0.00 -0.55 0.00 0.00 41.25 42.94 1wdl s ASN 404 CO 0.12 -0.23 1.63 -0.65 -2.79 0.00 0.00 177.10 175.19 1wdl h PRO 405 N 7.98 0.03 0.82 0.43 0.11 -1.99 0.83 132.00 140.20 1wdl h PRO 405 Ca -0.21 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.86 1wdl h PRO 405 Cb 1.15 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.26 1wdl h PRO 405 CO 0.19 0.02 -0.39 -0.22 -0.21 0.00 0.00 178.00 177.38 1wdl h LYS 406 N 0.03 -1.06 -0.18 1.05 1.63 -1.97 -2.25 116.57 113.82 1wdl h LYS 406 Ca 0.31 0.07 0.05 0.00 -0.85 0.00 0.00 60.65 60.24 1wdl h LYS 406 Cb 0.49 0.24 -0.07 0.00 -0.60 0.00 0.00 32.23 32.30 1wdl h LYS 406 CO -0.63 -0.69 -0.27 0.28 -3.45 0.00 0.00 179.45 174.69 1wdl h VAL 407 N -1.19 0.36 -0.93 2.00 2.07 -1.84 -1.35 116.25 115.36 1wdl h VAL 407 Ca -0.11 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.56 1wdl h VAL 407 Cb 0.85 0.36 -0.08 0.00 -1.52 0.00 0.00 31.29 30.90 1wdl h VAL 407 CO 0.18 0.00 0.59 0.11 0.02 0.00 0.00 177.57 178.48 1wdl h LYS 408 N -0.31 0.72 -0.45 1.57 1.57 -0.87 -0.75 116.57 118.05 1wdl h LYS 408 Ca 0.12 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.75 1wdl h LYS 408 Cb 0.49 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1wdl h LYS 408 CO -0.36 0.48 -0.13 1.96 -0.57 0.00 0.00 179.45 180.82 1wdl h GLN 409 N 0.74 0.89 -0.17 3.15 4.20 -0.65 -0.89 115.11 122.38 1wdl h GLN 409 Ca 0.48 -0.35 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 1wdl h GLN 409 Cb 0.74 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 1wdl h GLN 409 CO -0.24 1.00 0.03 0.00 -0.67 0.00 0.00 178.83 178.95 1wdl h ALA 410 N 0.86 0.23 -0.08 3.87 0.00 -0.36 -1.21 119.26 122.58 1wdl h ALA 410 Ca 0.11 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1wdl h ALA 410 Cb 0.69 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1wdl h ALA 410 CO 0.05 -0.11 0.04 0.28 0.00 0.00 0.00 179.25 179.51 1wdl h VAL 411 N 0.08 1.10 -0.00 0.00 2.07 -1.17 -0.72 116.25 117.60 1wdl h VAL 411 Ca 0.05 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.30 1wdl h VAL 411 Cb 0.30 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1wdl h VAL 411 CO 0.00 0.08 -0.06 -0.07 0.02 0.00 0.00 177.57 177.55 1wdl h LEU 412 N 0.02 -0.16 -1.78 2.57 3.38 -1.14 -1.50 115.31 116.70 1wdl h LEU 412 Ca 0.03 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1wdl h LEU 412 Cb 0.10 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1wdl h LEU 412 CO -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 178.44 178.45 1wdl h ALA 413 N 0.90 1.83 0.14 1.53 0.00 -1.16 -2.26 119.26 120.23 1wdl h ALA 413 Ca 0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1wdl h ALA 413 Cb 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1wdl h ALA 413 CO -0.06 0.14 -0.07 1.49 0.00 0.00 0.00 179.25 180.75 1wdl h GLU 414 N 0.14 -0.18 0.00 0.00 4.81 -0.33 -3.12 114.58 115.90 1wdl h GLU 414 Ca 0.03 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.23 1wdl h GLU 414 Cb 0.09 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1wdl h GLU 414 CO 0.00 0.12 -0.23 0.28 -0.73 0.00 0.00 179.01 178.45 1wdl h VAL 415 N -0.47 1.14 0.00 0.32 2.07 -1.05 -2.35 116.25 115.91 1wdl h VAL 415 Ca -0.02 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.71 1wdl h VAL 415 Cb 0.37 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1wdl h VAL 415 CO 0.03 0.22 0.00 -0.08 0.02 0.00 0.00 177.57 177.76 1wdl h GLU 416 N 0.00 0.00 -0.61 1.57 4.81 -1.35 -0.49 114.58 118.52 1wdl h GLU 416 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1wdl h GLU 416 Cb 0.41 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1wdl h GLU 416 CO 0.03 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.40 1wdl n ASN 417 N -2.48 4.72 -0.16 1.04 3.02 -0.88 -4.27 115.26 116.24 1wdl n ASN 417 Ca -0.01 -2.50 0.01 0.00 -0.03 0.00 0.00 54.58 52.04 1wdl n ASN 417 Cb 0.08 -0.57 0.01 0.00 -0.61 0.00 0.00 39.78 38.69 1wdl n ASN 417 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1wdl n HIS 418 N 0.95 0.00 -4.27 3.10 8.25 -0.20 -5.09 115.22 117.97 1wdl n HIS 418 Ca 0.25 -0.11 -0.15 0.00 -0.26 0.00 0.00 57.72 57.45 1wdl n HIS 418 Cb 0.90 -0.03 -0.10 0.00 1.12 0.00 0.00 29.99 31.87 1wdl n HIS 418 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1wdl s VAL 419 N -0.28 0.66 0.82 1.59 -7.23 -1.19 -4.11 120.40 110.67 1wdl s VAL 419 Ca 0.02 -1.99 -0.14 0.00 -1.81 0.00 0.00 61.98 58.06 1wdl s VAL 419 Cb 0.02 -2.28 0.06 0.00 0.56 0.00 0.00 36.38 34.73 1wdl s VAL 419 CO 0.00 -0.33 0.96 0.54 -0.31 0.00 0.00 175.10 175.97 1wdl n ARG 420 N -0.32 0.09 0.18 4.82 1.74 -1.26 -4.88 116.66 117.03 1wdl n ARG 420 Ca -0.04 0.10 0.13 0.00 -0.77 0.00 0.00 57.85 57.27 1wdl n ARG 420 Cb 0.64 -2.24 0.36 0.00 -1.02 0.00 0.00 32.46 30.20 1wdl n ARG 420 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 1wdl h GLU 421 N -0.97 0.00 -0.52 5.56 4.11 -1.98 -2.88 114.58 117.89 1wdl h GLU 421 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 1wdl h GLU 421 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1wdl h GLU 421 CO 0.43 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.11 1wdl n ASP 422 N -2.70 2.82 -4.82 3.06 5.75 -1.26 -4.92 116.55 114.48 1wdl n ASP 422 Ca 0.04 -2.08 -0.33 0.00 -0.01 0.00 0.00 54.79 52.40 1wdl n ASP 422 Cb 0.43 -0.37 -0.07 0.00 -1.03 0.00 0.00 41.12 40.09 1wdl n ASP 422 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wdl s ALA 423 N -1.45 3.15 -0.15 2.12 0.00 -1.09 -5.05 121.76 119.28 1wdl s ALA 423 Ca 0.33 0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.50 1wdl s ALA 423 Cb 0.18 -3.04 -0.05 0.00 0.00 0.00 0.00 23.12 20.22 1wdl s ALA 423 CO 0.21 0.20 0.20 0.42 0.00 0.00 0.00 175.76 176.78 1wdl s ILE 424 N -2.03 5.38 -0.01 0.00 1.09 0.11 -4.83 121.20 120.91 1wdl s ILE 424 Ca 0.58 0.34 0.03 0.00 -1.10 0.00 0.00 60.65 60.49 1wdl s ILE 424 Cb -0.11 -3.51 -0.03 0.00 -1.06 0.00 0.00 42.46 37.74 1wdl s ILE 424 CO 0.16 0.48 -0.06 -0.76 -0.10 0.00 0.00 174.94 174.66 1wdl s LEU 425 N -0.07 3.19 -0.12 2.97 1.43 -0.35 -0.07 118.68 125.66 1wdl s LEU 425 Ca 0.13 -0.11 -0.11 0.00 -1.03 0.00 0.00 54.13 53.01 1wdl s LEU 425 Cb -0.12 -1.81 0.03 0.00 0.03 0.00 0.00 46.19 44.32 1wdl s LEU 425 CO 0.02 0.30 0.33 0.00 0.23 0.00 0.00 176.35 177.23 1wdl s ALA 426 N -0.97 -0.81 0.10 4.21 0.00 0.96 -1.98 121.76 123.28 1wdl s ALA 426 Ca 0.16 0.92 0.03 0.00 0.00 0.00 0.00 51.96 53.07 1wdl s ALA 426 Cb -0.11 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1wdl s ALA 426 CO 0.07 -0.16 0.14 0.45 0.00 0.00 0.00 175.76 176.26 1wdl s SER 427 N 0.16 5.76 0.00 0.00 0.15 -1.19 0.28 113.70 118.87 1wdl s SER 427 Ca -0.00 0.03 0.17 0.00 0.70 0.00 0.00 55.95 56.86 1wdl s SER 427 Cb -0.02 -1.61 0.47 0.00 -1.71 0.00 0.00 66.02 63.15 1wdl s SER 427 CO 0.00 0.14 1.38 -3.20 1.20 0.00 0.00 173.24 172.77 1wdl n ASN 428 N 0.15 3.42 -4.36 5.45 5.15 -0.45 -1.01 115.26 123.61 1wdl n ASN 428 Ca -0.08 -1.98 -0.33 0.00 -0.60 0.00 0.00 54.58 51.59 1wdl n ASN 428 Cb 0.52 -0.34 0.11 0.00 -0.53 0.00 0.00 39.78 39.54 1wdl n ASN 428 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 1wdl n THR 429 N 1.13 0.00 0.00 -0.44 5.66 -1.26 -4.60 114.28 114.77 1wdl n THR 429 Ca 0.18 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 1wdl n THR 429 Cb 0.53 -0.55 0.00 0.00 -1.55 0.00 0.00 70.33 68.76 1wdl n THR 429 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1wdl n SER 430 N -0.78 2.63 -0.01 1.09 3.41 -1.26 -4.79 113.62 113.91 1wdl n SER 430 Ca 0.05 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.67 1wdl n SER 430 Cb 0.54 0.50 0.01 0.00 -0.26 0.00 0.00 64.21 65.01 1wdl n SER 430 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1wdl n THR 431 N -0.83 0.95 -5.27 6.66 -2.24 -1.26 -4.61 114.28 107.68 1wdl n THR 431 Ca 0.00 -0.99 -0.31 0.00 -2.27 0.00 0.00 64.05 60.49 1wdl n THR 431 Cb 0.02 0.49 -0.16 0.00 -2.10 0.00 0.00 70.33 68.58 1wdl n THR 431 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1wdl s ILE 432 N -1.04 2.01 0.10 2.28 1.01 -1.26 -4.96 121.20 119.33 1wdl s ILE 432 Ca 0.03 -1.08 -0.31 0.00 0.00 0.00 0.00 60.65 59.29 1wdl s ILE 432 Cb 0.02 -1.67 -0.09 0.00 0.01 0.00 0.00 42.46 40.74 1wdl s ILE 432 CO 0.00 0.57 1.62 -0.55 0.00 0.00 0.00 174.94 176.58 1wdl s SER 433 N -0.52 6.60 0.27 3.58 0.15 -1.26 -4.90 113.70 117.62 1wdl s SER 433 Ca 0.07 2.52 0.00 0.00 0.70 0.00 0.00 55.95 59.24 1wdl s SER 433 Cb -0.10 -2.57 0.37 0.00 -1.71 0.00 0.00 66.02 62.01 1wdl s SER 433 CO -0.00 -0.86 1.74 0.40 1.20 0.00 0.00 173.24 175.71 1wdl h ILE 434 N 4.57 1.25 0.00 6.45 5.03 -1.96 -1.74 117.51 131.12 1wdl h ILE 434 Ca -0.43 -1.14 0.00 0.00 -0.12 0.00 0.00 64.86 63.18 1wdl h ILE 434 Cb 1.20 1.13 0.00 0.00 -3.03 0.00 0.00 36.82 36.13 1wdl h ILE 434 CO 0.92 0.38 0.00 0.28 -0.68 0.00 0.00 178.15 179.05 1wdl h SER 435 N 0.57 0.00 0.05 1.72 0.02 -1.92 -1.93 113.55 112.05 1wdl h SER 435 Ca 0.10 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.91 1wdl h SER 435 Cb 0.57 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1wdl h SER 435 CO 0.04 0.00 -0.73 0.25 -1.14 0.00 0.00 176.83 175.25 1wdl h LEU 436 N 0.00 0.15 -1.08 5.07 6.46 -1.72 -3.35 115.31 120.83 1wdl h LEU 436 Ca 0.00 -0.84 -0.01 0.00 -0.12 0.00 0.00 57.88 56.91 1wdl h LEU 436 Cb 0.40 -0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.24 1wdl h LEU 436 CO 0.00 1.31 0.43 -0.07 -0.62 0.00 0.00 178.44 179.49 1wdl h LEU 437 N -0.76 0.95 -2.05 2.25 3.38 -1.24 -2.69 115.31 115.15 1wdl h LEU 437 Ca -0.17 -0.07 0.08 0.00 0.09 0.00 0.00 57.88 57.81 1wdl h LEU 437 Cb 1.33 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1wdl h LEU 437 CO -0.02 0.76 0.21 0.00 0.09 0.00 0.00 178.44 179.49 1wdl h ALA 438 N 1.40 2.18 0.00 1.53 0.00 -1.50 -2.19 119.26 120.67 1wdl h ALA 438 Ca 0.27 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1wdl h ALA 438 Cb 0.01 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1wdl h ALA 438 CO -0.05 -0.35 -0.00 0.87 0.00 0.00 0.00 179.25 179.72 1wdl h LYS 439 N 0.00 0.00 -0.15 0.00 1.57 -1.61 -2.30 116.57 114.08 1wdl h LYS 439 Ca 0.13 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 1wdl h LYS 439 Cb 0.55 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 1wdl h LYS 439 CO -0.00 0.00 -0.15 0.00 -0.57 0.00 0.00 179.45 178.73 1wdl h ALA 440 N 2.00 0.23 -2.26 3.86 0.00 -1.57 -3.45 119.26 118.06 1wdl h ALA 440 Ca -0.00 -0.32 -0.51 0.00 0.00 0.00 0.00 54.91 54.08 1wdl h ALA 440 Cb 0.00 -0.05 0.19 0.00 0.00 0.00 0.00 17.79 17.93 1wdl h ALA 440 CO 0.00 0.11 0.20 -0.51 0.00 0.00 0.00 179.25 179.05 