#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x9s n LYS 2 N 0.00 0.00 -3.80 0.03 3.00 -1.26 -5.14 118.16 110.99 2x9s n LYS 2 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 58.31 58.07 2x9s n LYS 2 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.00 2x9s n LYS 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2x9s n LYS 3 N 0.00 0.94 -3.19 1.64 5.02 -1.26 -5.17 118.16 116.14 2x9s n LYS 3 Ca 0.00 -2.87 -0.13 0.00 -2.02 0.00 0.00 58.31 53.29 2x9s n LYS 3 Cb 0.00 0.57 -0.04 0.00 -0.02 0.00 0.00 35.03 35.55 2x9s n LYS 3 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2x9s n VAL 4 N -1.24 0.00 -0.95 -0.18 3.14 -1.26 -4.64 118.33 113.20 2x9s n VAL 4 Ca -0.10 -1.17 0.00 0.00 -2.96 0.00 0.00 64.34 60.11 2x9s n VAL 4 Cb 0.51 0.41 0.00 0.00 -1.06 0.00 0.00 33.84 33.70 2x9s n VAL 4 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 2x9s n VAL 5 N -0.46 0.00 0.00 1.55 3.14 -1.26 -4.72 118.33 116.58 2x9s n VAL 5 Ca -0.03 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.35 2x9s n VAL 5 Cb 0.30 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.08 2x9s n VAL 5 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2x9s n ALA 6 N 0.85 0.00 -2.17 1.55 0.00 -1.26 -5.07 120.51 114.41 2x9s n ALA 6 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2x9s n ALA 6 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 2x9s n ALA 6 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2x9s s VAL 7 N 0.00 0.11 -0.21 0.00 -7.23 -1.26 0.71 120.40 112.51 2x9s s VAL 7 Ca 0.00 -1.89 -0.14 0.00 -1.81 0.00 0.00 61.98 58.14 2x9s s VAL 7 Cb 0.00 -2.02 0.06 0.00 0.56 0.00 0.00 36.38 34.99 2x9s s VAL 7 CO 0.00 -0.48 0.53 0.68 -0.31 0.00 0.00 175.10 175.52 2x9s s VAL 8 N -4.04 -0.01 -0.23 1.32 -7.23 -1.00 -4.94 120.40 104.26 2x9s s VAL 8 Ca 0.23 0.04 -0.00 0.00 -1.81 0.00 0.00 61.98 60.43 2x9s s VAL 8 Cb 0.07 -0.76 0.03 0.00 0.56 0.00 0.00 36.38 36.28 2x9s s VAL 8 CO 0.01 0.01 -0.10 -1.59 -0.31 0.00 0.00 175.10 173.13 2x9s s LYS 9 N 1.07 2.82 0.40 4.82 -2.85 -1.26 -0.50 119.74 124.24 2x9s s LYS 9 Ca -0.06 -0.98 0.04 0.00 -1.00 0.00 0.00 55.97 53.97 2x9s s LYS 9 Cb -0.06 -2.87 -0.04 0.00 -2.06 0.00 0.00 37.83 32.80 2x9s s LYS 9 CO -0.10 -0.37 0.08 -0.48 0.10 0.00 0.00 175.35 174.58 2x9s s LEU 10 N 1.29 2.15 -0.61 2.77 0.05 -1.26 -4.99 118.68 118.08 2x9s s LEU 10 Ca 0.00 -1.56 0.06 0.00 0.05 0.00 0.00 54.13 52.68 2x9s s LEU 10 Cb -0.16 -0.34 0.22 0.00 -2.05 0.00 0.00 46.19 43.86 2x9s s LEU 10 CO -0.07 -0.79 0.62 0.00 -0.55 0.00 0.00 176.35 175.57 2x9s n GLN 11 N -0.90 1.94 -0.92 1.48 10.64 -1.26 -3.78 117.38 124.58 2x9s n GLN 11 Ca -0.07 -4.33 -0.34 0.00 -1.83 0.00 0.00 57.00 50.43 2x9s n GLN 11 Cb 0.66 -2.09 0.03 0.00 -0.86 0.00 0.00 30.24 27.98 2x9s n GLN 11 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2x9s n LEU 12 N 1.37 -4.92 0.00 2.61 4.77 -1.04 -4.55 117.00 115.25 2x9s n LEU 12 Ca 0.26 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2x9s n LEU 12 Cb 0.41 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 2x9s n LEU 12 CO 0.32 -4.81 0.00 -0.81 -1.33 0.00 0.00 177.39 170.76 2x9s n PRO 13 N 2.29 0.00 -3.24 3.23 -0.04 -1.26 -2.47 135.00 133.51 2x9s n PRO 13 Ca -0.02 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.47 2x9s n PRO 13 Cb 0.56 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.98 2x9s n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2x9s s ALA 14 N -3.27 -3.16 0.00 0.55 0.00 -1.23 -3.24 121.76 111.41 2x9s s ALA 14 Ca 0.00 1.82 0.00 0.00 0.00 0.00 0.00 51.96 53.78 2x9s s ALA 14 Cb 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.87 2x9s s ALA 14 CO 0.00 -1.02 0.00 0.41 0.00 0.00 0.00 175.76 175.15 2x9s n GLY 15 N 4.78 2.40 3.17 0.00 0.00 -1.26 -4.71 105.19 109.56 2x9s n GLY 15 Ca -0.07 -0.70 -0.21 0.00 0.00 0.00 0.00 46.02 45.03 2x9s n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x9s s LYS 16 N 0.00 1.03 -0.30 1.61 0.00 -1.26 -4.98 119.74 115.84 2x9s s LYS 16 Ca 0.00 -0.83 -0.15 0.00 0.00 0.00 0.00 55.97 55.00 2x9s s LYS 16 Cb 0.00 -1.07 0.18 0.00 0.00 0.00 0.00 37.83 36.94 2x9s s LYS 16 CO 0.00 0.26 1.14 0.00 0.00 0.00 0.00 175.35 176.75 2x9s s ALA 17 N -0.88 -4.02 0.00 0.59 0.00 -1.26 -4.80 121.76 111.38 2x9s s ALA 17 Ca 0.03 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.35 2x9s s ALA 17 Cb -0.08 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.30 2x9s s ALA 17 CO 0.02 -1.83 0.00 2.41 0.00 0.00 0.00 175.76 176.36 2x9s n THR 18 N 5.27 0.00 0.00 0.00 -1.04 -1.26 -4.33 114.28 112.92 2x9s n THR 18 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 2x9s n THR 18 Cb 0.56 -0.07 0.00 0.00 -1.82 0.00 0.00 70.33 69.01 2x9s n THR 18 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2x9s n PRO 19 N -1.86 2.91 0.00 -2.82 -0.02 -1.26 -4.84 135.00 127.12 2x9s