#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y0l s VAL 2 N 0.00 4.76 -0.03 6.31 1.01 -1.26 -3.73 120.40 127.45 1y0l s VAL 2 Ca 0.00 2.04 0.01 0.00 0.00 0.00 0.00 61.98 64.03 1y0l s VAL 2 Cb 0.00 -4.30 0.01 0.00 0.00 0.00 0.00 36.38 32.09 1y0l s VAL 2 CO 0.00 0.19 -0.06 -0.54 0.00 0.00 0.00 175.10 174.69 1y0l s LYS 3 N 0.81 0.80 -0.19 2.72 1.02 0.83 -4.98 119.74 120.75 1y0l s LYS 3 Ca 0.51 -0.16 -0.01 0.00 0.02 0.00 0.00 55.97 56.33 1y0l s LYS 3 Cb -0.22 -0.78 0.05 0.00 -0.52 0.00 0.00 37.83 36.36 1y0l s LYS 3 CO 0.28 -0.01 -0.00 -0.51 -0.92 0.00 0.00 175.35 174.19 1y0l s LEU 4 N 0.59 1.57 -0.24 3.17 1.43 -1.26 -1.77 118.68 122.17 1y0l s LEU 4 Ca -0.08 -0.84 0.01 0.00 -1.03 0.00 0.00 54.13 52.19 1y0l s LEU 4 Cb -0.11 -0.79 0.04 0.00 0.03 0.00 0.00 46.19 45.36 1y0l s LEU 4 CO 0.00 -0.26 -0.11 -0.76 0.23 0.00 0.00 176.35 175.45 1y0l s LEU 5 N 1.71 3.12 0.36 1.79 1.43 -0.39 -4.26 118.68 122.44 1y0l s LEU 5 Ca -0.02 -1.10 -0.09 0.00 -1.03 0.00 0.00 54.13 51.89 1y0l s LEU 5 Cb -0.17 -1.57 -0.06 0.00 0.03 0.00 0.00 46.19 44.42 1y0l s LEU 5 CO -0.07 -0.14 0.70 -1.61 0.23 0.00 0.00 176.35 175.46 1y0l s GLU 6 N 1.20 3.75 0.18 1.70 8.01 -1.26 -1.05 118.70 131.24 1y0l s GLU 6 Ca -0.03 0.34 -0.15 0.00 0.01 0.00 0.00 54.97 55.14 1y0l s GLU 6 Cb -0.18 -2.47 0.02 0.00 -4.31 0.00 0.00 34.13 27.19 1y0l s GLU 6 CO -0.06 0.05 0.45 -1.12 0.01 0.00 0.00 175.26 174.59 1y0l s SER 7 N -3.10 -0.17 0.00 -0.19 0.01 -0.48 -4.83 113.70 104.94 1y0l s SER 7 Ca 0.49 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 57.16 1y0l s SER 7 Cb -0.10 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.66 1y0l s SER 7 CO 0.30 -1.00 0.00 0.61 0.41 0.00 0.00 173.24 173.56 1y0l n GLY 8 N -0.30 0.49 3.75 3.44 0.00 -1.26 -1.25 105.19 110.06 1y0l n GLY 8 Ca -0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 1y0l n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1y0l s GLY 9 N -1.15 1.60 0.00 -0.02 0.00 -1.26 -4.73 107.32 101.76 1y0l s GLY 9 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.07 1y0l s GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.10 173.71 1y0l n GLY 10 N -1.96 0.20 3.73 0.20 0.00 0.84 -4.95 105.19 103.25 1y0l n GLY 10 Ca 0.08 -1.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.12 1y0l n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1y0l s LEU 11 N 0.00 4.32 0.14 0.99 2.96 -1.26 -0.91 118.68 124.92 1y0l s LEU 11 Ca 0.00 1.00 0.06 0.00 -0.22 0.00 0.00 54.13 54.97 1y0l s LEU 11 Cb 0.00 -2.87 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 1y0l s LEU 11 CO 0.00 -0.02 -0.13 0.00 -1.32 0.00 0.00 176.35 174.88 1y0l s ALA 12 N 0.52 1.54 0.07 5.97 0.00 0.06 -4.96 121.76 124.96 1y0l s ALA 12 Ca 0.31 -1.39 -0.13 0.00 0.00 0.00 0.00 51.96 50.75 1y0l s ALA 12 Cb -0.17 -0.04 -0.06 0.00 0.00 0.00 0.00 23.12 22.85 1y0l s ALA 12 CO 0.14 0.04 0.45 -0.65 0.00 0.00 0.00 175.76 175.74 1y0l s GLN 13 N -3.07 3.89 0.26 0.00 -0.21 -1.26 -1.13 119.66 118.15 1y0l s GLN 13 Ca 0.12 0.36 -0.30 0.00 0.02 0.00 0.00 55.36 55.56 1y0l s GLN 13 Cb -0.02 -3.07 -0.13 0.00 1.00 0.00 0.00 33.01 30.78 1y0l s GLN 13 CO 0.03 0.59 1.35 -0.35 -2.12 0.00 0.00 175.29 174.79 1y0l n PRO 14 N 1.25 1.99 0.00 2.91 -0.04 -1.26 -1.07 135.00 138.77 1y0l n PRO 14 Ca -0.10 0.70 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 1y0l n PRO 14 Cb 0.52 -2.32 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 1y0l n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1y0l n GLY 15 N 1.79 2.56 0.00 0.55 0.00 0.37 -4.90 105.19 105.56 1y0l n GLY 15 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1y0l n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y0l n GLY 16 N -2.00 -1.26 3.19 -0.02 0.00 -0.23 -3.94 105.19 100.92 1y0l n GLY 16 Ca 0.00 -1.64 -0.12 0.00 0.00 0.00 0.00 46.02 44.26 1y0l n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y0l s SER 17 N -1.06 1.31 -0.03 1.61 1.04 -1.26 -1.56 113.70 113.75 1y0l s SER 17 Ca 0.00 -0.99 -0.12 0.00 0.48 0.00 0.00 55.95 55.33 1y0l s SER 17 Cb 0.00 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.20 1y0l s SER 17 CO 0.00 -0.42 0.26 -0.22 0.98 0.00 0.00 173.24 173.84 1y0l s LEU 18 N -3.01 1.06 -0.21 2.42 2.96 0.12 -4.97 118.68 117.05 1y0l s LEU 18 Ca 0.12 0.12 0.02 0.00 -0.22 0.00 0.00 54.13 54.17 1y0l s LEU 18 Cb 0.04 1.03 0.04 0.00 0.50 0.00 0.00 46.19 47.79 1y0l s LEU 18 CO -0.03 -0.34 -0.15 -0.75 -1.32 0.00 0.00 176.35 173.75 1y0l s LYS 19 N -0.98 2.58 0.11 1.98 2.47 -1.26 0.57 119.74 125.21 1y0l s LYS 19 Ca -0.11 -0.99 0.01 0.00 -1.56 0.00 0.00 55.97 53.33 1y0l s LYS 19 Cb -0.05 -2.63 -0.04 0.00 -1.46 0.00 0.00 37.83 33.65 1y0l s LYS 19 CO 0.03 -0.36 0.23 -0.51 0.16 0.00 0.00 175.35 174.90 1y0l s LEU 20 N 1.25 4.30 0.20 5.43 1.43 0.74 -4.69 118.68 127.34 1y0l s LEU 20 Ca -0.00 0.19 0.00 0.00 -1.03 0.00 0.00 54.13 53.29 1y0l s LEU 20 Cb -0.16 -2.89 -0.04 0.00 0.03 0.00 0.00 46.19 43.13 1y0l s LEU 20 CO -0.10 0.11 0.08 -0.94 0.23 0.00 0.00 176.35 175.74 1y0l s SER 21 N -2.86 0.72 -0.11 2.29 1.04 -0.38 -1.46 113.70 112.94 1y0l s SER 21 Ca 0.34 -1.32 -0.06 0.00 0.48 0.00 0.00 55.95 55.39 1y0l s SER 21 Cb -0.12 0.25 0.05 0.00 0.10 0.00 0.00 66.02 66.29 1y0l s SER 21 CO 0.28 -0.74 0.26 0.00 0.98 0.00 0.00 173.24 174.02 1y0l s ALA 23 N 1.16 3.55 0.08 0.00 0.00 -0.21 -1.42 121.76 124.92 1y0l s ALA 23 Ca -0.08 -0.72 0.09 0.00 0.00 0.00 0.00 51.96 51.25 1y0l s ALA 23 Cb -0.09 -2.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 1y0l s ALA 23 CO -0.08 0.20 -0.22 0.00 0.00 0.00 0.00 175.76 175.66 1y0l s ALA 24 N 0.29 2.50 0.15 0.00 0.00 -0.16 -1.26 121.76 123.28 1y0l s ALA 24 Ca 0.06 -1.31 -0.23 0.00 0.00 0.00 0.00 51.96 50.47 1y0l s ALA 24 Cb -0.12 -0.58 0.07 0.00 0.00 0.00 0.00 23.12 22.49 1y0l s ALA 24 CO -0.01 0.56 0.64 -1.54 0.00 0.00 0.00 175.76 175.41 1y0l s SER 25 N -1.71 -0.53 0.00 0.00 1.04 -0.73 -4.83 113.70 106.94 1y0l s SER 25 Ca 0.15 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.53 1y0l s SER 25 Cb -0.10 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1y0l s SER 25 CO 0.06 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.92 1y0l n GLY 26 N -0.38 0.70 3.69 7.32 0.00 -1.24 -0.12 105.19 115.16 1y0l n GLY 26 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 1y0l n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1y0l s PHE 27 N -2.27 -0.30 -1.29 1.61 -0.71 -1.26 -4.44 117.98 109.32 1y0l s PHE 27 Ca 0.00 -0.04 -0.18 0.00 -1.04 0.00 0.00 56.93 55.66 1y0l s PHE 27 Cb 0.00 0.64 0.06 0.00 -1.21 0.00 0.00 43.02 42.52 1y0l s PHE 27 CO 0.00 -1.03 1.73 0.34 -1.34 0.00 0.00 175.22 174.92 1y0l s ASP 28 N -2.84 6.78 0.32 1.98 -1.08 -1.26 -4.84 116.67 115.71 1y0l s ASP 28 Ca 0.08 -2.39 0.05 0.00 -0.52 0.00 0.00 52.55 49.77 1y0l s ASP 28 Cb -0.04 -2.58 0.84 0.00 -1.46 0.00 0.00 42.92 39.69 1y0l s ASP 28 CO -0.01 -1.24 1.58 0.15 0.52 0.00 0.00 175.17 176.18 1y0l h PHE 29 N 7.72 0.13 0.00 -5.34 3.57 -1.95 0.93 116.94 122.01 1y0l h PHE 29 Ca 0.43 0.06 0.00 0.00 3.53 0.00 0.00 57.97 62.00 1y0l h PHE 29 Cb 0.88 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.72 1y0l h PHE 29 CO 1.42 -0.42 0.00 2.89 -2.23 0.00 0.00 178.31 179.97 1y0l n ARG 30 N -5.43 0.05 -0.07 1.11 1.85 -1.26 -1.89 116.66 111.02 1y0l n ARG 30 Ca 0.25 0.50 0.10 0.00 -1.00 0.00 0.00 57.85 57.71 1y0l n ARG 30 Cb 0.84 -1.66 0.13 0.00 -1.05 0.00 0.00 32.46 30.72 1y0l n ARG 30 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1y0l n ARG 31 N -1.77 2.04 -4.44 2.89 3.00 0.32 -4.71 116.66 114.00 1y0l n ARG 31 Ca 0.00 -1.89 -0.29 0.00 -0.01 0.00 0.00 57.85 55.66 1y0l n ARG 31 Cb 0.05 -1.41 -0.13 0.00 0.00 0.00 0.00 32.46 30.96 1y0l n ARG 31 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1y0l s TYR 32 N -1.54 2.32 0.33 -1.55 1.51 -0.79 -4.90 117.35 112.73 1y0l s TYR 32 Ca 0.28 -0.38 -0.26 0.00 -1.01 0.00 0.00 57.07 55.70 1y0l s TYR 32 Cb 0.18 -1.27 -0.10 0.00 -0.11 0.00 0.00 41.96 40.66 1y0l s TYR 32 CO 0.26 0.32 0.96 -1.58 -1.11 0.00 0.00 175.55 174.40 1y0l s TRP 33 N -1.04 3.65 0.21 2.71 0.52 -1.25 -3.95 118.94 119.80 1y0l s TRP 33 Ca 0.14 1.77 0.10 0.00 0.02 0.00 0.00 56.10 58.13 1y0l s TRP 33 Cb -0.10 -2.95 -0.04 0.00 -1.15 0.00 0.00 33.47 29.22 1y0l s TRP 33 CO 0.06 0.11 -0.20 -1.64 0.02 0.00 0.00 176.95 175.29 1y0l s MET 34 N -2.07 1.46 0.03 4.98 -1.94 -0.52 -1.82 119.30 119.42 1y0l s MET 34 Ca 0.51 -1.55 -0.02 0.00 -1.71 0.00 0.00 55.69 52.92 1y0l s MET 34 Cb -0.19 -1.60 -0.02 0.00 2.01 0.00 0.00 34.83 35.02 1y0l s MET 34 CO 0.25 0.32 0.01 0.99 -0.01 0.00 0.00 175.02 176.58 1y0l s THR 35 N -2.10 0.15 -0.06 2.05 2.01 0.12 -1.49 115.64 116.32 1y0l s THR 35 Ca 0.21 -1.24 0.06 0.00 0.31 0.00 0.00 61.69 61.03 1y0l s THR 35 Cb -0.06 -0.83 -0.01 0.00 0.01 0.00 0.00 72.50 71.61 1y0l s THR 35 CO 0.10 -0.68 -0.23 0.26 -0.69 0.00 0.00 174.62 173.38 1y0l s TRP 36 N -2.54 2.49 0.02 4.92 0.52 -0.58 -0.28 118.94 123.49 1y0l s TRP 36 Ca -0.06 -0.60 0.01 0.00 0.02 0.00 0.00 56.10 55.48 1y0l s TRP 36 Cb -0.02 -1.61 -0.02 0.00 -1.15 0.00 0.00 33.47 30.68 1y0l s TRP 36 CO -0.05 -0.13 -0.04 0.08 0.02 0.00 0.00 176.95 176.83 1y0l s VAL 37 N -0.27 0.26 0.13 4.03 1.01 -0.68 -1.45 120.40 123.43 1y0l s VAL 37 Ca 0.00 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.20 1y0l s VAL 37 Cb -0.13 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 1y0l s VAL 37 CO 0.03 -0.36 -0.06 0.00 0.00 0.00 0.00 175.10 174.71 1y0l s ARG 38 N -1.22 0.98 -0.16 2.72 1.70 -0.36 0.95 118.95 123.56 1y0l s ARG 38 Ca -0.11 -1.43 -0.04 0.00 -0.47 0.00 0.00 55.73 53.68 1y0l s ARG 38 Cb -0.08 -0.35 0.07 0.00 -0.57 0.00 0.00 34.95 34.01 1y0l s ARG 38 CO -0.00 -0.02 0.14 -1.14 -1.08 0.00 0.00 175.30 173.19 1y0l s GLN 39 N -3.83 0.09 0.56 3.89 0.74 0.06 -0.63 119.66 120.54 1y0l s GLN 39 Ca 0.17 0.11 -0.09 0.00 0.05 0.00 0.00 55.36 55.59 1y0l s GLN 39 Cb 0.05 -1.38 -0.04 0.00 1.10 0.00 0.00 33.01 32.74 1y0l s GLN 39 CO -0.01 -0.61 0.94 0.00 -0.55 0.00 0.00 175.29 175.07 1y0l s ALA 40 N 2.22 3.21 0.22 1.58 0.00 -1.26 -1.18 121.76 126.55 1y0l s ALA 40 Ca 0.04 -0.23 -0.32 0.00 0.00 0.00 0.00 51.96 51.45 1y0l s ALA 40 Cb -0.15 -2.90 -0.13 0.00 0.00 0.00 0.00 23.12 19.93 1y0l s ALA 40 CO -0.09 -0.54 1.53 -2.30 0.00 0.00 0.00 175.76 174.36 1y0l n PRO 41 N -2.52 2.29 -1.25 0.00 -0.02 -1.26 -1.55 135.00 130.70 1y0l n PRO 41 Ca 0.04 0.82 -0.09 0.00 -2.02 0.00 0.00 63.50 62.25 1y0l n PRO 41 Cb 0.54 -2.56 -0.04 0.00 -0.02 0.00 0.00 33.50 31.43 1y0l n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y0l n GLY 42 N 2.74 0.96 3.49 -1.23 0.00 -1.26 -4.98 105.19 104.90 1y0l n GLY 42 Ca 0.13 -0.22 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 1y0l n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y0l s LYS 43 N -2.47 1.74 0.05 1.61 -0.14 -0.59 -5.16 119.74 114.78 1y0l s LYS 43 Ca 0.00 -1.99 -0.00 0.00 -1.36 0.00 0.00 55.97 52.62 1y0l s LYS 43 Cb 0.00 -0.95 0.01 0.00 -1.68 0.00 0.00 37.83 35.21 1y0l s LYS 43 CO 0.00 -0.21 0.07 0.41 -0.76 0.00 0.00 175.35 174.85 1y0l n GLY 44 N -0.77 0.68 3.77 -3.33 0.00 -1.26 -4.62 105.19 99.65 1y0l n GLY 44 Ca -0.04 -1.95 -0.37 0.00 0.00 0.00 0.00 46.02 43.66 1y0l n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y0l s LEU 45 N 0.00 4.07 -0.11 0.99 1.43 -1.26 -4.36 118.68 119.44 1y0l s LEU 45 Ca 0.05 2.35 -0.02 0.00 -1.03 0.00 0.00 54.13 55.47 1y0l s LEU 45 Cb -0.00 -4.17 0.04 0.00 0.03 0.00 0.00 46.19 42.09 1y0l s LEU 45 CO 0.03 -0.87 0.02 -0.70 0.23 0.00 0.00 176.35 175.07 1y0l s GLU 46 N -2.58 0.51 0.14 1.70 2.12 0.20 -4.98 118.70 115.82 1y0l s GLU 46 Ca 0.62 -0.03 -0.31 0.00 0.36 0.00 0.00 54.97 55.61 1y0l s GLU 46 Cb -0.30 -1.32 -0.09 0.00 0.26 0.00 0.00 34.13 32.68 1y0l s GLU 46 CO 0.37 -0.43 1.50 -0.46 -0.54 0.00 0.00 175.26 175.70 1y0l s TRP 47 N 1.97 3.12 -0.28 5.30 -0.00 -1.26 -1.22 118.94 126.58 1y0l s TRP 47 Ca 0.03 0.74 -0.13 0.00 -0.00 0.00 0.00 56.10 56.75 1y0l s TRP 47 Cb -0.14 -3.84 -0.13 0.00 -0.00 0.00 0.00 33.47 29.37 1y0l s TRP 47 CO -0.06 -3.04 -0.33 -0.89 -0.00 0.00 0.00 176.95 172.63 1y0l n ILE 48 N 3.97 1.53 -0.15 5.86 5.41 -0.53 -4.59 119.36 130.86 1y0l n ILE 48 Ca 0.13 -0.40 0.00 0.00 1.00 0.00 0.00 62.75 63.48 1y0l n ILE 48 Cb 0.40 -1.84 0.00 0.00 -0.71 0.00 0.00 39.64 37.49 1y0l n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1y0l n GLY 49 N 1.36 -1.72 3.30 7.39 0.00 -1.16 -1.13 105.19 113.23 1y0l n GLY 49 Ca -0.53 -1.11 -0.10 0.00 0.00 0.00 0.00 46.02 44.27 1y0l n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1y0l s GLU 50 N -1.94 1.14 -0.10 1.61 -1.05 -0.37 -1.52 118.70 116.47 1y0l s GLU 50 Ca 0.00 -1.30 -0.07 0.00 -0.15 0.00 0.00 54.97 53.45 1y0l s GLU 50 Cb 0.00 0.34 0.04 0.00 -0.44 0.00 0.00 34.13 34.07 1y0l s GLU 50 CO 0.00 -0.40 0.25 -1.50 0.95 0.00 0.00 175.26 174.57 1y0l s ILE 51 N -4.02 -0.03 0.84 1.83 2.07 -0.56 -2.18 121.20 119.17 1y0l s ILE 51 Ca 0.22 0.09 -0.13 0.00 -1.41 0.00 0.00 60.65 59.43 1y0l s ILE 51 Cb 0.04 -0.38 0.11 0.00 0.13 0.00 0.00 42.46 42.37 1y0l s ILE 51 CO 0.03 0.04 1.21 0.54 -1.91 0.00 0.00 174.94 174.84 1y0l s ASN 52 N 0.87 4.14 0.22 4.50 4.22 -0.64 -1.44 114.94 126.81 1y0l s ASN 52 Ca -0.06 0.60 -0.11 0.00 -2.14 0.00 0.00 52.86 51.15 1y0l s ASN 52 Cb -0.07 -0.98 0.31 0.00 1.28 0.00 0.00 41.25 41.79 1y0l s ASN 52 CO -0.06 -2.11 1.64 -0.65 -2.04 0.00 0.00 177.10 173.88 1y0l h PRO 52 N -1.18 0.06 -0.53 3.55 0.11 -1.84 -2.38 132.00 129.78 1y0l h PRO 52 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1y0l h PRO 52 Cb 1.30 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1y0l h PRO 52 CO 0.58 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 178.01 1y0l n ASP 53 N -5.36 2.65 0.00 -2.05 5.68 -1.26 -4.92 116.55 111.29 1y0l n ASP 53 Ca 0.10 -2.18 0.00 0.00 -0.50 0.00 0.00 54.79 52.21 1y0l n ASP 53 Cb 0.38 -0.39 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 1y0l n ASP 53 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1y0l n SER 54 N 0.55 -0.82 0.23 -1.12 7.64 -0.90 -4.80 113.62 114.41 1y0l n SER 54 Ca 0.14 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.14 1y0l n SER 54 Cb 0.49 -2.38 0.43 0.00 -1.01 0.00 0.00 64.21 61.74 1y0l n SER 54 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1y0l h ARG 55 N 0.28 0.00 -4.99 1.43 3.08 -1.91 -3.42 114.38 108.84 1y0l h ARG 55 Ca 0.00 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.41 1y0l h ARG 55 Cb 0.13 0.00 -0.35 0.00 0.08 0.00 0.00 29.97 29.83 1y0l h ARG 55 CO 0.00 0.15 -0.85 0.99 -1.07 0.00 0.00 179.97 179.19 1y0l s THR 56 N -3.51 1.87 -0.05 2.04 2.01 -1.26 -5.06 115.64 111.68 1y0l s THR 56 Ca 0.02 -0.85 -0.02 0.00 0.31 0.00 0.00 61.69 61.16 1y0l s THR 56 Cb 0.09 -1.69 0.03 0.00 0.01 0.00 0.00 72.50 70.94 1y0l s THR 56 CO 0.63 0.51 0.04 -0.63 -0.69 0.00 0.00 174.62 174.47 1y0l s ILE 57 N 1.07 0.10 -0.01 1.82 1.01 -1.26 -1.61 121.20 122.32 1y0l s ILE 57 Ca -0.02 0.29 0.05 0.00 0.00 0.00 0.00 60.65 60.97 1y0l s ILE 57 Cb -0.14 -0.32 -0.03 0.00 0.01 0.00 0.00 42.46 41.98 1y0l s ILE 57 CO -0.06 0.21 -0.15 0.20 0.00 0.00 0.00 174.94 175.14 1y0l s ASN 58 N 2.09 3.97 0.29 3.58 0.01 -0.92 -4.98 114.94 118.97 1y0l