#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lc3 s ILE 3 N 0.00 4.80 -0.07 3.17 1.01 -1.26 -5.07 121.20 123.79 1lc3 s ILE 3 Ca 0.00 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.35 1lc3 s ILE 3 Cb 0.00 -3.43 0.02 0.00 0.01 0.00 0.00 42.46 39.06 1lc3 s ILE 3 CO 0.00 0.08 -0.08 -0.89 0.00 0.00 0.00 174.94 174.05 1lc3 s THR 4 N 1.65 0.89 -0.31 2.92 2.01 -1.26 -5.11 115.64 116.44 1lc3 s THR 4 Ca 0.05 -0.29 -0.19 0.00 0.31 0.00 0.00 61.69 61.57 1lc3 s THR 4 Cb -0.17 -0.88 -0.01 0.00 0.01 0.00 0.00 72.50 71.45 1lc3 s THR 4 CO 0.07 0.32 0.57 0.20 -0.69 0.00 0.00 174.62 175.09 1lc3 s ASN 5 N 1.08 6.43 0.45 3.53 0.01 -1.26 -5.04 114.94 120.15 1lc3 s ASN 5 Ca -0.07 0.33 -0.24 0.00 -0.71 0.00 0.00 52.86 52.16 1lc3 s ASN 5 Cb -0.14 -2.30 -0.08 0.00 0.41 0.00 0.00 41.25 39.14 1lc3 s ASN 5 CO -0.01 -0.44 1.29 -0.55 -1.51 0.00 0.00 177.10 175.88 1lc3 s SER 6 N 1.66 6.05 0.00 -1.22 0.15 -1.26 -4.91 113.70 114.17 1lc3 s SER 6 Ca 0.22 2.61 0.25 0.00 0.70 0.00 0.00 55.95 59.74 1lc3 s SER 6 Cb -0.15 -2.63 0.54 0.00 -1.71 0.00 0.00 66.02 62.06 1lc3 s SER 6 CO 0.12 -1.02 1.44 0.61 1.20 0.00 0.00 173.24 175.59 1lc3 n GLY 7 N 0.62 0.27 3.84 9.45 0.00 -1.26 -4.94 105.19 113.18 1lc3 n GLY 7 Ca 0.06 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 1lc3 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lc3 s LYS 8 N -2.15 3.96 -0.14 1.61 1.02 -1.26 -5.03 119.74 117.75 1lc3 s LYS 8 Ca 0.29 0.89 -0.23 0.00 0.02 0.00 0.00 55.97 56.95 1lc3 s LYS 8 Cb 0.20 -2.19 -0.03 0.00 -0.52 0.00 0.00 37.83 35.29 1lc3 s LYS 8 CO 0.39 -0.19 0.72 -0.06 -0.92 0.00 0.00 175.35 175.28 1lc3 s PHE 9 N -2.51 3.46 0.01 3.18 0.40 0.07 -4.84 117.98 117.76 1lc3 s PHE 9 Ca 0.58 1.14 -0.30 0.00 -0.60 0.00 0.00 56.93 57.75 1lc3 s PHE 9 Cb -0.10 -2.87 -0.04 0.00 0.51 0.00 0.00 43.02 40.53 1lc3 s PHE 9 CO 0.28 -0.10 1.08 0.20 0.70 0.00 0.00 175.22 177.38 1lc3 s GLY 10 N 1.04 2.64 -0.03 4.36 0.00 -1.25 -0.92 107.32 113.17 1lc3 s GLY 10 Ca 0.35 0.65 0.06 0.00 0.00 0.00 0.00 44.72 45.77 1lc3 s GLY 10 CO 0.14 1.87 -0.20 0.14 0.00 0.00 0.00 173.10 175.04 1lc3 s VAL 11 N 1.17 2.59 -0.08 1.40 1.01 0.56 -0.29 120.40 126.76 1lc3 s VAL 11 Ca 0.55 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1lc3 s VAL 11 Cb -0.24 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.16 1lc3 s VAL 11 CO 0.27 0.56 -0.21 0.54 0.00 0.00 0.00 175.10 176.27 1lc3 s VAL 12 N -0.70 1.76 -0.22 2.92 0.11 -0.51 -0.72 120.40 123.04 1lc3 s VAL 12 Ca 0.11 -0.86 -0.13 0.00 -2.93 0.00 0.00 61.98 58.17 1lc3 s VAL 12 Cb -0.10 -1.53 -0.04 0.00 -1.53 0.00 0.00 36.38 33.18 1lc3 s VAL 12 CO 0.00 0.49 0.28 -0.69 -3.33 0.00 0.00 175.10 171.86 1lc3 s VAL 13 N 0.28 5.28 -0.34 2.04 1.01 -0.79 -0.89 120.40 126.98 1lc3 s VAL 13 Ca -0.13 0.45 -0.10 0.00 0.00 0.00 0.00 61.98 62.20 1lc3 s VAL 13 Cb -0.16 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.62 1lc3 s VAL 13 CO 0.06 0.30 0.16 -0.69 0.00 0.00 0.00 175.10 174.93 1lc3 s VAL 14 N 1.20 4.46 0.00 2.92 1.01 0.99 -0.44 120.40 130.54 1lc3 s VAL 14 Ca 0.13 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1lc3 s VAL 14 Cb -0.14 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.86 1lc3 s VAL 14 CO 0.06 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.70 1lc3 n GLY 15 N 4.96 0.32 2.68 4.51 0.00 0.01 -0.45 105.19 117.21 1lc3 n GLY 15 Ca -0.13 -1.11 -0.30 0.00 0.00 0.00 0.00 46.02 44.48 1lc3 n GLY 15 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1lc3 n VAL 16 N 2.39 3.32 -0.67 1.61 0.31 -1.26 -4.05 118.33 119.98 1lc3 n VAL 16 Ca 0.00 -5.50 0.00 0.00 -0.01 0.00 0.00 64.34 58.83 1lc3 n VAL 16 Cb 0.00 -1.82 0.00 0.00 -0.91 0.00 0.00 33.84 31.11 1lc3 n VAL 16 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1lc3 n GLY 17 N 0.47 1.90 0.20 2.92 0.00 -1.26 -4.69 105.19 104.73 1lc3 n GLY 17 Ca 0.31 -1.85 -0.15 0.00 0.00 0.00 0.00 46.02 44.34 1lc3 n GLY 17 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1lc3 h ARG 18 N 0.00 -0.43 -0.44 1.61 9.65 -1.94 -0.97 114.38 121.86 1lc3 h ARG 18 Ca 0.00 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.91 1lc3 h ARG 18 Cb 0.00 0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.66 1lc3 h ARG 18 CO 0.00 -0.23 0.28 0.00 2.80 0.00 0.00 179.97 182.81 1lc3 h ALA 19 N 0.12 0.56 -0.92 2.80 0.00 -1.93 -1.55 119.26 118.33 1lc3 h ALA 19 Ca -0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1lc3 h ALA 19 Cb 0.40 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1lc3 h ALA 19 CO 0.08 0.04 0.54 0.78 0.00 0.00 0.00 179.25 180.68 1lc3 h GLY 20 N 0.59 1.35 1.04 0.00 0.00 -1.68 0.20 103.07 104.57 1lc3 h GLY 20 Ca 0.16 -0.57 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 1lc3 h GLY 20 CO -0.03 0.55 0.12 1.76 0.00 0.00 0.00 176.54 178.94 1lc3 h SER 21 N 1.28 0.98 -0.56 0.19 0.02 -0.86 -0.60 113.55 114.00 1lc3 h SER 21 Ca 0.33 -0.25 -0.05 0.00 -0.84 0.00 0.00 61.79 60.97 1lc3 h SER 21 Cb -0.03 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 1lc3 h SER 21 CO -0.06 0.98 0.14 0.58 -1.14 0.00 0.00 176.83 177.33 1lc3 h VAL 22 N 0.94 1.25 -0.67 2.27 2.07 -0.73 -1.37 116.25 120.01 1lc3 h VAL 22 Ca 0.19 -0.88 -0.06 0.00 0.82 0.00 0.00 66.70 66.77 1lc3 h VAL 22 Cb 0.40 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 1lc3 h VAL 22 CO 0.01 0.32 0.17 0.03 0.02 0.00 0.00 177.57 178.12 1lc3 h ARG 23 N 0.79 1.07 -0.55 1.57 2.47 -0.62 -0.54 114.38 118.57 1lc3 h ARG 23 Ca 0.17 -0.26 -0.01 0.00 -1.26 0.00 0.00 59.98 58.63 1lc3 h ARG 23 Cb 0.34 -0.14 -0.03 0.00 -1.65 0.00 0.00 29.97 28.49 1lc3 h ARG 23 CO 0.00 0.95 0.30 -0.07 0.56 0.00 0.00 179.97 181.72 1lc3 h LEU 24 N 1.00 0.69 -0.09 3.04 3.38 -0.93 -0.57 115.31 121.83 1lc3 h LEU 24 Ca 0.21 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1lc3 h LEU 24 Cb 0.36 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1lc3 h LEU 24 CO 0.00 0.58 0.03 -0.09 0.09 0.00 0.00 178.44 179.06 1lc3 h ARG 25 N 0.74 0.08 -0.08 1.13 2.43 -0.94 -2.85 114.38 114.89 1lc3 h ARG 25 Ca 0.19 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 1lc3 h ARG 25 Cb 0.05 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1lc3 h ARG 25 CO -0.03 0.05 -0.23 -0.44 -1.51 0.00 0.00 179.97 177.81 1lc3 h ASP 26 N 0.08 0.13 0.52 -3.80 3.32 -0.85 -2.39 116.42 113.43 1lc3 h ASP 26 Ca 0.04 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1lc3 h ASP 26 Cb 0.02 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1lc3 h ASP 26 CO -0.04 0.37 0.00 -0.07 -1.72 0.00 0.00 179.24 177.78 1lc3 h LEU 27 N 0.12 0.00 0.00 1.55 3.38 -0.86 -1.56 115.31 117.95 1lc3 h LEU 27 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1lc3 h LEU 27 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1lc3 h LEU 27 CO 0.03 0.00 -0.78 0.29 0.09 0.00 0.00 178.44 178.07 1lc3 n LYS 28 N -2.35 0.24 -2.05 1.13 5.02 -0.90 -4.67 118.16 114.57 1lc3 n LYS 28 Ca 0.01 0.03 -0.37 0.00 -2.02 0.00 0.00 58.31 55.96 1lc3 n LYS 28 Cb 0.18 -1.61 0.02 0.00 -0.02 0.00 0.00 35.03 33.59 1lc3 n LYS 28 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1lc3 s ASP 29 N -3.88 5.63 0.54 4.39 -1.08 -0.59 -4.91 116.67 116.78 1lc3 s ASP 29 Ca 0.06 2.47 0.24 0.00 -0.52 0.00 0.00 52.55 54.80 1lc3 s ASP 29 Cb 0.14 -2.61 1.42 0.00 -1.46 0.00 0.00 42.92 40.42 1lc3 s ASP 29 CO 0.75 -1.30 2.04 -0.65 0.52 0.00 0.00 175.17 176.54 1lc3 h PRO 30 N 1.56 0.00 0.00 4.34 0.11 -1.92 0.27 132.00 136.36 1lc3 h PRO 30 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1lc3 h PRO 30 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1lc3 h PRO 30 CO 0.58 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.91 1lc3 n ARG 31 N -4.27 0.01 -0.00 1.05 1.74 -1.26 -1.99 116.66 111.93 1lc3 n ARG 31 Ca 0.06 0.31 0.08 0.00 -0.77 0.00 0.00 57.85 57.53 1lc3 n ARG 31 Cb 0.46 -1.52 -0.11 0.00 -1.02 0.00 0.00 32.46 30.27 1lc3 n ARG 31 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1lc3 n SER 32 N -1.55 0.93 -0.33 0.55 7.64 0.08 -4.71 113.62 116.23 1lc3 n SER 32 Ca 0.03 -0.52 -0.03 0.00 1.01 0.00 0.00 58.87 59.36 1lc3 n SER 32 Cb 0.14 1.32 0.09 0.00 -1.01 0.00 0.00 64.21 64.75 1lc3 n SER 32 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1lc3 h ALA 33 N 1.99 1.12 -0.03 -0.43 0.00 -1.32 -1.74 119.26 118.85 1lc3 h ALA 33 Ca 0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1lc3 h ALA 33 Cb 0.54 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1lc3 h ALA 33 CO 0.00 0.53 -0.50 0.00 0.00 0.00 0.00 179.25 179.27 1lc3 h ALA 34 N 1.32 1.11 0.00 0.00 0.00 -1.84 -3.37 119.26 116.48 1lc3 h ALA 34 Ca 0.32 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1lc3 h ALA 34 Cb -0.