#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dkr n ASN 2 N 0.00 0.00 0.00 6.43 4.05 -1.17 -4.28 115.26 120.29 1dkr n ASN 2 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1dkr n ASN 2 Cb 0.00 0.00 0.02 0.00 1.23 0.00 0.00 39.78 41.03 1dkr n ASN 2 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1dkr n GLN 3 N 0.00 0.00 -0.21 1.20 1.13 -1.10 -4.04 117.38 114.37 1dkr n GLN 3 Ca 0.00 0.47 -0.08 0.00 -1.94 0.00 0.00 57.00 55.45 1dkr n GLN 3 Cb 0.00 -1.55 0.05 0.00 0.11 0.00 0.00 30.24 28.85 1dkr n GLN 3 CO 0.00 0.00 0.00 -0.92 -1.44 0.00 0.00 177.06 174.70 1dkr h TYR 4 N 0.00 1.13 -0.10 1.08 3.20 -1.43 -3.48 116.97 117.38 1dkr h TYR 4 Ca 0.00 -0.18 -0.03 0.00 3.14 0.00 0.00 58.73 61.66 1dkr h TYR 4 Cb 0.08 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 1dkr h TYR 4 CO 0.00 0.98 -0.03 0.41 -1.64 0.00 0.00 178.16 177.88 1dkr n GLY 5 N -0.50 0.49 2.43 1.82 0.00 -1.26 -4.95 105.19 103.22 1dkr n GLY 5 Ca 0.03 -0.99 -0.28 0.00 0.00 0.00 0.00 46.02 44.78 1dkr n GLY 5 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dkr s ASP 6 N -2.98 2.20 0.17 1.61 -1.08 -1.26 -4.96 116.67 110.37 1dkr s ASP 6 Ca 0.00 -2.65 0.09 0.00 -0.52 0.00 0.00 52.55 49.47 1dkr s ASP 6 Cb 0.00 -0.43 0.50 0.00 -1.46 0.00 0.00 42.92 41.53 1dkr s ASP 6 CO 0.00 -0.24 1.20 1.17 0.52 0.00 0.00 175.17 177.83 1dkr n LYS 7 N 3.41 0.06 0.00 4.34 4.81 -1.26 -1.73 118.16 127.79 1dkr n LYS 7 Ca 0.21 0.51 0.15 0.00 -0.87 0.00 0.00 58.31 58.31 1dkr n LYS 7 Cb 0.42 -1.83 0.82 0.00 0.02 0.00 0.00 35.03 34.46 1dkr n LYS 7 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1dkr n ASN 8 N -1.80 0.29 -4.45 3.14 4.13 -1.26 -4.73 115.26 110.58 1dkr n ASN 8 Ca -0.01 -0.92 -0.37 0.00 1.68 0.00 0.00 54.58 54.96 1dkr n ASN 8 Cb 0.15 -0.04 -0.12 0.00 -1.54 0.00 0.00 39.78 38.22 1dkr n ASN 8 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1dkr s LEU 9 N -2.13 3.73 0.00 3.41 0.20 -0.71 -1.91 118.68 121.28 1dkr s LEU 9 Ca 0.42 -0.33 0.06 0.00 0.69 0.00 0.00 54.13 54.97 1dkr s LEU 9 Cb 0.21 -1.96 -0.03 0.00 -0.43 0.00 0.00 46.19 43.99 1dkr s LEU 9 CO 0.39 -0.10 -0.19 -0.54 -0.29 0.00 0.00 176.35 175.62 1dkr s LYS 10 N 1.62 2.18 -0.06 1.98 -0.14 -0.67 -5.00 119.74 119.65 1dkr s LYS 10 Ca 0.06 -0.90 0.01 0.00 -1.36 0.00 0.00 55.97 53.78 1dkr s LYS 10 Cb -0.16 -2.20 0.02 0.00 -1.68 0.00 0.00 37.83 33.81 1dkr s LYS 10 CO 0.05 0.57 -0.07 0.42 -0.76 0.00 0.00 175.35 175.56 1dkr s ILE 11 N -0.79 0.78 0.10 2.17 1.01 -1.26 -0.50 121.20 122.71 1dkr s ILE 11 Ca 0.12 -0.24 0.09 0.00 0.00 0.00 0.00 60.65 60.62 1dkr s ILE 11 Cb -0.10 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.55 1dkr s ILE 11 CO 0.02 0.29 -0.19 -0.36 0.00 0.00 0.00 174.94 174.70 1dkr s PHE 12 N 1.02 2.51 -0.03 3.97 0.40 0.16 0.11 117.98 126.13 1dkr s PHE 12 Ca -0.09 -0.28 0.08 0.00 -0.60 0.00 0.00 56.93 56.04 1dkr s PHE 12 Cb -0.14 -1.37 -0.02 0.00 0.51 0.00 0.00 43.02 42.00 1dkr s PHE 12 CO -0.00 0.34 -0.25 0.45 0.70 0.00 0.00 175.22 176.45 1dkr s SER 13 N -1.92 3.01 0.00 1.36 0.15 -1.26 -1.54 113.70 113.49 1dkr s SER 13 Ca 0.16 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.34 1dkr s SER 13 Cb -0.10 -0.41 0.00 0.00 -1.71 0.00 0.00 66.02 63.79 1dkr s SER 13 CO 0.08 0.30 0.00 0.18 1.20 0.00 0.00 173.24 175.01 1dkr n LEU 14 N 2.53 0.00 -0.17 3.45 4.77 -1.21 -4.98 117.00 121.39 1dkr n LEU 14 Ca -0.16 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 55.95 1dkr n LEU 14 Cb 0.51 0.00 0.50 0.00 -2.33 0.00 0.00 43.42 42.10 1dkr n LEU 14 CO 0.23 -0.04 0.76 0.59 -1.33 0.00 0.00 177.39 177.61 1dkr n ASN 15 N -0.28 0.73 -0.05 -1.43 3.02 -1.26 -4.27 115.26 111.71 1dkr n ASN 15 Ca 0.00 -0.70 -0.12 0.00 -0.03 0.00 0.00 54.58 53.72 1dkr n ASN 15 Cb 0.00 0.02 -0.07 0.00 -0.61 0.00 0.00 39.78 39.13 1dkr n ASN 15 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1dkr h SER 16 N 0.85 0.30 -1.33 6.41 4.64 -1.89 -3.40 113.55 119.14 1dkr h SER 16 Ca 0.00 -0.41 -0.43 0.00 -0.47 0.00 0.00 61.79 60.48 1dkr h SER 16 Cb 0.43 -0.08 -0.31 0.00 -0.31 0.00 0.00 62.40 62.13 1dkr h SER 16 CO 0.00 0.64 -0.91 -3.20 -0.87 0.00 0.00 176.83 172.49 1dkr n ASN 17 N -4.66 -0.69 -0.27 4.97 2.85 -1.26 -4.54 115.26 111.65 1dkr n ASN 17 Ca -0.06 -2.99 0.12 0.00 -0.11 0.00 0.00 54.58 51.54 1dkr n ASN 17 Cb 0.29 0.20 0.38 0.00 1.24 0.00 0.00 39.78 41.89 1dkr n ASN 17 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1dkr h PRO 18 N 3.72 0.67 -0.44 1.20 0.13 -1.79 -1.30 132.00 134.18 1dkr h PRO 18 Ca 0.01 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.07 1dkr h PRO 18 Cb 0.95 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 31.91 1dkr h PRO 18 CO 0.41 0.44 0.17 0.93 -0.23 0.00 0.00 178.00 179.71 1dkr h GLU 19 N 0.69 0.67 -0.47 0.86 5.08 -1.96 0.14 114.58 119.58 1dkr h GLU 19 Ca 0.46 -0.13 -0.07 0.00 -1.00 0.00 0.00 59.36 58.62 1dkr h GLU 19 Cb 0.75 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1dkr h GLU 19 CO -0.21 0.62 0.01 1.25 -1.00 0.00 0.00 179.01 179.68 1dkr h LEU 20 N 0.57 0.80 -0.93 1.33 5.85 -1.79 -1.58 115.31 119.57 1dkr h LEU 20 Ca 0.15 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 1dkr h LEU 20 Cb 0.21 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 1dkr h LEU 20 CO -0.01 0.90 0.38 0.00 -0.34 0.00 0.00 178.44 179.38 1dkr h ALA 21 N 0.93 1.16 -0.46 1.25 0.00 -1.02 -1.76 119.26 119.35 1dkr h ALA 21 Ca 0.13 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1dkr h ALA 21 Cb 0.48 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1dkr h ALA 21 CO 0.02 0.64 0.06 -0.22 0.00 0.00 0.00 179.25 179.75 1dkr h LYS 22 N 1.14 0.77 -0.58 0.00 1.63 -0.39 -2.14 116.57 117.01 1dkr h LYS 22 Ca 0.28 -0.22 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 1dkr h LYS 22 Cb 0.12 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1dkr h LYS 22 CO -0.03 0.80 0.37 1.49 -3.45 0.00 0.00 179.45 178.62 1dkr h GLU 23 N 0.64 0.77 0.16 1.90 4.81 -0.93 0.11 114.58 122.04 1dkr h GLU 23 Ca 0.14 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1dkr h GLU 23 Cb 0.41 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.62 1dkr h GLU 23 CO 0.01 0.53 -0.08 0.82 -0.73 0.00 0.00 179.01 179.56 1dkr h ILE 24 N 0.78 0.89 -0.70 2.32 2.04 -1.22 -1.60 117.51 120.01 1dkr h ILE 24 Ca 0.21 -0.21 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1dkr h ILE 24 Cb -0.06 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 1dkr h ILE 24 CO -0.04 0.05 0.42 0.00 0.00 0.00 0.00 178.15 178.57 1dkr h ALA 25 N 0.51 0.94 -0.47 1.87 0.00 -1.08 0.14 119.26 121.15 1dkr h ALA 25 Ca -0.02 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1dkr h ALA 25 Cb 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1dkr h ALA 25 CO 0.04 0.14 0.27 -0.44 0.00 0.00 0.00 179.25 179.26 1dkr h ASP 26 N 0.79 0.42 -0.34 0.00 3.32 -0.89 -0.32 116.42 119.40 1dkr h ASP 26 Ca 0.30 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.31 1dkr h ASP 26 Cb 0.11 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1dkr h ASP 26 CO -0.15 0.30 0.01 0.40 -1.72 0.00 0.00 179.24 178.08 1dkr h ILE 27 N 0.54 1.26 -0.31 0.35 2.04 -0.54 -2.87 117.51 117.97 1dkr h ILE 27 Ca 0.20 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 65.11 1dkr h ILE 27 Cb 0.05 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1dkr h ILE 27 CO -0.10 0.31 0.19 0.58 0.00 0.00 0.00 178.15 179.13 1dkr h VAL 28 N 0.41 1.05 0.00 1.67 2.07 -0.83 -3.47 116.25 117.15 1dkr h VAL 28 Ca 0.10 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1dkr h VAL 28 Cb 0.44 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1dkr h VAL 28 CO 0.02 0.07 0.00 0.61 0.02 0.00 0.00 177.57 178.29 1dkr n GLY 29 N -1.18 1.69 3.08 2.17 0.00 -0.23 -4.49 105.19 106.24 1dkr n GLY 29 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1dkr n GLY 29 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1dkr s VAL 30 N -2.00 0.33 0.24 1.61 -7.23 -0.63 -1.38 120.40 111.33 1dkr s VAL 30 Ca 0.00 -1.60 -0.15 0.00 -1.81 0.00 0.00 61.98 58.42 1dkr s VAL 30 Cb 0.00 -1.23 -0.08 0.00 0.56 0.00 0.00 36.38 35.63 1dkr s VAL 30 CO 0.00 -0.82 0.66 -1.10 -0.31 0.00 0.00 175.10 173.53 1dkr s GLN 31 N -3.22 4.04 0.29 4.82 -1.52 -1.26 -2.74 119.66 120.07 1dkr s GLN 31 Ca 0.02 0.63 -0.30 0.00 -1.95 0.00 0.00 55.36 53.76 1dkr s GLN 31 Cb 0.02 -2.72 -0.11 0.00 -0.22 0.00 0.00 33.01 29.99 1dkr s GLN 31 CO -0.06 0.33 1.56 -0.51 -0.25 0.00 0.00 175.29 176.35 1dkr s LEU 32 N -2.42 4.35 0.71 2.90 1.43 -1.26 -4.59 118.68 119.80 1dkr s LEU 32 Ca 0.46 2.90 -0.16 0.00 -1.03 0.00 0.00 54.13 56.30 1dkr s LEU 32 Cb -0.13 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.42 1dkr s LEU 32 CO 0.19 -0.87 0.68 0.61 0.23 0.00 0.00 176.35 177.19 1dkr n GLY 33 N 2.05 -1.16 3.68 -3.19 0.00 0.31 -4.95 105.19 101.94 1dkr n GLY 33 Ca 0.07 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 1dkr n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dkr s LYS 34 N -2.88 4.16 0.22 1.61 1.02 -1.26 -4.83 119.74 117.77 1dkr s LYS 34 Ca 0.68 0.05 -0.22 0.00 0.02 0.00 0.00 55.97 56.50 1dkr s LYS 34 Cb -0.36 -3.52 0.06 0.00 -0.52 0.00 0.00 37.83 33.49 1dkr s LYS 34 CO 0.55 0.04 0.90 0.00 -0.92 0.00 0.00 175.35 175.92 1dkr s SER 36 N -3.03 0.95 -0.37 0.00 1.04 -0.41 -4.84 113.70 107.05 1dkr s SER 36 Ca 0.14 -0.04 -0.04 0.00 0.48 0.00 0.00 55.95 56.48 1dkr s SER 36 Cb -0.03 -0.31 0.08 0.00 0.10 0.00 0.00 66.02 65.86 1dkr s SER 36 CO 0.05 -0.14 0.14 0.54 0.98 0.00 0.00 173.24 174.80 1dkr s VAL 37 N 1.45 3.43 0.29 5.02 0.11 -1.26 -2.43 120.40 127.02 1dkr s VAL 37 Ca -0.03 -1.59 0.11 0.00 -2.93 0.00 0.00 61.98 57.53 1dkr s VAL 37 Cb -0.13 -3.13 -0.05 0.00 -1.53 0.00 0.00 36.38 31.54 1dkr s VAL 37 CO -0.03 -0.40 -0.16 0.42 -3.33 0.00 0.00 175.10 171.60 1dkr s THR 38 N 1.26 2.56 -0.22 5.04 -4.23 0.17 -4.94 115.64 115.28 1dkr s THR 38 Ca 0.02 -2.32 0.02 0.00 -1.18 0.00 0.00 61.69 58.23 1dkr s THR 38 Cb -0.21 -2.42 0.05 0.00 1.34 0.00 0.00 72.50 71.26 1dkr s THR 38 CO -0.01 -0.37 -0.12 -0.13 -0.54 0.00 0.00 174.62 173.46 1dkr s ARG 39 N -3.55 2.24 1.23 3.99 0.52 -1.26 0.35 118.95 122.48 1dkr s ARG 39 Ca 0.31 -1.05 -0.15 0.00 -0.52 0.00 0.00 55.73 54.32 1dkr s ARG 39 Cb -0.04 -2.64 0.31 0.00 0.52 0.00 0.00 34.95 33.09 1dkr s ARG 39 CO 0.16 -0.46 1.00 -0.06 0.02 0.00 0.00 175.30 175.96 1dkr s PHE 40 N 1.26 0.98 0.42 -0.53 0.08 -0.04 -4.79 117.98 115.36 1dkr s PHE 40 Ca -0.04 1.03 0.17 0.00 0.12 0.00 0.00 56.93 58.22 1dkr s PHE 40 Cb -0.17 -3.05 1.07 0.00 -0.57 0.00 0.00 43.02 40.29 1dkr s PHE 40 CO -0.08 -4.14 1.89 0.77 -0.10 0.00 0.00 175.22 173.56 1dkr h SER 41 N -2.82 0.39 0.00 1.36 0.02 -2.00 -0.48 113.55 110.02 1dkr h SER 41 Ca -0.59 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1dkr h SER 41 Cb 1.34 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.84 1dkr h SER 41 CO 0.47 0.18 0.00 -0.90 -1.14 0.00 0.00 176.83 175.44 1dkr n ASP 42 N -4.49 0.00 0.00 3.07 5.75 -1.26 -4.88 116.55 114.74 1dkr n ASP 42 Ca 0.17 -1.83 0.00 0.00 -0.01 0.00 0.00 54.79 53.12 1dkr n ASP 42 Cb 0.62 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 1dkr n ASP 42 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dkr n GLY 43 N 0.45 1.37 3.77 6.12 0.00 -0.19 -5.01 105.19 111.70 1dkr n GLY 43 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1dkr n GLY 43 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dkr s GLU 44 N -0.04 4.46 -0.08 1.61 2.02 -1.26 -4.81 118.70 120.60 1dkr s GLU 44 Ca 0.00 1.59 -0.17 0.00 0.02 0.00 0.00 54.97 56.41 1dkr s GLU 44 Cb 0.00 -2.88 -0.05 0.00 0.10 0.00 0.00 34.13 31.31 1dkr s GLU 44 CO 0.00 0.10 0.45 0.08 0.02 0.00 0.00 175.26 175.92 1dkr s VAL 45 N -1.43 5.13 -0.08 2.63 1.01 -1.26 -0.86 120.40 125.54 1dkr s VAL 45 Ca 0.50 0.91 0.04 0.00 0.00 0.00 0.00 61.98 63.44 1dkr s VAL 45 Cb -0.25 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 1dkr s VAL 45 CO 0.32 0.40 -0.22 -1.58 0.00 0.00 0.00 175.10 174.02 1dkr s GLN 46 N 0.13 2.81 -0.02 2.72 2.00 0.16 -4.96 119.66 122.49 1dkr s GLN 46 Ca 0.25 -0.85 0.04 0.00 -2.00 0.00 0.00 55.36 52.80 1dkr s GLN 46 Cb -0.16 -2.28 -0.01 0.00 0.80 0.00 0.00 33.01 31.36 1dkr s GLN 46 CO 0.11 0.32 -0.14 0.42 -0.50 0.00 0.00 175.29 175.50 1dkr s ILE 47 N 0.01 1.11 -0.20 -2.34 1.01 -1.26 -0.66 121.20 118.88 1dkr s ILE 47 Ca -0.08 -0.59 -0.06 0.00 0.00 0.00 0.00 60.65 59.92 1dkr s ILE 47 Cb -0.15 -0.94 0.10 0.00 0.01 0.00 0.00 42.46 41.48 1dkr s ILE 47 CO 0.05 0.32 0.40 0.54 0.00 0.00 0.00 174.94 176.25 1dkr s ASN 48 N -0.23 -0.11 0.03 3.58 6.03 -1.02 -5.00 114.94 118.22 1dkr s ASN 48 Ca 0.03 0.81 -0.30 0.00 -1.03 0.00 0.00 52.86 52.37 1dkr s ASN 48 Cb -0.06 1.25 -0.05 0.00 -3.03 0.00 0.00 41.25 39.36 1dkr s ASN 48 CO -0.00 -0.25 1.16 -0.63 -2.03 0.00 0.00 177.10 175.35 1dkr s ILE 49 N 2.58 4.24 -2.10 0.54 -1.09 -1.26 -1.29 121.20 122.82 1dkr s ILE 49 Ca 0.01 1.60 0.15 0.00 -2.23 0.00 0.00 60.65 60.18 1dkr s ILE 49 Cb -0.13 -4.03 0.37 0.00 -1.58 0.00 0.00 42.46 37.10 1dkr s ILE 49 CO -0.13 0.10 1.37 -0.62 -1.23 0.00 0.00 174.94 174.43 1dkr n GLU 50 N 4.16 1.79 -3.76 2.79 1.02 -0.00 -4.88 120.64 121.76 1dkr n GLU 50 Ca 0.09 -1.22 -0.13 0.00 -0.02 0.00 0.00 57.16 55.88 1dkr n GLU 50 Cb 0.47 -1.32 -0.09 0.00 -0.02 0.00 0.00 31.44 30.48 1dkr n GLU 50 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1dkr s GLU 51 N -1.62 0.67 0.30 3.49 -1.05 -1.25 -4.95 118.70 114.29 1dkr s GLU 51 Ca 0.27 -0.22 -0.29 0.00 -0.15 0.00 0.00 54.97 54.58 1dkr s GLU 51 Cb 0.14 0.30 -0.11 0.00 -0.44 0.00 0.00 34.13 34.02 1dkr s GLU 51 CO 0.20 -0.19 1.50 0.45 0.95 0.00 0.00 175.26 178.17 1dkr s SER 52 N -1.38 6.48 -0.00 0.83 0.15 -1.26 -4.88 113.70 113.65 1dkr s SER 52 Ca -0.13 2.87 0.00 0.00 0.70 0.00 0.00 55.95 59.39 1dkr s SER 52 Cb -0.05 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1dkr s SER 52 CO 0.04 -0.81 0.80 2.30 1.20 0.00 0.00 173.24 176.78 1dkr n ILE 53 N 1.67 0.61 -1.65 6.45 -6.64 -1.26 -5.02 119.36 113.52 1dkr n ILE 53 Ca 0.05 -0.61 -0.53 0.00 -1.77 0.00 0.00 62.75 59.89 1dkr n ILE 53 Cb 0.39 0.69 -0.06 0.00 -1.44 0.00 0.00 39.64 39.22 1dkr n ILE 53 CO 0.00 0.00 0.00 -1.14 -1.77 0.00 0.00 176.55 173.64 1dkr n ARG 54 N -0.31 1.33 -0.93 6.28 0.63 -1.25 -0.04 116.66 122.37 1dkr n ARG 54 Ca 0.00 0.48 0.00 0.00 -0.92 0.00 0.00 57.85 57.42 1dkr n ARG 54 Cb 0.35 -2.17 0.00 0.00 0.45 0.00 0.00 32.46 31.09 1dkr n ARG 54 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1dkr n GLY 55 N 3.37 0.84 3.91 5.14 0.00 -0.53 -4.91 105.19 113.01 1dkr n GLY 55 Ca 0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 1dkr n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dkr s ASP 57 N -3.18 6.42 -0.13 0.00 1.01 -0.80 -0.92 116.67 119.08 1dkr s ASP 57 Ca 0.43 0.10 -0.05 0.00 0.71 0.00 0.00 52.55 53.75 1dkr s ASP 57 Cb -0.11 -2.33 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 1dkr s ASP 57 CO 0.30 -0.61 0.05 0.00 0.21 0.00 0.00 175.17 175.11 1dkr s TYR 59 N -0.46 2.77 -0.17 0.00 1.51 0.35 -0.67 117.35 120.68 1dkr s TYR 59 Ca 0.09 -0.99 -0.03 0.00 -1.01 0.00 0.00 57.07 55.14 1dkr s TYR 59 Cb -0.12 -1.87 -0.02 0.00 -0.11 0.00 0.00 41.96 39.84 1dkr s TYR 59 CO 0.02 -0.44 -0.07 0.42 -1.11 0.00 0.00 175.55 174.37 1dkr s ILE 60 N 0.73 3.40 -0.34 2.71 1.01 -0.23 0.40 121.20 128.88 1dkr s ILE 60 Ca -0.07 -0.51 -0.08 0.00 0.00 0.00 0.00 60.65 59.99 1dkr s ILE 60 Cb -0.16 -2.49 0.02 0.00 0.01 0.00 0.00 42.46 39.85 1dkr s ILE 60 CO 0.01 0.48 0.14 -0.63 0.00 0.00 0.00 174.94 174.93 1dkr s ILE 61 N 0.79 4.15 -0.19 2.92 1.01 -0.59 -0.40 121.20 128.89 1dkr s ILE 61 Ca -0.03 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 59.66 1dkr s ILE 61 Cb -0.15 -3.27 0.07 0.00 0.01 0.00 0.00 42.46 39.13 1dkr s ILE 61 CO 0.02 -0.11 0.43 -1.58 0.00 0.00 0.00 174.94 173.69 1dkr s GLN 62 N 1.49 0.38 -0.08 2.79 2.00 -0.67 -3.28 119.66 122.28 1dkr s GLN 62 Ca 0.01 0.91 -0.11 0.00 -2.00 0.00 0.00 55.36 54.17 1dkr s GLN 62 Cb -0.19 0.13 -0.05 0.00 0.80 0.00 0.00 33.01 33.70 1dkr s GLN 62 CO 0.04 -0.20 0.27 -1.12 -0.50 0.00 0.00 175.29 173.78 1dkr s SER 63 N 1.91 6.56 -1.13 6.67 0.01 -1.26 -4.09 113.70 122.36 1dkr s SER 63 Ca -0.06 0.67 -0.05 0.00 1.31 0.00 0.00 55.95 57.81 1dkr s SER 63 Cb -0.10 -2.16 0.27 0.00 0.21 0.00 0.00 66.02 64.25 1dkr s SER 63 CO -0.13 0.33 1.61 0.35 0.41 0.00 0.00 173.24 175.81 1dkr n THR 64 N 2.19 5.16 -3.23 1.44 -2.24 -0.54 -4.65 114.28 112.40 1dkr n THR 64 Ca -0.16 -5.56 -0.20 0.00 -2.27 0.00 0.00 64.05 55.86 1dkr n THR 64 Cb 0.53 -2.11 0.03 0.00 -2.10 0.00 0.00 70.33 66.68 1dkr n THR 64 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1dkr s SER 65 N -1.13 5.14 -0.36 3.42 1.04 -1.26 -2.79 113.70 117.75 1dkr s SER 65 Ca 0.34 -0.81 -0.42 0.00 0.48 0.00 0.00 55.95 55.54 1dkr s SER 65 Cb 0.07 0.01 -0.17 0.00 0.10 0.00 0.00 66.02 66.03 1dkr s SER 65 CO 0.07 -1.10 1.75 -0.67 0.98 0.00 0.00 173.24 174.27 1dkr n ASP 66 N -2.00 1.98 -4.61 7.02 2.03 -1.26 -1.56 116.55 118.14 1dkr n ASP 66 Ca 0.10 1.05 -0.40 0.00 0.52 0.00 0.00 54.79 56.06 1dkr n ASP 66 Cb 0.61 -1.06 -0.08 0.00 -0.72 0.00 0.00 41.12 39.88 1dkr n ASP 66 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1dkr s PRO 67 N 3.67 4.06 0.36 -0.67 0.04 -1.26 -5.05 135.00 136.15 1dkr s PRO 67 Ca 1.02 0.28 0.10 0.00 0.04 0.00 0.00 61.00 62.44 1dkr s PRO 67 Cb -1.20 -3.65 0.86 0.00 0.04 0.00 0.00 34.50 30.54 1dkr s PRO 67 CO 0.70 -0.34 1.84 -0.24 0.04 0.00 0.00 177.00 178.99 1dkr h VAL 68 N 5.40 0.77 -0.43 -0.36 3.04 -1.54 -2.57 116.25 120.55 1dkr h VAL 68 Ca -0.29 -0.22 -0.09 0.00 -1.01 0.00 0.00 66.70 65.08 1dkr h VAL 68 Cb 1.14 0.06 -0.02 0.00 -2.01 0.00 0.00 31.29 30.46 1dkr h VAL 68 CO 0.70 0.12 -0.10 0.78 -1.01 0.00 0.00 177.57 178.06 1dkr h ASN 69 N 0.65 0.77 -0.09 3.17 2.35 -1.93 -0.17 115.58 120.33 1dkr h ASN 69 Ca 0.49 -0.23 -0.06 0.00 -0.55 0.00 0.00 56.30 55.96 1dkr h ASN 69 Cb 0.87 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.04 1dkr h ASN 69 CO -0.24 0.90 -0.16 -0.33 -1.65 0.00 0.00 177.43 175.94 1dkr h GLU 70 N 0.71 0.27 -0.37 0.81 4.39 -1.84 -2.37 114.58 116.17 1dkr h GLU 70 Ca 0.12 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 1dkr h GLU 70 Cb 0.58 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 1dkr h GLU 70 CO 0.04 0.75 0.09 0.45 -1.16 0.00 0.00 179.01 179.18 1dkr h HIS 71 N -0.19 0.54 -0.22 4.33 3.86 -1.35 -0.58 115.15 121.54 1dkr h HIS 71 Ca 0.01 -0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.11 1dkr h HIS 71 Cb 0.74 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 29.04 1dkr h HIS 71 CO 0.11 0.47 -0.16 0.82 0.86 0.00 0.00 177.93 180.03 1dkr h ILE 72 N 0.53 1.32 -0.10 2.45 2.04 -1.04 -2.43 117.51 120.28 1dkr h ILE 72 Ca 0.13 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.70 1dkr h ILE 72 Cb 0.20 1.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.95 1dkr h ILE 72 CO -0.00 0.39 0.04 0.24 0.00 0.00 0.00 178.15 178.82 1dkr h MET 73 N 0.18 0.15 -0.13 2.37 2.86 -0.86 0.39 114.93 119.89 1dkr h MET 73 Ca 0.04 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1dkr h MET 73 Cb 0.68 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 1dkr h MET 73 CO 0.04 0.25 0.02 1.05 1.06 0.00 0.00 176.91 179.34 1dkr h GLU 74 N 0.00 0.18 -0.12 1.72 4.11 -1.18 0.16 114.58 119.46 1dkr h GLU 74 Ca 0.03 -0.02 -0.02 0.00 0.07 0.00 0.00 59.36 59.42 1dkr h GLU 74 Cb 0.16 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1dkr h GLU 74 CO -0.00 0.18 -0.02 1.25 0.07 0.00 0.00 179.01 180.49 1dkr h LEU 75 N 0.18 0.23 -0.73 3.06 5.85 -0.91 0.16 115.31 123.15 1dkr h LEU 75 Ca 0.05 -0.35 -0.05 0.00 0.84 0.00 0.00 57.88 58.36 1dkr h LEU 75 Cb 0.10 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1dkr h LEU 75 CO -0.00 0.52 0.25 -0.07 -0.34 0.00 0.00 178.44 178.80 1dkr h LEU 76 N -0.07 1.04 -0.48 2.25 3.38 0.01 -1.93 115.31 119.51 1dkr h LEU 76 Ca 0.03 -0.20 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 1dkr h LEU 76 Cb 0.42 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1dkr h LEU 76 CO 0.01 0.96 -0.27 0.40 0.09 0.00 0.00 178.44 179.63 1dkr h ILE 77 N 1.06 1.27 -0.28 1.22 2.04 -0.92 -1.77 117.51 120.13 1dkr h ILE 77 Ca 0.24 -1.43 0.03 0.00 1.00 0.00 0.00 64.86 64.70 1dkr h ILE 77 Cb 0.27 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 1dkr h ILE 77 CO -0.01 0.49 0.08 -0.03 0.00 0.00 0.00 178.15 178.68 1dkr h MET 78 N 0.83 0.20 -0.88 2.37 4.05 -0.74 -0.11 114.93 120.64 1dkr h MET 78 Ca 0.10 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.49 1dkr h MET 78 Cb 0.85 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.56 1dkr h MET 78 CO 0.07 0.13 0.49 0.28 0.23 0.00 0.00 176.91 178.11 1dkr h VAL 79 N 0.20 1.25 -0.59 -5.77 2.07 -1.19 -0.29 116.25 111.93 1dkr h VAL 79 Ca 0.13 -0.62 -0.07 0.00 0.82 0.00 0.00 66.70 66.96 1dkr h VAL 79 Cb 0.11 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 1dkr h VAL 79 CO -0.14 0.28 0.10 -0.78 0.02 0.00 0.00 177.57 177.05 1dkr h ASP 80 N 1.23 0.94 -0.26 0.57 3.58 -0.73 -0.65 116.42 121.10 1dkr h ASP 80 Ca 0.31 -0.26 -0.00 0.00 0.42 0.00 0.00 57.03 57.50 1dkr h ASP 80 