#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 3.07 0.00 1.39 1.01 0.13 -4.66 120.40 121.33 1a0l s VAL 17 Ca 0.00 0.94 0.00 0.00 0.00 0.00 0.00 61.98 62.92 1a0l s VAL 17 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1a0l s VAL 17 CO 0.00 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1a0l n GLY 18 N 1.82 -0.51 7.00 4.51 0.00 -1.26 -2.60 105.19 114.15 1a0l n GLY 18 Ca 0.04 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.96 3.48 -0.02 0.00 -1.26 -4.90 105.19 101.54 1a0l n GLY 19 Ca 0.00 -1.11 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 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 1.43 0.35 1.61 -2.07 -0.43 -4.97 119.66 115.59 1a0l s GLN 20 Ca 0.00 -1.31 -0.28 0.00 -1.82 0.00 0.00 55.36 51.95 1a0l s GLN 20 Cb 0.00 0.42 -0.10 0.00 -1.09 0.00 0.00 33.01 32.24 1a0l s GLN 20 CO 0.00 -0.57 1.32 -2.00 -1.32 0.00 0.00 175.29 172.73 1a0l s GLU 21 N -4.04 4.24 0.20 9.60 2.12 -1.26 -0.96 118.70 128.59 1a0l s GLU 21 Ca 0.25 2.24 -0.17 0.00 0.36 0.00 0.00 54.97 57.64 1a0l s GLU 21 Cb 0.01 -2.98 -0.08 0.00 0.26 0.00 0.00 34.13 31.34 1a0l s GLU 21 CO 0.08 -0.30 0.65 0.00 -0.54 0.00 0.00 175.26 175.16 1a0l s ALA 22 N -1.17 3.48 0.46 6.30 0.00 0.36 -4.75 121.76 126.43 1a0l s ALA 22 Ca 0.51 0.04 -0.23 0.00 0.00 0.00 0.00 51.96 52.28 1a0l s ALA 22 Cb -0.40 -2.69 -0.09 0.00 0.00 0.00 0.00 23.12 19.94 1a0l s ALA 22 CO 0.53 0.38 1.08 -2.30 0.00 0.00 0.00 175.76 175.45 1a0l n PRO 23 N 0.70 1.41 0.09 0.00 -0.02 -1.26 -4.82 135.00 131.10 1a0l n PRO 23 Ca -0.03 0.51 0.04 0.00 -2.02 0.00 0.00 63.50 62.00 1a0l n PRO 23 Cb 0.51 -2.17 0.22 0.00 -0.02 0.00 0.00 33.50 32.04 1a0l n PRO 23 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1a0l n ARG 24 N -0.15 0.05 -2.09 -0.52 0.63 -1.26 -1.69 116.66 111.63 1a0l n ARG 24 Ca 0.10 0.48 -0.09 0.00 -0.92 0.00 0.00 57.85 57.41 1a0l n ARG 24 Cb 0.41 -1.86 0.05 0.00 0.45 0.00 0.00 32.46 31.51 1a0l n ARG 24 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1a0l n SER 25 N -1.75 2.92 -0.13 6.15 3.41 -1.26 -4.88 113.62 118.08 1a0l n SER 25 Ca -0.01 -2.96 -0.20 0.00 -0.26 0.00 0.00 58.87 55.45 1a0l n SER 25 Cb 0.20 -0.41 -0.12 0.00 -0.26 0.00 0.00 64.21 63.62 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 -0.59 0.64 -3.54 4.33 4.76 -0.68 -4.80 118.16 118.28 1a0l n LYS 26 Ca 0.24 0.16 -0.27 0.00 -2.87 0.00 0.00 58.31 55.57 1a0l n LYS 26 Cb 0.89 -1.52 -0.10 0.00 -1.84 0.00 0.00 35.03 32.47 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 -3.39 2.06 0.33 2.13 7.02 -1.26 -4.92 117.44 119.41 1a0l n TRP 27 Ca -0.47 -3.96 0.20 0.00 -1.02 0.00 0.00 57.50 52.25 1a0l n TRP 27 Cb 0.98 -0.40 1.07 0.00 -2.42 0.00 0.00 31.31 30.54 1a0l n TRP 27 CO 0.00 0.00 0.00 -1.00 -2.02 0.00 0.00 177.69 174.67 1a0l h PRO 28 N 4.81 0.00 0.00 -0.99 0.13 -1.85 -1.49 132.00 132.62 1a0l h PRO 28 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1a0l h PRO 28 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1a0l h PRO 28 CO 0.65 0.00 -0.71 0.11 -0.23 0.00 0.00 178.00 177.82 1a0l h TRP 29 N 0.00 0.00 -2.87 1.56 0.09 -1.84 -3.06 115.95 109.83 1a0l h TRP 29 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 58.89 58.41 1a0l h TRP 29 Cb 0.23 0.00 0.09 0.00 0.08 0.00 0.00 29.16 29.56 1a0l h TRP 29 CO 0.00 0.00 0.66 1.04 0.09 0.00 0.00 178.44 180.23 1a0l n GLN 30 N -2.50 2.19 -4.10 0.12 1.13 -0.56 -0.78 117.38 112.88 1a0l n GLN 30 Ca 0.02 0.78 -0.08 0.00 -1.94 0.00 0.00 57.00 55.78 1a0l n GLN 30 Cb 0.50 -2.46 -0.10 0.00 0.11 0.00 0.00 30.24 28.29 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 -0.15 0.31 -0.13 5.09 -7.23 -1.09 -1.68 120.40 115.52 1a0l s VAL 31 Ca 0.66 -1.83 0.01 0.00 -1.81 0.00 0.00 61.98 59.02 1a0l s VAL 31 Cb -0.61 -1.54 0.02 0.00 0.56 0.00 0.00 36.38 34.81 1a0l s VAL 31 CO 0.51 -0.97 -0.16 -0.55 -0.31 0.00 0.00 175.10 173.62 1a0l s SER 32 N -2.93 2.62 0.11 4.85 0.15 -0.29 -1.61 113.70 116.61 1a0l s SER 32 Ca 0.08 -0.48 -0.22 0.00 0.70 0.00 0.00 55.95 56.03 1a0l s SER 32 Cb 0.07 -1.17 -0.07 0.00 -1.71 0.00 0.00 66.02 63.14 1a0l s SER 32 CO -0.09 -0.00 0.65 -0.76 1.20 0.00 0.00 173.24 174.24 1a0l s LEU 33 N 1.15 4.55 0.07 3.45 1.43 0.21 -1.10 118.68 128.44 1a0l s LEU 33 Ca -0.02 1.42 0.07 0.00 -1.03 0.00 0.00 54.13 54.56 1a0l s LEU 33 Cb -0.14 -3.06 -0.03 0.00 0.03 0.00 0.00 46.19 42.99 1a0l s LEU 33 CO -0.05 0.24 -0.18 -0.13 0.23 0.00 0.00 176.35 176.47 1a0l s ARG 34 N -1.10 1.05 0.04 1.70 1.81 0.11 -2.07 118.95 120.49 1a0l s ARG 34 Ca 0.32 -0.98 0.06 0.00 -1.72 0.00 0.00 55.73 53.40 1a0l s ARG 34 Cb -0.21 -1.17 -0.03 0.00 -0.45 0.00 0.00 34.95 33.08 1a0l s ARG 34 CO 0.22 0.28 -0.14 0.08 -0.68 0.00 0.00 175.30 175.05 1a0l s VAL 35 N -1.06 3.06 -0.79 3.52 1.01 -0.84 -2.10 120.40 123.19 1a0l s VAL 35 Ca 0.03 -1.10 -0.25 0.00 0.00 0.00 0.00 61.98 60.66 1a0l s VAL 35 Cb -0.09 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 1a0l s VAL 35 CO 0.03 0.32 1.70 -2.28 0.00 0.00 0.00 175.10 174.87 1a0l s HIS 36 N -0.98 1.98 0.00 5.22 2.46 -0.70 -2.58 115.29 120.68 1a0l s HIS 36 Ca 0.16 0.29 0.00 0.00 0.47 0.00 0.00 55.06 55.98 1a0l s HIS 36 Cb -0.11 -4.29 0.00 0.00 -0.13 0.00 0.00 32.58 28.05 1a0l s HIS 36 CO 0.07 -2.04 0.00 0.41 -2.47 0.00 0.00 174.74 170.71 1a0l n GLY 37 N 6.17 1.85 0.45 1.59 0.00 -1.26 -4.87 105.19 109.12 1a0l n GLY 37 Ca 0.25 -1.81 0.27 0.00 0.00 0.00 0.00 46.02 44.73 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 -3.88 1.61 0.11 -2.03 -3.44 132.00 124.38 1a0l h PRO 37 Ca 0.00 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.00 1a0l h PRO 37 Cb 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.01 1a0l h PRO 37 CO 0.00 0.00 -0.22 1.52 -0.21 0.00 0.00 178.00 179.09 1a0l s TYR 37 N -4.93 0.59 -1.26 0.65 1.13 -1.26 -5.05 117.35 107.21 1a0l s TYR 37 Ca -0.05 -0.91 -0.17 0.00 -1.41 0.00 0.00 57.07 54.53 1a0l s TYR 37 Cb 0.21 0.02 0.10 0.00 -1.10 0.00 0.00 41.96 41.18 1a0l s TYR 37 CO 0.74 -0.94 1.64 -1.58 -2.51 0.00 0.00 175.55 172.90 1a0l s TRP 38 N -3.94 2.96 0.33 -3.49 0.52 -1.25 -4.48 118.94 109.58 1a0l s TRP 38 Ca 0.26 -1.72 -0.22 0.00 0.02 0.00 0.00 56.10 54.45 1a0l s TRP 38 Cb 0.01 -4.63 -0.10 0.00 -1.15 0.00 0.00 33.47 27.60 1a0l s TRP 38 CO 0.11 -1.70 0.87 0.00 0.02 0.00 0.00 176.95 176.24 1a0l s MET 39 N 3.55 4.34 0.47 4.98 0.23 -1.07 -4.69 119.30 127.11 1a0l s MET 39 Ca 0.50 1.09 -0.22 0.00 -1.03 0.00 0.00 55.69 56.02 1a0l s MET 39 Cb 0.02 -2.60 -0.07 0.00 -1.53 0.00 0.00 34.83 30.65 1a0l s MET 39 CO 0.05 0.20 1.16 -1.58 -2.03 0.00 0.00 175.02 172.82 1a0l s HIS 40 N -1.80 2.86 0.00 3.16 2.46 -1.26 -1.99 115.29 118.72 1a0l s HIS 40 Ca 0.52 1.54 0.00 0.00 0.47 0.00 0.00 55.06 57.59 1a0l s HIS 40 Cb -0.14 -3.36 0.00 0.00 -0.13 0.00 0.00 32.58 28.94 1a0l s HIS 40 CO 0.19 -1.50 0.00 1.97 -2.47 0.00 0.00 174.74 172.94 1a0l n PHE 41 N -0.59 0.00 -3.62 3.88 -1.74 -0.88 -4.92 117.46 109.59 1a0l n PHE 41 Ca 0.08 0.00 -0.02 0.00 -0.56 0.00 0.00 57.45 56.95 1a0l n PHE 41 Cb 0.48 0.01 -0.02 0.00 1.52 0.00 0.00 39.48 41.48 1a0l n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1a0l n GLY 43 N -0.15 2.77 0.97 0.00 0.00 0.48 -0.62 105.19 108.65 1a0l n GLY 43 Ca 0.01 -2.23 -0.02 0.00 0.00 0.00 0.00 46.02 43.77 1a0l n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a0l n GLY 44 N 1.36 1.53 3.14 -0.02 0.00 -0.63 -3.86 105.19 106.71 1a0l n GLY 44 Ca 0.00 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.56 -0.28 -0.50 1.61 1.04 -0.66 -2.68 113.70 110.66 1a0l s SER 45 Ca 0.05 0.54 -0.26 0.00 0.48 0.00 0.00 55.95 56.75 1a0l s SER 45 Cb -0.01 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.67 1a0l s SER 45 CO 0.03 -0.10 1.00 -0.22 0.98 0.00 0.00 173.24 174.93 1a0l s LEU 46 N 0.23 3.89 