#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1be1 n GLU 2 N 0.00 4.77 -2.75 2.12 2.13 -1.26 -4.42 120.64 121.23 1be1 n GLU 2 Ca 0.00 -4.14 -0.35 0.00 0.66 0.00 0.00 57.16 53.33 1be1 n GLU 2 Cb 0.00 -2.59 -0.06 0.00 0.27 0.00 0.00 31.44 29.06 1be1 n GLU 2 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1be1 s LYS 3 N -2.48 4.32 -0.40 5.31 1.02 -1.26 -4.99 119.74 121.25 1be1 s LYS 3 Ca 0.42 1.26 0.10 0.00 0.02 0.00 0.00 55.97 57.77 1be1 s LYS 3 Cb 0.15 -2.44 0.43 0.00 -0.52 0.00 0.00 37.83 35.46 1be1 s LYS 3 CO -0.05 0.04 1.05 0.36 -0.92 0.00 0.00 175.35 175.83 1be1 n LYS 4 N -0.17 2.61 -3.42 1.68 -0.00 -1.26 -4.94 118.16 112.67 1be1 n LYS 4 Ca 0.05 -4.06 -0.21 0.00 -0.00 0.00 0.00 58.31 54.09 1be1 n LYS 4 Cb 0.52 -1.89 -0.10 0.00 -0.00 0.00 0.00 35.03 33.56 1be1 n LYS 4 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1be1 s THR 5 N -4.67 -0.22 -0.14 0.58 -4.23 -1.26 -1.87 115.64 103.82 1be1 s THR 5 Ca 0.41 -0.92 -0.00 0.00 -1.18 0.00 0.00 61.69 59.99 1be1 s THR 5 Cb 0.42 -0.91 -0.01 0.00 1.34 0.00 0.00 72.50 73.34 1be1 s THR 5 CO -0.11 -0.65 -0.12 0.27 -0.54 0.00 0.00 174.62 173.47 1be1 s ILE 6 N 1.78 3.05 -0.06 2.99 -5.25 -1.12 -2.01 121.20 120.58 1be1 s ILE 6 Ca 0.13 -0.66 0.02 0.00 -0.99 0.00 0.00 60.65 59.16 1be1 s ILE 6 Cb -0.16 -2.29 0.02 0.00 2.95 0.00 0.00 42.46 42.97 1be1 s ILE 6 CO -0.18 0.52 -0.10 0.54 -1.79 0.00 0.00 174.94 173.93 1be1 s VAL 7 N 0.49 0.97 0.05 8.37 0.11 -0.98 -2.76 120.40 126.65 1be1 s VAL 7 Ca -0.09 -0.38 0.07 0.00 -2.93 0.00 0.00 61.98 58.66 1be1 s VAL 7 Cb -0.16 -0.91 -0.03 0.00 -1.53 0.00 0.00 36.38 33.76 1be1 s VAL 7 CO 0.04 0.32 -0.21 -0.22 -3.33 0.00 0.00 175.10 171.71 1be1 s LEU 8 N 0.77 2.17 0.00 2.54 0.20 -1.05 -1.49 118.68 121.82 1be1 s LEU 8 Ca -0.13 -0.53 0.02 0.00 0.69 0.00 0.00 54.13 54.18 1be1 s LEU 8 Cb -0.15 -0.96 -0.01 0.00 -0.43 0.00 0.00 46.19 44.64 1be1 s LEU 8 CO 0.02 0.15 0.08 0.61 -0.29 0.00 0.00 176.35 176.92 1be1 n GLY 9 N 1.81 3.41 7.00 7.98 0.00 -0.54 -1.73 105.19 123.13 1be1 n GLY 9 Ca -0.17 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.62 1be1 n GLY 9 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1be1 n VAL 10 N -1.04 0.00 0.00 1.61 0.31 -0.85 -2.85 118.33 115.51 1be1 n VAL 10 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 1be1 n VAL 10 Cb 0.60 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.53 1be1 n VAL 10 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1be1 n ILE 11 N 0.00 0.00 0.00 2.52 2.08 -1.14 -4.85 119.36 117.97 1be1 n ILE 11 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1be1 n ILE 11 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 1be1 n ILE 11 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1be1 n GLY 12 N 5.00 -1.24 3.57 7.39 0.00 -1.26 -4.84 105.19 113.81 1be1 n GLY 12 Ca 0.00 -2.00 -0.40 0.00 0.00 0.00 0.00 46.02 43.62 1be1 n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1be1 s SER 13 N -4.00 5.61 0.00 1.61 0.01 -1.26 -4.01 113.70 111.65 1be1 s SER 13 Ca 0.00 0.63 0.00 0.00 1.31 0.00 0.00 55.95 57.89 1be1 s SER 13 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1be1 s SER 13 CO 0.00 -2.06 0.00 0.47 0.41 0.00 0.00 173.24 172.06 1be1 n ASP 14 N 11.47 0.00 -0.96 2.44 8.00 -1.23 -4.96 116.55 131.31 1be1 n ASP 14 Ca 0.20 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.70 1be1 n ASP 14 Cb 0.50 0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.72 1be1 n ASP 14 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1be1 n HIS 16 N 0.45 2.51 -3.13 0.00 1.44 -1.26 -4.65 115.22 110.57 1be1 n HIS 16 Ca 0.00 -2.34 -0.14 0.00 -2.01 0.00 0.00 57.72 53.23 1be1 n HIS 16 Cb 0.00 -1.33 0.07 0.00 0.12 0.00 0.00 29.99 28.85 1be1 n HIS 16 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1be1 n ALA 17 N 0.24 -1.95 0.08 1.59 0.00 -1.26 -4.93 120.51 114.29 1be1 n ALA 17 Ca 0.52 0.02 -0.05 0.00 0.00 0.00 0.00 53.44 53.94 1be1 n ALA 17 Cb 0.32 -3.43 -0.03 0.00 0.00 0.00 0.00 19.45 16.31 1be1 n ALA 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1be1 h VAL 18 N -1.33 1.62 -1.32 0.00 2.07 -1.89 -3.48 116.25 111.91 1be1 h VAL 18 Ca -0.52 -3.03 0.00 0.00 0.82 0.00 0.00 66.70 63.97 1be1 h VAL 18 Cb 1.28 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 33.69 1be1 h VAL 18 CO 0.41 0.86 0.00 0.61 0.02 0.00 0.00 177.57 179.47 1be1 n GLY 19 N 1.04 0.77 1.22 2.17 0.00 -1.26 -4.99 105.19 104.14 1be1 n GLY 19 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1be1 