#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2i n PHE 26 N -2.79 2.41 0.00 0.00 7.35 -1.26 -1.50 117.46 121.67 1h2i n PHE 26 Ca 0.07 0.31 0.00 0.00 -0.76 0.00 0.00 57.45 57.08 1h2i n PHE 26 Cb 0.26 -2.53 0.00 0.00 0.35 0.00 0.00 39.48 37.55 1h2i n PHE 26 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1h2i n GLY 27 N 2.64 1.43 0.03 7.13 0.00 -0.10 -4.86 105.19 111.46 1h2i n GLY 27 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1h2i n GLY 27 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1h2i n GLN 28 N -2.00 1.04 -1.63 1.61 6.02 -0.56 -4.01 117.38 117.84 1h2i n GLN 28 Ca 0.00 -1.03 -0.29 0.00 -0.01 0.00 0.00 57.00 55.66 1h2i n GLN 28 Cb 0.00 -1.01 0.10 0.00 1.02 0.00 0.00 30.24 30.35 1h2i n GLN 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1h2i s GLN 30 N -5.29 0.79 0.37 0.00 0.74 -1.26 -4.34 119.66 110.67 1h2i s GLN 30 Ca 0.62 -0.12 -0.27 0.00 0.05 0.00 0.00 55.36 55.64 1h2i s GLN 30 Cb -0.14 -0.80 -0.10 0.00 1.10 0.00 0.00 33.01 33.08 1h2i s GLN 30 CO 0.53 -0.06 1.33 0.71 -0.55 0.00 0.00 175.29 177.25 1h2i s TYR 31 N 0.80 2.87 0.50 1.67 1.51 -1.26 -4.98 117.35 118.46 1h2i s TYR 31 Ca -0.11 1.37 -0.19 0.00 -1.01 0.00 0.00 57.07 57.14 1h2i s TYR 31 Cb -0.14 -3.73 -0.08 0.00 -0.11 0.00 0.00 41.96 37.90 1h2i s TYR 31 CO 0.00 -2.15 1.01 0.95 -1.11 0.00 0.00 175.55 174.25 1h2i s THR 32 N -1.19 4.12 0.32 -0.71 -4.23 -1.26 -4.82 115.64 107.86 1h2i s THR 32 Ca 0.53 1.18 0.06 0.00 -1.18 0.00 0.00 61.69 62.28 1h2i s THR 32 Cb -0.40 -3.54 0.31 0.00 1.34 0.00 0.00 72.50 70.21 1h2i s THR 32 CO 0.53 -0.42 1.82 0.00 -0.54 0.00 0.00 174.62 176.00 1h2i h ALA 33 N 1.26 1.71 -0.08 3.99 0.00 -1.99 0.66 119.26 124.82 1h2i h ALA 33 Ca -0.48 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1h2i h ALA 33 Cb 1.20 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1h2i h ALA 33 CO 0.60 -0.02 0.02 1.49 0.00 0.00 0.00 179.25 181.34 1h2i h GLU 34 N 0.79 0.12 -0.51 0.00 4.81 -1.99 -0.70 114.58 117.10 1h2i h GLU 34 Ca 0.52 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.63 1h2i h GLU 34 Cb 0.78 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 1h2i h GLU 34 CO -0.30 0.30 -0.05 1.49 -0.73 0.00 0.00 179.01 179.73 1h2i h GLU 35 N -0.08 0.93 -0.01 1.92 4.81 -1.72 -1.88 114.58 118.55 1h2i h GLU 35 Ca 0.02 -0.32 0.03 0.00 -0.13 0.00 0.00 59.36 58.96 1h2i h GLU 35 Cb 0.24 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.51 1h2i h GLU 35 CO -0.00 0.98 -0.18 -0.92 -0.73 0.00 0.00 179.01 178.16 1h2i h TYR 36 N 0.79 -0.46 -0.73 0.92 3.20 -0.80 -0.91 116.97 118.98 1h2i h TYR 36 Ca 0.14 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.02 1h2i h TYR 36 Cb 0.59 0.21 -0.04 0.00 1.54 0.00 0.00 36.73 39.03 1h2i h TYR 36 CO 0.04 -0.26 0.46 0.37 -1.64 0.00 0.00 178.16 177.14 1h2i h GLN 37 N -0.28 0.98 -0.56 1.82 4.15 -0.98 0.43 115.11 120.66 1h2i h GLN 37 Ca 0.06 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 1h2i h GLN 37 Cb 0.36 -0.21 -0.03 0.00 0.21 0.00 0.00 27.48 27.81 1h2i h GLN 37 CO -0.17 0.67 0.27 0.00 -1.93 0.00 0.00 178.83 177.67 1h2i h ALA 38 N 1.25 0.72 -0.20 3.38 0.00 -0.94 -2.67 119.26 120.80 1h2i h ALA 38 Ca 0.26 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1h2i h ALA 38 Cb -0.07 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 1h2i h ALA 38 CO -0.05 0.28 -0.11 0.82 0.00 0.00 0.00 179.25 180.19 1h2i h ILE 39 N 0.76 1.31 -0.61 0.00 2.04 -0.80 -0.46 117.51 119.75 1h2i h ILE 39 Ca 0.19 -1.19 0.13 0.00 1.00 0.00 0.00 64.86 64.99 1h2i h ILE 39 Cb 0.11 1.66 -0.11 0.00 -0.74 0.00 0.00 36.82 37.74 1h2i h ILE 39 CO -0.03 0.36 -0.05 1.56 0.00 0.00 0.00 178.15 180.00 1h2i h GLN 40 N 0.13 0.07 0.14 2.37 1.08 -0.85 0.08 115.11 118.13 1h2i h GLN 40 Ca 0.04 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 1h2i h GLN 40 Cb 0.61 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1h2i h GLN 40 CO 0.03 0.05 -0.07 0.87 -0.95 0.00 0.00 178.83 178.76 1h2i h LYS 41 N 0.07 -0.18 -0.86 1.46 1.57 -1.34 -3.13 116.57 114.16 1h2i h LYS 41 Ca 0.31 0.01 0.12 0.00 -1.87 0.00 0.00 60.65 59.22 1h2i h LYS 41 Cb 0.50 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.79 1h2i h LYS 41 CO -0.56 0.13 0.55 0.00 -0.57 0.00 0.00 179.45 179.00 1h2i h ALA 42 N 0.29 1.77 0.00 3.86 0.00 -0.49 -1.78 119.26 122.91 1h2i h ALA 42 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1h2i h ALA 42 Cb 0.40 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1h2i