0.00 2.42 2.96 0.04 -0.99 118.68 127.23 1a0l s LEU 46 Ca -0.01 0.05 0.17 0.00 -0.22 0.00 0.00 54.13 54.12 1a0l s LEU 46 Cb -0.02 -3.15 0.15 0.00 0.50 0.00 0.00 46.19 43.66 1a0l s LEU 46 CO -0.00 -1.19 1.04 2.30 -1.32 0.00 0.00 176.35 177.18 1a0l n ILE 47 N 6.47 0.04 -3.63 6.68 -5.35 -1.05 -1.52 119.36 120.99 1a0l n ILE 47 Ca 0.06 -0.52 -0.09 0.00 -0.27 0.00 0.00 62.75 61.94 1a0l n ILE 47 Cb 0.48 1.31 -0.07 0.00 -1.74 0.00 0.00 39.64 39.63 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 -1.38 -0.43 -0.01 4.28 5.04 -1.21 -4.78 115.29 116.80 1a0l s HIS 48 Ca 0.20 1.02 0.03 0.00 -1.54 0.00 0.00 55.06 54.77 1a0l s HIS 48 Cb 0.14 0.38 0.15 0.00 0.04 0.00 0.00 32.58 33.29 1a0l s HIS 48 CO 0.21 -0.22 0.80 -2.30 -2.34 0.00 0.00 174.74 170.90 1a0l n PRO 49 N 2.04 0.02 0.00 2.88 -0.02 -1.26 -0.51 135.00 138.15 1a0l n PRO 49 Ca -0.12 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1a0l n PRO 49 Cb 0.56 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 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 -1.51 0.34 -4.51 -0.52 7.27 -1.26 -0.01 117.38 117.18 1a0l n GLN 50 Ca -0.00 -0.24 -0.23 0.00 0.07 0.00 0.00 57.00 56.60 1a0l n GLN 50 Cb 0.48 -0.70 -0.14 0.00 2.41 0.00 0.00 30.24 32.29 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 -0.12 1.51 -0.13 3.69 0.52 0.34 -0.02 118.94 124.73 1a0l s TRP 51 Ca 0.00 -0.36 0.02 0.00 0.02 0.00 0.00 56.10 55.78 1a0l s TRP 51 Cb 0.00 -0.90 -0.00 0.00 -1.15 0.00 0.00 33.47 31.42 1a0l s TRP 51 CO 0.00 0.06 -0.19 0.08 0.02 0.00 0.00 176.95 176.92 1a0l s VAL 52 N -0.80 2.42 -0.07 4.03 1.01 0.78 -2.54 120.40 125.24 1a0l s VAL 52 Ca 0.05 -0.87 -0.13 0.00 0.00 0.00 0.00 61.98 61.02 1a0l s VAL 52 Cb -0.08 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.26 1a0l s VAL 52 CO 0.01 0.54 0.33 -0.22 0.00 0.00 0.00 175.10 175.76 1a0l s LEU 53 N 0.58 4.40 0.36 3.92 2.96 -0.16 -0.81 118.68 129.92 1a0l s LEU 53 Ca -0.11 0.75 -0.16 0.00 -0.22 0.00 0.00 54.13 54.39 1a0l s LEU 53 Cb -0.16 -2.44 0.04 0.00 0.50 0.00 0.00 46.19 44.13 1a0l s LEU 53 CO 0.03 0.28 0.75 0.28 -1.32 0.00 0.00 176.35 176.37 1a0l s THR 54 N -0.64 0.00 0.14 3.68 -1.32 -0.55 -1.66 115.64 115.30 1a0l s THR 54 Ca 0.20 -1.04 -0.29 0.00 -1.21 0.00 0.00 61.69 59.36 1a0l s THR 54 Cb -0.15 -2.65 -0.07 0.00 -1.51 0.00 0.00 72.50 68.12 1a0l s THR 54 CO 0.09 0.00 0.92 0.00 -2.21 0.00 0.00 174.62 173.42 1a0l s ALA 55 N -2.75 3.30 0.26 11.08 0.00 -1.26 -0.28 121.76 132.11 1a0l s ALA 55 Ca 0.15 0.54 -0.04 0.00 0.00 0.00 0.00 51.96 52.61 1a0l s ALA 55 Cb -0.05 -3.20 0.33 0.00 0.00 0.00 0.00 23.12 20.20 1a0l s ALA 55 CO 0.11 0.07 1.86 0.00 0.00 0.00 0.00 175.76 177.80 1a0l h ALA 56 N 5.10 1.22 0.00 0.00 0.00 -1.67 -2.06 119.26 121.85 1a0l h ALA 56 Ca -0.44 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1a0l h ALA 56 Cb 1.21 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1a0l h ALA 56 CO 0.70 0.59 0.09 -2.39 0.00 0.00 0.00 179.25 178.24 1a0l n HIS 57 N -4.32 0.53 0.09 0.00 1.44 -1.26 0.13 115.22 111.83 1a0l n HIS 57 Ca 0.07 0.28 -0.12 0.00 -2.01 0.00 0.00 57.72 55.94 1a0l n HIS 57 Cb 0.14 -0.88 -0.13 0.00 0.12 0.00 0.00 29.99 29.24 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 -3.47 0.17 -4.01 0.00 0.24 0.30 -5.06 118.33 106.51 1a0l n VAL 59 Ca -0.05 -0.59 -0.00 0.00 -2.04 0.00 0.00 64.34 61.66 1a0l n VAL 59 Cb 0.98 0.94 -0.00 0.00 -1.47 0.00 0.00 33.84 34.29 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 0.01 4.08 0.17 7.63 0.00 0.12 -4.46 105.19 112.74 1a0l n GLY 60 Ca 0.01 -1.86 0.13 0.00 0.00 0.00 0.00 46.02 44.30 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 -6.95 1.61 0.13 -1.83 -3.43 132.00 121.53 1a0l h PRO 60 Ca -0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.62 1a0l h PRO 60 Cb 0.02 0.00 0.05 0.00 0.13 0.00 0.00 31.00 31.19 1a0l h PRO 60 CO 0.01 0.00 0.48 -0.51 -0.23 0.00 0.00 178.00 177.75 1a0l s ASP 60 N -4.92 6.53 0.15 1.44 1.01 -1.26 -4.98 116.67 114.64 1a0l s ASP 60 Ca 0.06 2.28 -0.31 0.00 0.71 0.00 0.00 52.55 55.28 1a0l s ASP 60 Cb 0.09 -2.61 -0.09 0.00 1.01 0.00 0.00 42.92 41.33 1a0l s ASP 60 CO 0.53 -0.67 1.48 -0.69 0.21 0.00 0.00 175.17 176.03 1a0l s VAL 60 N -1.48 2.91 0.06 -1.27 1.01 -1.26 -4.99 120.40 115.37 1a0l s VAL 60 Ca 0.58 0.66 0.04 0.00 0.00 0.00 0.00 61.98 63.26 1a0l s VAL 60 Cb -0.29 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1a0l s VAL 60 CO 0.36 0.06 0.00 -0.54 0.00 0.00 0.00 175.10 174.98 1a0l s LYS 60 N 0.95 2.65 -0.26 2.72 -0.14 -1.26 -5.09 119.74 119.31 1a0l s LYS 60 Ca 0.66 -0.75 -0.27 0.00 -1.36 0.00 0.00 55.97 54.26 1a0l s LYS 60 Cb -0.41 -2.60 0.01 0.00 -1.68 0.00 0.00 37.83 33.15 1a0l s LYS 60 CO 0.32 0.57 0.95 0.34 -0.76 0.00 0.00 175.35 176.77 1a0l s ASP 60 N -2.05 6.93 0.49 2.83 2.15 -1.26 -4.92 116.67 120.84 1a0l s ASP 60 Ca 0.24 1.12 0.16 0.00 0.43 0.00 0.00 52.55 54.50 1a0l s ASP 60 Cb -0.12 -2.49 1.20 0.00 -0.30 0.00 0.00 42.92 41.21 1a0l s ASP 60 CO 0.16 -0.66 2.09 -0.07 -0.17 0.00 0.00 175.17 176.52 1a0l h LEU 61 N 9.50 0.12 -1.12 -1.34 4.07 -1.92 0.82 115.31 125.43 1a0l h LEU 61 Ca -0.21 -0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.66 1a0l h LEU 61 Cb 1.07 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.77 1a0l h LEU 61 CO 0.95 0.08 -0.44 0.00 -1.08 0.00 0.00 178.44 177.95 1a0l h ALA 62 N 1.87 1.26 0.00 1.53 0.00 -1.91 -2.17 119.26 119.84 1a0l h ALA 62 Ca 0.10 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1a0l h ALA 62 Cb 0.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1a0l h ALA 62 CO -0.01 0.55 0.00 0.00 0.00 0.00 0.00 179.25 179.78 1a0l n ALA 63 N -2.45 2.30 -2.57 0.00 0.00 0.27 -4.77 120.51 113.30 1a0l n ALA 63 Ca -0.02 -0.13 -0.23 0.00 0.00 0.00 0.00 53.44 53.06 1a0l n ALA 63 Cb 0.47 -1.40 -0.08 0.00 0.00 0.00 0.00 19.45 18.43 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 -2.40 2.93 -0.29 0.00 1.43 -0.82 -1.73 118.68 117.81 1a0l s LEU 64 Ca 0.28 -0.82 -0.22 0.00 -1.03 0.00 0.00 54.13 52.33 1a0l s LEU 64 Cb 0.17 -1.44 0.15 0.00 0.03 0.00 0.00 46.19 45.10 1a0l s LEU 64 CO 0.35 0.00 1.14 -0.60 0.23 0.00 0.00 176.35 177.48 1a0l s ARG 65 N -3.61 0.33 -0.13 1.70 3.52 -0.89 -4.56 118.95 115.31 1a0l s ARG 65 Ca 0.31 0.44 -0.07 0.00 -0.13 0.00 0.00 55.73 56.28 1a0l s ARG 65 Cb -0.05 0.14 -0.04 0.00 -1.56 0.00 0.00 34.95 33.43 1a0l s ARG 65 CO 0.18 -0.05 0.10 0.08 -0.81 0.00 0.00 175.30 174.80 1a0l s VAL 66 N 0.46 5.18 -0.14 7.11 1.01 0.18 -0.71 120.40 133.49 1a0l s VAL 66 Ca 0.01 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 1a0l s VAL 66 Cb -0.05 -3.