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1lc3 h ALA 34 CO -0.07 0.64 -0.38 1.19 0.00 0.00 0.00 179.25 180.63 1lc3 n PHE 35 N -3.94 0.00 -4.80 0.00 3.01 -1.22 -4.76 117.46 105.75 1lc3 n PHE 35 Ca -0.02 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.18 1lc3 n PHE 35 Cb 0.53 -0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.85 1lc3 n PHE 35 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1lc3 s LEU 36 N -2.38 2.12 -0.19 4.37 1.43 -0.66 -0.75 118.68 122.62 1lc3 s LEU 36 Ca 0.00 -0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 52.63 1lc3 s LEU 36 Cb 0.00 -1.03 0.05 0.00 0.03 0.00 0.00 46.19 45.24 1lc3 s LEU 36 CO 0.02 0.20 -0.06 0.21 0.23 0.00 0.00 176.35 176.96 1lc3 s ASN 37 N -0.92 3.15 -0.28 2.29 2.47 -0.10 -4.54 114.94 117.02 1lc3 s ASN 37 Ca 0.08 -0.82 -0.29 0.00 0.42 0.00 0.00 52.86 52.25 1lc3 s ASN 37 Cb -0.09 -1.00 -0.01 0.00 -1.45 0.00 0.00 41.25 38.70 1lc3 s ASN 37 CO 0.01 -0.20 1.46 -0.22 -3.72 0.00 0.00 177.10 174.43 1lc3 s LEU 38 N 1.56 3.85 -0.08 3.21 2.96 -1.26 -0.32 118.68 128.59 1lc3 s LEU 38 Ca -0.01 1.34 -0.06 0.00 -0.22 0.00 0.00 54.13 55.18 1lc3 s LEU 38 Cb -0.16 -3.54 -0.27 0.00 0.50 0.00 0.00 46.19 42.72 1lc3 s LEU 38 CO -0.07 -1.21 0.53 0.40 -1.32 0.00 0.00 176.35 174.68 1lc3 h ILE 39 N 6.11 0.78 0.00 6.68 1.08 -1.28 -3.47 117.51 127.41 1lc3 h ILE 39 Ca -0.30 -2.47 0.00 0.00 -0.39 0.00 0.00 64.86 61.71 1lc3 h ILE 39 Cb 1.12 2.60 0.00 0.00 -3.07 0.00 0.00 36.82 37.47 1lc3 h ILE 39 CO 1.02 0.85 0.00 0.61 -0.69 0.00 0.00 178.15 179.94 1lc3 n GLY 40 N 1.89 -1.06 3.09 5.37 0.00 -1.22 -4.57 105.19 108.69 1lc3 n GLY 40 Ca -0.27 -0.99 -0.11 0.00 0.00 0.00 0.00 46.02 44.65 1lc3 n GLY 40 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1lc3 s PHE 41 N -3.00 0.67 -0.10 1.61 -0.12 -0.78 -1.89 117.98 114.37 1lc3 s PHE 41 Ca 0.00 -0.74 0.00 0.00 -0.05 0.00 0.00 56.93 56.14 1lc3 s PHE 41 Cb 0.00 -0.41 -0.02 0.00 -0.63 0.00 0.00 43.02 41.95 1lc3 s PHE 41 CO 0.00 -0.17 -0.10 0.08 -0.05 0.00 0.00 175.22 174.98 1lc3 s VAL 42 N -2.59 3.41 -0.00 -2.49 1.01 0.41 -0.59 120.40 119.56 1lc3 s VAL 42 Ca -0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 61.32 1lc3 s VAL 42 Cb -0.02 -2.41 0.01 0.00 0.00 0.00 0.00 36.38 33.96 1lc3 s VAL 42 CO -0.03 0.56 0.17 -0.55 0.00 0.00 0.00 175.10 175.25 1lc3 s SER 43 N -0.27 -0.02 0.00 3.32 0.15 -1.26 -0.81 113.70 114.81 1lc3 s SER 43 Ca 0.03 -0.14 0.28 0.00 0.70 0.00 0.00 55.95 56.82 1lc3 s SER 43 Cb -0.13 0.23 1.08 0.00 -1.71 0.00 0.00 66.02 65.49 1lc3 s SER 43 CO 0.03 -0.39 1.82 0.54 1.20 0.00 0.00 173.24 176.44 1lc3 n ARG 44 N 1.42 0.03 -3.84 5.44 1.74 -1.26 -4.80 116.66 115.39 1lc3 n ARG 44 Ca -0.22 -0.01 -0.24 0.00 -0.77 0.00 0.00 57.85 56.61 1lc3 n ARG 44 Cb 0.56 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.47 1lc3 n ARG 44 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1lc3 s ARG 45 N -2.97 3.46 -1.21 5.56 0.52 -1.26 -5.03 118.95 118.01 1lc3 s ARG 45 Ca 0.14 -0.60 -0.13 0.00 -0.52 0.00 0.00 55.73 54.63 1lc3 s ARG 45 Cb 0.19 -2.87 0.18 0.00 0.52 0.00 0.00 34.95 32.97 1lc3 s ARG 45 CO 0.56 0.41 1.44 0.39 0.02 0.00 0.00 175.30 178.13 1lc3 n GLU 46 N -1.13 3.41 0.00 3.54 1.02 -1.26 -4.74 120.64 121.48 1lc3 n GLU 46 Ca -0.07 -3.88 -0.14 0.00 -0.02 0.00 0.00 57.16 53.04 1lc3 n GLU 46 Cb 0.56 -2.99 -0.14 0.00 -0.02 0.00 0.00 31.44 28.85 1lc3 n GLU 46 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1lc3 h LEU 47 N 9.29 0.20 0.00 -4.62 3.38 -1.96 -3.48 115.31 118.12 1lc3 h LEU 47 Ca 0.31 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1lc3 h LEU 47 Cb 0.85 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1lc3 h LEU 47 CO 1.26 1.37 0.00 0.61 0.09 0.00 0.00 178.44 181.77 1lc3 n GLY 48 N 1.72 1.61 3.57 0.83 0.00 -1.26 -4.80 105.19 106.86 1lc3 n GLY 48 Ca -0.22 -0.07 -0.06 0.00 0.00 0.00 0.00 46.02 45.68 1lc3 n GLY 48 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lc3 s SER 49 N 0.00 -0.26 -0.26 1.61 1.04 -1.26 -1.32 113.70 113.25 1lc3 s SER 49 Ca 0.00 -0.06 -0.03 0.00 0.48 0.00 0.00 55.95 56.34 1lc3 s SER 49 Cb 0.00 0.32 0.09 0.00 0.10 0.00 0.00 66.02 66.53 1lc3 s SER 49 CO 0.00 -0.53 0.09 -0.76 0.98 0.00 0.00 173.24 173.01 1lc3 s LEU 50 N -2.50 1.33 0.00 2.42 1.43 0.25 -4.95 118.68 116.67 1lc3 s LEU 50 Ca 0.08 -1.24 0.00 0.00 -1.03 0.00 0.00 54.13 51.94 1lc3 s LEU 50 Cb -0.01 -0.60 0.00 0.00 0.03 0.00 0.00 46.19 45.61 1lc3 s LEU 50 CO -0.06 -0.39 0.00 0.47 0.23 0.00 0.00 176.35 176.60 1lc3 n ASP 51 N 5.05 0.00 -0.29 2.29 9.92 -1.26 -1.45 116.55 130.81 1lc3 n ASP 51 Ca -0.05 0.00 0.14 0.00 -0.53 0.00 0.00 54.79 54.35 1lc3 n ASP 51 Cb 0.44 0.00 0.67 0.00 -0.64 0.00 0.00 41.12 41.59 1lc3 n ASP 51 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 1lc3 n GLU 52 N 13.64 1.39 -3.20 -1.24 0.00 -1.26 -4.82 120.64 125.16 1lc3 n GLU 52 Ca 0.00 -0.57 -0.40 0.00 0.00 0.00 0.00 57.16 56.19 1lc3 n GLU 52 Cb 0.00 -1.47 -0.07 0.00 0.00 0.00 0.00 31.44 29.90 1lc3 n GLU 52 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1lc3 s VAL 53 N -1.98 5.05 0.34 3.84 1.01 -0.53 -5.06 120.40 123.08 1lc3 s VAL 53 Ca 0.41 0.98 -0.15 0.00 0.00 0.00 0.00 61.98 63.22 1lc3 s VAL 53 Cb 0.21 -3.87 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 1lc3 s VAL 53 CO 0.33 0.10 0.75 0.00 0.00 0.00 0.00 175.10 176.29 1lc3 s ARG 54 N 2.15 3.98 0.14 2.72 1.70 -1.26 -0.58 118.95 127.79 1lc3 s ARG 54 Ca 0.24 0.66 -0.23 0.00 -0.47 0.00 0.00 55.73 55.94 1lc3 s ARG 54 Cb -0.16 -2.41 -0.08 0.00 -0.57 0.00 0.00 34.95 31.74 1lc3 s ARG 54 CO 0.09 0.11 0.70 -1.14 -1.08 0.00 0.00 175.30 173.98 1lc3 s GLN 55 N -3.14 4.40 -0.02 3.89 0.74 -0.43 -1.87 119.66 123.23 1lc3 s GLN 55 Ca 0.54 0.97 0.05 0.00 0.05 0.00 0.00 55.36 56.98 1lc3 s GLN 55 Cb -0.10 -3.21 -0.01 0.00 1.10 0.00 0.00 33.01 30.79 1lc3 s GLN 55 CO 0.19 0.58 -0.18 0.42 -0.55 0.00 0.00 175.29 175.75 1lc3 s ILE 56 N -1.18 1.43 0.70 -2.34 1.01 0.25 -4.88 121.20 116.20 1lc3 s ILE 56 Ca 0.34 -0.77 -0.14 0.00 0.00 0.00 0.00 60.65 60.08 1lc3 s ILE 56 Cb -0.21 -1.20 0.02 0.00 0.01 0.00 0.00 42.46 41.08 1lc3 s ILE 56 CO 0.23 0.41 1.12 -0.94 0.00 0.00 0.00 174.94 175.76 1lc3 s SER 57 N -0.36 4.78 0.19 3.58 1.04 -1.26 -4.24 113.70 117.42 1lc3 s SER 57 Ca 0.06 2.01 -0.12 0.00 0.48 0.00 0.00 55.95 58.38 1lc3 s SER 57 Cb -0.08 -2.55 0.13 0.00 0.10 0.00 0.00 66.02 63.62 1lc3 s SER 57 CO -0.00 -1.85 1.83 0.25 0.98 0.00 0.00 173.24 174.44 1lc3 h LEU 58 N -0.33 0.59 -0.30 2.42 5.85 -1.95 -0.16 115.31 121.44 1lc3 h LEU 58 Ca -0.46 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.30 1lc3 h LEU 58 Cb 1.25 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 1lc3 h LEU 58 CO 0.52 0.41 0.07 -0.08 -0.34 0.00 0.00 178.44 179.02 1lc3 h GLU 59 N 0.71 0.17 -0.45 1.25 4.81 -2.00 -1.41 114.58 117.67 1lc3 h GLU 59 Ca 0.23 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.37 1lc3 h GLU 59 Cb 0.01 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1lc3 h GLU 59 CO -0.09 0.11 -0.06 -0.44 -0.73 0.00 0.00 179.01 177.80 1lc3 h ASP 60 N 0.18 0.75 -0.66 1.04 3.45 -1.83 -2.62 116.42 116.72 1lc3 h ASP 60 Ca 0.14 -0.21 -0.05 0.00 0.43 0.00 0.00 57.03 57.34 1lc3 h ASP 60 Cb 0.14 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 38.68 1lc3 h ASP 60 CO -0.17 0.86 0.24 0.00 -1.57 0.00 0.00 179.24 178.59 1lc3 h ALA 61 N 1.22 0.87 -0.10 3.45 0.00 -0.53 0.17 119.26 124.34 1lc3 h ALA 61 Ca 0.13 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1lc3 h ALA 61 Cb 0.53 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1lc3 h ALA 61 CO 0.03 0.51 -0.35 -0.07 0.00 0.00 0.00 179.25 179.37 1lc3 h LEU 62 N 0.95 0.19 0.09 0.00 3.38 -1.13 -3.17 115.31 115.62 1lc3 h LEU 62 Ca 0.22 -0.07 -0.28 0.00 0.09 0.00 0.00 57.88 57.84 1lc3 h LEU 62 Cb 0.25 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1lc3 h LEU 62 CO -0.01 0.54 -1.39 0.03 0.09 0.00 0.00 178.44 177.69 1lc3 h ARG 63 N 0.17 0.19 -6.39 1.13 2.47 -1.10 -3.47 114.38 107.37 1lc3 h ARG 63 Ca 0.02 -0.33 -0.60 0.00 -1.26 0.00 0.00 59.98 57.82 1lc3 h ARG 63 Cb 0.70 0.12 0.04 0.00 -1.65 0.00 0.00 29.97 29.18 1lc3 h ARG 63 CO 0.05 1.06 0.94 0.45 0.56 0.00 0.00 179.97 183.04 1lc3 n SER 64 N -3.42 3.25 -0.00 7.04 2.88 0.56 -4.88 113.62 119.04 1lc3 n SER 64 Ca -0.12 1.03 0.14 0.00 -1.33 0.00 0.00 58.87 58.59 1lc3 n SER 64 Cb 1.02 -1.40 0.55 0.00 -0.75 0.00 0.00 64.21 63.63 1lc3 n SER 64 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1lc3 n GLN 65 N 4.97 0.04 0.03 -1.46 7.27 -1.26 -3.09 117.38 123.88 1lc3 n GLN 65 Ca 0.20 -0.01 0.13 0.00 0.07 0.00 0.00 57.00 57.38 1lc3 n GLN 65 Cb 0.29 -1.50 0.32 0.00 2.41 0.00 0.00 30.24 31.76 1lc3 n GLN 65 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 1lc3 n GLU 66 N -1.47 0.13 -3.48 3.69 0.28 -1.26 -4.72 120.64 113.80 1lc3 n GLU 66 Ca 0.07 0.06 -0.39 0.00 -0.16 0.00 0.00 57.16 56.74 1lc3 n GLU 66 Cb 0.33 -1.60 -0.10 0.00 1.43 0.00 0.00 31.44 31.50 1lc3 n GLU 66 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1lc3 s ILE 67 N -3.07 5.24 -0.15 3.84 1.01 -1.18 -3.76 121.20 123.13 1lc3 s ILE 67 Ca 0.10 0.28 0.11 0.00 0.00 0.00 0.00 60.65 61.13 1lc3 s ILE 67 Cb 0.16 -3.65 -0.15 0.00 0.01 0.00 0.00 42.46 38.83 1lc3 s ILE 67 CO 0.66 0.15 0.29 0.47 0.00 0.00 0.00 174.94 176.50 1lc3 n ASP 68 N 5.22 1.99 -3.94 3.58 9.92 0.60 -4.90 116.55 129.02 1lc3 n ASP 68 Ca -0.11 -0.21 -0.13 0.00 -0.53 0.00 0.00 54.79 53.81 1lc3 n ASP 68 Cb 0.51 1.35 -0.13 0.00 -0.64 0.00 0.00 41.12 42.20 1lc3 n ASP 68 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1lc3 s VAL 69 N -2.52 0.22 -0.06 2.53 1.01 -0.12 -0.93 120.40 120.52 1lc3 s VAL 69 Ca -0.02 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 61.70 1lc3 s VAL 69 Cb 0.07 -0.23 -0.00 0.00 0.00 0.00 0.00 36.38 36.22 1lc3 s VAL 69 CO 0.44 -0.06 -0.21 0.00 0.00 0.00 0.00 175.10 175.26 1lc3 s ALA 70 N -0.38 1.89 -0.33 5.51 0.00 -0.16 -1.43 121.76 126.86 1lc3 s ALA 70 Ca -0.02 -0.87 -0.10 0.00 0.00 0.00 0.00 51.96 50.97 1lc3 s ALA 70 Cb -0.03 -0.64 0.01 0.00 0.00 0.00 0.00 23.12 22.45 1lc3 s ALA 70 CO -0.00 0.32 0.17 0.71 0.00 0.00 0.00 175.76 176.95 1lc3 s TYR 71 N 0.09 3.20 -0.49 0.00 1.51 -0.07 -1.26 117.35 120.32 1lc3 s TYR 71 Ca -0.08 -0.73 -0.19 0.00 -1.01 0.00 0.00 57.07 55.06 1lc3 s TYR 71 Cb -0.14 -2.38 0.05 0.00 -0.11 0.00 0.00 41.96 39.38 1lc3 s TYR 71 CO 0.04 -0.53 0.60 0.42 -1.11 0.00 0.00 175.55 174.98 1lc3 s ILE 72 N 1.59 4.91 -0.16 2.71 -1.09 0.12 -0.00 121.20 129.27 1lc3 s ILE 72 Ca 0.04 -0.47 0.11 0.00 -2.23 0.00 0.00 60.65 58.09 1lc3 s ILE 72 Cb -0.18 -4.26 0.21 0.00 -1.58 0.00 0.00 42.46 36.65 1lc3 s ILE 72 CO 0.06 -0.75 1.13 0.00 -1.23 0.00 0.00 174.94 174.16 1lc3 s SER 74 N -1.87 1.95 0.68 0.00 1.04 -1.09 -4.44 113.70 109.97 1lc3 s SER 74 Ca 0.20 0.37 -0.16 0.00 0.48 0.00 0.00 55.95 56.84 1lc3 s SER 74 Cb 0.16 -0.45 0.01 0.00 0.10 0.00 0.00 66.02 65.84 1lc3 s SER 74 CO 0.04 -3.46 1.19 -1.83 0.98 0.00 0.00 173.24 170.16 1lc3 s GLU 75 N -5.72 2.49 0.28 4.02 1.03 -1.26 -4.85 118.70 114.68 1lc3 s GLU 75 Ca 0.74 1.72 -0.01 0.00 0.03 0.00 0.00 54.97 57.45 1lc3 s GLU 75 Cb -0.05 -1.88 0.62 0.00 -0.80 0.00 0.00 34.13 32.02 1lc3 s GLU 75 CO 0.54 -1.56 1.64 0.77 -1.33 0.00 0.00 175.26 175.32 1lc3 h SER 76 N 0.10 -0.13 0.02 0.83 0.02 -1.75 -1.39 113.55 111.25 1lc3 h SER 76 Ca -0.48 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1lc3 h SER 76 Cb 1.29 0.30 0.00 0.00 0.14 0.00 0.00 62.40 64.13 1lc3 h SER 76 CO 0.52 -0.17 0.00 0.77 -1.14 0.00 0.00 176.83 176.81 1lc3 h SER 77 N 0.17 0.00 -0.02 3.07 4.64 -1.42 -2.08 113.55 117.91 1lc3 h SER 77 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1lc3 