#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dk0 n PHE 3 N 0.00 2.55 -4.05 0.00 -0.00 -1.25 -4.32 117.46 110.40 1dk0 n PHE 3 Ca 0.00 0.51 -0.11 0.00 -0.00 0.00 0.00 57.45 57.85 1dk0 n PHE 3 Cb 0.00 -2.46 -0.11 0.00 -0.00 0.00 0.00 39.48 36.91 1dk0 n PHE 3 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 1dk0 s SER 4 N -0.24 0.64 -0.02 -2.13 1.04 -0.11 -4.97 113.70 107.91 1dk0 s SER 4 Ca 0.55 -0.61 0.05 0.00 0.48 0.00 0.00 55.95 56.42 1dk0 s SER 4 Cb -0.53 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 65.65 1dk0 s SER 4 CO 0.63 -0.29 -0.17 0.54 0.98 0.00 0.00 173.24 174.92 1dk0 s VAL 5 N -1.82 1.36 -0.05 5.02 0.11 -1.26 -1.17 120.40 122.59 1dk0 s VAL 5 Ca -0.09 -0.73 0.04 0.00 -2.93 0.00 0.00 61.98 58.27 1dk0 s VAL 5 Cb -0.07 -1.13 0.00 0.00 -1.53 0.00 0.00 36.38 33.65 1dk0 s VAL 5 CO -0.01 0.39 -0.15 0.20 -3.33 0.00 0.00 175.10 172.19 1dk0 s ASN 6 N -0.37 2.00 -0.06 3.54 0.01 -0.40 -4.98 114.94 114.69 1dk0 s ASN 6 Ca 0.06 -0.33 -0.13 0.00 -0.71 0.00 0.00 52.86 51.75 1dk0 s ASN 6 Cb -0.07 -0.63 0.02 0.00 0.41 0.00 0.00 41.25 40.99 1dk0 s ASN 6 CO -0.00 0.12 0.30 -0.72 -1.51 0.00 0.00 177.10 175.29 1dk0 s TYR 7 N 0.17 -0.24 0.26 2.20 1.13 -1.26 -0.77 117.35 118.84 1dk0 s TYR 7 Ca -0.06 0.48 -0.30 0.00 -1.41 0.00 0.00 57.07 55.77 1dk0 s TYR 7 Cb -0.12 0.10 -0.13 0.00 -1.10 0.00 0.00 41.96 40.71 1dk0 s TYR 7 CO 0.02 -0.30 1.36 -3.47 -2.51 0.00 0.00 175.55 170.66 1dk0 n ASP 8 N 1.93 2.68 0.24 -0.18 2.03 0.15 -4.88 116.55 118.51 1dk0 n ASP 8 Ca -0.18 1.16 0.16 0.00 0.52 0.00 0.00 54.79 56.45 1dk0 n ASP 8 Cb 0.57 -1.43 0.73 0.00 -0.72 0.00 0.00 41.12 40.26 1dk0 n ASP 8 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1dk0 h SER 9 N 3.77 0.00 0.05 1.67 4.64 -1.99 -0.59 113.55 121.10 1dk0 h SER 9 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1dk0 h SER 9 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1dk0 h SER 9 CO 0.72 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.45 1dk0 h SER 10 N 0.00 0.00 -0.48 4.97 4.64 -1.97 -1.77 113.55 118.94 1dk0 h SER 10 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dk0 h SER 10 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1dk0 h SER 10 CO 0.00 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.45 1dk0 n PHE 11 N -2.76 0.65 -0.34 4.77 3.01 -0.23 -4.60 117.46 117.96 1dk0 n PHE 11 Ca -0.02 -0.32 0.04 0.00 1.01 0.00 0.00 57.45 58.16 1dk0 n PHE 11 Cb 0.07 -0.01 0.19 0.00 -0.01 0.00 0.00 39.48 39.72 1dk0 n PHE 11 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1dk0 h GLY 12 N 4.95 1.49 -1.93 1.37 0.00 -1.48 -1.77 103.07 105.70 1dk0 h GLY 12 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1dk0 h GLY 12 CO 0.01 0.21 0.00 0.61 0.00 0.00 0.00 176.54 177.37 1dk0 n GLY 13 N -1.34 1.41 3.81 4.60 0.00 -1.26 -1.60 105.19 110.81 1dk0 n GLY 13 Ca 0.16 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 1dk0 n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dk0 s TYR 14 N -1.47 3.51 0.80 1.61 4.12 -0.66 -4.89 117.35 120.36 1dk0 s TYR 14 Ca 0.37 1.52 -0.12 0.00 0.02 0.00 0.00 57.07 58.87 1dk0 s TYR 14 Cb 0.21 -2.75 0.07 0.00 -1.52 0.00 0.00 41.96 37.97 1dk0 s TYR 14 CO 0.29 0.13 1.10 -1.54 0.02 0.00 0.00 175.55 175.55 1dk0 s SER 15 N -1.92 4.49 0.15 2.29 1.04 -1.26 -1.79 113.70 116.70 1dk0 s SER 15 Ca 0.53 1.25 -0.14 0.00 0.48 0.00 0.00 55.95 58.07 1dk0 s SER 15 Cb -0.14 -1.97 0.03 0.00 0.10 0.00 0.00 66.02 64.05 1dk0 s SER 15 CO 0.19 -1.97 1.69 0.40 0.98 0.00 0.00 173.24 174.53 1dk0 h ILE 16 N -1.09 1.22 -0.49 -1.02 2.04 -0.88 -1.78 117.51 115.52 1dk0 h ILE 16 Ca -0.47 -0.71 0.05 0.00 1.00 0.00 0.00 64.86 64.73 1dk0 h ILE 16 Cb 1.27 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 1dk0 h ILE 16 CO 0.60 0.26 0.22 -0.74 0.00 0.00 0.00 178.15 178.49 1dk0 h HIS 17 N 0.67 0.40 -0.25 1.37 2.76 -1.44 -0.99 115.15 117.67 1dk0 h HIS 17 Ca 0.16 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.41 1dk0 h HIS 17 Cb 0.23 -0.11 -0.06 0.00 1.55 0.00 0.00 27.41 29.03 1dk0 h HIS 17 CO 0.01 0.18 -0.12 -0.44 -1.30 0.00 0.00 177.93 176.25 1dk0 h ASP 18 N 0.43 -0.41 -0.27 3.26 3.45 -1.74 0.17 116.42 121.32 1dk0 h ASP 18 Ca 0.22 0.10 -0.01 0.00 0.43 0.00 0.00 57.03 57.77 1dk0 h ASP 18 Cb 0.18 0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 39.16 1dk0 h ASP 18 CO -0.19 -0.16 0.14 0.22 -1.57 0.00 0.00 179.24 177.68 1dk0 h TYR 19 N -0.09 0.38 -0.55 4.55 3.20 -1.04 -1.84 116.97 121.57 1dk0 h TYR 19 Ca 0.13 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 1dk0 h TYR 19 Cb 0.29 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1dk0 h TYR 19 CO -0.30 0.34 0.11 -0.07 -1.64 0.00 0.00 178.16 176.60 1dk0 h LEU 20 N 0.31 0.81 -0.46 2.82 3.38 -1.04 0.20 115.31 121.33 1dk0 h LEU 20 Ca 0.09 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1dk0 h LEU 20 Cb 0.10 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1dk0 h LEU 20 CO -0.01 0.81 0.30 1.23 0.09 0.00 0.00 178.44 180.85 1dk0 h GLY 21 N 0.99 0.64 0.73 0.83 0.00 -0.69 -0.46 103.07 105.12 1dk0 h GLY 21 Ca 0.17 -0.23 0.03 0.00 0.00 0.00 0.00 47.33 47.30 1dk0 h GLY 21 CO 0.00 0.23 -0.04 -1.61 0.00 0.00 0.00 176.54 175.12 1dk0 h GLN 22 N 0.61 -0.01 -0.73 4.80 4.15 -0.90 -1.46 115.11 121.57 1dk0 h GLN 22 Ca 0.17 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.59 1dk0 h GLN 22 Cb -0.06 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.60 1dk0 h GLN 22 CO -0.04 -0.01 0.47 2.35 -1.93 0.00 0.00 178.83 179.66 1dk0 h TRP 23 N -0.02 0.93 -0.16 3.99 7.01 -0.84 -2.45 115.95 124.42 1dk0 h TRP 23 Ca 0.06 0.01 -0.12 0.00 2.11 0.00 0.00 58.89 60.96 1dk0 h TRP 23 Cb 0.11 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 26.85 1dk0 h TRP 23 CO -0.17 0.60 -0.41 0.00 -2.79 0.00 0.00 178.44 175.68 1dk0 h ALA 24 N 1.25 1.01 -0.03 2.65 0.00 -0.89 0.18 119.26 123.43 1dk0 h