#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blj n SER 2 N 0.00 -3.19 0.08 1.61 7.64 -1.26 -4.91 113.62 113.60 1blj n SER 2 Ca 0.00 0.08 -0.10 0.00 1.01 0.00 0.00 58.87 59.86 1blj n SER 2 Cb 0.00 -1.45 -0.08 0.00 -1.01 0.00 0.00 64.21 61.67 1blj n SER 2 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1blj h VAL 3 N 0.00 1.57 -1.51 0.44 2.07 -2.04 -3.37 116.25 113.40 1blj h VAL 3 Ca -0.10 -3.01 -0.42 0.00 0.82 0.00 0.00 66.70 63.99 1blj h VAL 3 Cb 0.49 2.73 -0.29 0.00 -1.52 0.00 0.00 31.29 32.69 1blj h VAL 3 CO 0.13 0.87 -0.83 0.00 0.02 0.00 0.00 177.57 177.77 1blj n ALA 4 N -2.44 0.95 -2.06 1.67 0.00 -1.26 -5.13 120.51 112.24 1blj n ALA 4 Ca -0.04 -2.45 -0.43 0.00 0.00 0.00 0.00 53.44 50.53 1blj n ALA 4 Cb 0.91 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.30 1blj n ALA 4 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1blj s PRO 5 N -0.04 3.81 -0.32 0.00 0.04 -1.26 -4.81 135.00 132.42 1blj s PRO 5 Ca 0.33 1.77 -0.06 0.00 0.04 0.00 0.00 61.00 63.08 1blj s PRO 5 Cb 0.11 -4.05 0.24 0.00 0.04 0.00 0.00 34.50 30.84 1blj s PRO 5 CO -0.15 -1.28 1.19 1.55 0.04 0.00 0.00 177.00 178.34 1blj n VAL 6 N 6.36 0.00 -0.72 -0.36 3.14 -1.26 -5.07 118.33 120.42 1blj n VAL 6 Ca 0.19 -0.28 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 1blj n VAL 6 Cb 0.45 0.74 0.00 0.00 -1.06 0.00 0.00 33.84 33.96 1blj n VAL 6 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1blj n GLU 7 N 2.15 -0.99 -2.74 1.45 0.00 -1.26 -5.07 120.64 114.18 1blj n GLU 7 Ca 0.07 1.06 -0.09 0.00 0.00 0.00 0.00 57.16 58.20 1blj n GLU 7 Cb 0.68 -0.76 0.07 0.00 0.00 0.00 0.00 31.44 31.43 1blj n GLU 7 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1blj n THR 8 N 0.25 0.00 -3.10 6.31 5.66 -1.26 -5.05 114.28 117.09 1blj n THR 8 Ca 0.00 -1.50 0.02 0.00 -3.05 0.00 0.00 64.05 59.52 1blj n THR 8 Cb 0.00 1.50 -0.00 0.00 -1.55 0.00 0.00 70.33 70.27 1blj n THR 8 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1blj s LEU 9 N -1.51 -1.21 0.00 1.09 0.05 -1.26 -5.01 118.68 110.83 1blj s LEU 9 Ca 0.27 -0.49 0.29 0.00 0.05 0.00 0.00 54.13 54.25 1blj s LEU 9 Cb 0.26 1.58 1.72 0.00 -2.05 0.00 0.00 46.19 47.70 1blj s LEU 9 CO -0.15 -0.15 2.11 -1.84 -0.55 0.00 0.00 176.35 175.77 1blj n GLU 10 N 4.39 1.00 0.00 1.48 0.28 -1.26 -4.40 120.64 122.12 1blj n GLU 10 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.09 1blj n GLU 10 Cb 0.58 -1.45 0.00 0.00 1.43 0.00 0.00 31.44 32.00 1blj n GLU 10 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 1blj n VAL 11 N -0.95 0.00 -4.96 3.84 0.24 -1.26 -5.04 118.33 110.20 1blj n VAL 11 Ca 0.22 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.52 1blj n VAL 11 Cb 0.10 -0.11 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 1blj n VAL 11 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1blj n GLU 12 N 0.00 0.00 0.00 7.34 1.02 -1.26 -4.88 120.64 122.86 1blj n GLU 12 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1blj n GLU 12 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1blj n GLU 12 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1blj n LYS 13 N 0.00 0.00 -0.23 3.49 4.76 -1.26 -4.60 118.16 120.32 1blj n LYS 13 Ca 0.00 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.37 1blj n LYS 13 Cb 0.00 -0.09 0.06 0.00 -1.84 0.00 0.00 35.03 33.16 1blj n LYS 13 CO 0.00 0.00 0.00 0.11 -1.37 0.00 0.00 177.40 176.14 1blj h TRP 14 N 0.00 1.15 -3.68 2.13 -0.00 -1.88 -3.29 115.95 110.38 1blj h TRP 14 Ca 0.00 -0.16 -0.66 0.00 -0.00 0.00 0.00 58.89 58.08 1blj h TRP 14 Cb 0.00 -0.32 -0.17 0.00 -0.00 0.00 0.00 29.16 28.67 1blj h TRP 14 CO 0.00 0.96 -0.28 0.12 -0.00 0.00 0.00 178.44 179.24 1blj s PHE 15 N -5.20 3.21 0.51 0.12 5.36 -1.26 -0.77 117.98 119.95 1blj s PHE 15 Ca -0.12 0.02 0.01 0.00 -0.96 0.00 0.00 56.93 55.88 1blj s