#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1luc s LYS 2 N 0.00 1.69 -0.05 2.12 1.02 -0.22 -5.03 119.74 119.28 1luc s LYS 2 Ca 0.00 -1.26 0.02 0.00 0.02 0.00 0.00 55.97 54.76 1luc s LYS 2 Cb 0.00 -2.04 0.01 0.00 -0.52 0.00 0.00 37.83 35.27 1luc s LYS 2 CO 0.00 0.46 -0.11 -0.06 -0.92 0.00 0.00 175.35 174.72 1luc s PHE 3 N -1.22 1.25 0.09 3.18 0.08 -1.26 -0.63 117.98 119.47 1luc s PHE 3 Ca 0.18 -0.40 0.09 0.00 0.12 0.00 0.00 56.93 56.92 1luc s PHE 3 Cb -0.10 -0.91 -0.04 0.00 -0.57 0.00 0.00 43.02 41.40 1luc s PHE 3 CO 0.10 -0.20 -0.20 0.20 -0.10 0.00 0.00 175.22 175.02 1luc s GLY 4 N 0.46 1.62 -0.18 4.36 0.00 0.51 -0.18 107.32 113.91 1luc s GLY 4 Ca -0.09 -1.31 0.01 0.00 0.00 0.00 0.00 44.72 43.32 1luc s GLY 4 CO 0.02 -1.26 -0.19 0.21 0.00 0.00 0.00 173.10 171.88 1luc s ASN 5 N -1.84 3.20 -0.11 1.64 2.47 0.62 -0.70 114.94 120.21 1luc s ASN 5 Ca 0.16 -0.63 -0.17 0.00 0.42 0.00 0.00 52.86 52.64 1luc s ASN 5 Cb -0.10 -1.49 -0.05 0.00 -1.45 0.00 0.00 41.25 38.16 1luc s ASN 5 CO 0.07 0.01 0.43 -0.36 -3.72 0.00 0.00 177.10 173.53 1luc s PHE 6 N 1.21 3.54 -0.20 0.43 0.08 0.12 -0.52 117.98 122.64 1luc s PHE 6 Ca 0.03 0.85 0.01 0.00 0.12 0.00 0.00 56.93 57.94 1luc s PHE 6 Cb -0.14 -2.47 0.03 0.00 -0.57 0.00 0.00 43.02 39.88 1luc s PHE 6 CO -0.11 0.26 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.60 1luc s LEU 7 N 0.31 2.53 0.21 -0.37 1.43 0.63 -4.29 118.68 119.13 1luc s LEU 7 Ca 0.24 -0.83 0.22 0.00 -1.03 0.00 0.00 54.13 52.73 1luc s LEU 7 Cb -0.15 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.56 1luc s LEU 7 CO 0.09 -0.05 1.05 -0.07 0.23 0.00 0.00 176.35 177.60 1luc h LEU 8 N 7.91 0.00 0.61 1.79 3.38 -1.91 -2.70 115.31 124.40 1luc h LEU 8 Ca -0.39 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.18 1luc h LEU 8 Cb 1.12 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.90 1luc h LEU 8 CO 0.59 0.01 -0.61 0.41 0.09 0.00 0.00 178.44 178.93 1luc n THR 9 N -2.69 -1.91 -2.55 0.22 -1.04 -1.26 -4.41 114.28 100.64 1luc n THR 9 Ca -0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.62 1luc n THR 9 Cb 0.55 -3.17 -0.04 0.00 -1.82 0.00 0.00 70.33 65.85 1luc n THR 9 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 1luc s TYR 10 N -3.15 3.50 -0.56 -1.42 5.04 -1.26 -0.61 117.35 118.89 1luc s TYR 10 Ca 0.37 1.70 -0.13 0.00 -2.44 0.00 0.00 57.07 56.57 1luc s TYR 10 Cb -0.17 -3.17 0.14 0.00 0.35 0.00 0.00 41.96 39.11 1luc s TYR 10 CO 0.46 -0.44 0.49 -1.14 -1.34 0.00 0.00 175.55 173.58 1luc s GLN 11 N -1.88 2.90 0.71 4.97 0.74 0.54 -4.93 119.66 122.72 1luc s GLN 11 Ca 0.50 -1.84 -0.11 0.00 0.05 0.00 0.00 55.36 53.96 1luc s GLN 11 Cb -0.27 -4.19 0.02 0.00 1.10 0.00 0.00 33.01 29.67 1luc s GLN 11 CO 0.34 -1.28 1.07 -1.25 -0.55 0.00 0.00 175.29 173.61 1luc s PRO 12 N 1.31 2.77 0.41 1.67 0.04 -1.26 -4.79 135.00 135.14 1luc s PRO 12 Ca 0.06 0.99 0.16 0.00 0.04 0.00 0.00 61.00 62.25 1luc s PRO 12 Cb -0.26 -1.97 1.04 0.00 0.04 0.00 0.00 34.50 33.35 1luc s PRO 12 CO 0.00 -1.23 1.86 -1.35 0.04 0.00 0.00 177.00 176.32 1luc h PRO 13 N -0.82 0.44 0.00 0.56 0.11 -1.98 -1.97 132.00 128.34 1luc h PRO 13 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1luc h PRO 13 Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1luc h PRO 13 CO 0.56 0.29 0.00 -0.85 -0.21 0.00 0.00 178.00 177.79 1luc n GLU 14 N -4.53 0.87 -4.42 1.05 0.00 -1.26 -4.86 120.64 107.49 1luc n GLU 14 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 57.16 57.10 1luc n GLU 14 Cb 0.66 -1.50 -0.13 0.00 0.00 0.00 0.00 31.44 30.47 1luc n GLU 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1luc s LEU 15 N -2.08 2.27 0.61 -1.84 1.43 -0.74 -5.14 118.68 113.18 1luc s LEU 15 Ca 0.43 -0.66 -0.06 0.00 -1.03 0.00 0.00 54.13 52.81 1luc s LEU 15 Cb 0.21 -1.00 0.02 0.00 0.03 0.00 0.00 46.19 45.44 1luc s LEU 15 CO 0.36 0.12 0.92 -0.94 0.23 0.00 0.00 176.35 177.03 1luc s SER 16 N -1.74 5.47 0.18 2.29 1.04 -1.26 -4.71 113.70 114.98 1luc s SER 16 Ca 0.08 0.67 -0.13 0.00 0.48 0.00 0.00 55.95 57.05 1luc s SER 16 Cb -0.10 -1.61 0.11 0.00 0.10 0.00 0.00 66.02 64.52 1luc s SER 16 CO 0.04 -1.14 1.82 1.56 0.98 0.00 0.00 173.24 176.50 1luc h GLN 17 N -0.23 0.63 -0.81 4.02 4.20 -1.99 0.53 115.11 121.46 1luc h GLN 17 Ca -0.45 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.22 1luc h GLN 17 Cb 1.27 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.86 1luc h GLN 17 CO 0.60 0.42 0.52 1.15 -0.67 0.00 0.00 178.83 180.85 1luc h THR 18 N 0.65 1.22 -0.37 -0.54 2.02 -1.99 -0.42 112.91 113.47 1luc h THR 18 Ca 0.22 -0.42 -0.10 0.00 0.77 0.00 0.00 66.41 66.87 1luc h THR 18 Cb 0.01 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.45 1luc h THR 18 CO -0.09 0.21 -0.15 -0.33 0.37 0.00 0.00 175.52 175.54 1luc h GLU 19 N 1.11 0.76 -0.51 6.66 5.08 -1.77 -1.42 114.58 124.49 1luc h GLU 19 Ca 0.29 -0.32 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1luc h GLU 19 Cb -0.10 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.09 1luc h GLU 19 CO -0.06 0.93 0.28 0.28 -1.00 0.00 0.00 179.01 179.44 1luc h VAL 20 N 0.55 1.01 -0.45 3.13 2.07 -0.23 -1.33 116.25 121.00 1luc h VAL 20 Ca 0.09 -0.19 -0.10 0.00 0.82 0.00 0.00 66.70 67.32 1luc h VAL 20 Cb 0.68 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1luc h VAL 20 CO 0.05 0.10 -0.10 0.24 0.02 0.00 0.00 177.57 177.87 1luc h MET 21 N 0.55 0.81 -0.58 1.57 2.86 -0.96 -0.37 114.93 118.81 1luc h MET 21 Ca 0.21 -0.27 -0.08 0.00 -2.06 0.00 0.00 59.70 57.50 1luc h MET 21 Cb 0.07 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1luc h MET 21 CO -0.12 0.88 0.06 -0.22 1.06 0.00 0.00 176.91 178.57 1luc h LYS 22 N 0.74 0.97 -0.38 1.72 3.64 -0.97 -2.21 116.57 120.06 1luc h LYS 22 Ca 0.12 -0.26 -0.10 0.00 -1.27 0.00 0.00 60.65 59.15 1luc h LYS 22 Cb 0.60 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 1luc h LYS 22 CO 0.04 0.92 -0.15 -0.09 -2.27 0.00 0.00 179.45 177.90 1luc h ARG 23 N 0.90 0.71 -0.28 1.90 2.43 -0.90 -1.07 114.38 118.08 1luc h ARG 23 Ca 0.18 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1luc h ARG 23 Cb 0.45 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1luc h ARG 23 CO 0.02 0.82 0.17 1.25 -1.51 0.00 0.00 179.97 180.72 1luc h LEU 24 N 0.63 0.32 -0.14 3.80 5.85 -0.67 0.18 115.31 125.29 1luc h LEU 24 Ca 0.10 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.80 1luc h LEU 24 Cb 0.62 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1luc h LEU 24 CO 0.04 0.26 0.07 0.58 -0.34 0.00 0.00 178.44 179.05 1luc h VAL 25 N 0.36 1.00 -0.55 1.05 2.07 -1.14 -1.64 116.25 117.40 1luc h VAL 25 Ca 0.10 -0.05 -0.08 0.00 0.82 0.00 0.00 66.70 67.49 1luc h VAL 25 Cb -0.01 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1luc h VAL 25 CO -0.02 0.03 0.02 0.78 0.02 0.00 0.00 177.57 178.40 1luc h ASN 26 N 0.15 0.93 -0.55 0.57 -0.26 -0.88 -2.28 115.58 113.25 1luc h ASN 26 Ca 0.06 -0.30 -0.10 0.00 -0.56 0.00 0.00 56.30 55.40 1luc h ASN 26 Cb 0.01 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 37.00 1luc h ASN 26 CO -0.04 1.00 -0.02 -0.07 -1.06 0.00 0.00 177.43 177.24 1luc h LEU 27 N 0.83 0.99 -0.38 1.61 3.38 -0.61 -1.17 115.31 119.96 1luc h LEU 27 Ca 0.16 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1luc h LEU 27 Cb 0.51 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1luc h LEU 27 CO 0.02 1.06 0.25 1.23 0.09 0.00 0.00 178.44 181.09 1luc h GLY 28 N 0.99 0.54 2.00 0.83 0.00 -1.14 -2.29 103.07 104.00 1luc h GLY 28 Ca 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 1luc h GLY 28 CO 0.03 0.20 -0.12 0.50 0.00 0.00 0.00 176.54 177.15 1luc h LYS 29 N 0.51 0.00 0.00 4.80 1.57 -1.18 -2.86 116.57 119.42 1luc h LYS 29 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1luc h LYS 29 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1luc h LYS 29 CO -0.03 0.12 -0.58 0.00 -0.57 0.00 0.00 179.45 178.40 1luc n ALA 30 N -2.20 3.61 -0.10 3.86 0.00 -0.46 -4.46 120.51 120.75 1luc n ALA 30 Ca -0.01 -0.37 -0.07 0.00 0.00 0.00 0.00 53.44 52.99 1luc n ALA 30 Cb 0.31 -1.08 0.01 0.00 0.00 0.00 0.00 19.45 18.68 1luc n ALA 30 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1luc h SER 31 N 0.00 0.19 -0.95 0.00 0.02 -1.18 -2.88 113.55 108.74 1luc h SER 31 Ca 0.00 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1luc h SER 31 Cb 0.53 -0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.01 1luc h SER 31 CO 0.00 0.15 0.62 -0.08 -1.14 0.00 0.00 176.83 176.38 1luc h GLU 32 N 0.30 1.15 0.00 3.45 4.81 -1.78 -1.56 114.58 120.94 1luc h GLU 32 Ca 0.15 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1luc h GLU 32 Cb 0.09 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 29.21 1luc h GLU 32 CO -0.13 0.76 -0.13 0.78 -0.73 0.00 0.00 179.01 179.56 1luc h GLY 33 N 1.18 0.00 -1.14 1.92 0.00 -1.80 -1.36 103.07 101.86 1luc h GLY 33 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1luc h GLY 33 CO -0.12 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.42 1luc n GLY 35 N 0.98 0.55 3.75 0.00 0.00 -0.51 -4.62 105.19 105.34 1luc n GLY 35 Ca 0.10 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 1luc n GLY 35 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1luc s PHE 36 N -2.00 3.64 -0.85 1.61 0.08 -1.03 -4.68 117.98 114.75 1luc s PHE 36 Ca 0.00 1.13 0.23 0.00 0.12 0.00 0.00 56.93 58.41 1luc s PHE 36 Cb 0.00 -2.60 0.13 0.00 -0.57 0.00 0.00 43.02 39.98 1luc s PHE 36 CO 0.00 0.30 1.12 -0.40 -0.10 0.00 0.00 175.22 176.15 1luc n ASP 37 N 2.98 0.67 -3.88 1.36 5.68 0.74 -4.07 116.55 120.04 1luc n ASP 37 Ca -0.07 -0.43 -0.11 0.00 -0.50 0.00 0.00 54.79 53.68 1luc n ASP 37 Cb 0.51 0.67 -0.11 0.00 -1.14 0.00 0.00 41.12 41.05 1luc n ASP 37 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1luc s THR 38 N -3.08 0.05 -0.12 2.12 2.01 -1.14 -1.61 115.64 113.89 1luc s THR 38 Ca 0.07 -0.45 0.01 0.00 0.31 0.00 0.00 61.69 61.64 1luc s THR 38 Cb 0.16 -0.28 -0.01 0.00 0.01 0.00 0.00 72.50 72.38 1luc s THR 38 CO 0.78 -0.24 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.62 1luc s VAL 39 N -0.79 2.83 -0.13 3.82 1.01 -0.45 -0.28 120.40 126.41 1luc s VAL 39 Ca -0.09 -0.74 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 1luc s VAL 39 Cb -0.05 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 1luc s VAL 39 CO 0.00 0.54 -0.07 0.26 0.00 0.00 0.00 175.10 175.83 1luc s TRP 40 N 0.27 2.94 -0.18 5.22 0.52 0.32 -0.38 118.94 127.67 1luc s TRP 40 Ca -0.11 -0.36 -0.02 0.00 0.02 0.00 0.00 56.10 55.63 1luc s TRP 40 Cb -0.16 -1.89 -0.01 0.00 -1.15 0.00 0.00 33.47 30.27 1luc s TRP 40 CO 0.06 -0.04 -0.10 -0.51 0.02 0.00 0.00 176.95 176.39 1luc s LEU 41 N 0.19 2.75 0.15 2.99 1.43 0.19 -0.27 118.68 126.11 1luc s LEU 41 Ca -0.04 -0.38 -0.16 0.00 -1.03 0.00 0.00 54.13 52.52 1luc s LEU 41 Cb -0.14 -1.66 -0.07 0.00 0.03 0.00 0.00 46.19 44.35 1luc s LEU 41 CO 0.04 0.07 0.58 -0.22 0.23 0.00 0.00 176.35 177.04 1luc s LEU 42 N 0.95 4.35 -0.15 1.79 2.96 -1.02 -0.28 118.68 127.28 1luc s LEU 42 Ca -0.02 1.15 -0.08 0.00 -0.22 0.00 0.00 54.13 54.96 1luc s LEU 42 Cb -0.15 -3.29 -0.04 0.00 0.50 0.00 0.00 46.19 43.20 1luc s LEU 42 CO -0.00 0.10 0.14 -0.70 -1.32 0.00 0.00 176.35 174.57 1luc s GLU 43 N -1.90 