1wdl s LEU 441 N -9.11 2.55 0.00 0.00 1.43 -0.86 -4.87 118.68 107.82 1wdl s LEU 441 Ca -0.14 2.02 0.16 0.00 -1.03 0.00 0.00 54.13 55.15 1wdl s LEU 441 Cb 0.05 -4.37 0.19 0.00 0.03 0.00 0.00 46.19 42.10 1wdl s LEU 441 CO 0.76 -3.13 1.09 2.29 0.23 0.00 0.00 176.35 177.58 1wdl n LYS 442 N -4.24 1.57 -3.18 1.70 -0.00 -1.26 -4.59 118.16 108.15 1wdl n LYS 442 Ca 0.10 -1.64 -0.21 0.00 -0.00 0.00 0.00 58.31 56.56 1wdl n LYS 442 Cb 0.53 -1.33 -0.05 0.00 -0.00 0.00 0.00 35.03 34.18 1wdl n LYS 442 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 1wdl n ARG 443 N 0.93 0.83 0.24 -1.58 -4.01 -1.26 -4.97 116.66 106.85 1wdl n ARG 443 Ca 0.11 -3.27 0.16 0.00 -1.04 0.00 0.00 57.85 53.81 1wdl n ARG 443 Cb 0.43 -1.44 0.86 0.00 -3.04 0.00 0.00 32.46 29.27 1wdl n ARG 443 CO 0.00 0.00 0.00 -1.35 -3.04 0.00 0.00 177.63 173.24 1wdl h PRO 444 N 3.53 0.00 -0.33 2.89 0.11 -1.81 -2.43 132.00 133.96 1wdl h PRO 444 Ca 0.08 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.22 1wdl h PRO 444 Cb 0.92 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 1wdl h PRO 444 CO 0.47 0.00 0.22 0.93 -0.21 0.00 0.00 178.00 179.42 1wdl h GLU 445 N 0.00 0.33 -0.01 1.05 3.07 -1.88 -0.93 114.58 116.22 1wdl h GLU 445 Ca 0.05 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 1wdl h GLU 445 Cb 0.29 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 1wdl h GLU 445 CO -0.00 0.22 -0.17 0.09 -1.40 0.00 0.00 179.01 177.75 1wdl n ASN 446 N -4.49 1.48 -4.73 1.42 3.02 -0.91 -1.25 115.26 109.80 1wdl n ASN 446 Ca 0.03 -1.27 -0.36 0.00 -0.03 0.00 0.00 54.58 52.95 1wdl n ASN 446 Cb 0.15 0.12 -0.08 0.00 -0.61 0.00 0.00 39.78 39.36 1wdl n ASN 446 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1wdl s PHE 447 N -2.29 3.43 0.00 3.10 5.36 -0.35 -1.22 117.98 126.02 1wdl s PHE 447 Ca 0.29 0.47 0.00 0.00 -0.96 0.00 0.00 56.93 56.73 1wdl s PHE 447 Cb 0.20 -2.27 0.00 0.00 -0.34 0.00 0.00 43.02 40.61 1wdl s PHE 447 CO 0.44 0.25 0.00 1.33 -1.46 0.00 0.00 175.22 175.78 1wdl n VAL 448 N 3.59 0.00 -4.45 3.12 0.24 -0.84 -4.51 118.33 115.48 1wdl n VAL 448 Ca -0.14 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.87 1wdl n VAL 448 Cb 0.52 0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.72 1wdl n VAL 448 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1wdl s GLY 449 N -0.52 1.08 -0.42 7.63 0.00 0.99 -3.15 107.32 112.93 1wdl s GLY 449 Ca 0.00 -0.78 0.04 0.00 0.00 0.00 0.00 44.72 43.97 1wdl s GLY 449 CO 0.00 0.22 0.15 -0.29 0.00 0.00 0.00 173.10 173.18 1wdl s MET 450 N 1.00 1.71 -0.31 2.90 0.00 -0.18 -0.11 119.30 124.31 1wdl s MET 450 Ca -0.06 -2.19 -0.16 0.00 0.00 0.00 0.00 55.69 53.28 1wdl s MET 450 Cb -0.15 -3.27 -0.02 0.00 0.00 0.00 0.00 34.83 31.39 1wdl s MET 450 CO -0.02 -1.02 0.43 -1.58 0.00 0.00 0.00 175.02 172.83 1wdl s HIS 451 N 0.41 3.22 0.34 4.11 2.46 0.66 -3.82 115.29 122.68 1wdl s HIS 451 Ca 0.13 0.27 0.07 0.00 0.47 0.00 0.00 55.06 56.01 1wdl s HIS 451 Cb -0.22 -2.71 -0.02 0.00 -0.13 0.00 0.00 32.58 29.50 1wdl s HIS 451 CO -0.05 -0.37 0.32 -0.06 -2.47 0.00 0.00 174.74 172.11 1wdl s PHE 452 N 2.18 2.93 -0.07 3.88 0.40 -1.26 -1.25 117.98 124.78 1wdl s PHE 452 Ca 0.16 -0.29 0.04 0.00 -0.60 0.00 0.00 56.93 56.24 1wdl s PHE 452 Cb -0.16 -1.83 0.00 0.00 0.51 0.00 0.00 43.02 41.55 1wdl s PHE 452 CO 0.11 0.16 -0.20 -0.06 0.70 0.00 0.00 175.22 175.93 1wdl s PHE 453 N -2.29 2.13 0.07 0.36 0.40 -1.26 -5.00 117.98 112.39 1wdl s PHE 453 Ca 0.41 -0.77 -0.31 0.00 -0.60 0.00 0.00 56.93 55.67 1wdl s PHE 453 Cb -0.06 -1.44 -0.08 0.00 0.51 0.00 0.00 43.02 41.95 1wdl s PHE 453 CO 0.27 -0.30 1.61 1.21 0.70 0.00 0.00 175.22 178.71 1wdl s ASN 454 N 0.27 6.63 0.19 1.36 3.84 -1.26 -2.64 114.94 123.33 1wdl s ASN 454 Ca -0.13 2.46 -0.26 0.00 0.21 0.00 0.00 52.86 55.15 1wdl s ASN 454 Cb -0.16 -2.57 -0.08 0.00 -0.55 0.00 0.00 41.25 37.90 1wdl s ASN 454 CO 0.06 -0.86 0.81 -2.84 -2.79 0.00 0.00 177.10 171.47 1wdl s PRO 455 N 2.41 4.61 0.49 0.43 0.02 -1.26 -4.86 135.00 136.84 1wdl s PRO 455 Ca 0.72 1.21 0.23 0.00 0.02 0.00 0.00 61.00 63.18 1wdl s PRO 455 Cb -0.39 -3.24 1.28 0.00 0.02 0.00 0.00 34.50 32.17 1wdl s PRO 455 CO 0.32 0.55 1.93 0.28 -0.33 0.00 0.00 177.00 179.74 1wdl h VAL 456 N 3.25 0.69 0.00 3.83 2.07 -1.85 -0.55 116.25 123.70 1wdl h VAL 456 Ca -0.47 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1wdl h VAL 456 Cb 1.20 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1wdl h VAL 456 CO 0.66 0.03 -0.51 0.00 0.02 0.00 0.00 177.57 177.78 1wdl n HIS 457 N -4.40 0.04 -0.11 1.57 1.44 -1.26 -4.42 115.22 108.07 1wdl n HIS 457 Ca 0.15 0.01 -0.21 0.00 -2.01 0.00 0.00 57.72 55.65 1wdl n HIS 457 Cb 0.69 -0.28 -0.08 0.00 0.12 0.00 0.00 29.99 30.44 1wdl n HIS 457 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1wdl n MET 458 N -1.54 0.56 -2.42 -1.40 2.00 -0.27 -4.96 117.12 109.08 1wdl n MET 458 Ca 0.05 0.35 -0.42 0.00 0.00 0.00 0.00 57.70 57.69 1wdl n MET 458 Cb 0.34 -1.56 -0.03 0.00 0.00 0.00 0.00 33.22 31.97 1wdl n MET 458 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 1wdl s MET 459 N -2.53 4.48 -0.08 0.03 -1.94 -0.83 -4.98 119.30 113.45 1wdl s MET 459 Ca -0.32 1.80 -0.27 0.00 -1.71 0.00 0.00 55.69 55.19 1wdl s MET 459 Cb 0.09 -3.30 -0.22 0.00 2.01 0.00 0.00 34.83 33.41 1wdl s MET 459 CO 0.47 -0.14 1.03 -1.35 -0.01 0.00 0.00 175.02 175.02 1wdl h PRO 460 N 5.94 -0.01 -7.00 2.03 0.11 -1.91 -3.46 132.00 127.70 1wdl h PRO 460 Ca -0.43 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.13 1wdl h PRO 460 Cb 1.21 0.00 0.12 0.00 0.11 0.00 0.00 31.00 32.45 1wdl h PRO 460 CO 0.77 0.69 0.69 -1.17 -0.21 0.00 0.00 178.00 178.78 1wdl s LEU 461 N -8.78 4.06 -0.23 2.35 2.96 -1.23 -2.63 118.68 115.19 1wdl s LEU 461 Ca -0.17 2.90 -0.03 0.00 -0.22 0.00 0.00 54.13 56.61 1wdl s LEU 461 Cb -0.00 -4.00 0.10 0.00 0.50 0.00 0.00 46.19 42.79 1wdl s LEU 461 CO 0.67 -1.26 0.20 -0.69 -1.32 0.00 0.00 176.35 173.95 1wdl s VAL 462 N -1.22 -0.26 0.15 1.68 1.01 -1.22 -4.31 120.40 116.24 1wdl s VAL 462 Ca 0.63 -0.31 -0.30 0.00 0.00 0.00 0.00 61.98 62.00 1wdl s VAL 462 Cb -0.43 -0.78 -0.07 0.00 0.00 0.00 0.00 36.38 35.10 1wdl s VAL 462 CO 0.55 -0.36 1.11 -1.61 0.00 0.00 0.00 175.10 174.79 1wdl s GLU 463 N 2.26 4.56 -0.95 2.72 2.02 -0.38 -2.97 118.70 125.96 1wdl s GLU 463 Ca 0.07 1.72 -0.05 0.00 0.02 0.00 0.00 54.97 56.73 1wdl s GLU 463 Cb -0.15 -3.29 0.24 0.00 0.10 0.00 0.00 34.13 31.02 1wdl s GLU 463 CO -0.20 0.01 0.87 0.08 0.02 0.00 0.00 175.26 176.04 1wdl s VAL 464 N 0.02 4.95 -0.47 2.63 1.01 -0.70 -0.24 120.40 127.60 1wdl s VAL 464 Ca 0.51 -3.59 -0.27 0.00 0.00 0.00 0.00 61.98 58.62 1wdl s VAL 464 Cb -0.29 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 1wdl s VAL 464 CO 0.34 -1.11 1.93 -0.63 0.00 0.00 0.00 175.10 175.63 1wdl s ILE 465 N -1.17 3.34 -0.12 2.22 1.09 0.84 -1.95 121.20 125.45 1wdl s ILE 465 Ca 0.27 0.28 -0.28 0.00 -1.10 0.00 0.00 60.65 59.83 1wdl s ILE 465 Cb -0.09 -3.66 -0.01 0.00 -1.06 0.00 0.00 42.46 37.64 1wdl s ILE 465 CO -0.10 -0.55 0.94 -0.60 -0.10 0.00 0.00 174.94 174.53 1wdl s ARG 466 N 6.63 4.39 1.01 2.79 3.52 0.69 -0.01 118.95 137.97 1wdl s ARG 466 Ca 0.78 1.26 -0.17 0.00 -0.13 0.00 0.00 55.73 57.46 1wdl s ARG 466 Cb -0.18 -3.55 0.23 0.00 -1.56 0.00 0.00 34.95 29.89 1wdl s ARG 466 CO 0.27 -0.30 1.32 0.20 -0.81 0.00 0.00 175.30 175.99 1wdl s GLY 467 N 1.10 1.79 0.37 8.12 0.00 -1.26 -1.75 107.32 115.68 1wdl s GLY 467 Ca 0.45 -1.26 0.19 0.00 0.00 0.00 0.00 44.72 44.10 1wdl s GLY 467 CO 0.16 -0.44 1.68 1.05 0.00 0.00 0.00 173.10 175.56 1wdl h GLU 468 N -1.83 0.00 -0.30 2.90 4.11 -1.92 -3.19 114.58 114.34 1wdl h GLU 468 Ca -0.44 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 58.85 1wdl h GLU 468 Cb 1.23 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.40 1wdl h GLU 468 CO 0.33 0.37 -0.10 1.63 0.07 0.00 0.00 179.01 181.31 1wdl n LYS 469 N -3.41 1.94 -3.35 1.06 5.02 -1.26 -5.01 118.16 113.15 1wdl n LYS 469 Ca 0.00 -3.13 -0.38 0.00 -2.02 0.00 0.00 58.31 52.79 1wdl n LYS 469 Cb 0.55 -1.79 -0.06 0.00 -0.02 0.00 0.00 35.03 33.70 1wdl n LYS 469 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1wdl s SER 470 N -2.53 6.66 0.66 4.39 0.01 -1.21 -2.62 113.70 119.07 1wdl s SER 470 Ca 0.43 0.79 -0.11 0.00 1.31 0.00 0.00 55.95 58.37 1wdl s SER 470 Cb 0.39 -2.27 -0.01 0.00 0.21 0.00 0.00 66.02 64.33 1wdl s SER 470 CO 0.00 0.03 1.05 -0.94 0.41 0.00 0.00 173.24 173.79 1wdl s SER 471 N 0.53 5.80 0.20 2.44 1.04 -0.38 -4.89 113.70 118.45 1wdl s SER 471 Ca 0.25 1.44 -0.07 0.00 0.48 0.00 0.00 55.95 58.05 1wdl s SER 471 Cb -0.15 -2.40 0.14 0.00 0.10 0.00 0.00 66.02 63.72 1wdl s SER 471 CO 0.10 -1.15 1.69 0.44 0.98 0.00 0.00 173.24 175.30 1wdl h ASP 472 N -0.51 1.00 -0.81 7.02 3.45 -1.98 -2.59 116.42 122.00 1wdl h ASP 472 Ca -0.44 -0.26 0.01 0.00 0.43 0.00 0.00 57.03 56.77 1wdl h ASP 472 Cb 1.21 -0.27 -0.04 0.00 -0.56 0.00 0.00 39.33 39.67 1wdl h ASP 472 CO 0.60 1.03 0.53 0.25 -1.57 0.00 0.00 179.24 180.09 1wdl h LEU 473 N 0.95 0.93 -0.01 1.55 6.46 -1.93 0.26 115.31 123.52 1wdl h LEU 473 Ca 0.18 -0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 57.91 1wdl h LEU 473 Cb 0.50 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 40.20 1wdl h LEU 473 CO 0.02 0.67 0.00 0.00 -0.62 0.00 0.00 178.44 178.52 1wdl h ALA 474 N 1.49 0.01 -0.50 1.25 0.00 -1.72 -1.22 119.26 118.58 1wdl h ALA 474 Ca 0.30 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 1wdl h ALA 474 Cb -0.13 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1wdl h ALA 474 CO -0.06 -0.46 0.03 0.28 0.00 0.00 0.00 179.25 179.03 1wdl h VAL 475 N -0.06 1.26 -0.28 0.00 2.07 -1.16 -2.60 116.25 115.47 1wdl h VAL 475 Ca 0.00 -1.03 0.04 0.00 0.82 0.00 0.00 66.70 66.53 1wdl h VAL 475 Cb 0.07 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 1wdl h VAL 475 CO -0.00 0.36 0.05 0.00 0.02 0.00 0.00 177.57 178.00 1wdl h ALA 476 N 0.94 0.29 -0.64 1.67 0.00 -0.34 0.58 119.26 121.76 1wdl h ALA 476 Ca 0.14 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1wdl h ALA 476 Cb 0.48 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1wdl h ALA 476 CO 0.02 -0.36 0.35 1.15 0.00 0.00 0.00 179.25 180.40 1wdl h THR 477 N 0.15 1.21 -0.36 0.00 2.02 -1.17 -0.73 112.91 114.02 1wdl h THR 477 Ca 0.13 -0.53 -0.03 0.00 0.77 0.00 0.00 66.41 66.75 1wdl h THR 477 Cb 0.14 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1wdl h THR 477 CO -0.18 0.23 0.12 0.74 0.37 0.00 0.00 175.52 176.80 1wdl h THR 478 N 0.88 1.21 -0.05 3.16 2.02 -1.06 0.90 112.91 119.98 1wdl h THR 478 Ca 0.23 