#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h0d s VAL 2 N 0.00 3.22 -0.02 2.62 1.01 -1.26 -4.38 120.40 121.59 1h0d s VAL 2 Ca 0.00 1.22 -0.03 0.00 0.00 0.00 0.00 61.98 63.17 1h0d s VAL 2 Cb 0.00 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.61 1h0d s VAL 2 CO 0.00 0.29 0.08 -0.04 0.00 0.00 0.00 175.10 175.43 1h0d s MET 3 N -1.51 0.21 -0.21 2.72 -1.94 -0.77 -5.00 119.30 112.80 1h0d s MET 3 Ca 0.46 -0.10 -0.05 0.00 -1.71 0.00 0.00 55.69 54.30 1h0d s MET 3 Cb -0.35 0.09 0.07 0.00 2.01 0.00 0.00 34.83 36.66 1h0d s MET 3 CO 0.45 -0.04 0.10 -0.51 -0.01 0.00 0.00 175.02 175.01 1h0d s LEU 4 N -0.47 0.44 -0.31 -0.03 1.43 -1.26 -1.52 118.68 116.97 1h0d s LEU 4 Ca -0.05 -0.84 -0.09 0.00 -1.03 0.00 0.00 54.13 52.11 1h0d s LEU 4 Cb -0.03 -0.29 -0.01 0.00 0.03 0.00 0.00 46.19 45.89 1h0d s LEU 4 CO 0.00 -0.38 0.15 -0.69 0.23 0.00 0.00 176.35 175.66 1h0d s VAL 5 N 2.11 4.59 0.34 -1.59 1.01 0.19 -4.07 120.40 122.98 1h0d s VAL 5 Ca 0.04 -0.40 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 1h0d s VAL 5 Cb -0.16 -3.33 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 1h0d s VAL 5 CO -0.18 0.08 0.62 -1.61 0.00 0.00 0.00 175.10 174.01 1h0d s GLU 6 N 1.61 3.64 0.24 2.72 8.01 -1.26 -0.09 118.70 133.58 1h0d s GLU 6 Ca 0.05 0.08 -0.22 0.00 0.01 0.00 0.00 54.97 54.89 1h0d s GLU 6 Cb -0.17 -2.57 0.03 0.00 -4.31 0.00 0.00 34.13 27.11 1h0d s GLU 6 CO 0.06 0.12 0.80 -1.54 0.01 0.00 0.00 175.26 174.71 1h0d s SER 7 N -3.34 -0.22 0.00 -0.19 1.04 -0.61 -4.81 113.70 105.56 1h0d s SER 7 Ca 0.45 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 56.32 1h0d s SER 7 Cb -0.10 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1h0d s SER 7 CO 0.32 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.93 1h0d n GLY 8 N -0.47 0.56 3.92 7.32 0.00 -1.26 -1.96 105.19 113.30 1h0d n GLY 8 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 1h0d n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h0d s GLY 9 N -1.17 1.65 0.00 -0.02 0.00 -1.26 -4.60 107.32 101.91 1h0d s GLY 9 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1h0d s GLY 9 CO 0.00 -0.35 0.00 0.61 0.00 0.00 0.00 173.10 173.36 1h0d n GLY 10 N -3.17 -0.82 3.70 0.20 0.00 -0.14 -4.89 105.19 100.08 1h0d n GLY 10 Ca 0.09 -1.00 -0.38 0.00 0.00 0.00 0.00 46.02 44.73 1h0d n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1h0d s LEU 11 N 0.00 4.22 0.02 0.99 2.96 -1.26 -1.42 118.68 124.19 1h0d s LEU 11 Ca 0.00 0.63 0.02 0.00 -0.22 0.00 0.00 54.13 54.56 1h0d s LEU 11 Cb 0.00 -2.55 -0.01 0.00 0.50 0.00 0.00 46.19 44.13 1h0d s LEU 11 CO 0.00 -0.01 -0.07 0.54 -1.32 0.00 0.00 176.35 175.50 1h0d s VAL 12 N 0.84 0.51 0.36 1.68 0.11 -0.25 -4.98 120.40 118.67 1h0d s VAL 12 Ca 0.21 -0.68 -0.25 0.00 -2.93 0.00 0.00 61.98 58.32 1h0d s VAL 12 Cb -0.14 -0.51 -0.09 0.00 -1.53 0.00 0.00 36.38 34.11 1h0d s VAL 12 CO 0.08 -0.14 1.05 -0.54 -3.33 0.00 0.00 175.10 172.22 1h0d s LYS 13 N -0.89 4.32 0.26 1.54 1.02 -1.25 -1.21 119.74 123.53 1h0d s LYS 13 Ca -0.04 1.56 -0.30 0.00 0.02 0.00 0.00 55.97 57.21 1h0d s LYS 13 Cb -0.06 -2.72 -0.14 0.00 -0.52 0.00 0.00 37.83 34.39 1h0d s LYS 13 CO 0.00 -0.02 1.14 -2.30 -0.92 0.00 0.00 175.35 173.26 1h0d n PRO 14 N 0.28 1.52 0.00 -1.68 -0.02 -1.26 0.17 135.00 134.01 1h0d n PRO 14 Ca 0.03 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1h0d n PRO 14 Cb 0.49 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1h0d n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h0d n GLY 15 N 1.48 2.63 0.00 -1.23 0.00 0.41 -4.94 105.19 103.54 1h0d n GLY 15 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1h0d n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h0d n GLY 16 N -2.00 -2.22 3.23 -0.02 0.00 0.13 -3.73 105.19 100.58 1h0d n GLY 16 Ca 0.00 -1.48 -0.13 0.00 0.00 0.00 0.00 46.02 44.41 1h0d n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h0d s SER 17 N -1.43 1.46 -0.18 1.61 0.01 -1.26 -1.86 113.70 112.05 1h0d s SER 17 Ca 0.00 -1.06 -0.28 0.00 1.31 0.00 0.00 55.95 55.93 1h0d s SER 17 Cb 0.00 0.05 0.09 0.00 0.21 0.00 0.00 66.02 66.37 1h0d s SER 17 CO 0.00 -0.44 0.80 -0.22 0.41 0.00 0.00 173.24 173.80 1h0d s LEU 18 N -3.14 -0.61 -0.15 2.44 2.96 -0.54 -4.99 118.68 114.66 1h0d s LEU 18 Ca 0.17 0.95 0.00 0.00 -0.22 0.00 0.00 54.13 55.03 1h0d s LEU 18 Cb 0.04 2.30 0.03 0.00 0.50 0.00 0.00 46.19 49.06 1h0d s LEU 18 CO 0.00 -0.37 -0.12 -0.75 -1.32 0.00 0.00 176.35 173.80 1h0d s LYS 19 N -0.39 2.08 0.17 1.98 2.20 -1.26 0.03 119.74 124.55 1h0d s LYS 19 Ca -0.03 -0.55 -0.06 0.00 -0.36 0.00 0.00 55.97 54.96 1h0d s LYS 19 Cb -0.03 -2.07 -0.06 0.00 -1.51 0.00 0.00 37.83 34.16 1h0d s LYS 19 CO 0.03 -0.28 0.43 -0.51 -0.36 0.00 0.00 175.35 174.66 1h0d s LEU 20 N 1.52 4.23 0.07 5.43 1.02 -0.09 -4.71 118.68 126.14 1h0d s LEU 20 Ca 0.04 0.68 0.03 0.00 0.02 0.00 0.00 54.13 54.90 1h0d s LEU 20 Cb -0.13 -3.42 -0.03 0.00 0.02 0.00 0.00 46.19 42.62 1h0d s LEU 20 CO -0.10 0.01 -0.08 -0.94 0.02 0.00 0.00 176.35 175.25 1h0d s SER 21 N -2.45 1.07 -0.22 2.29 1.04 -0.83 -1.51 113.70 113.09 1h0d s SER 21 Ca 0.43 -0.71 -0.02 0.00 0.48 0.00 0.00 55.95 56.13 1h0d s SER 21 Cb -0.12 0.04 0.07 0.00 0.10 0.00 0.00 66.02 66.11 1h0d s SER 21 CO 0.24 -0.27 0.05 0.00 0.98 0.00 0.00 173.24 174.24 1h0d s ALA 23 N 1.82 3.51 -0.03 0.00 0.00 0.88 -1.59 121.76 126.36 1h0d s ALA 23 Ca 0.02 -0.31 -0.06 0.00 0.00 0.00 0.00 51.96 51.61 1h0d s ALA 23 Cb -0.17 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 1h0d s ALA 23 CO -0.13 -1.34 0.22 0.00 0.00 0.00 0.00 175.76 174.51 1h0d s ALA 24 N 3.23 3.88 0.25 0.00 0.00 -0.13 -0.63 121.76 128.35 1h0d s ALA 24 Ca 0.37 -0.62 -0.18 0.00 0.00 0.00 0.00 51.96 51.53 1h0d s ALA 24 Cb -0.13 -2.01 0.02 0.00 0.00 0.00 0.00 23.12 20.99 1h0d s ALA 24 CO 0.14 0.66 0.60 -1.54 0.00 0.00 0.00 175.76 175.62 1h0d s SER 25 N -1.56 -0.23 0.00 0.00 1.04 -0.58 -4.84 113.70 107.53 1h0d s SER 25 Ca 0.24 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 56.03 1h0d s SER 25 Cb -0.13 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1h0d s SER 25 CO 0.14 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.76 1h0d n GLY 26 N -0.41 0.84 3.82 7.32 0.00 -1.26 -1.85 105.19 113.64 1h0d n GLY 26 Ca -0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 1h0d n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1h0d s PHE 27 N -3.27 -0.07 -1.08 1.61 -0.12 -1.26 -4.46 117.98 109.33 1h0d s PHE 27 Ca 0.00 -0.37 -0.21 0.00 -0.05 0.00 0.00 56.93 56.31 1h0d s PHE 27 Cb 0.00 0.71 0.07 0.00 -0.63 0.00 0.00 43.02 43.17 1h0d s PHE 27 CO 0.00 -1.10 1.47 0.99 -0.05 0.00 0.00 175.22 176.53 1h0d s THR 28 N -3.11 4.15 0.19 -4.49 2.01 -1.26 -4.89 115.64 108.23 1h0d s THR 28 Ca 0.14 -1.26 -0.22 0.00 0.31 0.00 0.00 61.69 60.66 1h0d s THR 28 Cb -0.04 -5.04 0.09 0.00 0.01 0.00 0.00 72.50 67.53 1h0d s THR 28 CO 0.06 -1.88 1.44 0.33 -0.69 0.00 0.00 174.62 173.88 1h0d n PHE 29 N 8.24 -0.17 0.11 4.92 7.35 -1.26 -0.50 117.46 136.15 1h0d n PHE 29 Ca 0.36 1.15 0.03 0.00 -0.76 0.00 0.00 57.45 58.23 1h0d n PHE 29 Cb 0.49 -0.73 0.14 0.00 0.35 0.00 0.00 39.48 39.73 1h0d n PHE 29 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1h0d n SER 30 N -5.28 0.09 -0.93 -2.13 3.41 -1.26 -2.19 113.62 105.34 1h0d n SER 30 Ca 0.06 0.54 0.07 0.00 -0.26 0.00 0.00 58.87 59.27 1h0d n SER 30 Cb 0.31 -0.55 0.21 0.00 -0.26 0.00 0.00 64.21 63.92 1h0d