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 1a0l s VAL 66 CO -0.11 0.57 -0.12 -1.58 0.00 0.00 0.00 175.10 173.87 1a0l s GLN 67 N -0.63 3.39 0.29 2.72 2.00 -0.26 -0.91 119.66 126.26 1a0l s GLN 67 Ca 0.12 -0.67 -0.05 0.00 -2.00 0.00 0.00 55.36 52.76 1a0l s GLN 67 Cb -0.12 -2.69 0.07 0.00 0.80 0.00 0.00 33.01 31.08 1a0l s GLN 67 CO 0.02 0.16 0.27 1.28 -0.50 0.00 0.00 175.29 176.52 1a0l n LEU 68 N 3.70 0.00 -4.76 3.68 4.77 -1.26 -1.13 117.00 121.99 1a0l n LEU 68 Ca -0.18 -0.29 -0.38 0.00 -0.03 0.00 0.00 56.01 55.13 1a0l n LEU 68 Cb 0.52 -0.24 0.01 0.00 -2.33 0.00 0.00 43.42 41.38 1a0l n LEU 68 CO 0.30 -1.24 0.93 -0.60 -1.33 0.00 0.00 177.39 175.46 1a0l s ARG 69 N -3.61 3.58 -0.06 3.23 3.52 -0.68 -4.46 118.95 120.47 1a0l s ARG 69 Ca 0.17 2.08 -0.31 0.00 -0.13 0.00 0.00 55.73 57.54 1a0l s ARG 69 Cb -0.02 -2.46 0.07 0.00 -1.56 0.00 0.00 34.95 30.99 1a0l s ARG 69 CO 0.13 -0.78 0.70 -1.83 -0.81 0.00 0.00 175.30 172.71 1a0l s GLU 70 N -2.64 1.02 0.14 5.12 -1.05 -1.26 -5.03 118.70 115.00 1a0l s GLU 70 Ca 0.65 0.27 -0.01 0.00 -0.15 0.00 0.00 54.97 55.73 1a0l s GLU 70 Cb -0.36 0.48 -0.07 0.00 -0.44 0.00 0.00 34.13 33.75 1a0l s GLU 70 CO 0.44 -0.31 1.33 0.37 0.95 0.00 0.00 175.26 178.04 1a0l h GLN 71 N 3.02 0.28 -4.49 -4.83 5.75 -1.93 -3.43 115.11 109.47 1a0l h GLN 71 Ca -0.26 -0.32 -0.54 0.00 -0.15 0.00 0.00 58.65 57.37 1a0l h GLN 71 Cb 1.14 0.09 -0.35 0.00 1.07 0.00 0.00 27.48 29.43 1a0l h GLN 71 CO 0.38 1.03 -0.82 -1.01 -2.65 0.00 0.00 178.83 175.76 1a0l s HIS 72 N -3.17 1.66 0.18 3.99 3.76 -1.26 -1.69 115.29 118.76 1a0l s HIS 72 Ca -0.04 -0.77 -0.20 0.00 -0.15 0.00 0.00 55.06 53.90 1a0l s HIS 72 Cb 0.09 -1.27 0.11 0.00 1.11 0.00 0.00 32.58 32.62 1a0l s HIS 72 CO 0.85 -0.45 1.34 1.28 -0.85 0.00 0.00 174.74 176.90 1a0l n LEU 73 N 4.41 -0.70 -0.18 0.89 4.77 -0.07 -3.12 117.00 123.00 1a0l n LEU 73 Ca -0.18 1.52 0.03 0.00 -0.03 0.00 0.00 56.01 57.35 1a0l n LEU 73 Cb 0.51 -0.29 0.07 0.00 -2.33 0.00 0.00 43.42 41.38 1a0l n LEU 73 CO 0.21 -1.32 0.55 -1.22 -1.33 0.00 0.00 177.39 174.29 1a0l n TYR 74 N -5.20 0.14 0.17 -1.77 4.01 -1.26 -4.79 117.16 108.47 1a0l n TYR 74 Ca 0.06 -0.61 -0.14 0.00 -0.16 0.00 0.00 57.90 57.05 1a0l n TYR 74 Cb 0.30 -0.08 -0.08 0.00 -0.31 0.00 0.00 39.34 39.17 1a0l n TYR 74 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 1a0l h TYR 75 N 0.48 -0.38 -1.72 -0.72 3.20 -1.90 -3.36 116.97 112.56 1a0l h TYR 75 Ca 0.00 -0.01 -0.53 0.00 3.14 0.00 0.00 58.73 61.33 1a0l h TYR 75 Cb 0.68 0.13 -0.41 0.00 1.54 0.00 0.00 36.73 38.67 1a0l h TYR 75 CO 0.07 -0.14 -0.87 1.04 -1.64 0.00 0.00 178.16 176.63 1a0l n GLN 79 N -5.20 2.57 -1.11 1.82 1.13 -1.26 -5.09 117.38 110.23 1a0l n GLN 79 Ca -0.10 -4.20 -0.35 0.00 -1.94 0.00 0.00 57.00 50.41 1a0l n GLN 79 Cb 0.23 -1.97 0.10 0.00 0.11 0.00 0.00 30.24 28.70 1a0l n GLN 79 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1a0l n ASP 80 N -0.22 -0.69 -2.77 1.08 9.92 -1.26 -4.97 116.55 117.65 1a0l n ASP 80 Ca 0.29 0.53 -0.07 0.00 -0.53 0.00 0.00 54.79 55.01 1a0l n ASP 80 Cb 0.61 -1.31 0.03 0.00 -0.64 0.00 0.00 41.12 39.82 1a0l n ASP 80 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 1a0l n GLN 81 N -1.74 0.68 -2.05 -1.24 7.27 -1.26 -5.14 117.38 113.90 1a0l n GLN 81 Ca 0.10 -1.89 -0.42 0.00 0.07 0.00 0.00 57.00 54.86 1a0l n GLN 81 Cb 0.51 -1.47 -0.03 0.00 2.41 0.00 0.00 30.24 31.66 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 -0.06 4.39 -0.13 1.69 2.01 -1.26 -4.57 118.68 120.74 1a0l s LEU 82 Ca 0.31 2.58 -0.00 0.00 0.01 0.00 0.00 54.13 57.03 1a0l s LEU 82 Cb 0.13 -3.61 -0.01 0.00 0.01 0.00 0.00 46.19 42.71 1a0l s LEU 82 CO -0.17 -0.69 -0.13 -0.76 1.01 0.00 0.00 176.35 175.62 1a0l s LEU 83 N 0.04 2.71 0.63 1.79 1.43 -0.09 -4.94 118.68 120.25 1a0l s LEU 83 Ca 0.61 -0.33 -0.14 0.00 -1.03 0.00 0.00 54.13 53.23 1a0l s LEU 83 Cb -0.41 -1.61 -0.02 0.00 0.03 0.00 0.00 46.19 44.18 1a0l s LEU 83 CO 0.39 0.16 1.06 -2.16 0.23 0.00 0.00 176.35 176.03 1a0l s PRO 84 N 0.40 3.20 -0.19 1.29 0.04 -1.26 -0.65 135.00 137.83 1a0l s PRO 84 Ca -0.10 1.12 -0.07 0.00 0.04 0.00 0.00 61.00 61.98 1a0l s PRO 84 Cb -0.16 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1a0l s PRO 84 CO 0.05 -0.90 0.06 0.14 0.04 0.00 0.00 177.00 176.40 1a0l s VAL 85 N -2.65 4.71 0.06 -0.36 -7.23 -1.26 -2.68 120.40 110.98 1a0l s VAL 85 Ca 0.62 -0.06 -0.17 0.00 -1.81 0.00 0.00 61.98 60.56 1a0l s VAL 85 Cb -0.15 -3.13 -0.15 0.00 0.56 0.00 0.00 36.38 33.51 1a0l s VAL 85 CO 0.43 0.44 1.29 -1.28 -0.31 0.00 0.00 175.10 175.67 1a0l h SER 86 N 6.89 0.64 -4.69 4.85 0.87 0.65 -3.44 113.55 119.32 1a0l h SER 86 Ca -0.37 -0.58 -0.10 0.00 -1.23 0.00 0.00 61.79 59.51 1a0l h SER 86 Cb 1.17 -0.19 -0.21 0.00 -0.44 0.00 0.00 62.40 62.74 1a0l h SER 86 CO 0.68 1.11 -0.16 -0.60 -0.53 0.00 0.00 176.83 177.33 1a0l s ARG 87 N -3.91 0.70 -0.14 2.24 3.52 -0.95 -4.95 118.95 115.47 1a0l s ARG 87 Ca -0.13 0.12 0.01 0.00 -0.13 0.00 0.00 55.73 55.60 1a0l s ARG 87 Cb 0.06 0.32 -0.01 0.00 -1.56 0.00 0.00 34.95 33.77 1a0l s ARG 87 CO 0.82 -0.18 -0.16 0.42 -0.81 0.00 0.00 175.30 175.40 1a0l s ILE 88 N -0.87 2.70 -0.30 4.11 1.01 -1.26 -0.30 121.20 126.29 1a0l s ILE 88 Ca -0.09 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 59.79 1a0l s ILE 88 Cb -0.04 -2.12 0.09 0.00 0.01 0.00 0.00 42.46 40.40 1a0l s ILE 88 CO 0.04 0.52 0.06 -0.63 0.00 0.00 0.00 174.94 174.94 1a0l s ILE 89 N 0.59 1.31 -0.01 2.92 1.01 0.71 -5.00 121.20 122.73 1a0l s ILE 89 Ca -0.09 -1.56 -0.14 0.00 0.00 0.00 0.00 60.65 58.85 1a0l s ILE 89 Cb -0.16 -1.91 -0.05 0.00 0.01 0.00 0.00 42.46 40.35 1a0l s ILE 89 CO 0.03 -0.54 0.39 -0.69 0.00 0.00 0.00 174.94 174.13 1a0l s VAL 90 N 1.42 5.07 0.32 2.92 1.01 -1.26 0.06 120.40 129.94 1a0l s VAL 90 Ca 0.07 0.79 -0.29 0.00 0.00 0.00 0.00 61.98 62.55 1a0l s VAL 90 Cb -0.18 -3.69 -0.12 0.00 0.00 0.00 0.00 36.38 32.39 1a0l s VAL 90 CO -0.17 0.57 1.32 1.57 0.00 0.00 0.00 175.10 178.39 1a0l n HIS 91 N 1.90 2.26 0.20 5.22 -0.00 -0.96 -4.90 115.22 118.95 1a0l n HIS 91 Ca -0.14 0.52 0.04 0.00 0.46 0.00 0.00 57.72 58.60 1a0l n HIS 91 Cb 0.52 -2.43 0.42 0.00 -0.12 0.00 0.00 29.99 28.38 1a0l n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1a0l h PRO 92 N 2.94 0.00 -0.06 1.57 0.13 -1.93 -2.85 132.00 131.81 1a0l h PRO 92 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1a0l h PRO 92 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1a0l h PRO 92 CO 0.66 0.30 0.00 1.04 -0.23 0.00 0.00 178.00 179.77 1a0l n GLN 93 N -4.17 1.36 -2.62 0.86 6.02 -1.26 -4.88 117.38 112.70 1a0l n GLN 93 Ca -0.02 -0.54 -0.43 0.00 -0.01 0.00 0.00 57.00 56.01 1a0l n GLN 93 Cb 0.35 -1.40 -0.02 0.00 1.02 0.00 0.00 30.24 30.19 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 -1.93 3.38 0.00 1.08 5.36 -1.08 -4.83 117.98 119.96 1a0l s PHE 94 Ca 0.35 1.46 0.00 0.00 -0.96 0.00 0.00 56.93 57.78 1a0l s PHE 94 Cb 0.17 -3.27 0.00 0.00 -0.34 0.00 0.00 43.02 39.58 1a0l s PHE 94 CO 0.28 -0.59 0.00 0.98 -1.46 0.00 0.00 175.22 174.43 1a0l n TYR 95 N 5.30 0.00 -3.87 10.12 9.36 -1.26 -4.87 117.16 131.94 1a0l n TYR 95 Ca 0.10 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.21 1a0l n TYR 95 Cb 0.48 0.08 -0.10 0.00 -0.63 0.00 0.00 39.34 39.17 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 -1.61 0.08 0.12 2.97 2.01 -1.26 -4.68 115.64 113.26 1a0l s THR 96 Ca 0.00 -0.65 -0.20 0.00 0.31 0.00 0.00 61.69 61.15 1a0l s THR 96 Cb 0.00 -0.41 -0.08 0.00 0.01 0.00 0.00 72.50 72.01 1a0l s THR 96 CO 0.00 -0.36 1.75 0.00 -0.69 0.00 0.00 174.62 175.32 1a0l h ALA 97 N 4.40 0.17 -0.25 7.40 0.00 -1.98 -2.47 119.26 126.52 1a0l h ALA 97 Ca -0.30 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.69 1a0l h ALA 97 Cb 1.19 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1a0l h ALA 97 CO 0.41 -0.38 0.19 1.96 0.00 0.00 0.00 179.25 181.43 1a0l h GLN 98 N 0.14 0.00 0.00 0.00 7.50 -1.97 0.12 115.11 120.89 1a0l h GLN 98 Ca 0.06 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.21 1a0l h GLN 98 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.56 1a0l h GLN 98 CO -0.05 0.00 -0.01 0.82 -1.50 0.00 0.00 178.83 178.09 1a0l h ILE 99 N 0.00 0.00 0.00 2.54 2.04 -1.84 -3.46 117.51 116.79 1a0l h ILE 99 Ca 0.12 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 65.09 1a0l h ILE 99 Cb 0.51 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 1a0l h ILE 99 CO -0.00 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.76 1a0l n GLY 100 N 1.14 -3.22 2.34 5.37 0.00 0.41 -4.98 105.19 106.26 1a0l n GLY 100 Ca 0.04 -2.15 -0.17 0.00 0.00 0.00 0.00 46.02 43.75 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 0.54 -0.50 -2.19 4.61 0.00 -1.26 -4.50 120.51 117.21 1a0l n ALA 101 Ca 0.00 0.14 -0.42 0.00 0.00 0.00 0.00 53.44 53.16 1a0l n ALA 101 Cb 0.00 -1.92 -0.01 0.00 0.00 0.00 0.00 19.45 17.53 1a0l n ALA 101 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1a0l