Cb 0.02 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.81 1dkr h ASP 80 CO -0.05 0.96 0.14 0.00 -2.88 0.00 0.00 179.24 177.41 1dkr h ALA 81 N 1.01 0.33 -0.20 -0.78 0.00 -0.43 -1.57 119.26 117.63 1dkr h ALA 81 Ca 0.18 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1dkr h ALA 81 Cb 0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1dkr h ALA 81 CO 0.01 -0.14 -0.27 -0.07 0.00 0.00 0.00 179.25 178.78 1dkr h LEU 82 N 0.31 0.39 -0.22 0.00 3.38 -0.86 -2.26 115.31 116.06 1dkr h LEU 82 Ca 0.09 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1dkr h LEU 82 Cb 0.06 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1dkr h LEU 82 CO -0.02 0.66 0.04 0.50 0.09 0.00 0.00 178.44 179.71 1dkr h LYS 83 N 0.35 0.36 0.00 1.13 3.64 -0.90 -1.93 116.57 119.22 1dkr h LYS 83 Ca 0.05 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1dkr h LYS 83 Cb 0.66 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1dkr h LYS 83 CO 0.05 0.50 0.00 0.00 -2.27 0.00 0.00 179.45 177.73 1dkr h ARG 84 N 0.16 0.00 -0.63 1.90 3.08 -1.18 -1.90 114.38 115.82 1dkr h ARG 84 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1dkr h ARG 84 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1dkr h ARG 84 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 1dkr n ALA 85 N -1.96 3.02 -2.56 0.04 0.00 -0.86 -4.95 120.51 113.24 1dkr n ALA 85 Ca 0.02 -1.18 -0.16 0.00 0.00 0.00 0.00 53.44 52.11 1dkr n ALA 85 Cb 0.32 -1.03 0.01 0.00 0.00 0.00 0.00 19.45 18.74 1dkr n ALA 85 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1dkr n SER 86 N 0.73 -4.85 -4.67 0.00 7.64 -0.71 -3.89 113.62 107.86 1dkr n SER 86 Ca 0.19 -0.11 -0.36 0.00 1.01 0.00 0.00 58.87 59.60 1dkr n SER 86 Cb 0.72 -3.84 0.09 0.00 -1.01 0.00 0.00 64.21 60.17 1dkr n SER 86 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dkr n ALA 87 N -2.43 0.31 0.02 -0.43 0.00 -0.74 -1.45 120.51 115.78 1dkr n ALA 87 Ca -0.14 -0.16 -0.18 0.00 0.00 0.00 0.00 53.44 52.96 1dkr n ALA 87 Cb 0.62 -2.22 -0.13 0.00 0.00 0.00 0.00 19.45 17.71 1dkr n ALA 87 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1dkr h LYS 88 N -0.15 0.28 -4.03 0.00 3.64 -1.23 -3.43 116.57 111.65 1dkr h LYS 88 Ca -0.48 -0.40 -0.14 0.00 -1.27 0.00 0.00 60.65 58.36 1dkr h LYS 88 Cb 1.33 0.13 -0.18 0.00 -0.41 0.00 0.00 32.23 33.10 1dkr h LYS 88 CO 0.49 1.14 -0.66 0.95 -2.27 0.00 0.00 179.45 179.10 1dkr s THR 89 N -2.72 0.15 -0.33 1.00 -4.23 -1.21 -5.00 115.64 103.31 1dkr s THR 89 Ca -0.14 -1.25 -0.00 0.00 -1.18 0.00 0.00 61.69 59.11 1dkr s THR 89 Cb 0.01 -0.81 0.10 0.00 1.34 0.00 0.00 72.50 73.14 1dkr s THR 89 CO 0.80 -0.69 0.11 -0.63 -0.54 0.00 0.00 174.62 173.68 1dkr s ILE 90 N -2.52 0.95 -0.22 2.99 1.01 -1.26 -1.25 121.20 120.91 1dkr s ILE 90 Ca -0.06 -1.55 -0.10 0.00 0.00 0.00 0.00 60.65 58.94 1dkr s ILE 90 Cb -0.02 -1.72 -0.05 0.00 0.01 0.00 0.00 42.46 40.68 1dkr s ILE 90 CO -0.05 -0.70 0.14 0.20 0.00 0.00 0.00 174.94 174.53 1dkr s ASN 91 N 1.45 6.06 -0.31 3.58 0.01 0.16 -0.39 114.94 125.50 1dkr s ASN 91 Ca 0.11 0.13 -0.10 0.00 -0.71 0.00 0.00 52.86 52.29 1dkr s ASN 91 Cb -0.18 -2.08 -0.01 0.00 0.41 0.00 0.00 41.25 39.39 1dkr s ASN 91 CO -0.22 0.11 0.15 -0.63 -1.51 0.00 0.00 177.10 175.01 1dkr s ILE 92 N 0.80 4.67 -0.40 0.60 -1.09 -0.10 -1.07 121.20 124.61 1dkr s ILE 92 Ca 0.07 -0.36 -0.11 0.00 -2.23 0.00 0.00 60.65 58.02 1dkr s ILE 92 Cb -0.13 -3.36 0.04 0.00 -1.58 0.00 0.00 42.46 37.43 1dkr s ILE 92 CO 0.02 0.09 0.24 -0.69 -1.23 0.00 0.00 174.94 173.37 1dkr s VAL 93 N 1.63 4.63 -0.47 2.92 1.01 0.47 -0.11 120.40 130.48 1dkr s VAL 93 Ca 0.05 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 61.00 1dkr s VAL 93 Cb -0.17 -3.65 0.12 0.00 0.00 0.00 0.00 36.38 32.68 1dkr s VAL 93 CO 0.07 -0.33 0.30 -0.63 0.00 0.00 0.00 175.10 174.50 1dkr s ILE 94 N 1.55 3.76 0.28 2.22 1.01 -0.03 -1.68 121.20 128.31 1dkr s ILE 94 Ca 0.03 -2.06 -0.00 0.00 0.00 0.00 0.00 60.65 58.61 1dkr s ILE 94 Cb -0.20 -3.51 0.13 0.00 0.01 0.00 0.00 42.46 38.89 1dkr s ILE 94 CO 0.06 -0.76 1.80 -0.65 0.00 0.00 0.00 174.94 175.40 1dkr h PRO 95 N 8.09 0.74 -4.03 2.79 0.11 -1.83 -3.16 132.00 134.71 1dkr h PRO 95 Ca -0.14 -0.18 -0.45 0.00 0.11 0.00 0.00 66.00 65.34 1dkr h PRO 95 Cb 1.05 -0.10 -0.35 0.00 0.11 0.00 0.00 31.00 31.71 1dkr h PRO 95 CO 0.77 0.73 -0.78 -0.47 -0.21 0.00 0.00 178.00 178.04 1dkr s TYR 96 N -5.04 0.92 -0.57 0.65 5.04 -1.26 -4.32 117.35 112.77 1dkr s TYR 96 Ca -0.09 -0.31 -0.17 0.00 -2.44 0.00 0.00 57.07 54.05 1dkr s TYR 96 Cb 0.15 -0.83 0.12 0.00 0.35 0.00 0.00 41.96 41.75 1dkr s TYR 96 CO 0.80 -0.28 0.59 -0.47 -1.34 0.00 0.00 175.55 174.84 1dkr s TYR 97 N 1.27 3.16 0.76 4.97 6.14 -1.26 -1.46 117.35 130.93 1dkr s TYR 97 Ca -0.05 -1.18 -0.13 0.00 0.64 0.00 0.00 57.07 56.35 1dkr s TYR 97 Cb -0.14 -3.89 0.05 0.00 0.42 0.00 0.00 41.96 38.41 1dkr s TYR 97 CO -0.02 -1.13 1.14 0.20 0.64 0.00 0.00 175.55 176.38 1dkr s GLY 98 N 3.58 1.99 -1.02 8.97 0.00 -1.12 -3.26 107.32 116.46 1dkr s GLY 98 Ca 0.07 0.57 0.00 0.00 0.00 0.00 0.00 44.72 45.36 1dkr s GLY 98 CO 0.04 0.95 0.00 -1.72 0.00 0.00 0.00 173.10 172.37 1dkr n TYR 99 N -3.14 0.00 0.70 1.90 4.01 -1.26 -4.83 117.16 114.54 1dkr n TYR 99 Ca 0.11 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.96 1dkr n TYR 99 Cb 0.52 -2.29 0.45 0.00 -0.31 0.00 0.00 39.34 37.71 1dkr n TYR 99 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dkr n ALA 100 N 1.18 1.96 -2.69 -0.72 0.00 -1.20 -3.30 120.51 115.74 1dkr n ALA 100 Ca -0.10 -0.06 -0.41 0.00 0.00 0.00 0.00 53.44 52.88 1dkr n ALA 100 Cb 0.47 -1.35 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 1dkr n ALA 100 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1dkr s ARG 101 N -3.03 4.36 -0.01 0.00 0.52 -1.26 -4.67 118.95 114.86 1dkr s ARG 101 Ca 0.10 0.96 0.16 0.00 -0.52 0.00 0.00 55.73 56.42 1dkr s ARG 101 Cb 0.13 -3.52 -0.21 0.00 0.52 0.00 0.00 34.95 31.87 1dkr s ARG 101 CO 0.40 -0.16 0.49 0.94 0.02 0.00 0.00 175.30 176.99 1dkr n GLN 102 N 4.58 1.13 0.00 3.54 7.27 -1.26 -4.55 117.38 128.08 1dkr n GLN 102 Ca 0.02 -0.08 0.09 0.00 0.07 0.00 0.00 57.00 57.10 1dkr n GLN 102 Cb 0.50 -1.31 -0.08 0.00 2.41 0.00 0.00 30.24 31.76 1dkr n GLN 102 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 1dkr n ASP 103 N -1.74 1.18 -0.26 1.69 5.68 -1.26 -4.71 116.55 117.13 1dkr n ASP 103 Ca -0.00 -1.09 0.01 0.00 -0.50 0.00 0.00 54.79 53.21 1dkr n ASP 103 Cb 0.34 0.86 0.06 0.00 -1.14 0.00 0.00 41.12 41.23 1dkr n ASP 103 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1dkr n ARG 104 N -1.09 -0.12 -4.55 0.11 1.74 -1.26 -3.90 116.66 107.59 1dkr n ARG 104 Ca 0.05 1.07 -0.34 0.00 -0.77 0.00 0.00 57.85 57.86 1dkr n ARG 104 Cb 0.34 -1.59 -0.11 0.00 -1.02 0.00 0.00 32.46 30.08 1dkr n ARG 104 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1dkr s LYS 105 N -5.74 2.97 -0.28 5.56 1.02 -1.26 -5.03 119.74 116.98 1dkr s LYS 105 Ca -0.10 -0.52 0.01 0.00 0.02 0.00 0.00 55.97 55.38 1dkr s LYS 105 Cb 0.16 -2.68 0.31 0.00 -0.52 0.00 0.00 37.83 35.10 1dkr s LYS 105 CO 0.51 0.58 1.68 0.00 -0.92 0.00 0.00 175.35 177.20 1dkr n ALA 106 N 2.48 4.53 -1.60 5.17 0.00 -1.25 -5.00 120.51 124.84 1dkr n ALA 106 Ca -0.18 -1.63 -0.00 0.00 0.00 0.00 0.00 53.44 51.63 1dkr n ALA 106 Cb 0.53 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.68 1dkr n ALA 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1dkr n ARG 107 N -0.15 0.27 0.00 0.00 5.12 -1.26 -5.09 116.66 115.55 1dkr n ARG 107 Ca 0.32 -0.04 0.00 0.00 -1.93 0.00 0.00 57.85 56.20 1dkr n ARG 107 Cb 0.93 -0.02 0.00 0.00 -1.16 0.00 0.00 32.46 32.21 1dkr n ARG 107 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1dkr n SER 108 N -3.01 0.00 -4.11 0.55 2.88 -1.26 -4.80 113.62 103.88 1dkr n SER 108 Ca 0.00 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.19 1dkr n SER 108 Cb 0.01 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.41 1dkr n SER 108 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1dkr n ARG 109 N -0.06 1.45 -3.97 -1.46 1.74 -1.26 -4.92 116.66 108.19 1dkr n ARG 109 Ca 0.00 -2.11 -0.22 0.00 -0.77 0.00 0.00 57.85 54.75 1dkr n ARG 109 Cb 0.00 -3.32 -0.04 0.00 -1.02 0.00 0.00 32.46 28.08 1dkr n ARG 109 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1dkr s GLU 110 N 5.90 2.75 0.50 5.56 2.02 -1.26 -5.13 118.70 129.04 1dkr s GLU 110 Ca 0.64 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 54.40 1dkr s GLU 110 Cb 0.07 -2.47 0.01 0.00 0.10 0.00 0.00 34.13 31.84 1dkr s GLU 110 CO 0.14 0.22 0.73 -1.25 0.02 0.00 0.00 175.26 175.12 1dkr s PRO 111 N -3.91 2.84 -0.73 0.39 0.04 -1.26 -5.03 135.00 127.34 1dkr s PRO 111 Ca 0.37 -0.57 0.04 0.00 0.04 0.00 0.00 61.00 60.88 1dkr s PRO 111 Cb -0.06 -2.51 0.19 0.00 0.04 0.00 0.00 34.50 32.16 1dkr s PRO 111 CO 0.25 -0.48 0.60 -0.89 0.04 0.00 0.00 177.00 176.52 1dkr n ILE 112 N -2.22 2.03 -0.24 0.56 5.41 -1.26 -4.97 119.36 118.67 1dkr n ILE 112 Ca 0.04 -4.99 0.15 0.00 1.00 0.00 0.00 62.75 58.95 1dkr n ILE 112 Cb 0.58 -2.19 0.44 0.00 -0.71 0.00 0.00 39.64 37.76 1dkr n ILE 112 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1dkr h THR 113 N 4.08 0.78 -0.08 1.39 2.02 -1.93 -0.58 112.91 118.59 1dkr h THR 113 Ca 0.16 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 1dkr h THR 113 Cb 0.74 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1dkr h THR 113 CO 0.77 0.10 -0.11 0.00 0.37 0.00 0.00 175.52 176.65 1dkr h ALA 114 N 1.62 1.68 0.11 6.16 0.00 -1.87 0.06 119.26 127.01 1dkr h ALA 114 Ca 0.44 -0.15 -0.23 0.00 0.00 0.00 0.00 54.91 54.97 1dkr h ALA 114 Cb 0.88 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.64 1dkr h ALA 114 CO -0.18 0.24 -0.97 -0.22 0.00 0.00 0.00 179.25 178.12 1dkr h LYS 115 N 0.11 0.45 -0.59 0.00 1.63 -1.48 -2.99 116.57 113.72 1dkr h LYS 115 Ca 0.02 -0.64 0.06 0.00 -0.85 0.00 0.00 60.65 59.25 1dkr h LYS 115 Cb 0.27 0.22 -0.05 0.00 -0.60 0.00 0.00 32.23 32.06 1dkr h LYS 115 CO 0.02 1.28 0.29 1.25 -3.45 0.00 0.00 179.45 178.83 1dkr h LEU 116 N -0.05 0.39 -0.33 5.20 5.85 -0.93 -2.03 115.31 123.40 1dkr h LEU 116 Ca -0.15 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.65 1dkr h LEU 116 Cb 1.71 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.67 1dkr h LEU 116 CO 0.18 0.26 0.10 0.15 -0.34 0.00 0.00 178.44 178.79 1dkr h PHE 117 N 0.54 0.17 -0.36 1.25 3.57 -1.04 -0.17 116.94 120.90 1dkr h PHE 117 Ca 0.27 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.84 1dkr h PHE 117 Cb 0.22 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 38.88 1dkr h PHE 117 CO -0.11 0.06 0.07 