3.75 -0.06 1.98 2.12 -1.25 -4.65 118.70 118.69 1luc s GLU 43 Ca 0.38 -0.15 -0.24 0.00 0.36 0.00 0.00 54.97 55.32 1luc s GLU 43 Cb -0.16 -3.28 0.05 0.00 0.26 0.00 0.00 34.13 31.00 1luc s GLU 43 CO 0.19 0.58 0.53 -1.58 -0.54 0.00 0.00 175.26 174.44 1luc s HIS 44 N -0.46 -0.48 0.06 5.30 2.46 0.38 -4.91 115.29 117.65 1luc s HIS 44 Ca 0.12 0.86 0.06 0.00 0.47 0.00 0.00 55.06 56.57 1luc s HIS 44 Cb -0.12 0.27 -0.03 0.00 -0.13 0.00 0.00 32.58 32.58 1luc s HIS 44 CO 0.02 -0.49 -0.17 -1.01 -2.47 0.00 0.00 174.74 170.62 1luc s HIS 45 N -1.06 1.46 -0.77 3.88 3.76 -1.26 -2.50 115.29 118.81 1luc s HIS 45 Ca -0.11 -0.40 0.00 0.00 -0.15 0.00 0.00 55.06 54.41 1luc s HIS 45 Cb -0.02 -0.84 0.00 0.00 1.11 0.00 0.00 32.58 32.82 1luc s HIS 45 CO 0.07 0.09 0.00 1.19 -0.85 0.00 0.00 174.74 175.24 1luc n PHE 46 N 1.57 -0.12 -3.91 1.40 3.72 -1.26 -4.95 117.46 113.91 1luc n PHE 46 Ca -0.19 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.12 1luc n PHE 46 Cb 0.54 -2.20 -0.07 0.00 -0.94 0.00 0.00 39.48 36.82 1luc n PHE 46 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1luc s THR 47 N -1.48 0.08 -0.57 4.37 -4.23 -1.26 -5.03 115.64 107.52 1luc s THR 47 Ca 0.00 -1.27 0.18 0.00 -1.18 0.00 0.00 61.69 59.41 1luc s THR 47 Cb 0.00 -1.67 0.18 0.00 1.34 0.00 0.00 72.50 72.35 1luc s THR 47 CO 0.00 -0.38 1.54 -1.84 -0.54 0.00 0.00 174.62 173.40 1luc n GLU 48 N -0.18 0.11 -0.06 3.99 0.00 -1.26 -3.12 120.64 120.12 1luc n GLU 48 Ca -0.10 0.47 0.19 0.00 0.00 0.00 0.00 57.16 57.72 1luc n GLU 48 Cb 0.63 -1.77 0.63 0.00 0.00 0.00 0.00 31.44 30.93 1luc n GLU 48 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 1luc h PHE 49 N 0.00 0.15 -1.48 -1.84 3.57 -1.87 0.16 116.94 115.64 1luc h PHE 49 Ca 0.00 0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.62 1luc h PHE 49 Cb 0.18 -0.05 -0.25 0.00 2.79 0.00 0.00 35.95 38.63 1luc h PHE 49 CO 0.00 0.06 0.25 0.20 -2.23 0.00 0.00 178.31 176.59 1luc s GLY 50 N -3.94 -0.20 0.00 2.40 0.00 -1.18 -4.10 107.32 100.30 1luc s GLY 50 Ca -0.06 2.96 0.25 0.00 0.00 0.00 0.00 44.72 47.87 1luc s GLY 50 CO 0.74 2.80 1.45 1.04 0.00 0.00 0.00 173.10 179.14 1luc n LEU 51 N 4.30 0.51 -4.48 0.66 4.77 0.22 -4.34 117.00 118.64 1luc n LEU 51 Ca -0.15 0.01 -0.43 0.00 -0.03 0.00 0.00 56.01 55.40 1luc n LEU 51 Cb 0.55 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1luc n LEU 51 CO -0.01 0.12 0.62 -0.22 -1.33 0.00 0.00 177.39 176.58 1luc s LEU 52 N -2.97 4.44 0.11 2.23 2.96 -1.26 -4.86 118.68 119.33 1luc s LEU 52 Ca 0.12 -0.65 0.23 0.00 -0.22 0.00 0.00 54.13 53.61 1luc s LEU 52 Cb 0.18 -2.63 0.13 0.00 0.50 0.00 0.00 46.19 44.37 1luc s LEU 52 CO 0.68 -1.16 1.12 0.61 -1.32 0.00 0.00 176.35 176.28 1luc n GLY 53 N 5.17 -1.34 2.46 7.98 0.00 -1.04 -0.47 105.19 117.95 1luc n GLY 53 Ca -0.02 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 1luc n GLY 53 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1luc n ASN 54 N -2.20 2.38 0.32 1.61 4.13 -1.26 -4.61 115.26 115.63 1luc n ASN 54 Ca 0.02 -3.12 0.21 0.00 1.68 0.00 0.00 54.58 53.36 1luc n ASN 54 Cb 0.47 -0.67 1.11 0.00 -1.54 0.00 0.00 39.78 39.15 1luc n ASN 54 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 1luc h PRO 55 N 4.52 0.00 -0.35 3.52 0.11 -1.88 -0.98 132.00 136.93 1luc h PRO 55 Ca 0.17 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.19 1luc h PRO 55 Cb 0.75 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.85 1luc h PRO 55 CO 0.68 0.01 -0.15 1.88 -0.21 0.00 0.00 178.00 180.21 1luc h TYR 56 N 0.00 0.69 -0.16 0.65 0.05 -1.97 0.16 116.97 116.38 1luc h TYR 56 Ca -0.00 -0.13 -0.18 0.00 0.05 0.00 0.00 58.73 58.48 1luc h TYR 56 Cb 0.05 -0.18 0.01 0.00 1.01 0.00 0.00 36.73 37.62 1luc h TYR 56 CO 0.00 0.75 -0.58 0.28 -1.05 0.00 0.00 178.16 177.55 1luc h VAL 57 N 0.57 1.32 -0.62 -2.88 2.07 -1.62 -1.20 116.25 113.89 1luc h VAL 57 Ca 0.10 -1.82 -0.09 0.00 0.82 0.00 0.00 66.70 65.70 1luc h VAL 57 Cb 0.59 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 1luc h VAL 57 CO 0.04 0.57 0.03 0.00 0.02 0.00 0.00 177.57 178.23 1luc h ALA 58 N 0.55 0.88 -0.86 1.67 0.00 -1.42 -2.01 119.26 118.08 1luc h ALA 58 Ca -0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 1luc h ALA 58 Cb 1.21 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 1luc h ALA 58 CO 0.12 0.67 0.46 0.00 0.00 0.00 0.00 179.25 180.50 1luc h ALA 59 N 1.04 1.10 -0.74 0.00 0.00 -0.66 -1.62 119.26 118.39 1luc h ALA 59 Ca 0.18 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1luc h ALA 59 Cb 0.52 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1luc h ALA 59 CO 0.02 0.62 0.45 0.00 0.00 0.00 0.00 179.25 180.35 1luc h ALA 60 N 1.25 0.98 -0.19 0.00 0.00 -0.79 0.17 119.26 120.67 1luc h ALA 60 Ca 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1luc h ALA 60 Cb 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1luc h ALA 60 CO -0.05 0.22 0.09 1.25 0.00 0.00 0.00 179.25 180.76 1luc h HIS 61 N 0.87 0.28 -0.46 0.00 6.17 -0.78 0.98 115.15 122.21 1luc h HIS 61 Ca 0.30 -0.01 -0.05 0.00 0.71 0.00 0.00 60.37 61.32 1luc h HIS 61 Cb 0.07 -0.09 -0.02 0.00 2.52 0.00 0.00 27.41 29.89 1luc h HIS 61 CO -0.04 0.29 0.11 1.25 0.71 0.00 0.00 177.93 180.25 1luc h LEU 62 N 0.19 0.71 -1.17 0.26 5.85 -1.11 -1.51 115.31 118.52 1luc h LEU 62 Ca 0.07 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.51 1luc h LEU 62 Cb 0.12 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 1luc h LEU 62 CO -0.01 0.76 0.09 -0.07 -0.34 0.00 0.00 178.44 178.87 1luc h LEU 63 N 0.62 0.62 -1.22 2.25 3.38 -0.55 -2.02 115.31 118.40 1luc h LEU 63 Ca 0.14 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1luc h LEU 63 Cb 0.33 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1luc h LEU 63 CO 0.00 0.63 -0.23 1.23 0.09 0.00 0.00 178.44 180.17 1luc h GLY 64 N 0.88 0.27 1.24 0.83 0.00 -0.29 -2.70 103.07 103.29 1luc h GLY 64 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1luc h GLY 64 CO -0.00 0.18 -0.02 0.00 0.00 0.00 0.00 176.54 176.70 1luc n ALA 65 N -2.48 2.60 -2.45 3.60 0.00 -0.62 -4.91 120.51 116.25 1luc n ALA 65 Ca -0.01 -0.19 -0.23 0.00 0.00 0.00 0.00 53.44 53.01 1luc n ALA 65 Cb 0.35 -1.46 -0.09 0.00 0.00 0.00 0.00 19.45 18.24 1luc n ALA 65 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1luc s THR 66 N -2.38 0.64 0.00 0.00 -4.23 -1.00 -5.09 115.64 103.58 1luc s THR 66 Ca 0.34 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 1luc s THR 66 Cb 0.21 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.57 1luc s THR 66 CO 0.44 0.00 0.00 1.21 -0.54 0.00 0.00 174.62 175.73 1luc n GLU 67 N -0.78 0.00 -0.00 3.99 4.07 -1.26 -4.88 120.64 121.78 1luc n GLU 67 Ca -0.03 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.08 1luc n GLU 67 Cb 0.65 -0.95 -0.02 0.00 -0.06 0.00 0.00 31.44 31.07 1luc n GLU 67 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1luc n THR 68 N -2.43 0.00 -2.21 6.31 -2.24 -1.26 -5.03 114.28 107.42 1luc n THR 68 Ca 0.00 -0.43 -0.41 0.00 -2.27 0.00 0.00 64.05 60.94 1luc n THR 68 Cb 0.46 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.66 1luc n THR 68 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1luc s LEU 69 N -2.14 4.45 0.08 3.22 2.96 -1.26 -5.02 118.68 120.97 1luc s LEU 69 Ca 0.01 2.54 -0.05 0.00 -0.22 0.00 0.00 54.13 56.41 1luc s LEU 69 Cb 0.02 -3.64 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 1luc s LEU 69 CO 0.11 -0.45 0.32 0.20 -1.32 0.00 0.00 176.35 175.21 1luc s ASN 70 N -0.39 6.48 -0.04 3.68 0.02 -0.63 -4.90 114.94 119.16 1luc s ASN 70 Ca 0.50 0.54 0.02 0.00 -1.02 0.00 0.00 52.86 52.90 1luc s ASN 70 Cb -0.37 -2.07 0.01 0.00 0.02 0.00 0.00 41.25 38.83 1luc s ASN 70 CO 0.47 0.14 -0.09 -0.69 0.02 0.00 0.00 177.10 176.95 1luc s VAL 71 N -1.50 0.85 0.29 1.60 1.01 -0.11 -1.34 120.40 121.20 1luc s VAL 71 Ca 0.35 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.00 1luc s VAL 71 Cb -0.13 -0.78 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 1luc s VAL 71 CO 0.22 0.28 0.09 -0.83 0.00 0.00 0.00 175.10 174.86 1luc s GLY 72 N 0.46 1.90 -0.09 4.51 0.00 0.49 -1.12 107.32 113.47 1luc s GLY 72 Ca -0.08 -1.88 -0.01 0.00 0.00 0.00 0.00 44.72 42.75 1luc s GLY 72 CO 0.01 -1.66 -0.04 -0.51 0.00 0.00 0.00 173.10 170.90 1luc s THR 73 N -3.60 3.91 -0.43 0.90 -4.23 -0.80 -0.64 115.64 110.75 1luc s THR 73 Ca 0.37 -0.39 0.07 0.00 -1.18 0.00 0.00 61.69 60.56 1luc s THR 73 Cb 0.08 -2.64 0.23 0.00 1.34 0.00 0.00 72.50 71.51 1luc s THR 73 CO 0.15 0.58 0.61 0.00 -0.54 0.00 0.00 174.62 175.42 1luc n ALA 74 N 2.50 1.08 -3.11 3.99 0.00 0.62 -1.97 120.51 123.63 1luc n ALA 74 Ca -0.18 -2.62 -0.10 0.00 0.00 0.00 0.00 53.44 50.55 1luc n ALA 74 Cb 0.53 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.93 1luc n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1luc s ALA 75 N -0.32 -0.66 0.33 0.00 0.00 -1.26 -3.97 121.76 115.89 1luc s ALA 75 Ca 0.33 -0.41 -0.28 0.00 0.00 0.00 0.00 51.96 51.60 1luc s ALA 75 Cb 0.15 0.84 -0.10 0.00 0.00 0.00 0.00 23.12 24.02 1luc s ALA 75 CO -0.16 -0.75 1.23 0.42 0.00 0.00 0.00 175.76 176.51 1luc s ILE 76 N -3.90 2.97 -0.78 0.00 -1.09 0.17 -3.95 121.20 114.64 1luc s ILE 76 Ca 0.11 0.95 -0.21 0.00 -2.23 0.00 0.00 60.65 59.27 1luc s ILE 76 Cb 0.00 -3.59 0.09 0.00 -1.58 0.00 0.00 42.46 37.38 1luc s ILE 76 CO -0.03 0.20 1.06 -0.69 -1.23 0.00 0.00 174.94 174.26 1luc s VAL 77 N -1.19 4.42 0.16 2.92 1.01 -1.26 -0.39 120.40 126.06 1luc s VAL 77 Ca 0.49 -0.78 -0.23 0.00 0.00 0.00 0.00 61.98 61.46 1luc s VAL 77 Cb -0.36 -4.75 0.05 0.00 0.00 0.00 0.00 36.38 31.32 1luc s VAL 77 CO 0.47 -1.52 1.60 0.25 0.00 0.00 0.00 175.10 175.90 1luc h LEU 78 N 11.18 -1.08 -2.05 3.92 5.85 -1.27 -3.17 115.31 128.70 1luc h LEU 78 Ca -0.10 0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.83 1luc h LEU 78 Cb 1.05 0.50 -0.00 0.00 0.37 0.00 0.00 40.66 42.58 1luc h LEU 78 CO 1.18 -0.32 0.06 -0.65 -0.34 0.00 0.00 178.44 178.36 1luc h PRO 79 N -0.26 0.00 0.00 5.25 0.11 -1.79 -3.24 132.00 132.07 1luc h PRO 79 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1luc h PRO 79 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1luc h PRO 79 CO -0.53 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.51 1luc n THR 80 N -4.43 0.00 -4.06 -1.15 -2.24 -1.20 -4.82 114.28 96.38 1luc n THR 80 Ca -0.01 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.66 1luc n THR 80 Cb 0.17 -0.23 -0.11 0.00 -2.10 0.00 0.00 70.33 68.06 1luc n THR 80 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1luc s ALA 81 N -2.00 0.50 0.10 6.98 0.00 -1.23 -4.89 121.76 121.22 1luc s ALA 81 Ca 0.20 -0.89 -0.31 0.00 0.00 0.00 0.00 51.96 50.95 1luc s ALA 81 Cb 0.09 0.13 -0.11 0.00 0.00 0.00 0.00 23.12 23.24 1luc s ALA 81 CO 0.15 -0.16 1.86 1.58 0.00 0.00 0.00 175.76 179.19 1luc n HIS 82 N 1.02 2.59 0.21 0.00 -0.00 -1.26 -4.88 115.22 112.90 1luc n HIS 82 Ca -0.20 -0.17 0.11 0.00 0.46 0.00 0.00 57.72 57.92 1luc n HIS 82 Cb 0.57 -2.74 0.67 0.00 -0.12 0.00 0.00 29.99 28.37 1luc n HIS 82 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1luc h PRO 83 N 8.87 0.00 -0.16 1.57 0.13 -1.93 -1.56 132.00 138.92 1luc h PRO 83 Ca -0.47 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.45 