ALA 24 Ca 0.26 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 1dk0 h ALA 24 Cb -0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1dk0 h ALA 24 CO -0.05 0.61 -0.55 0.77 0.00 0.00 0.00 179.25 180.03 1dk0 h SER 25 N 0.31 0.09 0.21 0.00 0.02 -0.97 -1.32 113.55 111.90 1dk0 h SER 25 Ca 0.03 -0.05 -0.29 0.00 -0.84 0.00 0.00 61.79 60.63 1dk0 h SER 25 Cb 0.85 -0.03 0.03 0.00 0.14 0.00 0.00 62.40 63.39 1dk0 h SER 25 CO 0.07 0.63 -1.31 0.74 -1.14 0.00 0.00 176.83 175.81 1dk0 h THR 26 N 0.06 1.31 -0.43 -2.27 2.02 -0.97 -3.35 112.91 109.29 1dk0 h THR 26 Ca -0.00 -2.63 -0.05 0.00 0.77 0.00 0.00 66.41 64.50 1dk0 h THR 26 Cb 1.00 3.06 -0.02 0.00 -1.74 0.00 0.00 68.15 70.45 1dk0 h THR 26 CO 0.08 0.78 0.08 0.15 0.37 0.00 0.00 175.52 176.98 1dk0 h PHE 27 N -0.02 0.74 0.00 3.16 3.04 -0.61 -3.43 116.94 119.82 1dk0 h PHE 27 Ca -0.23 -0.10 0.00 0.00 3.98 0.00 0.00 57.97 61.62 1dk0 h PHE 27 Cb 2.00 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 40.31 1dk0 h PHE 27 CO 0.15 0.70 0.00 0.41 -2.02 0.00 0.00 178.31 177.55 1dk0 n GLY 28 N -0.54 0.48 2.87 2.40 0.00 -0.50 -4.34 105.19 105.55 1dk0 n GLY 28 Ca -0.00 -1.04 -0.15 0.00 0.00 0.00 0.00 46.02 44.83 1dk0 n GLY 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dk0 s ASP 29 N -4.00 0.32 0.00 1.61 3.68 -1.26 -2.89 116.67 114.13 1dk0 s ASP 29 Ca 0.00 0.30 0.31 0.00 2.13 0.00 0.00 52.55 55.29 1dk0 s ASP 29 Cb 0.00 0.21 1.61 0.00 -1.45 0.00 0.00 42.92 43.29 1dk0 s ASP 29 CO 0.00 -0.19 2.09 1.33 0.13 0.00 0.00 175.17 178.52 1dk0 n VAL 30 N 4.74 0.00 -3.64 1.11 0.24 -0.64 -4.83 118.33 115.32 1dk0 n VAL 30 Ca -0.16 -0.01 -0.21 0.00 -2.04 0.00 0.00 64.34 61.91 1dk0 n VAL 30 Cb 0.51 -0.42 0.05 0.00 -1.47 0.00 0.00 33.84 32.51 1dk0 n VAL 30 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1dk0 n ASN 31 N -1.11 -2.13 -4.50 -1.34 5.15 -1.26 -4.87 115.26 105.20 1dk0 n ASN 31 Ca 0.18 -0.74 -0.43 0.00 -0.60 0.00 0.00 54.58 52.99 1dk0 n ASN 31 Cb 0.20 -4.42 0.00 0.00 -0.53 0.00 0.00 39.78 35.04 1dk0 n ASN 31 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 1dk0 n HIS 32 N -4.32 4.64 -4.19 1.20 -0.00 -1.26 -4.70 115.22 106.59 1dk0 n HIS 32 Ca -0.24 -2.95 -0.11 0.00 -0.00 0.00 0.00 57.72 54.41 1dk0 n HIS 32 Cb 0.65 -2.53 -0.10 0.00 -0.00 0.00 0.00 29.99 28.01 1dk0 n HIS 32 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 1dk0 s THR 33 N 3.57 0.81 -0.22 3.57 -4.23 -1.26 -5.03 115.64 112.85 1dk0 s THR 33 Ca 0.51 -1.96 -0.40 0.00 -1.18 0.00 0.00 61.69 58.66 1dk0 s THR 33 Cb 0.03 -1.72 -0.18 0.00 1.34 0.00 0.00 72.50 71.97 1dk0 s THR 33 CO 0.05 -0.84 1.22 -3.20 -0.54 0.00 0.00 174.62 171.31 1dk0 n ASN 34 N -0.07 0.52 0.00 3.99 5.15 -1.26 -1.00 115.26 122.59 1dk0 n ASN 34 Ca -0.12 1.09 0.00 0.00 -0.60 0.00 0.00 54.58 54.95 1dk0 n ASN 34 Cb 0.61 -0.83 0.00 0.00 -0.53 0.00 0.00 39.78 39.02 1dk0 n ASN 34 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1dk0 n GLY 35 N 2.47 0.79 0.33 8.20 0.00 -1.26 -4.87 105.19 110.84 1dk0 n GLY 35 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1dk0 n GLY 35 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1dk0 n ASN 36 N 0.00 0.00 -4.55 1.61 3.02 -0.17 -5.07 115.26 110.10 1dk0 n ASN 36 Ca 0.00 -1.63 -0.36 0.00 -0.03 0.00 0.00 54.58 52.56 1dk0 n ASN 36 Cb 0.00 -0.13 -0.11 0.00 -0.61 0.00 0.00 39.78 38.93 1dk0 n ASN 36 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1dk0 s VAL 37 N 0.00 4.81 0.29 2.41 1.01 -1.24 -4.64 120.40 123.04 1dk0 s VAL 37 Ca 0.00 -0.01 0.04 0.00 0.00 0.00 0.00 61.98 62.01 1dk0 s VAL 37 Cb 0.00 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.13 1dk0 s VAL 37 CO 0.00 0.35 0.13 0.35 0.00 0.00 0.00 175.10 175.93 1dk0 n THR 38 N 4.55 0.00 0.29 3.92 -2.24 -1.26 -5.03 114.28 114.51 1dk0 n THR 38 Ca -0.16 -1.78 0.14 0.00 -2.27 0.00 0.00 64.05 59.98 1dk0 n THR 38 Cb 0.52 0.70 0.85 0.00 -2.10 0.00 0.00 70.33 70.30 1dk0 n THR 38 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1dk0 h ASP 39 N 1.29 0.00 -0.19 3.42 3.32 -1.99 -2.61 116.42 119.66 1dk0 h ASP 39 Ca -0.22 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 1dk0 h ASP 39 Cb 0.90 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.44 1dk0 h ASP 39 CO 0.35 0.04 0.12 0.00 -1.72 0.00 0.00 179.24 178.02 1dk0 h ALA 40 N 1.96 1.82 0.00 3.45 0.00 -1.98 -3.25 119.26 121.27 1dk0 h ALA 40 Ca -0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1dk0 h ALA 40 Cb 0.09 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 17.66 1dk0 h ALA 40 CO 0.00 0.16 -0.61 0.27 0.00 0.00 0.00 179.25 179.07 1dk0 n ASN 41 N -4.49 1.27 0.02 0.00 6.94 -1.00 -4.72 115.26 113.29 1dk0 n ASN 41 Ca 0.00 -2.79 0.11 0.00 -0.02 0.00 0.00 54.58 51.88 1dk0 n ASN 41 Cb 0.09 -0.38 -0.11 0.00 -2.36 0.00 0.00 39.78 37.02 1dk0 n ASN 41 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1dk0 n SER 42 N -0.41 0.29 0.00 0.53 3.41 -1.13 -4.69 113.62 111.62 1dk0 n SER 42 Ca 0.11 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 1dk0 n SER 42 Cb 0.85 1.49 0.00 0.00 -0.26 0.00 0.00 64.21 66.28 1dk0 n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dk0 n GLY 43 N 1.25 0.11 3.65 5.00 0.00 -1.26 -4.99 105.19 108.95 1dk0 n GLY 43 Ca -0.02 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 44.99 1dk0 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dk0 s GLY 44 N -2.01 -0.33 0.03 -0.02 0.00 -0.18 -5.00 107.32 99.81 1dk0 s GLY 44 Ca 0.00 0.52 0.02 0.00 0.00 0.00 0.00 44.72 45.25 1dk0 s GLY 44 CO 0.00 0.14 0.05 -1.36 0.00 0.00 0.00 173.10 171.94 1dk0 s PHE 45 N -3.13 3.18 -0.21 1.90 0.40 -1.26 -1.28 117.98 117.58 1dk0 s PHE 45 Ca 0.10 0.12 -0.12 0.00 -0.60 0.00 0.00 56.93 56.43 1dk0 s PHE 45 Cb -0.01 -1.67 -0.05 0.00 0.51 0.00 0.00 43.02 41.81 1dk0 s PHE 45 CO -0.02 0.51 0.21 -0.47 0.70 0.00 0.00 175.22 176.15 1dk0 s TYR 46 N -1.24 3.38 0.00 0.36 6.14 -0.03 -4.33 