n ASP 102 N -1.18 4.36 -3.77 0.00 -0.08 -1.26 -4.48 116.55 110.14 1a0l n ASP 102 Ca -0.19 -2.87 -0.13 0.00 -1.51 0.00 0.00 54.79 50.09 1a0l n ASP 102 Cb 0.65 -1.69 -0.10 0.00 2.34 0.00 0.00 41.12 42.32 1a0l n ASP 102 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1a0l s ILE 103 N 4.28 0.04 0.03 5.18 2.07 -1.26 -3.86 121.20 127.68 1a0l s ILE 103 Ca 0.52 -0.33 -0.24 0.00 -1.41 0.00 0.00 60.65 59.19 1a0l s ILE 103 Cb 0.08 -0.54 0.06 0.00 0.13 0.00 0.00 42.46 42.18 1a0l s ILE 103 CO 0.02 -0.18 0.55 0.00 -1.91 0.00 0.00 174.94 173.43 1a0l s ALA 104 N -0.82 -1.43 0.10 1.50 0.00 0.62 -2.28 121.76 119.45 1a0l s ALA 104 Ca -0.09 0.75 0.09 0.00 0.00 0.00 0.00 51.96 52.71 1a0l s ALA 104 Cb -0.04 0.32 -0.04 0.00 0.00 0.00 0.00 23.12 23.36 1a0l s ALA 104 CO 0.03 -0.48 -0.22 -0.51 0.00 0.00 0.00 175.76 174.57 1a0l s LEU 105 N -1.81 2.50 -0.10 0.00 1.43 0.11 -1.48 118.68 119.33 1a0l s LEU 105 Ca -0.07 -0.61 0.01 0.00 -1.03 0.00 0.00 54.13 52.44 1a0l s LEU 105 Cb -0.01 -1.40 0.02 0.00 0.03 0.00 0.00 46.19 44.83 1a0l s LEU 105 CO 0.00 0.20 -0.13 -0.76 0.23 0.00 0.00 176.35 175.89 1a0l s LEU 106 N -1.93 1.59 -0.15 1.79 1.43 0.01 -0.21 118.68 121.21 1a0l s LEU 106 Ca 0.15 -0.37 -0.13 0.00 -1.03 0.00 0.00 54.13 52.76 1a0l s LEU 106 Cb -0.10 -0.97 -0.05 0.00 0.03 0.00 0.00 46.19 45.10 1a0l s LEU 106 CO 0.07 -0.01 0.28 -0.70 0.23 0.00 0.00 176.35 176.22 1a0l s GLU 107 N 1.06 4.18 0.39 1.70 2.12 0.59 -0.16 118.70 128.58 1a0l s GLU 107 Ca -0.06 0.08 -0.23 0.00 0.36 0.00 0.00 54.97 55.12 1a0l s GLU 107 Cb -0.15 -3.40 -0.10 0.00 0.26 0.00 0.00 34.13 30.75 1a0l s GLU 107 CO -0.02 0.31 0.97 -0.51 -0.54 0.00 0.00 175.26 175.47 1a0l s LEU 108 N 0.27 4.12 0.20 2.70 1.43 0.97 0.12 118.68 128.48 1a0l s LEU 108 Ca 0.16 1.82 -0.10 0.00 -1.03 0.00 0.00 54.13 54.99 1a0l s LEU 108 Cb -0.13 -4.28 0.14 0.00 0.03 0.00 0.00 46.19 41.95 1a0l s LEU 108 CO 0.04 -0.30 1.80 -0.08 0.23 0.00 0.00 176.35 178.04 1a0l h GLU 109 N 2.47 1.03 -5.28 1.70 4.81 -1.81 -3.39 114.58 114.11 1a0l h GLU 109 Ca -0.48 -0.14 -0.43 0.00 -0.13 0.00 0.00 59.36 58.18 1a0l h GLU 109 Cb 1.19 -0.19 -0.24 0.00 0.63 0.00 0.00 28.75 30.14 1a0l h GLU 109 CO 0.63 0.79 -0.79 -1.21 -0.73 0.00 0.00 179.01 177.69 1a0l s GLU 110 N -5.78 0.90 1.22 1.92 2.02 -1.26 -4.93 118.70 112.78 1a0l s GLU 110 Ca -0.13 -0.77 -0.20 0.00 0.02 0.00 0.00 54.97 53.89 1a0l s GLU 110 Cb 0.15 -0.90 0.31 0.00 0.10 0.00 0.00 34.13 33.79 1a0l s GLU 110 CO 0.80 0.22 0.70 -2.30 0.02 0.00 0.00 175.26 174.70 1a0l n PRO 111 N 1.82 -4.03 -4.41 0.39 -0.02 -1.26 -4.86 135.00 122.64 1a0l n PRO 111 Ca -0.18 -1.17 -0.25 0.00 -2.02 0.00 0.00 63.50 59.88 1a0l n PRO 111 Cb 0.55 -1.60 -0.13 0.00 -0.02 0.00 0.00 33.50 32.30 1a0l n PRO 111 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1a0l s VAL 112 N -1.94 1.71 -0.70 -1.45 -7.23 0.98 -4.93 120.40 106.84 1a0l s VAL 112 Ca 0.54 -1.43 -0.22 0.00 -1.81 0.00 0.00 61.98 59.06 1a0l s VAL 112 Cb -0.09 -1.53 0.08 0.00 0.56 0.00 0.00 36.38 35.39 1a0l s VAL 112 CO 0.45 0.03 0.97 -0.75 -0.31 0.00 0.00 175.10 175.50 1a0l s LYS 113 N -1.67 3.18 0.65 4.82 2.20 -1.26 -4.88 119.74 122.78 1a0l s LYS 113 Ca 0.07 -1.02 -0.18 0.00 -0.36 0.00 0.00 55.97 54.48 1a0l s LYS 113 Cb -0.10 -4.35 -0.01 0.00 -1.51 0.00 0.00 37.83 31.86 1a0l s LYS 113 CO 0.03 -1.79 1.26 0.14 -0.36 0.00 0.00 175.35 174.63 1a0l s VAL 114 N 3.74 2.23 0.00 4.02 -7.23 -1.26 -4.94 120.40 116.96 1a0l s VAL 114 Ca 0.23 0.14 0.00 0.00 -1.81 0.00 0.00 61.98 60.54 1a0l s VAL 114 Cb -0.15 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 33.78 1a0l s VAL 114 CO 0.07 -0.04 0.00 -1.54 -0.31 0.00 0.00 175.10 173.28 1a0l n SER 115 N -1.95 0.00 -0.03 4.85 3.41 0.14 -4.98 113.62 115.07 1a0l n SER 115 Ca 0.15 -0.69 -0.09 0.00 -0.26 0.00 0.00 58.87 57.99 1a0l n SER 115 Cb 0.49 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.51 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 0.68 0.97 4.04 4.64 -2.00 -3.14 113.55 118.73 1a0l h SER 116 Ca 0.00 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1a0l h SER 116 Cb 0.00 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.90 1a0l h SER 116 CO 0.00 1.01 -0.76 0.45 -0.87 0.00 0.00 176.83 176.66 1a0l h HIS 117 N 0.52 0.00 -2.02 4.77 3.86 -1.95 -3.44 115.15 116.89 1a0l h HIS 117 Ca 0.04 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.98 1a0l h HIS 117 Cb 0.94 0.00 -0.32 0.00 1.06 0.00 0.00 27.41 29.09 1a0l h HIS 117 CO 0.04 0.00 -0.59 0.54 0.86 0.00 0.00 177.93 178.78 1a0l s VAL 118 N -3.25 -0.48 0.26 2.45 0.11 -1.19 -4.37 120.40 113.92 1a0l s VAL 118 Ca 0.03 -0.38 -0.10 0.00 -2.93 0.00 0.00 61.98 58.61 1a0l s VAL 118 Cb 0.11 -0.96 -0.01 0.00 -1.53 0.00 0.00 36.38 34.00 1a0l s VAL 118 CO 0.75 -0.37 0.43 -1.38 -3.33 0.00 0.00 175.10 171.20 1a0l s HIS 119 N 2.43 0.57 0.94 1.54 -3.43 -1.15 0.25 115.29 116.44 1a0l s HIS 119 Ca 0.10 -0.90 -0.12 0.00 -0.80 0.00 0.00 55.06 53.33 1a0l s HIS 119 Cb -0.14 0.05 0.16 0.00 -1.43 0.00 0.00 32.58 31.22 1a0l s HIS 119 CO -0.30 -0.97 1.11 0.95 -2.00 0.00 0.00 174.74 173.53 1a0l s THR 120 N -3.88 2.14 -0.01 -5.38 -4.23 -1.26 -3.07 115.64 99.95 1a0l s THR 120 Ca 0.26 0.05 0.04 0.00 -1.18 0.00 0.00 61.69 60.85 1a0l s THR 120 Cb 0.00 -2.66 -0.03 0.00 1.34 0.00 0.00 72.50 71.15 1a0l s THR 120 CO 0.11 -0.06 -0.10 0.54 -0.54 0.00 0.00 174.62 174.57 1a0l s VAL 121 N -3.11 3.40 -0.13 2.29 0.11 -0.58 -4.80 120.40 117.57 1a0l s VAL 121 Ca 0.64 -0.80 -0.27 0.00 -2.93 0.00 0.00 61.98 58.62 1a0l s VAL 121 Cb -0.17 -2.43 -0.01 0.00 -1.53 0.00 0.00 36.38 32.23 1a0l s VAL 121 CO 0.55 0.44 0.90 -0.89 -3.33 0.00 0.00 175.10 172.78 1a0l s THR 122 N -0.91 4.85 0.63 5.04 2.01 -1.24 -4.71 115.64 121.30 1a0l s THR 122 Ca 0.15 1.81 -0.16 0.00 0.31 0.00 0.00 61.69 63.81 1a0l s THR 122 Cb -0.11 -4.21 -0.02 0.00 0.01 0.00 0.00 72.50 68.17 1a0l s THR 122 CO 0.05 0.03 1.10 -0.76 -0.69 0.00 0.00 174.62 174.35 1a0l s LEU 123 N 2.00 3.45 0.65 4.42 1.43 -1.26 -2.16 118.68 127.20 1a0l s LEU 123 Ca 0.43 1.96 -0.11 0.00 -1.03 0.00 0.00 54.13 55.37 1a0l s LEU 123 Cb -0.17 -4.55 -0.02 0.00 0.03 0.00 0.00 46.19 41.48 1a0l s LEU 123 CO 0.15 -1.45 1.05 -2.16 0.23 0.00 0.00 176.35 174.16 1a0l s PRO 124 N -4.03 3.36 0.55 1.29 0.04 -1.26 -4.76 135.00 130.20 1a0l s PRO 124 Ca 0.66 0.74 -0.17 0.00 0.04 0.00 0.00 61.00 62.27 1a0l s PRO 124 Cb -0.19 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.24 1a0l s PRO 124 CO 0.39 -0.74 1.05 -2.14 0.04 0.00 0.00 177.00 175.60 1a0l s PRO 125 N -5.18 3.52 0.23 0.56 0.02 -1.26 -4.89 135.00 128.00 1a0l s PRO 125 Ca 0.56 1.24 0.15 0.00 0.02 0.00 0.00 61.00 62.97 1a0l s PRO 125 Cb -0.12 -2.06 0.81 0.00 0.02 0.00 0.00 34.50 33.16 1a0l s PRO 125 CO 0.54 -0.65 1.44 0.00 -0.33 0.00 0.00 177.00 178.00 1a0l n ALA 126 N -1.65 0.99 0.06 -1.55 0.00 -1.26 -2.09 120.51 115.01 1a0l n ALA 126 Ca 0.09 0.14 -0.22 0.00 0.00 0.00 0.00 53.44 53.44 1a0l n ALA 126 Cb 0.53 -1.18 -0.15 0.00 0.00 0.00 0.00 19.45 18.65 1a0l n ALA 126 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1a0l h SER 127 N 0.00 0.56 -2.12 0.00 0.02 -1.95 -3.48 113.55 106.59 1a0l h SER 127 Ca 0.00 -0.93 -0.61 0.00 -0.84 0.00 0.00 61.79 59.41 1a0l h SER 127 Cb 0.05 -0.18 0.05 0.00 0.14 0.00 0.00 62.40 62.45 1a0l h SER 127 CO 0.00 1.80 0.82 -0.62 -1.14 0.00 0.00 176.83 177.69 1a0l n GLU 128 N -3.56 1.99 -0.00 3.45 -0.58 -0.89 -4.91 120.64 116.14 1a0l n GLU 128 Ca -0.26 0.72 0.06 0.00 -0.42 0.00 0.00 57.16 57.26 1a0l n GLU 128 Cb 1.07 -2.49 -0.08 0.00 -0.57 0.00 0.00 31.44 29.38 1a0l n GLU 128 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1a0l n THR 129 N 3.71 0.00 -3.41 2.62 -2.24 -1.26 -4.88 114.28 108.82 1a0l n THR 129 Ca 0.19 -0.23 -0.12 0.00 -2.27 0.00 0.00 64.05 61.61 1a0l n THR 129 Cb 0.27 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 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 -1.47 -2.52 -1.59 4.78 3.72 -1.26 -4.97 117.46 114.16 1a0l n PHE 130 Ca 0.01 0.96 -0.30 0.00 -0.05 0.00 0.00 57.45 58.07 1a0l n PHE 130 Cb 0.23 -3.51 0.09 0.00 -0.94 0.00 0.00 39.48 35.35 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 -4.03 2.14 0.30 -1.08 0.04 -1.26 -4.85 135.00 126.27 1a0l s PRO 131 Ca 0.04 0.61 -0.30 0.00 0.04 0.00 0.00 61.00 61.39 1a0l s PRO 131 Cb -0.01 -1.93 -0.12 0.00 0.04 0.00 0.00 34.50 32.48 1a0l s PRO 131 CO 0.82 -1.57 1.47 -0.35 0.04 0.00 0.00 177.00 177.41 1a0l n PRO 132 N -3.40 2.42 0.00 0.56 -0.04 -1.26 -3.19 135.00 130.10 1a0l n PRO 132 Ca 0.07 0.86 0.00 0.00 -0.04 0.00 0.00 63.50 64.39 1a0l n PRO 132 Cb 0.56 -2.56 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 1a0l n PRO 132 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1a0l n GLY 133 N 1.58 2.11 3.76 0.55 0.00 -1.26 -5.04 105.19 106.89 1a0l n GLY 133 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.11 4.63 -0.45 1.61 -1.94 -1.19 -4.98 119.30 116.88 1a0l s MET 134 Ca 0.00 1.80 -0.29 0.00 -1.71 0.00 0.00 55.69 55.49 1a0l s MET 134 Cb 0.00 -3.17 0.03 0.00 2.01 0.00 0.00 34.83 33.69 1a0l s MET 134 CO 0.00 0.20 1.13 -1.25 -0.01 0.00 0.00 175.02 175.10 1a0l s PRO 135 N -1.47 3.79 0.03 2.03 0.04 -1.26 -4.61 135.00 133.55 1a0l s PRO 135 Ca 0.45 0.67 0.07 0.00 0.04 0.00 0.00 61.00 62.23 1a0l s PRO 135 Cb -0.32 -3.88 -0.02 0.00 0.04 0.00 0.00 34.50 30.32 1a0l s PRO 135 CO 0.41 -1.30 -0.19 0.00 0.04 0.00 0.00 177.00 175.96 1a0l s TRP 137 N -0.76 1.99 0.06 0.00 0.52 0.11 -0.75 118.94 120.11 1a0l s TRP 137 Ca 0.06 -0.41 0.09 0.00 0.02 0.00 0.00 56.10 55.86 1a0l s TRP 137 Cb -0.08 -1.04 -0.03 0.00 -1.15 0.00 0.00 33.47 31.17 1a0l s TRP 137 CO 0.01 0.32 -0.24 0.08 0.02 0.00 0.00 176.95 177.14 1a0l s VAL 138 N -1.47 1.93 0.01 4.03 1.01 -0.28 -0.72 120.40 124.90 1a0l s VAL 138 Ca 0.13 -1.35 0.01 0.00 0.00 0.00 0.00 61.98 60.77 1a0l s VAL 138 Cb -0.08 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 1a0l s VAL 138 CO 0.06 0.25 -0.05 0.42 0.00 0.00 0.00 175.10 175.78 1a0l s THR 139 N -0.85 0.37 0.00 3.92 -4.23 -1.22 -1.76 115.64 111.88 1a0l s THR 139 Ca 0.10 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.14 1a0l s THR 139 Cb -0.09 -0.37 0.00 0.00 1.34 0.00 0.00 72.50 73.38 1a0l s THR 139 CO 0.02 -0.08 0.00 0.61 -0.54 0.00 0.00 174.62 174.64 1a0l n GLY 140 N 2.48 -0.94 1.61 3.99 0.00 -0.87 -4.36 105.19 107.09 1a0l n GLY 140 Ca -0.16 -1.10 -0.16 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.30 1.95 -2.37 1.61 8.01 -1.26 -2.08 117.44 123.00 1a0l n TRP 141 Ca 0.00 -2.05 -0.09 0.00 -1.31 0.00 0.00 57.50 54.05 1a0l n TRP 141 Cb 0.00 -0.44 0.05 0.00 -2.01 0.00 0.00 31.31 28.91 1a0l n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1a0l n GLY 142 N -0.88 0.69 3.60 6.99 0.00 -1.26 -4.77 105.19 109.56 1a0l n GLY 142 Ca 0.39 -1.98 -0.45 0.00 0.00 0.00 0.00 46.02 43.97 1a0l n GLY 142 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1a0l n ASP 143 N -2.97 1.52 -0.58 1.61 8.00 0.22 -3.02 116.55 121.33 1a0l n ASP 143 Ca 0.06 1.17 0.07 0.00 0.71 0.00 0.00 54.79 56.80 1a0l n ASP 143 Cb 0.23 -1.30 0.22 0.00 -0.02 0.00 0.00 41.12 40.25 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 0.63 0.37 0.00 2.53 0.24 0.22 -0.26 118.33 122.06 1a0l n VAL 144 Ca 0.11 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 1a0l n VAL 144 Cb 0.31 0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 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 0.40 0.00 -4.66 -1.34 2.03 -1.22 -4.53 116.55 107.23 1a0l n ASP 145 Ca 0.13 0.00 -0.49 0.00 0.52 0.00 0.00 54.79 54.95 1a0l n ASP 145 Cb 0.29 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.64 1a0l n ASP 145 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1a0l n ASN 146 N 0.00 2.82 -0.09 1.67 3.02 -1.26 -1.10 115.26 120.31 1a0l n ASN 146 Ca 0.00 1.06 -0.01 0.00 -0.03 0.00 0.00 54.58 55.60 1a0l n ASN 146 Cb 0.00 -1.34 -0.00 0.00 -0.61 0.00 0.00 39.78 37.83 1a0l n ASN 146 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1a0l n ASP 147 N 4.26 -4.86 -4.24 6.41 8.00 -1.26 -4.89 116.55 119.97 1a0l n ASP 147 Ca 0.20 0.03 -0.43 0.00 0.71 0.00 0.00 54.79 55.30 1a0l n ASP 147 Cb 0.25 -3.02 -0.06 0.00 -0.02 0.00 0.00 41.12 38.28 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 -1.74 2.97 0.44 -1.24 0.41 -0.26 -5.06 118.70 114.21 1a0l s GLU 149 Ca 0.00 -2.18 -0.23 0.00 -0.41 0.00 0.00 54.97 52.14 1a0l s GLU 149 Cb 0.00 -4.12 -0.08 0.00 -1.78 0.00 0.00 34.13 28.16 1a0l s GLU 149 CO 0.00 -1.24 1.13 -0.98 -0.49 0.00 0.00 175.26 173.68 1a0l s ARG 150 N 0.64 3.91 0.00 1.61 1.04 -1.26 -0.61 118.95 124.28 1a0l s ARG 150 Ca 0.12 1.71 0.00 0.00 -1.04 0.00 0.00 55.73 56.52 1a0l s ARG 150 Cb -0.20 -2.48 0.00 0.00 -2.04 0.00 0.00 34.95 30.24 1a0l s ARG 150 CO -0.04 -0.41 0.00 -0.11 -0.04 0.00 0.00 175.30 174.70 1a0l n LEU 151 N -0.30 0.00 -0.33 -1.89 7.94 -1.26 -4.69 117.00 116.47 1a0l n LEU 151 Ca 0.06 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.96 1a0l n LEU 151 Cb 0.48 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.43 1a0l n LEU 151 CO 0.47 -1.11 0.00 -0.81 -1.11 0.00 0.00 177.39 174.83 1a0l n PRO 152 N -1.18 0.00 -3.38 1.96 -0.04 -1.26 -5.03 135.00 126.06 1a0l n PRO 152 Ca 0.00 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 1a0l n PRO 152 Cb 0.00 -0.37 0.06 0.00 -0.04 0.00 0.00 33.50 33.15 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 0.00 -2.29 -2.36 0.54 3.72 -1.26 -3.32 117.46 112.49 1a0l n PHE 153 Ca 0.00 0.75 -0.37 0.00 -0.05 0.00 0.00 57.45 57.78 1a0l n PHE 153 Cb 0.00 -3.96 -0.02 0.00 -0.94 0.00 0.00 39.48 34.56 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 -4.89 3.88 -0.07 -1.08 0.04 -1.26 -0.89 135.00 130.73 1a0l s PRO 154 Ca 0.45 1.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.86 1a0l s PRO 154 Cb -0.09 -2.43 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 1a0l s PRO 154 CO 0.78 -0.43 1.22 -1.17 0.04 0.00 0.00 177.00 177.44 1a0l s LEU 155 N -2.94 4.27 0.09 -3.56 2.96 -0.68 -4.80 118.68 114.02 1a0l s LEU 155 Ca 0.62 1.82 0.04 0.00 -0.22 0.00 0.00 54.13 56.39 1a0l s LEU 155 Cb -0.26 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.83 1a0l s LEU 155 CO 0.32 -0.61 0.05 -0.54 -1.32 0.00 0.00 176.35 174.24 1a0l s LYS 156 N 2.38 2.74 0.09 1.98 1.02 -0.88 -0.49 119.74 126.58 1a0l s LYS 156 Ca 0.56 -0.77 0.07 0.00 0.02 0.00 0.00 55.97 55.85 1a0l s LYS 156 Cb -0.25 -2.64 -0.03 0.00 -0.52 0.00 0.00 37.83 34.39 1a0l s LYS 156 CO 0.21 0.55 -0.18 1.14 -0.92 0.00 0.00 175.35 176.15 1a0l s GLN 157 N -2.42 0.99 -0.07 1.68 -2.07 -0.14 -2.06 119.66 115.57 1a0l s GLN 157 Ca 0.28 -1.08 -0.09 0.00 -1.82 0.00 0.00 55.36 52.65 1a0l s GLN 157 Cb -0.12 -1.12 0.02 0.00 -1.09 0.00 0.00 33.01 30.71 1a0l s GLN 157 CO 0.21 0.25 0.24 0.54 -1.32 0.00 0.00 175.29 175.21 1a0l s VAL 158 N -1.29 0.01 -0.28 3.63 0.11 -0.72 -1.31 120.40 120.56 1a0l s VAL 158 Ca 0.03 -0.12 -0.16 0.00 -2.93 0.00 0.00 61.98 58.80 1a0l s VAL 158 Cb -0.10 -0.38 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 1a0l s VAL 158 CO 0.03 -0.07 0.43 -0.75 -3.33 0.00 0.00 175.10 171.41 1a0l s LYS 159 N -0.18 3.98 0.05 1.54 2.20 -1.26 -1.13 119.74 124.94 1a0l s LYS 159 Ca -0.03 0.09 0.05 0.00 -0.36 0.00 0.00 55.97 55.72 1a0l s LYS 159 Cb -0.03 -3.67 -0.04 0.00 -1.51 0.00 0.00 37.83 32.58 1a0l s LYS 159 CO 0.01 -0.34 -0.10 0.14 -0.36 0.00 0.00 175.35 174.70 1a0l s VAL 160 N 2.17 3.38 -0.03 4.02 -7.23 0.07 -4.93 120.40 117.85 1a0l s VAL 160 Ca 0.17 -1.03 -0.22 0.00 -1.81 0.00 0.00 61.98 59.09 1a0l s VAL 160 Cb -0.16 -2.50 -0.05 0.00 0.56 0.00 0.00 36.38 34.23 1a0l s VAL 160 CO 0.10 0.28 0.63 -2.16 -0.31 0.00 0.00 175.10 173.64 1a0l s PRO 161 N -1.71 4.37 0.49 4.82 0.04 -1.26 -3.93 135.00 137.82 1a0l s PRO 161 Ca 0.18 0.78 -0.20 0.00 0.04 0.00 0.00 61.00 61.80 1a0l s PRO 161 Cb -0.11 -3.38 -0.08 0.00 0.04 0.00 0.00 34.50 30.97 1a0l s PRO 161 CO 0.09 0.26 1.05 0.42 0.04 0.00 0.00 177.00 178.87 1a0l s ILE 162 N 0.16 3.70 0.04 0.56 -1.09 -1.26 -1.12 121.20 122.19 1a0l s ILE 162 Ca 0.33 1.08 0.05 0.00 -2.23 0.00 0.00 60.65 59.88 1a0l s ILE 162 Cb -0.18 -3.44 -0.02 0.00 -1.58 0.00 0.00 42.46 37.23 1a0l s ILE 162 CO 0.17 -0.21 -0.15 -0.32 -1.23 0.00 0.00 174.94 173.20 1a0l s MET 163 N -3.19 0.99 0.23 2.79 1.75 -0.52 -4.46 119.30 116.89 1a0l s MET 163 Ca 0.67 -0.82 -0.30 0.00 -1.25 0.00 0.00 55.69 54.00 1a0l s MET 163 Cb -0.18 -1.02 -0.09 0.00 2.84 0.00 0.00 34.83 36.38 1a0l s MET 163 CO 0.21 0.25 1.05 -2.00 -0.65 0.00 0.00 175.02 173.89 1a0l s GLU 164 N -1.23 4.68 0.40 4.11 2.12 -1.26 -4.12 118.70 123.40 1a0l s GLU 164 Ca 0.02 1.68 0.17 0.00 0.36 0.00 0.00 54.97 57.20 1a0l s GLU 164 Cb -0.08 -3.25 1.06 0.00 0.26 0.00 0.00 34.13 32.12 1a0l s GLU 164 CO 0.02 0.24 1.81 -0.91 -0.54 0.00 0.00 175.26 175.88 1a0l h ASN 165 N 4.40 0.46 0.62 -1.70 4.21 -1.95 -0.20 115.58 121.42 1a0l h ASN 165 Ca -0.45 0.06 -0.14 0.00 1.21 0.00 0.00 56.30 56.98 1a0l h ASN 165 Cb 1.21 -0.02 -0.02 0.00 -1.12 0.00 0.00 38.32 38.37 1a0l h ASN 165 CO 0.69 0.14 -0.65 0.45 -1.29 0.00 0.00 177.43 176.77 1a0l h HIS 166 N 0.44 0.04 0.10 1.19 3.86 -1.93 0.82 115.15 119.66 1a0l h HIS 166 Ca 0.54 -0.02 -0.27 0.00 -1.16 0.00 0.00 60.37 59.46 1a0l h HIS 166 Cb 1.30 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.76 1a0l h HIS 166 CO -0.00 0.67 -1.28 0.82 0.86 0.00 0.00 177.93 179.00 1a0l h ILE 167 N 0.02 1.45 -0.42 2.45 1.08 -1.78 -1.69 117.51 118.61 1a0l h ILE 167 Ca -0.01 -3.06 -0.06 0.00 -0.39 0.00 0.00 64.86 61.35 1a0l h ILE 167 Cb 1.15 2.88 -0.02 0.00 -3.07 0.00 0.00 36.82 37.76 1a0l h ILE 167 CO 0.09 0.88 0.05 0.00 -0.69 0.00 0.00 178.15 178.47 1a0l h ASP 169 N 0.56 1.01 -0.05 0.00 3.58 -0.81 -1.90 116.42 118.80 1a0l h ASP 169 Ca 0.13 -0.27 -0.00 0.00 0.42 0.00 0.00 57.03 57.30 1a0l h ASP 169 Cb 0.41 -0.27 -0.00 0.00 1.72 0.00 0.00 39.33 41.19 1a0l h ASP 169 CO 0.01 1.02 0.03 0.00 -2.88 0.00 0.00 179.24 177.42 1a0l h ALA 170 N 1.02 0.06 -0.57 -0.78 0.00 -1.14 -2.35 119.26 115.50 1a0l h ALA 170 Ca 0.19 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1a0l h ALA 170 Cb 0.46 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 1a0l h ALA 170 CO 0.02 -0.39 0.21 0.87 0.00 0.00 0.00 179.25 179.96 1a0l h LYS 171 N -0.01 0.39 -0.14 0.00 1.57 -0.85 -1.04 116.57 116.48 1a0l h LYS 171 Ca 0.02 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.81 1a0l h LYS 171 Cb 0.09 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1a0l h LYS 171 CO -0.00 0.26 0.11 1.88 -0.57 0.00 0.00 179.45 181.13 1a0l h TYR 172 N 0.40 0.00 0.00 -1.35 -1.99 -0.98 -1.01 116.97 112.04 1a0l h TYR 172 Ca 0.28 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.01 1a0l h TYR 172 Cb 0.33 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.06 1a0l h TYR 172 CO -0.16 0.00 -0.04 0.45 -0.00 0.00 0.00 178.16 178.40 1a0l h HIS 173 N 0.00 0.00 -3.00 4.88 3.86 -0.67 -3.42 115.15 116.80 1a0l h HIS 173 Ca 0.06 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.75 1a0l h HIS 173 Cb 0.29 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.80 1a0l h HIS 173 CO 0.00 0.00 0.77 -0.51 0.86 0.00 0.00 177.93 179.05 1a0l s LEU 173 N -5.21 4.37 0.00 2.43 1.43 -0.38 -1.92 118.68 119.40 1a0l s LEU 173 Ca 0.09 2.45 0.00 0.00 -1.03 0.00 0.00 54.13 55.64 1a0l s LEU 173 Cb 0.09 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.72 1a0l s LEU 173 CO 0.63 -0.70 0.00 0.61 0.23 0.00 0.00 176.35 177.12 1a0l n GLY 173 N 3.39 0.94 3.62 -3.19 0.00 -1.26 -5.00 105.19 103.69 1a0l n GLY 173 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.50 3.08 -0.22 4.61 0.00 -0.81 -5.00 121.76 119.93 1a0l s ALA 173 Ca 0.00 -1.02 0.29 0.00 0.00 0.00 0.00 51.96 51.22 1a0l s ALA 173 Cb 0.00 -1.16 1.09 0.00 0.00 0.00 0.00 23.12 23.05 1a0l s ALA 173 CO 0.00 0.63 1.84 1.88 0.00 0.00 0.00 175.76 180.10 1a0l h TYR 173 N 4.38 0.00 -2.26 0.00 0.05 -1.95 -3.45 116.97 113.74 1a0l h TYR 173 Ca -0.48 0.00 -0.55 0.00 0.05 0.00 0.00 58.73 57.74 1a0l h TYR 173 Cb 1.17 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.92 1a0l h TYR 173 CO 0.59 0.00 1.32 0.99 -1.05 0.00 0.00 178.16 180.00 1a0l s THR 173 N -3.46 3.04 0.00 -2.88 2.01 -1.26 -5.18 115.64 107.92 1a0l s THR 173 Ca 0.04 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.08 1a0l s THR 173 Cb 0.09 -3.04 0.00 0.00 0.01 0.00 0.00 72.50 69.56 1a0l s THR 173 CO 0.51 -0.01 0.00 0.61 -0.69 0.00 0.00 174.62 175.03 1a0l n GLY 173 N 4.95 -2.42 0.81 4.40 0.00 -1.26 -4.91 105.19 106.77 1a0l n GLY 173 Ca 0.23 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -4.31 1.61 5.75 -1.26 -4.76 116.55 113.58 1a0l n ASP 173 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 54.79 54.39 1a0l n ASP 173 Cb 0.00 -0.08 -0.11 0.00 -1.03 0.00 0.00 41.12 39.90 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 4.15 -0.12 2.12 1.01 -1.26 -5.05 120.40 121.25 1a0l s VAL 173 Ca 0.00 -1.11 -0.29 0.00 0.00 0.00 0.00 61.98 60.58 1a0l s VAL 173 Cb 0.00 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 1a0l s VAL 173 CO 0.00 -0.28 1.55 -0.13 0.00 0.00 0.00 175.10 176.24 1a0l s ARG 174 N 1.46 4.11 -0.18 2.72 1.81 -1.26 -4.85 118.95 122.76 1a0l s ARG 174 Ca 0.01 1.95 -0.13 0.00 -1.72 0.00 0.00 55.73 55.84 1a0l s ARG 174 Cb -0.20 -3.94 -0.22 0.00 -0.45 0.00 0.00 34.95 30.14 1a0l s ARG 174 CO 0.04 -0.91 0.20 -0.89 -0.68 0.00 0.00 175.30 173.07 1a0l n ILE 175 N 5.65 1.64 -3.16 1.52 5.41 -1.26 -4.70 119.36 124.47 1a0l n ILE 175 Ca 0.17 -0.38 -0.45 0.00 1.00 0.00 0.00 62.75 63.09 1a0l n ILE 175 Cb 0.44 -1.85 -0.04 0.00 -0.71 0.00 0.00 39.64 37.48 1a0l n ILE 175 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1a0l s VAL 176 N -2.47 5.00 1.27 1.39 1.01 -1.26 -5.00 120.40 120.33 1a0l s VAL 176 Ca -0.27 -1.38 -0.18 0.00 0.00 0.00 0.00 61.98 60.15 1a0l s VAL 176 Cb 0.07 -4.50 0.29 0.00 0.00 0.00 0.00 36.38 32.24 1a0l s VAL 176 CO 0.66 -1.11 0.73 0.54 0.00 0.00 0.00 175.10 175.92 1a0l n ARG 177 N 5.81 -3.24 0.14 2.72 3.00 -1.26 -4.88 116.66 118.94 1a0l n ARG 177 Ca -0.03 -0.94 0.12 0.00 -0.01 0.00 0.00 57.85 56.99 1a0l n ARG 177 Cb 0.43 -1.93 0.26 0.00 0.00 0.00 0.00 32.46 31.23 1a0l n ARG 177 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1a0l h ASP 178 N -2.97 0.00 -0.30 0.55 3.32 -2.00 -3.09 116.42 111.93 1a0l h ASP 178 Ca -0.50 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.52 1a0l h ASP 178 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1a0l h ASP 178 CO 0.36 0.02 0.00 -0.90 -1.72 0.00 0.00 179.24 176.99 1a0l n ASP 179 N -2.56 3.42 -4.37 6.45 5.75 -1.26 -4.85 116.55 119.14 1a0l n ASP 179 Ca 0.04 -2.47 -0.19 0.00 -0.01 0.00 0.00 54.79 52.16 1a0l n ASP 179 Cb 0.48 -0.58 -0.10 0.00 -1.03 0.00 0.00 41.12 39.88 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 -1.90 1.39 0.05 0.11 -1.94 -1.17 -1.55 119.30 114.29 1a0l s MET 180 Ca 0.28 -1.62 0.00 0.00 -1.71 0.00 0.00 55.69 52.65 1a0l s MET 180 Cb 0.21 -1.23 -0.03 0.00 2.01 0.00 0.00 34.83 35.79 1a0l s MET 180 CO 0.09 0.21 -0.05 -1.17 -0.01 0.00 0.00 175.02 174.09 1a0l s LEU 181 N -3.35 2.39 0.13 -0.03 0.20 0.36 -4.63 118.68 113.76 1a0l s LEU 181 Ca 0.24 -0.79 0.10 0.00 0.69 0.00 0.00 54.13 54.36 1a0l s LEU 181 Cb -0.01 0.05 -0.04 0.00 -0.43 0.00 0.00 46.19 45.76 