1luc h PRO 83 Cb 1.23 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.37 1luc h PRO 83 CO 0.95 0.00 -0.70 0.28 -0.23 0.00 0.00 178.00 178.29 1luc h VAL 84 N 0.00 1.29 -0.59 1.56 2.07 -1.96 -0.96 116.25 117.66 1luc h VAL 84 Ca 0.05 -1.91 -0.08 0.00 0.82 0.00 0.00 66.70 65.57 1luc h VAL 84 Cb 0.19 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 1luc h VAL 84 CO -0.00 0.60 0.04 0.03 0.02 0.00 0.00 177.57 178.26 1luc h ARG 85 N 0.47 1.01 -0.37 1.57 3.08 -1.80 -1.79 114.38 116.54 1luc h ARG 85 Ca -0.04 -0.29 -0.09 0.00 0.07 0.00 0.00 59.98 59.62 1luc h ARG 85 Cb 1.33 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.26 1luc h ARG 85 CO 0.15 0.97 -0.16 1.96 -1.07 0.00 0.00 179.97 181.82 1luc h GLN 86 N 0.93 0.68 -0.38 0.04 4.20 -1.24 -1.00 115.11 118.34 1luc h GLN 86 Ca 0.18 -0.23 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 1luc h GLN 86 Cb 0.49 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 1luc h GLN 86 CO 0.02 0.80 -0.12 0.00 -0.67 0.00 0.00 178.83 178.86 1luc h ALA 87 N 1.22 1.08 -0.31 3.87 0.00 -0.70 -0.46 119.26 123.96 1luc h ALA 87 Ca 0.10 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1luc h ALA 87 Cb 0.61 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1luc h ALA 87 CO 0.04 0.57 0.09 0.93 0.00 0.00 0.00 179.25 180.88 1luc h GLU 88 N 0.62 0.48 -0.08 0.00 5.08 -1.04 -1.39 114.58 118.25 1luc h GLU 88 Ca 0.11 -0.11 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1luc h GLU 88 Cb 0.56 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 1luc h GLU 88 CO 0.04 0.53 -0.14 -0.44 -1.00 0.00 0.00 179.01 177.99 1luc h ASP 89 N 0.33 -0.43 -0.42 1.42 3.32 -0.78 0.07 116.42 119.93 1luc h ASP 89 Ca 0.10 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 1luc h ASP 89 Cb 0.25 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 1luc h ASP 89 CO -0.00 -0.19 0.24 0.58 -1.72 0.00 0.00 179.24 178.15 1luc h VAL 90 N -0.20 1.15 -0.23 -1.35 2.07 -1.02 0.27 116.25 116.93 1luc h VAL 90 Ca 0.07 -0.36 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 1luc h VAL 90 Cb 0.30 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1luc h VAL 90 CO -0.19 0.15 -0.17 0.78 0.02 0.00 0.00 177.57 178.16 1luc h ASN 91 N 0.54 0.39 -0.31 0.57 2.35 -1.03 -0.26 115.58 117.84 1luc h ASN 91 Ca 0.15 -0.11 -0.05 0.00 -0.55 0.00 0.00 56.30 55.74 1luc h ASN 91 Cb 0.03 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1luc h ASN 91 CO -0.03 0.59 -0.00 -0.07 -1.65 0.00 0.00 177.43 176.27 1luc h LEU 92 N 0.37 0.53 -0.52 1.61 3.38 -0.51 -0.09 115.31 120.09 1luc h LEU 92 Ca 0.07 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1luc h LEU 92 Cb 0.52 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1luc h LEU 92 CO 0.03 0.72 0.33 -0.07 0.09 0.00 0.00 178.44 179.54 1luc h LEU 93 N 0.34 0.56 -0.19 1.67 3.38 -0.61 0.20 115.31 120.67 1luc h LEU 93 Ca 0.09 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.07 1luc h LEU 93 Cb 0.44 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1luc h LEU 93 CO 0.02 0.40 0.03 -0.78 0.09 0.00 0.00 178.44 178.20 1luc h ASP 94 N 0.67 0.00 0.26 -0.43 3.58 -0.92 -1.31 116.42 118.26 1luc h ASP 94 Ca 0.20 0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 1luc h ASP 94 Cb -0.04 0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.06 1luc h ASP 94 CO -0.06 0.03 -0.12 1.56 -2.88 0.00 0.00 179.24 177.76 1luc h GLN 95 N 0.11 -0.33 -0.79 0.28 1.08 -0.83 0.05 115.11 114.68 1luc h GLN 95 Ca 0.08 0.02 0.10 0.00 -1.45 0.00 0.00 58.65 57.41 1luc h GLN 95 Cb 0.08 0.08 -0.08 0.00 -0.05 0.00 0.00 27.48 27.51 1luc h GLN 95 CO -0.11 0.02 0.43 0.52 -0.95 0.00 0.00 178.83 178.73 1luc h MET 96 N -0.75 0.68 -0.01 1.46 2.86 -0.57 -2.24 114.93 116.36 1luc h MET 96 Ca -0.04 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1luc h MET 96 Cb 0.50 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1luc h MET 96 CO 0.06 0.45 -0.11 -1.13 1.06 0.00 0.00 176.91 177.24 1luc n SER 97 N -4.80 0.77 -3.34 1.22 3.41 -0.50 -4.96 113.62 105.42 1luc n SER 97 Ca 0.13 -0.88 -0.16 0.00 -0.26 0.00 0.00 58.87 57.69 1luc n SER 97 Cb 0.30 -0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.33 1luc n SER 97 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1luc n LYS 98 N -0.65 -6.10 -0.97 4.33 5.02 -0.62 -3.68 118.16 115.49 1luc n LYS 98 Ca 0.16 0.82 0.00 0.00 -2.02 0.00 0.00 58.31 57.27 1luc n LYS 98 Cb 0.29 -5.76 0.00 0.00 -0.02 0.00 0.00 35.03 29.54 1luc n LYS 98 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1luc n GLY 99 N -1.13 0.40 0.96 0.72 0.00 -0.09 -4.96 105.19 101.08 1luc n GLY 99 Ca -0.26 -1.05 0.12 0.00 0.00 0.00 0.00 46.02 44.83 1luc n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1luc n ARG 100 N -2.97 2.28 -3.38 1.61 1.74 -1.24 -4.93 116.66 109.77 1luc n ARG 100 Ca 0.00 -1.90 -0.38 0.00 -0.77 0.00 0.00 57.85 54.80 1luc n ARG 100 Cb 0.00 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 29.90 1luc n ARG 100 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1luc s PHE 101 N -1.73 3.76 -0.13 -1.55 5.36 -1.26 -0.93 117.98 121.49 1luc s PHE 101 Ca 0.35 1.13 0.01 0.00 -0.96 0.00 0.00 56.93 57.46 1luc s PHE 101 Cb 0.21 -2.39 0.02 0.00 -0.34 0.00 0.00 43.02 40.52 1luc s PHE 101 CO 0.31 0.60 -0.16 1.03 -1.46 0.00 0.00 175.22 175.54 1luc s ARG 102 N -1.18 2.36 -1.00 10.12 1.81 -0.28 -4.20 118.95 126.58 1luc s ARG 102 Ca 0.28 -0.60 -0.13 0.00 -1.72 0.00 0.00 55.73 53.56 1luc s ARG 102 Cb -0.18 -2.07 0.23 0.00 -0.45 0.00 0.00 34.95 32.48 1luc s ARG 102 CO 0.17 -0.15 1.03 0.12 -0.68 0.00 0.00 175.30 175.79 1luc s PHE 103 N 1.22 3.87 0.03 -0.53 5.36 0.31 -1.91 117.98 126.32 1luc s PHE 103 Ca -0.01 -2.23 -0.27 0.00 -0.96 0.00 0.00 56.93 53.46 1luc s PHE 103 Cb -0.14 -3.94 -0.05 0.00 -0.34 0.00 0.00 43.02 38.55 1luc s PHE 103 CO -0.06 -1.08 0.85 0.20 -1.46 0.00 0.00 175.22 173.66 1luc s GLY 104 N 2.07 2.84 0.16 13.12 0.00 -0.83 -1.58 107.32 123.09 1luc s GLY 104 Ca 0.28 0.38 0.06 0.00 0.00 0.00 0.00 44.72 45.44 1luc s GLY 104 CO -0.08 1.32 -0.12 -0.26 0.00 0.00 0.00 173.10 173.96 1luc s ILE 105 N 0.32 1.36 0.22 0.90 -4.36 0.00 -0.65 121.20 118.99 1luc s ILE 105 Ca 0.43 -2.01 -0.14 0.00 -0.26 0.00 0.00 60.65 58.67 1luc s ILE 105 Cb -0.21 -1.82 0.01 0.00 1.25 0.00 0.00 42.46 41.69 1luc s ILE 105 CO 0.25 -0.63 0.48 0.00 0.24 0.00 0.00 174.94 175.28 1luc h ARG 107 N 2.27 0.70 0.00 0.00 3.08 -1.85 -0.14 114.38 118.44 1luc h ARG 107 Ca -0.27 -0.36 0.00 0.00 0.07 0.00 0.00 59.98 59.41 1luc h ARG 107 Cb 1.25 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1luc h ARG 107 CO 0.37 0.98 0.00 0.41 -1.07 0.00 0.00 179.97 180.66 1luc n GLY 108 N 0.13 2.93 0.05 0.04 0.00 -1.26 -4.50 105.19 102.58 1luc n GLY 108 Ca -0.04 -1.31 0.02 0.00 0.00 0.00 0.00 46.02 44.69 1luc n GLY 108 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1luc n LEU 109 N 0.00 0.00 -4.52 0.99 4.77 -1.26 -4.98 117.00 112.01 1luc n LEU 109 Ca 0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.62 1luc n LEU 109 Cb 0.00 0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 41.19 1luc n LEU 109 CO 0.00 0.22 -0.26 -0.31 -1.33 0.00 0.00 177.39 175.71 1luc s TYR 110 N -3.04 3.14 0.51 -1.77 2.02 -1.26 -4.98 117.35 111.97 1luc s TYR 110 Ca -0.09 -0.21 0.19 0.00 -0.37 0.00 0.00 57.07 56.59 1luc s TYR 110 Cb 0.10 -2.21 1.26 0.00 -0.40 0.00 0.00 41.96 40.71 1luc s TYR 110 CO 0.85 -0.19 2.06 0.22 -1.57 0.00 0.00 175.55 176.92 1luc h ASP 111 N 7.83 0.08 -0.83 2.29 3.58 -1.88 -1.92 116.42 125.57 1luc h ASP 111 Ca -0.37 0.00 0.08 0.00 0.42 0.00 0.00 57.03 57.16 1luc h ASP 111 Cb 1.18 -0.02 -0.06 0.00 1.72 0.00 0.00 39.33 42.15 1luc h ASP 111 CO 0.60 0.05 0.54 0.07 -2.88 0.00 0.00 179.24 177.63 1luc h LYS 112 N 0.09 0.82 -0.49 0.28 2.10 -1.92 -0.49 116.57 116.96 1luc h LYS 112 Ca 0.15 -0.05 -0.04 0.00 -2.00 0.00 0.00 60.65 58.71 1luc h LYS 112 Cb 0.48 -0.19 -0.02 0.00 -0.90 0.00 0.00 32.23 31.61 1luc h LYS 112 CO -0.01 0.54 0.17 -0.44 -2.00 0.00 0.00 179.45 177.71 1luc h ASP 113 N 0.85 0.71 -0.42 7.07 5.19 -1.73 -1.60 116.42 126.49 1luc h ASP 113 Ca 0.37 -0.20 -0.03 0.00 -0.62 0.00 0.00 57.03 56.56 1luc h ASP 113 Cb 0.34 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.65 1luc h ASP 113 CO -0.14 0.72 0.14 -0.26 -3.12 0.00 0.00 179.24 176.57 1luc h PHE 114 N 0.66 0.67 -0.14 4.55 -1.00 -1.46 -0.27 116.94 119.95 1luc h PHE 114 Ca 0.16 -0.06 0.03 0.00 2.81 0.00 0.00 57.97 60.91 1luc h PHE 114 Cb 0.25 -0.20 -0.03 0.00 3.61 0.00 0.00 35.95 39.59 1luc h PHE 114 CO 0.01 0.61 -0.06 -0.09 -1.61 0.00 0.00 178.31 177.18 1luc h ARG 115 N 0.54 -0.03 -0.12 1.51 9.65 -0.92 0.30 114.38 125.32 1luc h ARG 115 Ca 0.14 0.00 -0.20 0.00 -1.10 0.00 0.00 59.98 58.82 1luc h ARG 115 Cb 0.25 0.01 0.01 0.00 -1.39 0.00 0.00 29.97 28.85 1luc h ARG 115 CO -0.01 -0.02 -0.70 0.28 2.80 0.00 0.00 179.97 182.33 1luc h VAL 116 N -0.03 1.31 -0.00 0.20 2.07 -1.25 -3.26 116.25 115.29 1luc h VAL 116 Ca 0.07 -1.95 0.00 0.00 0.82 0.00 0.00 66.70 65.65 1luc h VAL 116 Cb 0.14 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1luc h VAL 116 CO -0.16 0.60 -0.04 0.49 0.02 0.00 0.00 177.57 178.48 1luc n PHE 117 N -4.05 0.00 -2.63 1.57 3.72 -0.12 -4.94 117.46 111.01 1luc n PHE 117 Ca -0.08 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.25 1luc n PHE 117 Cb 0.70 -0.24 0.03 0.00 -0.94 0.00 0.00 39.48 39.04 1luc n PHE 117 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1luc n GLY 118 N 1.27 0.23 3.43 1.37 0.00 0.35 -4.97 105.19 106.88 1luc n GLY 118 Ca 0.15 -0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 1luc n GLY 118 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1luc s THR 119 N -3.13 2.31 -0.51 2.61 2.01 0.80 -5.02 115.64 114.70 1luc s THR 119 Ca 0.06 -2.24 -0.17 0.00 0.31 0.00 0.00 61.69 59.65 1luc s THR 119 Cb -0.03 -2.18 0.08 0.00 0.01 0.00 0.00 72.50 70.38 1luc s THR 119 CO 0.26 -0.33 0.54 -0.62 -0.69 0.00 0.00 174.62 173.78 1luc s ASP 120 N -3.17 6.19 0.57 3.53 -1.08 -1.26 -4.33 116.67 117.11 1luc s ASP 120 Ca 0.25 -1.25 0.28 0.00 -0.52 0.00 0.00 52.55 51.31 1luc s ASP 120 Cb -0.05 -2.24 1.49 0.00 -1.46 0.00 0.00 42.92 40.66 1luc s ASP 120 CO 0.12 -0.83 1.99 -0.03 0.52 0.00 0.00 175.17 176.93 1luc h MET 121 N 8.93 0.00 0.00 4.34 1.85 -1.94 0.35 114.93 128.46 1luc h MET 121 Ca -0.28 0.00 -0.00 0.00 -0.61 0.00 0.00 59.70 58.80 1luc h MET 121 Cb 1.10 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 33.13 1luc h MET 121 CO 0.96 0.00 -0.01 -0.44 -0.40 0.00 0.00 176.91 177.02 1luc h ASP 122 N 0.00 0.00 -0.23 1.39 3.32 -2.03 -2.09 116.42 116.79 1luc h ASP 122 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1luc h ASP 122 Cb 0.96 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.51 1luc h ASP 122 CO -0.00 0.01 0.00 0.59 -1.72 0.00 0.00 179.24 178.12 1luc n ASN 123 N -3.20 3.62 -0.31 6.45 5.03 0.12 -4.77 115.26 122.21 1luc n ASN 123 Ca -0.02 -2.98 0.12 0.00 0.87 0.00 0.00 54.58 52.57 1luc n ASN 123 Cb 0.14 -0.51 0.29 0.00 -1.02 0.00 0.00 39.78 38.68 1luc n ASN 123 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 1luc h SER 124 N 1.56 0.47 0.16 6.41 4.64 -1.37 -0.90 113.55 124.51 1luc h SER 124 