s ASN 58 Ca 0.05 -0.28 0.07 0.00 -0.71 0.00 0.00 52.86 51.98 1y0l s ASN 58 Cb -0.12 -0.77 -0.06 0.00 0.41 0.00 0.00 41.25 40.71 1y0l s ASN 58 CO -0.04 0.31 -0.05 -0.31 -1.51 0.00 0.00 177.10 175.49 1y0l s TYR 59 N -0.82 2.01 0.50 2.20 2.02 -1.26 -1.23 117.35 120.76 1y0l s TYR 59 Ca 0.13 -0.69 -0.19 0.00 -0.37 0.00 0.00 57.07 55.95 1y0l s TYR 59 Cb -0.11 -1.16 -0.08 0.00 -0.40 0.00 0.00 41.96 40.21 1y0l s TYR 59 CO 0.03 0.30 1.02 0.00 -1.57 0.00 0.00 175.55 175.33 1y0l s MET 60 N -3.72 3.83 -0.13 -0.62 0.23 -0.28 -4.92 119.30 113.69 1y0l s MET 60 Ca 0.30 1.24 -0.35 0.00 -1.03 0.00 0.00 55.69 55.85 1y0l s MET 60 Cb 0.04 -2.11 -0.12 0.00 -1.53 0.00 0.00 34.83 31.12 1y0l s MET 60 CO 0.13 -0.39 1.91 -2.30 -2.03 0.00 0.00 175.02 172.33 1y0l n PRO 61 N -1.14 2.02 -2.08 3.16 -0.02 -1.26 -4.87 135.00 130.80 1y0l n PRO 61 Ca 0.08 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1y0l n PRO 61 Cb 0.53 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1y0l n PRO 61 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1y0l n SER 62 N 6.96 -0.27 -4.73 2.55 3.41 -1.26 -5.15 113.62 115.13 1y0l n SER 62 Ca 0.24 -1.10 -0.41 0.00 -0.26 0.00 0.00 58.87 57.34 1y0l n SER 62 Cb 0.28 0.44 -0.05 0.00 -0.26 0.00 0.00 64.21 64.62 1y0l n SER 62 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1y0l s LEU 63 N 0.00 4.52 0.39 1.04 1.02 -1.26 -4.98 118.68 119.40 1y0l s LEU 63 Ca 0.05 1.78 -0.23 0.00 0.02 0.00 0.00 54.13 55.74 1y0l s LEU 63 Cb -0.00 -3.55 -0.13 0.00 0.02 0.00 0.00 46.19 42.52 1y0l s LEU 63 CO 0.00 -0.02 0.57 0.29 0.02 0.00 0.00 176.35 177.22 1y0l n LYS 64 N 2.59 0.58 -1.17 1.70 5.02 -1.26 -1.69 118.16 123.94 1y0l n LYS 64 Ca 0.01 0.21 -0.06 0.00 -2.02 0.00 0.00 58.31 56.45 1y0l n LYS 64 Cb 0.49 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 34.00 1y0l n LYS 64 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1y0l n ASP 65 N 1.38 -5.59 -0.19 4.39 9.92 -1.26 -4.79 116.55 120.41 1y0l n ASP 65 Ca 0.12 0.14 -0.09 0.00 -0.53 0.00 0.00 54.79 54.43 1y0l n ASP 65 Cb 0.37 -3.61 0.01 0.00 -0.64 0.00 0.00 41.12 37.26 1y0l n ASP 65 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 1y0l h LYS 66 N 0.06 0.91 -5.70 -1.24 3.11 -1.67 -3.43 116.57 108.61 1y0l h LYS 66 Ca -0.12 -0.26 -0.56 0.00 -2.81 0.00 0.00 60.65 56.90 1y0l h LYS 66 Cb 1.01 -0.10 -0.30 0.00 -1.00 0.00 0.00 32.23 31.85 1y0l h LYS 66 CO 0.17 0.90 -0.84 -0.06 -2.81 0.00 0.00 179.45 176.82 1y0l s PHE 67 N -5.13 1.64 -0.15 1.91 0.08 -1.26 -2.65 117.98 112.42 1y0l s PHE 67 Ca -0.12 -0.32 -0.01 0.00 0.12 0.00 0.00 56.93 56.59 1y0l s PHE 67 Cb 0.12 -1.06 0.04 0.00 -0.57 0.00 0.00 43.02 41.56 1y0l s PHE 67 CO 0.82 -0.04 -0.02 0.42 -0.10 0.00 0.00 175.22 176.30 1y0l s ILE 68 N -0.38 0.85 -0.11 0.64 1.01 -0.80 -4.98 121.20 117.42 1y0l s ILE 68 Ca 0.06 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.19 1y0l s ILE 68 Cb -0.07 -1.09 -0.04 0.00 0.01 0.00 0.00 42.46 41.27 1y0l s ILE 68 CO -0.00 0.08 0.09 -0.63 0.00 0.00 0.00 174.94 174.48 1y0l s ILE 69 N 1.74 5.05 0.25 2.92 1.01 -1.26 -0.79 121.20 130.12 1y0l s ILE 69 Ca 0.01 0.04 -0.11 0.00 0.00 0.00 0.00 60.65 60.59 1y0l s ILE 69 Cb -0.15 -3.19 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 1y0l s ILE 69 CO -0.07 0.60 0.45 -0.94 0.00 0.00 0.00 174.94 174.98 1y0l s SER 70 N -0.86 -0.04 0.11 3.58 1.04 -0.75 -5.02 113.70 111.76 1y0l s SER 70 Ca 0.14 -0.99 -0.11 0.00 0.48 0.00 0.00 55.95 55.46 1y0l s SER 70 Cb -0.12 0.57 0.01 0.00 0.10 0.00 0.00 66.02 66.59 1y0l s SER 70 CO 0.03 -1.12 0.28 0.00 0.98 0.00 0.00 173.24 173.40 1y0l s ARG 71 N -3.99 0.95 -0.35 4.02 1.70 -1.26 -0.33 118.95 119.69 1y0l s ARG 71 Ca 0.24 -0.88 -0.00 0.00 -0.47 0.00 0.00 55.73 54.62 1y0l s ARG 71 Cb -0.00 0.39 0.12 0.00 -0.57 0.00 0.00 34.95 34.89 1y0l s ARG 71 CO 0.10 -0.34 0.16 0.34 -1.08 0.00 0.00 175.30 174.48 1y0l s ASP 72 N -2.85 3.65 0.44 -2.89 -1.08 -0.59 -5.00 116.67 108.36 1y0l s ASP 72 Ca 0.05 -1.94 0.11 0.00 -0.52 0.00 0.00 52.55 50.24 1y0l s ASP 72 Cb 0.04 -0.73 0.99 0.00 -1.46 0.00 0.00 42.92 41.75 1y0l s ASP 72 CO -0.11 -0.36 2.06 0.78 0.52 0.00 0.00 175.17 178.06 1y0l h ASN 73 N 7.58 0.35 -0.14 -0.34 2.35 -1.93 -1.81 115.58 121.64 1y0l h ASN 73 Ca -0.07 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 1y0l h ASN 73 Cb 0.98 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.26 1y0l h ASN 73 CO 0.43 0.24 -0.01 0.00 -1.65 0.00 0.00 177.43 176.44 1y0l h ALA 74 N 1.78 1.52 -0.50 -0.83 0.00 -1.96 -2.77 119.26 116.50 1y0l h ALA 74 Ca 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1y0l h ALA 74 Cb 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1y0l h ALA 74 CO -0.03 0.35 0.00 1.63 0.00 0.00 0.00 179.25 181.20 1y0l n LYS 75 N -4.32 3.25 -4.15 0.00 5.02 -0.74 -4.97 118.16 112.23 1y0l n LYS 75 Ca 0.01 -2.62 -0.30 0.00 -2.02 0.00 0.00 58.31 53.38 1y0l n LYS 75 Cb 0.21 -1.67 -0.05 0.00 -0.02 0.00 0.00 35.03 33.50 1y0l n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1y0l n ASN 76 N 0.70 -0.45 -4.26 4.39 4.13 -0.81 -4.80 115.26 114.16 1y0l n ASN 76 Ca 0.21 -1.11 -0.22 0.00 1.68 0.00 0.00 54.58 55.13 1y0l n ASN 76 Cb 0.73 -2.44 -0.12 0.00 -1.54 0.00 0.00 39.78 36.41 1y0l n ASN 76 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1y0l s SER 77 N -4.14 2.30 0.00 6.41 0.01 -1.03 -0.99 113.70 116.26 1y0l s SER 77 Ca 0.17 -0.69 0.07 0.00 1.31 0.00 0.00 55.95 56.81 1y0l s SER 77 Cb -0.09 -0.11 -0.02 0.00 0.21 0.00 0.00 66.02 66.00 1y0l s SER 77 CO 0.94 0.01 -0.20 -0.22 0.41 0.00 0.00 173.24 174.17 1y0l s LEU 78 N -1.95 2.08 0.05 2.44 2.96 -0.51 -1.54 118.68 122.22 1y0l s LEU 78 Ca 0.05 -0.42 0.06 0.00 -0.22 0.00 0.00 54.13 53.60 1y0l s LEU 78 Cb -0.09 -1.02 -0.02 0.00 0.50 0.00 0.00 46.19 45.55 1y0l s LEU 78 CO 0.04 0.22 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.81 1y0l s TYR 79 N -0.58 1.46 -0.09 5.38 2.02 0.55 -0.51 117.35 125.57 1y0l s TYR 79 Ca 0.08 -0.38 -0.02 0.00 -0.37 0.00 0.00 57.07 56.38 1y0l s TYR 79 Cb -0.08 -0.85 0.03 0.00 -0.40 0.00 0.00 41.96 40.66 1y0l s TYR 79 CO 0.00 0.07 0.02 -1.17 -1.57 0.00 0.00 175.55 172.90 1y0l s LEU 80 N -1.30 0.60 -0.33 -1.29 2.96 -0.54 -1.82 118.68 116.97 1y0l s LEU 80 Ca 0.03 -0.19 -0.11 0.00 -0.22 0.00 0.00 54.13 53.64 1y0l s LEU 80 Cb -0.09 -0.41 -0.01 0.00 0.50 0.00 0.00 46.19 46.18 1y0l s LEU 80 CO 0.02 -0.22 0.20 -1.58 -1.32 0.00 0.00 176.35 173.45 1y0l s GLN 81 N 1.99 3.45 -0.10 1.98 2.00 0.03 -0.19 119.66 128.82 1y0l s GLN 81 Ca 0.04 -0.66 -0.04 0.00 -2.00 0.00 0.00 55.36 52.70 1y0l s GLN 81 Cb -0.13 -3.70 -0.04 0.00 0.80 0.00 0.00 33.01 29.94 1y0l s GLN 81 CO -0.06 -0.42 0.07 -0.51 -0.50 0.00 0.00 175.29 173.87 1y0l s LEU 82 N 1.68 3.98 0.14 3.68 1.43 0.19 -1.91 118.68 127.88 1y0l s LEU 82 Ca 0.06 0.31 -0.02 0.00 -1.03 0.00 0.00 54.13 53.44 1y0l s LEU 82 Cb -0.17 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 1y0l s LEU 82 CO 0.09 0.39 0.10 -0.94 0.23 0.00 0.00 176.35 176.22 1y0l s SER 82 N -0.96 0.26 -1.38 2.29 1.04 -1.08 0.13 113.70 113.99 1y0l s SER 82 Ca 0.14 -1.15 -0.05 0.00 0.48 0.00 0.00 55.95 55.37 1y0l s SER 82 Cb -0.12 0.32 0.03 0.00 0.10 0.00 0.00 66.02 66.36 1y0l s SER 82 CO 0.03 -0.76 0.82 -1.14 0.98 0.00 0.00 173.24 173.17 1y0l n ARG 82 N -0.12 -5.28 -1.78 4.02 0.63 -0.60 -4.86 116.66 108.68 1y0l n ARG 82 Ca -0.06 0.62 -0.41 0.00 -0.92 0.00 0.00 57.85 57.08 1y0l n ARG 82 Cb 0.64 -5.32 -0.01 0.00 0.45 0.00 0.00 32.46 28.21 1y0l n ARG 82 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1y0l s LEU 82 N -6.90 4.34 0.25 6.15 1.43 -0.73 -4.62 