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1wdl h THR 478 Cb 0.06 0.97 -0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1wdl h THR 478 CO -0.03 0.24 0.02 0.58 0.37 0.00 0.00 175.52 176.69 1wdl h VAL 479 N 0.44 0.99 -0.32 3.16 2.07 -0.67 -1.36 116.25 120.56 1wdl h VAL 479 Ca 0.12 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.62 1wdl h VAL 479 Cb 0.25 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1wdl h VAL 479 CO -0.00 0.01 0.20 0.00 0.02 0.00 0.00 177.57 177.80 1wdl h ALA 480 N 1.03 0.41 -0.10 1.67 0.00 -1.01 -1.90 119.26 119.35 1wdl h ALA 480 Ca 0.02 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1wdl h ALA 480 Cb 0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1wdl h ALA 480 CO -0.02 -0.11 0.07 -0.92 0.00 0.00 0.00 179.25 178.27 1wdl h TYR 481 N 0.43 0.01 -0.08 0.00 3.20 -0.60 -0.59 116.97 119.33 1wdl h TYR 481 Ca 0.12 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.90 1wdl h TYR 481 Cb -0.02 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.25 1wdl h TYR 481 CO -0.05 0.01 -0.31 0.00 -1.64 0.00 0.00 178.16 176.17 1wdl h ALA 482 N 1.95 0.15 -0.91 1.82 0.00 -0.56 -2.95 119.26 118.75 1wdl h ALA 482 Ca 0.05 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1wdl h ALA 482 Cb 0.19 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1wdl h ALA 482 CO -0.00 0.19 0.50 1.57 0.00 0.00 0.00 179.25 181.50 1wdl h LYS 483 N -0.13 1.26 -0.01 0.00 5.09 -0.62 -1.40 116.57 120.77 1wdl h LYS 483 Ca -0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 60.65 60.57 1wdl h LYS 483 Cb 0.94 -0.25 -0.00 0.00 0.10 0.00 0.00 32.23 33.02 1wdl h LYS 483 CO 0.06 0.92 -0.05 1.57 -2.09 0.00 0.00 179.45 179.87 1wdl h LYS 484 N 1.27 0.01 -0.88 0.07 2.10 -1.15 -0.25 116.57 117.74 1wdl h LYS 484 Ca 0.32 -0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.93 1wdl h LYS 484 Cb 0.02 -0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.33 1wdl h LYS 484 CO -0.05 0.06 0.05 -1.33 -2.00 0.00 0.00 179.45 176.18 1wdl n MET 485 N -4.48 2.18 -3.24 0.07 2.81 -0.59 -4.84 117.12 109.03 1wdl n MET 485 Ca -0.03 -1.10 -0.21 0.00 -1.81 0.00 0.00 57.70 54.55 1wdl n MET 485 Cb 0.13 -1.70 0.05 0.00 -0.71 0.00 0.00 33.22 31.00 1wdl n MET 485 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1wdl n GLY 486 N 0.16 -0.40 2.51 3.03 0.00 -0.10 -4.98 105.19 105.40 1wdl n GLY 486 Ca 0.12 0.11 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 1wdl n GLY 486 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wdl n LYS 487 N -4.19 1.06 -3.66 1.61 4.76 -0.84 -4.99 118.16 111.92 1wdl n LYS 487 Ca -0.04 -2.40 -0.29 0.00 -2.87 0.00 0.00 58.31 52.70 1wdl n LYS 487 Cb 0.58 0.46 -0.12 0.00 -1.84 0.00 0.00 35.03 34.10 1wdl n LYS 487 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1wdl s ASN 488 N -3.03 3.38 0.47 4.39 0.01 -1.08 -4.38 114.94 114.70 1wdl s ASN 488 Ca 0.11 -2.76 -0.20 0.00 -0.71 0.00 0.00 52.86 49.29 1wdl s ASN 488 Cb -0.01 -0.93 -0.09 0.00 0.41 0.00 0.00 41.25 40.63 1wdl s ASN 488 CO 0.07 -0.24 1.01 -2.16 -1.51 0.00 0.00 177.10 174.27 1wdl s PRO 489 N 0.21 3.91 -0.08 -0.60 0.04 -1.26 -3.42 135.00 133.80 1wdl s PRO 489 Ca 0.21 1.29 -0.04 0.00 0.04 0.00 0.00 61.00 62.50 1wdl s PRO 489 Cb -0.18 -2.12 0.04 0.00 0.04 0.00 0.00 34.50 32.29 1wdl s PRO 489 CO -0.04 -0.33 0.18 0.42 0.04 0.00 0.00 177.00 177.27 1wdl s ILE 490 N -2.05 -0.11 -0.04 0.56 1.01 -1.16 -4.97 121.20 114.45 1wdl s ILE 490 Ca 0.66 0.21 -0.30 0.00 0.00 0.00 0.00 60.65 61.22 1wdl s ILE 490 Cb -0.14 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 1wdl s ILE 490 CO 0.18 0.09 1.28 -0.69 0.00 0.00 0.00 174.94 175.80 1wdl s VAL 491 N 1.48 4.05 -0.03 2.92 1.01 -1.26 -1.73 120.40 126.84 1wdl s VAL 491 Ca -0.06 1.39 0.02 0.00 0.00 0.00 0.00 61.98 63.33 1wdl s VAL 491 Cb -0.11 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.38 1wdl s VAL 491 CO -0.07 -0.01 -0.07 -0.69 0.00 0.00 0.00 175.10 174.27 1wdl s VAL 492 N 2.35 0.65 0.46 2.92 1.01 -0.82 -4.70 120.40 122.26 1wdl s VAL 492 Ca 0.59 -0.25 -0.21 0.00 0.00 0.00 0.00 61.98 62.11 1wdl s VAL 492 Cb -0.27 -0.61 -0.09 0.00 0.00 0.00 0.00 36.38 35.41 1wdl s VAL 492 CO 0.23 0.22 1.05 0.20 0.00 0.00 0.00 175.10 176.80 1wdl s ASN 493 N 0.47 6.43 0.18 3.32 0.01 -0.64 -0.22 114.94 124.49 1wdl s ASN 493 Ca -0.07 1.97 -0.32 0.00 -0.71 0.00 0.00 52.86 53.74 1wdl s ASN 493 Cb -0.11 -2.57 -0.11 0.00 0.41 0.00 0.00 41.25 38.87 1wdl s ASN 493 CO 0.00 -0.72 1.72 -0.62 -1.51 0.00 0.00 177.10 175.98 1wdl s ASP 494 N -1.85 6.42 -0.15 -1.22 2.15 -0.72 -4.77 116.67 116.53 1wdl s ASP 494 Ca 0.65 2.81 -0.30 0.00 0.43 0.00 0.00 52.55 56.13 1wdl s ASP 494 Cb -0.18 -2.59 0.12 0.00 -0.30 0.00 0.00 42.92 39.97 1wdl s ASP 494 CO 0.22 -0.96 0.98 0.00 -0.17 0.00 0.00 175.17 175.24 1wdl n PRO 496 N 0.72 0.90 0.00 0.00 -0.02 -1.26 -0.17 135.00 135.17 1wdl n PRO 496 Ca -0.11 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 1wdl n PRO 496 Cb 0.58 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1wdl n PRO 496 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wdl n GLY 497 N 6.19 0.23 7.00 -1.23 0.00 -1.26 -4.81 105.19 111.30 1wdl n GLY 497 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1wdl n GLY 497 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wdl n PHE 498 N -1.71 0.00 -0.05 1.61 0.99 0.76 -1.69 117.46 117.37 1wdl n PHE 498 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.45 57.40 1wdl n PHE 498 Cb 0.00 0.05 -0.02 0.00 -1.00 0.00 0.00 39.48 38.51 1wdl n PHE 498 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 1wdl n LEU 499 N 0.00 1.17 0.14 4.37 -0.00 -1.26 -4.26 117.00 117.16 1wdl n LEU 499 Ca 0.00 0.21 -0.10 0.00 -0.00 0.00 0.00 56.01 56.12 1wdl n LEU 499 Cb 0.00 -0.65 -0.05 0.00 -0.00 0.00 0.00 43.42 42.72 1wdl n LEU 499 CO 0.00 -0.36 0.51 0.58 -0.00 0.00 0.00 177.39 178.12 1wdl h VAL 500 N -0.61 0.00 -0.60 1.96 2.07 -1.86 -2.40 116.25 114.82 1wdl h VAL 500 Ca 0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 1wdl h VAL 500 Cb 0.60 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 1wdl h VAL 500 CO 0.00 0.00 0.25 0.78 0.02 0.00 0.00 177.57 178.62 1wdl h ASN 501 N -0.52 0.30 -0.14 0.57 4.21 -1.87 0.22 115.58 118.34 1wdl h ASN 501 Ca -0.03 0.06 0.04 0.00 1.21 0.00 0.00 56.30 57.59 1wdl h ASN 501 Cb 0.47 0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 37.68 1wdl h ASN 501 CO -0.07 0.18 0.15 -0.09 -1.29 0.00 0.00 177.43 176.32 1wdl h ARG 502 N 0.46 0.00 0.00 0.81 2.43 -1.25 -1.62 114.38 115.21 1wdl h ARG 502 Ca 0.29 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.29 1wdl h ARG 502 Cb 0.31 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1wdl h ARG 502 CO -0.26 0.00 -1.99 0.28 -1.51 0.00 0.00 179.97 176.49 1wdl n VAL 503 N -3.86 0.80 0.10 0.20 0.31 -0.30 -4.35 118.33 111.22 1wdl n VAL 503 Ca 0.01 -0.68 -0.03 0.00 -0.01 0.00 0.00 64.34 63.63 1wdl n VAL 503 Cb 0.27 -0.35 0.18 0.00 -0.91 0.00 0.00 33.84 33.03 1wdl n VAL 503 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1wdl h LEU 504 N 0.00 0.22 0.13 7.52 6.46 0.34 -3.23 115.31 126.75 1wdl h LEU 504 Ca -0.24 -0.11 -0.30 0.00 -0.12 0.00 0.00 57.88 57.11 1wdl h LEU 504 Cb 1.60 -0.06 0.03 0.00 -0.73 0.00 0.00 40.66 41.49 1wdl h LEU 504 CO 0.02 0.69 -1.28 -0.26 -0.62 0.00 0.00 178.44 176.99 1wdl h PHE 505 N 0.16 0.88 -0.61 1.25 -1.00 -1.70 -2.82 116.94 113.10 1wdl h PHE 505 Ca 0.01 -0.58 0.03 0.00 2.81 0.00 0.00 57.97 60.23 1wdl h PHE 505 Cb 0.95 -0.06 -0.03 0.00 3.61 0.00 0.00 35.95 40.42 1wdl h PHE 505 CO 0.02 1.43 0.40 -1.35 -1.61 0.00 0.00 178.31 177.20 1wdl h PRO 506 N 0.20 0.71 -0.66 1.51 0.11 -1.76 0.59 132.00 132.71 1wdl h PRO 506 Ca -0.19 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.92 1wdl h PRO 506 Cb 1.96 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.87 1wdl h PRO 506 CO 0.24 0.47 0.40 -0.92 -0.21 0.00 0.00 178.00 177.97 1wdl h TYR 507 N 0.73 0.74 0.00 0.65 3.20 -1.56 0.11 116.97 120.84 1wdl h TYR 507 Ca 0.24 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.13 1wdl h TYR 507 Cb 0.06 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.09 1wdl h TYR 507 CO -0.00 0.41 0.00 0.74 -1.64 0.00 0.00 178.16 177.67 1wdl h PHE 508 N 0.77 0.00 -0.36 -3.82 0.05 -0.46 -2.70 116.94 110.42 1wdl h PHE 508 Ca 0.27 0.00 -0.09 0.00 3.82 0.00 0.00 57.97 61.97 1wdl h PHE 508 Cb 0.05 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 37.99 1wdl h PHE 508 CO -0.05 0.00 -0.16 0.78 -0.18 0.00 0.00 178.31 178.69 1wdl h GLY 509 N 2.69 0.71 1.86 -1.45 0.00 0.27 0.98 103.07 108.13 1wdl h GLY 509 Ca 0.00 -0.55 -0.11 0.00 0.00 0.00 0.00 47.33 46.68 1wdl h GLY 509 CO 0.00 0.50 -0.44 -1.33 0.00 0.00 0.00 176.54 175.27 1wdl h GLY 510 N 0.98 0.16 0.54 4.60 0.00 -1.08 -2.35 103.07 105.92 1wdl h GLY 510 Ca 0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 1wdl h GLY 510 CO 0.04 0.14 -0.02 -2.75 0.00 0.00 0.00 176.54 173.95 1wdl h PHE 511 N 0.12 0.06 -0.78 5.60 3.57 -1.31 -2.36 116.94 121.85 1wdl h PHE 511 Ca 0.01 -0.02 0.16 0.00 3.53 0.00 0.00 57.97 61.65 1wdl h PHE 511 Cb 0.84 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.51 1wdl h PHE 511 CO 0.01 0.53 0.52 0.00 -2.23 0.00 0.00 178.31 177.14 1wdl h ALA 512 N 0.52 2.18 -0.09 2.41 0.00 -0.70 0.78 119.26 124.35 1wdl h ALA 512 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1wdl h ALA 512 Cb 0.52 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1wdl h ALA 512 CO 0.01 -0.39 -0.73 0.87 0.00 0.00 0.00 179.25 179.00 1wdl h LYS 513 N 0.38 0.46 -0.05 0.00 1.57 -1.31 -2.81 116.57 114.81 1wdl h LYS 513 Ca 0.38 -0.38 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1wdl h LYS 513 Cb 0.95 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.33 1wdl h LYS 513 CO -0.12 1.01 0.02 -0.07 -0.57 0.00 0.00 179.45 179.72 1wdl h LEU 514 N 0.31 0.07 -1.19 2.94 3.38 -0.33 -1.82 115.31 118.67 1wdl h LEU 514 Ca -0.03 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.78 1wdl h LEU 514 Cb 1.32 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 42.01 1wdl h LEU 514 CO 0.13 0.22 0.55 0.58 0.09 0.00 0.00 178.44 180.00 1wdl h VAL 515 N -0.08 1.21 0.00 1.22 2.07 -1.40 0.33 116.25 119.60 1wdl h VAL 515 Ca 0.02 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1wdl h VAL 515 Cb 0.17 -0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 1wdl h VAL 515 CO -0.00 0.20 -0.04 0.28 0.02 0.00 0.00 177.57 178.03 1wdl h SER 516 N 1.11 0.00 -0.55 0.57 0.02 -1.26 -2.40 113.55 111.04 1wdl h SER 516 Ca 0.30 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 