0.00 -2.23 0.00 0.00 178.31 176.10 1dkr h ALA 118 N 1.22 0.38 -0.73 2.41 0.00 -1.30 0.70 119.26 121.93 1dkr h ALA 118 Ca 0.15 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1dkr h ALA 118 Cb 0.14 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1dkr h ALA 118 CO -0.17 -0.33 0.45 -0.91 0.00 0.00 0.00 179.25 178.29 1dkr h ASN 119 N 0.19 0.87 -0.58 0.00 2.35 -0.92 -1.27 115.58 116.23 1dkr h ASN 119 Ca 0.17 -0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.78 1dkr h ASN 119 Cb 0.20 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 1dkr h ASN 119 CO -0.23 0.67 0.04 -0.07 -1.65 0.00 0.00 177.43 176.19 1dkr h LEU 120 N 1.00 0.97 -0.40 1.61 3.38 -0.24 -0.16 115.31 121.47 1dkr h LEU 120 Ca 0.26 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1dkr h LEU 120 Cb -0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1dkr h LEU 120 CO -0.05 1.02 0.09 0.25 0.09 0.00 0.00 178.44 179.84 1dkr h LEU 121 N 0.89 0.62 -0.45 1.67 5.85 -0.67 0.16 115.31 123.38 1dkr h LEU 121 Ca 0.17 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 1dkr h LEU 121 Cb 0.50 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1dkr h LEU 121 CO 0.02 0.70 0.12 -0.33 -0.34 0.00 0.00 178.44 178.61 1dkr h GLU 122 N 0.51 0.71 -0.73 1.25 5.08 -1.13 -1.84 114.58 118.43 1dkr h GLU 122 Ca 0.12 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 1dkr h GLU 122 Cb 0.33 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1dkr h GLU 122 CO 0.00 0.70 0.29 1.15 -1.00 0.00 0.00 179.01 180.15 1dkr h THR 123 N 0.59 1.25 -0.61 1.13 2.02 -0.65 -1.26 112.91 115.38 1dkr h THR 123 Ca 0.14 -0.79 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 1dkr h THR 123 Cb 0.31 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 1dkr h THR 123 CO -0.00 0.32 0.37 0.00 0.37 0.00 0.00 175.52 176.58 1dkr h ALA 124 N 1.24 1.49 0.00 6.16 0.00 -0.50 -3.46 119.26 124.19 1dkr h ALA 124 Ca 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1dkr h ALA 124 Cb 0.21 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1dkr h ALA 124 CO -0.02 0.44 0.00 0.41 0.00 0.00 0.00 179.25 180.08 1dkr n GLY 125 N -1.34 0.77 3.77 0.00 0.00 -0.47 -4.42 105.19 103.50 1dkr n GLY 125 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1dkr n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dkr s ALA 126 N -0.96 3.33 -0.15 4.61 0.00 -0.74 -4.76 121.76 123.10 1dkr s ALA 126 Ca 0.00 1.48 -0.08 0.00 0.00 0.00 0.00 51.96 53.36 1dkr s ALA 126 Cb 0.00 -3.59 -0.24 0.00 0.00 0.00 0.00 23.12 19.29 1dkr s ALA 126 CO 0.00 -1.13 0.29 2.41 0.00 0.00 0.00 175.76 177.32 1dkr n THR 127 N 0.01 1.72 -3.83 0.00 -1.04 0.48 -4.82 114.28 106.80 1dkr n THR 127 Ca 0.04 -0.56 -0.07 0.00 -2.04 0.00 0.00 64.05 61.42 1dkr n THR 127 Cb 0.41 -1.75 -0.01 0.00 -1.82 0.00 0.00 70.33 67.16 1dkr n THR 127 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dkr s ARG 128 N -2.53 1.77 0.04 -2.82 1.70 -1.21 -4.24 118.95 111.66 1dkr s ARG 128 Ca -0.25 -1.02 0.03 0.00 -0.47 0.00 0.00 55.73 54.03 1dkr s ARG 128 Cb 0.07 0.57 -0.02 0.00 -0.57 0.00 0.00 34.95 35.00 1dkr s ARG 128 CO 0.73 -0.81 -0.10 0.08 -1.08 0.00 0.00 175.30 174.11 1dkr s VAL 129 N -3.45 0.76 -0.17 4.99 1.01 -0.67 -0.92 120.40 121.95 1dkr s VAL 129 Ca 0.12 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.08 1dkr s VAL 129 Cb -0.05 -0.76 0.03 0.00 0.00 0.00 0.00 36.38 35.60 1dkr s VAL 129 CO 0.07 -0.23 -0.12 -0.63 0.00 0.00 0.00 175.10 174.19 1dkr s ILE 130 N -1.13 1.59 0.30 2.22 1.01 0.85 -1.32 121.20 124.71 1dkr s ILE 130 Ca -0.05 -0.79 0.10 0.00 0.00 0.00 0.00 60.65 59.91 1dkr s ILE 130 Cb -0.09 -1.57 -0.06 0.00 0.01 0.00 0.00 42.46 40.75 1dkr s ILE 130 CO 0.01 0.33 -0.13 0.00 0.00 0.00 0.00 174.94 175.15 1dkr s ALA 131 N 1.45 2.71 -0.09 9.38 0.00 0.02 -0.85 121.76 134.38 1dkr s ALA 131 Ca 0.02 -1.95 -0.01 0.00 0.00 0.00 0.00 51.96 50.03 1dkr s ALA 131 Cb -0.14 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 22.91 1dkr s ALA 131 CO -0.10 0.13 -0.04 -1.17 0.00 0.00 0.00 175.76 174.58 1dkr s LEU 132 N -3.52 0.95 -0.88 0.00 2.96 -1.19 -0.15 118.68 116.84 1dkr s LEU 132 Ca 0.30 -0.20 -0.06 0.00 -0.22 0.00 0.00 54.13 53.96 1dkr s LEU 132 Cb -0.00 -0.64 0.00 0.00 0.50 0.00 0.00 46.19 46.05 1dkr s LEU 132 CO 0.14 -0.14 0.66 0.47 -1.32 0.00 0.00 176.35 176.16 1dkr n ASP 133 N 4.93 -5.59 -4.77 3.68 8.00 0.08 -4.73 116.55 118.15 1dkr n ASP 133 Ca -0.11 -0.78 -0.38 0.00 0.71 0.00 0.00 54.79 54.22 1dkr n ASP 133 Cb 0.50 -2.81 -0.02 0.00 -0.02 0.00 0.00 41.12 38.77 1dkr n ASP 133 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1dkr s LEU 134 N -5.14 4.17 0.42 0.64 1.43 -1.26 -4.91 118.68 114.03 1dkr s LEU 134 Ca 0.11 2.39 0.17 0.00 -1.03 0.00 0.00 54.13 55.77 1dkr s LEU 134 Cb -0.05 -4.03 1.07 0.00 0.03 0.00 0.00 46.19 43.22 1dkr s LEU 134 CO 0.86 -0.74 1.85 -0.74 0.23 0.00 0.00 176.35 177.82 1dkr h HIS 135 N 2.57 0.55 -3.46 0.29 -0.00 -1.92 -3.38 115.15 109.80 1dkr h HIS 135 Ca -0.49 0.02 -0.34 0.00 -0.00 0.00 0.00 60.37 59.56 1dkr h HIS 135 Cb 1.24 -0.17 -0.35 0.00 -0.00 0.00 0.00 27.41 28.13 1dkr h HIS 135 CO 0.54 0.15 -0.74 0.00 -0.00 0.00 0.00 177.93 177.88 1dkr s ALA 136 N -5.44 0.27 0.19 5.26 0.00 -1.26 -5.05 121.76 115.73 1dkr s ALA 136 Ca -0.08 0.19 0.33 0.00 0.00 0.00 0.00 51.96 52.40 1dkr s ALA 136 Cb 0.23 -0.37 1.73 0.00 0.00 0.00 0.00 23.12 24.71 1dkr s ALA 136 CO 0.78 -0.17 2.02 -1.00 0.00 0.00 0.00 175.76 177.40 1dkr h PRO 137 N 7.51 0.00 0.00 0.00 0.13 -2.00 -2.40 132.00 135.23 1dkr h PRO 137 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1dkr h PRO 137 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1dkr h PRO 137 CO 0.42 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.19 1dkr n GLN 138 N -2.72 0.85 0.28 0.86 0.00 -1.26 -2.41 117.38 112.98 1dkr n GLN 138 Ca -0.02 0.00 0.16 0.00 0.00 0.00 0.00 57.00 57.14 1dkr n GLN 138 Cb 0.10 -1.50 0.79 0.00 0.00 0.00 0.00 30.24 29.63 1dkr n GLN 138 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 1dkr h ILE 139 N 0.00 0.30 -0.49 -0.39 2.04 -1.85 0.11 117.51 117.23 1dkr h ILE 139 Ca 0.00 -0.48 0.01 0.00 1.00 0.00 0.00 64.86 65.39 1dkr h ILE 139 Cb 0.04 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 1dkr h ILE 139 CO 0.00 0.07 0.32 1.56 0.00 0.00 0.00 178.15 180.11 1dkr h GLN 140 N 0.00 0.62 0.00 2.37 4.20 -1.72 0.55 115.11 121.13 1dkr h GLN 140 Ca -0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1dkr h GLN 140 Cb 0.36 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1dkr h GLN 140 CO 0.01 0.41 0.00 0.41 -0.67 0.00 0.00 178.83 178.99 1dkr n GLY 141 N -1.47 -1.16 0.22 3.46 0.00 0.39 -2.83 105.19 103.80 1dkr n GLY 141 Ca 0.04 0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.24 1dkr n GLY 141 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1dkr h PHE 142 N 0.00 0.00 -2.98 1.61 0.04 -0.90 -3.44 116.94 111.27 1dkr h PHE 142 Ca 0.00 0.00 -0.62 0.00 2.80 0.00 0.00 57.97 60.15 1dkr h PHE 142 Cb 0.32 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.42 1dkr h PHE 142 CO 0.00 0.00 -0.53 -0.06 -0.60 0.00 0.00 178.31 177.12 1dkr s PHE 143 N -3.50 3.42 -1.11 -0.55 0.40 -1.13 -4.71 117.98 110.80 1dkr s PHE 143 Ca 0.03 0.19 0.09 0.00 -0.60 0.00 0.00 56.93 56.64 1dkr s PHE 143 Cb 0.09 -1.71 0.08 0.00 0.51 0.00 0.00 43.02 41.99 1dkr s PHE 143 CO 0.51 0.57 0.82 -0.25 0.70 0.00 0.00 175.22 177.56 1dkr n ASP 144 N 0.31 1.82 -4.91 1.36 8.00 -1.26 -4.96 116.55 116.91 1dkr n ASP 144 Ca -0.06 -1.42 -0.21 0.00 0.71 0.00 0.00 54.79 53.81 1dkr n ASP 144 Cb 0.51 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.57 1dkr n ASP 144 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1dkr s ILE 145 N -0.77 4.73 0.33 0.53 -4.36 -1.26 -5.07 121.20 115.33 1dkr s ILE 145 Ca 0.11 -1.17 -0.29 0.00 -0.26 0.00 0.00 60.65 59.04 1dkr s ILE 145 Cb 0.08 -3.60 -0.11 0.00 1.25 0.00 0.00 42.46 40.07 1dkr s ILE 145 CO 0.11 -0.31 1.53 -2.84 0.24 0.00 0.00 174.94 173.68 1dkr s PRO 146 N -3.95 4.12 -0.05 0.37 0.02 -1.26 -4.89 135.00 129.37 1dkr s PRO 146 Ca 0.35 2.56 -0.00 0.00 0.02 0.00 0.00 61.00 63.93 1dkr s PRO 146 Cb -0.08 -3.00 0.03 0.00 0.02 0.00 0.00 34.50 31.46 1dkr s PRO 146 CO 0.27 -0.57 -0.01 -1.50 -0.33 0.00 0.00 177.00 174.87 1dkr s ILE 147 N -0.56 0.34 -0.24 2.83 2.07 -1.26 -1.67 121.20 122.71 1dkr s ILE 147 Ca 0.58 0.06 -0.08 0.00 -1.41 0.00 0.00 60.65 59.80 1dkr s ILE 147 Cb -0.47 -0.44 -0.03 0.00 0.13 0.00 0.00 42.46 41.65 1dkr s ILE 147 CO 0.55 0.21 0.08 -1.81 -1.91 0.00 0.00 174.94 172.06 1dkr s ASP 148 N 1.40 5.24 -0.36 4.50 1.01 -0.44 -4.99 116.67 123.04 1dkr s ASP 148 Ca -0.04 -0.16 -0.10 0.00 0.71 0.00 0.00 52.55 52.96 1dkr s ASP 148 Cb -0.13 -1.94 0.03 0.00 1.01 0.00 0.00 42.92 41.89 1dkr s ASP 148 CO -0.03 -0.01 0.18 -2.28 0.21 0.00 0.00 175.17 173.24 1dkr s HIS 149 N 1.48 3.24 0.19 4.23 5.65 -1.26 -0.80 115.29 128.02 1dkr s HIS 149 Ca 0.06 -1.05 -0.17 0.00 0.25 0.00 0.00 55.06 54.15 1dkr s HIS 149 Cb -0.15 -2.39 -0.08 0.00 -1.18 0.00 0.00 32.58 28.78 1dkr s HIS 149 CO 0.04 -0.66 0.64 -0.51 -0.65 0.00 0.00 174.74 173.60 1dkr s LEU 150 N 1.52 4.34 -0.16 8.88 1.43 0.79 -4.91 118.68 130.57 1dkr s LEU 150 Ca 0.01 1.25 -0.07 0.00 -1.03 0.00 0.00 54.13 54.29 1dkr s LEU 150 Cb -0.19 -3.43 -0.04 0.00 0.03 0.00 0.00 46.19 42.56 1dkr s LEU 150 CO 0.06 0.07 0.07 -0.04 0.23 0.00 0.00 176.35 176.73 1dkr s MET 151 N -1.97 3.81 0.05 1.70 -1.94 0.78 -0.74 119.30 120.99 1dkr s MET 151 Ca 0.40 -0.32 0.23 0.00 -1.71 0.00 0.00 55.69 54.30 1dkr s MET 151 Cb -0.16 -3.17 0.14 0.00 2.01 0.00 0.00 34.83 33.66 1dkr s MET 151 CO 0.20 0.39 1.12 0.41 -0.01 0.00 0.00 175.02 177.12 1dkr n GLY 152 N 3.18 -1.23 0.36 -0.03 0.00 -1.26 -4.44 105.19 101.77 1dkr n GLY 152 Ca -0.17 -0.38 0.09 0.00 0.00 0.00 0.00 46.02 45.56 1dkr n GLY 152 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1dkr h VAL 153 N 0.00 0.86 -0.70 1.61 2.07 -1.97 -2.34 116.25 115.78 1dkr h VAL 153 Ca 0.00 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.22 1dkr h VAL 153 Cb 0.69 -0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1dkr h VAL 153 CO 0.00 0.16 0.46 -0.65 0.02 0.00 0.00 177.57 177.56 1dkr h PRO 154 N 0.89 0.92 -0.49 1.57 0.11 -1.98 0.12 132.00 133.16 1dkr h PRO 154 Ca 0.50 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.50 1dkr h PRO 154 Cb 0.61 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 1dkr h PRO 154 CO -0.27 0.62 0.10 0.82 -0.21 0.00 0.00 178.00 179.06 1dkr h ILE 155 N 0.95 1.24 -0.34 4.15 2.04 -1.73 -0.04 117.51 123.79 1dkr h ILE 155 