n GLY 19 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1be1 n ASN 20 N 0.55 0.18 0.00 1.61 3.02 -1.26 -5.16 115.26 114.20 1be1 n ASN 20 Ca 0.00 0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 1be1 n ASN 20 Cb 0.48 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 1be1 n ASN 20 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1be1 n LYS 21 N -2.71 0.00 -0.00 3.52 0.00 -1.26 -5.02 118.16 112.69 1be1 n LYS 21 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.34 1be1 n LYS 21 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 35.03 34.99 1be1 n LYS 21 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 1be1 n ILE 22 N 0.00 0.00 -1.94 0.58 0.13 -1.26 -4.84 119.36 112.02 1be1 n ILE 22 Ca 0.00 -0.18 -0.01 0.00 -1.10 0.00 0.00 62.75 61.46 1be1 n ILE 22 Cb 0.00 0.52 0.01 0.00 -0.84 0.00 0.00 39.64 39.33 1be1 n ILE 22 CO 0.00 0.00 0.00 -0.11 2.80 0.00 0.00 176.55 179.24 1be1 n LEU 23 N -1.56 -2.23 -4.34 9.51 7.94 -1.26 -3.41 117.00 121.65 1be1 n LEU 23 Ca -0.01 -0.06 -0.44 0.00 -1.11 0.00 0.00 56.01 54.40 1be1 n LEU 23 Cb 0.12 -0.73 0.00 0.00 0.53 0.00 0.00 43.42 43.35 1be1 n LEU 23 CO 0.11 0.02 1.12 -0.67 -1.11 0.00 0.00 177.39 176.86 1be1 n ASP 24 N -1.36 5.45 -2.42 1.96 2.03 -1.26 -4.21 116.55 116.73 1be1 n ASP 24 Ca -0.02 -3.05 -0.03 0.00 0.52 0.00 0.00 54.79 52.21 1be1 n ASP 24 Cb 0.51 -1.45 0.04 0.00 -0.72 0.00 0.00 41.12 39.50 1be1 n ASP 24 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 1be1 n HIS 25 N 3.81 -1.02 0.00 -0.67 -0.00 -1.26 -4.90 115.22 111.18 1be1 n HIS 25 Ca 0.30 -0.98 0.00 0.00 0.46 0.00 0.00 57.72 57.50 1be1 n HIS 25 Cb 0.40 1.20 0.00 0.00 -0.12 0.00 0.00 29.99 31.47 1be1 n HIS 25 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1be1 n SER 26 N -0.60 0.00 0.00 0.26 7.64 -1.26 -4.76 113.62 114.90 1be1 n SER 26 Ca -0.15 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.73 1be1 n SER 26 Cb 0.70 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.90 1be1 n SER 26 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1be1 n PHE 27 N -0.21 0.00 0.07 1.43 7.35 -1.26 -4.61 117.46 120.23 1be1 n PHE 27 Ca 0.00 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.61 1be1 n PHE 27 Cb 0.00 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 39.77 1be1 n PHE 27 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 1be1 h THR 28 N 0.00 0.51 0.00 -2.13 1.35 -1.94 -3.43 112.91 107.26 1be1 h THR 28 Ca 0.00 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 1be1 h THR 28 Cb 0.00 0.87 0.00 0.00 -1.73 0.00 0.00 68.15 67.29 1be1 h THR 28 CO 0.00 0.14 0.00 -3.20 -0.25 0.00 0.00 175.52 172.21 1be1 n ASN 29 N -4.95 0.00 -0.92 5.36 5.15 -1.26 -1.44 115.26 117.20 1be1 n ASN 29 Ca -0.06 0.00 0.08 0.00 -0.60 0.00 0.00 54.58 54.00 1be1 n ASN 29 Cb 0.22 0.00 0.26 0.00 -0.53 0.00 0.00 39.78 39.73 1be1 n ASN 29 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1be1 n ALA 30 N 0.67 2.96 -3.27 5.20 0.00 -1.26 -4.94 120.51 119.87 1be1 n ALA 30 Ca 0.00 -2.16 -0.20 0.00 0.00 0.00 0.00 53.44 51.08 1be1 n ALA 30 Cb 0.00 -0.71 0.06 0.00 0.00 0.00 0.00 19.45 18.80 1be1 n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1be1 n GLY 31 N -0.33 -0.32 2.23 0.00 0.00 -0.52 -5.02 105.19 101.23 1be1 n GLY 31 Ca 0.21 0.07 -0.11 0.00 0.00 0.00 0.00 46.02 46.19 1be1 n GLY 31 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1be1 n PHE 32 N -4.53 -2.62 -2.22 1.61 1.16 -1.15 -5.01 117.46 104.69 1be1 n PHE 32 Ca -0.02 -1.20 -0.43 0.00 -1.87 0.00 0.00 57.45 53.93 1be1 n PHE 32 Cb 0.57 -0.32 -0.02 0.00 -1.61 0.00 0.00 39.48 38.09 1be1 n PHE 32 CO 0.00 0.00 0.00 1.21 -1.87 0.00 0.00 176.76 176.10 1be1 s ASN 33 N -3.07 6.44 -0.33 5.98 2.47 -0.78 -4.87 114.94 120.77 1be1 s ASN 33 Ca 0.35 1.42 -0.13 0.00 0.42 0.00 0.00 52.86 54.92 1be1 s ASN 33 Cb -0.03 -2.53 -0.02 0.00 -1.45 0.00 0.00 41.25 37.22 1be1 s ASN 33 CO 0.22 -1.24 0.23 -0.69 -3.72 0.00 0.00 177.10 171.91 1be1 s VAL 34 N 5.04 5.25 0.04 -5.21 1.01 -1.26 -2.79 120.40 122.49 1be1 s VAL 34 Ca 0.66 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1be1 s VAL 34 Cb -0.21 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1be1 s VAL 34 CO 0.28 0.02 -0.04 -0.69 0.00 0.00 0.00 175.10 174.66 1be1 s VAL 35 N 1.72 0.30 -0.11 2.92 1.01 -1.11 -5.07 120.40 120.06 1be1 s VAL 35 Ca 0.06 -1.36 -0.02 0.00 0.00 0.00 0.00 61.98 60.66 1be1 s VAL 35 Cb -0.17 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 