n PRO 19 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2x9s n PRO 19 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2x9s n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x9s n ALA 20 N -3.00 1.62 -0.56 3.55 0.00 -1.26 -3.90 120.51 116.95 2x9s n ALA 20 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2x9s n ALA 20 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.47 2x9s n ALA 20 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2x9s n PRO 21 N -1.25 0.00 0.00 0.00 -0.02 -1.26 -3.45 135.00 129.02 2x9s n PRO 21 Ca 0.00 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2x9s n PRO 21 Cb 0.04 -1.22 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 2x9s n PRO 21 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2x9s n PRO 22 N -1.73 0.00 0.00 0.52 -0.02 -1.26 -4.67 135.00 127.84 2x9s n PRO 22 Ca 0.00 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2x9s n PRO 22 Cb 0.00 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 2x9s n PRO 22 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2x9s n VAL 23 N -2.35 0.00 -0.23 -1.45 0.31 -1.24 -4.99 118.33 108.38 2x9s n VAL 23 Ca 0.00 0.00 0.16 0.00 -0.01 0.00 0.00 64.34 64.49 2x9s n VAL 23 Cb 0.00 0.56 0.30 0.00 -0.91 0.00 0.00 33.84 33.78 2x9s n VAL 23 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2x9s n GLY 24 N 0.00 -0.74 0.07 2.92 0.00 -1.22 -0.92 105.19 105.29 2x9s n GLY 24 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.64 2x9s n GLY 24 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2x9s n PRO 25 N -4.75 0.66 -0.16 1.61 -0.04 -1.26 -4.43 135.00 126.63 2x9s n PRO 25 Ca 0.21 -0.02 0.20 0.00 -0.04 0.00 0.00 63.50 63.85 2x9s n PRO 25 Cb 0.70 -1.60 0.58 0.00 -0.04 0.00 0.00 33.50 33.14 2x9s n PRO 25 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2x9s h ALA 26 N 1.48 2.34 0.00 0.55 0.00 -1.36 0.51 119.26 122.79 2x9s h ALA 26 Ca -0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2x9s h ALA 26 Cb 1.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2x9s h ALA 26 CO 0.02 -0.57 -0.04 1.47 0.00 0.00 0.00 179.25 180.13 2x9s n LEU 27 N -4.43 0.20 0.10 0.00 -0.00 -1.21 -3.47 117.00 108.19 2x9s n LEU 27 Ca 0.16 0.48 0.05 0.00 -0.00 0.00 0.00 56.01 56.69 2x9s n LEU 27 Cb 0.67 -0.44 -0.00 0.00 -0.00 0.00 0.00 43.42 43.64 2x9s n LEU 27 CO 0.34 -0.03 0.12 1.23 -0.00 0.00 0.00 177.39 179.05 2x9s h GLY 28 N 4.90 0.00 1.55 1.47 0.00 -0.20 -3.19 103.07 107.59 2x9s h GLY 28 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 2x9s h GLY 28 CO 0.00 0.00 -0.25 1.46 0.00 0.00 0.00 176.54 177.75 2x9s h GLN 29 N 0.00 0.52 -0.62 4.80 4.20 -1.55 -2.05 115.11 120.41 2x9s h GLN 29 Ca -0.06 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.45 2x9s h GLN 29 Cb 1.33 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.08 2x9s h GLN 29 CO 0.04 0.74 0.00 0.72 -0.67 0.00 0.00 178.83 179.65 2x9s n HIS 30 N -4.11 1.09 0.00 2.96 8.25 -1.25 -4.97 115.22 117.19 2x9s n HIS 30 Ca -0.00 -0.46 0.00 0.00 -0.26 0.00 0.00 57.72 57.00 2x9s n HIS 30 Cb 0.41 -0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.38 2x9s n HIS 30 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x9s n GLY 31 N 1.15 0.80 0.68 -1.41 0.00 -0.77 -4.89 105.19 100.75 2x9s n GLY 31 Ca 0.21 -1.01 -0.01 0.00 0.00 0.00 0.00 46.02 45.21 2x9s n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x9s n ALA 32 N 2.97 -0.47 -2.65 4.61 0.00 -1.21 -4.58 120.51 119.18 2x9s n ALA 32 Ca 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 53.44 53.11 2x9s n ALA 32 Cb 0.00 0.11 -0.07 0.00 0.00 0.00 0.00 19.45 19.49 2x9s n ALA 32 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2x9s s ASN 33 N -1.43 0.73 -0.15 0.00 0.01 -1.26 -4.88 114.94 107.97 2x9s s ASN 33 Ca 0.04 -1.43 0.14 0.00 -0.71 0.00 0.00 52.86 50.90 2x9s s ASN 33 Cb -0.01 0.56 -0.20 0.00 0.41 0.00 0.00 41.25 42.02 2x9s s ASN 33 CO 0.01 -1.12 0.08 -0.38 -1.51 0.00 0.00 177.10 174.18 2x9s n ILE 34 N -0.48 1.00 1.34 0.60 2.08 -1.26 -4.47 119.36 118.17 2x9s n ILE 34 Ca 0.02 -0.65 0.13 0.00 0.56 0.00 0.00 62.75 62.82 2x9s n ILE 34 Cb 0.63 -0.53 0.41 0.00 -0.75 0.00 0.00 39.64 39.40 2x9s n ILE 34 CO 0.00 0.00 0.00 1.15 0.56 0.00 0.00 176.55 178.26 2x9s n MET 35 N -2.55 1.39 -0.08 0.38 0.00 -1.26 -4.17 117.12 110.83 2x9s n MET 35 Ca -0.24 -0.87 -0.07 0.00 0.00 0.00 0.00 57.70 56.53 2x9s n MET 35 Cb 0.97 -1.48 -0.15 0.00 0.00 0.00 0.00 33.22 32.55 2x9s n MET 35 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 2x9s n GLU 36 N -0.05 0.82 -3.24 3.17 -0.58 -1.26 -4.64 120.64 114.87 2x9s n GLU 36 Ca 0.16 -0.04 -0.25 0.00 -0.42 0.00 0.00 57.16 56.61 2x9s n GLU 36 Cb 0.38 -1.49 -0.06 0.00 -0.57 0.00 0.00 31.44 29.69 2x9s n GLU 36 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2x9s n PHE 37 N -2.64 2.07 0.12 -0.32 7.35 -1.26 -4.33 117.46 118.44 2x9s n PHE 37 Ca -0.27 -3.91 0.00 0.00 -0.76 0.00 0.00 57.45 52.51 2x9s n PHE 37 Cb 1.04 -0.47 0.00 0.00 0.35 0.00 0.00 39.48 40.41 2x9s n PHE 37 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33 2x9s n VAL 38 N 0.75 0.00 -0.12 -2.13 0.24 -1.26 -4.75 118.33 111.05 2x9s n VAL 38 Ca 0.27 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 62.39 2x9s n VAL 38 Cb 0.48 -0.21 -0.11 0.00 -1.47 0.00 0.00 33.84 32.53 2x9s n VAL 38 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2x9s n LYS 39 N -3.14 0.60 -0.95 7.34 4.01 -1.26 -3.67 118.16 121.09 2x9s n LYS 39 Ca 0.00 0.15 -0.13 0.00 -0.51 0.00 0.00 58.31 57.83 2x9s n LYS 39 Cb 0.00 -1.48 -0.07 0.00 -0.51 0.00 0.00 35.03 32.97 2x9s n LYS 39 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2x9s n ALA 40 N -3.33 5.57 0.00 7.82 0.00 -1.26 -3.05 120.51 126.25 2x9s n ALA 40 Ca -0.44 -1.56 0.00 0.00 0.00 0.00 0.00 53.44 51.43 2x9s n ALA 40 Cb 0.95 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.61 2x9s n ALA 40 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2x9s n PHE 41 N 1.56 -0.87 0.54 0.00 7.35 -1.26 -4.46 117.46 120.32 2x9s n PHE 41 Ca 0.31 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.00 2x9s n PHE 41 Cb 0.68 0.35 0.00 0.00 0.35 0.00 0.00 39.48 40.86 2x9s n PHE 41 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2x9s n ASN 42 N -2.19 0.55 0.08 -2.13 5.15 -1.17 -2.67 115.26 112.88 2x9s n ASN 42 Ca 0.00 -1.08 -0.10 0.00 -0.60 0.00 0.00 54.58 52.80 2x9s n ASN 42 Cb 0.00 -0.27 -0.00 0.00 -0.53 0.00 0.00 39.78 38.98 2x9s n ASN 42 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2x9s h ALA 43 N 1.55 0.51 0.16 5.20 0.00 -1.91 -2.25 119.26 122.52 2x9s h ALA 43 Ca 0.00 -0.70 -0.30 0.00 0.00 0.00 0.00 54.91 53.91 2x9s h ALA 43 Cb 0.27 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.01 2x9s h ALA 43 CO 0.00 0.86 -1.49 0.00 0.00 0.00 0.00 179.25 178.62 2x9s h ALA 44 N 0.93 0.10 0.00 0.00 0.00 -1.90 -3.31 119.26 115.08 2x9s h ALA 44 Ca -0.05 -1.04 -0.04 0.00 0.00 0.00 0.00 54.91 53.78 2x9s h ALA 44 Cb 1.47 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 2x9s h ALA 44 CO 0.14 0.84 -0.18 1.15 0.00 0.00 0.00 179.25 181.19 2x9s h THR 45 N -0.10 0.73 0.00 0.00 2.02 -1.72 0.36 112.91 114.20 2x9s h THR 45 Ca -0.30 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.13 2x9s h THR 45 Cb 1.92 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.80 2x9s h THR 45 CO 0.14 0.18 0.00 0.00 0.37 0.00 0.00 175.52 176.21 2x9s h ALA 46 N 1.82 1.00 0.01 6.16 0.00 -1.51 -3.04 119.26 123.69 2x9s h ALA 46 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.49 2x9s h ALA 46 Cb 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 2x9s h ALA 46 CO 0.02 0.00 -2.40 0.09 0.00 0.00 0.00 179.25 176.97 2x9s n ASN 47 N -2.73 1.97 0.08 0.00 4.13 -0.09 -4.27 115.26 114.35 2x9s n ASN 47 Ca 0.02 0.14 0.05 0.00 1.68 0.00 0.00 54.58 56.48 2x9s n ASN 47 Cb 0.35 -0.67 0.29 0.00 -1.54 0.00 0.00 39.78 38.21 2x9s n ASN 47 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 2x9s n MET 48 N -3.81 0.07 0.00 3.52 2.81 0.11 -4.91 117.12 114.91 2x9s n MET 48 Ca -0.48 0.56 0.00 0.00 -1.81 0.00 0.00 57.70 55.97 2x9s n MET 48 Cb 0.93 -1.75 0.00 0.00 -0.71 0.00 0.00 33.22 31.69 2x9s n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2x9s n GLY 49 N -1.39 1.00 0.00 3.03 0.00 -1.15 -4.96 105.19 101.72 2x9s n GLY 49 Ca -0.01 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2x9s n GLY 49 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2x9s n ASP 50 N 0.00 2.09 0.00 1.61 5.68 -1.26 -4.68 116.55 119.99 2x9s n ASP 50 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 2x9s n ASP 50 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2x9s n ASP 50 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2x9s n ALA 51 N -3.00 0.00 -2.50 2.12 0.00 -1.26 -4.55 120.51 111.32 2x9s n ALA 51 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 2x9s n ALA 51 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2x9s n ALA 51 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2x9s s ILE 52 N 0.00 2.96 -0.35 0.00 2.07 -1.26 -3.56 121.20 121.06 2x9s s ILE 52 Ca 0.00 -1.36 -0.00 0.00 -1.41 0.00 0.00 60.65 57.88 2x9s s ILE 52 Cb 0.00 -2.34 0.13 0.00 0.13 0.00 0.00 42.46 40.38 2x9s s ILE 52 CO 0.00 0.17 0.18 0.68 -1.91 0.00 0.00 174.94 174.06 2x9s s VAL 53 N -1.10 0.48 0.00 4.00 -7.23 -1.03 -4.55 120.40 110.97 2x9s s VAL 53 Ca 0.18 -1.67 -0.00 0.00 -1.81 0.00 0.00 61.98 58.68 2x9s s VAL 53 Cb -0.11 -1.36 -0.01 0.00 0.56 0.00 0.00 36.38 35.47 2x9s s VAL 53 CO 0.10 -0.88 0.33 -0.81 -0.31 0.00 0.00 175.10 173.53 2x9s n PRO 54 N 4.28 0.12 -2.77 4.82 -0.04 -1.26 -2.49 135.00 137.66 2x9s n PRO 54 Ca 0.06 -0.02 -0.38 0.00 -0.04 0.00 0.00 63.50 63.12 2x9s n PRO 54 Cb 