h ALA 42 CO 0.03 0.03 -0.09 -0.07 0.00 0.00 0.00 179.25 179.15 1h2i h LEU 43 N 0.74 0.00 -1.31 0.00 3.38 -0.94 -2.76 115.31 114.43 1h2i h LEU 43 Ca 0.41 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.31 1h2i h LEU 43 Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1h2i h LEU 43 CO -0.18 0.09 -0.33 0.03 0.09 0.00 0.00 178.44 178.14 1h2i h ARG 44 N 0.00 0.02 -6.70 1.13 3.08 -1.34 0.19 114.38 110.76 1h2i h ARG 44 Ca -0.00 -0.01 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1h2i h ARG 44 Cb 0.22 -0.00 0.11 0.00 0.08 0.00 0.00 29.97 30.38 1h2i h ARG 44 CO 0.01 0.35 0.40 1.04 -1.07 0.00 0.00 179.97 180.70 1h2i n GLN 45 N -4.14 1.87 -2.98 0.04 6.02 -1.04 -4.59 117.38 112.57 1h2i n GLN 45 Ca -0.02 0.66 -0.26 0.00 -0.01 0.00 0.00 57.00 57.37 1h2i n GLN 45 Cb 0.38 -2.22 -0.01 0.00 1.02 0.00 0.00 30.24 29.42 1h2i n GLN 45 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1h2i s ARG 46 N -1.88 3.54 -0.01 -1.09 1.81 -1.26 -1.13 118.95 118.93 1h2i s ARG 46 Ca 0.58 -0.01 -0.03 0.00 -1.72 0.00 0.00 55.73 54.55 1h2i s ARG 46 Cb -0.58 -2.50 -0.04 0.00 -0.45 0.00 0.00 34.95 31.37 1h2i s ARG 46 CO 0.61 -0.03 0.18 -0.48 -0.68 0.00 0.00 175.30 174.89 1h2i s LEU 47 N -4.46 4.37 1.20 2.53 2.34 -1.26 -4.91 118.68 118.48 1h2i s LEU 47 Ca 0.44 0.34 -0.17 0.00 0.06 0.00 0.00 54.13 54.81 1h2i s LEU 47 Cb -0.10 -2.63 0.28 0.00 -0.56 0.00 0.00 46.19 43.19 1h2i s LEU 47 CO 0.40 0.26 1.04 -0.83 -1.06 0.00 0.00 176.35 176.16 1h2i s GLY 48 N -1.96 1.53 0.59 -3.48 0.00 -1.26 -4.90 107.32 97.84 1h2i s GLY 48 Ca 0.28 -0.58 0.30 0.00 0.00 0.00 0.00 44.72 44.71 1h2i s GLY 48 CO 0.19 0.23 2.26 -2.55 0.00 0.00 0.00 173.10 173.23 1h2i h PRO 49 N -2.62 0.00 0.00 2.90 0.11 -1.96 -2.34 132.00 128.09 1h2i h PRO 49 Ca -0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1h2i h PRO 49 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1h2i h PRO 49 CO 0.43 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.37 1h2i n GLU 50 N -3.84 0.06 -0.11 1.05 0.00 -1.26 -2.71 120.64 113.82 1h2i n GLU 50 Ca -0.03 0.28 -0.14 0.00 0.00 0.00 0.00 57.16 57.27 1h2i n GLU 50 Cb 0.08 -1.50 -0.13 0.00 0.00 0.00 0.00 31.44 29.89 1h2i n GLU 50 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1h2i n TYR 51 N -1.40 0.00 -2.70 -1.84 4.02 -0.88 -4.99 117.16 109.37 1h2i n TYR 51 Ca 0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.51 1h2i n TYR 51 Cb 0.09 -0.95 -0.05 0.00 -0.02 0.00 0.00 39.34 38.41 1h2i n TYR 51 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1h2i s ILE 52 N -2.48 4.32 0.28 -0.72 -1.09 -1.10 -4.44 121.20 115.98 1h2i s ILE 52 Ca -0.23 2.01 0.02 0.00 -2.23 0.00 0.00 60.65 60.22 1h2i s ILE 52 Cb 0.07 -4.28 -0.05 0.00 -1.58 0.00 0.00 42.46 36.62 1h2i s ILE 52 CO 0.67 0.35 0.10 -0.94 -1.23 0.00 0.00 174.94 173.88 1h2i s SER 53 N -0.25 1.56 0.12 3.58 1.04 -0.49 -4.98 113.70 114.28 1h2i s SER 53 Ca 0.46 -1.41 -0.10 0.00 0.48 0.00 0.00 55.95 55.38 1h2i s SER 53 Cb -0.25 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.02 1h2i s SER 53 CO 0.31 -0.73 0.26 -0.94 0.98 0.00 0.00 173.24 173.13 1h2i s SER 54 N -3.37 0.03 0.21 7.02 1.04 -1.26 -1.27 113.70 116.10 1h2i s SER 54 Ca 0.37 -0.67 -0.02 0.00 0.48 0.00 0.00 55.95 56.11 1h2i s SER 54 Cb 0.08 0.40 -0.04 0.00 0.10 0.00 0.00 66.02 66.56 1h2i s SER 54 CO 0.14 -0.81 0.16 0.00 0.98 0.00 0.00 173.24 173.72 1h2i s ARG 55 N -3.89 1.24 -0.29 4.02 1.70 -0.74 -4.96 118.95 116.03 1h2i s ARG 55 Ca 0.09 -1.60 -0.16 0.00 -0.47 0.00 0.00 55.73 53.59 1h2i s ARG 55 Cb 0.04 0.29 -0.03 0.00 -0.57 0.00 0.00 34.95 34.68 1h2i s ARG 55 CO -0.07 -0.42 0.44 -1.64 -1.08 0.00 0.00 175.30 172.53 1h2i s MET 56 N -4.14 3.90 0.80 3.89 -1.94 -1.26 -1.38 119.30 119.16 1h2i s MET 56 Ca 0.37 0.02 -0.11 0.00 -1.71 0.00 0.00 55.69 54.26 1h2i s MET 56 Cb 0.06 -3.70 0.07 0.00 2.01 0.00 0.00 34.83 33.27 1h2i s MET 56 CO 0.12 -0.40 1.09 0.00 -0.01 0.00 0.00 175.02 175.83 1h2i s ALA 57 N 2.19 2.24 0.37 3.03 0.00 0.65 -4.88 121.76 125.37 1h2i s ALA 57 Ca 0.17 -0.16 0.08 0.00 0.00 0.00 0.00 51.96 52.04 1h2i s ALA 57 Cb -0.16 -3.12 0.81 0.00 0.00 0.00 0.00 23.12 20.65 1h2i s ALA 57 CO 0.11 -1.73 1.95 0.78 0.00 0.00 0.00 175.76 176.87 1h2i h GLY 58 N -1.09 0.91 -0.98 0.00 0.00 -1.98 -0.45 103.07 99.48 1h2i h GLY 58 Ca -0.47 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.58 1h2i h GLY 58 CO 0.59 0.19 0.00 0.61 0.00 0.00 0.00 176.54 177.92 1h2i n GLY 59 N -1.46 