#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lsa h HIS -7 N 0.00 1.06 -3.67 4.41 6.17 -2.01 -3.41 115.15 117.71 3lsa h HIS -7 Ca 0.00 0.03 -0.63 0.00 0.71 0.00 0.00 60.37 60.48 3lsa h HIS -7 Cb 0.00 -0.34 -0.18 0.00 2.52 0.00 0.00 27.41 29.41 3lsa h HIS -7 CO 0.00 0.53 -0.55 -1.01 0.71 0.00 0.00 177.93 177.61 3lsa s HIS -6 N -6.05 3.21 -0.37 5.26 4.02 -1.26 -4.98 115.29 115.12 3lsa s HIS -6 Ca -0.12 -0.01 0.25 0.00 1.02 0.00 0.00 55.06 56.20 3lsa s HIS -6 Cb 0.19 -2.27 1.07 0.00 -1.02 0.00 0.00 32.58 30.55 3lsa s HIS -6 CO 0.80 -0.11 1.76 1.12 1.02 0.00 0.00 174.74 179.32 3lsa h HIS -5 N 7.89 0.00 0.00 1.40 2.07 -2.01 -2.70 115.15 121.80 3lsa h HIS -5 Ca -0.37 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.15 3lsa h HIS -5 Cb 1.18 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.16 3lsa h HIS -5 CO 0.69 0.00 0.00 -2.39 -3.07 0.00 0.00 177.93 173.16 3lsa n HIS -4 N -2.37 0.57 0.06 6.12 -0.00 -1.26 -0.48 115.22 117.86 3lsa n HIS -4 Ca 0.02 0.27 -0.20 0.00 -0.00 0.00 0.00 57.72 57.81 3lsa n HIS -4 Cb 0.23 -0.94 -0.13 0.00 -0.00 0.00 0.00 29.99 29.14 3lsa n HIS -4 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 3lsa h HIS -3 N 0.00 0.74 0.00 -1.40 3.86 -1.86 -3.42 115.15 113.08 3lsa h HIS -3 Ca 0.00 -0.48 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 3lsa h HIS -3 Cb 0.11 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.53 3lsa h HIS -3 CO 0.00 1.34 0.00 0.25 0.86 0.00 0.00 177.93 180.38 3lsa n THR -2 N -4.02 0.00 -2.20 2.45 -2.24 -1.03 -5.02 114.28 102.23 3lsa n THR -2 Ca -0.13 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 60.77 3lsa n THR -2 Cb 0.86 1.09 -0.03 0.00 -2.10 0.00 0.00 70.33 70.15 3lsa n THR -2 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3lsa s ASP -1 N -0.03 6.81 0.45 3.42 2.15 0.37 -4.91 116.67 124.93 3lsa s ASP -1 Ca 0.00 2.04 0.18 0.00 0.43 0.00 0.00 52.55 55.21 3lsa s ASP -1 Cb 0.00 -2.54 1.14 0.00 -0.30 0.00 0.00 42.92 41.21 3lsa s ASP -1 CO 0.00 -0.81 1.92 -0.65 -0.17 0.00 0.00 175.17 175.46 3lsa h PRO 0 N 8.56 0.31 -0.46 4.34 0.11 -1.95 0.32 132.00 143.22 3lsa h PRO 0 Ca -0.35 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3lsa h PRO 0 Cb 1.16 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3lsa h PRO 0 CO 0.94 0.21 0.00 -1.33 -0.21 0.00 0.00 178.00 177.61 3lsa n MET 1 N -4.45 2.07 -1.73 1.05 2.81 -1.26 -4.97 117.12 110.64 3lsa n MET 1 Ca 0.14 -1.64 -0.42 0.00 -1.81 0.00 0.00 57.70 53.97 3lsa n MET 1 Cb 0.59 -1.36 -0.02 0.00 -0.71 0.00 0.00 33.22 31.72 3lsa n MET 1 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3lsa n SER 2 N 0.82 3.76 -0.04 7.83 2.88 0.10 -4.89 113.62 124.07 3lsa n SER 2 Ca 0.15 1.12 0.13 0.00 -1.33 0.00 0.00 58.87 58.94 3lsa n SER 2 Cb 0.39 -1.57 0.39 0.00 -0.75 0.00 0.00 64.21 62.67 3lsa n SER 2 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3lsa n VAL 3 N 2.59 0.00 -3.05 2.46 0.24 -1.26 -4.68 118.33 114.62 3lsa n VAL 3 Ca 0.11 -0.02 -0.43 0.00 -2.04 0.00 0.00 64.34 61.96 3lsa n VAL 3 Cb 0.35 0.07 -0.06 0.00 -1.47 0.00 0.00 33.84 32.73 3lsa n VAL 3 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3lsa s ILE 4 N -2.88 4.76 0.25 1.34 -1.09 -1.26 -4.98 121.20 117.34 3lsa s ILE 4 Ca 0.15 0.25 0.06 0.00 -2.23 0.00 0.00 60.65 58.88 3lsa s ILE 4 Cb 0.18 -4.25 -0.03 0.00 -1.58 0.00 0.00 42.46 36.79 3lsa s ILE 4 CO 0.62 -0.63 0.33 -0.54 -1.23 0.00 0.00 174.94 173.49 3lsa s LYS 5 N 3.00 3.29 0.47 2.79 -0.14 -1.26 -4.99 119.74 122.90 3lsa s LYS 5 Ca 0.25 -0.86 0.18 0.00 -1.36 0.00 0.00 55.97 54.19 3lsa s LYS 5 Cb -0.13 -2.80 1.14 0.00 -1.68 0.00 0.00 37.83 34.36 3lsa s LYS 5 CO 0.20 0.39 2.03 -1.35 -0.76 0.00 0.00 175.35 175.86 3lsa h PRO 6 N 1.22 0.00 -4.99 -1.68 0.11 -1.97 -3.41 132.00 121.29 3lsa h PRO 6 Ca -0.51 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 64.97 3lsa h PRO 6 Cb 1.23 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 32.00 3lsa h PRO 6 CO 0.60 0.15 -0.85 -0.51 -0.21 0.00 0.00 178.00 177.18 3lsa s ASP 7 N -6.80 2.80 0.29 -2.05 1.01 -1.26 -3.99 116.67 106.66 3lsa s ASP 7 Ca -0.04 -0.52 0.05 0.00 0.71 0.00 0.00 52.55 52.75 3lsa s ASP 7 Cb 0.15 -1.28 -0.06 0.00 1.01 0.00 0.00 42.92 42.74 3lsa s ASP 7 CO 0.67 0.05 -0.00 -0.04 0.21 0.00 0.00 175.17 176.05 3lsa s MET 8 N 0.88 1.54 0.34 8.23 -1.94 -0.54 -5.00 119.30 122.81 3lsa s MET 8 Ca -0.07 -1.81 0.09 0.00 -1.71 0.00 0.00 55.69 52.19 3lsa s MET 8 Cb -0.15 -0.94 -0.05 0.00 2.01 0.00 0.00 34.83 35.70 3lsa s MET 8 CO -0.01 -0.07 0.05 0.15 -0.01 0.00 0.00 175.02 175.12 3lsa s LYS 9 N -3.81 2.16 -0.02 2.03 -0.14 0.23 -1.61 119.74 118.58 3lsa s LYS 9 Ca 0.32 -1.70 0.01 0.00 -1.36 0.00 0.00 55.97 53.23 3lsa s LYS 9 Cb 0.06 -1.99 0.01 0.00 -1.68 0.00 0.00 37.83 34.23 3lsa s LYS 9 CO 0.12 0.12 -0.03 0.42 -0.76 0.00 0.00 175.35 175.23 3lsa s ILE 10 N -2.50 0.34 -0.07 2.17 1.01 -0.07 -0.85 121.20 121.22 3lsa s ILE 10 Ca 0.36 -0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.96 3lsa s ILE 10 Cb -0.00 -0.36 0.01 0.00 0.01 0.00 0.00 42.46 42.12 3lsa s ILE 10 CO 0.20 0.15 -0.12 -0.54 0.00 0.00 0.00 174.94 174.63 3lsa s LYS 11 N 0.58 1.71 0.03 2.79 1.02 0.36 -0.56 119.74 125.66 3lsa s LYS 11 Ca -0.06 -0.41 -0.00 0.00 0.02 0.00 0.00 55.97 55.51 3lsa s LYS 11 Cb -0.10 -1.43 -0.03 0.00 -0.52 0.00 0.00 37.83 35.76 3lsa s LYS 11 CO -0.01 0.01 -0.03 -0.48 -0.92 0.00 0.00 175.35 173.93 3lsa s LEU 12 N 0.72 2.35 -0.04 3.17 0.05 -0.00 -0.98 118.68 123.95 3lsa s LEU 12 Ca -0.13 -0.72 0.01 0.00 0.05 0.00 0.00 54.13 53.33 3lsa s LEU 12 Cb -0.16 0.15 0.02 0.00 -2.05 0.00 0.00 46.19 44.15 3lsa s LEU 12 CO 0.03 -0.43 -0.03 -0.60 -0.55 0.00 0.00 176.35 174.77 3lsa s ARG 13 N -2.56 0.63 -0.15 1.48 3.52 -0.66 -0.92 118.95 120.29 3lsa s ARG 13 Ca -0.06 -0.04 -0.03 0.00 -0.13 0.00 0.00 55.73 55.47 3lsa s ARG 13 Cb -0.02 -0.70 -0.03 0.00 -1.56 0.00 0.00 34.95 32.65 3lsa s ARG 13 CO -0.05 -0.10 -0.05 1.41 -0.81 0.00 0.00 175.30 175.71 3lsa s MET 14 N 0.93 3.59 -0.00 5.12 -2.45 0.64 -0.89 119.30 126.24 3lsa s MET 14 Ca -0.11 -0.54 0.07 0.00 -1.25 0.00 0.00 55.69 53.86 3lsa s MET 14 Cb -0.14 -2.87 -0.03 0.00 1.25 0.00 0.00 34.83 33.05 3lsa s MET 14 CO -0.00 0.27 -0.21 -1.21 1.05 0.00 0.00 175.02 174.92 3lsa s GLU 15 N 0.27 2.17 0.20 4.11 2.02 -0.55 -1.01 118.70 125.91 3lsa s GLU 15 Ca -0.04 -0.90 -0.22 0.00 0.02 0.00 0.00 54.97 53.84 3lsa s GLU 15 Cb -0.14 -2.17 0.07 0.00 0.10 0.00 0.00 34.13 31.99 3lsa s GLU 15 CO 0.03 0.57 1.01 0.20 0.02 0.00 0.00 175.26 177.09 3lsa s GLY 16 N -0.95 0.13 -0.03 -1.39 0.00 -0.61 -1.60 107.32 102.88 3lsa s GLY 16 Ca 0.12 -0.37 -0.17 0.00 0.00 0.00 0.00 44.72 44.30 3lsa s GLY 16 CO 0.01 2.13 0.37 0.00 0.00 0.00 0.00 173.10 175.61 3lsa s ALA 17 N -2.21 -0.94 -0.08 3.20 0.00 -0.37 -1.07 121.76 120.30 3lsa s ALA 17 Ca 0.21 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.71 3lsa s ALA 17 Cb -0.03 0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.11 3lsa s ALA 17 CO 0.06 -0.27 -0.09 0.08 0.00 0.00 0.00 175.76 175.53 3lsa s VAL 18 N -1.17 1.01 -1.39 0.00 1.01 -0.75 -1.12 120.40 117.99 3lsa s VAL 18 Ca -0.12 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 3lsa s VAL 18 Cb -0.04 -0.97 0.08 0.00 0.00 0.00 0.00 36.38 35.45 3lsa s VAL 18 CO 0.05 0.34 0.60 0.59 0.00 0.00 0.00 175.10 176.68 3lsa n ASN 19 N 4.23 -3.98 0.00 3.32 4.13 0.34 -1.42 115.26 121.88 3lsa n ASN 19 Ca -0.20 -0.51 0.00 0.00 1.68 0.00 0.00 54.58 55.55 3lsa n ASN 19 Cb 0.51 -3.27 0.00 0.00 -1.54 0.00 0.00 39.78 35.48 3lsa