118.68 118.59 1y0l s LEU 82 Ca 0.25 2.98 0.02 0.00 -1.03 0.00 0.00 54.13 56.35 1y0l s LEU 82 Cb -0.12 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.40 1y0l s LEU 82 CO 0.81 -0.91 0.05 0.00 0.23 0.00 0.00 176.35 176.54 1y0l s ARG 83 N -0.87 1.38 0.40 1.70 1.70 -1.26 0.14 118.95 122.14 1y0l s ARG 83 Ca 0.61 -1.73 0.09 0.00 -0.47 0.00 0.00 55.73 54.23 1y0l s ARG 83 Cb -0.48 -0.42 0.88 0.00 -0.57 0.00 0.00 34.95 34.36 1y0l s ARG 83 CO 0.52 -0.21 1.98 0.66 -1.08 0.00 0.00 175.30 177.16 1y0l h SER 84 N 2.42 0.51 0.00 -2.89 4.64 -1.96 -0.48 113.55 115.79 1y0l h SER 84 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1y0l h SER 84 Cb 1.23 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1y0l h SER 84 CO 0.63 0.33 0.05 -0.33 -0.87 0.00 0.00 176.83 176.64 1y0l h GLU 85 N 0.58 0.00 -0.01 4.77 3.07 -1.96 0.55 114.58 121.58 1y0l h GLU 85 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 1y0l h GLU 85 Cb 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1y0l h GLU 85 CO -0.09 0.00 -0.20 -0.25 -1.40 0.00 0.00 179.01 177.08 1y0l n ASP 86 N -2.35 0.74 -4.69 1.42 8.00 -0.19 -4.86 116.55 114.62 1y0l n ASP 86 Ca -0.02 -0.69 -0.42 0.00 0.71 0.00 0.00 54.79 54.37 1y0l n ASP 86 Cb 0.09 0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 1y0l n ASP 86 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1y0l s SER 87 N -2.52 6.77 0.00 -2.24 0.01 0.18 -4.86 113.70 111.03 1y0l s SER 87 Ca 0.25 2.26 0.00 0.00 1.31 0.00 0.00 55.95 59.77 1y0l s SER 87 Cb 0.19 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.86 1y0l s SER 87 CO 0.51 -0.76 0.00 0.00 0.41 0.00 0.00 173.24 173.39 1y0l n ALA 88 N 5.25 0.00 -2.70 1.44 0.00 -0.03 -4.41 120.51 120.06 1y0l n ALA 88 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.20 1y0l n ALA 88 Cb 0.42 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.81 1y0l n ALA 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1y0l s LEU 89 N 0.00 4.22 -0.20 0.00 1.43 -0.33 -0.98 118.68 122.82 1y0l s LEU 89 Ca 0.00 0.64 -0.07 0.00 -1.03 0.00 0.00 54.13 53.68 1y0l s LEU 89 Cb 0.00 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 1y0l s LEU 89 CO 0.00 -0.03 0.04 -0.31 0.23 0.00 0.00 176.35 176.29 1y0l s TYR 90 N 0.93 3.15 -0.08 0.29 1.51 -0.16 -0.76 117.35 122.23 1y0l s TYR 90 Ca 0.22 -0.15 -0.01 0.00 -1.01 0.00 0.00 57.07 56.12 1y0l s TYR 90 Cb -0.15 -2.10 -0.03 0.00 -0.11 0.00 0.00 41.96 39.57 1y0l s TYR 90 CO 0.08 -0.04 -0.03 0.71 -1.11 0.00 0.00 175.55 175.16 1y0l s TYR 91 N 0.76 3.06 -0.25 2.71 2.02 0.27 -1.28 117.35 124.64 1y0l s TYR 91 Ca 0.02 0.09 -0.14 0.00 -0.37 0.00 0.00 57.07 56.67 1y0l s TYR 91 Cb -0.14 -1.77 -0.04 0.00 -0.40 0.00 0.00 41.96 39.61 1y0l s TYR 91 CO 0.02 0.38 0.33 0.00 -1.57 0.00 0.00 175.55 174.71 1y0l s VAL 93 N 1.67 0.87 -0.07 0.00 1.01 0.61 -0.91 120.40 123.58 1y0l s VAL 93 Ca 0.14 -0.65 -0.14 0.00 0.00 0.00 0.00 61.98 61.33 1y0l s VAL 93 Cb -0.15 -0.76 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 1y0l s VAL 93 CO 0.09 0.11 0.37 -0.60 0.00 0.00 0.00 175.10 175.07 1y0l s ARG 94 N -0.61 4.04 -0.27 2.72 3.52 -0.32 0.14 118.95 128.17 1y0l s ARG 94 Ca 0.02 0.29 -0.06 0.00 -0.13 0.00 0.00 55.73 55.85 1y0l s ARG 94 Cb -0.06 -3.31 -0.01 0.00 -1.56 0.00 0.00 34.95 30.02 1y0l s ARG 94 CO 0.00 0.49 0.05 -1.17 -0.81 0.00 0.00 175.30 173.86 1y0l s LEU 95 N -0.37 3.54 -0.31 -0.88 2.96 -0.76 -1.89 118.68 120.98 1y0l s LEU 95 Ca 0.22 -0.50 -0.25 0.00 -0.22 0.00 0.00 54.13 53.38 1y0l s LEU 95 Cb -0.15 -1.86 0.00 0.00 0.50 0.00 0.00 46.19 44.68 1y0l s LEU 95 CO 0.10 -0.11 0.85 -0.62 -1.32 0.00 0.00 176.35 175.24 1y0l s ASP 96 N 1.53 6.72 -0.49 3.68 2.15 0.72 -3.75 116.67 127.24 1y0l s ASP 96 Ca 0.04 0.75 -0.04 0.00 0.43 0.00 0.00 52.55 53.73 1y0l s ASP 96 Cb -0.16 -2.44 0.13 0.00 -0.30 0.00 0.00 42.92 40.15 1y0l s ASP 96 CO 0.02 -0.67 0.30 0.12 -0.17 0.00 0.00 175.17 174.77 1y0l s PHE 97 N 3.10 3.52 -0.47 -5.34 2.19 -1.26 -1.81 117.98 117.90 1y0l s PHE 97 Ca 0.35 -2.39 -0.06 0.00 0.33 0.00 0.00 56.93 55.16 1y0l s PHE 97 Cb -0.14 -3.28 0.12 0.00 -1.31 0.00 0.00 43.02 38.41 1y0l s PHE 97 CO 0.13 -0.94 0.31 0.34 1.83 0.00 0.00 175.22 176.89 1y0l s ASP 98 N 1.70 5.53 0.18 6.13 -1.08 -1.26 -4.94 116.67 122.93 1y0l s ASP 98 Ca 0.10 -2.06 0.25 0.00 -0.52 0.00 0.00 52.55 50.32 1y0l s ASP 98 Cb -0.22 -1.94 0.91 0.00 -1.46 0.00 0.00 42.92 40.20 1y0l s ASP 98 CO -0.03 -0.61 1.75 1.33 0.52 0.00 0.00 175.17 178.13 1y0l n VAL 99 N 4.65 0.62 0.14 1.11 0.24 -1.26 -1.43 118.33 122.40 1y0l n VAL 99 Ca -0.04 -0.05 -0.24 0.00 -2.04 0.00 0.00 64.34 61.98 1y0l n VAL 99 Cb 0.41 -0.79 -0.16 0.00 -1.47 0.00 0.00 33.84 31.83 1y0l n VAL 99 CO 0.00 0.00 0.00 1.88 -2.14 0.00 0.00 176.83 176.57 1y0l h TYR 100 N 0.00 0.92 -0.30 6.34 0.05 -2.05 -3.33 116.97 118.60 1y0l h TYR 100 Ca 0.00 -0.67 0.00 0.00 0.05 0.00 0.00 58.73 58.11 1y0l h TYR 100 Cb 0.55 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.26 1y0l h TYR 100 CO 0.00 1.54 0.00 0.09 -1.05 0.00 0.00 178.16 178.74 1y0l n ASN 100 N -3.69 2.83 -2.62 3.88 3.02 -1.22 -5.26 115.26 112.20 1y0l n ASN 100 Ca -0.16 -1.87 -0.03 0.00 -0.03 0.00 0.00 54.58 52.49 1y0l n ASN 100 Cb 1.10 -0.20 -0.02 0.00 -0.61 0.00 0.00 39.78 40.05 1y0l n ASN 100 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1y0l n HIS 100 N 0.73 -2.87 0.00 3.10 8.25 -0.52 -5.09 115.22 118.83 1y0l n HIS 100 Ca 0.12 1.68 0.00 0.00 -0.26 0.00 0.00 57.72 59.26 1y0l n HIS 100 Cb 0.43 -2.80 0.00 0.00 1.12 0.00 0.00 29.99 28.73 1y0l n HIS 100 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1y0l n TYR 100 N 2.00 0.00 -4.23 4.41 4.01 -1.26 -5.03 117.16 117.06 1y0l n TYR 100 Ca -0.19 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.38 1y0l n TYR 100 Cb 0.29 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.18 1y0l n TYR 100 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1y0l s VAL 100 N 0.00 0.53 -1.09 -0.72 1.01 -0.75 -4.97 120.40 114.41 1y0l s VAL 100 Ca 0.00 -0.31 -0.18 0.00 0.00 0.00 0.00 61.98 61.49 1y0l s VAL 100 Cb 0.00 -0.45 0.11 0.00 0.00 0.00 0.00 36.38 36.05 1y0l s VAL 100 CO 0.00 0.13 1.38 -0.76 0.00 0.00 0.00 175.10 175.85 1y0l s LEU 100 N -0.21 4.52 0.00 3.92 1.43 -1.26 -0.20 118.68 126.88 1y0l s LEU 100 Ca 0.02 -2.25 0.00 0.00 -1.03 0.00 0.00 54.13 50.87 1y0l s LEU 100 Cb -0.03 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.73 1y0l s LEU 100 CO -0.00 -1.09 0.45 0.47 0.23 0.00 0.00 176.35 176.41 1y0l n ASP 101 N 7.11 0.00 -4.62 2.29 8.00 -0.79 -4.85 116.55 123.69 1y0l n ASP 101 Ca 0.34 0.45 -0.34 0.00 0.71 0.00 0.00 54.79 55.94 1y0l n ASP 101 Cb 0.47 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.47 1y0l n ASP 101 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1y0l s TYR 102 N -0.90 3.08 0.04 1.24 2.02 -1.26 -4.99 117.35 116.59 1y0l s TYR 102 Ca 0.00 0.06 0.08 0.00 -0.37 0.00 0.00 57.07 56.84 1y0l s TYR 102 Cb 0.00 -1.81 -0.03 0.00 -0.40 0.00 0.00 41.96 39.72 1y0l s TYR 102 CO 0.00 0.33 -0.23 -1.58 -1.57 0.00 0.00 175.55 172.50 1y0l s TRP 103 N -0.59 2.05 0.93 2.71 0.52 -1.26 -1.18 118.94 122.12 1y0l s TRP 103 Ca 0.09 -0.39 -0.15 0.00 0.02 0.00 0.00 56.10 55.67 1y0l s TRP 103 Cb -0.12 -1.23 0.18 0.00 -1.15 0.00 0.00 33.47 31.16 1y0l s TRP 103 CO 0.02 0.10 1.29 0.20 0.02 0.00 0.00 176.95 178.58 1y0l s GLY 104 N -1.17 1.76 0.00 0.98 0.00 -0.09 -4.82 107.32 103.97 1y0l s GLY 104 Ca 0.09 -1.16 0.28 0.00 0.00 0.00 0.00 44.72 43.94 1y0l s GLY 104 CO 0.02 -0.43 1.79 -1.06 0.00 0.00 0.00 173.10 173.42 1y0l n GLN 105 N -3.67 1.20 0.00 2.90 6.02 -1.26 -4.74 117.38 117.83 1y0l n GLN 105 Ca 0.14 -0.59 0.00 0.00 -0.01 0.00 0.00 57.00 56.54 1y0l n GLN 105 Cb 0.60 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.37 1y0l n GLN 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1y0l n GLY 106 N 1.21 -0.98 3.08 1.08 0.00 -1.26 -5.00 105.19 103.32 1y0l n GLY 106 Ca 0.17 -1.58 -0.26 0.00 0.00 0.00 0.00 46.02 44.35 1y0l n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1y0l s THR 107 N -3.05 1.37 0.10 2.61 -1.32 -0.40 -4.82 115.64 110.13 1y0l s THR 107 Ca 0.00 -0.63 -0.27 0.00 -1.21 0.00 0.00 61.69 59.58 1y0l s THR 107 Cb 0.00 -1.22 -0.06 0.00 -1.51 0.00 0.00 72.50 69.70 1y0l s THR 107 CO 0.00 0.41 0.82 -0.55 -2.21 0.00 0.00 174.62 173.09 1y0l s SER 108 N 0.49 7.35 -0.08 8.08 0.15 -1.26 -0.99 113.70 127.43 1y0l s SER 108 Ca -0.14 1.60 0.01 0.00 0.70 0.00 0.00 55.95 58.13 1y0l s SER 108 Cb -0.16 -2.51 0.02 0.00 -1.71 0.00 0.00 66.02 61.66 1y0l s SER 108 CO 0.05 0.05 -0.11 -0.69 1.20 0.00 0.00 173.24 173.74 1y0l s VAL 109 N -0.36 1.11 -0.11 4.45 1.01 -0.15 -0.11 120.40 126.24 1y0l s VAL 109 Ca 0.40 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.97 1y0l s VAL 109 Cb -0.22 -1.05 0.02 0.00 0.00 0.00 0.00 36.38 35.13 1y0l s VAL 109 CO 0.26 0.36 -0.14 -0.89 0.00 0.00 0.00 175.10 174.69 1y0l s THR 110 N 0.99 1.40 -0.26 3.92 2.01 -0.09 -0.85 115.64 122.76 1y0l s THR 110 Ca -0.08 -0.57 -0.10 0.00 0.31 0.00 0.00 61.69 61.24 1y0l s THR 110 Cb -0.15 -1.30 -0.05 0.00 0.01 0.00 0.00 72.50 71.01 1y0l s THR 110 CO -0.00 0.42 0.17 -0.69 -0.69 0.00 0.00 174.62 173.83 1y0l s VAL 111 N 1.12 5.22 -0.12 3.82 1.01 -1.26 -0.76 120.40 129.42 1y0l s VAL 111 Ca -0.04 0.14 -0.31 0.00 0.00 0.00 0.00 61.98 61.76 1y0l s VAL 111 Cb -0.14 -3.46 0.13 0.00 0.00 0.00 0.00 36.38 32.90 1y0l s VAL 111 CO -0.03 0.29 1.03 -0.55 0.00 0.00 0.00 175.10 175.84 1y0l s SER 112 N 1.53 -0.29 0.22 3.32 0.15 -0.28 -4.59 113.70 113.75 1y0l s SER 112 Ca 0.07 0.16 0.21 0.00 0.70 0.00 0.00 55.95 57.08 1y0l s SER 112 Cb -0.15 0.28 0.03 0.00 -1.71 0.00 0.00 66.02 64.46 1y0l s SER 112 CO 0.08 -0.39 1.12 0.77 1.20 0.00 0.00 173.24 176.02 1y0l h SER 113 N 2.22 0.00 -3.18 5.45 4.64 -1.97 -3.38 113.55 117.33 1y0l h SER 113 Ca -0.17 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.67 1y0l h SER 113 Cb 1.19 0.00 0.22 0.00 -0.31 0.00 0.00 62.40 63.50 1y0l h SER 113 CO 0.29 0.17 -0.44 0.00 -0.87 0.00 0.00 176.83 175.97 1y0l n ALA 114 N -2.22 -2.84 -2.73 5.18 0.00 -1.26 -5.02 120.51 111.63 1y0l n ALA 114 Ca -0.01 -0.95 -0.24 0.00 0.00 0.00 0.00 53.44 52.23 1y0l n ALA 114 Cb 0.63 -1.84 -0.06 0.00 0.00 0.00 0.00 19.45 18.18 1y0l n ALA 114 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1y0l s SER 115 N -2.17 5.07 0.63 0.00 1.04 -1.26 -5.05 113.70 111.96 1y0l s SER 115 Ca 0.61 -0.36 -0.19 0.00 0.48 0.00 0.00 55.95 56.49 1y0l s SER 115 Cb -0.20 -1.17 -0.02 0.00 0.10 0.00 0.00 66.02 64.74 1y0l s SER 115 CO 0.65 0.03 1.28 0.35 0.98 0.00 0.00 173.24 176.53 1y0l n THR 116 N -0.65 4.72 -3.68 2.02 -2.24 -1.26 -4.83 114.28 108.35 1y0l n THR 116 Ca -0.08 -0.50 -0.16 0.00 -2.27 0.00 0.00 64.05 61.04 1y0l n THR 116 Cb 0.57 -1.50 -0.15 0.00 -2.10 0.00 0.00 70.33 67.14 1y0l n THR 116 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1y0l s LYS 117 N -3.25 0.05 0.55 -0.78 2.20 0.72 -4.93 119.74 114.29 1y0l s LYS 117 Ca 0.81 0.54 -0.21 0.00 -0.36 0.00 0.00 55.97 56.75 1y0l s LYS 117 Cb -0.39 -0.24 -0.05 0.00 -1.51 0.00 0.00 37.83 35.64 1y0l s LYS 117 CO 0.42 -0.28 1.27 0.20 -0.36 0.00 0.00 175.35 176.60 1y0l s GLY 118 N 2.10 2.83 0.53 5.54 0.00 -1.26 -1.75 107.32 115.31 1y0l s GLY 118 Ca 0.01 1.16 -0.09 0.00 0.00 0.00 0.00 44.72 45.80 1y0l s GLY 118 CO -0.06 1.63 0.90 2.56 0.00 0.00 0.00 173.10 178.12 1y0l s PRO 119 N -3.00 3.63 -0.12 2.90 0.04 -1.26 -4.56 135.00 132.63 1y0l s PRO 119 Ca 0.72 0.52 -0.05 0.00 0.04 0.00 0.00 61.00 62.23 1y0l s PRO 119 Cb -0.35 -2.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.91 1y0l s PRO 119 CO 0.41 -0.33 0.05 -1.12 0.04 0.00 0.00 177.00 176.04 1y0l s SER 120 N -3.91 5.58 -0.28 6.66 0.01 -0.35 -4.94 113.70 116.47 1y0l s SER 120 Ca 0.52 0.19 -0.02 0.00 1.31 0.00 0.00 55.95 57.95 1y0l s SER 120 Cb -0.11 -1.75 0.04 0.00 0.21 0.00 0.00 66.02 64.41 1y0l s SER 120 CO 0.45 0.32 -0.02 -0.69 0.41 0.00 0.00 173.24 173.72 1y0l s VAL 121 N -0.55 2.97 -0.01 3.43 1.01 -1.26 -1.27 120.40 124.73 1y0l s VAL 121 Ca 0.10 -1.22 0.02 0.00 0.00 0.00 0.00 61.98 60.88 1y0l s VAL 121 Cb -0.12 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 1y0l s VAL 121 CO 0.02 0.02 -0.02 -0.36 0.00 0.00 0.00 175.10 174.76 1y0l s PHE 122 N 1.29 3.03 0.27 5.22 0.08 -0.04 -4.93 117.98 122.90 1y0l s PHE 122 Ca -0.03 0.06 -0.23 0.00 0.12 0.00 0.00 56.93 56.85 1y0l s PHE 122 Cb -0.18 -1.67 -0.09 0.00 -0.57 0.00 0.00 43.02 40.51 1y0l s PHE 122 CO -0.02 0.44 0.84 -1.25 -0.10 0.00 0.00 175.22 175.12 1y0l s PRO 123 N -1.43 4.43 -0.88 0.24 0.04 -1.26 0.20 135.00 136.33 1y0l s PRO 123 Ca 0.18 1.11 -0.03 0.00 0.04 0.00 0.00 61.00 62.29 1y0l s PRO 123 Cb -0.11 -2.85 0.22 0.00 0.04 0.00 0.00 34.50 31.79 1y0l s PRO 123 CO 0.08 0.34 0.77 -0.51 0.04 0.00 0.00 177.00 177.73 1y0l s LEU 124 N -1.99 5.66 0.44 -3.56 1.43 0.33 -4.84 118.68 116.16 1y0l s LEU 124 Ca 0.46 -3.54 -0.24 0.00 -1.03 0.00 0.00 54.13 49.77 1y0l s LEU 124 Cb -0.18 -1.95 -0.09 0.00 0.03 0.00 0.00 46.19 44.00 1y0l s LEU 124 CO 0.23 -0.24 1.17 0.00 0.23 0.00 0.00 176.35 177.74 1y0l n ALA 125 N 2.61 0.87 -2.03 4.21 0.00 -1.26 -1.66 120.51 123.25 1y0l n ALA 125 Ca 0.20 0.23 -0.42 0.00 0.00 0.00 0.00 53.44 53.45 1y0l n ALA 125 Cb 0.38 -2.20 -0.03 0.00 0.00 0.00 0.00 19.45 17.60 1y0l n ALA 125 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1y0l s PRO 126 N -2.22 4.31 0.14 0.00 0.02 -1.26 -4.86 135.00 131.13 1y0l s PRO 126 Ca 0.63 2.16 -0.31 0.00 0.02 0.00 0.00 61.00 63.50 1y0l s PRO 126 Cb -0.51 -3.19 -0.09 0.00 0.02 0.00 0.00 34.50 30.72 1y0l s PRO 126 CO 0.56 -0.42 1.55 0.45 -0.33 0.00 0.00 177.00 178.81 1y0l s SER 127 N 0.80 6.63 0.11 2.53 0.15 -1.26 -4.62 113.70 118.04 1y0l s SER 127 Ca 0.63 2.54 -0.22 0.00 0.70 0.00 0.00 55.95 59.59 1y0l s SER 127 Cb -0.39 -2.59 -0.08 0.00 -1.71 0.00 0.00 66.02 61.26 1y0l s SER 127 CO 0.35 -0.81 1.70 0.77 1.20 0.00 0.00 173.24 176.45 1y0l h SER 128 N 7.08 -0.24 -0.86 5.45 4.64 -1.94 -2.86 113.55 124.81 1y0l h SER 128 Ca -0.42 0.05 -0.56 0.00 -0.47 0.00 0.00 61.79 60.38 1y0l h SER 128 Cb 1.20 0.12 -0.25 0.00 -0.31 0.00 0.00 62.40 63.15 1y0l h SER 128 CO 0.91 -0.11 0.72 2.29 -0.87 0.00 0.00 176.83 179.77 1y0l n LYS 129 N -5.21 2.38 -2.98 4.77 2.85 -1.26 -4.92 118.16 113.79 1y0l n LYS 129 Ca -0.05 -2.79 -0.43 0.00 -1.05 0.00 0.00 58.31 53.99 1y0l n LYS 129 Cb 0.13 -2.10 -0.05 0.00 -0.65 0.00 0.00 35.03 32.36 1y0l n LYS 129 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1y0l s SER 130 N -1.24 6.35 -0.26 -5.58 0.15 -1.08 -4.91 113.70 107.13 1y0l s SER 130 Ca 0.55 -0.33 0.15 0.00 0.70 0.00 0.00 55.95 57.02 1y0l s SER 130 Cb 0.44 -2.38 0.48 0.00 -1.71 0.00 0.00 66.02 62.85 1y0l s SER 130 CO 0.01 -0.97 1.16 0.35 1.20 0.00 0.00 173.24 174.99 1y0l n THR 133 N 6.04 1.83 -1.97 6.45 -2.24 -1.26 -4.60 114.28 118.53 1y0l n THR 133 Ca 0.00 -3.42 -0.25 0.00 -2.27 0.00 0.00 64.05 58.11 1y0l n THR 133 Cb 0.48 0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.72 1y0l n THR 133 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1y0l s SER 134 N -3.58 4.71 -1.10 3.42 0.01 -1.24 -2.99 113.70 112.94 1y0l s SER 134 Ca 0.39 -1.41 -0.00 0.00 1.31 0.00 0.00 