1be1 s VAL 35 CO 0.10 -0.69 -0.03 0.54 0.00 0.00 0.00 175.10 175.03 1be1 s ASN 36 N -2.15 4.95 -0.14 3.32 2.20 -1.26 -2.54 114.94 119.32 1be1 s ASN 36 Ca -0.04 0.00 -0.11 0.00 -0.94 0.00 0.00 52.86 51.77 1be1 s ASN 36 Cb -0.02 -1.53 -0.25 0.00 -2.00 0.00 0.00 41.25 37.46 1be1 s ASN 36 CO -0.04 0.29 0.34 -0.29 -2.94 0.00 0.00 177.10 174.46 1be1 h ILE 37 N 4.56 0.72 0.00 0.54 6.09 -1.67 -3.47 117.51 124.28 1be1 h ILE 37 Ca -0.43 -2.31 0.00 0.00 -1.37 0.00 0.00 64.86 60.76 1be1 h ILE 37 Cb 1.19 2.44 0.00 0.00 0.47 0.00 0.00 36.82 40.92 1be1 h ILE 37 CO 0.58 0.74 0.00 0.61 -3.07 0.00 0.00 178.15 177.00 1be1 n GLY 38 N 1.83 1.16 3.68 8.18 0.00 -1.26 -4.96 105.19 113.83 1be1 n GLY 38 Ca -0.32 -2.16 -0.30 0.00 0.00 0.00 0.00 46.02 43.24 1be1 n GLY 38 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1be1 s VAL 39 N -1.12 1.68 0.00 1.61 -7.23 -1.26 -2.01 120.40 112.07 1be1 s VAL 39 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.17 1be1 s VAL 39 Cb 0.00 -2.63 0.00 0.00 0.56 0.00 0.00 36.38 34.31 1be1 s VAL 39 CO 0.00 0.00 0.00 -0.11 -0.31 0.00 0.00 175.10 174.68 1be1 n LEU 40 N -4.54 0.00 0.00 1.32 7.94 -1.26 -4.47 117.00 115.99 1be1 n LEU 40 Ca 0.15 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.05 1be1 n LEU 40 Cb 0.60 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.55 1be1 n LEU 40 CO 0.44 0.00 0.00 -0.24 -1.11 0.00 0.00 177.39 176.48 1be1 n SER 41 N 8.87 0.00 -2.34 1.96 2.88 -1.26 -4.41 113.62 119.32 1be1 n SER 41 Ca 0.00 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.40 1be1 n SER 41 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 1be1 n SER 41 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1be1 n SER 42 N 0.00 -0.56 0.02 -3.46 3.41 -1.26 -4.76 113.62 107.01 1be1 n SER 42 Ca 0.00 -0.20 0.05 0.00 -0.26 0.00 0.00 58.87 58.46 1be1 n SER 42 Cb 0.00 -0.32 0.46 0.00 -0.26 0.00 0.00 64.21 64.09 1be1 n SER 42 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1be1 h GLN 43 N 5.85 0.45 -0.21 4.33 -0.00 -1.92 -0.07 115.11 123.53 1be1 h GLN 43 Ca 0.01 -0.03 -0.04 0.00 -0.00 0.00 0.00 58.65 58.59 1be1 h GLN 43 Cb 0.61 -0.10 -0.01 0.00 0.00 0.00 0.00 27.48 27.98 1be1 h GLN 43 CO 0.82 0.30 -0.02 1.05 0.00 0.00 0.00 178.83 180.98 1be1 h GLU 44 N 0.47 0.39 0.00 1.69 4.11 -1.93 0.22 114.58 119.52 1be1 h GLU 44 Ca 0.15 -0.13 -0.03 0.00 0.07 0.00 0.00 59.36 59.41 1be1 h GLU 44 Cb 0.02 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 1be1 h GLU 44 CO -0.03 0.60 -0.15 -0.44 0.07 0.00 0.00 179.01 179.06 1be1 h ASP 45 N 0.14 0.00 -0.25 3.06 3.32 -1.85 -2.36 116.42 118.49 1be1 h ASP 45 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1be1 h ASP 45 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1be1 h ASP 45 CO 0.01 0.15 0.00 0.49 -1.72 0.00 0.00 179.24 178.17 1be1 n PHE 46 N -3.15 0.32 -0.00 4.55 3.72 -0.07 -2.67 117.46 120.15 1be1 n PHE 46 Ca 0.03 -0.16 -0.10 0.00 -0.05 0.00 0.00 57.45 57.17 1be1 n PHE 46 Cb 0.56 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.96 1be1 n PHE 46 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1be1 h ILE 47 N 2.27 0.98 0.00 4.37 2.10 -0.01 -2.05 117.51 125.17 1be1 h ILE 47 Ca 0.00 -2.78 -0.14 0.00 1.08 0.00 0.00 64.86 63.02 1be1 h ILE 47 Cb 0.51 2.51 -0.02 0.00 -1.09 0.00 0.00 36.82 38.73 1be1 h ILE 47 CO 0.00 0.62 -0.66 0.78 -1.08 0.00 0.00 178.15 177.81 1be1 h ASN 48 N 0.01 0.00 0.13 2.19 4.21 -1.55 -1.87 115.58 118.69 1be1 h ASN 48 Ca -0.25 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.26 1be1 h ASN 48 Cb 1.98 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 39.18 1be1 h ASN 48 CO 0.09 0.66 -0.07 0.00 -1.29 0.00 0.00 177.43 176.82 1be1 n ALA 49 N -2.37 2.73 0.69 -0.83 0.00 -1.15 -2.43 120.51 117.15 1be1 n ALA 49 Ca -0.00 -0.35 0.12 0.00 0.00 0.00 0.00 53.44 53.21 1be1 n ALA 49 Cb 0.68 -1.27 0.19 0.00 0.00 0.00 0.00 19.45 19.06 1be1 n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1be1 n ALA 50 N -0.47 3.11 0.09 0.00 0.00 -0.72 -1.99 120.51 120.53 1be1 n ALA 50 Ca 0.17 -0.28 -0.13 0.00 0.00 0.00 0.00 53.44 53.20 1be1 n ALA 50 Cb 0.29 -1.15 -0.10 0.00 0.00 0.00 0.00 19.45 18.50 1be1 n ALA 50 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1be1 h ILE 51 N 0.00 1.51 0.00 0.00 2.04 -1.30 -0.13 117.51 119.62 1be1 h ILE 51 Ca 0.00 -2.92 0.00 0.00 1.00 0.00 0.00 64.86 62.94 1be1 h ILE 51 Cb 0.68 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.51 1be1 h ILE 51 CO 0.00 0.85 