0.94 3.31 4.60 0.00 -1.26 -4.74 105.19 106.58 1h2i n GLY 59 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 1h2i n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2i n GLY 60 N 0.17 -0.53 3.10 -0.02 0.00 -0.18 -4.98 105.19 102.76 1h2i n GLY 60 Ca 0.00 0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 1h2i n GLY 60 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1h2i s GLN 61 N -6.00 1.32 0.36 1.61 -2.07 -1.22 -4.90 119.66 108.76 1h2i s GLN 61 Ca 0.43 -0.50 -0.28 0.00 -1.82 0.00 0.00 55.36 53.19 1h2i s GLN 61 Cb -0.20 -1.21 -0.12 0.00 -1.09 0.00 0.00 33.01 30.39 1h2i s GLN 61 CO 0.54 0.25 1.41 1.17 -1.32 0.00 0.00 175.29 177.33 1h2i n LYS 62 N 2.98 2.45 -3.81 9.60 4.81 -1.26 -0.25 118.16 132.68 1h2i n LYS 62 Ca -0.16 0.86 -0.25 0.00 -0.87 0.00 0.00 58.31 57.88 1h2i n LYS 62 Cb 0.54 -2.53 -0.17 0.00 0.02 0.00 0.00 35.03 32.89 1h2i n LYS 62 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1h2i s VAL 63 N -1.08 0.64 0.24 3.15 1.01 -0.48 -4.84 120.40 119.04 1h2i s VAL 63 Ca 0.54 -0.17 -0.12 0.00 0.00 0.00 0.00 61.98 62.23 1h2i s VAL 63 Cb -0.52 -0.82 -0.08 0.00 0.00 0.00 0.00 36.38 34.97 1h2i s VAL 63 CO 0.63 0.20 0.61 0.00 0.00 0.00 0.00 175.10 176.53 1h2i s TYR 65 N -1.78 -0.23 -0.09 0.00 -0.85 -0.39 -4.99 117.35 109.01 1h2i s TYR 65 Ca 0.47 -0.09 0.01 0.00 -0.52 0.00 0.00 57.07 56.94 1h2i s TYR 65 Cb -0.12 0.64 -0.02 0.00 0.38 0.00 0.00 41.96 42.84 1h2i s TYR 65 CO 0.20 -0.91 -0.12 0.42 -1.52 0.00 0.00 175.55 173.62 1h2i s ILE 66 N -3.51 3.23 0.24 -3.49 1.01 -1.26 -1.39 121.20 116.02 1h2i s ILE 66 Ca 0.09 -0.63 -0.30 0.00 0.00 0.00 0.00 60.65 59.82 1h2i s ILE 66 Cb -0.03 -2.32 -0.09 0.00 0.01 0.00 0.00 42.46 40.03 1h2i s ILE 66 CO 0.00 0.56 1.23 -1.61 0.00 0.00 0.00 174.94 175.12 1h2i s GLU 67 N -0.22 4.46 0.29 2.79 2.02 -1.26 -4.90 118.70 121.89 1h2i s GLU 67 Ca 0.01 1.98 0.01 0.00 0.02 0.00 0.00 54.97 57.00 1h2i s GLU 67 Cb -0.13 -3.18 0.71 0.00 0.10 0.00 0.00 34.13 31.63 1h2i s GLU 67 CO 0.03 -0.09 1.62 0.78 0.02 0.00 0.00 175.26 177.61 1h2i h GLY 68 N 4.59 1.27 1.75 -1.39 0.00 -1.99 0.13 103.07 107.43 1h2i h GLY 68 Ca -0.46 0.05 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 1h2i h GLY 68 CO 0.72 -0.43 -0.06 1.12 0.00 0.00 0.00 176.54 177.89 1h2i h HIS 69 N 0.11 0.32 -0.36 5.60 2.07 -2.00 -0.26 115.15 120.64 1h2i h HIS 69 Ca 0.56 -0.03 -0.13 0.00 -2.85 0.00 0.00 60.37 57.92 1h2i h HIS 69 Cb 1.14 -0.10 -0.01 0.00 2.57 0.00 0.00 27.41 31.01 1h2i h HIS 69 CO -0.36 0.38 -0.31 0.00 -3.07 0.00 0.00 177.93 174.58 1h2i h ARG 70 N 0.30 0.77 -0.59 5.12 2.47 -1.13 -2.19 114.38 119.13 1h2i h ARG 70 Ca 0.07 -0.35 -0.08 0.00 -1.26 0.00 0.00 59.98 58.35 1h2i h ARG 70 Cb 0.31 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.59 1h2i h ARG 70 CO 0.01 0.97 0.06 0.28 0.56 0.00 0.00 179.97 181.85 1h2i h VAL 71 N 0.65 1.26 -0.37 2.04 2.07 -0.87 0.68 116.25 121.72 1h2i h VAL 71 Ca 0.07 -1.06 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 1h2i h VAL 71 Cb 0.84 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 1h2i h VAL 71 CO 0.07 0.39 0.23 0.40 0.02 0.00 0.00 177.57 178.68 1h2i h ILE 72 N 0.90 1.12 -0.12 4.57 2.04 -0.93 -0.28 117.51 124.82 1h2i h ILE 72 Ca 0.17 -0.26 -0.11 0.00 1.00 0.00 0.00 64.86 65.67 1h2i h ILE 72 Cb 0.48 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1h2i h ILE 72 CO 0.02 0.12 -0.41 0.78 0.00 0.00 0.00 178.15 178.65 1h2i h ASN 73 N 0.49 0.28 -0.43 1.72 2.35 -1.12 -0.43 115.58 118.44 1h2i h ASN 73 Ca 0.13 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 1h2i h ASN 73 Cb -0.01 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1h2i h ASN 73 CO -0.03 0.66 0.24 -0.07 -1.65 0.00 0.00 177.43 176.59 1h2i h LEU 74 N 0.22 0.54 -0.13 1.61 3.38 -0.29 -1.20 115.31 119.44 1h2i h LEU 74 Ca 0.02 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1h2i h LEU 74 Cb 0.82 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1h2i h LEU 74 CO 0.07 0.46 0.08 0.00 0.09 0.00 0.00 178.44 179.13 1h2i h ALA 75 N 1.10 0.17 -0.97 1.53 0.00 -0.58 0.43 119.26 120.93 1h2i h ALA 75 Ca 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1h2i h ALA 75 Cb 0.04 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1h2i h ALA 75 CO -0.03 -0.32 0.64 -0.91 0.00 0.00 0.00 179.25 178.63 1h2i h ASN 76 N 0.14 1.12 0.76 0.00 2.35 -0.90 0.07 115.58 119.11 1h2i h ASN 76 Ca 0.05 -0.03 -0.17 0.00 -0.55 0.00 0.00 56.30 55.59 1h2i h ASN 76 Cb 0.04 