#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lww n SER 10 N 0.00 1.63 -4.82 1.61 3.41 -1.26 -4.87 113.62 109.33 1lww n SER 10 Ca 0.00 -1.60 -0.28 0.00 -0.26 0.00 0.00 58.87 56.73 1lww n SER 10 Cb 0.00 -0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 63.85 1lww n SER 10 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1lww s GLU 11 N -1.91 3.00 0.35 4.33 0.41 -1.26 -5.03 118.70 118.58 1lww s GLU 11 Ca 0.36 -0.76 0.00 0.00 -0.41 0.00 0.00 54.97 54.15 1lww s GLU 11 Cb 0.20 -2.73 0.00 0.00 -1.78 0.00 0.00 34.13 29.82 1lww s GLU 11 CO 0.31 0.52 0.00 0.41 -0.49 0.00 0.00 175.26 176.00 1lww n GLY 12 N -0.13 -2.20 3.74 -1.39 0.00 -1.26 -4.86 105.19 99.08 1lww n GLY 12 Ca -0.08 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 1lww n GLY 12 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1lww s HIS 13 N -0.68 3.31 0.63 1.61 3.76 -1.26 -4.78 115.29 117.88 1lww s HIS 13 Ca 0.00 1.34 -0.13 0.00 -0.15 0.00 0.00 55.06 56.12 1lww s HIS 13 Cb 0.00 -3.53 -0.02 0.00 1.11 0.00 0.00 32.58 30.13 1lww s HIS 13 CO 0.00 -1.57 1.04 1.03 -0.85 0.00 0.00 174.74 174.40 1lww s ARG 14 N -0.41 3.28 0.06 1.40 0.52 -1.26 -5.07 118.95 117.46 1lww s ARG 14 Ca 0.54 1.00 0.03 0.00 -0.52 0.00 0.00 55.73 56.78 1lww s ARG 14 Cb -0.35 -2.03 -0.03 0.00 0.52 0.00 0.00 34.95 33.06 1lww s ARG 14 CO 0.39 -0.83 -0.10 0.95 0.02 0.00 0.00 175.30 175.73 1lww s THR 15 N -2.83 0.77 0.24 0.02 -4.23 -1.26 -4.99 115.64 103.36 1lww s THR 15 Ca 0.59 -1.20 -0.05 0.00 -1.18 0.00 0.00 61.69 59.85 1lww s THR 15 Cb -0.14 -0.83 0.20 0.00 1.34 0.00 0.00 72.50 73.07 1lww s THR 15 CO 0.46 -0.34 1.80 0.25 -0.54 0.00 0.00 174.62 176.25 1lww h LEU 16 N 4.36 0.59 -0.15 4.79 6.46 -1.96 -2.51 115.31 126.89 1lww h LEU 16 Ca -0.38 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.41 1lww h LEU 16 Cb 1.20 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 41.06 1lww h LEU 16 CO 0.41 0.34 -0.00 0.00 -0.62 0.00 0.00 178.44 178.57 1lww h ALA 17 N 1.44 0.20 -0.46 1.25 0.00 -1.98 -3.13 119.26 116.59 1lww h ALA 17 Ca 0.38 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1lww h ALA 17 Cb 0.36 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1lww h ALA 17 CO -0.25 -0.10 0.15 1.03 0.00 0.00 0.00 179.25 180.08 1lww h SER 18 N 0.01 0.67 -2.12 0.00 0.87 -1.90 -3.35 113.55 107.73 1lww h SER 18 Ca 0.04 -0.20 -0.56 0.00 -1.23 0.00 0.00 61.79 59.84 1lww h SER 18 Cb 0.37 -0.17 -0.42 0.00 -0.44 0.00 0.00 62.40 61.74 1lww h SER 18 CO 0.01 0.69 -0.77 0.35 -0.53 0.00 0.00 176.83 176.58 1lww n THR 19 N -4.54 2.35 -0.28 2.23 -2.24 -0.98 -4.97 114.28 105.84 1lww n THR 19 Ca 0.01 -5.26 -0.01 0.00 -2.27 0.00 0.00 64.05 56.52 1lww n THR 19 Cb 0.18 -1.11 0.03 0.00 -2.10 0.00 0.00 70.33 67.33 1lww n THR 19 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1lww n PRO 20 N -0.17 -0.17 0.02 -0.78 -0.02 -1.18 0.12 135.00 132.83 1lww n PRO 20 Ca 0.30 1.13 0.05 0.00 -2.02 0.00 0.00 63.50 62.96 1lww n PRO 20 Cb 0.48 -1.67 0.23 0.00 -0.02 0.00 0.00 33.50 32.52 1lww n PRO 20 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lww n ALA 21 N -3.62 1.36 -1.89 3.55 0.00 -1.26 -3.08 120.51 115.56 1lww n ALA 21 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.14 1lww n ALA 21 Cb 0.30 -1.16 0.04 0.00 0.00 0.00 0.00 19.45 18.62 1lww n ALA 21 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1lww n LEU 22 N -1.62 7.26 -3.68 0.00 7.99 0.33 -4.54 117.00 122.74 1lww n LEU 22 Ca 0.02 -4.80 -0.11 0.00 -0.01 0.00 0.00 56.01 51.11 1lww n LEU 22 Cb 0.10 -0.99 -0.09 0.00 -0.11 0.00 0.00 43.42 42.33 1lww n LEU 22 CO 0.08 1.77 0.19 0.26 -1.51 0.00 0.00 177.39 178.18 1lww s TRP 23 N -3.99 -0.68 0.09 -1.77 0.52 -1.18 -4.58 118.94 107.37 1lww s TRP 23 Ca 0.53 1.51 0.10 0.00 0.02 0.00 0.00 56.10 58.26 1lww s TRP 23 Cb 0.45 0.30 -0.04 0.00 -1.15 0.00 0.00 33.47 33.03 1lww s TRP 23 CO -0.33 -0.35 -0.25 0.00 0.02 0.00 0.00 176.95 176.04 1lww s ALA 24 N 0.88 2.40 0.26 0.98 0.00 0.45 -4.91 121.76 121.82 1lww s ALA 24 Ca -0.05 -1.37 0.08 0.00 0.00 0.00 0.00 51.96 50.62 1lww s ALA 24 Cb -0.05 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 1lww s ALA 24 CO -0.07 0.55 0.15 -1.12 0.00 0.00 0.00 175.76 175.27 1lww s SER 25 N -1.77 5.26 -0.09 0.00 0.01 -1.26 -0.26 113.70 115.58 1lww s SER 25 Ca 0.14 -0.37 -0.04 0.00 1.31 0.00 0.00 55.95 56.99 1lww s SER 25 Cb -0.10 -1.23 0.05 0.00 0.21 0.00 0.00 66.02 64.95 1lww s SER 25 CO 0.05 -0.05 0.17 -0.51 0.41 0.00 0.00 173.24 173.31 1lww s ILE 26 N -2.19 -0.27 -0.05 1.44 1.10 -1.03 -4.99 121.20 115.20 1lww s ILE 26 Ca 0.33 0.32 -0.36 0.00 -0.51 0.00 0.00 60.65 60.43 1lww s ILE 26 Cb -0.07 -0.33 -0.14 0.00 0.15 0.00 0.00 42.46 42.07 1lww s ILE 26 CO 0.24 0.12 1.68 -2.65 -2.11 0.00 0.00 174.94 172.22 1lww n PRO 27 N 5.33 1.70 -3.15 3.50 -0.02 -1.26 -2.22 135.00 138.88 1lww n PRO 27 Ca -0.05 0.62 0.05 0.00 -2.02 0.00 0.00 63.50 62.11 1lww n PRO 27 Cb 0.50 -2.37 -0.01 0.00 -0.02 0.00 0.00 33.50 31.60 1lww n PRO 27 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lww s PRO 29 N 2.94 3.92 0.00 0.00 0.04 -1.25 -3.26 135.00 137.39 1lww s PRO 29 Ca 0.06 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.15 1lww s PRO 29 Cb -0.10 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.32 1lww s PRO 29 CO -0.15 -0.30 0.98 0.54 0.04 0.00 0.00 177.00 178.11 1lww n ARG 30 N -1.41 0.00 0.15 4.56 1.74 -1.07 0.47 116.66 121.11 1lww n ARG 30 Ca 0.07 0.48 0.12 0.00 -0.77 0.00 0.00 57.85 57.75 1lww n ARG 30 Cb 0.54 -1.52 0.25 0.00 -1.02 0.00 0.00 32.46 30.71 1lww n ARG 30 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1lww h SER 31 N 0.00 0.00 0.07 0.55 4.64 -1.91 -3.26 113.55 113.65 1lww h SER 31 Ca 0.00 -0.02 -0.13 0.00 -0.47 0.00 0.00 61.79 61.17 1lww h SER 31 Cb 0.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 1lww h SER 31 CO 0.00 0.01 -2.06 -0.62 -0.87 0.00 0.00 176.83 173.29 1lww n GLU 32 N -2.65 0.67 -3.63 4.77 -0.58 0.18 -3.63 120.64 115.76 1lww n GLU 32 Ca 0.04 -0.11 -0.11 0.00 -0.42 0.00 0.00 57.16 56.57 1lww n GLU 32 Cb 0.48 -1.55 -0.07 0.00 -0.57 0.00 0.00 31.44 29.74 1lww n GLU 32 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1lww s LEU 33 N -4.93 -0.71 -0.33 -4.62 2.96 -0.98 -4.70 118.68 105.37 1lww s LEU 33 Ca -0.08 1.30 -0.00 0.00 -0.22 0.00 0.00 54.13 55.13 1lww s LEU 33 Cb 0.11 2.29 0.11 0.00 0.50 0.00 0.00 46.19 49.20 1lww s LEU 33 CO 0.87 -0.22 0.13 -0.13 -1.32 0.00 0.00 176.35 175.68 1lww s ARG 34 N 0.60 0.79 0.26 1.98 1.81 -0.71 -4.18 118.95 119.51 1lww s ARG 34 Ca -0.01 -1.23 -0.01 0.00 -1.72 0.00 0.00 55.73 52.76 1lww s ARG 34 Cb -0.05 -2.00 0.57 0.00 -0.45 0.00 0.00 34.95 33.02 1lww s ARG 34 CO -0.05 -1.03 1.71 -0.07 -0.68 0.00 0.00 175.30 175.18 1lww h LEU 35 N 7.83 0.25 -0.71 2.53 3.38 -1.96 0.11 115.31 126.73 1lww h LEU 35 Ca -0.11 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1lww h LEU 35 Cb 1.00 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1lww h LEU 35 CO 0.46 0.04 0.00 -0.90 0.09 0.00 0.00 178.44 178.13 1lww n ASP 36 N -5.05 0.40 -0.00 -0.43 3.85 -1.26 -1.61 116.55 112.45 1lww n ASP 36 Ca 0.18 0.64 0.07 0.00 -0.71 0.00 0.00 54.79 54.96 1lww n ASP 36 Cb 0.52 -0.71 -0.09 0.00 -1.35 0.00 0.00 41.12 39.49 1lww n ASP 36 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1lww n LEU 37 N -1.99 0.35 -0.12 -2.12 4.77 0.33 -4.64 117.00 113.58 1lww n LEU 37 Ca 0.01 -0.28 -0.26 0.00 -0.03 0.00 0.00 56.01 55.45 1lww n LEU 37 Cb 0.11 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.11 1lww n LEU 37 CO 0.12 0.09 -1.34 0.52 -1.33 0.00 0.00 177.39 175.45 1lww n VAL 38 N -1.61 1.33 -0.12 4.08 0.31 -0.87 -4.50 118.33 116.95 1lww n VAL 38 Ca 0.00 -0.34 -0.03 0.00 -0.01 0.00 0.00 64.34 63.96 1lww n VAL 38 Cb 0.27 -1.82 0.19 0.00 -0.91 0.00 0.00 33.84 31.57 1lww n VAL 38 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1lww h LEU 39 N -0.85 0.76 -3.06 7.52 3.38 -1.57 -3.10 115.31 118.39 1lww h LEU 39 Ca -0.62 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1lww h LEU 39 Cb 1.55 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1lww h LEU 39 CO -0.37 0.77 0.00 -0.81 0.09 0.00 0.00 178.44 178.12 1lww n PRO 40 N -4.26 3.42 -0.61 1.13 -0.04 -1.26 -4.54 135.00 128.84 1lww n PRO 40 Ca 0.03 -2.75 0.05 0.00 -0.04 0.00 0.00 63.50 60.79 1lww n PRO 40 Cb 0.25 -1.76 0.28 0.00 -0.04 0.00 0.00 33.50 32.23 1lww n PRO 40 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1lww n SER 41 N 1.01 4.21 0.00 3.54 3.41 -1.17 -4.92 113.62 119.69 1lww n SER 41 Ca 0.24 -2.61 0.00 0.00 -0.26 0.00 0.00 58.87 56.24 1lww n SER 41 Cb 0.79 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1lww n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lww n GLY 42 N 0.49 0.71 0.06 5.00 0.00 -1.26 -4.85 105.19 105.34 1lww n GLY 42 Ca 0.19 -0.71 -0.05 0.00 0.00 0.00 0.00 46.02 45.46 1lww n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1lww n GLN 43 N -1.71 0.28 -4.25 1.61 6.02 -1.26 -4.95 117.38 113.12 1lww n GLN 43 Ca 0.00 0.11 -0.33 0.00 -0.01 0.00 0.00 57.00 56.77 1lww n GLN 43 Cb 0.21 -0.99 -0.08 0.00 1.02 0.00 0.00 30.24 30.40 1lww n GLN 43 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1lww s SER 44 N -5.03 5.29 0.00 1.08 0.15 -1.26 -5.01 113.70 108.91 1lww s SER 44 Ca -0.15 0.06 0.13 0.00 0.70 0.00 0.00 55.95 56.68 1lww s SER 44 Cb 0.02 -1.44 0.35 0.00 -1.71 0.00 0.00 66.02 63.24 1lww s SER 44 CO 0.23 0.30 1.28 0.49 1.20 0.00 0.00 173.24 176.74 1lww n PHE 45 N 1.47 0.52 -1.00 3.44 3.01 -1.26 -4.67 117.46 118.98 1lww n PHE 45 Ca -0.15 -0.48 0.07 0.00 1.01 0.00 0.00 57.45 57.90 1lww n PHE 45 Cb 0.53 -0.02 0.30 0.00 -0.01 0.00 0.00 39.48 40.27 1lww n PHE 45 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1lww n ARG 46 N 0.70 3.41 -4.67 -1.08 1.74 -1.26 -4.84 116.66 110.65 1lww n ARG 46 Ca 0.13 -2.95 -0.33 0.00 -0.77 0.00 0.00 57.85 53.93 1lww n ARG 46 Cb 0.45 -1.97 -0.12 0.00 -1.02 0.00 0.00 32.46 29.80 1lww n ARG 46 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1lww s TRP 47 N -2.85 2.88 -0.03 -1.55 0.52 -1.26 -4.23 118.94 112.42 1lww s TRP 47 Ca 0.46 -0.22 0.03 0.00 0.02 0.00 0.00 56.10 56.39 1lww s TRP 47 Cb 0.37 -1.77 0.00 0.00 -1.15 0.00 0.00 33.47 30.92 1lww s TRP 47 CO 0.10 0.11 -0.11 1.03 0.02 0.00 0.00 176.95 178.11 1lww s ARG 48 N -0.31 1.16 -1.29 4.98 1.81 -0.20 -4.85 118.95 120.24 1lww s ARG 48 Ca 0.04 -0.37 -0.16 0.00 -1.72 0.00 0.00 55.73 53.52 1lww s ARG 48 Cb -0.13 -1.05 0.10 0.00 -0.45 0.00 0.00 34.95 33.42 1lww s ARG 48 CO 0.02 0.13 1.73 -1.91 -0.68 0.00 0.00 175.30 174.59 1lww n GLU 49 N 3.30 3.23 0.07 3.54 2.13 -1.26 -0.39 120.64 131.27 1lww n GLU 49 Ca -0.19 -3.37 0.02 0.00 0.66 0.00 0.00 57.16 54.29 1lww n GLU 49 Cb 0.54 -3.31 0.37 0.00 0.27 0.00 0.00 31.44 29.31 1lww n