117.35 121.64 1dk0 s TYR 46 Ca 0.24 0.38 0.00 0.00 0.64 0.00 0.00 57.07 58.33 1dk0 s TYR 46 Cb -0.12 -2.28 0.00 0.00 0.42 0.00 0.00 41.96 39.98 1dk0 s TYR 46 CO 0.16 0.16 0.00 0.41 0.64 0.00 0.00 175.55 176.92 1dk0 n GLY 47 N 3.81 0.88 0.00 8.97 0.00 -1.26 -0.97 105.19 116.62 1dk0 n GLY 47 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1dk0 n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dk0 n GLY 48 N -1.59 -0.84 0.14 -0.02 0.00 -1.12 -4.64 105.19 97.11 1dk0 n GLY 48 Ca 0.00 -1.19 -0.22 0.00 0.00 0.00 0.00 46.02 44.61 1dk0 n GLY 48 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1dk0 h SER 49 N 0.00 0.48 0.00 1.61 0.02 -1.97 -3.40 113.55 110.29 1dk0 h SER 49 Ca 0.00 -0.90 0.00 0.00 -0.84 0.00 0.00 61.79 60.05 1dk0 h SER 49 Cb 0.00 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1dk0 h SER 49 CO 0.00 1.75 -0.08 0.18 -1.14 0.00 0.00 176.83 177.53 1dk0 n LEU 50 N -3.70 1.28 -3.72 5.07 4.77 -1.26 -4.54 117.00 114.90 1dk0 n LEU 50 Ca -0.27 -1.63 -0.09 0.00 -0.03 0.00 0.00 56.01 53.99 1dk0 n LEU 50 Cb 1.00 -0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.96 1dk0 n LEU 50 CO 0.45 0.39 0.42 -0.94 -1.33 0.00 0.00 177.39 176.38 1dk0 s SER 51 N -1.23 -0.35 0.00 -1.43 1.04 -1.26 -0.70 113.70 109.76 1dk0 s SER 51 Ca 0.08 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.09 1dk0 s SER 51 Cb 0.07 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.86 1dk0 s SER 51 CO 0.01 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 173.64 1dk0 n GLY 52 N -0.42 -1.30 0.15 7.32 0.00 0.13 -2.81 105.19 108.27 1dk0 n GLY 52 Ca -0.09 -1.20 0.12 0.00 0.00 0.00 0.00 46.02 44.85 1dk0 n GLY 52 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dk0 n SER 53 N 2.63 1.00 -3.86 1.61 3.41 -0.14 -1.25 113.62 117.02 1dk0 n SER 53 Ca 0.00 -0.79 -0.11 0.00 -0.26 0.00 0.00 58.87 57.71 1dk0 n SER 53 Cb 0.00 0.39 -0.09 0.00 -0.26 0.00 0.00 64.21 64.25 1dk0 n SER 53 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1dk0 s GLN 54 N -2.76 0.59 -0.04 4.33 -0.21 -1.19 -1.33 119.66 119.06 1dk0 s GLN 54 Ca 0.16 -0.50 0.05 0.00 0.02 0.00 0.00 55.36 55.09 1dk0 s GLN 54 Cb 0.18 0.25 -0.01 0.00 1.00 0.00 0.00 33.01 34.43 1dk0 s GLN 54 CO 0.66 -0.16 -0.18 -0.47 -2.12 0.00 0.00 175.29 173.02 1dk0 s TYR 55 N -1.94 1.74 0.04 0.91 5.04 -0.37 -0.85 117.35 121.92 1dk0 s TYR 55 Ca -0.10 -0.46 -0.06 0.00 -2.44 0.00 0.00 57.07 54.01 1dk0 s TYR 55 Cb -0.04 -1.16 -0.01 0.00 0.35 0.00 0.00 41.96 41.10 1dk0 s TYR 55 CO -0.01 -0.13 0.11 0.00 -1.34 0.00 0.00 175.55 174.18 1dk0 s ALA 56 N -0.09 -0.11 -0.06 3.97 0.00 -0.40 -0.32 121.76 124.74 1dk0 s ALA 56 Ca -0.01 -0.51 -0.18 0.00 0.00 0.00 0.00 51.96 51.26 1dk0 s ALA 56 Cb -0.11 0.26 0.04 0.00 0.00 0.00 0.00 23.12 23.31 1dk0 s ALA 56 CO 0.02 -0.33 0.42 -1.50 0.00 0.00 0.00 175.76 174.37 1dk0 s ILE 57 N -2.62 0.03 0.23 0.00 2.07 -1.13 -1.01 121.20 118.77 1dk0 s ILE 57 Ca -0.05 -0.25 0.07 0.00 -1.41 0.00 0.00 60.65 59.02 1dk0 s ILE 57 Cb -0.01 -0.69 -0.04 0.00 0.13 0.00 0.00 42.46 41.85 1dk0 s ILE 57 CO -0.05 -0.14 0.10 -0.44 -1.91 0.00 0.00 174.94 172.51 1dk0 s SER 58 N -0.87 5.14 0.37 4.50 0.01 -1.26 -2.70 113.70 118.89 1dk0 s SER 58 Ca -0.09 -0.36 -0.28 0.00 1.31 0.00 0.00 55.95 56.53 1dk0 s SER 58 Cb -0.04 -1.20 -0.10 0.00 0.21 0.00 0.00 66.02 64.89 1dk0 s SER 58 CO 0.04 0.01 1.42 -0.55 0.41 0.00 0.00 173.24 174.57 1dk0 s SER 59 N -3.54 6.44 0.07 2.44 0.15 0.51 -4.92 113.70 114.85 1dk0 s SER 59 Ca 0.31 2.91 0.25 0.00 0.70 0.00 0.00 55.95 60.12 1dk0 s SER 59 Cb -0.08 -2.66 0.44 0.00 -1.71 0.00 0.00 66.02 62.00 1dk0 s SER 59 CO 0.22 -0.79 1.38 0.35 1.20 0.00 0.00 173.24 175.60 1dk0 n THR 60 N 0.50 0.22 0.02 6.45 -2.24 -1.26 -1.77 114.28 116.20 1dk0 n THR 60 Ca 0.01 -0.17 -0.19 0.00 -2.27 0.00 0.00 64.05 61.43 1dk0 n THR 60 Cb 0.40 -0.02 -0.11 0.00 -2.10 0.00 0.00 70.33 68.51 1dk0 n THR 60 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1dk0 h ALA 61 N 2.69 0.11 0.00 6.98 0.00 -1.89 -3.39 119.26 123.76 1dk0 h ALA 61 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1dk0 h ALA 61 Cb 0.65 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1dk0 h ALA 61 CO 0.00 0.52 0.00 0.27 0.00 0.00 0.00 179.25 180.04 1dk0 n ASN 62 N -4.04 0.73 0.00 0.00 0.23 -1.26 -5.01 115.26 105.91 1dk0 n ASN 62 Ca -0.10 -0.96 0.00 0.00 -0.53 0.00 0.00 54.58 52.98 1dk0 n ASN 62 Cb 0.77 0.05 0.00 0.00 -2.08 0.00 0.00 39.78 38.52 1dk0 n ASN 62 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1dk0 n GLN 63 N -0.05 -1.31 0.00 -3.83 1.13 -0.73 -4.71 117.38 107.89 1dk0 n GLN 63 Ca 0.00 0.33 0.00 0.00 -1.94 0.00 0.00 57.00 55.39 1dk0 n GLN 63 Cb 0.05 -4.76 0.00 0.00 0.11 0.00 0.00 30.24 25.65 1dk0 n GLN 63 CO 0.00 0.00 0.00 1.55 -1.44 0.00 0.00 177.06 177.17 1dk0 n VAL 64 N -2.03 0.00 -2.30 5.09 3.14 -1.26 -4.74 118.33 116.23 1dk0 n VAL 64 Ca 0.00 0.00 -0.41 0.00 -2.96 0.00 0.00 64.34 60.97 1dk0 n VAL 64 Cb 0.33 -0.40 -0.03 0.00 -1.06 0.00 0.00 33.84 32.68 1dk0 n VAL 64 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1dk0 s THR 65 N -1.71 3.25 0.17 1.55 2.01 -1.26 -0.79 115.64 118.87 1dk0 s THR 65 Ca 0.00 1.15 -0.12 0.00 0.31 0.00 0.00 61.69 63.03 1dk0 s THR 65 Cb 0.00 -3.73 0.01 0.00 0.01 0.00 0.00 72.50 68.78 1dk0 s THR 65 CO 0.00 0.23 0.37 0.00 -0.69 0.00 0.00 174.62 174.54 1dk0 s ALA 66 N -0.61 -0.39 0.07 7.40 0.00 0.09 -0.36 121.76 127.96 1dk0 s ALA 66 Ca 0.50 -0.60 0.01 0.00 0.00 0.00 0.00 51.96 51.87 1dk0 s ALA 66 Cb -0.35 0.84 -0.03 0.00 0.00 0.00 0.00 23.12 23.57 1dk0 s ALA 66 CO 0.42 -0.70 -0.06 -0.59 0.00 0.00 0.00 175.76 174.83 1dk0 s PHE 67 N -3.92 0.72 -0.10 0.00 -0.12 -1.10 -2.68 117.98 110.78 1dk0 s PHE 67 Ca 0.13 -0.75 0.02 0.00 -0.05 0.00 0.00 56.93 56.29 1dk0 s PHE 67 Cb 0.02 -0.43 0.01 0.00 -0.63 0.00 0.00 43.02 41.98 1dk0 s PHE 67 CO -0.02 -0.15 -0.16 0.08 -0.05 0.00 0.00 