n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3lsa n GLY 20 N -1.29 0.88 3.47 7.41 0.00 -1.26 -5.03 105.19 109.37 3lsa n GLY 20 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3lsa n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3lsa s HIS 21 N -3.51 3.14 0.60 1.61 5.04 -0.51 -5.05 115.29 116.61 3lsa s HIS 21 Ca 0.00 -0.44 -0.16 0.00 -1.54 0.00 0.00 55.06 52.92 3lsa s HIS 21 Cb 0.00 -3.10 -0.03 0.00 0.04 0.00 0.00 32.58 29.48 3lsa s HIS 21 CO 0.00 -0.80 1.07 -1.25 -2.34 0.00 0.00 174.74 171.42 3lsa s PRO 22 N 2.25 3.23 0.26 2.88 0.04 -1.26 -1.81 135.00 140.59 3lsa s PRO 22 Ca 0.13 1.29 -0.21 0.00 0.04 0.00 0.00 61.00 62.24 3lsa s PRO 22 Cb -0.18 -2.02 0.03 0.00 0.04 0.00 0.00 34.50 32.37 3lsa s PRO 22 CO 0.13 -0.89 0.70 -0.59 0.04 0.00 0.00 177.00 176.38 3lsa s PHE 23 N -2.35 -0.25 -0.09 0.56 -0.12 -0.24 -4.27 117.98 111.23 3lsa s PHE 23 Ca 0.65 -0.16 -0.12 0.00 -0.05 0.00 0.00 56.93 57.26 3lsa s PHE 23 Cb -0.18 0.68 0.03 0.00 -0.63 0.00 0.00 43.02 42.92 3lsa s PHE 23 CO 0.36 -1.16 0.30 0.00 -0.05 0.00 0.00 175.22 174.67 3lsa s ALA 24 N -3.89 -0.75 -0.02 1.99 0.00 -0.42 -1.57 121.76 117.10 3lsa s ALA 24 Ca 0.09 0.69 0.01 0.00 0.00 0.00 0.00 51.96 52.75 3lsa s ALA 24 Cb -0.05 -0.34 0.01 0.00 0.00 0.00 0.00 23.12 22.74 3lsa s ALA 24 CO 0.03 -0.18 -0.03 0.42 0.00 0.00 0.00 175.76 176.00 3lsa s ILE 25 N -0.28 0.34 0.05 0.00 1.01 -0.18 -0.40 121.20 121.74 3lsa s ILE 25 Ca -0.04 -0.10 0.07 0.00 0.00 0.00 0.00 60.65 60.57 3lsa s ILE 25 Cb -0.03 -0.34 -0.03 0.00 0.01 0.00 0.00 42.46 42.06 3lsa s ILE 25 CO 0.01 0.14 -0.16 -1.61 0.00 0.00 0.00 174.94 173.32 3lsa s GLU 26 N 0.39 2.09 0.03 2.79 2.02 -0.53 -0.26 118.70 125.22 3lsa s GLU 26 Ca -0.04 -0.98 0.01 0.00 0.02 0.00 0.00 54.97 53.98 3lsa s GLU 26 Cb -0.07 -2.22 -0.02 0.00 0.10 0.00 0.00 34.13 31.91 3lsa s GLU 26 CO -0.01 0.54 -0.05 0.20 0.02 0.00 0.00 175.26 175.96 3lsa s GLY 27 N -1.59 0.34 -0.02 -1.39 0.00 -0.10 -1.02 107.32 103.55 3lsa s GLY 27 Ca 0.16 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.21 3lsa s GLY 27 CO 0.07 -0.74 -0.00 0.14 0.00 0.00 0.00 173.10 172.57 3lsa s VAL 28 N -1.51 0.13 0.28 1.40 1.01 -0.75 -0.82 120.40 120.14 3lsa s VAL 28 Ca -0.13 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 3lsa s VAL 28 Cb -0.09 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 36.10 3lsa s VAL 28 CO -0.01 0.10 0.43 0.61 0.00 0.00 0.00 175.10 176.24 3lsa n GLY 29 N 3.82 2.11 2.98 4.51 0.00 0.27 -1.11 105.19 117.77 3lsa n GLY 29 Ca -0.23 -1.50 -0.11 0.00 0.00 0.00 0.00 46.02 44.18 3lsa n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3lsa s LEU 30 N 0.00 1.90 0.28 0.99 1.43 -0.40 -0.90 118.68 121.98 3lsa s LEU 30 Ca 0.21 -0.15 -0.15 0.00 -1.03 0.00 0.00 54.13 53.01 3lsa s LEU 30 Cb -0.01 0.25 0.01 0.00 0.03 0.00 0.00 46.19 46.46 3lsa s LEU 30 CO 0.15 -0.18 0.57 -0.83 0.23 0.00 0.00 176.35 176.30 3lsa s GLY 31 N -0.74 0.42 -0.41 -3.19 0.00 -0.63 -1.00 107.32 101.78 3lsa s GLY 31 Ca -0.08 -0.76 0.02 0.00 0.00 0.00 0.00 44.72 43.91 3lsa s GLY 31 CO -0.00 -0.48 0.18 0.54 0.00 0.00 0.00 173.10 173.34 3lsa s LYS 32 N -3.77 1.34 0.27 2.90 1.02 0.10 -1.47 119.74 120.13 3lsa s LYS 32 Ca 0.19 -1.91 -0.03 0.00 0.02 0.00 0.00 55.97 54.25 3lsa s LYS 32 Cb -0.03 -2.63 0.39 0.00 -0.52 0.00 0.00 37.83 35.05 3lsa s LYS 32 CO 0.10 -1.07 1.91 -1.35 -0.92 0.00 0.00 175.35 174.01 3lsa h PRO 33 N 7.14 1.16 0.00 -1.68 0.11 -1.78 0.19 132.00 137.14 3lsa h PRO 33 Ca -0.06 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.98 3lsa h PRO 33 Cb 0.96 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 31.80 3lsa h PRO 33 CO 0.53 0.77 0.00 0.74 -0.21 0.00 0.00 178.00 179.83 3lsa h PHE 34 N 1.20 0.00 0.00 0.65 -1.00 -1.84 -3.04 116.94 112.91 3lsa h PHE 34 Ca 0.40 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.18 3lsa h PHE 34 Cb 0.06 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.62 3lsa h PHE 34 CO -0.00 0.00 -1.14 0.39 -1.61 0.00 0.00 178.31 175.95 3lsa n GLU 35 N -2.91 0.38 -2.81 1.51 1.02 -0.64 -4.61 120.64 112.57 3lsa n GLU 35 Ca 0.03 -0.01 -0.08 0.00 -0.02 0.00 0.00 57.16 57.08 3lsa n GLU 35 Cb 0.40 -1.62 0.03 0.00 -0.02 0.00 0.00 31.44 30.23 3lsa n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3lsa n GLY 36 N 1.33 0.33 3.01 0.62 0.00 -0.04 -4.48 105.19 105.97 3lsa n GLY 36 Ca 0.01 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.56 3lsa n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lsa s LYS 37 N -5.24 0.53 0.04 1.61 1.02 -1.07 -0.69 119.74 115.93 3lsa s LYS 37 Ca 0.16 -0.44 -0.17 0.00 0.02 0.00 0.00 55.97 55.54 3lsa s LYS 37 Cb -0.07 -0.44 0.03 0.00 -0.52 0.00 0.00 37.83 36.83 3lsa s LYS 37 CO 0.27 0.11 0.38 1.14 -0.92 0.00 0.00 175.35 176.33 3lsa s GLN 38 N -0.71 0.88 0.04 1.68 -2.07 -0.48 0.02 119.66 119.01 3lsa s GLN 38 Ca -0.02 -0.38 0.02 0.00 -1.82 0.00 0.00 55.36 53.16 3lsa s GLN 38 Cb -0.05 0.39 -0.02 0.00 -1.09 0.00 0.00 33.01 32.23 3lsa s GLN 38 CO 0.00 -0.29 -0.06 -1.54 -1.32 0.00 0.00 175.29 172.08 3lsa s SER 39 N -1.96 0.68 0.03 12.60 1.04 -0.17 -1.34 113.70 124.59 3lsa s SER 39 Ca -0.06 -0.55 -0.12 0.00 0.48 0.00 0.00 55.95 55.71 3lsa s SER 39 Cb -0.01 0.06 0.01 0.00 0.10 0.00 0.00 66.02 66.18 3lsa s SER 39 CO -0.02 -0.24 0.25 0.00 0.98 0.00 0.00 173.24 174.21 3lsa s MET 40 N -1.60 0.72 -0.17 4.02 0.23 0.05 -1.27 119.30 121.28 3lsa s MET 40 Ca -0.11 -0.51 -0.05 0.00 -1.03 0.00 0.00 55.69 53.99 3lsa s MET 40 Cb -0.10 0.31 -0.03 0.00 -1.53 0.00 0.00 34.83 33.48 3lsa s MET 40 CO -0.00 -0.22 -0.01 -0.51 -2.03 0.00 0.00 175.02 172.26 3lsa s ASP 41 N -1.93 4.95 -0.06 -1.18 1.01 -0.27 -0.93 116.67 118.26 3lsa s ASP 41 Ca -0.07 -0.12 0.05 0.00 0.71 0.00 0.00 52.55 53.13 3lsa s ASP 41 Cb -0.02 -1.83 -0.01 0.00 1.01 0.00 0.00 42.92 42.08 3lsa s ASP 41 CO -0.02 0.13 -0.24 -0.76 0.21 0.00 0.00 175.17 174.49 3lsa s LEU 42 N 0.58 2.05 -0.09 1.23 1.43 0.84 -1.82 118.68 122.90 3lsa s LEU 42 Ca -0.01 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 3lsa s LEU 42 Cb -0.14 -1.33 0.01 0.00 0.03 0.00 0.00 46.19 44.77 3lsa s LEU 42 CO 0.02 0.22 -0.13 -0.75 0.23 0.00 0.00 176.35 175.94 3lsa s LYS 43 N -0.04 1.87 -0.07 1.70 2.47 -0.19 -1.02 119.74 124.46 3lsa s LYS 43 Ca -0.06 -0.45 -0.30 0.00 -1.56 0.00 0.00 55.97 53.60 3lsa s LYS 43 Cb -0.14 -1.60 -0.04 0.00 -1.46 0.00 0.00 37.83 34.59 3lsa s LYS 43 CO 0.04 -0.04 1.45 0.08 0.16 0.00 0.00 175.35 177.04 3lsa s VAL 44 N 0.89 3.83 -0.14 4.02 1.01 -0.17 -1.46 120.40 128.39 3lsa s VAL 44 Ca -0.10 1.09 0.15 0.00 0.00 0.00 0.00 61.98 63.13 3lsa s VAL 44 Cb -0.15 -3.71 -0.21 0.00 0.00 0.00 0.00 36.38 32.31 3lsa s VAL 44 CO 0.01 -0.06 0.11 0.29 0.00 0.00 0.00 175.10 175.45 3lsa n LYS 45 N 6.32 1.19 -3.85 2.72 4.76 0.47 -4.94 118.16 124.83 3lsa n LYS 45 Ca 0.15 -0.03 -0.12 0.00 -2.87 0.00 0.00 58.31 55.44 3lsa n LYS 45 Cb 0.44 -1.42 -0.11 0.00 -1.84 0.00 0.00 35.03 32.09 3lsa n LYS 45 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3lsa s GLU 46 N -2.53 0.34 0.00 1.97 2.02 -1.01 -4.92 118.70 114.57 3lsa s GLU 46 Ca -0.08 -0.10 0.00 0.00 0.02 0.00 0.00 54.97 54.81 3lsa s GLU 46 Cb 0.06 0.15 0.00 0.00 0.10 0.00 0.00 34.13 34.44 3lsa s GLU 46 CO 0.68 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 176.30 3lsa n GLY 47 N 2.20 0.67 3.87 -1.39 0.00 -1.26 -1.31 105.19 107.98 3lsa n GLY 47 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 3lsa n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3lsa s GLY 48 N -1.96 1.89 0.20 -0.02 0.00 -1.26 -3.94 107.32 102.22 