GLU 49 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1lww h GLN 50 N 7.14 0.35 -5.65 5.31 1.08 -1.89 -3.42 115.11 118.03 1lww h GLN 50 Ca 0.43 -0.07 -0.47 0.00 -1.45 0.00 0.00 58.65 57.09 1lww h GLN 50 Cb 0.83 -0.05 -0.22 0.00 -0.05 0.00 0.00 27.48 27.99 1lww h GLN 50 CO 1.46 0.41 -0.80 0.45 -0.95 0.00 0.00 178.83 179.41 1lww s SER 51 N -6.82 2.00 -0.08 1.46 0.15 -1.23 -5.06 113.70 104.12 1lww s SER 51 Ca -0.06 -0.64 -0.38 0.00 0.70 0.00 0.00 55.95 55.56 1lww s SER 51 Cb 0.16 -0.08 -0.16 0.00 -1.71 0.00 0.00 66.02 64.22 1lww s SER 51 CO 0.74 -0.03 1.53 -0.81 1.20 0.00 0.00 173.24 175.87 1lww n PRO 52 N 1.20 1.17 -1.16 5.44 -0.04 -1.26 -0.60 135.00 139.74 1lww n PRO 52 Ca -0.21 0.42 -0.06 0.00 -0.04 0.00 0.00 63.50 63.62 1lww n PRO 52 Cb 0.54 -2.09 -0.02 0.00 -0.04 0.00 0.00 33.50 31.89 1lww n PRO 52 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1lww n ALA 53 N 3.83 -0.09 -4.01 0.55 0.00 -1.26 -4.96 120.51 114.57 1lww n ALA 53 Ca 0.22 0.09 -0.33 0.00 0.00 0.00 0.00 53.44 53.42 1lww n ALA 53 Cb 0.16 -1.58 -0.15 0.00 0.00 0.00 0.00 19.45 17.89 1lww n ALA 53 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1lww s HIS 54 N -1.54 3.01 -0.20 0.00 3.76 0.23 -4.38 115.29 116.17 1lww s HIS 54 Ca 0.00 -1.85 -0.08 0.00 -0.15 0.00 0.00 55.06 52.98 1lww s HIS 54 Cb 0.00 -1.95 -0.04 0.00 1.11 0.00 0.00 32.58 31.70 1lww s HIS 54 CO 0.00 -0.81 0.08 -1.58 -0.85 0.00 0.00 174.74 171.58 1lww s TRP 55 N 1.23 3.24 -0.02 1.40 0.52 0.11 -2.86 118.94 122.56 1lww s TRP 55 Ca -0.01 0.03 0.05 0.00 0.02 0.00 0.00 56.10 56.19 1lww s TRP 55 Cb -0.16 -2.13 -0.03 0.00 -1.15 0.00 0.00 33.47 30.00 1lww s TRP 55 CO -0.08 0.07 -0.15 -1.12 0.02 0.00 0.00 176.95 175.68 1lww s SER 56 N 0.66 3.97 -0.05 2.95 0.01 0.48 0.34 113.70 122.06 1lww s SER 56 Ca 0.04 -0.26 -0.30 0.00 1.31 0.00 0.00 55.95 56.74 1lww s SER 56 Cb -0.13 -0.79 0.11 0.00 0.21 0.00 0.00 66.02 65.42 1lww s SER 56 CO 0.01 0.32 1.34 -0.83 0.41 0.00 0.00 173.24 174.49 1lww s GLY 57 N -0.95 -0.24 -0.16 3.44 0.00 -0.53 -1.03 107.32 107.85 1lww s GLY 57 Ca 0.13 0.27 -0.20 0.00 0.00 0.00 0.00 44.72 44.92 1lww s GLY 57 CO 0.02 4.72 0.57 0.14 0.00 0.00 0.00 173.10 178.55 1lww s VAL 58 N -2.06 5.09 -0.11 1.40 1.01 -1.26 -0.99 120.40 123.49 1lww s VAL 58 Ca 0.27 1.10 -0.02 0.00 0.00 0.00 0.00 61.98 63.34 1lww s VAL 58 Cb 0.01 -3.90 0.04 0.00 0.00 0.00 0.00 36.38 32.53 1lww s VAL 58 CO -0.03 0.21 0.00 -0.22 0.00 0.00 0.00 175.10 175.06 1lww s LEU 59 N 1.31 0.83 -1.29 3.92 2.96 0.11 -4.83 118.68 121.69 1lww s LEU 59 Ca 0.28 -0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 1lww s LEU 59 Cb -0.16 -0.54 -0.00 0.00 0.50 0.00 0.00 46.19 45.99 1lww s LEU 59 CO 0.11 -0.21 0.71 0.00 -1.32 0.00 0.00 176.35 175.64 1lww n ALA 60 N 5.09 -2.06 -1.32 5.97 0.00 -1.26 -2.32 120.51 124.61 1lww n ALA 60 Ca -0.08 -0.16 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 1lww n ALA 60 Cb 0.49 -2.15 -0.05 0.00 0.00 0.00 0.00 19.45 17.74 1lww n ALA 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1lww n ASP 61 N -3.05 -5.04 -4.19 0.00 10.43 -1.26 -4.98 116.55 108.47 1lww n ASP 61 Ca -0.29 0.27 -0.11 0.00 2.57 0.00 0.00 54.79 57.23 1lww n ASP 61 Cb 0.67 -3.51 -0.10 0.00 1.84 0.00 0.00 41.12 40.03 1lww n ASP 61 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1lww s GLN 62 N -2.78 0.91 -0.03 -1.24 -0.21 -0.98 -5.05 119.66 110.27 1lww s GLN 62 Ca 0.00 -1.39 -0.13 0.00 0.02 0.00 0.00 55.36 53.86 1lww s GLN 62 Cb 0.00 -0.19 -0.05 0.00 1.00 0.00 0.00 33.01 33.77 1lww s GLN 62 CO 0.00 -0.06 0.34 0.08 -2.12 0.00 0.00 175.29 173.53 1lww s VAL 63 N -3.66 5.15 0.08 1.09 1.01 -1.25 0.09 120.40 122.90 1lww s VAL 63 Ca 0.15 0.69 0.02 0.00 0.00 0.00 0.00 61.98 62.84 1lww s VAL 63 Cb 0.06 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 1lww s VAL 63 CO -0.02 0.59 -0.07 0.26 0.00 0.00 0.00 175.10 175.85 1lww s TRP 64 N -1.04 0.83 -0.02 5.22 0.52 -0.16 -1.22 118.94 123.06 1lww s TRP 64 Ca 0.22 -0.74 0.05 0.00 0.02 0.00 0.00 56.10 55.65 1lww s TRP 64 Cb -0.16 -0.48 -0.01 0.00 -1.15 0.00 0.00 33.47 31.68 1lww s TRP 64 CO 0.11 -0.11 -0.16 0.99 0.02 0.00 0.00 176.95 177.80 1lww s THR 65 N -2.67 1.32 0.03 2.01 2.01 -0.81 -1.46 115.64 116.06 1lww s THR 65 Ca 0.03 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 61.37 1lww s THR 65 Cb -0.01 -1.11 -0.02 0.00 0.01 0.00 0.00 72.50 71.37 1lww s THR 65 CO -0.02 0.38 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.42 1lww s LEU 66 N -0.23 2.16 0.11 4.42 1.43 0.15 -2.35 118.68 124.37 1lww s LEU 66 Ca 0.03 -0.39 -0.19 0.00 -1.03 0.00 0.00 54.13 52.54 1lww s LEU 66 Cb -0.08 -0.38 0.05 0.00 0.03 0.00 0.00 46.19 45.81 1lww s LEU 66 CO 0.00 -0.03 0.48 0.28 0.23 0.00 0.00 176.35 177.31 1lww s THR 67 N -0.83 0.04 0.05 5.49 -1.32 -0.77 0.09 115.64 118.39 1lww s THR 67 Ca -0.02 -0.35 0.02 0.00 -1.21 0.00 0.00 61.69 60.12 1lww s THR 67 Cb -0.07 -1.07 -0.03 0.00 -1.51 0.00 0.00 72.50 69.83 1lww s THR 67 CO 0.01 -0.20 -0.07 0.00 -2.21 0.00 0.00 174.62 172.15 1lww s GLN 68 N -3.38 0.55 0.56 7.08 -2.07 -1.26 0.62 119.66 121.77 1lww s GLN 68 Ca -0.00 -0.84 0.05 0.00 -1.82 0.00 0.00 55.36 52.75 1lww s GLN 68 Cb 0.00 -0.23 0.05 0.00 -1.09 0.00 0.00 33.01 31.74 1lww s GLN 68 CO -0.09 0.03 0.42 0.95 -1.32 0.00 0.00 175.29 175.28 1lww s THR 69 N -1.77 1.52 0.40 3.63 -4.23 0.11 -4.98 115.64 110.32 1lww s THR 69 Ca -0.07 -1.49 0.15 0.00 -1.18 0.00 0.00 61.69 59.10 1lww s THR 69 Cb -0.07 -2.01 0.36 0.00 1.34 0.00 0.00 72.50 72.11 1lww s THR 69 CO -0.01 0.00 1.88 -0.08 -0.54 0.00 0.00 174.62 175.87 1lww h GLU 70 N 0.68 0.47 -0.00 3.99 4.57 -2.01 -3.12 114.58 119.16 1lww h GLU 70 Ca -0.36 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 1lww h GLU 70 Cb 1.31 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 1lww h GLU 70 CO 0.56 0.31 -0.00 0.39 -1.18 0.00 0.00 179.01 179.09 1lww n GLU 71 N -4.52 1.60 -4.27 1.92 -0.58 -1.26 -2.60 120.64 110.93 1lww n GLU 71 Ca 0.17 -0.34 -0.20 0.00 -0.42 0.00 0.00 57.16 56.37 1lww n GLU 71 Cb 0.59 -0.84 -0.13 0.00 -0.57 0.00 0.00 31.44 30.49 1lww n GLU 71 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1lww s GLN 72 N -0.33 0.94 -0.36 3.49 -1.52 -1.18 -1.71 119.66 119.00 1lww s GLN 72 Ca 0.00 -0.94 -0.07 0.00 -1.95 0.00 0.00 55.36 52.40 1lww s GLN 72 Cb 0.00 -1.01 0.05 0.00 -0.22 0.00 0.00 33.01 31.83 1lww s GLN 72 CO 0.00 0.24 0.15 -1.17 -0.25 0.00 0.00 175.29 174.25 1lww s LEU 73 N -1.57 4.57 -0.09 2.90 2.96 -0.94 -0.71 118.68 125.80 1lww s LEU 73 Ca 0.01 -1.28 -0.21 0.00 -0.22 0.00 0.00 54.13 52.43 1lww s LEU 73 Cb -0.09 -1.89 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 1lww s LEU 73 CO 0.02 -0.39 0.59 -1.00 -1.32 0.00 0.00 176.35 174.26 1lww s HIS 74 N 1.39 3.56 0.02 5.38 3.76 0.20 -2.47 115.29 127.13 1lww s HIS 74 Ca 0.00 1.09 0.06 0.00 -0.15 0.00 0.00 55.06 56.06 1lww s HIS 74 Cb -0.20 -2.68 -0.02 0.00 1.11 0.00 0.00 32.58 30.79 1lww s HIS 74 CO 0.02 0.14 -0.19 0.00 -0.85 0.00 0.00 174.74 173.87 1lww s THR 76 N -0.66 -0.01 -0.02 0.00 -1.32 -0.99 -0.41 115.64 112.23 1lww s THR 76 Ca 0.06 0.03 0.07 0.00 -1.21 0.00 0.00 61.69 60.65 1lww s THR 76 Cb -0.08 -0.08 -0.02 0.00 -1.51 0.00 0.00 72.50 70.82 1lww s THR 76 CO 0.01 0.01 -0.24 0.54 -2.21 0.00 0.00 174.62 172.74 1lww s VAL 77 N 0.20 1.87 -0.39 5.08 0.11 -1.26 -1.93 120.40 124.08 1lww s VAL 77 Ca -0.02 -1.01 -0.09 0.00 -2.93 0.00 0.00 61.98 57.93 1lww s VAL 77 Cb -0.02 -1.55 0.06 0.00 -1.53 0.00 0.00 36.38 33.33 1lww s VAL 77 CO -0.01 0.53 0.22 -0.31 -3.33 0.00 0.00 175.10 172.20 1lww s TYR 78 N -0.52 3.29 0.00 1.54 1.51 -0.36 -4.83 117.35 117.99 1lww s TYR 78 Ca 0.08 -1.33 0.00 0.00 -1.01 0.00 0.00 57.07 54.81 1lww s TYR 78 Cb -0.09 -2.68 0.00 0.00 -0.11 0.00 0.00 41.96 39.07 1lww s TYR 78 CO -0.01 -0.77 0.00 0.54 -1.11 0.00 0.00 175.55 174.21 1lww n ARG 79 N 4.93 0.00 -0.07 -0.62 1.74 -1.26 -3.81 116.66 117.56 1lww n ARG 79 Ca -0.11 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.88 1lww n ARG 79 Cb 0.44 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.80 1lww n ARG 79 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1lww n SER 83 N 0.00 2.45 -4.67 0.55 7.64 -1.26 -4.95 113.62 113.38 1lww n SER 83 Ca 0.00 -0.05 -0.43 0.00 1.01 0.00 0.00 58.87 59.40 1lww n SER 83 Cb 0.00 0.20 -0.03 0.00 -1.01 0.00 0.00 64.21 63.37 1lww n SER 83 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1lww n GLN 84 N -2.74 2.80 -1.67 1.43 1.13 -1.26 -4.86 117.38 112.20 1lww n GLN 84 Ca -0.24 1.02 -0.49 0.00 -1.94 0.00 0.00 57.00 55.35 1lww n GLN 84 Cb 0.84 -2.96 -0.05 0.00 0.11 0.00 0.00 30.24 28.18 1lww n GLN 84 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1lww n ALA 85 N 7.24 0.81 -2.70 -1.58 0.00 -1.26 -4.94 120.51 118.09 1lww n ALA 85 Ca 0.20 0.36 -0.16 0.00 0.00 0.00 0.00 53.44 53.84 1lww n ALA 85 Cb 0.39 -2.40 -0.05 0.00 0.00 0.00 0.00 19.45 17.38 1lww n ALA 85 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1lww s SER 86 N 2.86 1.10 0.48 0.00 1.04 -1.26 -5.08 113.70 112.84 1lww s SER 86 Ca 0.89 -1.56 -0.21 0.00 0.48 0.00 0.00 55.95 55.55 1lww s SER 86 Cb -0.74 0.62 -0.08 0.00 0.10 0.00 0.00 66.02 65.93 1lww s SER 86 CO 0.48 -1.22 1.09 -0.13 0.98 0.00 0.00 173.24 174.45 1lww s ARG 87 N -3.21 3.73 0.37 4.02 1.81 -1.26 -4.75 118.95 119.66 1lww s ARG 87 Ca 0.34 1.53 -0.28 0.00 -1.72 0.00 0.00 55.73 55.60 1lww s ARG 87 Cb 0.01 -2.20 -0.11 0.00 -0.45 0.00 0.00 34.95 32.19 1lww s ARG 87 CO 0.22 -0.52 1.47 -2.30 -0.68 0.00 0.00 175.30 173.49 1lww n PRO 88 N -0.82 2.60 -1.99 3.54 -0.02 -1.26 -4.96 135.00 132.10 1lww n PRO 88 Ca 0.09 0.91 -0.28 0.00 -2.02 0.00 0.00 63.50 62.20 1lww n PRO 88 Cb 0.51 -2.63 0.08 0.00 -0.02 0.00 0.00 33.50 31.44 1lww n PRO 88 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1lww s THR 89 N -1.05 2.22 0.47 3.45 -4.23 -1.26 -4.85 115.64 110.39 1lww s THR 89 Ca 0.54 -0.03 0.13 0.00 -1.18 0.00 0.00 61.69 61.15 1lww s THR 89 Cb -0.49 -3.05 0.29 0.00 1.34 0.00 0.00 72.50 70.59 1lww s THR 89 CO 0.63 -0.06 2.08 -0.65 -0.54 0.00 0.00 174.62 176.08 1lww h PRO 90 N -0.89 0.26 -0.14 3.99 0.11 -1.99 -1.51 132.00 131.83 1lww h PRO 90 Ca -0.45 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.56 1lww h PRO 90 Cb 1.32 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 1lww h PRO 90 CO 0.64 0.17 -0.23 -0.44 -0.21 0.00 0.00 178.00 177.93 1lww h ASP 91 N 0.27 0.45 -0.79 -2.05 3.32 -1.99 -2.52 116.42 113.11 1lww h ASP 91 Ca 0.11 -0.54 -0.03 0.00 0.02 0.00 0.00 57.03 56.60 1lww h ASP 91 Cb 0.12 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 1lww h ASP 91 CO -0.02 0.90 0.40 -0.33 -1.72 0.00 0.00 179.24 178.46 1lww h GLU 92 N 0.01 1.14 -0.32 3.56 5.08 -1.83 -1.32 114.58 120.91 1lww h GLU 92 Ca 0.01 