Ca 0.26 -0.87 -0.09 0.00 1.00 0.00 0.00 64.86 65.16 1dkr h ILE 155 Cb -0.10 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1dkr h ILE 155 CO -0.05 0.31 -0.13 -0.07 0.00 0.00 0.00 178.15 178.21 1dkr h LEU 156 N 0.67 0.70 -0.05 1.44 3.38 -1.34 -2.74 115.31 117.36 1dkr h LEU 156 Ca 0.15 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1dkr h LEU 156 Cb 0.36 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1dkr h LEU 156 CO 0.00 0.93 0.03 1.23 0.09 0.00 0.00 178.44 180.73 1dkr h GLY 157 N 0.46 0.07 0.90 0.83 0.00 -0.57 -1.83 103.07 102.93 1dkr h GLY 157 Ca 0.08 -0.02 0.11 0.00 0.00 0.00 0.00 47.33 47.50 1dkr h GLY 157 CO 0.04 0.02 0.45 -2.09 0.00 0.00 0.00 176.54 174.97 1dkr h GLU 158 N 0.06 0.46 0.07 4.80 4.81 -0.90 0.12 114.58 124.01 1dkr h GLU 158 Ca 0.02 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1dkr h GLU 158 Cb -0.00 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1dkr h GLU 158 CO -0.01 0.31 -0.03 -0.92 -0.73 0.00 0.00 179.01 177.62 1dkr h TYR 159 N 0.48 -0.09 -0.22 0.92 3.20 -1.11 -2.80 116.97 117.35 1dkr h TYR 159 Ca 0.32 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.16 1dkr h TYR 159 Cb 0.61 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 1dkr h TYR 159 CO -0.00 0.32 -0.00 0.74 -1.64 0.00 0.00 178.16 177.58 1dkr h PHE 160 N -0.52 0.32 -0.80 -3.82 0.04 -0.52 -2.51 116.94 109.13 1dkr h PHE 160 Ca -0.01 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.72 1dkr h PHE 160 Cb 0.45 -0.10 -0.04 0.00 2.20 0.00 0.00 35.95 38.46 1dkr h PHE 160 CO 0.07 0.33 0.43 1.49 -0.60 0.00 0.00 178.31 180.03 1dkr h GLU 161 N 0.31 1.12 0.00 1.51 4.81 -0.99 -1.83 114.58 119.51 1dkr h GLU 161 Ca 0.07 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1dkr h GLU 161 Cb 0.21 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1dkr h GLU 161 CO 0.00 0.84 0.00 0.41 -0.73 0.00 0.00 179.01 179.53 1dkr n GLY 162 N -1.08 -0.65 0.04 1.92 0.00 -0.95 -2.07 105.19 102.40 1dkr n GLY 162 Ca 0.08 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1dkr n GLY 162 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dkr n LYS 163 N -1.24 0.12 -3.50 1.61 5.02 -0.69 -4.99 118.16 114.48 1dkr n LYS 163 Ca 0.06 -0.08 -0.24 0.00 -2.02 0.00 0.00 58.31 56.04 1dkr n LYS 163 Cb 0.09 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.66 1dkr n LYS 163 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1dkr n ASN 164 N -1.37 -5.46 -4.87 4.39 3.02 -0.88 -4.98 115.26 105.10 1dkr n ASN 164 Ca 0.06 -0.87 -0.31 0.00 -0.03 0.00 0.00 54.58 53.43 1dkr n ASN 164 Cb 0.34 -4.21 -0.05 0.00 -0.61 0.00 0.00 39.78 35.25 1dkr n ASN 164 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1dkr s LEU 165 N -6.05 4.08 0.13 3.41 1.43 -1.26 -5.09 118.68 115.33 1dkr s LEU 165 Ca 0.42 1.01 0.06 0.00 -1.03 0.00 0.00 54.13 54.59 1dkr s LEU 165 Cb -0.11 -3.81 -0.04 0.00 0.03 0.00 0.00 46.19 42.26 1dkr s LEU 165 CO 0.81 -0.17 0.02 -1.61 0.23 0.00 0.00 176.35 175.63 1dkr s GLU 166 N -3.09 2.57 -0.96 1.70 2.02 -1.26 -4.78 118.70 114.90 1dkr s GLU 166 Ca 0.49 -0.92 -0.12 0.00 0.02 0.00 0.00 54.97 54.44 1dkr s GLU 166 Cb -0.11 -2.51 0.01 0.00 0.10 0.00 0.00 34.13 31.63 1dkr s GLU 166 CO 0.23 0.50 0.66 -0.25 0.02 0.00 0.00 175.26 176.42 1dkr n ASP 167 N 0.20 -5.04 -4.91 -0.19 8.00 -1.26 -4.14 116.55 109.21 1dkr n ASP 167 Ca -0.10 -0.97 -0.32 0.00 0.71 0.00 0.00 54.79 54.11 1dkr n ASP 167 Cb 0.53 -2.25 -0.04 0.00 -0.02 0.00 0.00 41.12 39.34 1dkr n ASP 167 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1dkr s ILE 168 N -3.19 5.40 -0.06 0.53 -4.36 -1.26 -0.05 121.20 118.22 1dkr s ILE 168 Ca 0.19 -0.29 -0.00 0.00 -0.26 0.00 0.00 60.65 60.29 1dkr s ILE 168 Cb -0.09 -3.60 0.02 0.00 1.25 0.00 0.00 42.46 40.05 1dkr s ILE 168 CO 0.90 0.21 -0.03 0.54 0.24 0.00 0.00 174.94 176.80 1dkr s VAL 169 N -1.44 0.51 -0.20 8.37 0.11 -0.28 -4.17 120.40 123.29 1dkr s VAL 169 Ca 0.32 -0.03 -0.24 0.00 -2.93 0.00 0.00 61.98 59.09 1dkr s VAL 169 Cb -0.13 -0.58 -0.01 0.00 -1.53 0.00 0.00 36.38 34.12 1dkr s VAL 169 CO 0.24 0.25 0.80 -0.63 -3.33 0.00 0.00 175.10 172.44 1dkr s ILE 170 N 1.41 4.88 -0.19 7.04 -1.09 -0.43 -1.17 121.20 131.65 1dkr s ILE 170 Ca -0.03 1.54 -0.06 0.00 -2.23 0.00 0.00 60.65 59.87 1dkr s ILE 170 Cb -0.13 -4.10 -0.03 0.00 -1.58 0.00 0.00 42.46 36.61 1dkr s ILE 170 CO -0.03 -0.00 0.04 -0.69 -1.23 0.00 0.00 174.94 173.03 1dkr s VAL 171 N 2.40 4.42 -0.25 2.92 1.01 0.14 -1.24 120.40 129.79 1dkr s VAL 171 Ca 0.36 -0.16 -0.20 0.00 0.00 0.00 0.00 61.98 61.98 1dkr s VAL 171 Cb -0.16 -3.00 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 1dkr s VAL 171 CO 0.10 0.44 0.63 -0.55 0.00 0.00 0.00 175.10 175.72 1dkr s SER 172 N 0.69 6.58 0.55 3.32 0.15 0.47 -2.59 113.70 122.87 1dkr s SER 172 Ca 0.02 0.71 0.23 0.00 0.70 0.00 0.00 55.95 57.61 1dkr s SER 172 Cb -0.14 -2.34 1.49 0.00 -1.71 0.00 0.00 66.02 63.32 1dkr s SER 172 CO 0.02 -0.37 2.13 -0.65 1.20 0.00 0.00 173.24 175.57 1dkr h PRO 173 N 7.90 0.00 0.00 5.44 0.11 -1.89 -1.29 132.00 142.27 1dkr h PRO 173 Ca -0.27 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.72 1dkr h PRO 173 Cb 1.12 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1dkr h PRO 173 CO 0.77 0.00 0.06 -0.40 -0.21 0.00 0.00 178.00 178.23 1dkr n ASP 174 N -4.21 -1.57 0.20 -2.05 5.68 -1.26 -4.53 116.55 108.80 1dkr n ASP 174 Ca 0.00 -2.47 0.04 0.00 -0.50 0.00 0.00 54.79 51.87 1dkr n ASP 174 Cb 0.24 2.72 0.41 0.00 -1.14 0.00 0.00 41.12 43.35 1dkr n ASP 174 CO 0.00 0.00 0.00 0.45 -1.33 0.00 0.00 177.20 176.32 1dkr h HIS 175 N 1.85 0.00 0.00 2.11 3.86 -1.89 -3.02 115.15 118.05 1dkr h HIS 175 Ca -0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.95 1dkr h HIS 175 Cb 1.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.49 1dkr h HIS 175 CO 0.00 0.33 -0.09 0.41 0.86 0.00 0.00 177.93 179.45 1dkr n GLY 176 N -0.43 -1.63 1.41 2.45 0.00 -1.26 -3.96 105.19 101.77 1dkr n GLY 176 Ca -0.02 -0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.01 1dkr n GLY 176 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dkr n GLY 177 N 1.35 3.23 0.22 -0.02 0.00 -1.14 -4.54 105.19 104.28 1dkr n GLY 177 Ca 0.06 -0.90 -0.05 0.00 0.00 0.00 0.00 46.02 45.12 1dkr n GLY 177 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1dkr h VAL 178 N 3.21 1.31 -0.63 1.61 2.07 -1.71 -2.25 116.25 119.86 1dkr h VAL 178 Ca 0.00 -1.56 -0.07 0.00 0.82 0.00 0.00 66.70 65.89 1dkr h VAL 178 Cb 1.58 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.93 1dkr h VAL 178 CO 0.30 0.48 0.12 0.74 0.02 0.00 0.00 177.57 179.24 1dkr h THR 179 N 0.37 1.25 -0.17 2.57 2.02 -1.89 -1.62 112.91 115.45 1dkr h THR 179 Ca 0.03 -0.96 -0.15 0.00 0.77 0.00 0.00 66.41 66.11 1dkr h THR 179 Cb 0.88 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1dkr h THR 179 CO 0.07 0.36 -0.51 -0.09 0.37 0.00 0.00 175.52 175.72 1dkr h ARG 180 N 0.96 0.47 -0.14 6.66 2.43 -1.84 -2.65 114.38 120.26 1dkr h ARG 180 Ca 0.20 -0.28 -0.13 0.00 -0.81 0.00 0.00 59.98 58.96 1dkr h ARG 180 Cb 0.38 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1dkr h ARG 180 CO 0.01 0.87 -0.48 0.00 -1.51 0.00 0.00 179.97 178.86 1dkr h ALA 181 N 1.08 0.92 -0.72 2.80 0.00 -1.24 -2.99 119.26 119.11 1dkr h ALA 181 Ca 0.01 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.40 1dkr h ALA 181 Cb 1.02 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1dkr h ALA 181 CO 0.09 0.65 0.22 -0.09 0.00 0.00 0.00 179.25 180.12 1dkr h ARG 182 N 0.29 1.12 -0.65 0.00 9.65 -1.07 -0.78 114.38 122.94 1dkr h ARG 182 Ca 0.02 -0.24 -0.06 0.00 -1.10 0.00 0.00 59.98 58.59 1dkr h ARG 182 Cb 0.95 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 29.34 1dkr h ARG 182 CO 0.08 0.96 0.16 0.87 2.80 0.00 0.00 179.97 184.84 1dkr h LYS 183 N 1.08 1.02 -0.31 0.20 1.57 -1.33 -0.89 116.57 117.90 1dkr h LYS 183 Ca 0.23 -0.23 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 1dkr h LYS 183 Cb 0.31 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.48 1dkr h LYS 183 CO -0.01 0.90 -0.52 1.25 -0.57 0.00 0.00 179.45 180.50 1dkr h LEU 184 N 0.97 0.99 -1.68 2.94 5.85 -1.45 -2.49 115.31 120.44 1dkr h LEU 184 Ca 0.21 -0.52 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 1dkr h LEU 184 Cb 0.34 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1dkr h LEU 184 CO -0.00 1.32 0.14 0.00 -0.34 0.00 0.00 178.44 179.57 1dkr h ALA 185 N 0.69 1.76 -0.29 1.25 0.00 -0.73 0.31 119.26 122.25 1dkr h ALA 185 Ca 0.02 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1dkr h ALA 185 Cb 1.13 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1dkr h ALA 185 CO 0.12 0.21 -0.35 -0.44 0.00 0.00 0.00 179.25 178.78 1dkr h ASP 186 N 0.36 0.82 -0.26 0.00 3.32 -0.97 0.27 116.42 119.95 1dkr h ASP 186 Ca 0.09 -0.49 -0.07 0.00 0.02 0.00 0.00 57.03 56.58 1dkr h ASP 186 Cb 0.01 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 1dkr h ASP 186 CO -0.02 1.14 -0.06 -0.09 -1.72 0.00 0.00 179.24 178.50 1dkr h ARG 187 N 0.51 0.63 -0.53 3.56 1.12 -0.83 -3.01 114.38 115.83 1dkr h ARG 187 Ca 0.04 -0.17 0.00 0.00 -1.11 0.00 0.00 59.98 58.74 1dkr h ARG 187 Cb 0.94 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 30.83 1dkr h ARG 187 CO 0.08 0.69 0.00 1.28 -3.11 0.00 0.00 179.97 178.92 1dkr n LEU 188 N -4.21 4.07 -4.25 3.80 4.32 -0.00 -4.96 117.00 115.77 1dkr n LEU 188 Ca 0.01 -2.35 -0.30 0.00 -0.02 0.00 0.00 56.01 53.35 1dkr n LEU 188 Cb 0.31 -0.47 -0.08 0.00 -1.62 0.00 0.00 43.42 41.55 1dkr n LEU 188 CO 0.41 0.80 -0.43 0.29 -1.22 0.00 0.00 177.39 177.24 1dkr n LYS 189 N 0.82 -1.39 -4.35 3.23 5.02 0.73 -4.95 118.16 117.27 1dkr n LYS 189 Ca 0.21 0.15 -0.23 0.00 -2.02 0.00 0.00 58.31 56.42 1dkr n LYS 189 Cb 0.74 -3.75 -0.11 0.00 -0.02 0.00 0.00 35.03 31.88 1dkr n LYS 189 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1dkr s ALA 190 N -4.30 2.13 0.80 7.82 0.00 -0.04 -5.04 121.76 123.13 1dkr s ALA 190 Ca 0.01 -1.51 -0.11 0.00 0.00 0.00 0.00 51.96 50.34 1dkr s ALA 190 Cb -0.00 -0.22 0.08 0.00 0.00 0.00 0.00 23.12 22.97 1dkr s ALA 190 CO 0.98 0.29 1.16 -1.25 0.00 0.00 0.00 175.76 176.94 1dkr s PRO 191 N -2.71 2.00 0.31 0.00 0.04 -1.26 -4.59 135.00 128.80 1dkr s PRO 191 Ca 0.16 0.08 0.10 0.00 0.04 0.00 0.00 61.00 61.38 1dkr s PRO 191 Cb -0.07 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 1dkr s PRO 191 CO 0.07 -1.55 -0.03 0.96 0.04 0.00 0.00 177.00 176.49 1dkr s ILE 192 N -3.54 2.76 -0.00 0.56 -4.36 -1.26 -1.31 121.20 114.04 1dkr s ILE 192 Ca 0.62 -2.05 -0.09 0.00 -0.26 0.00 0.00 60.65 58.87 1dkr s ILE 192 Cb -0.11 -2.71 