h SER 77 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1lc3 h SER 77 CO -0.67 0.00 -0.18 -1.54 -0.87 0.00 0.00 176.83 173.57 1lc3 n SER 78 N -2.78 2.31 0.07 4.97 3.41 -0.53 -4.61 113.62 116.45 1lc3 n SER 78 Ca -0.02 -1.65 -0.12 0.00 -0.26 0.00 0.00 58.87 56.81 1lc3 n SER 78 Cb 0.06 0.22 -0.06 0.00 -0.26 0.00 0.00 64.21 64.17 1lc3 n SER 78 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1lc3 h HIS 79 N 3.16 -0.19 -0.26 7.33 3.86 -1.40 -2.68 115.15 124.96 1lc3 h HIS 79 Ca 0.00 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.28 1lc3 h HIS 79 Cb 0.76 0.08 -0.07 0.00 1.06 0.00 0.00 27.41 29.24 1lc3 h HIS 79 CO 0.00 -0.12 -0.23 1.49 0.86 0.00 0.00 177.93 179.93 1lc3 h GLU 80 N -0.15 -0.22 -0.36 2.45 4.81 -1.78 0.78 114.58 120.10 1lc3 h GLU 80 Ca 0.02 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1lc3 h GLU 80 Cb 0.17 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1lc3 h GLU 80 CO -0.05 -0.15 0.21 0.22 -0.73 0.00 0.00 179.01 178.52 1lc3 h ASP 81 N -0.23 0.35 -0.36 1.04 3.58 -1.86 -1.40 116.42 117.54 1lc3 h ASP 81 Ca 0.14 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.56 1lc3 h ASP 81 Cb 0.45 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 1lc3 h ASP 81 CO -0.39 0.25 0.09 1.88 -2.88 0.00 0.00 179.24 178.19 1lc3 h TYR 82 N 0.43 0.61 -0.30 0.28 0.99 -1.10 -1.83 116.97 116.05 1lc3 h TYR 82 Ca 0.14 -0.07 0.01 0.00 2.00 0.00 0.00 58.73 60.81 1lc3 h TYR 82 Cb -0.00 -0.17 -0.02 0.00 1.00 0.00 0.00 36.73 37.53 1lc3 h TYR 82 CO -0.07 0.61 0.17 0.82 -0.00 0.00 0.00 178.16 179.69 1lc3 h ILE 83 N 0.44 1.03 -0.30 -2.88 2.04 -0.71 -1.37 117.51 115.75 1lc3 h ILE 83 Ca 0.11 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.86 1lc3 h ILE 83 Cb 0.31 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1lc3 h ILE 83 CO 0.00 0.06 0.19 -0.09 0.00 0.00 0.00 178.15 178.32 1lc3 h ARG 84 N 0.36 0.38 -0.66 2.37 2.43 -1.14 -0.72 114.38 117.39 1lc3 h ARG 84 Ca 0.12 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1lc3 h ARG 84 Cb 0.01 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 1lc3 h ARG 84 CO -0.06 0.25 0.41 1.96 -1.51 0.00 0.00 179.97 181.02 1lc3 h GLN 85 N 0.39 0.89 -0.15 0.20 4.20 -1.08 -0.63 115.11 118.94 1lc3 h GLN 85 Ca 0.11 -0.07 -0.19 0.00 0.06 0.00 0.00 58.65 58.56 1lc3 h GLN 85 Cb -0.03 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.56 1lc3 h GLN 85 CO -0.04 0.63 -0.67 0.74 -0.67 0.00 0.00 178.83 178.82 1lc3 h PHE 86 N 0.90 0.76 -0.44 2.96 0.04 -1.05 -2.02 116.94 118.09 1lc3 h PHE 86 Ca 0.24 -0.31 -0.06 0.00 2.80 0.00 0.00 57.97 60.64 1lc3 h PHE 86 Cb -0.05 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 37.96 1lc3 h PHE 86 CO -0.02 1.08 0.03 -0.07 -0.60 0.00 0.00 178.31 178.73 1lc3 h LEU 87 N 0.42 0.74 -1.58 1.54 3.38 -1.00 -0.46 115.31 118.35 1lc3 h LEU 87 Ca -0.02 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1lc3 h LEU 87 Cb 1.25 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1lc3 h LEU 87 CO 0.13 0.85 0.19 1.56 0.09 0.00 0.00 178.44 181.26 1lc3 h GLN 88 N 0.61 0.47 -0.00 1.13 4.20 -1.06 -0.25 115.11 120.21 1lc3 h GLN 88 Ca 0.13 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1lc3 h GLN 88 Cb 0.45 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1lc3 h GLN 88 CO 0.02 0.35 -0.00 0.00 -0.67 0.00 0.00 178.83 178.53 1lc3 n ALA 89 N -2.48 2.65 -0.96 3.87 0.00 -0.77 -4.91 120.51 117.92 1lc3 n ALA 89 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1lc3 n ALA 89 Cb 0.09 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.03 1lc3 n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lc3 n GLY 90 N 1.06 0.66 3.78 0.00 0.00 -0.10 -4.99 105.19 105.59 1lc3 n GLY 90 Ca 0.22 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 1lc3 n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lc3 s LYS 91 N -2.01 2.98 0.60 1.61 3.01 -0.22 -4.99 119.74 120.72 1lc3 s LYS 91 Ca 0.00 -0.60 -0.16 0.00 -1.01 0.00 0.00 55.97 54.20 1lc3 s LYS 91 Cb 0.00 -2.79 -0.03 0.00 -1.01 0.00 0.00 37.83 34.00 1lc3 s LYS 91 CO 0.00 0.60 1.07 -1.01 0.51 0.00 0.00 175.35 176.52 1lc3 s HIS 92 N -1.31 2.92 -0.04 3.18 3.76 -0.11 -4.15 115.29 119.54 1lc3 s HIS 92 Ca 0.27 1.52 0.01 0.00 -0.15 0.00 0.00 55.06 56.71 1lc3 s HIS 92 Cb -0.12 -3.04 0.02 0.00 1.11 0.00 0.00 32.58 30.55 1lc3 s HIS 92 CO 0.19 -1.22 -0.05 0.08 -0.85 0.00 0.00 174.74 172.90 1lc3 s VAL 93 N -2.42 0.53 -0.15 -0.90 1.01 0.16 -0.99 120.40 117.63 1lc3 s VAL 93 Ca 0.64 -0.14 -0.00 0.00 0.00 0.00 0.00 61.98 62.48 1lc3 s VAL 93 Cb -0.17 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.67 1lc3 s VAL 93 CO 0.37 0.21 -0.14 -0.22 0.00 0.00 0.00 175.10 175.32 1lc3 s LEU 94 N 0.76 2.57 -0.01 3.92 0.20 -0.39 -0.67 118.68 125.06 1lc3 s LEU 94 Ca -0.10 -0.42 0.03 0.00 0.69 0.00 0.00 54.13 54.33 1lc3 s LEU 94 Cb -0.13 -1.59 -0.01 0.00 -0.43 0.00 0.00 46.19 44.04 1lc3 s LEU 94 CO 0.00 0.11 -0.10 0.54 -0.29 0.00 0.00 176.35 176.61 1lc3 s VAL 95 N 0.69 0.81 0.44 1.68 0.11 0.09 0.13 120.40 124.35 1lc3 s VAL 95 Ca -0.07 -0.46 -0.22 0.00 -2.93 0.00 0.00 61.98 58.30 1lc3 s VAL 95 Cb -0.16 -0.68 -0.08 0.00 -1.53 0.00 0.00 36.38 33.93 1lc3 s VAL 95 CO 0.02 0.21 1.06 -1.61 -3.33 0.00 0.00 175.10 171.45 1lc3 s GLU 96 N -0.29 3.95 0.54 1.54 0.41 -0.94 -0.84 118.70 123.08 1lc3 s GLU 96 Ca 0.04 1.49 -0.20 0.00 -0.41 0.00 0.00 54.97 55.89 1lc3 s GLU 96 Cb -0.04 -2.34 -0.05 0.00 -1.78 0.00 0.00 34.13 29.92 1lc3 s GLU 96 CO -0.00 -0.33 1.18 1.52 -0.49 0.00 0.00 175.26 177.14 1lc3 s TYR 97 N -1.77 2.59 0.13 1.61 -0.85 -1.19 -3.92 117.35 113.95 1lc3 s TYR 97 Ca 0.63 1.52 -0.23 0.00 -0.52 0.00 0.00 57.07 58.46 1lc3 s TYR 97 Cb -0.21 -3.41 -0.07 0.00 0.38 0.00 0.00 41.96 38.65 1lc3 s TYR 97 CO 0.26 -1.86 0.71 -1.25 -1.52 0.00 0.00 175.55 171.88 1lc3 s PRO 98 N -3.16 4.44 0.43 -3.49 0.04 -1.26 -4.97 135.00 127.04 1lc3 s PRO 98 Ca 0.72 1.01 0.11 0.00 0.04 0.00 0.00 61.00 62.88 1lc3 s PRO 98 Cb -0.28 -3.26 0.97 0.00 0.04 0.00 0.00 34.50 31.97 1lc3 s PRO 98 CO 0.32 0.57 2.04 0.00 0.04 0.00 0.00 177.00 179.97 1lc3 h MET 99 N 4.50 0.42 -3.75 4.56 -0.00 -1.89 -3.45 114.93 115.32 1lc3 h MET 99 Ca -0.48 -0.03 -0.14 0.00 -0.00 0.00 0.00 59.70 59.06 1lc3 h MET 99 Cb 1.21 -0.10 -0.07 0.00 -0.00 0.00 0.00 31.60 32.64 1lc3 h MET 99 CO 0.66 0.28 -0.10 0.95 -0.00 0.00 0.00 176.91 178.70 1lc3 s THR 100 N -5.40 0.00 -0.18 -0.10 -4.23 -1.26 -3.81 115.64 100.66 1lc3 s THR 100 Ca -0.08 -1.43 0.16 0.00 -1.18 0.00 0.00 61.69 59.16 1lc3 s THR 100 Cb 0.18 -2.47 0.42 0.00 1.34 0.00 0.00 72.50 71.98 1lc3 s THR 100 CO 0.73 0.00 1.30 0.18 -0.54 0.00 0.00 174.62 176.29 1lc3 n LEU 101 N -0.47 3.20 -3.69 4.79 4.77 -1.26 -4.95 117.00 119.39 1lc3 n LEU 101 Ca -0.02 -3.24 -0.12 0.00 -0.03 0.00 0.00 56.01 52.60 1lc3 n LEU 101 Cb 0.62 -0.51 -0.12 0.00 -2.33 0.00 0.00 43.42 41.07 1lc3 n LEU 101 CO 0.26 0.84 -0.08 -0.55 -1.33 0.00 0.00 177.39 176.53 1lc3 s SER 102 N -2.52 -0.08 0.08 -1.43 0.15 -1.26 -5.00 113.70 103.63 1lc3 s SER 102 Ca 0.38 0.66 -0.23 0.00 0.70 0.00 0.00 55.95 57.46 1lc3 s SER 102 Cb 0.33 0.68 -0.16 0.00 -1.71 0.00 0.00 66.02 65.16 1lc3 s SER 102 CO 0.04 -0.20 1.69 0.15 1.20 0.00 0.00 173.24 176.11 1lc3 h PHE 103 N 7.68 -0.01 -0.82 3.44 3.57 -1.92 -1.32 116.94 127.56 1lc3 h PHE 103 Ca -0.28 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.28 1lc3 h PHE 103 Cb 1.14 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.83 1lc3 h PHE 103 CO 0.34 0.04 0.50 0.00 -2.23 0.00 0.00 178.31 176.96 1lc3 h ALA 104 N 0.92 1.12 -0.75 2.41 0.00 -1.97 -1.04 119.26 119.95 1lc3 h ALA 104 Ca -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1lc3 h ALA 104 Cb 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1lc3 h ALA 104 CO 0.00 0.24 0.34 0.00 0.00 0.00 0.00 179.25 179.84 1lc3 h ALA 105 N 1.39 0.97 -0.66 0.00 0.00 -1.93 -1.85 119.26 117.18 1lc3 h ALA 105 Ca 0.36 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1lc3 h ALA 105 Cb 0.16 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1lc3 h ALA 105 CO -0.17 0.56 0.38 0.00 0.00 0.00 0.00 179.25 180.02 1lc3 h ALA 106 N 1.17 0.85 -0.54 0.00 0.00 -0.24 -1.37 119.26 119.13 1lc3 h ALA 106 Ca 0.26 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1lc3 h ALA 106 Cb 0.15 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1lc3 h ALA 106 CO -0.03 0.34 0.31 1.96 0.00 0.00 0.00 179.25 181.83 1lc3 h GLN 107 N 0.90 0.58 -0.66 0.00 4.20 -0.83 -1.57 115.11 117.73 1lc3 h GLN 107 Ca 0.23 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.92 1lc3 h GLN 107 Cb 0.01 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 1lc3 h GLN 107 CO -0.04 0.39 0.44 1.49 -0.67 0.00 0.00 178.83 180.43 1lc3 h GLU 108 N 0.60 0.86 -0.41 1.46 4.81 -0.82 -2.15 114.58 118.94 1lc3 h GLU 108 Ca 0.22 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.30 1lc3 h GLU 108 Cb 0.07 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 1lc3 h GLU 108 CO -0.12 0.57 -0.17 -0.07 -0.73 0.00 0.00 179.01 178.49 1lc3 h LEU 109 N 0.89 0.77 -0.64 1.64 3.38 -0.82 -0.50 115.31 120.03 1lc3 h LEU 109 Ca 0.24 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 1lc3 h LEU 109 Cb -0.10 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1lc3 h LEU 109 CO -0.06 0.93 -0.02 -0.50 0.09 0.00 0.00 178.44 178.89 1lc3 h TRP 110 N 0.68 1.15 -0.44 1.13 4.06 -1.08 -0.48 115.95 120.97 1lc3 h TRP 110 Ca 0.11 -0.20 -0.04 0.00 2.06 0.00 0.00 58.89 60.82 1lc3 h TRP 110 Cb 0.66 -0.30 -0.02 0.00 -1.00 0.00 0.00 29.16 28.50 1lc3 h TRP 110 CO 0.03 1.02 0.13 0.93 -3.56 0.00 0.00 178.44 176.99 1lc3 h GLU 111 N 0.95 0.68 -0.71 0.49 5.08 -1.14 -1.93 114.58 118.01 1lc3 h GLU 111 Ca 0.17 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1lc3 h GLU 111 Cb 0.58 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1lc3 h GLU 111 CO 0.03 0.67 0.37 1.25 -1.00 0.00 0.00 179.01 180.34 1lc3 h LEU 112 N 0.57 0.90 -0.75 1.33 5.85 -0.87 -0.72 115.31 121.63 1lc3 h LEU 112 Ca 0.14 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1lc3 h LEU 112 Cb 0.28 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1lc3 h LEU 112 