PHE 15 Cb 0.14 -2.66 -0.00 0.00 -0.34 0.00 0.00 43.02 40.16 1blj s PHE 15 CO 0.85 -0.41 0.02 1.19 -1.46 0.00 0.00 175.22 175.41 1blj n PHE 16 N 5.38 1.05 -3.97 10.12 3.01 -1.04 -4.79 117.46 127.21 1blj n PHE 16 Ca -0.09 -2.62 -0.09 0.00 1.01 0.00 0.00 57.45 55.66 1blj n PHE 16 Cb 0.50 -0.29 -0.01 0.00 -0.01 0.00 0.00 39.48 39.66 1blj n PHE 16 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1blj n ARG 17 N -1.26 1.46 -1.79 -1.08 1.74 -1.26 -4.14 116.66 110.34 1blj n ARG 17 Ca -0.19 -1.11 -0.30 0.00 -0.77 0.00 0.00 57.85 55.48 1blj n ARG 17 Cb 0.66 0.23 -0.07 0.00 -1.02 0.00 0.00 32.46 32.26 1blj n ARG 17 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1blj n THR 18 N -0.61 1.59 -3.72 0.55 5.66 -1.25 -2.61 114.28 113.88 1blj n THR 18 Ca -0.04 -1.60 -0.21 0.00 -3.05 0.00 0.00 64.05 59.15 1blj n THR 18 Cb 0.20 -2.17 -0.01 0.00 -1.55 0.00 0.00 70.33 66.80 1blj n THR 18 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1blj s ILE 19 N 10.71 4.98 0.70 1.09 2.07 -1.26 -4.94 121.20 134.54 1blj s ILE 19 Ca 0.68 -0.86 -0.12 0.00 -1.41 0.00 0.00 60.65 58.95 1blj s ILE 19 Cb 0.02 -3.77 0.01 0.00 0.13 0.00 0.00 42.46 38.86 1blj s ILE 19 CO 0.15 -0.35 1.07 -0.55 -1.91 0.00 0.00 174.94 173.35 1blj s SER 20 N -4.03 5.17 0.22 4.50 0.15 -1.26 -4.84 113.70 113.60 1blj s SER 20 Ca 0.38 1.73 -0.09 0.00 0.70 0.00 0.00 55.95 58.67 1blj s SER 20 Cb -0.09 -2.51 0.32 0.00 -1.71 0.00 0.00 66.02 62.03 1blj s SER 20 CO 0.31 -1.59 1.70 -0.09 1.20 0.00 0.00 173.24 174.78 1blj h ARG 21 N -0.62 0.26 0.00 5.44 2.43 -2.00 0.04 114.38 119.93 1blj h ARG 21 Ca -0.44 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1blj h ARG 21 Cb 1.22 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1blj h ARG 21 CO 0.55 0.17 0.00 1.57 -1.51 0.00 0.00 179.97 180.75 1blj h LYS 22 N 0.27 0.00 0.03 0.20 -0.00 -1.98 -2.66 116.57 112.42 1blj h LYS 22 Ca 0.33 0.00 -0.17 0.00 -0.00 0.00 0.00 60.65 60.82 1blj h LYS 22 Cb 0.50 0.00 0.02 0.00 -0.00 0.00 0.00 32.23 32.75 1blj h LYS 22 CO -0.42 0.00 -0.67 -0.44 -0.00 0.00 0.00 179.45 177.92 1blj h ASP 23 N 0.00 0.53 -0.58 7.07 3.32 -1.37 -0.35 116.42 125.03 1blj h ASP 23 Ca 0.00 -0.80 -0.07 0.00 0.02 0.00 0.00 57.03 56.18 1blj h ASP 23 Cb 0.66 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.02 1blj h ASP 23 CO 0.00 1.27 0.12 0.00 -1.72 0.00 0.00 179.24 178.91 1blj h ALA 24 N 0.27 1.05 -0.21 3.45 0.00 -1.32 -1.39 119.26 121.11 1blj h ALA 24 Ca -0.09 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 1blj h ALA 24 Cb 1.41 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1blj h ALA 24 CO 0.13 0.62 -0.11 0.93 0.00 0.00 0.00 179.25 180.81 1blj h GLU 25 N 0.93 0.34 0.00 0.00 5.08 -1.45 -1.48 114.58 118.00 1blj h GLU 25 Ca 0.19 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.43 1blj h GLU 25 Cb 0.37 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1blj h GLU 25 CO 0.01 0.46 -0.22 0.07 -1.00 0.00 0.00 179.01 178.33 1blj h ARG 26 N 0.32 0.00 0.23 2.33 0.11 0.06 -0.85 114.38 116.58 1blj h ARG 26 Ca 0.06 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.13 1blj h ARG 26 Cb 0.40 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.48 1blj h ARG 26 CO 0.02 0.22 -0.11 1.96 0.10 0.00 0.00 179.97 182.16 1blj h GLN 27 N 0.00 -0.29 0.00 0.08 1.08 -0.89 -3.29 115.11 111.79 1blj h GLN 27 Ca -0.00 0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.18 1blj h GLN 27 Cb 0.43 0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.92 1blj h GLN 27 CO 0.03 -0.20 -0.18 -0.07 -0.95 0.00 0.00 178.83 177.46 1blj h LEU 28 N -0.78 0.00 -0.28 1.46 3.38 -1.45 -1.50 115.31 116.14 1blj h LEU 28 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1blj h LEU 28 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1blj h LEU 28 CO 0.05 0.18 0.00 0.18 0.09 