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 1lww h GLU 92 Cb 0.81 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 1lww h GLU 92 CO 0.05 0.86 -0.00 -0.07 -1.00 0.00 0.00 179.01 178.85 1lww h LEU 93 N 1.13 0.46 -1.81 1.33 3.38 -1.29 -1.33 115.31 117.18 1lww h LEU 93 Ca 0.28 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1lww h LEU 93 Cb 0.09 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1lww h LEU 93 CO -0.04 0.53 -0.06 -0.33 0.09 0.00 0.00 178.44 178.63 1lww h GLU 94 N 0.47 0.04 -0.35 1.13 4.39 -0.79 -0.99 114.58 118.49 1lww h GLU 94 Ca 0.10 -0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.67 1lww h GLU 94 Cb 0.32 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1lww h GLU 94 CO 0.01 0.11 -0.28 0.00 -1.16 0.00 0.00 179.01 177.69 1lww h ALA 95 N 1.90 0.85 -0.05 3.43 0.00 -0.90 -1.83 119.26 122.66 1lww h ALA 95 Ca 0.01 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1lww h ALA 95 Cb 0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1lww h ALA 95 CO 0.01 0.64 -0.01 0.28 0.00 0.00 0.00 179.25 180.16 1lww h VAL 96 N 0.63 1.30 -0.87 0.00 2.07 -1.10 -1.64 116.25 116.63 1lww h VAL 96 Ca 0.08 -0.91 0.14 0.00 0.82 0.00 0.00 66.70 66.83 1lww h VAL 96 Cb 0.79 1.81 -0.09 0.00 -1.52 0.00 0.00 31.29 32.29 1lww h VAL 96 CO 0.07 0.25 0.47 0.03 0.02 0.00 0.00 177.57 178.40 1lww h ARG 97 N -0.26 0.67 -0.46 1.57 3.08 -1.17 -0.80 114.38 117.01 1lww h ARG 97 Ca 0.01 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 59.90 1lww h ARG 97 Cb 0.40 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1lww h ARG 97 CO 0.00 0.44 -0.18 -0.22 -1.07 0.00 0.00 179.97 178.94 1lww h LYS 98 N 0.69 0.90 -0.78 0.04 3.64 -1.21 -1.16 116.57 118.70 1lww h LYS 98 Ca 0.47 -0.36 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1lww h LYS 98 Cb 0.62 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.36 1lww h LYS 98 CO -0.34 1.01 0.35 -0.92 -2.27 0.00 0.00 179.45 177.28 1lww h TYR 99 N 0.79 1.14 -0.43 1.91 3.20 -0.19 -2.31 116.97 121.07 1lww h TYR 99 Ca 0.11 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1lww h TYR 99 Cb 0.73 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.65 1lww h TYR 99 CO 0.04 0.85 0.00 1.19 -1.64 0.00 0.00 178.16 178.60 1lww n PHE 100 N -4.35 0.62 -4.25 -3.82 3.01 -0.56 -0.41 117.46 107.71 1lww n PHE 100 Ca 0.07 -0.30 -0.35 0.00 1.01 0.00 0.00 57.45 57.88 1lww n PHE 100 Cb 0.15 -0.02 -0.07 0.00 -0.01 0.00 0.00 39.48 39.54 1lww n PHE 100 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1lww n GLN 101 N 0.76 -0.81 0.12 -1.08 6.02 -0.53 -4.81 117.38 117.06 1lww n GLN 101 Ca 0.15 0.09 0.10 0.00 -0.01 0.00 0.00 57.00 57.33 1lww n GLN 101 Cb 0.39 -3.32 0.48 0.00 1.02 0.00 0.00 30.24 28.81 1lww n GLN 101 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1lww n LEU 102 N -4.71 0.52 0.25 1.08 4.32 -0.68 -1.84 117.00 115.94 1lww n LEU 102 Ca -0.27 0.68 0.13 0.00 -0.02 0.00 0.00 56.01 56.53 1lww n LEU 102 Cb 0.66 -0.67 0.55 0.00 -1.62 0.00 0.00 43.42 42.35 1lww n LEU 102 CO 0.82 -0.69 0.89 0.44 -1.22 0.00 0.00 177.39 177.63 1lww h ASP 103 N 0.00 0.00 -3.38 -1.43 3.32 -1.87 -3.41 116.42 109.65 1lww h ASP 103 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 1lww h ASP 103 Cb 0.18 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.66 1lww h ASP 103 CO 0.00 0.11 0.81 -0.69 -1.72 0.00 0.00 179.24 177.75 1lww s VAL 104 N -3.65 4.50 -0.62 -1.35 1.01 -0.77 -4.98 120.40 114.54 1lww s VAL 104 Ca 0.01 1.60 -0.28 0.00 0.00 0.00 0.00 61.98 63.31 1lww s VAL 104 Cb 0.09 -4.42 0.03 0.00 0.00 0.00 0.00 36.38 32.08 1lww s VAL 104 CO 0.60 -0.54 1.28 -0.89 0.00 0.00 0.00 175.10 175.54 1lww s THR 105 N 3.69 3.87 0.41 3.92 2.01 -1.26 -4.88 115.64 123.41 1lww s THR 105 Ca 0.44 0.70 0.14 0.00 0.31 0.00 0.00 61.69 63.29 1lww s THR 105 Cb -0.12 -4.71 0.15 0.00 0.01 0.00 0.00 72.50 67.83 1lww s THR 105 CO 0.17 -1.45 1.92 0.25 -0.69 0.00 0.00 174.62 174.83 1lww h LEU 106 N 12.56 0.00 -1.16 4.42 5.85 -1.90 -2.36 115.31 132.73 1lww h LEU 106 Ca -0.26 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.38 1lww h LEU 106 Cb 1.06 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1lww h LEU 106 CO 1.21 0.26 -0.20 0.00 -0.34 0.00 0.00 178.44 179.37 1lww h ALA 107 N 1.74 1.30 -0.20 1.25 0.00 -1.90 -0.11 119.26 121.34 1lww h ALA 107 Ca -0.00 -0.28 -0.20 0.00 0.00 0.00 0.00 54.91 54.42 1lww h ALA 107 Cb 0.46 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1lww h ALA 107 CO 0.03 0.47 -0.67 1.96 0.00 0.00 0.00 179.25 181.04 1lww h GLN 108 N 0.31 0.77 -0.25 0.00 1.08 -1.84 -2.53 115.11 112.65 1lww h GLN 108 Ca 0.05 -0.57 -0.07 0.00 -1.45 0.00 0.00 58.65 56.61 1lww h GLN 108 Cb 0.54 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 28.06 1lww h GLN 108 CO 0.04 1.18 -0.14 -0.07 -0.95 0.00 0.00 178.83 178.89 1lww h LEU 109 N 0.56 0.55 -0.69 1.46 3.38 -1.21 -2.68 115.31 116.68 1lww h LEU 109 Ca -0.02 -0.42 0.02 0.00 0.09 0.00 0.00 57.88 57.55 1lww h LEU 109 Cb 1.28 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 1lww h LEU 109 CO 0.14 0.85 0.44 1.88 0.09 0.00 0.00 178.44 181.84 1lww h TYR 110 N 0.26 0.83 0.10 1.13 -1.99 -1.06 -1.19 116.97 115.05 1lww h TYR 110 Ca 0.05 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.83 1lww h TYR 110 Cb 0.65 -0.28 -0.04 0.00 2.00 0.00 0.00 36.73 39.06 1lww h TYR 110 CO 0.06 0.49 -0.30 1.25 -0.00 0.00 0.00 178.16 179.67 1lww h HIS 111 N 0.88 -0.81 0.29 4.88 -0.00 -1.42 -0.23 115.15 118.73 1lww h HIS 111 Ca 0.27 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.66 1lww h HIS 111 Cb -0.03 0.34 -0.03 0.00 -0.00 0.00 0.00 27.41 27.69 1lww h HIS 111 CO -0.04 -0.40 -0.34 1.25 -0.00 0.00 0.00 177.93 178.40 1lww h HIS 112 N -0.51 -0.92 -0.72 5.26 -0.00 -1.12 -0.67 115.15 116.47 1lww h HIS 112 Ca 0.03 0.01 0.06 0.00 -0.00 0.00 0.00 60.37 60.47 1lww h HIS 112 Cb 0.55 0.37 -0.06 0.00 -0.00 0.00 0.00 27.41 28.27 1lww h HIS 112 CO -0.28 -0.47 0.42 -1.49 -0.00 0.00 0.00 177.93 176.11 1lww h TRP 113 N -0.68 0.78 0.00 5.26 6.55 -1.17 -0.18 115.95 126.52 1lww h TRP 113 Ca -0.01 0.03 -0.02 0.00 0.95 0.00 0.00 58.89 59.83 1lww h TRP 113 Cb 0.63 -0.25 -0.00 0.00 -0.86 0.00 0.00 29.16 28.68 1lww h TRP 113 CO -0.22 0.39 -0.12 0.78 -1.05 0.00 0.00 178.44 178.22 1lww h GLY 114 N 0.78 0.00 2.00 1.49 0.00 -0.78 -0.20 103.07 106.37 1lww h GLY 114 Ca 0.32 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.53 1lww h GLY 114 CO -0.17 0.00 -0.57 1.76 0.00 0.00 0.00 176.54 177.56 1lww h SER 115 N 0.00 0.00 -0.01 0.19 0.02 0.55 -3.28 113.55 111.03 1lww h SER 115 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1lww h SER 115 Cb 0.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1lww h SER 115 CO 0.02 0.57 -0.23 1.33 -1.14 0.00 0.00 176.83 177.38 1lww n VAL 116 N -3.51 0.00 -3.48 2.27 0.24 -0.95 -4.86 118.33 108.04 1lww n VAL 116 Ca -0.00 -0.39 -0.25 0.00 -2.04 0.00 0.00 64.34 61.67 1lww n VAL 116 Cb 0.65 1.17 -0.13 0.00 -1.47 0.00 0.00 33.84 34.07 1lww n VAL 116 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1lww s ASP 117 N -1.54 2.77 0.31 -1.34 3.68 -0.13 -5.01 116.67 115.40 1lww s ASP 117 Ca 0.11 -1.20 0.02 0.00 2.13 0.00 0.00 52.55 53.62 1lww s ASP 117 Cb 0.10 -0.03 0.58 0.00 -1.45 0.00 0.00 42.92 42.13 1lww s ASP 117 CO 0.30 -0.40 1.89 -1.28 0.13 0.00 0.00 175.17 175.81 1lww h SER 118 N 8.19 0.87 -0.46 -0.34 0.87 -1.85 -1.41 113.55 119.42 1lww h SER 118 Ca -0.15 0.02 -0.11 0.00 -1.23 0.00 0.00 61.79 60.32 1lww h SER 118 Cb 1.03 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.81 1lww h SER 118 CO 0.38 0.53 -0.14 -0.74 -0.53 0.00 0.00 176.83 176.33 1lww h HIS 119 N 0.97 1.06 -0.17 2.24 -0.00 -1.93 -2.55 115.15 114.78 1lww h HIS 119 Ca 0.41 -0.22 -0.00 0.00 -0.00 0.00 0.00 60.37 60.56 1lww h HIS 119 Cb 0.32 -0.26 -0.01 0.00 -0.00 0.00 0.00 27.41 27.46 1lww h HIS 119 CO -0.00 1.01 0.10 0.35 -0.00 0.00 0.00 177.93 179.39 1lww h PHE 120 N 0.84 0.23 -0.92 5.26 3.57 -1.63 -1.91 116.94 122.37 1lww h PHE 120 Ca 0.13 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.83 1lww h PHE 120 Cb 0.69 -0.07 -0.11 0.00 2.79 0.00 0.00 35.95 39.24 1lww h PHE 120 CO 0.04 0.21 0.48 0.37 -2.23 0.00 0.00 178.31 177.17 1lww h GLN 121 N 0.18 0.52 0.17 1.11 5.75 -1.17 0.20 115.11 121.88 1lww h GLN 121 Ca 0.06 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1lww h GLN 121 Cb 0.05 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.48 1lww h GLN 121 CO -0.01 0.35 -0.08 1.49 -2.65 0.00 0.00 178.83 177.92 1lww h GLU 122 N 0.54 -0.22 -0.27 1.69 4.81 -0.95 -2.67 114.58 117.51 1lww h GLU 122 Ca 0.56 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.76 1lww h GLU 122 Cb 0.98 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1lww h GLU 122 CO -0.46 0.04 0.01 0.28 -0.73 0.00 0.00 179.01 178.15 1lww h VAL 123 N -0.47 1.25 -0.54 0.32 2.07 -0.67 -3.04 116.25 115.17 1lww h VAL 123 Ca -0.02 -0.90 0.13 0.00 0.82 0.00 0.00 66.70 66.73 1lww h VAL 123 Cb 0.36 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1lww h VAL 123 CO 0.04 0.29 0.37 0.00 0.02 0.00 0.00 177.57 178.29 1lww h ALA 124 N 0.83 2.33 -0.04 1.67 0.00 -0.66 -0.85 119.26 122.53 1lww h ALA 124 Ca 0.08 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1lww h ALA 124 Cb 0.41 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1lww h ALA 124 CO 0.01 -0.47 0.08 0.37 0.00 0.00 0.00 179.25 179.24 1lww h GLN 125 N 0.13 0.00 -0.00 0.00 -0.00 -1.35 -2.34 115.11 111.55 1lww h GLN 125 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.90 1lww h GLN 125 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.32 1lww h GLN 125 CO -0.03 0.00 -0.14 0.36 0.00 0.00 0.00 178.83 179.02 1lww n LYS 126 N -3.51 2.46 -3.27 1.69 2.85 -0.36 -4.78 118.16 113.23 1lww n LYS 126 Ca -0.02 -0.46 -0.25 0.00 -1.05 0.00 0.00 58.31 56.53 1lww n LYS 126 Cb 0.16 -0.96 -0.07 0.00 -0.65 0.00 0.00 35.03 33.51 1lww n LYS 126 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1lww n PHE 127 N -0.37 1.30 -2.65 5.58 3.01 -0.88 -5.10 117.46 118.34 1lww n PHE 127 Ca 0.03 -3.81 -0.26 0.00 1.01 0.00 0.00 57.45 54.42 1lww n PHE 127 Cb 0.13 -0.44 0.02 0.00 -0.01 0.00 0.00 39.48 39.19 1lww n PHE 127 CO 0.00 0.00 0.00 1.14 1.01 0.00 0.00 176.76 178.91 1lww s GLN 128 N -1.80 3.10 0.00 -1.08 -2.07 -1.23 -4.37 119.66 112.22 1lww s GLN 128 Ca 0.38 -0.13 0.00 0.00 -1.82 0.00 0.00 55.36 53.79 1lww s GLN 128 Cb 0.17 -2.39 0.00 0.00 -1.09 0.00 0.00 33.01 29.70 1lww s GLN 128 CO -0.07 -0.44 0.00 0.41 -1.32 0.00 0.00 175.29 173.86 1lww n GLY 129 N -2.34 0.44 3.50 2.60 0.00 -1.24 -4.54 105.19 103.61 1lww n GLY 129 Ca 0.02 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.99 1lww n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lww s VAL 130 N -2.00 4.88 0.38 1.61 