1a0l s LEU 181 CO 0.08 -0.42 -0.23 0.00 -0.29 0.00 0.00 176.35 175.49 1a0l s ALA 183 N -1.34 -1.85 0.00 0.00 0.00 -0.82 -1.44 121.76 116.32 1a0l s ALA 183 Ca 0.13 1.61 0.00 0.00 0.00 0.00 0.00 51.96 53.70 1a0l s ALA 183 Cb -0.09 -0.64 0.00 0.00 0.00 0.00 0.00 23.12 22.39 1a0l s ALA 183 CO 0.06 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1a0l n GLY 184 N 1.41 2.68 3.75 0.00 0.00 -0.27 -1.15 105.19 111.61 1a0l n GLY 184 Ca -0.15 -2.11 -0.10 0.00 0.00 0.00 0.00 46.02 43.66 1a0l n GLY 184 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a0l s ASN 185 N 0.00 0.21 0.66 1.61 2.20 0.37 -4.69 114.94 115.29 1a0l s ASN 185 Ca 0.00 -1.25 0.29 0.00 -0.94 0.00 0.00 52.86 50.96 1a0l s ASN 185 Cb 0.00 0.83 1.58 0.00 -2.00 0.00 0.00 41.25 41.66 1a0l s ASN 185 CO 0.00 -1.65 1.89 0.71 -2.94 0.00 0.00 177.10 175.10 1a0l h THR 186 N 2.01 0.00 0.00 0.54 1.35 -1.81 -1.85 112.91 113.15 1a0l h THR 186 Ca -0.32 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1a0l h THR 186 Cb 1.25 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1a0l h THR 186 CO 0.41 0.00 0.00 -2.11 -0.25 0.00 0.00 175.52 173.57 1a0l n ARG 187 N -2.86 0.72 -3.68 4.72 1.85 -1.26 -4.72 116.66 111.43 1a0l n ARG 187 Ca -0.02 -0.82 -0.10 0.00 -1.00 0.00 0.00 57.85 55.92 1a0l n ARG 187 Cb 0.39 -0.89 -0.11 0.00 -1.05 0.00 0.00 32.46 30.81 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 -0.37 0.33 -0.09 2.89 0.52 -0.69 -3.98 118.95 117.56 1a0l s ARG 188 Ca 0.00 0.87 -0.33 0.00 -0.52 0.00 0.00 55.73 55.76 1a0l s ARG 188 Cb 0.00 0.11 0.14 0.00 0.52 0.00 0.00 34.95 35.73 1a0l s ARG 188 CO 0.00 -0.21 1.43 0.34 0.02 0.00 0.00 175.30 176.89 1a0l s ASP 189 N 1.97 -0.00 0.71 0.23 2.15 -1.07 -0.48 116.67 120.18 1a0l s ASP 189 Ca -0.05 -0.01 -0.06 0.00 0.43 0.00 0.00 52.55 52.86 1a0l s ASP 189 Cb -0.10 0.01 0.08 0.00 -0.30 0.00 0.00 42.92 42.61 1a0l s ASP 189 CO -0.12 -0.02 1.01 -0.94 -0.17 0.00 0.00 175.17 174.93 1a0l s SER 190 N -3.07 4.63 0.22 -0.34 1.04 -1.26 -0.69 113.70 114.23 1a0l s SER 190 Ca 0.16 0.26 -0.03 0.00 0.48 0.00 0.00 55.95 56.82 1a0l s SER 190 Cb 0.07 -0.84 0.01 0.00 0.10 0.00 0.00 66.02 65.37 1a0l s SER 190 CO -0.07 -1.70 0.34 0.00 0.98 0.00 0.00 173.24 172.80 1a0l n GLN 192 N -0.34 0.97 0.00 0.00 -0.06 -1.26 -1.43 117.38 115.27 1a0l n GLN 192 Ca -0.01 0.35 0.00 0.00 -2.00 0.00 0.00 57.00 55.34 1a0l n GLN 192 Cb 0.35 -1.86 0.00 0.00 -4.06 0.00 0.00 30.24 24.67 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 2.09 1.56 0.07 1.69 0.00 -1.26 -0.61 105.19 108.73 1a0l n GLY 193 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1a0l n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1a0l h ASP 194 N 0.00 0.00 -2.01 1.61 3.32 -1.58 -3.37 116.42 114.39 1a0l h ASP 194 Ca 0.00 -0.21 -0.62 0.00 0.02 0.00 0.00 57.03 56.22 1a0l h ASP 194 Cb 0.00 0.00 0.12 0.00 0.22 0.00 0.00 39.33 39.67 1a0l h ASP 194 CO 0.00 0.10 -0.15 -1.20 -1.72 0.00 0.00 179.24 176.28 1a0l n SER 195 N -2.17 0.22 0.00 6.45 7.64 -1.26 -0.42 113.62 124.08 1a0l n SER 195 Ca 0.03 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1a0l n SER 195 Cb 0.45 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 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 1.53 1.74 3.87 0.23 0.00 -0.39 -0.38 105.19 111.79 1a0l n GLY 196 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.93 1.61 -0.13 -0.02 0.00 0.44 -2.74 107.32 104.54 1a0l s GLY 197 Ca 0.00 -0.47 -0.10 0.00 0.00 0.00 0.00 44.72 44.15 1a0l s GLY 197 CO 0.00 -0.02 0.20 2.56 0.00 0.00 0.00 173.10 175.84 1a0l s PRO 198 N -5.41 3.86 -0.37 2.90 0.04 -1.26 -0.40 135.00 134.36 1a0l s PRO 198 Ca 0.61 -0.04 -0.13 0.00 0.04 0.00 0.00 61.00 61.47 1a0l s PRO 198 Cb -0.12 -3.30 0.01 0.00 0.04 0.00 0.00 34.50 31.13 1a0l s PRO 198 CO 0.51 0.54 0.25 -1.17 0.04 0.00 0.00 177.00 177.16 1a0l s LEU 199 N -0.37 4.75 0.10 -3.56 2.96 0.57 -3.38 118.68 119.76 1a0l s LEU 199 Ca 0.14 -0.76 0.08 0.00 -0.22 0.00 0.00 54.13 53.37 1a0l s LEU 199 Cb -0.12 -2.10 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 1a0l s LEU 199 CO 0.03 -0.35 -0.13 0.68 -1.32 0.00 0.00 176.35 175.26 1a0l s VAL 200 N 1.65 3.15 0.11 1.68 -7.23 0.10 -1.49 120.40 118.37 1a0l s VAL 200 Ca 0.05 -1.33 0.05 0.00 -1.81 0.00 0.00 61.98 58.93 1a0l s VAL 200 Cb -0.18 -2.45 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 1a0l s VAL 200 CO 0.09 0.13 -0.12 0.00 -0.31 0.00 0.00 175.10 174.89 1a0l s LYS 202 N -2.67 3.15 -0.32 0.00 2.20 -1.03 -1.37 119.74 119.70 1a0l s LYS 202 Ca 0.06 -0.73 -0.04 0.00 -0.36 0.00 0.00 55.97 54.90 1a0l s LYS 202 Cb -0.04 -4.02 0.04 0.00 -1.51 0.00 0.00 37.83 32.30 1a0l s LYS 202 CO 0.01 -1.04 0.05 0.08 -0.36 0.00 0.00 175.35 174.10 1a0l s VAL 203 N 2.47 3.35 -1.08 4.02 1.01 0.12 -4.65 120.40 125.65 1a0l s VAL 203 Ca 0.15 -1.27 -0.07 0.00 0.00 0.00 0.00 61.98 60.80 1a0l s VAL 203 Cb -0.17 -2.91 -0.05 0.00 0.00 0.00 0.00 36.38 33.24 1a0l s VAL 203 CO 0.14 -0.14 0.91 -3.20 0.00 0.00 0.00 175.10 172.81 1a0l n ASN 204 N 4.71 -5.85 -0.57 3.32 5.15 -1.26 -2.49 115.26 118.27 1a0l n ASN 204 Ca -0.13 -0.74 -0.07 0.00 -0.60 0.00 0.00 54.58 53.04 1a0l n ASN 204 Cb 0.44 -4.95 -0.03 0.00 -0.53 0.00 0.00 39.78 34.70 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 -1.28 0.80 2.95 8.20 0.00 -1.26 -4.98 105.19 109.62 1a0l n GLY 205 Ca -0.10 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.84 0.06 -0.29 2.61 2.01 -1.04 -5.10 115.64 112.04 1a0l s THR 206 Ca 0.00 -0.47 -0.25 0.00 0.31 0.00 0.00 61.69 61.28 1a0l s THR 206 Cb 0.00 -0.18 0.00 0.00 0.01 0.00 0.00 72.50 72.34 1a0l s THR 206 CO 0.00 -0.26 0.87 0.26 -0.69 0.00 0.00 174.62 174.80 1a0l s TRP 207 N -0.77 3.22 0.16 4.92 0.52 -1.26 0.17 118.94 125.90 1a0l s TRP 207 Ca -0.08 1.00 0.10 0.00 0.02 0.00 0.00 56.10 57.13 1a0l s TRP 207 Cb -0.05 -3.28 -0.04 0.00 -1.15 0.00 0.00 33.47 28.95 1a0l s TRP 207 CO -0.00 -0.56 -0.20 -0.51 0.02 0.00 0.00 176.95 175.69 1a0l s LEU 208 N 3.08 2.59 -0.43 2.99 1.43 -0.47 -3.60 118.68 124.27 1a0l s LEU 208 Ca 0.36 -0.70 -0.16 0.00 -1.03 0.00 0.00 54.13 52.60 1a0l s LEU 208 Cb -0.14 -1.38 0.03 0.00 0.03 0.00 0.00 46.19 44.73 1a0l s LEU 208 CO 0.11 0.14 0.36 -1.58 0.23 0.00 0.00 176.35 175.62 1a0l s GLN 209 N -2.44 3.00 -0.03 1.70 0.74 -0.92 -1.48 119.66 120.22 1a0l s GLN 209 Ca 0.20 -1.05 -0.22 0.00 0.05 0.00 0.00 55.36 54.33 1a0l s GLN 209 Cb -0.09 -4.02 -0.25 0.00 1.10 0.00 0.00 33.01 29.75 1a0l s GLN 209 CO 0.10 -0.85 1.02 0.00 -0.55 0.00 0.00 175.29 175.01 1a0l h ALA 210 N 8.69 0.02 -2.63 1.58 0.00 -1.62 -3.36 119.26 121.94 1a0l h ALA 210 Ca -0.27 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 53.94 1a0l h ALA 210 Cb 1.12 0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.82 1a0l h ALA 210 CO 0.78 0.26 -0.39 0.20 0.00 0.00 0.00 179.25 180.10 1a0l s GLY 211 N -4.11 0.76 -0.17 0.00 0.00 -1.10 -0.81 107.32 101.89 1a0l s GLY 211 Ca -0.14 -1.14 -0.01 0.00 0.00 0.00 0.00 44.72 43.44 1a0l s GLY 211 CO 0.79 -0.99 -0.13 0.14 0.00 0.00 0.00 173.10 172.91 1a0l s VAL 212 N -4.03 2.78 -0.72 1.40 1.01 -0.89 -0.31 120.40 119.64 1a0l s VAL 212 Ca 0.23 -0.72 -0.31 0.00 0.00 0.00 0.00 61.98 61.18 1a0l s VAL 212 Cb 0.04 -2.20 -0.16 0.00 0.00 0.00 0.00 36.38 34.07 1a0l s VAL 212 CO 0.04 0.50 2.51 0.52 0.00 0.00 0.00 175.10 178.67 1a0l n VAL 213 N 4.22 -0.00 0.00 2.92 0.31 0.47 -0.76 118.33 125.48 1a0l n VAL 213 Ca -0.19 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 1a0l n VAL 213 Cb 0.51 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 32.10 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 11.84 0.00 -0.06 4.52 2.88 -0.82 -1.27 113.62 130.71 1a0l n SER 214 Ca 0.53 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1a0l n