3lsa s GLY 48 Ca 0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 44.72 44.26 3lsa s GLY 48 CO 0.00 0.05 1.17 2.56 0.00 0.00 0.00 173.10 176.88 3lsa s PRO 49 N -4.12 4.53 0.19 2.90 0.04 -1.26 -5.09 135.00 132.20 3lsa s PRO 49 Ca 0.52 1.84 -0.31 0.00 0.04 0.00 0.00 61.00 63.09 3lsa s PRO 49 Cb -0.10 -3.24 -0.11 0.00 0.04 0.00 0.00 34.50 31.09 3lsa s PRO 49 CO 0.35 -0.02 1.60 -0.51 0.04 0.00 0.00 177.00 178.46 3lsa s LEU 50 N -0.42 4.37 0.00 -3.56 1.43 -1.25 -4.89 118.68 114.35 3lsa s LEU 50 Ca 0.51 2.71 0.10 0.00 -1.03 0.00 0.00 54.13 56.42 3lsa s LEU 50 Cb -0.32 -3.60 0.34 0.00 0.03 0.00 0.00 46.19 42.64 3lsa s LEU 50 CO 0.37 -0.86 1.26 -0.81 0.23 0.00 0.00 176.35 176.54 3lsa n PRO 51 N 3.72 1.61 -4.28 1.29 -0.04 -1.26 -4.91 135.00 131.13 3lsa n PRO 51 Ca 0.13 -0.94 -0.15 0.00 -0.04 0.00 0.00 63.50 62.50 3lsa n PRO 51 Cb 0.38 -1.24 -0.10 0.00 -0.04 0.00 0.00 33.50 32.50 3lsa n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3lsa s PHE 52 N -1.67 1.35 -0.02 0.54 -0.12 -1.26 -4.72 117.98 112.08 3lsa s PHE 52 Ca 0.20 -1.01 -0.31 0.00 -0.05 0.00 0.00 56.93 55.76 3lsa s PHE 52 Cb 0.10 -0.78 -0.10 0.00 -0.63 0.00 0.00 43.02 41.62 3lsa s PHE 52 CO 0.14 -0.17 1.96 0.00 -0.05 0.00 0.00 175.22 177.10 3lsa n ALA 53 N -0.32 1.35 0.19 1.99 0.00 -0.01 -4.88 120.51 118.83 3lsa n ALA 53 Ca -0.05 0.21 0.14 0.00 0.00 0.00 0.00 53.44 53.74 3lsa n ALA 53 Cb 0.64 -2.63 0.74 0.00 0.00 0.00 0.00 19.45 18.19 3lsa n ALA 53 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 3lsa h TYR 54 N 10.39 0.00 -0.13 0.00 3.20 -1.95 -2.63 116.97 125.85 3lsa h TYR 54 Ca -0.49 0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.42 3lsa h TYR 54 Cb 1.25 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.52 3lsa h TYR 54 CO 0.93 0.00 0.18 -0.44 -1.64 0.00 0.00 178.16 177.20 3lsa h ASP 55 N 0.00 0.00 0.64 -2.11 3.32 -1.96 -0.69 116.42 115.62 3lsa h ASP 55 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3lsa h ASP 55 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3lsa h ASP 55 CO -0.00 0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.82 3lsa n ILE 56 N -3.63 0.90 0.06 0.35 -5.35 -0.99 -3.03 119.36 107.67 3lsa n ILE 56 Ca 0.00 0.24 0.11 0.00 -0.27 0.00 0.00 62.75 62.83 3lsa n ILE 56 Cb 0.29 -1.10 -0.16 0.00 -1.74 0.00 0.00 39.64 36.93 3lsa n ILE 56 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3lsa n LEU 57 N -1.95 0.11 -0.07 7.28 4.77 -0.27 -4.73 117.00 122.14 3lsa n LEU 57 Ca 0.03 -0.01 -0.05 0.00 -0.03 0.00 0.00 56.01 55.95 3lsa n LEU 57 Cb 0.21 -0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.46 3lsa n LEU 57 CO 0.17 0.01 0.81 0.71 -1.33 0.00 0.00 177.39 177.76 3lsa h THR 58 N 0.00 1.25 0.00 -5.08 1.35 -1.59 -1.39 112.91 107.44 3lsa h THR 58 Ca 0.00 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 3lsa h THR 58 Cb 0.97 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 3lsa h THR 58 CO 0.00 0.38 0.00 0.23 -0.25 0.00 0.00 175.52 175.88 3lsa n MET 59 N -4.18 0.20 -0.01 4.72 2.81 -1.26 -2.33 117.12 117.08 3lsa n MET 59 Ca 0.01 0.26 -0.17 0.00 -1.81 0.00 0.00 57.70 55.99 3lsa n MET 59 Cb 0.35 -1.78 -0.06 0.00 -0.71 0.00 0.00 33.22 31.02 3lsa n MET 59 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3lsa h ALA 60 N 2.49 0.32 0.00 3.04 0.00 -1.57 -3.44 119.26 120.11 3lsa h ALA 60 Ca 0.00 -0.61 -0.23 0.00 0.00 0.00 0.00 54.91 54.06 3lsa h ALA 60 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3lsa h ALA 60 CO 0.00 0.70 1.71 1.19 0.00 0.00 0.00 179.25 182.85 3lsa n PHE 61 N -3.91 0.77 0.00 0.00 0.99 -0.98 -5.03 117.46 109.29 3lsa n PHE 61 Ca -0.07 -1.36 0.00 0.00 -0.00 0.00 0.00 57.45 56.02 3lsa n PHE 61 Cb 0.76 -1.28 0.00 0.00 -1.00 0.00 0.00 39.48 37.96 3lsa n PHE 61 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 3lsa n ASN 65 N 4.03 0.00 0.00 4.37 2.85 -1.26 -5.13 115.26 120.12 3lsa n ASN 65 Ca 0.29 0.00 0.10 0.00 -0.11 0.00 0.00 54.58 54.87 3lsa n ASN 65 Cb 0.16 0.00 0.61 0.00 1.24 0.00 0.00 39.78 41.79 3lsa n ASN 65 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 3lsa n ARG 66 N 0.00 0.76 0.25 1.20 3.00 -1.26 -1.86 116.66 118.74 3lsa n ARG 66 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.85 57.94 3lsa n ARG 66 Cb 0.00 -1.42 0.62 0.00 0.00 0.00 0.00 32.46 31.66 3lsa n ARG 66 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.63 177.39 3lsa h VAL 67 N 0.00 0.89 -1.48 5.15 3.04 -1.96 -3.16 116.25 118.73 3lsa h VAL 67 Ca 0.00 -0.50 -0.76 0.00 -1.01 0.00 0.00 66.70 64.44 3lsa h VAL 67 Cb 0.00 1.28 -0.16 0.00 -2.01 0.00 0.00 31.29 30.40 3lsa h VAL 67 CO 0.00 0.13 2.01 0.49 -1.01 0.00 0.00 177.57 179.19 3lsa n PHE 68 N -4.08 2.72 -3.81 3.17 3.72 -0.78 -4.63 117.46 113.78 3lsa n PHE 68 Ca -0.02 -2.77 -0.13 0.00 -0.05 0.00 0.00 57.45 54.48 3lsa n PHE 68 Cb 0.22 -1.81 -0.13 0.00 -0.94 0.00 0.00 39.48 36.82 3lsa n PHE 68 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3lsa s ALA 69 N -0.69 -0.31 -0.47 4.37 0.00 -1.20 -4.40 121.76 119.05 3lsa s ALA 69 Ca 0.44 0.44 -0.27 0.00 0.00 0.00 0.00 51.96 52.57 3lsa s ALA 69 Cb 0.13 -0.27 0.03 0.00 0.00 0.00 0.00 23.12 23.01 3lsa s ALA 69 CO -0.03 -0.08 1.02 0.21 0.00 0.00 0.00 175.76 176.88 3lsa s LYS 70 N 0.31 3.60 -0.23 0.00 2.20 -0.55 -4.54 119.74 120.53 3lsa s LYS 70 Ca -0.02 0.31 -0.12 0.00 -0.36 0.00 0.00 55.97 55.78 3lsa s LYS 70 Cb -0.03 -3.93 -0.05 0.00 -1.51 0.00 0.00 37.83 32.32 3lsa s LYS 70 CO -0.01 -1.31 0.23 0.71 -0.36 0.00 0.00 175.35 174.61 3lsa s TYR 71 N 4.07 3.33 0.86 4.03 2.02 -1.26 -0.77 117.35 129.63 3lsa s TYR 71 Ca 0.41 0.35 -0.11 0.00 -0.37 0.00 0.00 57.07 57.35 3lsa s TYR 71 Cb -0.09 -2.35 0.11 0.00 -0.40 0.00 0.00 41.96 39.23 3lsa s TYR 71 CO 0.28 0.04 1.09 -1.25 -1.57 0.00 0.00 175.55 174.15 3lsa s PRO 72 N 1.13 1.54 0.55 -1.71 0.04 -1.26 -4.93 135.00 130.36 3lsa s PRO 72 Ca 0.11 0.82 0.29 0.00 0.04 0.00 0.00 61.00 62.26 3lsa s PRO 72 Cb -0.14 -1.84 1.61 0.00 0.04 0.00 0.00 34.50 34.17 3lsa s PRO 72 CO 0.05 -2.04 2.14 1.49 0.04 0.00 0.00 177.00 178.68 3lsa h GLU 73 N -1.41 0.00 -0.25 4.56 4.22 -1.99 -2.83 114.58 116.89 3lsa h GLU 73 Ca -0.48 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.96 3lsa h GLU 73 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3lsa h GLU 73 CO 0.55 0.07 0.00 0.27 -2.18 0.00 0.00 179.01 177.73 3lsa n ASN 74 N -3.67 1.80 -4.14 1.04 6.94 -1.26 -4.70 115.26 111.27 3lsa n ASN 74 Ca -0.02 -1.82 -0.29 0.00 -0.02 0.00 0.00 54.58 52.42 3lsa n ASN 74 Cb 0.18 -0.16 -0.17 0.00 -2.36 0.00 0.00 39.78 37.27 3lsa n ASN 74 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3lsa s ILE 75 N -1.68 1.70 0.23 1.53 1.01 -1.07 -5.06 121.20 117.86 3lsa s ILE 75 Ca 0.29 -0.81 -0.31 0.00 0.00 0.00 0.00 60.65 59.83 3lsa s ILE 75 Cb 0.16 -1.50 -0.10 0.00 0.01 0.00 0.00 42.46 41.03 3lsa s ILE 75 CO 0.23 0.48 1.51 -0.69 0.00 0.00 0.00 174.94 176.47 3lsa s VAL 76 N 0.49 2.54 -0.55 2.92 1.01 -1.26 -4.71 120.40 120.84 3lsa s VAL 76 Ca -0.17 0.43 -0.10 0.00 0.00 0.00 0.00 61.98 62.14 3lsa s VAL 76 Cb -0.17 -3.27 0.14 0.00 0.00 0.00 0.00 36.38 33.07 3lsa s VAL 76 CO 0.07 0.06 0.44 -0.62 0.00 0.00 0.00 175.10 175.04 3lsa s ASP 77 N 0.66 5.89 0.32 3.32 -1.08 -1.26 -4.65 116.67 119.87 3lsa s ASP 77 Ca 0.64 -2.09 0.01 0.00 -0.52 0.00 0.00 52.55 50.59 3lsa s ASP 77 Cb -0.44 -2.06 0.55 0.00 -1.46 0.00 0.00 42.92 39.51 3lsa s ASP 77 CO 0.40 -0.68 1.92 0.22 0.52 0.00 0.00 175.17 177.55 3lsa h TYR 78 N 8.31 0.77 0.07 -5.34 3.20 -1.94 -3.13 116.97 118.91 3lsa h TYR 78 Ca -0.17 -0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.57 3lsa h TYR 78 Cb 1.06 -0.24 0.01 0.00 1.54 0.00 0.00 36.73 39.10 3lsa h TYR 78 CO 0.71 0.58 -0.44 0.74 -1.64 0.00 0.00 178.16 178.12 3lsa h PHE 79 N 0.77 0.31 0.00 -3.82 -1.00 -1.92 -3.15 116.94 108.14 3lsa h PHE 79 Ca 0.19 -0.22 -0.06 0.00 2.81 0.00 0.00 57.97 60.69 3lsa h PHE 79 Cb 0.12 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.65 3lsa h PHE 79 CO 0.01 1.14 -0.28 0.87 -1.61 0.00 0.00 178.31 178.45 3lsa h LYS 80 N -0.61 0.00 0.00 1.51 1.57 -1.89 -2.13 116.57 115.02 3lsa h LYS 80 Ca -0.07 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 3lsa h LYS 80 Cb 1.32 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.62 3lsa h LYS 80 CO 0.08 0.28 -0.27 1.96 -0.57 0.00 0.00 179.45 180.93 3lsa h GLN 81 N 0.00 0.00 0.00 3.15 4.20 -1.57 -3.24 115.11 117.65 3lsa h GLN 81 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3lsa h GLN 81 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 3lsa h GLN 81 CO 0.04 0.27 0.00 0.77 -0.67 0.00 0.00 178.83 179.23 3lsa h SER 82 N 0.00 0.00 -3.51 1.46 0.02 -1.34 -3.45 113.55 106.73 3lsa h SER 82 Ca -0.00 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.44 3lsa h SER 82 Cb 0.57 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 3lsa h SER 82 CO 0.03 0.00 0.01 -0.36 -1.14 0.00 0.00 176.83 175.37 3lsa s PHE 83 N -3.28 3.46 -0.46 3.45 0.40 -1.22 -0.43 117.98 119.90 3lsa s PHE 83 Ca 0.06 0.91 0.26 0.00 -0.60 0.00 0.00 56.93 57.56 3lsa s PHE 83 Cb 0.10 -2.32 0.76 0.00 0.51 0.00 0.00 43.02 42.07 3lsa s PHE 83 CO 0.52 0.04 1.74 -1.00 0.70 0.00 0.00 175.22 177.23 3lsa h PRO 84 N 1.63 0.00 -0.53 0.24 0.13 -1.92 -3.46 132.00 128.09 3lsa h PRO 84 Ca -0.47 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.69 3lsa h PRO 84 Cb 1.18 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.27 3lsa h PRO 84 CO 0.65 0.00 0.30 0.93 -0.23 0.00 0.00 178.00 179.65 3lsa h GLU 85 N 0.00 0.57 0.00 0.86 3.07 -1.91 -3.28 114.58 113.89 3lsa h GLU 85 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3lsa h GLU 85 Cb 0.74 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 3lsa h GLU 85 CO 0.00 0.37 0.00 0.41 -1.40 0.00 0.00 179.01 178.39 3lsa n GLY 86 N -1.25 -1.83 3.70 -3.84 0.00 0.42 -4.66 105.19 97.73 3lsa n GLY 86 Ca 0.04 -1.98 -0.09 0.00 0.00 0.00 0.00 46.02 44.00 3lsa n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3lsa s TYR 87 N 0.00 0.22 0.22 1.61 1.13 -1.02 -1.29 117.35 118.22 3lsa s TYR 87 Ca 0.00 -0.64 0.05 0.00 -1.41 0.00 0.00 57.07 55.07 3lsa s TYR 87 Cb 0.00 0.42 -0.05 0.00 -1.10 0.00 0.00 41.96 41.23 3lsa s TYR 87 CO 0.00 -1.16 -0.05 -1.54 -2.51 0.00 0.00 175.55 170.29 3lsa s SER 88 N -3.01 2.09 0.09 -0.18 1.04 -0.01 -1.30 113.70 112.41 3lsa s SER 88 Ca 0.19 -1.15 0.02 0.00 0.48 0.00 0.00 55.95 55.48 3lsa s SER 88 Cb -0.03 -0.05 -0.04 0.00 0.10 0.00 0.00 66.02 66.01 3lsa s SER 88 CO 0.10 -0.40 -0.06 -1.66 0.98 0.00 0.00 173.24 172.19 3lsa s TRP 89 N -3.27 0.82 0.01 5.02 1.48 -0.23 -0.71 118.94 122.07 3lsa s TRP 89 Ca 0.26 -0.87 0.04 0.00 -1.06 0.00 0.00 56.10 54.46 3lsa s TRP 89 Cb 0.04 -0.49 -0.01 0.00 -1.16 0.00 0.00 33.47 31.85 3lsa s TRP 89 CO 0.07 -0.16 -0.11 -1.21 -4.06 0.00 0.00 176.95 171.48 3lsa s GLU 90 N -3.52 0.81 -0.17 3.25 2.02 -0.62 -1.62 118.70 118.85 3lsa s GLU 90 Ca 0.08 -0.54 -0.14 0.00 0.02 0.00 0.00 54.97 54.39 3lsa s GLU 90 Cb 0.03 -0.78 0.05 0.00 0.10 0.00 0.00 34.13 33.53 3lsa s GLU 90 CO -0.05 0.20 0.44 0.50 0.02 0.00 0.00 175.26 176.37 3lsa s ARG 91 N -0.71 0.49 0.13 1.61 3.52 0.19 -1.02 118.95 123.17 3lsa s ARG 91 Ca 0.01 0.66 0.08 0.00 -0.13 0.00 0.00 55.73 56.35 3lsa s ARG 91 Cb -0.06 0.20 -0.04 0.00 -1.56 0.00 0.00 34.95 33.49 3lsa s ARG 91 CO 0.00 -0.08 -0.09 -1.12 -0.81 0.00 0.00 175.30 173.20 3lsa s SER 92 N 0.49 4.39 -0.18 -2.12 0.01 -0.05 -0.90 113.70 115.32 3lsa s SER 92 Ca -0.02 -0.43 -0.04 0.00 1.31 0.00 0.00 55.95 56.77 3lsa s SER 92 Cb -0.04 -0.82 0.06 0.00 0.21 0.00 0.00 66.02 65.43 3lsa s SER 92 CO -0.02 0.15 0.07 -0.04 0.41 0.00 0.00 173.24 173.81 3lsa s MET 93 N -2.41 0.35 -0.31 12.44 -1.94 0.62 -0.79 119.30 127.26 3lsa s MET 93 Ca 0.23 -0.26 -0.07 0.00 -1.71 0.00 0.00 55.69 53.88 3lsa s MET 93 Cb -0.10 -1.95 0.02 0.00 2.01 0.00 0.00 34.83 34.80 3lsa s MET 93 CO 0.14 -0.67 0.09 0.42 -0.01 0.00 0.00 175.02 175.00 3lsa s ILE 94 N 2.00 3.96 0.29 2.53 1.01 0.06 -1.00 121.20 130.05 3lsa s ILE 94 Ca 0.01 -0.80 -0.08 0.00 0.00 0.00 0.00 60.65 59.77 3lsa s ILE 94 Cb -0.17 -3.10 -0.06 0.00 0.01 0.00 0.00 42.46 39.15 3lsa s ILE 94 CO -0.09 0.00 0.60 -0.31 0.00 0.00 0.00 174.94 175.14 3lsa s TYR 95 N 1.48 3.45 -0.22 3.97 1.51 -0.38 -0.87 117.35 126.29 3lsa s TYR 95 Ca 0.02 0.83 0.28 0.00 -1.01 0.00 0.00 57.07 57.18 3lsa s TYR 95 Cb -0.18 -2.24 1.18 0.00 -0.11 0.00 0.00 41.96 40.61 3lsa s TYR 95 CO 0.03 0.16 1.83 1.05 -1.11 0.00 0.00 175.55 177.50 3lsa h GLU 96 N 1.96 0.00 -0.67 -0.62 4.11 -1.42 -1.52 114.58 116.40 3lsa h GLU 96 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 3lsa h GLU 96 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3lsa h GLU 96 CO 0.67 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.35 3lsa n ASP 97 N -2.57 4.42 0.00 3.06 5.75 -1.26 -4.95 116.55 121.00 3lsa n ASP 97 Ca 0.01 -2.31 0.00 0.00 -0.01 0.00 0.00 54.79 52.48 3lsa n ASP 97 Cb 0.24 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 39.78 3lsa n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3lsa n GLY 98 N 1.27 1.26 3.76 6.12 0.00 -0.57 -4.75 105.19 112.27 3lsa n GLY 98 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 3lsa n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lsa n GLY 99 N -1.81 1.32 2.90 -0.02 0.00 -1.20 -4.78 105.19 101.60 3lsa n GLY 99 Ca 0.00 0.42 -0.19 0.00 0.00 0.00 0.00 46.02 46.25 3lsa n GLY 99 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lsa s ILE 100 N -0.34 0.48 -0.04 -0.61 1.01 -0.49 -1.25 121.20 119.96 3lsa s ILE 100 Ca 0.61 -0.12 0.05 0.00 0.00 0.00 0.00 60.65 61.19 3lsa s ILE 100 Cb -0.48 -0.50 -0.02 0.00 0.01 0.00 0.00 42.46 41.47 3lsa s ILE 100 CO 0.53 0.20 -0.20 0.00 0.00 0.00 0.00 174.94 175.47 3lsa s ASN 102 N -0.56 1.86 0.04 0.00 2.20 0.19 -0.28 114.94 118.39 3lsa s ASN 102 Ca 0.08 -0.43 -0.04 0.00 -0.94 0.00 0.00 52.86 51.53 3lsa s ASN 102 Cb -0.11 -0.15 -0.02 0.00 -2.00 0.00 0.00 41.25 38.98 3lsa s ASN 102 CO 0.01 0.09 0.05 0.00 -2.94 0.00 0.00 177.10 174.31 3lsa s ALA 103 N -0.73 0.05 0.04 3.54 0.00 -0.08 -0.79 121.76 123.79 3lsa s ALA 103 Ca 0.04 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.35 3lsa s ALA 103 Cb -0.08 0.23 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 3lsa s ALA 103 CO 0.01 -0.30 -0.04 0.95 0.00 0.00 0.00 175.76 176.38 3lsa s THR 104 N -2.58 0.26 -0.04 0.00 -4.23 -0.51 -0.64 115.64 107.91 3lsa s THR 104 Ca -0.05 -1.32 -0.03 0.00 -1.18 0.00 0.00 61.69 59.11 3lsa s THR 104 Cb -0.01 -0.84 0.01 0.00 1.34 0.00 0.00 72.50 72.99 3lsa s THR 104 CO -0.05 -0.68 0.10 0.21 -0.54 0.00 0.00 174.62 173.67 3lsa s ASN 105 N -2.09 -0.10 -0.18 3.99 3.84 -0.64 -1.49 114.94 118.28 3lsa s ASN 105 Ca -0.05 0.20 0.01 0.00 0.21 0.00 0.00 52.86 53.23 3lsa s ASN 105 Cb -0.03 0.20 0.02 0.00 -0.55 0.00 0.00 41.25 40.89 3lsa s ASN 105 CO -0.04 -0.04 -0.20 -0.62 -2.79 0.00 0.00 177.10 173.41 3lsa s ASP 106 N 0.10 3.11 -0.18 -4.21 2.15 -0.74 -1.07 116.67 115.83 3lsa s ASP 106 Ca -0.00 -0.64 -0.01 0.00 0.43 0.00 0.00 52.55 52.33 3lsa s ASP 106 Cb -0.01 -1.46 0.00 0.00 -0.30 0.00 0.00 42.92 41.15 3lsa s ASP 