CO -0.00 0.75 0.46 0.00 -0.34 0.00 0.00 178.44 179.31 1lc3 h ALA 113 N 1.19 0.95 -0.47 1.25 0.00 -0.85 -1.20 119.26 120.13 1lc3 h ALA 113 Ca 0.25 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1lc3 h ALA 113 Cb 0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1lc3 h ALA 113 CO -0.04 0.41 0.10 0.00 0.00 0.00 0.00 179.25 179.72 1lc3 h ALA 114 N 1.24 0.62 -0.49 0.00 0.00 -0.96 0.25 119.26 119.92 1lc3 h ALA 114 Ca 0.27 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 55.03 1lc3 h ALA 114 Cb -0.05 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1lc3 h ALA 114 CO -0.05 0.32 0.18 0.37 0.00 0.00 0.00 179.25 180.07 1lc3 h GLN 115 N 0.63 0.36 -0.01 0.00 4.15 -0.67 -1.75 115.11 117.82 1lc3 h GLN 115 Ca 0.14 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1lc3 h GLN 115 Cb 0.35 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.96 1lc3 h GLN 115 CO 0.00 0.24 -0.04 1.63 -1.93 0.00 0.00 178.83 178.73 1lc3 n LYS 116 N -4.99 1.12 -2.68 1.69 4.76 -0.50 -4.92 118.16 112.64 1lc3 n LYS 116 Ca 0.05 -0.40 -0.18 0.00 -2.87 0.00 0.00 58.31 54.91 1lc3 n LYS 116 Cb 0.18 -1.49 0.02 0.00 -1.84 0.00 0.00 35.03 31.90 1lc3 n LYS 116 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1lc3 n GLY 117 N 1.15 -0.34 3.73 0.72 0.00 -0.40 -5.00 105.19 105.06 1lc3 n GLY 117 Ca 0.19 -0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 1lc3 n GLY 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lc3 s ARG 118 N -5.27 2.65 -0.03 1.61 3.00 -0.06 -5.02 118.95 115.82 1lc3 s ARG 118 Ca 0.16 -1.02 -0.25 0.00 0.00 0.00 0.00 55.73 54.61 1lc3 s ARG 118 Cb -0.07 -2.48 -0.04 0.00 0.00 0.00 0.00 34.95 32.36 1lc3 s ARG 118 CO 0.20 0.46 0.79 0.08 0.00 0.00 0.00 175.30 176.82 1lc3 s VAL 119 N -1.81 4.95 -0.18 3.52 1.01 -1.26 -4.50 120.40 122.14 1lc3 s VAL 119 Ca 0.30 1.64 0.01 0.00 0.00 0.00 0.00 61.98 63.93 1lc3 s VAL 119 Cb -0.09 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.18 1lc3 s VAL 119 CO 0.21 0.24 -0.18 -0.22 0.00 0.00 0.00 175.10 175.16 1lc3 s LEU 120 N 0.73 2.07 -0.09 3.92 2.96 -1.26 -0.67 118.68 126.33 1lc3 s LEU 120 Ca 0.42 -0.64 0.01 0.00 -0.22 0.00 0.00 54.13 53.70 1lc3 s LEU 120 Cb -0.19 -1.40 0.02 0.00 0.50 0.00 0.00 46.19 45.12 1lc3 s LEU 120 CO 0.22 -0.03 -0.12 -2.28 -1.32 0.00 0.00 176.35 172.82 1lc3 s HIS 121 N 1.34 1.62 -0.29 5.38 5.65 0.15 -5.01 115.29 124.12 1lc3 s HIS 121 Ca 0.04 -0.72 -0.11 0.00 0.25 0.00 0.00 55.06 54.52 1lc3 s HIS 121 Cb -0.13 -1.23 -0.03 0.00 -1.18 0.00 0.00 32.58 30.01 1lc3 s HIS 121 CO -0.12 -0.42 0.17 -2.00 -0.65 0.00 0.00 174.74 171.73 1lc3 s GLU 122 N 1.11 3.69 0.22 2.88 2.12 -1.26 -0.73 118.70 126.73 1lc3 s GLU 122 Ca -0.06 -0.49 -0.30 0.00 0.36 0.00 0.00 54.97 54.48 1lc3 s GLU 122 Cb -0.14 -3.62 -0.09 0.00 0.26 0.00 0.00 34.13 30.53 1lc3 s GLU 122 CO -0.02 -0.28 1.33 -2.00 -0.54 0.00 0.00 175.26 173.75 1lc3 s GLU 123 N 1.70 4.37 -0.39 4.30 -6.30 -0.02 -4.91 118.70 117.45 1lc3 s GLU 123 Ca 0.06 2.11 0.08 0.00 -2.50 0.00 0.00 54.97 54.72 1lc3 s GLU 123 Cb -0.16 -3.17 0.24 0.00 0.00 0.00 0.00 34.13 31.04 1lc3 s GLU 123 CO 0.09 -0.26 0.51 0.72 0.02 0.00 0.00 175.26 176.33 1lc3 n HIS 124 N 2.35 -0.47 0.33 5.30 8.25 -1.26 -3.16 115.22 126.55 1lc3 n HIS 124 Ca 0.05 -3.51 0.22 0.00 -0.26 0.00 0.00 57.72 54.23 1lc3 n HIS 124 Cb 0.42 -0.26 1.18 0.00 1.12 0.00 0.00 29.99 32.45 1lc3 n HIS 124 CO 0.00 0.00 0.00 -0.39 0.64 0.00 0.00 176.34 176.59 1lc3 h VAL 125 N 2.25 0.04 0.00 1.59 -1.51 -1.93 -1.86 116.25 114.83 1lc3 h VAL 125 Ca 0.08 -0.03 -0.00 0.00 -1.23 0.00 0.00 66.70 65.52 1lc3 h VAL 125 Cb 0.89 1.03 -0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1lc3 h VAL 125 CO 0.45 0.00 -0.02 1.05 -1.23 0.00 0.00 177.57 177.82 1lc3 h GLU 126 N 0.00 0.00 -0.00 5.19 9.09 -1.94 0.67 114.58 127.59 1lc3 h GLU 126 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1lc3 h GLU 126 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.13 1lc3 h GLU 126 CO 0.00 0.02 -0.05 1.28 0.05 0.00 0.00 179.01 180.31 1lc3 n LEU 127 N -3.97 0.36 -0.53 3.06 4.77 -0.70 -3.17 117.00 116.82 1lc3 n LEU 127 Ca -0.03 0.01 0.06 0.00 -0.03 0.00 0.00 56.01 56.02 1lc3 n LEU 127 Cb 0.11 -0.14 0.06 0.00 -2.33 0.00 0.00 43.42 41.12 1lc3 n LEU 127 CO 0.29 0.06 0.47 0.18 -1.33 0.00 0.00 177.39 177.06 1lc3 n LEU 128 N -0.92 2.14 -4.77 2.23 4.77 0.21 -4.83 117.00 115.84 1lc3 n LEU 128 Ca 0.17 -1.08 -0.36 0.00 -0.03 0.00 0.00 56.01 54.72 1lc3 n LEU 128 Cb 0.23 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1lc3 n LEU 128 CO 0.21 0.41 0.82 -0.04 -1.33 0.00 0.00 177.39 177.47 1lc3 s MET 129 N -1.06 3.49 0.33 3.23 -1.94 -1.09 -4.93 119.30 117.34 1lc3 s MET 129 Ca 0.16 1.74 0.01 0.00 -1.71 0.00 0.00 55.69 55.89 1lc3 s MET 129 Cb 0.11 -2.20 0.57 0.00 2.01 0.00 0.00 34.83 35.32 1lc3 s MET 129 CO 0.16 -0.76 1.99 0.93 -0.01 0.00 0.00 175.02 177.32 1lc3 h GLU 130 N 1.57 0.93 -0.29 2.03 5.08 -1.94 -1.27 114.58 120.69 1lc3 h GLU 130 Ca -0.50 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 57.75 1lc3 h GLU 130 Cb 1.26 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 1lc3 h GLU 130 CO 0.58 0.61 -0.05 0.93 -1.00 0.00 0.00 179.01 180.08 1lc3 h GLU 131 N 0.95 0.46 -0.07 2.33 3.07 -1.92 -2.30 114.58 117.11 1lc3 h GLU 131 Ca 0.27 -0.11 -0.20 0.00 -0.50 0.00 0.00 59.36 58.83 1lc3 h GLU 131 Cb -0.07 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 27.78 1lc3 h GLU 131 CO -0.06 0.53 -0.78 0.35 -1.40 0.00 0.00 179.01 177.65 1lc3 h PHE 132 N 0.44 0.59 -0.93 4.33 3.04 -1.52 -2.42 116.94 120.47 1lc3 h PHE 132 Ca 0.09 -0.28 0.02 0.00 3.98 0.00 0.00 57.97 61.78 1lc3 h PHE 132 Cb 0.37 -0.09 -0.05 0.00 2.56 0.00 0.00 35.95 38.75 1lc3 h PHE 132 CO 0.01 1.05 0.62 0.93 -2.02 0.00 0.00 178.31 178.90 1lc3 h GLU 133 N 0.28 1.21 0.10 1.11 4.39 -0.95 0.19 114.58 120.91 1lc3 h GLU 133 Ca -0.04 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 1lc3 h GLU 133 Cb 1.37 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 1lc3 h GLU 133 CO 0.14 0.80 -0.05 0.35 -1.16 0.00 0.00 179.01 179.09 1lc3 h PHE 134 N 1.24 -0.12 -0.67 4.33 3.57 -1.29 -2.51 116.94 121.50 1lc3 h PHE 134 Ca 0.35 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.82 1lc3 h PHE 134 Cb -0.11 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 1lc3 h PHE 134 CO -0.00 -0.06 0.29 -0.07 -2.23 0.00 0.00 178.31 176.25 1lc3 h LEU 135 N -0.15 0.88 -0.68 0.59 3.38 -0.81 -1.06 115.31 117.46 1lc3 h LEU 135 Ca -0.01 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 57.88 1lc3 h LEU 135 Cb 0.12 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1lc3 h LEU 135 CO 0.02 0.77 0.43 -0.09 0.09 0.00 0.00 178.44 179.65 1lc3 h ARG 136 N 0.95 0.82 -0.25 1.13 2.43 -0.50 -1.22 114.38 117.74 1lc3 h ARG 136 Ca 0.23 -0.05 -0.15 0.00 -0.81 0.00 0.00 59.98 59.20 1lc3 h ARG 136 Cb 0.14 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1lc3 h ARG 136 CO -0.03 0.54 -0.44 -0.09 -1.51 0.00 0.00 179.97 178.44 1lc3 h ARG 137 N 0.84 0.64 -0.19 0.20 9.65 -1.00 -3.11 114.38 121.40 1lc3 h ARG 137 Ca 0.27 -0.35 -0.02 0.00 -1.10 0.00 0.00 59.98 58.78 1lc3 h ARG 137 Cb 0.00 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.59 1lc3 h ARG 137 CO -0.10 0.95 0.04 1.49 2.80 0.00 0.00 179.97 185.15 1lc3 h GLU 138 N 0.51 0.31 0.00 0.20 4.57 -0.63 -3.14 114.58 116.40 1lc3 h GLU 138 Ca 0.03 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1lc3 h GLU 138 Cb 0.97 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.52 1lc3 h GLU 138 CO 0.09 0.46 0.00 1.33 -1.18 0.00 0.00 179.01 179.71 1lc3 n VAL 139 N -4.77 0.49 -1.67 0.32 0.24 -0.51 -4.77 118.33 107.65 1lc3 n VAL 139 Ca -0.04 -0.01 -0.45 0.00 -2.04 0.00 0.00 64.34 61.79 1lc3 n VAL 139 Cb 0.18 -0.72 -0.04 0.00 -1.47 0.00 0.00 33.84 31.79 1lc3 n VAL 139 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1lc3 n LEU 140 N -1.85 3.80 -0.52 1.34 7.94 -1.18 -1.69 117.00 124.85 1lc3 n LEU 140 Ca 0.05 0.94 -0.07 0.00 -1.11 0.00 0.00 56.01 55.82 1lc3 n LEU 140 Cb 0.32 -1.45 -0.03 0.00 0.53 0.00 0.00 43.42 42.80 1lc3 n LEU 140 CO 0.25 0.07 -0.06 0.61 -1.11 0.00 0.00 177.39 177.14 1lc3 n GLY 141 N 4.48 0.90 3.43 -3.96 0.00 -1.26 -5.03 105.19 103.75 1lc3 n GLY 141 Ca 0.21 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 45.27 1lc3 n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lc3 s LYS 142 N -2.51 1.54 -0.26 1.61 1.02 -0.68 -5.08 119.74 115.38 1lc3 s LYS 142 Ca 0.00 -1.56 -0.07 0.00 0.02 0.00 0.00 55.97 54.36 1lc3 s LYS 142 Cb 0.00 -1.83 -0.01 0.00 -0.52 0.00 0.00 37.83 35.46 1lc3 s LYS 142 CO 0.00 0.39 0.06 -1.21 -0.92 0.00 0.00 175.35 173.67 1lc3 s GLU 143 N -2.80 3.40 -0.10 1.68 0.41 -1.26 -5.03 118.70 115.00 1lc3 s GLU 143 Ca 0.22 -0.64 -0.30 0.00 -0.41 0.00 0.00 54.97 53.84 1lc3 s GLU 143 Cb -0.07 -3.30 -0.02 0.00 -1.78 0.00 0.00 34.13 28.95 1lc3 s GLU 143 CO 0.11 -0.29 1.20 -1.17 -0.49 0.00 0.00 175.26 174.62 1lc3 s LEU 144 N 1.55 4.24 -0.17 1.80 2.96 -1.26 -1.62 118.68 126.17 1lc3 s LEU 144 Ca 0.05 1.74 -0.15 0.00 -0.22 0.00 0.00 54.13 55.55 1lc3 s LEU 144 Cb -0.16 -3.55 -0.11 0.00 0.50 0.00 0.00 46.19 42.88 1lc3 s LEU 144 CO 0.02 -0.64 0.02 -0.07 -1.32 0.00 0.00 176.35 174.36 1lc3 h LEU 145 N 8.75 0.00 -7.14 -0.68 3.38 -1.40 -3.37 115.31 114.85 1lc3 h LEU 145 Ca -0.31 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.37 1lc3 h LEU 145 Cb 1.14 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.73 1lc3 h LEU 145 CO 0.91 1.08 0.09 -1.59 0.09 0.00 0.00 178.44 179.03 1lc3 s LYS 146 N -2.27 1.10 0.19 1.13 -2.85 -1.11 -2.11 119.74 113.82 1lc3 s LYS 146 Ca -0.21 -0.28 -0.23 0.00 -1.00 0.00 0.00 55.97 54.25 1lc3 s LYS 146 Cb 0.04 0.51 0.05 0.00 -2.06 0.00 0.00 37.83 36.36 1lc3 s LYS 146 CO 0.39 -0.42 0.73 0.20 0.10 0.00 0.00 175.35 176.34 1lc3 s GLY 147 N -2.15 -0.34 -0.02 0.59 0.00 -0.12 -0.30 107.32 104.98 1lc3 s GLY 147 Ca -0.04 0.19 -0.02 0.00 0.00 0.00 0.00 44.72 44.85 1lc3 s GLY 147 CO -0.04 0.06 0.07 -0.45 0.00 0.00 0.00 173.10 172.74 1lc3 s SER 148 N -2.81 -0.06 -0.12 1.64 0.15 0.62 -0.92 113.70 112.20 1lc3 s SER 148 Ca 0.07 0.11 -0.01 0.00 0.70 0.00 0.00 55.95 56.82 1lc3 s SER 148 Cb -0.03 0.14 0.04 0.00 -1.71 0.00 0.00 66.02 64.45 1lc3 s SER 148 CO -0.03 -0.04 -0.01 -0.22 1.20 0.00 0.00 173.24 174.14 1lc3 s LEU 149 N -0.03 0.98 -0.04 3.45 2.96 0.08 -1.55 118.68 124.52 1lc3 s LEU 149 Ca -0.01 -0.36 0.05 0.00 -0.22 0.00 0.00 54.13 53.59 1lc3 s LEU 149 Cb -0.01 -0.62 -0.01 0.00 0.50 0.00 0.00 46.19 46.06 1lc3 s LEU 149 CO 0.00 -0.20 -0.18 -0.60 -1.32 0.00 0.00 176.35 174.05 1lc3 s ARG 150 N 1.85 1.85 -0.10 1.98 3.52 -0.45 -1.24 118.95 126.36 1lc3 s ARG 150 Ca 0.03 -0.65 0.01 0.00 -0.13 0.00 0.00 55.73 54.98 1lc3 s ARG 150 Cb -0.14 -1.62 0.02 0.00 -1.56 0.00 0.00 34.95 31.65 1lc3 s ARG 150 CO -0.07 0.28 -0.10 0.12 -0.81 0.00 0.00 175.30 174.72 1lc3 s PHE 151 N -0.04 1.57 0.07 5.12 5.36 -0.19 -0.35 117.98 129.51 1lc3 s PHE 151 Ca -0.03 -0.73 0.05 0.00 -0.96 0.00 0.00 56.93 55.26 1lc3 s PHE 151 Cb -0.11 -1.23 -0.04 0.00 -0.34 0.00 0.00 43.02 41.30 1lc3 s PHE 151 CO 0.02 -0.45 -0.07 0.95 -1.46 0.00 0.00 175.22 174.21 1lc3 s THR 152 N 1.32 3.60 0.11 0.12 -4.23 0.09 -1.07 115.64 115.57 1lc3 s THR 152 Ca -0.02 -1.04 -0.07 0.00 -1.18 0.00 0.00 61.69 59.38 1lc3 s THR 152 Cb -0.14 -2.65 0.03 0.00 1.34 0.00 0.00 72.50 71.08 1lc3 s THR 152 CO -0.04 0.21 0.34 0.00 -0.54 0.00 0.00 174.62 174.59 1lc3 n ALA 153 N 0.97 -0.84 -1.93 3.99 0.00 -0.56 -1.92 120.51 120.23 1lc3 n ALA 153 Ca -0.13 -0.42 -0.28 0.00 0.00 0.00 0.00 53.44 52.60 1lc3 n ALA 153 Cb 0.52 0.29 0.07 0.00 0.00 0.00 0.00 19.45 20.33 1lc3 n ALA 153 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1lc3 s SER 154 N -1.84 4.92 0.59 0.00 0.01 -1.25 -1.78 113.70 114.35 1lc3 s SER 154 Ca 0.07 0.77 -0.20 0.00 1.31 0.00 0.00 55.95 57.90 1lc3 s SER 154 Cb -0.01 -1.43 -0.03 0.00 0.21 0.00 0.00 66.02 64.76 1lc3 s SER 154 CO 0.03 -1.60 1.33 -2.65 0.41 0.00 0.00 173.24 170.76 1lc3 n PRO 155 N -3.06 1.45 -3.98 12.44 -0.02 -1.26 -4.46 135.00 136.11 1lc3 n PRO 155 Ca 0.07 0.54 -0.17 0.00 -2.02 0.00 0.00 63.50 61.92 1lc3 n PRO 155 Cb 0.60 -2.56 -0.16 0.00 -0.02 0.00 0.00 33.50 31.36 1lc3 n PRO 155 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1lc3 s LEU 156 N -3.81 1.25 -0.33 2.45 2.96 -1.26 -5.01 118.68 114.94 1lc3 s LEU 156 Ca 0.76 -0.05 -0.28 0.00 -0.22 0.00 0.00 54.13 54.35 1lc3 s LEU 156 Cb -0.40 -0.26 -0.03 0.00 0.50 0.00 0.00 46.19 46.00 1lc3 s LEU 156 CO 0.45 -0.08 1.96 -0.70 -1.32 0.00 0.00 176.35 176.66 1lc3 s GLU 157 N 0.92 3.15 0.34 1.98 2.12 -1.26 -4.86 118.70 121.10 1lc3 s GLU 157 Ca -0.10 1.54 0.02 0.00 0.36 0.00 0.00 54.97 56.80 1lc3 s GLU 157 Cb -0.13 -4.28 0.62 0.00 0.26 0.00 0.00 34.13 30.59 1lc3 s GLU 157 CO -0.01 -2.07 1.98 1.49 -0.54 0.00 0.00 175.26 176.11 1lc3 h GLU 158 N 14.05 0.87 -0.32 4.30 4.81 -1.95 -0.23 114.58 136.11 1lc3 h GLU 158 Ca -0.35 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 58.87 1lc3 h GLU 158 Cb 1.19 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 1lc3 h GLU 158 CO 1.03 0.58 0.21 1.49 -0.73 0.00 0.00 179.01 181.59 1lc3 h GLU 159 N 0.90 0.26 0.01 1.92 4.57 -1.89 0.37 114.58 120.72 1lc3 h GLU 159 Ca 0.28 -0.02 -0.41 0.00 -1.18 0.00 0.00 59.36 58.03 1lc3 h GLU 159 Cb -0.00 -0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 28.46 1lc3 h GLU 159 CO -0.07 0.17 -2.38 0.54 -1.18 0.00 0.00 179.01 176.09 1lc3 n ARG 160 N -4.49 0.63 0.00 1.92 1.74 -0.81 -4.62 116.66 111.03 1lc3 n ARG 160 Ca 0.03 0.23 0.11 0.00 -0.77 0.00 0.00 57.85 57.45 1lc3 n ARG 160 Cb 0.19 -1.54 -0.01 0.00 -1.02 0.00 0.00 32.46 30.08 1lc3 n ARG 160 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1lc3 n PHE 161 N -3.71 0.00 0.00 -1.55 3.01 -0.16 -1.18 117.46 113.87 1lc3 n PHE 161 Ca -0.47 0.00 0.00 0.00 1.01 0.00 0.00 57.45 57.99 1lc3 n PHE 161 Cb 0.94 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.39 1lc3 n PHE 161 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1lc3 n GLY 162 N 1.45 0.39 3.66 1.37 0.00 0.13 -4.01 105.19 108.18 1lc3 n GLY 162 Ca 0.07 -1.83 -0.39 0.00 0.00 0.00 0.00 46.02 43.87 1lc3 n GLY 162 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1lc3 n PHE 163 N 0.63 1.48 -0.36 1.61 7.35 -1.26 -4.43 117.46 122.49 1lc3 n PHE 163 Ca 0.00 0.47 0.30 0.00 -0.76 0.00 0.00 57.45 57.46 1lc3 n PHE 163 Cb 0.00 -2.25 0.61 0.00 0.35 0.00 0.00 39.48 38.19 1lc3 n PHE 163 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1lc3 h PRO 164 N 1.23 0.21 0.00 -7.13 0.11 -1.96 0.17 132.00 124.64 1lc3 h PRO 164 Ca -0.48 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 1lc3 h PRO 164 Cb 1.33 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1lc3 h PRO 164 CO 0.55 0.14 -0.36 0.00 -0.21 0.00 0.00 178.00 178.13 1lc3 h ALA 165 N 1.54 1.28 0.04 -0.75 0.00 -1.90 -0.66 119.26 118.81 1lc3 h ALA 165 Ca 0.64 -0.33 -0.21 0.00 0.00 0.00 0.00 54.91 55.01 1lc3 h ALA 165 Cb 1.97 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.68 1lc3 h ALA 165 CO -0.23 0.45 -1.13 0.74 0.00 0.00 0.00 179.25 179.07 1lc3 h PHE 166 N 0.00 0.14 -0.16 0.00 -1.00 -1.05 -2.99 116.94 111.88 1lc3 h PHE 166 Ca -0.00 -0.10 -0.03 0.00 2.81 0.00 0.00 57.97 60.64 1lc3 h PHE 166 Cb 0.69 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.23 1lc3 h PHE 166 CO 0.00 1.44 -0.05 0.66 -1.61 0.00 0.00 178.31 178.76 1lc3 h SER 167 N -0.76 0.21 -0.56 2.17 4.64 -1.17 -2.34 113.55 115.73 1lc3 h SER 167 Ca -0.28 -0.03 -0.23 0.00 -0.47 0.00 0.00 61.79 60.78 1lc3 h SER 167 Cb 1.41 -0.05 -0.13 0.00 -0.31 0.00 0.00 62.40 63.31 1lc3 h SER 167 CO -0.09 0.29 0.17 0.61 -0.87 0.00 0.00 176.83 176.94 1lc3 n GLY 168 N -1.10 4.37 0.14 -0.77 0.00 -0.26 -4.64 105.19 102.94 1lc3 n GLY 168 Ca -0.01 -1.11 0.10 0.00 0.00 0.00 0.00 46.02 45.00 1lc3 n GLY 168 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1lc3 n ILE 169 N -0.79 1.13 -0.02 -0.61 3.06 -0.88 -1.56 119.36 119.68 1lc3 n ILE 169 Ca 0.38 0.66 -0.02 0.00 -2.50 0.00 0.00 62.75 61.28 1lc3 n ILE 169 Cb 1.23 -1.65 0.24 0.00 0.54 0.00 0.00 39.64 39.99 1lc3 n ILE 169 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 1lc3 h SER 170 N 0.00 0.55 -0.36 9.51 4.64 -1.84 0.10 113.55 126.15 1lc3 h SER 170 Ca 0.00 -0.13 -0.13 0.00 -0.47 0.00 0.00 61.79 61.06 1lc3 h SER 170 Cb 0.04 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 1lc3 h SER 170 CO 0.00 0.67 -0.29 0.03 -0.87 0.00 0.00 176.83 176.37 1lc3 h ARG 171 N 0.54 0.83 -0.67 4.77 -0.00 -1.68 -2.18 114.38 115.99 1lc3 h ARG 171 Ca 0.11 -0.41 -0.06 0.00 -0.50 0.00 0.00 59.98 59.11 1lc3 h ARG 171 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.38 1lc3 h ARG 171 CO 0.02 1.05 0.18 1.25 0.00 0.00 0.00 179.97 182.47 1lc3 h LEU 172 N 0.62 0.99 -1.31 3.04 5.85 -1.55 -2.31 115.31 120.64 1lc3 h LEU 172 Ca 0.07 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1lc3 h LEU 172 Cb 0.86 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 1lc3 h LEU 172 CO 0.08 0.94 0.26 0.74 -0.34 0.00 0.00 178.44 180.12 1lc3 h THR 173 N 1.01 1.17 -0.07 1.05 2.02 -0.64 -0.40 112.91 117.04 1lc3 h THR 173 Ca 0.22 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.92 1lc3 h THR 173 Cb 0.33 0.49 -0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1lc3 h THR 173 CO -0.00 0.20 0.05 -0.50 0.37 0.00 0.00 175.52 175.63 1lc3 h TRP 174 N 0.73 0.10 -0.54 3.16 4.06 -0.85 -0.70 115.95 121.91 1lc3 h TRP 174 Ca 0.19 -0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.12 1lc3 h TRP 174 Cb 0.06 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.17 1lc3 h TRP 174 CO 0.01 0.10 0.26 -0.07 -3.56 0.00 0.00 178.44 175.18 1lc3 h LEU 175 N 0.07 0.71 -0.57 -4.49 3.38 -1.02 -1.22 115.31 112.18 1lc3 h LEU 175 Ca 0.03 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.73 1lc3 h LEU 175 Cb 0.03 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1lc3 h LEU 175 CO -0.01 0.64 -0.29 0.58 0.09 0.00 0.00 178.44 179.45 1lc3 h VAL 176 N 0.73 1.28 -0.59 1.22 2.07 -1.03 0.73 116.25 120.65 1lc3 h VAL 176 Ca 0.19 -1.45 -0.09 0.00 0.82 0.00 0.00 66.70 66.17 1lc3 h VAL 176 Cb 0.12 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1lc3 h VAL 176 CO -0.02 0.48 0.02 -1.28 0.02 0.00 0.00 177.57 176.79 1lc3 h SER 177 N 0.71 1.00 0.11 0.57 0.87 -0.97 0.12 113.55 115.96 1lc3 h SER 177 Ca 0.08 -0.30 -0.27 0.00 -1.23 0.00 0.00 61.79 60.07 1lc3 h SER 177 Cb 0.84 -0.27 0.03 0.00 -0.44 0.00 0.00 62.40 62.56 1lc3 h SER 177 CO 0.07 1.06 -1.13 -0.07 -0.53 0.00 0.00 176.83 176.23 1lc3 h LEU 178 N 0.92 0.80 -1.74 2.23 3.38 -1.12 -3.39 115.31 116.39 1lc3 h LEU 178 Ca 0.17 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.31 1lc3 h LEU 178 Cb 0.53 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1lc3 h LEU 178 CO 0.03 1.55 0.00 0.49 0.09 0.00 0.00 178.44 180.60 1lc3 n PHE 179 N -3.88 0.09 -1.37 1.13 3.01 0.24 -5.06 117.46 111.62 1lc3 n PHE 179 Ca -0.13 -0.13 0.00 0.00 1.01 0.00 0.00 57.45 58.19 1lc3 n PHE 179 Cb 0.93 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.40 1lc3 n PHE 179 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1lc3 n GLY 180 N 0.41 -2.46 3.77 1.37 0.00 0.40 -4.65 105.19 104.04 1lc3 n GLY 180 Ca 0.06 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.97 1lc3 n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lc3 s GLU 181 N -0.46 4.00 0.18 1.61 2.02 -1.26 -4.38 118.70 120.41 1lc3 s GLU 181 Ca 0.00 2.49 0.10 0.00 0.02 0.00 0.00 54.97 57.58 1lc3 s GLU 181 Cb 0.00 -2.88 -0.04 0.00 0.10 0.00 0.00 34.13 31.31 1lc3 s GLU 181 CO 0.00 -0.59 -0.16 -0.51 0.02 0.00 0.00 175.26 174.02 1lc3 s LEU 182 N -2.26 2.75 -0.10 1.80 1.43 -1.26 -4.09 118.68 116.94 1lc3 s LEU 182 Ca 0.55 -0.68 -0.02 0.00 -1.03 0.00 0.00 54.13 52.95 1lc3 s LEU 182 Cb -0.45 -1.47 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 1lc3 s LEU 182 CO 0.60 0.12 0.00 -0.44 0.23 0.00 0.00 176.35 176.86 1lc3 s SER 183 N -2.69 5.21 -0.18 2.29 0.01 -0.18 -4.92 113.70 113.25 1lc3 s SER 183 Ca 0.23 0.12 -0.24 0.00 1.31 0.00 0.00 55.95 57.37 1lc3 s SER 183 Cb -0.09 -1.52 -0.02 0.00 0.21 0.00 0.00 66.02 64.60 1lc3 s SER 183 CO 0.13 0.35 0.76 -0.22 0.41 0.00 0.00 173.24 174.67 1lc3 s LEU 184 N -0.71 4.16 -0.26 2.44 2.96 -1.26 -1.10 118.68 124.90 1lc3 s LEU 184 Ca 0.11 1.05 -0.07 0.00 -0.22 0.00 0.00 54.13 55.00 1lc3 s LEU 184 Cb -0.12 -3.11 -0.16 0.00 0.50 0.00 0.00 46.19 43.31 1lc3 s LEU 184 CO 0.02 -0.36 -0.21 -0.38 -1.32 0.00 0.00 176.35 174.10 1lc3 n ILE 185 N 4.75 1.53 -3.52 6.68 2.08 -0.14 -4.98 119.36 125.76 1lc3 n ILE 185 Ca 0.03 -0.46 -0.10 0.00 0.56 0.00 0.00 62.75 62.78 1lc3 n ILE 185 Cb 0.49 -1.69 -0.02 0.00 -0.75 0.00 0.00 39.64 37.67 1lc3 n ILE 185 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1lc3 s SER 186 N -7.02 -0.45 -0.21 4.38 1.04 -1.08 -4.98 113.70 105.38 1lc3 s SER 186 Ca -0.35 -0.11 -0.16 0.00 0.48 0.00 0.00 55.95 55.81 1lc3 s SER 186 Cb 0.11 0.56 0.06 0.00 0.10 0.00 0.00 66.02 66.85 1lc3 s SER 186 CO 0.56 -0.93 0.55 0.00 0.98 0.00 0.00 173.24 174.40 1lc3 s ALA 187 N -3.59 -1.40 0.03 5.32 0.00 -1.26 -1.18 121.76 119.69 1lc3 s ALA 187 Ca 0.04 1.75 0.02 0.00 0.00 0.00 0.00 51.96 53.77 1lc3 s ALA 187 Cb -0.02 -1.