n SER 30 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1h0d n SER 31 N -1.62 2.68 -3.92 4.04 7.64 0.34 -4.58 113.62 118.20 1h0d n SER 31 Ca 0.00 -2.11 -0.11 0.00 1.01 0.00 0.00 58.87 57.67 1h0d n SER 31 Cb 0.04 -0.36 -0.13 0.00 -1.01 0.00 0.00 64.21 62.75 1h0d n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1h0d s TYR 32 N -1.53 0.12 0.40 1.43 1.51 -0.93 -4.95 117.35 113.41 1h0d s TYR 32 Ca 0.31 -0.24 -0.25 0.00 -1.01 0.00 0.00 57.07 55.87 1h0d s TYR 32 Cb 0.17 -0.09 -0.09 0.00 -0.11 0.00 0.00 41.96 41.85 1h0d s TYR 32 CO 0.18 -0.09 1.12 0.99 -1.11 0.00 0.00 175.55 176.65 1h0d s THR 33 N -0.67 3.38 0.12 -0.71 2.01 -1.26 -3.96 115.64 114.56 1h0d s THR 33 Ca -0.07 1.12 0.06 0.00 0.31 0.00 0.00 61.69 63.11 1h0d s THR 33 Cb -0.05 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1h0d s THR 33 CO -0.00 0.07 -0.14 -0.04 -0.69 0.00 0.00 174.62 173.81 1h0d s MET 34 N -2.35 1.02 0.17 4.92 1.00 0.18 -1.76 119.30 122.48 1h0d s MET 34 Ca 0.57 -1.25 -0.03 0.00 0.00 0.00 0.00 55.69 54.99 1h0d s MET 34 Cb -0.27 -0.90 -0.03 0.00 0.00 0.00 0.00 34.83 33.63 1h0d s MET 34 CO 0.34 0.17 0.13 -1.12 0.00 0.00 0.00 175.02 174.55 1h0d s SER 35 N -2.48 0.19 -0.08 3.03 0.01 0.51 -0.91 113.70 113.97 1h0d s SER 35 Ca 0.09 -1.23 0.04 0.00 1.31 0.00 0.00 55.95 56.17 1h0d s SER 35 Cb -0.05 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.55 1h0d s SER 35 CO 0.03 -0.81 -0.21 0.26 0.41 0.00 0.00 173.24 172.91 1h0d s TRP 36 N -4.08 2.28 -0.03 2.43 0.52 -0.16 -0.73 118.94 119.17 1h0d s TRP 36 Ca 0.29 -0.87 0.02 0.00 0.02 0.00 0.00 56.10 55.56 1h0d s TRP 36 Cb 0.06 -1.53 0.01 0.00 -1.15 0.00 0.00 33.47 30.86 1h0d s TRP 36 CO 0.06 -0.35 -0.07 0.08 0.02 0.00 0.00 176.95 176.69 1h0d s VAL 37 N 0.30 0.68 0.14 4.03 1.01 -0.38 -1.03 120.40 125.16 1h0d s VAL 37 Ca -0.15 -0.27 0.08 0.00 0.00 0.00 0.00 61.98 61.64 1h0d s VAL 37 Cb -0.16 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 1h0d s VAL 37 CO 0.07 0.23 -0.11 0.00 0.00 0.00 0.00 175.10 175.28 1h0d s ARG 38 N 0.40 2.03 -0.19 2.72 1.70 -0.18 0.49 118.95 125.92 1h0d s ARG 38 Ca -0.06 -1.17 0.01 0.00 -0.47 0.00 0.00 55.73 54.05 1h0d s ARG 38 Cb -0.10 -2.20 0.03 0.00 -0.57 0.00 0.00 34.95 32.11 1h0d s ARG 38 CO 0.00 0.47 -0.18 -1.14 -1.08 0.00 0.00 175.30 173.38 1h0d s GLN 39 N -2.49 2.78 0.86 3.89 0.74 -0.08 -0.26 119.66 125.10 1h0d s GLN 39 Ca 0.22 -0.92 -0.12 0.00 0.05 0.00 0.00 55.36 54.60 1h0d s GLN 39 Cb -0.10 -2.60 0.11 0.00 1.10 0.00 0.00 33.01 31.52 1h0d s GLN 39 CO 0.14 -0.29 1.12 0.95 -0.55 0.00 0.00 175.29 176.66 1h0d s THR 40 N 1.27 2.49 0.46 -0.34 -4.23 -0.77 -1.08 115.64 113.44 1h0d s THR 40 Ca 0.02 0.16 0.17 0.00 -1.18 0.00 0.00 61.69 60.86 1h0d s THR 40 Cb -0.14 -2.90 0.35 0.00 1.34 0.00 0.00 72.50 71.15 1h0d s THR 40 CO -0.11 -0.21 1.98 -0.65 -0.54 0.00 0.00 174.62 175.09 1h0d h PRO 41 N -1.32 0.28 0.00 3.99 0.11 -1.92 0.22 132.00 133.36 1h0d h PRO 41 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1h0d h PRO 41 Cb 1.30 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1h0d h PRO 41 CO 0.60 0.19 0.00 0.39 -0.21 0.00 0.00 178.00 178.97 1h0d n GLU 42 N -4.45 0.87 -0.91 1.05 4.71 -1.26 -4.90 120.64 115.75 1h0d n GLU 42 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.25 1h0d n GLU 42 Cb 0.44 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.38 1h0d n GLU 42 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1h0d n LYS 43 N -1.00 0.00 -2.85 3.49 5.02 0.77 -5.06 118.16 118.54 1h0d n LYS 43 Ca 0.21 0.24 -0.31 0.00 -2.02 0.00 0.00 58.31 56.43 1h0d n LYS 43 Cb 0.09 -3.20 -0.04 0.00 -0.02 0.00 0.00 35.03 31.86 1h0d n LYS 43 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1h0d s ARG 44 N -1.01 3.86 -0.18 1.97 1.81 -1.26 -4.82 118.95 119.32 1h0d s ARG 44 Ca 0.00 0.59 -0.07 0.00 -1.72 0.00 0.00 55.73 54.53 1h0d s ARG 44 Cb 0.00 -2.36 -0.04 0.00 -0.45 0.00 0.00 34.95 32.10 1h0d s ARG 44 CO 0.00 -0.03 0.06 -0.51 -0.68 0.00 0.00 175.30 174.14 1h0d s LEU 45 N -3.68 3.79 -0.11 2.53 1.43 -1.26 -1.85 118.68 119.53 1h0d s LEU 45 Ca 0.53 0.08 -0.01 0.00 -1.03 0.00 0.00 54.13 53.70 1h0d s LEU 45 Cb -0.10 -1.96 0.03 0.00 0.03 0.00 0.00 46.19 44.19 1h0d s LEU 45 CO 0.28 0.18 -0.05 -1.61 0.23 0.00 0.00 176.35 175.38 1h0d s GLU 46 N 0.34 1.28 0.24 1.70 2.02 0.64 -4.98 118.70 119.95 1h0d s GLU 46 Ca 0.03 -0.20 -0.30 0.00 0.02 0.00 0.00 54.97 54.52 1h0d s GLU 46 Cb -0.12 -1.49 -0.10 0.00 0.10 0.00 0.00 34.13 32.52 1h0d s GLU 46 CO 0.00 -0.30 1.40 -0.46 0.02 0.00 0.00 175.26 175.92 1h0d s TRP 47 N 1.77 3.08 -0.05 1.61 -0.00 -1.26 -1.02 118.94 123.07 1h0d s TRP 47 Ca 0.04 1.11 0.04 0.00 -0.00 0.00 0.00 56.10 57.30 1h0d s TRP 47 Cb -0.13 -3.75 -0.06 0.00 -0.00 0.00 0.00 33.47 29.53 1h0d s TRP 47 CO -0.07 -2.40 0.01 0.28 -0.00 0.00 0.00 176.95 174.76 1h0d n VAL 48 N 2.27 0.36 -3.62 5.86 0.31 -0.19 -4.73 118.33 118.59 1h0d n VAL 48 Ca 0.06 -0.22 -0.04 0.00 -0.01 0.00 0.00 64.34 64.13 1h0d n VAL 48 Cb 0.41 -0.85 -0.04 0.00 -0.91 0.00 0.00 33.84 32.45 1h0d n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1h0d s ALA 49 N -2.13 -2.07 0.01 3.52 0.00 -1.13 -4.28 121.76 115.69 1h0d s ALA 49 Ca -0.03 1.78 0.00 0.00 0.00 0.00 0.00 51.96 53.71 1h0d s ALA 49 Cb 0.02 -1.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 1h0d s ALA 49 CO 0.21 -0.33 -0.02 0.99 0.00 0.00 0.00 175.76 176.61 1h0d s THR 50 N -1.32 0.14 0.00 0.00 2.01 -0.85 -0.99 115.64 114.63 1h0d s THR 50 Ca 0.07 -0.43 0.00 0.00 0.31 0.00 0.00 61.69 61.64 1h0d s THR 50 Cb -0.01 -0.19 0.00 0.00 0.01 0.00 0.00 72.50 72.31 1h0d s THR 50 CO -0.05 -0.19 0.00 0.00 -0.69 0.00 0.00 174.62 173.69 1h0d n ILE 51 N 2.43 0.00 -0.01 1.82 3.06 -0.08 -0.73 119.36 125.83 1h0d n ILE 51 Ca -0.17 0.00 -0.12 0.00 -2.50 0.00 0.00 62.75 59.96 1h0d n ILE 51 Cb 0.58 0.00 -0.14 0.00 0.54 0.00 0.00 39.64 40.62 1h0d n ILE 51 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 1h0d n SER 52 N -0.84 1.25 0.13 9.51 3.41 -1.25 -0.65 113.62 125.17 1h0d n SER 52 Ca 0.00 0.35 0.05 0.00 -0.26 0.00 0.00 58.87 59.01 1h0d n SER 52 Cb 0.00 -0.30 0.03 0.00 -0.26 0.00 0.00 64.21 63.68 1h0d n SER 52 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1h0d h GLY 53 N 2.79 0.00 0.00 5.00 0.00 -1.89 -3.43 103.07 105.53 1h0d h GLY 53 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1h0d h GLY 53 CO 0.08 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.23 1h0d n GLY 54 N 1.23 0.69 0.08 4.60 0.00 -1.26 -4.95 105.19 105.58 1h0d n GLY 54 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1h0d n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h0d n GLY 55 N -2.00 -1.54 3.19 -0.02 0.00 -1.26 -4.82 105.19 98.73 1h0d n GLY 55 Ca 0.00 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.56 1h0d n GLY 55 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h0d s ASN 56 N -4.29 2.95 0.04 1.61 0.01 -1.26 -5.13 114.94 108.87 1h0d s ASN 56 Ca 0.08 -0.54 0.06 0.00 -0.71 0.00 0.00 52.86 51.76 1h0d s ASN 56 Cb 0.13 -1.35 -0.02 0.00 0.41 0.00 0.00 41.25 40.42 1h0d s ASN 56 CO 0.66 0.13 -0.18 0.42 -1.51 0.00 0.00 177.10 176.62 1h0d s THR 57 N 0.45 1.46 0.01 1.60 -4.23 -1.26 -4.27 115.64 109.40 1h0d s THR 57 Ca -0.17 -1.13 0.02 0.00 -1.18 0.00 0.00 61.69 59.24 1h0d s THR 57 Cb -0.17 -1.28 -0.01 0.00 1.34 0.00 0.00 72.50 72.37 1h0d s THR 57 CO 0.07 0.12 -0.08 -0.31 -0.54 0.00 0.00 174.62 173.88 