0.00 1.21 0.00 0.00 0.00 178.15 180.21 1be1 n GLU 52 N -3.57 0.00 -0.01 2.37 2.13 -1.19 -4.55 120.64 115.82 1be1 n GLU 52 Ca -0.06 0.43 -0.00 0.00 0.66 0.00 0.00 57.16 58.19 1be1 n GLU 52 Cb 0.94 -1.31 -0.00 0.00 0.27 0.00 0.00 31.44 31.34 1be1 n GLU 52 CO 0.00 0.00 0.00 1.79 -0.41 0.00 0.00 177.13 178.51 1be1 h THR 53 N 0.00 0.00 -1.83 6.31 1.35 -1.54 -3.48 112.91 113.72 1be1 h THR 53 Ca 0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 1be1 h THR 53 Cb 0.00 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.42 1be1 h THR 53 CO 0.00 0.00 0.00 1.17 -0.25 0.00 0.00 175.52 176.44 1be1 n LYS 54 N -2.60 0.00 -1.82 4.72 4.81 -0.06 -4.97 118.16 118.25 1be1 n LYS 54 Ca -0.00 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.03 1be1 n LYS 54 Cb 0.00 -2.43 -0.01 0.00 0.02 0.00 0.00 35.03 32.61 1be1 n LYS 54 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1be1 s ALA 55 N -2.94 3.70 -0.08 3.14 0.00 -1.26 -4.86 121.76 119.45 1be1 s ALA 55 Ca 0.00 1.54 0.07 0.00 0.00 0.00 0.00 51.96 53.56 1be1 s ALA 55 Cb 0.00 -3.63 -0.24 0.00 0.00 0.00 0.00 23.12 19.25 1be1 s ALA 55 CO 0.00 -0.96 0.53 -3.47 0.00 0.00 0.00 175.76 171.86 1be1 n ASP 56 N 1.89 1.25 -4.12 0.00 2.03 -0.85 -3.37 116.55 113.38 1be1 n ASP 56 Ca 0.07 0.32 -0.37 0.00 0.52 0.00 0.00 54.79 55.33 1be1 n ASP 56 Cb 0.38 -0.28 -0.10 0.00 -0.72 0.00 0.00 41.12 40.40 1be1 n ASP 56 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1be1 s LEU 57 N -6.37 5.31 -0.43 -2.67 2.96 -1.17 -3.97 118.68 112.33 1be1 s LEU 57 Ca -0.11 -2.41 -0.16 0.00 -0.22 0.00 0.00 54.13 51.24 1be1 s LEU 57 Cb 0.07 -1.86 0.04 0.00 0.50 0.00 0.00 46.19 44.94 1be1 s LEU 57 CO 0.80 -0.48 0.35 -0.63 -1.32 0.00 0.00 176.35 175.08 1be1 s ILE 58 N 0.59 5.22 -0.01 6.68 1.01 -1.17 -2.31 121.20 131.20 1be1 s ILE 58 Ca 0.12 -0.73 0.08 0.00 0.00 0.00 0.00 60.65 60.12 1be1 s ILE 58 Cb -0.22 -4.01 -0.02 0.00 0.01 0.00 0.00 42.46 38.22 1be1 s ILE 58 CO -0.04 -0.42 -0.25 0.00 0.00 0.00 0.00 174.94 174.24 1be1 s VAL 60 N -0.61 -0.10 -1.07 0.00 -7.23 -1.19 -1.47 120.40 108.73 1be1 s VAL 60 Ca 0.10 0.34 -0.04 0.00 -1.81 0.00 0.00 61.98 60.57 1be1 s VAL 60 Cb -0.10 -0.14 0.31 0.00 0.56 0.00 0.00 36.38 37.02 1be1 s VAL 60 CO -0.01 0.14 1.53 -1.54 -0.31 0.00 0.00 175.10 174.91 1be1 n SER 61 N 4.84 6.55 -4.41 4.85 3.41 -1.13 -1.18 113.62 126.54 1be1 n SER 61 Ca -0.14 -3.45 -0.37 0.00 -0.26 0.00 0.00 58.87 54.66 1be1 n SER 61 Cb 0.50 -1.25 -0.13 0.00 -0.26 0.00 0.00 64.21 63.07 1be1 n SER 61 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1be1 s SER 62 N -1.76 5.03 -1.30 4.04 0.15 -0.53 -2.87 113.70 116.46 1be1 s SER 62 Ca 0.32 -0.34 -0.07 0.00 0.70 0.00 0.00 55.95 56.56 1be1 s SER 62 Cb 0.07 -1.89 0.14 0.00 -1.71 0.00 0.00 66.02 62.63 1be1 s SER 62 CO 0.08 -0.07 2.14 0.18 1.20 0.00 0.00 173.24 176.77 1be1 n LEU 63 N 4.90 7.38 0.00 3.45 4.32 -1.26 -2.48 117.00 133.31 1be1 n LEU 63 Ca -0.16 -4.77 0.00 0.00 -0.02 0.00 0.00 56.01 51.06 1be1 n LEU 63 Cb 0.51 -1.42 0.00 0.00 -1.62 0.00 0.00 43.42 40.89 1be1 n LEU 63 CO 0.31 1.73 0.00 0.00 -1.22 0.00 0.00 177.39 178.21 1be1 n TYR 64 N 2.75 0.00 0.53 -1.77 9.36 0.64 -4.80 117.16 123.88 1be1 n TYR 64 Ca 0.51 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.85 1be1 n TYR 64 Cb 0.30 -0.90 0.45 0.00 -0.63 0.00 0.00 39.34 38.57 1be1 n TYR 64 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1be1 n GLY 65 N -1.27 -1.41 0.22 2.98 0.00 -1.26 -1.66 105.19 102.79 1be1 n GLY 65 Ca 0.00 0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 1be1 n GLY 65 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1be1 h GLN 66 N 0.00 0.73 0.00 1.61 3.07 -1.86 -3.46 115.11 115.20 1be1 h GLN 66 Ca 0.00 -0.43 0.00 0.00 0.09 0.00 0.00 58.65 58.31 1be1 h GLN 66 Cb 0.49 0.04 0.00 0.00 0.08 0.00 0.00 27.48 28.09 1be1 h GLN 66 CO 0.00 1.05 0.00 0.41 0.09 0.00 0.00 178.83 180.38 1be1 n GLY 67 N 0.29 -1.20 0.00 0.06 0.00 -0.66 -3.06 105.19 100.61 1be1 n GLY 67 Ca -0.04 -1.61 0.12 0.00 0.00 0.00 0.00 46.02 44.48 1be1 n GLY 67 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1be1 n GLU 68 N -1.45 0.12 -0.06 1.61 0.28 -1.26 -1.17 120.64 118.71 1be1 n GLU 68 Ca 0.00 0.06 -0.08 0.00 -0.16 0.00 0.00 57.16 56.98 1be1 n GLU 68 Cb 0.00 -1.50 -0.07 0.00 1.43 0.00 0.00 31.44 31.30 1be1 n GLU 68 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 1be1 h ILE 69 N 0.00 0.99 0.00 3.84 5.03 -1.96 -2.62 117.51 122.78 1be1 h ILE 69 Ca 0.00 -1.74 0.00 0.00 -0.12 0.00 0.00 64.86 63.00 1be1 h ILE 69 Cb 0.37 1.87 0.00 0.00 -3.03 0.00 0.00 36.82 36.03 1be1 h ILE 69 CO 0.00 0.34 0.00 -0.67 -0.68 0.00 0.00 178.15 177.14 1be1 n ASP 70 N -4.69 0.29 0.01 1.72 2.03 -1.17 -1.01 116.55 113.74 1be1 n ASP 70 Ca -0.06 0.54 -0.15 0.00 0.52 0.00 0.00 54.79 55.64 1be1 n ASP 70 Cb 0.27 -0.61 -0.04 0.00 -0.72 0.00 0.00 41.12 40.01 1be1 n ASP 70 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1be1 n LYS 72 N -3.89 1.75 0.03 0.00 0.00 -0.76 -3.34 118.16 111.95 1be1 n LYS 72 Ca -0.07 -1.15 -0.20 0.00 0.00 0.00 0.00 58.31 56.89 1be1 n LYS 72 Cb 0.75 -1.29 -0.14 0.00 0.00 0.00 0.00 35.03 34.35 1be1 n LYS 72 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1be1 h GLY 73 N 5.22 0.31 1.90 3.14 0.00 -0.46 -3.15 103.07 110.04 1be1 h GLY 73 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 47.33 46.53 1be1 h GLY 73 CO 0.00 0.70 -0.09 1.41 0.00 0.00 0.00 176.54 178.56 1be1 h LEU 74 N 0.07 0.00 -0.80 3.11 3.38 -1.51 -1.83 115.31 117.73 1be1 h LEU 74 Ca -0.35 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.50 1be1 h LEU 74 Cb 2.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.78 1be1 h LEU 74 CO 0.13 0.00 -0.53 0.03 0.09 0.00 0.00 178.44 178.16 1be1 h ARG 75 N 0.00 0.00 0.00 1.13 2.47 -1.62 -2.53 114.38 113.82 1be1 h ARG 75 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1be1 h ARG 75 Cb 0.91 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.23 1be1 h ARG 75 CO 0.00 0.53 -0.50 0.93 0.56 0.00 0.00 179.97 181.49 1be1 h GLU 76 N 0.00 0.00 0.00 0.04 5.08 -1.39 -1.00 114.58 117.31 1be1 h GLU 76 Ca -0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1be1 h GLU 76 Cb 1.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1be1 h GLU 76 CO 0.07 0.00 -0.43 -0.22 -1.00 0.00 0.00 179.01 177.43 1be1 h LYS 77 N 0.00 0.00 0.07 2.33 1.63 -0.98 -0.06 116.57 119.56 1be1 h LYS 77 Ca 0.00 0.00 -0.31 0.00 -0.85 0.00 0.00 60.65 59.49 1be1 h LYS 77 Cb 0.77 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.37 1be1 h LYS 77 CO 0.00 0.24 -1.71 0.00 -3.45 0.00 0.00 179.45 174.53 1be1 n ASP 79 N -3.89 0.00 -0.00 0.00 8.00 -0.38 -1.77 116.55 118.50 1be1 n ASP 79 Ca -0.33 -1.21 -0.07 0.00 0.71 0.00 0.00 54.79 53.90 1be1 n ASP 79 Cb 0.89 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.94 1be1 n ASP 79 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1be1 h GLU 80 N 0.00 -0.11 0.00 -1.24 4.81 -1.02 -3.47 114.58 113.55 1be1 h GLU 80 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1be1 h GLU 80 Cb 0.00 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1be1 h GLU 80 CO 0.00 0.27 0.00 0.00 -0.73 0.00 0.00 179.01 178.55 1be1 n ALA 81 N -2.68 0.00 0.01 2.92 0.00 -0.73 -4.73 120.51 115.31 1be1 n ALA 81 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.18 1be1 n ALA 81 Cb 0.21 -0.38 -0.14 0.00 0.00 0.00 0.00 19.45 19.14 1be1 n ALA 81 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1be1 h GLY 82 N 0.00 0.27 -5.23 0.00 0.00 -1.87 -3.44 103.07 92.81 1be1 h GLY 82 Ca 0.00 -0.69 -0.68 0.00 0.00 0.00 0.00 47.33 45.96 1be1 h GLY 82 CO 0.00 0.61 -0.65 1.08 0.00 0.00 0.00 176.54 177.57 1be1 s LEU 83 N -7.73 3.40 0.00 3.11 2.01 -1.26 -5.12 118.68 113.09 1be1 s LEU 83 Ca -0.18 0.07 0.00 0.00 0.01 0.00 0.00 54.13 54.03 1be1 s LEU 83 Cb 0.03 -1.76 0.00 0.00 0.01 0.00 0.00 46.19 44.47 1be1 s LEU 83 CO 0.78 0.36 0.00 2.29 1.01 0.00 0.00 176.35 180.79 1be1 n LYS 84 N 2.22 -0.20 0.00 1.70 0.00 -1.26 -4.66 118.16 115.96 1be1 n LYS 84 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 1be1 n LYS 84 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.56 1be1 n LYS 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1be1 n GLY 85 N 4.07 0.66 0.21 2.58 0.00 -1.22 -4.86 105.19 106.64 1be1 n GLY 85 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1be1 n GLY 85 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1be1 h ILE 86 N 0.00 0.74 -3.44 -0.61 1.08 -1.88 -3.41 117.51 109.99 1be1 h ILE 86 Ca 0.00 -1.24 -0.65 0.00 -0.39 0.00 0.00 64.86 62.58 1be1 h ILE 86 Cb 0.00 1.78 -0.25 0.00 -3.07 0.00 0.00 36.82 35.28 1be1 h ILE 86 CO 0.00 0.28 -0.69 -0.54 -0.69 0.00 0.00 178.15 176.51 1be1 s LYS 87 N -3.73 3.51 0.33 2.37 1.02 -1.25 -4.76 119.74 117.23 1be1 s LYS 87 Ca -0.00 -0.57 0.08 0.00 0.02 0.00 0.00 55.97 55.50 1be1 s LYS 87 Cb 0.11 -3.06 -0.06 0.00 -0.52 0.00 0.00 37.83 34.30 1be1 s LYS 87 CO 0.66 -0.09 -0.07 -0.51 -0.92 0.00 0.00 175.35 174.41 1be1 s LEU 