Ca 0.00 0.13 -0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1luc h SER 124 Cb 1.35 0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1luc h SER 124 CO 0.18 0.10 -0.10 0.03 -0.87 0.00 0.00 176.83 176.18 1luc h ARG 125 N 0.52 -0.24 -0.86 4.77 3.08 -1.86 0.17 114.38 119.96 1luc h ARG 125 Ca 0.54 0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.61 1luc h ARG 125 Cb 0.94 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.00 1luc h ARG 125 CO -0.46 -0.16 0.56 0.00 -1.07 0.00 0.00 179.97 178.85 1luc h ALA 126 N 0.59 1.09 -0.26 0.04 0.00 -1.80 -1.67 119.26 117.25 1luc h ALA 126 Ca -0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1luc h ALA 126 Cb 0.21 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1luc h ALA 126 CO 0.01 0.50 0.08 -0.07 0.00 0.00 0.00 179.25 179.78 1luc h LEU 127 N 1.17 0.38 -0.42 0.00 3.38 -1.03 0.20 115.31 118.98 1luc h LEU 127 Ca 0.31 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 58.10 1luc h LEU 127 Cb -0.13 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1luc h LEU 127 CO -0.07 0.48 0.25 -0.03 0.09 0.00 0.00 178.44 179.16 1luc h MET 128 N 0.26 0.48 -0.55 1.13 4.05 -0.70 0.17 114.93 119.77 1luc h MET 128 Ca 0.08 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.47 1luc h MET 128 Cb 0.24 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 30.90 1luc h MET 128 CO -0.00 0.32 0.32 0.22 0.23 0.00 0.00 176.91 178.00 1luc h ASP 129 N 0.50 0.67 -0.05 1.39 3.58 -1.14 -1.06 116.42 120.30 1luc h ASP 129 Ca 0.17 -0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.55 1luc h ASP 129 Cb 0.01 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 40.89 1luc h ASP 129 CO -0.08 0.54 0.02 0.00 -2.88 0.00 0.00 179.24 176.84 1luc h TRP 131 N -0.10 1.11 -0.53 0.00 -0.00 -0.63 -1.55 115.95 114.25 1luc h TRP 131 Ca 0.02 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 58.92 1luc h TRP 131 Cb 0.19 -0.37 -0.03 0.00 -0.00 0.00 0.00 29.16 28.95 1luc h TRP 131 CO -0.01 0.70 0.31 -0.92 -0.00 0.00 0.00 178.44 178.52 1luc h TYR 132 N 1.19 0.71 -0.84 0.49 3.20 -1.09 0.28 116.97 120.91 1luc h TYR 132 Ca 0.32 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.15 1luc h TYR 132 Cb -0.13 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 37.87 1luc h TYR 132 CO -0.01 0.50 0.41 -0.44 -1.64 0.00 0.00 178.16 176.98 1luc h ASP 133 N 0.71 1.10 -0.26 -2.11 3.32 -0.86 0.90 116.42 119.21 1luc h ASP 133 Ca 0.19 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 1luc h ASP 133 Cb 0.01 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 1luc h ASP 133 CO -0.03 0.93 -0.00 -0.07 -1.72 0.00 0.00 179.24 178.34 1luc h LEU 134 N 1.20 0.46 -0.51 1.55 3.38 -0.94 -1.59 115.31 118.85 1luc h LEU 134 Ca 0.29 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1luc h LEU 134 Cb 0.12 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1luc h LEU 134 CO -0.04 0.65 0.22 0.24 0.09 0.00 0.00 178.44 179.60 1luc h MET 135 N 0.25 0.76 -0.61 1.13 2.86 -0.68 -1.96 114.93 116.68 1luc h MET 135 Ca 0.07 -0.13 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1luc h MET 135 Cb 0.42 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 1luc h MET 135 CO 0.01 0.66 0.31 -0.22 1.06 0.00 0.00 176.91 178.73 1luc h LYS 136 N 0.69 0.85 -0.60 1.72 1.63 -0.79 0.91 116.57 120.98 1luc h LYS 136 Ca 0.17 -0.10 -0.00 0.00 -0.85 0.00 0.00 60.65 59.87 1luc h LYS 136 Cb 0.18 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.61 1luc h LYS 136 CO -0.02 0.65 0.36 1.49 -3.45 0.00 0.00 179.45 178.49 1luc h GLU 137 N 0.85 0.81 -0.48 1.90 4.81 -0.90 0.14 114.58 121.72 1luc h GLU 137 Ca 0.21 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1luc h GLU 137 Cb 0.07 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1luc h GLU 137 CO -0.03 0.58 0.15 0.78 -0.73 0.00 0.00 179.01 179.76 1luc h GLY 138 N 0.81 0.80 0.98 1.92 0.00 -0.48 0.37 103.07 107.47 1luc h GLY 138 Ca 0.22 -0.47 0.01 0.00 0.00 0.00 0.00 47.33 47.08 1luc h GLY 138 CO -0.04 0.44 0.52 0.74 0.00 0.00 0.00 176.54 178.21 1luc h PHE 139 N 0.64 0.99 0.22 5.60 0.04 -0.47 -0.12 116.94 123.84 1luc h PHE 139 Ca 0.16 0.02 -0.32 0.00 2.80 0.00 0.00 57.97 60.63 1luc h PHE 139 Cb 0.27 -0.33 0.03 0.00 2.20 0.00 0.00 35.95 38.12 1luc h PHE 139 CO 0.01 0.61 -1.41 -0.91 -0.60 0.00 0.00 178.31 176.01 1luc h ASN 140 N 1.06 0.76 0.00 2.17 -0.26 -0.43 -3.40 115.58 115.48 1luc h ASN 140 Ca 0.30 -0.80 0.00 0.00 -0.56 0.00 0.00 56.30 55.23 1luc h ASN 140 Cb -0.10 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 36.92 1luc h ASN 140 CO -0.07 1.63 -1.63 -0.62 -1.06 0.00 0.00 177.43 175.68 1luc n GLU 141 N -3.68 0.57 -0.56 0.81 -0.58 0.13 -4.96 120.64 112.37 1luc n GLU 141 Ca -0.15 -0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.46 1luc n GLU 141 Cb 1.08 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 30.60 1luc n GLU 141 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1luc n GLY 142 N 1.62 0.74 3.23 0.62 0.00 -0.06 -5.02 105.19 106.33 1luc n GLY 142 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1luc n GLY 142 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1luc s TYR 143 N -2.40 0.01 -0.03 1.61 1.51 -1.26 -0.52 117.35 116.27 1luc s TYR 143 Ca 0.00 -0.32 -0.04 0.00 -1.01 0.00 0.00 57.07 55.70 1luc s TYR 143 Cb 0.00 0.04 0.01 0.00 -0.11 0.00 0.00 41.96 41.90 1luc s TYR 143 CO 0.00 -0.55 0.09 0.42 -1.11 0.00 0.00 175.55 174.40 1luc s ILE 144 N -3.36 0.02 -0.01 2.71 1.01 -0.71 -3.34 121.20 117.51 1luc s ILE 144 Ca 0.01 -0.17 -0.06 0.00 0.00 0.00 0.00 60.65 60.43 1luc s ILE 144 Cb 0.02 -0.19 0.00 0.00 0.01 0.00 0.00 42.46 42.30 1luc s ILE 144 CO -0.08 -0.09 0.13 0.00 0.00 0.00 0.00 174.94 174.90 1luc s ALA 145 N -0.26 -0.32 -0.01 9.38 0.00 -1.26 -1.17 121.76 128.12 1luc s ALA 145 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 1luc s ALA 145 Cb -0.02 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.11 1luc s ALA 145 CO 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 175.76 175.62 1luc s ALA 146 N -0.99 -0.06 -0.50 0.00 0.00 -0.74 -4.98 121.76 114.50 1luc s ALA 146 Ca -0.11 0.03 0.07 0.00 0.00 0.00 0.00 51.96 51.95 1luc s ALA 146 Cb -0.06 -0.03 0.19 0.00 0.00 0.00 0.00 23.12 23.22 1luc s ALA 146 CO 0.01 -0.03 0.69 0.34 0.00 0.00 0.00 175.76 176.77 1luc s ASP 147 N -0.13 -1.24 0.14 0.00 -1.08 -1.22 -0.63 116.67 112.52 1luc s ASP 147 Ca -0.02 -1.71 0.02 0.00 -0.52 0.00 0.00 52.55 50.33 1luc s ASP 147 Cb -0.01 1.74 -0.01 0.00 -1.46 0.00 0.00 42.92 43.18 1luc s ASP 147 CO -0.00 -0.07 0.15 -0.46 0.52 0.00 0.00 175.17 175.30 1luc n ASN 148 N 3.13 -0.38 0.26 -0.34 0.23 0.26 -5.00 115.26 113.41 1luc n ASN 148 Ca 0.18 -1.90 0.16 0.00 -0.53 0.00 0.00 54.58 52.48 1luc n ASN 148 Cb 0.55 0.82 0.53 0.00 -2.08 0.00 0.00 39.78 39.61 1luc n ASN 148 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1luc h GLU 149 N 0.00 0.00 0.05 -3.83 4.11 -2.04 -3.23 114.58 109.64 1luc h GLU 149 Ca -0.10 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 58.98 1luc h GLU 149 Cb 0.51 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 1luc h GLU 149 CO 0.15 0.01 -2.05 0.72 0.07 0.00 0.00 179.01 177.91 1luc n HIS 150 N -3.10 0.82 -3.58 2.06 8.25 -1.26 -5.02 115.22 113.38 1luc n HIS 150 Ca 0.02 0.22 -0.13 0.00 -0.26 0.00 0.00 57.72 57.56 1luc n HIS 150 Cb 0.38 -1.12 -0.05 0.00 1.12 0.00 0.00 29.99 30.31 1luc n HIS 150 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1luc s ILE 151 N -2.55 0.04 -0.09 1.59 2.07 -1.22 -5.17 121.20 115.87 1luc s ILE 151 Ca -0.18 -0.29 -0.04 0.00 -1.41 0.00 0.00 60.65 58.73 1luc s ILE 151 Cb 0.07 -0.99 0.04 0.00 0.13 0.00 0.00 42.46 41.72 1luc s ILE 151 CO 0.76 -0.16 0.20 -0.75 -1.91 0.00 0.00 174.94 173.08 1luc s LYS 152 N -2.62 0.16 -0.09 3.50 2.20 -1.26 -0.57 119.74 121.06 1luc s LYS 152 Ca -0.04 0.44 -0.30 0.00 -0.36 0.00 0.00 55.97 55.71 1luc s LYS 152 Cb -0.00 -0.12 0.11 0.00 -1.51 0.00 0.00 37.83 36.30 1luc s LYS 152 CO -0.03 -0.15 0.89 -0.59 -0.36 0.00 0.00 175.35 175.10 1luc s PHE 153 N 1.11 -0.43 0.72 4.03 -0.12 0.20 -4.95 117.98 118.53 1luc s PHE 153 Ca -0.08 0.63 -0.11 0.00 -0.05 0.00 0.00 56.93 57.32 1luc s PHE 153 Cb -0.10 0.47 0.02 0.00 -0.63 0.00 0.00 43.02 42.78 1luc s PHE 153 CO -0.07 -0.47 1.08 -1.25 -0.05 0.00 0.00 175.22 174.47 1luc s PRO 154 N -1.69 2.66 0.18 1.99 0.04 -1.26 -1.79 135.00 135.12 1luc s PRO 154 Ca -0.02 1.11 -0.32 0.00 0.04 0.00 0.00 61.00 61.82 1luc s PRO 154 Cb -0.00 -1.95 -0.11 0.00 0.04 0.00 0.00 34.50 32.47 1luc s PRO 154 CO 0.00 -1.33 1.73 0.21 0.04 0.00 0.00 177.00 177.65 1luc s LYS 155 N -4.80 4.14 0.10 4.56 2.20 -1.26 -4.62 119.74 120.05 1luc s LYS 155 Ca 0.61 2.57 0.04 0.00 -0.36 0.00 0.00 55.97 58.83 1luc s LYS 155 Cb -0.16 -3.22 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 1luc s LYS 155 CO 0.52 -0.76 -0.11 0.96 -0.36 0.00 0.00 175.35 175.61 1luc s ILE 156 N 1.58 1.00 0.07 5.43 -5.25 -0.32 -4.96 121.20 118.75 1luc s ILE 156 Ca 0.76 -1.63 -0.30 0.00 -0.99 0.00 0.00 60.65 58.48 1luc s ILE 156 Cb -0.48 -1.36 -0.05 0.00 2.95 0.00 0.00 42.46 43.52 1luc s ILE 156 CO 0.33 -0.52 1.04 -1.58 -1.79 0.00 0.00 174.94 172.41 1luc s GLN 157 N -2.72 4.58 -0.27 0.37 0.74 -1.26 -1.74 119.66 119.36 1luc s GLN 157 Ca 0.05 1.54 -0.12 0.00 0.05 0.00 0.00 55.36 56.89 1luc s GLN 157 Cb -0.04 -3.38 -0.05 0.00 1.10 0.00 0.00 33.01 30.64 1luc s GLN 157 CO 0.01 0.01 0.22 -1.17 -0.55 0.00 0.00 175.29 173.80 1luc s LEU 158 N 0.49 4.04 0.14 3.68 2.96 0.32 -4.92 118.68 125.39 1luc s LEU 158 Ca 0.51 0.06 0.07 0.00 -0.22 0.00 0.00 54.13 54.55 1luc s LEU 158 Cb -0.25 -2.17 -0.04 0.00 0.50 0.00 0.00 46.19 44.23 1luc s LEU 158 CO 0.30 -0.06 -0.06 0.20 -1.32 0.00 0.00 176.35 175.41 1luc s ASN 159 N 1.65 4.53 0.81 3.68 0.01 -1.26 -4.41 114.94 119.95 1luc s ASN 159 Ca 0.08 -0.42 -0.03 0.00 -0.71 0.00 0.00 52.86 51.79 1luc s ASN 159 Cb -0.16 -0.89 0.06 0.00 0.41 0.00 0.00 41.25 40.67 1luc s ASN 159 CO 0.10 0.13 0.37 -0.81 -1.51 0.00 0.00 177.10 175.38 1luc n PRO 160 N 0.29 -0.10 -1.83 -0.60 -0.04 -1.26 -4.57 135.00 126.89 1luc n PRO 160 Ca -0.11 -0.70 -0.31 0.00 -0.04 0.00 0.00 63.50 62.34 1luc n PRO 160 Cb 0.54 -0.34 0.02 0.00 -0.04 0.00 0.00 33.50 33.68 1luc n PRO 160 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1luc s SER 161 N -2.38 5.90 0.33 3.54 1.04 -1.26 -4.87 113.70 116.00 1luc s SER 161 Ca 0.22 1.55 -0.28 0.00 0.48 0.00 0.00 55.95 57.92 1luc s SER 161 Cb -0.01 -2.49 -0.10 0.00 0.10 0.00 0.00 66.02 63.52 1luc s SER 161 CO 0.15 -1.09 1.23 0.00 0.98 0.00 0.00 173.24 174.51 1luc s ALA 162 N -2.99 3.41 -0.02 5.32 0.00 -1.26 -4.78 121.76 121.44 1luc s ALA 162 Ca 0.57 1.12 -0.17 0.00 0.00 0.00 0.00 51.96 53.49 1luc s ALA 162 Cb -0.13 -3.43 -0.33 0.00 0.00 0.00 0.00 23.12 19.24 1luc s ALA 162 CO 0.50 -0.51 0.88 -0.92 0.00 0.00 0.00 175.76 175.71 1luc h TYR 163 N 3.33 0.78 -3.36 0.00 3.20 -1.84 -3.44 116.97 115.64 1luc h TYR 163 Ca -0.48 -0.57 -0.58 0.00 3.14 0.00 0.00 58.73 60.24 1luc h TYR 163 Cb 1.22 -0.03 -0.08 0.00 1.54 0.00 0.00 36.73 39.39 1luc h TYR 163 CO 0.56 1.51 -0.02 0.99 -1.64 0.00 0.00 178.16 179.57 1luc s THR 164 N -2.54 5.11 0.00 1.81 2.01 -1.26 -4.98 115.64 