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.05 1lc3 s ALA 187 CO -0.08 -0.29 -0.08 0.99 0.00 0.00 0.00 175.76 176.30 1lc3 s THR 188 N 0.89 0.56 -0.09 0.00 2.01 -0.24 -4.52 115.64 114.24 1lc3 s THR 188 Ca -0.05 -0.91 -0.00 0.00 0.31 0.00 0.00 61.69 61.04 1lc3 s THR 188 Cb -0.05 -0.59 0.02 0.00 0.01 0.00 0.00 72.50 71.89 1lc3 s THR 188 CO -0.07 -0.26 -0.06 -0.22 -0.69 0.00 0.00 174.62 173.32 1lc3 s LEU 189 N -1.27 1.10 -0.23 4.42 2.96 -1.26 -1.10 118.68 123.29 1lc3 s LEU 189 Ca -0.07 -0.23 -0.07 0.00 -0.22 0.00 0.00 54.13 53.54 1lc3 s LEU 189 Cb -0.08 -0.70 -0.03 0.00 0.50 0.00 0.00 46.19 45.88 1lc3 s LEU 189 CO 0.00 -0.11 0.05 -1.61 -1.32 0.00 0.00 176.35 173.36 1lc3 s GLU 190 N 1.58 3.66 -0.15 1.98 2.02 0.13 -4.98 118.70 122.95 1lc3 s GLU 190 Ca 0.01 -0.48 -0.00 0.00 0.02 0.00 0.00 54.97 54.52 1lc3 s GLU 190 Cb -0.13 -3.26 0.03 0.00 0.10 0.00 0.00 34.13 30.87 1lc3 s GLU 190 CO -0.05 -0.12 -0.09 -1.21 0.02 0.00 0.00 175.26 173.81 1lc3 s GLU 191 N 1.40 1.75 -0.72 1.61 2.02 -1.26 -1.14 118.70 122.35 1lc3 s GLU 191 Ca 0.05 -0.47 0.05 0.00 0.02 0.00 0.00 54.97 54.62 1lc3 s GLU 191 Cb -0.15 -1.93 0.17 0.00 0.10 0.00 0.00 34.13 32.33 1lc3 s GLU 191 CO 0.03 -0.32 0.52 0.54 0.02 0.00 0.00 175.26 176.05 1lc3 n ARG 192 N 4.85 1.91 0.08 1.61 1.74 -0.35 -4.92 116.66 121.58 1lc3 n ARG 192 Ca -0.14 -4.50 0.18 0.00 -0.77 0.00 0.00 57.85 52.62 1lc3 n ARG 192 Cb 0.49 -2.30 0.70 0.00 -1.02 0.00 0.00 32.46 30.33 1lc3 n ARG 192 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1lc3 h LYS 193 N 5.39 0.00 -0.59 5.56 1.79 -1.95 0.21 116.57 126.98 1lc3 h LYS 193 Ca 0.15 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.61 1lc3 h LYS 193 Cb 0.75 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.37 1lc3 h LYS 193 CO 0.73 0.00 0.34 1.05 -1.08 0.00 0.00 179.45 180.49 1lc3 h GLU 194 N 0.00 0.80 -0.42 3.15 4.11 -1.93 -2.21 114.58 118.08 1lc3 h GLU 194 Ca 0.18 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.54 1lc3 h GLU 194 Cb 0.76 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1lc3 h GLU 194 CO -0.00 0.58 0.00 -0.25 0.07 0.00 0.00 179.01 179.41 1lc3 n ASP 195 N -4.40 3.84 -4.08 3.06 8.00 -0.06 -4.95 116.55 117.96 1lc3 n ASP 195 Ca 0.06 -2.47 -0.33 0.00 0.71 0.00 0.00 54.79 52.75 1lc3 n ASP 195 Cb 0.09 -0.45 -0.01 0.00 -0.02 0.00 0.00 41.12 40.74 1lc3 n ASP 195 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lc3 n GLN 196 N 0.38 -4.10 -4.29 -1.24 6.02 -0.48 -4.47 117.38 109.20 1lc3 n GLN 196 Ca 0.19 0.46 -0.30 0.00 -0.01 0.00 0.00 57.00 57.35 1lc3 n GLN 196 Cb 0.73 -5.21 -0.10 0.00 1.02 0.00 0.00 30.24 26.67 1lc3 n GLN 196 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1lc3 s TYR 197 N -3.34 2.75 -0.24 1.08 5.04 -0.54 -4.11 117.35 117.99 1lc3 s TYR 197 Ca 0.65 -0.15 -0.20 0.00 -2.44 0.00 0.00 57.07 54.94 1lc3 s TYR 197 Cb -0.35 -1.46 0.06 0.00 0.35 0.00 0.00 41.96 40.57 1lc3 s TYR 197 CO 0.89 0.41 0.62 1.41 -1.34 0.00 0.00 175.55 177.54 1lc3 s MET 198 N -2.06 0.71 -0.04 4.97 -2.45 -0.41 -1.21 119.30 118.80 1lc3 s MET 198 Ca 0.20 0.93 -0.02 0.00 -1.25 0.00 0.00 55.69 55.55 1lc3 s MET 198 Cb -0.11 0.30 0.03 0.00 1.25 0.00 0.00 34.83 36.30 1lc3 s MET 198 CO 0.12 -0.10 0.05 0.21 1.05 0.00 0.00 175.02 176.35 1lc3 s LYS 199 N 0.61 0.05 -0.18 4.11 2.20 -0.29 -1.01 119.74 125.23 1lc3 s LYS 199 Ca -0.02 0.32 -0.03 0.00 -0.36 0.00 0.00 55.97 55.87 1lc3 s LYS 199 Cb -0.05 -0.58 -0.02 0.00 -1.51 0.00 0.00 37.83 35.67 1lc3 s LYS 199 CO -0.03 -0.32 -0.05 1.41 -0.36 0.00 0.00 175.35 176.01 1lc3 s MET 200 N 2.07 3.53 -0.16 4.03 -2.45 0.11 -0.69 119.30 125.74 1lc3 s MET 200 Ca 0.04 -0.58 0.01 0.00 -1.25 0.00 0.00 55.69 53.92 1lc3 s MET 200 Cb -0.12 -2.93 0.02 0.00 1.25 0.00 0.00 34.83 33.05 1lc3 s MET 200 CO -0.03 0.07 -0.20 0.99 1.05 0.00 0.00 175.02 176.90 1lc3 s THR 201 N 0.80 2.01 -0.06 10.11 2.01 -0.26 -1.43 115.64 128.83 1lc3 s THR 201 Ca -0.01 -0.92 0.05 0.00 0.31 0.00 0.00 61.69 61.11 1lc3 s THR 201 Cb -0.15 -1.81 -0.01 0.00 0.01 0.00 0.00 72.50 70.55 1lc3 s THR 201 CO 0.02 0.53 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.58 1lc3 s VAL 202 N 1.17 1.77 -0.17 3.82 1.01 0.65 -1.08 120.40 127.55 1lc3 s VAL 202 Ca 0.01 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 1lc3 s VAL 202 Cb -0.14 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 1lc3 s VAL 202 CO -0.10 0.50 -0.06 -1.10 0.00 0.00 0.00 175.10 174.34 1lc3 s GLN 203 N -0.02 3.49 0.22 2.72 -1.52 -0.32 -0.17 119.66 124.07 1lc3 s GLN 203 Ca -0.05 -0.60 0.08 0.00 -1.95 0.00 0.00 55.36 52.84 1lc3 s GLN 203 Cb -0.13 -2.89 -0.05 0.00 -0.22 0.00 0.00 33.01 29.72 1lc3 s GLN 203 CO 0.03 0.07 -0.14 -0.51 -0.25 0.00 0.00 175.29 174.49 1lc3 s LEU 204 N 0.80 2.55 -0.03 2.90 1.43 0.65 -0.97 118.68 126.01 1lc3 s LEU 204 Ca -0.02 -1.04 0.02 0.00 -1.03 0.00 0.00 54.13 52.06 1lc3 s LEU 204 Cb -0.15 -0.71 0.01 0.00 0.03 0.00 0.00 46.19 45.38 1lc3 s LEU 204 CO 0.02 -0.17 -0.08 -0.70 0.23 0.00 0.00 176.35 175.65 1lc3 s GLU 205 N -3.64 0.91 0.80 1.70 2.12 -0.26 -0.68 118.70 119.64 1lc3 s GLU 205 Ca 0.24 -0.24 -0.09 0.00 0.36 0.00 0.00 54.97 55.23 1lc3 s GLU 205 Cb -0.01 -0.86 0.11 0.00 0.26 0.00 0.00 34.13 33.64 1lc3 s GLU 205 CO 0.08 0.05 1.12 0.95 -0.54 0.00 0.00 175.26 176.93 1lc3 s THR 206 N 0.39 2.13 -0.96 -1.70 -4.23 0.25 -1.01 115.64 110.52 1lc3 s THR 206 Ca -0.06 -0.20 0.18 0.00 -1.18 0.00 0.00 61.69 60.43 1lc3 s THR 206 Cb -0.10 -2.93 0.15 0.00 1.34 0.00 0.00 72.50 70.96 1lc3 s THR 206 CO 0.01 0.00 1.56 0.00 -0.54 0.00 0.00 174.62 175.65 1lc3 n GLN 207 N -3.21 0.02 -0.67 3.99 1.13 -1.26 -2.11 117.38 115.27 1lc3 n GLN 207 Ca 0.11 0.22 0.07 0.00 -1.94 0.00 0.00 57.00 55.46 1lc3 n GLN 207 Cb 0.60 -1.53 0.32 0.00 0.11 0.00 0.00 30.24 29.74 1lc3 n GLN 207 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1lc3 n ASN 208 N -1.57 4.60 -0.19 1.08 5.15 -1.26 -4.93 115.26 118.14 1lc3 n ASN 208 Ca 0.04 -3.03 -0.03 0.00 -0.60 0.00 0.00 54.58 50.96 1lc3 n ASN 208 Cb 0.20 -0.62 -0.01 0.00 -0.53 0.00 0.00 39.78 38.83 1lc3 n ASN 208 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1lc3 n LYS 209 N -0.10 -0.87 -2.38 1.20 5.02 -0.90 -4.99 118.16 115.16 1lc3 n LYS 209 Ca 0.26 0.39 -0.41 0.00 -2.02 0.00 0.00 58.31 56.53 1lc3 n LYS 209 Cb 1.05 -4.14 -0.04 0.00 -0.02 0.00 0.00 35.03 31.88 1lc3 n LYS 209 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1lc3 s GLY 210 N -2.23 2.77 -0.23 0.72 0.00 -1.26 -4.77 107.32 102.31 1lc3 s GLY 210 Ca 0.00 0.96 -0.09 0.00 0.00 0.00 0.00 44.72 45.59 1lc3 s GLY 210 CO 0.00 1.79 0.11 0.48 0.00 0.00 0.00 173.10 175.48 1lc3 s LEU 211 N -0.57 3.80 -0.06 0.66 2.34 -0.90 -0.58 118.68 123.37 1lc3 s LEU 211 Ca 0.51 -0.02 0.04 0.00 0.06 0.00 0.00 54.13 54.72 1lc3 s LEU 211 Cb -0.33 -2.01 -0.02 0.00 -0.56 0.00 0.00 46.19 43.27 1lc3 s LEU 211 CO 0.38 0.04 -0.18 -0.76 -1.06 0.00 0.00 176.35 174.77 1lc3 s LEU 212 N 1.16 2.47 -0.18 1.48 1.43 0.14 -0.94 118.68 124.24 1lc3 s LEU 212 Ca 0.06 -0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 52.79 1lc3 s LEU 212 Cb -0.14 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.57 1lc3 s LEU 212 CO 0.04 0.29 -0.06 -0.55 0.23 0.00 0.00 176.35 176.30 1lc3 s SER 213 N -0.39 4.45 -0.18 2.29 0.15 -0.10 -0.25 113.70 119.67 1lc3 s SER 213 Ca 0.04 -0.27 0.01 0.00 0.70 0.00 0.00 55.95 56.43 1lc3 s SER 213 Cb -0.12 -1.73 0.02 0.00 -1.71 0.00 0.00 66.02 62.48 1lc3 s SER 213 CO 0.02 0.09 -0.19 0.86 1.20 0.00 0.00 173.24 175.22 1lc3 s TRP 214 N 0.81 2.74 -0.07 3.44 -0.00 0.77 -0.74 118.94 125.88 1lc3 s TRP 214 Ca -0.02 -1.62 0.04 0.00 -0.00 0.00 0.00 56.10 54.50 1lc3 s TRP 214 Cb -0.15 -1.89 -0.00 0.00 -0.00 0.00 0.00 33.47 31.43 1lc3 s TRP 214 CO 0.02 -0.80 -0.20 0.42 -0.00 0.00 0.00 176.95 176.38 1lc3 s ILE 215 N 1.30 1.72 -0.16 5.86 1.01 -0.37 -0.26 121.20 130.31 1lc3 s ILE 215 Ca 0.05 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 59.87 1lc3 s ILE 215 Cb -0.13 -1.49 0.02 0.00 0.01 0.00 0.00 42.46 40.87 1lc3 s ILE 215 CO -0.13 0.48 -0.20 -1.61 0.00 0.00 0.00 174.94 173.49 1lc3 s GLU 216 N 0.24 2.90 -0.02 2.79 0.41 -0.51 -1.02 118.70 123.49 1lc3 s GLU 216 Ca -0.12 -0.80 0.05 0.00 -0.41 0.00 0.00 54.97 53.69 1lc3 s GLU 216 Cb -0.15 -2.43 -0.01 0.00 -1.78 0.00 0.00 34.13 29.76 1lc3 s GLU 216 CO 0.05 -0.12 -0.16 -2.00 -0.49 0.00 0.00 175.26 172.55 1lc3 s GLU 217 N 1.08 1.40 -0.01 1.61 2.12 -0.23 -0.71 118.70 123.95 1lc3 s GLU 217 Ca -0.01 -0.57 0.00 0.00 0.36 0.00 0.00 54.97 54.75 1lc3 s GLU 217 Cb -0.14 -1.32 0.01 0.00 0.26 0.00 0.00 34.13 32.94 1lc3 s GLU 217 CO -0.07 0.31 -0.00 0.15 -0.54 0.00 0.00 175.26 175.11 1lc3 s LYS 218 N -0.25 0.11 -0.11 4.30 1.02 -0.18 -1.50 119.74 123.12 1lc3 s LYS 218 Ca 0.03 0.03 -0.31 0.00 0.02 0.00 0.00 55.97 55.74 1lc3 s LYS 218 Cb -0.08 -0.20 0.12 0.00 -0.52 0.00 0.00 37.83 37.16 1lc3 s LYS 218 CO 0.00 -0.04 1.04 0.20 -0.92 0.00 0.00 175.35 175.63 1lc3 s GLY 219 N 0.39 -0.34 0.28 -3.33 0.00 -0.73 -1.28 107.32 102.30 1lc3 s GLY 219 Ca -0.03 1.51 -0.30 0.00 0.00 0.00 0.00 44.72 45.90 1lc3 s GLY 219 CO -0.01 0.58 1.61 -4.14 0.00 0.00 0.00 173.10 171.15 1lc3 s PRO 220 N -2.37 4.12 0.00 2.90 0.02 -1.26 -2.47 135.00 135.95 1lc3 s PRO 220 Ca 0.05 2.58 0.00 0.00 0.02 0.00 0.00 61.00 