1h0d s TYR 58 N -0.83 0.69 0.02 3.99 1.51 0.09 -4.97 117.35 117.84 1h0d s TYR 58 Ca 0.05 -0.25 -0.04 0.00 -1.01 0.00 0.00 57.07 55.82 1h0d s TYR 58 Cb -0.08 -0.43 -0.01 0.00 -0.11 0.00 0.00 41.96 41.33 1h0d s TYR 58 CO 0.02 -0.02 0.06 0.71 -1.11 0.00 0.00 175.55 175.20 1h0d s TYR 59 N -0.60 0.16 0.52 2.71 1.51 -1.26 -2.01 117.35 118.38 1h0d s TYR 59 Ca -0.01 -0.37 -0.18 0.00 -1.01 0.00 0.00 57.07 55.50 1h0d s TYR 59 Cb -0.05 -0.13 -0.07 0.00 -0.11 0.00 0.00 41.96 41.60 1h0d s TYR 59 CO 0.00 -0.27 1.02 -2.14 -1.11 0.00 0.00 175.55 173.05 1h0d s PRO 60 N -1.70 3.75 0.43 -1.71 0.02 -1.26 -4.90 135.00 129.63 1h0d s PRO 60 Ca -0.13 1.15 0.14 0.00 0.02 0.00 0.00 61.00 62.18 1h0d s PRO 60 Cb -0.07 -2.10 1.01 0.00 0.02 0.00 0.00 34.50 33.37 1h0d s PRO 60 CO -0.01 -0.45 1.96 -0.44 -0.33 0.00 0.00 177.00 177.73 1h0d h ASP 61 N 1.05 0.40 -0.03 2.53 5.19 -1.97 -2.59 116.42 120.99 1h0d h ASP 61 Ca -0.48 0.01 0.01 0.00 -0.62 0.00 0.00 57.03 55.95 1h0d h ASP 61 Cb 1.20 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.64 1h0d h ASP 61 CO 0.60 0.23 0.05 0.77 -3.12 0.00 0.00 179.24 177.76 1h0d h SER 62 N 0.44 0.00 0.00 6.45 4.64 -1.99 -3.05 113.55 120.05 1h0d h SER 62 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1h0d h SER 62 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1h0d h SER 62 CO -0.09 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.20 1h0d n VAL 63 N -3.57 0.08 -2.00 0.95 0.24 -1.01 -4.99 118.33 108.03 1h0d n VAL 63 Ca -0.02 -0.42 -0.42 0.00 -2.04 0.00 0.00 64.34 61.44 1h0d n VAL 63 Cb 0.13 1.17 -0.03 0.00 -1.47 0.00 0.00 33.84 33.64 1h0d n VAL 63 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1h0d s LYS 64 N -0.08 4.24 0.00 7.34 2.20 -1.03 -1.28 119.74 131.14 1h0d s LYS 64 Ca 0.00 2.28 0.00 0.00 -0.36 0.00 0.00 55.97 57.89 1h0d s LYS 64 Cb 0.00 -3.20 0.00 0.00 -1.51 0.00 0.00 37.83 33.12 1h0d s LYS 64 CO 0.00 -0.57 0.00 0.41 -0.36 0.00 0.00 175.35 174.83 1h0d n GLY 65 N 3.70 1.53 0.00 5.54 0.00 -1.26 -4.83 105.19 109.87 1h0d n GLY 65 Ca 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.15 1h0d n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h0d n ARG 66 N -2.00 3.33 -4.29 1.61 1.74 -0.40 -5.05 116.66 111.59 1h0d n ARG 66 Ca 0.00 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.76 1h0d n ARG 66 Cb 0.00 -1.02 -0.09 0.00 -1.02 0.00 0.00 32.46 30.33 1h0d n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1h0d s PHE 67 N -2.02 3.06 -0.04 -1.55 0.40 -0.45 -4.44 117.98 112.94 1h0d s PHE 67 Ca -0.00 0.07 -0.01 0.00 -0.60 0.00 0.00 56.93 56.39 1h0d s PHE 67 Cb 0.00 -1.66 0.03 0.00 0.51 0.00 0.00 43.02 41.90 1h0d s PHE 67 CO 0.03 0.45 0.02 0.99 0.70 0.00 0.00 175.22 177.41 1h0d s THR 68 N -1.08 0.15 0.08 0.64 2.01 -0.05 -4.89 115.64 112.50 1h0d s THR 68 Ca 0.19 0.18 0.02 0.00 0.31 0.00 0.00 61.69 62.40 1h0d s THR 68 Cb -0.11 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 72.06 1h0d s THR 68 CO 0.10 0.18 0.11 -0.51 -0.69 0.00 0.00 174.62 173.81 1h0d s ILE 69 N 1.50 4.73 0.26 1.82 2.07 -1.26 0.11 121.20 130.43 1h0d s ILE 69 Ca -0.03 -0.70 -0.20 0.00 -1.41 0.00 0.00 60.65 58.31 1h0d s ILE 69 Cb -0.13 -3.30 0.06 0.00 0.13 0.00 0.00 42.46 39.23 1h0d s ILE 69 CO -0.03 0.11 0.92 -0.94 -1.91 0.00 0.00 174.94 173.09 1h0d s SER 70 N -2.47 -0.04 -0.08 4.50 1.04 -0.84 -4.98 113.70 110.84 1h0d s SER 70 Ca 0.31 -0.81 -0.10 0.00 0.48 0.00 0.00 55.95 55.83 1h0d s SER 70 Cb -0.12 0.64 0.02 0.00 0.10 0.00 0.00 66.02 66.66 1h0d s SER 70 CO 0.23 -1.26 0.26 0.00 0.98 0.00 0.00 173.24 173.45 1h0d s ARG 71 N -2.48 0.37 -0.61 4.02 1.70 -1.26 -0.40 118.95 120.28 1h0d s ARG 71 Ca 0.18 0.23 -0.06 0.00 -0.47 0.00 0.00 55.73 55.60 1h0d s ARG 71 Cb -0.04 0.17 0.16 0.00 -0.57 0.00 0.00 34.95 34.68 1h0d s ARG 71 CO 0.07 -0.06 0.46 0.34 -1.08 0.00 0.00 175.30 175.03 1h0d s ASP 72 N -0.18 5.62 0.15 -2.89 -1.08 0.31 -4.97 116.67 113.63 1h0d s ASP 72 Ca -0.03 -2.56 -0.31 0.00 -0.52 0.00 0.00 52.55 49.12 1h0d s ASP 72 Cb -0.03 -1.95 -0.08 0.00 -1.46 0.00 0.00 42.92 39.40 1h0d s ASP 72 CO 0.01 -0.49 1.55 0.40 0.52 0.00 0.00 175.17 177.16 1h0d h ILE 73 N 5.45 0.01 -0.51 4.11 2.04 -1.97 -0.26 117.51 126.38 1h0d h ILE 73 Ca -0.04 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.88 1h0d h ILE 73 Cb 1.00 0.01 -0.09 0.00 -0.74 0.00 0.00 36.82 37.00 1h0d h ILE 73 CO 0.75 0.00 -0.55 0.00 0.00 0.00 0.00 178.15 178.35 1h0d h ALA 74 N 0.21 -0.69 0.00 1.87 0.00 -1.97 0.34 119.26 119.02 1h0d h ALA 74 Ca 0.11 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1h0d h ALA 74 Cb 0.53 1.14 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1h0d h ALA 74 CO -0.72 -1.01 0.00 1.63 0.00 0.00 0.00 179.25 179.14 1h0d n LYS 75 N -5.36 0.67 -3.96 0.00 5.02 -0.81 -4.88 118.16 108.85 1h0d n LYS 75 Ca -0.02 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.93 1h0d n LYS 75 Cb 0.33 -1.32 -0.00 0.00 -0.02 0.00 0.00 35.03 34.02 1h0d n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1h0d n ASN 76 N -0.82 -2.66 -3.81 4.39 4.13 0.12 -4.75 115.26 111.85 1h0d n ASN 76 Ca 0.10 -1.13 -0.14 0.00 1.68 0.00 0.00 54.58 55.10 1h0d n ASN 76 Cb 0.05 -2.57 -0.15 0.00 -1.54 0.00 0.00 39.78 35.57 1h0d n ASN 76 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1h0d s THR 77 N -3.76 -0.04 0.13 3.41 2.01 -1.05 -0.95 115.64 115.40 1h0d s THR 77 Ca 0.28 0.13 0.02 0.00 0.31 0.00 0.00 61.69 62.42 1h0d s THR 77 Cb -0.13 -0.05 -0.04 0.00 0.01 0.00 0.00 72.50 72.30 1h0d s THR 77 CO 0.92 0.05 0.28 -0.22 -0.69 0.00 0.00 174.62 174.96 1h0d s LEU 78 N 0.64 4.33 0.05 4.42 2.96 -0.62 -0.53 118.68 129.94 1h0d s LEU 78 Ca -0.05 0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.09 1h0d s LEU 78 Cb -0.08 -2.95 -0.03 0.00 0.50 0.00 0.00 46.19 43.63 1h0d s LEU 78 CO -0.02 0.07 -0.06 -0.31 -1.32 0.00 0.00 176.35 174.71 1h0d s TYR 79 N -1.70 0.64 -0.22 5.38 2.02 0.46 -0.48 117.35 123.44 1h0d s TYR 79 Ca 0.35 -0.66 -0.02 0.00 -0.37 0.00 0.00 57.07 56.36 1h0d s TYR 79 Cb -0.11 -0.39 0.07 0.00 -0.40 0.00 0.00 41.96 41.12 1h0d s TYR 79 CO 0.28 -0.15 0.04 -1.17 -1.57 0.00 0.00 175.55 172.99 1h0d s LEU 80 N -2.05 1.42 -0.32 -1.29 2.96 -0.57 -1.98 118.68 116.85 1h0d s LEU 80 Ca -0.04 -1.00 -0.18 0.00 -0.22 0.00 0.00 54.13 52.68 1h0d s LEU 80 Cb -0.04 -0.67 -0.01 0.00 0.50 0.00 0.00 46.19 45.97 1h0d s LEU 80 CO -0.02 -0.33 0.53 -1.58 -1.32 0.00 0.00 176.35 173.63 1h0d s GLN 81 N 1.80 3.78 0.38 1.98 2.00 0.12 -0.91 119.66 128.80 1h0d s GLN 81 Ca 0.01 0.04 0.08 0.00 -2.00 0.00 0.00 55.36 53.48 1h0d s GLN 81 Cb -0.17 -3.75 -0.03 0.00 0.80 0.00 0.00 33.01 29.85 1h0d s GLN 81 CO -0.12 -0.56 0.27 -1.64 -0.50 0.00 0.00 175.29 172.74 1h0d s MET 82 N 2.42 2.49 0.00 1.67 -1.94 0.10 -0.87 119.30 123.17 1h0d s MET 82 Ca 0.20 -1.53 0.00 0.00 -1.71 0.00 0.00 55.69 52.66 1h0d s MET 82 Cb -0.15 -2.29 0.00 0.00 2.01 0.00 0.00 34.83 34.39 1h0d s MET 82 CO 0.12 -0.04 0.00 0.45 -0.01 0.00 0.00 175.02 175.54 1h0d n SER 82 N -1.36 0.00 -4.76 3.03 2.88 -0.78 -1.46 113.62 111.17 1h0d n SER 82 Ca -0.00 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.15 1h0d n SER 82 Cb 0.62 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.10 1h0d n SER 82 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1h0d s LEU 82 N -2.34 4.01 0.24 2.46 1.43 -0.80 -4.66 118.68 119.03 1h0d s LEU 82 Ca 0.00 2.87 0.09 0.00 -1.03 0.00 0.00 54.13 