106 CO -0.00 -0.00 -0.13 -0.63 -0.17 0.00 0.00 175.17 174.23 3lsa s ILE 107 N 1.30 2.71 0.39 4.11 1.01 -0.42 -1.94 121.20 128.35 3lsa s ILE 107 Ca 0.05 -0.74 0.05 0.00 0.00 0.00 0.00 60.65 60.01 3lsa s ILE 107 Cb -0.13 -2.17 -0.07 0.00 0.01 0.00 0.00 42.46 40.11 3lsa s ILE 107 CO -0.13 0.50 0.03 0.42 0.00 0.00 0.00 174.94 175.76 3lsa s THR 108 N 1.11 1.58 -0.12 2.92 -4.23 -0.30 -2.43 115.64 114.17 3lsa s THR 108 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.54 3lsa s THR 108 Cb -0.14 -2.82 0.01 0.00 1.34 0.00 0.00 72.50 70.88 3lsa s THR 108 CO -0.04 0.00 -0.19 -0.22 -0.54 0.00 0.00 174.62 173.63 3lsa s LEU 109 N -3.64 1.90 -0.30 4.79 2.96 -1.24 -0.48 118.68 122.67 3lsa s LEU 109 Ca 0.32 -0.50 0.03 0.00 -0.22 0.00 0.00 54.13 53.76 3lsa s LEU 109 Cb 0.08 -1.24 0.08 0.00 0.50 0.00 0.00 46.19 45.62 3lsa s LEU 109 CO 0.16 0.06 -0.00 -0.62 -1.32 0.00 0.00 176.35 174.62 3lsa s ASP 110 N 0.83 4.50 1.65 3.68 2.15 0.08 -4.98 116.67 124.59 3lsa s ASP 110 Ca -0.09 -1.78 0.00 0.00 0.43 0.00 0.00 52.55 51.12 3lsa s ASP 110 Cb -0.16 -1.48 0.00 0.00 -0.30 0.00 0.00 42.92 40.98 3lsa s ASP 110 CO -0.00 -0.31 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 3lsa n GLY 111 N 4.41 2.68 1.20 2.66 0.00 -1.26 -1.54 105.19 113.34 3lsa n GLY 111 Ca -0.04 0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3lsa n GLY 111 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3lsa n ASP 112 N 10.02 4.04 -4.17 1.61 5.75 -1.26 -4.95 116.55 127.58 3lsa n ASP 112 Ca 0.00 -2.35 -0.33 0.00 -0.01 0.00 0.00 54.79 52.10 3lsa n ASP 112 Cb 0.00 -0.47 -0.16 0.00 -1.03 0.00 0.00 41.12 39.46 3lsa n ASP 112 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3lsa s TYR 114 N 1.14 3.50 -0.23 0.00 1.51 -0.03 -0.74 117.35 122.51 3lsa s TYR 114 Ca 0.01 1.47 -0.04 0.00 -1.01 0.00 0.00 57.07 57.50 3lsa s TYR 114 Cb -0.14 -3.36 -0.00 0.00 -0.11 0.00 0.00 41.96 38.35 3lsa s TYR 114 CO -0.08 -0.95 -0.04 0.42 -1.11 0.00 0.00 175.55 173.79 3lsa s ILE 115 N 0.20 3.32 -0.14 2.71 -1.09 0.37 -0.49 121.20 126.08 3lsa s ILE 115 Ca 0.53 -0.58 0.02 0.00 -2.23 0.00 0.00 60.65 58.38 3lsa s ILE 115 Cb -0.30 -2.54 0.00 0.00 -1.58 0.00 0.00 42.46 38.04 3lsa s ILE 115 CO 0.34 0.37 -0.20 0.00 -1.23 0.00 0.00 174.94 174.22 3lsa s GLU 117 N 0.73 2.55 -0.08 0.00 0.41 -0.82 -1.65 118.70 119.84 3lsa s GLU 117 Ca -0.08 -1.17 0.01 0.00 -0.41 0.00 0.00 54.97 53.32 3lsa s GLU 117 Cb -0.16 -3.05 -0.02 0.00 -1.78 0.00 0.00 34.13 29.12 3lsa s GLU 117 CO 0.00 -0.53 -0.12 0.42 -0.49 0.00 0.00 175.26 174.55 3lsa s ILE 118 N 1.25 3.23 -0.07 -1.63 1.01 -0.07 -1.79 121.20 123.14 3lsa s ILE 118 Ca -0.04 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.01 3lsa s ILE 118 Cb -0.19 -2.32 -0.02 0.00 0.01 0.00 0.00 42.46 39.95 3lsa s ILE 118 CO -0.03 0.57 -0.15 -0.60 0.00 0.00 0.00 174.94 174.73 3lsa s ARG 119 N -0.34 2.71 -0.04 2.79 6.06 -0.55 -1.48 118.95 128.11 3lsa s ARG 119 Ca 0.04 -0.71 0.00 0.00 -2.50 0.00 0.00 55.73 52.56 3lsa s ARG 119 Cb -0.13 -2.43 0.03 0.00 0.06 0.00 0.00 34.95 32.49 3lsa s ARG 119 CO 0.02 0.51 0.00 0.12 -2.50 0.00 0.00 175.30 173.46 3lsa s PHE 120 N -0.44 0.37 -0.09 5.12 5.36 -0.63 -1.42 117.98 126.25 3lsa s PHE 120 Ca 0.05 -0.02 -0.03 0.00 -0.96 0.00 0.00 56.93 55.98 3lsa s PHE 120 Cb -0.12 -0.49 0.04 0.00 -0.34 0.00 0.00 43.02 42.11 3lsa s PHE 120 CO 0.02 -0.17 0.05 -0.51 -1.46 0.00 0.00 175.22 173.16 3lsa s ASP 121 N 1.24 1.67 -0.05 6.13 1.01 0.03 -1.23 116.67 125.46 3lsa s ASP 121 Ca -0.07 -0.20 0.04 0.00 0.71 0.00 0.00 52.55 53.04 3lsa s ASP 121 Cb -0.13 -0.27 -0.02 0.00 1.01 0.00 0.00 42.92 43.51 3lsa s ASP 121 CO -0.02 -0.27 -0.17 -0.83 0.21 0.00 0.00 175.17 174.09 3lsa s GLY 122 N 2.09 1.46 0.10 0.21 0.00 -0.28 -0.63 107.32 110.27 3lsa s GLY 122 Ca 0.04 -1.00 0.01 0.00 0.00 0.00 0.00 44.72 43.76 3lsa s GLY 122 CO -0.05 -0.73 -0.04 -1.34 0.00 0.00 0.00 173.10 170.94 3lsa s VAL 123 N -0.55 0.50 -1.53 1.40 -7.23 -0.21 -0.50 120.40 112.28 3lsa s VAL 123 Ca 0.08 -1.90 0.00 0.00 -1.81 0.00 0.00 61.98 58.34 3lsa s VAL 123 Cb -0.11 -1.73 0.00 0.00 0.56 0.00 0.00 36.38 35.10 3lsa s VAL 123 CO 0.01 -0.82 0.00 0.59 -0.31 0.00 0.00 175.10 174.57 3lsa n ASN 124 N -0.03 -4.85 -4.66 4.85 3.02 -1.26 -1.39 115.26 110.93 3lsa n ASN 124 Ca -0.11 0.19 -0.43 0.00 -0.03 0.00 0.00 54.58 54.20 3lsa n ASN 124 Cb 0.61 -3.87 -0.02 0.00 -0.61 0.00 0.00 39.78 35.89 3lsa n ASN 124 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3lsa s PHE 125 N -2.70 2.90 0.48 3.10 0.08 -1.26 -3.23 117.98 117.35 3lsa s PHE 125 Ca 0.00 1.04 -0.24 0.00 0.12 0.00 0.00 56.93 57.85 3lsa s PHE 125 Cb 0.00 -3.49 -0.07 0.00 -0.57 0.00 0.00 43.02 38.89 3lsa s PHE 125 CO 0.00 -1.65 1.35 -2.14 -0.10 0.00 0.00 175.22 172.68 3lsa s PRO 126 N 3.29 3.54 0.52 0.24 0.02 -1.26 -4.89 135.00 136.45 3lsa s PRO 126 Ca 0.55 2.23 0.20 0.00 0.02 0.00 0.00 61.00 63.99 3lsa s PRO 126 Cb -0.22 -2.49 1.37 0.00 0.02 0.00 0.00 34.50 33.17 3lsa s PRO 126 CO 0.16 -0.87 2.15 0.00 -0.33 0.00 0.00 177.00 178.10 3lsa h ALA 127 N 2.02 1.80 -0.05 -1.55 0.00 -1.98 -1.84 119.26 117.66 3lsa h ALA 127 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3lsa h ALA 127 Cb 1.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3lsa h ALA 127 CO 0.60 0.04 0.00 0.27 0.00 0.00 0.00 179.25 180.16 3lsa n ASN 128 N -4.30 2.89 -4.86 0.00 0.23 -1.26 -4.40 115.26 103.56 3lsa n ASN 128 Ca -0.03 -1.93 -0.30 0.00 -0.53 0.00 0.00 54.58 51.80 3lsa n ASN 128 Cb 0.12 -0.02 0.08 0.00 -2.08 0.00 0.00 39.78 37.88 3lsa n ASN 128 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 3lsa s GLY 129 N -1.82 1.61 0.57 4.83 0.00 -0.69 -4.84 107.32 106.98 3lsa s GLY 129 Ca 0.27 -0.41 0.34 0.00 0.00 0.00 0.00 44.72 44.91 3lsa s GLY 129 CO 0.28 0.02 2.11 -0.56 0.00 0.00 0.00 173.10 174.95 3lsa h PRO 130 N -0.95 0.00 0.15 2.90 0.13 -1.94 -1.15 132.00 131.14 3lsa h PRO 130 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 3lsa h PRO 130 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3lsa h PRO 130 CO 0.63 0.05 -0.07 0.28 -0.23 0.00 0.00 178.00 178.66 3lsa h VAL 131 N 0.00 0.78 0.00 1.56 2.07 -1.93 -0.26 116.25 118.47 3lsa h VAL 131 Ca -0.00 -1.18 -0.04 0.00 0.82 0.00 0.00 66.70 66.30 3lsa h VAL 131 Cb 0.34 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 3lsa h VAL 131 CO 0.01 0.21 -0.18 0.24 0.02 0.00 0.00 177.57 177.87 3lsa h MET 132 N -0.91 0.00 -0.12 1.57 2.86 -1.75 0.13 114.93 116.70 3lsa h MET 132 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3lsa h MET 132 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 3lsa h MET 132 CO 0.03 0.18 0.00 1.04 1.06 0.00 0.00 176.91 179.23 3lsa n GLN 133 N -3.55 1.83 -3.89 1.72 1.13 -0.44 -4.71 117.38 109.48 3lsa n GLN 133 Ca -0.01 -1.23 -0.24 0.00 -1.94 0.00 0.00 57.00 53.57 3lsa n GLN 133 Cb 0.33 -1.44 -0.01 0.00 0.11 0.00 0.00 30.24 29.23 3lsa n GLN 133 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3lsa n LYS 134 N 0.47 -3.76 -0.32 -1.09 5.02 -0.80 -4.90 118.16 112.77 3lsa n LYS 134 Ca 0.17 0.47 0.11 0.00 -2.02 0.00 0.00 58.31 57.04 3lsa n LYS 134 Cb 0.39 -4.73 0.29 0.00 -0.02 0.00 0.00 35.03 30.96 3lsa n LYS 134 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3lsa n ARG 135 N -4.37 2.71 -3.20 1.97 1.74 -0.17 -4.98 116.66 110.36 3lsa n ARG 135 Ca -0.30 -2.53 -0.34 0.00 -0.77 0.00 0.00 57.85 53.91 3lsa n ARG 135 Cb 0.68 -1.52 -0.06 0.00 -1.02 0.00 0.00 32.46 30.54 3lsa n ARG 135 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3lsa s THR 136 N -1.05 4.71 -0.13 0.55 -4.23 -1.26 -0.45 115.64 113.77 3lsa s THR 136 Ca 0.44 0.97 -0.10 0.00 -1.18 0.00 0.00 61.69 61.82 3lsa s THR 136 Cb 0.23 -3.71 -0.06 0.00 1.34 0.00 0.00 72.50 70.31 3lsa s THR 136 CO 0.31 0.02 -0.23 0.52 -0.54 0.00 0.00 174.62 174.69 3lsa n VAL 137 N 0.18 1.19 -3.57 2.29 0.31 0.23 -4.74 118.33 114.23 3lsa n VAL 137 Ca -0.00 -0.02 -0.07 0.00 -0.01 0.00 0.00 64.34 64.24 3lsa n VAL 137 Cb 0.52 -1.91 -0.02 0.00 -0.91 0.00 0.00 33.84 31.53 3lsa n VAL 137 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3lsa s LYS 138 N -2.45 0.87 0.14 5.55 -2.85 -1.24 -4.99 119.74 114.76 3lsa s LYS 138 Ca -0.22 -0.37 -0.26 0.00 -1.00 0.00 0.00 55.97 54.11 3lsa s LYS 138 Cb 0.06 0.37 -0.07 0.00 -2.06 0.00 0.00 37.83 36.13 3lsa s LYS 138 CO 0.30 -0.39 0.82 -1.58 0.10 0.00 0.00 175.35 174.60 3lsa s TRP 139 N -3.11 3.86 1.05 1.78 0.52 -1.26 -1.02 118.94 120.76 3lsa s TRP 139 Ca 0.07 1.65 -0.12 0.00 0.02 0.00 0.00 56.10 57.72 3lsa s TRP 139 Cb -0.01 -2.85 0.22 0.00 -1.15 0.00 0.00 33.47 29.68 3lsa s TRP 139 CO -0.06 0.40 1.07 -1.21 0.02 0.00 0.00 176.95 177.17 3lsa s GLU 140 N -0.69 0.00 0.06 4.98 0.41 -0.32 -4.81 118.70 118.34 3lsa s GLU 140 Ca 0.39 0.65 -0.34 0.00 -0.41 0.00 0.00 54.97 55.26 3lsa s GLU 140 Cb -0.23 -1.68 -0.13 0.00 -1.78 0.00 0.00 34.13 30.31 3lsa s GLU 140 CO 0.27 -3.06 1.68 -0.11 -0.49 0.00 0.00 175.26 173.56 3lsa n LEU 141 N -4.42 3.18 -4.40 1.80 -0.00 -1.26 -4.83 117.00 107.06 3lsa n LEU 141 Ca 0.05 1.04 -0.34 0.00 -0.00 0.00 0.00 56.01 56.76 3lsa n LEU 141 Cb 0.56 -1.40 -0.13 0.00 -0.00 0.00 0.00 43.42 42.45 3lsa n LEU 141 CO 0.57 -0.23 -0.37 -0.44 -0.00 0.00 0.00 177.39 176.92 3lsa s SER 142 N 2.09 4.52 -0.36 1.96 0.01 -0.47 -4.94 113.70 116.51 3lsa s SER 142 Ca 0.84 -0.27 -0.09 0.00 1.31 0.00 0.00 55.95 57.74 3lsa s SER 142 Cb -0.69 -1.75 0.03 0.00 0.21 0.00 0.00 66.02 63.81 3lsa s SER 142 CO 0.43 0.08 0.17 -0.89 0.41 0.00 0.00 173.24 173.45 3lsa s THR 143 N 0.91 4.30 -0.05 1.44 2.01 -1.26 -0.06 115.64 122.94 3lsa s THR 143 Ca -0.00 -0.97 -0.19 0.00 0.31 0.00 0.00 61.69 60.84 3lsa s THR 143 Cb -0.15 -3.42 -0.05 0.00 0.01 0.00 0.00 72.50 68.89 3lsa s THR 143 CO 0.01 -0.23 0.52 -0.70 -0.69 0.00 0.00 174.62 173.53 3lsa s GLU 144 N 1.50 4.25 -0.21 4.92 2.12 0.28 -4.53 118.70 127.03 3lsa s GLU 144 Ca 0.01 0.57 -0.03 0.00 0.36 0.00 0.00 54.97 55.87 3lsa s GLU 144 Cb -0.19 -3.36 -0.01 0.00 0.26 0.00 0.00 34.13 30.83 3lsa s GLU 144 CO 0.05 0.35 -0.06 0.15 -0.54 0.00 0.00 175.26 175.21 3lsa s LYS 145 N -0.04 3.37 -0.10 4.30 -0.14 -0.48 -0.81 119.74 125.84 3lsa s LYS 145 Ca 0.28 -0.64 -0.02 0.00 -1.36 0.00 0.00 55.97 54.24 3lsa s LYS 145 Cb -0.17 -2.96 -0.03 0.00 -1.68 0.00 0.00 37.83 32.99 3lsa s LYS 145 CO 0.14 -0.16 -0.03 -0.51 -0.76 0.00 0.00 175.35 174.03 3lsa s LEU 146 N 1.36 3.37 0.04 3.17 1.02 -0.01 -1.84 118.68 125.80 3lsa s LEU 146 Ca 0.04 0.02 -0.14 0.00 0.02 0.00 0.00 54.13 54.07 3lsa s LEU 146 Cb -0.14 -1.77 0.02 0.00 0.02 0.00 0.00 46.19 44.32 3lsa s LEU 146 CO -0.03 0.31 0.32 -0.72 0.02 0.00 0.00 176.35 176.25 3lsa s TYR 147 N -0.50 -0.13 -0.03 0.29 1.13 -0.22 -2.23 117.35 115.67 3lsa s TYR 147 Ca 0.08 0.01 -0.16 0.00 -1.41 0.00 0.00 57.07 55.59 3lsa s TYR 147 Cb -0.12 0.11 -0.05 0.00 -1.10 0.00 0.00 41.96 40.80 3lsa s TYR 147 CO 0.02 -0.51 0.44 0.08 -2.51 0.00 0.00 175.55 173.06 3lsa s VAL 148 N -2.53 5.05 -0.10 -3.49 1.01 -1.26 -0.33 120.40 118.75 3lsa s VAL 148 Ca -0.05 0.89 -0.08 0.00 0.00 0.00 0.00 61.98 62.75 3lsa s VAL 148 Cb -0.01 -3.75 0.03 0.00 0.00 0.00 0.00 36.38 32.65 3lsa s VAL 148 CO -0.03 0.50 0.26 -0.60 0.00 0.00 0.00 175.10 175.23 3lsa s ARG 149 N -0.56 0.27 -1.48 2.72 3.52 -0.78 -4.94 118.95 117.69 3lsa s ARG 149 Ca 0.24 0.43 -0.11 0.00 -0.13 0.00 0.00 55.73 56.16 3lsa s ARG 149 Cb -0.16 0.05 0.07 0.00 -1.56 0.00 0.00 34.95 33.34 3lsa s ARG 149 CO 0.13 -0.08 0.97 -0.25 -0.81 0.00 0.00 175.30 175.26 3lsa n ASP 150 N 3.44 -4.53 0.00 -2.12 8.00 -1.26 -2.11 116.55 117.97 3lsa n ASP 150 Ca -0.17 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 54.57 3lsa n ASP 150 Cb 0.56 -4.05 0.00 0.00 -0.02 0.00 0.00 41.12 37.61 3lsa n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3lsa n GLY 151 N -1.71 0.38 3.45 0.44 0.00 -1.26 -4.97 105.19 101.52 3lsa n GLY 151 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 3lsa n GLY 151 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3lsa s VAL 152 N -1.94 0.78 -0.17 1.61 -7.23 -0.90 -5.02 120.40 107.54 3lsa s VAL 152 Ca 0.00 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.12 3lsa s VAL 152 Cb 0.00 -2.56 -0.03 0.00 0.56 0.00 0.00 36.38 34.35 3lsa s VAL 152 CO 0.00 0.00 0.00 -0.22 -0.31 0.00 0.00 175.10 174.57 3lsa s LEU 153 N -3.51 3.45 0.26 1.32 2.96 -1.11 -1.87 118.68 120.18 3lsa s LEU 153 Ca 0.31 -0.06 0.10 0.00 -0.22 0.00 0.00 54.13 54.26 3lsa s LEU 153 Cb 0.06 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 3lsa s LEU 153 CO 0.15 0.16 -0.04 -0.54 -1.32 0.00 0.00 176.35 174.76 3lsa s LYS 154 N 0.41 2.18 0.19 1.98 -0.14 0.55 -0.13 119.74 124.78 3lsa s LYS 154 Ca -0.01 -1.44 -0.12 0.00 -1.36 0.00 0.00 55.97 53.03 3lsa s LYS 154 Cb -0.14 -2.11 0.00 0.00 -1.68 0.00 0.00 37.83 33.91 3lsa s LYS 154 CO 0.02 0.37 0.39 -1.54 -0.76 0.00 0.00 175.35 173.83 3lsa s SER 155 N -3.54 -0.08 0.22 2.83 1.04 -0.14 -1.05 113.70 112.99 3lsa s SER 155 Ca 0.30 -0.76 -0.20 0.00 0.48 0.00 0.00 55.95 55.78 3lsa s SER 155 Cb -0.07 0.51 0.03 0.00 0.10 0.00 0.00 66.02 66.60 3lsa s SER 155 CO 0.19 -0.99 0.62 1.51 0.98 0.00 0.00 173.24 175.54 3lsa s ASP 156 N -2.95 -0.32 -0.17 7.02 1.47 -0.77 -1.22 116.67 119.74 3lsa s ASP 156 Ca 0.16 -0.45 -0.20 0.00 1.18 0.00 0.00 52.55 53.23 3lsa s ASP 156 Cb 0.01 0.64 0.05 0.00 -0.34 0.00 0.00 42.92 43.29 3lsa s ASP 156 CO 0.01 -1.16 0.54 -0.83 0.68 0.00 0.00 175.17 174.41 3lsa s GLY 157 N -2.87 -0.41 -0.54 2.12 0.00 -0.86 -1.38 107.32 103.39 3lsa s GLY 157 Ca 0.09 1.41 -0.10 0.00 0.00 0.00 0.00 44.72 46.12 3lsa s GLY 157 CO -0.00 1.18 0.42 -1.31 0.00 0.00 0.00 173.10 173.39 3lsa s ASN 158 N -0.02 5.84 0.39 1.64 0.02 -1.26 -1.09 114.94 120.46 3lsa s ASN 158 Ca -0.02 -2.08 0.08 0.00 -1.02 0.00 0.00 52.86 49.81 3lsa s ASN 158 Cb -0.04 -2.04 -0.01 0.00 0.02 0.00 0.00 41.25 39.18 3lsa s ASN 158 CO 0.02 -0.67 0.41 -0.31 0.02 0.00 0.00 177.10 176.57 3lsa s TYR 159 N 1.12 2.82 -0.11 2.20 2.02 0.66 -4.86 117.35 121.20 3lsa s TYR 159 Ca 0.08 -0.40 -0.08 0.00 -0.37 0.00 0.00 57.07 56.30 3lsa s TYR 159 Cb -0.24 -2.12 0.04 0.00 -0.40 0.00 0.00 41.96 39.24 3lsa s TYR 159 CO -0.01 -0.11 0.28 0.00 -1.57 0.00 0.00 175.55 174.14 3lsa s ALA 160 N -2.38 -0.68 -0.14 3.71 0.00 -1.26 -1.41 121.76 119.60 3lsa s ALA 160 Ca 0.48 0.98 -0.16 0.00 0.00 0.00 0.00 51.96 53.25 3lsa s ALA 160 Cb -0.06 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 3lsa s ALA 160 CO 0.29 -0.18 0.40 -0.51 0.00 0.00 0.00 175.76 175.76 3lsa s LEU 161 N 0.81 4.25 0.41 0.00 1.43 0.16 -1.17 118.68 124.57 3lsa s LEU 161 Ca -0.05 0.67 -0.23 0.00 -1.03 0.00 0.00 54.13 53.49 3lsa s LEU 161 Cb -0.07 -2.55 -0.09 0.00 0.03 0.00 0.00 46.19 43.51 3lsa s LEU 161 CO -0.05 0.03 1.01 -0.94 0.23 0.00 0.00 176.35 176.63 3lsa s SER 162 N 0.60 6.79 0.01 2.29 1.04 -0.18 -0.14 113.70 124.10 3lsa s SER 162 Ca 0.22 1.92 0.02 0.00 0.48 0.00 0.00 55.95 58.58 3lsa s SER 162 Cb -0.14 -2.57 -0.04 0.00 0.10 0.00 0.00 66.02 63.37 3lsa s SER 162 CO 0.07 -0.47 0.01 -0.76 0.98 0.00 0.00 173.24 173.07 3lsa s LEU 163 N -2.84 3.53 0.09 2.42 1.43 -0.58 -0.60 118.68 122.14 3lsa s LEU 