63.65 1lc3 s PRO 220 Cb -0.01 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.48 1lc3 s PRO 220 CO -0.05 -0.65 0.00 0.41 -0.33 0.00 0.00 177.00 176.38 1lc3 n GLY 221 N 2.50 2.95 3.69 0.52 0.00 -1.26 -4.99 105.19 108.59 1lc3 n GLY 221 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1lc3 n GLY 221 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lc3 s LEU 222 N 0.00 4.34 0.56 0.99 1.43 -1.03 -4.98 118.68 119.98 1lc3 s LEU 222 Ca 0.00 2.28 -0.17 0.00 -1.03 0.00 0.00 54.13 55.22 1lc3 s LEU 222 Cb 0.00 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.61 1lc3 s LEU 222 CO 0.00 -0.81 1.04 -0.54 0.23 0.00 0.00 176.35 176.27 1lc3 s LYS 223 N 2.67 3.49 -0.54 1.70 3.01 -1.26 -3.89 119.74 124.93 1lc3 s LYS 223 Ca 0.69 1.19 -0.27 0.00 -1.01 0.00 0.00 55.97 56.56 1lc3 s LYS 223 Cb -0.35 -2.06 -0.01 0.00 -1.01 0.00 0.00 37.83 34.41 1lc3 s LYS 223 CO 0.29 -0.67 1.65 0.50 0.51 0.00 0.00 175.35 177.63 1lc3 s ARG 224 N -3.95 3.06 0.03 1.68 3.52 -1.26 -4.10 118.95 117.94 1lc3 s ARG 224 Ca 0.63 0.69 0.05 0.00 -0.13 0.00 0.00 55.73 56.97 1lc3 s ARG 224 Cb -0.15 -4.24 -0.02 0.00 -1.56 0.00 0.00 34.95 28.98 1lc3 s ARG 224 CO 0.33 -2.21 -0.14 -0.80 -0.81 0.00 0.00 175.30 171.67 1lc3 s ASN 225 N 6.08 1.65 -0.14 -2.12 0.01 -0.81 -4.99 114.94 114.62 1lc3 s ASN 225 Ca 0.63 -0.42 0.01 0.00 -0.71 0.00 0.00 52.86 52.37 1lc3 s ASN 225 Cb -0.14 -0.12 0.02 0.00 0.41 0.00 0.00 41.25 41.42 1lc3 s ASN 225 CO 0.25 0.05 -0.18 -0.60 -1.51 0.00 0.00 177.10 175.12 1lc3 s ARG 226 N -1.01 2.57 -0.19 -0.60 3.52 -1.26 -0.73 118.95 121.25 1lc3 s ARG 226 Ca 0.02 -0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 54.92 1lc3 s ARG 226 Cb -0.07 -2.19 -0.01 0.00 -1.56 0.00 0.00 34.95 31.12 1lc3 s ARG 226 CO 0.01 -0.11 -0.08 0.71 -0.81 0.00 0.00 175.30 175.02 1lc3 s TYR 227 N 1.10 2.91 -0.09 5.12 1.51 0.53 -4.99 117.35 123.44 1lc3 s TYR 227 Ca -0.02 -0.88 0.04 0.00 -1.01 0.00 0.00 57.07 55.21 1lc3 s TYR 227 Cb -0.14 -2.01 -0.00 0.00 -0.11 0.00 0.00 41.96 39.69 1lc3 s TYR 227 CO -0.05 -0.45 -0.24 0.08 -1.11 0.00 0.00 175.55 173.78 1lc3 s VAL 228 N 1.09 2.01 -0.29 0.71 1.01 -1.26 -1.34 120.40 122.33 1lc3 s VAL 228 Ca 0.01 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 1lc3 s VAL 228 Cb -0.15 -1.73 0.13 0.00 0.00 0.00 0.00 36.38 34.64 1lc3 s VAL 228 CO -0.01 0.55 0.28 0.21 0.00 0.00 0.00 175.10 176.13 1lc3 s ASN 229 N 0.25 1.81 -0.18 3.32 3.84 -0.60 -4.03 114.94 119.36 1lc3 s ASN 229 Ca -0.16 -0.78 -0.02 0.00 0.21 0.00 0.00 52.86 52.11 1lc3 s ASN 229 Cb -0.17 0.45 -0.01 0.00 -0.55 0.00 0.00 41.25 40.97 1lc3 s ASN 229 CO 0.08 -0.39 -0.09 -0.36 -2.79 0.00 0.00 177.10 173.54 1lc3 s PHE 230 N 2.34 2.89 -0.26 0.43 2.99 0.42 -0.27 117.98 126.52 1lc3 s PHE 230 Ca 0.09 -0.84 -0.06 0.00 0.00 0.00 0.00 56.93 56.12 1lc3 s PHE 230 Cb -0.14 -1.97 -0.01 0.00 0.00 0.00 0.00 43.02 40.90 1lc3 s PHE 230 CO -0.33 -0.40 0.05 -0.65 -0.00 0.00 0.00 175.22 173.89 1lc3 s GLN 231 N 0.92 3.44 0.42 0.44 -0.21 0.60 -1.03 119.66 124.23 1lc3 s GLN 231 Ca -0.02 -0.62 0.08 0.00 0.02 0.00 0.00 55.36 54.82 1lc3 s GLN 231 Cb -0.15 -3.27 -0.01 0.00 1.00 0.00 0.00 33.01 30.58 1lc3 s GLN 231 CO -0.00 -0.26 0.42 -0.06 -2.12 0.00 0.00 175.29 173.27 1lc3 s PHE 232 N 1.55 2.74 -0.20 0.91 0.40 -0.75 -1.05 117.98 121.58 1lc3 s PHE 232 Ca 0.05 -0.47 0.29 0.00 -0.60 0.00 0.00 56.93 56.20 1lc3 s PHE 232 Cb -0.15 -2.22 0.93 0.00 0.51 0.00 0.00 43.02 42.09 1lc3 s PHE 232 CO 0.02 -0.19 1.81 1.79 0.70 0.00 0.00 175.22 179.35 1lc3 h THR 233 N 0.94 0.00 -2.55 0.64 1.35 -1.67 -3.36 112.91 108.26 1lc3 h THR 233 Ca -0.41 -0.66 -0.59 0.00 -0.55 0.00 0.00 66.41 64.20 1lc3 h THR 233 Cb 1.27 1.63 -0.39 0.00 -1.73 0.00 0.00 68.15 68.93 1lc3 h THR 233 CO 0.55 0.00 -0.88 -0.94 -0.25 0.00 0.00 175.52 173.99 1lc3 s SER 234 N -5.66 2.33 0.00 5.36 1.04 -1.26 -5.07 113.70 110.44 1lc3 s SER 234 Ca 0.04 -2.98 0.00 0.00 0.48 0.00 0.00 55.95 53.50 1lc3 s SER 234 Cb 0.08 -0.64 0.00 0.00 0.10 0.00 0.00 66.02 65.56 1lc3 s SER 234 CO 0.58 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 175.22 1lc3 n GLY 235 N 3.00 1.55 3.29 7.32 0.00 -1.26 -4.99 105.19 114.11 1lc3 n GLY 235 Ca 0.23 -2.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.10 1lc3 n GLY 235 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1lc3 s SER 236 N 0.00 0.23 -0.15 1.61 0.15 -1.26 -1.82 113.70 112.46 1lc3 s SER 236 Ca 0.00 -1.33 -0.07 0.00 0.70 0.00 0.00 55.95 55.25 1lc3 s SER 236 Cb 0.00 0.44 0.06 0.00 -1.71 0.00 0.00 66.02 64.81 1lc3 s SER 236 CO 0.00 -0.93 0.34 -0.22 1.20 0.00 0.00 173.24 173.64 1lc3 s LEU 237 N -3.15 -0.12 0.00 3.45 2.96 -0.20 -4.97 118.68 116.65 1lc3 s LEU 237 Ca 0.36 0.77 0.00 0.00 -0.22 0.00 0.00 54.13 55.03 1lc3 s LEU 237 Cb 0.05 1.08 0.00 0.00 0.50 0.00 0.00 46.19 47.82 1lc3 s LEU 237 CO 0.13 -0.20 0.41 -1.84 -1.32 0.00 0.00 176.35 173.52 1lc3 n GLU 238 N 4.69 0.31 -3.73 1.98 0.28 -1.26 -0.44 120.64 122.47 1lc3 n GLU 238 Ca -0.18 -0.49 -0.13 0.00 -0.16 0.00 0.00 57.16 56.20 1lc3 n GLU 238 Cb 0.52 -0.68 -0.10 0.00 1.43 0.00 0.00 31.44 32.62 1lc3 n GLU 238 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1lc3 s GLU 239 N -0.17 0.45 -0.22 3.44 2.12 -1.26 -4.56 118.70 118.50 1lc3 s GLU 239 Ca 0.00 0.57 0.02 0.00 0.36 0.00 0.00 54.97 55.92 1lc3 s GLU 239 Cb 0.00 0.19 0.05 0.00 0.26 0.00 0.00 34.13 34.63 1lc3 s GLU 239 CO 0.00 -0.07 -0.12 0.08 -0.54 0.00 0.00 175.26 174.61 1lc3 s VAL 240 N 0.35 1.94 0.63 3.70 1.01 -1.26 -5.09 120.40 121.68 1lc3 s VAL 240 Ca -0.01 -1.28 -0.17 0.00 0.00 0.00 0.00 61.98 60.52 1lc3 s VAL 240 Cb -0.03 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 1lc3 s VAL 240 CO -0.01 0.14 1.18 -2.16 0.00 0.00 0.00 175.10 174.25 1lc3 s PRO 241 N 1.25 2.81 -0.31 2.72 0.04 -1.26 -5.03 135.00 135.21 1lc3 s PRO 241 Ca -0.04 1.70 -0.02 0.00 0.04 0.00 0.00 61.00 62.68 1lc3 s PRO 241 Cb -0.17 -1.92 0.10 0.00 0.04 0.00 0.00 34.50 32.55 1lc3 s PRO 241 CO -0.08 -1.31 0.13 -1.12 0.04 0.00 0.00 177.00 174.66 1lc3 s SER 242 N -1.91 3.74 0.00 6.66 0.01 -1.26 -4.67 113.70 116.28 1lc3 s SER 242 Ca 0.74 -1.59 0.13 0.00 1.31 0.00 0.00 55.95 56.53 1lc3 s SER 242 Cb -0.27 -0.64 -0.03 0.00 0.21 0.00 0.00 66.02 65.29 1lc3 s SER 242 CO 0.37 -0.41 0.68 1.33 0.41 0.00 0.00 173.24 175.62 1lc3 n VAL 243 N 4.88 0.00 -4.07 3.43 0.24 -1.26 -5.01 118.33 116.54 1lc3 n VAL 243 Ca -0.02 -0.33 -0.04 0.00 -2.04 0.00 0.00 64.34 61.90 1lc3 n VAL 243 Cb 0.41 1.12 -0.01 0.00 -1.47 0.00 0.00 33.84 33.89 1lc3 n VAL 243 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1lc3 n GLY 244 N 1.07 4.05 0.18 7.63 0.00 -1.26 -5.07 105.19 111.79 1lc3 n GLY 244 Ca 0.05 -2.23 0.07 0.00 0.00 0.00 0.00 46.02 43.91 1lc3 n GLY 244 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1lc3 n VAL 245 N -0.20 1.35 -3.90 1.61 0.24 -1.26 -4.99 118.33 111.18 1lc3 n VAL 245 Ca -0.03 -1.62 -0.26 0.00 -2.04 0.00 0.00 64.34 60.39 1lc3 n VAL 245 Cb 0.09 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.45 1lc3 n VAL 245 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1lc3 n ASN 246 N -1.02 -1.74 -4.78 -1.34 3.02 -1.26 -4.88 115.26 103.26 1lc3 n ASN 246 Ca 0.11 -0.91 -0.41 0.00 -0.03 0.00 0.00 54.58 53.34 1lc3 n ASN 246 Cb 0.64 -3.48 -0.01 0.00 -0.61 0.00 0.00 39.78 36.32 1lc3 n ASN 246 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1lc3 s LYS 247 N -6.43 4.17 -2.05 3.52 2.20 -1.26 -2.73 119.74 117.17 1lc3 s LYS 247 Ca 0.21 2.48 0.00 0.00 -0.36 0.00 0.00 55.97 58.30 1lc3 s LYS 247 Cb -0.11 -3.00 0.00 0.00 -1.51 0.00 0.00 37.83 33.21 1lc3 s LYS 247 CO 0.86 -0.45 0.00 0.09 -0.36 0.00 0.00 175.35 175.49 1lc3 n ASN 248 N 0.61 -5.68 -0.07 1.43 3.02 -1.26 -4.89 115.26 108.43 1lc3 n ASN 248 Ca 0.01 0.30 -0.01 0.00 -0.03 0.00 0.00 54.58 54.85 1lc3 n ASN 248 Cb 0.40 -4.88 0.25 0.00 -0.61 0.00 0.00 39.78 34.94 1lc3 n ASN 248 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1lc3 h ILE 249 N 0.00 1.21 0.00 2.41 2.10 -1.90 -1.73 117.51 119.60 1lc3 h ILE 249 Ca -0.45 -0.77 -0.12 0.00 1.08 0.00 0.00 64.86 64.60 1lc3 h ILE 249 Cb 1.36 0.79 -0.02 0.00 -1.09 0.00 0.00 36.82 37.86 1lc3 h ILE 249 CO 0.61 0.28 -0.56 -0.26 -1.08 0.00 0.00 178.15 177.14 1lc3 h PHE 250 N 0.65 0.00 -0.23 2.19 -1.00 -1.90 -2.26 116.94 114.39 1lc3 h PHE 250 Ca 0.14 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.83 1lc3 h PHE 250 Cb 0.29 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.84 1lc3 h PHE 250 CO 0.01 0.56 -0.28 -0.07 -1.61 0.00 0.00 178.31 176.92 1lc3 h LEU 251 N 0.00 0.46 -0.78 1.54 3.38 -1.77 -0.35 115.31 117.79 1lc3 h LEU 251 Ca -0.01 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1lc3 h LEU 251 Cb 1.00 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.59 1lc3 h LEU 251 CO 0.07 0.73 0.40 0.11 0.09 0.00 0.00 178.44 179.84 1lc3 h LYS 252 N 0.40 1.11 -0.44 1.13 1.57 -0.83 0.49 116.57 120.01 1lc3 h LYS 252 Ca 0.06 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.61 1lc3 h LYS 252 Cb 0.70 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1lc3 h LYS 252 CO 0.05 0.85 -0.01 0.22 -0.57 0.00 0.00 179.45 179.99 1lc3 h ASP 253 N 1.10 0.77 -0.79 0.86 1.82 -0.91 -2.63 116.42 116.62 1lc3 h ASP 253 Ca 0.27 -0.31 0.01 0.00 -0.39 0.00 0.00 57.03 56.61 1lc3 h ASP 253 Cb 0.08 -0.21 -0.04 0.00 0.68 0.00 0.00 39.33 39.85 1lc3 h ASP 253 CO -0.04 0.89 0.52 -0.61 -1.61 0.00 0.00 179.24 178.40 1lc3 h GLN 254 N 0.62 1.05 -0.91 0.28 4.15 -0.62 -1.82 115.11 117.85 1lc3 h GLN 254 Ca 0.12 -0.07 0.06 0.00 0.77 0.00 0.00 58.65 59.53 1lc3 h GLN 254 Cb 0.51 -0.24 -0.06 0.00 0.21 0.00 0.00 27.48 27.90 1lc3 h GLN 254 CO 0.02 0.70 0.58 -0.44 -1.93 0.00 0.00 178.83 177.76 1lc3 h ASP 255 N 1.08 0.93 -0.40 -0.69 3.32 -0.56 0.63 116.42 120.74 1lc3 h ASP 255 Ca 0.29 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.33 1lc3 h ASP 255 Cb -0.12 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 1lc3 h ASP 255 CO -0.06 0.60 0.15 0.40 -1.72 0.00 0.00 179.24 178.61 1lc3 h ILE 256 N 1.07 1.20 -0.72 0.35 2.04 -1.10 -1.54 117.51 118.81 1lc3 h ILE 256 Ca 0.39 -0.63 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1lc3 h ILE 256 