SER 214 Cb 0.21 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 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 -1.22 0.00 0.00 0.66 4.27 -0.94 -4.87 117.44 115.34 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 0.74 2.25 2.69 -1.67 0.00 -1.26 -1.94 105.19 106.00 1a0l n GLY 216 Ca 0.00 -1.06 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 1a0l n GLY 216 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a0l n GLU 217 N -1.00 5.32 0.00 1.61 1.02 -1.26 -4.98 120.64 121.35 1a0l n GLU 217 Ca 0.00 -4.65 0.00 0.00 -0.02 0.00 0.00 57.16 52.49 1a0l n GLU 217 Cb 0.00 -2.48 0.00 0.00 -0.02 0.00 0.00 31.44 28.94 1a0l n GLU 217 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a0l n GLY 219 N 0.13 -1.13 3.09 0.62 0.00 -1.26 -4.84 105.19 101.80 1a0l n GLY 219 Ca 0.44 -2.10 -0.28 0.00 0.00 0.00 0.00 46.02 44.08 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 3.90 -1.29 -2.53 0.00 0.00 -1.26 -4.76 120.51 114.56 1a0l n ALA 221 Ca -0.20 0.09 -0.36 0.00 0.00 0.00 0.00 53.44 52.97 1a0l n ALA 221 Cb 0.52 -3.98 -0.06 0.00 0.00 0.00 0.00 19.45 15.93 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 -6.75 3.83 0.22 0.00 -0.21 -1.26 -4.41 119.66 111.07 1a0l s GLN 221 Ca 0.68 0.28 -0.30 0.00 0.02 0.00 0.00 55.36 56.04 1a0l s GLN 221 Cb -0.36 -3.07 -0.10 0.00 1.00 0.00 0.00 33.01 30.49 1a0l s GLN 221 CO 0.88 0.60 1.46 -1.25 -2.12 0.00 0.00 175.29 174.85 1a0l s PRO 222 N -1.63 4.27 -0.12 2.91 0.04 -1.26 -3.02 135.00 136.19 1a0l s PRO 222 Ca 0.30 2.28 0.00 0.00 0.04 0.00 0.00 61.00 63.63 1a0l s PRO 222 Cb -0.15 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.26 1a0l s PRO 222 CO 0.16 -0.45 0.00 0.09 0.04 0.00 0.00 177.00 176.84 1a0l n ASN 223 N 2.81 -4.15 -3.22 6.66 3.02 -1.26 -4.91 115.26 114.21 1a0l n ASN 223 Ca 0.09 0.03 -0.24 0.00 -0.03 0.00 0.00 54.58 54.43 1a0l n ASN 223 Cb 0.40 -1.74 -0.06 0.00 -0.61 0.00 0.00 39.78 37.77 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 -1.62 1.28 -0.81 3.52 5.12 -1.17 -3.24 116.66 119.76 1a0l n ARG 224 Ca -0.01 -3.64 -0.29 0.00 -1.93 0.00 0.00 57.85 51.98 1a0l n ARG 224 Cb 0.21 -1.58 0.21 0.00 -1.16 0.00 0.00 32.46 30.14 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 -1.82 -0.18 0.22 5.56 0.04 -1.26 -4.47 135.00 133.09 1a0l s PRO 225 Ca 0.38 0.80 -0.30 0.00 0.04 0.00 0.00 61.00 61.92 1a0l s PRO 225 Cb 0.21 -1.64 -0.09 0.00 0.04 0.00 0.00 34.50 33.02 1a0l s PRO 225 CO -0.09 -3.21 1.19 0.20 0.04 0.00 0.00 177.00 175.13 1a0l s GLY 226 N -2.90 2.78 -0.16 0.56 0.00 -0.30 -4.64 107.32 102.66 1a0l s GLY 226 Ca 0.67 0.98 -0.07 0.00 0.00 0.00 0.00 44.72 46.30 1a0l s GLY 226 CO 0.61 1.80 0.06 -0.42 0.00 0.00 0.00 173.10 175.15 1a0l s ILE 227 N -0.39 4.80 0.16 0.90 -1.09 -0.82 -1.94 121.20 122.83 1a0l s ILE 227 Ca 0.51 -0.04 0.07 0.00 -2.23 0.00 0.00 60.65 58.96 1a0l s ILE 227 Cb -0.33 -3.14 -0.04 0.00 -1.58 0.00 0.00 42.46 37.36 1a0l s ILE 227 CO 0.39 0.49 -0.15 -0.31 -1.23 0.00 0.00 174.94 174.14 1a0l s TYR 228 N 0.09 1.59 -0.09 3.97 1.51 0.45 -1.95 117.35 122.93 1a0l s TYR 228 Ca 0.05 -0.56 -0.30 0.00 -1.01 0.00 0.00 57.07 55.26 1a0l s TYR 228 Cb -0.12 -0.79 -0.02 0.00 -0.11 0.00 0.00 41.96 40.92 1a0l s TYR 228 CO 0.01 0.25 1.04 0.99 -1.11 0.00 0.00 175.55 176.73 1a0l s THR 229 N -2.49 4.68 -0.26 -0.71 2.01 0.06 -0.48 115.64 118.44 1a0l s THR 229 Ca 0.16 1.96 -0.29 0.00 0.31 0.00 0.00 61.69 63.82 1a0l s THR 229 Cb -0.03 -4.26 -0.02 0.00 0.01 0.00 0.00 72.50 68.21 1a0l s THR 229 CO 0.05 0.01 1.52 -0.60 -0.69 0.00 0.00 174.62 174.91 1a0l s ARG 230 N 1.99 3.79 0.11 4.92 3.52 -0.59 -2.09 118.95 130.59 1a0l s ARG 230 Ca 0.50 1.48 -0.18 0.00 -0.13 0.00 0.00 55.73 57.40 1a0l s ARG 230 Cb -0.20 -4.00 -0.05 0.00 -1.56 0.00 0.00 34.95 29.14 1a0l s ARG 230 CO 0.19 -1.30 1.60 0.28 -0.81 0.00 0.00 175.30 175.27 1a0l h VAL 231 N 6.15 1.22 -1.01 7.11 2.07 -1.25 -3.13 116.25 127.41 1a0l h VAL 231 Ca -0.31 -0.72 0.29 0.00 0.82 0.00 0.00 66.70 66.79 1a0l h VAL 231 Cb 1.13 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 31.98 1a0l h VAL 231 CO 1.02 0.24 0.74 0.71 0.02 0.00 0.00 177.57 180.29 1a0l h THR 232 N 0.32 0.48 -0.72 2.57 1.35 -1.87 -0.02 112.91 115.03 1a0l h THR 232 Ca 0.09 0.00 -0.07 0.00 -0.55 0.00 0.00 66.41 65.89 1a0l h THR 232 Cb 0.29 0.49 -0.03 0.00 -1.73 0.00 0.00 68.15 67.16 1a0l h THR 232 CO 0.00 0.00 0.19 0.22 -0.25 0.00 0.00 175.52 175.68 1a0l h TYR 233 N 0.00 1.18 -0.55 4.73 5.03 -1.91 -2.74 116.97 122.72 1a0l h TYR 233 Ca 0.48 -0.13 0.00 0.00 2.58 0.00 0.00 58.73 61.66 1a0l h TYR 233 Cb 1.95 -0.34 0.00 0.00 1.55 0.00 0.00 36.73 39.89 1a0l h TYR 233 CO 0.00 0.95 0.00 0.66 -1.32 0.00 0.00 178.16 178.45 1a0l n TYR 234 N -4.24 1.34 -0.12 -3.82 4.01 -0.10 -4.58 117.16 109.66 1a0l n TYR 234 Ca 0.05 -0.65 -0.05 0.00 -0.16 0.00 0.00 57.90 57.10 1a0l n TYR 234 Cb 0.25 -0.25 0.02 0.00 -0.31 0.00 0.00 39.34 39.05 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 3.49 -0.24 0.32 7.72 5.85 -1.02 -0.75 115.31 130.69 1a0l h LEU 235 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1a0l h LEU 235 Cb 1.42 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.61 1a0l h LEU 235 CO 0.23 -0.08 -0.46 0.44 -0.34 0.00 0.00 178.44 178.23 1a0l h ASP 236 N 0.06 -1.32 -0.64 1.25 5.19 -1.81 -1.91 116.42 117.25 1a0l h ASP 236 Ca 0.19 0.12 0.12 0.00 -0.62 0.00 0.00 57.03 56.85 1a0l h ASP 236 Cb 0.28 0.46 -0.09 0.00 0.18 0.00 0.00 39.33 40.17 1a0l h ASP 236 CO -0.36 -0.58 0.17 -0.25 -3.12 0.00 0.00 179.24 175.11 1a0l h TRP 237 N -0.84 0.29 -0.12 4.55 7.01 -1.79 -0.66 115.95 124.40 1a0l h TRP 237 Ca -0.03 0.04 0.04 0.00 2.11 0.00 0.00 58.89 61.05 1a0l h TRP 237 Cb 0.78 -0.03 -0.05 0.00 -2.10 0.00 0.00 29.16 27.76 1a0l h TRP 237 CO -0.31 -0.00 -0.19 0.82 -2.79 0.00 0.00 178.44 175.97 1a0l h ILE 238 N 0.31 0.53 0.00 2.65 2.04 -0.93 -1.24 117.51 120.87 1a0l h ILE 238 Ca 0.34 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.20 1a0l h ILE 238 Cb 0.50 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 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 -0.24 0.00 0.00 1.37 3.86 -0.35 0.12 115.15 119.91 1a0l h HIS 239 Ca 0.09 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.27 1a0l h HIS 239 Cb 0.38 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 1a0l h HIS 239 CO -0.29 0.00 -0.17 0.45 0.86 0.00 0.00 177.93 178.78 1a0l h HIS 240 N 0.00 0.00 0.00 2.45 3.86 -0.03 -3.27 115.15 118.15 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 0.16 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.60 1a0l h HIS 240 CO 0.00 0.17 -1.80 0.66 0.86 0.00 0.00 177.93 177.83 1a0l n TYR 241 N -3.72 0.00 -3.30 2.45 4.01 -0.44 -4.95 117.16 111.21 1a0l n TYR 241 Ca -0.02 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.31 1a0l n TYR 241 Cb 0.29 -0.55 -0.08 0.00 -0.31 0.00 0.00 39.34 38.68 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 -2.28 5.07 0.72 -0.72 1.01 0.30 -5.07 120.40 119.42 1a0l s VAL 242 Ca -0.15 0.16 -0.14 0.00 0.00 0.00 0.00 61.98 61.85 1a0l s VAL 242 Cb 0.04 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.52 1a0l s VAL 242 CO 0.37 -0.21 1.15 -2.16 0.00 0.00 0.00 175.10 174.24 1a0l s PRO 243 N 2.26 2.34 -0.60 2.72 0.04 -1.26 -4.38 135.00 136.12 1a0l s PRO 243 Ca 0.16 1.53 -0.28 0.00 0.04 0.00 0.00 61.00 62.45 1a0l s PRO 243 Cb -0.16 -1.88 0.02 0.00 0.04 0.00 0.00 34.50 32.52 1a0l s PRO 243 CO 0.13 -1.63 1.35 0.15 0.04 0.00 0.00 177.00 177.04 1a0l s LYS 244 N -4.14 3.32 0.00 4.56 1.02 -1.26 -5.06 119.74 118.18 1a0l s LYS 244 Ca 0.69 0.29 0.00 0.00 0.02 0.00 0.00 55.97 56.97 1a0l s LYS 244 Cb -0.24 -4.11 0.00 0.00 -0.52 0.00 0.00 37.83 32.96 1a0l s LYS 244 CO 0.46 -1.93 0.00 1.17 -0.92 0.00 0.00 175.35 174.12