1.01 -1.26 -1.74 120.40 123.28 1lww s VAL 130 Ca 0.00 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 61.96 1lww s VAL 130 Cb 0.00 -4.19 -0.05 0.00 0.00 0.00 0.00 36.38 32.14 1lww s VAL 130 CO 0.00 -0.60 0.07 0.00 0.00 0.00 0.00 175.10 174.58 1lww s ARG 131 N 2.67 1.82 -0.11 2.72 1.70 -1.26 -4.74 118.95 121.75 1lww s ARG 131 Ca 0.20 -2.07 -0.09 0.00 -0.47 0.00 0.00 55.73 53.30 1lww s ARG 131 Cb -0.15 -0.89 -0.04 0.00 -0.57 0.00 0.00 34.95 33.29 1lww s ARG 131 CO 0.17 -0.30 0.20 -0.51 -1.08 0.00 0.00 175.30 173.79 1lww s LEU 132 N -3.58 4.37 0.40 -1.89 2.01 -1.26 -4.95 118.68 113.78 1lww s LEU 132 Ca 0.29 0.54 -0.23 0.00 0.01 0.00 0.00 54.13 54.74 1lww s LEU 132 Cb 0.06 -2.20 -0.10 0.00 0.01 0.00 0.00 46.19 43.96 1lww s LEU 132 CO 0.14 0.34 0.98 -0.76 1.01 0.00 0.00 176.35 178.06 1lww s LEU 133 N -0.74 4.07 -0.58 1.79 1.02 -1.26 -4.46 118.68 118.51 1lww s LEU 133 Ca 0.16 1.84 -0.14 0.00 0.02 0.00 0.00 54.13 56.00 1lww s LEU 133 Cb -0.13 -4.33 0.14 0.00 0.02 0.00 0.00 46.19 41.89 1lww s LEU 133 CO 0.05 -0.38 0.52 -0.60 0.02 0.00 0.00 176.35 175.96 1lww s ARG 134 N -2.76 3.01 0.50 1.70 6.06 0.45 -4.73 118.95 123.19 1lww s ARG 134 Ca 0.59 -1.86 0.00 0.00 -2.50 0.00 0.00 55.73 51.96 1lww s ARG 134 Cb -0.15 -4.26 0.01 0.00 0.06 0.00 0.00 34.95 30.61 1lww s ARG 134 CO 0.20 -1.30 0.73 -0.65 -2.50 0.00 0.00 175.30 171.77 1lww s GLN 135 N 1.29 2.83 0.03 5.12 -0.21 0.26 -4.70 119.66 124.27 1lww s GLN 135 Ca 0.06 -0.59 -0.30 0.00 0.02 0.00 0.00 55.36 54.55 1lww s GLN 135 Cb -0.26 -2.51 -0.05 0.00 1.00 0.00 0.00 33.01 31.19 1lww s GLN 135 CO 0.00 -0.48 1.14 0.34 -2.12 0.00 0.00 175.29 174.17 1lww s ASP 136 N -4.31 7.15 0.27 5.90 2.15 -1.26 -4.49 116.67 122.08 1lww s ASP 136 Ca 0.52 1.89 -0.01 0.00 0.43 0.00 0.00 52.55 55.38 1lww s ASP 136 Cb -0.10 -2.57 0.60 0.00 -0.30 0.00 0.00 42.92 40.55 1lww s ASP 136 CO 0.38 -0.43 1.67 -0.65 -0.17 0.00 0.00 175.17 175.97 1lww h PRO 137 N 6.90 0.27 0.05 4.34 0.11 -1.95 0.93 132.00 142.65 1lww h PRO 137 Ca -0.40 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.69 1lww h PRO 137 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1lww h PRO 137 CO 0.81 0.18 -0.03 0.82 -0.21 0.00 0.00 178.00 179.57 1lww h ILE 138 N 0.28 1.26 -0.45 4.15 1.08 -1.98 0.15 117.51 122.00 1lww h ILE 138 Ca 0.49 -1.12 0.03 0.00 -0.39 0.00 0.00 64.86 63.87 1lww h ILE 138 Cb 0.92 1.98 -0.03 0.00 -3.07 0.00 0.00 36.82 36.62 1lww h ILE 138 CO -0.57 0.28 0.24 -0.08 -0.69 0.00 0.00 178.15 177.33 1lww h GLU 139 N -0.58 0.47 -0.57 2.37 4.81 -1.84 -1.72 114.58 117.52 1lww h GLU 139 Ca -0.01 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 1lww h GLU 139 Cb 0.51 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1lww h GLU 139 CO 0.01 0.31 0.12 0.00 -0.73 0.00 0.00 179.01 178.73 1lww h LEU 141 N 0.86 -0.48 -0.67 0.00 5.85 0.04 -2.82 115.31 118.08 1lww h LEU 141 Ca 0.18 -0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.71 1lww h LEU 141 Cb 0.34 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1lww h LEU 141 CO 0.00 -0.22 -0.63 -0.26 -0.34 0.00 0.00 178.44 176.99 1lww h PHE 142 N -0.73 0.00 -0.38 1.25 -1.00 -1.35 -2.48 116.94 112.25 1lww h PHE 142 Ca -0.06 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.70 1lww h PHE 142 Cb 0.52 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.06 1lww h PHE 142 CO -0.01 0.63 0.16 0.77 -1.61 0.00 0.00 178.31 178.25 1lww h SER 143 N 0.00 0.51 1.39 2.17 0.02 -1.32 -2.60 113.55 113.72 1lww h SER 143 Ca -0.01 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1lww h SER 143 Cb 1.16 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.56 1lww h SER 143 CO 0.08 0.52 0.00 -0.26 -1.14 0.00 0.00 176.83 176.03 1lww h PHE 144 N 0.47 0.00 -0.20 3.45 -1.00 -1.45 -2.23 116.94 115.98 1lww h PHE 144 Ca 0.13 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.83 1lww h PHE 144 Cb 0.16 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 1lww h PHE 144 CO -0.01 0.00 -0.20 0.82 -1.61 0.00 0.00 178.31 177.31 1lww h ILE 145 N 0.00 1.23 0.00 -0.55 1.08 -1.08 -1.57 117.51 116.63 1lww h ILE 145 Ca 0.00 -1.07 0.00 0.00 -0.39 0.00 0.00 64.86 63.40 1lww h ILE 145 Cb 0.70 1.30 0.00 0.00 -3.07 0.00 0.00 36.82 35.75 1lww h ILE 145 CO 0.00 0.34 0.00 0.00 -0.69 0.00 0.00 178.15 177.80 1lww h SER 147 N 0.00 0.39 -1.96 0.00 0.02 -1.07 -3.45 113.55 107.49 1lww h SER 147 Ca 0.00 -0.29 -0.64 0.00 -0.84 0.00 0.00 61.79 60.02 1lww h SER 147 Cb 0.66 -0.12 0.06 0.00 0.14 0.00 0.00 62.40 63.15 1lww h SER 147 CO 0.00 1.06 0.47 -1.54 -1.14 0.00 0.00 176.83 175.68 1lww n SER 148 N -3.76 1.90 -4.01 3.07 3.41 -1.24 -2.18 113.62 110.82 1lww n SER 148 Ca -0.04 1.12 -0.30 0.00 -0.26 0.00 0.00 58.87 59.39 1lww n SER 148 Cb 0.76 -1.26 -0.00 0.00 -0.26 0.00 0.00 64.21 63.45 1lww n SER 148 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1lww n ASN 149 N 2.48 -2.85 -3.61 4.04 4.05 -1.26 -4.93 115.26 113.18 1lww n ASN 149 Ca 0.16 -0.92 -0.15 0.00 0.45 0.00 0.00 54.58 54.13 1lww n ASN 149 Cb 0.24 -3.32 -0.07 0.00 1.23 0.00 0.00 39.78 37.86 1lww n ASN 149 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 1lww s ASN 150 N -3.66 0.80 0.17 1.20 3.04 -0.93 -5.17 114.94 110.39 1lww s ASN 150 Ca 0.47 -1.46 0.10 0.00 0.04 0.00 0.00 52.86 52.00 1lww s ASN 150 Cb -0.25 0.56 -0.04 0.00 -1.54 0.00 0.00 41.25 39.98 1lww s ASN 150 CO 0.88 -1.10 -0.15 0.54 -3.04 0.00 0.00 177.10 174.22 1lww s ASN 151 N -3.23 3.94 0.27 -4.21 2.20 -1.26 -5.02 114.94 107.63 1lww s ASN 151 Ca 0.34 -0.66 -0.01 0.00 -0.94 0.00 0.00 52.86 51.60 1lww s ASN 151 Cb 0.02 -0.55 0.54 0.00 -2.00 0.00 0.00 41.25 39.26 1lww s ASN 151 CO 0.19 0.12 1.78 0.40 -2.94 0.00 0.00 177.10 176.65 1lww h ILE 152 N 3.04 0.77 -0.18 0.54 2.04 -1.99 -0.57 117.51 121.16 1lww h ILE 152 Ca -0.47 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 1lww h ILE 152 Cb 1.20 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1lww h ILE 152 CO 0.51 0.13 0.11 0.00 0.00 0.00 0.00 178.15 178.89 1lww h ALA 153 N 1.55 0.23 -0.22 1.87 0.00 -1.97 -1.22 119.26 119.50 1lww h ALA 153 Ca 0.47 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.30 1lww h ALA 153 Cb 0.62 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1lww h ALA 153 CO -0.34 -0.26 -0.04 -0.09 0.00 0.00 0.00 179.25 178.52 1lww h ARG 154 N 0.21 0.42 -1.01 0.00 1.12 -1.87 -2.93 114.38 110.33 1lww h ARG 154 Ca 0.07 -0.15 0.14 0.00 -1.11 0.00 0.00 59.98 58.93 1lww h ARG 154 Cb 0.03 -0.03 -0.09 0.00 -0.01 0.00 0.00 29.97 29.87 1lww h ARG 154 CO -0.01 0.64 0.63 0.82 -3.11 0.00 0.00 179.97 178.93 1lww h ILE 155 N 0.16 0.85 -0.78 1.20 2.04 -1.03 -1.46 117.51 118.49 1lww h ILE 155 Ca 0.06 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.64 1lww h ILE 155 Cb 0.48 -0.15 -0.05 0.00 -0.74 0.00 0.00 36.82 36.35 1lww h ILE 155 CO 0.02 0.17 0.49 0.74 0.00 0.00 0.00 178.15 179.56 1lww h THR 156 N 0.92 1.09 -0.28 -0.27 2.02 -1.03 -1.20 112.91 114.16 1lww h THR 156 Ca 0.53 -0.32 -0.15 0.00 0.77 0.00 0.00 66.41 67.23 1lww h THR 156 Cb 0.62 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1lww h THR 156 CO -0.31 0.17 -0.43 1.23 0.37 0.00 0.00 175.52 176.56 1lww h GLY 157 N 0.94 0.86 0.60 2.16 0.00 -1.23 -2.56 103.07 103.83 1lww h GLY 157 Ca 0.32 -0.96 0.05 0.00 0.00 0.00 0.00 47.33 46.74 1lww h GLY 157 CO -0.13 0.86 0.14 -0.33 0.00 0.00 0.00 176.54 177.09 1lww h MET 158 N 0.54 0.29 -0.38 4.80 2.07 -1.02 -0.45 114.93 120.79 1lww h MET 158 Ca 0.03 -0.02 -0.07 0.00 -2.07 0.00 0.00 59.70 57.57 1lww h MET 158 Cb 1.03 -0.07 -0.02 0.00 -1.87 0.00 0.00 31.60 30.67 1lww h MET 158 CO 0.10 0.19 -0.06 0.28 1.07 0.00 0.00 176.91 178.49 1lww h VAL 159 N 0.30 1.23 -0.25 -2.22 2.07 -1.21 -0.34 116.25 115.84 1lww h VAL 159 Ca 0.20 -0.99 -0.07 0.00 0.82 0.00 0.00 66.70 66.66 1lww h VAL 159 Cb 0.19 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1lww h VAL 159 CO -0.21 0.34 -0.10 -0.33 0.02 0.00 0.00 177.57 177.29 1lww h GLU 160 N 0.59 0.51 -0.11 1.57 5.08 -1.00 -1.76 114.58 119.45 1lww h GLU 160 Ca 0.11 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 1lww h GLU 160 Cb 0.46 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1lww h GLU 160 CO 0.02 0.75 -0.35 0.00 -1.00 0.00 0.00 179.01 178.43 1lww h ARG 161 N 0.23 0.22 -0.40 2.33 3.08 -0.90 -1.08 114.38 117.86 1lww h ARG 161 Ca 0.06 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 1lww h ARG 161 Cb 0.59 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 1lww h ARG 161 CO 0.03 0.55 -0.01 1.25 -1.07 0.00 0.00 179.97 180.72 1lww h LEU 162 N 0.19 0.71 -0.53 3.04 6.46 -0.93 -1.66 115.31 122.59 1lww h LEU 162 Ca 0.02 -0.32 -0.16 0.00 -0.12 0.00 0.00 57.88 57.30 1lww h LEU 162 Cb 0.72 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.44 1lww h LEU 162 CO 0.05 0.85 -0.70 0.00 -0.62 0.00 0.00 178.44 178.03 1lww h GLN 164 N 0.14 0.89 0.05 0.00 4.15 -1.08 0.11 115.11 119.37 1lww h GLN 164 Ca -0.02 -0.33 -0.23 0.00 0.77 0.00 0.00 58.65 58.84 1lww h GLN 164 Cb 1.25 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 1lww h GLN 164 CO 0.11 0.98 -1.05 0.00 -1.93 0.00 0.00 178.83 176.93 1lww h ALA 165 N 0.89 0.30 0.00 3.38 0.00 -1.28 -3.39 119.26 119.16 1lww h ALA 165 Ca 0.12 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1lww h ALA 165 Cb 0.64 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1lww h ALA 165 CO 0.04 0.99 0.00 1.19 0.00 0.00 0.00 179.25 181.48 1lww n PHE 166 N -3.56 0.00 -4.10 0.00 3.01 -0.57 -5.07 117.46 107.17 1lww n PHE 166 Ca -0.05 -0.02 -0.23 0.00 1.01 0.00 0.00 57.45 58.15 1lww n PHE 166 Cb 0.92 -0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 40.34 1lww n PHE 166 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1lww s GLY 167 N -0.05 1.50 0.32 1.37 0.00 0.37 -4.46 107.32 106.36 1lww s GLY 167 Ca 0.00 -1.35 -0.29 0.00 0.00 0.00 0.00 44.72 43.07 1lww s GLY 167 CO 0.00 -1.38 1.57 -1.05 0.00 0.00 0.00 173.10 172.24 1lww n PRO 168 N -0.93 2.70 -2.55 2.90 -0.02 -1.25 -4.65 135.00 131.19 1lww n PRO 168 Ca -0.08 0.96 -0.42 0.00 -2.02 0.00 0.00 63.50 61.94 1lww n PRO 168 Cb 0.57 -2.73 -0.03 0.00 -0.02 0.00 0.00 33.50 31.29 1lww n PRO 168 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1lww s ARG 169 N -0.96 4.46 0.00 -0.52 3.52 -1.26 -0.56 118.95 123.64 1lww s ARG 169 Ca 0.61 1.60 0.00 0.00 -0.13 0.00 0.00 55.73 57.81 1lww s ARG 169 Cb -0.49 -3.43 0.00 0.00 -1.56 0.00 0.00 34.95 29.47 1lww s ARG 169 CO 0.53 -0.22 0.00 1.28 -0.81 0.00 0.00 175.30 176.08 1lww n LEU 170 N 4.20 0.03 -4.04 -0.88 4.77 0.84 -4.92 117.00 117.01 1lww n LEU 170 Ca 0.08 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.96 1lww n LEU 170 Cb 0.48 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.50 1lww n LEU 170 CO 0.54 0.00 -0.01 0.27 -1.33 