Cb 0.14 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 1lc3 h ILE 256 CO -0.16 0.23 0.46 0.15 0.00 0.00 0.00 178.15 178.82 1lc3 h PHE 257 N 0.49 0.86 -0.77 1.37 3.57 -0.83 -1.77 116.94 119.87 1lc3 h PHE 257 Ca 0.13 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 1lc3 h PHE 257 Cb 0.21 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 1lc3 h PHE 257 CO 0.00 0.51 0.39 0.28 -2.23 0.00 0.00 178.31 177.27 1lc3 h VAL 258 N 0.91 1.24 -0.68 1.41 2.07 -0.65 -0.93 116.25 119.61 1lc3 h VAL 258 Ca 0.28 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1lc3 h VAL 258 Cb -0.03 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 29.93 1lc3 h VAL 258 CO -0.09 0.28 0.43 1.56 0.02 0.00 0.00 177.57 179.76 1lc3 h GLN 259 N 1.09 0.92 -0.43 1.57 1.08 -0.45 -0.85 115.11 118.04 1lc3 h GLN 259 Ca 0.27 -0.07 -0.14 0.00 -1.45 0.00 0.00 58.65 57.26 1lc3 h GLN 259 Cb 0.08 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.29 1lc3 h GLN 259 CO -0.04 0.63 -0.28 0.87 -0.95 0.00 0.00 178.83 179.06 1lc3 h LYS 260 N 0.94 0.92 -0.14 1.46 1.57 -0.61 -0.76 116.57 119.95 1lc3 h LYS 260 Ca 0.25 -0.42 -0.04 0.00 -1.87 0.00 0.00 60.65 58.56 1lc3 h LYS 260 Cb -0.06 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1lc3 h LYS 260 CO -0.05 1.08 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.74 1lc3 h LEU 261 N 0.78 0.20 -0.57 2.94 3.38 -0.40 -1.09 115.31 120.55 1lc3 h LEU 261 Ca 0.09 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1lc3 h LEU 261 Cb 0.85 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1lc3 h LEU 261 CO 0.07 0.34 0.00 0.18 0.09 0.00 0.00 178.44 179.13 1lc3 n LEU 262 N -4.30 0.88 -3.73 1.67 4.77 -0.40 -4.91 117.00 110.97 1lc3 n LEU 262 Ca -0.01 -0.31 -0.26 0.00 -0.03 0.00 0.00 56.01 55.40 1lc3 n LEU 262 Cb 0.24 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.38 1lc3 n LEU 262 CO 0.37 0.16 0.18 -0.67 -1.33 0.00 0.00 177.39 176.10 1lc3 n ASP 263 N -0.29 -5.56 -1.13 -1.43 2.03 -0.41 -4.89 116.55 104.86 1lc3 n ASP 263 Ca 0.20 -0.65 0.09 0.00 0.52 0.00 0.00 54.79 54.95 1lc3 n ASP 263 Cb 0.24 -4.54 0.27 0.00 -0.72 0.00 0.00 41.12 36.37 1lc3 n ASP 263 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1lc3 n GLN 264 N -4.85 3.11 -4.17 -0.67 6.02 -0.33 -4.92 117.38 111.58 1lc3 n GLN 264 Ca 0.01 -2.55 -0.34 0.00 -0.01 0.00 0.00 57.00 54.11 1lc3 n GLN 264 Cb 0.55 -1.60 -0.12 0.00 1.02 0.00 0.00 30.24 30.09 1lc3 n GLN 264 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1lc3 s VAL 265 N -1.47 4.20 0.74 5.09 1.01 -1.25 -4.97 120.40 123.75 1lc3 s VAL 265 Ca 0.40 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.99 1lc3 s VAL 265 Cb 0.24 -2.88 0.04 0.00 0.00 0.00 0.00 36.38 33.79 1lc3 s VAL 265 CO 0.22 0.46 1.23 -0.94 0.00 0.00 0.00 175.10 176.07 1lc3 s SER 266 N 0.60 4.05 0.31 3.32 1.04 -1.26 -4.81 113.70 116.95 1lc3 s SER 266 Ca -0.00 2.43 -0.01 0.00 0.48 0.00 0.00 55.95 58.85 1lc3 s SER 266 Cb -0.14 -2.60 0.47 0.00 0.10 0.00 0.00 66.02 63.86 1lc3 s SER 266 CO 0.02 -2.37 1.97 0.00 0.98 0.00 0.00 173.24 173.84 1lc3 h ALA 267 N -0.33 1.42 -0.50 5.32 0.00 -1.99 -1.21 119.26 121.97 1lc3 h ALA 267 Ca -0.48 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 1lc3 h ALA 267 Cb 1.31 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1lc3 h ALA 267 CO 0.49 0.53 0.18 0.93 0.00 0.00 0.00 179.25 181.38 1lc3 h GLU 268 N 1.06 0.76 -0.54 0.00 5.08 -1.99 -0.16 114.58 118.79 1lc3 h GLU 268 Ca 0.28 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1lc3 h GLU 268 Cb -0.10 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.01 1lc3 h GLU 268 CO -0.06 0.69 0.09 -0.44 -1.00 0.00 0.00 179.01 178.29 1lc3 h ASP 269 N 0.67 0.87 -0.71 1.42 3.45 -1.79 -0.49 116.42 119.84 1lc3 h ASP 269 Ca 0.17 -0.26 -0.04 0.00 0.43 0.00 0.00 57.03 57.32 1lc3 h ASP 269 Cb 0.23 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 38.73 1lc3 h ASP 269 CO -0.01 0.91 0.28 -0.07 -1.57 0.00 0.00 179.24 178.78 1lc3 h LEU 270 N 0.79 0.99 -0.44 1.55 3.38 -1.03 -2.04 115.31 118.51 1lc3 h LEU 270 Ca 0.17 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1lc3 h LEU 270 Cb 0.41 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1lc3 h LEU 270 CO 0.01 0.89 -0.15 0.00 0.09 0.00 0.00 178.44 179.27 1lc3 h ALA 271 N 1.13 0.61 -0.59 1.53 0.00 -0.77 -2.25 119.26 118.92 1lc3 h ALA 271 Ca 0.24 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1lc3 h ALA 271 Cb 0.21 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1lc3 h ALA 271 CO -0.02 0.54 0.25 0.00 0.00 0.00 0.00 179.25 180.02 1lc3 h ALA 272 N 0.85 0.77 -0.20 0.00 0.00 -0.95 -1.16 119.26 118.56 1lc3 h ALA 272 Ca 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1lc3 h ALA 272 Cb 0.71 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1lc3 h ALA 272 CO 0.05 0.36 0.08 1.49 0.00 0.00 0.00 179.25 181.23 1lc3 h GLU 273 N 0.81 0.30 -0.90 0.00 4.81 -1.30 -2.00 114.58 116.31 1lc3 h GLU 273 Ca 0.20 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1lc3 h GLU 273 Cb 0.17 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 1lc3 h GLU 273 CO -0.02 0.36 0.59 -0.22 -0.73 0.00 0.00 179.01 178.99 1lc3 h LYS 274 N 0.17 1.18 -0.78 1.92 3.64 -1.25 -0.78 116.57 120.67 1lc3 h LYS 274 Ca 0.07 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1lc3 h LYS 274 Cb 0.17 -0.27 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 1lc3 h LYS 274 CO -0.01 0.78 0.50 -0.22 -2.27 0.00 0.00 179.45 178.23 1lc3 h LYS 275 N 1.21 1.04 -0.22 1.90 3.64 -0.98 -0.55 116.57 122.61 1lc3 h LYS 275 Ca 0.33 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.58 1lc3 h LYS 275 Cb -0.14 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.45 1lc3 h LYS 275 CO -0.07 0.71 -0.04 -0.09 -2.27 0.00 0.00 179.45 177.69 1lc3 h ARG 276 N 1.06 0.42 -0.31 1.90 2.43 -0.72 -1.21 114.38 117.95 1lc3 h ARG 276 Ca 0.28 -0.16 0.04 0.00 -0.81 0.00 0.00 59.98 59.34 1lc3 h ARG 276 Cb -0.09 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.40 1lc3 h ARG 276 CO -0.06 0.65 0.09 0.82 -1.51 0.00 0.00 179.97 179.96 1lc3 h ILE 277 N 0.16 0.88 -0.19 1.20 2.04 -0.89 -1.02 117.51 119.69 1lc3 h ILE 277 Ca 0.06 -0.07 -0.10 0.00 1.00 0.00 0.00 64.86 65.75 1lc3 h ILE 277 Cb 0.49 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1lc3 h ILE 277 CO 0.02 0.04 -0.30 0.24 0.00 0.00 0.00 178.15 178.14 1lc3 h MET 278 N 0.21 0.37 -0.38 2.37 2.86 -1.07 -1.51 114.93 117.79 1lc3 h MET 278 Ca 0.14 -0.15 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1lc3 h MET 278 Cb 0.13 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 1lc3 h MET 278 CO -0.17 0.65 0.09 1.25 1.06 0.00 0.00 176.91 179.79 1lc3 h HIS 279 N 0.33 0.65 -0.50 -0.22 -0.00 -0.67 0.29 115.15 115.02 1lc3 h HIS 279 Ca 0.04 -0.08 -0.05 0.00 -0.00 0.00 0.00 60.37 60.29 1lc3 h HIS 279 Cb 0.70 -0.18 -0.02 0.00 -0.00 0.00 0.00 27.41 27.91 1lc3 h HIS 279 CO 0.02 0.64 0.12 0.00 -0.00 0.00 0.00 177.93 178.70 1lc3 h LEU 281 N 0.69 0.76 -0.54 0.00 3.38 -1.16 -0.34 115.31 118.10 1lc3 h LEU 281 Ca 0.16 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1lc3 h LEU 281 Cb 0.33 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1lc3 h LEU 281 CO 0.00 0.80 0.18 1.23 0.09 0.00 0.00 178.44 180.74 1lc3 h GLY 282 N 0.97 0.89 0.99 0.83 0.00 -0.61 -0.70 103.07 105.44 1lc3 h GLY 282 Ca 0.15 -0.52 -0.06 0.00 0.00 0.00 0.00 47.33 46.90 1lc3 h GLY 282 CO 0.01 0.49 0.07 1.41 0.00 0.00 0.00 176.54 178.52 1lc3 h LEU 283 N 0.74 0.82 -0.73 3.11 3.38 -0.75 -0.95 115.31 120.94 1lc3 h LEU 283 Ca 0.18 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1lc3 h LEU 283 Cb 0.26 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1lc3 h LEU 283 CO -0.01 0.88 0.43 0.00 0.09 0.00 0.00 178.44 179.83 1lc3 h ALA 284 N 0.97 0.93 -0.46 1.53 0.00 -0.82 0.12 119.26 121.53 1lc3 h ALA 284 Ca 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1lc3 h ALA 284 Cb 0.42 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1lc3 h ALA 284 CO 0.01 0.41 0.21 1.03 0.00 0.00 0.00 179.25 180.91 1lc3 h SER 285 N 1.00 0.62 -0.59 0.00 0.87 -0.90 -1.53 113.55 113.01 1lc3 h SER 285 Ca 0.26 -0.14 -0.09 0.00 -1.23 0.00 0.00 61.79 60.59 1lc3 h SER 285 Cb -0.02 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.76 1lc3 h SER 285 CO -0.05 0.59 0.04 0.44 -0.53 0.00 0.00 176.83 177.32 1lc3 h ASP 286 N 0.60 0.99 -0.74 6.23 3.32 -0.74 -2.53 116.42 123.55 1lc3 h ASP 286 Ca 0.16 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 56.91 1lc3 h ASP 286 Cb 0.14 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 1lc3 h ASP 286 CO -0.02 1.04 0.45 0.40 -1.72 0.00 0.00 179.24 179.39 1lc3 h ILE 287 N 0.92 1.21 -0.70 0.35 2.04 -0.57 -1.52 117.51 119.23 1lc3 h ILE 287 Ca 0.17 -0.47 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 1lc3 h ILE 287 Cb 0.51 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 1lc3 h ILE 287 CO 0.02 0.22 0.43 -0.61 0.00 0.00 0.00 178.15 178.21 1lc3 h GLN 288 N 1.02 0.95 -0.56 2.37 4.15 -1.08 -1.88 115.11 120.08 1lc3 h GLN 288 Ca 0.27 -0.08 -0.07 0.00 0.77 0.00 0.00 58.65 59.53 1lc3 h GLN 288 Cb -0.03 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 27.43 1lc3 h GLN 288 CO -0.05 0.67 0.06 0.87 -1.93 0.00 0.00 178.83 178.44 1lc3 h LYS 289 N 0.96 0.92 -0.27 1.69 1.57 -1.02 0.22 116.57 120.63 1lc3 h LYS 289 Ca 0.25 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 1lc3 h LYS 289 Cb -0.04 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1lc3 h LYS 289 CO -0.05 0.88 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.50 1lc3 h LEU 290 N 0.86 0.45 0.16 2.94 3.38 -0.83 -0.43 115.31 121.83 1lc3 h LEU 290 Ca 0.17 -0.12 -0.29 0.00 0.09 0.00 0.00 57.88 57.73 1lc3 h LEU 290 Cb 0.43 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1lc3 h LEU 290 CO 0.01 0.61 -1.34 0.00 0.09 0.00 0.00 178.44 177.82 1lc3 h HIS 292 N 0.09 0.54 0.00 0.00 3.86 -0.93 -3.45 115.15 115.27 1lc3 h HIS 292 Ca -0.18 -0.40 0.00 0.00 -1.16 0.00 0.00 60.37 58.64 1lc3 h HIS 292 Cb 2.03 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 30.48 1lc3 h HIS 292 CO 0.08 1.75 0.00 1.04 0.86 0.00 0.00 177.93 181.66