0.00 0.00 178.44 178.94 1blj n LEU 29 N -4.30 0.24 -4.65 1.67 4.77 -0.33 -4.75 117.00 109.65 1blj n LEU 29 Ca -0.02 0.56 -0.47 0.00 -0.03 0.00 0.00 56.01 56.05 1blj n LEU 29 Cb 0.24 -0.54 -0.04 0.00 -2.33 0.00 0.00 43.42 40.76 1blj n LEU 29 CO 0.36 -0.39 1.04 0.00 -1.33 0.00 0.00 177.39 177.06 1blj n ALA 30 N -1.60 0.76 0.41 -1.18 0.00 -0.57 -4.81 120.51 113.52 1blj n ALA 30 Ca 0.03 0.44 0.04 0.00 0.00 0.00 0.00 53.44 53.95 1blj n ALA 30 Cb 0.17 -2.25 0.20 0.00 0.00 0.00 0.00 19.45 17.57 1blj n ALA 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1blj n PRO 31 N 2.58 0.18 0.09 0.00 -0.04 -1.26 -2.13 135.00 134.42 1blj n PRO 31 Ca 0.15 0.08 0.13 0.00 -0.04 0.00 0.00 63.50 63.82 1blj n PRO 31 Cb 0.28 -1.50 0.44 0.00 -0.04 0.00 0.00 33.50 32.68 1blj n PRO 31 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1blj n MET 32 N -1.10 0.21 -4.17 0.54 2.81 -1.26 -4.90 117.12 109.25 1blj n MET 32 Ca 0.05 0.23 -0.21 0.00 -1.81 0.00 0.00 57.70 55.95 1blj n MET 32 Cb 0.04 -1.77 -0.07 0.00 -0.71 0.00 0.00 33.22 30.70 1blj n MET 32 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1blj n ASN 33 N -2.15 0.36 -3.63 7.83 4.13 -0.91 -4.86 115.26 116.03 1blj n ASN 33 Ca 0.05 -3.03 -0.11 0.00 1.68 0.00 0.00 54.58 53.17 1blj n ASN 33 Cb 0.38 1.23 -0.04 0.00 -1.54 0.00 0.00 39.78 39.81 1blj n ASN 33 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1blj s LYS 34 N -3.36 1.73 -0.44 3.52 0.00 -1.26 -4.92 119.74 115.00 1blj s LYS 34 Ca 0.27 -1.47 -0.45 0.00 0.00 0.00 0.00 55.97 54.32 1blj s LYS 34 Cb 0.01 0.47 -0.19 0.00 0.00 0.00 0.00 37.83 38.12 1blj s LYS 34 CO 0.19 -0.72 1.61 0.00 0.00 0.00 0.00 175.35 176.42 1blj n ALA 35 N -0.46 -1.23 0.00 0.59 0.00 -1.24 -1.06 120.51 117.11 1blj n ALA 35 Ca -0.01 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1blj n ALA 35 Cb 0.62 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 18.10 1blj n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1blj n GLY 36 N 3.93 2.71 3.64 0.00 0.00 -1.26 -4.81 105.19 109.40 1blj n GLY 36 Ca 0.30 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 1blj n GLY 36 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1blj n SER 37 N 0.11 0.03 -0.88 1.61 3.41 -0.23 -1.51 113.62 116.16 1blj n SER 37 Ca 0.00 0.41 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1blj n SER 37 Cb 0.00 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.51 1blj n SER 37 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1blj n PHE 38 N -4.14 -0.37 -3.65 7.33 3.72 -1.26 -3.58 117.46 115.51 1blj n PHE 38 Ca 0.11 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.44 1blj n PHE 38 Cb 0.52 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.04 1blj n PHE 38 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1blj s LEU 39 N 0.00 -0.34 -0.43 4.37 1.43 -1.08 -3.30 118.68 119.33 1blj s LEU 39 Ca 0.00 -0.29 0.05 0.00 -1.03 0.00 0.00 54.13 52.86 1blj s LEU 39 Cb 0.00 2.44 0.17 0.00 0.03 0.00 0.00 46.19 48.83 1blj s LEU 39 CO 0.00 -1.01 0.51 -0.51 0.23 0.00 0.00 176.35 175.56 1blj s ILE 40 N -3.58 -0.47 0.49 -0.59 2.07 0.05 -2.02 121.20 117.15 1blj s ILE 40 Ca 0.08 -1.24 -0.21 0.00 -1.41 0.00 0.00 60.65 57.86 1blj s ILE 40 Cb -0.03 -0.51 -0.07 0.00 0.13 0.00 0.00 42.46 41.98 1blj s ILE 40 CO -0.02 -0.48 1.14 0.00 -1.91 0.00 0.00 174.94 173.66 1blj s ARG 41 N 1.00 3.61 0.35 3.50 1.04 -0.68 -2.51 118.95 125.27 1blj s ARG 41 Ca 0.24 1.68 0.03 0.00 -1.04 0.00 0.00 55.73 56.64 1blj s ARG 41 Cb -0.05 -2.23 -0.02 0.00 -2.04 0.00 0.00 34.95 30.61 1blj s ARG 41 CO -0.08 -0.65 0.52 -1.83 -0.04 0.00 0.00 175.30 173.23 1blj s GLU 42 N -2.95 3.29 -0.44 3.89 -1.05 -1.07 -0.03 118.70 120.33 1blj s GLU 42 Ca 0.67 -0.61 -0.16 0.00 -0.15 0.00 0.00 54.97 54.73 1blj s GLU 42 Cb -0.26 -2.72 0.04 0.00 -0.44 0.00 0.00 34.13 30.76 1blj s GLU 42 CO 0.31 0.08 0.37 0.45 0.95 0.00 0.00 175.26 177.42 1blj s SER 43 N -4.10 6.14 0.00 0.83 0.15 -0.18 -3.85 113.70 112.69 1blj s SER 43 Ca 0.42 -1.04 0.00 0.00 0.70 0.00 0.00 55.95 56.03 1blj s SER 43 Cb -0.10 -2.