115.79 1luc s THR 164 Ca -0.12 1.14 -0.34 0.00 0.31 0.00 0.00 61.69 62.67 1luc s THR 164 Cb 0.03 -3.91 -0.13 0.00 0.01 0.00 0.00 72.50 68.51 1luc s THR 164 CO 0.88 0.26 1.75 1.67 -0.69 0.00 0.00 174.62 178.49 1luc n GLN 165 N 4.02 2.11 -0.79 4.92 0.00 -1.26 -0.14 117.38 126.25 1luc n GLN 165 Ca -0.04 0.77 0.00 0.00 -0.00 0.00 0.00 57.00 57.73 1luc n GLN 165 Cb 0.51 -2.58 0.00 0.00 0.00 0.00 0.00 30.24 28.17 1luc n GLN 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1luc n GLY 166 N 3.99 0.75 0.00 1.69 0.00 -1.26 -4.89 105.19 105.47 1luc n GLY 166 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1luc n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1luc n GLY 167 N -2.39 0.07 3.66 -0.02 0.00 0.80 -4.69 105.19 102.62 1luc n GLY 167 Ca 0.00 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 1luc n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1luc n ALA 168 N 0.20 0.81 -1.68 4.61 0.00 -1.26 -4.76 120.51 118.44 1luc n ALA 168 Ca 0.00 0.22 -0.45 0.00 0.00 0.00 0.00 53.44 53.21 1luc n ALA 168 Cb 0.00 -2.19 -0.04 0.00 0.00 0.00 0.00 19.45 17.22 1luc n ALA 168 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1luc n PRO 169 N -0.08 2.34 -3.52 0.00 -0.02 -1.26 -4.65 135.00 127.80 1luc n PRO 169 Ca 0.08 0.85 -0.36 0.00 -2.02 0.00 0.00 63.50 62.05 1luc n PRO 169 Cb 0.40 -2.65 -0.06 0.00 -0.02 0.00 0.00 33.50 31.17 1luc n PRO 169 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1luc s VAL 170 N 1.54 5.04 0.05 -1.45 1.01 -1.26 -0.53 120.40 124.80 1luc s VAL 170 Ca 0.80 0.66 0.05 0.00 0.00 0.00 0.00 61.98 63.49 1luc s VAL 170 Cb -0.63 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.04 1luc s VAL 170 CO 0.38 0.41 -0.15 -0.31 0.00 0.00 0.00 175.10 175.44 1luc s TYR 171 N -1.26 1.26 -0.04 5.22 1.51 -0.61 -4.15 117.35 119.27 1luc s TYR 171 Ca 0.29 -0.39 0.04 0.00 -1.01 0.00 0.00 57.07 56.00 1luc s TYR 171 Cb -0.15 -0.73 -0.00 0.00 -0.11 0.00 0.00 41.96 40.96 1luc s TYR 171 CO 0.16 0.05 -0.16 0.08 -1.11 0.00 0.00 175.55 174.57 1luc s VAL 172 N -1.01 1.38 -0.53 0.71 1.01 0.19 -0.82 120.40 121.33 1luc s VAL 172 Ca 0.01 -0.69 -0.22 0.00 0.00 0.00 0.00 61.98 61.08 1luc s VAL 172 Cb -0.09 -1.18 0.05 0.00 0.00 0.00 0.00 36.38 35.16 1luc s VAL 172 CO 0.02 0.40 0.80 -0.69 0.00 0.00 0.00 175.10 175.62 1luc s VAL 173 N 0.05 4.61 -0.52 2.92 1.01 -0.89 -0.88 120.40 126.70 1luc s VAL 173 Ca -0.04 -0.09 -0.18 0.00 0.00 0.00 0.00 61.98 61.68 1luc s VAL 173 Cb -0.11 -4.43 0.08 0.00 0.00 0.00 0.00 36.38 31.91 1luc s VAL 173 CO 0.02 -0.98 0.58 0.00 0.00 0.00 0.00 175.10 174.72 1luc s ALA 174 N 3.35 3.46 -1.35 5.51 0.00 -1.26 -4.75 121.76 126.72 1luc s ALA 174 Ca 0.23 -2.00 0.26 0.00 0.00 0.00 0.00 51.96 50.45 1luc s ALA 174 Cb -0.16 -3.32 0.60 0.00 0.00 0.00 0.00 23.12 20.24 1luc s ALA 174 CO 0.16 -2.02 1.47 -0.85 0.00 0.00 0.00 175.76 174.52 1luc n GLU 175 N 5.90 0.39 -4.05 0.00 0.00 -1.26 -4.82 120.64 116.80 1luc n GLU 175 Ca -0.09 -0.23 -0.08 0.00 0.00 0.00 0.00 57.16 56.76 1luc n GLU 175 Cb 0.44 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.29 1luc n GLU 175 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 1luc s SER 176 N -2.77 0.35 0.26 -1.84 1.04 -1.26 -5.01 113.70 104.47 1luc s SER 176 Ca 0.17 -0.96 -0.05 0.00 0.48 0.00 0.00 55.95 55.59 1luc s SER 176 Cb 0.18 0.26 0.32 0.00 0.10 0.00 0.00 66.02 66.89 1luc s SER 176 CO 0.62 -0.67 1.92 0.00 0.98 0.00 0.00 173.24 176.09 1luc h ALA 177 N 2.97 1.33 -0.37 5.32 0.00 -1.99 0.11 119.26 126.63 1luc h ALA 177 Ca -0.34 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 1luc h ALA 177 Cb 1.17 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1luc h ALA 177 CO 0.61 0.59 -0.04 0.66 0.00 0.00 0.00 179.25 181.07 1luc h SER 178 N 1.29 0.58 -0.00 0.00 4.64 -1.99 0.25 113.55 118.33 1luc h SER 178 Ca 0.39 -0.13 -0.15 0.00 -0.47 0.00 0.00 61.79 61.42 1luc h SER 178 Cb -0.05 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 1luc h SER 178 CO -0.11 0.68 -0.51 0.74 -0.87 0.00 0.00 176.83 176.77 1luc h THR 179 N 0.57 1.31 -0.71 2.95 2.02 -1.47 -0.41 112.91 117.18 1luc h THR 179 Ca 0.11 -1.73 0.00 0.00 0.77 0.00 0.00 66.41 65.56 1luc h THR 179 Cb 0.43 1.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.51 1luc h THR 179 CO 0.02 0.54 0.45 0.74 0.37 0.00 0.00 175.52 177.64 1luc h THR 180 N 0.45 1.19 -0.49 3.16 2.02 0.13 -0.86 112.91 118.51 1luc h THR 180 Ca 0.02 -0.40 -0.05 0.00 0.77 0.00 0.00 66.41 66.75 1luc h THR 180 Cb 1.04 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 1luc h THR 180 CO 0.10 0.20 0.13 -0.33 0.37 0.00 0.00 175.52 175.98 1luc h GLU 181 N 0.96 0.78 -0.68 6.66 5.08 -0.26 -1.70 114.58 125.43 1luc h GLU 181 Ca 0.26 -0.18 0.06 0.00 -1.00 0.00 0.00 59.36 58.49 1luc h GLU 181 Cb -0.07 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.02 1luc h GLU 181 CO -0.05 0.75 0.38 2.35 -1.00 0.00 0.00 179.01 181.44 1luc h TRP 182 N 0.67 0.69 -0.50 4.33 7.01 -0.63 -0.42 115.95 127.11 1luc h TRP 182 Ca 0.15 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.13 1luc h TRP 182 Cb 0.32 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.15 1luc h TRP 182 CO 0.02 0.33 0.10 0.00 -2.79 0.00 0.00 178.44 176.10 1luc h ALA 183 N 1.36 0.66 -0.91 2.65 0.00 -0.95 -3.06 119.26 119.00 1luc h ALA 183 Ca 0.31 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1luc h ALA 183 Cb 0.20 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1luc h ALA 183 CO -0.19 0.37 0.53 0.00 0.00 0.00 0.00 179.25 179.97 1luc h ALA 184 N 0.98 1.16 0.00 0.00 0.00 -0.57 -0.52 119.26 120.31 1luc h ALA 184 Ca 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1luc h ALA 184 Cb 0.37 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1luc h ALA 184 CO 0.01 0.63 -0.03 0.93 0.00 0.00 0.00 179.25 180.79 1luc h GLU 185 N 1.25 0.00 -0.17 0.00 5.08 -1.00 -1.73 114.58 118.01 1luc h GLU 185 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1luc h GLU 185 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1luc h GLU 185 CO -0.06 0.03 0.00 0.54 -1.00 0.00 0.00 179.01 178.52 1luc n ARG 186 N -3.56 1.64 -2.31 2.33 1.74 -0.77 -4.98 116.66 110.75 1luc n ARG 186 Ca -0.03 -1.64 -0.17 0.00 -0.77 0.00 0.00 57.85 55.24 1luc n ARG 186 Cb 0.12 -1.29 -0.01 0.00 -1.02 0.00 0.00 32.46 30.26 1luc n ARG 186 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1luc n GLY 187 N 0.76 -0.30 3.79 -0.13 0.00 -0.34 -4.99 105.19 103.98 1luc n GLY 187 Ca 0.10 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 1luc n GLY 187 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1luc s LEU 188 N -4.99 4.44 0.55 0.99 1.43 -0.39 -4.98 118.68 115.72 1luc s LEU 188 Ca 0.00 1.07 -0.19 0.00 -1.03 0.00 0.00 54.13 53.98 1luc s LEU 188 Cb 0.00 -2.78 -0.05 0.00 0.03 0.00 0.00 46.19 43.38 1luc s LEU 188 CO 0.00 0.19 1.13 -2.16 0.23 0.00 0.00 176.35 175.74 1luc s PRO 189 N -0.52 3.31 0.18 1.29 0.04 -1.26 -4.58 135.00 133.46 1luc s PRO 189 Ca 0.28 1.61 0.07 0.00 0.04 0.00 0.00 61.00 62.99 1luc s PRO 189 Cb -0.18 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1luc s PRO 189 CO 0.15 -0.88 0.04 -1.64 0.04 0.00 0.00 177.00 174.71 1luc s MET 190 N -3.34 2.54 -0.39 4.56 -1.94 -1.26 -0.63 119.30 118.84 1luc s MET 190 Ca 0.73 -1.06 -0.07 0.00 -1.71 0.00 0.00 55.69 53.58 1luc s MET 190 Cb -0.24 -2.43 0.07 0.00 2.01 0.00 0.00 34.83 34.24 1luc s MET 190 CO 0.28 0.46 0.20 0.42 -0.01 0.00 0.00 175.02 176.37 1luc s ILE 191 N -1.77 3.92 0.36 2.53 1.01 -0.06 -0.27 121.20 126.93 1luc s ILE 191 Ca 0.29 -1.44 -0.27 0.00 0.00 0.00 0.00 60.65 59.23 1luc s ILE 191 Cb -0.09 -3.40 -0.09 0.00 0.01 0.00 0.00 42.46 38.89 1luc s ILE 191 CO 0.20 -0.44 1.16 -0.76 0.00 0.00 0.00 174.94 175.10 1luc s LEU 192 N 1.37 4.31 0.55 2.97 1.43 -0.03 -4.26 118.68 125.01 1luc s LEU 192 Ca 0.02 2.36 -0.20 0.00 -1.03 0.00 0.00 54.13 55.28 1luc s LEU 192 Cb -0.22 -3.89 -0.05 0.00 0.03 0.00 0.00 46.19 42.06 1luc s LEU 192 CO 0.01 -0.52 1.23 -0.55 0.23 0.00 0.00 176.35 176.75 1luc s SER 193 N -1.01 5.47 0.00 2.29 0.15 -1.26 -2.87 113.70 116.46 1luc s SER 193 Ca 0.53 2.45 0.26 0.00 0.70 0.00 0.00 55.95 59.89 1luc s SER 193 Cb -0.32 -2.61 0.75 0.00 -1.71 0.00 0.00 66.02 62.14 1luc s SER 193 CO 0.40 -1.41 1.57 -2.67 1.20 0.00 0.00 173.24 172.33 1luc n TRP 194 N -1.18 0.00 -0.62 3.44 4.27 -1.26 -4.07 117.44 118.02 1luc n TRP 194 Ca 0.11 0.00 0.08 0.00 -3.89 0.00 0.00 57.50 53.80 1luc n TRP 194 Cb 0.48 -0.05 0.28 0.00 -1.36 0.00 0.00 31.31 30.66 1luc n TRP 194 CO 0.00 0.00 0.00 0.44 -2.29 0.00 0.00 177.69 175.84 1luc n ILE 195 N -0.09 1.78 -4.28 -1.67 -5.35 -1.26 -4.85 119.36 103.64 1luc n ILE 195 Ca 0.15 -1.35 -0.27 0.00 -0.27 0.00 0.00 62.75 61.01 1luc n ILE 195 Cb 0.38 0.10 -0.10 0.00 -1.74 0.00 0.00 39.64 38.29 1luc n ILE 195 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 1luc s ILE 196 N -1.93 3.19 0.83 7.28 -4.36 -1.26 -4.93 121.20 120.01 1luc s ILE 196 Ca 0.42 -1.59 -0.06 0.00 -0.26 0.00 0.00 60.65 59.16 1luc s ILE 196 Cb 0.28 -2.56 0.17 0.00 1.25 0.00 0.00 42.46 41.61 1luc s ILE 196 CO 0.18 -0.06 1.14 0.54 0.24 0.00 0.00 174.94 176.98 1luc s ASN 197 N -2.67 3.74 0.24 4.36 2.20 -1.26 -4.84 114.94 116.71 1luc s ASN 197 Ca 0.24 -0.23 -0.04 0.00 -0.94 0.00 0.00 52.86 51.89 1luc s ASN 197 Cb -0.09 0.05 0.43 0.00 -2.00 0.00 0.00 41.25 39.64 1luc s ASN 197 CO 0.14 -2.29 1.77 0.74 -2.94 0.00 0.00 177.10 174.53 1luc h THR 198 N -1.00 0.80 -0.71 0.54 2.02 -1.97 -1.17 112.91 111.41 1luc h THR 198 Ca -0.38 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1luc h THR 198 Cb 1.25 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.73 1luc h THR 198 CO 0.36 0.12 0.45 -0.74 0.37 0.00 0.00 175.52 176.08 1luc h HIS 199 N 0.63 0.92 -0.14 3.16 -0.00 -1.99 0.10 115.15 117.84 1luc h HIS 199 Ca 0.41 0.01 -0.11 0.00 -0.00 0.00 0.00 60.37 60.67 1luc h HIS 199 Cb 0.49 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 27.58 1luc h HIS 199 CO -0.10 0.60 -0.42 0.93 -0.00 0.00 0.00 177.93 178.95 1luc h GLU 200 N 0.97 0.31 -0.29 5.26 5.08 -1.74 -0.94 114.58 123.23 1luc h GLU 200 Ca 0.26 -0.15 -0.11 0.00 -1.00 0.00 0.00 59.36 58.36 1luc h GLU 200 Cb -0.07 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1luc h GLU 200 CO -0.05 0.68 -0.23 0.87 -1.00 0.00 0.00 179.01 179.28 1luc h LYS 201 N 0.26 0.67 -0.61 2.33 1.57 -0.63 -1.27 116.57 118.88 1luc h LYS 201 Ca 0.02 -0.33 -0.07 0.00 -1.87 0.00 0.00 60.65 58.40 1luc h LYS 201 Cb 0.85 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.14 1luc h LYS 201 CO 0.07 0.94 0.09 -0.22 -0.57 0.00 0.00 179.45 179.76 1luc h LYS 202 N 0.41 1.00 -0.22 3.15 3.64 -0.87 -1.60 116.57 122.08 1luc h LYS 202 Ca 0.05 -0.26 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 1luc h LYS 202 Cb 0.79 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1luc h LYS 202 CO 0.06 0.93 0.09 0.00 -2.27 0.00 0.00 179.45 178.26 1luc h ALA 203 N 1.15 0.29 -0.76 5.00 0.00 -1.05 -0.19 119.26 123.70 1luc h ALA 203 Ca 0.19 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1luc h ALA 203 Cb 0.42 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1luc h ALA 203 CO 0.01 -0.12 0.48 0.37 0.00 0.00 0.00 179.25 179.99 1luc h GLN 