0.00 0.00 177.39 176.86 1lww s ILE 171 N 0.00 0.03 -0.08 -0.08 -5.25 -1.24 -4.98 121.20 109.60 1lww s ILE 171 Ca 0.00 -1.57 0.05 0.00 -0.99 0.00 0.00 60.65 58.14 1lww s ILE 171 Cb 0.00 -2.14 -0.00 0.00 2.95 0.00 0.00 42.46 43.26 1lww s ILE 171 CO 0.00 -0.12 -0.24 -1.58 -1.79 0.00 0.00 174.94 171.21 1lww s GLN 172 N -4.04 2.77 -0.11 0.37 0.74 -1.26 -0.33 119.66 117.81 1lww s GLN 172 Ca 0.25 -0.87 0.02 0.00 0.05 0.00 0.00 55.36 54.80 1lww s GLN 172 Cb 0.03 -2.20 0.02 0.00 1.10 0.00 0.00 33.01 31.96 1lww s GLN 172 CO 0.06 0.26 -0.14 -0.51 -0.55 0.00 0.00 175.29 174.41 1lww s LEU 173 N 0.13 1.67 0.00 3.68 1.43 0.64 -4.93 118.68 121.30 1lww s LEU 173 Ca -0.12 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 1lww s LEU 173 Cb -0.16 -1.05 0.00 0.00 0.03 0.00 0.00 46.19 45.01 1lww s LEU 173 CO 0.06 0.00 0.00 0.47 0.23 0.00 0.00 176.35 177.12 1lww n ASP 174 N 4.24 0.00 -1.86 2.29 8.00 -1.26 -0.49 116.55 127.47 1lww n ASP 174 Ca -0.19 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.35 1lww n ASP 174 Cb 0.51 0.00 0.36 0.00 -0.02 0.00 0.00 41.12 41.97 1lww n ASP 174 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1lww n ASP 175 N 3.96 5.30 -4.41 -2.24 5.75 -1.26 -4.90 116.55 118.75 1lww n ASP 175 Ca 0.00 -2.95 -0.36 0.00 -0.01 0.00 0.00 54.79 51.47 1lww n ASP 175 Cb 0.00 -0.69 -0.13 0.00 -1.03 0.00 0.00 41.12 39.27 1lww n ASP 175 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1lww s VAL 176 N -2.72 4.04 -0.25 2.12 1.01 0.35 -5.08 120.40 119.88 1lww s VAL 176 Ca 0.52 -0.26 -0.09 0.00 0.00 0.00 0.00 61.98 62.14 1lww s VAL 176 Cb 0.40 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1lww s VAL 176 CO 0.15 0.36 0.13 -0.89 0.00 0.00 0.00 175.10 174.85 1lww s THR 177 N 1.56 4.92 0.13 3.92 2.01 -1.26 -0.26 115.64 126.66 1lww s THR 177 Ca 0.06 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 61.92 1lww s THR 177 Cb -0.15 -3.30 -0.07 0.00 0.01 0.00 0.00 72.50 68.99 1lww s THR 177 CO 0.02 0.32 0.59 -0.31 -0.69 0.00 0.00 174.62 174.54 1lww s TYR 178 N 1.41 3.69 0.04 4.92 1.51 0.55 -4.98 117.35 124.48 1lww s TYR 178 Ca 0.06 1.19 0.05 0.00 -1.01 0.00 0.00 57.07 57.37 1lww s TYR 178 Cb -0.15 -2.46 -0.02 0.00 -0.11 0.00 0.00 41.96 39.22 1lww s TYR 178 CO 0.06 0.47 -0.15 -1.01 -1.11 0.00 0.00 175.55 173.81 1lww s HIS 179 N -1.35 1.33 0.77 2.71 3.76 -1.26 -0.11 115.29 121.14 1lww s HIS 179 Ca 0.35 -0.35 -0.12 0.00 -0.15 0.00 0.00 55.06 54.80 1lww s HIS 179 Cb -0.17 -0.79 0.05 0.00 1.11 0.00 0.00 32.58 32.78 1lww s HIS 179 CO 0.19 0.04 1.11 0.20 -0.85 0.00 0.00 174.74 175.44 1lww s GLY 180 N -1.11 1.62 0.26 -2.22 0.00 0.28 -4.92 107.32 101.23 1lww s GLY 180 Ca 0.03 -0.36 -0.29 0.00 0.00 0.00 0.00 44.72 44.10 1lww s GLY 180 CO 0.01 0.07 1.18 -0.12 0.00 0.00 0.00 173.10 174.23 1lww s PHE 181 N -3.32 3.42 0.63 1.90 5.36 -1.26 -3.87 117.98 120.84 1lww s PHE 181 Ca 0.60 1.55 -0.19 0.00 -0.96 0.00 0.00 56.93 57.93 1lww s PHE 181 Cb -0.12 -3.42 -0.02 0.00 -0.34 0.00 0.00 43.02 39.12 1lww s PHE 181 CO 0.52 -1.04 1.29 -2.30 -1.46 0.00 0.00 175.22 172.23 1lww n PRO 182 N 1.50 1.20 -1.84 10.12 -0.02 -1.26 -4.71 135.00 139.99 1lww n PRO 182 Ca 0.01 0.47 -0.29 0.00 -2.02 0.00 0.00 63.50 61.66 1lww n PRO 182 Cb 0.44 -2.52 0.12 0.00 -0.02 0.00 0.00 33.50 31.51 1lww n PRO 182 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1lww s SER 183 N -1.29 4.02 0.12 2.55 1.04 -1.26 -4.89 113.70 113.99 1lww s SER 183 Ca 0.81 0.70 -0.16 0.00 0.48 0.00 0.00 55.95 57.77 1lww s SER 183 Cb -0.39 -1.10 -0.02 0.00 0.10 0.00 0.00 66.02 64.60 1lww s SER 183 CO 0.42 -2.21 1.63 0.25 0.98 0.00 0.00 173.24 174.32 1lww h LEU 184 N -1.27 0.54 -0.58 2.42 5.85 -1.96 -1.93 115.31 118.38 1lww h LEU 184 Ca -0.46 -0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.11 1lww h LEU 184 Cb 1.31 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.14 1lww h LEU 184 CO 0.59 0.61 0.27 1.56 -0.34 0.00 0.00 178.44 181.13 1lww h GLN 185 N 0.44 0.49 -0.53 1.25 7.50 -1.93 0.11 115.11 122.44 1lww h GLN 185 Ca 0.12 -0.03 -0.03 0.00 0.50 0.00 0.00 58.65 59.21 1lww h GLN 185 Cb 0.27 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 27.66 1lww h GLN 185 CO -0.00 0.32 0.22 0.00 -1.50 0.00 0.00 178.83 177.87 1lww h ALA 186 N 1.34 0.69 0.00 3.87 0.00 -1.87 -1.58 119.26 121.72 1lww h ALA 186 Ca 0.27 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1lww h ALA 186 Cb 0.24 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1lww h ALA 186 CO -0.22 0.30 -0.09 -0.07 0.00 0.00 0.00 179.25 179.17 1lww h LEU 187 N 0.72 0.00 -1.21 0.00 3.38 -0.72 -2.60 115.31 114.88 1lww h LEU 187 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1lww h LEU 187 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1lww h LEU 187 CO -0.02 0.09 -0.08 0.00 0.09 0.00 0.00 178.44 178.52 1lww n ALA 188 N -2.15 2.71 -0.29 1.53 0.00 0.33 -4.41 120.51 118.24 1lww n ALA 188 Ca 0.01 -0.54 -0.30 0.00 0.00 0.00 0.00 53.44 52.61 1lww n ALA 188 Cb 0.37 -1.01 0.28 0.00 0.00 0.00 0.00 19.45 19.10 1lww n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lww n GLY 189 N 1.28 -3.48 3.75 0.00 0.00 -0.63 -4.84 105.19 101.27 1lww n GLY 189 Ca 0.15 -1.56 -0.40 0.00 0.00 0.00 0.00 46.02 44.22 1lww n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lww s PRO 190 N -4.84 4.83 -0.45 1.61 0.04 -1.26 -3.85 135.00 131.07 1lww s PRO 190 Ca 0.66 1.45 0.00 0.00 0.04 0.00 0.00 61.00 63.16 1lww s PRO 190 Cb -0.15 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.12 1lww s PRO 190 CO 0.58 0.52 0.00 0.39 0.04 0.00 0.00 177.00 178.53 1lww n GLU 191 N 1.49 -1.21 0.06 4.56 1.02 -1.26 -4.90 120.64 120.40 1lww n GLU 191 Ca -0.02 0.53 -0.12 0.00 -0.02 0.00 0.00 57.16 57.52 1lww n GLU 191 Cb 0.47 -4.55 -0.07 0.00 -0.02 0.00 0.00 31.44 27.27 1lww n GLU 191 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1lww h VAL 192 N 0.00 0.95 -0.72 2.62 2.07 -1.90 -2.27 116.25 117.00 1lww h VAL 192 Ca -0.09 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.57 1lww h VAL 192 Cb 0.73 0.95 -0.10 0.00 -1.52 0.00 0.00 31.29 31.36 1lww h VAL 192 CO 0.13 0.00 0.25 -0.08 0.02 0.00 0.00 177.57 177.88 1lww h GLU 193 N -0.06 0.37 -0.74 1.57 4.81 -1.89 0.20 114.58 118.84 1lww h GLU 193 Ca -0.01 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1lww h GLU 193 Cb 0.05 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1lww h GLU 193 CO 0.01 0.24 0.32 0.00 -0.73 0.00 0.00 179.01 178.86 1lww h ALA 194 N 1.54 1.18 -0.36 2.92 0.00 -1.87 -1.02 119.26 121.66 1lww h ALA 194 Ca 0.39 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.97 1lww h ALA 194 Cb 0.61 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1lww h ALA 194 CO -0.42 0.61 -0.43 1.25 0.00 0.00 0.00 179.25 180.26 1lww h HIS 195 N 1.06 1.11 -0.26 0.00 -0.00 -0.53 -3.00 115.15 113.54 1lww h HIS 195 Ca 0.25 -0.35 -0.05 0.00 -0.00 0.00 0.00 60.37 60.22 1lww h HIS 195 Cb 0.16 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 27.32 1lww h HIS 195 CO 0.01 1.18 -0.07 -0.07 -0.00 0.00 0.00 177.93 178.98 1lww h LEU 196 N 0.73 0.39 -0.80 0.26 3.38 -0.30 -2.46 115.31 116.51 1lww h LEU 196 Ca 0.05 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1lww h LEU 196 Cb 1.03 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 1lww h LEU 196 CO 0.10 0.51 -0.04 0.03 0.09 0.00 0.00 178.44 179.13 1lww h ARG 197 N 0.39 0.86 0.00 1.13 3.08 -1.07 -1.55 114.38 117.23 1lww h ARG 197 Ca 0.08 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 1lww h ARG 197 Cb 0.37 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 1lww h ARG 197 CO 0.02 0.89 -0.09 0.87 -1.07 0.00 0.00 179.97 180.59 1lww h LYS 198 N 0.79 0.00 -0.01 0.04 1.57 -1.33 -1.31 116.57 116.33 1lww h LYS 198 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1lww h LYS 198 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1lww h LYS 198 CO 0.03 0.09 -0.00 1.28 -0.57 0.00 0.00 179.45 180.27 1lww n LEU 199 N -3.26 0.78 0.00 2.94 4.77 -0.62 -4.94 117.00 116.66 1lww n LEU 199 Ca -0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1lww n LEU 199 Cb 0.32 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1lww n LEU 199 CO 0.29 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1lww n GLY 200 N 1.10 0.55 0.08 -0.72 0.00 -0.49 -4.87 105.19 100.84 1lww n GLY 200 Ca 0.21 -0.84 0.15 0.00 0.00 0.00 0.00 46.02 45.54 1lww n GLY 200 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1lww n LEU 201 N 0.00 0.26 0.00 0.99 4.77 -0.97 -4.99 117.00 117.06 1lww n LEU 201 Ca 0.00 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1lww n LEU 201 Cb 0.18 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1lww n LEU 201 CO 0.00 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.72 1lww n GLY 202 N 1.00 1.74 0.16 -0.72 0.00 -1.26 -2.27 105.19 103.83 1lww n GLY 202 Ca 0.22 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.85 1lww n GLY 202 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1lww h TYR 203 N 0.00 0.00 0.00 1.61 -0.00 -1.99 -2.67 116.97 113.91 1lww h TYR 203 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1lww h TYR 203 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 1lww h TYR 203 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.16 1lww h ARG 204 N 0.00 0.00 -0.91 0.10 3.08 -1.82 -2.86 114.38 111.97 1lww h ARG 204 Ca 0.00 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.15 1lww h ARG 204 Cb 0.28 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.27 1lww h ARG 204 CO 0.00 0.00 0.59 0.00 -1.07 0.00 0.00 179.97 179.49 1lww h ALA 205 N 2.13 1.63 -0.41 0.04 0.00 -1.55 -0.29 119.26 120.80 1lww h ALA 205 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1lww h ALA 205 Cb 0.47 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1lww h ALA 205 CO 0.00 0.17 -0.12 -0.09 0.00 0.00 0.00 179.25 179.22 1lww h ARG 206 N 0.89 0.80 -0.73 0.00 9.65 -1.74 -2.61 114.38 120.64 1lww h ARG 206 Ca 0.43 -0.31 0.02 0.00 -1.10 0.00 0.00 59.98 59.02 1lww h ARG 206 Cb 0.45 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.94 1lww h ARG 206 CO -0.19 0.93 0.47 1.88 2.80 0.00 0.00 179.97 185.86 1lww h TYR 207 N 0.61 0.89 0.37 2.20 0.05 -1.20 0.22 116.97 120.11 1lww h TYR 207 Ca 0.10 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.89 1lww h TYR 207 Cb 0.65 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 38.10 1lww h TYR 207 CO 0.05 0.52 -0.18 0.28 -1.05 0.00 0.00 178.16 177.79 1lww h VAL 208 N 0.93 0.64 0.43 -2.88 2.07 -1.07 0.28 116.25 116.66 1lww h VAL 208 Ca 0.29 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1lww h VAL 208 Cb -0.03 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1lww h VAL 208 CO -0.09 0.06 -0.27 -1.28 0.02 0.00 0.00 177.57 176.00 1lww h SER 209 N -0.67 -0.69 -0.76 0.57 0.87 -1.34 -1.34 113.55 110.19 1lww h SER 209 Ca -0.05 0.04 0.07 0.00 -1.23 0.00 0.00 61.79 60.62 1lww h SER 209 Cb 0.48 0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 62.60 1lww h SER 209 CO 0.08 -0.43 0.50 0.00 -0.53 0.00 0.00 176.83 176.45 1lww h ALA 210 N -0.16 1.68 -0.13 6.23 0.00 -0.58 -2.29 119.26 124.01 1lww h ALA 210 Ca -0.05 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 1lww h ALA 210 Cb 0.56 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1lww h ALA 210 CO 0.04 0.19 -0.69 0.77 0.00 0.00 0.00 179.25 179.57 1lww h SER 211 N 0.79 0.66 -0.33 0.00 0.02 -0.16 -1.79 113.55 112.75 1lww h SER 211 Ca 0.33 -0.41 -0.04 0.00 -0.84 0.00 0.00 61.79 60.84 1lww h SER 211 Cb 0.28 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1lww h SER 211 CO -0.12 1.16 0.06 0.00 -1.14 0.00 0.00 176.83 176.79 1lww h ALA 212 N 0.84 0.43 -0.47 3.77 0.00 -0.83 -1.55 119.26 121.46 1lww h ALA 212 Ca -0.02 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1lww h ALA 212 Cb 1.27 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1lww h ALA 212 CO 0.13 0.13 -0.03 0.00 0.00 0.00 0.00 179.25 179.48 1lww h ARG 213 N 0.37 0.84 -0.79 0.00 3.08 -1.46 -1.43 114.38 114.99 1lww h ARG 213 Ca 0.10 -0.28 0.04 0.00 0.07 0.00 0.00 59.98 59.91 1lww h ARG 213 Cb 0.34 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.27 1lww h ARG 213 CO 0.01 0.90 0.49 0.00 -1.07 0.00 0.00 179.97 180.30 1lww h ALA 214 N 0.91 1.06 -0.33 0.04 0.00 -1.23 0.80 119.26 120.50 1lww h ALA 214 Ca 0.13 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1lww h ALA 214 Cb 0.54 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1lww h ALA 214 CO 0.03 0.26 -0.21 0.82 0.00 0.00 0.00 179.25 180.16 1lww h ILE 215 N 0.93 1.29 0.00 0.00 2.04 -1.06 -0.94 117.51 119.77 1lww h ILE 215 Ca 0.33 -1.34 -0.18 0.00 1.00 0.00 0.00 64.86 64.67 1lww h ILE 215 Cb 0.09 1.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 1lww h ILE 215 CO -0.14 0.44 -0.90 0.25 0.00 0.00 0.00 178.15 177.80 1lww h LEU 216 N 0.50 0.00 -0.88 1.44 5.85 -0.85 0.54 115.31 121.91 1lww h LEU 216 Ca 0.07 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1lww h LEU 216 Cb 0.76 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.79 1lww h LEU 216 CO 0.06 0.84 -0.15 -0.62 -0.34 0.00 0.00 178.44 178.23 1lww n GLU 217 N -3.29 1.72 0.00 1.25 1.02 0.27 -4.28 120.64 117.35 1lww n GLU 217 Ca -0.00 -0.69 0.00 0.00 -0.02 0.00 0.00 57.16 56.45 1lww n GLU 217 Cb 0.88 -1.08 0.00 0.00 -0.02 0.00 0.00 31.44 31.22 1lww n GLU 217 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1lww n GLU 218 N -0.08 0.70 0.01 3.49 1.02 -0.45 -4.88 120.64 120.45 1lww n GLU 218 Ca 0.04 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.29 1lww n GLU 218 Cb 0.20 -0.62 0.05 0.00 -0.02 0.00 0.00 31.44 31.05 1lww n GLU 218 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1lww n GLN 219 N -1.14 0.15 0.00 3.49 1.13 -0.69 -4.97 117.38 115.35 1lww n GLN 219 Ca 0.00 -0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1lww n GLN 219 Cb 0.12 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 28.93 1lww n GLN 219 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1lww n GLY 220 N 1.43 1.21 6.36 1.08 0.00 -1.13 -4.71 105.19 109.44 1lww n GLY 220 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1lww n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lww n GLY 221 N -1.02 -1.90 0.40 -0.02 0.00 0.19 -4.30 105.19 98.54 1lww n GLY 221 Ca 0.00 -1.45 0.19 0.00 0.00 0.00 0.00 46.02 44.76 1lww n GLY 221 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1lww h LEU 222 N 0.00 0.41 -1.48 0.99 5.85 -1.96 -1.35 115.31 117.77 1lww h LEU 222 Ca 0.00 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.82 1lww h LEU 222 Cb 0.00 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1lww h LEU 222 CO 0.00 0.17 0.41 0.00 -0.34 0.00 0.00 178.44 178.68 1lww h ALA 223 N 1.61 1.76 -0.48 1.25 0.00 -1.97 -1.40 119.26 120.03 1lww h ALA 223 Ca 0.46 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.31 1lww h ALA 223 Cb 1.15 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1lww h ALA 223 CO -0.17 0.15 0.13 2.35 0.00 0.00 0.00 179.25 181.71 1lww h TRP 224 N 0.65 0.73 0.06 0.00 7.01 -1.44 -1.54 115.95 121.41 1lww h TRP 224 Ca 0.26 -0.05 -0.00 0.00 2.11 0.00 0.00 58.89 61.21 1lww h TRP 224 Cb 0.23 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.07 1lww h TRP 224 CO -0.00 0.61 -0.03 1.25 -2.79 0.00 0.00 178.44 177.48 1lww h LEU 225 N 0.70 -0.07 -1.50 0.65 5.85 -1.39 -3.21 115.31 116.34 1lww h LEU 225 Ca 0.16 -0.49 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1lww h LEU 225 Cb 0.24 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1lww h LEU 225 CO -0.01 0.63 0.03 1.56 -0.34 0.00 0.00 178.44 180.32 1lww h GLN 226 N -0.95 0.00 0.01 1.25 4.20 -1.33 -2.03 115.11 116.27 1lww h GLN 226 Ca -0.01 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1lww h GLN 226 Cb 0.55 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.34 1lww h GLN 226 CO 0.01 0.00 -0.28 0.37 -0.67 0.00 0.00 178.83 178.27 1lww h GLN 227 N 0.00 0.18 -0.36 1.46 4.15 -1.28 -3.29 115.11 115.96 1lww h GLN 227 Ca 0.00 -0.20 0.10 0.00 0.77 0.00 0.00 58.65 59.33 1lww h GLN 227 Cb 0.07 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 1lww h GLN 227 CO 0.00 0.95 0.79 -0.07 -1.93 0.00 0.00 178.83 178.57 1lww h LEU 228 N -0.51 0.00 -1.86 -2.39 4.07 -1.37 0.29 115.31 113.54 1lww h LEU 228 Ca -0.04 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.90 1lww h LEU 228 Cb 1.05 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.79 1lww h LEU 228 CO 0.05 0.00 -0.13 -0.09 -1.08 0.00 0.00 178.44 177.19 1lww h ARG 229 N 0.00 0.00 0.00 1.13 2.43 -1.70 -2.04 114.38 114.20 1lww h ARG 229 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1lww h ARG 229 Cb 1.75 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.30 1lww h ARG 229 CO -0.00 0.13 -1.07 0.39 -1.51 0.00 0.00 179.97 177.91 1lww n GLU 230 N -3.81 0.14 -1.78 0.20 4.71 0.09 -4.84 120.64 115.34 1lww n GLU 230 Ca -0.02 -0.03 -0.30 0.00 -0.01 0.00 0.00 57.16 56.80 1lww n GLU 230 Cb 0.24 -1.52 0.21 0.00 -1.01 0.00 0.00 31.44 29.36 1lww n GLU 230 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 1lww s SER 231 N -3.37 2.46 0.22 1.62 0.01 -0.77 -5.06 113.70 108.81 1lww s SER 231 Ca 0.06 0.24 -0.06 0.00 1.31 0.00 0.00 55.95 57.50 1lww s SER 231 Cb 0.16 -0.24 -0.06 0.00 0.21 0.00 0.00 66.02 66.09 1lww s SER 231 CO 0.84 -3.14 0.49 -0.94 0.41 0.00 0.00 173.24 170.90 1lww s SER 232 N -4.77 6.51 0.24 2.44 1.04 -1.26 -4.86 113.70 113.03 1lww s SER 232 Ca 0.75 0.71 -0.08 0.00 0.48 0.00 0.00 55.95 57.82 1lww s SER 232 Cb -0.03 -2.14 0.40 0.00 0.10 0.00 0.00 66.02 64.34 1lww s SER 232 CO 0.54 -0.07 1.64 0.22 0.98 0.00 0.00 173.24 176.54 1lww h TYR 233 N 2.31 -0.08 -0.55 5.02 3.20 -1.96 0.63 116.97 125.53 1lww h TYR 233 Ca -0.47 0.05 0.07 0.00 3.14 0.00 0.00 58.73 61.53 1lww h TYR 233 Cb 1.18 0.15 -0.06 0.00 1.54 0.00 0.00 36.73 39.54 1lww h TYR 233 CO 0.60 -0.24 0.22 0.93 -1.64 0.00 0.00 178.16 178.03 1lww h GLU 234 N 0.09 0.40 0.80 1.82 3.07 -1.99 0.18 114.58 118.94 1lww h GLU 234 Ca 0.39 -0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 59.19 1lww h GLU 234 Cb 0.67 -0.09 0.01 0.00 -0.84 0.00 0.00 28.75 28.50 1lww h GLU 234 CO -0.65 0.26 -0.38 0.93 -1.40 0.00 0.00 179.01 177.77 1lww h GLU 235 N 0.41 -1.03 -0.53 2.33 4.39 -0.72 -2.93 114.58 116.49 1lww h GLU 235 Ca 0.27 0.07 0.11 0.00 0.34 0.00 0.00 59.36 60.14 1lww h GLU 235 Cb 0.29 0.23 -0.09 0.00 -0.10 0.00 0.00 28.75 29.08 1lww h GLU 235 CO -0.25 -0.68 -0.01 0.00 -1.16 0.00 0.00 179.01 176.91 1lww h ALA 236 N -1.22 0.50 -0.48 3.43 0.00 0.28 -2.16 119.26 119.62 1lww h ALA 236 Ca -0.11 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1lww h ALA 236 Cb 0.83 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1lww h ALA 236 CO 0.18 -0.39 0.31 1.25 0.00 0.00 0.00 179.25 180.59 1lww h HIS 237 N 0.11 0.61 -0.41 0.00 -0.00 -0.71 -2.13 115.15 112.61 1lww h HIS 237 Ca 0.27 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.65 1lww h HIS 237 Cb 0.42 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.61 1lww h HIS 237 CO -0.34 0.40 0.27 -0.22 -0.00 0.00 0.00 177.93 178.03 1lww h LYS 238 N 0.64 0.55 0.13 5.26 1.63 -1.27 -2.72 116.57 120.80 1lww h LYS 238 Ca 0.17 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.93 1lww h LYS 238 Cb -0.05 -0.12 -0.00 0.00 -0.60 0.00 0.00 32.23 31.45 1lww h LYS 238 CO -0.04 0.38 -0.08 0.00 -3.45 0.00 0.00 179.45 176.26 1lww h ALA 239 N 1.14 -0.19 -0.97 5.00 0.00 -1.22 -2.92 119.26 120.11 1lww h ALA 239 Ca 0.15 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1lww h ALA 239 Cb -0.05 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 1lww h ALA 239 CO -0.03 -0.61 0.62 -0.07 0.00 0.00 0.00 179.25 179.16 1lww h LEU 240 N -0.20 0.93 0.00 0.00 3.38 -1.33 -0.61 115.31 117.48 1lww h LEU 240 Ca -0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1lww h LEU 240 Cb 0.17 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1lww h LEU 240 CO 0.02 0.55 0.00 0.00 0.09 0.00 0.00 178.44 179.09 1lww h ILE 242 N 0.00 1.30 -3.96 0.00 2.04 -1.16 -3.45 117.51 112.28 1lww h ILE 242 Ca 0.00 -1.13 -0.54 0.00 1.00 0.00 0.00 64.86 64.19 1lww h ILE 242 Cb 0.02 1.55 0.11 0.00 -0.74 0.00 0.00 36.82 37.76 1lww h ILE 242 CO 0.00 0.35 0.75 -0.76 0.00 0.00 0.00 178.15 178.49 1lww s LEU 243 N -9.27 4.26 0.17 1.44 1.43 -0.50 -4.94 118.68 111.27 1lww s LEU 243 Ca -0.14 3.01 -0.32 0.00 -1.03 0.00 0.00 54.13 55.65 1lww s LEU 243 Cb 0.07 -3.75 -0.11 0.00 0.03 0.00 0.00 46.19 42.44 1lww s LEU 243 CO 0.76 -0.96 1.66 -2.84 0.23 0.00 0.00 176.35 175.21 1lww s PRO 244 N -2.19 4.17 0.00 1.29 0.02 -1.26 -2.28 135.00 134.74 1lww s PRO 244 Ca 0.55 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.05 1lww s PRO 244 Cb -0.46 -3.19 0.00 0.00 0.02 0.00 0.00 34.50 30.88 1lww s PRO 244 CO 0.61 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 177.00 1lww n GLY 245 N 3.90 1.14 3.25 0.52 0.00 -1.26 -4.63 105.19 108.11 1lww n GLY 245 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1lww n GLY 245 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lww s VAL 246 N -3.05 4.74 0.00 1.61 1.01 -0.97 -4.84 120.40 118.90 1lww s VAL 246 Ca 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 61.98 60.04 1lww s VAL 246 Cb 0.00 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1lww s VAL 246 CO 0.00 -0.86 0.00 0.61 0.00 0.00 0.00 175.10 174.85 1lww n GLY 247 N 4.71 1.29 0.22 4.51 0.00 -1.26 -4.28 105.19 110.37 1lww n GLY 247 Ca -0.04 -1.97 -0.04 0.00 0.00 0.00 0.00 46.02 43.97 1lww n GLY 247 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1lww