61.10 1wdl h SER 516 Cb -0.12 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.33 1wdl h SER 516 CO -0.07 0.04 0.20 0.00 -1.14 0.00 0.00 176.83 175.86 1wdl n ALA 517 N -2.13 4.04 -1.20 3.77 0.00 0.03 -0.77 120.51 124.25 1wdl n ALA 517 Ca -0.00 -1.70 -0.07 0.00 0.00 0.00 0.00 53.44 51.67 1wdl n ALA 517 Cb 0.29 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.52 1wdl n ALA 517 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wdl n GLY 518 N -0.01 0.82 3.70 0.00 0.00 -0.90 -2.90 105.19 105.89 1wdl n GLY 518 Ca 0.30 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1wdl n GLY 518 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wdl s VAL 519 N -1.95 4.92 -0.08 1.61 1.01 -0.71 -4.93 120.40 120.27 1wdl s VAL 519 Ca 0.00 1.76 -0.29 0.00 0.00 0.00 0.00 61.98 63.44 1wdl s VAL 519 Cb 0.00 -4.19 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 1wdl s VAL 519 CO 0.00 0.15 1.75 -0.62 0.00 0.00 0.00 175.10 176.38 1wdl s ASP 520 N 0.98 6.49 0.55 3.32 3.68 -1.26 -4.23 116.67 126.19 1wdl s ASP 520 Ca 0.44 2.19 0.27 0.00 2.13 0.00 0.00 52.55 57.57 1wdl s ASP 520 Cb -0.19 -2.53 1.58 0.00 -1.45 0.00 0.00 42.92 40.33 1wdl s ASP 520 CO 0.20 -1.08 2.15 2.19 0.13 0.00 0.00 175.17 178.76 1wdl h PHE 521 N 10.35 0.00 -0.57 -5.34 -5.15 -1.95 -1.46 116.94 112.82 1wdl h PHE 521 Ca -0.40 0.00 -0.09 0.00 -0.20 0.00 0.00 57.97 57.28 1wdl h PHE 521 Cb 1.19 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.34 1wdl h PHE 521 CO 0.91 0.07 0.02 0.28 -2.00 0.00 0.00 178.31 177.58 1wdl h VAL 522 N 0.00 1.26 -0.21 0.88 2.07 -1.99 -1.87 116.25 116.40 1wdl h VAL 522 Ca -0.00 -1.10 -0.13 0.00 0.82 0.00 0.00 66.70 66.28 1wdl h VAL 522 Cb 0.17 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1wdl h VAL 522 CO 0.01 0.40 -0.43 -0.09 0.02 0.00 0.00 177.57 177.47 1wdl h ARG 523 N 0.88 0.50 0.75 1.57 2.43 -1.69 -2.84 114.38 115.97 1wdl h ARG 523 Ca 0.16 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 59.04 1wdl h ARG 523 Cb 0.52 0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1wdl h ARG 523 CO 0.03 0.84 -0.38 0.82 -1.51 0.00 0.00 179.97 179.76 1wdl h ILE 524 N 0.41 0.00 0.00 1.20 2.04 -0.86 -2.41 117.51 117.88 1wdl h ILE 524 Ca 0.03 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 1wdl h ILE 524 Cb 0.92 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1wdl h ILE 524 CO 0.08 0.00 -0.12 -2.24 0.00 0.00 0.00 178.15 175.87 1wdl h ASP 525 N -1.04 0.00 0.24 1.72 3.04 -1.44 0.19 116.42 119.13 1wdl h ASP 525 Ca -0.10 0.00 -0.07 0.00 -3.24 0.00 0.00 57.03 53.61 1wdl h ASP 525 Cb 0.80 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.08 1wdl h ASP 525 CO 0.16 0.12 -0.31 0.11 -2.04 0.00 0.00 179.24 177.28 1wdl h LYS 526 N 0.00 0.11 0.20 4.15 1.57 -1.41 0.27 116.57 121.45 1wdl h LYS 526 Ca -0.00 -0.04 -0.32 0.00 -1.87 0.00 0.00 60.65 58.42 1wdl h LYS 526 Cb 0.27 -0.01 0.03 0.00 0.08 0.00 0.00 32.23 32.60 1wdl h LYS 526 CO 0.02 0.41 -1.37 0.28 -0.57 0.00 0.00 179.45 178.21 1wdl h VAL 527 N 0.10 1.32 0.00 0.50 2.07 -0.58 -2.34 116.25 117.33 1wdl h VAL 527 Ca 0.01 -2.70 -0.09 0.00 0.82 0.00 0.00 66.70 64.75 1wdl h VAL 527 Cb 0.60 2.93 -0.01 0.00 -1.52 0.00 0.00 31.29 33.29 1wdl h VAL 527 CO 0.04 0.81 -0.41 0.24 0.02 0.00 0.00 177.57 178.27 1wdl h MET 528 N 0.17 0.00 0.00 1.57 2.86 -0.59 -0.52 114.93 118.41 1wdl h MET 528 Ca -0.22 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.25 1wdl h MET 528 Cb 2.07 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.70 1wdl h MET 528 CO 0.25 0.41 -0.84 0.93 1.06 0.00 0.00 176.91 178.72 1wdl h GLU 529 N 0.00 0.00 0.00 1.72 5.08 -0.52 -1.95 114.58 118.91 1wdl h GLU 529 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1wdl h GLU 529 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1wdl h GLU 529 CO 0.05 0.84 0.00 -0.22 -1.00 0.00 0.00 179.01 178.69 1wdl h LYS 530 N 0.00 0.00 0.04 2.33 3.64 -0.83 -3.07 116.57 118.69 1wdl h LYS 530 Ca -0.01 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1wdl h LYS 530 Cb 1.61 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.44 1wdl h LYS 530 CO 0.11 0.00 -0.44 0.35 -2.27 0.00 0.00 179.45 177.20 1wdl h PHE 531 N 0.00 0.36 0.00 1.91 3.57 -0.80 -3.48 116.94 118.50 1wdl h PHE 531 Ca 0.00 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1wdl h PHE 531 Cb 0.74 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.45 1wdl h PHE 531 CO 0.00 1.09 0.00 0.41 -2.23 0.00 0.00 178.31 177.58 1wdl n GLY 532 N 1.32 -0.00 3.75 2.40 0.00 -0.92 -5.00 105.19 106.74 1wdl n GLY 532 Ca -0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 1wdl n GLY 532 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1wdl s TRP 533 N 0.00 3.23 0.10 1.61 0.52 -0.78 -2.69 118.94 120.93 1wdl s TRP 533 Ca 0.00 1.36 -0.31 0.00 0.02 0.00 0.00 56.10 57.17 1wdl s TRP 533 Cb 0.00 -3.58 -0.13 0.00 -1.15 0.00 0.00 33.47 28.61 1wdl s TRP 533 CO 0.00 -1.68 1.61 -1.35 0.02 0.00 0.00 176.95 175.55 1wdl h PRO 534 N 4.44 -0.70 -6.48 4.98 0.11 -1.89 -3.37 132.00 129.08 1wdl h PRO 534 Ca -0.46 0.05 -0.63 0.00 0.11 0.00 0.00 66.00 65.06 1wdl h PRO 534 Cb 1.22 0.16 -0.15 0.00 0.11 0.00 0.00 31.00 32.33 1wdl h PRO 534 CO 0.72 -0.47 -0.75 -1.64 -0.21 0.00 0.00 178.00 175.64 1wdl s MET 535 N -5.98 1.88 0.62 1.05 -1.94 -1.26 -4.21 119.30 109.46 1wdl s MET 535 Ca -0.17 -1.37 -0.10 0.00 -1.71 0.00 0.00 55.69 52.34 1wdl s MET 535 Cb 0.06 -2.05 -0.03 0.00 2.01 0.00 0.00 34.83 34.83 1wdl s MET 535 CO 0.63 0.42 1.00 0.20 -0.01 0.00 0.00 175.02 177.26 1wdl s GLY 536 N -2.83 1.63 0.15 -0.03 0.00 -1.26 -4.81 107.32 100.17 1wdl s GLY 536 Ca 0.24 -0.23 -0.22 0.00 0.00 0.00 0.00 44.72 44.51 1wdl s GLY 536 CO 0.14 0.05 1.63 -2.55 0.00 0.00 0.00 173.10 172.36 1wdl h PRO 537 N -0.30 -0.23 -0.12 2.90 0.11 -1.92 0.51 132.00 132.95 1wdl h PRO 537 Ca -0.45 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 1wdl h PRO 537 Cb 1.21 0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 1wdl h PRO 537 CO 0.62 -0.16 0.04 0.00 -0.21 0.00 0.00 178.00 178.29 1wdl h ALA 538 N 0.81 0.15 -0.80 -0.75 0.00 -1.94 -1.49 119.26 115.24 1wdl h ALA 538 Ca 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1wdl h ALA 538 Cb 0.45 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1wdl h ALA 538 CO -0.37 -0.23 0.42 -0.92 0.00 0.00 0.00 179.25 178.15 1wdl h TYR 539 N -0.00 1.10 -0.30 0.00 3.20 -1.89 -2.27 116.97 116.81 1wdl h TYR 539 Ca 0.04 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 1wdl h TYR 539 Cb 0.22 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 1wdl h TYR 539 CO -0.00 0.77 0.06 1.25 -1.64 0.00 0.00 178.16 178.60 1wdl h LEU 540 N 1.12 0.46 -1.75 2.82 6.46 0.15 -2.20 115.31 122.38 1wdl h LEU 540 Ca 0.28 -0.25 0.09 0.00 -0.12 0.00 0.00 57.88 57.88 1wdl h LEU 540 Cb 0.05 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 39.83 1wdl h LEU 540 CO -0.04 0.59 0.34 0.24 -0.62 0.00 0.00 178.44 178.95 1wdl h MET 541 N 0.32 0.28 -0.29 1.25 2.86 -0.88 -0.10 114.93 118.38 1wdl h MET 541 Ca 0.09 -0.02 -0.19 0.00 -2.06 0.00 0.00 59.70 57.53 1wdl h MET 541 Cb 0.32 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1wdl h MET 541 CO 0.00 0.19 -0.55 -0.44 1.06 0.00 0.00 176.91 177.17 1wdl h ASP 542 N 0.29 0.97 0.08 1.22 3.32 -0.95 0.79 116.42 122.14 1wdl h ASP 542 Ca 0.23 -0.52 -0.00 0.00 0.02 0.00 0.00 57.03 56.75 1wdl h ASP 542 Cb 0.53 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1wdl h ASP 542 CO -0.05 1.32 -0.04 0.58 -1.72 0.00 0.00 179.24 179.33 1wdl h VAL 543 N 0.67 1.05 -0.45 -1.35 2.07 -0.52 -1.45 116.25 116.27 1wdl h VAL 543 Ca 0.01 -0.48 -0.08 0.00 0.82 0.00 0.00 66.70 66.97 1wdl h VAL 543 Cb 1.16 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 1wdl h VAL 543 CO 0.12 0.12 -0.04 0.58 0.02 0.00 0.00 177.57 178.38 1wdl h VAL 544 N -0.33 1.24 0.00 2.57 2.07 -1.12 -3.46 116.25 117.22 1wdl h VAL 544 Ca -0.01 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1wdl h VAL 544 Cb 0.28 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1wdl h VAL 544 CO 0.02 0.36 0.00 0.61 0.02 0.00 0.00 177.57 178.58 1wdl n GLY 545 N -0.60 2.55 0.28 2.17 0.00 0.27 -4.60 105.19 105.26 1wdl n GLY 545 Ca 0.02 -1.38 -0.01 0.00 0.00 0.00 0.00 46.02 44.65 1wdl n GLY 545 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1wdl h ILE 546 N 0.00 1.21 -0.09 -0.61 5.03 -1.53 0.11 117.51 121.62 1wdl h ILE 546 Ca 0.00 -0.82 -0.11 0.00 -0.12 0.00 0.00 64.86 63.82 1wdl h ILE 546 Cb 0.00 0.87 -0.01 0.00 -3.03 0.00 0.00 36.82 34.65 1wdl h ILE 546 CO 0.00 0.29 -0.41 -2.24 -0.68 0.00 0.00 178.15 175.10 1wdl h ASP 547 N 0.60 0.22 0.04 1.72 3.04 -1.91 -1.02 116.42 119.11 1wdl h ASP 547 Ca 0.13 -0.09 -0.00 0.00 -3.24 0.00 0.00 57.03 53.83 1wdl h ASP 547 Cb 0.34 -0.06 0.00 0.00 -1.04 0.00 0.00 39.33 38.57 1wdl h ASP 547 CO 0.01 0.61 -0.02 0.74 -2.04 0.00 0.00 179.24 178.55 1wdl h THR 548 N 0.18 1.30 -0.59 1.15 2.02 -1.67 -2.91 112.91 112.39 1wdl h THR 548 Ca 0.02 -1.73 0.10 0.00 0.77 0.00 0.00 66.41 65.57 1wdl h THR 548 Cb 0.81 2.34 -0.03 0.00 -1.74 0.00 0.00 68.15 69.53 1wdl h THR 548 CO 0.06 0.40 0.40 1.23 0.37 0.00 0.00 175.52 177.98 1wdl h GLY 549 N -0.89 0.53 1.39 2.16 0.00 -0.80 0.54 103.07 105.99 1wdl h GLY 549 Ca -0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 47.33 47.04 1wdl h GLY 549 CO 0.01 0.09 -0.36 0.84 0.00 0.00 0.00 176.54 177.12 1wdl h HIS 550 N 0.37 0.80 -0.25 5.60 6.17 -1.24 -1.81 115.15 124.80 1wdl h HIS 550 Ca 0.27 -0.22 -0.16 0.00 0.71 0.00 0.00 60.37 60.97 1wdl h HIS 550 Cb 0.58 -0.17 0.00 0.00 2.52 0.00 0.00 27.41 30.33 1wdl h HIS 550 CO -0.00 0.94 -0.49 1.25 0.71 0.00 0.00 177.93 180.34 1wdl h HIS 551 N 0.56 0.97 -0.10 5.26 6.17 -0.85 -3.08 115.15 124.08 1wdl h HIS 551 Ca 0.06 -0.35 -0.05 0.00 0.71 0.00 0.00 60.37 60.74 1wdl h HIS 551 Cb 0.88 -0.18 -0.01 0.00 2.52 0.00 0.00 27.41 30.62 1wdl h HIS 551 CO 0.04 1.15 -0.15 0.78 0.71 0.00 0.00 177.93 180.46 1wdl h GLY 552 N 0.51 0.17 0.78 5.26 0.00 -0.88 -2.67 103.07 106.23 1wdl h GLY 552 Ca 0.01 -0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.27 1wdl h GLY 552 CO 0.11 0.10 0.17 -0.09 0.00 0.00 0.00 176.54 176.83 1wdl h ARG 553 N 0.15 0.34 -0.28 4.80 2.43 -1.23 -1.49 114.38 119.11 1wdl h ARG 553 Ca 0.03 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.10 1wdl h ARG 553 Cb 0.36 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1wdl h ARG 553 CO 0.02 0.23 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.11 1wdl h ASP 554 N 0.35 0.47 -0.24 -3.80 5.19 -1.50 0.34 116.42 117.23 1wdl h ASP 554 Ca 