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 1blj s SER 43 CO 0.34 -0.57 0.72 -1.84 1.20 0.00 0.00 173.24 173.10 1blj n GLU 44 N 5.29 0.00 0.11 5.44 -0.00 -1.26 -1.96 120.64 128.26 1blj n GLU 44 Ca -0.11 0.22 0.09 0.00 -0.00 0.00 0.00 57.16 57.36 1blj n GLU 44 Cb 0.46 -1.50 0.01 0.00 -0.00 0.00 0.00 31.44 30.41 1blj n GLU 44 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1blj h SER 45 N 0.00 0.00 -3.00 -1.84 4.64 -1.94 -3.48 113.55 107.93 1blj h SER 45 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 1blj h SER 45 Cb 0.00 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 61.95 1blj h SER 45 CO 0.00 0.14 -0.64 0.54 -0.87 0.00 0.00 176.83 176.00 1blj s ASN 46 N -5.64 2.65 -0.01 4.97 4.22 -0.83 -5.06 114.94 115.25 1blj s ASN 46 Ca 0.00 -1.27 0.22 0.00 -2.14 0.00 0.00 52.86 49.67 1blj s ASN 46 Cb 0.09 -0.15 0.64 0.00 1.28 0.00 0.00 41.25 43.11 1blj s ASN 46 CO 0.77 -0.45 1.54 2.29 -2.04 0.00 0.00 177.10 179.21 1blj n LYS 47 N -0.64 2.79 0.00 3.55 -0.00 -1.26 -4.55 118.16 118.05 1blj n LYS 47 Ca -0.04 -2.66 0.00 0.00 -0.00 0.00 0.00 58.31 55.60 1blj n LYS 47 Cb 0.65 -1.58 0.00 0.00 -0.00 0.00 0.00 35.03 34.10 1blj n LYS 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1blj n GLY 48 N 1.59 0.68 3.68 2.58 0.00 -1.26 -5.11 105.19 107.36 1blj n GLY 48 Ca 0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 1blj n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1blj s ALA 49 N 0.00 3.51 0.07 4.61 0.00 -1.26 -3.38 121.76 125.30 1blj s ALA 49 Ca 0.00 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.24 1blj s ALA 49 Cb 0.00 -1.95 -0.00 0.00 0.00 0.00 0.00 23.12 21.17 1blj s ALA 49 CO 0.00 0.25 0.02 1.19 0.00 0.00 0.00 175.76 177.22 1blj n PHE 50 N 3.27 0.03 -3.17 0.00 3.01 -0.14 -1.01 117.46 119.45 1blj n PHE 50 Ca -0.17 -0.44 0.02 0.00 1.01 0.00 0.00 57.45 57.88 1blj n PHE 50 Cb 0.53 -0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.98 1blj n PHE 50 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1blj s SER 51 N -1.42 -1.24 -0.23 4.37 0.01 0.96 -3.00 113.70 113.15 1blj s SER 51 Ca 0.03 0.61 -0.29 0.00 1.31 0.00 0.00 55.95 57.61 1blj s SER 51 Cb 0.00 2.00 0.01 0.00 0.21 0.00 0.00 66.02 68.24 1blj s SER 51 CO 0.02 -0.28 1.04 -0.22 0.41 0.00 0.00 173.24 174.22 1blj s LEU 52 N 2.81 4.09 -0.19 2.44 2.96 -0.68 -1.68 118.68 128.44 1blj s LEU 52 Ca 0.17 1.37 -0.10 0.00 -0.22 0.00 0.00 54.13 55.35 1blj s LEU 52 Cb -0.14 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.96 1blj s LEU 52 CO -0.22 -0.68 0.13 -0.44 -1.32 0.00 0.00 176.35 173.82 1blj s SER 53 N 1.22 6.23 -0.00 3.68 0.01 -0.86 -1.59 113.70 122.40 1blj s SER 53 Ca 0.44 0.27 -0.04 0.00 1.31 0.00 0.00 55.95 57.93 1blj s SER 53 Cb -0.15 -2.09 -0.00 0.00 0.21 0.00 0.00 66.02 63.99 1blj s SER 53 CO 0.06 0.21 0.07 -0.69 0.41 0.00 0.00 173.24 173.31 1blj s VAL 54 N 0.15 0.07 -0.66 3.43 1.01 -1.23 -2.62 120.40 120.54 1blj s VAL 54 Ca 0.09 -0.57 -0.28 0.00 0.00 0.00 0.00 61.98 61.23 1blj s VAL 54 Cb -0.11 -0.29 0.03 0.00 0.00 0.00 0.00 36.38 36.01 1blj s VAL 54 CO -0.01 -0.31 1.26 -0.75 0.00 0.00 0.00 175.10 175.28 1blj s LYS 55 N -1.00 3.33 -0.50 2.72 2.20 -1.23 0.19 119.74 125.45 1blj s LYS 55 Ca -0.11 0.03 -0.26 0.00 -0.36 0.00 0.00 55.97 55.27 1blj s LYS 55 Cb -0.06 -4.11 0.03 0.00 -1.51 0.00 0.00 37.83 32.18 1blj s LYS 55 CO 0.00 -1.94 0.98 0.34 -0.36 0.00 0.00 175.35 174.38 1blj s ASP 56 N 3.48 6.46 -0.98 1.43 2.15 -0.66 -3.62 116.67 124.93 1blj s ASP 56 Ca 0.40 0.02 -0.14 0.00 0.43 0.00 0.00 52.55 53.25 1blj s ASP 56 Cb -0.08 -2.47 