#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a0l s VAL 17 N 0.00 4.96 0.00 1.39 1.01 0.19 -4.36 120.40 123.59 1a0l s VAL 17 Ca 0.00 1.62 0.00 0.00 0.00 0.00 0.00 61.98 63.60 1a0l s VAL 17 Cb 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1a0l s VAL 17 CO 0.00 0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1a0l n GLY 18 N 2.96 -0.94 7.00 4.51 0.00 -1.25 -2.21 105.19 115.25 1a0l n GLY 18 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.75 1a0l n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a0l n GLY 19 N 0.00 -0.25 3.62 -0.02 0.00 -1.26 -4.91 105.19 102.37 1a0l n GLY 19 Ca 0.00 -1.06 -0.09 0.00 0.00 0.00 0.00 46.02 44.87 1a0l n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1a0l s GLN 20 N 0.00 1.63 -0.09 1.61 -2.07 -0.67 -4.97 119.66 115.10 1a0l s GLN 20 Ca 0.00 -1.26 -0.30 0.00 -1.82 0.00 0.00 55.36 51.98 1a0l s GLN 20 Cb 0.00 0.49 -0.03 0.00 -1.09 0.00 0.00 33.01 32.38 1a0l s GLN 20 CO 0.00 -0.69 1.35 -2.00 -1.32 0.00 0.00 175.29 172.63 1a0l s GLU 21 N -3.87 4.26 0.33 9.60 2.12 -1.26 -0.58 118.70 129.30 1a0l s GLU 21 Ca 0.21 1.83 -0.29 0.00 0.36 0.00 0.00 54.97 57.08 1a0l s GLU 21 Cb -0.01 -3.72 -0.11 0.00 0.26 0.00 0.00 34.13 30.54 1a0l s GLU 21 CO 0.10 -0.65 1.53 0.00 -0.54 0.00 0.00 175.26 175.69 1a0l s ALA 22 N 3.10 3.65 0.48 6.30 0.00 0.18 -4.86 121.76 130.60 1a0l s ALA 22 Ca 0.60 1.56 -0.24 0.00 0.00 0.00 0.00 51.96 53.88 1a0l s ALA 22 Cb -0.26 -3.62 -0.07 0.00 0.00 0.00 0.00 23.12 19.16 1a0l s ALA 22 CO 0.21 -1.00 1.36 -2.30 0.00 0.00 0.00 175.76 174.04 1a0l n PRO 23 N 1.30 1.97 0.19 0.00 -0.02 -1.26 -4.84 135.00 132.35 1a0l n PRO 23 Ca 0.04 0.71 0.05 0.00 -2.02 0.00 0.00 63.50 62.28 1a0l n PRO 23 Cb 0.39 -2.55 0.25 0.00 -0.02 0.00 0.00 33.50 31.56 1a0l n PRO 23 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1a0l h ARG 24 N 1.92 0.00 -2.07 -0.52 2.43 -1.99 -2.05 114.38 112.10 1a0l h ARG 24 Ca -0.50 0.00 -0.53 0.00 -0.81 0.00 0.00 59.98 58.13 1a0l h ARG 24 Cb 1.29 0.00 -0.40 0.00 -0.42 0.00 0.00 29.97 30.44 1a0l h ARG 24 CO 0.59 0.00 -1.02 -1.13 -1.51 0.00 0.00 179.97 176.91 1a0l n SER 25 N -2.06 1.56 0.00 -3.80 3.41 -1.26 -4.90 113.62 106.58 1a0l n SER 25 Ca -0.01 -3.08 0.00 0.00 -0.26 0.00 0.00 58.87 55.53 1a0l n SER 25 Cb 0.53 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 1a0l n SER 25 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1a0l n LYS 26 N 0.58 0.31 -3.44 4.33 4.76 -0.77 -4.92 118.16 119.01 1a0l n LYS 26 Ca 0.25 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.43 1a0l n LYS 26 Cb 0.55 -0.99 -0.09 0.00 -1.84 0.00 0.00 35.03 32.66 1a0l n LYS 26 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 1a0l n TRP 27 N -2.45 1.44 0.44 2.13 7.02 -1.26 -4.92 117.44 119.84 1a0l n TRP 27 Ca 0.00 -3.84 0.03 0.00 -1.02 0.00 0.00 57.50 52.67 1a0l n TRP 27 Cb 0.49 -0.35 0.16 0.00 -2.42 0.00 0.00 31.31 29.20 1a0l n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 1a0l n PRO 28 N 1.62 0.22 -0.00 -0.99 -0.04 -1.26 -1.65 135.00 132.90 1a0l n PRO 28 Ca 0.25 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.77 1a0l n PRO 28 Cb 0.45 -1.38 -0.08 0.00 -0.04 0.00 0.00 33.50 32.45 1a0l n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1a0l n TRP 29 N -0.88 0.00 -1.72 0.54 2.14 -1.18 -0.83 117.44 115.51 1a0l n TRP 29 Ca 0.04 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.19 1a0l n TRP 29 Cb 0.02 -0.10 -0.00 0.00 -0.81 0.00 0.00 31.31 30.41 1a0l n TRP 29 CO 0.00 0.00 0.00 1.04 2.07 0.00 0.00 177.69 180.80 1a0l n GLN 30 N -1.51 2.27 -3.90 -2.67 1.13 -0.66 0.35 117.38 112.39 1a0l n GLN 30 Ca 0.01 0.79 -0.11 0.00 -1.94 0.00 0.00 57.00 55.75 1a0l n GLN 30 Cb 0.23 -2.41 -0.11 0.00 0.11 0.00 0.00 30.24 28.06 1a0l n GLN 30 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1a0l s VAL 31 N -1.10 0.07 -0.20 5.09 -7.23 -0.43 -1.32 120.40 115.27 1a0l s VAL 31 Ca 0.55 -0.58 -0.07 0.00 -1.81 0.00 0.00 61.98 60.07 1a0l s VAL 31 Cb -0.54 -0.29 -0.03 0.00 0.56 0.00 0.00 36.38 36.08 1a0l s VAL 31 CO 0.63 -0.32 0.05 -0.55 -0.31 0.00 0.00 175.10 174.60 1a0l s SER 32 N -1.02 5.29 -0.21 4.85 0.15 0.22 -1.76 113.70 121.22 1a0l s SER 32 Ca -0.11 -0.07 -0.21 0.00 0.70 0.00 0.00 55.95 56.26 1a0l s SER 32 Cb -0.07 -1.92 -0.02 0.00 -1.71 0.00 0.00 66.02 62.30 1a0l s SER 32 CO 0.00 0.09 0.64 -0.76 1.20 0.00 0.00 173.24 174.41 1a0l s LEU 33 N 0.86 4.13 0.12 3.45 1.43 0.44 -0.81 118.68 128.30 1a0l s LEU 33 Ca 0.03 0.82 0.08 0.00 -1.03 0.00 0.00 54.13 54.03 1a0l s LEU 33 Cb -0.14 -2.89 -0.04 0.00 0.03 0.00 0.00 46.19 43.15 1a0l s LEU 33 CO 0.02 -0.30 -0.14 -0.13 0.23 0.00 0.00 176.35 176.03 1a0l s ARG 34 N 2.06 1.92 0.21 1.70 1.81 0.11 -0.81 118.95 125.96 1a0l s ARG 34 Ca 0.28 -1.14 0.11 0.00 -1.72 0.00 0.00 55.73 53.26 1a0l s ARG 34 Cb -0.16 -2.18 -0.04 0.00 -0.45 0.00 0.00 34.95 32.12 1a0l s ARG 34 CO 0.10 0.48 -0.17 0.08 -0.68 0.00 0.00 175.30 175.11 1a0l s VAL 35 N -1.24 2.71 -0.83 3.52 1.01 -0.94 -1.19 120.40 123.45 1a0l s VAL 35 Ca 0.20 -1.98 -0.26 0.00 0.00 0.00 0.00 61.98 59.94 1a0l s VAL 35 Cb -0.11 -2.35 0.04 0.00 0.00 0.00 0.00 36.38 33.96 1a0l s VAL 35 CO 0.12 -0.19 1.33 -2.28 0.00 0.00 0.00 175.10 174.09 1a0l s HIS 36 N -1.89 2.36 0.00 5.22 2.46 0.19 -1.81 115.29 121.83 1a0l s HIS 36 Ca 0.24 -0.30 0.00 0.00 0.47 0.00 0.00 55.06 55.47 1a0l s HIS 36 Cb -0.08 -4.65 0.00 0.00 -0.13 0.00 0.00 32.58 27.72 1a0l s HIS 36 CO 0.13 -2.03 0.00 0.41 -2.47 0.00 0.00 174.74 170.78 1a0l n GLY 37 N 5.86 1.85 0.37 1.59 0.00 -1.26 -4.88 105.19 108.72 1a0l n GLY 37 Ca 0.13 -1.86 0.17 0.00 0.00 0.00 0.00 46.02 44.46 1a0l n GLY 37 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1a0l h PRO 37 N 0.00 0.00 -1.97 1.61 0.11 -2.03 -3.42 132.00 126.30 1a0l h PRO 37 Ca 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 1a0l h PRO 37 Cb 0.00 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 30.91 1a0l h PRO 37 CO 0.00 0.00 0.21 1.52 -0.21 0.00 0.00 178.00 179.52 1a0l s TYR 37 N -4.34 -0.65 -0.80 0.65 1.13 -1.26 -5.07 117.35 107.01 1a0l s TYR 37 Ca -0.04 1.19 -0.25 0.00 -1.41 0.00 0.00 57.07 56.56 1a0l s TYR 37 Cb 0.11 0.40 -0.16 0.00 -1.10 0.00 0.00 41.96 41.22 1a0l s TYR 37 CO 0.39 -0.56 2.40 0.91 -2.51 0.00 0.00 175.55 176.18 1a0l n TRP 38 N 1.11 1.08 -3.07 -3.49 7.02 -1.25 -4.75 117.44 114.09 1a0l n TRP 38 Ca -0.18 -0.02 -0.40 0.00 -1.02 0.00 0.00 57.50 55.89 1a0l n TRP 38 Cb 0.57 -2.46 -0.05 0.00 -2.42 0.00 0.00 31.31 26.95 1a0l n TRP 38 CO 0.00 0.00 0.00 1.41 -2.02 0.00 0.00 177.69 177.08 1a0l s MET 39 N 8.78 4.43 0.12 -0.99 -2.45 -0.75 -4.70 119.30 123.73 1a0l s MET 39 Ca 0.96 0.86 -0.31 0.00 -1.25 0.00 0.00 55.69 55.95 1a0l s MET 39 Cb -0.19 -3.43 -0.11 0.00 1.25 0.00 0.00 34.83 32.36 1a0l s MET 39 CO 0.12 0.12 1.84 1.58 1.05 0.00 0.00 175.02 179.74 1a0l n HIS 40 N 3.57 2.62 0.00 4.11 -0.00 -1.26 -2.20 115.22 122.06 1a0l n HIS 40 Ca -0.02 -0.15 0.00 0.00 0.46 0.00 0.00 57.72 58.01 1a0l n HIS 40 Cb 0.51 -2.73 0.00 0.00 -0.12 0.00 0.00 29.99 27.65 1a0l n HIS 40 CO 0.00 0.00 0.00 1.97 0.46 0.00 0.00 176.34 178.77 1a0l n PHE 41 N 5.69 0.00 -3.69 1.57 -1.74 0.01 -4.97 117.46 114.34 1a0l n PHE 41 Ca 0.18 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.07 1a0l n PHE 41 Cb 0.37 0.00 -0.00 0.00 1.52 0.00 0.00 39.48 41.37 1a0l n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1a0l s GLY 43 N -3.05 2.72 0.27 0.00 0.00 0.10 -0.42 107.32 106.94 1a0l s GLY 43 Ca 0.15 -1.47 -0.19 0.00 0.00 0.00 0.00 44.72 43.21 1a0l s GLY 43 CO -0.02 -2.13 0.95 0.61 0.00 0.00 0.00 173.10 172.51 1a0l n GLY 44 N -1.09 0.74 3.12 0.20 0.00 -0.72 -2.88 105.19 104.55 1a0l n GLY 44 Ca -0.11 -1.19 -0.18 0.00 0.00 0.00 0.00 46.02 44.53 1a0l n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a0l s SER 45 N -3.32 1.45 -0.56 1.61 1.04 -0.22 -1.32 113.70 112.38 1a0l s SER 45 Ca 0.20 -0.45 -0.26 0.00 0.48 0.00 0.00 55.95 55.93 1a0l s SER 45 Cb -0.04 -0.08 0.04 0.00 0.10 0.00 0.00 66.02 66.04 1a0l s SER 45 CO 0.08 -0.01 