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 1h2i h ASN 76 CO -0.01 0.82 -0.81 -0.33 -1.65 0.00 0.00 177.43 175.45 1h2i h GLU 77 N 1.32 0.03 0.03 0.81 4.39 -1.04 0.30 114.58 120.42 1h2i h GLU 77 Ca 0.35 -0.04 -0.24 0.00 0.34 0.00 0.00 59.36 59.78 1h2i h GLU 77 Cb -0.14 0.01 0.02 0.00 -0.10 0.00 0.00 28.75 28.54 1h2i h GLU 77 CO -0.08 0.82 -0.94 1.98 -1.16 0.00 0.00 179.01 179.64 1h2i h MET 78 N 0.02 0.59 0.00 2.33 4.05 -0.28 -3.38 114.93 118.26 1h2i h MET 78 Ca -0.01 -0.67 0.00 0.00 -0.28 0.00 0.00 59.70 58.74 1h2i h MET 78 Cb 1.43 0.20 0.00 0.00 -0.80 0.00 0.00 31.60 32.43 1h2i h MET 78 CO 0.11 1.27 -0.56 1.19 0.23 0.00 0.00 176.91 179.15 1h2i n PHE 79 N -3.97 0.00 0.00 1.39 3.72 -0.05 -4.97 117.46 113.58 1h2i n PHE 79 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1h2i n PHE 79 Cb 0.84 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.34 1h2i n PHE 79 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1h2i n GLY 80 N 1.39 2.17 0.32 1.37 0.00 0.10 -3.35 105.19 107.20 1h2i n GLY 80 Ca 0.01 -1.74 0.19 0.00 0.00 0.00 0.00 46.02 44.47 1h2i n GLY 80 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1h2i h TYR 81 N 0.00 0.00 -0.27 1.61 -0.00 -1.90 0.88 116.97 117.30 1h2i h TYR 81 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1h2i h TYR 81 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1h2i h TYR 81 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 178.16 178.43 1h2i n ASN 82 N -3.45 3.66 -0.00 0.10 2.04 -1.26 -4.53 115.26 111.83 1h2i n ASN 82 Ca -0.03 -2.83 0.10 0.00 -0.44 0.00 0.00 54.58 51.38 1h2i n ASN 82 Cb 0.09 -0.48 -0.12 0.00 -2.53 0.00 0.00 39.78 36.74 1h2i n ASN 82 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1h2i n GLY 83 N -0.35 -0.91 3.12 4.83 0.00 0.30 -4.72 105.19 107.46 1h2i n GLY 83 Ca 0.19 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 1h2i n GLY 83 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1h2i s TRP 84 N -2.97 0.26 0.18 1.61 1.48 -1.25 -1.07 118.94 117.18 1h2i s TRP 84 Ca 0.06 -0.63 -0.13 0.00 -1.06 0.00 0.00 56.10 54.34 1h2i s TRP 84 Cb 0.15 -0.18 0.01 0.00 -1.16 0.00 0.00 33.47 32.28 1h2i s TRP 84 CO 0.83 -0.39 0.39 0.00 -4.06 0.00 0.00 176.95 173.73 1h2i s ALA 85 N -3.02 -0.40 -0.04 2.67 0.00 0.13 -4.97 121.76 116.13 1h2i s ALA 85 Ca -0.01 -0.62 -0.19 0.00 0.00 0.00 0.00 51.96 51.14 1h2i s ALA 85 Cb 0.01 0.87 0.04 0.00 0.00 0.00 0.00 23.12 24.04 1h2i s ALA 85 CO -0.07 -0.72 0.42 -3.38 0.00 0.00 0.00 175.76 172.01 1h2i s HIS 86 N -3.93 -0.34 0.10 0.00 -3.43 -1.26 0.36 115.29 106.79 1h2i s HIS 86 Ca 0.14 0.61 0.01 0.00 -0.80 0.00 0.00 55.06 55.02 1h2i s HIS 86 Cb 0.01 0.18 -0.04 0.00 -1.43 0.00 0.00 32.58 31.30 1h2i s HIS 86 CO -0.01 -0.42 -0.06 -1.54 -2.00 0.00 0.00 174.74 170.71 1h2i s SER 87 N -1.08 1.05 -0.49 7.38 1.04 -0.04 -4.97 113.70 116.60 1h2i s SER 87 Ca -0.11 -1.01 -0.17 0.00 0.48 0.00 0.00 55.95 55.14 1h2i s SER 87 Cb -0.04 0.11 0.07 0.00 0.10 0.00 0.00 66.02 66.27 1h2i s SER 87 CO 0.05 -0.49 0.47 -0.63 0.98 0.00 0.00 173.24 173.62 1h2i s ILE 88 N -3.67 5.13 0.38 -1.02 1.01 -1.26 -0.96 121.20 120.81 1h2i s ILE 88 Ca 0.12 -0.93 0.15 0.00 0.00 0.00 0.00 60.65 59.99 1h2i s ILE 88 Cb 0.06 -4.19 0.14 0.00 0.01 0.00 0.00 42.46 38.47 1h2i s ILE 88 CO -0.05 -0.67 1.89 0.71 0.00 0.00 0.00 174.94 176.82 1h2i h THR 89 N 5.79 1.12 -1.28 2.92 1.35 -1.05 -3.46 112.91 118.30 1h2i h THR 89 Ca -0.28 -1.06 0.17 0.00 -0.55 0.00 0.00 66.41 64.68 1h2i h THR 89 Cb 1.11 1.59 -0.26 0.00 -1.73 0.00 0.00 68.15 68.85 1h2i h THR 89 CO 0.92 0.30 0.76 -1.58 -0.25 0.00 0.00 175.52 175.67 1h2i s GLN 90 N -4.24 0.29 -0.06 4.72 0.74 -1.21 -4.99 119.66 114.91 1h2i s GLN 90 Ca -0.03 0.10 0.01 0.00 0.05 0.00 0.00 55.36 55.49 1h2i s GLN 90 Cb 0.14 0.14 0.02 0.00 1.10 0.00 0.00 33.01 34.41 1h2i s GLN 90 CO 0.70 -0.08 -0.05 -1.14 -0.55 0.00 0.00 175.29 174.17 1h2i s GLN 91 N -0.87 0.96 -0.06 1.67 0.74 -1.26 -0.28 119.66 120.55 1h2i s GLN 91 Ca 0.04 -0.12 0.03 0.00 0.05 0.00 0.00 55.36 55.36 1h2i s GLN 91 Cb -0.01 -0.99 0.00 0.00 1.10 0.00 0.00 33.01 33.12 1h2i s GLN 91 CO -0.05 -0.11 -0.16 1.21 -0.55 0.00 0.00 175.29 175.63 1h2i s ASN 92 N 1.10 2.09 -0.39 6.67 3.84 0.59 -4.99 114.94 123.86 1h2i s ASN 92 Ca -0.08 -0.35 -0.24 0.00 0.21 0.00 0.00 52.86 52.39 1h2i s ASN 92 Cb -0.14 -0.81 0.01 0.00 -0.55 0.00 0.00 41.25 39.76 1h2i s ASN 92 CO -0.01 0.10 0.85 -0.69 -2.79 0.00 0.00 177.10 174.56 1h2i s VAL 93 N 