204 N 0.22 0.92 0.00 0.00 4.15 -1.04 -0.43 115.11 118.92 1luc h GLN 204 Ca 0.08 -0.06 -0.09 0.00 0.77 0.00 0.00 58.65 59.35 1luc h GLN 204 Cb 0.16 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1luc h GLN 204 CO -0.01 0.61 -0.43 -0.07 -1.93 0.00 0.00 178.83 177.00 1luc h LEU 205 N 0.94 0.00 -0.40 -2.39 3.38 -1.08 -1.66 115.31 114.11 1luc h LEU 205 Ca 0.31 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.13 1luc h LEU 205 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1luc h LEU 205 CO -0.11 0.43 -0.32 0.44 0.09 0.00 0.00 178.44 178.97 1luc h ASP 206 N 0.00 0.97 -0.37 -0.43 3.32 0.15 -0.20 116.42 119.87 1luc h ASP 206 Ca -0.00 -0.45 -0.04 0.00 0.02 0.00 0.00 57.03 56.56 1luc h ASP 206 Cb 0.90 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 1luc h ASP 206 CO 0.06 1.21 0.09 0.25 -1.72 0.00 0.00 179.24 179.13 1luc h LEU 207 N 0.75 0.56 -0.29 1.55 5.85 -0.92 -2.50 115.31 120.31 1luc h LEU 207 Ca 0.07 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.57 1luc h LEU 207 Cb 0.91 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1luc h LEU 207 CO 0.08 0.65 0.17 0.22 -0.34 0.00 0.00 178.44 179.22 1luc h TYR 208 N 0.45 0.31 -0.23 1.25 5.03 -1.17 -2.99 116.97 119.62 1luc h TYR 208 Ca 0.12 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.39 1luc h TYR 208 Cb 0.31 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.47 1luc h TYR 208 CO 0.02 0.18 -0.05 -0.91 -1.32 0.00 0.00 178.16 176.08 1luc h ASN 209 N 0.34 0.33 0.04 -2.11 2.35 -0.84 -0.62 115.58 115.08 1luc h ASN 209 Ca 0.11 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1luc h ASN 209 Cb 0.00 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.29 1luc h ASN 209 CO -0.06 0.43 -0.02 -0.33 -1.65 0.00 0.00 177.43 175.81 1luc h GLU 210 N 0.34 -0.06 0.01 0.81 5.08 -1.31 0.37 114.58 119.82 1luc h GLU 210 Ca 0.07 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1luc h GLU 210 Cb 0.32 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1luc h GLU 210 CO 0.01 -0.03 -0.01 0.28 -1.00 0.00 0.00 179.01 178.27 1luc h VAL 211 N -0.07 1.28 -0.95 3.13 2.07 -1.34 -2.66 116.25 117.72 1luc h VAL 211 Ca -0.01 -0.89 0.06 0.00 0.82 0.00 0.00 66.70 66.68 1luc h VAL 211 Cb 0.05 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 1luc h VAL 211 CO 0.01 0.23 0.61 0.00 0.02 0.00 0.00 177.57 178.44 1luc h ALA 212 N 0.58 1.31 -0.71 1.67 0.00 -1.07 -1.07 119.26 119.98 1luc h ALA 212 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1luc h ALA 212 Cb 0.39 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1luc h ALA 212 CO 0.00 0.40 0.35 1.15 0.00 0.00 0.00 179.25 181.15 1luc h THR 213 N 1.12 1.23 -0.06 0.00 2.02 -0.93 -0.58 112.91 115.71 1luc h THR 213 Ca 0.41 -0.64 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1luc h THR 213 Cb 0.15 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 66.90 1luc h THR 213 CO -0.17 0.27 0.04 -0.08 0.37 0.00 0.00 175.52 175.95 1luc h GLU 214 N 0.99 0.08 -0.00 6.66 4.81 -0.86 0.42 114.58 126.67 1luc h GLU 214 Ca 0.24 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 1luc h GLU 214 Cb 0.10 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.47 1luc h GLU 214 CO -0.03 0.05 -0.19 0.72 -0.73 0.00 0.00 179.01 178.83 1luc n HIS 215 N -4.53 0.00 -0.11 0.92 8.25 -0.56 -4.92 115.22 114.27 1luc n HIS 215 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1luc n HIS 215 Cb 0.09 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 30.93 1luc n HIS 215 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1luc n GLY 216 N 1.38 0.73 3.84 -1.41 0.00 0.14 -5.07 105.19 104.79 1luc n GLY 216 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1luc n GLY 216 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1luc s TYR 217 N -2.13 3.36 -0.63 1.61 2.02 -0.33 -4.99 117.35 116.26 1luc s TYR 217 Ca 0.00 1.39 -0.24 0.00 -0.37 0.00 0.00 57.07 57.84 1luc s TYR 217 Cb 0.00 -2.67 0.05 0.00 -0.40 0.00 0.00 41.96 38.94 1luc s TYR 217 CO 0.00 0.02 1.02 0.34 -1.57 0.00 0.00 175.55 175.36 1luc s ASP 218 N -2.22 6.25 0.51 2.29 -1.08 -1.26 -4.27 116.67 116.89 1luc s ASP 218 Ca 0.57 -0.59 0.35 0.00 -0.52 0.00 0.00 52.55 52.35 1luc s ASP 218 Cb -0.10 -2.46 1.86 0.00 -1.46 0.00 0.00 42.92 40.76 1luc s ASP 218 CO 0.16 -1.43 2.06 -0.37 0.52 0.00 0.00 175.17 176.11 1luc h VAL 219 N 6.01 0.00 0.00 1.11 -1.51 -1.94 -2.16 116.25 117.77 1luc h VAL 219 Ca -0.27 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 1luc h VAL 219 Cb 1.07 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.04 1luc h VAL 219 CO 1.16 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 177.85 1luc n THR 220 N -2.73 0.14 -0.29 7.19 -2.24 -1.26 -3.49 114.28 111.61 1luc n THR 220 Ca -0.02 -0.02 0.06 0.00 -2.27 0.00 0.00 64.05 61.79 1luc n THR 220 Cb 0.07 -0.54 0.16 0.00 -2.10 0.00 0.00 70.33 67.91 1luc n THR 220 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1luc n LYS 221 N -1.61 2.88 -3.04 -0.78 4.76 -0.81 -4.96 118.16 114.59 1luc n LYS 221 Ca 0.07 -2.13 -0.40 0.00 -2.87 0.00 0.00 58.31 52.98 1luc n LYS 221 Cb 0.34 -1.33 -0.05 0.00 -1.84 0.00 0.00 35.03 32.15 1luc n LYS 221 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1luc s ILE 222 N -1.28 5.01 -0.79 -0.18 1.01 -1.23 -4.97 121.20 118.77 1luc s ILE 222 Ca 0.24 1.39 -0.07 0.00 0.00 0.00 0.00 60.65 62.22 1luc s ILE 222 Cb 0.14 -4.02 -0.13 0.00 0.01 0.00 0.00 42.46 38.46 1luc s ILE 222 CO 0.13 0.16 2.72 -0.67 0.00 0.00 0.00 174.94 177.29 1luc n ASP 223 N 4.50 5.88 -4.74 3.58 2.03 -1.26 -4.96 116.55 121.58 1luc n ASP 223 Ca -0.00 -2.38 -0.35 0.00 0.52 0.00 0.00 54.79 52.58 1luc n ASP 223 Cb 0.50 -1.26 0.07 0.00 -0.72 0.00 0.00 41.12 39.71 1luc n ASP 223 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 1luc s HIS 224 N 2.24 2.22 0.01 -0.67 3.76 -1.26 -4.67 115.29 116.91 1luc s HIS 224 Ca 0.55 1.56 0.08 0.00 -0.15 0.00 0.00 55.06 57.10 1luc s HIS 224 Cb 0.19 -3.44 -0.02 0.00 1.11 0.00 0.00 32.58 30.41 1luc s HIS 224 CO -0.03 -2.39 -0.24 0.00 -0.85 0.00 0.00 174.74 171.23 1luc s LEU 226 N -0.80 4.24 0.02 0.00 1.43 -0.45 -0.85 118.68 122.27 1luc s LEU 226 Ca 0.09 0.48 0.03 0.00 -1.03 0.00 0.00 54.13 53.70 1luc s LEU 226 Cb -0.09 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 1luc s LEU 226 CO 0.00 0.12 -0.02 -0.94 0.23 0.00 0.00 176.35 175.74 1luc s SER 227 N 0.40 4.96 0.00 2.29 1.04 -1.14 -0.19 113.70 121.07 1luc s SER 227 Ca 0.15 -0.09 -0.12 0.00 0.48 0.00 0.00 55.95 56.37 1luc s SER 227 Cb -0.13 -1.23 0.01 0.00 0.10 0.00 0.00 66.02 64.78 1luc s SER 227 CO 0.03 0.25 0.25 -0.31 0.98 0.00 0.00 173.24 174.44 1luc s TYR 228 N -1.12 -0.08 -0.20 5.02 2.02 0.47 -4.02 117.35 119.44 1luc s TYR 228 Ca 0.20 0.07 -0.22 0.00 -0.37 0.00 0.00 57.07 56.75 1luc s TYR 228 Cb -0.11 0.04 -0.02 0.00 -0.40 0.00 0.00 41.96 41.46 1luc s TYR 228 CO 0.12 -0.37 0.67 -1.50 -1.57 0.00 0.00 175.55 172.89 1luc s ILE 229 N -1.57 4.99 -0.08 2.71 2.07 -1.26 -0.71 121.20 127.34 1luc s ILE 229 Ca -0.12 1.27 0.04 0.00 -1.41 0.00 0.00 60.65 60.43 1luc s ILE 229 Cb -0.05 -3.98 0.00 0.00 0.13 0.00 0.00 42.46 38.56 1luc s ILE 229 CO 0.02 0.08 -0.20 -0.89 -1.91 0.00 0.00 174.94 172.05 1luc s THR 230 N 2.03 1.71 -0.27 4.00 2.01 0.17 -3.54 115.64 121.75 1luc s THR 230 Ca 0.30 -0.82 -0.01 0.00 0.31 0.00 0.00 61.69 61.47 1luc s THR 230 Cb -0.16 -1.49 0.13 0.00 0.01 0.00 0.00 72.50 70.99 1luc s THR 230 CO 0.10 0.48 0.32 -0.55 -0.69 0.00 0.00 174.62 174.29 1luc s SER 231 N 0.39 1.19 -0.20 3.53 0.15 -0.53 -4.35 113.70 113.88 1luc s SER 231 Ca -0.15 -0.48 -0.07 0.00 0.70 0.00 0.00 55.95 55.94 1luc s SER 231 Cb -0.16 0.69 -0.04 0.00 -1.71 0.00 0.00 66.02 64.80 1luc s SER 231 CO 0.06 -0.36 0.06 -0.69 1.20 0.00 0.00 173.24 173.51 1luc s VAL 232 N 2.42 4.66 -0.28 4.45 1.01 -1.26 -0.68 120.40 130.72 1luc s VAL 232 Ca 0.10 -0.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.79 1luc s VAL 232 Cb -0.14 -3.12 0.08 0.00 0.00 0.00 0.00 36.38 33.20 1luc s VAL 232 CO -0.27 0.43 0.73 -0.62 0.00 0.00 0.00 175.10 175.36 1luc s ASP 233 N 0.67 -0.82 0.65 3.32 -1.08 -0.57 -4.72 116.67 114.12 1luc s ASP 233 Ca 0.03 1.44 0.36 0.00 -0.52 0.00 0.00 52.55 53.87 1luc s ASP 233 Cb -0.13 1.41 2.01 0.00 -1.46 0.00 0.00 42.92 44.74 1luc s ASP 233 CO 0.02 -0.24 2.18 0.45 0.52 0.00 0.00 175.17 178.10 1luc h HIS 234 N 5.87 0.00 -3.10 -5.34 3.86 -1.95 -3.06 115.15 111.42 1luc h HIS 234 Ca -0.29 0.00 -0.74 0.00 -1.16 0.00 0.00 60.37 58.17 1luc h HIS 234 Cb 1.19 0.00 -0.23 0.00 1.06 0.00 0.00 27.41 29.44 1luc h HIS 234 CO 0.23 0.00 -0.02 0.34 0.86 0.00 0.00 177.93 179.35 1luc s ASP 235 N -5.15 6.29 0.14 2.45 -1.08 -1.26 -4.79 116.67 113.26 1luc s ASP 235 Ca -0.04 -1.81 -0.25 0.00 -0.52 0.00 0.00 52.55 49.93 1luc s ASP 235 Cb 0.12 -2.25 0.00 0.00 -1.46 0.00 0.00 42.92 39.34 1luc s ASP 235 CO 0.41 -0.92 1.61 -1.28 0.52 0.00 0.00 175.17 175.52 1luc h SER 236 N 8.83 -0.96 -0.14 -0.34 0.87 -1.88 -2.20 113.55 117.73 1luc h SER 236 Ca -0.22 0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.47 1luc h SER 236 Cb 1.08 0.42 -0.01 0.00 -0.44 0.00 0.00 62.40 63.45 1luc h SER 236 CO 1.02 -0.33 0.05 0.78 -0.53 0.00 0.00 176.83 177.81 1luc h ASN 237 N -0.34 0.27 0.43 6.23 -0.26 -1.92 -2.21 115.58 117.77 1luc h ASN 237 Ca 0.12 -0.03 -0.02 0.00 -0.56 0.00 0.00 56.30 55.81 1luc h ASN 237 Cb 0.52 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.72 1luc h ASN 237 CO -0.39 0.28 -0.20 -0.09 -1.06 0.00 0.00 177.43 175.97 1luc h ARG 238 N 0.30 -0.55 -0.69 0.81 2.43 -1.81 0.50 114.38 115.36 1luc h ARG 238 Ca 0.07 0.04 0.12 0.00 -0.81 0.00 0.00 59.98 59.40 1luc h ARG 238 Cb 0.13 0.13 -0.09 0.00 -0.42 0.00 0.00 29.97 29.72 1luc h ARG 238 CO -0.00 -0.33 0.26 0.00 -1.51 0.00 0.00 179.97 178.39 1luc h ALA 239 N -0.10 0.93 -0.76 2.80 0.00 -1.02 -1.34 119.26 119.77 1luc h ALA 239 Ca -0.06 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1luc h ALA 239 Cb 0.48 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1luc h ALA 239 CO 0.10 -0.21 0.29 0.87 0.00 0.00 0.00 179.25 180.30 1luc h LYS 240 N 0.42 1.14 -0.38 0.00 1.57 -1.21 -0.29 116.57 117.82 1luc h LYS 240 Ca 0.37 -0.22 -0.08 0.00 -1.87 0.00 0.00 60.65 58.85 1luc h LYS 240 Cb 0.52 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1luc h LYS 240 CO -0.37 0.94 -0.09 -0.44 -0.57 0.00 0.00 179.45 178.92 1luc h ASP 241 N 1.10 0.74 -0.22 0.86 3.32 0.03 -0.71 116.42 121.54 1luc h ASP 241 Ca 0.25 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1luc h ASP 241 Cb 0.24 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1luc h ASP 241 CO -0.02 0.93 0.14 0.40 -1.72 0.00 0.00 179.24 178.97 1luc h ILE 242 N 0.54 1.06 -0.24 0.35 2.04 -1.15 0.14 117.51 120.24 1luc h ILE 242 Ca 0.10 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.85 1luc h ILE 242 Cb 0.60 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1luc h ILE 242 CO 0.04 0.06 0.13 0.00 0.00 0.00 0.00 178.15 178.38 1luc h ARG 244 N 0.27 0.86 -0.38 0.00 3.08 -0.91 -1.12 114.38 116.18 1luc h ARG 244 Ca 0.10 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 1luc h ARG 244 Cb 0.01 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 1luc h ARG 