56.07 1h0d s LEU 82 Cb 0.00 -4.06 -0.05 0.00 0.03 0.00 0.00 46.19 42.11 1h0d s LEU 82 CO 0.00 -1.34 -0.16 -0.60 0.23 0.00 0.00 176.35 174.48 1h0d s ARG 83 N -2.63 1.47 0.53 1.70 6.06 -1.26 -0.44 118.95 124.38 1h0d s ARG 83 Ca 0.65 -1.67 0.24 0.00 -2.50 0.00 0.00 55.73 52.45 1h0d s ARG 83 Cb -0.43 -1.36 1.39 0.00 0.06 0.00 0.00 34.95 34.61 1h0d s ARG 83 CO 0.53 0.23 2.02 0.66 -2.50 0.00 0.00 175.30 176.24 1h0d h SER 84 N 2.43 0.00 0.63 -2.12 4.64 -1.96 0.29 113.55 117.46 1h0d h SER 84 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1h0d h SER 84 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1h0d h SER 84 CO 0.62 0.00 0.00 1.05 -0.87 0.00 0.00 176.83 177.63 1h0d h GLU 85 N 0.00 0.00 -0.06 4.77 4.11 -1.95 -2.49 114.58 118.96 1h0d h GLU 85 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.64 1h0d h GLU 85 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1h0d h GLU 85 CO -0.00 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.83 1h0d n ASP 86 N -2.62 1.06 -4.66 3.06 10.43 0.10 -4.85 116.55 119.07 1h0d n ASP 86 Ca 0.00 -1.48 -0.43 0.00 2.57 0.00 0.00 54.79 55.46 1h0d n ASP 86 Cb 0.21 -0.04 -0.02 0.00 1.84 0.00 0.00 41.12 43.10 1h0d n ASP 86 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1h0d s THR 87 N -1.93 3.85 0.00 -3.53 2.01 -0.94 -4.87 115.64 110.23 1h0d s THR 87 Ca 0.36 1.02 0.00 0.00 0.31 0.00 0.00 61.69 63.38 1h0d s THR 87 Cb 0.19 -3.67 0.00 0.00 0.01 0.00 0.00 72.50 69.03 1h0d s THR 87 CO 0.30 -0.10 0.00 0.00 -0.69 0.00 0.00 174.62 174.13 1h0d n ALA 88 N 6.97 0.00 -2.56 7.40 0.00 -0.55 -4.44 120.51 127.33 1h0d n ALA 88 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.20 1h0d n ALA 88 Cb 0.44 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.78 1h0d n ALA 88 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1h0d s LEU 89 N 0.00 4.39 -0.26 0.00 2.96 -0.24 -1.34 118.68 124.18 1h0d s LEU 89 Ca 0.00 -0.33 -0.19 0.00 -0.22 0.00 0.00 54.13 53.39 1h0d s LEU 89 Cb 0.00 -2.13 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 1h0d s LEU 89 CO 0.00 -0.19 0.56 -0.31 -1.32 0.00 0.00 176.35 175.09 1h0d s TYR 90 N 1.73 3.27 0.01 5.38 1.51 -0.54 -0.90 117.35 127.80 1h0d s TYR 90 Ca 0.06 0.69 -0.02 0.00 -1.01 0.00 0.00 57.07 56.79 1h0d s TYR 90 Cb -0.17 -2.78 -0.04 0.00 -0.11 0.00 0.00 41.96 38.86 1h0d s TYR 90 CO 0.10 -0.31 0.19 0.71 -1.11 0.00 0.00 175.55 175.14 1h0d s TYR 91 N 2.40 3.55 -0.19 2.71 2.02 0.18 -1.94 117.35 126.07 1h0d s TYR 91 Ca 0.23 0.34 -0.08 0.00 -0.37 0.00 0.00 57.07 57.20 1h0d s TYR 91 Cb -0.16 -1.82 -0.04 0.00 -0.40 0.00 0.00 41.96 39.54 1h0d s TYR 91 CO 0.09 0.63 0.07 0.00 -1.57 0.00 0.00 175.55 174.78 1h0d s THR 93 N 0.43 0.58 -0.20 0.00 -4.23 0.09 -1.01 115.64 111.31 1h0d s THR 93 Ca 0.04 -1.17 -0.09 0.00 -1.18 0.00 0.00 61.69 59.29 1h0d s THR 93 Cb -0.12 -0.72 -0.05 0.00 1.34 0.00 0.00 72.50 72.95 1h0d s THR 93 CO 0.00 -0.42 0.11 -0.60 -0.54 0.00 0.00 174.62 173.17 1h0d s ARG 94 N -1.79 4.07 0.07 3.99 3.52 -0.27 -0.36 118.95 128.18 1h0d s ARG 94 Ca -0.08 -0.28 -0.19 0.00 -0.13 0.00 0.00 55.73 55.05 1h0d s ARG 94 Cb -0.09 -3.36 -0.07 0.00 -1.56 0.00 0.00 34.95 29.88 1h0d s ARG 94 CO 0.00 0.24 0.56 -1.17 -0.81 0.00 0.00 175.30 174.11 1h0d s LEU 95 N 0.52 4.52 0.64 -0.88 2.96 -0.72 -1.74 118.68 123.97 1h0d s LEU 95 Ca 0.06 1.23 -0.09 0.00 -0.22 0.00 0.00 54.13 55.12 1h0d s LEU 95 Cb -0.12 -2.89 0.00 0.00 0.50 0.00 0.00 46.19 43.69 1h0d s LEU 95 CO 0.00 0.27 0.99 -0.83 -1.32 0.00 0.00 176.35 175.47 1h0d s GLY 96 N -1.13 1.61 0.00 7.98 0.00 0.33 -4.33 107.32 111.79 1h0d s GLY 96 Ca 0.29 -0.46 0.00 0.00 0.00 0.00 0.00 44.72 44.54 1h0d s GLY 96 CO 0.19 -0.15 0.00 2.09 0.00 0.00 0.00 173.10 175.22 1h0d n ASP 97 N -2.77 0.00 -0.34 1.64 5.68 -1.26 -3.88 116.55 115.63 1h0d n ASP 97 Ca 0.05 -0.96 0.12 0.00 -0.50 0.00 0.00 54.79 53.50 1h0d n ASP 97 Cb 0.57 0.00 0.31 0.00 -1.14 0.00 0.00 41.12 40.85 1h0d n ASP 97 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 1h0d h TYR 98 N -0.59 0.96 0.00 2.11 3.20 -1.98 0.21 116.97 120.89 1h0d h TYR 98 Ca 0.00 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1h0d h TYR 98 Cb 0.00 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 1h0d h TYR 98 CO 0.00 0.18 -0.05 0.78 -1.64 0.00 0.00 178.16 177.43 1h0d h GLY 99 N 0.68 0.00 -2.94 1.82 0.00 -2.04 0.33 103.07 100.93 1h0d h GLY 99 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.89 1h0d h GLY 99 CO -0.40 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.42 1h0d n TYR 100 N -3.90 1.66 -3.79 5.60 4.02 0.67 -4.94 117.16 116.48 1h0d n TYR 100 Ca -0.03 -0.74 -0.27 0.00 -0.01 0.00 0.00 57.90 56.86 1h0d n TYR 100 Cb 0.14 -0.40 0.04 0.00 -0.02 0.00 0.00 39.34 39.10 1h0d n TYR 100 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1h0d n ALA 100 N 0.45 -1.44 -4.19 -0.72 0.00 0.10 -2.86 120.51 111.85 1h0d n ALA 100 Ca 0.25 0.17 -0.31 0.00 0.00 0.00 0.00 53.44 53.55 1h0d n ALA 100 Cb 1.05 -4.21 -0.05 0.00 0.00 0.00 0.00 19.45 16.24 1h0d n ALA 100 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1h0d n TYR 100 N -4.67 -1.50 -2.44 0.00 0.53 -0.74 -4.97 117.16 103.38 1h0d n TYR 100 Ca -0.04 0.71 -0.24 0.00 -1.02 0.00 0.00 57.90 57.31 1h0d n TYR 100 Cb 0.56 -3.08 0.09 0.00 -1.03 0.00 0.00 39.34 35.88 1h0d n TYR 100 CO 0.00 0.00 0.00 -0.08 -1.02 0.00 0.00 176.86 175.76 1h0d s THR 100 N -3.87 2.27 -0.45 -0.72 -1.32 -1.13 -4.69 115.64 105.72 1h0d s THR 100 Ca 0.25 -0.47 -0.07 0.00 -1.21 0.00 0.00 61.69 60.18 1h0d s THR 100 Cb -0.14 -2.80 0.11 0.00 -1.51 0.00 0.00 72.50 68.16 1h0d s THR 100 CO 0.95 0.00 0.30 -0.04 -2.21 0.00 0.00 174.62 173.62 1h0d s MET 100 N -5.16 2.34 0.17 7.08 -1.94 -1.26 0.12 119.30 120.66 1h0d s MET 100 Ca 0.64 -1.77 0.25 0.00 -1.71 0.00 0.00 55.69 53.09 1h0d s MET 100 Cb -0.08 -3.82 0.52 0.00 2.01 0.00 0.00 34.83 33.47 1h0d s MET 100 CO 0.44 -1.15 1.51 0.38 -0.01 0.00 0.00 175.02 176.19 1h0d h ASP 101 N 8.33 0.00 -3.61 3.03 3.04 -1.68 -3.46 116.42 122.08 1h0d h ASP 101 Ca -0.19 -0.11 -0.25 0.00 -3.24 0.00 0.00 57.03 53.24 1h0d h ASP 101 Cb 1.07 0.00 -0.30 0.00 -1.04 0.00 0.00 39.33 39.05 1h0d h ASP 101 CO 0.81 0.06 -0.66 -0.31 -2.04 0.00 0.00 179.24 177.09 1h0d s TYR 102 N -3.15 -0.06 -0.04 4.15 1.51 -1.24 -5.01 117.35 113.52 1h0d s TYR 102 Ca 0.08 0.22 0.06 0.00 -1.01 0.00 0.00 57.07 56.42 1h0d s TYR 102 Cb 0.12 -0.08 -0.01 0.00 -0.11 0.00 0.00 41.96 41.88 1h0d s TYR 102 CO 0.67 -0.08 -0.21 -1.58 -1.11 0.00 0.00 175.55 173.24 1h0d s TRP 103 N 0.61 1.99 0.95 2.71 0.52 -1.26 -1.12 118.94 123.35 1h0d s TRP 103 Ca -0.05 -0.50 -0.15 0.00 0.02 0.00 0.00 56.10 55.43 1h0d s TRP 103 Cb -0.07 -1.31 0.20 0.00 -1.15 0.00 0.00 33.47 31.15 1h0d s TRP 103 CO -0.02 -0.12 1.30 0.20 0.02 0.00 0.00 176.95 178.33 1h0d s GLY 104 N -0.25 1.79 0.00 0.98 0.00 -0.18 -4.89 107.32 104.78 1h0d s GLY 104 Ca 0.01 -1.31 0.29 0.00 0.00 0.00 0.00 44.72 43.71 1h0d s GLY 104 CO 0.01 -0.53 1.87 -1.06 0.00 0.00 0.00 173.10 173.39 1h0d n GLN 105 N -3.71 0.22 0.00 2.90 6.02 -1.26 -4.70 117.38 116.86 1h0d n GLN 105 Ca 0.16 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1h0d n GLN 105 Cb 0.59 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.36 1h0d n GLN 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1h0d n GLY 106 N 1.41 -1.49 3.05 1.08 0.00 -1.26 -4.99 105.19 102.98 1h0d n GLY 106 Ca 0.10 -1.52 -0.23 0.00 