1.03 -0.22 0.98 0.00 0.00 173.24 175.10 1a0l s LEU 46 N -1.15 3.87 0.08 2.42 2.96 0.16 -1.29 118.68 125.73 1a0l s LEU 46 Ca -0.00 -0.20 0.22 0.00 -0.22 0.00 0.00 54.13 53.93 1a0l s LEU 46 Cb -0.08 -2.94 -0.14 0.00 0.50 0.00 0.00 46.19 43.53 1a0l s LEU 46 CO 0.01 -1.32 0.80 2.30 -1.32 0.00 0.00 176.35 176.82 1a0l n ILE 47 N 6.36 0.28 -3.76 6.68 -5.35 -1.09 -1.50 119.36 120.97 1a0l n ILE 47 Ca 0.04 -0.47 -0.13 0.00 -0.27 0.00 0.00 62.75 61.92 1a0l n ILE 47 Cb 0.48 -0.09 -0.09 0.00 -1.74 0.00 0.00 39.64 38.20 1a0l n ILE 47 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1a0l s HIS 48 N -3.40 -0.21 -0.54 4.28 5.04 -1.17 -4.62 115.29 114.67 1a0l s HIS 48 Ca -0.03 0.38 0.03 0.00 -1.54 0.00 0.00 55.06 53.89 1a0l s HIS 48 Cb 0.12 0.10 0.14 0.00 0.04 0.00 0.00 32.58 32.99 1a0l s HIS 48 CO 0.84 -0.36 0.92 -2.30 -2.34 0.00 0.00 174.74 171.51 1a0l n PRO 49 N 1.54 0.02 0.00 2.88 -0.02 -1.26 -1.14 135.00 137.02 1a0l n PRO 49 Ca -0.20 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1a0l n PRO 49 Cb 0.56 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 1a0l n PRO 49 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1a0l n GLN 50 N -1.46 0.93 -4.88 -0.52 7.27 -1.26 -1.16 117.38 116.30 1a0l n GLN 50 Ca -0.00 -0.23 -0.25 0.00 0.07 0.00 0.00 57.00 56.58 1a0l n GLN 50 Cb 0.19 -0.68 -0.15 0.00 2.41 0.00 0.00 30.24 32.00 1a0l n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1a0l s TRP 51 N -0.20 1.63 -0.08 3.69 0.52 -0.29 0.22 118.94 124.43 1a0l s TRP 51 Ca 0.00 -0.31 0.04 0.00 0.02 0.00 0.00 56.10 55.85 1a0l s TRP 51 Cb 0.00 -1.05 -0.01 0.00 -1.15 0.00 0.00 33.47 31.26 1a0l s TRP 51 CO 0.00 -0.03 -0.21 0.08 0.02 0.00 0.00 176.95 176.81 1a0l s VAL 52 N -0.42 2.35 -0.16 4.03 1.01 0.11 -2.67 120.40 124.66 1a0l s VAL 52 Ca 0.07 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.03 1a0l s VAL 52 Cb -0.07 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 1a0l s VAL 52 CO -0.01 0.56 0.09 -0.22 0.00 0.00 0.00 175.10 175.52 1a0l s LEU 53 N -0.04 4.02 0.34 3.92 2.96 -0.41 -0.76 118.68 128.70 1a0l s LEU 53 Ca -0.06 0.23 -0.10 0.00 -0.22 0.00 0.00 54.13 53.97 1a0l s LEU 53 Cb -0.15 -2.00 0.02 0.00 0.50 0.00 0.00 46.19 44.57 1a0l s LEU 53 CO 0.05 0.27 0.60 0.28 -1.32 0.00 0.00 176.35 176.23 1a0l s THR 54 N -0.18 0.00 0.09 3.68 -1.32 -0.01 -1.06 115.64 116.85 1a0l s THR 54 Ca 0.09 -1.31 -0.27 0.00 -1.21 0.00 0.00 61.69 58.98 1a0l s THR 54 Cb -0.12 -2.59 -0.06 0.00 -1.51 0.00 0.00 72.50 68.22 1a0l s THR 54 CO 0.01 0.00 0.84 0.00 -2.21 0.00 0.00 174.62 173.26 1a0l s ALA 55 N -3.04 3.33 0.32 11.08 0.00 -1.26 -0.41 121.76 131.78 1a0l s ALA 55 Ca 0.22 0.41 -0.00 0.00 0.00 0.00 0.00 51.96 52.59 1a0l s ALA 55 Cb -0.02 -3.10 0.51 0.00 0.00 0.00 0.00 23.12 20.51 1a0l s ALA 55 CO 0.14 0.07 1.98 0.00 0.00 0.00 0.00 175.76 177.95 1a0l h ALA 56 N 5.41 1.46 0.00 0.00 0.00 -1.70 -1.48 119.26 122.94 1a0l h ALA 56 Ca -0.44 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1a0l h ALA 56 Cb 1.21 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1a0l h ALA 56 CO 0.70 0.50 0.00 -2.39 0.00 0.00 0.00 179.25 178.07 1a0l n HIS 57 N -4.42 0.00 0.13 0.00 1.44 -1.26 0.21 115.22 111.32 1a0l n HIS 57 Ca 0.08 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.85 1a0l n HIS 57 Cb 0.03 -0.31 0.03 0.00 0.12 0.00 0.00 29.99 29.87 1a0l n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1a0l n VAL 59 N -3.01 0.19 -3.59 0.00 0.24 0.36 -5.03 118.33 107.49 1a0l n VAL 59 Ca -0.00 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 1a0l n VAL 59 Cb 0.67 1.22 0.00 0.00 -1.47 0.00 0.00 33.84 34.26 1a0l n VAL 59 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1a0l n GLY 60 N -0.10 4.66 0.15 7.63 0.00 0.13 -4.35 105.19 113.32 1a0l n GLY 60 Ca 0.00 -1.64 0.12 0.00 0.00 0.00 0.00 46.02 44.51 1a0l n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a0l h PRO 60 N 0.00 0.00 -6.73 1.61 0.13 -1.84 -3.43 132.00 121.75 1a0l h PRO 60 Ca 0.00 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.62 1a0l h PRO 60 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 1a0l h PRO 60 CO 0.00 0.00 0.46 -0.51 -0.23 0.00 0.00 178.00 177.72 1a0l s ASP 60 N -4.38 7.31 0.19 1.44 1.01 -1.26 -4.97 116.67 116.02 1a0l s ASP 60 Ca 0.03 2.14 -0.32 0.00 0.71 0.00 0.00 52.55 55.12 1a0l s ASP 60 Cb 0.09 -2.61 -0.12 0.00 1.01 0.00 0.00 42.92 41.29 1a0l s ASP 60 CO 0.39 -0.14 1.76 -0.69 0.21 0.00 0.00 175.17 176.69 1a0l s VAL 60 N -0.71 2.12 -0.00 -1.27 1.01 -1.26 -4.98 120.40 115.30 1a0l s VAL 60 Ca 0.46 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.44 1a0l s VAL 60 Cb -0.30 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1a0l s VAL 60 CO 0.37 0.00 0.12 -0.54 0.00 0.00 0.00 175.10 175.05 1a0l s LYS 60 N 1.54 3.19 -0.28 2.72 -0.14 -1.26 -5.08 119.74 120.43 1a0l s LYS 60 Ca 0.76 -0.44 -0.23 0.00 -1.36 0.00 0.00 55.97 54.71 1a0l s LYS 60 Cb -0.49 -2.94 -0.01 0.00 -1.68 0.00 0.00 37.83 32.71 1a0l s LYS 60 CO 0.33 0.65 0.74 0.34 -0.76 0.00 0.00 175.35 176.65 1a0l s ASP 60 N -1.86 6.66 0.58 2.83 2.15 -1.26 -4.94 116.67 120.83 1a0l s ASP 60 Ca 0.25 0.72 0.29 0.00 0.43 0.00 0.00 52.55 54.23 1a0l s ASP 60 Cb -0.12 -2.39 1.50 0.00 -0.30 0.00 0.00 42.92 41.61 1a0l s ASP 60 CO 0.16 -0.52 1.93 -0.07 -0.17 0.00 0.00 175.17 176.50 1a0l h LEU 61 N 9.24 0.00 -0.79 -1.34 4.07 -1.94 0.30 115.31 124.84 1a0l h LEU 61 Ca -0.25 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.67 1a0l h LEU 61 Cb 1.10 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.81 1a0l h LEU 61 CO 0.84 0.00 0.35 0.00 -1.08 0.00 0.00 178.44 178.55 1a0l h ALA 62 N 1.52 1.03 0.00 1.53 0.00 -1.92 -1.58 119.26 119.84 1a0l h ALA 62 Ca 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1a0l h ALA 62 Cb 1.09 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1a0l h ALA 62 CO -0.00 0.62 0.00 0.00 0.00 0.00 0.00 179.25 179.87 1a0l n ALA 63 N -2.42 1.40 -2.72 0.00 0.00 0.09 -4.72 120.51 112.15 1a0l n ALA 63 Ca 0.07 0.07 -0.32 0.00 0.00 0.00 0.00 53.44 53.26 1a0l n ALA 63 Cb 0.16 -1.27 -0.08 0.00 0.00 0.00 0.00 19.45 18.26 1a0l n ALA 63 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1a0l s LEU 64 N -3.91 3.65 -0.18 0.00 1.43 -0.60 -0.64 118.68 118.43 1a0l s LEU 64 Ca 0.03 -0.01 -0.25 0.00 -1.03 0.00 0.00 54.13 52.86 1a0l s LEU 64 Cb 0.07 -2.21 0.06 0.00 0.03 0.00 0.00 46.19 44.14 1a0l s LEU 64 CO 0.25 0.23 0.65 -0.60 0.23 0.00 0.00 176.35 177.11 1a0l s ARG 65 N -1.94 0.85 -0.08 1.70 3.52 -0.33 -4.47 118.95 118.19 1a0l s ARG 65 Ca 0.24 0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 56.50 1a0l s ARG 65 Cb -0.12 0.41 -0.03 0.00 -1.56 0.00 0.00 34.95 33.65 1a0l s ARG 65 CO 0.15 -0.16 0.02 0.08 -0.81 0.00 0.00 175.30 174.58 1a0l s VAL 66 N -0.16 4.44 -0.18 7.11 1.01 0.45 0.08 120.40 133.15 1a0l s VAL 66 Ca -0.04 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1a0l s VAL 66 Cb -0.03 -2.89 0.02 0.00 0.00 0.00 0.00 36.38 33.48 1a0l s VAL 66 CO 0.04 0.58 -0.18 -1.58 0.00 0.00 0.00 175.10 173.96 1a0l s GLN 67 N -0.97 2.77 1.11 2.72 2.00 0.01 0.01 119.66 127.31 1a0l s GLN 67 Ca 0.14 -0.80 -0.17 0.00 -2.00 0.00 0.00 55.36 52.53 1a0l s GLN 67 Cb -0.11 -2.48 0.25 0.00 0.80 0.00 0.00 33.01 31.46 1a0l s GLN 67 CO 0.03 -0.24 1.15 -0.51 -0.50 0.00 0.00 175.29 175.22 1a0l s LEU 68 N 1.33 1.27 0.13 3.68 1.43 -1.26 0.73 118.68 125.98 1a0l s LEU 68 Ca 0.04 0.67 -0.34 0.00 -1.03 0.00 0.00 54.13 53.48 1a0l s LEU 68 Cb -0.13 -2.57 -0.17 0.00 0.03 0.00 0.00 46.19 43.34 1a0l s LEU 68 CO -0.12 -3.62 0.92 -1.14 0.23 0.00 0.00 176.35 172.62 1a0l n ARG 69 N -4.43 0.41 -3.69 1.70 0.00 -0.43 -4.62 116.66 105.59 1a0l n ARG 69 Ca 0.12 0.15 -0.13 0.00 -0.00 0.00 0.00 57.85 57.98 1a0l n ARG 69 Cb 0.59 -1.48 -0.09 0.00 0.00 0.00 0.00 32.46 31.48 1a0l n ARG 69 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.63 175.80 1a0l s GLU 70 N -0.48 0.61 0.40 -0.14 -1.05 -1.26 -5.04 118.70 111.74 1a0l s GLU 70 Ca 0.76 0.74 0.19 0.00 -0.15 0.00 0.00 