244 CO -0.06 0.72 0.19 -0.91 -1.07 0.00 0.00 179.97 178.85 1luc h ASN 245 N 0.80 0.48 -0.19 7.04 -0.26 -0.46 -2.62 115.58 120.37 1luc h ASN 245 Ca 0.20 -0.11 0.01 0.00 -0.56 0.00 0.00 56.30 55.84 1luc h ASN 245 Cb 0.18 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.29 1luc h ASN 245 CO -0.02 0.45 0.08 0.15 -1.06 0.00 0.00 177.43 177.04 1luc h PHE 246 N 0.47 0.15 0.00 1.19 3.57 -0.86 -2.00 116.94 119.46 1luc h PHE 246 Ca 0.13 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1luc h PHE 246 Cb 0.09 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.79 1luc h PHE 246 CO -0.02 0.08 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.04 1luc h LEU 247 N 0.18 0.00 0.80 0.59 3.38 -1.11 -1.21 115.31 117.94 1luc h LEU 247 Ca 0.08 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1luc h LEU 247 Cb 0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.79 1luc h LEU 247 CO -0.07 0.03 -0.39 1.23 0.09 0.00 0.00 178.44 179.34 1luc h GLY 248 N 0.48 -1.13 0.96 0.83 0.00 -0.98 0.13 103.07 103.37 1luc h GLY 248 Ca -0.00 0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.76 1luc h GLY 248 CO 0.00 -0.41 0.49 1.12 0.00 0.00 0.00 176.54 177.75 1luc h HIS 249 N -1.22 0.93 -0.46 5.60 2.07 -1.38 -2.77 115.15 117.93 1luc h HIS 249 Ca -0.11 0.02 -0.08 0.00 -2.85 0.00 0.00 60.37 57.35 1luc h HIS 249 Cb 0.84 -0.31 -0.02 0.00 2.57 0.00 0.00 27.41 30.49 1luc h HIS 249 CO -0.00 0.57 -0.05 2.35 -3.07 0.00 0.00 177.93 177.73 1luc h TRP 250 N 1.00 0.93 -0.72 6.12 7.01 -1.19 -1.98 115.95 127.11 1luc h TRP 250 Ca 0.29 -0.18 -0.03 0.00 2.11 0.00 0.00 58.89 61.08 1luc h TRP 250 Cb -0.08 -0.23 -0.03 0.00 -2.10 0.00 0.00 29.16 26.72 1luc h TRP 250 CO -0.02 0.90 0.33 -0.92 -2.79 0.00 0.00 178.44 175.94 1luc h TYR 251 N 0.68 1.03 -0.82 2.65 3.20 -0.56 -1.33 116.97 121.82 1luc h TYR 251 Ca 0.12 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 1luc h TYR 251 Cb 0.57 -0.32 -0.04 0.00 1.54 0.00 0.00 36.73 38.48 1luc h TYR 251 CO 0.04 0.76 0.36 -0.44 -1.64 0.00 0.00 178.16 177.24 1luc h ASP 252 N 1.02 1.11 -0.08 -2.11 3.32 -1.31 -1.14 116.42 117.24 1luc h ASP 252 Ca 0.25 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 1luc h ASP 252 Cb 0.13 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1luc h ASP 252 CO -0.03 0.97 -0.12 -1.28 -1.72 0.00 0.00 179.24 177.06 1luc h SER 253 N 1.19 0.38 0.08 6.45 0.87 -0.69 -1.46 113.55 120.37 1luc h SER 253 Ca 0.28 -0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1luc h SER 253 Cb 0.18 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1luc h SER 253 CO -0.03 0.54 -0.04 0.22 -0.53 0.00 0.00 176.83 177.00 1luc h TYR 254 N 0.38 -0.09 -0.82 2.24 3.20 -0.49 -1.47 116.97 119.91 1luc h TYR 254 Ca 0.07 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1luc h TYR 254 Cb 0.44 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 1luc h TYR 254 CO 0.01 0.08 0.53 0.28 -1.64 0.00 0.00 178.16 177.42 1luc h VAL 255 N -0.25 1.22 -0.38 1.81 2.07 -0.95 -2.32 116.25 117.44 1luc h VAL 255 Ca -0.01 -0.43 0.01 0.00 0.82 0.00 0.00 66.70 67.09 1luc h VAL 255 Cb 0.21 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 1luc h VAL 255 CO 0.02 0.22 0.25 0.78 0.02 0.00 0.00 177.57 178.85 1luc h ASN 256 N 1.12 0.43 -0.07 0.57 -0.26 -1.16 -2.12 115.58 114.09 1luc h ASN 256 Ca 0.30 -0.01 0.02 0.00 -0.56 0.00 0.00 56.30 56.05 1luc h ASN 256 Cb -0.10 -0.10 -0.00 0.00 -1.06 0.00 0.00 38.32 37.06 1luc h ASN 256 CO -0.06 0.31 0.05 0.00 -1.06 0.00 0.00 177.43 176.67 1luc h ALA 257 N 1.14 1.96 0.00 -0.83 0.00 -0.73 -1.44 119.26 119.36 1luc h ALA 257 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1luc h ALA 257 Cb -0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1luc h ALA 257 CO -0.04 -0.09 0.00 0.25 0.00 0.00 0.00 179.25 179.38 1luc n THR 258 N -4.36 0.38 -0.19 0.00 -2.24 -0.81 -3.98 114.28 103.07 1luc n THR 258 Ca -0.01 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1luc n THR 258 Cb 0.16 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 1luc n THR 258 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1luc n LYS 259 N -1.97 1.29 -0.70 -0.78 5.02 -0.60 -4.83 118.16 115.60 1luc n LYS 259 Ca 0.06 -0.99 0.52 0.00 -2.02 0.00 0.00 58.31 55.88 1luc n LYS 259 Cb 0.39 -0.90 0.80 0.00 -0.02 0.00 0.00 35.03 35.30 1luc n LYS 259 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1luc n ILE 260 N -0.26 -0.00 0.18 -0.18 -5.35 -0.88 -5.08 119.36 107.79 1luc n ILE 260 Ca 0.00 1.46 0.02 0.00 -0.27 0.00 0.00 62.75 63.96 1luc n ILE 260 Cb 0.21 -2.43 -0.02 0.00 -1.74 0.00 0.00 39.64 35.66 1luc n ILE 260 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1luc n PHE 261 N -3.88 0.00 0.00 4.28 3.72 -1.26 -5.15 117.46 115.17 1luc n PHE 261 Ca 0.44 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.84 1luc n PHE 261 Cb 1.98 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 40.52 1luc n PHE 261 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1luc n ARG 291 N -0.92 0.00 0.10 -1.08 1.85 -1.26 -5.18 116.66 110.17 1luc n ARG 291 Ca 0.01 0.00 -0.04 0.00 -1.00 0.00 0.00 57.85 56.82 1luc n ARG 291 Cb 0.07 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 31.50 1luc n ARG 291 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 1luc h ILE 292 N 0.00 1.53 -0.19 8.89 2.04 -2.00 -2.99 117.51 124.79 1luc h ILE 292 Ca 0.00 -2.76 -0.01 0.00 1.00 0.00 0.00 64.86 63.10 1luc h ILE 292 Cb 0.00 2.50 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 1luc h ILE 292 CO 0.00 0.78 0.09 0.44 0.00 0.00 0.00 178.15 179.46 1luc h ASP 293 N 0.00 0.25 0.74 1.72 5.19 -2.01 -2.76 116.42 119.56 1luc h ASP 293 Ca -0.01 -0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1luc h ASP 293 Cb 1.44 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.88 1luc h ASP 293 CO 0.10 0.31 0.00 -1.22 -3.12 0.00 0.00 179.24 175.31 1luc n TYR 294 N -4.87 0.00 -0.32 4.55 4.02 -1.23 -4.14 117.16 115.17 1luc n TYR 294 Ca -0.04 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.89 1luc n TYR 294 Cb 0.10 -0.38 0.11 0.00 -0.02 0.00 0.00 39.34 39.14 1luc n TYR 294 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1luc n SER 295 N -1.38 -0.36 -0.25 7.72 3.41 -1.04 0.20 113.62 121.92 1luc n SER 295 Ca 0.11 1.51 0.23 0.00 -0.26 0.00 0.00 58.87 60.45 1luc n SER 295 Cb 0.28 -0.44 0.57 0.00 -0.26 0.00 0.00 64.21 64.36 1luc n SER 295 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1luc h TYR 296 N 0.00 0.43 0.00 7.33 -0.00 -1.76 0.50 116.97 123.47 1luc h TYR 296 Ca 0.40 0.01 -0.03 0.00 0.00 0.00 0.00 58.73 59.11 1luc h TYR 296 Cb 0.62 -0.13 -0.00 0.00 0.00 0.00 0.00 36.73 37.21 1luc h TYR 296 CO -0.69 0.09 -0.16 0.93 -0.00 0.00 0.00 178.16 178.32 1luc h GLU 297 N 0.30 0.00 -0.24 0.10 5.08 0.20 -3.11 114.58 116.91 1luc h GLU 297 Ca 0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.86 1luc h GLU 297 Cb 1.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1luc h GLU 297 CO -0.16 0.16 0.00 0.44 -1.00 0.00 0.00 179.01 178.45 1luc n ILE 298 N -3.36 2.07 -4.30 3.13 -5.35 0.17 -4.99 119.36 106.74 1luc n ILE 298 Ca -0.00 -1.79 -0.17 0.00 -0.27 0.00 0.00 62.75 60.52 1luc n ILE 298 Cb 0.38 -0.15 -0.10 0.00 -1.74 0.00 0.00 39.64 38.03 1luc n ILE 298 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1luc s ASN 299 N -1.89 2.22 -1.14 7.28 0.01 -0.91 -4.99 114.94 115.51 1luc s ASN 299 Ca 0.38 -1.00 -0.20 0.00 -0.71 0.00 0.00 52.86 51.33 1luc s ASN 299 Cb 0.30 -0.08 -0.05 0.00 0.41 0.00 0.00 41.25 41.83 1luc s ASN 299 CO 0.09 -0.23 1.92 -0.81 -1.51 0.00 0.00 177.10 176.56 1luc n PRO 300 N -0.22 2.11 -3.92 -0.60 -0.04 -1.23 -4.86 135.00 126.25 1luc n PRO 300 Ca -0.10 -2.52 -0.30 0.00 -0.04 0.00 0.00 63.50 60.54 1luc n PRO 300 Cb 0.60 -3.42 -0.16 0.00 -0.04 0.00 0.00 33.50 30.49 1luc n PRO 300 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1luc s VAL 301 N 6.91 1.47 -5.00 0.52 1.01 -1.26 -1.45 120.40 122.61 1luc s VAL 301 Ca 0.59 -1.20 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1luc s VAL 301 Cb 0.06 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.68 1luc s VAL 301 CO 0.09 -0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1luc n GLY 302 N 4.69 0.58 3.75 4.51 0.00 0.14 -4.79 105.19 114.08 1luc n GLY 302 Ca -0.11 -1.53 -0.31 0.00 0.00 0.00 0.00 46.02 44.07 1luc n GLY 302 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1luc s THR 303 N -3.79 3.15 0.34 2.61 -4.23 -1.16 -1.51 115.64 111.06 1luc s THR 303 Ca 0.00 0.37 0.06 0.00 -1.18 0.00 0.00 61.69 60.95 1luc s THR 303 Cb 0.00 -2.86 0.31 0.00 1.34 0.00 0.00 72.50 71.29 1luc s THR 303 CO 0.00 -0.49 1.89 -0.65 -0.54 0.00 0.00 174.62 174.83 1luc h PRO 304 N -1.24 0.76 -0.80 3.99 0.10 -1.90 -0.39 132.00 132.52 1luc h PRO 304 Ca -0.45 -0.05 -0.03 0.00 0.10 0.00 0.00 66.00 65.57 1luc h PRO 304 Cb 1.25 -0.17 -0.04 0.00 0.10 0.00 0.00 31.00 32.14 1luc h PRO 304 CO 0.52 0.50 0.37 0.93 0.10 0.00 0.00 178.00 180.42 1luc h GLU 305 N 0.78 1.15 -0.52 1.05 3.07 -1.90 0.17 114.58 118.38 1luc h GLU 305 Ca 0.42 -0.17 -0.07 0.00 -0.50 0.00 0.00 59.36 59.04 1luc h GLU 305 Cb 0.53 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.22 1luc h GLU 305 CO -0.18 0.90 0.06 0.93 -1.40 0.00 0.00 179.01 179.31 1luc h GLU 306 N 1.14 0.88 -0.54 2.33 5.08 -1.49 -1.64 114.58 120.33 1luc h GLU 306 Ca 0.27 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1luc h GLU 306 Cb 0.13 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1luc h GLU 306 CO -0.03 0.87 0.20 0.00 -1.00 0.00 0.00 179.01 179.06 1luc h ILE 308 N 0.73 1.04 -0.21 0.00 2.04 -0.53 -2.23 117.51 118.36 1luc h ILE 308 Ca 0.18 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 65.89 1luc h ILE 308 Cb 0.22 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1luc h ILE 308 CO -0.01 0.09 0.10 0.00 0.00 0.00 0.00 178.15 178.32 1luc h ALA 309 N 1.17 0.24 0.10 1.87 0.00 -0.94 -0.16 119.26 121.54 1luc h ALA 309 Ca 0.16 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1luc h ALA 309 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1luc h ALA 309 CO -0.07 -0.31 -0.05 0.82 0.00 0.00 0.00 179.25 179.64 1luc h ILE 310 N 0.22 0.95 -0.52 0.00 2.04 -1.25 -2.08 117.51 116.87 1luc h ILE 310 Ca 0.08 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 1luc h ILE 310 Cb 0.02 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1luc h ILE 310 CO -0.06 0.04 0.14 0.40 0.00 0.00 0.00 178.15 178.68 1luc h ILE 311 N -0.21 1.24 -0.14 -0.67 2.04 -1.36 -2.61 117.51 115.80 1luc h ILE 311 Ca -0.01 -0.83 -0.04 0.00 1.00 0.00 0.00 64.86 64.97 1luc h ILE 311 Cb 0.17 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1luc h ILE 311 CO 0.02 0.30 -0.11 -0.61 0.00 0.00 0.00 178.15 177.75 1luc h GLN 312 N 0.72 0.21 -0.26 2.37 5.75 -0.98 0.15 115.11 123.07 1luc h GLN 312 Ca 0.17 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.62 1luc h GLN 312 Cb 0.31 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1luc h GLN 312 CO -0.00 0.33 0.14 0.37 -2.65 0.00 0.00 178.83 177.03 1luc h GLN 313 N 0.20 0.37 -0.42 1.69 4.15 -1.01 0.20 115.11 120.28 1luc h GLN 313 Ca 0.04 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 1luc h GLN 