0.00 0.00 0.00 46.02 44.37 1h0d n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1h0d s THR 107 N -3.13 1.05 0.25 2.61 -1.32 -0.82 -4.83 115.64 109.45 1h0d s THR 107 Ca 0.00 -0.49 -0.12 0.00 -1.21 0.00 0.00 61.69 59.87 1h0d s THR 107 Cb 0.00 -0.93 -0.08 0.00 -1.51 0.00 0.00 72.50 69.99 1h0d s THR 107 CO 0.00 0.32 0.62 -0.94 -2.21 0.00 0.00 174.62 172.40 1h0d s SER 108 N 0.23 6.72 -0.06 8.08 1.04 -1.26 -1.46 113.70 126.99 1h0d s SER 108 Ca -0.05 1.08 0.02 0.00 0.48 0.00 0.00 55.95 57.47 1h0d s SER 108 Cb -0.11 -2.29 0.02 0.00 0.10 0.00 0.00 66.02 63.74 1h0d s SER 108 CO 0.02 -0.09 -0.10 -0.69 0.98 0.00 0.00 173.24 173.36 1h0d s VAL 109 N -1.81 0.95 -0.17 5.02 1.01 -0.45 -0.97 120.40 123.98 1h0d s VAL 109 Ca 0.48 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1h0d s VAL 109 Cb -0.12 -0.90 0.04 0.00 0.00 0.00 0.00 36.38 35.41 1h0d s VAL 109 CO 0.20 0.32 -0.08 -0.89 0.00 0.00 0.00 175.10 174.64 1h0d s THR 110 N 0.78 1.34 -0.38 3.92 2.01 -0.51 -1.48 115.64 121.32 1h0d s THR 110 Ca -0.13 -0.73 -0.13 0.00 0.31 0.00 0.00 61.69 61.01 1h0d s THR 110 Cb -0.15 -1.44 0.01 0.00 0.01 0.00 0.00 72.50 70.93 1h0d s THR 110 CO 0.02 0.20 0.25 -0.69 -0.69 0.00 0.00 174.62 173.72 1h0d s VAL 111 N 1.54 5.05 0.12 3.82 1.01 -1.26 -1.10 120.40 129.59 1h0d s VAL 111 Ca 0.01 -0.59 -0.25 0.00 0.00 0.00 0.00 61.98 61.15 1h0d s VAL 111 Cb -0.15 -3.75 0.07 0.00 0.00 0.00 0.00 36.38 32.55 1h0d s VAL 111 CO -0.08 -0.20 0.78 -0.55 0.00 0.00 0.00 175.10 175.06 1h0d s SER 112 N 1.66 -0.38 0.05 3.32 0.15 -0.35 -4.56 113.70 113.59 1h0d s SER 112 Ca 0.05 -0.17 0.22 0.00 0.70 0.00 0.00 55.95 56.75 1h0d s SER 112 Cb -0.19 0.53 -0.08 0.00 -1.71 0.00 0.00 66.02 64.57 1h0d s SER 112 CO 0.09 -0.90 0.88 -1.20 1.20 0.00 0.00 173.24 173.32 1h0d n SER 113 N -0.36 0.53 -4.74 5.45 7.64 -1.26 -3.90 113.62 116.97 1h0d n SER 113 Ca -0.10 -0.12 -0.38 0.00 1.01 0.00 0.00 58.87 59.28 1h0d n SER 113 Cb 0.62 1.05 0.06 0.00 -1.01 0.00 0.00 64.21 64.93 1h0d n SER 113 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h0d n ALA 114 N -1.97 1.35 -2.90 -0.43 0.00 -1.26 -4.99 120.51 110.31 1h0d n ALA 114 Ca 0.00 0.05 -0.32 0.00 0.00 0.00 0.00 53.44 53.18 1h0d n ALA 114 Cb 0.48 -2.34 -0.04 0.00 0.00 0.00 0.00 19.45 17.55 1h0d n ALA 114 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1h0d s LYS 115 N -3.18 3.45 0.20 0.00 1.02 -1.26 -5.02 119.74 114.94 1h0d s LYS 115 Ca 0.78 -0.40 -0.33 0.00 0.02 0.00 0.00 55.97 56.05 1h0d s LYS 115 Cb -0.39 -3.04 -0.13 0.00 -0.52 0.00 0.00 37.83 33.74 1h0d s LYS 115 CO 0.44 0.62 1.53 2.41 -0.92 0.00 0.00 175.35 179.43 1h0d n THR 116 N 0.41 0.36 -3.79 2.17 -1.04 -1.26 -4.69 114.28 106.45 1h0d n THR 116 Ca -0.06 -0.09 -0.13 0.00 -2.04 0.00 0.00 64.05 61.73 1h0d n THR 116 Cb 0.51 -1.56 -0.13 0.00 -1.82 0.00 0.00 70.33 67.33 1h0d n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1h0d s THR 117 N 0.56 -0.01 0.57 12.58 2.01 -1.26 -4.95 115.64 125.14 1h0d s THR 117 Ca 0.74 0.04 -0.13 0.00 0.31 0.00 0.00 61.69 62.66 1h0d s THR 117 Cb -0.65 -0.28 -0.05 0.00 0.01 0.00 0.00 72.50 71.52 1h0d s THR 117 CO 0.42 0.02 0.99 -2.16 -0.69 0.00 0.00 174.62 173.20 1h0d s PRO 118 N 0.39 3.72 0.50 4.92 0.04 -1.26 -2.16 135.00 141.15 1h0d s PRO 118 Ca -0.02 0.78 -0.17 0.00 0.04 0.00 0.00 61.00 61.63 1h0d s PRO 118 Cb -0.04 -2.12 -0.08 0.00 0.04 0.00 0.00 34.50 32.30 1h0d s PRO 118 CO -0.02 -0.43 0.98 -1.25 0.04 0.00 0.00 177.00 176.32 1h0d s PRO 119 N -4.75 3.99 -0.11 0.56 0.04 -1.26 -4.30 135.00 129.17 1h0d s PRO 119 Ca 0.56 0.97 -0.06 0.00 0.04 0.00 0.00 61.00 62.51 1h0d s PRO 119 Cb -0.11 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1h0d s PRO 119 CO 0.45 -0.23 0.11 -1.12 0.04 0.00 0.00 177.00 176.25 1h0d s SER 120 N -2.94 6.10 -0.15 6.66 0.01 0.48 -4.91 113.70 118.94 1h0d s SER 120 Ca 0.59 0.38 0.01 0.00 1.31 0.00 0.00 55.95 58.25 1h0d s SER 120 Cb -0.10 -1.92 0.02 0.00 0.21 0.00 0.00 66.02 64.23 1h0d s SER 120 CO 0.29 0.40 -0.19 -0.69 0.41 0.00 0.00 173.24 173.45 1h0d s VAL 121 N -1.01 1.93 -0.03 3.43 1.01 -1.26 -0.42 120.40 124.05 1h0d s VAL 121 Ca 0.15 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.32 1h0d s VAL 121 Cb -0.12 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 1h0d s VAL 121 CO 0.04 0.52 -0.23 -0.31 0.00 0.00 0.00 175.10 175.12 1h0d s TYR 122 N 1.13 2.43 0.28 5.22 2.02 0.02 -4.97 117.35 123.48 1h0d s TYR 122 Ca -0.00 -0.37 -0.29 0.00 -0.37 0.00 0.00 57.07 56.04 1h0d s TYR 122 Cb -0.14 -1.53 -0.09 0.00 -0.40 0.00 0.00 41.96 39.79 1h0d s TYR 122 CO -0.08 0.02 1.00 -1.25 -1.57 0.00 0.00 175.55 173.67 1h0d s PRO 123 N -0.64 4.69 -0.31 -1.71 0.04 -1.26 -0.93 135.00 134.88 1h0d s PRO 123 Ca 0.10 1.57 -0.01 0.00 0.04 0.00 0.00 61.00 62.70 1h0d s PRO 123 Cb -0.10 -3.12 0.06 0.00 0.04 0.00 0.00 34.50 31.38 1h0d s PRO 123 CO -0.01 0.33 0.00 -0.51 0.04 0.00 0.00 177.00 176.86 1h0d s LEU 124 N -1.52 3.98 0.10 -3.56 1.43 -0.53 -4.88 118.68 113.70 1h0d s LEU 124 Ca 0.45 -1.38 0.08 0.00 -1.03 0.00 0.00 54.13 52.25 1h0d s LEU 124 Cb -0.26 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 1h0d s LEU 124 CO 0.33 -0.28 -0.21 0.00 0.23 0.00 0.00 176.35 176.43 1h0d s ALA 125 N 1.21 1.78 0.39 4.21 0.00 -1.26 -1.24 121.76 126.85 1h0d s ALA 125 Ca -0.04 -1.22 -0.23 0.00 0.00 0.00 0.00 51.96 50.46 1h0d s ALA 125 Cb -0.20 -0.25 -0.13 0.00 0.00 0.00 0.00 23.12 22.54 1h0d s ALA 125 CO -0.02 0.36 0.59 -2.30 0.00 0.00 0.00 175.76 174.39 1h0d n PRO 126 N 1.15 0.61 0.04 0.00 -0.02 -1.26 -4.56 135.00 130.96 1h0d n PRO 126 Ca -0.19 0.22 -0.02 0.00 -2.02 0.00 0.00 63.50 61.49 1h0d n PRO 126 Cb 0.54 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.50 1h0d n PRO 126 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1h0d h GLY 127 N 0.94 -0.14 0.00 -1.23 0.00 -1.96 -3.22 103.07 97.46 1h0d h GLY 127 Ca -0.39 0.05 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1h0d h GLY 127 CO 0.53 -0.05 0.00 0.61 0.00 0.00 0.00 176.54 177.63 1h0d n GLY 128 N 0.73 0.43 3.57 4.60 0.00 -1.26 -3.54 105.19 109.73 1h0d n GLY 128 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1h0d n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h0d s GLY 129 N 0.00 0.36 -0.72 -0.02 0.00 -1.26 -4.77 107.32 100.91 1h0d s GLY 129 Ca 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 44.72 42.70 1h0d s GLY 129 CO 0.00 3.41 1.75 0.61 0.00 0.00 0.00 173.10 178.87 1h0d n GLY 130 N 6.16 5.67 0.13 0.20 0.00 -1.26 -4.64 105.19 111.46 1h0d n GLY 130 Ca 0.43 -2.57 -0.18 0.00 0.00 0.00 0.00 46.02 43.70 1h0d n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h0d n GLY 131 N -0.52 -0.35 2.24 -0.02 0.00 -1.26 -4.59 105.19 100.68 1h0d n GLY 131 Ca 0.50 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 46.21 1h0d n GLY 131 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h0d n GLY 132 N 2.21 2.78 0.00 -0.02 0.00 -1.26 -4.72 105.19 104.18 1h0d n GLY 132 Ca -0.44 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 44.63 1h0d n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h0d n GLY 133 N 2.93 0.00 0.39 -0.02 0.00 -1.26 -2.94 105.19 104.29 1h0d n GLY 133 Ca 0.39 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.23 1h0d n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h0d h ALA 134 N 0.49 -0.95 -2.95 4.61 0.00 -1.98 -3.36 119.26 115.12 1h0d h ALA 134 Ca 0.00 -0.22 -0.37 0.00 0.00 0.00 