#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dy3 s THR 2 N 0.00 -0.16 -0.01 12.58 2.01 -1.26 -0.80 115.64 128.01 3dy3 s THR 2 Ca 0.00 0.30 -0.00 0.00 0.31 0.00 0.00 61.69 62.30 3dy3 s THR 2 Cb 0.00 -0.24 0.01 0.00 0.01 0.00 0.00 72.50 72.28 3dy3 s THR 2 CO 0.00 0.12 0.02 0.42 -0.69 0.00 0.00 174.62 174.50 3dy3 s THR 3 N 1.82 -0.02 0.12 -0.82 -4.23 -0.36 -1.83 115.64 110.32 3dy3 s THR 3 Ca -0.02 0.07 -0.00 0.00 -1.18 0.00 0.00 61.69 60.56 3dy3 s THR 3 Cb -0.12 -0.05 -0.04 0.00 1.34 0.00 0.00 72.50 73.63 3dy3 s THR 3 CO -0.05 0.03 0.03 -1.48 -0.54 0.00 0.00 174.62 172.60 3dy3 s LEU 4 N 0.36 2.00 -0.28 4.79 -0.00 -0.08 0.05 118.68 125.52 3dy3 s LEU 4 Ca -0.03 -1.15 -0.16 0.00 -0.00 0.00 0.00 54.13 52.79 3dy3 s LEU 4 Cb -0.04 0.21 0.11 0.00 -0.00 0.00 0.00 46.19 46.46 3dy3 s LEU 4 CO -0.01 -0.67 0.78 0.00 -0.00 0.00 0.00 176.35 176.45 3dy3 s ALA 5 N -3.95 -2.03 0.04 1.48 0.00 -0.55 -2.24 121.76 114.50 3dy3 s ALA 5 Ca 0.20 2.35 0.01 0.00 0.00 0.00 0.00 51.96 54.52 3dy3 s ALA 5 Cb 0.07 -1.56 -0.02 0.00 0.00 0.00 0.00 23.12 21.61 3dy3 s ALA 5 CO -0.01 -0.43 -0.05 -0.59 0.00 0.00 0.00 175.76 174.69 3dy3 s PHE 6 N 1.67 0.47 0.04 0.00 -0.12 -0.83 -1.37 117.98 117.85 3dy3 s PHE 6 Ca -0.09 -0.60 -0.12 0.00 -0.05 0.00 0.00 56.93 56.07 3dy3 s PHE 6 Cb -0.05 -0.31 -0.06 0.00 -0.63 0.00 0.00 43.02 41.98 3dy3 s PHE 6 CO -0.18 -0.17 0.40 1.03 -0.05 0.00 0.00 175.22 176.25 3dy3 s ARG 7 N -1.91 3.82 0.31 1.99 0.52 0.16 -1.50 118.95 122.33 3dy3 s ARG 7 Ca -0.10 0.27 -0.20 0.00 -0.52 0.00 0.00 55.73 55.18 3dy3 s ARG 7 Cb -0.07 -3.09 0.03 0.00 0.52 0.00 0.00 34.95 32.34 3dy3 s ARG 7 CO -0.02 0.61 0.74 -0.59 0.02 0.00 0.00 175.30 176.07 3dy3 s PHE 8 N -1.27 -0.11 0.27 -0.53 -0.12 0.79 -4.90 117.98 112.11 3dy3 s PHE 8 Ca 0.29 -0.41 0.04 0.00 -0.05 0.00 0.00 56.93 56.80 3dy3 s PHE 8 Cb -0.15 0.74 0.71 0.00 -0.63 0.00 0.00 43.02 43.70 3dy3 s PHE 8 CO 0.16 -1.32 1.31 0.94 -0.05 0.00 0.00 175.22 176.26 3dy3 n GLN 9 N -0.48 -0.06 -0.13 1.99 0.00 0.36 0.10 117.38 119.15 3dy3 n GLN 9 Ca -0.05 1.24 0.08 0.00 -0.00 0.00 0.00 57.00 58.27 3dy3 n GLN 9 Cb 0.59 -2.01 0.26 0.00 0.00 0.00 0.00 30.24 29.08 3dy3 n GLN 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3dy3 n GLY 10 N -1.39 0.46 0.00 1.69 0.00 -1.26 -5.04 105.19 99.65 3dy3 n GLY 10 Ca 0.21 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3dy3 n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dy3 n GLY 11 N 1.09 0.13 3.07 -0.02 0.00 0.11 -4.74 105.19 104.83 3dy3 n GLY 11 Ca 0.14 -1.44 -0.19 0.00 0.00 0.00 0.00 46.02 44.52 3dy3 n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dy3 s ILE 12 N 0.00 0.88 -0.14 -0.61 1.01 -0.74 -0.15 121.20 121.45 3dy3 s ILE 12 Ca 0.00 -0.61 -0.02 0.00 0.00 0.00 0.00 60.65 60.02 3dy3 s ILE 12 Cb 0.00 -0.76 -0.02 0.00 0.01 0.00 0.00 42.46 41.69 3dy3 s ILE 12 CO 0.00 0.15 -0.08 -0.63 0.00 0.00 0.00 174.94 174.37 3dy3 s ILE 13 N -0.45 3.48 -0.13 2.92 -1.09 -0.56 -0.17 121.20 125.20 3dy3 s ILE 13 Ca 0.03 -0.51 0.01 0.00 -2.23 0.00 0.00 60.65 57.95 3dy3 s ILE 13 Cb -0.05 -2.49 0.02 0.00 -1.58 0.00 0.00 42.46 38.36 3dy3 s ILE 13 CO 0.00 0.52 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.39 3dy3 s VAL 14 N 0.27 1.55 -0.04 2.92 1.01 -0.48 -1.96 120.40 123.68 3dy3 s VAL 14 Ca -0.06 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.29 3dy3 s VAL 14 Cb -0.15 -1.44 0.02 0.00 0.00 0.00 0.00 36.38 34.81 3dy3 s VAL 14 CO 0.04 0.45 -0.06 0.00 0.00 0.00 0.00 175.10 175.53 3dy3 s ALA 15 N 1.25 0.74 0.19 5.51 0.00 -0.95 -0.97 121.76 127.53 3dy3 s ALA 15 Ca -0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 51.96 51.80 3dy3 s ALA 15 Cb -0.14 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 3dy3 s ALA 15 CO -0.06 0.05 0.09 0.14 0.00 0.00 0.00 175.76 175.98 3dy3 s VAL 16 N 0.64 0.18 0.01 0.00 -7.23 -0.97 -0.90 120.40 112.13 3dy3 s VAL 16 Ca -0.09 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 3dy3 s VAL 16 Cb -0.12 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.46 3dy3 s VAL 16 CO 0.01 -0.18 0.01 -0.90 -0.31 0.00 0.00 175.10 173.73 3dy3 n ASP 17 N -0.25 0.11 -1.56 4.85 5.68 -0.76 -1.81 116.55 122.81 3dy3 n ASP 17 Ca -0.01 -1.03 0.01 0.00 -0.50 0.00 0.00 54.79 53.26 3dy3 n ASP 17 Cb 0.65 -0.01 0.01 0.00 -1.14 0.00 0.00 41.12 40.63 3dy3 n ASP 17 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3dy3 n SER 18 N -2.92 0.45 -4.90 -1.12 3.41 -0.94 -4.42 113.62 103.19 3dy3 n SER 18 Ca 0.00 -2.01 -0.34 0.00 -0.26 0.00 0.00 58.87 56.27 3dy3 n SER 18 Cb 0.01 -0.13 -0.05 0.00 -0.26 0.00 0.00 64.21 63.78 3dy3 n SER 18 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3dy3 s ARG 19 N -0.38 3.49 -0.09 4.33 3.52 -1.14 -2.33 118.95 126.35 3dy3 s ARG 19 Ca 0.24 -0.23 0.01 0.00 -0.13 0.00 0.00 55.73 55.61 3dy3 s ARG 19 Cb 0.29 -3.08 0.02 0.00 -1.56 0.00 0.00 34.95 30.62 3dy3 s ARG 19 CO -0.11 0.66 -0.10 0.00 -0.81 0.00 0.00 175.30 174.93 3dy3 s ALA 20 N -1.33 1.32 0.01 6.12 0.00 0.28 -4.68 121.76 123.48 3dy3 s ALA 20 Ca 0.28 -0.50 0.07 0.00 0.00 0.00 0.00 51.96 51.80 3dy3 s ALA 20 Cb -0.13 -0.76 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 3dy3 s ALA 20 CO 0.18 -0.16 -0.21 0.95 0.00 0.00 0.00 175.76 176.51 3dy3 s THR 21 N 1.20 1.68 -0.49 0.00 -4.23 -1.26 0.88 115.64 113.42 3dy3 s THR 21 Ca -0.04 -1.01 0.04 0.00 -1.18 0.00 0.00 61.69 59.49 3dy3 s THR 21 Cb -0.14 -1.42 0.13 0.00 1.34 0.00 0.00 72.50 72.40 3dy3 s THR 21 CO -0.03 0.38 0.23 0.00 -0.54 0.00 0.00 174.62 174.66 3dy3 s ALA 22 N -0.60 3.25 0.00 3.99 0.00 0.74 -4.89 121.76 124.24 3dy3 s ALA 22 Ca 0.08 -3.14 0.00 0.00 0.00 0.00 0.00 51.96 48.90 3dy3 s ALA 22 Cb -0.08 -2.15 0.00 0.00 0.00 0.00 0.00 23.12 20.88 3dy3 s ALA 22 CO 0.00 -1.96 0.00 0.41 0.00 0.00 0.00 175.76 174.21 3dy3 n GLY 23 N 3.34 1.59 0.00 0.00 0.00 -1.26 -2.13 105.19 106.73 3dy3 n GLY 23 Ca 0.05 -0.53 0.11 0.00 0.00 0.00 0.00 46.02 45.65 3dy3 n GLY 23 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dy3 n ASN 24 N 8.10 0.74 -4.68 1.61 3.02 -1.26 -4.90 115.26 117.90 3dy3 n ASN 24 Ca 0.00 -0.60 -0.43 0.00 -0.03 0.00 0.00 54.58 53.52 3dy3 n ASN 24 Cb 0.00 0.67 -0.02 0.00 -0.61 0.00 0.00 39.78 39.82 3dy3 n ASN 24 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3dy3 s TRP 25 N -3.02 3.08 -0.66 3.10 -0.11 -0.91 -4.97 118.94 115.45 3dy3 s TRP 25 Ca 0.09 1.16 -0.24 0.00 1.22 0.00 0.00 56.10 58.32 3dy3 s TRP 25 Cb 0.16 -3.44 0.05 0.00 -1.50 0.00 0.00 33.47 28.75 3dy3 s TRP 25 CO 0.79 -1.41 1.05 0.08 -4.62 0.00 0.00 176.95 172.84 3dy3 s VAL 26 N 2.70 4.17 0.18 5.86 1.01 -1.26 -0.19 120.40 132.88 3dy3 s VAL 26 Ca 0.55 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.52 3dy3 s VAL 26 Cb -0.23 -4.72 -0.11 0.00 0.00 0.00 0.00 36.38 31.31 3dy3 s VAL 26 CO 0.19 -1.50 1.44 0.00 0.00 0.00 0.00 175.10 175.22 3dy3 h ALA 27 N 9.64 0.62 -2.15 5.51 0.00 0.14 -3.47 119.26 129.55 3dy3 h ALA 27 Ca -0.28 -0.64 0.01 0.00 0.00 0.00 0.00 54.91 54.00 3dy3 h ALA 27 Cb 1.07 -0.07 -0.18 0.00 0.00 0.00 0.00 17.79 18.61 3dy3 h ALA 27 CO 1.19 0.81 0.34 0.45 0.00 0.00 0.00 179.25 182.04 3dy3 s SER 28 N -6.95 -0.52 -0.03 0.00 0.15 -0.88 -4.96 