175.22 174.91 1dk0 s VAL 68 N -2.65 1.54 -0.13 -2.49 1.01 -0.15 -2.83 120.40 114.70 1dk0 s VAL 68 Ca 0.01 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 1dk0 s VAL 68 Cb -0.01 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1dk0 s VAL 68 CO -0.03 0.45 0.09 0.00 0.00 0.00 0.00 175.10 175.61 1dk0 s ALA 69 N 0.80 3.64 0.06 5.51 0.00 0.57 -1.12 121.76 131.22 1dk0 s ALA 69 Ca -0.10 -0.70 0.08 0.00 0.00 0.00 0.00 51.96 51.24 1dk0 s ALA 69 Cb -0.16 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.06 1dk0 s ALA 69 CO 0.01 0.48 -0.23 0.20 0.00 0.00 0.00 175.76 176.22 1dk0 s GLY 70 N -0.58 1.25 0.00 0.00 0.00 -0.13 -1.23 107.32 106.63 1dk0 s GLY 70 Ca 0.12 -1.18 0.00 0.00 0.00 0.00 0.00 44.72 43.66 1dk0 s GLY 70 CO 0.02 -1.11 0.00 0.61 0.00 0.00 0.00 173.10 172.62 1dk0 n GLY 71 N 1.64 -0.36 2.89 0.20 0.00 -0.44 -0.94 105.19 108.18 1dk0 n GLY 71 Ca -0.17 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.93 1dk0 n GLY 71 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dk0 s ASN 72 N -4.00 4.16 0.04 1.61 0.01 -0.02 -4.30 114.94 112.45 1dk0 s ASN 72 Ca 0.00 -1.61 0.08 0.00 -0.71 0.00 0.00 52.86 50.62 1dk0 s ASN 72 Cb 0.00 -1.20 -0.03 0.00 0.41 0.00 0.00 41.25 40.44 1dk0 s ASN 72 CO 0.00 -0.34 -0.22 -0.76 -1.51 0.00 0.00 177.10 174.27 1dk0 s LEU 73 N 1.33 2.17 -0.04 0.60 1.43 -0.38 -1.42 118.68 122.37 1dk0 s LEU 73 Ca 0.04 -0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 52.57 1dk0 s LEU 73 Cb -0.18 -1.03 0.01 0.00 0.03 0.00 0.00 46.19 45.02 1dk0 s LEU 73 CO -0.13 0.18 0.10 0.28 0.23 0.00 0.00 176.35 177.01 1dk0 s THR 74 N -0.81 -0.00 -0.09 5.49 -1.32 -0.63 -0.69 115.64 117.59 1dk0 s THR 74 Ca 0.08 0.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.58 1dk0 s THR 74 Cb -0.09 -0.16 -0.03 0.00 -1.51 0.00 0.00 72.50 70.72 1dk0 s THR 74 CO 0.02 0.01 -0.08 -0.47 -2.21 0.00 0.00 174.62 171.88 1dk0 s TYR 75 N 0.15 2.91 -0.75 9.09 5.04 0.12 -1.08 117.35 132.82 1dk0 s TYR 75 Ca -0.01 -0.12 0.26 0.00 -2.44 0.00 0.00 57.07 54.76 1dk0 s TYR 75 Cb -0.02 -1.75 0.76 0.00 0.35 0.00 0.00 41.96 41.30 1dk0 s TYR 75 CO -0.00 0.20 1.70 0.25 -1.34 0.00 0.00 175.55 176.35 1dk0 n THR 76 N 2.58 0.48 0.00 4.34 -2.24 -0.11 -4.83 114.28 114.49 1dk0 n THR 76 Ca -0.18 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1dk0 n THR 76 Cb 0.53 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 1dk0 n THR 76 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1dk0 n LEU 77 N -2.14 0.00 -0.80 3.22 7.94 -1.26 -0.76 117.00 123.21 1dk0 n LEU 77 Ca 0.05 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.06 1dk0 n LEU 77 Cb 0.42 0.00 0.08 0.00 0.53 0.00 0.00 43.42 44.45 1dk0 n LEU 77 CO 0.31 0.00 0.54 0.49 -1.11 0.00 0.00 177.39 177.63 1dk0 n PHE 78 N 0.00 0.00 -2.40 1.96 3.01 -1.26 -0.35 117.46 118.42 1dk0 n PHE 78 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 1dk0 n PHE 78 Cb 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.44 1dk0 n PHE 78 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 1dk0 s ASN 79 N -1.86 6.51 0.42 4.37 0.01 0.06 -4.65 114.94 119.81 1dk0 s ASN 79 Ca 0.24 2.19 -0.24 0.00 -0.71 0.00 0.00 52.86 54.34 1dk0 s ASN 79 Cb 0.18 -2.60 -0.08 0.00 0.41 0.00 0.00 41.25 39.16 1dk0 s ASN 79 CO 0.31 -0.67 1.14 -1.61 -1.51 0.00 0.00 177.10 174.75 1dk0 s GLU 80 N -2.53 3.96 0.11 -0.60 8.01 -1.26 -2.46 118.70 123.94 1dk0 s GLU 80 Ca 0.60 1.72 -0.31 0.00 0.01 0.00 0.00 54.97 56.99 1dk0 s GLU 80 Cb -0.26 -2.53 -0.07 0.00 -4.31 0.00 0.00 34.13 26.96 1dk0 s GLU 80 CO 0.32 -0.37 1.29 -2.14 0.01 0.00 0.00 175.26 174.37 1dk0 s PRO 81 N -2.52 4.39 0.55 0.39 0.02 -1.26 -4.97 135.00 131.60 1dk0 s PRO 81 Ca 0.60 1.94 -0.21 0.00 0.02 0.00 0.00 61.00 63.35 1dk0 s PRO 81 Cb -0.27 -3.28 -0.05 0.00 0.02 0.00 0.00 34.50 30.92 1dk0 s PRO 81 CO 0.34 -0.31 1.26 0.00 -0.33 0.00 0.00 177.00 177.96 1dk0 s ALA 82 N 0.84 2.74 -1.27 -1.55 0.00 -1.03 -3.68 121.76 117.81 1dk0 s ALA 82 Ca 0.60 1.12 -0.04 0.00 0.00 0.00 0.00 51.96 53.65 1dk0 s ALA 82 Cb -0.34 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.31 1dk0 s ALA 82 CO 0.31 -1.14 1.04 0.72 0.00 0.00 0.00 175.76 176.69 1dk0 n HIS 83 N -1.13 -2.41 -4.60 0.00 8.25 0.53 -4.93 115.22 110.93 1dk0 n HIS 83 Ca 0.11 0.96 -0.33 0.00 -0.26 0.00 0.00 57.72 58.20 1dk0 n HIS 83 Cb 0.47 -4.98 -0.15 0.00 1.12 0.00 0.00 29.99 26.45 1dk0 n HIS 83 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1dk0 s THR 84 N -3.37 2.99 -0.19 1.59 2.01 -1.24 -4.93 115.64 112.50 1dk0 s THR 84 Ca 0.23 -0.67 -0.14 0.00 0.31 0.00 0.00 61.69 61.42 1dk0 s THR 84 Cb -0.10 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 1dk0 s THR 84 CO 0.74 0.51 0.31 -0.22 -0.69 0.00 0.00 174.62 175.27 1dk0 s LEU 85 N 0.61 4.18 0.23 4.42 2.96 -1.26 -0.94 118.68 128.88 1dk0 s LEU 85 Ca -0.07 0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 54.25 1dk0 s LEU 85 Cb -0.15 -2.38 -0.03 0.00 0.50 0.00 0.00 46.19 44.12 1dk0 s LEU 85 CO 0.03 0.02 0.22 -0.72 -1.32 0.00 0.00 176.35 174.58 1dk0 s TYR 86 N 0.92 1.10 -1.18 5.38 -0.85 -0.24 -2.90 117.35 119.58 1dk0 s TYR 86 Ca 0.16 -1.31 0.00 0.00 -0.52 0.00 0.00 57.07 55.40 1dk0 s TYR 86 Cb -0.14 -0.44 0.00 0.00 0.38 0.00 0.00 41.96 41.77 1dk0 s TYR 86 CO 0.06 -0.75 0.00 0.41 -1.52 0.00 0.00 175.55 173.75 1dk0 n GLY 87 N -0.35 0.38 3.10 5.49 0.00 -0.99 -1.60 105.19 111.22 1dk0 n GLY 87 Ca 0.02 -1.64 -0.33 0.00 0.00 0.00 0.00 46.02 44.07 1dk0 n GLY 87 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dk0 s GLN 88 N -1.14 2.70 -0.26 1.61 1.11 -0.51 -1.40 119.66 121.76 1dk0 s GLN 88 Ca 0.00 -1.03 -0.05 0.00 0.01 0.00 0.00 55.36 54.28 1dk0 s GLN 88 Cb 0.00 -2.70 0.00 0.00 -1.01 0.00 0.00 33.01 29.30 1dk0 s GLN 88 CO 0.00 -0.35 0.03 -1.17 0.01 0.00 0.00 175.29 173.81 1dk0 s LEU 89 N 1.22 3.48 -0.22 2.90 0.20 0.16 -0.84 118.68 125.58 1dk0 s LEU 89 Ca -0.00 -0.59 0.07 0.00 0.69 0.00 0.00 54.13 54.30 1dk0 s LEU 89 Cb -0.16 -1.82 -0.19 0.00 -0.43 0.00 0.00 46.19 43.59 1dk0 s LEU 89 CO -0.10 -0.12 -0.11 -0.67 -0.29 0.00 0.00 176.35 175.06 1dk0 n ASP 90 N 4.83 1.45 -4.07 3.68 -0.08 -0.12 -2.30 116.55 119.94 1dk0 n ASP 90 Ca -0.16 -0.08 -0.14 0.00 -1.51 0.00 0.00 54.79 52.91 1dk0 n ASP 90 Cb 0.49 0.13 -0.11 0.00 2.34 0.00 0.00 41.12 43.96 1dk0 n ASP 90 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1dk0 s SER 91 N -5.96 0.94 -0.03 1.67 1.04 -0.99 -1.62 113.70 108.75 1dk0 s SER 91 Ca -0.24 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 55.64 1dk0 s SER 91 Cb 0.07 0.03 0.03 0.00 0.10 0.00 0.00 66.02 66.25 1dk0 s SER 91 CO 0.64 -0.19 -0.00 -0.76 0.98 0.00 0.00 173.24 173.91 1dk0 s LEU 92 N -1.60 1.13 -0.03 2.42 2.01 -0.55 -0.96 118.68 121.10 1dk0 s LEU 92 Ca -0.09 -0.03 0.07 0.00 0.01 0.00 0.00 54.13 54.09 1dk0 s LEU 92 Cb -0.10 -0.24 -0.02 0.00 0.01 0.00 0.00 46.19 45.85 1dk0 s LEU 92 CO 0.01 -0.10 -0.24 -0.55 1.01 0.00 0.00 176.35 176.47 1dk0 s SER 93 N 1.07 2.85 -0.01 2.29 0.15 -0.28 -0.54 113.70 119.24 1dk0 s SER 93 Ca -0.09 -0.45 0.04 0.00 0.70 0.00 0.00 55.95 56.15 1dk0 s SER 93 Cb -0.13 -0.45 -0.01 0.00 -1.71 0.00 0.00 66.02 63.71 1dk0 s SER 93 CO -0.02 0.28 -0.14 -0.36 1.20 0.00 0.00 173.24 174.20 1dk0 s PHE 94 N -0.44 1.26 -2.57 3.44 0.40 -0.03 -0.97 117.98 119.06 1dk0 s PHE 94 Ca 0.06 -0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.15 1dk0 s PHE 94 Cb -0.10 -0.81 0.00 0.00 0.51 0.00 0.00 43.02 42.62 1dk0 s PHE 94 CO 0.00 -0.02 0.00 0.41 0.70 0.00 0.00 175.22 176.31 1dk0 n GLY 95 N 2.71 -0.57 3.46 4.36 0.00 -1.09 -0.77 105.19 113.29 1dk0 n GLY 95 Ca -0.14 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 1dk0 n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dk0 s ASP 96 N -4.00 3.97 0.00 1.61 1.01 -0.57 -0.73 116.67 117.95 1dk0 s ASP 96 Ca 0.00 -0.22 0.00 0.00 0.71 0.00 0.00 52.55 53.04 1dk0 s ASP 96 Cb 0.00 -0.87 0.00 0.00 1.01 0.00 0.00 42.92 43.06 1dk0 s ASP 96 CO 0.00 0.33 0.00 0.61 0.21 0.00 0.00 175.17 176.32 1dk0 n GLY 97 N 2.40 0.21 3.72 0.21 0.00 0.03 -0.94 105.19 110.82 1dk0 n GLY 97 Ca -0.17 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 1dk0 n GLY 97 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1dk0 s LEU 98 N -0.22 4.43 0.31 0.99 2.96 -1.26 -0.68 118.68 125.21 1dk0 s LEU 98 Ca 0.00 1.82 0.06 0.00 -0.22 0.00 0.00 54.13 55.78 1dk0 s LEU 98 Cb 0.00 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 43.05 1dk0 s LEU 98 CO 0.00 -0.22 -0.01 -0.94 -1.32 0.00 0.00 176.35 173.86 1dk0 s SER 99 N 0.52 2.72 0.15 3.68 1.04 -0.50 -4.96 113.70 116.36 1dk0 s SER 99 Ca 0.51 -1.28 0.00 0.00 0.48 0.00 0.00 55.95 55.66 1dk0 s SER 99 Cb -0.24 -0.16 0.00 0.00 0.10 0.00 0.00 66.02 65.72 1dk0 s SER 99 CO 0.30 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.68 1dk0 n GLY 100 N -0.66 -1.26 0.00 7.32 0.00 -1.26 -1.71 105.19 107.63 1dk0 n GLY 100 Ca -0.04 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1dk0 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dk0 n GLY 101 N 0.00 1.27 0.46 -0.02 0.00 0.42 -4.72 105.19 102.61 1dk0 n GLY 101 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1dk0 n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dk0 n ASP 102 N 0.00 0.00 0.06 1.61 9.92 -1.26 -4.45 116.55 122.43 1dk0 n ASP 102 Ca 0.00 0.00 0.12 0.00 -0.53 0.00 0.00 54.79 54.38 1dk0 n ASP 102 Cb 0.00 -0.12 0.18 0.00 -0.64 0.00 0.00 41.12 40.54 1dk0 n ASP 102 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1dk0 n THR 103 N -2.10 0.35 -4.30 -3.53 -1.04 -1.26 -4.82 114.28 97.58 1dk0 n THR 103 Ca 0.00 -0.27 -0.16 0.00 -2.04 0.00 0.00 64.05 61.58 1dk0 n THR 103 Cb 0.00 -0.13 -0.10 0.00 -1.82 0.00 0.00 70.33 68.28 1dk0 n THR 103 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1dk0 s SER 104 N -4.21 1.88 0.76 8.00 1.04 -1.26 -5.14 113.70 114.77 1dk0 s SER 104 Ca 0.06 -1.13 -0.15 0.00 0.48 0.00 0.00 55.95 55.21 1dk0 s SER 104 Cb 0.13 -0.01 0.05 0.00 0.10 0.00 0.00 66.02 66.30 1dk0 s SER 104 CO 0.72 -0.43 1.20 -2.65 0.98 0.00 0.00 173.24 173.06 1dk0 n PRO 105 N -0.34 0.44 -1.98 4.02 -0.02 -1.26 -0.44 135.00 135.42 1dk0 n PRO 105 Ca -0.07 0.22 -0.38 0.00 -2.02 0.00 0.00 63.50 61.25 1dk0 n PRO 105 Cb 0.62 -2.44 0.01 0.00 -0.02 0.00 0.00 33.50 31.67 1dk0 n PRO 105 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1dk0 s TYR 106 N -1.91 2.59 0.22 6.00 1.51 -1.26 -3.53 117.35 120.98 1dk0 s TYR 106 Ca 0.76 1.42 0.02 0.00 -1.01 0.00 0.00 57.07 58.26 1dk0 s TYR 106 Cb -0.32 -3.66 -0.01 0.00 -0.11 0.00 0.00 41.96 37.86 1dk0 s TYR 106 CO 0.48 -2.31 0.24 0.45 -1.11 0.00 0.00 175.55 173.30 1dk0 n SER 107 N -0.53 -0.65 -4.13 2.29 2.88 -0.69 -4.91 113.62 107.89 1dk0 n SER 107 Ca 0.07 -2.35 -0.29 0.00 -1.33 0.00 0.00 58.87 54.98 1dk0 n SER 107 Cb 0.45 1.34 -0.17 0.00 -0.75 0.00 0.00 64.21 65.08 1dk0 n SER 107 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1dk0 s ILE 108 N -2.80 1.64 0.11 2.46 -1.09 -1.26 -1.40 121.20 118.86 1dk0 s ILE 108 Ca 0.23 -0.77 0.02 0.00 -2.23 0.00 0.00 60.65 57.90 1dk0 s ILE 108 Cb 0.00 -1.45 -0.24 0.00 -1.58 0.00 0.00 42.46 39.20 1dk0 s ILE 108 CO 0.16 0.47 1.23 1.56 -1.23 0.00 0.00 174.94 177.13 1dk0 h GLN 109 N 6.89 0.12 -2.93 2.79 4.20 -0.82 -3.35 115.11 122.00 1dk0 h GLN 109 Ca -0.25 -0.20 -0.61 0.00 0.06 0.00 0.00 58.65 57.64 1dk0 h GLN 109 Cb 1.21 0.07 -0.41 0.00 0.30 0.00 0.00 27.48 28.66 1dk0 h GLN 109 CO 0.48 1.09 -0.69 0.08 -0.67 0.00 0.00 178.83 179.12 1dk0 s VAL 110 N -2.72 2.14 0.35 -0.54 1.01 -0.11 -5.03 120.40 115.49 1dk0 s VAL 110 Ca -0.01 -3.66 -0.26 0.00 0.00 0.00 0.00 61.98 58.05 1dk0 s VAL 110 Cb 0.09 -2.43 -0.09 0.00 0.00 0.00 0.00 36.38 33.95 1dk0 s VAL 110 CO 0.85 -1.03 1.02 -2.16 0.00 0.00 0.00 175.10 173.78 1dk0 s PRO 111 N -0.84 4.41 -0.19 2.72 