54.97 56.51 1a0l s GLU 70 Cb -1.01 0.29 0.84 0.00 -0.44 0.00 0.00 34.13 33.81 1a0l s GLU 70 CO 0.55 -0.08 1.82 0.37 0.95 0.00 0.00 175.26 178.87 1a0l h GLN 71 N 5.38 0.00 -3.05 -4.83 5.75 -1.93 -3.41 115.11 113.01 1a0l h GLN 71 Ca -0.28 0.00 -0.52 0.00 -0.15 0.00 0.00 58.65 57.70 1a0l h GLN 71 Cb 1.17 0.00 -0.40 0.00 1.07 0.00 0.00 27.48 29.32 1a0l h GLN 71 CO 0.18 0.33 -0.77 -1.01 -2.65 0.00 0.00 178.83 174.90 1a0l s HIS 72 N -3.85 0.54 0.00 3.99 3.76 -1.26 -2.22 115.29 116.26 1a0l s HIS 72 Ca -0.01 -0.83 0.00 0.00 -0.15 0.00 0.00 55.06 54.07 1a0l s HIS 72 Cb 0.12 -0.96 0.00 0.00 1.11 0.00 0.00 32.58 32.85 1a0l s HIS 72 CO 0.67 -0.72 0.00 1.28 -0.85 0.00 0.00 174.74 175.12 1a0l n LEU 73 N 5.18 0.00 0.00 0.89 4.77 -0.52 -1.68 117.00 125.64 1a0l n LEU 73 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1a0l n LEU 73 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1a0l n LEU 73 CO 0.08 0.00 0.26 -1.22 -1.33 0.00 0.00 177.39 175.18 1a0l n TYR 74 N -2.87 0.00 0.15 -1.77 4.01 -1.26 -4.80 117.16 110.62 1a0l n TYR 74 Ca 0.00 -0.06 0.01 0.00 -0.16 0.00 0.00 57.90 57.70 1a0l n TYR 74 Cb 0.00 -0.01 0.34 0.00 -0.31 0.00 0.00 39.34 39.36 1a0l n TYR 74 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1a0l h TYR 75 N 0.00 0.11 -2.00 -0.72 -1.99 -1.69 -3.31 116.97 107.36 1a0l h TYR 75 Ca 0.00 -0.02 -0.49 0.00 2.00 0.00 0.00 58.73 60.22 1a0l h TYR 75 Cb 0.10 -0.03 -0.40 0.00 2.00 0.00 0.00 36.73 38.40 1a0l h TYR 75 CO 0.00 0.42 -1.12 1.04 -0.00 0.00 0.00 178.16 178.50 1a0l n GLN 79 N -4.12 1.30 -2.07 4.88 1.13 -1.26 -5.11 117.38 112.13 1a0l n GLN 79 Ca -0.02 -3.58 -0.38 0.00 -1.94 0.00 0.00 57.00 51.08 1a0l n GLN 79 Cb 0.39 -1.77 0.01 0.00 0.11 0.00 0.00 30.24 28.98 1a0l n GLN 79 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1a0l s ASP 80 N -2.60 5.95 -0.50 1.08 1.11 -1.25 -4.98 116.67 115.48 1a0l s ASP 80 Ca 0.41 2.52 0.07 0.00 0.18 0.00 0.00 52.55 55.73 1a0l s ASP 80 Cb 0.34 -2.62 0.20 0.00 1.07 0.00 0.00 42.92 41.91 1a0l s ASP 80 CO -0.08 -1.08 0.72 1.67 1.18 0.00 0.00 175.17 177.57 1a0l n GLN 81 N -0.48 0.55 -2.05 8.23 7.27 -1.26 -5.14 117.38 124.50 1a0l n GLN 81 Ca 0.07 -2.10 -0.42 0.00 0.07 0.00 0.00 57.00 54.62 1a0l n GLN 81 Cb 0.46 -1.48 -0.03 0.00 2.41 0.00 0.00 30.24 31.60 1a0l n GLN 81 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1a0l s LEU 82 N 0.50 4.36 -0.16 1.69 1.02 -1.26 -4.66 118.68 120.18 1a0l s LEU 82 Ca 0.31 2.42 -0.06 0.00 0.02 0.00 0.00 54.13 56.82 1a0l s LEU 82 Cb 0.05 -3.58 -0.04 0.00 0.02 0.00 0.00 46.19 42.64 1a0l s LEU 82 CO -0.10 -0.76 0.05 -0.76 0.02 0.00 0.00 176.35 174.81 1a0l s LEU 83 N 1.56 3.81 0.59 1.79 1.43 0.10 -4.91 118.68 123.06 1a0l s LEU 83 Ca 0.68 0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 53.79 1a0l s LEU 83 Cb -0.39 -1.94 -0.05 0.00 0.03 0.00 0.00 46.19 43.84 1a0l s LEU 83 CO 0.30 0.24 1.01 -2.16 0.23 0.00 0.00 176.35 175.97 1a0l s PRO 84 N -0.03 3.66 0.00 1.29 0.04 -1.26 -0.41 135.00 138.28 1a0l s PRO 84 Ca 0.06 0.75 0.01 0.00 0.04 0.00 0.00 61.00 61.85 1a0l s PRO 84 Cb -0.12 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 1a0l s PRO 84 CO 0.01 -0.49 0.05 0.14 0.04 0.00 0.00 177.00 176.74 1a0l s VAL 85 N -3.05 4.47 -0.18 -0.36 -7.23 -1.26 -2.53 120.40 110.25 1a0l s VAL 85 Ca 0.55 -0.52 0.10 0.00 -1.81 0.00 0.00 61.98 60.30 1a0l s VAL 85 Cb -0.11 -3.03 -0.23 0.00 0.56 0.00 0.00 36.38 33.57 1a0l s VAL 85 CO 0.49 0.34 0.14 -0.24 -0.31 0.00 0.00 175.10 175.53 1a0l n SER 86 N 1.22 0.91 -3.63 4.85 2.88 0.41 -4.69 113.62 115.56 1a0l n SER 86 Ca -0.13 0.07 -0.15 0.00 -1.33 0.00 0.00 58.87 57.33 1a0l n SER 86 Cb 0.53 0.23 -0.07 0.00 -0.75 0.00 0.00 64.21 64.14 1a0l n SER 86 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1a0l s ARG 87 N -2.53 0.81 -0.15 -1.46 3.52 -1.20 -5.01 118.95 112.94 1a0l s ARG 87 Ca -0.17 0.68 -0.01 0.00 -0.13 0.00 0.00 55.73 56.10 1a0l s ARG 87 Cb 0.07 0.39 -0.02 0.00 -1.56 0.00 0.00 34.95 33.84 1a0l s ARG 87 CO 0.76 -0.15 -0.10 0.42 -0.81 0.00 0.00 175.30 175.42 1a0l s ILE 88 N -0.12 3.24 -0.19 4.11 1.01 -1.26 -0.72 121.20 127.28 1a0l s ILE 88 Ca -0.03 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 60.03 1a0l s ILE 88 Cb -0.03 -2.39 0.04 0.00 0.01 0.00 0.00 42.46 40.09 1a0l s ILE 88 CO 0.03 0.51 -0.09 -0.63 0.00 0.00 0.00 174.94 174.76 1a0l s ILE 89 N 0.48 1.49 0.01 2.92 1.01 0.46 -5.01 121.20 122.56 1a0l s ILE 89 Ca -0.08 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 59.73 1a0l s ILE 89 Cb -0.15 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 1a0l s ILE 89 CO 0.04 0.18 -0.07 -0.69 0.00 0.00 0.00 174.94 174.40 1a0l s VAL 90 N 1.47 3.63 0.11 2.92 1.01 -1.26 -0.08 120.40 128.19 1a0l s VAL 90 Ca -0.00 -0.81 -0.31 0.00 0.00 0.00 0.00 61.98 60.86 1a0l s VAL 90 Cb -0.16 -2.58 -0.10 0.00 0.00 0.00 0.00 36.38 33.54 1a0l s VAL 90 CO -0.08 0.38 1.76 -2.28 0.00 0.00 0.00 175.10 174.87 1a0l s HIS 91 N -1.01 2.28 0.63 5.22 2.46 -1.16 -4.86 115.29 118.85 1a0l s HIS 91 Ca 0.17 0.12 0.27 0.00 0.47 0.00 0.00 55.06 56.10 1a0l s HIS 91 Cb -0.11 -4.10 1.44 0.00 -0.13 0.00 0.00 32.58 29.68 1a0l s HIS 91 CO 0.08 -4.46 1.83 -1.00 -2.47 0.00 0.00 174.74 168.72 1a0l h PRO 92 N 8.42 0.00 -0.01 2.88 0.13 -1.94 0.36 132.00 141.85 1a0l h PRO 92 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1a0l h PRO 92 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1a0l h PRO 92 CO 0.94 0.00 -0.38 1.04 -0.23 0.00 0.00 178.00 179.37 1a0l n GLN 93 N -3.25 0.87 -2.32 0.86 6.02 -1.26 -4.92 117.38 113.38 1a0l n GLN 93 Ca 0.04 -0.61 -0.42 0.00 -0.01 0.00 0.00 57.00 55.99 1a0l n GLN 93 Cb 0.58 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.33 1a0l n GLN 93 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 1a0l s PHE 94 N -2.55 3.08 0.00 1.08 5.36 0.13 -4.81 117.98 120.27 1a0l s PHE 94 Ca 0.21 1.02 0.00 0.00 -0.96 0.00 0.00 56.93 57.20 1a0l s PHE 94 Cb 0.19 -3.55 0.00 0.00 -0.34 0.00 0.00 43.02 39.31 1a0l s PHE 94 CO 0.56 -1.92 0.00 0.98 -1.46 0.00 0.00 175.22 173.39 1a0l n TYR 95 N 4.98 0.00 -3.90 10.12 9.36 -1.26 -4.82 117.16 131.64 1a0l n TYR 95 Ca 0.12 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.23 1a0l n TYR 95 Cb 0.45 0.24 -0.11 0.00 -0.63 0.00 0.00 39.34 39.29 1a0l n TYR 95 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1a0l s THR 96 N -1.94 0.07 0.28 2.97 2.01 -1.26 -4.54 115.64 113.24 1a0l s THR 96 Ca 0.00 -0.62 -0.04 0.00 0.31 0.00 0.00 61.69 61.34 1a0l s THR 96 Cb 0.00 -0.33 0.26 0.00 0.01 0.00 0.00 72.50 72.44 1a0l s THR 96 CO 0.00 -0.34 1.95 0.00 -0.69 0.00 0.00 174.62 175.54 1a0l h ALA 97 N 4.72 1.34 0.00 7.40 0.00 -1.96 -1.84 119.26 128.92 1a0l h ALA 97 Ca -0.30 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1a0l h ALA 97 Cb 1.20 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1a0l h ALA 97 CO 0.41 0.61 -0.05 1.96 0.00 0.00 0.00 179.25 182.18 1a0l h GLN 98 N 1.23 0.00 -0.01 0.00 7.50 -1.97 0.09 115.11 121.96 1a0l h GLN 98 Ca 0.33 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.48 1a0l h GLN 98 Cb -0.13 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.40 1a0l h GLN 98 CO -0.07 0.05 -0.20 -0.89 -1.50 0.00 0.00 178.83 176.22 1a0l n ILE 99 N -3.44 0.00 -0.85 2.54 5.41 -0.71 -4.90 119.36 117.42 1a0l n ILE 99 Ca -0.02 -0.19 0.00 0.00 1.00 0.00 0.00 62.75 63.54 1a0l n ILE 99 Cb 0.17 0.57 0.00 0.00 -0.71 0.00 0.00 39.64 39.67 1a0l n ILE 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1a0l n GLY 100 N 1.31 -2.52 2.35 7.39 0.00 0.02 -4.96 105.19 108.77 1a0l n GLY 100 Ca 0.14 -1.63 -0.13 0.00 0.00 0.00 0.00 46.02 44.40 1a0l n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a0l n ALA 101 N -0.44 -0.24 -2.50 4.61 0.00 -1.26 -4.57 120.51 116.10 1a0l n ALA 101 Ca 0.00 0.18 -0.40 0.00 0.00 0.00 0.00 53.44 53.23 1a0l n ALA 101 Cb 0.00 -1.49 -0.02 0.00 0.00 0.00 0.00 19.45 17.93 1a0l n ALA 101 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1a0l s ASP 102 N -2.75 6.43 0.01 0.00 2.15 -1.26 -4.37 