0.01 0.00 1.25 0.00 0.00 42.46 40.90 1dkr s ILE 192 CO 0.49 -0.27 0.18 0.00 0.24 0.00 0.00 174.94 175.58 1dkr s ALA 193 N -2.48 -0.45 0.02 2.27 0.00 -0.38 -4.76 121.76 115.99 1dkr s ALA 193 Ca 0.33 0.00 0.04 0.00 0.00 0.00 0.00 51.96 52.33 1dkr s ALA 193 Cb -0.02 0.09 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 1dkr s ALA 193 CO 0.19 -0.22 -0.12 0.96 0.00 0.00 0.00 175.76 176.56 1dkr s ILE 194 N -1.34 0.97 -0.32 0.00 -4.36 -0.01 -0.40 121.20 115.75 1dkr s ILE 194 Ca -0.14 -0.79 -0.23 0.00 -0.26 0.00 0.00 60.65 59.23 1dkr s ILE 194 Cb -0.07 -0.86 0.00 0.00 1.25 0.00 0.00 42.46 42.78 1dkr s ILE 194 CO 0.02 0.08 0.76 -0.63 0.24 0.00 0.00 174.94 175.41 1dkr s ILE 195 N -0.64 4.80 -0.94 8.37 -1.09 -0.49 -0.19 121.20 131.02 1dkr s ILE 195 Ca 0.02 1.03 -0.14 0.00 -2.23 0.00 0.00 60.65 59.33 1dkr s ILE 195 Cb -0.06 -4.14 0.21 0.00 -1.58 0.00 0.00 42.46 36.89 1dkr s ILE 195 CO 0.00 -0.28 0.97 -0.62 -1.23 0.00 0.00 174.94 173.78 1dkr s ASP 196 N 1.69 6.88 -0.17 3.58 2.15 0.28 -4.21 116.67 126.87 1dkr s ASP 196 Ca 0.31 -2.77 -0.18 0.00 0.43 0.00 0.00 52.55 50.34 1dkr s ASP 196 Cb -0.14 -2.27 -0.04 0.00 -0.30 0.00 0.00 42.92 40.18 1dkr s ASP 196 CO 0.14 -0.63 0.48 -0.75 -0.17 0.00 0.00 175.17 174.24 1dkr s LYS 197 N 0.52 4.25 0.00 4.34 2.36 -1.26 -2.00 119.74 127.95 1dkr s LYS 197 Ca 0.26 0.40 0.00 0.00 -2.55 0.00 0.00 55.97 54.08 1dkr s LYS 197 Cb -0.08 -3.50 0.00 0.00 -1.05 0.00 0.00 37.83 33.19 1dkr s LYS 197 CO -0.08 -0.00 0.00 -2.13 1.55 0.00 0.00 175.35 174.69 1dkr n ARG 198 N 4.27 1.44 -3.51 4.03 3.00 -1.26 -5.01 116.66 119.61 1dkr n ARG 198 Ca -0.06 0.00 -0.27 0.00 -0.00 0.00 0.00 57.85 57.52 1dkr n ARG 198 Cb 0.51 -0.88 -0.10 0.00 0.00 0.00 0.00 32.46 31.99 1dkr n ARG 198 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.63 177.51 1dkr n MET 208 N -1.96 1.25 -2.34 -0.14 1.56 -1.26 -5.32 117.12 108.91 1dkr n MET 208 Ca 0.00 -3.87 -0.26 0.00 -0.27 0.00 0.00 57.70 53.30 1dkr n MET 208 Cb 0.38 -1.88 0.05 0.00 2.15 0.00 0.00 33.22 33.92 1dkr n MET 208 CO 0.00 0.00 0.00 -0.80 -0.73 0.00 0.00 175.97 174.44 1dkr s ASN 209 N -1.15 5.25 -0.14 6.12 -0.87 -0.85 -4.85 114.94 118.45 1dkr s ASN 209 Ca 0.32 0.56 0.02 0.00 -1.57 0.00 0.00 52.86 52.19 1dkr s ASN 209 Cb 0.06 -1.40 0.01 0.00 -0.02 0.00 0.00 41.25 39.90 1dkr s ASN 209 CO -0.14 -1.29 -0.18 -0.63 -2.57 0.00 0.00 177.10 172.29 1dkr s ILE 210 N -3.08 1.81 -0.41 0.60 1.01 -1.26 0.99 121.20 120.87 1dkr s ILE 210 Ca 0.57 -0.82 -0.11 0.00 0.00 0.00 0.00 60.65 60.29 1dkr s ILE 210 Cb -0.11 -1.64 0.05 0.00 0.01 0.00 0.00 42.46 40.78 1dkr s ILE 210 CO 0.44 0.50 0.26 -0.69 0.00 0.00 0.00 174.94 175.46 1dkr s VAL 211 N 1.05 4.62 0.00 2.92 1.01 0.73 -4.96 120.40 125.77 1dkr s VAL 211 Ca -0.03 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 60.88 1dkr s VAL 211 Cb -0.14 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.54 1dkr s VAL 211 CO -0.05 -0.40 0.00 0.61 0.00 0.00 0.00 175.10 175.26 1dkr n GLY 212 N 5.02 3.29 3.55 4.51 0.00 -1.26 -0.83 105.19 119.47 1dkr n GLY 212 Ca -0.11 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 1dkr n GLY 212 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1dkr s ASN 213 N 0.00 6.24 0.00 1.61 2.47 -1.26 -4.87 114.94 119.12 1dkr s ASN 213 Ca 0.00 -0.14 0.10 0.00 0.42 0.00 0.00 52.86 53.23 1dkr s ASN 213 Cb 0.00 -2.23 -0.00 0.00 -1.45 0.00 0.00 41.25 37.57 1dkr s ASN 213 CO 0.00 -0.39 0.62 2.30 -3.72 0.00 0.00 177.10 175.91 1dkr n ILE 214 N 5.31 0.00 -1.67 -5.21 -5.35 -1.26 -4.99 119.36 106.19 1dkr n ILE 214 Ca -0.07 -0.40 -0.50 0.00 -0.27 0.00 0.00 62.75 61.50 1dkr n ILE 214 Cb 0.49 1.12 -0.05 0.00 -1.74 0.00 0.00 39.64 39.45 1dkr n ILE 214 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1dkr n GLU 215 N -0.24 1.79 -2.03 6.28 -0.58 -1.26 -2.24 120.64 122.35 1dkr n GLU 215 Ca 0.04 0.65 -0.18 0.00 -0.42 0.00 0.00 57.16 57.25 1dkr n GLU 215 Cb 0.20 -2.41 -0.04 0.00 -0.57 0.00 0.00 31.44 28.63 1dkr n GLU 215 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dkr n GLY 216 N 3.75 0.43 3.66 0.62 0.00 0.15 -4.90 105.19 108.91 1dkr n GLY 216 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.99 1dkr n GLY 216 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dkr s LYS 217 N -4.39 2.18 -0.33 1.61 1.02 -0.95 -4.44 119.74 114.43 1dkr s LYS 217 Ca 0.00 -1.66 -0.20 0.00 0.02 0.00 0.00 55.97 54.13 1dkr s LYS 217 Cb 0.00 -2.02 -0.00 0.00 -0.52 0.00 0.00 37.83 35.29 1dkr s LYS 217 CO 0.00 0.15 0.64 0.99 -0.92 0.00 0.00 175.35 176.21 1dkr s THR 218 N -2.47 4.91 -0.02 2.17 2.01 0.93 -0.02 115.64 123.14 1dkr s THR 218 Ca 0.35 0.71 -0.12 0.00 0.31 0.00 0.00 61.69 62.94 1dkr s THR 218 Cb -0.01 -4.05 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 1dkr s THR 218 CO 0.20 -0.24 0.33 0.00 -0.69 0.00 0.00 174.62 174.22 1dkr s ALA 219 N 2.67 3.76 -0.23 7.40 0.00 0.12 -1.13 121.76 134.35 1dkr s ALA 219 Ca 0.25 -0.36 0.02 0.00 0.00 0.00 0.00 51.96 51.86 1dkr s ALA 219 Cb -0.15 -2.25 0.05 0.00 0.00 0.00 0.00 23.12 20.78 1dkr s ALA 219 CO 0.14 0.54 -0.11 0.42 0.00 0.00 0.00 175.76 176.74 1dkr s ILE 220 N -1.12 1.94 -0.09 0.00 1.01 -0.32 -0.84 121.20 121.79 1dkr s ILE 220 Ca 0.23 -1.34 -0.24 0.00 0.00 0.00 0.00 60.65 59.30 1dkr s ILE 220 Cb -0.15 -2.02 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 1dkr s ILE 220 CO 0.12 0.08 0.73 -0.76 0.00 0.00 0.00 174.94 175.11 1dkr s LEU 221 N 1.24 4.29 -0.03 2.97 1.43 0.76 0.24 118.68 129.57 1dkr s LEU 221 Ca -0.05 1.19 0.04 0.00 -1.03 0.00 0.00 54.13 54.28 1dkr s LEU 221 Cb -0.18 -3.13 -0.00 0.00 0.03 0.00 0.00 46.19 42.91 1dkr s LEU 221 CO -0.07 -0.18 -0.14 -0.51 0.23 0.00 0.00 176.35 175.68 1dkr s ILE 222 N 1.10 1.13 0.19 -0.59 2.07 -1.07 -0.39 121.20 123.64 1dkr s ILE 222 Ca 0.38 -0.57 -0.06 0.00 -1.41 0.00 0.00 60.65 58.99 1dkr s ILE 222 Cb -0.18 -0.97 -0.02 0.00 0.13 0.00 0.00 42.46 41.42 1dkr s ILE 222 CO 0.17 0.33 0.24 -0.62 -1.91 0.00 0.00 174.94 173.15 1dkr s ASP 223 N -0.02 0.09 -0.01 4.50 -1.08 -0.86 -4.35 116.67 114.94 1dkr s ASP 223 Ca -0.01 -1.12 -0.15 0.00 -0.52 0.00 0.00 52.55 50.75 1dkr s ASP 223 Cb -0.09 0.43 -0.33 0.00 -1.46 0.00 0.00 42.92 41.47 1dkr s ASP 223 CO 0.01 -0.90 0.86 -2.24 0.52 0.00 0.00 175.17 173.42 1dkr h ASP 224 N 2.56 0.71 -4.27 -0.34 2.03 -1.96 -3.30 116.42 111.85 1dkr h ASP 224 Ca -0.32 -0.93 -0.52 0.00 -0.73 0.00 0.00 57.03 54.53 1dkr h ASP 224 Cb 1.24 -0.23 -0.29 0.00 -0.83 0.00 0.00 39.33 39.21 1dkr h ASP 224 CO 0.49 1.69 -0.82 -0.63 -1.03 0.00 0.00 179.24 178.93 1dkr s ILE 225 N -2.56 1.26 -0.24 4.15 1.01 -1.26 -1.13 121.20 122.42 1dkr s ILE 225 Ca -0.12 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 59.85 1dkr s ILE 225 Cb 0.04 -1.05 0.05 0.00 0.01 0.00 0.00 42.46 41.51 1dkr s ILE 225 CO 0.90 0.35 -0.12 -0.63 0.00 0.00 0.00 174.94 175.43 1dkr s ILE 226 N -0.39 2.22 0.00 2.92 1.01 -0.91 -4.99 121.20 121.07 1dkr s ILE 226 Ca 0.06 -1.43 0.00 0.00 0.00 0.00 0.00 60.65 59.28 1dkr s ILE 226 Cb -0.06 -2.21 0.00 0.00 0.01 0.00 0.00 42.46 40.19 1dkr s ILE 226 CO -0.01 0.11 0.00 -0.67 0.00 0.00 0.00 174.94 174.38 1dkr n ASP 227 N 4.50 0.00 0.13 3.58 2.03 -1.26 -1.65 116.55 123.87 1dkr n ASP 227 Ca -0.16 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.28 1dkr n ASP 227 Cb 0.44 0.00 0.35 0.00 -0.72 0.00 0.00 41.12 41.19 1dkr n ASP 227 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1dkr h THR 228 N 0.00 0.00 0.00 5.18 1.35 -1.94 -0.74 112.91 116.76 1dkr h THR 228 Ca 0.00 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 1dkr h THR 228 Cb 0.00 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 1dkr h THR 228 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1dkr n ALA 229 N -1.85 0.00 -0.07 6.62 0.00 -1.26 -2.89 120.51 121.05 1dkr n ALA 229 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.40 1dkr n ALA 229 Cb 0.45 -0.26 -0.02 0.00 0.00 0.00 0.00 19.45 19.62 1dkr n ALA 229 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1dkr h GLY 230 N 0.00 0.37 0.88 0.00 0.00 -1.94 -2.02 103.07 100.36 1dkr h GLY 230 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1dkr h GLY 230 CO 0.00 0.14 0.06 -0.84 0.00 0.00 0.00 176.54 175.90 1dkr h THR 231 N 0.35 1.16 -0.32 4.70 2.02 -1.99 -2.26 112.91 116.57 1dkr h THR 231 Ca 0.10 -0.50 -0.11 0.00 0.77 0.00 0.00 66.41 66.67 1dkr h THR 231 Cb -0.03 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1dkr h THR 231 CO -0.02 0.16 -0.23 -0.29 0.37 0.00 0.00 175.52 175.51 1dkr h ILE 232 N 0.11 1.29 -0.49 3.11 6.09 -1.93 -1.97 117.51 123.72 1dkr h ILE 232 Ca 0.06 -1.37 -0.12 0.00 -1.37 0.00 0.00 64.86 62.06 1dkr h ILE 232 Cb 0.19 1.47 -0.01 0.00 0.47 0.00 0.00 36.82 38.93 1dkr h ILE 232 CO -0.00 0.44 -0.16 0.71 -3.07 0.00 0.00 178.15 176.07 1dkr h THR 233 N 0.49 1.27 -0.54 2.19 1.35 -1.43 0.18 112.91 116.42 1dkr h THR 233 Ca 0.06 -1.31 -0.06 0.00 -0.55 0.00 0.00 66.41 64.55 1dkr h THR 233 Cb 0.78 1.09 -0.02 0.00 -1.73 0.00 0.00 68.15 68.27 1dkr h THR 233 CO 0.06 0.46 0.09 -0.07 -0.25 0.00 0.00 175.52 175.81 1dkr h LEU 234 N 0.83 0.79 -0.79 3.87 4.07 -1.43 -0.64 115.31 122.00 1dkr h LEU 234 Ca 0.12 -0.16 -0.13 0.00 0.08 0.00 0.00 57.88 57.79 1dkr h LEU 234 Cb 0.73 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 42.25 1dkr h LEU 234 CO 0.06 0.80 -0.58 0.00 -1.08 0.00 0.00 178.44 177.64 1dkr h ALA 235 N 1.30 0.99 -0.14 1.53 0.00 -0.98 -2.22 119.26 119.73 1dkr h ALA 235 Ca 0.17 -0.53 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 1dkr h ALA 235 Cb 0.35 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1dkr h ALA 235 CO 0.01 0.72 -0.65 0.00 0.00 0.00 0.00 179.25 179.33 1dkr h ALA 236 N 1.35 0.27 -0.32 0.00 0.00 -0.08 -2.75 119.26 117.73 1dkr h ALA 236 Ca -0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 1dkr h ALA 236 Cb 1.04 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1dkr h ALA 236 CO 0.08 0.55 0.07 -0.91 0.00 0.00 0.00 179.25 179.05 1dkr h ASN 237 N 0.37 0.50 0.33 0.00 4.21 -1.08 -1.64 115.58 118.27 1dkr h ASN 237 Ca -0.04 -0.24 -0.03 0.00 1.21 0.00 0.00 56.30 57.20 1dkr h ASN 237 Cb 1.28 -0.13 -0.00 0.00 -1.12 0.00 0.00 38.32 38.35 1dkr h ASN 237 CO 0.13 0.61 -0.16 0.00 -1.29 0.00 0.00 177.43 176.72 1dkr h ALA 238 N 0.91 1.39 0.42 -0.83 0.00 -1.50 -0.52 119.26 119.13 1dkr h ALA 238 Ca 0.10 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1dkr h ALA 238 Cb 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1dkr h ALA 238 CO 0.00 0.20 -0.20 -0.07 0.00 0.00 0.00 179.25 179.18 1dkr h LEU 239 N 0.00 -0.48 0.16 