113.70 100.52 3dy3 s SER 28 Ca -0.04 0.36 0.04 0.00 0.70 0.00 0.00 55.95 57.01 3dy3 s SER 28 Cb 0.11 0.47 0.06 0.00 -1.71 0.00 0.00 66.02 64.94 3dy3 s SER 28 CO 0.83 -0.62 0.91 0.00 1.20 0.00 0.00 173.24 175.56 3dy3 n GLN 29 N 0.39 1.54 -2.56 5.44 1.13 -1.24 1.00 117.38 123.07 3dy3 n GLN 29 Ca -0.15 -1.43 -0.18 0.00 -1.94 0.00 0.00 57.00 53.30 3dy3 n GLN 29 Cb 0.60 -0.93 0.02 0.00 0.11 0.00 0.00 30.24 30.04 3dy3 n GLN 29 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3dy3 n THR 30 N -0.52 1.70 -3.86 5.09 -2.24 -1.02 -4.19 114.28 109.23 3dy3 n THR 30 Ca 0.03 -3.99 -0.37 0.00 -2.27 0.00 0.00 64.05 57.45 3dy3 n THR 30 Cb 0.45 -0.30 -0.06 0.00 -2.10 0.00 0.00 70.33 68.32 3dy3 n THR 30 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3dy3 s VAL 31 N -4.34 5.48 -0.64 2.28 1.01 -0.98 -5.04 120.40 118.16 3dy3 s VAL 31 Ca 0.38 0.20 -0.22 0.00 0.00 0.00 0.00 61.98 62.34 3dy3 s VAL 31 Cb 0.43 -3.40 0.08 0.00 0.00 0.00 0.00 36.38 33.48 3dy3 s VAL 31 CO -0.07 0.59 0.91 -0.54 0.00 0.00 0.00 175.10 175.99 3dy3 s LYS 32 N -0.81 3.11 0.00 2.72 3.01 -1.26 -4.53 119.74 121.97 3dy3 s LYS 32 Ca 0.14 -0.90 0.24 0.00 -1.01 0.00 0.00 55.97 54.43 3dy3 s LYS 32 Cb -0.12 -4.23 1.08 0.00 -1.01 0.00 0.00 37.83 33.56 3dy3 s LYS 32 CO 0.03 -1.74 1.74 1.63 0.51 0.00 0.00 175.35 177.51 3dy3 n LYS 33 N 7.42 1.45 -4.15 1.68 5.02 -1.26 -4.63 118.16 123.69 3dy3 n LYS 33 Ca -0.05 -0.66 -0.34 0.00 -2.02 0.00 0.00 58.31 55.24 3dy3 n LYS 33 Cb 0.45 -1.41 -0.14 0.00 -0.02 0.00 0.00 35.03 33.91 3dy3 n LYS 33 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3dy3 s VAL 34 N -1.92 3.39 -0.21 -0.18 1.01 -1.26 0.15 120.40 121.38 3dy3 s VAL 34 Ca 0.35 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.75 3dy3 s VAL 34 Cb 0.18 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 3dy3 s VAL 34 CO 0.29 0.45 0.07 -0.63 0.00 0.00 0.00 175.10 175.28 3dy3 s ILE 35 N 1.09 4.65 -1.19 2.22 1.01 0.50 -4.94 121.20 124.55 3dy3 s ILE 35 Ca 0.01 -0.07 -0.17 0.00 0.00 0.00 0.00 60.65 60.42 3dy3 s ILE 35 Cb -0.15 -3.13 0.12 0.00 0.01 0.00 0.00 42.46 39.32 3dy3 s ILE 35 CO -0.01 0.41 1.50 -1.61 0.00 0.00 0.00 174.94 175.24 3dy3 s GLU 36 N 0.83 3.95 0.23 2.79 2.02 -1.26 -0.71 118.70 126.55 3dy3 s GLU 36 Ca 0.04 -2.15 -0.11 0.00 0.02 0.00 0.00 54.97 52.77 3dy3 s GLU 36 Cb -0.14 -5.24 0.32 0.00 0.10 0.00 0.00 34.13 29.18 3dy3 s GLU 36 CO 0.02 -1.98 1.63 0.82 0.02 0.00 0.00 175.26 175.78 3dy3 h ILE 37 N 5.31 0.36 -2.34 -1.63 2.04 -1.76 -3.45 117.51 116.03 3dy3 h ILE 37 Ca 0.33 -0.02 0.20 0.00 1.00 0.00 0.00 64.86 66.37 3dy3 h ILE 37 Cb 0.90 0.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 3dy3 h ILE 37 CO 1.32 0.01 0.60 0.54 0.00 0.00 0.00 178.15 180.62 3dy3 s ASN 38 N -5.22 -0.05 0.34 1.72 2.20 -1.15 -4.47 114.94 108.31 3dy3 s ASN 38 Ca -0.14 -0.52 0.14 0.00 -0.94 0.00 0.00 52.86 51.40 3dy3 s ASN 38 Cb 0.21 0.44 0.76 0.00 -2.00 0.00 0.00 41.25 40.66 3dy3 s ASN 38 CO 0.74 -0.85 1.34 -0.65 -2.94 0.00 0.00 177.10 174.74 3dy3 h PRO 39 N 2.00 0.00 0.00 3.55 0.11 -1.99 -2.18 132.00 133.49 3dy3 h PRO 39 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3dy3 h PRO 39 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3dy3 h PRO 39 CO 0.32 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.30 3dy3 n PHE 40 N -2.09 0.00 -4.49 0.65 3.72 -1.26 -2.26 117.46 111.73 3dy3 n PHE 40 Ca -0.01 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.19 3dy3 n PHE 40 Cb 0.31 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.70 3dy3 n PHE 40 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3dy3 s LEU 41 N -0.34 1.96 0.10 4.37 1.43 -0.82 -4.17 118.68 121.21 3dy3 s LEU 41 Ca 0.00 -0.21 0.08 0.00 -1.03 0.00 0.00 54.13 52.97 3dy3 s LEU 41 Cb 0.00 -0.59 -0.03 0.00 0.03 0.00 0.00 46.19 45.59 3dy3 s LEU 41 CO 0.00 0.12 -0.20 -0.76 0.23 0.00 0.00 176.35 175.74 3dy3 s LEU 42 N -0.14 2.29 -0.00 1.79 1.43 -0.16 -2.32 118.68 121.58 3dy3 s LEU 42 Ca 0.02 -0.67 0.03 0.00 -1.03 0.00 0.00 54.13 52.48 3dy3 s LEU 42 Cb -0.06 -0.87 -0.01 0.00 0.03 0.00 0.00 46.19 45.29 3dy3 s LEU 42 CO -0.00 0.06 -0.08 -0.83 0.23 0.00 0.00 176.35 175.72 3dy3 s GLY 43 N -1.85 0.41 0.03 -3.19 0.00 0.11 -0.40 107.32 102.44 3dy3 s GLY 43 Ca 0.06 -0.39 -0.01 0.00 0.00 0.00 0.00 44.72 44.39 3dy3 s GLY 43 CO 0.04 -0.34 0.18 -0.51 0.00 0.00 0.00 173.10 172.48 3dy3 s THR 44 N -0.28 5.30 -0.27 0.90 -4.23 -1.09 0.19 115.64 116.15 3dy3 s THR 44 Ca 0.02 -0.34 -0.08 0.00 -1.18 0.00 0.00 61.69 60.11 3dy3 s THR 44 Cb -0.04 -3.54 -0.02 0.00 1.34 0.00 0.00 72.50 70.25 3dy3 s THR 44 CO -0.00 0.22 0.10 -0.32 -0.54 0.00 0.00 174.62 174.07 3dy3 s MET 45 N -2.25 3.54 -0.09 3.99 0.00 0.40 -4.27 119.30 120.62 3dy3 s MET 45 Ca 0.31 -0.56 -0.07 0.00 0.00 0.00 0.00 55.69 55.37 3dy3 s MET 45 Cb -0.13 -3.40 0.03 0.00 0.00 0.00 0.00 34.83 31.33 3dy3 s MET 45 CO 0.23 -0.26 0.22 0.00 0.00 0.00 0.00 175.02 175.21 3dy3 s ALA 46 N 1.61 -0.54 0.00 4.11 0.00 -1.18 -4.90 121.76 120.86 3dy3 s ALA 46 Ca 0.06 0.69 0.00 0.00 0.00 0.00 0.00 51.96 52.71 3dy3 s ALA 46 Cb -0.16 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.55 3dy3 s ALA 46 CO 0.04 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.09 3dy3 n GLY 47 N 3.24 0.85 3.63 0.00 0.00 -1.26 -1.16 105.19 110.50 3dy3 n GLY 47 Ca -0.15 -1.21 -0.39 0.00 0.00 0.00 0.00 46.02 44.26 3dy3 n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dy3 s GLY 48 N 0.00 1.93 0.10 -0.02 0.00 0.25 -4.96 107.32 104.62 3dy3 s GLY 48 Ca 0.00 -0.58 -0.33 0.00 0.00 0.00 0.00 44.72 43.81 3dy3 s GLY 48 CO 0.00 1.11 1.58 0.00 0.00 0.00 0.00 173.10 175.79 3dy3 h ALA 49 N 7.82 -0.91 -0.53 3.20 0.00 -1.90 -1.71 119.26 125.23 3dy3 h ALA 49 Ca -0.31 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.58 3dy3 h ALA 49 Cb 1.15 0.74 -0.08 0.00 0.00 0.00 0.00 17.79 19.60 3dy3 h ALA 49 CO 0.71 -1.07 0.07 0.00 0.00 0.00 0.00 179.25 178.96 3dy3 h ALA 50 N -0.45 0.57 -0.29 0.00 0.00 -1.95 0.79 119.26 117.93 3dy3 h ALA 50 Ca -0.01 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.08 3dy3 h ALA 50 Cb 0.75 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 3dy3 h ALA 50 CO -0.19 -0.34 -0.04 -0.44 0.00 0.00 0.00 179.25 178.25 3dy3 h ASP 51 N 0.20 -0.20 0.26 0.00 3.45 -1.77 0.18 116.42 118.55 3dy3 h ASP 51 Ca 0.27 0.08 -0.01 0.00 0.43 0.00 0.00 57.03 57.79 3dy3 h ASP 51 Cb 0.39 0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.32 3dy3 h ASP 51 CO -0.38 -0.06 -0.13 0.00 -1.57 0.00 0.00 179.24 177.09 3dy3 h GLN 53 N -0.74 0.17 0.58 0.00 4.15 -0.75 -0.96 115.11 117.56 3dy3 h GLN 53 Ca -0.04 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.34 3dy3 h GLN 53 Cb 0.49 -0.04 0.01 0.00 0.21 0.00 0.00 27.48 28.15 3dy3 h GLN 53 CO 0.06 0.12 -0.28 0.35 -1.93 0.00 0.00 178.83 177.15 3dy3 h PHE 54 N 0.18 -0.72 0.00 3.99 3.57 -0.71 -2.64 116.94 120.61 3dy3 h PHE 54 Ca 0.26 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.72 3dy3 h PHE 54 Cb 0.38 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 3dy3 h PHE 54 CO -0.27 -0.45 -0.12 -1.49 -2.23 0.00 0.00 178.31 173.75 3dy3 h TRP 55 N -1.04 0.00 0.00 0.41 4.06 -1.48 -0.06 115.95 117.83 3dy3 h TRP 55 Ca -0.08 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 60.73 3dy3 h TRP 55 Cb 0.59 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.73 3dy3 h TRP 55 CO 0.03 0.12 -0.86 0.93 -3.56 0.00 0.00 178.44 175.10 3dy3 h GLU 56 N 0.00 0.00 -0.24 0.49 5.08 -1.26 0.63 114.58 119.29 3dy3 h GLU 56 Ca -0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 3dy3 h GLU 56 Cb 0.