0.38 -1.47 -0.06 0.00 -0.04 0.00 0.00 33.50 32.31 2x9s n PRO 54 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2x9s s VAL 55 N 2.00 4.16 0.00 0.52 1.01 -1.25 -4.06 120.40 122.79 2x9s s VAL 55 Ca 0.01 1.93 0.00 0.00 0.00 0.00 0.00 61.98 63.92 2x9s s VAL 55 Cb 0.01 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.25 2x9s s VAL 55 CO 0.00 0.28 0.00 -1.84 0.00 0.00 0.00 175.10 173.54 2x9s n GLU 56 N 0.93 3.18 -4.16 2.72 0.28 -1.25 -4.10 120.64 118.24 2x9s n GLU 56 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.90 2x9s n GLU 56 Cb 0.49 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.26 2x9s n GLU 56 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2x9s s ILE 57 N 0.29 0.43 -0.21 3.84 1.01 0.34 -4.48 121.20 122.42 2x9s s ILE 57 Ca 0.00 -1.90 -0.05 0.00 0.00 0.00 0.00 60.65 58.69 2x9s s ILE 57 Cb 0.00 -1.80 0.11 0.00 0.01 0.00 0.00 42.46 40.77 2x9s s ILE 57 CO 0.00 -0.74 0.40 -0.89 0.00 0.00 0.00 174.94 173.71 2x9s s THR 58 N -3.81 -0.63 0.29 2.92 2.01 -1.26 -2.38 115.64 112.78 2x9s s THR 58 Ca 0.16 0.08 -0.15 0.00 0.31 0.00 0.00 61.69 62.08 2x9s s THR 58 Cb 0.07 -0.72 -0.09 0.00 0.01 0.00 0.00 72.50 71.77 2x9s s THR 58 CO -0.03 0.00 0.72 -0.63 -0.69 0.00 0.00 174.62 173.99 2x9s s ILE 59 N 2.59 4.68 0.00 1.82 1.09 0.22 -3.61 121.20 127.99 2x9s s ILE 59 Ca 0.04 0.97 0.00 0.00 -1.10 0.00 0.00 60.65 60.56 2x9s s ILE 59 Cb -0.13 -3.66 0.00 0.00 -1.06 0.00 0.00 42.46 37.61 2x9s s ILE 59 CO -0.14 -0.10 0.00 -1.22 -0.10 0.00 0.00 174.94 173.38 2x9s n TYR 60 N -0.13 0.00 -2.00 3.97 4.01 -1.24 -4.73 117.16 117.04 2x9s n TYR 60 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 2x9s n TYR 60 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 2x9s n TYR 60 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2x9s n ALA 61 N -0.54 0.00 -2.20 -0.72 0.00 -1.26 -4.95 120.51 110.84 2x9s n ALA 61 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2x9s n ALA 61 Cb 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 19.45 18.98 2x9s n ALA 61 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2x9s n ASP 62 N 1.72 -1.09 -0.49 0.00 5.75 -1.26 -4.99 116.55 116.18 2x9s n ASP 62 Ca 0.00 -1.98 -0.06 0.00 -0.01 0.00 0.00 54.79 52.73 2x9s n ASP 62 Cb 0.46 0.40 -0.03 0.00 -1.03 0.00 0.00 41.12 40.93 2x9s n ASP 62 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2x9s n ARG 63 N -0.48 -1.23 -3.98 0.11 1.74 -1.26 -5.00 116.66 106.55 2x9s n ARG 63 Ca -0.24 0.64 -0.27 0.00 -0.77 0.00 0.00 57.85 57.22 2x9s n ARG 63 Cb 0.74 -4.73 -0.04 0.00 -1.02 0.00 0.00 32.46 27.41 2x9s n ARG 63 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2x9s s SER 64 N -2.37 6.07 -0.03 0.55 0.15 -1.26 -5.04 113.70 111.77 2x9s s SER 64 Ca 0.00 0.09 -0.29 0.00 0.70 0.00 0.00 55.95 56.45 2x9s s SER 64 Cb 0.00 -1.76 0.11 0.00 -1.71 0.00 0.00 66.02 62.65 2x9s s SER 64 CO 0.00 0.08 0.92 0.72 1.20 0.00 0.00 173.24 176.16 2x9s s PHE 65 N -1.69 -0.33 -1.00 3.44 -0.12 -1.26 -3.69 117.98 113.34 2x9s s PHE 65 Ca 0.33 0.23 -0.04 0.00 -0.05 0.00 0.00 56.93 57.40 2x9s s PHE 65 Cb -0.11 0.53 0.27 0.00 -0.63 0.00 0.00 43.02 43.08 2x9s s PHE 65 CO 0.27 -0.51 1.08 2.41 -0.05 0.00 0.00 175.22 178.42 2x9s n THR 66 N -0.18 4.09 -0.31 -4.49 -1.04 -1.24 -4.95 114.28 106.16 2x9s n THR 66 Ca -0.08 -5.44 -0.09 0.00 -2.04 0.00 0.00 64.05 56.41 2x9s n THR 66 Cb 0.61 -2.34 -0.01 0.00 -1.82 0.00 0.00 70.33 66.77 2x9s n THR 66 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 2x9s n PHE 67 N 2.01 0.49 -2.08 -1.42 -1.74 -1.26 -4.56 117.46 108.90 2x9s n PHE 67 Ca 0.24 -1.01 -0.38 0.00 -0.56 0.00 0.00 57.45 55.75 2x9s n PHE 67 Cb 0.37 -1.01 -0.03 0.00 1.52 0.00 0.00 39.48 40.33 2x9s n PHE 67 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 2x9s s VAL 68 N 3.95 3.40 0.79 1.97 1.01 -1.26 -4.89 120.40 125.37 2x9s s VAL 68 Ca 0.17 0.15 -0.13 0.00 0.00 0.00 0.00 61.98 62.17 2x9s s VAL 68 Cb 0.05 -4.03 0.08 0.00 0.00 0.00 0.00 36.38 32.48 2x9s s VAL 68 CO -0.01 -1.00 1.20 -0.89 0.00 0.00 0.00 175.10 174.40 2x9s s THR 69 N 8.89 2.16 0.29 3.92 2.01 -1.26 -3.96 115.64 127.69 2x9s s THR 69 Ca 0.65 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.75 2x9s s THR 69 Cb -0.12 -2.49 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 2x9s s THR 69 CO 0.18 -0.05 0.16 -0.54 -0.69 0.00 0.00 174.62 173.67 2x9s s LYS 70 N -4.15 1.56 0.02 4.92 1.02 -1.26 -4.93 119.74 116.92 2x9s s LYS 70 Ca 0.72 -1.88 -0.20 0.00 0.02 0.00 0.00 55.97 54.63 2x9s s LYS 70 Cb -0.28 -0.07 -0.06 0.00 -0.52 0.00 0.00 37.83 36.90 2x9s s LYS 70 CO 0.50 -0.44 0.59 0.99 -0.92 0.00 0.00 175.35 176.07 2x9s s THR 71 N -3.65 4.86 0.07 2.17 2.01 -1.26 -4.32 115.64 115.52 2x9s s THR 71 Ca 0.36 1.23 -0.27 0.00 0.31 0.00 0.00 61.69 63.33 2x9s s THR 71 Cb 0.05 -3.92 -0.14 0.00 0.01 0.00 0.00 72.50 68.50 2x9s s