116.67 116.88 1a0l s ASP 102 Ca 0.00 -1.71 -0.24 0.00 0.43 0.00 0.00 52.55 51.03 1a0l s ASP 102 Cb 0.00 -2.57 0.06 0.00 -0.30 0.00 0.00 42.92 40.10 1a0l s ASP 102 CO 0.00 -1.57 0.55 -0.51 -0.17 0.00 0.00 175.17 173.47 1a0l s ILE 103 N 5.42 0.02 -0.02 4.11 2.07 -1.26 -4.04 121.20 127.50 1a0l s ILE 103 Ca 0.51 -0.18 -0.29 0.00 -1.41 0.00 0.00 60.65 59.29 1a0l s ILE 103 Cb 0.01 -0.94 0.09 0.00 0.13 0.00 0.00 42.46 41.75 1a0l s ILE 103 CO -0.03 -0.10 0.76 0.00 -1.91 0.00 0.00 174.94 173.67 1a0l s ALA 104 N -1.89 -1.78 -0.05 1.50 0.00 0.46 -3.00 121.76 117.01 1a0l s ALA 104 Ca -0.08 1.16 0.04 0.00 0.00 0.00 0.00 51.96 53.08 1a0l s ALA 104 Cb -0.01 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.18 1a0l s ALA 104 CO 0.03 -0.49 -0.16 -0.51 0.00 0.00 0.00 175.76 174.63 1a0l s LEU 105 N -1.68 2.60 -0.17 0.00 1.43 0.89 -0.83 118.68 120.91 1a0l s LEU 105 Ca -0.04 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.81 1a0l s LEU 105 Cb -0.00 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.72 1a0l s LEU 105 CO 0.01 0.33 -0.20 -0.76 0.23 0.00 0.00 176.35 175.95 1a0l s LEU 106 N -0.62 2.12 -0.17 1.79 1.43 0.06 -0.41 118.68 122.88 1a0l s LEU 106 Ca 0.09 -0.64 -0.19 0.00 -1.03 0.00 0.00 54.13 52.37 1a0l s LEU 106 Cb -0.11 -1.47 -0.03 0.00 0.03 0.00 0.00 46.19 44.61 1a0l s LEU 106 CO 0.01 0.02 0.53 -0.70 0.23 0.00 0.00 176.35 176.43 1a0l s GLU 107 N 1.18 4.24 0.38 1.70 2.12 0.11 -0.71 118.70 127.72 1a0l s GLU 107 Ca 0.02 0.47 -0.25 0.00 0.36 0.00 0.00 54.97 55.57 1a0l s GLU 107 Cb -0.14 -3.52 -0.09 0.00 0.26 0.00 0.00 34.13 30.64 1a0l s GLU 107 CO -0.10 -0.07 1.05 -0.51 -0.54 0.00 0.00 175.26 175.09 1a0l s LEU 108 N 1.35 4.20 0.23 2.70 1.43 0.13 -0.45 118.68 128.28 1a0l s LEU 108 Ca 0.26 2.06 -0.07 0.00 -1.03 0.00 0.00 54.13 55.35 1a0l s LEU 108 Cb -0.15 -4.10 0.25 0.00 0.03 0.00 0.00 46.19 42.21 1a0l s LEU 108 CO 0.10 -0.44 1.87 -0.08 0.23 0.00 0.00 176.35 178.04 1a0l h GLU 109 N 2.69 1.00 -5.00 1.70 4.81 -1.77 -3.41 114.58 114.60 1a0l h GLU 109 Ca -0.48 -0.06 -0.38 0.00 -0.13 0.00 0.00 59.36 58.31 1a0l h GLU 109 Cb 1.21 -0.22 -0.24 0.00 0.63 0.00 0.00 28.75 30.13 1a0l h GLU 109 CO 0.63 0.66 -0.77 -1.21 -0.73 0.00 0.00 179.01 177.59 1a0l s GLU 110 N -6.10 0.75 0.56 1.92 2.02 -1.26 -4.94 118.70 111.65 1a0l s GLU 110 Ca -0.13 -0.70 -0.21 0.00 0.02 0.00 0.00 54.97 53.96 1a0l s GLU 110 Cb 0.17 -0.70 -0.04 0.00 0.10 0.00 0.00 34.13 33.66 1a0l s GLU 110 CO 0.79 0.17 1.29 -2.14 0.02 0.00 0.00 175.26 175.39 1a0l s PRO 111 N -1.16 3.10 0.60 0.39 0.02 -1.26 -4.87 135.00 131.82 1a0l s PRO 111 Ca -0.02 2.06 -0.03 0.00 0.02 0.00 0.00 61.00 63.04 1a0l s PRO 111 Cb -0.08 -2.15 0.04 0.00 0.02 0.00 0.00 34.50 32.33 1a0l s PRO 111 CO 0.01 -1.17 0.87 0.14 -0.33 0.00 0.00 177.00 176.52 1a0l s VAL 112 N -1.41 2.78 -0.43 3.83 -7.23 -0.31 -5.01 120.40 112.63 1a0l s VAL 112 Ca 0.73 -0.42 -0.09 0.00 -1.81 0.00 0.00 61.98 60.40 1a0l s VAL 112 Cb -0.36 -3.11 0.09 0.00 0.56 0.00 0.00 36.38 33.56 1a0l s VAL 112 CO 0.42 -0.09 0.27 -0.75 -0.31 0.00 0.00 175.10 174.64 1a0l s LYS 113 N -4.94 2.55 0.60 4.82 2.20 -1.26 -4.97 119.74 118.73 1a0l s LYS 113 Ca 0.57 -1.54 -0.19 0.00 -0.36 0.00 0.00 55.97 54.45 1a0l s LYS 113 Cb -0.10 -3.80 -0.03 0.00 -1.51 0.00 0.00 37.83 32.39 1a0l s LYS 113 CO 0.41 -1.01 1.23 0.14 -0.36 0.00 0.00 175.35 175.77 1a0l s VAL 114 N 1.40 2.49 0.00 4.02 -7.23 -1.26 -4.91 120.40 114.90 1a0l s VAL 114 Ca 0.04 0.31 0.00 0.00 -1.81 0.00 0.00 61.98 60.51 1a0l s VAL 114 Cb -0.24 -3.13 0.00 0.00 0.56 0.00 0.00 36.38 33.58 1a0l s VAL 114 CO 0.01 -0.06 0.00 -1.54 -0.31 0.00 0.00 175.10 173.20 1a0l n SER 115 N -1.60 0.00 0.17 4.85 3.41 0.19 -4.97 113.62 115.67 1a0l n SER 115 Ca 0.14 -0.42 0.05 0.00 -0.26 0.00 0.00 58.87 58.38 1a0l n SER 115 Cb 0.49 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.61 1a0l n SER 115 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1a0l h SER 116 N 0.00 0.00 0.19 4.04 4.64 -2.00 -3.26 113.55 117.16 1a0l h SER 116 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1a0l h SER 116 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1a0l h SER 116 CO 0.00 0.40 -1.86 1.41 -0.87 0.00 0.00 176.83 175.91 1a0l n HIS 117 N -3.29 0.20 -3.55 4.77 8.25 -1.26 -4.82 115.22 115.51 1a0l n HIS 117 Ca 0.01 0.06 -0.27 0.00 -0.26 0.00 0.00 57.72 57.26 1a0l n HIS 117 Cb 0.63 -0.66 -0.15 0.00 1.12 0.00 0.00 29.99 30.93 1a0l n HIS 117 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1a0l s VAL 118 N -3.35 -0.10 0.19 1.59 0.11 -1.23 -4.32 120.40 113.29 1a0l s VAL 118 Ca -0.07 -0.56 -0.18 0.00 -2.93 0.00 0.00 61.98 58.24 1a0l s VAL 118 Cb 0.12 -0.86 0.03 0.00 -1.53 0.00 0.00 36.38 34.14 1a0l s VAL 118 CO 0.88 -0.58 0.52 -1.38 -3.33 0.00 0.00 175.10 171.21 1a0l s HIS 119 N 2.13 -0.15 0.84 1.54 -3.43 -0.01 0.53 115.29 116.74 1a0l s HIS 119 Ca 0.07 -0.19 -0.11 0.00 -0.80 0.00 0.00 55.06 54.04 1a0l s HIS 119 Cb -0.16 0.39 0.10 0.00 -1.43 0.00 0.00 32.58 31.48 1a0l s HIS 119 CO -0.28 -0.90 1.10 0.95 -2.00 0.00 0.00 174.74 173.60 1a0l s THR 120 N -3.86 2.94 0.13 -5.38 -4.23 -1.26 -3.11 115.64 100.87 1a0l s THR 120 Ca 0.08 0.30 0.03 0.00 -1.18 0.00 0.00 61.69 60.93 1a0l s THR 120 Cb -0.01 -2.72 -0.04 0.00 1.34 0.00 0.00 72.50 71.08 1a0l s THR 120 CO -0.04 -0.40 0.18 0.54 -0.54 0.00 0.00 174.62 174.37 1a0l s VAL 121 N -2.87 4.91 -0.16 2.29 0.11 -0.57 -4.85 120.40 119.26 1a0l s VAL 121 Ca 0.63 -0.78 -0.15 0.00 -2.93 0.00 0.00 61.98 58.74 1a0l s VAL 121 Cb -0.18 -3.47 -0.04 0.00 -1.53 0.00 0.00 36.38 31.16 1a0l s VAL 121 CO 0.57 -0.02 0.35 -0.89 -3.33 0.00 0.00 175.10 171.78 1a0l s THR 122 N -1.64 5.26 0.44 5.04 2.01 -1.25 -4.66 115.64 120.85 1a0l s THR 122 Ca 0.32 0.66 -0.22 0.00 0.31 0.00 0.00 61.69 62.76 1a0l s THR 122 Cb -0.11 -3.69 -0.09 0.00 0.01 0.00 0.00 72.50 68.62 1a0l s THR 122 CO 0.25 0.35 1.01 -0.76 -0.69 0.00 0.00 174.62 174.79 1a0l s LEU 123 N 0.67 3.97 0.72 4.42 1.43 -1.26 -1.45 118.68 127.18 1a0l s LEU 123 Ca 0.19 1.89 -0.11 0.00 -1.03 0.00 0.00 54.13 55.07 1a0l s LEU 123 Cb -0.14 -4.43 0.02 0.00 0.03 0.00 0.00 46.19 41.67 1a0l s LEU 123 CO 0.06 -0.57 1.07 -2.16 0.23 0.00 0.00 176.35 174.98 1a0l s PRO 124 N -2.98 2.74 0.72 1.29 0.04 -1.26 -4.82 135.00 130.74 1a0l s PRO 124 Ca 0.63 0.82 -0.11 0.00 0.04 0.00 0.00 61.00 62.38 1a0l s PRO 124 Cb -0.16 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.42 1a0l s PRO 124 CO 0.20 -1.20 1.07 -2.14 0.04 0.00 0.00 177.00 174.97 1a0l s PRO 125 N -5.10 2.72 0.00 0.56 0.02 -1.26 -4.88 135.00 127.05 1a0l s PRO 125 Ca 0.59 0.83 0.00 0.00 0.02 0.00 0.00 61.00 62.43 1a0l s PRO 125 Cb -0.14 -1.98 0.00 0.00 0.02 0.00 0.00 34.50 32.41 1a0l s PRO 125 CO 0.55 -1.22 0.67 0.00 -0.33 0.00 0.00 177.00 176.67 1a0l n ALA 126 N -3.19 2.20 0.27 -1.55 0.00 -1.26 -2.59 120.51 114.39 1a0l n ALA 126 Ca 0.07 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.54 1a0l n ALA 126 Cb 0.54 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 19.01 1a0l n ALA 126 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1a0l n SER 127 N -0.41 1.33 -4.79 0.00 7.64 -1.26 -5.02 113.62 111.11 1a0l n SER 127 Ca 0.00 -1.16 -0.39 0.00 1.01 0.00 0.00 58.87 58.33 1a0l n SER 127 Cb 0.03 0.17 -0.06 0.00 -1.01 0.00 0.00 64.21 63.34 1a0l n SER 127 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1a0l s GLU 128 N -0.72 4.33 -0.01 1.43 0.41 -1.07 -4.98 118.70 118.10 1a0l s GLU 128 Ca 0.07 0.87 0.07 0.00 -0.41 0.00 0.00 54.97 55.58 1a0l s GLU 128 Cb 0.05 -3.26 -0.10 0.00 -1.78 0.00 0.00 34.13 29.04 1a0l s GLU 128 CO 0.11 0.57 0.24 0.25 -0.49 0.00 0.00 175.26 175.94 1a0l n THR 129 N 1.85 0.00 -3.43 3.63 -2.24 -1.26 -4.95 114.28 107.88 1a0l n THR 129 Ca -0.08 -0.25 -0.19 0.00 -2.27 0.00 0.00 64.05 61.27 1a0l n THR 129 Cb 0.50 0.65 0.03 0.00 -2.10 0.00 0.00 70.33 69.41 1a0l n THR 129 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1a0l n PHE 130 N -1.48 -2.34 -1.23 4.78 3.72 -1.26 -4.97 117.46 114.68 1a0l n PHE 130 Ca -0.00 