88 N 1.25 2.66 -0.15 3.17 2.01 -1.26 -3.07 118.68 123.29 1be1 s LEU 88 Ca 0.03 -1.21 -0.04 0.00 0.01 0.00 0.00 54.13 52.92 1be1 s LEU 88 Cb -0.15 -0.88 0.06 0.00 0.01 0.00 0.00 46.19 45.23 1be1 s LEU 88 CO 0.00 -0.27 0.09 0.12 1.01 0.00 0.00 176.35 177.30 1be1 s PHE 89 N -2.74 0.15 -0.97 0.29 2.19 -0.93 -2.73 117.98 113.24 1be1 s PHE 89 Ca 0.32 -0.19 -0.18 0.00 0.33 0.00 0.00 56.93 57.21 1be1 s PHE 89 Cb 0.03 -0.64 0.14 0.00 -1.31 0.00 0.00 43.02 41.24 1be1 s PHE 89 CO 0.15 -0.46 1.16 0.08 1.83 0.00 0.00 175.22 177.98 1be1 s VAL 90 N 2.15 4.79 0.25 3.12 1.01 -0.54 -3.19 120.40 128.00 1be1 s VAL 90 Ca 0.03 -1.75 -0.30 0.00 0.00 0.00 0.00 61.98 59.97 1be1 s VAL 90 Cb -0.15 -4.79 -0.09 0.00 0.00 0.00 0.00 36.38 31.35 1be1 s VAL 90 CO -0.08 -1.51 1.15 -0.83 0.00 0.00 0.00 175.10 173.83 1be1 s GLY 91 N 3.49 2.93 0.00 4.51 0.00 -0.33 -2.70 107.32 115.22 1be1 s GLY 91 Ca 0.34 0.95 0.00 0.00 0.00 0.00 0.00 44.72 46.00 1be1 s GLY 91 CO -0.08 1.66 0.00 0.61 0.00 0.00 0.00 173.10 175.29 1be1 n GLY 92 N 1.50 2.29 5.72 0.20 0.00 -1.26 -1.46 105.19 112.18 1be1 n GLY 92 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1be1 n GLY 92 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1be1 n ASN 93 N 4.54 0.00 0.00 1.61 4.05 -1.04 -4.35 115.26 120.07 1be1 n ASN 93 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1be1 n ASN 93 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1be1 n ASN 93 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1be1 n ILE 94 N 0.00 0.00 -1.73 -1.44 2.08 -1.26 -0.26 119.36 116.75 1be1 n ILE 94 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1be1 n ILE 94 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 1be1 n ILE 94 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 1be1 n VAL 95 N 0.00 0.00 -1.75 1.39 0.31 -1.26 -4.69 118.33 112.33 1be1 n VAL 95 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.92 1be1 n VAL 95 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 1be1 n VAL 95 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1be1 s VAL 96 N 1.38 3.17 0.00 2.52 0.11 -1.26 -4.68 120.40 121.64 1be1 s VAL 96 Ca 0.00 0.16 0.00 0.00 -2.93 0.00 0.00 61.98 59.21 1be1 s VAL 96 Cb 0.00 -3.28 0.00 0.00 -1.53 0.00 0.00 36.38 31.57 1be1 s VAL 96 CO 0.00 -0.21 0.00 0.61 -3.33 0.00 0.00 175.10 172.17 1be1 n GLY 97 N 5.71 1.60 1.63 6.54 0.00 -1.26 -5.09 105.19 114.32 1be1 n GLY 97 Ca 0.28 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.75 1be1 n GLY 97 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1be1 n LYS 98 N 0.00 0.00 -2.61 1.61 5.02 -1.26 -4.74 118.16 116.17 1be1 n LYS 98 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 1be1 n LYS 98 Cb 0.00 -0.20 -0.03 0.00 -0.02 0.00 0.00 35.03 34.79 1be1 n LYS 98 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1be1 s GLN 99 N -2.00 3.53 -0.44 1.97 1.11 -1.26 -3.19 119.66 119.37 1be1 s GLN 99 Ca 0.00 0.24 -0.02 0.00 0.01 0.00 0.00 55.36 55.59 1be1 s GLN 99 Cb 0.00 -4.00 -0.02 0.00 -1.01 0.00 0.00 33.01 27.98 1be1 s GLN 99 CO 0.00 -1.61 0.40 0.09 0.01 0.00 0.00 175.29 174.18 1be1 n ASN 100 N 8.24 -4.53 -4.39 5.90 3.02 -1.26 -5.06 115.26 117.18 1be1 n ASN 100 Ca 0.08 -0.20 -0.27 0.00 -0.03 0.00 0.00 54.58 54.16 1be1 n ASN 100 Cb 0.49 -2.94 0.15 0.00 -0.61 0.00 0.00 39.78 36.87 1be1 n ASN 100 CO 0.00 0.00 0.00 -1.66 -2.62 0.00 0.00 177.26 172.98 1be1 s TRP 101 N -3.10 1.67 1.00 3.10 1.48 -1.19 -5.03 118.94 116.87 1be1 s TRP 101 Ca 0.12 0.10 -0.12 0.00 -1.06 0.00 0.00 56.10 55.14 1be1 s TRP 101 Cb -0.02 -3.64 0.19 0.00 -1.16 0.00 0.00 33.47 28.85 1be1 s TRP 101 CO 0.36 -2.22 1.08 -2.14 -4.06 0.00 0.00 176.95 169.97 1be1 s PRO 102 N -5.57 0.37 0.00 3.25 0.02 -1.26 -4.91 135.00 126.90 1be1 s PRO 102 Ca 0.70 0.75 0.20 0.00 0.02 0.00 0.00 61.00 62.67 1be1 s PRO 102 Cb -0.05 -1.71 0.90 0.00 0.02 0.00 0.00 34.50 33.66 1be1 s PRO 102 CO 0.49 -2.83 1.62 -0.40 -0.33 0.00 0.00 177.00 175.55 1be1 n ASP 103 N -4.28 0.00 0.00 2.53 5.75 -1.26 -3.07 116.55 116.22 1be1 n ASP 103 Ca 0.06 0.29 0.00 0.00 -0.01 0.00 0.00 54.79 55.12 1be1 n ASP 103 Cb 0.56 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 1be1 n ASP 103 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 1be1 n VAL 104 N -1.41 0.00 -0.04 2.12 3.14 -1.26 -2.82 118.33 118.06 1be1 n VAL 104 Ca 0.07 1.17 0.02 0.00 -2.96 0.00 0.00 64.34 62.64 1be1 n VAL 104 Cb 0.20 -2.02 0.21 0.00 -1.06 0.00 0.00 33.84 31.17 1be1 n VAL 104 