0.37 4.64 0.17 -5.21 1.01 -1.26 -1.31 120.40 118.81 1h2i s VAL 93 Ca -0.11 0.93 -0.07 0.00 0.00 0.00 0.00 61.98 62.73 1h2i s VAL 93 Cb -0.14 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.91 1h2i s VAL 93 CO 0.04 -0.54 1.50 0.44 0.00 0.00 0.00 175.10 176.54 1h2i h ASP 94 N 8.60 0.81 -4.15 3.32 3.45 -0.91 -3.48 116.42 124.07 1h2i h ASP 94 Ca -0.24 -0.39 0.17 0.00 0.43 0.00 0.00 57.03 56.99 1h2i h ASP 94 Cb 1.09 -0.23 -0.20 0.00 -0.56 0.00 0.00 39.33 39.42 1h2i h ASP 94 CO 0.95 1.14 0.68 0.72 -1.57 0.00 0.00 179.24 181.16 1h2i s PHE 95 N -4.23 -0.24 -0.31 4.55 -0.12 -1.16 -4.98 117.98 111.48 1h2i s PHE 95 Ca -0.09 0.27 -0.02 0.00 -0.05 0.00 0.00 56.93 57.04 1h2i s PHE 95 Cb 0.11 0.50 0.10 0.00 -0.63 0.00 0.00 43.02 43.11 1h2i s PHE 95 CO 0.86 -0.30 0.12 0.08 -0.05 0.00 0.00 175.22 175.93 1h2i s VAL 96 N -2.00 0.49 -0.07 -2.49 1.01 -1.26 -2.53 120.40 113.55 1h2i s VAL 96 Ca 0.05 -1.23 -0.01 0.00 0.00 0.00 0.00 61.98 60.79 1h2i s VAL 96 Cb -0.01 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1h2i s VAL 96 CO -0.04 -0.73 0.01 -1.81 0.00 0.00 0.00 175.10 172.53 1h2i s ASP 97 N 1.71 5.27 -0.32 3.32 1.01 0.39 -4.94 116.67 123.11 1h2i s ASP 97 Ca 0.10 0.13 -0.02 0.00 0.71 0.00 0.00 52.55 53.47 1h2i s ASP 97 Cb -0.17 -1.47 0.06 0.00 1.01 0.00 0.00 42.92 42.35 1h2i s ASP 97 CO -0.27 0.35 0.04 -0.22 0.21 0.00 0.00 175.17 175.29 1h2i s LEU 98 N -1.07 4.22 0.00 1.23 2.96 -1.26 0.76 118.68 125.53 1h2i s LEU 98 Ca 0.15 -1.47 0.13 0.00 -0.22 0.00 0.00 54.13 52.72 1h2i s LEU 98 Cb -0.11 -1.73 0.12 0.00 0.50 0.00 0.00 46.19 44.96 1h2i s LEU 98 CO 0.05 -0.32 0.93 0.59 -1.32 0.00 0.00 176.35 176.27 1h2i n ASN 99 N 4.60 2.13 0.00 3.68 5.03 -0.83 -4.97 115.26 124.90 1h2i n ASN 99 Ca -0.10 -1.56 0.00 0.00 0.87 0.00 0.00 54.58 53.79 1h2i n ASN 99 Cb 0.43 -0.01 0.00 0.00 -1.02 0.00 0.00 39.78 39.17 1h2i n ASN 99 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1h2i n ASN 100 N 0.72 0.00 -0.08 6.41 3.02 -1.26 -4.91 115.26 119.17 1h2i n ASN 100 Ca 0.08 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.64 1h2i n ASN 100 Cb 0.33 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.52 1h2i n ASN 100 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h2i n GLY 101 N 0.00 3.01 3.63 7.41 0.00 -1.26 -5.02 105.19 112.96 1h2i n GLY 101 Ca 0.00 -0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 1h2i n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h2i s LYS 102 N -1.04 2.26 -0.05 1.61 1.02 -1.26 -4.49 119.74 117.79 1h2i s LYS 102 Ca 0.04 -1.24 -0.01 0.00 0.02 0.00 0.00 55.97 54.77 1h2i s LYS 102 Cb 0.02 -2.24 -0.04 0.00 -0.52 0.00 0.00 37.83 35.06 1h2i s LYS 102 CO 0.02 0.42 0.02 -0.06 -0.92 0.00 0.00 175.35 174.83 1h2i s PHE 103 N -1.89 3.17 -0.21 3.18 0.40 0.23 -1.96 117.98 120.91 1h2i s PHE 103 Ca 0.28 0.18 0.02 0.00 -0.60 0.00 0.00 56.93 56.80 1h2i s PHE 103 Cb -0.08 -1.75 0.04 0.00 0.51 0.00 0.00 43.02 41.74 1h2i s PHE 103 CO 0.18 0.49 -0.15 0.71 0.70 0.00 0.00 175.22 177.15 1h2i s TYR 104 N -1.00 2.82 -0.05 0.36 1.51 0.23 -1.40 117.35 119.82 1h2i s TYR 104 Ca 0.17 -1.83 0.03 0.00 -1.01 0.00 0.00 57.07 54.43 1h2i s TYR 104 Cb -0.12 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 39.90 1h2i s TYR 104 CO 0.07 -0.81 -0.14 0.08 -1.11 0.00 0.00 175.55 173.63 1h2i s VAL 105 N 1.26 1.26 -0.14 0.71 1.01 0.42 -0.46 120.40 124.46 1h2i s VAL 105 Ca -0.01 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.39 1h2i s VAL 105 Cb -0.16 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.13 1h2i s VAL 105 CO -0.09 0.37 -0.16 -0.83 0.00 0.00 0.00 175.10 174.39 1h2i s GLY 106 N 0.30 1.17 -0.02 4.51 0.00 -1.05 -1.85 107.32 110.38 1h2i s GLY 106 Ca -0.08 -0.92 0.03 0.00 0.00 0.00 0.00 44.72 43.74 1h2i s GLY 106 CO 0.03 0.33 -0.11 0.14 0.00 0.00 0.00 173.10 173.49 1h2i s VAL 107 N 1.21 0.89 0.09 1.40 1.01 -0.08 -0.14 120.40 124.79 1h2i s VAL 107 Ca -0.00 -0.44 0.09 0.00 0.00 0.00 0.00 61.98 61.63 1h2i s VAL 107 Cb -0.14 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1h2i s VAL 107 CO -0.07 0.26 -0.22 0.00 0.00 0.00 0.00 175.10 175.07 1h2i s ALA 109 N -1.02 0.71 -0.27 0.00 0.00 -0.59 -0.30 121.76 120.29 1h2i s ALA 109 Ca 0.15 -0.32 -0.07 0.00 0.00 0.00 0.00 51.96 51.72 1h2i s ALA 109 Cb -0.10 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 1h2i s ALA 109 CO 0.07 0.15 0.07 -0.06 0.00 0.00 0.00 175.76 175.99 1h2i s PHE 110 N -0.04 3.11 -0.13 0.00 0.40 0.61 -0.15 117.98 121.78 1h2i s PHE 110 Ca 0.01 -0.67 0.01 0.00 -0.60 0.00 0.00 56.93 55.68 1h2i s PHE 110 Cb -0.05 -2.25 -0.01 0.00 0.51 0.00 0.00 43.02 41.22 1h2i s PHE 110 CO -0.00 -0.46 -0.15 0.08 0.70 0.00 0.00 175.22 175.39 1h2i s VAL 111 N 1.57 2.80 -0.23 -0.44 1.01 -0.55 -0.34 120.40 124.22 1h2i s VAL 111 Ca 0.05 -0.75 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 1h2i s VAL 111 Cb -0.16 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.04 1h2i s VAL 111 CO 0.03 0.53 -0.01 -0.60 0.00 0.00 0.00 175.10 175.04 1h2i s ARG 112 N 0.44 3.43 -0.01 2.72 3.52 -0.13 -1.70 118.95 127.21 1h2i s ARG 112 Ca -0.11 -0.60 0.01 0.00 -0.13 0.00 0.00 55.73 54.90 1h2i s ARG 112 Cb -0.16 -3.09 -0.03 0.00 -1.56 0.00 0.00 34.95 30.10 1h2i s ARG 112 CO 0.05 -0.20 -0.02 0.54 -0.81 0.00 0.00 175.30 174.86 1h2i s VAL 113 N 1.51 4.04 0.05 7.11 0.11 -0.14 -0.86 120.40 132.22 1h2i s VAL 113 Ca 0.06 -0.59 0.02 0.00 -2.93 0.00 0.00 61.98 58.54 1h2i s VAL 113 Cb -0.15 -2.77 -0.03 0.00 -1.53 0.00 0.00 36.38 31.90 1h2i s VAL 113 CO -0.02 0.42 -0.08 -1.58 -3.33 0.00 0.00 175.10 170.51 1h2i s GLN 114 N -1.41 0.59 0.31 1.54 0.74 0.16 -1.86 119.66 119.73 1h2i s GLN 114 Ca 0.18 -0.86 0.05 0.00 0.05 0.00 0.00 55.36 54.78 1h2i s GLN 114 Cb -0.11 -0.31 -0.02 0.00 1.10 0.00 0.00 33.01 33.67 1h2i s GLN 114 CO 0.08 0.05 0.44 -0.51 -0.55 0.00 0.00 175.29 174.80 1h2i s LEU 115 N -1.83 4.09 0.22 3.68 1.02 -0.27 0.19 118.68 125.78 1h2i s LEU 115 Ca -0.06 -0.04 0.15 0.00 0.02 0.00 0.00 54.13 54.20 1h2i s LEU 115 Cb -0.07 -2.84 0.81 0.00 0.02 0.00 0.00 46.19 44.11 1h2i s LEU 115 CO -0.00 -0.31 1.46 2.29 0.02 0.00 0.00 176.35 179.81 1h2i n LYS 116 N -1.58 0.10 -0.09 1.70 2.85 -0.24 -0.33 118.16 120.57 1h2i n LYS 116 Ca -0.03 0.60 -0.12 0.00 -1.05 0.00 0.00 58.31 57.70 1h2i n LYS 116 Cb 0.58 -1.82 0.00 0.00 -0.65 0.00 0.00 35.03 33.14 1h2i n LYS 116 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 1h2i h ASP 117 N 0.00 0.91 0.00 -5.58 -0.00 -1.84 0.03 116.42 109.93 1h2i h ASP 117 Ca 0.00 -0.43 0.00 0.00 -0.00 0.00 0.00 57.03 56.60 1h2i h ASP 117 Cb 0.01 -0.26 0.00 0.00 -0.00 0.00 0.00 39.33 39.08 1h2i h ASP 117 CO 0.00 1.20 0.00 0.61 -0.00 0.00 0.00 179.24 181.05 1h2i n GLY 118 N 0.15 1.67 3.76 -0.78 0.00 0.56 -4.56 105.19 105.99 1h2i n GLY 118 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1h2i n GLY 118 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h2i s SER 119 N -1.78 5.13 0.17 1.61 1.04 -1.26 -4.76 113.70 113.86 1h2i s SER 119 Ca 0.00 2.11 -0.21 0.00 0.48 0.00 0.00 55.95 58.33 1h2i s SER 119 Cb 0.00 -2.57 0.05 0.00 0.10 0.00 0.00 66.02 63.61 1h2i s SER 119 CO 0.00 -1.62 0.57 -0.72 0.98 0.00 0.00 173.24 172.46 1h2i s TYR 120 N -2.12 -0.39 -0.06 5.02 -0.85 -1.26 -1.11 117.35 116.58 1h2i s TYR 120 Ca 0.70 0.11 -0.06 0.00 -0.52 0.00 0.00 57.07 57.31 1h2i s TYR 120 Cb -0.23 0.51 0.01 0.00 0.38 0.00 0.00 41.96 42.64 1h2i s TYR 120 CO 0.38 -0.88 0.16 -1.01 -1.52 0.00 0.00 175.55 172.67 1h2i s HIS 121 N -3.80 -0.16 0.04 -3.49 3.76 -0.78 -5.01 115.29 105.86 1h2i s HIS 121 Ca 0.04 0.40 0.06 0.00 -0.15 0.00 0.00 55.06 55.41 1h2i s HIS 121 Cb -0.01 0.05 -0.02 0.00 1.11 0.00 0.00 32.58 33.71 1h2i s HIS 121 CO -0.09 -0.09 -0.17 -2.00 -0.85 0.00 0.00 174.74 171.53 1h2i s GLU 122 N 0.02 1.17 0.29 1.40 2.12 -1.26 -0.96 118.70 121.48 1h2i s GLU 122 Ca -0.01 -0.84 -0.08 0.00 0.36 0.00 0.00 54.97 54.41 1h2i s GLU 122 Cb -0.01 -1.23 0.00 0.00 0.26 0.00 0.00 34.13 33.15 1h2i s GLU 122 CO 0.00 0.31 0.48 0.34 -0.54 0.00 0.00 175.26 175.85 1h2i s ASP 123 N -1.12 0.33 0.04 -1.70 -1.08 -0.69 -4.89 116.67 107.56 1h2i s ASP 123 Ca 0.05 -1.20 -0.01 0.00 -0.52 0.00 0.00 52.55 50.87 1h2i s ASP 123 Cb -0.08 0.62 -0.04 0.00 -1.46 0.00 0.00 42.92 41.96 1h2i s ASP 123 CO 0.01 -1.23 0.19 -0.69 0.52 0.00 0.00 175.17 173.98 1h2i s VAL 124 N -3.51 5.33 0.20 1.11 1.01 -1.26 -1.49 120.40 121.79 1h2i s VAL 124 Ca 0.26 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 61.99 1h2i s VAL 124 Cb -0.00 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1h2i s VAL 124 CO 0.14 0.21 -0.17 -0.83 0.00 0.00 0.00 175.10 174.44 1h2i s GLY 125 N -2.29 1.48 0.05 4.51 0.00 0.79 -4.49 107.32 107.37 1h2i s GLY 125 Ca 0.32 -1.62 0.05 0.00 0.00 0.00 0.00 44.72 43.47 1h2i s GLY 125 CO 0.24 -1.69 -0.14 -0.47 0.00 0.00 0.00 173.10 171.04 1h2i s TYR 126 N -2.49 1.20 -0.05 1.90 5.04 -1.26 -1.55 117.35 120.15 1h2i s TYR 126 Ca 0.21 -0.39 0.03 