0.20 0.00 -0.30 0.00 0.00 42.92 40.27 1blj s ASP 56 CO 0.20 -1.17 1.06 -0.63 -0.17 0.00 0.00 175.17 174.46 1blj s ILE 57 N 4.02 5.35 0.57 4.11 1.01 -1.26 -1.00 121.20 134.00 1blj s ILE 57 Ca 0.37 -2.46 -0.01 0.00 0.00 0.00 0.00 60.65 58.55 1blj s ILE 57 Cb -0.10 -4.66 0.03 0.00 0.01 0.00 0.00 42.46 37.74 1blj s ILE 57 CO 0.25 -1.30 0.81 0.28 0.00 0.00 0.00 174.94 174.99 1blj s THR 58 N 0.80 2.90 -0.82 2.92 -1.32 -0.99 -4.99 115.64 114.14 1blj s THR 58 Ca 0.29 -0.50 0.19 0.00 -1.21 0.00 0.00 61.69 60.46 1blj s THR 58 Cb -0.07 -3.12 0.18 0.00 -1.51 0.00 0.00 72.50 67.97 1blj s THR 58 CO -0.07 -0.10 1.59 1.07 -2.21 0.00 0.00 174.62 174.90 1blj n THR 59 N -2.43 0.87 0.39 5.08 5.66 -1.26 -2.00 114.28 120.58 1blj n THR 59 Ca 0.07 0.21 0.12 0.00 -3.05 0.00 0.00 64.05 61.40 1blj n THR 59 Cb 0.59 -1.01 0.21 0.00 -1.55 0.00 0.00 70.33 68.57 1blj n THR 59 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 175.07 173.58 1blj h GLN 60 N 0.00 0.00 0.00 1.09 4.20 -1.97 -3.49 115.11 114.93 1blj h GLN 60 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1blj h GLN 60 Cb 0.32 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.10 1blj h GLN 60 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 1blj n GLY 61 N 1.22 0.14 3.60 3.46 0.00 -0.85 -5.08 105.19 107.68 1blj n GLY 61 Ca 0.04 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 43.97 1blj n GLY 61 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1blj s GLU 62 N -1.47 3.81 0.00 1.61 2.12 -1.26 -2.36 118.70 121.14 1blj s GLU 62 Ca 0.00 0.46 0.00 0.00 0.36 0.00 0.00 54.97 55.79 1blj s GLU 62 Cb 0.00 -3.80 0.00 0.00 0.26 0.00 0.00 34.13 30.59 1blj s GLU 62 CO 0.00 -0.89 0.00 1.33 -0.54 0.00 0.00 175.26 175.16 1blj n VAL 63 N 5.86 0.00 -4.22 3.70 0.24 -0.17 -5.01 118.33 118.73 1blj n VAL 63 Ca 0.05 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.25 1blj n VAL 63 Cb 0.48 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.83 1blj n VAL 63 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1blj n VAL 64 N 0.00 0.00 -4.09 3.34 0.31 -1.26 -1.65 118.33 114.98 1blj n VAL 64 Ca 0.00 -0.80 -0.11 0.00 -0.01 0.00 0.00 64.34 63.41 1blj n VAL 64 Cb 0.00 0.21 -0.07 0.00 -0.91 0.00 0.00 33.84 33.07 1blj n VAL 64 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1blj s LYS 65 N -2.58 1.51 -0.19 5.55 -0.14 0.13 -3.73 119.74 120.29 1blj s LYS 65 Ca 0.03 -1.50 -0.06 0.00 -1.36 0.00 0.00 55.97 53.07 1blj s LYS 65 Cb 0.00 0.39 0.09 0.00 -1.68 0.00 0.00 37.83 36.63 1blj s LYS 65 CO 0.02 -0.59 0.39 -1.01 -0.76 0.00 0.00 175.35 173.40 1blj s HIS 66 N -3.85 -0.74 -0.13 3.18 3.76 -1.20 -3.58 115.29 112.73 1blj s HIS 66 Ca 0.30 1.43 0.02 0.00 -0.15 0.00 0.00 55.06 56.66 1blj s HIS 66 Cb 0.02 0.25 0.01 0.00 1.11 0.00 0.00 32.58 33.97 1blj s HIS 66 CO 0.13 -0.47 -0.18 0.71 -0.85 0.00 0.00 174.74 174.08 1blj s TYR 67 N 2.58 2.36 -1.02 1.40 1.51 -0.62 -4.90 117.35 118.66 1blj s TYR 67 Ca -0.01 -1.20 -0.23 0.00 -1.01 0.00 0.00 57.07 54.62 1blj s TYR 67 Cb -0.12 -1.65 0.00 0.00 -0.11 0.00 0.00 41.96 40.08 1blj s TYR 67 CO -0.12 -0.58 1.72 -1.59 -1.11 0.00 0.00 175.55 173.86 1blj s LYS 68 N 0.98 3.13 -0.52 -0.62 0.00 -1.26 -1.68 119.74 119.77 1blj s LYS 68 Ca -0.05 -0.91 -0.28 0.00 0.00 0.00 0.00 55.97 54.73 1blj s LYS 68 Cb -0.15 -5.26 0.01 0.00 0.00 0.00 0.00 37.83 32.43 1blj s LYS 68 CO -0.03 -2.84 1.48 0.96 0.00 0.00 0.00 175.35 174.92 1blj s ILE 69 N 7.43 3.75 0.82 3.79 -0.00 -1.16 -4.24 121.20 131.59 1blj s ILE 69 Ca 0.58 0.67 -0.07 0.00 -0.00 0.00 0.00 60.65 61.83 1blj s ILE 69 Cb -0.02 -4.29 0.16 0.00 -0.00 0.00 0.00 42.46 38.31 1blj s ILE 69 CO -0.02 -1.01 1.13 -0.13 -0.00 0.00 0.00 174.94 174.91 1blj s ARG 70 N 5.54 1.21 -0.15 0.37 3.00 -0.54 -0.96 118.95 127.41 1blj s ARG 70 Ca 0.57 -0.88 0.00 0.00 0.00 0.00 0.00 