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1be1 n GLU 105 N -1.19 3.00 -0.10 1.45 1.02 -1.25 -2.88 120.64 120.69 1be1 n GLU 105 Ca 0.00 -1.70 -0.14 0.00 -0.02 0.00 0.00 57.16 55.30 1be1 n GLU 105 Cb 0.00 -1.90 -0.03 0.00 -0.02 0.00 0.00 31.44 29.49 1be1 n GLU 105 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1be1 h GLN 106 N 2.03 0.91 0.01 3.49 4.15 -1.44 0.32 115.11 124.59 1be1 h GLN 106 Ca 0.03 -0.53 -0.30 0.00 0.77 0.00 0.00 58.65 58.62 1be1 h GLN 106 Cb 1.36 0.04 -0.05 0.00 0.21 0.00 0.00 27.48 29.05 1be1 h GLN 106 CO 0.29 1.18 -1.73 0.54 -1.93 0.00 0.00 178.83 177.18 1be1 n ARG 107 N -4.03 0.64 0.09 1.69 1.74 -1.24 -2.50 116.66 113.05 1be1 n ARG 107 Ca -0.03 0.30 -0.01 0.00 -0.77 0.00 0.00 57.85 57.34 1be1 n ARG 107 Cb 0.59 -1.79 -0.04 0.00 -1.02 0.00 0.00 32.46 30.20 1be1 n ARG 107 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 1be1 h PHE 108 N 0.01 0.00 -0.01 -1.55 0.04 -1.55 -2.93 116.94 110.94 1be1 h PHE 108 Ca -0.30 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.47 1be1 h PHE 108 Cb 2.02 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.17 1be1 h PHE 108 CO 0.01 0.64 -0.25 1.17 -0.60 0.00 0.00 178.31 179.28 1be1 n LYS 109 N -3.16 0.86 -0.23 1.51 0.00 0.11 -1.90 118.16 115.35 1be1 n LYS 109 Ca -0.02 -0.51 0.01 0.00 0.00 0.00 0.00 58.31 57.79 1be1 n LYS 109 Cb 0.82 -1.49 0.24 0.00 0.00 0.00 0.00 35.03 34.60 1be1 n LYS 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1be1 h ALA 110 N 3.70 1.47 0.02 3.14 0.00 -1.29 -1.93 119.26 124.37 1be1 h ALA 110 Ca 0.00 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 1be1 h ALA 110 Cb 0.51 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1be1 h ALA 110 CO 0.00 0.48 -0.99 0.00 0.00 0.00 0.00 179.25 178.74 1be1 h MET 111 N 1.03 0.03 -7.07 0.00 -0.00 -1.69 -3.49 114.93 103.75 1be1 h MET 111 Ca 0.29 -0.06 -0.49 0.00 -0.00 0.00 0.00 59.70 59.44 1be1 h MET 111 Cb -0.07 0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 31.53 1be1 h MET 111 CO -0.07 1.03 -0.83 0.41 -0.00 0.00 0.00 176.91 177.45 1be1 n GLY 112 N 1.52 -0.68 0.28 -3.00 0.00 -0.73 -4.80 105.19 97.79 1be1 n GLY 112 Ca -0.26 0.27 0.17 0.00 0.00 0.00 0.00 46.02 46.20 1be1 n GLY 112 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1be1 h PHE 113 N -1.59 0.00 -1.55 1.61 -0.00 -1.87 -3.43 116.94 110.11 1be1 h PHE 113 Ca -0.58 0.00 -0.48 0.00 -0.00 0.00 0.00 57.97 56.90 1be1 h PHE 113 Cb 1.14 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 37.07 1be1 h PHE 113 CO 0.30 0.02 -0.37 0.16 -0.00 0.00 0.00 178.31 178.42 1be1 s ASP 114 N -5.69 5.17 0.00 -0.68 1.47 -1.26 -4.32 116.67 111.36 1be1 s ASP 114 Ca 0.00 -0.67 0.00 0.00 1.18 0.00 0.00 52.55 53.07 1be1 s ASP 114 Cb 0.10 -0.64 0.00 0.00 -0.34 0.00 0.00 42.92 42.04 1be1 s ASP 114 CO 0.54 -0.63 0.00 0.54 0.68 0.00 0.00 175.17 176.30 1be1 n ARG 115 N -1.57 1.53 -3.99 2.11 5.12 -1.10 -4.95 116.66 113.80 1be1 n ARG 115 Ca 0.03 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.87 1be1 n ARG 115 Cb 0.61 0.00 -0.11 0.00 -1.16 0.00 0.00 32.46 31.80 1be1 n ARG 115 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1be1 s VAL 116 N -0.06 0.12 0.12 1.55 -7.23 -1.26 -1.47 120.40 112.17 1be1 s VAL 116 Ca 0.00 -1.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.17 1be1 s VAL 116 Cb 0.00 -0.40 -0.04 0.00 0.56 0.00 0.00 36.38 36.50 1be1 s VAL 116 CO 0.00 -0.55 0.28 -0.31 -0.31 0.00 0.00 175.10 174.20 1be1 s TYR 117 N -1.73 3.50 0.92 2.82 1.51 -1.10 -4.94 117.35 118.34 1be1 s TYR 117 Ca -0.13 0.25 -0.12 0.00 -1.01 0.00 0.00 57.07 56.06 1be1 s TYR 117 Cb -0.08 -1.77 0.14 0.00 -0.11 0.00 0.00 41.96 40.15 1be1 s TYR 117 CO -0.02 0.52 1.11 -1.25 -1.11 0.00 0.00 175.55 174.80 1be1 s PRO 118 N -2.87 1.04 0.00 -1.71 0.04 -1.26 -4.20 135.00 126.04 1be1 s PRO 118 Ca 0.36 0.47 0.14 0.00 0.04 0.00 0.00 61.00 62.01 1be1 s PRO 118 Cb -0.12 -1.81 0.66 0.00 0.04 0.00 0.00 34.50 33.27 1be1 s PRO 118 CO 0.28 -2.30 1.41 -0.35 0.04 0.00 0.00 177.00 176.07 1be1 n PRO 119 N -3.87 0.12 -3.38 0.56 -0.04 -1.26 -3.47 135.00 123.66 1be1 n PRO 119 Ca 0.06 0.20 -0.26 0.00 -0.04 0.00 0.00 63.50 63.46 1be1 n PRO 119 Cb 0.58 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.44 1be1 n PRO 119 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1be1 s GLY 120 N -2.75 0.86 0.71 0.55 0.00 -1.26 -4.97 107.32 100.47 1be1 s GLY 120 Ca 0.11 -2.04 -0.13 0.00 0.00 0.00 0.00 44.72 42.65 1be1 s GLY 120 CO 0.23 2.24 1.10 -1.08 0.00 0.00 