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 3dy3 h GLU 56 CO 0.02 0.52 -0.37 1.15 -1.00 0.00 0.00 179.01 179.33 3dy3 h THR 57 N 0.00 1.31 -0.74 1.13 2.02 -1.01 -1.85 112.91 113.77 3dy3 h THR 57 Ca -0.06 -1.57 0.04 0.00 0.77 0.00 0.00 66.41 65.60 3dy3 h THR 57 Cb 1.52 1.73 -0.05 0.00 -1.74 0.00 0.00 68.15 69.61 3dy3 h THR 57 CO 0.07 0.49 0.46 -0.25 0.37 0.00 0.00 175.52 176.67 3dy3 h TRP 58 N 0.39 0.86 -0.97 3.16 7.01 -0.94 -0.76 115.95 124.69 3dy3 h TRP 58 Ca 0.02 0.02 0.09 0.00 2.11 0.00 0.00 58.89 61.13 3dy3 h TRP 58 Cb 0.96 -0.28 -0.07 0.00 -2.10 0.00 0.00 29.16 27.66 3dy3 h TRP 58 CO 0.08 0.47 0.62 1.25 -2.79 0.00 0.00 178.44 178.07 3dy3 h LEU 59 N 0.88 0.95 -0.73 0.65 5.85 -0.50 0.17 115.31 122.58 3dy3 h LEU 59 Ca 0.31 0.03 0.07 0.00 0.84 0.00 0.00 57.88 59.13 3dy3 h LEU 59 Cb 0.06 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 3dy3 h LEU 59 CO -0.13 0.57 0.41 1.23 -0.34 0.00 0.00 178.44 180.18 3dy3 h GLY 60 N 1.06 1.10 1.00 3.75 0.00 -0.31 0.41 103.07 110.07 3dy3 h GLY 60 Ca 0.45 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3dy3 h GLY 60 CO -0.21 0.15 0.04 1.76 0.00 0.00 0.00 176.54 178.28 3dy3 h SER 61 N 0.74 0.07 -0.69 0.19 0.02 -0.60 -1.69 113.55 111.59 3dy3 h SER 61 Ca 0.34 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.31 3dy3 h SER 61 Cb 0.24 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 62.72 3dy3 h SER 61 CO -0.21 0.05 0.43 1.56 -1.14 0.00 0.00 176.83 177.53 3dy3 h GLN 62 N 0.08 0.82 -0.23 3.45 1.08 -0.32 -1.46 115.11 118.52 3dy3 h GLN 62 Ca 0.02 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.17 3dy3 h GLN 62 Cb -0.01 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.23 3dy3 h GLN 62 CO -0.00 0.54 0.13 0.00 -0.95 0.00 0.00 178.83 178.54 3dy3 h ARG 64 N 0.27 0.97 -0.26 0.00 9.65 -0.94 -1.02 114.38 123.04 3dy3 h ARG 64 Ca 0.08 -0.06 -0.17 0.00 -1.10 0.00 0.00 59.98 58.74 3dy3 h ARG 64 Cb 0.06 -0.22 -0.00 0.00 -1.39 0.00 0.00 29.97 28.42 3dy3 h ARG 64 CO -0.01 0.64 -0.51 1.25 2.80 0.00 0.00 179.97 184.13 3dy3 h LEU 65 N 1.00 0.82 -0.69 3.80 5.85 -0.96 -1.88 115.31 123.25 3dy3 h LEU 65 Ca 0.31 -0.42 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 3dy3 h LEU 65 Cb -0.01 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.76 3dy3 h LEU 65 CO -0.08 1.18 0.26 -0.74 -0.34 0.00 0.00 178.44 178.72 3dy3 h HIS 66 N 0.58 1.07 -0.16 1.25 2.76 -0.41 -2.00 115.15 118.25 3dy3 h HIS 66 Ca 0.02 -0.09 -0.13 0.00 -2.20 0.00 0.00 60.37 57.97 3dy3 h HIS 66 Cb 1.09 -0.32 -0.01 0.00 1.55 0.00 0.00 27.41 29.72 3dy3 h HIS 66 CO 0.06 0.84 -0.47 0.93 -1.30 0.00 0.00 177.93 177.99 3dy3 h GLU 67 N 1.00 0.41 -0.21 5.26 5.08 -1.09 -0.07 114.58 124.96 3dy3 h GLU 67 Ca 0.23 -0.23 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 3dy3 h GLU 67 Cb 0.24 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 3dy3 h GLU 67 CO -0.02 0.80 -0.46 -0.07 -1.00 0.00 0.00 179.01 178.26 3dy3 h LEU 68 N 0.33 0.56 -0.05 1.33 3.38 -1.17 -0.19 115.31 119.50 3dy3 h LEU 68 Ca 0.02 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 3dy3 h LEU 68 Cb 0.96 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3dy3 h LEU 68 CO 0.08 0.94 -0.11 -0.09 0.09 0.00 0.00 178.44 179.35 3dy3 h ARG 69 N 0.42 0.17 -0.51 1.13 2.43 -1.15 -3.32 114.38 113.55 3dy3 h ARG 69 Ca 0.03 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 3dy3 h ARG 69 Cb 0.97 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 3dy3 h ARG 69 CO 0.09 0.70 0.00 0.39 -1.51 0.00 0.00 179.97 179.64 3dy3 n GLU 70 N -4.65 2.50 -4.32 0.20 -0.58 -0.06 -4.96 120.64 108.77 3dy3 n GLU 70 Ca -0.08 -2.30 -0.35 0.00 -0.42 0.00 0.00 57.16 54.01 3dy3 n GLU 70 Cb 0.36 -1.52 -0.07 0.00 -0.57 0.00 0.00 31.44 29.64 3dy3 n GLU 70 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3dy3 n LYS 71 N 1.44 -1.54 -3.58 3.49 5.02 -0.09 -4.91 118.16 117.99 3dy3 n LYS 71 Ca 0.21 0.19 -0.16 0.00 -2.02 0.00 0.00 58.31 56.53 3dy3 n LYS 71 Cb 0.58 -4.29 -0.07 0.00 -0.02 0.00 0.00 35.03 31.24 3dy3 n LYS 71 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3dy3 s GLU 72 N -7.16 0.93 0.17 1.97 2.12 -1.20 -5.07 118.70 110.46 3dy3 s GLU 72 Ca 0.37 0.67 -0.32 0.00 0.36 0.00 0.00 54.97 56.05 3dy3 s GLU 72 Cb -0.21 0.45 -0.11 0.00 0.26 0.00 0.00 34.13 34.52 3dy3 s GLU 72 CO 0.98 -0.20 1.62 0.50 -0.54 0.00 0.00 175.26 177.63 3dy3 s ARG 73 N -0.32 4.18 0.43 4.30 3.52 -1.26 -4.33 118.95 125.48 3dy3 s ARG 73 Ca -0.05 2.44 -0.24 0.00 -0.13 0.00 0.00 55.73 57.75 3dy3 s ARG 73 Cb -0.03 -3.15 -0.08 0.00 -1.56 0.00 0.00 34.95 30.13 3dy3 s ARG 73 CO 0.05 -0.66 1.21 -1.50 -0.81 0.00 0.00 175.30 173.59 3dy3 s ILE 74 N 1.24 2.95 0.46 4.11 2.07 -1.26 -5.02 121.20 125.75 3dy3 s ILE 74 Ca 0.72 0.78 -0.19 0.00 -1.41 0.00 0.00 60.65 60.55 3dy3 s ILE 74 Cb -0.46 -3.43 -0.10 0.00 0.13 0.00 0.00 42.46 38.61 3dy3 s ILE 74 CO 0.32 0.05 0.95 -0.94 -1.91 0.00 0.00 174.94 173.41 3dy3 s SER 75 N -1.11 6.80 0.36 4.50 1.04 -1.26 -4.92 113.70 119.11 3dy3 s SER 75 Ca 0.60 1.61 0.06 0.00 0.48 0.00 0.00 55.95 58.70 3dy3 s SER 75 Cb -0.32 -2.52 0.69 0.00 0.10 0.00 0.00 66.02 63.97 3dy3 s SER 75 CO 0.40 -0.45 1.91 0.58 0.98 0.00 0.00 173.24 176.66 3dy3 h VAL 76 N 1.49 1.18 -0.25 5.02 2.07 -1.95 -0.59 116.25 123.22 3dy3 h VAL 76 Ca -0.48 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.33 3dy3 h VAL 76 Cb 1.18 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 3dy3 h VAL 76 CO 0.61 0.24 0.13 0.00 0.02 0.00 0.00 177.57 178.58 3dy3 h ALA 77 N 1.57 0.32 -0.33 1.67 0.00 -1.97 -2.01 119.26 118.51 3dy3 h ALA 77 Ca 0.10 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 3dy3 h ALA 77 Cb 0.29 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3dy3 h ALA 77 CO 0.01 -0.14 -0.45 0.00 0.00 0.00 0.00 179.25 178.67 3dy3 h ALA 78 N 1.01 0.57 -0.82 0.00 0.00 -1.84 -2.04 119.26 116.15 3dy3 h ALA 78 Ca 0.09 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 3dy3 h ALA 78 Cb 0.08 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3dy3 h ALA 78 CO -0.01 0.68 0.38 0.00 0.00 0.00 0.00 179.25 180.30 3dy3 h ALA 79 N 0.79 1.05 -0.30 0.00 0.00 -1.05 -1.85 119.26 117.90 3dy3 h ALA 79 Ca 0.04 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 3dy3 h ALA 79 Cb 1.04 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3dy3 h ALA 79 CO 0.10 0.63 -0.25 0.66 0.00 0.00 0.00 179.25 180.39 3dy3 h SER 80 N 1.16 0.75 0.26 0.00 4.64 -1.34 -3.00 113.55 116.03 3dy3 h SER 80 Ca 0.28 -0.45 -0.05 0.00 -0.47 0.00 0.00 61.79 61.10 3dy3 h SER 80 Cb 0.13 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 3dy3 h SER 80 CO -0.03 1.04 -0.23 0.50 -0.87 0.00 0.00 176.83 177.24 3dy3 h LYS 81 N 0.46 0.00 -0.40 4.77 3.64 -1.12 0.18 116.57 124.10 3dy3 h LYS 