THR 71 CO 0.17 0.46 0.63 -2.65 -0.69 0.00 0.00 174.62 172.54 2x9s n PRO 72 N 2.45 0.00 -1.66 4.92 -0.02 -1.26 -4.64 135.00 134.78 2x9s n PRO 72 Ca -0.08 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 60.97 2x9s n PRO 72 Cb 0.51 -0.98 -0.01 0.00 -0.02 0.00 0.00 33.50 33.00 2x9s n PRO 72 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2x9s n PRO 73 N 0.98 1.89 0.00 0.52 -0.02 -1.26 -4.69 135.00 132.42 2x9s n PRO 73 Ca 0.15 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 2x9s n PRO 73 Cb 0.12 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2x9s n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x9s n ALA 74 N 0.40 1.00 0.12 3.55 0.00 -1.26 -0.50 120.51 123.82 2x9s n ALA 74 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.31 2x9s n ALA 74 Cb 0.34 -0.89 -0.15 0.00 0.00 0.00 0.00 19.45 18.76 2x9s n ALA 74 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2x9s h SER 75 N 0.00 0.61 0.00 0.00 0.02 -1.94 -3.33 113.55 108.91 2x9s h SER 75 Ca 0.00 -0.65 -0.07 0.00 -0.84 0.00 0.00 61.79 60.22 2x9s h SER 75 Cb 0.08 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2x9s h SER 75 CO 0.00 1.51 -0.51 0.22 -1.14 0.00 0.00 176.83 176.91 2x9s h TYR 76 N 0.11 0.00 0.00 3.45 5.03 -1.13 -3.37 116.97 121.06 2x9s h TYR 76 Ca -0.19 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.12 2x9s h TYR 76 Cb 2.06 0.00 0.00 0.00 1.55 0.00 0.00 36.73 40.34 2x9s h TYR 76 CO 0.09 0.76 0.69 -0.07 -1.32 0.00 0.00 178.16 178.31 2x9s h LEU 77 N -1.00 0.00 0.00 2.82 3.38 -1.60 0.60 115.31 119.51 2x9s h LEU 77 Ca -0.11 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.72 2x9s h LEU 77 Cb 0.81 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 2x9s h LEU 77 CO -0.07 0.00 -0.94 0.40 0.09 0.00 0.00 178.44 177.92 2x9s h ILE 78 N 0.00 0.71 0.00 1.22 2.04 -1.71 -3.27 117.51 116.50 2x9s h ILE 78 Ca 0.00 -2.13 0.00 0.00 1.00 0.00 0.00 64.86 63.73 2x9s h ILE 78 Cb 1.38 2.24 0.00 0.00 -0.74 0.00 0.00 36.82 39.71 2x9s h ILE 78 CO 0.00 0.40 0.00 0.08 0.00 0.00 0.00 178.15 178.63 2x9s h ARG 79 N 0.00 0.00 0.02 2.37 -0.00 0.04 -2.30 114.38 114.51 2x9s h ARG 79 Ca -0.08 0.00 -0.11 0.00 -0.00 0.00 0.00 59.98 59.79 2x9s h ARG 79 Cb 1.48 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 31.46 2x9s h ARG 79 CO 0.06 0.00 -0.45 0.87 -0.00 0.00 0.00 179.97 180.45 2x9s h LYS 80 N 0.00 0.27 -0.35 0.08 1.57 -1.61 0.43 116.57 116.96 2x9s h LYS 80 Ca 0.00 -0.32 -0.02 0.00 -1.87 0.00 0.00 60.65 58.45 2x9s h LYS 80 Cb 0.53 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.92 2x9s h LYS 80 CO 0.00 1.04 0.16 0.00 -0.57 0.00 0.00 179.45 180.08 2x9s h ALA 81 N 0.24 0.45 0.00 3.86 0.00 -1.61 -3.33 119.26 118.88 2x9s h ALA 81 Ca -0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2x9s h ALA 81 Cb 1.21 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2x9s h ALA 81 CO 0.09 0.03 -0.49 0.00 0.00 0.00 0.00 179.25 178.87 2x9s h ALA 82 N 1.01 0.07 0.00 0.00 0.00 -1.44 -3.47 119.26 115.43 2x9s h ALA 82 Ca 0.12 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2x9s h ALA 82 Cb 0.14 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2x9s h ALA 82 CO -0.01 0.34 0.00 0.41 0.00 0.00 0.00 179.25 179.99 2x9s n GLY 83 N 1.60 3.98 3.35 0.00 0.00 0.15 -4.53 105.19 109.75 2x9s n GLY 83 Ca -0.13 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 44.75 2x9s n GLY 83 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2x9s n LEU 84 N 0.00 -1.02 -0.06 0.99 -0.00 -1.24 -4.82 117.00 110.85 2x9s n LEU 84 Ca 0.00 0.43 -0.20 0.00 -0.00 0.00 0.00 56.01 56.24 2x9s n LEU 84 Cb 0.00 -1.11 -0.13 0.00 -0.00 0.00 0.00 43.42 42.18 2x9s n LEU 84 CO 0.00 -3.91 -1.04 -0.62 -0.00 0.00 0.00 177.39 171.82 2x9s n GLU 85 N -0.38 0.70 0.00 1.47 1.02 -1.26 -4.62 120.64 117.57 2x9s n GLU 85 Ca 0.07 0.23 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 2x9s n GLU 85 Cb 0.52 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2x9s n GLU 85 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2x9s n LYS 86 N -3.48 0.00 0.00 3.49 5.02 -1.26 -5.03 118.16 116.90 2x9s n LYS 86 Ca -0.39 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 55.99 2x9s n LYS 86 Cb 1.00 -0.57 0.00 0.00 -0.02 0.00 0.00 35.03 35.44 2x9s n LYS 86 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2x9s n GLY 87 N 1.64 2.11 0.00 0.72 0.00 -1.26 -5.04 105.19 103.36 2x9s n GLY 87 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2x9s n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x9s n ALA 88 N 0.00 0.00 0.03 4.61 0.00 -1.22 -4.16 120.51 119.76 2x9s n ALA 88 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 2x9s n ALA 88 Cb 0.00 0.00 0.41 0.00 0.00 0.00 0.00 19.45 19.86 2x9s n ALA 88 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2x9s h HIS 89 N 0.00 0.47 -2.80 0.00 2.76 -1.98 -3.40 115.15 110.20 2x9s h HIS 89 Ca 0.00 -0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 57.95 2x9s h HIS 89 Cb 0.00 -0.15 -0.32 0.00 1.55 0.00 0.00 27.41 28.48 2x9s h HIS 89 CO 0.00 0.34 -0.53 -1.59 -1.30 0.00 0.00 177.93 174.85 2x9s s LYS 90 N -5.31 0.16 0.00 5.26 -2.85 -1.26 -5.17 119.74 110.57 2x9s s LYS 90 Ca -0.08 0.72 0.00 0.00 -1.00 0.00 0.00 55.97 55.61 2x9s s LYS 90 Cb 0.17 -0.12 0.00 0.00 -2.06 0.00 0.00 37.83 35.82 2x9s s LYS 90 CO 0.73 -0.32 0.00 -0.35 0.10 0.00 0.00 175.35 175.51 2x9s n PRO 91 N 5.35 -0.48 0.00 1.78 -0.04 -1.26 -4.91 135.00 135.45 2x9s n PRO 91 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 2x9s n PRO 91 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 2x9s n PRO 91 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2x9s n GLY 92 N 2.46 0.80 0.01 0.55 0.00 -1.26 -4.80 105.19 102.96 2x9s n GLY 92 Ca 0.00 -0.61 0.03 0.00 0.00 0.00 0.00 46.02 45.44 2x9s n GLY 92 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2x9s n ARG 93 N 0.00 0.78 -4.26 1.61 0.00 -1.26 -4.92 116.66 108.61 2x9s n ARG 93 Ca 0.00 -0.08 -0.35 0.00 -0.00 0.00 0.00 57.85 57.42 2x9s n ARG 93 Cb 0.00 -1.25 -0.09 0.00 0.00 0.00 0.00 32.46 31.12 2x9s n ARG 93 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 2x9s s GLU 94 N -2.62 3.20 -0.18 -0.14 -6.30 -1.26 -4.97 118.70 106.42 2x9s s GLU 94 Ca -0.04 -0.36 -0.28 0.00 -2.50 0.00 0.00 54.97 51.79 2x9s s GLU 94 Cb 0.06 -2.91 0.09 0.00 0.00 0.00 0.00 34.13 31.38 2x9s s GLU 94 CO 0.43 0.65 0.84 -1.59 0.02 0.00 0.00 175.26 175.60 2x9s s LYS 95 N -0.71 0.78 0.00 4.30 0.00 -1.26 -4.79 119.74 118.06 2x9s s LYS 95 Ca 0.12 0.51 0.00 0.00 0.00 0.00 0.00 55.97 56.59 2x9s s LYS 95 Cb -0.12 0.37 0.00 0.00 0.00 0.00 0.00 37.83 38.09 2x9s s LYS 95 CO 0.02 -0.18 0.68 1.33 0.00 0.00 0.00 175.35 177.21 2x9s n VAL 96 N 1.63 0.39 -4.31 1.79 0.24 -1.26 -4.77 118.33 112.05 2x9s n VAL 96 Ca -0.14 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 61.97 2x9s n VAL 96 Cb 0.56 -0.69 -0.09 0.00 -1.47 0.00 0.00 33.84 32.16 2x9s n VAL 96 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2x9s s GLY 97 N 0.39 2.09 -0.03 7.63 0.00 -1.26 -4.37 107.32 111.76 2x9s s GLY 97 Ca 0.00 -1.81 -0.10 0.00 0.00 0.00 0.00 44.72 42.81 2x9s s GLY 97 CO 0.00 -1.54 0.22 0.50 0.00 0.00 0.00 173.10 172.29 2x9s s ARG 98 N -3.74 0.48 -0.27 2.90 0.52 -1.26 -2.93 118.95 114.65 2x9s s ARG 98 Ca 0.37 -0.10 -0.01 0.00 -0.52 0.00 0.00 55.73 55.47 2x9s s ARG 98 Cb 0.04 0.21 0.13 0.00 0.52 0.00 0.00 34.95 35.86 2x9s s ARG 98 CO 0.20 -0.11 0.33 0.42 0.02 0.00 0.00 175.30 176.16 2x9s s ILE 99 N -0.88 -0.49 1.11 1.52 1.01 -0.65 -3.46 121.20 119.36 2x9s s ILE 99 Ca -0.10 -0.29 -0.19 0.00 0.00 0.00 0.00 60.65 60.07 2x9s s ILE 99 Cb -0.05 -0.90 0.29 0.00 0.01 0.00 0.00 42.46 41.80 2x9s s ILE 99 CO 0.02 -0.31 0.73 0.35 0.00 0.00 0.00 174.94 175.73 2x9s n THR 100 N 5.33 0.00 0.21 2.92 -2.24 -1.26 -0.42 114.28 118.82 2x9s n THR 100 Ca -0.02 -0.10 -0.09 0.00 -2.27 0.00 0.00 64.05 61.57 2x9s n THR 100 Cb 0.48 -0.88 -0.04 0.00 -2.10 0.00 0.00 70.33 67.79 2x9s n THR 100 CO 0.00 0.00 0.00 -0.50 -0.57 0.00 0.00 175.07 174.00 2x9s h TRP 101 N -3.10 -0.58 0.00 4.78 4.06 -1.89 -2.71 115.95 116.51 2x9s h TRP 101 Ca -0.31 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.63 2x9s h TRP 101 Cb 1.03 0.20 0.00 0.00 -1.00 0.00 0.00 29.16 29.39 2x9s h TRP 101 CO 0.00 -0.34 0.00 -0.85 -3.56 0.00 0.00 178.44 173.69 2x9s n GLU 102 N -3.64 0.65 0.20 0.49 0.00 -1.26 -2.46 120.64 114.61 2x9s n GLU 102 Ca -0.07 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.13 2x9s n GLU 102 Cb 0.23 -1.49 0.40 0.00 0.00 0.00 0.00 31.44 30.58 2x9s n GLU 102 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 2x9s h GLN 103 N 0.00 0.00 -0.00 3.44 5.75 -1.81 -1.32 115.11 121.18 2x9s h GLN 103 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2x9s h GLN 103 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 2x9s h GLN 103 CO 0.00 0.33 -0.14 0.28 -2.65 0.00 0.00 178.83 176.64 2x9s n VAL 104 N -4.11 0.00 0.30 2.39 0.31 -1.03 -2.93 118.33 113.26 2x9s n VAL 104 Ca -0.02 -0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.42 2x9s n VAL 104 Cb 0.37 -0.27 0.19 0.00 -0.91 0.00 0.00 33.84 33.22 2x9s n VAL 104 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2x9s n LEU 105 N -1.47 3.30 0.06 7.52 4.32 -0.52 -3.63 117.00 126.58 2x9s n LEU 105 Ca 0.07 -1.48 -0.06 0.00 -0.02 0.00 0.00 56.01 54.51 2x9s n LEU 105 Cb 0.33 -0.22 -0.11 0.00 -1.62 0.00 0.00 43.42 41.81 2x9s n LEU 105 CO 0.29 0.71 0.13 -0.33 -1.22 0.00 0.00 177.39 176.97 2x9s h GLU 106 N 4.13 0.00 -0.00 3.23 5.08 -1.36 -2.73 114.58 122.92 2x9s h GLU 106 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2x9s h GLU 106 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2x9s h