0.00 54.91 54.33 1h0d h ALA 134 Cb 0.00 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 18.07 1h0d h ALA 134 CO 0.00 -1.00 -0.28 -1.64 0.00 0.00 0.00 179.25 176.33 1h0d s MET 135 N -5.74 1.93 -0.04 0.00 1.00 -1.15 -3.20 119.30 112.09 1h0d s MET 135 Ca -0.17 -1.90 -0.04 0.00 0.00 0.00 0.00 55.69 53.58 1h0d s MET 135 Cb 0.03 0.41 0.01 0.00 0.00 0.00 0.00 34.83 35.28 1h0d s MET 135 CO 0.58 -0.77 0.12 0.54 0.00 0.00 0.00 175.02 175.48 1h0d s VAL 136 N -3.06 0.00 -0.16 -6.03 0.11 -0.02 -4.65 120.40 106.60 1h0d s VAL 136 Ca 0.34 -0.01 -0.05 0.00 -2.93 0.00 0.00 61.98 59.34 1h0d s VAL 136 Cb 0.00 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.65 1h0d s VAL 136 CO 0.24 -0.00 0.01 -0.89 -3.33 0.00 0.00 175.10 171.13 1h0d s THR 137 N 0.04 4.32 0.42 5.04 2.01 -1.26 -1.82 115.64 124.39 1h0d s THR 137 Ca -0.00 -0.21 0.05 0.00 0.31 0.00 0.00 61.69 61.84 1h0d s THR 137 Cb -0.01 -2.90 -0.06 0.00 0.01 0.00 0.00 72.50 69.54 1h0d s THR 137 CO 0.00 0.50 0.02 -0.76 -0.69 0.00 0.00 174.62 173.69 1h0d s LEU 138 N 0.19 2.59 0.38 4.42 1.43 0.41 -4.60 118.68 123.49 1h0d s LEU 138 Ca 0.01 -1.46 -0.10 0.00 -1.03 0.00 0.00 54.13 51.55 1h0d s LEU 138 Cb -0.13 -0.75 0.04 0.00 0.03 0.00 0.00 46.19 45.38 1h0d s LEU 138 CO 0.02 -0.60 0.68 -0.83 0.23 0.00 0.00 176.35 175.85 1h0d s GLY 139 N -3.72 0.88 -0.15 -3.19 0.00 -0.37 -0.88 107.32 99.90 1h0d s GLY 139 Ca 0.27 -1.11 -0.05 0.00 0.00 0.00 0.00 44.72 43.83 1h0d s GLY 139 CO 0.14 -0.60 0.31 0.00 0.00 0.00 0.00 173.10 172.94 1h0d s LEU 141 N 2.42 4.53 -0.47 0.00 2.96 -0.11 -1.63 118.68 126.37 1h0d s LEU 141 Ca 0.00 -0.58 -0.13 0.00 -0.22 0.00 0.00 54.13 53.20 1h0d s LEU 141 Cb -0.12 -2.09 0.10 0.00 0.50 0.00 0.00 46.19 44.58 1h0d s LEU 141 CO -0.10 -0.27 0.37 -0.69 -1.32 0.00 0.00 176.35 174.34 1h0d s VAL 142 N 1.67 4.73 0.08 1.68 1.01 0.28 -0.80 120.40 129.05 1h0d s VAL 142 Ca 0.05 -1.42 0.09 0.00 0.00 0.00 0.00 61.98 60.70 1h0d s VAL 142 Cb -0.18 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1h0d s VAL 142 CO 0.09 -0.68 -0.25 -0.75 0.00 0.00 0.00 175.10 173.51 1h0d s LYS 143 N 1.51 1.55 -0.73 2.72 2.20 0.44 -1.39 119.74 126.04 1h0d s LYS 143 Ca 0.04 -1.16 -0.04 0.00 -0.36 0.00 0.00 55.97 54.44 1h0d s LYS 143 Cb -0.26 -1.83 0.00 0.00 -1.51 0.00 0.00 37.83 34.24 1h0d s LYS 143 CO 0.03 0.46 0.64 0.41 -0.36 0.00 0.00 175.35 176.52 1h0d n GLY 144 N 1.46 0.12 3.73 5.54 0.00 -0.65 -0.39 105.19 115.01 1h0d n GLY 144 Ca -0.17 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.45 1h0d n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1h0d s TYR 145 N -3.18 2.79 0.00 1.61 1.13 -1.04 -4.49 117.35 114.17 1h0d s TYR 145 Ca 0.29 -0.28 0.00 0.00 -1.41 0.00 0.00 57.07 55.66 1h0d s TYR 145 Cb -0.13 -1.49 0.00 0.00 -1.10 0.00 0.00 41.96 39.25 1h0d s TYR 145 CO 0.40 0.44 0.00 0.34 -2.51 0.00 0.00 175.55 174.21 1h0d n PHE 146 N -1.10 0.00 -1.62 -3.49 7.35 -0.92 -0.44 117.46 117.24 1h0d n PHE 146 Ca -0.05 0.00 -0.47 0.00 -0.76 0.00 0.00 57.45 56.17 1h0d n PHE 146 Cb 0.60 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.39 1h0d n PHE 146 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1h0d n PRO 147 N -1.91 1.55 0.04 -7.13 -0.02 -1.26 -4.71 135.00 121.55 1h0d n PRO 147 Ca 0.00 0.55 0.05 0.00 -2.02 0.00 0.00 63.50 62.08 1h0d n PRO 147 Cb 0.00 -2.12 0.24 0.00 -0.02 0.00 0.00 33.50 31.60 1h0d n PRO 147 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1h0d n GLU 148 N 1.88 0.04 -2.77 -0.52 0.00 -1.26 -4.78 120.64 113.23 1h0d n GLU 148 Ca 0.13 0.43 -0.42 0.00 0.00 0.00 0.00 57.16 57.30 1h0d n GLU 148 Cb 0.28 -1.61 -0.03 0.00 0.00 0.00 0.00 31.44 30.08 1h0d n GLU 148 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.13 174.99 1h0d s PRO 149 N -3.12 4.29 0.03 5.31 0.02 -1.26 -4.97 135.00 135.30 1h0d s PRO 149 Ca 0.02 1.20 0.02 0.00 0.02 0.00 0.00 61.00 62.26 1h0d s PRO 149 Cb 0.05 -3.60 -0.02 0.00 0.02 0.00 0.00 34.50 30.95 1h0d s PRO 149 CO 0.16 -0.46 -0.07 0.54 -0.33 0.00 0.00 177.00 176.84 1h0d s VAL 150 N 2.60 0.48 -0.04 3.83 0.11 -1.26 -4.30 120.40 121.82 1h0d s VAL 150 Ca 0.42 -0.79 0.04 0.00 -2.93 0.00 0.00 61.98 58.72 1h0d s VAL 150 Cb -0.16 -0.51 -0.00 0.00 -1.53 0.00 0.00 36.38 34.18 1h0d s VAL 150 CO 0.10 -0.22 -0.16 0.42 -3.33 0.00 0.00 175.10 171.91 1h0d s THR 151 N -0.97 1.32 -0.05 5.04 -4.23 -0.75 -4.99 115.64 111.01 1h0d s THR 151 Ca -0.06 -0.66 0.06 0.00 -1.18 0.00 0.00 61.69 59.85 1h0d s THR 151 Cb -0.07 -1.13 -0.01 0.00 1.34 0.00 0.00 72.50 72.62 1h0d s THR 151 CO 0.00 0.38 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.53 1h0d s VAL 152 N 0.01 2.16 0.14 2.29 1.01 -1.26 -1.96 120.40 122.79 1h0d s VAL 152 Ca -0.03 -1.04 -0.00 0.00 0.00 0.00 0.00 61.98 60.91 1h0d s VAL 152 Cb -0.10 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1h0d s VAL 152 CO 0.02 0.57 0.05 0.42 0.00 0.00 0.00 175.10 176.16 1h0d s THR 153 N -0.30 0.22 -0.04 3.92 -4.23 -0.89 -5.00 115.64 109.32 1h0d s THR 153 Ca 0.01 -1.93 0.06 0.00 -1.18 0.00 0.00 61.69 58.65 1h0d s THR 153 Cb -0.13 -2.09 -0.01 0.00 1.34 0.00 0.00 72.50 71.61 1h0d s THR 153 CO 0.02 -0.44 -0.22 0.26 -0.54 0.00 0.00 174.62 173.71 1h0d s TRP 154 N -3.97 2.05 -1.34 3.99 0.52 -1.26 -0.97 118.94 117.97 1h0d s TRP 154 Ca 0.25 -0.54 -0.09 0.00 0.02 0.00 0.00 56.10 55.74 1h0d s TRP 154 Cb 0.07 -1.35 0.00 0.00 -1.15 0.00 0.00 33.47 31.05 1h0d s TRP 154 CO 0.03 -0.14 0.49 0.09 0.02 0.00 0.00 176.95 177.43 1h0d n ASN 155 N 2.88 -1.80 -1.78 2.95 3.02 0.13 -1.01 115.26 119.65 1h0d n ASN 155 Ca -0.17 -1.08 -0.11 0.00 -0.03 0.00 0.00 54.58 53.19 1h0d n ASN 155 Cb 0.52 -2.78 -0.03 0.00 -0.61 0.00 0.00 39.78 36.88 1h0d n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1h0d n SER 156 N -2.80 -3.08 0.00 6.41 7.64 -1.26 -0.51 113.62 120.02 1h0d n SER 156 Ca -0.24 0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1h0d n SER 156 Cb 0.65 -2.83 0.00 0.00 -1.01 0.00 0.00 64.21 61.02 1h0d n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h0d n GLY 157 N -0.43 2.62 0.21 0.23 0.00 -0.18 -4.98 105.19 102.65 1h0d n GLY 157 Ca -0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 1h0d n GLY 157 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1h0d h SER 158 N 0.04 -0.51 -3.35 1.61 0.02 -0.57 -3.37 113.55 107.42 1h0d h SER 158 Ca 0.00 0.09 -0.58 0.00 -0.84 0.00 0.00 61.79 60.47 1h0d h SER 158 Cb 0.00 0.24 -0.09 0.00 0.14 0.00 0.00 62.40 62.69 1h0d h SER 158 CO 0.00 -0.21 0.80 -0.76 -1.14 0.00 0.00 176.83 175.52 1h0d s LEU 159 N -10.42 3.74 0.00 5.07 1.43 -0.93 -4.80 118.68 112.77 1h0d s LEU 159 Ca -0.14 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 1h0d s LEU 159 Cb 0.11 -3.14 0.00 0.00 0.03 0.00 0.00 46.19 43.18 1h0d s LEU 159 CO 0.68 -1.31 0.00 -1.54 0.23 0.00 0.00 176.35 174.41 1h0d n SER 160 N 7.89 3.91 -4.86 2.29 3.41 -1.26 -4.06 113.62 120.94 1h0d n SER 160 Ca 0.07 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.33 1h0d n SER 160 Cb 0.49 0.61 -0.05 0.00 -0.26 0.00 0.00 64.21 64.99 1h0d n SER 160 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1h0d s SER 161 N -2.00 6.68 -0.09 4.04 1.04 -1.26 -4.15 113.70 117.95 1h0d s SER 161 Ca 0.00 0.85 0.00 0.00 0.48 0.00 0.00 55.95 57.28 1h0d s SER 161 Cb 0.00 -2.20 0.00 0.00 0.10 0.00 0.00 66.02 63.92 1h0d s SER 161 CO 0.00 0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.98 1h0d n GLY 162 N 0.83 