0.77 -0.29 0.00 -0.05 0.00 0.00 57.45 57.88 1a0l n PHE 130 Cb 0.16 -3.69 0.14 0.00 -0.94 0.00 0.00 39.48 35.15 1a0l n PHE 130 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1a0l s PRO 131 N -4.69 1.09 0.40 -1.08 0.04 -1.26 -4.84 135.00 124.66 1a0l s PRO 131 Ca 0.29 0.72 -0.27 0.00 0.04 0.00 0.00 61.00 61.77 1a0l s PRO 131 Cb -0.08 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.57 1a0l s PRO 131 CO 0.81 -2.33 1.45 -1.25 0.04 0.00 0.00 177.00 175.72 1a0l s PRO 132 N -4.97 3.95 0.00 0.56 0.04 -1.26 -2.85 135.00 130.47 1a0l s PRO 132 Ca 0.64 2.49 0.00 0.00 0.04 0.00 0.00 61.00 64.17 1a0l s PRO 132 Cb -0.18 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1a0l s PRO 132 CO 0.57 -0.63 0.00 0.41 0.04 0.00 0.00 177.00 177.39 1a0l n GLY 133 N 0.52 2.71 3.76 0.56 0.00 -1.26 -5.02 105.19 106.46 1a0l n GLY 133 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1a0l n GLY 133 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1a0l s MET 134 N -0.40 3.63 -0.84 1.61 -1.94 -1.13 -4.94 119.30 115.28 1a0l s MET 134 Ca 0.00 2.16 -0.20 0.00 -1.71 0.00 0.00 55.69 55.94 1a0l s MET 134 Cb 0.00 -2.53 0.11 0.00 2.01 0.00 0.00 34.83 34.42 1a0l s MET 134 CO 0.00 -0.77 1.08 -1.25 -0.01 0.00 0.00 175.02 174.07 1a0l s PRO 135 N -2.56 3.44 0.14 2.03 0.04 -1.26 -4.63 135.00 132.20 1a0l s PRO 135 Ca 0.63 -1.46 0.07 0.00 0.04 0.00 0.00 61.00 60.27 1a0l s PRO 135 Cb -0.38 -4.72 -0.04 0.00 0.04 0.00 0.00 34.50 29.40 1a0l s PRO 135 CO 0.47 -1.79 -0.03 0.00 0.04 0.00 0.00 177.00 175.69 1a0l s TRP 137 N -1.52 0.75 0.03 0.00 0.52 -0.31 -1.16 118.94 117.25 1a0l s TRP 137 Ca 0.26 -0.41 0.07 0.00 0.02 0.00 0.00 56.10 56.04 1a0l s TRP 137 Cb -0.10 -0.45 -0.03 0.00 -1.15 0.00 0.00 33.47 31.74 1a0l s TRP 137 CO 0.17 -0.05 -0.21 0.08 0.02 0.00 0.00 176.95 176.97 1a0l s VAL 138 N -1.11 2.54 0.10 4.03 1.01 -0.42 -1.20 120.40 125.35 1a0l s VAL 138 Ca -0.06 -1.19 0.04 0.00 0.00 0.00 0.00 61.98 60.76 1a0l s VAL 138 Cb -0.08 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 1a0l s VAL 138 CO 0.01 0.40 -0.10 0.42 0.00 0.00 0.00 175.10 175.83 1a0l s THR 139 N -0.83 0.97 0.00 3.92 -4.23 -1.19 -1.37 115.64 112.91 1a0l s THR 139 Ca 0.13 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 1a0l s THR 139 Cb -0.10 -1.45 0.00 0.00 1.34 0.00 0.00 72.50 72.29 1a0l s THR 139 CO 0.03 -0.60 0.00 0.61 -0.54 0.00 0.00 174.62 174.12 1a0l n GLY 140 N 0.43 0.49 0.93 3.99 0.00 -0.85 -4.42 105.19 105.75 1a0l n GLY 140 Ca -0.15 -1.16 0.07 0.00 0.00 0.00 0.00 46.02 44.78 1a0l n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1a0l n TRP 141 N -0.84 0.98 -1.76 1.61 8.01 -1.26 -2.19 117.44 121.99 1a0l n TRP 141 Ca 0.00 -0.94 -0.30 0.00 -1.31 0.00 0.00 57.50 54.95 1a0l n TRP 141 Cb 0.00 -0.33 0.17 0.00 -2.01 0.00 0.00 31.31 29.13 1a0l n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1a0l s GLY 142 N -1.98 1.69 0.37 6.99 0.00 -1.25 -4.74 107.32 108.40 1a0l s GLY 142 Ca 0.43 -0.96 -0.23 0.00 0.00 0.00 0.00 44.72 43.95 1a0l s GLY 142 CO 0.08 -0.26 0.35 1.22 0.00 0.00 0.00 173.10 174.49 1a0l n ASP 143 N -3.81 -1.76 -0.16 1.64 8.00 -0.30 -1.52 116.55 118.64 1a0l n ASP 143 Ca 0.12 0.92 0.13 0.00 0.71 0.00 0.00 54.79 56.67 1a0l n ASP 143 Cb 0.60 -0.99 0.42 0.00 -0.02 0.00 0.00 41.12 41.14 1a0l n ASP 143 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1a0l n VAL 144 N -0.73 0.00 -3.95 2.53 0.24 0.24 -0.75 118.33 115.91 1a0l n VAL 144 Ca 0.13 -0.08 0.01 0.00 -2.04 0.00 0.00 64.34 62.35 1a0l n VAL 144 Cb 0.37 0.21 0.01 0.00 -1.47 0.00 0.00 33.84 32.96 1a0l n VAL 144 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1a0l n ASP 145 N -0.90 -1.15 -4.69 -1.34 2.03 -1.19 -4.23 116.55 105.08 1a0l n ASP 145 Ca 0.11 -1.35 -0.42 0.00 0.52 0.00 0.00 54.79 53.65 1a0l n ASP 145 Cb 0.33 1.81 -0.03 0.00 -0.72 0.00 0.00 41.12 42.51 1a0l n ASP 145 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 1a0l s ASN 146 N -3.39 6.62 -1.19 1.67 0.01 -1.26 -2.21 114.94 115.19 1a0l s ASN 146 Ca 0.25 2.47 0.00 0.00 -0.71 0.00 0.00 52.86 54.86 1a0l s ASN 146 Cb -0.01 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 39.09 1a0l s ASN 146 CO 0.01 -0.88 0.00 0.47 -1.51 0.00 0.00 177.10 175.19 1a0l n ASP 147 N 5.58 -3.75 -3.99 -1.22 8.00 -1.26 -4.90 116.55 115.02 1a0l n ASP 147 Ca 0.16 0.24 -0.32 0.00 0.71 0.00 0.00 54.79 55.58 1a0l n ASP 147 Cb 0.41 -3.30 -0.12 0.00 -0.02 0.00 0.00 41.12 38.08 1a0l n ASP 147 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1a0l s GLU 149 N -4.26 2.23 0.81 -1.24 0.41 -0.94 -5.09 118.70 110.62 1a0l s GLU 149 Ca 0.00 -2.69 -0.11 0.00 -0.41 0.00 0.00 54.97 51.75 1a0l s GLU 149 Cb 0.00 -3.46 0.08 0.00 -1.78 0.00 0.00 34.13 28.97 1a0l s GLU 149 CO 0.00 -1.15 1.13 -0.98 -0.49 0.00 0.00 175.26 173.77 1a0l s ARG 150 N -0.38 1.81 0.00 1.61 1.04 -1.26 -0.59 118.95 121.18 1a0l s ARG 150 Ca 0.18 1.39 0.00 0.00 -1.04 0.00 0.00 55.73 56.26 1a0l s ARG 150 Cb -0.22 -1.83 0.00 0.00 -2.04 0.00 0.00 34.95 30.86 1a0l s ARG 150 CO -0.03 -2.01 0.00 -0.11 -0.04 0.00 0.00 175.30 173.11 1a0l n LEU 151 N -3.63 0.00 -1.91 -1.89 7.94 -1.26 -4.53 117.00 111.71 1a0l n LEU 151 Ca 0.11 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 1a0l n LEU 151 Cb 0.52 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.47 1a0l n LEU 151 CO 0.51 -0.55 0.00 -0.81 -1.11 0.00 0.00 177.39 175.43 1a0l n PRO 152 N -0.73 0.00 -3.71 1.96 -0.04 -1.26 -5.02 135.00 126.21 1a0l n PRO 152 Ca 0.00 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 1a0l n PRO 152 Cb 0.00 -0.54 0.04 0.00 -0.04 0.00 0.00 33.50 32.96 1a0l n PRO 152 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1a0l n PHE 153 N 0.74 -1.88 -2.62 0.54 3.72 -1.26 -4.13 117.46 112.56 1a0l n PHE 153 Ca 0.00 0.50 -0.37 0.00 -0.05 0.00 0.00 57.45 57.52 1a0l n PHE 153 Cb 0.00 -3.51 -0.05 0.00 -0.94 0.00 0.00 39.48 34.98 1a0l n PHE 153 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1a0l s PRO 154 N -6.03 4.38 -0.00 -1.08 0.04 -1.26 -1.44 135.00 129.60 1a0l s PRO 154 Ca 0.41 1.48 -0.30 0.00 0.04 0.00 0.00 61.00 62.63 1a0l s PRO 154 Cb -0.15 -2.71 -0.07 0.00 0.04 0.00 0.00 34.50 31.61 1a0l s PRO 154 CO 0.86 0.06 1.65 -1.17 0.04 0.00 0.00 177.00 178.44 1a0l s LEU 155 N -2.28 4.34 0.18 -3.56 2.96 -0.94 -4.83 118.68 114.54 1a0l s LEU 155 Ca 0.53 2.33 0.04 0.00 -0.22 0.00 0.00 54.13 56.82 1a0l s LEU 155 Cb -0.22 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 1a0l s LEU 155 CO 0.28 -0.90 0.21 -0.54 -1.32 0.00 0.00 176.35 174.07 1a0l s LYS 156 N 3.47 3.12 0.07 1.98 1.02 -0.93 0.47 119.74 128.94 1a0l s LYS 156 Ca 0.74 -0.80 0.02 0.00 0.02 0.00 0.00 55.97 55.95 1a0l s LYS 156 Cb -0.36 -2.75 -0.03 0.00 -0.52 0.00 0.00 37.83 34.16 1a0l s LYS 156 CO 0.31 0.48 -0.07 1.14 -0.92 0.00 0.00 175.35 176.29 1a0l s GLN 157 N -3.31 0.71 -0.10 1.68 -2.07 0.26 -2.00 119.66 114.82 1a0l s GLN 157 Ca 0.33 -1.09 -0.12 0.00 -1.82 0.00 0.00 55.36 52.66 1a0l s GLN 157 Cb -0.10 -0.25 0.03 0.00 -1.09 0.00 0.00 33.01 31.60 1a0l s GLN 157 CO 0.26 0.01 0.33 0.54 -1.32 0.00 0.00 175.29 175.11 1a0l s VAL 158 N -2.63 0.01 -0.39 3.63 0.11 -0.47 -1.67 120.40 118.99 1a0l s VAL 158 Ca 0.02 -0.10 -0.20 0.00 -2.93 0.00 0.00 61.98 58.77 1a0l s VAL 158 Cb -0.01 -0.50 0.01 0.00 -1.53 0.00 0.00 36.38 34.34 1a0l s VAL 158 CO -0.02 -0.05 0.62 -0.75 -3.33 0.00 0.00 175.10 171.57 1a0l s LYS 159 N -0.13 3.50 0.13 1.54 2.20 -1.26 -1.30 119.74 124.41 1a0l s LYS 159 Ca -0.03 -0.16 0.07 0.00 -0.36 0.00 0.00 55.97 55.49 1a0l s LYS 159 Cb -0.03 -3.87 -0.04 0.00 -1.51 0.00 0.00 37.83 32.38 1a0l s LYS 159 CO 0.01 -0.85 -0.06 0.14 -0.36 0.00 0.00 175.35 174.24 1a0l s VAL 160 N 2.72 3.55 -0.20 4.02 -7.23 -0.31 -4.97 120.40 117.98 1a0l s VAL 160 Ca 0.23 -1.31 -0.16 0.00 -1.81 0.00 0.00 61.98 58.93 1a0l s VAL 160 Cb -0.14 -2.71 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 1a0l s VAL 160 CO 0.16 0.03 0.40 -2.16 -0.31 0.00 0.00 175.10 173.22 1a0l s PRO 161 N -2.49 4.18 0.95 4.82 0.04 -1.26 -3.73 