h THR 248 N -0.08 0.96 0.51 2.61 2.02 -1.97 -2.04 112.91 114.92 1lww h THR 248 Ca 0.00 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 66.97 1lww h THR 248 Cb 0.00 0.36 0.01 0.00 -1.74 0.00 0.00 68.15 66.77 1lww h THR 248 CO 0.00 0.10 -0.25 0.50 0.37 0.00 0.00 175.52 176.24 1lww h LYS 249 N 0.55 -0.66 -0.62 6.66 3.64 -1.95 -1.93 116.57 122.27 1lww h LYS 249 Ca 0.25 0.05 0.10 0.00 -1.27 0.00 0.00 60.65 59.77 1lww h LYS 249 Cb 0.15 0.15 -0.07 0.00 -0.41 0.00 0.00 32.23 32.04 1lww h LYS 249 CO -0.17 -0.36 0.22 0.28 -2.27 0.00 0.00 179.45 177.15 1lww h VAL 250 N -0.91 0.75 -0.84 2.00 2.07 -1.89 0.11 116.25 117.55 1lww h VAL 250 Ca -0.07 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 1lww h VAL 250 Cb 0.61 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 1lww h VAL 250 CO 0.12 0.07 0.43 0.00 0.02 0.00 0.00 177.57 178.20 1lww h ALA 251 N 1.43 1.16 -0.52 1.67 0.00 -1.38 -1.36 119.26 120.26 1lww h ALA 251 Ca 0.31 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1lww h ALA 251 Cb 0.40 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1lww h ALA 251 CO -0.32 0.65 -0.08 -0.44 0.00 0.00 0.00 179.25 179.06 1lww h ASP 252 N 1.19 0.97 -0.34 0.00 3.32 -0.37 -0.43 116.42 120.76 1lww h ASP 252 Ca 0.29 -0.34 0.01 0.00 0.02 0.00 0.00 57.03 57.01 1lww h ASP 252 Cb 0.08 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1lww h ASP 252 CO -0.04 1.09 0.20 0.00 -1.72 0.00 0.00 179.24 178.77 1lww h ILE 254 N 0.41 1.13 -0.39 0.00 2.04 -1.09 0.41 117.51 120.03 1lww h ILE 254 Ca 0.13 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.68 1lww h ILE 254 Cb -0.00 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1lww h ILE 254 CO -0.06 0.13 0.21 0.00 0.00 0.00 0.00 178.15 178.43 1lww h LEU 256 N 0.42 0.88 0.00 0.00 5.85 -1.11 -0.76 115.31 120.59 1lww h LEU 256 Ca 0.16 -0.49 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1lww h LEU 256 Cb 0.04 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.82 1lww h LEU 256 CO -0.09 1.19 -1.10 0.23 -0.34 0.00 0.00 178.44 178.32 1lww n MET 257 N -4.15 0.23 0.00 1.25 2.81 0.12 -4.45 117.12 112.94 1lww n MET 257 Ca -0.04 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.83 1lww n MET 257 Cb 0.53 -1.55 0.00 0.00 -0.71 0.00 0.00 33.22 31.49 1lww n MET 257 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1lww n ALA 258 N -1.76 0.53 -0.88 3.04 0.00 -0.02 -0.57 120.51 120.84 1lww n ALA 258 Ca 0.02 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.54 1lww n ALA 258 Cb 0.42 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.14 1lww n ALA 258 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1lww n LEU 259 N -0.39 4.09 -3.31 0.00 4.77 -0.82 -4.62 117.00 116.72 1lww n LEU 259 Ca 0.00 -2.87 -0.24 0.00 -0.03 0.00 0.00 56.01 52.87 1lww n LEU 259 Cb 0.00 -0.53 0.03 0.00 -2.33 0.00 0.00 43.42 40.59 1lww n LEU 259 CO 0.00 0.68 0.04 0.47 -1.33 0.00 0.00 177.39 177.25 1lww n ASP 260 N -0.16 -5.38 -4.13 -1.43 8.00 -1.10 -4.62 116.55 107.73 1lww n ASP 260 Ca 0.21 -0.41 -0.37 0.00 0.71 0.00 0.00 54.79 54.93 1lww n ASP 260 Cb 0.89 -4.34 -0.06 0.00 -0.02 0.00 0.00 41.12 37.59 1lww n ASP 260 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1lww s LYS 261 N -5.99 3.29 0.00 -1.24 3.01 -0.33 -4.92 119.74 113.56 1lww s LYS 261 Ca 0.42 -3.16 0.06 0.00 -1.01 0.00 0.00 55.97 52.28 1lww s LYS 261 Cb -0.20 -4.00 0.25 0.00 -1.01 0.00 0.00 37.83 32.87 1lww s LYS 261 CO 0.51 -1.25 1.12 -0.35 0.51 0.00 0.00 175.35 175.89 1lww n PRO 262 N 2.56 0.03 0.00 -1.68 -0.04 -1.26 -1.97 135.00 132.64 1lww n PRO 262 Ca 0.20 0.34 0.11 0.00 -0.04 0.00 0.00 63.50 64.11 1lww n PRO 262 Cb 0.38 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.38 1lww n PRO 262 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1lww n GLN 263 N -1.42 0.23 -2.18 0.54 0.00 -1.02 -0.54 117.38 112.98 1lww n GLN 263 Ca 0.02 -0.18 -0.41 0.00 0.00 0.00 0.00 57.00 56.43 1lww n GLN 263 Cb 0.06 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 28.77 1lww n GLN 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1lww s ALA 264 N -2.89 3.53 -0.31 2.61 0.00 -0.83 -4.26 121.76 119.60 1lww s ALA 264 Ca 0.12 1.16 0.02 0.00 0.00 0.00 0.00 51.96 53.25 1lww s ALA 264 Cb 0.17 -3.48 0.09 0.00 0.00 0.00 0.00 23.12 19.90 1lww s ALA 264 CO 0.75 -0.56 0.04 0.08 0.00 0.00 0.00 175.76 176.08 1lww s VAL 265 N -0.24 1.73 0.14 0.00 1.01 -1.26 -3.50 120.40 118.27 1lww s VAL 265 Ca 0.55 -1.86 -0.31 0.00 0.00 0.00 0.00 61.98 60.35 1lww s VAL 265 Cb -0.38 -2.23 -0.10 0.00 0.00 0.00 0.00 36.38 33.68 1lww s VAL 265 CO 0.42 -0.53 1.63 -2.84 0.00 0.00 0.00 175.10 173.78 1lww s PRO 266 N 1.20 4.19 -0.26 2.72 0.02 -1.26 -4.79 135.00 136.82 1lww s PRO 266 Ca 0.07 2.40 -0.07 0.00 0.02 0.00 0.00 61.00 63.42 1lww s PRO 266 Cb -0.18 -3.29 -0.01 0.00 0.02 0.00 0.00 34.50 31.03 1lww s PRO 266 CO -0.13 -0.67 0.06 0.08 -0.33 0.00 0.00 177.00 176.01 1lww s VAL 267 N 1.66 4.11 0.00 3.83 1.01 -1.26 -4.87 120.40 124.88 1lww s VAL 267 Ca 0.72 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1lww s VAL 267 Cb -0.44 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 32.96 1lww s VAL 267 CO 0.32 0.26 0.00 -0.90 0.00 0.00 0.00 175.10 174.78 1lww n ASP 268 N 4.90 0.47 -0.17 3.32 5.75 -1.26 -4.66 116.55 124.89 1lww n ASP 268 Ca -0.16 -0.76 -0.03 0.00 -0.01 0.00 0.00 54.79 53.83 1lww n ASP 268 Cb 0.50 0.00 0.18 0.00 -1.03 0.00 0.00 41.12 40.77 1lww n ASP 268 CO 0.00 0.00 0.00 1.62 -0.11 0.00 0.00 177.20 178.71 1lww h VAL 269 N 0.76 1.23 -0.37 2.12 3.04 -1.99 -2.06 116.25 118.98 1lww h VAL 269 Ca 0.00 -0.74 -0.05 0.00 -1.01 0.00 0.00 66.70 64.90 1lww h VAL 269 Cb 0.00 0.52 -0.01 0.00 -2.01 0.00 0.00 31.29 29.79 1lww h VAL 269 CO 0.00 0.29 0.03 0.45 -1.01 0.00 0.00 177.57 177.33 1lww h HIS 270 N 0.89 0.67 -0.02 3.17 3.86 -1.99 -1.60 115.15 120.15 1lww h HIS 270 Ca 0.21 -0.11 -0.10 0.00 -1.16 0.00 0.00 60.37 59.21 1lww h HIS 270 Cb 0.22 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 1lww h HIS 270 CO 0.02 0.70 -0.45 0.52 0.86 0.00 0.00 177.93 179.58 1lww h MET 271 N 0.45 0.03 -0.41 2.45 2.86 -1.86 -0.59 114.93 117.87 1lww h MET 271 Ca 0.11 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.64 1lww h MET 271 Cb 0.41 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1lww h MET 271 CO 0.01 0.48 -0.09 -1.49 1.06 0.00 0.00 176.91 176.88 1lww h TRP 272 N 0.03 0.89 -0.41 -0.22 4.06 -1.20 0.01 115.95 119.10 1lww h TRP 272 Ca -0.00 -0.19 -0.04 0.00 2.06 0.00 0.00 58.89 60.72 1lww h TRP 272 Cb 0.80 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 28.73 1lww h TRP 272 CO 0.00 0.91 0.09 1.25 -3.56 0.00 0.00 178.44 177.13 1lww h HIS 273 N 0.61 0.71 -0.65 0.49 2.76 -0.98 -1.67 115.15 116.42 1lww h HIS 273 Ca 0.11 -0.09 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 1lww h HIS 273 Cb 0.61 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 29.35 1lww h HIS 273 CO 0.05 0.68 0.33 0.82 -1.30 0.00 0.00 177.93 178.51 1lww h ILE 274 N 0.53 1.22 0.11 6.26 2.04 -1.01 -0.01 117.51 126.64 1lww h ILE 274 Ca 0.13 -0.58 -0.00 0.00 1.00 0.00 0.00 64.86 65.40 1lww h ILE 274 Cb 0.34 0.41 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1lww h ILE 274 CO 0.00 0.24 -0.07 0.00 0.00 0.00 0.00 178.15 178.33 1lww h ALA 275 N 1.15 -0.17 -0.30 1.87 0.00 -0.78 -0.11 119.26 120.93 1lww h ALA 275 Ca 0.22 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 1lww h ALA 275 Cb 0.09 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1lww h ALA 275 CO -0.03 -0.60 -0.12 1.96 0.00 0.00 0.00 179.25 180.46 1lww h GLN 276 N -0.18 0.61 0.11 0.00 4.20 -1.19 -2.21 115.11 116.45 1lww h GLN 276 Ca -0.01 -0.26 -0.27 0.00 0.06 0.00 0.00 58.65 58.18 1lww h GLN 276 Cb 0.15 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 27.92 1lww h GLN 276 CO 0.01 0.83 -1.18 -0.09 -0.67 0.00 0.00 178.83 177.72 1lww h ARG 277 N 0.37 0.33 -0.01 1.46 2.43 -1.00 -2.66 114.38 115.30 1lww h ARG 277 Ca 0.07 -0.50 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1lww h ARG 277 Cb 0.63 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 1lww h ARG 277 CO 0.04 1.21 -0.56 -0.25 -1.51 0.00 0.00 179.97 178.90 1lww n ASP 278 N -3.61 1.26 0.00 -3.80 8.00 -0.06 -4.55 116.55 113.79 1lww n ASP 278 Ca -0.09 -1.13 0.00 0.00 0.71 0.00 0.00 54.79 54.28 1lww n ASP 278 Cb 0.98 0.72 0.00 0.00 -0.02 0.00 0.00 41.12 42.80 1lww n ASP 278 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1lww n TYR 279 N -0.72 0.00 -3.35 1.24 4.02 -0.93 -4.96 117.16 112.46 1lww n TYR 279 Ca 0.05 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.70 1lww n TYR 279 Cb 0.31 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.66 1lww n TYR 279 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1lww n SER 280 N -0.18 -5.22 -4.79 7.72 7.64 -0.97 -4.94 113.62 112.88 1lww n SER 280 Ca 0.00 -0.44 -0.34 0.00 1.01 0.00 0.00 58.87 59.10 1lww n SER 280 Cb 0.07 -4.21 -0.02 0.00 -1.01 0.00 0.00 64.21 59.05 1lww n SER 280 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 1lww s TRP 281 N -3.14 2.86 -0.09 1.43 -0.00 -0.88 -4.97 118.94 114.15 1lww s TRP 281 Ca 0.43 1.56 -0.16 0.00 -0.00 0.00 0.00 56.10 57.93 1lww s TRP 281 Cb -0.21 -3.15 0.04 0.00 -0.00 0.00 0.00 33.47 30.14 1lww s TRP 281 CO 0.53 -1.16 0.40 -1.01 -0.00 0.00 0.00 176.95 175.72 1lww s HIS 282 N -1.93 -0.37 0.32 5.86 3.76 -1.26 -4.50 115.29 117.18 1lww s HIS 282 Ca 0.69 0.77 -0.29 0.00 -0.15 0.00 0.00 55.06 56.08 1lww s HIS 282 Cb -0.19 0.16 -0.10 0.00 1.11 0.00 0.00 32.58 33.55 1lww s HIS 282 CO 0.24 -0.34 1.36 -2.14 -0.85 0.00 0.00 174.74 173.01 1lww s PRO 283 N -0.58 4.30 0.00 8.40 0.02 -1.26 -4.91 135.00 140.97 1lww s PRO 283 Ca -0.07 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.24 1lww s PRO 283 Cb -0.04 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.42 1lww s PRO 283 CO 0.03 -0.28 0.00 0.25 -0.33 0.00 0.00 177.00 176.67 1lww n THR 284 N 1.01 0.00 1.13 0.99 -2.24 -1.26 -4.71 114.28 109.21 1lww n THR 284 Ca 0.01 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.91 1lww n THR 284 Cb 0.41 -0.72 0.25 0.00 -2.10 0.00 0.00 70.33 68.17 1lww n THR 284 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1lww n THR 285 N -1.62 0.00 -4.32 4.28 -2.24 -1.26 -4.90 114.28 104.23 1lww n THR 285 Ca 0.00 -0.11 -0.26 0.00 -2.27 0.00 0.00 64.05 61.41 1lww n THR 285 Cb 0.37 0.56 -0.09 0.00 -2.10 0.00 0.00 70.33 69.06 1lww n THR 285 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1lww s SER 286 N -2.64 4.16 0.02 3.42 0.01 -1.26 -5.05 113.70 112.36 1lww s SER 286 Ca 0.19 -0.65 -0.03 0.00 1.31 0.00 0.00 55.95 56.77 1lww s SER 286 Cb 0.18 -0.66 -0.28 0.00 0.21 0.00 0.00 66.02 65.47 1lww s SER 286 CO 0.60 0.09 0.92 0.06 0.41 0.00 0.00 173.24 