0.37 3.47 7.32 0.00 -1.26 -4.75 105.19 111.17 1h0d n GLY 162 Ca -0.07 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 1h0d n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h0d s VAL 163 N -2.05 3.19 -0.23 1.61 1.01 -1.26 -1.59 120.40 121.08 1h0d s VAL 163 Ca 0.00 -0.66 -0.00 0.00 0.00 0.00 0.00 61.98 61.32 1h0d s VAL 163 Cb 0.00 -2.28 0.07 0.00 0.00 0.00 0.00 36.38 34.16 1h0d s VAL 163 CO 0.00 0.57 -0.01 -1.00 0.00 0.00 0.00 175.10 174.67 1h0d s HIS 164 N -0.46 1.96 -0.38 5.22 3.76 -0.47 -4.99 115.29 119.94 1h0d s HIS 164 Ca 0.06 -1.53 -0.11 0.00 -0.15 0.00 0.00 55.06 53.33 1h0d s HIS 164 Cb -0.12 -1.48 0.03 0.00 1.11 0.00 0.00 32.58 32.12 1h0d s HIS 164 CO 0.02 -0.74 0.21 0.99 -0.85 0.00 0.00 174.74 174.36 1h0d s THR 165 N 1.54 4.54 0.46 1.30 2.01 -1.26 -0.87 115.64 123.35 1h0d s THR 165 Ca -0.02 -0.91 -0.21 0.00 0.31 0.00 0.00 61.69 60.86 1h0d s THR 165 Cb -0.18 -3.55 -0.10 0.00 0.01 0.00 0.00 72.50 68.68 1h0d s THR 165 CO -0.09 -0.26 1.00 -0.36 -0.69 0.00 0.00 174.62 174.22 1h0d s PHE 166 N 1.54 3.15 0.58 4.92 0.40 -0.53 -5.00 117.98 123.04 1h0d s PHE 166 Ca 0.02 1.59 -0.19 0.00 -0.60 0.00 0.00 56.93 57.75 1h0d s PHE 166 Cb -0.19 -2.96 -0.05 0.00 0.51 0.00 0.00 43.02 40.32 1h0d s PHE 166 CO 0.06 -0.48 0.96 -2.30 0.70 0.00 0.00 175.22 174.16 1h0d n PRO 167 N -0.79 0.94 -2.97 0.24 -0.02 -1.26 -4.44 135.00 126.70 1h0d n PRO 167 Ca 0.08 0.36 -0.33 0.00 -2.02 0.00 0.00 63.50 61.59 1h0d n PRO 167 Cb 0.53 -2.15 -0.07 0.00 -0.02 0.00 0.00 33.50 31.80 1h0d n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1h0d s ALA 168 N -1.50 3.19 -0.04 3.55 0.00 -1.26 -4.77 121.76 120.93 1h0d s ALA 168 Ca 0.74 0.24 0.06 0.00 0.00 0.00 0.00 51.96 53.00 1h0d s ALA 168 Cb -0.43 -2.97 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 1h0d s ALA 168 CO 0.48 0.23 -0.21 0.08 0.00 0.00 0.00 175.76 176.35 1h0d s VAL 169 N -2.02 2.48 -0.37 0.00 1.01 -0.29 -4.93 120.40 116.28 1h0d s VAL 169 Ca 0.57 -0.94 -0.24 0.00 0.00 0.00 0.00 61.98 61.37 1h0d s VAL 169 Cb -0.11 -1.92 0.01 0.00 0.00 0.00 0.00 36.38 34.36 1h0d s VAL 169 CO 0.16 0.58 0.82 -0.22 0.00 0.00 0.00 175.10 176.44 1h0d s LEU 170 N -0.55 4.09 -0.44 3.92 2.96 -1.26 -1.74 118.68 125.67 1h0d s LEU 170 Ca 0.08 0.42 0.04 0.00 -0.22 0.00 0.00 54.13 54.44 1h0d s LEU 170 Cb -0.11 -3.09 0.12 0.00 0.50 0.00 0.00 46.19 43.60 1h0d s LEU 170 CO 0.01 -0.77 0.17 -1.58 -1.32 0.00 0.00 176.35 172.86 1h0d s GLN 171 N 3.20 1.74 -0.65 1.98 0.74 0.17 -4.88 119.66 121.97 1h0d s GLN 171 Ca 0.33 -2.29 -0.02 0.00 0.05 0.00 0.00 55.36 53.44 1h0d s GLN 171 Cb -0.13 -3.24 0.00 0.00 1.10 0.00 0.00 33.01 30.75 1h0d s GLN 171 CO 0.17 -1.04 0.64 0.43 -0.55 0.00 0.00 175.29 174.94 1h0d n SER 172 N 3.60 -7.38 -0.25 6.67 7.64 -1.26 -3.02 113.62 119.63 1h0d n SER 172 Ca 0.05 -0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.89 1h0d n SER 172 Cb 0.36 -5.00 -0.01 0.00 -1.01 0.00 0.00 64.21 58.55 1h0d n SER 172 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1h0d n ASP 173 N -1.56 -4.72 -3.89 6.43 8.00 -1.26 -4.91 116.55 114.64 1h0d n ASP 173 Ca 0.01 0.07 -0.11 0.00 0.71 0.00 0.00 54.79 55.47 1h0d n ASP 173 Cb 0.49 -3.07 -0.13 0.00 -0.02 0.00 0.00 41.12 38.39 1h0d n ASP 173 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1h0d s LEU 174 N -0.70 2.02 0.15 0.64 1.43 -1.17 -4.78 118.68 116.27 1h0d s LEU 174 Ca 0.00 -0.08 -0.08 0.00 -1.03 0.00 0.00 54.13 52.94 1h0d s LEU 174 Cb 0.00 0.04 -0.06 0.00 0.03 0.00 0.00 46.19 46.20 1h0d s LEU 174 CO 0.00 -0.06 0.44 -0.31 0.23 0.00 0.00 176.35 176.66 1h0d s TYR 175 N -0.26 3.50 -0.00 0.29 1.51 0.41 0.44 117.35 123.24 1h0d s TYR 175 Ca -0.03 0.75 0.00 0.00 -1.01 0.00 0.00 57.07 56.78 1h0d s TYR 175 Cb -0.02 -2.15 0.00 0.00 -0.11 0.00 0.00 41.96 39.68 1h0d s TYR 175 CO -0.00 0.41 -0.01 0.99 -1.11 0.00 0.00 175.55 175.83 1h0d s THR 176 N -1.61 0.09 0.15 -0.71 2.01 -0.71 -1.64 115.64 113.22 1h0d s THR 176 Ca 0.40 -0.04 -0.12 0.00 0.31 0.00 0.00 61.69 62.24 1h0d s THR 176 Cb -0.13 -0.09 0.01 0.00 0.01 0.00 0.00 72.50 72.30 1h0d s THR 176 CO 0.21 0.03 0.33 -0.22 -0.69 0.00 0.00 174.62 174.29 1h0d s LEU 177 N 0.02 0.78 0.07 4.42 0.20 -0.48 -1.14 118.68 122.54 1h0d s LEU 177 Ca 0.00 -0.67 -0.00 0.00 0.69 0.00 0.00 54.13 54.15 1h0d s LEU 177 Cb -0.01 1.46 -0.04 0.00 -0.43 0.00 0.00 46.19 47.17 1h0d s LEU 177 CO -0.00 -0.89 -0.04 -0.94 -0.29 0.00 0.00 176.35 174.19 1h0d s SER 178 N -2.91 0.68 -0.06 3.68 1.04 -1.26 -0.55 113.70 114.32 1h0d s SER 178 Ca 0.11 -1.01 -0.03 0.00 0.48 0.00 0.00 55.95 55.50 1h0d s SER 178 Cb 0.02 0.17 0.03 0.00 0.10 0.00 0.00 66.02 66.35 1h0d s SER 178 CO -0.04 -0.56 0.14 -0.55 0.98 0.00 0.00 173.24 173.21 1h0d s SER 179 N -2.96 -0.11 0.13 7.02 0.15 -0.65 -1.45 113.70 115.83 1h0d s SER 179 Ca 0.09 0.29 0.07 0.00 0.70 0.00 0.00 55.95 57.10 1h0d s SER 179 Cb 0.07 0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.54 1h0d s SER 179 CO -0.08 -0.13 -0.05 -0.94 1.20 0.00 0.00 173.24 173.24 1h0d s SER 180 N 0.95 4.63 -0.02 5.45 1.04 -0.05 -0.99 113.70 124.71 1h0d s SER 180 Ca -0.07 -0.36 -0.01 0.00 0.48 0.00 0.00 55.95 55.98 1h0d s SER 180 Cb -0.09 -0.96 0.02 0.00 0.10 0.00 0.00 66.02 65.09 1h0d s SER 180 CO -0.05 0.14 0.05 0.54 0.98 0.00 0.00 173.24 174.90 1h0d s VAL 181 N -1.44 -0.03 -0.18 5.02 0.11 -0.06 -1.37 120.40 122.44 1h0d s VAL 181 Ca 0.25 0.13 -0.00 0.00 -2.93 0.00 0.00 61.98 59.42 1h0d s VAL 181 Cb -0.10 -0.10 0.01 0.00 -1.53 0.00 0.00 36.38 34.66 1h0d s VAL 181 CO 0.16 0.05 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.94 1h0d s THR 182 N 0.68 2.47 0.34 5.04 2.01 -0.62 -0.45 115.64 125.10 1h0d s THR 182 Ca -0.05 -0.81 0.04 0.00 0.31 0.00 0.00 61.69 61.18 1h0d s THR 182 Cb -0.08 -2.06 -0.07 0.00 0.01 0.00 0.00 72.50 70.31 1h0d s THR 182 CO -0.02 0.51 0.05 0.68 -0.69 0.00 0.00 174.62 175.15 1h0d s VAL 183 N 1.22 1.31 0.85 3.82 -7.23 -0.76 -4.75 120.40 114.86 1h0d s VAL 183 Ca 0.03 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.09 1h0d s VAL 183 Cb -0.14 -2.83 0.10 0.00 0.56 0.00 0.00 36.38 34.08 1h0d s VAL 183 CO -0.08 0.00 1.10 -2.84 -0.31 0.00 0.00 175.10 172.97 1h0d s PRO 184 N -3.87 1.61 0.54 4.82 0.02 -1.26 -0.84 135.00 136.03 1h0d s PRO 184 Ca 0.36 1.07 0.33 0.00 0.02 0.00 0.00 61.00 62.79 1h0d s PRO 184 Cb 0.09 -1.83 1.33 0.00 0.02 0.00 0.00 34.50 34.10 1h0d s PRO 184 CO 0.16 -2.07 1.97 0.77 -0.33 0.00 0.00 177.00 177.50 1h0d h SER 185 N -1.43 0.00 -0.40 2.53 0.02 -1.70 -3.19 113.55 109.38 1h0d h SER 185 Ca -0.46 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.44 1h0d h SER 185 Cb 1.26 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.78 1h0d h SER 185 CO 0.51 0.00 0.06 0.28 -1.14 0.00 0.00 176.83 176.54 1h0d h SER 186 N 0.00 0.64 0.00 3.07 0.02 -1.87 -3.43 113.55 111.98 1h0d h SER 186 Ca 0.00 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1h0d h SER 186 Cb 0.52 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1h0d h SER 186 CO 0.00 0.75 0.00 -0.81 -1.14 0.00 0.00 176.83 175.63 1h0d n PRO 187 N -4.51 0.00 0.00 3.45 -0.04 -1.21 -4.42 135.00 128.28 1h0d n PRO 187 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1h0d n PRO 187 Cb 0.24 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.70 1h0d n PRO 187 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 1h0d n TRP 188 N 0.00 0.00 -0.34 0.54 -0.00 -1.09 -0.00 117.44 