0.16 -0.13 -0.09 0.00 -0.62 0.00 0.00 57.03 56.35 1wdl h ASP 554 Cb 0.09 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.46 1wdl h ASP 554 CO -0.13 0.66 -0.14 0.58 -3.12 0.00 0.00 179.24 177.09 1wdl h VAL 555 N 0.44 1.25 0.03 -1.35 2.07 -1.09 -2.07 116.25 115.54 1wdl h VAL 555 Ca 0.08 -1.15 -0.26 0.00 0.82 0.00 0.00 66.70 66.19 1wdl h VAL 555 Cb 0.54 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1wdl h VAL 555 CO 0.03 0.38 -1.36 0.24 0.02 0.00 0.00 177.57 176.89 1wdl h MET 556 N 0.60 0.07 -0.47 1.57 2.86 -1.05 -3.04 114.93 115.48 1wdl h MET 556 Ca 0.10 -0.12 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 1wdl h MET 556 Cb 0.58 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.26 1wdl h MET 556 CO 0.04 0.88 0.20 0.00 1.06 0.00 0.00 176.91 179.09 1wdl h ALA 557 N 0.85 0.61 -0.22 6.32 0.00 -0.81 -1.91 119.26 124.10 1wdl h ALA 557 Ca -0.16 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 1wdl h ALA 557 Cb 1.91 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 1wdl h ALA 557 CO 0.12 0.20 -0.34 0.93 0.00 0.00 0.00 179.25 180.16 1wdl h GLU 558 N 0.61 0.47 0.60 0.00 5.08 -1.49 -2.28 114.58 117.57 1wdl h GLU 558 Ca 0.16 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1wdl h GLU 558 Cb 0.18 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.42 1wdl h GLU 558 CO -0.01 0.75 -0.29 0.78 -1.00 0.00 0.00 179.01 179.24 1wdl h GLY 559 N 1.08 -0.84 -6.49 -3.84 0.00 -1.33 -3.37 103.07 88.27 1wdl h GLY 559 Ca 0.05 0.31 -0.60 0.00 0.00 0.00 0.00 47.33 47.09 1wdl h GLY 559 CO 0.06 -0.31 -0.77 0.69 0.00 0.00 0.00 176.54 176.22 1wdl n PHE 560 N -5.41 1.71 -0.05 5.60 3.01 -0.75 -4.95 117.46 116.61 1wdl n PHE 560 Ca -0.13 -3.90 0.12 0.00 1.01 0.00 0.00 57.45 54.55 1wdl n PHE 560 Cb 0.34 -0.35 0.52 0.00 -0.01 0.00 0.00 39.48 39.98 1wdl n PHE 560 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1wdl h PRO 561 N 4.89 0.36 0.00 -1.08 0.11 -1.59 -0.61 132.00 134.08 1wdl h PRO 561 Ca 0.18 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1wdl h PRO 561 Cb 0.79 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1wdl h PRO 561 CO 0.62 0.24 0.16 0.38 -0.21 0.00 0.00 178.00 179.19 1wdl h ASP 562 N 0.37 0.00 0.00 -2.05 2.03 -1.93 -3.28 116.42 111.56 1wdl h ASP 562 Ca 0.25 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.55 1wdl h ASP 562 Cb 0.49 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.99 1wdl h ASP 562 CO -0.06 0.00 0.00 -2.11 -1.03 0.00 0.00 179.24 176.04 1wdl n ARG 563 N -2.47 1.51 -0.49 4.15 1.85 -1.01 -4.87 116.66 115.33 1wdl n ARG 563 Ca -0.02 0.00 0.05 0.00 -1.00 0.00 0.00 57.85 56.88 1wdl n ARG 563 Cb 0.20 -0.13 0.19 0.00 -1.05 0.00 0.00 32.46 31.68 1wdl n ARG 563 CO 0.00 0.00 0.00 -1.33 -0.01 0.00 0.00 177.63 176.29 1wdl n MET 564 N 0.00 1.71 -3.87 2.89 2.81 -0.27 -4.53 117.12 115.86 1wdl n MET 564 Ca 0.00 -3.03 -0.28 0.00 -1.81 0.00 0.00 57.70 52.57 1wdl n MET 564 Cb 0.00 -1.66 -0.12 0.00 -0.71 0.00 0.00 33.22 30.74 1wdl n MET 564 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1wdl n LYS 565 N -1.14 1.92 0.00 0.03 5.02 -1.24 -3.80 118.16 118.96 1wdl n LYS 565 Ca 0.22 -4.50 0.00 0.00 -2.02 0.00 0.00 58.31 52.00 1wdl n LYS 565 Cb 0.78 -2.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.49 1wdl n LYS 565 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1wdl n ASP 566 N 1.92 0.00 -0.14 4.39 5.75 -1.26 -5.02 116.55 122.19 1wdl n ASP 566 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.98 1wdl n ASP 566 Cb 0.35 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 1wdl n ASP 566 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1wdl n ASP 567 N 0.00 -0.19 -3.34 -1.12 9.92 -1.26 -5.11 116.55 115.46 1wdl n ASP 567 Ca 0.00 0.00 0.02 0.00 -0.53 0.00 0.00 54.79 54.28 1wdl n ASP 567 Cb 0.00 -0.09 -0.03 0.00 -0.64 0.00 0.00 41.12 40.36 1wdl n ASP 567 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1wdl s ARG 568 N -0.07 0.32 0.17 -1.24 0.52 -1.26 -5.12 118.95 112.27 1wdl s ARG 568 Ca 0.00 0.73 -0.31 0.00 -0.52 0.00 0.00 55.73 55.62 1wdl s ARG 568 Cb 0.00 0.43 -0.17 0.00 0.52 0.00 0.00 34.95 35.73 1wdl s ARG 568 CO 0.00 -0.19 0.89 0.54 0.02 0.00 0.00 175.30 176.56 1wdl n ARG 569 N 5.17 0.58 -4.74 3.54 1.74 -1.26 -4.99 116.66 116.70 1wdl n ARG 569 Ca -0.08 0.20 -0.33 0.00 -0.77 0.00 0.00 57.85 56.87 1wdl n ARG 569 Cb 0.52 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.40 1wdl n ARG 569 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1wdl n SER 570 N 1.79 3.34 0.20 0.55 3.41 -1.26 -4.77 113.62 116.88 1wdl n SER 570 Ca 0.16 -3.29 0.17 0.00 -0.26 0.00 0.00 58.87 55.65 1wdl n SER 570 Cb 0.23 0.40 0.81 0.00 -0.26 0.00 0.00 64.21 65.40 1wdl n SER 570 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wdl h ALA 571 N 1.29 1.84 0.00 7.33 0.00 -1.94 0.10 119.26 127.89 1wdl h ALA 571 Ca -0.43 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1wdl h ALA 571 Cb 1.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1wdl h ALA 571 CO 0.71 -0.28 -0.00 0.82 0.00 0.00 0.00 179.25 180.50 1wdl h ILE 572 N 0.00 1.27 -0.29 0.00 2.04 -1.96 -2.15 117.51 116.43 1wdl h ILE 572 Ca 0.09 -0.80 -0.12 0.00 1.00 0.00 0.00 64.86 65.03 1wdl h ILE 572 Cb 0.45 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 1wdl h ILE 572 CO -0.00 0.21 -0.32 0.44 0.00 0.00 0.00 178.15 178.48 1wdl h ASP 573 N -0.34 0.63 0.66 1.72 3.32 -1.68 -2.36 116.42 118.37 1wdl h ASP 573 Ca -0.00 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 56.78 1wdl h ASP 573 Cb 0.34 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1wdl h ASP 573 CO 0.00 0.90 -0.49 0.00 -1.72 0.00 0.00 179.24 177.93 1wdl h ALA 574 N 1.14 -1.19 -0.82 3.45 0.00 -0.94 0.14 119.26 121.04 1wdl h ALA 574 Ca 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1wdl h ALA 574 Cb 0.80 0.65 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 1wdl h ALA 574 CO 0.07 -1.20 0.41 -0.07 0.00 0.00 0.00 179.25 178.46 1wdl h LEU 575 N -1.11 1.05 -0.23 0.00 3.38 -1.43 -0.61 115.31 116.36 1wdl h LEU 575 Ca -0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1wdl h LEU 575 Cb 0.92 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1wdl h LEU 575 CO 0.03 0.87 0.11 0.22 0.09 0.00 0.00 178.44 179.76 1wdl h TYR 576 N 1.16 0.33 0.00 1.13 3.20 -1.26 0.34 116.97 121.86 1wdl h TYR 576 Ca 0.28 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.14 1wdl h TYR 576 Cb 0.09 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.25 1wdl h TYR 576 CO 0.01 0.33 0.00 0.39 -1.64 0.00 0.00 178.16 177.25 1wdl n GLU 577 N -4.83 0.02 -0.57 1.82 1.02 0.49 -2.83 120.64 115.76 1wdl n GLU 577 Ca -0.03 0.17 0.08 0.00 -0.02 0.00 0.00 57.16 57.35 1wdl n GLU 577 Cb 0.10 -1.53 0.31 0.00 -0.02 0.00 0.00 31.44 30.30 1wdl n GLU 577 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wdl n ALA 578 N -1.53 3.13 -0.91 0.62 0.00 -0.26 -4.94 120.51 116.62 1wdl n ALA 578 Ca 0.05 -1.88 0.00 0.00 0.00 0.00 0.00 53.44 51.61 1wdl n ALA 578 Cb 0.25 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1wdl n ALA 578 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1wdl n LYS 579 N 0.34 -1.19 -2.99 0.00 5.02 -1.02 -4.90 118.16 113.43 1wdl n LYS 579 Ca 0.23 0.30 -0.44 0.00 -2.02 0.00 0.00 58.31 56.38 1wdl n LYS 579 Cb 0.91 -4.43 -0.00 0.00 -0.02 0.00 0.00 35.03 31.49 1wdl n LYS 579 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1wdl s ARG 580 N -1.36 4.10 0.00 1.97 0.52 0.04 -4.84 118.95 119.37 1wdl s ARG 580 Ca 0.00 -2.65 0.05 0.00 -0.52 0.00 0.00 55.73 52.62 1wdl s ARG 580 Cb 0.00 -5.01 0.31 0.00 0.52 0.00 0.00 34.95 30.77 1wdl s ARG 580 CO 0.00 -1.71 1.08 1.28 0.02 0.00 0.00 175.30 175.97 1wdl n LEU 581 N 5.35 0.00 0.00 2.53 4.77 -1.07 -4.27 117.00 124.30 1wdl n LEU 581 Ca 0.35 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1wdl n LEU 581 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1wdl n LEU 581 CO 0.61 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1wdl n GLY 582 N 0.44 -0.29 0.24 -0.72 0.00 0.28 -2.44 105.19 102.70 1wdl n GLY 582 Ca 0.04 -1.98 -0.09 0.00 0.00 0.00 0.00 46.02 43.98 1wdl n GLY 582 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1wdl h GLN 583 N 0.00 0.71 -0.04 1.61 4.15 -1.53 0.14 115.11 120.14 1wdl h GLN 583 Ca 0.00 -0.35 -0.09 0.00 0.77 0.00 0.00 58.65 58.97 1wdl h GLN 583 Cb 0.00 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1wdl h GLN 583 CO 0.00 0.97 -0.41 0.87 -1.93 0.00 0.00 178.83 178.33 1wdl h LYS 584 N 0.59 0.09 0.00 1.69 1.57 -1.82 -2.80 116.57 115.89 1wdl h LYS 584 Ca 0.05 -0.04 -0.23 0.00 -1.87 0.00 0.00 60.65 58.57 1wdl h LYS 584 Cb 0.91 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.18 1wdl h LYS 584 CO 0.08 0.49 -1.22 -0.97 -0.57 0.00 0.00 179.45 177.26 1wdl h ASN 585 N 0.08 0.00 0.00 0.86 -1.24 -1.76 -3.48 115.58 110.04 1wdl h ASN 585 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.02 1wdl h ASN 585 Cb 0.76 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.81 1wdl h ASN 585 CO 0.06 0.94 0.00 0.61 -1.29 0.00 0.00 177.43 177.74 1wdl n GLY 586 N 1.41 0.53 3.14 1.57 0.00 0.10 -4.97 105.19 106.98 1wdl n GLY 586 Ca -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 1wdl n GLY 586 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wdl s LYS 587 N -0.73 0.24 0.00 1.61 -2.85 0.25 -1.85 119.74 116.41 1wdl s LYS 587 Ca 0.00 0.88 0.00 0.00 -1.00 0.00 0.00 55.97 55.85 1wdl s LYS 587 Cb 0.00 0.14 0.00 0.00 -2.06 0.00 0.00 37.83 35.91 1wdl s LYS 587 CO 0.00 -0.26 0.00 0.41 0.10 0.00 0.00 175.35 175.60 1wdl n GLY 588 N 5.29 4.44 0.20 0.59 0.00 -1.25 -0.55 105.19 113.91 1wdl n GLY 588 Ca -0.09 -0.53 0.06 0.00 0.00 0.00 0.00 46.02 45.47 1wdl n GLY 588 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1wdl h PHE 589 N 0.00 0.00 -1.25 1.61 -1.00 -1.91 -3.44 116.94 110.94 1wdl h PHE 589 Ca 0.00 0.00 -0.63 0.00 2.81 0.00 0.00 57.97 60.15 1wdl h PHE 589 Cb 0.00 0.00 -0.13 0.00 3.61 0.00 0.00 35.95 39.43 1wdl h PHE 589 CO 0.00 0.33 -0.52 0.71 -1.61 0.00 0.00 178.31 177.23 1wdl s TYR 590 N -3.73 1.85 0.05 -0.55 1.51 -1.26 -4.84 117.35 110.38 1wdl s TYR 590 Ca -0.01 -1.07 0.07 0.00 -1.01 0.00 0.00 57.07 55.05 1wdl s TYR 590 Cb 0.11 -1.45 -0.03 0.00 -0.11 0.00 0.00 41.96 40.48 1wdl s TYR 590 CO 0.67 0.04 -0.15 0.00 -1.11 0.00 0.00 175.55 175.00 1wdl s ALA 591 N -3.00 2.72 -0.04 3.71 0.00 -0.72 -4.37 121.76 120.06 1wdl s ALA 591 Ca 0.13 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.93 1wdl s ALA 591 Cb 0.02 -0.82 0.01 0.00 0.00 0.00 0.00 23.12 22.33 1wdl s ALA 591 