55.73 55.42 1blj s ARG 70 Cb -0.12 -2.14 0.03 0.00 0.00 0.00 0.00 34.95 32.72 1blj s ARG 70 CO 0.27 -1.87 -0.12 -1.54 0.00 0.00 0.00 175.30 172.04 1blj s SER 71 N -4.82 2.74 -0.13 0.23 1.04 -1.22 -3.17 113.70 108.37 1blj s SER 71 Ca 0.70 -0.54 -0.04 0.00 0.48 0.00 0.00 55.95 56.55 1blj s SER 71 Cb -0.04 -1.11 -0.03 0.00 0.10 0.00 0.00 66.02 64.93 1blj s SER 71 CO 0.48 -0.09 0.02 -0.76 0.98 0.00 0.00 173.24 173.87 1blj s LEU 72 N 1.52 3.64 0.59 2.42 2.01 -0.65 -5.00 118.68 123.22 1blj s LEU 72 Ca 0.04 0.09 0.30 0.00 0.01 0.00 0.00 54.13 54.57 1blj s LEU 72 Cb -0.14 -1.87 1.77 0.00 0.01 0.00 0.00 46.19 45.97 1blj s LEU 72 CO -0.10 0.28 2.19 -2.24 1.01 0.00 0.00 176.35 177.50 1blj h ASP 73 N 5.91 0.00 -0.19 2.29 2.03 -2.00 -2.92 116.42 121.55 1blj h ASP 73 Ca -0.43 0.00 -0.21 0.00 -0.73 0.00 0.00 57.03 55.66 1blj h ASP 73 Cb 1.19 0.00 -0.37 0.00 -0.83 0.00 0.00 39.33 39.32 1blj h ASP 73 CO 0.61 0.00 -1.03 -0.46 -1.03 0.00 0.00 179.24 177.33 1blj n ASN 74 N -3.80 1.41 0.00 4.15 2.04 -1.26 -4.87 115.26 112.94 1blj n ASN 74 Ca -0.01 -2.20 0.00 0.00 -0.44 0.00 0.00 54.58 51.93 1blj n ASN 74 Cb 0.18 -0.38 0.00 0.00 -2.53 0.00 0.00 39.78 37.05 1blj n ASN 74 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1blj n GLY 75 N -0.05 0.66 0.81 4.83 0.00 -1.16 -5.11 105.19 105.17 1blj n GLY 75 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1blj n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1blj n GLY 76 N 0.00 0.96 3.06 -0.02 0.00 -1.11 -2.87 105.19 105.20 1blj n GLY 76 Ca 0.00 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 45.23 1blj n GLY 76 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1blj s TYR 77 N 0.00 -0.12 0.01 1.61 1.51 0.30 -1.64 117.35 119.02 1blj s TYR 77 Ca 0.00 0.29 0.03 0.00 -1.01 0.00 0.00 57.07 56.38 1blj s TYR 77 Cb 0.00 0.03 -0.01 0.00 -0.11 0.00 0.00 41.96 41.87 1blj s TYR 77 CO 0.00 -0.14 -0.08 1.52 -1.11 0.00 0.00 175.55 175.74 1blj s TYR 78 N -0.28 0.74 -0.15 2.71 -0.85 -1.19 -1.47 117.35 116.86 1blj s TYR 78 Ca -0.04 -0.23 -0.02 0.00 -0.52 0.00 0.00 57.07 56.26 1blj s TYR 78 Cb -0.03 -0.46 -0.08 0.00 0.38 0.00 0.00 41.96 41.77 1blj s TYR 78 CO 0.01 -0.02 -0.15 0.44 -1.52 0.00 0.00 175.55 174.30 1blj n ILE 79 N 2.46 0.82 -3.92 -3.49 -5.35 -1.24 -1.47 119.36 107.16 1blj n ILE 79 Ca -0.16 -0.27 -0.35 0.00 -0.27 0.00 0.00 62.75 61.70 1blj n ILE 79 Cb 0.57 -1.29 -0.11 0.00 -1.74 0.00 0.00 39.64 37.07 1blj n ILE 79 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1blj s SER 80 N -5.77 5.36 0.20 7.28 0.15 -1.26 -4.65 113.70 115.01 1blj s SER 80 Ca -0.20 -0.06 0.17 0.00 0.70 0.00 0.00 55.95 56.56 1blj s SER 80 Cb 0.06 -1.94 0.82 0.00 -1.71 0.00 0.00 66.02 63.25 1blj s SER 80 CO 0.30 0.07 1.52 -2.65 1.20 0.00 0.00 173.24 173.68 1blj n PRO 81 N 4.20 0.11 0.00 5.44 -0.02 -1.26 -1.16 135.00 142.31 1blj n PRO 81 Ca -0.16 0.51 0.14 0.00 -2.02 0.00 0.00 63.50 61.96 1blj n PRO 81 Cb 0.52 -1.79 0.59 0.00 -0.02 0.00 0.00 33.50 32.80 1blj n PRO 81 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1blj n ARG 82 N -2.01 0.10 -3.72 -0.52 -4.01 -1.26 -4.77 116.66 100.47 1blj n ARG 82 Ca 0.00 -0.01 -0.14 0.00 -1.04 0.00 0.00 57.85 56.66 1blj n ARG 82 Cb 0.10 -1.50 -0.14 0.00 -3.04 0.00 0.00 32.46 27.87 1blj n ARG 82 CO 0.00 0.00 0.00 0.96 -3.04 0.00 0.00 177.63 175.55 1blj s ILE 83 N -2.91 -0.11 0.14 8.89 -4.36 -0.31 -5.14 121.20 117.40 1blj s ILE 83 Ca 0.17 0.21 0.06 0.00 -0.26 0.00 0.00 60.65 60.82 1blj s ILE 83 Cb 0.19 -0.30 -0.04 0.00 1.25 0.00 0.00 42.46 43.56 1blj s ILE 83 CO 0.54 0.09 -0.13 -0.89 0.24 0.00 0.00 174.94 174.79 1blj s THR 84 N 1.48 1.30 -0.03 8.37 2.01 -1.26 -3.74 115.64 123.78 1blj s THR 84 Ca -0.06 -1.86 -0.04 0.00 0.31 0.00 0.00 61.69 60.04 1blj s THR 84 Cb -0.11 -1.66 0.01 0.00 0.01 0.00 0.00 72.50 70.74 