0.00 173.10 175.59 1be1 s THR 121 N 0.55 3.27 0.30 0.90 -1.32 -1.23 -5.07 115.64 113.04 1be1 s THR 121 Ca 0.27 0.51 0.03 0.00 -1.21 0.00 0.00 61.69 61.29 1be1 s THR 121 Cb -0.07 -3.02 -0.03 0.00 -1.51 0.00 0.00 72.50 67.88 1be1 s THR 121 CO -0.11 -0.44 0.29 -0.55 -2.21 0.00 0.00 174.62 171.60 1be1 s SER 122 N -2.91 1.14 0.00 8.08 0.15 -1.26 -5.02 113.70 113.87 1be1 s SER 122 Ca 0.65 -1.60 0.20 0.00 0.70 0.00 0.00 55.95 55.89 1be1 s SER 122 Cb -0.19 0.54 0.84 0.00 -1.71 0.00 0.00 66.02 65.50 1be1 s SER 122 CO 0.48 -1.06 1.58 -0.81 1.20 0.00 0.00 173.24 174.63 1be1 n PRO 123 N -0.53 1.49 0.19 5.44 -0.04 -1.26 -2.61 135.00 137.69 1be1 n PRO 123 Ca 0.05 -0.74 0.07 0.00 -0.04 0.00 0.00 63.50 62.84 1be1 n PRO 123 Cb 0.63 -1.35 0.32 0.00 -0.04 0.00 0.00 33.50 33.06 1be1 n PRO 123 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1be1 h GLU 124 N 1.49 0.00 0.05 0.54 5.08 -1.96 0.26 114.58 120.04 1be1 h GLU 124 Ca 0.00 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.17 1be1 h GLU 124 Cb 0.33 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.59 1be1 h GLU 124 CO 0.00 0.33 -0.79 1.15 -1.00 0.00 0.00 179.01 178.70 1be1 h THR 125 N 0.00 1.42 -0.01 1.13 2.02 -1.92 -3.15 112.91 112.39 1be1 h THR 125 Ca -0.00 -2.26 0.00 0.00 0.77 0.00 0.00 66.41 64.91 1be1 h THR 125 Cb 0.93 2.75 0.00 0.00 -1.74 0.00 0.00 68.15 70.09 1be1 h THR 125 CO 0.04 0.66 -0.03 0.35 0.37 0.00 0.00 175.52 176.92 1be1 n THR 126 N -4.10 0.00 0.10 3.16 -2.24 -1.03 -1.80 114.28 108.37 1be1 n THR 126 Ca -0.12 -0.14 -0.05 0.00 -2.27 0.00 0.00 64.05 61.47 1be1 n THR 126 Cb 0.77 0.12 0.07 0.00 -2.10 0.00 0.00 70.33 69.19 1be1 n THR 126 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1be1 h ILE 127 N 1.36 1.49 0.00 2.28 1.08 -0.45 -2.62 117.51 120.66 1be1 h ILE 127 Ca 0.00 -2.43 0.00 0.00 -0.39 0.00 0.00 64.86 62.04 1be1 h ILE 127 Cb 0.33 2.32 0.00 0.00 -3.07 0.00 0.00 36.82 36.40 1be1 h ILE 127 CO 0.00 0.70 -0.51 0.00 -0.69 0.00 0.00 178.15 177.65 1be1 n ALA 128 N -2.43 3.02 0.23 1.87 0.00 -0.74 -2.25 120.51 120.22 1be1 n ALA 128 Ca -0.02 -0.25 -0.10 0.00 0.00 0.00 0.00 53.44 53.07 1be1 n ALA 128 Cb 0.72 -1.20 -0.05 0.00 0.00 0.00 0.00 19.45 18.93 1be1 n ALA 128 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1be1 h ASP 129 N 0.00 -0.53 0.50 0.00 5.19 -0.98 -2.92 116.42 117.68 1be1 h ASP 129 Ca 0.00 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1be1 h ASP 129 Cb 0.66 0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.30 1be1 h ASP 129 CO 0.00 -0.27 0.00 0.23 -3.12 0.00 0.00 179.24 176.08 1be1 n MET 130 N -4.27 0.19 0.00 3.56 2.81 -1.16 -1.81 117.12 116.44 1be1 n MET 130 Ca -0.08 0.50 0.00 0.00 -1.81 0.00 0.00 57.70 56.32 1be1 n MET 130 Cb 0.25 -1.92 0.00 0.00 -0.71 0.00 0.00 33.22 30.83 1be1 n MET 130 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1be1 n LYS 131 N -2.28 0.00 0.28 0.03 3.00 -0.95 -3.30 118.16 114.93 1be1 n LYS 131 Ca 0.01 0.37 0.13 0.00 -0.00 0.00 0.00 58.31 58.82 1be1 n LYS 131 Cb 0.17 -0.86 0.81 0.00 0.00 0.00 0.00 35.03 35.15 1be1 n LYS 131 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1be1 h GLU 132 N 0.00 0.00 0.00 1.64 4.57 -1.62 -1.89 114.58 117.28 1be1 h GLU 132 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1be1 h GLU 132 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1be1 h GLU 132 CO 0.00 0.05 -0.38 0.28 -1.18 0.00 0.00 179.01 177.77 1be1 n VAL 133 N -3.89 0.19 -0.10 0.32 0.31 -0.75 -2.76 118.33 111.65 1be1 n VAL 133 Ca -0.03 -0.12 -0.06 0.00 -0.01 0.00 0.00 64.34 64.12 1be1 n VAL 133 Cb 0.14 -0.12 0.13 0.00 -0.91 0.00 0.00 33.84 33.08 1be1 n VAL 133 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1be1 h LEU 134 N 0.00 0.77 0.00 7.52 3.38 -1.33 -3.46 115.31 122.19 1be1 h LEU 134 Ca 0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1be1 h LEU 134 Cb 0.61 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1be1 h LEU 134 CO 0.00 0.89 0.00 0.61 0.09 0.00 0.00 178.44 180.03 1be1 n GLY 135 N -0.47 -0.40 3.72 0.83 0.00 -1.14 -4.32 105.19 103.40 1be1 n GLY 135 Ca 0.01 -0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1be1 n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1be1 s VAL 136 N 0.00 0.00 -0.13 1.61 1.01 -1.11 -4.95 120.40 116.83 1be1 s VAL 136 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1be1 s VAL 136 Cb 0.00 -1.67 0.01 0.00 0.00 0.00 0.00 36.38 34.71 1be1 s VAL 136 CO 0.00 0.00 0.53 -1.84 0.00 0.00 0.00 175.10 173.79