CO 0.08 0.59 -0.07 0.71 0.00 0.00 0.00 175.76 177.06 1wdl s TYR 592 N -1.00 0.92 -0.32 0.00 1.51 -0.77 -0.32 117.35 117.37 1wdl s TYR 592 Ca 0.16 -0.26 -0.16 0.00 -1.01 0.00 0.00 57.07 55.81 1wdl s TYR 592 Cb -0.11 -0.71 -0.02 0.00 -0.11 0.00 0.00 41.96 41.02 1wdl s TYR 592 CO 0.07 -0.16 0.40 0.21 -1.11 0.00 0.00 175.55 174.96 1wdl s LYS 602 N 0.53 3.72 0.37 -0.62 2.20 -1.26 -4.77 119.74 119.91 1wdl s LYS 602 Ca -0.08 -0.22 0.08 0.00 -0.36 0.00 0.00 55.97 55.40 1wdl s LYS 602 Cb -0.12 -3.76 -0.06 0.00 -1.51 0.00 0.00 37.83 32.38 1wdl s LYS 602 CO 0.01 -0.47 0.02 -0.51 -0.36 0.00 0.00 175.35 174.04 1wdl s LEU 603 N 2.11 2.93 0.10 5.43 1.43 0.56 -5.15 118.68 126.09 1wdl s LEU 603 Ca 0.14 -1.14 0.10 0.00 -1.03 0.00 0.00 54.13 52.20 1wdl s LEU 603 Cb -0.16 -1.18 -0.03 0.00 0.03 0.00 0.00 46.19 44.84 1wdl s LEU 603 CO 0.11 -0.33 -0.25 -0.69 0.23 0.00 0.00 176.35 175.42 1wdl s VAL 604 N -2.60 2.06 -0.25 -1.59 1.01 -1.26 -1.76 120.40 116.00 1wdl s VAL 604 Ca 0.35 -1.58 -0.13 0.00 0.00 0.00 0.00 61.98 60.62 1wdl s VAL 604 Cb 0.04 -1.81 0.08 0.00 0.00 0.00 0.00 36.38 34.68 1wdl s VAL 604 CO 0.19 0.13 0.61 1.51 0.00 0.00 0.00 175.10 177.54 1wdl s ASP 605 N -1.76 -0.85 0.00 3.32 -4.77 -1.26 -4.95 116.67 106.41 1wdl s ASP 605 Ca 0.11 1.37 0.02 0.00 -3.30 0.00 0.00 52.55 50.74 1wdl s ASP 605 Cb -0.10 1.35 0.10 0.00 -1.09 0.00 0.00 42.92 43.18 1wdl s ASP 605 CO 0.04 -0.23 0.69 -1.54 0.70 0.00 0.00 175.17 174.84 1wdl n SER 606 N 4.48 0.00 0.21 2.11 3.41 -1.26 -2.30 113.62 120.27 1wdl n SER 606 Ca -0.19 0.07 0.09 0.00 -0.26 0.00 0.00 58.87 58.58 1wdl n SER 606 Cb 0.57 -0.11 0.36 0.00 -0.26 0.00 0.00 64.21 64.77 1wdl n SER 606 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1wdl h SER 607 N 0.00 0.00 0.67 4.04 4.64 -2.01 -2.94 113.55 117.95 1wdl h SER 607 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1wdl h SER 607 Cb 0.01 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1wdl h SER 607 CO 0.00 0.25 -0.42 0.58 -0.87 0.00 0.00 176.83 176.36 1wdl h VAL 608 N 0.00 1.08 -0.95 0.95 2.07 -1.83 -3.04 116.25 114.53 1wdl h VAL 608 Ca -0.00 -1.57 0.04 0.00 0.82 0.00 0.00 66.70 65.99 1wdl h VAL 608 Cb 0.88 1.90 -0.06 0.00 -1.52 0.00 0.00 31.29 32.49 1wdl h VAL 608 CO 0.03 0.41 0.62 -0.07 0.02 0.00 0.00 177.57 178.58 1wdl h LEU 609 N 0.00 1.01 -0.38 2.57 3.38 -1.73 -2.26 115.31 117.91 1wdl h LEU 609 Ca -0.00 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1wdl h LEU 609 Cb 0.87 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 1wdl h LEU 609 CO 0.05 0.68 0.14 -0.33 0.09 0.00 0.00 178.44 179.07 1wdl h GLU 610 N 1.17 0.28 -0.27 1.13 5.08 -1.68 -1.29 114.58 119.00 1wdl h GLU 610 Ca 0.38 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.65 1wdl h GLU 610 Cb 0.05 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1wdl h GLU 610 CO -0.13 0.19 -0.15 0.28 -1.00 0.00 0.00 179.01 178.21 1wdl h VAL 611 N 0.29 1.23 0.00 3.13 2.07 -1.55 -3.00 116.25 118.43 1wdl h VAL 611 Ca 0.17 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.64 1wdl h VAL 611 Cb 0.14 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1wdl h VAL 611 CO -0.17 0.34 -0.21 0.18 0.02 0.00 0.00 177.57 177.73 1wdl n LEU 612 N -4.19 0.49 -0.10 2.57 4.77 -0.90 -4.16 117.00 115.48 1wdl n LEU 612 Ca 0.00 0.39 -0.06 0.00 -0.03 0.00 0.00 56.01 56.32 1wdl n LEU 612 Cb 0.33 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1wdl n LEU 612 CO 0.40 -0.05 0.86 0.50 -1.33 0.00 0.00 177.39 177.78 1wdl h LYS 613 N 0.00 0.12 0.00 3.23 1.63 -1.10 -1.48 116.57 118.96 1wdl h LYS 613 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1wdl h LYS 613 Cb 0.63 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.23 1wdl h LYS 613 CO 0.00 0.08 0.01 -2.30 -3.45 0.00 0.00 179.45 173.78 1wdl n PRO 614 N -5.16 0.12 -0.01 1.90 -0.02 -1.26 -1.70 135.00 128.87 1wdl n PRO 614 Ca 0.01 0.61 -0.05 0.00 -2.02 0.00 0.00 63.50 62.05 1wdl n PRO 614 Cb 0.18 -1.89 -0.12 0.00 -0.02 0.00 0.00 33.50 31.64 1wdl n PRO 614 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1wdl n ILE 615 N -2.13 1.43 -1.92 4.25 2.08 -0.57 -4.84 119.36 117.66 1wdl n ILE 615 Ca -0.01 -0.76 -0.43 0.00 0.56 0.00 0.00 62.75 62.11 1wdl n ILE 615 Cb 0.04 -0.89 -0.03 0.00 -0.75 0.00 0.00 39.64 38.01 1wdl n ILE 615 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1wdl s VAL 616 N -2.72 3.40 -0.61 1.39 1.01 -0.69 -4.49 120.40 117.69 1wdl s VAL 616 Ca -0.04 0.44 0.14 0.00 0.00 0.00 0.00 61.98 62.51 1wdl s VAL 616 Cb 0.08 -3.45 -0.15 0.00 0.00 0.00 0.00 36.38 32.86 1wdl s VAL 616 CO 0.82 -0.23 0.57 -1.22 0.00 0.00 0.00 175.10 175.04 1wdl n TYR 617 N 9.56 0.00 -3.59 5.22 0.53 0.05 -4.99 117.16 123.93 1wdl n TYR 617 Ca 0.22 0.00 -0.13 0.00 -1.02 0.00 0.00 57.90 56.97 1wdl n TYR 617 Cb 0.45 -0.02 -0.06 0.00 -1.03 0.00 0.00 39.34 38.68 1wdl n TYR 617 CO 0.00 0.00 0.00 -1.21 -1.02 0.00 0.00 176.86 174.63 1wdl s GLU 618 N -2.34 0.79 -0.52 -0.72 2.02 -1.22 -5.04 118.70 111.67 1wdl s GLU 618 Ca 0.05 0.55 -0.02 0.00 0.02 0.00 0.00 54.97 55.57 1wdl s GLU 618 Cb 0.10 0.38 0.33 0.00 0.10 0.00 0.00 34.13 35.04 1wdl s GLU 618 CO 0.57 -0.17 2.06 1.04 0.02 0.00 0.00 175.26 178.78 1wdl n GLN 619 N 1.74 2.30 -1.62 1.61 1.13 -1.26 -2.40 117.38 118.88 1wdl n GLN 619 Ca -0.14 -2.52 -0.44 0.00 -1.94 0.00 0.00 57.00 51.95 1wdl n GLN 619 Cb 0.56 -2.00 -0.01 0.00 0.11 0.00 0.00 30.24 28.90 1wdl n GLN 619 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 1wdl n ARG 620 N -0.29 1.60 -3.45 -1.09 0.63 -1.14 -4.96 116.66 107.96 1wdl n ARG 620 Ca 0.48 0.56 -0.35 0.00 -0.92 0.00 0.00 57.85 57.62 1wdl n ARG 620 Cb 0.60 -2.02 -0.06 0.00 0.45 0.00 0.00 32.46 31.44 1wdl n ARG 620 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1wdl s ASP 621 N -0.41 6.74 -0.15 6.15 1.01 -1.26 -4.73 116.67 124.02 1wdl s ASP 621 Ca 0.59 0.95 -0.18 0.00 0.71 0.00 0.00 52.55 54.62 1wdl s ASP 621 Cb -0.67 -2.24 0.05 0.00 1.01 0.00 0.00 42.92 41.07 1wdl s ASP 621 CO 0.60 0.13 0.49 0.54 0.21 0.00 0.00 175.17 177.13 1wdl s VAL 622 N -1.44 0.01 0.49 -1.27 0.11 -1.26 -5.15 120.40 111.88 1wdl s VAL 622 Ca 0.36 -0.06 -0.05 0.00 -2.93 0.00 0.00 61.98 59.31 1wdl s VAL 622 Cb -0.14 -0.71 -0.03 0.00 -1.53 0.00 0.00 36.38 33.97 1wdl s VAL 622 CO 0.19 -0.03 0.78 0.42 -3.33 0.00 0.00 175.10 173.13 1wdl s THR 623 N -0.04 4.71 0.47 5.04 -4.23 -1.26 -4.95 115.64 115.39 1wdl s THR 623 Ca -0.02 0.10 0.34 0.00 -1.18 0.00 0.00 61.69 60.93 1wdl s THR 623 Cb -0.03 -3.79 0.37 0.00 1.34 0.00 0.00 72.50 70.38 1wdl s THR 623 CO 0.02 -0.76 2.18 0.44 -0.54 0.00 0.00 174.62 175.96 1wdl h ASP 624 N 0.21 0.00 -0.09 3.99 3.32 -1.99 -1.77 116.42 120.09 1wdl h ASP 624 Ca -0.47 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.39 1wdl h ASP 624 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1wdl h ASP 624 CO 0.61 0.05 -0.65 -0.33 -1.72 0.00 0.00 179.24 177.20 1wdl h GLU 625 N 0.00 0.71 -0.21 3.56 3.07 -2.01 -3.06 114.58 116.65 1wdl h GLU 625 Ca -0.00 -0.51 -0.20 0.00 -0.50 0.00 0.00 59.36 58.16 1wdl h GLU 625 Cb 0.21 0.08 0.01 0.00 -0.84 0.00 0.00 28.75 28.21 1wdl h GLU 625 CO 0.01 1.13 -0.63 -0.44 -1.40 0.00 0.00 179.01 177.67 1wdl h ASP 626 N 0.52 0.92 -0.92 1.42 3.32 -1.73 -3.07 116.42 116.87 1wdl h ASP 626 Ca -0.01 -0.59 0.20 0.00 0.02 0.00 0.00 57.03 56.65 1wdl h ASP 626 Cb 1.24 -0.27 -0.07 0.00 0.22 0.00 0.00 39.33 40.45 1wdl h ASP 626 CO 0.13 1.34 0.60 0.40 -1.72 0.00 0.00 179.24 179.99 1wdl h ILE 627 N 0.54 0.69 0.00 0.35 2.04 -1.37 0.38 117.51 120.14 1wdl h ILE 627 Ca -0.02 -0.17 -0.09 0.00 1.00 0.00 0.00 64.86 65.59 1wdl h ILE 627 Cb 1.26 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1wdl h ILE 627 CO 0.14 0.09 -0.42 0.40 0.00 0.00 0.00 178.15 178.35 1wdl h ILE 628 N 0.48 1.18 0.21 -0.67 2.04 -1.44 -3.12 117.51 116.20 1wdl h ILE 628 Ca 0.49 -1.51 -0.31 0.00 1.00 0.00 0.00 64.86 64.53 1wdl h ILE 628 Cb 1.11 1.84 0.03 0.00 -0.74 0.00 0.00 36.82 39.06 1wdl h ILE 628 CO -0.21 0.41 -1.34 0.78 0.00 0.00 0.00 178.15 177.80 1wdl h ASN 629 N 0.00 0.82 -0.06 1.72 2.35 -0.31 -0.11 115.58 119.98 1wdl h ASN 629 Ca -0.00 -0.90 0.02 0.00 -0.55 0.00 0.00 56.30 54.87 1wdl h ASN 629 Cb 0.80 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.91 1wdl h ASN 629 CO 0.05 1.65 0.08 -0.50 -1.65 0.00 0.00 177.43 177.07 1wdl h TRP 630 N 0.12 0.00 0.00 1.19 4.06 -1.22 -2.05 115.95 118.04 1wdl h TRP 630 Ca -0.23 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.63 1wdl h TRP 630 Cb 2.04 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 30.18 1wdl h TRP 630 CO 0.13 0.00 -1.11 -1.33 -3.56 0.00 0.00 178.44 172.58 1wdl n MET 631 N -3.70 0.52 -0.15 0.49 2.81 -1.18 -4.07 117.12 111.82 1wdl n MET 631 Ca -0.01 0.35 -0.09 0.00 -1.81 0.00 0.00 57.70 56.14 1wdl n MET 631 Cb 0.18 -1.55 0.00 0.00 -0.71 0.00 0.00 33.22 31.14 1wdl n MET 631 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 1wdl h MET 632 N -1.00 0.67 -0.18 0.03 2.86 -1.01 -3.03 114.93 113.28 1wdl h MET 632 Ca -0.14 -0.12 0.04 0.00 -2.06 0.00 0.00 59.70 57.42 1wdl h MET 632 Cb 0.97 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 32.48 1wdl h MET 632 CO -0.08 0.61 -0.11 0.82 1.06 0.00 0.00 176.91 179.21 1wdl h ILE 633 N 0.59 0.67 -0.46 -1.22 2.04 -1.57 0.31 117.51 117.87 1wdl h ILE 633 Ca 0.15 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.02 1wdl h ILE 633 Cb 0.19 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1wdl h ILE 633 CO -0.01 0.00 0.30 -0.65 0.00 0.00 0.00 178.15 177.79 1wdl h PRO 634 N -0.10 0.58 -0.06 2.37 0.11 -1.73 -1.03 132.00 132.14 1wdl h PRO 634 Ca 0.10 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 66.03 1wdl h PRO 634 Cb 0.25 -0.13 0.01 0.00 0.11 0.00 0.00 31.00 31.24 1wdl h PRO 634 CO -0.24 0.38 -0.55 1.25 -0.21 0.00 0.00 178.00 178.64 1wdl h LEU 635 N 0.60 0.58 -0.06 2.35 6.46 -1.21 -2.93 115.31 121.10 1wdl h LEU 635 Ca 0.17 -0.69 -0.01 0.00 -0.12 0.00 0.00 57.88 57.23 1wdl h LEU 635 Cb -0.04 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 39.71 1wdl h LEU 635 CO -0.04 1.19 0.01 0.00 -0.62 0.00 0.00 178.44 178.98 1wdl h LEU 637 N -0.12 0.55 -1.60 0.00 3.38 -1.30 -0.53 115.31 115.69 1wdl h LEU 637 Ca 0.02 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1wdl h LEU 637 Cb 0.25 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1wdl h LEU 637 CO 0.00 0.35 0.09 -0.08 0.09 0.00 0.00 178.44 178.89 1wdl h GLU 638 N 0.68 0.35 -0.49 1.13 4.57 -1.46 -0.25 114.58 119.12 1wdl h GLU 638 Ca 0.31 -0.04 -0.12 0.00 -1.18 0.00 0.00 59.36 58.33 1wdl h GLU 638 Cb 0.20 