0.00 3.38 -1.05 -2.88 115.31 114.43 1dkr h LEU 239 Ca -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1dkr h LEU 239 Cb 0.38 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1dkr h LEU 239 CO 0.02 -0.11 -0.16 0.58 0.09 0.00 0.00 178.44 178.86 1dkr h VAL 240 N -0.91 0.65 0.00 1.22 2.07 -1.05 -1.15 116.25 117.09 1dkr h VAL 240 Ca -0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1dkr h VAL 240 Cb 0.56 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1dkr h VAL 240 CO 0.10 0.00 0.00 -1.84 0.02 0.00 0.00 177.57 175.85 1dkr n GLU 241 N -5.28 0.28 -0.17 1.57 0.28 -0.23 -0.41 120.64 116.68 1dkr n GLU 241 Ca -0.08 0.00 0.05 0.00 -0.16 0.00 0.00 57.16 56.98 1dkr n GLU 241 Cb 0.20 -1.20 0.13 0.00 1.43 0.00 0.00 31.44 32.00 1dkr n GLU 241 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1dkr n ASN 242 N -0.70 2.79 0.00 -1.84 3.02 -0.47 -4.96 115.26 113.09 1dkr n ASN 242 Ca 0.03 -2.41 0.00 0.00 -0.03 0.00 0.00 54.58 52.17 1dkr n ASN 242 Cb 0.01 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 1dkr n ASN 242 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dkr n GLY 243 N -0.32 0.56 3.76 7.41 0.00 0.45 -4.52 105.19 112.53 1dkr n GLY 243 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1dkr n GLY 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dkr s ALA 244 N -2.00 3.66 0.16 4.61 0.00 -1.01 0.33 121.76 127.51 1dkr s ALA 244 Ca 0.00 1.52 -0.07 0.00 0.00 0.00 0.00 51.96 53.40 1dkr s ALA 244 Cb 0.00 -3.61 0.01 0.00 0.00 0.00 0.00 23.12 19.52 1dkr s ALA 244 CO 0.00 -0.95 1.46 -0.22 0.00 0.00 0.00 175.76 176.05 1dkr h LYS 245 N 4.23 0.72 -3.34 0.00 3.64 -0.66 -3.43 116.57 117.74 1dkr h LYS 245 Ca -0.48 -0.45 -0.06 0.00 -1.27 0.00 0.00 60.65 58.39 1dkr h LYS 245 Cb 1.23 0.05 -0.14 0.00 -0.41 0.00 0.00 32.23 32.96 1dkr h LYS 245 CO 0.74 1.08 -0.10 -1.21 -2.27 0.00 0.00 179.45 177.69 1dkr s GLU 246 N -4.08 1.02 -0.09 1.90 2.02 -1.07 -4.99 118.70 113.42 1dkr s GLU 246 Ca -0.09 -0.65 -0.01 0.00 0.02 0.00 0.00 54.97 54.24 1dkr s GLU 246 Cb 0.11 0.45 0.03 0.00 0.10 0.00 0.00 34.13 34.81 1dkr s GLU 246 CO 0.87 -0.39 -0.03 0.08 0.02 0.00 0.00 175.26 175.81 1dkr s VAL 247 N -3.53 0.67 0.19 2.63 1.01 -1.26 0.12 120.40 120.22 1dkr s VAL 247 Ca 0.01 -0.06 0.06 0.00 0.00 0.00 0.00 61.98 61.99 1dkr s VAL 247 Cb 0.01 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 1dkr s VAL 247 CO -0.10 0.31 0.09 -0.31 0.00 0.00 0.00 175.10 175.08 1dkr s TYR 248 N 1.82 3.00 0.02 5.22 1.51 -0.02 -0.75 117.35 128.15 1dkr s TYR 248 Ca 0.04 -0.09 0.02 0.00 -1.01 0.00 0.00 57.07 56.04 1dkr s TYR 248 Cb -0.12 -1.42 -0.01 0.00 -0.11 0.00 0.00 41.96 40.29 1dkr s TYR 248 CO -0.06 0.53 -0.07 0.00 -1.11 0.00 0.00 175.55 174.84 1dkr s ALA 249 N -1.85 0.53 0.13 3.71 0.00 -1.05 -0.17 121.76 123.06 1dkr s ALA 249 Ca 0.30 -0.51 -0.15 0.00 0.00 0.00 0.00 51.96 51.60 1dkr s ALA 249 Cb -0.09 -0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.02 1dkr s ALA 249 CO 0.22 0.05 0.38 0.00 0.00 0.00 0.00 175.76 176.41 1dkr h THR 252 N 2.00 1.40 -3.59 0.00 2.02 -1.50 -3.31 112.91 109.93 1dkr h THR 252 Ca -0.23 -2.22 -0.70 0.00 0.77 0.00 0.00 66.41 64.02 1dkr h THR 252 Cb 1.25 2.82 -0.23 0.00 -1.74 0.00 0.00 68.15 70.25 1dkr h THR 252 CO 0.27 0.47 -0.50 -1.00 0.37 0.00 0.00 175.52 175.14 1dkr s HIS 253 N -2.25 3.23 -1.17 3.16 3.76 -0.29 -2.52 115.29 119.22 1dkr s HIS 253 Ca -0.22 -0.71 -0.16 0.00 -0.15 0.00 0.00 55.06 53.82 1dkr s HIS 253 Cb 0.00 -2.47 0.13 0.00 1.11 0.00 0.00 32.58 31.36 1dkr s HIS 253 CO 0.63 -0.56 1.45 -1.25 -0.85 0.00 0.00 174.74 174.15 1dkr s PRO 254 N 1.62 3.96 0.08 8.40 0.04 -1.26 -2.14 135.00 145.70 1dkr s PRO 254 Ca 0.04 -2.23 -0.16 0.00 0.04 0.00 0.00 61.00 58.69 1dkr s PRO 254 Cb -0.19 -5.16 -0.11 0.00 0.04 0.00 0.00 34.50 29.09 1dkr s PRO 254 CO 0.08 -1.90 1.38 0.28 0.04 0.00 0.00 177.00 176.88 1dkr h VAL 255 N 5.19 1.32 -6.88 -0.36 2.07 -1.74 -3.46 116.25 112.39 1dkr h VAL 255 Ca 0.31 -1.47 -0.51 0.00 0.82 0.00 0.00 66.70 65.85 1dkr h VAL 255 Cb 0.91 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1dkr h VAL 255 CO 1.28 0.46 -0.94 0.18 0.02 0.00 0.00 177.57 178.57 1dkr n LEU 256 N -4.31 -0.61 -4.97 2.57 4.77 -0.66 -4.96 117.00 108.82 1dkr n LEU 256 Ca -0.05 -1.08 -0.21 0.00 -0.03 0.00 0.00 56.01 54.65 1dkr n LEU 256 Cb 0.47 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 1dkr n LEU 256 CO 0.44 0.62 0.17 -0.94 -1.33 0.00 0.00 177.39 176.35 1dkr s SER 257 N -3.40 5.91 1.69 -1.43 1.04 -0.29 -4.72 113.70 112.49 1dkr s SER 257 Ca 0.29 0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.77 1dkr s SER 257 Cb -0.16 -1.40 0.00 0.00 0.10 0.00 0.00 66.02 64.56 1dkr s SER 257 CO 0.85 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 175.13 1dkr n GLY 258 N -1.85 3.43 0.05 7.32 0.00 -1.26 -2.15 105.19 110.73 1dkr n GLY 258 Ca 0.00 -0.12 0.05 0.00 0.00 0.00 0.00 46.02 45.95 1dkr n GLY 258 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dkr n PRO 259 N 14.00 1.07 -0.31 1.61 -0.04 -1.26 -4.56 135.00 145.50 1dkr n PRO 259 Ca 0.00 -0.10 -0.07 0.00 -0.04 0.00 0.00 63.50 63.29 1dkr n PRO 259 Cb 0.00 -1.15 -0.06 0.00 -0.04 0.00 0.00 33.50 32.25 1dkr n PRO 259 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1dkr n ALA 260 N -0.54 -0.41 0.11 0.55 0.00 -0.91 -1.62 120.51 117.69 1dkr n ALA 260 Ca 0.07 0.66 -0.13 0.00 0.00 0.00 0.00 53.44 54.04 1dkr n ALA 260 Cb 0.05 -0.15 -0.06 0.00 0.00 0.00 0.00 19.45 19.30 1dkr n ALA 260 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1dkr h VAL 261 N 0.00 0.61 -0.98 0.00 2.07 -1.86 -1.01 116.25 115.08 1dkr h VAL 261 Ca 0.15 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.70 1dkr h VAL 261 Cb 0.33 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 30.66 1dkr h VAL 261 CO -0.71 0.00 0.64 -0.33 0.02 0.00 0.00 177.57 177.19 1dkr h GLU 262 N -0.35 1.22 -0.77 1.57 3.07 -1.74 0.89 114.58 118.46 1dkr h GLU 262 Ca 0.02 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1dkr h GLU 262 Cb 0.35 -0.28 -0.04 0.00 -0.84 0.00 0.00 28.75 27.95 1dkr h GLU 262 CO -0.07 0.81 0.45 0.00 -1.40 0.00 0.00 179.01 178.79 1dkr h ARG 263 N 1.26 1.06 -0.01 2.33 3.08 -0.88 -0.96 114.38 120.27 1dkr h ARG 263 Ca 0.39 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.32 1dkr h ARG 263 Cb -0.03 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 29.81 1dkr h ARG 263 CO -0.12 0.77 -0.01 0.82 -1.07 0.00 0.00 179.97 180.36 1dkr h ILE 264 N 1.07 1.44 -0.59 2.04 2.04 0.00 -2.48 117.51 121.03 1dkr h ILE 264 Ca 0.28 -1.30 0.12 0.00 1.00 0.00 0.00 64.86 64.95 1dkr h ILE 264 Cb -0.01 2.30 -0.03 0.00 -0.74 0.00 0.00 36.82 38.34 1dkr h ILE 264 CO -0.05 0.34 0.40 0.78 0.00 0.00 0.00 178.15 179.62 1dkr h ASN 265 N -0.52 0.26 -0.37 1.72 2.35 -0.73 0.46 115.58 118.75 1dkr h ASN 265 Ca 0.00 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1dkr h ASN 265 Cb 0.56 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1dkr h ASN 265 CO 0.00 0.15 0.00 0.59 -1.65 0.00 0.00 177.43 176.52 1dkr n ASN 266 N -4.45 2.46 -3.81 5.81 3.02 -0.38 -4.93 115.26 112.98 1dkr n ASN 266 Ca 0.10 -1.91 -0.13 0.00 -0.03 0.00 0.00 54.58 52.61 1dkr n ASN 266 Cb 0.45 -0.24 0.05 0.00 -0.61 0.00 0.00 39.78 39.43 1dkr n ASN 266 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1dkr n SER 267 N 0.84 1.21 -0.52 6.41 3.41 0.15 -4.99 113.62 120.13 1dkr n SER 267 Ca 0.17 -1.91 0.12 0.00 -0.26 0.00 0.00 58.87 56.99 1dkr n SER 267 Cb 0.42 -0.32 0.44 0.00 -0.26 0.00 0.00 64.21 64.50 1dkr n SER 267 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1dkr n THR 268 N -1.97 0.12 -1.84 6.66 -2.24 -1.26 -4.90 114.28 108.85 1dkr n THR 268 Ca 0.11 -0.30 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 1dkr n THR 268 Cb 0.38 0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 69.00 1dkr n THR 268 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1dkr s ILE 269 N -1.88 3.13 0.10 2.28 1.01 -1.26 -4.59 121.20 120.00 1dkr s ILE 269 Ca 0.35 0.34 -0.16 0.00 0.00 0.00 0.00 60.65 61.17 1dkr s ILE 269 Cb 0.19 -3.22 -0.06 0.00 0.01 0.00 0.00 42.46 39.39 1dkr s ILE 269 CO 0.29 -0.02 1.52 0.50 0.00 0.00 0.00 174.94 177.23 1dkr h LYS 270 N 9.52 0.60 -2.42 2.79 3.64 -1.29 -3.45 116.57 125.97 1dkr h LYS 270 Ca -0.44 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 58.65 1dkr h LYS 270 Cb 1.21 -0.04 -0.24 0.00 -0.41 0.00 0.00 32.23 32.75 1dkr h LYS 270 CO 0.94 0.76 -0.17 -2.00 -2.27 0.00 0.00 179.45 176.72 1dkr s GLU 271 N -4.85 0.53 -0.21 1.90 2.12 -1.26 -4.75 118.70 112.18 1dkr s GLU 271 Ca -0.13 0.91 -0.11 0.00 0.36 0.00 0.00 54.97 56.00 1dkr s GLU 271 Cb 0.09 0.08 -0.05 0.00 0.26 0.00 0.00 34.13 34.51 1dkr s GLU 271 CO 0.78 -0.14 0.17 -1.17 -0.54 0.00 0.00 175.26 174.36 1dkr s LEU 272 N 1.27 4.19 -0.13 2.70 2.96 -0.02 -2.52 118.68 127.13 1dkr s LEU 272 Ca -0.08 0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.08 1dkr s LEU 272 Cb -0.07 -2.14 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 1dkr s LEU 272 CO -0.13 0.13 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.18 1dkr s VAL 273 N 0.60 2.66 0.27 1.68 1.01 0.01 -0.80 120.40 125.84 1dkr s VAL 273 Ca 0.09 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.31 1dkr s VAL 273 Cb -0.12 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1dkr s VAL 273 CO 0.01 0.53 0.21 0.68 0.00 0.00 0.00 175.10 176.53 1dkr s VAL 274 N 0.46 0.01 0.56 2.92 -7.23 -0.28 -1.48 120.40 115.37 1dkr s VAL 274 Ca -0.12 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.10 1dkr s VAL 274 Cb -0.16 -2.50 0.05 0.00 0.56 0.00 0.00 36.38 34.33 1dkr s VAL 274 CO 0.05 0.00 0.43 0.35 -0.31 0.00 0.00 175.10 175.62 1dkr n THR 275 N -0.47 0.00 -1.27 5.32 -2.24 -1.05 -0.00 114.28 114.57 1dkr n THR 275 Ca 0.05 -2.22 -0.21 0.00 -2.27 0.00 0.00 64.05 59.40 1dkr n THR 275 Cb 0.64 -0.03 0.18 0.00 -2.10 0.00 0.00 70.33 69.03 1dkr n THR 275 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1dkr n ASN 276 N -1.84 3.54 0.26 3.42 6.94 -0.97 -4.52 115.26 122.09 1dkr n ASN 276 Ca -0.02 -3.64 0.14 0.00 -0.02 0.00 0.00 54.58 51.04 1dkr n ASN 276 Cb 0.64 -0.81 0.69 0.00 -2.36 0.00 0.00 39.78 37.94 1dkr n ASN 276 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1dkr h SER 277 N 1.00 0.00 -4.15 0.53 4.64 -1.89 -3.41 113.55 110.27 1dkr h SER 277 Ca 0.57 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 61.35 1dkr h SER 277 Cb 2.69 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 64.48 1dkr h SER 277 CO 1.00 0.11 -0.83 -0.63 -0.87 0.00 0.00 176.83 175.61 