0.04 -1.26 -1.51 135.00 138.37 1dk0 s PRO 111 Ca 0.25 1.51 -0.12 0.00 0.04 0.00 0.00 61.00 62.68 1dk0 s PRO 111 Cb -0.06 -2.77 -0.08 0.00 0.04 0.00 0.00 34.50 31.63 1dk0 s PRO 111 CO -0.14 0.08 -0.28 -0.25 0.04 0.00 0.00 177.00 176.45 1dk0 n ASP 112 N 0.42 1.57 -3.76 6.66 8.00 0.05 -4.70 116.55 124.79 1dk0 n ASP 112 Ca 0.03 0.27 -0.13 0.00 0.71 0.00 0.00 54.79 55.66 1dk0 n ASP 112 Cb 0.49 -0.64 -0.10 0.00 -0.02 0.00 0.00 41.12 40.85 1dk0 n ASP 112 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1dk0 s VAL 113 N -2.47 0.03 0.01 2.53 1.01 -1.13 -0.68 120.40 119.70 1dk0 s VAL 113 Ca -0.28 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1dk0 s VAL 113 Cb 0.09 -0.55 -0.01 0.00 0.00 0.00 0.00 36.38 35.92 1dk0 s VAL 113 CO 0.37 -0.12 -0.01 -0.94 0.00 0.00 0.00 175.10 174.39 1dk0 s SER 114 N -0.53 0.15 -0.09 3.32 1.04 0.05 -0.85 113.70 116.78 1dk0 s SER 114 Ca -0.06 -0.14 -0.01 0.00 0.48 0.00 0.00 55.95 56.22 1dk0 s SER 114 Cb -0.04 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 66.07 1dk0 s SER 114 CO 0.02 -0.07 -0.06 -0.36 0.98 0.00 0.00 173.24 173.75 1dk0 s PHE 115 N -0.39 2.96 0.22 5.02 0.40 0.29 -1.28 117.98 125.21 1dk0 s PHE 115 Ca -0.04 -0.09 0.03 0.00 -0.60 0.00 0.00 56.93 56.23 1dk0 s PHE 115 Cb -0.03 -1.79 -0.05 0.00 0.51 0.00 0.00 43.02 41.67 1dk0 s PHE 115 CO -0.00 0.21 -0.01 0.20 0.70 0.00 0.00 175.22 176.32 1dk0 s GLY 116 N -0.44 1.49 -1.10 4.36 0.00 -0.32 -1.48 107.32 109.83 1dk0 s GLY 116 Ca 0.07 -1.73 -0.01 0.00 0.00 0.00 0.00 44.72 43.05 1dk0 s GLY 116 CO 0.02 -1.64 0.13 0.61 0.00 0.00 0.00 173.10 172.21 1dk0 n GLY 117 N -0.38 -0.15 0.22 0.20 0.00 -0.64 -0.94 105.19 103.50 1dk0 n GLY 117 Ca -0.05 -0.28 -0.00 0.00 0.00 0.00 0.00 46.02 45.68 1dk0 n GLY 117 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1dk0 h LEU 118 N -0.29 0.29 -1.20 0.99 -0.00 -1.57 -3.32 115.31 110.21 1dk0 h LEU 118 Ca -0.33 -0.09 -0.46 0.00 -0.00 0.00 0.00 57.88 57.01 1dk0 h LEU 118 Cb 1.24 -0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 41.81 1dk0 h LEU 118 CO 0.37 0.54 -0.77 -3.20 -0.00 0.00 0.00 178.44 175.38 1dk0 n ASN 119 N -4.15 -3.88 -4.86 -0.43 5.15 -1.22 -4.95 115.26 100.91 1dk0 n ASN 119 Ca -0.01 -0.78 -0.37 0.00 -0.60 0.00 0.00 54.58 52.82 1dk0 n ASN 119 Cb 0.37 -3.98 -0.06 0.00 -0.53 0.00 0.00 39.78 35.58 1dk0 n ASN 119 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1dk0 s LEU 120 N -7.12 4.42 -0.08 1.20 1.43 -0.97 -4.98 118.68 112.57 1dk0 s LEU 120 Ca 0.48 0.65 -0.06 0.00 -1.03 0.00 0.00 54.13 54.17 1dk0 s LEU 120 Cb -0.24 -2.27 0.03 0.00 0.03 0.00 0.00 46.19 43.74 1dk0 s LEU 120 CO 0.82 0.38 0.21 -0.55 0.23 0.00 0.00 176.35 177.43 1dk0 s SER 121 N -1.07 -0.21 0.01 2.29 0.15 -1.26 -0.66 113.70 112.95 1dk0 s SER 121 Ca 0.18 0.43 -0.06 0.00 0.70 0.00 0.00 55.95 57.20 1dk0 s SER 121 Cb -0.14 0.38 -0.00 0.00 -1.71 0.00 0.00 66.02 64.55 1dk0 s SER 121 CO 0.08 -0.11 0.11 -0.55 1.20 0.00 0.00 173.24 173.97 1dk0 s SER 122 N 0.65 0.08 0.07 5.45 0.15 -0.49 -4.73 113.70 114.87 1dk0 s SER 122 Ca -0.04 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 56.31 1dk0 s SER 122 Cb -0.06 0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.41 1dk0 s SER 122 CO -0.04 -0.40 0.12 -0.76 1.20 0.00 0.00 173.24 173.37 1dk0 s LEU 123 N -1.56 4.00 0.28 3.45 1.02 -1.26 -2.35 118.68 122.26 1dk0 s LEU 123 Ca -0.13 0.10 0.00 0.00 0.02 0.00 0.00 54.13 54.13 1dk0 s LEU 123 Cb -0.06 -2.63 0.66 0.00 0.02 0.00 0.00 46.19 44.18 1dk0 s LEU 123 CO -0.00 0.18 1.65 -0.61 0.02 0.00 0.00 176.35 177.59 1dk0 h GLN 124 N 3.29 0.21 0.00 1.70 4.15 -1.95 -1.99 115.11 120.52 1dk0 h GLN 124 Ca -0.46 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.94 1dk0 h GLN 124 Cb 1.16 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.81 1dk0 h GLN 124 CO 0.69 0.14 0.00 0.00 -1.93 0.00 0.00 178.83 177.73 1dk0 h ALA 125 N 1.75 1.00 0.00 3.38 0.00 -1.94 -1.50 119.26 121.95 1dk0 h ALA 125 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1dk0 h ALA 125 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1dk0 h ALA 125 CO -0.64 0.00 0.00 1.96 0.00 0.00 0.00 179.25 180.57 1dk0 h GLN 126 N 0.00 0.00 0.00 0.00 4.20 -1.77 -3.48 115.11 114.06 1dk0 h GLN 126 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1dk0 h GLN 126 Cb 0.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1dk0 h GLN 126 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 1dk0 n GLY 127 N 0.29 3.15 0.00 3.46 0.00 -0.56 -2.29 105.19 109.23 1dk0 n GLY 127 Ca 0.03 -0.28 0.13 0.00 0.00 0.00 0.00 46.02 45.90 1dk0 n GLY 127 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1dk0 n HIS 128 N 14.00 0.00 1.46 1.61 8.25 -1.26 -2.41 115.22 136.87 1dk0 n HIS 128 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.60 1dk0 n HIS 128 Cb 0.00 -0.40 0.59 0.00 1.12 0.00 0.00 29.99 31.31 1dk0 n HIS 128 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1dk0 n ASP 129 N -1.40 0.68 -4.77 0.41 8.00 -0.97 -4.41 116.55 114.09 1dk0 n ASP 129 Ca 0.10 -0.82 -0.38 0.00 0.71 0.00 0.00 54.79 54.40 1dk0 n ASP 129 Cb 0.27 -0.02 -0.01 0.00 -0.02 0.00 0.00 41.12 41.34 1dk0 n ASP 129 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1dk0 s GLY 130 N -2.35 2.83 0.26 0.44 0.00 -1.01 -4.87 107.32 102.62 1dk0 s GLY 130 Ca 0.32 1.00 0.01 0.00 0.00 0.00 0.00 44.72 46.04 1dk0 s GLY 130 CO 0.45 1.49 1.69 -0.24 0.00 0.00 0.00 173.10 176.49 1dk0 h VAL 131 N 2.03 1.27 -0.48 1.40 3.04 -1.91 -1.11 116.25 120.48 1dk0 h VAL 131 Ca -0.49 -1.30 -0.05 0.00 -1.01 0.00 0.00 66.70 63.85 1dk0 h VAL 131 Cb 1.25 1.32 -0.02 0.00 -2.01 0.00 0.00 31.29 31.83 1dk0 h VAL 131 CO 0.61 0.42 0.10 -0.37 -1.01 0.00 0.00 177.57 177.31 1dk0 h VAL 132 N 0.49 1.24 -0.19 1.51 -1.51 -1.86 -1.05 116.25 114.88 1dk0 h VAL 132 Ca 0.07 -0.88 0.00 0.00 -1.23 0.00 0.00 66.70 64.66 1dk0 h VAL 132 Cb 0.69 0.88 -0.01 