81 Ca 0.05 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.39 3dy3 h LYS 81 Cb 0.81 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 3dy3 h LYS 81 CO 0.07 0.23 0.10 0.82 -2.27 0.00 0.00 179.45 178.39 3dy3 h ILE 82 N 0.00 1.23 -0.40 2.00 2.04 -1.24 0.23 117.51 121.37 3dy3 h ILE 82 Ca -0.00 -0.79 -0.11 0.00 1.00 0.00 0.00 64.86 64.96 3dy3 h ILE 82 Cb 0.42 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 3dy3 h ILE 82 CO 0.03 0.27 -0.18 0.25 0.00 0.00 0.00 178.15 178.52 3dy3 h LEU 83 N 0.51 0.84 -0.12 1.44 5.85 -1.25 -2.16 115.31 120.41 3dy3 h LEU 83 Ca 0.13 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.45 3dy3 h LEU 83 Cb 0.31 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3dy3 h LEU 83 CO 0.00 1.06 0.08 -1.28 -0.34 0.00 0.00 178.44 177.96 3dy3 h SER 84 N 0.63 0.14 -0.08 1.25 0.87 -0.42 -1.24 113.55 114.71 3dy3 h SER 84 Ca 0.09 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.55 3dy3 h SER 84 Cb 0.73 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.64 3dy3 h SER 84 CO 0.06 0.10 -0.23 0.78 -0.53 0.00 0.00 176.83 177.01 3dy3 h ASN 85 N 0.17 0.50 0.58 6.23 -0.26 -0.53 -0.98 115.58 121.29 3dy3 h ASN 85 Ca 0.05 -0.16 -0.03 0.00 -0.56 0.00 0.00 56.30 55.59 3dy3 h ASN 85 Cb -0.02 -0.14 0.01 0.00 -1.06 0.00 0.00 38.32 37.11 3dy3 h ASN 85 CO -0.01 0.73 -0.28 0.25 -1.06 0.00 0.00 177.43 177.06 3dy3 h LEU 86 N 0.44 -0.66 -1.31 1.61 7.12 -1.21 -2.39 115.31 118.92 3dy3 h LEU 86 Ca 0.07 -0.04 0.18 0.00 0.13 0.00 0.00 57.88 58.22 3dy3 h LEU 86 Cb 0.65 0.17 -0.08 0.00 -0.53 0.00 0.00 40.66 40.87 3dy3 h LEU 86 CO 0.05 -0.33 0.59 0.58 -0.13 0.00 0.00 178.44 179.20 3dy3 h VAL 87 N -1.00 0.75 0.00 1.05 2.07 -1.17 0.12 116.25 118.07 3dy3 h VAL 87 Ca -0.08 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 3dy3 h VAL 87 Cb 0.66 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 3dy3 h VAL 87 CO 0.13 0.11 -0.28 0.22 0.02 0.00 0.00 177.57 177.77 3dy3 h TYR 88 N 0.60 0.00 0.00 1.57 5.03 -0.97 -1.65 116.97 121.55 3dy3 h TYR 88 Ca 0.49 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.77 3dy3 h TYR 88 Cb 0.93 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 39.21 3dy3 h TYR 88 CO -0.00 0.28 -0.14 1.96 -1.32 0.00 0.00 178.16 178.93 3dy3 h GLN 89 N 0.00 0.00 -0.37 1.82 1.08 -0.24 -2.31 115.11 115.10 3dy3 h GLN 89 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3dy3 h GLN 89 Cb 0.65 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.08 3dy3 h GLN 89 CO 0.04 0.14 0.00 0.66 -0.95 0.00 0.00 178.83 178.72 3dy3 n TYR 90 N -3.59 0.47 -1.67 2.96 4.01 -0.64 -4.99 117.16 113.72 3dy3 n TYR 90 Ca -0.01 -0.24 -0.53 0.00 -0.16 0.00 0.00 57.90 56.96 3dy3 n TYR 90 Cb 0.28 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.25 3dy3 n TYR 90 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 3dy3 n LYS 91 N 1.51 1.47 0.00 -0.72 4.81 -0.87 -0.23 118.16 124.13 3dy3 n LYS 91 Ca 0.19 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 58.17 3dy3 n LYS 91 Cb 0.61 -2.25 0.00 0.00 0.02 0.00 0.00 35.03 33.41 3dy3 n LYS 91 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dy3 n GLY 92 N 3.71 2.70 0.28 3.14 0.00 -1.26 -4.92 105.19 108.83 3dy3 n GLY 92 Ca 0.22 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.42 3dy3 n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dy3 h ALA 93 N 0.00 1.00 0.00 4.61 0.00 -1.00 -3.47 119.26 120.41 3dy3 h ALA 93 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dy3 h ALA 93 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dy3 h ALA 93 CO 0.00 0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3dy3 n GLY 94 N -0.10 1.13 3.73 0.00 0.00 -1.26 -5.10 105.19 103.59 3dy3 n GLY 94 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 3dy3 n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dy3 s LEU 95 N 0.00 3.55 -0.25 0.99 1.43 -1.26 -5.00 118.68 118.14 3dy3 s LEU 95 Ca 0.00 2.58 -0.03 0.00 -1.03 0.00 0.00 54.13 55.65 3dy3 s LEU 95 Cb 0.00 -4.61 0.08 0.00 0.03 0.00 0.00 46.19 41.69 3dy3 s LEU 95 CO 0.00 -2.01 0.09 -0.55 0.23 0.00 0.00 176.35 174.11 3dy3 s SER 96 N -1.48 3.33 -0.25 2.29 0.15 -1.26 -4.86 113.70 111.62 3dy3 s SER 96 Ca 0.81 -1.16 -0.17 0.00 0.70 0.00 0.00 55.95 56.13 3dy3 s SER 96 Cb -0.36 -0.54 0.07 0.00 -1.71 0.00 0.00 66.02 63.48 3dy3 s SER 96 CO 0.40 -0.38 0.63 0.00 1.20 0.00 0.00 173.24 175.08 3dy3 s MET 97 N 1.91 0.67 -0.23 5.44 0.23 -1.26 0.88 119.30 126.95 3dy3 s MET 97 Ca 0.06 1.04 0.01 0.00 -1.03 0.00 0.00 55.69 55.76 3dy3 s MET 97 Cb -0.17 0.19 0.06 0.00 -1.53 0.00 0.00 34.83 33.38 3dy3 s MET 97 CO -0.22 -0.13 -0.06 0.20 -2.03 0.00 0.00 175.02 172.78 3dy3 s GLY 98 N 1.14 1.30 0.03 3.16 0.00 -0.31 -0.44 107.32 112.20 3dy3 s GLY 98 Ca -0.06 -1.34 -0.00 0.00 0.00 0.00 0.00 44.72 43.31 3dy3 s GLY 98 CO -0.11 0.88 -0.03 -1.08 0.00 0.00 0.00 173.10 172.75 3dy3 s THR 99 N 1.39 0.19 -0.22 0.90 -1.32 0.94 -3.12 115.64 114.39 3dy3 s THR 99 Ca -0.05 -1.24 -0.05 0.00 -1.21 0.00 0.00 61.69 59.14 3dy3 s THR 99 Cb -0.18 -0.73 -0.01 0.00 -1.51 0.00 0.00 72.50 70.07 3dy3 s THR 99 CO -0.06 -0.66 -0.02 -0.04 -2.21 0.00 0.00 174.62 171.63 3dy3 s MET 100 N -2.32 3.45 -0.31 7.08 -1.94 -1.26 0.71 119.30 124.71 3dy3 s MET 100 Ca -0.07 -0.59 -0.14 0.00 -1.71 0.00 0.00 55.69 53.18 3dy3 s MET 100 Cb -0.04 -3.07 -0.03 0.00 2.01 0.00 0.00 34.83 33.70 3dy3 s MET 100 CO -0.04 -0.17 0.31 0.42 -0.01 0.00 0.00 175.02 175.53 3dy3 s ILE 101 N 1.45 5.22 -0.09 2.53 -1.09 0.12 -2.69 121.20 126.65 3dy3 s ILE 101 Ca 0.05 0.15 0.03 0.00 -2.23 0.00 0.00 60.65 58.65 3dy3 s ILE 101 Cb -0.14 -3.72 -0.01 0.00 -1.58 0.00 0.00 42.46 37.01 3dy3 s ILE 101 CO -0.01 0.05 -0.19 0.00 -1.23 0.00 0.00 174.94 173.55 3dy3 s GLY 103 N 0.04 0.25 -0.32 0.00 0.00 -0.61 -0.99 107.32 105.70 3dy3 s GLY 103 Ca -0.08 -0.61 -0.01 0.00 0.00 0.00 0.00 44.72 44.03 3dy3 s GLY 103 CO 0.05 -0.42 0.23 -0.47 0.00 0.00 0.00 173.10 172.50 3dy3 s TYR 104 N -3.97 0.18 0.15 1.90 6.14 -1.26 -0.42 117.35 120.07 3dy3 s TYR 104 Ca 0.17 -0.96 0.06 0.00 0.64 0.00 0.00 57.07 56.98 3dy3 s TYR 104 Cb -0.02 -0.73 -0.04 0.00 0.42 0.00 0.00 41.96 41.59 3dy3 s TYR 104 CO 0.06 -0.87 0.05 0.95 0.64 0.00 0.00 175.55 176.39 3dy3 s THR 105 N 1.72 4.11 0.20 4.34 -4.23 -1.13 -4.20 115.64 116.44 3dy3 s THR 105 Ca 0.13 -1.17 -0.11 0.00 -1.18 0.00 0.00 61.69 59.36 3dy3 s THR 105 Cb -0.18 -3.05 0.16 0.00 1.34 0.00 0.00 72.50 70.77 3dy3 s THR 105 CO -0.19 -0.05 1.69 -0.09 -0.54 0.00 0.00 174.62 175.45 3dy3 h ARG 10 N 2.78 0.19 -0.59 3.99 9.65 -1.90 1.76 114.38 130.26 3dy3 h ARG 10 Ca -0.47 -0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 58.32 3dy3 h ARG 10 Cb 1.19 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.71 3dy3 h ARG 10 CO 0.61 0.13 0.06 0.87 2.80 0.00 0.00 179.97 184.43 3dy3 h LYS 10 N 0.20 1.00 0.00 0.20 6.56 -2.01 -3.36 116.57 119.17 3dy3 h LYS 10 Ca 0.30 -0.29 -0.33 0.00 -1.06 0.00 0.00 60.65 59.27 3dy3 h LYS 10 Cb 0.45 -0.11 -0.06 0.00 -0.57 0.00 0.00 32.23 31.94 3dy3 h LYS 10 CO -0.42 0.96 -2.25 0.39 -2.06 0.00 0.00 179.45 176.07 3dy3 n GLU 106 N -4.27 0.99 0.00 3.15 1.02 -0.78 -5.12 120.64 115.63 3dy3 n GLU 106 