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 1wdl h GLU 638 CO -0.19 0.31 -0.16 1.15 -1.18 0.00 0.00 179.01 178.94 1wdl h THR 639 N 0.35 1.27 -0.38 0.32 2.02 -0.80 0.46 112.91 116.16 1wdl h THR 639 Ca 0.09 -1.30 -0.04 0.00 0.77 0.00 0.00 66.41 65.93 1wdl h THR 639 Cb 0.09 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 1wdl h THR 639 CO -0.01 0.45 0.06 0.58 0.37 0.00 0.00 175.52 176.97 1wdl h VAL 640 N 0.83 1.19 -0.05 3.16 2.07 -0.03 -1.23 116.25 122.19 1wdl h VAL 640 Ca 0.12 -0.71 -0.19 0.00 0.82 0.00 0.00 66.70 66.75 1wdl h VAL 640 Cb 0.71 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1wdl h VAL 640 CO 0.05 0.25 -0.78 0.03 0.02 0.00 0.00 177.57 177.14 1wdl h ARG 641 N 0.55 0.34 0.00 1.57 3.08 -0.57 -0.94 114.38 118.41 1wdl h ARG 641 Ca 0.12 -0.30 -0.06 0.00 0.07 0.00 0.00 59.98 59.81 1wdl h ARG 641 Cb 0.27 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1wdl h ARG 641 CO 0.00 0.96 -0.28 0.00 -1.07 0.00 0.00 179.97 179.59 1wdl h LEU 643 N 0.00 0.34 -0.07 0.00 6.46 -1.09 0.20 115.31 121.13 1wdl h LEU 643 Ca -0.00 -0.49 -0.19 0.00 -0.12 0.00 0.00 57.88 57.07 1wdl h LEU 643 Cb 0.66 -0.11 0.01 0.00 -0.73 0.00 0.00 40.66 40.49 1wdl h LEU 643 CO 0.04 1.42 -0.70 -0.33 -0.62 0.00 0.00 178.44 178.24 1wdl h GLU 644 N 0.06 0.61 0.00 1.25 5.08 -0.88 -3.14 114.58 117.56 1wdl h GLU 644 Ca -0.25 -0.56 0.00 0.00 -1.00 0.00 0.00 59.36 57.56 1wdl h GLU 644 Cb 2.01 0.13 0.00 0.00 0.50 0.00 0.00 28.75 31.39 1wdl h GLU 644 CO 0.15 1.17 0.00 -0.25 -1.00 0.00 0.00 179.01 179.08 1wdl n ASP 645 N -4.08 0.22 -0.59 1.42 8.00 0.70 -4.90 116.55 117.32 1wdl n ASP 645 Ca -0.09 0.54 0.00 0.00 0.71 0.00 0.00 54.79 55.95 1wdl n ASP 645 Cb 0.71 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 1wdl n ASP 645 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wdl n GLY 646 N 0.46 0.77 0.09 0.44 0.00 -1.19 -4.98 105.19 100.77 1wdl n GLY 646 Ca 0.04 -0.51 -0.08 0.00 0.00 0.00 0.00 46.02 45.47 1wdl n GLY 646 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wdl n ILE 647 N -1.64 1.50 -4.61 -0.61 -0.00 0.67 -4.72 119.36 109.95 1wdl n ILE 647 Ca 0.00 -0.80 -0.22 0.00 -0.00 0.00 0.00 62.75 61.72 1wdl n ILE 647 Cb 0.43 -0.85 -0.15 0.00 -0.00 0.00 0.00 39.64 39.06 1wdl n ILE 647 CO 0.00 0.00 0.00 -0.69 -0.00 0.00 0.00 176.55 175.86 1wdl s VAL 648 N -2.60 1.07 -0.03 1.39 1.01 -1.07 -1.63 120.40 118.54 1wdl s VAL 648 Ca -0.06 -0.56 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 1wdl s VAL 648 Cb 0.08 -0.91 -0.20 0.00 0.00 0.00 0.00 36.38 35.34 1wdl s VAL 648 CO 0.83 0.31 1.20 -0.08 0.00 0.00 0.00 175.10 177.35 1wdl h GLU 649 N 6.00 0.07 -6.00 2.72 4.81 -1.89 -3.43 114.58 116.87 1wdl h GLU 649 Ca -0.34 -0.05 -0.55 0.00 -0.13 0.00 0.00 59.36 58.30 1wdl h GLU 649 Cb 1.17 0.01 -0.16 0.00 0.63 0.00 0.00 28.75 30.40 1wdl h GLU 649 CO 0.49 0.63 -0.76 0.95 -0.73 0.00 0.00 179.01 179.58 1wdl s THR 650 N -3.91 2.09 0.45 0.32 -4.23 -1.26 -5.02 115.64 104.08 1wdl s THR 650 Ca -0.16 -2.19 0.12 0.00 -1.18 0.00 0.00 61.69 58.28 1wdl s THR 650 Cb 0.02 -2.10 0.29 0.00 1.34 0.00 0.00 72.50 72.05 1wdl s THR 650 CO 0.69 -0.41 2.06 0.00 -0.54 0.00 0.00 174.62 176.43 1wdl h ALA 651 N 2.69 1.91 -0.09 3.99 0.00 -1.91 -1.82 119.26 124.04 1wdl h ALA 651 Ca -0.41 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1wdl h ALA 651 Cb 1.23 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1wdl h ALA 651 CO 0.57 0.03 -0.04 0.00 0.00 0.00 0.00 179.25 179.81 1wdl h ALA 652 N 1.79 0.04 -0.08 0.00 0.00 -1.95 -2.36 119.26 116.70 1wdl h ALA 652 Ca 0.15 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1wdl h ALA 652 Cb 0.18 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1wdl h ALA 652 CO -0.03 -0.51 -0.40 0.93 0.00 0.00 0.00 179.25 179.24 1wdl h GLU 653 N -0.03 0.17 0.00 0.00 5.08 -1.79 -2.99 114.58 115.01 1wdl h GLU 653 Ca 0.05 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1wdl h GLU 653 Cb 0.10 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1wdl h GLU 653 CO -0.11 0.55 -0.09 0.00 -1.00 0.00 0.00 179.01 178.36 1wdl h ALA 654 N 1.45 1.38 0.02 3.43 0.00 -0.82 -2.85 119.26 121.87 1wdl h ALA 654 Ca 0.01 -0.08 -0.39 0.00 0.00 0.00 0.00 54.91 54.46 1wdl h ALA 654 Cb 0.78 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.49 1wdl h ALA 654 CO 0.06 0.11 -2.38 -0.25 0.00 0.00 0.00 179.25 176.79 1wdl n ASP 655 N -3.74 2.01 0.28 0.00 8.00 -1.06 -4.31 116.55 117.72 1wdl n ASP 655 Ca -0.02 -0.05 0.16 0.00 0.71 0.00 0.00 54.79 55.59 1wdl n ASP 655 Cb 0.19 -0.52 0.82 0.00 -0.02 0.00 0.00 41.12 41.59 1wdl n ASP 655 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 1wdl h MET 656 N -0.03 0.00 0.00 -1.24 2.86 -1.56 0.66 114.93 115.62 1wdl h MET 656 Ca -0.55 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.06 1wdl h MET 656 Cb 1.91 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.57 1wdl h MET 656 CO -0.07 0.07 -0.12 0.78 1.06 0.00 0.00 176.91 178.63 1wdl h GLY 657 N 0.95 0.00 0.72 8.32 0.00 -1.69 -1.50 103.07 109.87 1wdl h GLY 657 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.01 1wdl h GLY 657 CO 0.01 0.00 -1.90 1.04 0.00 0.00 0.00 176.54 175.69 1wdl n LEU 658 N -3.41 1.01 -0.06 3.11 4.77 0.11 -2.48 117.00 120.06 1wdl n LEU 658 Ca -0.01 0.29 -0.07 0.00 -0.03 0.00 0.00 56.01 56.20 1wdl n LEU 658 Cb 0.29 0.03 0.11 0.00 -2.33 0.00 0.00 43.42 41.53 1wdl n LEU 658 CO 0.30 0.49 0.70 0.58 -1.33 0.00 0.00 177.39 178.12 1wdl h VAL 659 N 0.01 1.27 0.00 4.08 2.07 -0.74 0.39 116.25 123.33 1wdl h VAL 659 Ca -0.36 -1.35 -0.18 0.00 0.82 0.00 0.00 66.70 65.62 1wdl h VAL 659 Cb 2.06 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 33.07 1wdl h VAL 659 CO 0.07 0.44 -1.92 -1.22 0.02 0.00 0.00 177.57 174.96 1wdl n TYR 660 N -4.10 0.35 0.00 1.57 4.02 -0.61 -3.85 117.16 114.54 1wdl n TYR 660 Ca -0.00 0.12 0.00 0.00 -0.01 0.00 0.00 57.90 58.00 1wdl n TYR 660 Cb 0.44 -0.88 0.00 0.00 -0.02 0.00 0.00 39.34 38.88 1wdl n TYR 660 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1wdl n GLY 661 N 1.47 0.80 0.29 2.72 0.00 -1.03 -3.51 105.19 105.93 1wdl n GLY 661 Ca -0.16 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.03 1wdl n GLY 661 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1wdl h ILE 662 N 0.00 0.24 -1.00 -0.61 2.10 -1.70 -3.47 117.51 113.07 1wdl h ILE 662 Ca 0.00 -0.35 0.00 0.00 1.08 0.00 0.00 64.86 65.59 1wdl h ILE 662 Cb 0.00 1.27 0.00 0.00 -1.09 0.00 0.00 36.82 37.00 1wdl h ILE 662 CO 0.00 0.05 0.00 0.61 -1.08 0.00 0.00 178.15 177.73 1wdl n GLY 663 N -0.63 0.50 3.73 8.18 0.00 0.09 -4.92 105.19 112.15 1wdl n GLY 663 Ca -0.02 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 1wdl n GLY 663 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1wdl s PHE 664 N -2.06 3.21 -0.41 1.61 5.36 0.11 -4.28 117.98 121.54 1wdl s PHE 664 Ca 0.00 1.11 -0.41 0.00 -0.96 0.00 0.00 56.93 56.66 1wdl s PHE 664 Cb 0.00 -3.66 -0.16 0.00 -0.34 0.00 0.00 43.02 38.85 1wdl s PHE 664 CO 0.00 -2.16 1.97 -2.30 -1.46 0.00 0.00 175.22 171.26 1wdl n PRO 665 N 2.96 0.55 0.17 10.12 -0.02 -1.26 -4.55 135.00 142.98 1wdl n PRO 665 Ca 0.08 0.18 -0.16 0.00 -2.02 0.00 0.00 63.50 61.58 1wdl n PRO 665 Cb 0.42 -1.89 -0.08 0.00 -0.02 0.00 0.00 33.50 31.93 1wdl n PRO 665 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1wdl h LEU 666 N 8.75 -1.29 0.00 2.45 4.07 -1.89 -2.17 115.31 125.23 1wdl h LEU 666 Ca -0.29 0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.80 1wdl h LEU 666 Cb 1.36 0.46 0.00 0.00 1.08 0.00 0.00 40.66 43.56 1wdl h LEU 666 CO 1.02 -0.55 0.03 2.22 -1.08 0.00 0.00 178.44 180.08 1wdl n PHE 667 N -5.49 0.00 0.28 1.13 1.16 -1.26 -0.22 117.46 113.05 1wdl n PHE 667 Ca -0.09 0.00 0.11 0.00 -1.87 0.00 0.00 57.45 55.60 1wdl n PHE 667 Cb 0.40 -0.33 0.19 0.00 -1.61 0.00 0.00 39.48 38.13 1wdl n PHE 667 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 1wdl n ARG 668 N -1.32 2.35 0.00 3.97 1.74 -0.82 0.01 116.66 122.59 1wdl n ARG 668 Ca 0.00 -2.16 0.00 0.00 -0.77 0.00 0.00 57.85 54.92 1wdl n ARG 668 Cb 0.03 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.01 1wdl n ARG 668 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wdl n GLY 669 N 1.32 2.04 0.00 -0.13 0.00 0.69 -4.11 105.19 105.00 1wdl n GLY 669 Ca 0.17 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1wdl n GLY 669 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdl n GLY 670 N 0.00 -1.17 0.22 -0.02 0.00 -1.26 -4.78 105.19 98.18 1wdl n GLY 670 Ca 0.00 -0.97 -0.07 0.00 0.00 0.00 0.00 46.02 44.98 1wdl n GLY 670 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdl h ALA 671 N 0.00 0.66 -0.09 4.61 0.00 -1.88 0.14 119.26 122.69 1wdl h ALA 671 Ca 0.00 -0.09 -0.24 0.00 0.00 0.00 0.00 54.91 54.58 1wdl h ALA 671 Cb 0.00 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.60 1wdl h ALA 671 CO 0.00 0.17 -0.89 -0.07 0.00 0.00 0.00 179.25 178.46 1wdl h LEU 672 N 0.68 0.94 -0.91 0.00 3.38 -1.91 -2.95 115.31 114.54 1wdl h LEU 672 Ca 0.18 -0.67 -0.09 0.00 0.09 0.00 0.00 57.88 57.39 1wdl h LEU 672 Cb 0.04 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1wdl h LEU 672 CO -0.03 1.47 -0.20 -0.09 0.09 0.00 0.00 178.44 179.68 1wdl h ARG 673 N 0.49 0.57 -0.42 1.13 9.65 -1.85 -2.04 114.38 121.90 1wdl h ARG 673 Ca -0.08 -0.20 -0.02 0.00 -1.10 0.00 0.00 59.98 58.57 1wdl h ARG 673 Cb 1.53 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 30.04 1wdl h ARG 673 CO 0.18 0.74 0.18 -0.92 2.80 0.00 0.00 179.97 182.95 1wdl h TYR 674 N 0.51 0.59 -0.41 2.20 3.20 -0.71 0.87 116.97 123.22 1wdl h TYR 674 Ca 0.08 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 1wdl h TYR 674 Cb 0.63 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 1wdl h TYR 674 CO 0.02 0.45 0.11 0.82 -1.64 0.00 0.00 178.16 177.93 1wdl h ILE 675 N 0.60 1.22 -0.34 1.81 2.04 -1.20 -2.58 117.51 119.05 1wdl h ILE 675 Ca 0.15 -0.75 -0.07 0.00 1.00 0.00 0.00 64.86 65.18 1wdl h ILE 675 Cb 0.10 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1wdl h ILE 675 CO -0.02 0.26 -0.09 0.44 0.00 0.00 0.00 178.15 178.75 1wdl h ASP 676 N 0.52 0.56 0.20 1.72 5.19 -0.87 0.29 116.42 124.04 1wdl h ASP 676 Ca 0.13 -0.14 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1wdl h ASP 676 Cb 0.29 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.65 1wdl h ASP 676 CO -0.00 0.69 0.00 -1.20 -3.12 0.00 0.00 179.24 175.61 1wdl n SER 677 N -4.21 0.35 -0.05 6.45 7.64 0.20 -2.04 113.62 121.95 1wdl n SER 677 Ca 0.01 0.64 -0.06 0.00 1.01 0.00 0.00 58.87 60.46 1wdl n SER 677 Cb 0.31 -0.69 -0.06 0.00 -1.01 0.00 0.00 