135.00 137.51 1a0l s PRO 161 Ca 0.24 0.21 -0.11 0.00 0.04 0.00 0.00 61.00 61.38 1a0l s PRO 161 Cb -0.10 -3.53 0.16 0.00 0.04 0.00 0.00 34.50 31.07 1a0l s PRO 161 CO 0.16 -0.03 1.10 0.42 0.04 0.00 0.00 177.00 178.70 1a0l s ILE 162 N 1.27 2.32 -0.19 0.56 -1.09 -1.26 -1.36 121.20 121.44 1a0l s ILE 162 Ca 0.19 0.10 -0.10 0.00 -2.23 0.00 0.00 60.65 58.61 1a0l s ILE 162 Cb -0.15 -2.27 0.06 0.00 -1.58 0.00 0.00 42.46 38.53 1a0l s ILE 162 CO 0.08 -0.13 0.46 -0.32 -1.23 0.00 0.00 174.94 173.79 1a0l s MET 163 N -4.68 0.44 -0.05 2.79 1.75 -1.06 -4.63 119.30 113.85 1a0l s MET 163 Ca 0.66 0.87 -0.37 0.00 -1.25 0.00 0.00 55.69 55.59 1a0l s MET 163 Cb -0.22 0.01 -0.15 0.00 2.84 0.00 0.00 34.83 37.31 1a0l s MET 163 CO 0.59 -0.16 1.58 0.39 -0.65 0.00 0.00 175.02 176.77 1a0l n GLU 164 N 4.31 1.41 -0.31 4.11 1.02 -1.26 -4.23 120.64 125.68 1a0l n GLU 164 Ca -0.22 0.51 0.12 0.00 -0.02 0.00 0.00 57.16 57.55 1a0l n GLU 164 Cb 0.56 -2.21 0.26 0.00 -0.02 0.00 0.00 31.44 30.03 1a0l n GLU 164 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1a0l h ASN 165 N 6.25 -0.34 -0.79 1.62 4.21 -1.94 0.26 115.58 124.85 1a0l h ASN 165 Ca -0.47 0.24 -0.01 0.00 1.21 0.00 0.00 56.30 57.27 1a0l h ASN 165 Cb 1.31 0.40 -0.04 0.00 -1.12 0.00 0.00 38.32 38.88 1a0l h ASN 165 CO 0.88 -0.27 0.43 0.45 -1.29 0.00 0.00 177.43 177.63 1a0l h HIS 166 N 0.07 1.08 -0.38 1.19 3.86 -1.92 0.66 115.15 119.70 1a0l h HIS 166 Ca 0.55 -0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.59 1a0l h HIS 166 Cb 1.09 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 29.21 1a0l h HIS 166 CO -0.43 0.75 -0.32 0.82 0.86 0.00 0.00 177.93 179.61 1a0l h ILE 167 N 1.09 1.28 0.40 2.45 1.08 -1.14 -2.59 117.51 120.07 1a0l h ILE 167 Ca 0.28 -1.49 -0.02 0.00 -0.39 0.00 0.00 64.86 63.24 1a0l h ILE 167 Cb 0.03 1.33 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1a0l h ILE 167 CO -0.04 0.50 -0.19 0.00 -0.69 0.00 0.00 178.15 177.72 1a0l h ASP 169 N -0.71 0.21 0.21 0.00 3.58 0.28 -0.28 116.42 119.71 1a0l h ASP 169 Ca -0.05 0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 1a0l h ASP 169 Cb 0.50 0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.71 1a0l h ASP 169 CO 0.09 -0.01 -0.10 0.00 -2.88 0.00 0.00 179.24 176.34 1a0l h ALA 170 N 1.66 -0.29 -0.85 -0.78 0.00 -1.29 -2.55 119.26 115.17 1a0l h ALA 170 Ca 0.50 -0.12 0.19 0.00 0.00 0.00 0.00 54.91 55.48 1a0l h ALA 170 Cb 0.90 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 1a0l h ALA 170 CO -0.52 -0.59 0.57 0.87 0.00 0.00 0.00 179.25 179.59 1a0l h LYS 171 N -0.43 0.34 0.00 0.00 1.57 -0.12 0.38 116.57 118.31 1a0l h LYS 171 Ca -0.03 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1a0l h LYS 171 Cb 0.33 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1a0l h LYS 171 CO 0.05 0.23 0.00 0.66 -0.57 0.00 0.00 179.45 179.81 1a0l n TYR 172 N -4.47 0.86 0.07 -1.35 4.01 -0.44 -2.07 117.16 113.77 1a0l n TYR 172 Ca 0.18 0.35 0.08 0.00 -0.16 0.00 0.00 57.90 58.35 1a0l n TYR 172 Cb 0.68 -1.06 -0.04 0.00 -0.31 0.00 0.00 39.34 38.61 1a0l n TYR 172 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1a0l n HIS 173 N -2.29 0.85 -1.68 -0.72 8.25 0.13 -4.74 115.22 115.02 1a0l n HIS 173 Ca 0.02 0.26 -0.42 0.00 -0.26 0.00 0.00 57.72 57.31 1a0l n HIS 173 Cb 0.22 -0.94 -0.03 0.00 1.12 0.00 0.00 29.99 30.36 1a0l n HIS 173 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1a0l s LEU 173 N -5.36 4.42 0.00 2.41 1.43 -0.88 -1.24 118.68 119.46 1a0l s LEU 173 Ca -0.02 2.73 0.00 0.00 -1.03 0.00 0.00 54.13 55.81 1a0l s LEU 173 Cb 0.10 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1a0l s LEU 173 CO 0.81 -1.03 0.00 0.61 0.23 0.00 0.00 176.35 176.97 1a0l n GLY 173 N 4.39 0.49 3.25 -3.19 0.00 -1.26 -5.05 105.19 103.83 1a0l n GLY 173 Ca 0.19 -0.48 -0.21 0.00 0.00 0.00 0.00 46.02 45.52 1a0l n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a0l s ALA 173 N -2.00 1.60 -0.25 4.61 0.00 -0.37 -5.03 121.76 120.32 1a0l s ALA 173 Ca 0.00 -1.20 0.28 0.00 0.00 0.00 0.00 51.96 51.05 1a0l s ALA 173 Cb 0.00 -0.18 1.07 0.00 0.00 0.00 0.00 23.12 24.01 1a0l s ALA 173 CO 0.00 0.27 1.83 1.88 0.00 0.00 0.00 175.76 179.74 1a0l h TYR 173 N 4.02 0.00 -2.38 0.00 0.05 -1.97 -3.45 116.97 113.25 1a0l h TYR 173 Ca -0.44 0.00 -0.55 0.00 0.05 0.00 0.00 58.73 57.79 1a0l h TYR 173 Cb 1.19 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.93 1a0l h TYR 173 CO 0.63 0.00 1.26 0.99 -1.05 0.00 0.00 178.16 179.99 1a0l s THR 173 N -3.44 3.20 0.00 -2.88 2.01 -1.26 -5.19 115.64 108.08 1a0l s THR 173 Ca 0.04 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.27 1a0l s THR 173 Cb 0.09 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.42 1a0l s THR 173 CO 0.51 -0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.99 1a0l n GLY 173 N 4.79 -2.50 2.49 4.40 0.00 -1.26 -4.90 105.19 108.21 1a0l n GLY 173 Ca 0.22 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1a0l n GLY 173 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1a0l n ASP 173 N 0.00 0.00 -4.50 1.61 5.75 -1.26 -4.73 116.55 113.42 1a0l n ASP 173 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.36 1a0l n ASP 173 Cb 0.00 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.00 1a0l n ASP 173 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1a0l s VAL 173 N 0.00 5.13 -0.42 2.12 1.01 -1.26 -5.04 120.40 121.94 1a0l s VAL 173 Ca 0.00 -0.29 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 1a0l s VAL 173 Cb 0.00 -3.97 0.01 0.00 0.00 0.00 0.00 36.38 32.42 1a0l s VAL 173 CO 0.00 -0.32 1.33 -0.60 0.00 0.00 0.00 175.10 175.51 1a0l s ARG 174 N 2.04 3.64 -0.09 2.72 3.52 -1.26 -4.91 118.95 124.61 1a0l s ARG 174 Ca 0.11 0.87 -0.17 0.00 -0.13 0.00 0.00 55.73 56.41 1a0l s ARG 174 Cb -0.17 -3.98 -0.28 0.00 -1.56 0.00 0.00 34.95 28.96 1a0l s ARG 174 CO 0.13 -1.48 0.62 0.82 -0.81 0.00 0.00 175.30 174.58 1a0l h ILE 175 N 6.36 1.13 -3.09 4.11 2.04 -1.95 -3.42 117.51 122.68 1a0l h ILE 175 Ca -0.26 -2.42 -0.73 0.00 1.00 0.00 0.00 64.86 62.45 1a0l h ILE 175 Cb 1.09 2.81 -0.22 0.00 -0.74 0.00 0.00 36.82 39.76 1a0l h ILE 175 CO 1.09 0.69 -0.11 -0.69 0.00 0.00 0.00 178.15 179.14 1a0l s VAL 176 N -2.46 5.05 0.82 1.67 1.01 -1.26 -5.00 120.40 120.23 1a0l s VAL 176 Ca -0.19 -1.13 -0.12 0.00 0.00 0.00 0.00 61.98 60.54 1a0l s VAL 176 Cb 0.04 -4.34 0.09 0.00 0.00 0.00 0.00 36.38 32.16 1a0l s VAL 176 CO 0.77 -0.88 1.14 -0.13 0.00 0.00 0.00 175.10 176.00 1a0l s ARG 177 N 2.07 1.73 0.53 2.72 3.00 -1.26 -4.86 118.95 122.88 1a0l s ARG 177 Ca 0.07 1.47 0.29 0.00 0.00 0.00 0.00 55.73 57.57 1a0l s ARG 177 Cb -0.26 -1.81 1.51 0.00 0.00 0.00 0.00 34.95 34.39 1a0l s ARG 177 CO 0.06 -2.09 2.08 -0.44 0.00 0.00 0.00 175.30 174.91 1a0l h ASP 178 N -1.20 0.00 0.02 0.23 3.32 -1.99 -1.51 116.42 115.30 1a0l h ASP 178 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1a0l h ASP 178 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1a0l h ASP 178 CO 0.47 0.10 -0.01 -0.90 -1.72 0.00 0.00 179.24 177.18 1a0l n ASP 179 N -3.53 0.74 -4.91 6.45 5.75 -1.26 -4.86 116.55 114.92 1a0l n ASP 179 Ca -0.02 -1.21 -0.20 0.00 -0.01 0.00 0.00 54.79 53.36 1a0l n ASP 179 Cb 0.24 -0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.30 1a0l n ASP 179 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 1a0l s MET 180 N -2.03 2.64 -0.13 0.11 -1.94 -0.57 0.57 119.30 117.95 1a0l s MET 180 Ca 0.42 -1.43 -0.06 0.00 -1.71 0.00 0.00 55.69 52.90 1a0l s MET 180 Cb 0.21 -2.49 0.05 0.00 2.01 0.00 0.00 34.83 34.61 1a0l s MET 180 CO 0.36 -0.18 0.30 -1.17 -0.01 0.00 0.00 175.02 174.32 1a0l s LEU 181 N -4.17 0.25 0.20 -0.03 0.20 0.15 -4.56 118.68 110.71 1a0l s LEU 181 Ca 0.49 0.64 0.00 0.00 0.69 0.00 0.00 54.13 55.96 1a0l s LEU 181 Cb -0.05 0.93 -0.04 0.00 -0.43 0.00 0.00 46.19 46.60 1a0l s LEU 181 CO 0.29 -0.17 0.37 0.00 -0.29 0.00 0.00 176.35 176.55 1a0l s ALA 183 N -1.87 -2.03 0.00 0.00 0.00 -0.99 -2.56 121.76 114.31 1a0l s ALA 183 Ca 0.37 1.81 0.00 0.00 0.00 0.00 0.00 51.96 54.14 1a0l s ALA 