1blj s THR 84 CO -0.07 -0.54 0.09 -0.36 -0.69 0.00 0.00 174.62 173.06 1blj s PHE 85 N -2.59 -0.06 -1.11 4.92 0.08 -0.54 -4.99 117.98 113.69 1blj s PHE 85 Ca 0.12 0.16 0.03 0.00 0.12 0.00 0.00 56.93 57.37 1blj s PHE 85 Cb -0.02 0.01 0.14 0.00 -0.57 0.00 0.00 43.02 42.58 1blj s PHE 85 CO 0.03 -0.09 1.05 -0.35 -0.10 0.00 0.00 175.22 175.76 1blj n PRO 86 N 2.76 0.01 -3.55 0.24 -0.04 -1.14 -0.54 135.00 132.74 1blj n PRO 86 Ca -0.14 0.40 -0.08 0.00 -0.04 0.00 0.00 63.50 63.64 1blj n PRO 86 Cb 0.59 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.53 1blj n PRO 86 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1blj s THR 87 N -2.89 0.00 0.30 0.52 -1.32 -1.26 -4.47 115.64 106.53 1blj s THR 87 Ca 0.02 -0.15 -0.01 0.00 -1.21 0.00 0.00 61.69 60.34 1blj s THR 87 Cb 0.02 -1.23 0.27 0.00 -1.51 0.00 0.00 72.50 70.06 1blj s THR 87 CO 0.06 0.00 1.95 -0.07 -2.21 0.00 0.00 174.62 174.35 1blj h LEU 88 N 2.00 0.91 -1.37 9.08 -0.00 -1.93 -2.69 115.31 121.31 1blj h LEU 88 Ca -0.24 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.61 1blj h LEU 88 Cb 1.25 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 41.67 1blj h LEU 88 CO 0.30 0.63 0.17 0.06 -0.00 0.00 0.00 178.44 179.61 1blj h GLN 89 N 1.06 0.60 0.00 1.13 3.07 -1.96 0.46 115.11 119.47 1blj h GLN 89 Ca 0.33 -0.08 0.00 0.00 0.09 0.00 0.00 58.65 59.00 1blj h GLN 89 Cb 0.01 -0.11 0.00 0.00 0.08 0.00 0.00 27.48 27.45 1blj h GLN 89 CO -0.09 0.49 0.00 0.00 0.09 0.00 0.00 178.83 179.32 1blj n ALA 90 N -2.47 2.00 0.03 0.06 0.00 -1.03 -1.42 120.51 117.68 1blj n ALA 90 Ca 0.03 -0.01 -0.22 0.00 0.00 0.00 0.00 53.44 53.23 1blj n ALA 90 Cb 0.14 -1.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.05 1blj n ALA 90 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1blj h LEU 91 N 0.00 0.49 -0.07 0.00 6.46 -0.53 -3.16 115.31 118.49 1blj h LEU 91 Ca 0.00 -0.93 0.00 0.00 -0.12 0.00 0.00 57.88 56.83 1blj h LEU 91 Cb 0.49 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.26 1blj h LEU 91 CO 0.00 1.80 0.00 0.52 -0.62 0.00 0.00 178.44 180.14 1blj n VAL 92 N -3.60 0.44 -0.08 1.05 0.31 0.13 -2.09 118.33 114.49 1blj n VAL 92 Ca -0.28 0.02 -0.11 0.00 -0.01 0.00 0.00 64.34 63.96 1blj n VAL 92 Cb 1.04 -0.70 -0.05 0.00 -0.91 0.00 0.00 33.84 33.21 1blj n VAL 92 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 1blj h GLN 93 N 0.00 0.00 -0.54 5.55 3.07 -1.36 -3.20 115.11 118.64 1blj h GLN 93 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 58.65 58.76 1blj h GLN 93 Cb 0.48 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.00 1blj h GLN 93 CO 0.00 0.37 0.33 1.25 0.09 0.00 0.00 178.83 180.87 1blj h HIS 94 N -1.00 0.61 0.00 0.06 2.76 -1.63 -1.26 115.15 114.69 1blj h HIS 94 Ca -0.13 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.03 1blj h HIS 94 Cb 0.80 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.56 1blj h HIS 94 CO -0.10 0.35 -0.11 1.88 -1.30 0.00 0.00 177.93 178.65 1blj h TYR 95 N 0.65 0.00 0.00 5.26 0.05 -1.59 -2.01 116.97 119.32 1blj h TYR 95 Ca 0.22 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.98 1blj h TYR 95 Cb 0.02 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.75 1blj h TYR 95 CO -0.06 0.11 -0.07 0.77 -1.05 0.00 0.00 178.16 177.86 1blj h SER 96 N 0.00 0.00 0.34 3.88 0.02 -1.21 -2.68 113.55 113.90 1blj h SER 96 Ca -0.00 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.63 1blj h SER 96 Cb 0.61 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.10 1blj h SER 96 CO 0.01 0.07 -1.85 0.29 -1.14 0.00 0.00 176.83 174.22 1blj n LYS 97 N -3.76 0.68 -3.18 3.45 4.01 -0.80 -4.67 118.16 113.89 1blj n LYS 97 Ca -0.02 0.27 0.02 0.00 -0.51 0.00 0.00 58.31 58.07 1blj n LYS 97 Cb 0.17 -1.75 -0.02 0.00 -0.51 0.00 0.00 35.03 32.93 1blj n LYS 97 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1blj