0.00 -2.13 0.00 0.00 31.29 30.73 1dk0 h VAL 132 CO 0.05 0.31 0.12 -0.74 -1.23 0.00 0.00 177.57 176.08 1dk0 h HIS 133 N 0.67 0.24 -0.73 5.19 6.17 -1.35 -1.79 115.15 123.55 1dk0 h HIS 133 Ca 0.15 0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.24 1dk0 h HIS 133 Cb 0.36 -0.08 -0.04 0.00 2.52 0.00 0.00 27.41 30.17 1dk0 h HIS 133 CO 0.02 0.18 0.49 1.96 0.71 0.00 0.00 177.93 181.29 1dk0 h GLN 134 N 0.24 0.96 0.11 5.26 4.20 -0.95 0.88 115.11 125.81 1dk0 h GLN 134 Ca 0.07 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1dk0 h GLN 134 Cb 0.00 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.57 1dk0 h GLN 134 CO -0.01 0.64 -0.05 0.28 -0.67 0.00 0.00 178.83 179.01 1dk0 h VAL 135 N 0.99 0.98 0.14 -0.54 2.07 -1.05 -1.65 116.25 117.19 1dk0 h VAL 135 Ca 0.27 -0.35 -0.31 0.00 0.82 0.00 0.00 66.70 67.13 1dk0 h VAL 135 Cb -0.12 1.21 0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1dk0 h VAL 135 CO -0.06 0.09 -1.28 0.58 0.02 0.00 0.00 177.57 176.92 1dk0 h VAL 136 N -0.31 1.28 -0.51 2.57 2.07 -1.19 -1.54 116.25 118.63 1dk0 h VAL 136 Ca -0.01 -2.50 -0.07 0.00 0.82 0.00 0.00 66.70 64.94 1dk0 h VAL 136 Cb 0.25 2.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.74 1dk0 h VAL 136 CO 0.02 0.76 0.05 0.22 0.02 0.00 0.00 177.57 178.64 1dk0 h TYR 137 N 0.26 0.88 -0.13 1.57 3.20 -0.92 -1.24 116.97 120.59 1dk0 h TYR 137 Ca -0.20 -0.11 0.04 0.00 3.14 0.00 0.00 58.73 61.60 1dk0 h TYR 137 Cb 1.95 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 39.93 1dk0 h TYR 137 CO 0.12 0.78 -0.15 0.78 -1.64 0.00 0.00 178.16 178.05 1dk0 h GLY 138 N 0.98 -0.07 1.12 1.82 0.00 -1.24 -2.26 103.07 103.41 1dk0 h GLY 138 Ca 0.16 0.18 0.03 0.00 0.00 0.00 0.00 47.33 47.69 1dk0 h GLY 138 CO 0.01 -0.15 0.54 1.41 0.00 0.00 0.00 176.54 178.36 1dk0 h LEU 139 N -0.18 0.90 -2.08 3.11 3.38 -0.73 0.57 115.31 120.28 1dk0 h LEU 139 Ca 0.09 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1dk0 h LEU 139 Cb 0.32 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1dk0 h LEU 139 CO -0.24 0.63 -0.03 0.24 0.09 0.00 0.00 178.44 179.13 1dk0 h MET 140 N 1.05 0.00 -0.54 1.13 2.86 -0.91 -1.49 114.93 117.03 1dk0 h MET 140 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 1dk0 h MET 140 Cb -0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1dk0 h MET 140 CO -0.09 0.03 0.00 0.43 1.06 0.00 0.00 176.91 178.35 1dk0 n SER 141 N -4.26 3.19 -2.03 1.22 7.64 -0.46 -1.61 113.62 117.31 1dk0 n SER 141 Ca -0.03 -1.98 -0.17 0.00 1.01 0.00 0.00 58.87 57.70 1dk0 n SER 141 Cb 0.12 -0.36 -0.01 0.00 -1.01 0.00 0.00 64.21 62.95 1dk0 n SER 141 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dk0 n GLY 142 N 1.46 -0.35 3.11 0.23 0.00 -0.56 -4.57 105.19 104.50 1dk0 n GLY 142 Ca 0.20 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1dk0 n GLY 142 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dk0 s ASP 143 N -2.25 4.82 0.00 1.61 -1.08 0.07 -4.88 116.67 114.95 1dk0 s ASP 143 Ca 0.02 -1.60 0.15 0.00 -0.52 0.00 0.00 52.55 50.59 1dk0 s ASP 143 Cb -0.01 -1.68 0.56 0.00 -1.46 0.00 0.00 42.92 40.34 1dk0 s ASP 143 CO 0.02 -0.31 1.41 0.41 0.52 0.00 0.00 175.17 177.22 1dk0 n THR 144 N 4.50 0.25 -0.11 1.71 -1.04 -1.26 -3.44 114.28 114.88 1dk0 n THR 144 Ca -0.08 -0.31 -0.08 0.00 -2.04 0.00 0.00 64.05 61.54 1dk0 n THR 144 Cb 0.42 0.20 0.00 0.00 -1.82 0.00 0.00 70.33 69.13 1dk0 n THR 144 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1dk0 h GLY 145 N 5.25 0.51 1.28 3.41 0.00 -1.94 0.52 103.07 112.10 1dk0 h GLY 145 Ca 0.00 -0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.09 1dk0 h GLY 145 CO 0.00 0.14 0.02 0.00 0.00 0.00 0.00 176.54 176.70 1dk0 h ALA 146 N 1.16 1.05 -0.54 3.60 0.00 -1.85 -0.91 119.26 121.78 1dk0 h ALA 146 Ca 0.14 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1dk0 h ALA 146 Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1dk0 h ALA 146 CO -0.07 0.60 0.10 1.25 0.00 0.00 0.00 179.25 181.13 1dk0 h LEU 147 N 0.81 0.84 -0.68 0.00 6.46 -1.75 -1.05 115.31 119.94 1dk0 h LEU 147 Ca 0.16 -0.25 -0.03 0.00 -0.12 0.00 0.00 57.88 57.64 1dk0 h LEU 147 Cb 0.46 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.14 1dk0 h LEU 147 CO 0.02 0.87 0.30 -0.33 -0.62 0.00 0.00 178.44 178.68 1dk0 h GLU 148 N 0.77 1.00 -0.66 1.25 5.08 -0.49 0.16 114.58 121.68 1dk0 h GLU 148 Ca 0.16 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1dk0 h GLU 148 Cb 0.38 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1dk0 h GLU 148 CO 0.01 0.81 0.32 1.15 -1.00 0.00 0.00 179.01 180.30 1dk0 h THR 149 N 0.96 1.22 -0.75 1.13 2.02 -1.00 -0.72 112.91 115.77 1dk0 h THR 149 Ca 0.23 -0.62 -0.05 0.00 0.77 0.00 0.00 66.41 66.74 1dk0 h THR 149 Cb 0.16 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 1dk0 h THR 149 CO -0.02 0.26 0.27 0.00 0.37 0.00 0.00 175.52 176.39 1dk0 h ALA 150 N 1.15 1.06 -0.11 6.16 0.00 -0.75 -2.69 119.26 124.08 1dk0 h ALA 150 Ca 0.23 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 1dk0 h ALA 150 Cb 0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1dk0 h ALA 150 CO -0.03 0.65 -0.61 -0.07 0.00 0.00 0.00 179.25 179.20 1dk0 h LEU 151 N 1.10 0.43 -1.24 0.00 3.38 -0.23 -2.54 115.31 116.21 1dk0 h LEU 151 Ca 0.25 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1dk0 h LEU 151 Cb 0.25 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1dk0 h LEU 151 CO -0.02 0.94 0.51 0.78 0.09 0.00 0.00 178.44 180.75 1dk0 h ASN 152 N 0.28 0.88 -0.88 -0.43 2.35 -1.00 0.14 115.58 116.92 1dk0 h ASN 152 Ca -0.01 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 1dk0 h ASN 152 Cb 1.14 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 39.25 1dk0 h ASN 152 CO 0.10 0.63 0.49 1.23 -1.65 0.00 0.00 177.43 178.23 1dk0 h GLY 153 N 1.03 1.31 1.00 2.83 0.00 -1.13 -1.68 103.07 106.44 1dk0 h GLY 153 Ca 0.29 -0.59 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 1dk0 h GLY 153 CO -0.07 0.57 -0.36 -2.22 0.00 0.00 0.00 176.54 174.46 1dk0 h ILE 154 N 1.23 1.30 0.00 2.60 2.04 -1.05 -3.30 117.51 120.34 1dk0 h ILE 154 Ca 0.31 -1.55 0.00 0.00 1.00 0.00 0.00 64.86 64.63 1dk0 h ILE 154 Cb 0.02 1.