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 3dy3 n GLU 106 Cb 0.30 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 3dy3 n GLU 106 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dy3 n GLY 107 N 1.93 -1.63 3.69 0.62 0.00 0.59 -4.76 105.19 105.62 3dy3 n GLY 107 Ca -0.31 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 3dy3 n GLY 107 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3dy3 s PRO 108 N 0.00 4.24 -0.01 1.61 0.02 -1.26 -2.84 135.00 136.76 3dy3 s PRO 108 Ca 0.00 2.13 0.01 0.00 0.02 0.00 0.00 61.00 63.16 3dy3 s PRO 108 Cb 0.00 -3.62 0.00 0.00 0.02 0.00 0.00 34.50 30.90 3dy3 s PRO 108 CO 0.00 -0.67 -0.03 0.99 -0.33 0.00 0.00 177.00 176.96 3dy3 s THR 109 N 2.66 0.26 -0.05 0.99 2.01 0.44 -5.00 115.64 116.95 3dy3 s THR 109 Ca 0.69 -0.10 0.02 0.00 0.31 0.00 0.00 61.69 62.61 3dy3 s THR 109 Cb -0.35 -0.25 0.01 0.00 0.01 0.00 0.00 72.50 71.93 3dy3 s THR 109 CO 0.29 0.09 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.59 3dy3 s ILE 110 N 0.15 0.87 -0.12 1.82 1.01 -1.26 -1.57 121.20 122.10 3dy3 s ILE 110 Ca -0.01 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.31 3dy3 s ILE 110 Cb -0.04 -0.81 0.01 0.00 0.01 0.00 0.00 42.46 41.63 3dy3 s ILE 110 CO -0.00 0.29 -0.19 -0.31 0.00 0.00 0.00 174.94 174.73 3dy3 s TYR 111 N 0.57 2.32 -0.17 3.97 2.02 -0.27 -2.21 117.35 123.59 3dy3 s TYR 111 Ca -0.10 -1.13 -0.20 0.00 -0.37 0.00 0.00 57.07 55.27 3dy3 s TYR 111 Cb -0.13 -1.62 -0.03 0.00 -0.40 0.00 0.00 41.96 39.78 3dy3 s TYR 111 CO 0.02 -0.54 0.60 -0.47 -1.57 0.00 0.00 175.55 173.60 3dy3 s TYR 112 N 0.87 3.43 -0.07 2.71 5.04 0.18 0.12 117.35 129.61 3dy3 s TYR 112 Ca -0.08 0.95 0.00 0.00 -2.44 0.00 0.00 57.07 55.51 3dy3 s TYR 112 Cb -0.15 -2.75 0.02 0.00 0.35 0.00 0.00 41.96 39.43 3dy3 s TYR 112 CO -0.01 -0.07 -0.06 0.08 -1.34 0.00 0.00 175.55 174.14 3dy3 s VAL 113 N 1.51 0.79 0.31 3.14 1.01 0.22 -0.50 120.40 126.88 3dy3 s VAL 113 Ca 0.29 -0.21 0.07 0.00 0.00 0.00 0.00 61.98 62.13 3dy3 s VAL 113 Cb -0.16 -0.81 -0.06 0.00 0.00 0.00 0.00 36.38 35.35 3dy3 s VAL 113 CO 0.11 0.30 -0.05 1.51 0.00 0.00 0.00 175.10 176.98 3dy3 s ASP 114 N 1.29 3.03 0.00 3.32 1.47 -0.92 -0.04 116.67 124.82 3dy3 s ASP 114 Ca -0.04 -1.23 0.05 0.00 1.18 0.00 0.00 52.55 52.51 3dy3 s ASP 114 Cb -0.14 -0.22 0.29 0.00 -0.34 0.00 0.00 42.92 42.52 3dy3 s ASP 114 CO -0.03 -0.35 0.67 -1.54 0.68 0.00 0.00 175.17 174.60 3dy3 n SER 115 N -0.67 0.00 0.10 2.11 3.41 0.41 -1.73 113.62 117.25 3dy3 n SER 115 Ca -0.05 -0.43 0.03 0.00 -0.26 0.00 0.00 58.87 58.16 3dy3 n SER 115 Cb 0.64 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.58 3dy3 n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3dy3 h ASP 116 N 0.00 0.00 0.00 4.04 3.45 -1.92 -3.44 116.42 118.55 3dy3 h ASP 116 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3dy3 h ASP 116 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3dy3 h ASP 116 CO 0.00 0.44 0.00 0.61 -1.57 0.00 0.00 179.24 178.72 3dy3 n GLY 117 N 1.28 1.02 3.74 2.75 0.00 -0.70 -4.96 105.19 108.31 3dy3 n GLY 117 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 3dy3 n GLY 117 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dy3 s THR 118 N -2.00 3.69 -0.15 2.61 2.01 -1.23 -4.94 115.64 115.62 3dy3 s THR 118 Ca 0.00 1.46 -0.04 0.00 0.31 0.00 0.00 61.69 63.42 3dy3 s THR 118 Cb 0.00 -3.93 0.07 0.00 0.01 0.00 0.00 72.50 68.65 3dy3 s THR 118 CO 0.00 0.25 0.15 -0.60 -0.69 0.00 0.00 174.62 173.73 3dy3 s ARG 119 N -0.41 0.09 -0.04 4.92 3.52 -1.25 -2.15 118.95 123.62 3dy3 s ARG 119 Ca 0.51 0.17 0.03 0.00 -0.13 0.00 0.00 55.73 56.31 3dy3 s ARG 119 Cb -0.31 -1.22 0.00 0.00 -1.56 0.00 0.00 34.95 31.86 3dy3 s ARG 119 CO 0.36 -0.57 -0.12 -0.51 -0.81 0.00 0.00 175.30 173.65 3dy3 s LEU 120 N 2.23 1.79 0.08 -0.88 1.43 0.34 -4.94 118.68 118.74 3dy3 s LEU 120 Ca 0.04 -0.26 -0.15 0.00 -1.03 0.00 0.00 54.13 52.73 3dy3 s LEU 120 Cb -0.15 -0.73 -0.06 0.00 0.03 0.00 0.00 46.19 45.28 3dy3 s LEU 120 CO -0.09 0.09 0.50 -0.75 0.23 0.00 0.00 176.35 176.33 3dy3 s LYS 121 N 0.23 4.01 0.24 1.70 2.20 -1.26 0.48 119.74 127.33 3dy3 s LYS 121 Ca -0.05 0.52 -0.21 0.00 -0.36 0.00 0.00 55.97 55.86 3dy3 s LYS 121 Cb -0.11 -3.11 0.06 0.00 -1.51 0.00 0.00 37.83 33.16 3dy3 s LYS 121 CO 0.01 0.59 0.90 0.20 -0.36 0.00 0.00 175.35 176.70 3dy3 s GLY 122 N -1.37 0.02 -0.18 5.54 0.00 -0.94 -4.96 107.32 105.43 3dy3 s GLY 122 Ca 0.31 -0.27 0.11 0.00 0.00 0.00 0.00 44.72 44.87 3dy3 s GLY 122 CO 0.17 0.55 0.14 1.22 0.00 0.00 0.00 173.10 175.19 3dy3 n ASP 123 N -0.88 0.82 -3.95 1.64 10.43 -1.26 -4.15 116.55 119.20 3dy3 n ASP 123 Ca -0.05 0.07 -0.18 0.00 2.57 0.00 0.00 54.79 57.19 3dy3 n ASP 123 Cb 0.60 0.30 -0.15 0.00 1.84 0.00 0.00 41.12 43.70 3dy3 n ASP 123 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3dy3 s ILE 124 N -2.52 0.56 -0.11 0.53 1.01 -1.26 0.37 121.20 119.77 3dy3 s ILE 124 Ca -0.16 -0.23 -0.06 0.00 0.00 0.00 0.00 60.65 60.20 3dy3 s ILE 124 Cb 0.07 -0.51 0.04 0.00 0.01 0.00 0.00 42.46 42.07 3dy3 s ILE 124 CO 0.77 0.19 0.25 -0.36 0.00 0.00 0.00 174.94 175.79 3dy3 s PHE 125 N 0.29 -0.33 -0.10 3.97 0.40 -0.47 -5.01 117.98 116.73 3dy3 s PHE 125 Ca -0.04 0.79 0.02 0.00 -0.60 0.00 0.00 56.93 57.11 3dy3 s PHE 125 Cb -0.08 0.06 0.01 0.00 0.51 0.00 0.00 43.02 43.53 3dy3 s PHE 125 CO 0.00 -0.23 -0.15 0.00 0.70 0.00 0.00 175.22 175.54 3dy3 s VAL 127 N 0.84 0.64 0.00 0.00 1.01 0.11 -4.86 120.40 118.14 3dy3 s VAL 127 Ca -0.10 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.63 3dy3 s VAL 127 Cb -0.15 -0.59 0.00 0.00 0.00 0.00 0.00 36.38 35.63 3dy3 s VAL 127 CO 0.01 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.94 3dy3 n GLY 128 N 3.49 2.26 0.23 4.51 0.00 -1.26 -1.22 105.19 113.20 3dy3 n GLY 128 Ca -0.20 -1.92 0.16 0.00 0.00 0.00 0.00 46.02 44.07 3dy3 n GLY 128 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3dy3 h SER 129 N 0.00 0.00 -0.44 1.61 4.64 -1.37 -1.43 113.55 116.56 3dy3 h SER 129 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dy3 h SER 129 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3dy3 h SER 129 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3dy3 n GLY 130 N -0.52 1.99 0.31 -0.77 0.00 -0.52 -4.70 105.19 100.97 3dy3 n GLY 130 Ca -0.00 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.28 3dy3 n GLY 130 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3dy3 h GLN 131 N 3.68 -0.33 -0.68 1.61 3.07 -1.46 -2.39 115.11 118.62 3dy3 h GLN 131 Ca 0.00 0.02 0.18 0.00 0.09 0.00 0.00 58.65 58.94 3dy3 h GLN 131 Cb 0.89 0.07 -0.03 0.00 0.08 0.00 0.00 27.48 28.49 3dy3 h GLN 131 CO 0.00 -0.22 0.48 1.79 0.09 0.00 0.00 178.83 180.97 3dy3 h THR 132 N -0.34 0.70 -0.12 1.86 1.35 -1.84 -0.87 112.91 113.66 3dy3 h THR 132 Ca 0.11 -0.04 -0.10 0.00 -0.55 0.00 0.00 66.41 65.83 3dy3 h THR 132 Cb 0.51 0.58 0.00 0.00 -1.73 0.00 0.00 68.15 67.51 3dy3 h THR 132 CO -0.37 0.02 -0.31 -0.26 -0.25 0.00 0.00 175.52 174.35 3dy3 h PHE 133 N 0.12 0.54 -0.72 4.73 0.04 -1.79 -2.27 116.94 117.59 3dy3 h PHE 133 Ca 0.33 -0.21 -0.01 0.00 2.80 0.00 0.00 57.97 60.88 3dy3 h PHE 133 Cb 1.14 -0.10 -0.04 0.00 2.20 0.00 0.00 35.95 39.16 3dy3 h PHE 133 CO -0.00 0.93 0.42 0.00 -0.60 0.00 0.00 178.31 179.06 3dy3 h ALA 134 N 0.51 1.39 -0.70 2.45 0.00 -1.07 -2.22 119.26 119.63 3dy3 h ALA 134 Ca -0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3dy3 h ALA 134 Cb 0.92 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 3dy3 h ALA 134 CO 0.07 0.52 0.28 1.88 0.00 0.00 0.00 179.25 181.99 3dy3 h TYR 135 N 0.99 1.07 -0.23 0.00 0.99 -1.12 -1.61 116.97 117.07 3dy3 h TYR 135 Ca 0.26 -0.08 0.04 0.00 2.00 0.00 0.00 58.73 60.94 3dy3 h TYR 135 Cb -0.02 -0.32 -0.04 0.00 1.00 0.00 0.00 36.73 37.35 3dy3 h TYR 135 CO 0.00 0.83 0.00 0.78 -0.00 0.00 0.00 178.16 179.78 3dy3 h GLY 136 N 1.00 0.22 0.92 3.88 0.00 -0.80 0.18 103.07 108.47 3dy3 h GLY 136 Ca 0.23 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 3dy3 h GLY 136 CO -0.02 -0.04 -0.23 -2.08 0.00 0.00 0.00 176.54 174.17 3dy3 h VAL 137 N 0.07 0.53 0.30 4.60 2.07 -1.38 -3.21 116.25 119.24 3dy3 h VAL 137 Ca 0.11 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 3dy3 h VAL 137 Cb 0.13 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 3dy3 h VAL 137 CO -0.18 0.03 -0.29 -0.07 0.02 0.00 0.00 177.57 177.08 3dy3 h LEU 138 N -0.72 -0.78 -1.93 2.57 4.07 -1.14 -2.86 115.31 114.52 3dy3 h LEU 138 Ca -0.06 0.07 0.07 0.00 0.08 0.00 0.00 57.88 58.04 3dy3 h LEU 138 Cb 0.53 0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.52 3dy3 h LEU 138 CO 0.11 -0.42 0.42 0.44 -1.08 0.00 0.00 178.44 177.91 3dy3 h ASP 139 N -0.62 0.00 -0.02 -0.43 3.32 -0.72 -0.05 116.42 117.90 3dy3 h ASP 139 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3dy3 h ASP 139 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 3dy3 h ASP 139 CO -0.05 0.00 -0.11 -1.54 -1.72 0.00 0.00 179.24 175.82 3dy3 n SER 140 N -3.36 2.28 0.00 6.45 3.41 -1.09 -4.50 113.62 116.80 3dy3 n SER 140 Ca 0.04 -1.64 0.00 0.00 -0.26 0.00 0.00 58.87 57.01 3dy3 n SER 140 Cb 0.54 0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 3dy3 n SER 140 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3dy3 n ASN 141 N 0.68 0.31 -4.72 4.04 4.13 -0.70 -5.06 115.26 113.94 3dy3 n ASN 141 Ca 0.10 -0.77 -0.41 0.00 1.68 0.00 0.00 54.58 55.17 3dy3 n ASN 141 Cb 0.43 0.13 -0.04 0.00 -1.54 0.00 0.00 39.78 38.76 3dy3 n ASN 141 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 3dy3 s TYR 142 N -0.13 3.62 -0.03 3.10 6.14 -0.11 -5.03 117.35 124.91 3dy3 s TYR 142 Ca 0.00 1.59 -0.06 0.00 0.64 0.00 0.00 57.07 59.25 3dy3 s TYR 142 Cb 0.00 -3.22 0.01 0.00 0.42 0.00 0.00 41.96 39.16 3dy3 s TYR 142 CO 0.00 -0.45 0.13 0.15 0.64 0.00 0.00 175.55 176.02 3dy3 s LYS 143 N 0.39 0.29 0.58 4.97 3.01 -1.26 -5.03 119.74 122.70 3dy3 s LYS 143 Ca 0.52 -0.06 0.37 0.00 -1.01 0.00 0.00 55.97 55.79 3dy3 s LYS 143 Cb -0.26 0.13 1.67 0.00 -1.01 0.00 0.00 37.83 38.36 3dy3 s LYS 143 CO 0.31 -0.06 2.10 2.35 0.51 0.00 0.00 175.35 180.56 3dy3 h TRP 144 N 5.26 0.00 -0.19 3.18 2.91 -1.96 -2.91 115.95 122.24 3dy3 h TRP 144 Ca -0.27 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.75 3dy3 h TRP 144 Cb 1.20 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.85 3dy3 h TRP 144 CO 0.49 0.01 0.00 -0.25 -1.03 0.00 0.00 178.44 177.65 3dy3 n ASP 145 N -3.10 1.30 -4.70 2.65 8.00 -1.26 -0.49 116.55 118.95 3dy3 n ASP 145 Ca -0.00 -1.83 -0.39 0.00 0.71 0.00 0.00 54.79 53.28 3dy3 n ASP 145 Cb 0.24 -0.13 0.04 0.00 -0.02 0.00 0.00 41.12 41.25 3dy3 n ASP 145 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3dy3 n LEU 146 N 0.15 4.75 -4.86 0.64 4.32 -1.10 -4.96 117.00 115.94 3dy3 n LEU 146 Ca 0.12 0.98 -0.31 0.00 -0.02 0.00 0.00 56.01 56.77 3dy3 n LEU 146 Cb 0.24 -1.52 -0.00 0.00 -1.62 0.00 0.00 43.42 40.52 3dy3 n LEU 146 CO 0.09 -0.87 0.71 -0.94 -1.22 0.00 0.00 177.39 175.15 3dy3 s SER 147 N -0.89 6.31 0.33 -1.43 1.04 -1.26 -4.55 113.70 113.25 3dy3 s SER 147 Ca 0.70 1.49 0.04 0.00 0.48 0.00 0.00 55.95 58.66 3dy3 s SER 147 Cb -0.44 -2.49 0.67 0.00 0.10 0.00 0.00 66.02 63.86 3dy3 s SER 147 CO 0.51 -0.81 1.91 0.58 0.98 0.00 0.00 173.24 176.40 3dy3 h VAL 148 N 0.09 0.98 -0.39 5.02 2.07 -1.95 0.46 116.25 122.54 3dy3 h VAL 148 Ca -0.45 -0.29 -0.09 0.00 0.82 0.00 0.00 66.70 66.69 3dy3 h VAL 148 Cb 1.19 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 3dy3 h VAL 148 CO 0.61 0.16 -0.10 -0.08 0.02 0.00 0.00 177.57 178.18 3dy3 h GLU 149 N 0.86 0.76 -0.28 1.57 4.81 -2.00 -1.67 114.58 118.63 3dy3 h GLU 149 Ca 0.39 -0.29 -0.18 0.00 -0.13 0.00 0.00 59.36 59.14 3dy3 h GLU 149 Cb 0.37 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.71 3dy3 h GLU 149 CO -0.16 0.90 -0.54 -0.44 -0.73 0.00 0.00 179.01 178.04 3dy3 h ASP 150 N 0.56 0.96 -0.31 1.04 3.45 -1.69 -2.89 116.42 117.54 3dy3 h ASP 150 Ca 0.10 -0.54 0.01 0.00 0.43 0.00 0.00 57.03 57.03 3dy3 h ASP 150 Cb 0.63 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 39.10 3dy3 h ASP 150 CO 0.04 1.32 0.19 0.00 -1.57 0.00 0.00 179.24 179.22 3dy3 h ALA 151 N 0.67 0.39 -0.55 3.45 0.00 -0.07 -0.27 119.26 122.89 3dy3 h ALA 151 Ca 0.01 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.97 3dy3 h ALA 151 Cb 1.15 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 3dy3 h ALA 151 CO 0.12 -0.17 0.26 -0.07 0.00 0.00 0.00 179.25 179.39 3dy3 h LEU 152 N 0.39 0.34 -0.46 0.00 3.38 -1.31 -1.73 115.31 115.92 3dy3 h LEU 152 Ca 0.12 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 3dy3 h LEU 152 Cb -0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 3dy3 h LEU 152 CO -0.05 0.23 0.10 0.22 0.09 0.00 0.00 178.44 179.02 3dy3 h TYR 153 N 0.49 0.79 -0.66 1.13 5.03 -1.23 -0.74 116.97 121.78 3dy3 h TYR 153 Ca 0.25 -0.10 0.08 0.00 2.58 0.00 0.00 58.73 61.54 3dy3 h TYR 153 Cb 0.21 -0.22 -0.07 0.00 1.55 0.00 0.00 36.73 38.20 3dy3 h TYR 153 CO -0.12 0.73 0.32 1.25 -1.32 0.00 0.00 178.16 179.02 3dy3 h LEU 154 N 0.62 0.41 -0.11 2.82 5.85 -0.57 0.50 115.31 124.83 3dy3 h LEU 154 Ca 0.14 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 3dy3 h LEU 154 Cb 0.35 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.36 3dy3 h LEU 154 CO 0.00 0.25 0.03 1.23 -0.34 0.00 0.00 178.44 179.61 3dy3 h GLY 155 N 0.56 0.18 1.54 3.75 0.00 -1.07 -0.79 103.07 107.23 3dy3 h GLY 155 Ca 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.54 3dy3 h GLY 155 CO -0.25 0.10 0.31 1.70 0.00 0.00 0.00 176.54 178.40 3dy3 h LYS 156 N -0.01 0.62 -0.12 4.80 3.64 -0.27 -2.29 116.57 122.94 3dy3 h LYS 156 Ca 0.03 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.19 3dy3 h LYS 156 Cb 0.22 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 3dy3 h LYS 156 CO -0.00 0.42 -0.69 -0.09 -2.27 0.00 0.00 179.45 176.81 3dy3 h ARG 157 N 0.64 0.52 -0.29 1.90 9.65 0.29 -2.45 114.38 124.65 3dy3 h ARG 157 Ca 0.17 -0.40 -0.06 0.00 -1.10 0.00 0.00 59.98 58.60 3dy3 h ARG 157 Cb -0.07 0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.57 3dy3 h ARG 157 CO -0.04 1.02 -0.06 0.77 2.80 0.00 0.00 179.97 184.47 3dy3 h SER 158 N 0.37 0.44 -0.04 -3.80 0.02 -0.59 -1.49 113.55 108.46 3dy3 h SER 158 Ca -0.02 -0.09 -0.25 0.00 -0.84 0.00 0.00 61.79 60.59 3dy3 h SER 158 Cb 1.27 -0.12 0.02 0.00 0.14 0.00 0.00 62.40 63.71 3dy3 h SER 158 CO 0.13 0.55 -0.93 0.40 -1.14 0.00 0.00 176.83 