55.95 56.24 1y0l s SER 134 Cb 0.37 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 64.01 1y0l s SER 134 CO -0.01 -3.39 0.04 0.61 0.41 0.00 0.00 173.24 170.89 1y0l n GLY 135 N 5.98 -0.16 2.10 3.44 0.00 -1.26 -2.06 105.19 113.24 1y0l n GLY 135 Ca 0.44 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1y0l n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y0l n GLY 136 N -1.03 0.49 3.83 -0.02 0.00 -1.16 -5.02 105.19 102.27 1y0l n GLY 136 Ca -0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 1y0l n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y0l s THR 137 N -2.02 4.94 0.12 2.61 2.01 -0.87 -0.30 115.64 122.13 1y0l s THR 137 Ca 0.00 0.95 0.10 0.00 0.31 0.00 0.00 61.69 63.06 1y0l s THR 137 Cb 0.00 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 1y0l s THR 137 CO 0.00 0.57 -0.25 0.00 -0.69 0.00 0.00 174.62 174.25 1y0l s ALA 138 N -1.09 2.42 -0.03 7.40 0.00 0.19 -3.62 121.76 127.03 1y0l s ALA 138 Ca 0.25 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.81 1y0l s ALA 138 Cb -0.18 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.51 1y0l s ALA 138 CO 0.15 0.55 -0.10 0.00 0.00 0.00 0.00 175.76 176.36 1y0l s ALA 139 N -1.05 0.95 0.15 0.00 0.00 -1.26 -0.96 121.76 119.60 1y0l s ALA 139 Ca 0.14 -0.40 -0.07 0.00 0.00 0.00 0.00 51.96 51.64 1y0l s ALA 139 Cb -0.10 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 1y0l s ALA 139 CO 0.06 0.17 0.22 -0.48 0.00 0.00 0.00 175.76 175.73 1y0l s LEU 140 N 0.11 1.20 0.00 0.00 0.05 -0.90 -4.13 118.68 115.01 1y0l s LEU 140 Ca -0.02 -0.97 0.00 0.00 0.05 0.00 0.00 54.13 53.19 1y0l s LEU 140 Cb -0.08 0.93 0.00 0.00 -2.05 0.00 0.00 46.19 44.99 1y0l s LEU 140 CO 0.01 -0.85 0.00 0.61 -0.55 0.00 0.00 176.35 175.57 1y0l n GLY 141 N -0.18 1.14 3.00 -3.48 0.00 -0.66 -0.54 105.19 104.47 1y0l n GLY 141 Ca -0.07 -0.76 -0.19 0.00 0.00 0.00 0.00 46.02 45.01 1y0l n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y0l s LEU 143 N -0.05 4.20 -0.44 0.00 2.96 0.13 -1.35 118.68 124.13 1y0l s LEU 143 Ca 0.01 -0.70 -0.12 0.00 -0.22 0.00 0.00 54.13 53.10 1y0l s LEU 143 Cb -0.05 -1.97 0.07 0.00 0.50 0.00 0.00 46.19 44.74 1y0l s LEU 143 CO -0.00 -0.24 0.32 -0.69 -1.32 0.00 0.00 176.35 174.42 1y0l s VAL 144 N 1.56 4.72 0.18 1.68 1.01 0.46 -0.86 120.40 129.15 1y0l s VAL 144 Ca 0.03 -1.21 0.07 0.00 0.00 0.00 0.00 61.98 60.87 1y0l s VAL 144 Cb -0.18 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 1y0l s VAL 144 CO 0.05 -0.53 -0.14 -1.59 0.00 0.00 0.00 175.10 172.90 1y0l s LYS 145 N 1.53 1.23 -0.88 2.72 -2.85 -0.39 -0.26 119.74 120.84 1y0l s LYS 145 Ca 0.03 -1.49 -0.04 0.00 -1.00 0.00 0.00 55.97 53.47 1y0l s LYS 145 Cb -0.23 -1.02 -0.02 0.00 -2.06 0.00 0.00 37.83 34.49 1y0l s LYS 145 CO 0.04 0.17 0.77 -0.25 0.10 0.00 0.00 175.35 176.18 1y0l n ASP 146 N -0.14 -6.92 -4.27 0.03 8.00 -0.18 -1.21 116.55 111.87 1y0l n ASP 146 Ca -0.10 -0.45 -0.15 0.00 0.71 0.00 0.00 54.79 54.80 1y0l n ASP 146 Cb 0.60 -4.73 -0.10 0.00 -0.02 0.00 0.00 41.12 36.87 1y0l n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1y0l s TYR 147 N -3.17 1.33 -0.28 1.24 -0.85 -1.03 -4.27 117.35 110.32 1y0l s TYR 147 Ca 0.19 -0.81 -0.21 0.00 -0.52 0.00 0.00 57.07 55.72 1y0l s TYR 147 Cb -0.04 -0.71 0.10 0.00 0.38 0.00 0.00 41.96 41.70 1y0l s TYR 147 CO 0.77 0.03 0.86 0.12 -1.52 0.00 0.00 175.55 175.82 1y0l s PHE 148 N -3.37 -0.72 0.00 -3.49 5.36 -0.72 -0.89 117.98 114.15 1y0l s PHE 148 Ca 0.20 1.59 0.00 0.00 -0.96 0.00 0.00 56.93 57.76 1y0l s PHE 148 Cb 0.03 0.40 0.00 0.00 -0.34 0.00 0.00 43.02 43.12 1y0l s PHE 148 CO 0.03 -0.35 0.00 -0.35 -1.46 0.00 0.00 175.22 173.09 1y0l n PRO 149 N 3.15 1.83 -1.77 10.12 -0.04 -1.26 -0.20 135.00 146.84 1y0l n PRO 149 Ca -0.16 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 62.99 1y0l n PRO 149 Cb 0.57 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.05 1y0l n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1y0l s GLU 150 N 0.46 3.28 0.54 0.54 2.02 -1.26 -4.77 118.70 119.50 1y0l s GLU 150 Ca 0.00 0.90 0.03 0.00 0.02 0.00 0.00 54.97 55.91 1y0l s GLU 150 Cb 0.00 -2.04 0.02 0.00 0.10 0.00 0.00 34.13 32.21 1y0l s GLU 150 CO 0.00 -0.83 0.19 -1.25 0.02 0.00 0.00 175.26 173.39 1y0l s PRO 151 N -4.96 2.23 0.10 0.39 0.04 -1.26 -4.90 135.00 126.65 1y0l s PRO 151 Ca 0.57 -2.26 0.08 0.00 0.04 0.00 0.00 61.00 59.43 1y0l s PRO 151 Cb -0.13 -1.78 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 1y0l s PRO 151 CO 0.52 -0.51 -0.19 0.54 0.04 0.00 0.00 177.00 177.39 1y0l s VAL 152 N -2.85 1.63 -0.01 -0.36 0.11 -1.26 -4.47 120.40 113.18 1y0l s VAL 152 Ca 0.16 -1.56 0.06 0.00 -2.93 0.00 0.00 61.98 57.71 1y0l s VAL 152 Cb -0.01 -1.52 -0.03 0.00 -1.53 0.00 0.00 36.38 33.30 1y0l s VAL 152 CO 0.10 -0.12 -0.18 0.42 -3.33 0.00 0.00 175.10 171.99 1y0l s THR 153 N -1.30 2.77 -0.04 5.04 -4.23 0.14 -4.96 115.64 113.06 1y0l s THR 153 Ca 0.06 -0.95 0.02 0.00 -1.18 0.00 0.00 61.69 59.65 1y0l s THR 153 Cb -0.09 -2.09 0.01 0.00 1.34 0.00 0.00 72.50 71.66 1y0l s THR 153 CO 0.04 0.51 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.84 1y0l s VAL 154 N -0.77 0.89 0.06 2.29 1.01 -1.26 -1.18 120.40 121.44 1y0l s VAL 154 Ca 0.12 -0.39 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 1y0l s VAL 154 Cb -0.10 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 1y0l s VAL 154 CO 0.02 0.28 0.01 -0.94 0.00 0.00 0.00 175.10 174.47 1y0l s SER 156 N 0.36 0.42 -0.10 3.32 1.04 -0.55 -4.97 113.70 113.22 1y0l s SER 156 Ca -0.07 -0.95 0.03 0.00 0.48 0.00 0.00 55.95 55.45 1y0l s SER 156 Cb -0.11 0.23 -0.01 0.00 0.10 0.00 0.00 66.02 66.23 1y0l s SER 156 CO 0.01 -0.63 -0.19 0.26 0.98 0.00 0.00 173.24 173.68 1y0l s TRP 157 N -3.91 2.65 -1.25 5.02 0.52 -1.26 0.13 118.94 120.83 1y0l s TRP 157 Ca 0.07 -0.73 -0.05 0.00 0.02 0.00 0.00 56.10 55.41 1y0l s TRP 157 Cb 0.07 -1.73 -0.01 0.00 -1.15 0.00 0.00 33.47 30.66 1y0l s TRP 157 CO -0.10 -0.23 0.73 0.09 0.02 0.00 0.00 176.95 177.45 1y0l n ASN 162 N 3.27 -2.44 -2.67 2.95 3.02 0.10 -1.76 115.26 117.73 1y0l n ASN 162 Ca -0.18 -0.85 -0.12 0.00 -0.03 0.00 0.00 54.58 53.39 1y0l n ASN 162 Cb 0.53 -4.00 -0.01 0.00 -0.61 0.00 0.00 39.78 35.69 1y0l n ASN 162 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1y0l n SER 163 N -3.00 -3.26 0.00 6.41 2.88 -1.26 -0.64 113.62 114.75 1y0l n SER 163 Ca -0.24 0.12 0.00 0.00 -1.33 0.00 0.00 58.87 57.42 1y0l n SER 163 Cb 0.66 -2.78 0.00 0.00 -0.75 0.00 0.00 64.21 61.34 1y0l n SER 163 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1y0l n GLY 164 N -0.82 0.65 0.29 0.46 0.00 -0.72 -4.95 105.19 100.10 1y0l n GLY 164 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 1y0l n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y0l h ALA 165 N 0.00 0.86 -2.69 4.61 0.00 -0.77 -3.40 119.26 117.86 1y0l h ALA 165 Ca 0.00 -0.20 -0.67 0.00 0.00 0.00 0.00 54.91 54.04 1y0l h ALA 165 Cb 0.00 -0.26 -0.18 0.00 0.00 0.00 0.00 17.79 17.35 1y0l h ALA 165 CO 0.00 0.52 -0.43 -1.17 0.00 0.00 0.00 179.25 178.17 1y0l s LEU 166 N -9.67 4.48 0.00 0.00 2.96 -1.01 -4.85 118.68 110.58 1y0l s LEU 166 Ca -0.13 -0.35 0.00 0.00 -0.22 0.00 0.00 54.13 53.43 1y0l s LEU 166 Cb 0.14 -2.19 0.00 0.00 0.50 0.00 0.00 46.19 44.64 1y0l s LEU 166 CO 0.82 -0.25 0.00 0.35 -1.32 0.00 0.00 176.35 175.94 1y0l n THR 167 N 5.14 0.00 -2.69 3.68 -2.24 -1.26 -4.11 114.28 112.80 1y0l n THR 167 Ca -0.12 -0.03 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 1y0l n THR 167 Cb 0.50 0.33 -0.03 0.00 -2.10 0.00 0.00 70.33 69.03 1y0l n THR 167 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1y0l