116.54 1h0d n TRP 188 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.50 57.49 1h0d n TRP 188 Cb 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 31.31 31.35 1h0d n TRP 188 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 1h0d n PRO 189 N 0.00 -0.20 0.11 5.87 -0.02 -1.26 -0.54 135.00 138.95 1h0d n PRO 189 Ca 0.00 1.36 -0.17 0.00 -2.02 0.00 0.00 63.50 62.67 1h0d n PRO 189 Cb 0.00 -2.02 -0.14 0.00 -0.02 0.00 0.00 33.50 31.32 1h0d n PRO 189 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1h0d h SER 190 N 0.00 0.49 -3.31 2.55 4.64 -0.64 -3.45 113.55 113.83 1h0d h SER 190 Ca 0.31 -0.51 -0.64 0.00 -0.47 0.00 0.00 61.79 60.48 1h0d h SER 190 Cb 0.53 -0.16 -0.23 0.00 -0.31 0.00 0.00 62.40 62.24 1h0d h SER 190 CO -0.88 1.39 -0.69 -1.61 -0.87 0.00 0.00 176.83 174.17 1h0d s GLU 191 N -2.69 3.59 0.10 4.77 2.02 0.29 -5.08 118.70 121.71 1h0d s GLU 191 Ca -0.05 -0.56 -0.35 0.00 0.02 0.00 0.00 54.97 54.03 1h0d s GLU 191 Cb 0.07 -2.84 -0.14 0.00 0.10 0.00 0.00 34.13 31.32 1h0d s GLU 191 CO 0.89 0.24 1.56 2.41 0.02 0.00 0.00 175.26 180.38 1h0d n THR 192 N 3.51 0.08 -4.13 3.63 -1.04 -1.26 -2.69 114.28 112.38 1h0d n THR 192 Ca -0.18 -0.01 -0.30 0.00 -2.04 0.00 0.00 64.05 61.52 1h0d n THR 192 Cb 0.53 -1.38 -0.16 0.00 -1.82 0.00 0.00 70.33 67.49 1h0d n THR 192 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1h0d s VAL 193 N 1.26 1.67 -0.03 12.58 1.01 -1.26 -4.92 120.40 130.71 1h0d s VAL 193 Ca 0.83 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 62.14 1h0d s VAL 193 Cb -0.76 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.07 1h0d s VAL 193 CO 0.43 0.47 -0.14 -0.89 0.00 0.00 0.00 175.10 174.97 1h0d s THR 194 N 1.35 1.14 -0.10 3.92 2.01 -1.26 -1.42 115.64 121.29 1h0d s THR 194 Ca 0.03 -0.57 -0.22 0.00 0.31 0.00 0.00 61.69 61.24 1h0d s THR 194 Cb -0.13 -0.98 -0.04 0.00 0.01 0.00 0.00 72.50 71.36 1h0d s THR 194 CO -0.09 0.34 0.63 0.00 -0.69 0.00 0.00 174.62 174.80 1h0d s ASN 196 N 0.80 4.51 -0.12 0.00 0.02 -0.14 0.06 114.94 120.07 1h0d s ASN 196 Ca 0.33 -1.55 -0.03 0.00 -1.02 0.00 0.00 52.86 50.59 1h0d s ASN 196 Cb -0.17 -1.56 -0.03 0.00 0.02 0.00 0.00 41.25 39.51 1h0d s ASN 196 CO 0.15 -0.23 -0.01 -0.69 0.02 0.00 0.00 177.10 176.34 1h0d s VAL 197 N 1.06 4.19 -0.04 1.60 1.01 0.57 -2.10 120.40 126.69 1h0d s VAL 197 Ca -0.05 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 61.70 1h0d s VAL 197 Cb -0.20 -2.79 -0.00 0.00 0.00 0.00 0.00 36.38 33.38 1h0d s VAL 197 CO -0.06 0.55 -0.18 0.00 0.00 0.00 0.00 175.10 175.42 1h0d s ALA 198 N -0.36 1.59 -0.47 5.51 0.00 -0.83 -0.58 121.76 126.62 1h0d s ALA 198 Ca 0.07 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.33 1h0d s ALA 198 Cb -0.12 -0.52 0.14 0.00 0.00 0.00 0.00 23.12 22.62 1h0d s ALA 198 CO 0.02 0.29 0.27 -1.58 0.00 0.00 0.00 175.76 174.77 1h0d s HIS 199 N 0.01 2.12 0.32 0.00 2.46 0.45 -1.82 115.29 118.82 1h0d s HIS 199 Ca -0.04 -2.54 0.07 0.00 0.47 0.00 0.00 55.06 53.03 1h0d s HIS 199 Cb -0.12 -1.93 0.78 0.00 -0.13 0.00 0.00 32.58 31.19 1h0d s HIS 199 CO 0.02 -0.76 1.79 -1.35 -2.47 0.00 0.00 174.74 171.97 1h0d h PRO 200 N 6.49 0.70 -0.45 2.88 0.11 -1.79 -1.68 132.00 138.27 1h0d h PRO 200 Ca 0.03 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 66.15 1h0d h PRO 200 Cb 0.91 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 1h0d h PRO 200 CO 0.51 0.47 0.30 0.00 -0.21 0.00 0.00 178.00 179.06 1h0d h ALA 201 N 1.64 1.94 -0.41 -0.75 0.00 -1.92 -1.62 119.26 118.14 1h0d h ALA 201 Ca 0.57 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1h0d h ALA 201 Cb 0.94 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1h0d h ALA 201 CO -0.36 -0.01 0.00 -1.13 0.00 0.00 0.00 179.25 177.75 1h0d n SER 202 N -4.48 3.13 -2.23 0.00 3.41 -0.70 -4.96 113.62 107.79 1h0d n SER 202 Ca 0.06 -1.94 -0.20 0.00 -0.26 0.00 0.00 58.87 56.53 1h0d n SER 202 Cb 0.24 -0.27 -0.02 0.00 -0.26 0.00 0.00 64.21 63.90 1h0d n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1h0d n SER 203 N 0.92 -5.71 -4.68 4.04 7.64 -0.61 -4.97 113.62 110.25 1h0d n SER 203 Ca 0.15 0.02 -0.29 0.00 1.01 0.00 0.00 58.87 59.76 1h0d n SER 203 Cb 0.48 -4.75 -0.08 0.00 -1.01 0.00 0.00 64.21 58.85 1h0d n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1h0d s THR 204 N -2.98 3.91 -0.05 0.44 2.01 -0.93 -4.99 115.64 113.06 1h0d s THR 204 Ca 0.00 -1.09 -0.02 0.00 0.31 0.00 0.00 61.69 60.89 1h0d s THR 204 Cb 0.00 -2.88 0.03 0.00 0.01 0.00 0.00 72.50 69.66 1h0d s THR 204 CO 0.00 0.07 0.10 -0.54 -0.69 0.00 0.00 174.62 173.56 1h0d s LYS 205 N -2.43 0.04 -0.05 4.92 1.02 -1.26 -0.41 119.74 121.57 1h0d s LYS 205 Ca 0.26 0.29 0.05 0.00 0.02 0.00 0.00 55.97 56.58 1h0d s LYS 205 Cb -0.11 -0.21 -0.00 0.00 -0.52 0.00 0.00 37.83 36.99 1h0d s LYS 205 CO 0.18 -0.17 -0.18 0.08 -0.92 0.00 0.00 175.35 174.34 1h0d s VAL 206 N 1.12 1.52 -0.07 3.17 1.01 0.26 -4.99 120.40 122.41 1h0d s VAL 206 Ca -0.09 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.17 1h0d s VAL 206 Cb -0.12 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1h0d s VAL 206 CO -0.05 0.43 -0.19 -1.81 0.00 0.00 0.00 175.10 173.48 1h0d s ASP 207 N 0.02 3.55 -0.15 3.32 1.01 -1.26 -0.32 116.67 122.85 1h0d s ASP 207 Ca -0.04 -0.38 -0.02 0.00 0.71 0.00 0.00 52.55 52.81 1h0d s ASP 207 Cb -0.12 -1.01 0.05 0.00 1.01 0.00 0.00 42.92 42.85 1h0d s ASP 207 CO 0.02 0.26 0.02 -0.75 0.21 0.00 0.00 175.17 174.93 1h0d s LYS 208 N -0.21 0.66 0.06 8.23 2.47 0.11 -4.96 119.74 126.10 1h0d s LYS 208 Ca -0.01 -0.22 -0.30 0.00 -1.56 0.00 0.00 55.97 53.89 1h0d s LYS 208 Cb -0.13 -1.68 -0.04 0.00 -1.46 0.00 0.00 37.83 34.52 1h0d s LYS 208 CO 0.03 -0.50 0.96 0.21 0.16 0.00 0.00 175.35 176.21 1h0d s LYS 209 N 1.90 4.63 -0.52 4.03 2.20 -1.26 0.01 119.74 130.72 1h0d s LYS 209 Ca 0.02 1.42 -0.22 0.00 -0.36 0.00 0.00 55.97 56.82 1h0d s LYS 209 Cb -0.15 -3.42 0.04 0.00 -1.51 0.00 0.00 37.83 32.80 1h0d s LYS 209 CO -0.07 0.09 0.82 0.42 -0.36 0.00 0.00 175.35 176.25 1h0d s ILE 210 N 0.48 4.58 -0.13 5.43 -1.09 -0.51 -4.93 121.20 125.03 1h0d s ILE 210 Ca 0.49 0.08 -0.05 0.00 -2.23 0.00 0.00 60.65 58.95 1h0d s ILE 210 Cb -0.22 -4.42 -0.04 0.00 -1.58 0.00 0.00 42.46 36.20 1h0d s ILE 210 CO 0.29 -0.94 0.04 -0.69 -1.23 0.00 0.00 174.94 172.41 1h0d s VAL 211 N 3.43 4.64 1.01 2.92 1.01 -1.26 -4.69 120.40 127.45 1h0d s VAL 211 Ca 0.26 -0.10 -0.16 0.00 0.00 0.00 0.00 61.98 61.97 1h0d s VAL 211 Cb -0.14 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1h0d s VAL 211 CO 0.18 0.54 -0.05 -2.65 0.00 0.00 0.00 175.10 173.12 1h0d n PRO 212 N 2.75 -0.56 -2.85 2.72 -0.02 -1.26 -4.45 135.00 131.33 1h0d n PRO 212 Ca -0.18 -0.14 -0.07 0.00 -2.02 0.00 0.00 63.50 61.10 1h0d n PRO 212 Cb 0.53 -1.61 0.01 0.00 -0.02 0.00 0.00 33.50 32.41 1h0d n PRO 212 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1h0d n ARG 213 N -0.77 -2.69 0.00 -0.52 -4.01 -1.26 -4.98 116.66 102.43 1h0d n ARG 213 Ca 0.03 2.28 0.00 0.00 -1.04 0.00 0.00 57.85 59.12 1h0d n ARG 213 Cb 0.58 -5.27 0.00 0.00 -3.04 0.00 0.00 32.46 24.72 1h0d n ARG 213 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 1h0d n ASP 214 N 0.09 0.29 0.00 2.89 10.43 -1.22 -5.09 116.55 123.94 1h0d n ASP 214 Ca 0.07 -0.63 0.00 0.00 2.57 0.00 0.00 54.79 56.80 1h0d n ASP 214 Cb 0.32 0.61 0.00 0.00 1.84 0.00 0.00 41.12 43.89 1h0d n ASP 214 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13