s LYS 98 N -2.58 0.54 0.21 1.97 2.36 -0.95 -5.06 119.74 116.23 1blj s LYS 98 Ca -0.11 0.86 -0.09 0.00 -2.55 0.00 0.00 55.97 54.07 1blj s LYS 98 Cb 0.07 0.37 0.27 0.00 -1.05 0.00 0.00 37.83 37.49 1blj s LYS 98 CO 0.80 -0.70 1.76 0.78 1.55 0.00 0.00 175.35 179.54 1blj h GLY 99 N 8.03 0.89 -5.53 5.54 0.00 -1.81 -3.37 103.07 106.82 1blj h GLY 99 Ca -0.19 -0.16 -0.12 0.00 0.00 0.00 0.00 47.33 46.86 1blj h GLY 99 CO 0.24 0.03 -0.34 1.34 0.00 0.00 0.00 176.54 177.82 1blj n ASP 100 N -4.93 -7.20 0.00 0.19 2.03 -1.26 -3.68 116.55 101.70 1blj n ASP 100 Ca 0.09 -0.34 0.00 0.00 0.52 0.00 0.00 54.79 55.06 1blj n ASP 100 Cb 0.24 -4.95 0.00 0.00 -0.72 0.00 0.00 41.12 35.69 1blj n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1blj n GLY 101 N -1.62 0.65 0.72 0.27 0.00 -1.26 -4.95 105.19 99.00 1blj n GLY 101 Ca -0.04 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 45.88 1blj n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1blj n LEU 102 N 0.00 2.06 0.00 0.99 4.77 -1.24 -4.93 117.00 118.64 1blj n LEU 102 Ca 0.00 -1.03 0.00 0.00 -0.03 0.00 0.00 56.01 54.95 1blj n LEU 102 Cb 0.00 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 1blj n LEU 102 CO 0.00 0.45 0.00 0.00 -1.33 0.00 0.00 177.39 176.51 1blj s GLN 104 N 0.00 0.46 0.41 0.00 -1.52 -1.26 -5.09 119.66 112.67 1blj s GLN 104 Ca 0.00 1.01 -0.21 0.00 -1.95 0.00 0.00 55.36 54.20 1blj s GLN 104 Cb 0.00 0.33 -0.15 0.00 -0.22 0.00 0.00 33.01 32.98 1blj s GLN 104 CO 0.00 -0.44 0.19 0.36 -0.25 0.00 0.00 175.29 175.14 1blj n LYS 105 N 5.41 0.12 -1.85 2.91 2.85 -1.26 -4.39 118.16 121.95 1blj n LYS 105 Ca -0.06 0.05 -0.38 0.00 -1.05 0.00 0.00 58.31 56.87 1blj n LYS 105 Cb 0.50 -1.12 0.04 0.00 -0.65 0.00 0.00 35.03 33.80 1blj n LYS 105 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1blj s LEU 106 N 3.74 3.77 0.00 -5.58 1.43 -1.09 -4.11 118.68 116.85 1blj s LEU 106 Ca 0.60 2.63 0.00 0.00 -1.03 0.00 0.00 54.13 56.34 1blj s LEU 106 Cb -0.63 -4.40 0.00 0.00 0.03 0.00 0.00 46.19 41.19 1blj s LEU 106 CO 0.62 -1.61 0.00 0.35 0.23 0.00 0.00 176.35 175.93 1blj n THR 107 N -1.27 0.00 -4.75 5.49 -2.24 -0.57 -4.13 114.28 106.80 1blj n THR 107 Ca 0.12 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.64 1blj n THR 107 Cb 0.47 0.00 -0.17 0.00 -2.10 0.00 0.00 70.33 68.53 1blj n THR 107 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1blj s LEU 108 N 0.00 1.79 0.16 3.22 1.43 -1.26 -4.90 118.68 119.12 1blj s LEU 108 Ca 0.00 -0.36 -0.34 0.00 -1.03 0.00 0.00 54.13 52.41 1blj s LEU 108 Cb 0.00 -0.96 -0.15 0.00 0.03 0.00 0.00 46.19 45.11 1blj s LEU 108 CO 0.00 0.08 1.31 -2.65 0.23 0.00 0.00 176.35 175.32 1blj n PRO 109 N 3.60 1.44 -0.98 1.29 -0.02 -1.26 -3.76 135.00 135.31 1blj n PRO 109 Ca -0.21 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.46 1blj n PRO 109 Cb 0.52 -2.12 0.13 0.00 -0.02 0.00 0.00 33.50 32.02 1blj n PRO 109 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1blj h VAL 111 N -1.18 1.35 -5.68 0.00 3.04 -1.91 -3.43 116.25 108.44 1blj h VAL 111 Ca -0.45 -1.90 -0.42 0.00 -1.01 0.00 0.00 66.70 62.91 1blj h VAL 111 Cb 1.29 1.90 0.05 0.00 -2.01 0.00 0.00 31.29 32.53 1blj h VAL 111 CO 0.43 0.58 -0.68 0.59 -1.01 0.00 0.00 177.57 177.48 1blj n ASN 112 N -3.91 -5.69 0.00 3.17 4.13 -1.26 -2.90 115.26 108.80 1blj n ASN 112 Ca -0.03 -0.55 0.00 0.00 1.68 0.00 0.00 54.58 55.68 1blj n ASN 112 Cb 0.62 -4.53 0.00 0.00 -1.54 0.00 0.00 39.78 34.33 1blj n ASN 112 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1blj n LEU 113 N -4.63 0.00 0.00 3.41 4.77 -1.26 -5.05 117.00 114.24 1blj n LEU 113 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1blj n LEU 113 Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1blj n LEU 113 CO 0.64 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.70