163 Ca 0.60 -0.02 -0.31 0.00 -1.03 0.00 0.00 54.13 53.37 3lsa s LEU 163 Cb -0.18 -2.05 -0.09 0.00 0.03 0.00 0.00 46.19 43.90 3lsa s LEU 163 CO 0.22 0.27 1.62 -0.70 0.23 0.00 0.00 176.35 178.00 3lsa s GLU 164 N -1.65 4.21 -0.21 1.70 -6.30 0.40 -0.53 118.70 116.32 3lsa s GLU 164 Ca 0.20 2.33 -0.00 0.00 -2.50 0.00 0.00 54.97 55.00 3lsa s GLU 164 Cb -0.12 -3.48 0.00 0.00 0.00 0.00 0.00 34.13 30.54 3lsa s GLU 164 CO 0.11 -0.69 0.04 0.41 0.02 0.00 0.00 175.26 175.15 3lsa n GLY 165 N 3.92 0.40 0.14 -1.50 0.00 -1.26 -4.98 105.19 101.91 3lsa n GLY 165 Ca 0.15 -0.72 0.02 0.00 0.00 0.00 0.00 46.02 45.47 3lsa n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lsa n GLY 166 N -0.92 -2.71 0.00 -0.02 0.00 0.31 -5.10 105.19 96.75 3lsa n GLY 166 Ca -0.02 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.60 3lsa n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lsa n GLY 167 N -2.20 0.02 3.22 -0.02 0.00 -1.26 -4.47 105.19 100.49 3lsa n GLY 167 Ca -0.01 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 43.99 3lsa n GLY 167 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3lsa s HIS 168 N -1.56 1.24 -0.15 1.61 0.09 -1.26 -1.52 115.29 113.74 3lsa s HIS 168 Ca 0.00 -0.66 0.00 0.00 -0.00 0.00 0.00 55.06 54.41 3lsa s HIS 168 Cb 0.00 -0.65 0.03 0.00 -0.00 0.00 0.00 32.58 31.96 3lsa s HIS 168 CO 0.00 0.08 -0.12 -0.47 -0.00 0.00 0.00 174.74 174.23 3lsa s TYR 169 N -2.63 2.02 0.04 1.40 5.04 0.80 -4.92 117.35 119.09 3lsa s TYR 169 Ca 0.10 -1.15 -0.15 0.00 -2.44 0.00 0.00 57.07 53.43 3lsa s TYR 169 Cb -0.02 -1.51 -0.06 0.00 0.35 0.00 0.00 41.96 40.72 3lsa s TYR 169 CO 0.01 -0.64 0.46 1.03 -1.34 0.00 0.00 175.55 175.07 3lsa s ARG 170 N 1.53 3.98 -0.02 4.97 1.81 -1.26 -0.67 118.95 129.30 3lsa s ARG 170 Ca 0.04 0.48 -0.01 0.00 -1.72 0.00 0.00 55.73 54.53 3lsa s ARG 170 Cb -0.13 -3.18 0.01 0.00 -0.45 0.00 0.00 34.95 31.20 3lsa s ARG 170 CO -0.10 0.65 0.03 0.00 -0.68 0.00 0.00 175.30 175.20 3lsa s ASP 172 N 0.46 5.24 -0.07 0.00 1.01 -0.05 -0.24 116.67 123.01 3lsa s ASP 172 Ca -0.04 -0.11 -0.06 0.00 0.71 0.00 0.00 52.55 53.05 3lsa s ASP 172 Cb -0.05 -1.92 -0.04 0.00 1.01 0.00 0.00 42.92 41.92 3lsa s ASP 172 CO -0.01 0.05 0.18 -0.36 0.21 0.00 0.00 175.17 175.23 3lsa s PHE 173 N 1.10 3.59 -0.05 4.23 2.99 -0.25 -0.76 117.98 128.84 3lsa s PHE 173 Ca 0.04 0.52 -0.00 0.00 0.00 0.00 0.00 56.93 57.48 3lsa s PHE 173 Cb -0.14 -1.94 0.03 0.00 0.00 0.00 0.00 43.02 40.97 3lsa s PHE 173 CO 0.03 0.70 -0.01 0.15 -0.00 0.00 0.00 175.22 176.09 3lsa s LYS 174 N -1.32 0.59 0.04 0.44 1.02 0.03 -2.03 119.74 118.52 3lsa s LYS 174 Ca 0.20 0.04 0.06 0.00 0.02 0.00 0.00 55.97 56.29 3lsa s LYS 174 Cb -0.13 -0.82 -0.02 0.00 -0.52 0.00 0.00 37.83 36.34 3lsa s LYS 174 CO 0.09 -0.20 -0.17 0.99 -0.92 0.00 0.00 175.35 175.14 3lsa s THR 175 N 1.46 1.34 -0.10 2.17 2.01 -0.35 -0.87 115.64 121.30 3lsa s THR 175 Ca -0.03 -1.06 0.03 0.00 0.31 0.00 0.00 61.69 60.94 3lsa s THR 175 Cb -0.13 -1.19 -0.01 0.00 0.01 0.00 0.00 72.50 71.18 3lsa s THR 175 CO -0.03 0.11 -0.20 -0.89 -0.69 0.00 0.00 174.62 172.92 3lsa s THR 176 N -0.79 2.43 -0.10 -0.82 2.01 -0.19 -0.96 115.64 117.21 3lsa s THR 176 Ca 0.04 -0.90 -0.01 0.00 0.31 0.00 0.00 61.69 61.13 3lsa s THR 176 Cb -0.08 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.45 3lsa s THR 176 CO 0.01 0.55 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.14 3lsa s TYR 177 N 0.23 3.00 -0.20 4.92 2.02 0.81 -1.59 117.35 126.54 3lsa s TYR 177 Ca -0.13 -0.07 -0.02 0.00 -0.37 0.00 0.00 57.07 56.48 3lsa s TYR 177 Cb -0.16 -1.81 0.06 0.00 -0.40 0.00 0.00 41.96 39.65 3lsa s TYR 177 CO 0.07 0.23 0.02 0.15 -1.57 0.00 0.00 175.55 174.45 3lsa s LYS 178 N -0.42 0.79 0.43 -0.62 1.02 0.12 -2.77 119.74 118.29 3lsa s LYS 178 Ca 0.07 -0.50 -0.25 0.00 0.02 0.00 0.00 55.97 55.31 3lsa s LYS 178 Cb -0.12 -2.17 -0.08 0.00 -0.52 0.00 0.00 37.83 34.94 3lsa s LYS 178 CO 0.02 -0.63 1.27 0.00 -0.92 0.00 0.00 175.35 175.09 3lsa s ALA 179 N 1.79 3.14 -2.10 5.17 0.00 -1.26 -0.83 121.76 127.67 3lsa s ALA 179 Ca -0.02 1.16 0.30 0.00 0.00 0.00 0.00 51.96 53.40 3lsa s ALA 179 Cb -0.17 -3.46 1.48 0.00 0.00 0.00 0.00 23.12 20.96 3lsa s ALA 179 CO -0.08 -0.82 1.99 1.63 0.00 0.00 0.00 175.76 178.48 3lsa n LYS 180 N -0.13 1.17 -4.25 0.00 5.02 -0.41 -4.88 118.16 114.69 3lsa n LYS 180 Ca 0.05 -0.38 -0.15 0.00 -2.02 0.00 0.00 58.31 55.81 3lsa n LYS 180 Cb 0.45 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.87 3lsa n LYS 180 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 3lsa s LYS 181 N -2.09 1.45 -0.27 1.97 -2.85 -1.26 -4.99 119.74 111.69 3lsa s LYS 181 Ca 0.41 -1.80 -0.29 0.00 -1.00 0.00 0.00 55.97 53.28 3lsa s LYS 181 Cb 0.21 0.25 0.01 0.00 -2.06 0.00 0.00 37.83 36.24 3lsa s LYS 181 CO 0.38 -0.49 1.05 0.08 0.10 0.00 0.00 175.35 176.46 3lsa s VAL 182 N -3.83 4.60 0.25 1.79 1.01 -1.26 -5.02 120.40 117.94 3lsa s VAL 182 Ca 0.39 1.86 0.04 0.00 0.00 0.00 0.00 61.98 64.28 3lsa s VAL 182 Cb 0.05 -4.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.02 3lsa s VAL 182 CO 0.18 -0.32 -0.02 0.68 0.00 0.00 0.00 175.10 175.63 3lsa s VAL 183 N 3.40 1.21 0.09 2.92 -7.23 -1.26 -5.04 120.40 114.49 3lsa s VAL 183 Ca 0.44 -2.06 -0.30 0.00 -1.81 0.00 0.00 61.98 58.26 3lsa s VAL 183 Cb -0.14 -2.39 -0.06 0.00 0.56 0.00 0.00 36.38 34.35 3lsa s VAL 183 CO 0.11 -0.30 1.09 -1.58 -0.31 0.00 0.00 175.10 174.10 3lsa s GLN 184 N -3.83 4.55 0.24 4.82 0.74 -1.26 -5.03 119.66 119.89 3lsa s GLN 184 Ca 0.29 1.64 -0.23 0.00 0.05 0.00 0.00 55.36 57.10 3lsa s GLN 184 Cb 0.05 -3.35 -0.09 0.00 1.10 0.00 0.00 33.01 30.72 3lsa s GLN 184 CO 0.10 -0.04 0.81 -0.51 -0.55 0.00 0.00 175.29 175.09 3lsa s LEU 185 N 0.44 4.42 0.59 3.68 1.43 -1.26 -4.64 118.68 123.35 3lsa s LEU 185 Ca 0.53 1.61 -0.07 0.00 -1.03 0.00 0.00 54.13 55.17 3lsa s LEU 185 Cb -0.27 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.32 3lsa s LEU 185 CO 0.31 0.06 0.92 -2.16 0.23 0.00 0.00 176.35 175.70 3lsa s PRO 186 N -1.75 3.10 0.80 1.29 0.04 -1.26 -4.97 135.00 132.25 3lsa s PRO 186 Ca 0.43 0.18 -0.12 0.00 0.04 0.00 0.00 61.00 61.53 3lsa s PRO 186 Cb -0.19 -2.24 0.08 0.00 0.04 0.00 0.00 34.50 32.19 3lsa s PRO 186 CO 0.24 -0.64 1.17 0.34 0.04 0.00 0.00 177.00 178.14 3lsa s ASP 187 N -4.26 4.57 0.27 6.66 3.68 -1.26 -4.62 116.67 121.70 3lsa s ASP 187 Ca 0.53 0.78 -0.30 0.00 2.13 0.00 0.00 52.55 55.69 3lsa s ASP 187 Cb -0.11 -1.29 -0.13 0.00 -1.45 0.00 0.00 42.92 39.93 3lsa s ASP 187 CO 0.47 -1.86 1.28 0.00 0.13 0.00 0.00 175.17 175.19 3lsa n TYR 188 N -3.28 1.96 -3.84 -5.34 4.19 -1.26 -4.87 117.16 104.72 3lsa n TYR 188 Ca 0.08 0.54 -0.06 0.00 3.31 0.00 0.00 57.90 61.76 3lsa n TYR 188 Cb 0.61 -2.39 0.02 0.00 0.49 0.00 0.00 39.34 38.06 3lsa n TYR 188 CO 0.00 0.00 0.00 -3.38 0.91 0.00 0.00 176.86 174.39 3lsa s HIS 189 N -0.53 0.07 0.23 2.98 -3.43 -0.95 -4.90 115.29 108.77 3lsa s HIS 189 Ca 0.64 -0.61 0.06 0.00 -0.80 0.00 0.00 55.06 54.35 3lsa s HIS 189 Cb -0.66 0.77 -0.05 0.00 -1.43 0.00 0.00 32.58 31.21 3lsa s HIS 189 CO 0.55 -1.27 -0.09 -1.54 -2.00 0.00 0.00 174.74 170.39 3lsa s SER 190 N -3.19 2.45 -0.07 7.38 1.04 -0.32 -0.83 113.70 120.16 3lsa s SER 190 Ca 0.18 -1.10 0.01 0.00 0.48 0.00 0.00 55.95 55.51 3lsa s SER 190 Cb -0.04 -0.11 0.02 0.00 0.10 0.00 0.00 66.02 65.99 3lsa s SER 190 CO 0.08 -0.29 -0.06 -0.69 0.98 0.00 0.00 173.24 173.26 3lsa s VAL 191 N -3.08 0.80 -0.07 5.02 1.01 0.01 -0.53 120.40 123.56 3lsa s VAL 191 Ca 0.25 -0.22 -0.20 0.00 0.00 0.00 0.00 61.98 61.81 3lsa s VAL 191 Cb 0.02 