s SER 168 N -0.61 7.24 0.00 3.42 0.01 -1.26 -3.32 113.70 119.18 1y0l s SER 168 Ca 0.00 1.53 0.00 0.00 1.31 0.00 0.00 55.95 58.79 1y0l s SER 168 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1y0l s SER 168 CO 0.00 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 173.81 1y0l n GLY 169 N 3.10 0.65 3.81 3.44 0.00 -1.26 -4.81 105.19 110.11 1y0l n GLY 169 Ca 0.09 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1y0l n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y0l s VAL 171 N -2.00 4.97 -0.17 1.61 1.01 -1.21 -2.75 120.40 121.86 1y0l s VAL 171 Ca 0.00 0.98 -0.02 0.00 0.00 0.00 0.00 61.98 62.94 1y0l s VAL 171 Cb 0.00 -3.79 0.05 0.00 0.00 0.00 0.00 36.38 32.64 1y0l s VAL 171 CO 0.00 0.52 0.02 -1.00 0.00 0.00 0.00 175.10 174.64 1y0l s HIS 172 N -0.76 1.08 -0.30 5.22 3.76 0.30 -5.00 115.29 119.59 1y0l s HIS 172 Ca 0.26 -0.79 -0.07 0.00 -0.15 0.00 0.00 55.06 54.31 1y0l s HIS 172 Cb -0.17 -1.04 0.01 0.00 1.11 0.00 0.00 32.58 32.49 1y0l s HIS 172 CO 0.15 -0.57 0.09 0.99 -0.85 0.00 0.00 174.74 174.55 1y0l s THR 173 N 1.84 4.00 0.51 1.30 2.01 -1.26 -0.91 115.64 123.13 1y0l s THR 173 Ca 0.00 -0.71 -0.18 0.00 0.31 0.00 0.00 61.69 61.11 1y0l s THR 173 Cb -0.16 -3.08 -0.08 0.00 0.01 0.00 0.00 72.50 69.19 1y0l s THR 173 CO -0.07 0.06 1.01 -0.36 -0.69 0.00 0.00 174.62 174.56 1y0l s PHE 174 N 1.50 3.18 0.32 4.92 0.08 -0.11 -5.00 117.98 122.87 1y0l s PHE 174 Ca 0.02 1.54 -0.29 0.00 0.12 0.00 0.00 56.93 58.33 1y0l s PHE 174 Cb -0.17 -2.93 -0.10 0.00 -0.57 0.00 0.00 43.02 39.24 1y0l s PHE 174 CO 0.03 -0.61 1.39 -1.25 -0.10 0.00 0.00 175.22 174.68 1y0l s PRO 175 N -3.63 4.27 0.64 0.24 0.04 -1.26 -4.51 135.00 130.79 1y0l s PRO 175 Ca 0.63 2.33 -0.17 0.00 0.04 0.00 0.00 61.00 63.83 1y0l s PRO 175 Cb -0.13 -3.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.34 1y0l s PRO 175 CO 0.25 -0.34 1.20 0.00 0.04 0.00 0.00 177.00 178.15 1y0l s ALA 176 N -0.77 2.40 0.03 8.56 0.00 -1.26 -4.86 121.76 125.87 1y0l s ALA 176 Ca 0.53 0.94 0.08 0.00 0.00 0.00 0.00 51.96 53.51 1y0l s ALA 176 Cb -0.42 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.22 1y0l s ALA 176 CO 0.52 -1.41 -0.24 0.14 0.00 0.00 0.00 175.76 174.77 1y0l s VAL 177 N -1.77 2.34 -0.45 0.00 -7.23 0.24 -4.92 120.40 108.61 1y0l s VAL 177 Ca 0.76 -1.28 -0.24 0.00 -1.81 0.00 0.00 61.98 59.40 1y0l s VAL 177 Cb -0.29 -1.92 0.03 0.00 0.56 0.00 0.00 36.38 34.75 1y0l s VAL 177 CO 0.38 0.39 0.87 -0.22 -0.31 0.00 0.00 175.10 176.21 1y0l s LEU 178 N -1.20 4.10 0.77 1.32 2.96 -1.26 -1.74 118.68 123.63 1y0l s LEU 178 Ca 0.12 0.05 -0.12 0.00 -0.22 0.00 0.00 54.13 53.97 1y0l s LEU 178 Cb -0.10 -3.10 0.05 0.00 0.50 0.00 0.00 46.19 43.54 1y0l s LEU 178 CO 0.02 -0.98 1.11 -1.10 -1.32 0.00 0.00 176.35 174.08 1y0l s GLN 179 N 3.55 2.29 0.31 1.98 -0.21 -0.21 -4.92 119.66 122.45 1y0l s GLN 179 Ca 0.34 0.51 0.03 0.00 0.02 0.00 0.00 55.36 56.26 1y0l s GLN 179 Cb -0.11 -1.95 0.63 0.00 1.00 0.00 0.00 33.01 32.58 1y0l s GLN 179 CO 0.24 -1.44 1.86 0.66 -2.12 0.00 0.00 175.29 174.49 1y0l h SER 180 N -0.96 0.84 0.00 5.90 4.64 -1.96 -0.18 113.55 121.83 1y0l h SER 180 Ca -0.46 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1y0l h SER 180 Cb 1.27 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1y0l h SER 180 CO 0.62 0.46 0.00 -1.54 -0.87 0.00 0.00 176.83 175.50 1y0l n SER 182 N -4.58 0.19 0.00 4.97 3.41 -1.26 -4.78 113.62 111.58 1y0l n SER 182 Ca 0.17 0.59 0.00 0.00 -0.26 0.00 0.00 58.87 59.37 1y0l n SER 182 Cb 0.36 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 1y0l n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y0l n GLY 183 N -1.43 0.74 3.67 5.00 0.00 -0.08 -5.06 105.19 108.04 1y0l n GLY 183 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1y0l n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y0l s LEU 184 N 0.00 3.42 0.49 0.99 1.43 -1.25 -4.89 118.68 118.86 1y0l s LEU 184 Ca 0.00 -0.17 -0.06 0.00 -1.03 0.00 0.00 54.13 52.87 1y0l s LEU 184 Cb 0.00 -2.12 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 1y0l s LEU 184 CO 0.00 0.20 0.80 -0.31 0.23 0.00 0.00 176.35 177.27 1y0l s TYR 185 N -1.26 3.56 -0.12 0.29 2.02 -0.07 -1.05 117.35 120.73 1y0l s TYR 185 Ca 0.24 0.86 -0.23 0.00 -0.37 0.00 0.00 57.07 57.57 1y0l s TYR 185 Cb -0.12 -2.34 0.05 0.00 -0.40 0.00 0.00 41.96 39.16 1y0l s TYR 185 CO 0.16 -0.30 0.55 0.45 -1.57 0.00 0.00 175.55 174.85 1y0l s SER 186 N -4.06 -0.53 0.20 2.29 0.15 -0.71 -1.01 113.70 110.03 1y0l s SER 186 Ca 0.48 0.78 -0.18 0.00 0.70 0.00 0.00 55.95 57.73 1y0l s SER 186 Cb -0.10 0.77 0.03 0.00 -1.71 0.00 0.00 66.02 65.01 1y0l s SER 186 CO 0.45 -0.39 0.54 -1.48 1.20 0.00 0.00 173.24 173.56 1y0l s LEU 187 N -0.55 0.00 0.10 3.45 0.05 0.65 -0.59 118.68 121.79 1y0l s LEU 187 Ca -0.07 -0.44 0.08 0.00 0.05 0.00 0.00 54.13 53.75 1y0l s LEU 187 Cb -0.03 2.22 -0.03 0.00 -2.05 0.00 0.00 46.19 46.29 1y0l s LEU 187 CO 0.05 -1.06 -0.21 -0.44 -0.55 0.00 0.00 176.35 174.13 1y0l s SER 188 N -2.86 2.59 -0.07 1.48 0.01 -1.26 -0.40 113.70 113.19 1y0l s SER 188 Ca 0.08 -0.67 -0.00 0.00 1.31 0.00 0.00 55.95 56.67 1y0l s SER 188 Cb -0.01 -0.15 0.03 0.00 0.21 0.00 0.00 66.02 66.09 1y0l s SER 188 CO -0.03 0.08 -0.03 -0.55 0.41 0.00 0.00 173.24 173.12 1y0l s SER 189 N -1.83 1.43 0.23 2.44 0.15 -0.45 -0.93 113.70 114.74 1y0l s SER 189 Ca 0.07 -0.13 0.06 0.00 0.70 0.00 0.00 55.95 56.65 1y0l s SER 189 Cb -0.10 -0.50 -0.05 0.00 -1.71 0.00 0.00 66.02 63.66 1y0l s SER 189 CO 0.04 -0.13 -0.08 0.68 1.20 0.00 0.00 173.24 174.95 1y0l s VAL 190 N 1.54 1.52 -0.17 4.45 -7.23 -0.08 -0.06 120.40 120.36 1y0l s VAL 190 Ca -0.01 -2.13 -0.10 0.00 -1.81 0.00 0.00 61.98 57.93 1y0l s VAL 190 Cb -0.13 -2.24 0.06 0.00 0.56 0.00 0.00 36.38 34.63 1y0l s VAL 190 CO -0.04 -0.45 0.43 0.54 -0.31 0.00 0.00 175.10 175.28 1y0l s VAL 191 N -3.10 -0.02 0.16 1.32 0.11 0.30 -0.54 120.40 118.62 1y0l s VAL 191 Ca 0.26 0.08 -0.06 0.00 -2.93 0.00 0.00 61.98 59.33 1y0l s VAL 191 Cb 0.02 -0.63 -0.06 0.00 -1.53 0.00 0.00 36.38 34.19 1y0l s VAL 191 CO 0.09 0.03 0.41 0.42 -3.33 0.00 0.00 175.10 172.72 1y0l s THR 192 N 1.26 5.11 0.02 5.04 -4.23 -1.11 -2.11 115.64 119.63 1y0l s THR 192 Ca -0.08 0.13 -0.16 0.00 -1.18 0.00 0.00 61.69 60.39 1y0l s THR 192 Cb -0.08 -3.62 0.03 0.00 1.34 0.00 0.00 72.50 70.17 1y0l s THR 192 CO -0.11 0.01 0.36 0.68 -0.54 0.00 0.00 174.62 175.02 1y0l s VAL 193 N -1.70 0.06 0.08 2.29 -7.23 -0.13 -4.82 120.40 108.96 1y0l s VAL 193 Ca 0.42 -0.52 -0.31 0.00 -1.81 0.00 0.00 61.98 59.77 1y0l s VAL 193 Cb -0.12 -0.86 -0.10 0.00 0.56 0.00 0.00 36.38 35.86 1y0l s VAL 193 CO 0.24 -0.29 1.87 -2.16 -0.31 0.00 0.00 175.10 174.45 1y0l s PRO 194 N -2.16 4.14 0.45 4.82 0.04 -1.26 -0.64 135.00 140.39 1y0l s PRO 194 Ca -0.08 2.58 0.18 0.00 0.04 0.00 0.00 61.00 63.73 1y0l s PRO 194 Cb -0.02 -3.82 1.14 0.00 0.04 0.00 0.00 34.50 31.84 1y0l s PRO 194 CO -0.00 -0.88 1.92 1.03 0.04 0.00 0.00 177.00 179.10 1y0l h SER 195 N 9.35 0.31 0.00 6.66 0.87 -0.93 -1.95 113.55 127.86 1y0l h SER 195 Ca -0.47 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 1y0l h SER 195 Cb 1.22 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 1y0l h SER 195 CO 0.94 0.15 0.00 -1.54 -0.53 0.00 0.00 176.83 175.86 1y0l n SER 196 N -4.46 0.64 0.00 6.23 3.41 -1.26 -1.84 113.62 116.34 1y0l n SER 196 Ca 0.15 -1.26 0.00 0.00 -0.26 0.00 0.00 58.87 57.50 1y0l n SER 196 Cb 0.60 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1y0l n SER 196 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1y0l n SER 197 N 0.19 0.51 -4.26 4.04 3.41 -0.73 -4.96 113.62 111.82 1y0l n SER 197 Ca 0.00 -1.09 -0.33 0.00 -0.26 0.00 0.00 58.87 57.19 1y0l n SER 197 Cb 0.16 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.05 1y0l n SER 197 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1y0l n LEU 198 N -0.05 3.39 0.00 1.04 4.77 -0.77 -1.73 117.00 123.65 1y0l n LEU 198 Ca 0.00 -3.08 0.00 0.00 -0.03 0.00 0.00 56.01 52.90 1y0l n LEU 198 Cb 0.20 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.76 1y0l n LEU 198 CO 0.00 -1.35 0.00 0.61 -1.33 0.00 0.00 177.39 175.32 1y0l n GLY 199 N 5.37 0.50 0.43 -0.72 0.00 -1.26 -4.92 105.19 104.59 1y0l n GLY 199 Ca 0.46 -0.01 0.14 0.00 0.00 0.00 0.00 46.02 46.61 1y0l n GLY 199 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1y0l n THR 200 N 0.00 0.00 -3.83 2.61 -2.24 -0.71 -4.86 114.28 105.25 1y0l n THR 200 Ca 0.00 -0.23 -0.13 0.00 -2.27 0.00 0.00 64.05 61.42 1y0l n THR 200 Cb 0.00 0.54 -0.14 0.00 -2.10 0.00 0.00 70.33 68.62 1y0l n THR 200 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1y0l s GLN 203 N -2.17 0.01 0.06 -0.78 -1.52 -1.19 -5.14 119.66 108.94 1y0l s GLN 203 Ca 0.33 0.09 -0.01 0.00 -1.95 0.00 0.00 55.36 53.83 1y0l s GLN 203 Cb 0.20 -0.07 -0.04 0.00 -0.22 0.00 0.00 33.01 32.88 1y0l s GLN 203 CO 0.40 -0.06 0.22 0.95 -0.25 0.00 0.00 175.29 176.55 1y0l s THR 205 N 0.37 5.38 -0.09 -0.19 -4.23 -1.26 -4.90 115.64 110.72 1y0l s THR 205 Ca -0.03 -0.34 -0.01 0.00 -1.18 0.00 0.00 61.69 60.14 1y0l s THR 205 Cb -0.04 -3.62 0.03 0.00 1.34 0.00 0.00 72.50 70.20 1y0l s THR 205 CO -0.01 0.15 -0.05 -0.31 -0.54 0.00 0.00 174.62 173.85 1y0l s TYR 206 N -1.51 1.19 -0.06 3.99 2.02 -1.26 -5.01 117.35 116.71 1y0l s TYR 206 Ca 0.35 -0.53 0.03 0.00 -0.37 0.00 0.00 57.07 56.55 1y0l s TYR 206 Cb -0.13 -1.06 0.01 0.00 -0.40 0.00 0.00 41.96 40.38 1y0l s TYR 206 CO 0.27 -0.43 -0.14 0.42 -1.57 0.00 0.00 175.55 174.10 1y0l s ILE 207 N 1.70 1.24 -0.20 2.71 1.01 -1.26 -0.85 121.20 125.55 1y0l s ILE 207 Ca 0.03 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 60.03 1y0l s ILE 207 Cb -0.13 -1.11 -0.05 0.00 0.01 0.00 0.00 42.46 41.18 1y0l s ILE 207 CO -0.06 0.38 0.13 0.00 0.00 0.00 0.00 174.94 175.39 1y0l s ASN 209 N 0.41 5.91 -0.10 0.00 -0.87 0.34 -2.03 114.94 118.59 1y0l s ASN 209 Ca 0.08 -0.76 -0.04 0.00 -1.57 0.00 0.00 52.86 50.58 1y0l s ASN 209 Cb -0.11 -2.09 -0.04 0.00 -0.02 0.00 0.00 41.25 38.99 1y0l s ASN 209 CO -0.01 -0.34 0.04 -0.69 -2.57 0.00 0.00 177.10 173.52 1y0l s VAL 210 N 1.65 4.65 -0.04 1.60 1.01 0.15 -1.48 120.40 127.94 1y0l s VAL 210 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.91 1y0l s VAL 210 Cb -0.18 -2.99 0.03 0.00 0.00 0.00 0.00 36.38 33.23 1y0l s VAL 210 CO 0.09 0.60 -0.01 0.21 0.00 0.00 0.00 175.10 175.98 1y0l s ASN 211 N -0.80 0.73 -0.38 3.32 3.04 -0.32 -0.67 114.94 119.86 1y0l s ASN 211 Ca 0.12 -0.06 0.01 0.00 0.04 0.00 0.00 52.86 52.98 1y0l s ASN 211 Cb -0.12 -0.30 0.12 0.00 -1.54 0.00 0.00 41.25 39.41 1y0l s ASN 211 CO 0.03 -0.11 0.16 -2.28 -3.04 0.00 0.00 177.10 171.86 1y0l s HIS 212 N 1.15 2.03 0.12 0.43 5.65 0.33 -0.69 115.29 124.32 1y0l s HIS 212 Ca -0.08 -2.19 -0.20 0.00 0.25 0.00 0.00 55.06 52.84 1y0l s HIS 212 Cb -0.14 -1.91 -0.07 0.00 -1.18 0.00 0.00 32.58 29.28 1y0l s HIS 212 CO -0.02 -0.84 1.75 -0.22 -0.65 0.00 0.00 174.74 174.76 1y0l h LYS 213 N 7.38 0.14 -1.44 2.88 3.64 -1.79 -0.90 116.57 126.48 1y0l h LYS 213 Ca -0.07 -0.01 0.42 0.00 -1.27 0.00 0.00 60.65 59.72 1y0l h LYS 213 Cb 0.97 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.70 1y0l h LYS 213 CO 0.48 0.09 1.16 -1.35 -2.27 0.00 0.00 179.45 177.56 1y0l h PRO 214 N 0.14 0.00 -0.02 1.90 0.11 -1.92 0.78 132.00 132.99 1y0l h PRO 214 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1y0l h PRO 214 Cb 0.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.15 1y0l h PRO 214 CO -0.07 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.59 1y0l n SER 215 N -3.82 2.22 -4.20 -2.05 3.41 -1.08 -4.92 113.62 103.18 1y0l n SER 215 Ca 0.32 -2.47 -0.30 0.00 -0.26 0.00 0.00 58.87 56.16 1y0l n SER 215 Cb 1.61 -0.20 -0.07 0.00 -0.26 0.00 0.00 64.21 65.29 1y0l n SER 215 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1y0l n ASN 216 N -0.85 0.17 -4.52 4.04 2.85 0.27 -4.91 115.26 112.31 1y0l n ASN 216 Ca 0.07 -1.17 -0.34 0.00 -0.11 0.00 0.00 54.58 53.04 1y0l n ASN 216 Cb 0.43 -2.16 -0.12 0.00 1.24 0.00 0.00 39.78 39.17 1y0l n ASN 216 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1y0l s THR 217 N -4.13 3.71 -0.06 -0.44 2.01 -0.40 -5.01 115.64 111.33 1y0l s THR 217 Ca 0.08 -0.44 -0.02 0.00 0.31 0.00 0.00 61.69 61.62 1y0l s THR 217 Cb -0.05 -2.57 0.03 0.00 0.01 0.00 0.00 72.50 69.92 1y0l s THR 217 CO 0.96 0.54 0.03 -0.75 -0.69 0.00 0.00 174.62 174.71 1y0l s LYS 218 N -0.13 0.33 -0.01 4.92 2.20 -1.26 -0.51 119.74 125.28 1y0l s LYS 218 Ca 0.02 0.20 0.04 0.00 -0.36 0.00 0.00 55.97 55.87 1y0l s LYS 218 Cb -0.13 -0.83 -0.01 0.00 -1.51 0.00 0.00 37.83 35.35 1y0l s LYS 218 CO 0.03 -0.33 -0.14 0.08 -0.36 0.00 0.00 175.35 174.63 1y0l s VAL 219 N 2.05 1.13 -0.31 4.02 1.01 0.15 -5.00 120.40 123.45 1y0l s VAL 219 Ca 0.05 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.45 1y0l s VAL 219 Cb -0.12 -0.95 0.09 0.00 0.00 0.00 0.00 36.38 35.40 1y0l s VAL 219 CO -0.04 0.32 0.05 -1.81 0.00 0.00 0.00 175.10 173.61 1y0l s ASP 220 N -0.27 4.40 -0.18 3.32 1.01 -1.26 0.33 116.67 124.01 1y0l s ASP 220 Ca 0.04 -1.83 -0.08 0.00 0.71 0.00 0.00 52.55 51.39 1y0l s ASP 220 Cb -0.06 -1.32 -0.04 0.00 1.01 0.00 0.00 42.92 42.50 1y0l s ASP 220 CO -0.00 -0.37 0.09 -0.75 0.21 0.00 0.00 175.17 174.35 1y0l s LYS 221 N 1.20 4.01 -0.12 8.23 2.47 -0.86 -4.93 119.74 129.75 1y0l s LYS 221 Ca 0.08 -0.29 -0.19 0.00 -1.56 0.00 0.00 55.97 54.02 1y0l s LYS 221 Cb -0.18 -3.28 -0.04 0.00 -1.46 0.00 0.00 37.83 32.86 1y0l s LYS 221 CO -0.13 0.32 0.49 0.21 0.16 0.00 0.00 175.35 176.40 1y0l s LYS 222 N 0.26 4.34 -0.28 4.03 2.20 -1.26 -1.36 119.74 127.67 1y0l s LYS 222 Ca 0.06 0.48 -0.09 0.00 -0.36 0.00 0.00 55.97 56.06 1y0l s LYS 222 Cb -0.12 -3.44 -0.02 0.00 -1.51 0.00 0.00 37.83 32.74 1y0l s LYS 222 CO -0.01 0.14 0.13 0.08 -0.36 0.00 0.00 175.35 175.34 1y0l s VAL 223 N 0.66 4.60 0.25 4.02 1.01 -0.03 -4.96 120.40 125.94 1y0l s VAL 223 Ca 0.27 -0.25 0.08 0.00 0.00 0.00 0.00 61.98 62.08 1y0l s VAL 223 Cb -0.15 -3.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 1y0l s VAL 223 CO 0.11 0.19 -0.11 -1.61 0.00 0.00 0.00 175.10 173.68 1y0l s GLU 226 N 1.63 1.46 0.03 2.72 2.02 -1.26 -4.39 118.70 120.92 1y0l s GLU 226 Ca 0.06 -1.70 -0.30 0.00 0.02 0.00 0.00 54.97 53.04 1y0l s GLU 226 Cb -0.16 -1.20 -0.06 0.00 0.10 0.00 0.00 34.13 32.82 1y0l s GLU 226 CO 0.06 0.13 1.31 -2.14 0.02 0.00 0.00 175.26 174.64 1y0l s PRO 227 N -3.67 4.35 0.19 0.39 0.02 -1.26 -4.45 135.00 130.56 1y0l s PRO 227 Ca 0.26 1.88 -0.31 0.00 0.02 0.00 0.00 61.00 62.86 1y0l s PRO 227 Cb 0.01 -3.44 -0.10 0.00 0.02 0.00 0.00 34.50 30.99 1y0l s PRO 227 CO 0.10 -0.43 1.51 0.21 -0.33 0.00 0.00 177.00 178.06 1y0l s LYS 228 N 1.70 4.24 0.40 5.54 2.20 -1.26 -4.97 119.74 127.60 1y0l s LYS 228 Ca 0.61 2.32 -0.20 0.00 -0.36 0.00 0.00 55.97 58.34 1y0l s LYS 228 Cb -0.31 -3.15 -0.11 0.00 -1.51 0.00 0.00 37.83 32.76 1y0l s LYS 228 CO 0.27 -0.53 0.91 0.45 -0.36 0.00 0.00 175.35 176.09 1y0l s SER 232 N 0.88 6.93 0.00 1.43 0.15 -1.26 -5.00 113.70 116.83 1y0l s SER 232 Ca 0.66 1.62 0.14 0.00 0.70 0.00 0.00 55.95 59.07 1y0l s SER 232 Cb -0.42 -2.51 0.11 0.00 -1.71 0.00 0.00 66.02 61.48 1y0l s SER 232 CO 0.35 -0.31 0.93 0.00 1.20 0.00 0.00 173.24 175.41