GLU 106 CO 0.00 0.92 -0.46 1.51 -1.00 0.00 0.00 179.01 179.98 2x9s n ILE 107 N -3.32 0.00 0.28 3.13 0.13 -1.25 -3.63 119.36 114.71 2x9s n ILE 107 Ca -0.01 -0.02 0.16 0.00 -1.10 0.00 0.00 62.75 61.78 2x9s n ILE 107 Cb 0.93 0.26 0.83 0.00 -0.84 0.00 0.00 39.64 40.81 2x9s n ILE 107 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2x9s h ALA 108 N 3.08 1.17 -0.01 1.51 0.00 -1.55 0.24 119.26 123.71 2x9s h ALA 108 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2x9s h ALA 108 Cb 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2x9s h ALA 108 CO 0.00 0.09 -0.20 0.36 0.00 0.00 0.00 179.25 179.49 2x9s n LYS 109 N -3.42 1.08 0.00 0.00 2.85 -1.24 -4.40 118.16 113.03 2x9s n LYS 109 Ca -0.02 -0.65 0.00 0.00 -1.05 0.00 0.00 58.31 56.59 2x9s n LYS 109 Cb 0.21 -1.49 0.00 0.00 -0.65 0.00 0.00 35.03 33.11 2x9s n LYS 109 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 2x9s n GLN 110 N -0.39 0.00 -2.76 -1.58 1.13 0.58 -4.91 117.38 109.45 2x9s n GLN 110 Ca 0.14 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.77 2x9s n GLN 110 Cb 0.36 -0.41 -0.04 0.00 0.11 0.00 0.00 30.24 30.26 2x9s n GLN 110 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2x9s s LYS 111 N -0.85 3.49 0.00 -1.09 1.02 0.31 -4.64 119.74 117.97 2x9s s LYS 111 Ca 0.00 0.09 0.00 0.00 0.02 0.00 0.00 55.97 56.08 2x9s s LYS 111 Cb 0.00 -3.98 0.00 0.00 -0.52 0.00 0.00 37.83 33.33 2x9s s LYS 111 CO 0.00 -1.41 0.00 -1.33 -0.92 0.00 0.00 175.35 171.69 2x9s n MET 112 N 7.57 0.00 0.00 1.68 2.81 -1.26 -4.69 117.12 123.23 2x9s n MET 112 Ca 0.06 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 2x9s n MET 112 Cb 0.48 -0.45 0.00 0.00 -0.71 0.00 0.00 33.22 32.55 2x9s n MET 112 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 2x9s n PRO 113 N -0.96 0.00 0.00 0.03 -0.02 -1.26 -4.38 135.00 128.40 2x9s n PRO 113 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2x9s n PRO 113 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2x9s n PRO 113 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2x9s n ASP 114 N 0.00 0.15 -0.19 2.55 9.92 -1.26 -3.85 116.55 123.86 2x9s n ASP 114 Ca 0.00 -0.61 -0.07 0.00 -0.53 0.00 0.00 54.79 53.58 2x9s n ASP 114 Cb 0.00 -0.07 0.02 0.00 -0.64 0.00 0.00 41.12 40.43 2x9s n ASP 114 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2x9s h LEU 115 N 0.33 0.69 0.00 0.64 3.38 -1.95 -3.47 115.31 114.94 2x9s h LEU 115 Ca 0.00 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2x9s h LEU 115 Cb 0.07 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2x9s h LEU 115 CO 0.00 0.61 0.00 0.59 0.09 0.00 0.00 178.44 179.73 2x9s n ASN 116 N -4.59 0.00 -4.47 -0.43 5.03 -1.25 -5.11 115.26 104.44 2x9s n ASN 116 Ca 0.03 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 55.14 2x9s n ASN 116 Cb 0.11 0.00 -0.13 0.00 -1.02 0.00 0.00 39.78 38.74 2x9s n ASN 116 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2x9s s THR 117 N -0.02 3.43 0.17 3.41 -4.23 -1.26 -5.03 115.64 112.11 2x9s s THR 117 Ca 0.00 -0.55 -0.09 0.00 -1.18 0.00 0.00 61.69 59.87 2x9s s THR 117 Cb 0.00 -2.44 0.01 0.00 1.34 0.00 0.00 72.50 71.41 2x9s s THR 117 CO 0.00 0.54 1.56 0.74 -0.54 0.00 0.00 174.62 176.92 2x9s h THR 118 N 4.90 1.27 -3.12 3.99 2.02 -1.86 -3.45 112.91 116.66 2x9s h THR 118 Ca -0.36 -1.38 -0.40 0.00 0.77 0.00 0.00 66.41 65.04 2x9s h THR 118 Cb 1.19 1.14 0.21 0.00 -1.74 0.00 0.00 68.15 68.95 2x9s h THR 118 CO 0.56 0.48 -0.07 1.51 0.37 0.00 0.00 175.52 178.37 2x9s s ASP 119 N -6.73 -0.26 -0.11 4.18 3.84 -1.26 -4.86 116.67 111.47 2x9s s ASP 119 Ca -0.11 1.11 0.08 0.00 -0.00 0.00 0.00 52.55 53.63 2x9s s ASP 119 Cb 0.12 -1.65 -0.24 0.00 -1.38 0.00 0.00 42.92 39.78 2x9s s ASP 119 CO 0.87 -4.91 0.40 0.18 -0.00 0.00 0.00 175.17 171.71 2x9s n LEU 120 N -5.35 1.31 0.05 2.11 4.32 -1.26 -4.21 117.00 113.96 2x9s n LEU 120 Ca 0.08 0.24 0.01 0.00 -0.02 0.00 0.00 56.01 56.32 2x9s n LEU 120 Cb 0.58 -0.17 -0.07 0.00 -1.62 0.00 0.00 43.42 42.14 2x9s n LEU 120 CO 0.49 0.57 -0.21 1.05 -1.22 0.00 0.00 177.39 178.07 2x9s h GLU 121 N 0.02 0.00 -0.15 3.23 -0.00 -1.95 -2.50 114.58 113.22 2x9s h GLU 121 Ca -0.39 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.97 2x9s h GLU 121 Cb 2.05 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.80 2x9s h GLU 121 CO 0.06 0.29 0.00 0.00 -0.00 0.00 0.00 179.01 179.35 2x9s n ALA 122 N -2.37 2.52 -0.08 1.06 0.00 -1.26 -3.53 120.51 116.86 2x9s n ALA 122 Ca -0.08 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 52.94 2x9s n ALA 122 Cb 0.81 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 19.16 2x9s n ALA 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x9s n ALA 123 N 0.07 0.94 0.03 0.00 0.00 -1.25 -4.76 120.51 115.55 2x9s n ALA 123 Ca 0.14 -0.03 -0.14 0.00 0.00 0.00 0.00 53.44 53.41 2x9s n ALA 123 Cb 0.25 