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.54 3lsa s VAL 191 CO 0.08 0.30 0.56 -1.81 0.00 0.00 0.00 175.10 174.23 3lsa s ASP 192 N 1.26 6.84 -0.09 3.32 1.01 -0.34 -0.56 116.67 128.12 3lsa s ASP 192 Ca -0.05 1.01 0.04 0.00 0.71 0.00 0.00 52.55 54.26 3lsa s ASP 192 Cb -0.14 -2.33 0.00 0.00 1.01 0.00 0.00 42.92 41.46 3lsa s ASP 192 CO -0.02 0.03 -0.21 -1.00 0.21 0.00 0.00 175.17 174.17 3lsa s HIS 193 N 0.32 2.24 -0.23 4.23 3.76 0.92 -1.61 115.29 124.91 3lsa s HIS 193 Ca 0.30 -0.88 -0.01 0.00 -0.15 0.00 0.00 55.06 54.32 3lsa s HIS 193 Cb -0.17 -1.52 0.03 0.00 1.11 0.00 0.00 32.58 32.03 3lsa s HIS 193 CO 0.14 -0.36 -0.09 -1.58 -0.85 0.00 0.00 174.74 172.00 3lsa s HIS 194 N 0.38 3.02 -0.05 1.40 2.46 -0.17 -1.37 115.29 120.96 3lsa s HIS 194 Ca -0.16 -1.61 0.06 0.00 0.47 0.00 0.00 55.06 53.82 3lsa s HIS 194 Cb -0.17 -2.02 -0.01 0.00 -0.13 0.00 0.00 32.58 30.25 3lsa s HIS 194 CO 0.07 -0.75 -0.24 -1.50 -2.47 0.00 0.00 174.74 169.85 3lsa s ILE 195 N 1.31 1.98 -0.10 0.89 2.07 -1.26 -1.05 121.20 125.04 3lsa s ILE 195 Ca 0.01 -1.03 -0.05 0.00 -1.41 0.00 0.00 60.65 58.17 3lsa s ILE 195 Cb -0.16 -1.68 0.05 0.00 0.13 0.00 0.00 42.46 40.80 3lsa s ILE 195 CO -0.06 0.55 0.23 -0.70 -1.91 0.00 0.00 174.94 173.05 3lsa s GLU 196 N -0.18 0.17 -0.44 3.50 2.12 -0.29 -4.57 118.70 119.01 3lsa s GLU 196 Ca -0.03 0.53 -0.29 0.00 0.36 0.00 0.00 54.97 55.54 3lsa s GLU 196 Cb -0.13 -0.13 0.02 0.00 0.26 0.00 0.00 34.13 34.15 3lsa s GLU 196 CO 0.03 -0.18 1.33 0.42 -0.54 0.00 0.00 175.26 176.32 3lsa s ILE 197 N 1.42 3.99 0.04 -3.70 1.01 -1.26 -0.91 121.20 121.79 3lsa s ILE 197 Ca -0.08 1.00 -0.16 0.00 0.00 0.00 0.00 60.65 61.41 3lsa s ILE 197 Cb -0.11 -4.35 -0.26 0.00 0.01 0.00 0.00 42.46 37.75 3lsa s ILE 197 CO -0.08 -0.87 1.12 0.40 0.00 0.00 0.00 174.94 175.51 3lsa h ILE 198 N 6.39 1.32 -3.19 2.92 1.08 -1.25 -3.48 117.51 121.31 3lsa h ILE 198 Ca -0.26 -2.32 -0.06 0.00 -0.39 0.00 0.00 64.86 61.83 3lsa h ILE 198 Cb 1.09 2.61 -0.14 0.00 -3.07 0.00 0.00 36.82 37.30 3lsa h ILE 198 CO 1.11 0.70 -0.06 -0.94 -0.69 0.00 0.00 178.15 178.27 3lsa s SER 199 N -7.23 -0.29 0.02 1.72 1.04 -1.18 -5.01 113.70 102.77 3lsa s SER 199 Ca -0.11 -0.15 -0.28 0.00 0.48 0.00 0.00 55.95 55.90 3lsa s SER 199 Cb 0.05 0.47 0.08 0.00 0.10 0.00 0.00 66.02 66.72 3lsa s SER 199 CO 0.90 -0.78 0.73 -1.38 0.98 0.00 0.00 173.24 173.68 3lsa s HIS 200 N -3.24 -0.53 0.80 5.02 -3.43 -1.26 -0.83 115.29 111.82 3lsa s HIS 200 Ca -0.01 0.63 -0.08 0.00 -0.80 0.00 0.00 55.06 54.80 3lsa s HIS 200 Cb 0.01 0.49 0.13 0.00 -1.43 0.00 0.00 32.58 31.77 3lsa s HIS 200 CO -0.08 -0.65 1.12 0.16 -2.00 0.00 0.00 174.74 173.29 3lsa s ASP 201 N -1.95 4.12 0.22 7.38 1.47 -0.77 -4.94 116.67 122.20 3lsa s ASP 201 Ca -0.03 0.19 -0.12 0.00 1.18 0.00 0.00 52.55 53.77 3lsa s ASP 201 Cb -0.01 -0.56 0.27 0.00 -0.34 0.00 0.00 42.92 42.28 3lsa s ASP 201 CO -0.02 -2.06 1.63 0.50 0.68 0.00 0.00 175.17 175.90 3lsa h LYS 202 N -0.94 0.02 -0.58 2.11 3.64 -2.02 -1.68 116.57 117.11 3lsa h LYS 202 Ca -0.42 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 3lsa h LYS 202 Cb 1.28 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 3lsa h LYS 202 CO 0.48 0.01 0.00 -0.40 -2.27 0.00 0.00 179.45 177.27 3lsa n ASP 203 N -5.41 4.86 -1.33 4.20 5.68 -1.26 -4.95 116.55 118.34 3lsa n ASP 203 Ca 0.09 -2.60 -0.17 0.00 -0.50 0.00 0.00 54.79 51.60 3lsa n ASP 203 Cb 0.35 -0.59 -0.07 0.00 -1.14 0.00 0.00 41.12 39.67 3lsa n ASP 203 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 3lsa n TYR 204 N 0.82 0.00 0.10 2.11 4.02 -0.63 -4.27 117.16 119.30 3lsa n TYR 204 Ca 0.25 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.24 3lsa n TYR 204 Cb 0.95 -2.99 0.57 0.00 -0.02 0.00 0.00 39.34 37.85 3lsa n TYR 204 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 3lsa h SER 205 N 0.00 0.18 -3.33 7.72 0.02 -1.92 -3.41 113.55 112.81 3lsa h SER 205 Ca -0.36 -0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.10 3lsa h SER 205 Cb 1.14 -0.04 -0.35 0.00 0.14 0.00 0.00 62.40 63.29 3lsa h SER 205 CO 0.52 0.12 -0.80 0.20 -1.14 0.00 0.00 176.83 175.74 3lsa s ASN 206 N -6.70 1.73 -0.02 3.07 -0.87 -1.26 -1.00 114.94 109.90 3lsa s ASN 206 Ca -0.06 -0.25 0.01 0.00 -1.57 0.00 0.00 52.86 50.99 3lsa s ASN 206 Cb 0.18 -0.73 0.01 0.00 -0.02 0.00 0.00 41.25 40.69 3lsa s ASN 206 CO 0.71 -0.05 -0.03 -0.69 -2.57 0.00 0.00 177.10 174.46 3lsa s VAL 207 N 1.18 0.34 -0.23 1.60 1.01 -0.19 -1.84 120.40 122.27 3lsa s VAL 207 Ca -0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 3lsa s VAL 207 Cb -0.14 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 3lsa s VAL 207 CO -0.02 0.13 0.04 0.21 0.00 0.00 0.00 175.10 175.46 3lsa s ASN 208 N 0.34 5.02 -0.05 3.32 3.04 -0.01 -0.11 114.94 126.49 3lsa s ASN 208 Ca -0.04 -0.20 0.06 0.00 0.04 0.00 0.00 52.86 52.73 3lsa s ASN 208 Cb -0.07 -1.88 -0.02 0.00 -1.54 0.00 0.00 41.25 37.74 3lsa s ASN 208 CO -0.00 0.01 -0.23 -0.22 -3.04 0.00 0.00 177.10 173.62 3lsa s LEU 209 N 1.32 2.21 0.08 3.21 2.96 -0.10 -0.66 118.68 127.69 3lsa s LEU 209 Ca 0.05 -0.43 0.09 0.00 -0.22 0.00 0.00 54.13 53.61 3lsa s LEU 209 Cb -0.15 -1.40 -0.03 0.00 0.50 0.00 0.00 46.19 45.11 3lsa s LEU 209 CO 0.02 0.29 -0.23 -1.00 -1.32 0.00 0.00 176.35 174.11 3lsa s HIS 210 N -0.40 1.98 -0.00 5.38 3.76 -0.09 -0.77 115.29 125.16 3lsa s HIS 210 Ca 0.04 -0.39 -0.00 0.00 -0.15 0.00 0.00 55.06 54.55 3lsa s HIS 210 Cb -0.12 -1.13 0.00 0.00 1.11 0.00 0.00 32.58 32.44 3lsa s HIS 210 CO 0.02 0.18 0.01 -2.00 -0.85 0.00 0.00 174.74 172.09 3lsa s GLU 211 N -1.56 0.01 -0.03 1.40 2.12 -0.45 -1.14 118.70 119.05 3lsa s GLU 211 Ca 0.09 0.02 0.01 0.00 0.36 0.00 0.00 54.97 55.45 3lsa s GLU 211 Cb -0.10 0.00 0.02 0.00 0.26 0.00 0.00 34.13 34.32 3lsa s GLU 211 CO 0.03 -0.00 -0.04 -3.38 -0.54 0.00 0.00 175.26 171.33 3lsa s HIS 212 N 0.01 0.57 -0.00 5.30 -3.43 -0.21 -1.39 115.29 116.14 3lsa s HIS 212 Ca -0.00 -0.12 0.01 0.00 -0.80 0.00 0.00 55.06 54.14 3lsa s HIS 212 Cb -0.00 -0.51 -0.00 0.00 -1.43 0.00 0.00 32.58 30.64 3lsa s HIS 212 CO -0.00 -0.13 -0.03 0.00 -2.00 0.00 0.00 174.74 172.59 3lsa s ALA 213 N 0.66 0.23 -0.02 -1.38 0.00 0.13 -1.00 121.76 120.37 3lsa s ALA 213 Ca -0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.76 3lsa s ALA 213 Cb -0.11 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 22.97 3lsa s ALA 213 CO -0.00 0.05 0.05 -1.21 0.00 0.00 0.00 175.76 174.65 3lsa s GLU 214 N -0.06 0.01 0.24 0.00 2.02 -0.64 -1.48 118.70 118.80 3lsa s GLU 214 Ca 0.01 0.15 -0.22 0.00 0.02 0.00 0.00 54.97 54.93 3lsa s GLU 214 Cb -0.01 -0.12 -0.09 0.00 0.10 0.00 0.00 34.13 34.01 3lsa s GLU 214 CO -0.00 -0.09 0.78 0.00 0.02 0.00 0.00 175.26 175.97 3lsa s ALA 215 N 0.61 3.37 0.03 5.21 0.00 0.05 -1.20 121.76 129.83 3lsa s ALA 215 Ca -0.05 0.27 -0.07 0.00 0.00 0.00 0.00 51.96 52.11 3lsa s ALA 215 Cb -0.07 -2.92 -0.00 0.00 0.00 0.00 0.00 23.12 20.13 3lsa s ALA 215 CO -0.02 0.29 0.13 -3.38 0.00 0.00 0.00 175.76 172.78 3lsa s HIS 216 N -1.52 0.13 0.14 0.00 -3.43 0.31 -4.52 115.29 106.41 3lsa s HIS 216 Ca 0.44 -0.38 -0.02 0.00 -0.80 0.00 0.00 55.06 54.30 3lsa s HIS 216 Cb -0.18 -0.09 -0.04 0.00 -1.43 0.00 0.00 32.58 30.84 3lsa s HIS 216 CO 0.22 -0.37 0.09 -1.54 -2.00 0.00 0.00 174.74 171.14 3lsa s SER 217 N -2.01 0.26 0.00 7.38 1.04 -1.26 -1.18 113.70 117.93 3lsa s SER 217 Ca -0.06 -1.20 0.00 0.00 0.48 0.00 0.00 55.95 55.17 3lsa s SER 217 Cb -0.02 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.42 3lsa s SER 217 CO -0.03 -0.76 0.40 1.21 0.98 0.00 0.00 173.24 175.04