64.21 62.76 1wdl n SER 677 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1wdl n ILE 678 N -1.94 0.65 0.00 0.44 5.41 -0.65 -4.95 119.36 118.33 1wdl n ILE 678 Ca 0.00 -0.33 0.00 0.00 1.00 0.00 0.00 62.75 63.42 1wdl n ILE 678 Cb 0.08 -0.83 0.00 0.00 -0.71 0.00 0.00 39.64 38.18 1wdl n ILE 678 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1wdl n GLY 679 N 2.66 2.31 0.31 7.39 0.00 0.95 -4.60 105.19 114.20 1wdl n GLY 679 Ca -0.18 -1.16 0.05 0.00 0.00 0.00 0.00 46.02 44.73 1wdl n GLY 679 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1wdl h VAL 680 N 0.00 0.81 -0.43 1.61 2.07 -1.84 0.97 116.25 119.44 1wdl h VAL 680 Ca 0.00 -0.24 -0.12 0.00 0.82 0.00 0.00 66.70 67.16 1wdl h VAL 680 Cb 0.00 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.81 1wdl h VAL 680 CO 0.00 0.13 -0.22 0.00 0.02 0.00 0.00 177.57 177.49 1wdl h ALA 681 N 1.51 0.79 -0.00 1.67 0.00 -1.86 -2.64 119.26 118.73 1wdl h ALA 681 Ca 0.43 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wdl h ALA 681 Cb 0.53 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1wdl h ALA 681 CO -0.31 0.65 -0.18 0.39 0.00 0.00 0.00 179.25 179.80 1wdl n GLU 682 N -4.11 0.23 0.08 0.00 4.71 -0.44 -3.56 120.64 117.56 1wdl n GLU 682 Ca 0.00 -0.08 -0.23 0.00 -0.01 0.00 0.00 57.16 56.84 1wdl n GLU 682 Cb 0.45 -1.50 -0.15 0.00 -1.01 0.00 0.00 31.44 29.23 1wdl n GLU 682 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 177.13 177.57 1wdl h PHE 683 N 0.18 0.74 -0.18 -0.32 3.57 0.13 -3.13 116.94 117.94 1wdl h PHE 683 Ca 0.00 -0.54 -0.10 0.00 3.53 0.00 0.00 57.97 60.86 1wdl h PHE 683 Cb 0.45 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 1wdl h PHE 683 CO 0.00 1.64 -0.31 0.28 -2.23 0.00 0.00 178.31 177.70 1wdl h VAL 684 N 0.06 1.27 -0.58 1.41 2.07 -1.57 -1.35 116.25 117.56 1wdl h VAL 684 Ca -0.32 -1.32 -0.09 0.00 0.82 0.00 0.00 66.70 65.79 1wdl h VAL 684 Cb 2.07 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 33.30 1wdl h VAL 684 CO 0.18 0.41 0.02 0.00 0.02 0.00 0.00 177.57 178.20 1wdl h ALA 685 N 1.38 0.93 -0.45 1.67 0.00 -1.67 -1.65 119.26 119.46 1wdl h ALA 685 Ca 0.04 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1wdl h ALA 685 Cb 0.70 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1wdl h ALA 685 CO 0.05 0.65 -0.20 1.25 0.00 0.00 0.00 179.25 181.00 1wdl h LEU 686 N 0.92 0.92 -0.62 0.00 6.46 -1.39 -3.09 115.31 118.51 1wdl h LEU 686 Ca 0.17 -0.33 -0.06 0.00 -0.12 0.00 0.00 57.88 57.54 1wdl h LEU 686 Cb 0.51 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 40.16 1wdl h LEU 686 CO 0.02 1.09 0.16 0.00 -0.62 0.00 0.00 178.44 179.10 1wdl h ALA 687 N 0.98 0.82 -0.70 1.25 0.00 -0.91 -3.05 119.26 117.65 1wdl h ALA 687 Ca 0.11 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.87 1wdl h ALA 687 Cb 0.75 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1wdl h ALA 687 CO 0.06 0.52 0.46 -0.44 0.00 0.00 0.00 179.25 179.85 1wdl h ASP 688 N 0.91 0.57 0.27 0.00 3.32 -1.22 -0.62 116.42 119.65 1wdl h ASP 688 Ca 0.20 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 1wdl h ASP 688 Cb 0.34 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 1wdl h ASP 688 CO 0.00 0.36 -0.15 1.56 -1.72 0.00 0.00 179.24 179.29 1wdl h GLN 689 N 0.65 0.00 -0.47 3.56 4.20 -1.55 -1.81 115.11 119.68 1wdl h GLN 689 Ca 0.31 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.02 1wdl h GLN 689 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1wdl h GLN 689 CO -0.10 0.15 0.00 0.66 -0.67 0.00 0.00 178.83 178.87 1wdl n TYR 690 N -3.95 1.59 0.30 2.96 4.02 -0.28 -4.50 117.16 117.30 1wdl n TYR 690 Ca -0.02 -0.76 0.17 0.00 -0.01 0.00 0.00 57.90 57.27 1wdl n TYR 690 Cb 0.24 -0.41 0.67 0.00 -0.02 0.00 0.00 39.34 39.83 1wdl n TYR 690 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wdl h ALA 691 N 3.21 1.00 0.00 -0.72 0.00 -0.88 -2.91 119.26 118.96 1wdl h ALA 691 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wdl h ALA 691 Cb 1.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.50 1wdl h ALA 691 CO 0.36 0.00 0.00 -0.85 0.00 0.00 0.00 179.25 178.76 1wdl n GLU 692 N -2.96 0.80 -0.00 0.00 -0.00 -1.26 -2.96 120.64 114.25 1wdl n GLU 692 Ca 0.01 0.00 0.10 0.00 -0.00 0.00 0.00 57.16 57.26 1wdl n GLU 692 Cb 0.29 -1.19 -0.12 0.00 -0.00 0.00 0.00 31.44 30.43 1wdl n GLU 692 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1wdl n LEU 693 N -0.69 0.92 0.00 -1.84 4.77 -1.10 -5.09 117.00 113.97 1wdl n LEU 693 Ca 0.07 -0.49 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 1wdl n LEU 693 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1wdl n LEU 693 CO 0.05 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1wdl n GLY 694 N 1.47 0.94 0.08 -0.72 0.00 -1.16 -4.82 105.19 100.99 1wdl n GLY 694 Ca 0.04 -2.08 0.08 0.00 0.00 0.00 0.00 46.02 44.05 1wdl n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdl n ALA 695 N -1.00 1.45 0.31 4.61 0.00 -1.26 -2.23 120.51 122.39 1wdl n ALA 695 Ca 0.00 0.05 0.15 0.00 0.00 0.00 0.00 53.44 53.64 1wdl n ALA 695 Cb 0.00 -1.27 0.51 0.00 0.00 0.00 0.00 19.45 18.69 1wdl n ALA 695 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1wdl h LEU 696 N 0.00 0.00 -3.28 0.00 3.38 -1.88 -3.02 115.31 110.52 1wdl h LEU 696 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1wdl h LEU 696 Cb 0.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1wdl h LEU 696 CO 0.00 0.00 -0.01 -1.22 0.09 0.00 0.00 178.44 177.30 1wdl n TYR 697 N -2.91 0.95 -3.57 1.13 4.02 -0.94 -4.26 117.16 111.57 1wdl n TYR 697 Ca 0.02 -1.10 -0.41 0.00 -0.01 0.00 0.00 57.90 56.41 1wdl n TYR 697 Cb 0.36 -0.36 -0.11 0.00 -0.02 0.00 0.00 39.34 39.21 1wdl n TYR 697 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 1wdl s HIS 698 N -2.96 3.23 0.56 -0.72 3.76 -1.14 -4.50 115.29 113.52 1wdl s HIS 698 Ca 0.42 -0.73 -0.20 0.00 -0.15 0.00 0.00 55.06 54.40 1wdl s HIS 698 Cb 0.36 -2.47 -0.06 0.00 1.11 0.00 0.00 32.58 31.52 1wdl s HIS 698 CO 0.06 -0.57 1.09 -2.30 -0.85 0.00 0.00 174.74 172.17 1wdl n PRO 699 N 5.05 1.20 -1.58 8.40 -0.02 -1.26 -4.97 135.00 141.81 1wdl n PRO 699 Ca -0.12 0.45 -0.30 0.00 -2.02 0.00 0.00 63.50 61.51 1wdl n PRO 699 Cb 0.47 -2.27 0.08 0.00 -0.02 0.00 0.00 33.50 31.77 1wdl n PRO 699 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1wdl s THR 700 N -1.41 3.14 0.18 3.45 -4.23 -1.26 -4.87 115.64 110.65 1wdl s THR 700 Ca 0.73 0.37 -0.11 0.00 -1.18 0.00 0.00 61.69 61.50 1wdl s THR 700 Cb -0.44 -3.14 0.09 0.00 1.34 0.00 0.00 72.50 70.35 1wdl s THR 700 CO 0.49 -0.49 1.72 0.00 -0.54 0.00 0.00 174.62 175.81 1wdl h ALA 701 N -1.03 0.82 -0.01 3.99 0.00 -1.99 -1.06 119.26 119.98 1wdl h ALA 701 Ca -0.47 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.19 1wdl h ALA 701 Cb 1.26 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1wdl h ALA 701 CO 0.60 0.46 -0.31 1.57 0.00 0.00 0.00 179.25 181.57 1wdl h LYS 702 N 0.89 0.01 -0.09 0.00 -0.00 -1.98 0.50 116.57 115.90 1wdl h LYS 702 Ca 0.21 -0.00 -0.14 0.00 -0.00 0.00 0.00 60.65 60.71 1wdl h LYS 702 Cb 0.25 -0.00 0.01 0.00 -0.00 0.00 0.00 32.23 32.49 1wdl h LYS 702 CO -0.01 0.32 -0.49 1.25 -0.00 0.00 0.00 179.45 180.52 1wdl h LEU 703 N 0.01 0.58 -1.10 7.07 6.46 -1.82 -1.80 115.31 124.71 1wdl h LEU 703 Ca -0.00 -0.65 -0.04 0.00 -0.12 0.00 0.00 57.88 57.06 1wdl h LEU 703 Cb 0.56 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.29 1wdl h LEU 703 CO 0.04 1.14 0.14 0.03 -0.62 0.00 0.00 178.44 179.18 1wdl h ARG 704 N 0.06 0.78 -0.09 1.25 3.08 -0.90 0.58 114.38 119.14 1wdl h ARG 704 Ca -0.04 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 1wdl h ARG 704 Cb 1.14 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 31.06 1wdl h ARG 704 CO 0.10 0.70 0.03 1.49 -1.07 0.00 0.00 179.97 181.21 1wdl h GLU 705 N 0.76 0.15 -0.00 0.04 4.81 -0.82 -2.32 114.58 117.20 1wdl h GLU 705 Ca 0.17 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1wdl h GLU 705 Cb 0.25 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1wdl h GLU 705 CO -0.01 0.30 0.00 0.00 -0.73 0.00 0.00 179.01 178.57 1wdl n MET 706 N -4.90 1.04 -0.04 1.92 0.00 -0.69 -3.31 117.12 111.15 1wdl n MET 706 Ca -0.06 -0.06 -0.15 0.00 0.00 0.00 0.00 57.70 57.43 1wdl n MET 706 Cb 0.13 -1.48 -0.12 0.00 0.00 0.00 0.00 33.22 31.75 1wdl n MET 706 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1wdl h ALA 707 N 3.99 0.00 -0.14 3.17 0.00 -0.31 -0.82 119.26 125.15 1wdl h ALA 707 Ca 0.00 -0.48 -0.15 0.00 0.00 0.00 0.00 54.91 54.28 1wdl h ALA 707 Cb 0.03 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1wdl h ALA 707 CO 0.00 0.04 -0.54 0.87 0.00 0.00 0.00 179.25 179.62 1wdl h LYS 708 N -0.72 0.41 0.00 0.00 1.57 -1.56 -2.92 116.57 113.35 1wdl h LYS 708 Ca -0.02 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1wdl h LYS 708 Cb 1.01 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1wdl h LYS 708 CO 0.03 0.84 0.00 0.09 -0.57 0.00 0.00 179.45 179.84 1wdl n ASN 709 N -3.94 0.00 -2.12 0.86 3.02 -1.21 -4.84 115.26 107.03 1wdl n ASN 709 Ca -0.03 -0.44 -0.17 0.00 -0.03 0.00 0.00 54.58 53.91 1wdl n ASN 709 Cb 0.58 -0.08 0.01 0.00 -0.61 0.00 0.00 39.78 39.68 1wdl n ASN 709 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdl n GLY 710 N 0.26 -0.29 3.85 7.41 0.00 -1.10 -4.98 105.19 110.33 1wdl n GLY 710 Ca 0.13 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1wdl n GLY 710 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wdl s GLN 711 N -5.09 3.81 0.25 1.61 -0.21 -0.32 -5.05 119.66 114.66 1wdl s GLN 711 Ca 0.10 0.27 0.11 0.00 0.02 0.00 0.00 55.36 55.86 1wdl s GLN 711 Cb -0.05 -3.13 -0.05 0.00 1.00 0.00 0.00 33.01 30.78 1wdl s GLN 711 CO 0.13 0.65 -0.20 -1.54 -2.12 0.00 0.00 175.29 172.20 1wdl s SER 712 N -1.34 3.44 0.58 5.90 1.04 -1.26 -4.64 113.70 117.42 1wdl s SER 712 Ca 0.26 -0.98 0.28 0.00 0.48 0.00 0.00 55.95 55.99 1wdl s SER 712 Cb -0.15 -0.27 1.75 0.00 0.10 0.00 0.00 66.02 67.45 1wdl s SER 712 CO 0.14 0.04 2.24 -0.26 0.98 0.00 0.00 173.24 176.39 1wdl h PHE 713 N 2.55 0.00 0.00 5.02 -1.00 -1.98 -3.39 116.94 118.14 1wdl h PHE 713 Ca -0.41 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.37 1wdl h PHE 713 Cb 1.24 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.80 1wdl h PHE 713 CO 0.77 0.00 0.00 1.19 -1.61 0.00 0.00 178.31 178.66 1wdl n PHE 714 N -3.94 0.00 -1.93 -0.55 3.01 -1.26 -4.93 117.46 107.87 1wdl n PHE 714 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 1wdl n PHE 714 Cb 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 1wdl n PHE 714 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18