183 Cb -0.11 -1.47 0.00 0.00 0.00 0.00 0.00 23.12 21.54 1a0l s ALA 183 CO 0.29 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.25 1a0l n GLY 184 N 1.92 3.04 2.00 0.00 0.00 -0.46 -3.00 105.19 108.70 1a0l n GLY 184 Ca -0.11 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 43.79 1a0l n GLY 184 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1a0l n ASN 185 N 0.00 -0.43 0.01 1.61 0.23 -0.36 -4.79 115.26 111.52 1a0l n ASN 185 Ca 0.00 -2.37 0.02 0.00 -0.53 0.00 0.00 54.58 51.70 1a0l n ASN 185 Cb 0.00 1.04 0.07 0.00 -2.08 0.00 0.00 39.78 38.81 1a0l n ASN 185 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1a0l n THR 186 N -0.40 1.81 -0.58 5.53 -2.24 -1.26 -2.47 114.28 114.67 1a0l n THR 186 Ca 0.05 0.47 0.00 0.00 -2.27 0.00 0.00 64.05 62.30 1a0l n THR 186 Cb 0.38 -1.43 0.00 0.00 -2.10 0.00 0.00 70.33 67.17 1a0l n THR 186 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1a0l n ARG 187 N -1.53 1.17 -3.55 -0.78 1.85 -1.26 -4.76 116.66 107.79 1a0l n ARG 187 Ca 0.00 -0.88 -0.15 0.00 -1.00 0.00 0.00 57.85 55.82 1a0l n ARG 187 Cb 0.03 -0.71 -0.13 0.00 -1.05 0.00 0.00 32.46 30.60 1a0l n ARG 187 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1a0l s ARG 188 N -0.40 0.18 -0.03 2.89 0.52 -1.03 -3.95 118.95 117.13 1a0l s ARG 188 Ca 0.00 0.46 -0.29 0.00 -0.52 0.00 0.00 55.73 55.38 1a0l s ARG 188 Cb 0.00 -0.64 0.11 0.00 0.52 0.00 0.00 34.95 34.94 1a0l s ARG 188 CO 0.00 -0.49 0.91 0.34 0.02 0.00 0.00 175.30 176.08 1a0l s ASP 189 N 2.38 -0.36 0.77 0.23 2.15 -0.94 -1.22 116.67 119.68 1a0l s ASP 189 Ca 0.05 0.06 -0.11 0.00 0.43 0.00 0.00 52.55 52.98 1a0l s ASP 189 Cb -0.14 0.36 0.06 0.00 -0.30 0.00 0.00 42.92 42.91 1a0l s ASP 189 CO -0.11 -0.57 1.13 -0.94 -0.17 0.00 0.00 175.17 174.52 1a0l s SER 190 N -2.29 4.74 0.25 -0.34 1.04 -1.26 0.53 113.70 116.37 1a0l s SER 190 Ca 0.04 0.79 -0.06 0.00 0.48 0.00 0.00 55.95 57.20 1a0l s SER 190 Cb -0.01 -1.37 0.02 0.00 0.10 0.00 0.00 66.02 64.76 1a0l s SER 190 CO -0.07 -1.74 0.43 0.00 0.98 0.00 0.00 173.24 172.84 1a0l n GLN 192 N -0.37 1.10 -0.03 0.00 -0.06 -1.26 -0.73 117.38 116.03 1a0l n GLN 192 Ca -0.03 0.39 0.00 0.00 -2.00 0.00 0.00 57.00 55.36 1a0l n GLN 192 Cb 0.39 -1.92 0.00 0.00 -4.06 0.00 0.00 30.24 24.65 1a0l n GLN 192 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1a0l n GLY 193 N 2.12 1.27 0.06 1.69 0.00 -1.26 -1.15 105.19 107.91 1a0l n GLY 193 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 1a0l n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1a0l n ASP 194 N 0.00 0.60 -4.41 1.61 8.00 0.09 -3.79 116.55 118.65 1a0l n ASP 194 Ca 0.00 0.01 -0.47 0.00 0.71 0.00 0.00 54.79 55.04 1a0l n ASP 194 Cb 0.00 0.81 -0.02 0.00 -0.02 0.00 0.00 41.12 41.89 1a0l n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1a0l n SER 195 N -2.23 -1.12 0.00 -2.24 7.64 -1.26 -1.06 113.62 113.36 1a0l n SER 195 Ca 0.01 1.10 0.00 0.00 1.01 0.00 0.00 58.87 60.98 1a0l n SER 195 Cb 0.49 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.70 1a0l n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a0l n GLY 196 N 1.94 2.95 3.62 0.23 0.00 -0.92 0.02 105.19 113.03 1a0l n GLY 196 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1a0l n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a0l s GLY 197 N -1.61 1.56 0.08 -0.02 0.00 -0.23 -2.89 107.32 104.22 1a0l s GLY 197 Ca 0.00 -0.56 -0.00 0.00 0.00 0.00 0.00 44.72 44.16 1a0l s GLY 197 CO 0.00 0.17 0.23 2.56 0.00 0.00 0.00 173.10 176.06 1a0l s PRO 198 N -5.06 3.45 -0.33 2.90 0.04 -1.26 -1.52 135.00 133.22 1a0l s PRO 198 Ca 0.68 -0.43 0.00 0.00 0.04 0.00 0.00 61.00 61.29 1a0l s PRO 198 Cb -0.16 -3.01 0.08 0.00 0.04 0.00 0.00 34.50 31.45 1a0l s PRO 198 CO 0.58 0.58 0.05 -1.17 0.04 0.00 0.00 177.00 177.08 1a0l s LEU 199 N -2.62 4.42 -0.09 -3.56 2.96 -0.69 -3.19 118.68 115.90 1a0l s LEU 199 Ca 0.35 -1.74 0.01 0.00 -0.22 0.00 0.00 54.13 52.53 1a0l s LEU 199 Cb -0.13 -1.69 -0.02 0.00 0.50 0.00 0.00 46.19 44.85 1a0l s LEU 199 CO 0.28 -0.35 -0.11 0.68 -1.32 0.00 0.00 176.35 175.52 1a0l s VAL 200 N 1.10 3.27 -0.01 1.68 -7.23 -0.34 -0.38 120.40 118.49 1a0l s VAL 200 Ca 0.02 -0.62 0.05 0.00 -1.81 0.00 0.00 61.98 59.62 1a0l s VAL 200 Cb -0.20 -2.33 -0.03 0.00 0.56 0.00 0.00 36.38 34.37 1a0l s VAL 200 CO -0.05 0.56 -0.15 0.00 -0.31 0.00 0.00 175.10 175.16 1a0l s LYS 202 N -1.07 3.48 -0.29 0.00 2.20 -1.04 -0.38 119.74 122.64 1a0l s LYS 202 Ca 0.13 -1.36 -0.15 0.00 -0.36 0.00 0.00 55.97 54.23 1a0l s LYS 202 Cb -0.11 -4.84 -0.03 0.00 -1.51 0.00 0.00 37.83 31.34 1a0l s LYS 202 CO 0.03 -1.89 0.35 0.08 -0.36 0.00 0.00 175.35 173.56 1a0l s VAL 203 N 3.60 5.18 -1.31 4.02 1.01 -0.71 -4.37 120.40 127.81 1a0l s VAL 203 Ca 0.33 0.41 -0.01 0.00 0.00 0.00 0.00 61.98 62.71 1a0l s VAL 203 Cb -0.06 -3.71 0.01 0.00 0.00 0.00 0.00 36.38 32.61 1a0l s VAL 203 CO -0.04 0.11 0.76 -3.20 0.00 0.00 0.00 175.10 172.72 1a0l n ASN 204 N 5.32 -1.64 0.00 3.32 5.15 -1.26 -1.76 115.26 124.40 1a0l n ASN 204 Ca -0.09 -0.79 0.00 0.00 -0.60 0.00 0.00 54.58 53.10 1a0l n ASN 204 Cb 0.51 -4.18 0.00 0.00 -0.53 0.00 0.00 39.78 35.58 1a0l n ASN 204 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1a0l n GLY 205 N -1.54 2.39 3.40 8.20 0.00 -1.26 -4.99 105.19 111.38 1a0l n GLY 205 Ca -0.27 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1a0l n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a0l s THR 206 N -2.30 3.59 -0.01 2.61 2.01 -0.72 -5.06 115.64 115.77 1a0l s THR 206 Ca 0.00 -0.44 -0.30 0.00 0.31 0.00 0.00 61.69 61.26 1a0l s THR 206 Cb 0.00 -2.60 -0.07 0.00 0.01 0.00 0.00 72.50 69.84 1a0l s THR 206 CO 0.00 0.46 1.74 0.26 -0.69 0.00 0.00 174.62 176.39 1a0l s TRP 207 N 0.92 1.86 0.10 4.92 0.52 -1.26 -1.74 118.94 124.25 1a0l s TRP 207 Ca -0.00 0.03 0.09 0.00 0.02 0.00 0.00 56.10 56.24 1a0l s TRP 207 Cb -0.15 -4.02 -0.04 0.00 -1.15 0.00 0.00 33.47 28.12 1a0l s TRP 207 CO 0.01 -4.35 -0.22 -0.51 0.02 0.00 0.00 176.95 171.90 1a0l s LEU 208 N 3.91 2.50 -0.51 2.99 1.43 0.49 -3.76 118.68 125.73 1a0l s LEU 208 Ca 0.78 -0.59 -0.19 0.00 -1.03 0.00 0.00 54.13 53.10 1a0l s LEU 208 Cb -0.37 -1.41 0.06 0.00 0.03 0.00 0.00 46.19 44.50 1a0l s LEU 208 CO 0.33 0.21 0.60 -1.58 0.23 0.00 0.00 176.35 176.14 1a0l s GLN 209 N -1.85 3.10 -0.03 1.70 0.74 -0.53 0.02 119.66 122.82 1a0l s GLN 209 Ca 0.15 -0.96 -0.25 0.00 0.05 0.00 0.00 55.36 54.35 1a0l s GLN 209 Cb -0.10 -4.11 -0.20 0.00 1.10 0.00 0.00 33.01 29.70 1a0l s GLN 209 CO 0.07 -1.21 1.22 0.00 -0.55 0.00 0.00 175.29 174.81 1a0l h ALA 210 N 8.98 0.03 -2.96 1.58 0.00 -1.06 -3.37 119.26 122.46 1a0l h ALA 210 Ca -0.28 -0.29 -0.27 0.00 0.00 0.00 0.00 54.91 54.07 1a0l h ALA 210 Cb 1.10 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 1a0l h ALA 210 CO 0.96 -0.17 -0.12 0.20 0.00 0.00 0.00 179.25 180.12 1a0l s GLY 211 N -3.35 1.47 -0.08 0.00 0.00 -1.11 -0.99 107.32 103.25 1a0l s GLY 211 Ca -0.16 -1.49 0.04 0.00 0.00 0.00 0.00 44.72 43.11 1a0l s GLY 211 CO 0.69 -0.94 -0.22 0.14 0.00 0.00 0.00 173.10 172.77 1a0l s VAL 212 N -2.79 1.89 -0.08 1.40 1.01 -0.80 -1.71 120.40 119.32 1a0l s VAL 212 Ca 0.29 -0.93 -0.36 0.00 0.00 0.00 0.00 61.98 60.98 1a0l s VAL 212 Cb -0.01 -1.63 -0.14 0.00 0.00 0.00 0.00 36.38 34.60 1a0l s VAL 212 CO 0.21 0.52 1.74 0.52 0.00 0.00 0.00 175.10 178.09 1a0l n VAL 213 N 3.42 0.35 0.00 2.92 0.31 -0.57 -0.25 118.33 124.51 1a0l n VAL 213 Ca -0.19 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1a0l n VAL 213 Cb 0.53 -1.54 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 1a0l n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1a0l n SER 214 N 5.34 0.00 -0.04 4.52 2.88 -0.25 -2.17 113.62 123.89 1a0l n SER 214 Ca 0.22 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 1a0l n SER 214 Cb 0.24 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 1a0l n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1a0l n TRP 215 N -1.70 -0.01 0.00 0.66 4.27 -0.88 -4.93 117.44 114.84 1a0l n TRP 215 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1a0l n TRP 215 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 1a0l n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1a0l n GLY 216 N 0.00 2.09 3.16 -1.67 0.00 -1.26 -1.77 105.19 105.75 1a0l n GLY 216 Ca 0.00 -1.35 -0.39 0.00 0.00 0.00 0.00 46.02 44.28 1a0l n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a0l s GLU 217 N -1.95 3.19 0.00 1.61 2.02 -1.26 -5.00 118.70 117.31 1a0l s GLU 217 Ca 0.00 -2.90 0.00 0.00 0.02 0.00 0.00 54.97 52.09 1a0l s GLU 217 Cb 0.00 -4.02 0.00 0.00 0.10 0.00 0.00 34.13 30.21 1a0l s GLU 217 CO 0.00 -1.24 0.00 0.41 0.02 0.00 0.00 175.26 174.45 1a0l n GLY 219 N 3.01 -1.88 3.64 -1.39 0.00 -1.26 -4.68 105.19 102.63 1a0l n GLY 219 Ca 0.16 -1.