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 1dk0 h ILE 154 CO -0.05 0.50 -0.14 -0.07 0.00 0.00 0.00 178.15 178.38 1dk0 h LEU 155 N 0.48 0.00 -1.84 1.44 3.38 -0.77 -3.09 115.31 114.91 1dk0 h LEU 155 Ca 0.03 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1dk0 h LEU 155 Cb 0.95 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1dk0 h LEU 155 CO 0.09 0.01 -0.09 -0.78 0.09 0.00 0.00 178.44 177.76 1dk0 h ASP 156 N 0.00 0.00 0.38 -0.43 1.82 -1.36 0.12 116.42 116.95 1dk0 h ASP 156 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1dk0 h ASP 156 Cb 0.85 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.86 1dk0 h ASP 156 CO 0.00 0.09 0.00 0.44 -1.61 0.00 0.00 179.24 178.16 1dk0 h ASP 157 N 0.00 0.00 -0.02 2.28 3.45 -1.73 -2.01 116.42 118.39 1dk0 h ASP 157 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1dk0 h ASP 157 Cb 0.16 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.93 1dk0 h ASP 157 CO 0.01 0.00 -0.08 -1.22 -1.57 0.00 0.00 179.24 176.39 1dk0 n TYR 158 N -2.84 0.00 -1.51 4.55 4.02 -0.35 -4.97 117.16 116.06 1dk0 n TYR 158 Ca -0.01 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.77 1dk0 n TYR 158 Cb 0.15 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.43 1dk0 n TYR 158 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1dk0 n GLY 159 N 0.86 0.91 1.29 2.72 0.00 -0.76 -5.03 105.19 105.18 1dk0 n GLY 159 Ca 0.07 -0.52 -0.08 0.00 0.00 0.00 0.00 46.02 45.49 1dk0 n GLY 159 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dk0 n LEU 160 N -1.28 0.00 0.00 0.99 4.77 -0.12 -4.96 117.00 116.40 1dk0 n LEU 160 Ca -0.11 -0.94 -0.06 0.00 -0.03 0.00 0.00 56.01 54.87 1dk0 n LEU 160 Cb 0.41 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.47 1dk0 n LEU 160 CO 0.16 -0.41 0.30 -1.54 -1.33 0.00 0.00 177.39 174.57 1dk0 n SER 161 N -2.15 -1.35 0.00 -1.43 3.41 -1.26 -3.58 113.62 107.25 1dk0 n SER 161 Ca 0.01 -2.00 0.07 0.00 -0.26 0.00 0.00 58.87 56.68 1dk0 n SER 161 Cb 0.21 2.27 0.30 0.00 -0.26 0.00 0.00 64.21 66.73 1dk0 n SER 161 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1dk0 n VAL 162 N -0.33 1.04 1.51 -3.33 0.24 -1.26 -1.28 118.33 114.92 1dk0 n VAL 162 Ca -0.05 0.26 0.15 0.00 -2.04 0.00 0.00 64.34 62.66 1dk0 n VAL 162 Cb 0.37 -1.02 0.77 0.00 -1.47 0.00 0.00 33.84 32.48 1dk0 n VAL 162 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1dk0 n ASN 163 N -1.49 0.07 -4.78 -1.34 3.02 -1.26 -1.17 115.26 108.31 1dk0 n ASN 163 Ca 0.03 -0.34 -0.37 0.00 -0.03 0.00 0.00 54.58 53.87 1dk0 n ASN 163 Cb 0.16 -0.21 -0.04 0.00 -0.61 0.00 0.00 39.78 39.08 1dk0 n ASN 163 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1dk0 s SER 164 N -2.47 6.75 0.81 6.41 0.01 -0.40 -4.78 113.70 120.03 1dk0 s SER 164 Ca 0.32 2.11 -0.12 0.00 1.31 0.00 0.00 55.95 59.56 1dk0 s SER 164 Cb 0.21 -2.59 0.08 0.00 0.21 0.00 0.00 66.02 63.92 1dk0 s SER 164 CO 0.45 -0.50 1.14 0.42 0.41 0.00 0.00 173.24 175.16 1dk0 s THR 165 N -1.58 2.49 0.22 1.44 -4.23 -1.26 -2.12 115.64 110.60 1dk0 s THR 165 Ca 0.57 0.16 -0.05 0.00 -1.18 0.00 0.00 61.69 61.18 1dk0 s THR 165 Cb -0.24 -3.05 0.09 0.00 1.34 0.00 0.00 72.50 70.65 1dk0 s THR 165 CO 0.30 -0.21 1.71 -0.26 -0.54 0.00 0.00 174.62 175.62 1dk0 h PHE 166 N -1.10 1.01 -0.23 3.99 -1.00 -1.24 -0.90 116.94 117.47 1dk0 h PHE 166 Ca -0.47 -0.15 -0.09 0.00 2.81 0.00 0.00 57.97 60.06 1dk0 h PHE 166 Cb 1.30 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 40.58 1dk0 h PHE 166 CO 0.37 0.90 -0.25 -0.44 -1.61 0.00 0.00 178.31 177.28 1dk0 h ASP 167 N 0.87 0.43 -0.43 2.17 3.32 -1.59 0.02 116.42 121.21 1dk0 h ASP 167 Ca 0.16 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 1dk0 h ASP 167 Cb 0.50 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 1dk0 h ASP 167 CO 0.02 0.68 0.16 1.56 -1.72 0.00 0.00 179.24 179.94 1dk0 h GLN 168 N 0.38 0.65 -0.62 3.56 4.20 -1.68 -2.25 115.11 119.35 1dk0 h GLN 168 Ca 0.06 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 1dk0 h GLN 168 Cb 0.65 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.30 1dk0 h GLN 168 CO 0.05 0.61 0.21 0.28 -0.67 0.00 0.00 178.83 179.31 1dk0 h VAL 169 N 0.55 1.24 -0.76 -0.54 2.07 -0.83 -2.65 116.25 115.34 1dk0 h VAL 169 Ca 0.14 -0.80 0.03 0.00 0.82 0.00 0.00 66.70 66.88 1dk0 h VAL 169 Cb 0.22 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 1dk0 h VAL 169 CO -0.01 0.31 0.48 0.00 0.02 0.00 0.00 177.57 178.37 1dk0 h ALA 170 N 1.07 0.99 0.00 1.67 0.00 -0.93 -1.30 119.26 120.76 1dk0 h ALA 170 Ca 0.20 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1dk0 h ALA 170 Cb 0.27 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1dk0 h ALA 170 CO -0.01 0.29 -0.31 0.00 0.00 0.00 0.00 179.25 179.22 1dk0 h ALA 171 N 1.31 1.42 0.00 0.00 0.00 -1.27 -1.52 119.26 119.21 1dk0 h ALA 171 Ca 0.30 -0.29 -0.17 0.00 0.00 0.00 0.00 54.91 54.76 1dk0 h ALA 171 Cb -0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1dk0 h ALA 171 CO -0.10 0.39 -1.03 0.00 0.00 0.00 0.00 179.25 178.51 1dk0 h ALA 172 N 1.69 0.62 -0.00 0.00 0.00 -1.07 -3.38 119.26 117.11 1dk0 h ALA 172 Ca -0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.13 1dk0 h ALA 172 Cb 0.57 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1dk0 h ALA 172 CO 0.04 0.94 -0.38 0.25 0.00 0.00 0.00 179.25 180.10 1dk0 n THR 173 N -3.12 0.00 -0.57 0.00 -2.24 -0.54 -5.09 114.28 102.72 1dk0 n THR 173 Ca -0.04 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1dk0 n THR 173 Cb 0.84 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 70.08 1dk0 n THR 173 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50