1dkr s ILE 278 N -3.93 1.35 0.13 0.95 1.01 -1.26 -4.26 121.20 115.19 1dkr s ILE 278 Ca -0.01 -0.71 -0.31 0.00 0.00 0.00 0.00 60.65 59.62 1dkr s ILE 278 Cb 0.11 -1.13 -0.08 0.00 0.01 0.00 0.00 42.46 41.37 1dkr s ILE 278 CO 0.57 0.38 1.34 -0.75 0.00 0.00 0.00 174.94 176.49 1dkr s LYS 279 N -0.23 4.36 0.51 2.79 2.20 -1.26 -4.85 119.74 123.26 1dkr s LYS 279 Ca 0.03 2.03 -0.19 0.00 -0.36 0.00 0.00 55.97 57.48 1dkr s LYS 279 Cb -0.08 -3.25 -0.07 0.00 -1.51 0.00 0.00 37.83 32.92 1dkr s LYS 279 CO 0.00 -0.36 1.03 -0.51 -0.36 0.00 0.00 175.35 175.16 1dkr s LEU 280 N 0.76 3.75 -0.01 5.43 1.02 -1.26 -5.00 118.68 123.36 1dkr s LEU 280 Ca 0.62 1.86 -0.30 0.00 0.02 0.00 0.00 54.13 56.32 1dkr s LEU 280 Cb -0.36 -4.55 -0.05 0.00 0.02 0.00 0.00 46.19 41.25 1dkr s LEU 280 CO 0.32 -0.84 1.36 -2.16 0.02 0.00 0.00 176.35 175.05 1dkr s PRO 281 N -3.51 4.30 0.24 1.29 0.04 -1.26 -4.84 135.00 131.26 1dkr s PRO 281 Ca 0.65 1.91 0.01 0.00 0.04 0.00 0.00 61.00 63.62 1dkr s PRO 281 Cb -0.15 -3.56 0.26 0.00 0.04 0.00 0.00 34.50 31.09 1dkr s PRO 281 CO 0.25 -0.54 1.60 1.05 0.04 0.00 0.00 177.00 179.39 1dkr h GLU 282 N 7.72 0.42 -0.24 4.56 4.11 -2.05 -3.34 114.58 125.77 1dkr h GLU 282 Ca -0.37 -0.23 0.03 0.00 0.07 0.00 0.00 59.36 58.85 1dkr h GLU 282 Cb 1.18 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.39 1dkr h GLU 282 CO 0.90 0.81 -0.32 0.93 0.07 0.00 0.00 179.01 181.39 1dkr h GLU 283 N 0.34 -0.21 -6.26 1.06 5.08 -2.05 -3.42 114.58 109.12 1dkr h GLU 283 Ca 0.02 0.01 -0.69 0.00 -1.00 0.00 0.00 59.36 57.71 1dkr h GLU 283 Cb 0.95 0.05 -0.21 0.00 0.50 0.00 0.00 28.75 30.04 1dkr h GLU 283 CO 0.08 -0.14 -0.74 -1.59 -1.00 0.00 0.00 179.01 175.62 1dkr s LYS 284 N -4.49 2.59 -0.14 2.33 -2.85 -1.25 -5.12 119.74 110.80 1dkr s LYS 284 Ca -0.08 -0.65 -0.07 0.00 -1.00 0.00 0.00 55.97 54.17 1dkr s LYS 284 Cb 0.05 -2.46 -0.04 0.00 -2.06 0.00 0.00 37.83 33.31 1dkr s LYS 284 CO 0.35 0.64 0.11 0.21 0.10 0.00 0.00 175.35 176.75 1dkr s LYS 285 N -0.83 3.62 0.02 1.78 2.20 -1.26 -4.77 119.74 120.49 1dkr s LYS 285 Ca 0.12 -0.22 -0.21 0.00 -0.36 0.00 0.00 55.97 55.30 1dkr s LYS 285 Cb -0.11 -3.18 -0.06 0.00 -1.51 0.00 0.00 37.83 32.97 1dkr s LYS 285 CO 0.01 0.59 0.61 0.42 -0.36 0.00 0.00 175.35 176.63 1dkr s ILE 286 N -0.50 4.85 -0.12 5.43 1.09 -1.26 -4.98 121.20 125.71 1dkr s ILE 286 Ca 0.11 1.29 -0.28 0.00 -1.10 0.00 0.00 60.65 60.67 1dkr s ILE 286 Cb -0.12 -3.95 -0.26 0.00 -1.06 0.00 0.00 42.46 37.08 1dkr s ILE 286 CO 0.02 0.44 0.83 -0.33 -0.10 0.00 0.00 174.94 175.79 1dkr h GLU 287 N 5.44 0.01 -3.90 2.79 5.08 -1.94 -3.40 114.58 118.66 1dkr h GLU 287 Ca -0.46 -0.01 -0.75 0.00 -1.00 0.00 0.00 59.36 57.14 1dkr h GLU 287 Cb 1.20 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 30.17 1dkr h GLU 287 CO 0.69 0.95 -0.16 1.03 -1.00 0.00 0.00 179.01 180.52 1dkr s ARG 288 N -2.44 3.02 -0.05 2.33 3.00 -1.26 -5.03 118.95 118.52 1dkr s ARG 288 Ca -0.19 -2.25 -0.12 0.00 0.00 0.00 0.00 55.73 53.17 1dkr s ARG 288 Cb -0.02 -4.12 0.02 0.00 0.00 0.00 0.00 34.95 30.82 1dkr s ARG 288 CO 0.69 -1.24 0.29 0.12 0.00 0.00 0.00 175.30 175.16 1dkr s PHE 289 N 0.52 -0.22 -0.03 -0.53 2.19 -1.26 -0.84 117.98 117.82 1dkr s PHE 289 Ca 0.13 0.44 0.01 0.00 0.33 0.00 0.00 56.93 57.84 1dkr s PHE 289 Cb -0.18 0.09 0.02 0.00 -1.31 0.00 0.00 43.02 41.63 1dkr s PHE 289 CO -0.04 -0.29 -0.01 0.21 1.83 0.00 0.00 175.22 176.92 1dkr s LYS 290 N -0.74 0.35 -0.20 10.12 2.47 0.02 -4.92 119.74 126.85 1dkr s LYS 290 Ca -0.08 0.03 -0.01 0.00 -1.56 0.00 0.00 55.97 54.35 1dkr s LYS 290 Cb -0.04 -0.48 0.01 0.00 -1.46 0.00 0.00 37.83 35.85 1dkr s LYS 290 CO 0.02 -0.10 -0.14 -1.14 0.16 0.00 0.00 175.35 174.15 1dkr s GLN 291 N 0.85 3.10 0.14 4.03 0.74 -1.26 -1.13 119.66 126.13 1dkr s GLN 291 Ca -0.09 -0.78 -0.06 0.00 0.05 0.00 0.00 55.36 54.48 1dkr s GLN 291 Cb -0.12 -2.74 -0.06 0.00 1.10 0.00 0.00 33.01 31.19 1dkr s GLN 291 CO -0.01 -0.22 0.39 -0.51 -0.55 0.00 0.00 175.29 174.39 1dkr s LEU 292 N 1.35 4.27 -0.14 3.68 1.43 1.00 -4.95 118.68 125.32 1dkr s LEU 292 Ca 0.05 0.64 -0.08 0.00 -1.03 0.00 0.00 54.13 53.71 1dkr s LEU 292 Cb -0.14 -3.28 -0.04 0.00 0.03 0.00 0.00 46.19 42.76 1dkr s LEU 292 CO -0.09 0.06 0.14 -0.55 0.23 0.00 0.00 176.35 176.14 1dkr s SER 293 N -2.32 6.35 0.00 2.29 0.15 -1.26 -2.30 113.70 116.61 1dkr s SER 293 Ca 0.40 0.41 0.23 0.00 0.70 0.00 0.00 55.95 57.69 1dkr s SER 293 Cb -0.12 -2.08 0.29 0.00 -1.71 0.00 0.00 66.02 62.41 1dkr s SER 293 CO 0.23 0.35 1.30 1.33 1.20 0.00 0.00 173.24 177.65 1dkr n VAL 294 N 2.36 0.25 0.12 4.45 0.24 -1.26 -4.52 118.33 119.97 1dkr n VAL 294 Ca -0.19 -0.63 -0.13 0.00 -2.04 0.00 0.00 64.34 61.36 1dkr n VAL 294 Cb 0.54 1.23 -0.06 0.00 -1.47 0.00 0.00 33.84 34.08 1dkr n VAL 294 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1dkr h GLY 295 N 4.39 -0.49 1.31 7.63 0.00 -1.93 0.04 103.07 114.02 1dkr h GLY 295 Ca 0.00 0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 1dkr h GLY 295 CO 0.00 -0.22 0.34 -2.55 0.00 0.00 0.00 176.54 174.11 1dkr h PRO 296 N -0.47 0.90 -0.49 4.80 0.11 -1.92 -0.05 132.00 134.87 1dkr h PRO 296 Ca 0.03 -0.10 -0.04 0.00 0.11 0.00 0.00 66.00 65.99 1dkr h PRO 296 Cb 0.49 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 1dkr h PRO 296 CO -0.15 0.68 0.13 1.25 -0.21 0.00 0.00 178.00 179.70 1dkr h LEU 297 N 0.91 0.74 -0.23 2.35 5.85 -1.68 -1.28 115.31 121.96 1dkr h LEU 297 Ca 0.23 -0.22 -0.22 0.00 0.84 0.00 0.00 57.88 58.51 1dkr h LEU 297 Cb 0.05 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1dkr h LEU 297 CO -0.04 0.77 -0.82 -0.07 -0.34 0.00 0.00 178.44 177.94 1dkr h LEU 298 N 0.67 0.70 -0.52 2.25 3.38 -0.87 -2.39 115.31 118.53 1dkr h LEU 298 Ca 0.16 -0.49 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1dkr h LEU 298 Cb 0.31 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1dkr h LEU 298 CO -0.00 1.27 0.28 0.00 0.09 0.00 0.00 178.44 180.07 1dkr h ALA 299 N 0.71 0.67 -0.62 1.53 0.00 -0.91 -0.82 119.26 119.81 1dkr h ALA 299 Ca -0.06 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1dkr h ALA 299 Cb 1.44 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 1dkr h ALA 299 CO 0.15 0.19 0.21 1.49 0.00 0.00 0.00 179.25 181.29 1dkr h GLU 300 N 0.69 0.92 -0.45 0.00 4.57 -1.20 -2.32 114.58 116.79 1dkr h GLU 300 Ca 0.18 -0.17 -0.03 0.00 -1.18 0.00 0.00 59.36 58.16 1dkr h GLU 300 Cb 0.06 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.48 1dkr h GLU 300 CO -0.03 0.78 0.15 0.00 -1.18 0.00 0.00 179.01 178.74 1dkr h ALA 301 N 1.33 0.59 -0.59 2.92 0.00 -0.86 -2.12 119.26 120.53 1dkr h ALA 301 Ca 0.20 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1dkr h ALA 301 Cb 0.24 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1dkr h ALA 301 CO -0.01 0.23 0.19 0.82 0.00 0.00 0.00 179.25 180.48 1dkr h ILE 302 N 0.59 1.24 -0.17 0.00 2.04 -0.95 -1.36 117.51 118.91 1dkr h ILE 302 Ca 0.15 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 1dkr h ILE 302 Cb 0.25 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1dkr h ILE 302 CO -0.01 0.31 0.07 0.40 0.00 0.00 0.00 178.15 178.92 1dkr h ILE 303 N 0.83 1.14 -0.19 -0.67 2.04 -1.27 -1.25 117.51 118.15 1dkr h ILE 303 Ca 0.19 -0.41 -0.07 0.00 1.00 0.00 0.00 64.86 65.57 1dkr h ILE 303 Cb 0.27 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1dkr h ILE 303 CO -0.01 0.13 -0.18 0.03 0.00 0.00 0.00 178.15 178.12 1dkr h ARG 304 N 0.13 0.32 -0.21 2.37 3.08 -1.30 -0.96 114.38 117.81 1dkr h ARG 304 Ca 0.06 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 59.93 1dkr h ARG 304 Cb 0.14 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1dkr h ARG 304 CO -0.01 0.50 -0.20 0.28 -1.07 0.00 0.00 179.97 179.47 1dkr h VAL 305 N 0.30 1.33 -0.59 2.04 2.07 -1.08 0.26 116.25 120.58 1dkr h VAL 305 Ca 0.05 -1.36 -0.07 0.00 0.82 0.00 0.00 66.70 66.14 1dkr h VAL 305 Cb 0.50 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 1dkr h VAL 305 CO 0.03 0.42 0.10 -0.74 0.02 0.00 0.00 177.57 177.40 1dkr h HIS 306 N 0.18 0.99 -0.02 1.57 -0.00 -0.95 -2.86 115.15 114.06 1dkr h HIS 306 Ca 0.03 -0.12 0.00 0.00 -0.00 0.00 0.00 60.37 60.28 1dkr h HIS 306 Cb 0.75 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 27.88 1dkr h HIS 306 CO 0.08 0.84 -0.05 0.39 -0.00 0.00 0.00 177.93 179.19 1dkr n GLU 307 N -4.23 1.61 -2.79 5.26 1.02 -0.39 -4.96 120.64 116.16 1dkr n GLU 307 Ca 0.04 -1.02 -0.12 0.00 -0.02 0.00 0.00 57.16 56.04 1dkr n GLU 307 Cb 0.27 -1.48 0.03 0.00 -0.02 0.00 0.00 31.44 30.24 1dkr n GLU 307 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1dkr n GLN 308 N 0.19 -3.08 -3.23 3.49 1.13 -0.58 -5.05 117.38 110.26 1dkr n GLN 308 Ca 0.17 0.47 -0.20 0.00 -1.94 0.00 0.00 57.00 55.49 1dkr n GLN 308 Cb 0.39 -4.40 0.00 0.00 0.11 0.00 0.00 30.24 26.35 1dkr n GLN 308 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1dkr s GLN 309 N -5.31 3.04 0.01 -1.09 -1.52 0.81 -5.03 119.66 110.58 1dkr s GLN 309 Ca 0.21 -0.84 -0.30 0.00 -1.95 0.00 0.00 55.36 52.48 1dkr s GLN 309 Cb -0.09 -2.71 -0.06 0.00 -0.22 0.00 0.00 33.01 29.93 1dkr s GLN 309 CO 0.25 -0.12 1.49 0.45 -0.25 0.00 0.00 175.29 177.11 1dkr s SER 310 N -4.22 6.77 -0.01 5.90 0.15 -1.26 -4.59 113.70 116.44 1dkr s SER 310 Ca 0.47 2.21 0.13 0.00 0.70 0.00 0.00 55.95 59.47 1dkr s SER 310 Cb -0.10 -2.56 -0.17 0.00 -1.71 0.00 0.00 66.02 61.48 1dkr s SER 310 CO 0.34 -0.78 0.45 1.33 1.20 0.00 0.00 173.24 175.78 1dkr n VAL 311 N 4.77 0.00 0.23 4.45 0.24 -1.26 -4.31 118.33 122.45 1dkr n VAL 311 Ca 0.14 -0.24 0.06 0.00 -2.04 0.00 0.00 64.34 62.26 1dkr n VAL 311 Cb 0.43 0.66 0.55 0.00 -1.47 0.00 0.00 33.84 34.01 1dkr n VAL 311 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1dkr h SER 312 N 0.00 0.02 -0.99 -1.34 4.64 -2.00 0.10 113.55 113.98 1dkr h SER 312 Ca 0.00 -0.00 0.26 0.00 -0.47 0.00 0.00 61.79 61.58 1dkr h SER 312 Cb 0.44 -0.01 -0.07 0.00 -0.31 0.00 0.00 62.40 62.46 1dkr h SER 312 CO 0.00 0.12 0.67 0.22 -0.87 0.00 0.00 176.83 176.98 1dkr h TYR 313 N 0.03 0.37 0.00 4.77 5.03 -1.98 -3.35 116.97 121.83 1dkr h TYR 313 Ca 0.01 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.33 1dkr h TYR 313 Cb 0.19 -0.11 0.00 0.00 1.55 0.00 0.00 36.73 38.36 1dkr h TYR 313 CO 0.00 0.06 0.00 -0.11 -1.32 0.00 0.00 178.16 176.79 1dkr n LEU 314 N -4.44 0.00 0.00 2.82 7.94 0.34 -5.22 117.00 118.45 1dkr n LEU 314 Ca 0.22 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.12 1dkr n LEU 314 Cb 0.90 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.85 1dkr n LEU 314 CO 0.32 0.00 0.00 0.49 -1.11 0.00 0.00 177.39 177.09