175.83 3dy3 h ILE 159 N 0.44 1.28 -0.88 3.27 1.08 -1.44 -2.66 117.51 118.61 3dy3 h ILE 159 Ca 0.09 -2.14 0.08 0.00 -0.39 0.00 0.00 64.86 62.50 3dy3 h ILE 159 Cb 0.38 2.22 -0.07 0.00 -3.07 0.00 0.00 36.82 36.28 3dy3 h ILE 159 CO 0.02 0.67 0.53 0.25 -0.69 0.00 0.00 178.15 178.93 3dy3 h LEU 160 N 0.45 0.82 0.25 1.44 5.85 -0.99 0.23 115.31 123.34 3dy3 h LEU 160 Ca -0.10 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 3dy3 h LEU 160 Cb 1.58 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.47 3dy3 h LEU 160 CO 0.19 0.50 -0.12 0.00 -0.34 0.00 0.00 178.44 178.66 3dy3 h ALA 161 N 1.44 -0.33 0.26 1.25 0.00 -1.21 -2.04 119.26 118.62 3dy3 h ALA 161 Ca 0.40 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 3dy3 h ALA 161 Cb 0.26 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3dy3 h ALA 161 CO -0.21 -0.68 -0.20 0.00 0.00 0.00 0.00 179.25 178.16 3dy3 h ALA 162 N 0.42 -0.45 -0.98 0.00 0.00 -0.98 -2.44 119.26 114.82 3dy3 h ALA 162 Ca -0.03 -0.08 0.22 0.00 0.00 0.00 0.00 54.91 55.02 3dy3 h ALA 162 Cb 0.26 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 18.20 3dy3 h ALA 162 CO 0.06 -0.77 0.56 0.00 0.00 0.00 0.00 179.25 179.10 3dy3 h ALA 163 N 0.23 1.67 0.51 0.00 0.00 -0.52 0.22 119.26 121.38 3dy3 h ALA 163 Ca -0.02 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3dy3 h ALA 163 Cb 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3dy3 h ALA 163 CO -0.01 -0.20 -0.24 1.25 0.00 0.00 0.00 179.25 180.05 3dy3 h HIS 164 N 0.62 -0.63 0.00 0.00 6.17 -0.91 -3.35 115.15 117.04 3dy3 h HIS 164 Ca 0.60 -0.01 -0.03 0.00 0.71 0.00 0.00 60.37 61.64 3dy3 h HIS 164 Cb 1.07 0.21 0.00 0.00 2.52 0.00 0.00 27.41 31.21 3dy3 h HIS 164 CO -0.03 -0.34 -0.12 0.00 0.71 0.00 0.00 177.93 178.15 3dy3 h ARG 165 N -0.81 0.08 -6.46 5.26 2.47 -1.06 -3.45 114.38 110.41 3dy3 h ARG 165 Ca -0.07 -0.09 -0.54 0.00 -1.26 0.00 0.00 59.98 58.02 3dy3 h ARG 165 Cb 0.58 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.93 3dy3 h ARG 165 CO 0.11 0.87 0.66 0.34 0.56 0.00 0.00 179.97 182.52 3dy3 s ASP 166 N -6.18 6.98 0.46 7.04 3.68 0.74 -4.92 116.67 124.48 3dy3 s ASP 166 Ca -0.17 2.08 0.26 0.00 2.13 0.00 0.00 52.55 56.85 3dy3 s ASP 166 Cb -0.00 -2.57 0.75 0.00 -1.45 0.00 0.00 42.92 39.64 3dy3 s ASP 166 CO 0.71 -0.57 1.75 0.00 0.13 0.00 0.00 175.17 177.20 3dy3 h ALA 167 N 7.05 0.97 -0.02 3.66 0.00 -1.86 -3.16 119.26 125.89 3dy3 h ALA 167 Ca -0.40 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3dy3 h ALA 167 Cb 1.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3dy3 h ALA 167 CO 0.85 0.12 0.00 0.66 0.00 0.00 0.00 179.25 180.87 3dy3 n TYR 168 N -3.16 0.00 -4.34 0.00 4.01 -1.26 -4.89 117.16 107.52 3dy3 n TYR 168 Ca 0.02 -0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.49 3dy3 n TYR 168 Cb 0.46 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.39 3dy3 n TYR 168 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 3dy3 s SER 169 N -1.99 3.92 0.00 7.72 0.01 -1.20 -1.40 113.70 120.76 3dy3 s SER 169 Ca 0.34 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.90 3dy3 s SER 169 Cb 0.21 -0.53 0.00 0.00 0.21 0.00 0.00 66.02 65.90 3dy3 s SER 169 CO 0.32 0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.69 3dy3 n GLY 170 N 0.14 0.43 2.93 3.44 0.00 -1.26 -4.59 105.19 106.28 3dy3 n GLY 170 Ca -0.11 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.30 3dy3 n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dy3 n GLY 171 N 0.00 1.35 3.31 -0.02 0.00 -1.26 -2.20 105.19 106.36 3dy3 n GLY 171 Ca 0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 3dy3 n GLY 171 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dy3 s SER 172 N -4.00 0.10 -0.01 1.61 1.04 -1.26 -0.86 113.70 110.32 3dy3 s SER 172 Ca 0.00 -1.05 0.02 0.00 0.48 0.00 0.00 55.95 55.40 3dy3 s SER 172 Cb 0.00 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 3dy3 s SER 172 CO 0.00 -0.88 -0.05 -0.69 0.98 0.00 0.00 173.24 172.60 3dy3 s VAL 173 N -4.03 3.80 -0.10 5.02 1.01 0.11 -2.77 120.40 123.44 3dy3 s VAL 173 Ca 0.23 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.58 3dy3 s VAL 173 Cb 0.04 -2.65 0.01 0.00 0.00 0.00 0.00 36.38 33.79 3dy3 s VAL 173 CO 0.04 0.43 -0.17 0.20 0.00 0.00 0.00 175.10 175.60 3dy3 s ASN 174 N -1.33 2.54 0.04 3.32 0.02 -0.75 -0.26 114.94 118.51 3dy3 s ASN 174 Ca 0.17 -0.45 0.06 0.00 -1.02 0.00 0.00 52.86 51.61 3dy3 s ASN 174 Cb -0.11 -1.15 -0.03 0.00 0.02 0.00 0.00 41.25 39.97 3dy3 s ASN 174 CO 0.07 0.05 -0.14 -0.76 0.02 0.00 0.00 177.10 176.34 3dy3 s LEU 175 N 0.79 2.80 -0.01 0.60 1.43 -0.99 -2.29 118.68 121.01 3dy3 s LEU 175 Ca -0.10 -0.35 -0.06 0.00 -1.03 0.00 0.00 54.13 52.59 3dy3 s LEU 175 Cb -0.16 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.43 3dy3 s LEU 175 CO 0.01 0.26 0.12 -0.31 0.23 0.00 0.00 176.35 176.65 3dy3 s TYR 176 N -0.97 0.03 -0.11 0.29 1.51 -0.14 -0.52 117.35 117.44 3dy3 s TYR 176 Ca 0.16 -0.09 0.02 0.00 -1.01 0.00 0.00 57.07 56.15 3dy3 s TYR 176 Cb -0.11 -0.05 0.01 0.00 -0.11 0.00 0.00 41.96 41.71 3dy3 s TYR 176 CO 0.07 -0.23 -0.16 -1.58 -1.11 0.00 0.00 175.55 172.54 3dy3 s HIS 177 N -1.11 2.02 -0.25 2.71 2.46 -0.75 -1.39 115.29 118.98 3dy3 s HIS 177 Ca -0.12 -0.95 -0.08 0.00 0.47 0.00 0.00 55.06 54.38 3dy3 s HIS 177 Cb -0.07 -1.45 -0.03 0.00 -0.13 0.00 0.00 32.58 30.91 3dy3 s HIS 177 CO 0.01 -0.48 0.09 0.08 -2.47 0.00 0.00 174.74 171.97 3dy3 s VAL 178 N 0.96 4.46 0.36 0.89 1.01 0.77 0.44 120.40 129.28 3dy3 s VAL 178 Ca -0.07 -0.12 0.09 0.00 0.00 0.00 0.00 61.98 61.87 3dy3 s VAL 178 Cb -0.15 -3.09 -0.06 0.00 0.00 0.00 0.00 36.38 33.08 3dy3 s VAL 178 CO -0.01 0.33 -0.02 0.42 0.00 0.00 0.00 175.10 175.81 3dy3 s THR 179 N 1.61 2.29 0.57 3.92 -4.23 0.26 -1.80 115.64 118.27 3dy3 s THR 179 Ca 0.06 -2.06 0.26 0.00 -1.18 0.00 0.00 61.69 58.78 3dy3 s THR 179 Cb -0.15 -2.79 0.34 0.00 1.34 0.00 0.00 72.50 71.23 3dy3 s THR 179 CO 0.05 -0.14 2.20 -0.08 -0.54 0.00 0.00 174.62 176.10 3dy3 h GLU 180 N 1.86 0.00 -0.13 3.99 4.81 -1.93 -0.77 114.58 122.42 3dy3 h GLU 180 Ca -0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 3dy3 h GLU 180 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 3dy3 h GLU 180 CO 0.72 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 178.75 3dy3 n ASP 181 N -4.02 1.45 0.00 1.04 10.43 -1.26 -4.83 116.55 119.35 3dy3 n ASP 181 Ca -0.02 -1.64 0.00 0.00 2.57 0.00 0.00 54.79 55.70 3dy3 n ASP 181 Cb 0.15 -0.08 0.00 0.00 1.84 0.00 0.00 41.12 43.03 3dy3 n ASP 181 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3dy3 n GLY 183 N 1.10 0.91 3.88 0.44 0.00 -0.29 -4.95 105.19 106.29 3dy3 n GLY 183 Ca 0.16 -2.14 -0.26 0.00 0.00 0.00 0.00 46.02 43.79 3dy3 n GLY 183 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3dy3 s TRP 184 N -1.00 3.34 -0.12 1.61 1.48 -0.96 -0.57 118.94 122.72 3dy3 s TRP 184 Ca 0.00 0.05 0.01 0.00 -1.06 0.00 0.00 56.10 55.10 3dy3 s TRP 184 Cb 0.00 -1.59 0.02 0.00 -1.16 0.00 0.00 33.47 30.74 3dy3 s TRP 184 CO 0.00 0.51 -0.15 0.42 -4.06 0.00 0.00 176.95 173.68 3dy3 s ILE 185 N -1.77 1.52 0.17 0.66 1.01 0.17 -4.95 121.20 118.01 3dy3 s ILE 185 Ca 0.33 -0.64 -0.31 0.00 0.00 0.00 0.00 60.65 