175.31 1lww h GLN 287 N 2.76 0.26 -7.11 12.44 -0.00 -1.94 -3.47 115.11 118.04 1lww h GLN 287 Ca -0.46 -0.44 -0.55 0.00 -0.00 0.00 0.00 58.65 57.20 1lww h GLN 287 Cb 1.21 0.16 0.17 0.00 -0.00 0.00 0.00 27.48 29.02 1lww h GLN 287 CO 0.55 1.13 0.44 0.00 -0.00 0.00 0.00 178.83 180.96 1lww n ALA 288 N -2.64 0.79 0.32 0.06 0.00 -1.26 -4.94 120.51 112.85 1lww n ALA 288 Ca -0.15 -0.09 0.10 0.00 0.00 0.00 0.00 53.44 53.31 1lww n ALA 288 Cb 1.04 -2.29 -0.15 0.00 0.00 0.00 0.00 19.45 18.05 1lww n ALA 288 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1lww n LYS 289 N -2.20 0.47 -0.73 0.00 4.76 -1.26 -4.78 118.16 114.42 1lww n LYS 289 Ca 0.15 -0.13 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1lww n LYS 289 Cb 0.49 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.17 1lww n LYS 289 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1lww n GLY 290 N 1.35 5.83 3.71 0.72 0.00 -1.26 -4.82 105.19 110.72 1lww n GLY 290 Ca -0.01 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 1lww n GLY 290 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1lww n PRO 291 N 0.00 2.27 -3.60 1.61 -0.02 -1.26 -4.70 135.00 129.30 1lww n PRO 291 Ca 0.00 0.80 -0.03 0.00 -2.02 0.00 0.00 63.50 62.24 1lww n PRO 291 Cb 0.00 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.03 1lww n PRO 291 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1lww s SER 292 N -0.12 -0.12 0.39 2.55 1.04 -1.26 -4.97 113.70 111.22 1lww s SER 292 Ca 0.58 -0.02 0.15 0.00 0.48 0.00 0.00 55.95 57.14 1lww s SER 292 Cb -0.56 0.14 1.01 0.00 0.10 0.00 0.00 66.02 66.71 1lww s SER 292 CO 0.59 -0.22 1.83 1.55 0.98 0.00 0.00 173.24 177.97 1lww h PRO 293 N 2.00 0.47 -0.01 4.02 0.13 -1.99 -0.47 132.00 136.15 1lww h PRO 293 Ca -0.11 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.97 1lww h PRO 293 Cb 1.17 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1lww h PRO 293 CO 0.23 0.31 -0.08 1.96 -0.23 0.00 0.00 178.00 180.19 1lww h GLN 294 N 0.48 0.08 -0.46 0.86 7.50 -1.95 -3.05 115.11 118.57 1lww h GLN 294 Ca 0.51 -0.07 -0.06 0.00 0.50 0.00 0.00 58.65 59.53 1lww h GLN 294 Cb 1.15 0.02 -0.02 0.00 0.05 0.00 0.00 27.48 28.68 1lww h GLN 294 CO -0.23 0.76 0.03 1.79 -1.50 0.00 0.00 178.83 179.68 1lww h THR 295 N -0.59 1.23 -0.44 -0.54 1.35 -1.73 -2.08 112.91 110.11 1lww h THR 295 Ca -0.01 -0.92 -0.08 0.00 -0.55 0.00 0.00 66.41 64.86 1lww h THR 295 Cb 0.78 0.85 -0.02 0.00 -1.73 0.00 0.00 68.15 68.04 1lww h THR 295 CO 0.02 0.32 -0.04 0.78 -0.25 0.00 0.00 175.52 176.35 1lww h ASN 296 N 0.69 0.72 -0.32 5.36 2.35 -1.20 -0.59 115.58 122.59 1lww h ASN 296 Ca 0.14 -0.18 -0.12 0.00 -0.55 0.00 0.00 56.30 55.59 1lww h ASN 296 Cb 0.39 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1lww h ASN 296 CO 0.01 0.81 -0.21 0.50 -1.65 0.00 0.00 177.43 176.89 1lww h LYS 297 N 0.69 0.81 -0.13 0.81 3.64 -1.35 -2.27 116.57 118.78 1lww h LYS 297 Ca 0.13 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 59.17 1lww h LYS 297 Cb 0.48 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 1lww h LYS 297 CO 0.02 0.95 0.02 1.49 -2.27 0.00 0.00 179.45 179.66 1lww h GLU 298 N 0.70 0.21 -0.56 1.90 4.81 -0.78 -2.37 114.58 118.49 1lww h GLU 298 Ca 0.10 -0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.36 1lww h GLU 298 Cb 0.73 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.02 1lww h GLU 298 CO 0.06 0.39 0.20 1.25 -0.73 0.00 0.00 179.01 180.17 1lww h LEU 299 N -0.01 0.18 -0.32 1.64 6.46 -1.03 0.25 115.31 122.48 1lww h LEU 299 Ca 0.04 0.07 0.06 0.00 -0.12 0.00 0.00 57.88 57.93 1lww h LEU 299 Cb 0.28 0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 40.22 1lww h LEU 299 CO 0.00 0.12 -0.01 1.23 -0.62 0.00 0.00 178.44 179.16 1lww h GLY 300 N 0.37 0.30 1.24 3.75 0.00 -1.27 0.54 103.07 108.01 1lww h GLY 300 Ca 0.28 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.63 1lww h GLY 300 CO -0.29 -0.08 0.33 3.43 0.00 0.00 0.00 176.54 179.93 1lww h ASN 301 N 0.08 0.89 0.25 0.19 -0.26 -0.74 -0.70 115.58 115.29 1lww h ASN 301 Ca 0.16 -0.09 -0.01 0.00 -0.56 0.00 0.00 56.30 55.79 1lww h ASN 301 Cb 0.22 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.25 1lww h ASN 301 CO -0.28 0.75 -0.12 0.15 -1.06 0.00 0.00 177.43 176.87 1lww h PHE 302 N 0.98 -0.31 -0.14 1.19 3.57 0.77 0.68 116.94 123.68 1lww h PHE 302 Ca 0.24 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 1lww h PHE 302 Cb 0.10 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1lww h PHE 302 CO 0.01 -0.19 -0.13 0.74 -2.23 0.00 0.00 178.31 176.51 1lww h PHE 303 N -0.34 0.23 -0.37 0.41 0.05 -0.67 -1.04 116.94 115.22 1lww h PHE 303 Ca -0.03 -0.03 -0.10 0.00 3.82 0.00 0.00 57.97 61.63 1lww h PHE 303 Cb 0.26 -0.07 -0.01 0.00 2.00 0.00 0.00 35.95 38.13 1lww h PHE 303 CO -0.06 0.36 -0.16 0.00 -0.18 0.00 0.00 178.31 178.27 1lww h ARG 304 N 0.21 0.75 -0.19 1.51 3.08 -0.73 -0.94 114.38 118.08 1lww h ARG 304 Ca 0.04 -0.32 -0.05 0.00 0.07 0.00 0.00 59.98 59.73 1lww h ARG 304 Cb 0.37 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1lww h ARG 304 CO 0.02 0.93 -0.10 1.03 -1.07 0.00 0.00 179.97 180.79 1lww h SER 305 N 0.54 0.27 0.02 7.04 0.87 -0.33 0.16 113.55 122.12 1lww h SER 305 Ca 0.08 -0.05 -0.10 0.00 -1.23 0.00 0.00 61.79 60.49 1lww h SER 305 Cb 0.69 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.59 1lww h SER 305 CO 0.05 0.41 -0.41 0.25 -0.53 0.00 0.00 176.83 176.59 1lww h LEU 306 N 0.28 0.33 0.00 2.23 5.85 -0.93 -3.39 115.31 119.68 1lww h LEU 306 Ca 0.06 -0.81 -0.07 0.00 0.84 0.00 0.00 57.88 57.90 1lww h LEU 306 Cb 0.35 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1lww h LEU 306 CO 0.02 1.10 -1.93 0.79 -0.34 0.00 0.00 178.44 178.08 1lww n TRP 307 N -4.38 0.15 -0.22 1.25 8.01 -0.38 -4.87 117.44 117.00 1lww n TRP 307 Ca -0.10 0.04 0.00 0.00 -1.31 0.00 0.00 57.50 56.13 1lww n TRP 307 Cb 0.60 -0.66 0.00 0.00 -2.01 0.00 0.00 31.31 29.24 1lww n TRP 307 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1lww n GLY 308 N 1.34 -1.42 0.37 6.99 0.00 0.56 -4.54 105.19 108.49 1lww n GLY 308 Ca -0.09 -1.92 0.16 0.00 0.00 0.00 0.00 46.02 44.17 1lww n GLY 308 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1lww h PRO 309 N 0.00 0.28 -0.74 1.61 0.11 -1.93 -2.03 132.00 129.30 1lww h PRO 309 Ca 0.00 -0.02 -0.45 0.00 0.11 0.00 0.00 66.00 65.64 1lww h PRO 309 Cb 0.00 -0.06 -0.25 0.00 0.11 0.00 0.00 31.00 30.79 1lww h PRO 309 CO 0.00 0.19 0.24 0.66 -0.21 0.00 0.00 178.00 178.88 1lww n TYR 310 N -4.45 2.40 -0.13 0.65 4.02 -1.26 -2.44 117.16 115.95 1lww n TYR 310 Ca 0.12 -2.13 0.13 0.00 -0.01 0.00 0.00 57.90 56.01 1lww n TYR 310 Cb 0.50 -0.84 0.49 0.00 -0.02 0.00 0.00 39.34 39.48 1lww n TYR 310 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1lww h ALA 311 N 1.43 2.03 -0.21 -0.72 0.00 -1.18 -0.97 119.26 119.64 1lww h ALA 311 Ca 0.45 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.28 1lww h ALA 311 Cb 1.74 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 1lww h ALA 311 CO 0.94 -0.20 -0.22 0.78 0.00 0.00 0.00 179.25 180.55 1lww h GLY 312 N 0.45 0.42 1.04 0.00 0.00 -0.85 -1.25 103.07 102.86 1lww h GLY 312 Ca 0.33 -0.31 -0.15 0.00 0.00 0.00 0.00 47.33 47.20 1lww h GLY 312 CO -0.10 0.29 -0.41 1.49 0.00 0.00 0.00 176.54 177.81 1lww h TRP 313 N 0.35 0.95 -0.81 5.60 4.06 -1.28 -2.17 115.95 122.65 1lww h TRP 313 Ca 0.06 -0.32 -0.01 0.00 2.06 0.00 0.00 58.89 60.68 1lww h TRP 313 Cb 0.58 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 28.52 1lww h TRP 313 CO 0.01 1.10 0.45 0.00 -3.56 0.00 0.00 178.44 176.45 1lww h ALA 314 N 0.68 1.04 -0.67 1.49 0.00 -1.27 -1.53 119.26 119.00 1lww h ALA 314 Ca 0.03 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.89 1lww h ALA 314 Cb 1.00 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1lww h ALA 314 CO 0.09 0.54 0.44 0.37 0.00 0.00 0.00 179.25 180.70 1lww h GLN 315 N 1.13 0.61 -0.14 0.00 -0.00 -1.06 -0.85 115.11 114.79 1lww h GLN 315 Ca 0.29 -0.04 -0.07 0.00 -0.00 0.00 0.00 58.65 58.83 1lww h GLN 315 Cb 0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.35 1lww h GLN 315 CO -0.05 0.40 -0.22 0.00 0.00 0.00 0.00 178.83 178.96 1lww h ALA 316 N 1.65 1.36 0.10 3.38 0.00 -0.62 0.24 119.26 125.37 1lww h ALA 316 Ca 0.29 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1lww h ALA 316 Cb 0.34 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1lww h ALA 316 CO -0.09 0.44 -0.05 0.28 0.00 0.00 0.00 179.25 179.83 1lww h VAL 317 N 0.23 1.12 -0.70 0.00 2.07 -0.96 -1.74 116.25 116.28 1lww h VAL 317 Ca 0.04 -1.10 -0.07 0.00 0.82 0.00 0.00 66.70 66.39 1lww h VAL 317 Cb 0.53 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 1lww h VAL 317 CO 0.04 0.26 0.17 -0.07 0.02 0.00 0.00 177.57 177.98 1lww h LEU 318 N -0.67 1.05 -0.06 2.57 3.38 -1.35 -0.80 115.31 119.43 1lww h LEU 318 Ca -0.01 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 1lww h LEU 318 Cb 0.52 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1lww h LEU 318 CO 0.02 1.01 0.03 0.15 0.09 0.00 0.00 178.44 179.74 1lww h PHE 319 N 1.05 0.08 -0.93 1.13 3.57 -1.01 0.30 116.94 121.13 1lww h PHE 319 Ca 0.22 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.72 1lww h PHE 319 Cb 0.37 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.04 1lww h PHE 319 CO 0.03 0.13 0.61 1.03 -2.23 0.00 0.00 178.31 177.88 1lww h SER 320 N 0.01 1.08 0.04 0.41 0.87 -1.12 -1.71 113.55 113.13 1lww h SER 320 Ca 0.02 -0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.44 1lww h SER 320 Cb 0.08 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1lww h SER 320 CO -0.00 0.79 -0.34 0.00 -0.53 0.00 0.00 176.83 176.75 1lww h ALA 321 N 1.34 1.04 0.00 6.23 0.00 -0.86 -2.71 119.26 124.30 1lww h ALA 321 Ca 0.34 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1lww h ALA 321 Cb -0.13 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1lww h ALA 321 CO -0.07 0.59 -0.01 0.22 0.00 0.00 0.00 179.25 179.97 1lww h ASP 322 N 0.36 0.00 0.02 0.00 -0.00 0.44 -2.98 116.42 114.26 1lww h ASP 322 Ca 0.04 0.00 -0.17 0.00 -0.00 0.00 0.00 57.03 56.90 1lww h ASP 322 Cb 0.77 0.00 0.01 0.00 -0.00 0.00 0.00 39.33 40.12 1lww h ASP 322 CO 0.06 0.01 -0.67 -0.07 -0.00 0.00 0.00 179.24 178.57 1lww h LEU 323 N 0.00 0.56 -5.58 2.28 3.38 -1.03 -3.34 115.31 111.58 1lww h LEU 323 Ca -0.00 -0.78 -0.30 0.00 0.09 0.00 0.00 57.88 56.89 1lww h LEU 323 Cb 0.63 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.23 1lww h LEU 323 CO 0.00 1.27 2.26 0.54 0.09 0.00 0.00 178.44 182.60 1lww n ARG 324 N -4.18 1.62 0.00 1.13 5.12 -1.13 -5.13 116.66 114.10 1lww n ARG 324 Ca -0.11 -1.26 0.00 0.00 -1.93 0.00 0.00 57.85 54.56 1lww n ARG 324 Cb 0.71 -2.36 0.00 0.00 -1.16 0.00 0.00 32.46 29.65 1lww n ARG 324 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64