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.56 2x9s n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x9s h ALA 124 N 0.00 0.43 0.00 0.00 0.00 -1.49 -3.28 119.26 114.93 2x9s h ALA 124 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 54.91 53.70 2x9s h ALA 124 Cb 0.04 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2x9s h ALA 124 CO 0.00 1.29 0.00 2.89 0.00 0.00 0.00 179.25 183.43 2x9s n ARG 125 N -3.33 0.16 0.04 0.00 1.85 -1.25 -0.81 116.66 113.33 2x9s n ARG 125 Ca -0.16 0.04 -0.22 0.00 -1.00 0.00 0.00 57.85 56.51 2x9s n ARG 125 Cb 1.03 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.80 2x9s n ARG 125 CO 0.00 0.00 0.00 0.52 -0.01 0.00 0.00 177.63 178.14 2x9s h MET 126 N 0.00 0.33 0.00 2.89 2.86 -1.90 -3.31 114.93 115.80 2x9s h MET 126 Ca 0.00 -0.57 0.00 0.00 -2.06 0.00 0.00 59.70 57.07 2x9s h MET 126 Cb 0.01 0.21 0.00 0.00 0.06 0.00 0.00 31.60 31.88 2x9s h MET 126 CO 0.00 1.27 0.00 0.82 1.06 0.00 0.00 176.91 180.06 2x9s h ILE 127 N -0.02 0.00 0.00 -1.22 2.04 -1.15 -1.40 117.51 115.75 2x9s h ILE 127 Ca -0.35 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.05 2x9s h ILE 127 Cb 1.99 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 39.43 2x9s h ILE 127 CO 0.13 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.28 2x9s n ALA 128 N -1.88 1.80 0.06 1.87 0.00 -0.99 -1.78 120.51 119.59 2x9s n ALA 128 Ca 0.03 0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.51 2x9s n ALA 128 Cb 0.34 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 18.37 2x9s n ALA 128 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2x9s h GLY 129 N 2.85 0.00 1.44 0.00 0.00 -1.38 -3.20 103.07 102.78 2x9s h GLY 129 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2x9s h GLY 129 CO 0.00 0.00 -0.01 -1.26 0.00 0.00 0.00 176.54 175.27 2x9s n SER 130 N -2.92 0.05 -0.86 0.19 2.88 -0.73 -1.91 113.62 110.33 2x9s n SER 130 Ca -0.07 -0.27 0.11 0.00 -1.33 0.00 0.00 58.87 57.31 2x9s n SER 130 Cb 0.79 -0.23 0.28 0.00 -0.75 0.00 0.00 64.21 64.30 2x9s n SER 130 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2x9s n ALA 131 N -1.22 2.47 -0.47 -1.46 0.00 -1.13 -2.70 120.51 115.99 2x9s n ALA 131 Ca 0.15 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.83 2x9s n ALA 131 Cb 0.23 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.71 2x9s n ALA 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2x9s n ARG 132 N 0.92 1.46 -0.06 0.00 1.74 -0.80 -4.17 116.66 115.75 2x9s n ARG 132 Ca 0.18 -0.98 -0.10 0.00 -0.77 0.00 0.00 57.85 56.17 2x9s n ARG 132 Cb 0.47 -0.76 -0.03 0.00 -1.02 0.00 0.00 32.46 31.11 2x9s n ARG 132 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2x9s n SER 133 N -0.25 1.50 0.03 0.55 2.88 -1.07 -4.69 113.62 112.57 2x9s n SER 133 Ca 0.00 0.24 -0.06 0.00 -1.33 0.00 0.00 58.87 57.72 2x9s n SER 133 Cb 0.35 -0.57 -0.11 0.00 -0.75 0.00 0.00 64.21 63.14 2x9s n SER 133 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 2x9s h MET 134 N -0.63 0.00 0.00 -1.46 2.86 -1.81 -3.40 114.93 110.50 2x9s h MET 134 Ca -0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 2x9s h MET 134 Cb 0.90 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.56 2x9s h MET 134 CO -0.09 0.67 0.00 0.41 1.06 0.00 0.00 176.91 178.95 2x9s n GLY 135 N 1.43 3.54 0.00 8.32 0.00 -1.26 -3.45 105.19 113.77 2x9s n GLY 135 Ca -0.08 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.00 2x9s n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2x9s n VAL 136 N 0.00 0.00 -0.66 1.61 0.24 -1.26 -4.60 118.33 113.67 2x9s n VAL 136 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.99 2x9s n VAL 136 Cb 0.00 0.00 0.18 0.00 -1.47 0.00 0.00 33.84 32.55 2x9s n VAL 136 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2x9s n GLU 137 N 0.00 -1.36 -3.37 7.34 4.07 -1.15 -4.65 120.64 121.52 2x9s n GLU 137 Ca 0.00 -0.37 -0.26 0.00 -0.06 0.00 0.00 57.16 56.48 2x9s n GLU 137 Cb 0.00 -1.93 -0.09 0.00 -0.06 0.00 0.00 31.44 29.37 2x9s n GLU 137 CO 0.00 0.00 0.00 1.55 -0.06 0.00 0.00 177.13 178.62 2x9s n VAL 138 N -4.34 -0.27 -0.83 6.31 3.14 -1.25 -1.64 118.33 119.45 2x9s n VAL 138 Ca 0.04 -4.04 -0.16 0.00 -2.96 0.00 0.00 64.34 57.23 2x9s n VAL 138 Cb 0.57 -1.89 -0.11 0.00 -1.06 0.00 0.00 33.84 31.35 2x9s n VAL 138 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2x9s n VAL 139 N 1.92 0.00 0.00 1.55 0.31 0.44 -2.89 118.33 119.67 2x9s n VAL 139 Ca 0.25 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 2x9s n VAL 139 Cb 0.48 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.32 2x9s n VAL 139 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2x9s n GLY 140 N 3.24 0.61 0.00 2.92 0.00 -1.26 -3.66 105.19 107.04 2x9s n GLY 140 Ca 0.37 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.49 2x9s n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32