60.04 3dy3 s ILE 185 Cb -0.10 -1.41 -0.09 0.00 0.01 0.00 0.00 42.46 40.87 3dy3 s ILE 185 CO 0.26 0.45 1.37 -0.47 0.00 0.00 0.00 174.94 176.55 3dy3 s TYR 186 N 1.18 3.21 -0.35 3.97 5.04 -1.26 -1.81 117.35 127.32 3dy3 s TYR 186 Ca -0.02 1.06 0.06 0.00 -2.44 0.00 0.00 57.07 55.72 3dy3 s TYR 186 Cb -0.14 -3.68 0.45 0.00 0.35 0.00 0.00 41.96 38.94 3dy3 s TYR 186 CO -0.05 -2.27 1.30 0.72 -1.34 0.00 0.00 175.55 173.91 3dy3 n HIS 187 N 3.15 2.86 -0.59 4.97 8.25 0.32 -4.95 115.22 129.23 3dy3 n HIS 187 Ca 0.09 -2.39 0.07 0.00 -0.26 0.00 0.00 57.72 55.23 3dy3 n HIS 187 Cb 0.42 -0.47 -0.03 0.00 1.12 0.00 0.00 29.99 31.02 3dy3 n HIS 187 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dy3 n GLY 188 N -0.72 -2.44 3.37 -1.41 0.00 -1.26 -4.44 105.19 98.30 3dy3 n GLY 188 Ca 0.46 -1.32 -0.37 0.00 0.00 0.00 0.00 46.02 44.79 3dy3 n GLY 188 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dy3 s ASN 189 N -5.74 5.06 -0.31 1.61 3.84 -1.26 -2.33 114.94 115.80 3dy3 s ASN 189 Ca 0.00 -0.54 -0.04 0.00 0.21 0.00 0.00 52.86 52.49 3dy3 s ASN 189 Cb 0.00 -1.88 0.04 0.00 -0.55 0.00 0.00 41.25 38.86 3dy3 s ASN 189 CO 0.00 -0.13 0.04 -1.00 -2.79 0.00 0.00 177.10 173.22 3dy3 s HIS 190 N 1.53 3.25 -0.01 0.43 3.76 0.64 -4.89 115.29 120.00 3dy3 s HIS 190 Ca 0.04 -1.67 -0.34 0.00 -0.15 0.00 0.00 55.06 52.94 3dy3 s HIS 190 Cb -0.16 -2.18 -0.12 0.00 1.11 0.00 0.00 32.58 31.23 3dy3 s HIS 190 CO 0.02 -0.77 1.80 -3.47 -0.85 0.00 0.00 174.74 171.47 3dy3 n ASP 191 N 4.70 3.36 0.22 1.40 2.03 -1.26 0.10 116.55 127.10 3dy3 n ASP 191 Ca -0.13 1.00 0.06 0.00 0.52 0.00 0.00 54.79 56.24 3dy3 n ASP 191 Cb 0.44 -1.39 0.53 0.00 -0.72 0.00 0.00 41.12 39.98 3dy3 n ASP 191 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 3dy3 h VAL 192 N 4.93 1.10 0.58 5.18 2.07 -1.31 -0.98 116.25 127.82 3dy3 h VAL 192 Ca -0.47 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 3dy3 h VAL 192 Cb 1.27 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 3dy3 h VAL 192 CO 0.93 0.13 -0.47 1.23 0.02 0.00 0.00 177.57 179.41 3dy3 h GLY 193 N 0.40 -1.20 1.51 2.17 0.00 -1.89 -0.80 103.07 103.26 3dy3 h GLY 193 Ca 0.01 0.54 -0.14 0.00 0.00 0.00 0.00 47.33 47.74 3dy3 h GLY 193 CO 0.02 -0.39 -0.43 0.83 0.00 0.00 0.00 176.54 176.57 3dy3 h GLU 194 N -1.03 0.54 -0.45 4.80 5.08 -1.90 -3.09 114.58 118.52 3dy3 h GLU 194 Ca -0.07 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 57.97 3dy3 h GLU 194 Cb 0.87 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 3dy3 h GLU 194 CO -0.00 0.87 0.14 1.25 -1.00 0.00 0.00 179.01 180.27 3dy3 h LEU 195 N 0.44 0.61 0.12 1.33 5.85 -1.09 -2.38 115.31 120.18 3dy3 h LEU 195 Ca 0.03 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 3dy3 h LEU 195 Cb 0.93 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.80 3dy3 h LEU 195 CO 0.08 0.58 -0.06 0.15 -0.34 0.00 0.00 178.44 178.86 3dy3 h PHE 196 N 0.65 -0.15 -0.62 1.25 3.04 -1.05 0.29 116.94 120.35 3dy3 h PHE 196 Ca 0.15 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.06 3dy3 h PHE 196 Cb 0.20 0.05 -0.03 0.00 2.56 0.00 0.00 35.95 38.73 3dy3 h PHE 196 CO 0.01 0.05 0.23 -1.49 -2.02 0.00 0.00 178.31 175.08 3dy3 h TRP 197 N -0.32 0.96 0.57 0.41 -0.00 -1.60 0.82 115.95 116.79 3dy3 h TRP 197 Ca -0.02 -0.08 -0.03 0.00 -0.00 0.00 0.00 58.89 58.77 3dy3 h TRP 197 Cb 0.26 -0.28 0.00 0.00 -0.00 0.00 0.00 29.16 29.14 3dy3 h TRP 197 CO -0.02 0.77 -0.32 -0.22 -0.00 0.00 0.00 178.44 178.66 3dy3 h LYS 198 N 0.87 -0.79 -0.85 0.49 3.64 -1.37 -2.03 116.57 116.54 3dy3 h LYS 198 Ca 0.20 0.05 0.19 0.00 -1.27 0.00 0.00 60.65 59.83 3dy3 h LYS 198 Cb 0.23 0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 32.18 3dy3 h LYS 198 CO -0.01 -0.53 0.57 0.28 -2.27 0.00 0.00 179.45 177.49 3dy3 h VAL 199 N -0.82 0.70 0.86 2.00 2.07 -0.89 -1.63 116.25 118.54 3dy3 h VAL 199 Ca -0.08 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 3dy3 h VAL 199 Cb 0.64 0.31 0.01 0.00 -1.52 0.00 0.00 31.29 30.73 3dy3 h VAL 199 CO 0.10 0.07 -0.41 0.50 0.02 0.00 0.00 177.57 177.85 3dy3 h LYS 200 N 0.36 -1.11 0.71 1.57 3.64 -0.48 -1.78 116.57 119.49 3dy3 h LYS 200 Ca 0.43 0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.85 3dy3 h LYS 200 Cb 1.12 0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 33.19 3dy3 h LYS 200 CO -0.14 -0.73 -0.41 1.49 -2.27 0.00 0.00 179.45 177.38 3dy3 h GLU 201 N -1.19 -1.01 -0.34 1.90 4.81 -0.76 0.50 114.58 118.49 3dy3 h GLU 201 Ca -0.12 0.07 0.10 0.00 -0.13 0.00 0.00 59.36 59.28 3dy3 h GLU 201 Cb 0.89 0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 3dy3 h GLU 201 CO 0.19 -0.67 0.30 0.93 -0.73 0.00 0.00 179.01 179.03 3dy3 h GLU 202 N -1.04 0.00 0.00 1.92 5.08 -1.41 -3.04 114.58 116.08 3dy3 h GLU 202 Ca -0.10 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.14 3dy3 h GLU 202 Cb 0.83 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 3dy3 h GLU 202 CO 0.12 0.00 -1.78 -1.91 -1.00 0.00 0.00 179.01 174.43 3dy3 n GLU 203 N -4.05 1.15 -0.00 2.33 2.13 -0.67 -5.01 120.64 116.51 3dy3 n GLU 203 Ca 0.05 -0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.81 3dy3 n GLU 203 Cb 0.47 -1.34 0.00 0.00 0.27 0.00 0.00 31.44 30.84 3dy3 n GLU 203 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3dy3 n GLY 204 N 1.94 1.95 3.78 8.31 0.00 0.17 -5.04 105.19 116.31 3dy3 n GLY 204 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 3dy3 n GLY 204 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dy3 s SER 205 N -3.31 2.19 -1.45 1.61 1.04 -1.22 -4.05 113.70 108.51 3dy3 s SER 205 Ca 0.00 0.47 -0.08 0.00 0.48 0.00 0.00 55.95 56.81 3dy3 s SER 205 Cb 0.00 -0.63 0.03 0.00 0.10 0.00 0.00 66.02 65.52 3dy3 s SER 205 CO 0.00 -3.32 0.91 0.49 0.98 0.00 0.00 173.24 172.30 3dy3 n PHE 206 N -4.20 -2.41 0.01 5.02 3.72 -1.26 -4.63 117.46 113.72 3dy3 n PHE 206 Ca 0.14 0.79 -0.10 0.00 -0.05 0.00 0.00 57.45 58.23 3dy3 n PHE 206 Cb 0.59 -4.53 -0.03 0.00 -0.94 0.00 0.00 39.48 34.57 3dy3 n PHE 206 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 3dy3 h ASN 207 N -2.03 -0.50 -0.25 4.37 -1.24 -1.95 -2.71 115.58 111.26 3dy3 h ASN 207 Ca -0.55 0.09 0.07 0.00 0.71 0.00 0.00 56.30 56.62 3dy3 h ASN 207 Cb 1.36 0.23 -0.01 0.00 0.73 0.00 0.00 38.32 40.64 3dy3 h ASN 207 CO 0.58 -0.21 0.29 -1.13 -1.29 0.00 0.00 177.43 175.67 3dy3 h ASN 208 N -0.21 0.00 -3.18 1.15 -1.24 -1.94 -3.41 115.58 106.75 3dy3 h ASN 208 Ca 0.09 0.00 -0.53 0.00 0.71 0.00 0.00 56.30 56.56 3dy3 h ASN 208 Cb 0.34 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.40 3dy3 h ASN 208 CO -0.24 0.00 0.57 -0.69 -1.29 0.00 0.00 177.43 175.79 3dy3 s VAL 209 N -4.59 4.00 -0.12 2.57 1.01 -1.02 -4.97 120.40 117.28 3dy3 s VAL 209 Ca -0.04 1.43 -0.29 0.00 0.00 0.00 0.00 61.98 63.07 3dy3 s VAL 209 Cb 0.15 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 3dy3 s VAL 209 CO 0.53 0.11 1.38 -0.63 0.00 0.00 0.00 175.10 176.49 3dy3 s ILE 210 N 1.11 4.04 0.00 2.22 1.09 -1.26 -5.06 121.20 123.34 3dy3 s ILE 210 Ca 0.59 1.28 0.00 0.00 -1.10 0.00 0.00 60.65 61.41 3dy3 s ILE 210 Cb -0.30 -3.82 0.00 0.00 -1.06 0.00 0.00 42.46 37.28 3dy3 s ILE 210 CO 0.29 -0.10 0.36 0.61 -0.10 0.00 0.00 174.94 176.00