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.26 1a0l n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a0l n ALA 221 N 5.31 -2.32 -2.85 0.00 0.00 -1.26 -4.76 120.51 114.62 1a0l n ALA 221 Ca -0.03 -0.22 -0.34 0.00 0.00 0.00 0.00 53.44 52.86 1a0l n ALA 221 Cb 0.50 -3.15 -0.06 0.00 0.00 0.00 0.00 19.45 16.73 1a0l n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1a0l s GLN 221 N -6.07 3.28 0.46 0.00 -0.21 -1.26 -4.56 119.66 111.30 1a0l s GLN 221 Ca 0.27 -0.37 -0.25 0.00 0.02 0.00 0.00 55.36 55.04 1a0l s GLN 221 Cb -0.09 -3.00 -0.08 0.00 1.00 0.00 0.00 33.01 30.84 1a0l s GLN 221 CO 0.86 0.67 1.38 -1.25 -2.12 0.00 0.00 175.29 174.83 1a0l s PRO 222 N -1.75 3.64 -1.91 2.91 0.04 -1.26 -1.96 135.00 134.70 1a0l s PRO 222 Ca 0.24 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.58 1a0l s PRO 222 Cb -0.12 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.83 1a0l s PRO 222 CO 0.15 -0.81 0.00 0.09 0.04 0.00 0.00 177.00 176.47 1a0l n ASN 223 N -0.31 -5.17 -3.19 6.66 3.02 -1.26 -4.87 115.26 110.15 1a0l n ASN 223 Ca 0.06 0.45 -0.21 0.00 -0.03 0.00 0.00 54.58 54.85 1a0l n ASN 223 Cb 0.43 -4.47 -0.05 0.00 -0.61 0.00 0.00 39.78 35.09 1a0l n ASN 223 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1a0l n ARG 224 N -2.05 0.88 -1.54 3.52 5.12 -0.83 -3.76 116.66 118.00 1a0l n ARG 224 Ca -0.18 -3.33 -0.34 0.00 -1.93 0.00 0.00 57.85 52.08 1a0l n ARG 224 Cb 0.63 -1.51 0.08 0.00 -1.16 0.00 0.00 32.46 30.49 1a0l n ARG 224 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1a0l s PRO 225 N -1.92 2.39 0.41 5.56 0.04 -1.26 -4.24 135.00 135.98 1a0l s PRO 225 Ca 0.38 1.58 -0.26 0.00 0.04 0.00 0.00 61.00 62.74 1a0l s PRO 225 Cb 0.28 -1.88 -0.08 0.00 0.04 0.00 0.00 34.50 32.85 1a0l s PRO 225 CO -0.09 -1.61 1.28 0.20 0.04 0.00 0.00 177.00 176.82 1a0l s GLY 226 N -2.32 2.91 -0.14 0.56 0.00 -1.16 -4.75 107.32 102.42 1a0l s GLY 226 Ca 0.71 1.19 -0.06 0.00 0.00 0.00 0.00 44.72 46.55 1a0l s GLY 226 CO 0.44 1.76 0.07 -0.42 0.00 0.00 0.00 173.10 174.95 1a0l s ILE 227 N -1.30 4.91 0.17 0.90 -1.09 -0.73 -2.35 121.20 121.71 1a0l s ILE 227 Ca 0.58 -0.00 0.09 0.00 -2.23 0.00 0.00 60.65 59.08 1a0l s ILE 227 Cb -0.37 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.31 1a0l s ILE 227 CO 0.47 0.54 -0.18 -0.31 -1.23 0.00 0.00 174.94 174.22 1a0l s TYR 228 N -0.31 1.83 -0.02 3.97 1.51 0.12 -1.10 117.35 123.35 1a0l s TYR 228 Ca 0.09 -0.47 -0.28 0.00 -1.01 0.00 0.00 57.07 55.40 1a0l s TYR 228 Cb -0.12 -0.91 -0.03 0.00 -0.11 0.00 0.00 41.96 40.79 1a0l s TYR 228 CO 0.02 0.33 0.92 0.99 -1.11 0.00 0.00 175.55 176.70 1a0l s THR 229 N -2.06 4.91 -0.43 -0.71 2.01 0.65 0.31 115.64 120.32 1a0l s THR 229 Ca 0.16 1.91 -0.28 0.00 0.31 0.00 0.00 61.69 63.79 1a0l s THR 229 Cb -0.06 -4.25 -0.01 0.00 0.01 0.00 0.00 72.50 68.19 1a0l s THR 229 CO 0.07 0.17 1.65 -0.60 -0.69 0.00 0.00 174.62 175.22 1a0l s ARG 230 N 1.04 3.27 0.19 4.92 3.52 0.19 -1.90 118.95 130.17 1a0l s ARG 230 Ca 0.48 1.02 -0.12 0.00 -0.13 0.00 0.00 55.73 56.98 1a0l s ARG 230 Cb -0.20 -4.18 0.18 0.00 -1.56 0.00 0.00 34.95 29.19 1a0l s ARG 230 CO 0.25 -1.95 1.77 0.28 -0.81 0.00 0.00 175.30 174.84 1a0l h VAL 231 N 6.67 0.88 -0.36 7.11 2.07 -1.35 -1.82 116.25 129.46 1a0l h VAL 231 Ca -0.30 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 67.17 1a0l h VAL 231 Cb 1.14 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1a0l h VAL 231 CO 1.10 0.08 0.38 0.71 0.02 0.00 0.00 177.57 179.86 1a0l h THR 232 N 0.45 0.41 0.00 2.57 1.35 -1.88 0.26 112.91 116.07 1a0l h THR 232 Ca 0.25 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 66.09 1a0l h THR 232 Cb 0.22 0.70 -0.00 0.00 -1.73 0.00 0.00 68.15 67.33 1a0l h THR 232 CO -0.21 0.00 -0.08 0.22 -0.25 0.00 0.00 175.52 175.20 1a0l h TYR 233 N 0.00 0.00 -0.05 4.73 5.03 -1.68 -3.24 116.97 121.76 1a0l h TYR 233 Ca 0.17 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.48 1a0l h TYR 233 Cb 0.93 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 39.21 1a0l h TYR 233 CO 0.00 0.08 -0.02 0.66 -1.32 0.00 0.00 178.16 177.56 1a0l n TYR 234 N -3.13 0.19 -0.05 -3.82 4.01 0.04 -4.75 117.16 109.65 1a0l n TYR 234 Ca 0.03 -1.00 -0.08 0.00 -0.16 0.00 0.00 57.90 56.69 1a0l n TYR 234 Cb 0.51 -0.19 -0.02 0.00 -0.31 0.00 0.00 39.34 39.33 1a0l n TYR 234 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1a0l h LEU 235 N 0.39 -0.22 0.38 7.72 5.85 -1.48 -0.76 115.31 127.20 1a0l h LEU 235 Ca 0.00 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1a0l h LEU 235 Cb 1.09 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1a0l h LEU 235 CO 0.05 -0.08 -0.18 0.44 -0.34 0.00 0.00 178.44 178.33 1a0l h ASP 236 N -0.01 -0.43 -0.47 1.25 3.32 -1.86 -1.02 116.42 117.20 1a0l h ASP 236 Ca 0.11 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.25 1a0l h ASP 236 Cb 0.17 0.11 -0.08 0.00 0.22 0.00 0.00 39.33 39.75 1a0l h ASP 236 CO -0.23 -0.29 -0.01 -0.25 -1.72 0.00 0.00 179.24 176.74 1a0l h TRP 237 N -0.53 -0.04 -0.26 4.55 7.01 -1.85 -0.36 115.95 124.47 1a0l h TRP 237 Ca -0.05 0.04 0.06 0.00 2.11 0.00 0.00 58.89 61.04 1a0l h TRP 237 Cb 0.40 0.09 -0.06 0.00 -2.10 0.00 0.00 29.16 27.50 1a0l h TRP 237 CO -0.04 -0.11 -0.10 0.82 -2.79 0.00 0.00 178.44 176.21 1a0l h ILE 238 N 0.10 0.66 0.00 2.65 2.04 -0.92 -0.89 117.51 121.16 1a0l h ILE 238 Ca 0.23 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.09 1a0l h ILE 238 Cb 0.35 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1a0l h ILE 238 CO -0.40 0.00 0.00 0.45 0.00 0.00 0.00 178.15 178.20 1a0l h HIS 239 N -0.06 0.00 0.00 1.37 3.86 0.28 0.52 115.15 121.12 1a0l h HIS 239 Ca 0.13 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.32 1a0l h HIS 239 Cb 0.26 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.72 1a0l h HIS 239 CO -0.29 0.00 -0.11 0.45 0.86 0.00 0.00 177.93 178.84 1a0l h HIS 240 N 0.00 0.00 0.00 2.45 3.86 -0.30 -3.29 115.15 117.87 1a0l h HIS 240 Ca 0.00 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.00 1a0l h HIS 240 Cb 0.11 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.55 1a0l h HIS 240 CO 0.00 0.11 -1.74 0.66 0.86 0.00 0.00 177.93 177.82 1a0l n TYR 241 N -4.04 0.00 -2.82 2.45 4.01 -0.59 -4.95 117.16 111.22 1a0l n TYR 241 Ca -0.02 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.29 1a0l n TYR 241 Cb 0.20 -0.49 -0.04 0.00 -0.31 0.00 0.00 39.34 38.70 1a0l n TYR 241 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1a0l s VAL 242 N -2.25 4.49 1.01 -0.72 1.01 0.07 -5.03 120.40 118.99 1a0l s VAL 242 Ca -0.18 0.80 -0.12 0.00 0.00 0.00 0.00 61.98 62.48 1a0l s VAL 242 Cb 0.06 -4.42 0.20 0.00 0.00 0.00 0.00 36.38 32.22 1a0l s VAL 242 CO 0.26 -0.79 1.08 -2.16 0.00 0.00 0.00 175.10 173.49 1a0l s PRO 243 N 3.70 0.30 -0.64 2.72 0.04 -1.26 -4.28 135.00 135.57 1a0l s PRO 243 Ca 0.37 0.95 -0.20 0.00 0.04 0.00 0.00 61.00 62.16 1a0l s PRO 243 Cb -0.10 -1.69 0.10 0.00 0.04 0.00 0.00 34.50 32.85 1a0l s PRO 243 CO 0.25 -2.94 0.81 0.15 0.04 0.00 0.00 177.00 175.32 1a0l s LYS 244 N -4.70 3.11 0.00 4.56 1.02 -1.26 -5.05 119.74 117.42 1a0l s LYS 244 Ca 0.66 -1.21 0.00 0.00 0.02 0.00 0.00 55.97 55.44 1a0l s LYS 244 Cb -0.22 -4.29 0.00 0.00 -0.52 0.00 0.00 37.83 32.80 1a0l s LYS 244 CO 0.60 -1.64 0.00 1.17 -0.92 0.00 0.00 175.35 174.56