313 Cb 0.33 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.94 1luc h GLN 313 CO 0.02 0.32 0.01 -0.44 -1.93 0.00 0.00 178.83 176.81 1luc h ASP 314 N 0.31 0.72 -0.67 -0.69 3.32 -1.13 -1.94 116.42 116.35 1luc h ASP 314 Ca 0.09 -0.30 0.01 0.00 0.02 0.00 0.00 57.03 56.85 1luc h ASP 314 Cb 0.06 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 1luc h ASP 314 CO -0.01 0.85 0.44 0.40 -1.72 0.00 0.00 179.24 179.19 1luc h ILE 315 N 0.58 1.17 -0.51 0.35 2.04 -0.70 -0.30 117.51 120.14 1luc h ILE 315 Ca 0.12 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1luc h ILE 315 Cb 0.47 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 1luc h ILE 315 CO 0.02 0.16 0.23 0.44 0.00 0.00 0.00 178.15 179.01 1luc h ASP 316 N 0.90 0.65 1.34 1.72 3.32 -0.41 0.39 116.42 124.33 1luc h ASP 316 Ca 0.25 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.13 1luc h ASP 316 Cb -0.10 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 1luc h ASP 316 CO -0.05 0.56 -0.68 0.00 -1.72 0.00 0.00 179.24 177.35 1luc h ALA 317 N 1.54 0.69 0.00 3.45 0.00 -0.89 -3.39 119.26 120.66 1luc h ALA 317 Ca 0.18 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1luc h ALA 317 Cb 0.10 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1luc h ALA 317 CO -0.02 0.58 -1.39 0.25 0.00 0.00 0.00 179.25 178.67 1luc n THR 318 N -3.10 0.00 -0.95 0.00 -2.24 -0.16 -4.84 114.28 102.99 1luc n THR 318 Ca -0.00 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1luc n THR 318 Cb 0.72 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 69.26 1luc n THR 318 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1luc n GLY 319 N 2.02 0.98 3.77 3.38 0.00 0.13 -5.01 105.19 110.47 1luc n GLY 319 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1luc n GLY 319 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1luc s ILE 320 N -3.80 3.17 -0.10 -0.61 1.01 -1.26 -4.80 121.20 114.82 1luc s ILE 320 Ca 0.00 0.92 0.14 0.00 0.00 0.00 0.00 60.65 61.70 1luc s ILE 320 Cb 0.00 -3.48 0.27 0.00 0.01 0.00 0.00 42.46 39.26 1luc s ILE 320 CO 0.00 0.02 1.13 -0.90 0.00 0.00 0.00 174.94 175.20 1luc n ASP 321 N -0.25 1.43 -3.84 3.58 5.75 -1.26 -4.75 116.55 117.21 1luc n ASP 321 Ca 0.06 -2.86 -0.29 0.00 -0.01 0.00 0.00 54.79 51.69 1luc n ASP 321 Cb 0.48 -0.38 -0.16 0.00 -1.03 0.00 0.00 41.12 40.03 1luc n ASP 321 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1luc s ASN 322 N -2.38 3.39 -0.29 -1.12 3.84 -1.26 -1.06 114.94 116.07 1luc s ASN 322 Ca 0.26 -1.01 -0.08 0.00 0.21 0.00 0.00 52.86 52.24 1luc s ASN 322 Cb 0.25 -0.89 -0.01 0.00 -0.55 0.00 0.00 41.25 40.05 1luc s ASN 322 CO -0.03 -0.27 0.11 -0.63 -2.79 0.00 0.00 177.10 173.48 1luc s ILE 323 N 1.62 4.30 -0.22 -5.21 -1.09 0.20 -1.34 121.20 119.45 1luc s ILE 323 Ca -0.03 -0.46 -0.04 0.00 -2.23 0.00 0.00 60.65 57.88 1luc s ILE 323 Cb -0.18 -3.16 -0.01 0.00 -1.58 0.00 0.00 42.46 37.53 1luc s ILE 323 CO -0.07 0.14 -0.02 0.00 -1.23 0.00 0.00 174.94 173.75 1luc s GLY 326 N -1.38 1.67 0.00 0.00 0.00 0.11 -0.70 107.32 107.02 1luc s GLY 326 Ca 0.06 -0.95 0.10 0.00 0.00 0.00 0.00 44.72 43.92 1luc s GLY 326 CO 0.02 0.11 0.92 0.69 0.00 0.00 0.00 173.10 174.84 1luc n PHE 327 N 4.01 0.11 0.30 1.90 3.01 -1.26 -0.66 117.46 124.87 1luc n PHE 327 Ca -0.18 -0.13 0.17 0.00 1.01 0.00 0.00 57.45 58.32 1luc n PHE 327 Cb 0.52 -0.01 0.97 0.00 -0.01 0.00 0.00 39.48 40.95 1luc n PHE 327 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1luc h GLU 328 N 1.87 0.00 0.00 -1.08 5.08 -1.86 -2.07 114.58 116.53 1luc h GLU 328 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1luc h GLU 328 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1luc h GLU 328 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1luc h ALA 329 N 1.99 1.00 0.00 3.43 0.00 -1.86 -3.27 119.26 120.54 1luc h ALA 329 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1luc h ALA 329 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1luc h ALA 329 CO -0.00 0.00 0.00 -0.91 0.00 0.00 0.00 179.25 178.34 1luc h ASN 330 N 0.00 0.00 0.00 0.00 2.35 -1.66 -3.44 115.58 112.83 1luc h ASN 330 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1luc h ASN 330 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1luc h ASN 330 CO 0.00 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.39 1luc n GLY 331 N -0.94 0.24 3.81 2.83 0.00 -1.24 -4.55 105.19 105.35 1luc n GLY 331 Ca -0.02 -1.45 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 1luc n GLY 331 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1luc s SER 332 N -4.00 3.65 0.35 1.61 1.04 -1.26 -4.74 113.70 110.34 1luc s SER 332 Ca 0.00 0.88 0.06 0.00 0.48 0.00 0.00 55.95 57.37 1luc s SER 332 Cb 0.00 -1.40 0.74 0.00 0.10 0.00 0.00 66.02 65.46 1luc s SER 332 CO 0.00 -2.46 1.92 -0.08 0.98 0.00 0.00 173.24 173.60 1luc h GLU 333 N -1.43 0.74 -0.60 4.02 4.81 -1.99 0.12 114.58 120.25 1luc h GLU 333 Ca -0.49 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 58.62 1luc h GLU 333 Cb 1.33 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1luc h GLU 333 CO 0.61 0.49 0.08 1.49 -0.73 0.00 0.00 179.01 180.96 1luc h GLU 334 N 0.77 1.01 -0.05 1.92 4.81 -1.99 -0.94 114.58 120.10 1luc h GLU 334 Ca 0.38 -0.28 -0.14 0.00 -0.13 0.00 0.00 59.36 59.19 1luc h GLU 334 Cb 0.44 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1luc h GLU 334 CO -0.15 0.95 -0.58 0.93 -0.73 0.00 0.00 179.01 179.44 1luc h GLU 335 N 0.91 0.17 -0.08 1.92 5.08 -1.63 -0.66 114.58 120.29 1luc h GLU 335 Ca 0.18 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1luc h GLU 335 Cb 0.45 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 1luc h GLU 335 CO 0.01 0.70 -0.03 0.82 -1.00 0.00 0.00 179.01 179.51 1luc h ILE 336 N 0.13 1.32 -0.85 3.13 2.04 -0.47 -1.41 117.51 121.39 1luc h ILE 336 Ca -0.00 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 64.83 1luc h ILE 336 Cb 1.06 1.85 -0.04 0.00 -0.74 0.00 0.00 36.82 38.94 1luc h ILE 336 CO 0.09 0.29 0.55 0.40 0.00 0.00 0.00 178.15 179.47 1luc h ILE 337 N -0.21 1.22 -0.63 -0.67 2.04 -1.08 0.11 117.51 118.29 1luc h ILE 337 Ca 0.02 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 1luc h ILE 337 Cb 0.47 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1luc h ILE 337 CO 0.01 0.22 0.34 0.00 0.00 0.00 0.00 178.15 178.72 1luc h ALA 338 N 1.44 0.81 -0.53 1.87 0.00 -0.97 0.81 119.26 122.71 1luc h ALA 338 Ca 0.31 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1luc h ALA 338 Cb -0.11 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1luc h ALA 338 CO -0.06 0.34 0.19 0.66 0.00 0.00 0.00 179.25 180.38 1luc h SER 339 N 0.87 0.75 -0.51 0.00 4.64 -0.42 -0.88 113.55 117.99 1luc h SER 339 Ca 0.22 -0.19 0.03 0.00 -0.47 0.00 0.00 61.79 61.39 1luc h SER 339 Cb 0.06 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 61.92 1luc h SER 339 CO -0.03 0.73 0.30 0.24 -0.87 0.00 0.00 176.83 177.19 1luc h MET 340 N 0.72 0.57 -0.23 4.77 2.07 -0.29 -0.68 114.93 121.86 1luc h MET 340 Ca 0.17 -0.03 -0.08 0.00 -2.07 0.00 0.00 59.70 57.69 1luc h MET 340 Cb 0.23 -0.13 -0.01 0.00 -1.87 0.00 0.00 31.60 29.82 1luc h MET 340 CO -0.01 0.38 -0.21 0.87 1.07 0.00 0.00 176.91 179.00 1luc h LYS 341 N 0.58 0.41 -0.08 1.72 1.57 -0.51 -0.50 116.57 119.76 1luc h LYS 341 Ca 0.21 -0.14 -0.14 0.00 -1.87 0.00 0.00 60.65 58.72 1luc h LYS 341 Cb 0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1luc h LYS 341 CO -0.11 0.61 -0.56 1.25 -0.57 0.00 0.00 179.45 180.07 1luc h LEU 342 N 0.37 0.28 -0.32 2.94 5.85 -0.65 0.24 115.31 124.02 1luc h LEU 342 Ca 0.06 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.57 1luc h LEU 342 Cb 0.58 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1luc h LEU 342 CO 0.04 0.78 -0.04 0.15 -0.34 0.00 0.00 178.44 179.04 1luc h PHE 343 N 0.19 0.65 -0.27 1.25 3.04 -0.76 0.50 116.94 121.54 1luc h PHE 343 Ca 0.00 -0.13 0.02 0.00 3.98 0.00 0.00 57.97 61.85 1luc h PHE 343 Cb 1.04 -0.17 -0.03 0.00 2.56 0.00 0.00 35.95 39.36 1luc h PHE 343 CO 0.02 0.74 0.11 0.37 -2.02 0.00 0.00 178.31 177.53 1luc h GLN 344 N 0.38 0.23 0.17 1.11 4.15 -0.90 0.14 115.11 120.40 1luc h GLN 344 Ca 0.09 -0.01 -0.30 0.00 0.77 0.00 0.00 58.65 59.19 1luc h GLN 344 Cb 0.50 -0.05 0.02 0.00 0.21 0.00 0.00 27.48 28.16 1luc h GLN 344 CO 0.02 0.16 -1.32 0.66 -1.93 0.00 0.00 178.83 176.42 1luc h SER 345 N 0.24 0.62 -0.01 -0.69 4.64 -0.81 -3.37 113.55 114.18 1luc h SER 345 Ca 0.12 -0.65 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 1luc h SER 345 Cb 0.07 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 1luc h SER 345 CO -0.11 1.50 -0.11 0.47 -0.87 0.00 0.00 176.83 177.71 1luc n ASP 346 N -3.63 1.53 0.04 4.97 9.92 0.15 -4.70 116.55 124.83 1luc n ASP 346 Ca -0.12 -1.27 -0.01 0.00 -0.53 0.00 0.00 54.79 52.87 1luc n ASP 346 Cb 1.04 0.25 -0.00 0.00 -0.64 0.00 0.00 41.12 41.77 1luc n ASP 346 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1luc n VAL 347 N 0.15 1.11 -0.33 2.53 0.31 0.26 -4.71 118.33 117.64 1luc n VAL 347 Ca 0.05 0.34 -0.01 0.00 -0.01 0.00 0.00 64.34 64.72 1luc n VAL 347 Cb 0.24 -1.62 0.05 0.00 -0.91 0.00 0.00 33.84 31.60 1luc n VAL 347 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1luc h MET 348 N -0.06 -0.04 0.00 5.55 2.86 -1.10 -1.27 114.93 120.88 1luc h MET 348 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1luc h MET 348 Cb 0.18 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1luc h MET 348 CO -0.00 -0.02 0.00 -1.35 1.06 0.00 0.00 176.91 176.59 1luc h PRO 349 N -0.04 0.00 -0.00 -0.22 0.11 -1.84 -3.04 132.00 126.96 1luc h PRO 349 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1luc h PRO 349 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.71 1luc h PRO 349 CO -0.91 0.00 -0.77 0.66 -0.21 0.00 0.00 178.00 176.77 1luc n TYR 350 N -2.98 0.00 -2.56 0.65 4.01 -0.48 -4.92 117.16 110.88 1luc n TYR 350 Ca -0.02 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.32 1luc n TYR 350 Cb 0.10 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.08 1luc n TYR 350 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1luc s LEU 351 N -2.75 4.52 0.07 7.72 1.43 -1.15 -5.03 118.68 123.49 1luc s LEU 351 Ca 0.10 2.15 0.09 0.00 -1.03 0.00 0.00 54.13 55.45 1luc s LEU 351 Cb 0.15 -3.70 -0.03 0.00 0.03 0.00 0.00 46.19 42.64 1luc s LEU 351 CO 0.72 -0.11 -0.25 -0.54 0.23 0.00 0.00 176.35 176.40 1luc s LYS 352 N -1.52 1.57 0.63 1.70 -0.14 -1.26 -5.02 119.74 115.69 1luc s LYS 352 Ca 0.45 -1.14 -0.17 0.00 -1.36 0.00 0.00 55.97 53.75 1luc s LYS 352 Cb -0.29 -1.82 -0.02 0.00 -1.68 0.00 0.00 37.83 34.03 1luc s LYS 352 CO 0.37 0.46 1.17 -1.21 -0.76 0.00 0.00 175.35 175.38 1luc s GLU 353 N -1.48 2.84 0.21 1.68 2.02 -1.26 -4.89 118.70 117.82 1luc s GLU 353 Ca 0.11 1.68 -0.32 0.00 0.02 0.00 0.00 54.97 56.45 1luc s GLU 353 Cb -0.10 -1.93 -0.14 0.00 0.10 0.00 0.00 34.13 32.07 1luc s GLU 353 CO 0.03 -1.27 1.43 1.17 0.02 0.00 0.00 175.26 176.63 1luc n LYS 354 N -1.95 1.98 0.00 1.61 4.81 -1.26 -5.04 118.16 118.32 1luc n LYS 354 Ca 0.12 0.71 0.16 0.00 -0.87 0.00 0.00 58.31 58.43 1luc n LYS 354 Cb 0.50 -2.38 0.90 0.00 0.02 0.00 0.00 35.03 34.08 1luc n LYS 354 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61