0.00 -2.44 0.00 0.00 57.07 54.48 1h2i s TYR 126 Cb -0.04 -0.70 0.01 0.00 0.35 0.00 0.00 41.96 41.58 1h2i s TYR 126 CO 0.08 0.04 -0.12 0.20 -1.34 0.00 0.00 175.55 174.40 1h2i s GLY 127 N -1.33 0.74 0.03 8.97 0.00 0.26 -3.88 107.32 112.12 1h2i s GLY 127 Ca 0.00 -0.45 0.05 0.00 0.00 0.00 0.00 44.72 44.32 1h2i s GLY 127 CO 0.02 -0.05 -0.16 0.14 0.00 0.00 0.00 173.10 173.04 1h2i s VAL 128 N 0.37 1.24 -0.18 1.40 1.01 -1.26 -0.90 120.40 122.08 1h2i s VAL 128 Ca -0.08 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 60.90 1h2i s VAL 128 Cb -0.13 -1.09 0.09 0.00 0.00 0.00 0.00 36.38 35.25 1h2i s VAL 128 CO 0.02 0.12 0.24 -0.55 0.00 0.00 0.00 175.10 174.93 1h2i s SER 129 N -0.97 1.04 -0.09 3.32 0.15 -0.77 -4.54 113.70 111.84 1h2i s SER 129 Ca 0.04 0.01 0.01 0.00 0.70 0.00 0.00 55.95 56.71 1h2i s SER 129 Cb -0.08 0.50 0.02 0.00 -1.71 0.00 0.00 66.02 64.75 1h2i s SER 129 CO 0.01 -0.30 -0.12 -1.61 1.20 0.00 0.00 173.24 172.42 1h2i s GLU 130 N 2.36 1.80 0.00 5.44 2.02 -1.26 -0.44 118.70 128.62 1h2i s GLU 130 Ca 0.06 -0.41 0.00 0.00 0.02 0.00 0.00 54.97 54.64 1h2i s GLU 130 Cb -0.15 -1.60 0.00 0.00 0.10 0.00 0.00 34.13 32.48 1h2i s GLU 130 CO -0.11 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 175.49 1h2i n GLY 131 N 4.27 2.89 3.76 -1.39 0.00 -0.49 -5.01 105.19 109.22 1h2i n GLY 131 Ca -0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 1h2i n GLY 131 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h2i s LEU 132 N 0.00 3.06 -0.00 0.99 1.43 -1.26 -4.56 118.68 118.34 1h2i s LEU 132 Ca 0.00 1.90 0.21 0.00 -1.03 0.00 0.00 54.13 55.21 1h2i s LEU 132 Cb 0.00 -4.53 -0.17 0.00 0.03 0.00 0.00 46.19 41.52 1h2i s LEU 132 CO 0.00 -2.12 0.91 0.29 0.23 0.00 0.00 176.35 175.66 1h2i n LYS 133 N -3.47 0.07 -3.17 1.70 5.02 -1.26 -0.60 118.16 116.45 1h2i n LYS 133 Ca 0.10 -0.02 -0.40 0.00 -2.02 0.00 0.00 58.31 55.97 1h2i n LYS 133 Cb 0.53 -1.51 -0.07 0.00 -0.02 0.00 0.00 35.03 33.96 1h2i n LYS 133 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1h2i s SER 134 N -3.16 6.55 0.05 4.39 0.15 -1.26 -4.83 113.70 115.59 1h2i s SER 134 Ca 0.07 0.66 -0.21 0.00 0.70 0.00 0.00 55.95 57.17 1h2i s SER 134 Cb 0.16 -2.32 -0.13 0.00 -1.71 0.00 0.00 66.02 62.03 1h2i s SER 134 CO 0.86 -0.31 1.47 0.50 1.20 0.00 0.00 173.24 176.96 1h2i h LYS 135 N 7.82 0.25 0.21 5.44 3.64 -1.98 -1.93 116.57 130.02 1h2i h LYS 135 Ca -0.29 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.02 1h2i h LYS 135 Cb 1.14 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 1h2i h LYS 135 CO 0.75 0.49 -0.28 0.00 -2.27 0.00 0.00 179.45 178.14 1h2i h ALA 136 N 0.75 -0.54 -0.08 5.00 0.00 -1.99 0.10 119.26 122.50 1h2i h ALA 136 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1h2i h ALA 136 Cb 0.39 0.43 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1h2i h ALA 136 CO 0.01 -0.84 0.05 -0.07 0.00 0.00 0.00 179.25 178.40 1h2i h LEU 137 N -0.55 0.09 -0.02 0.00 -0.00 -1.97 0.53 115.31 113.38 1h2i h LEU 137 Ca 0.01 -0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.86 1h2i h LEU 137 Cb 0.54 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1h2i h LEU 137 CO -0.10 0.07 -0.08 0.28 -0.00 0.00 0.00 178.44 178.61 1h2i h SER 138 N 0.11 0.11 -0.32 -0.43 0.02 -0.48 -2.38 113.55 110.17 1h2i h SER 138 Ca 0.03 -0.62 0.01 0.00 -0.84 0.00 0.00 61.79 60.38 1h2i h SER 138 Cb -0.01 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1h2i h SER 138 CO -0.01 0.71 0.18 -0.07 -1.14 0.00 0.00 176.83 176.51 1h2i h LEU 139 N -0.48 0.30 -0.72 5.07 -0.00 -0.46 -1.32 115.31 117.70 1h2i h LEU 139 Ca -0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.88 57.97 1h2i h LEU 139 Cb 0.70 -0.06 -0.07 0.00 -0.00 0.00 0.00 40.66 41.23 1h2i h LEU 139 CO 0.02 0.22 0.37 -0.08 -0.00 0.00 0.00 178.44 178.97 1h2i h GLU 140 N 0.38 0.63 -0.19 1.13 4.81 -0.93 0.23 114.58 120.64 1h2i h GLU 140 Ca 0.12 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 1h2i h GLU 140 Cb 0.00 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 1h2i h GLU 140 CO -0.06 0.41 -0.03 -0.22 -0.73 0.00 0.00 179.01 178.39 1h2i h LYS 141 N 0.64 0.35 -0.32 1.92 3.64 -1.09 -2.00 116.57 119.71 1h2i h LYS 141 Ca 0.35 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.56 1h2i h LYS 141 Cb 0.33 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1h2i h LYS 141 CO -0.25 0.59 0.05 0.00 -2.27 0.00 0.00 179.45 177.57 1h2i h ALA 142 N 0.75 0.43 -0.39 5.00 0.00 -0.82 -1.68 119.26 122.55 1h2i h ALA 142 Ca 0.05 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1h2i h ALA 142 Cb 0.45 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1h2i h ALA 142 CO 0.01 0.13 0.12 0.00 0.00 0.00 0.00 179.25 179.52 1h2i h ARG 143 N 0.37 0.61 -0.70 0.00 3.08 -0.99 -1.65 114.38 115.08 1h2i h ARG 143 Ca 0.10 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1h2i h ARG 143 Cb 0.35 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 1h2i h ARG 143 CO 0.01 0.61 0.19 0.87 -1.07 0.00 0.00 179.97 180.58 1h2i h LYS 144 N 0.48 1.11 -0.05 0.04 1.57 -1.31 -2.86 116.57 115.56 1h2i h LYS 144 Ca 0.13 -0.26 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 1h2i h LYS 144 Cb 0.26 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1h2i h LYS 144 CO -0.00 0.97 -0.64 0.93 -0.57 0.00 0.00 179.45 180.14 1h2i h GLU 145 N 1.05 0.19 -0.45 3.15 5.08 -1.21 -2.54 114.58 119.85 1h2i h GLU 145 Ca 0.22 -0.14 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1h2i h GLU 145 Cb 0.35 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1h2i h GLU 145 CO -0.00 0.76 0.26 0.00 -1.00 0.00 0.00 179.01 179.03 1h2i h ALA 146 N 1.20 0.57 0.10 3.43 0.00 -1.14 0.42 119.26 123.84 1h2i h ALA 146 Ca -0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1h2i h ALA 146 Cb 1.15 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1h2i h ALA 146 CO 0.10 -0.07 -0.05 0.28 0.00 0.00 0.00 179.25 179.51 1h2i h VAL 147 N 0.52 0.97 -0.89 0.00 2.07 -1.36 0.52 116.25 118.07 1h2i h VAL 147 Ca 0.18 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1h2i h VAL 147 Cb 0.03 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1h2i h VAL 147 CO -0.09 0.06 0.49 0.74 0.02 0.00 0.00 177.57 178.79 1h2i h THR 148 N -0.25 1.26 -0.61 2.57 2.02 -1.17 0.30 112.91 117.02 1h2i h THR 148 Ca -0.01 -0.63 -0.05 0.00 0.77 0.00 0.00 66.41 66.48 1h2i h THR 148 Cb 0.21 0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 66.63 1h2i h THR 148 CO 0.02 0.29 0.17 -0.78 0.37 0.00 0.00 175.52 175.59 1h2i h ASP 149 N 1.25 0.91 -0.39 4.18 -0.00 -0.02 -0.69 116.42 121.66 1h2i h ASP 149 Ca 0.32 -0.22 -0.11 0.00 -0.00 0.00 0.00 57.03 57.02 1h2i h ASP 149 Cb 0.02 -0.24 -0.02 0.00 -0.00 0.00 0.00 39.33 39.10 1h2i h ASP 149 CO -0.05 0.89 -0.15 1.23 -0.00 0.00 0.00 179.24 181.16 1h2i h GLY 150 N 0.88 0.94 0.97 -0.78 0.00 -0.26 -1.09 103.07 103.72 1h2i h GLY 150 Ca 0.19 -0.76 -0.03 0.00 0.00 0.00 0.00 47.33 46.74 1h2i h GLY 150 CO -0.00 0.69 0.19 -2.00 0.00 0.00 0.00 176.54 175.42 1h2i h LEU 151 N 0.77 0.69 -0.59 3.11 5.85 -0.54 -0.55 115.31 124.05 1h2i h LEU 151 Ca 0.12 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 1h2i h LEU 151 Cb 0.67 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1h2i h LEU 151 CO 0.05 0.68 0.24 0.11 -0.34 0.00 0.00 178.44 179.17 1h2i h LYS 152 N 0.67 0.88 -0.49 1.25 1.57 -0.83 -1.11 116.57 118.51 1h2i h LYS 152 Ca 0.17 -0.16 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 1h2i h LYS 152 Cb 0.21 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1h2i h LYS 152 CO -0.01 0.75 -0.11 0.00 -0.57 0.00 0.00 179.45 179.50 1h2i h ARG 153 N 0.81 0.91 -0.35 3.15 3.08 -0.91 -1.85 114.38 119.22 1h2i h ARG 153 Ca 0.20 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 1h2i h ARG 153 Cb 0.20 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1h2i h ARG 153 CO -0.02 0.97 0.18 0.00 -1.07 0.00 0.00 179.97 180.03 1h2i h ALA 154 N 1.05 0.45 -0.30 0.04 0.00 -0.81 -2.51 119.26 117.18 1h2i h ALA 154 Ca 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1h2i h ALA 154 Cb 0.64 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1h2i h ALA 154 CO 0.04 0.00 0.15 -0.07 0.00 0.00 0.00 179.25 179.38 1h2i h LEU 155 N 0.43 0.36 -1.71 0.00 4.07 -1.02 -2.43 115.31 115.01 1h2i h LEU 155 Ca 0.12 -0.02 0.19 0.00 0.08 0.00 0.00 57.88 58.25 1h2i h LEU 155 Cb 0.10 -0.09 -0.05 0.00 1.08 0.00 0.00 40.66 41.70 1h2i h LEU 155 CO -0.02 0.30 0.54 0.03 -1.08 0.00 0.00 178.44 178.22 1h2i h ARG 156 N 0.41 0.25 -0.07 1.13 3.08 -0.87 -1.23 114.38 117.08 1h2i h ARG 156 Ca 0.11 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.16 1h2i h ARG 156 Cb 0.03 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1h2i h ARG 156 CO -0.02 0.16 0.21 0.77 -1.07 0.00 0.00 179.97 180.03 1h2i h SER 157 N 0.25 0.00 1.86 7.04 0.02 -1.51 -1.84 113.55 119.36 1h2i h SER 157 Ca 0.40 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.33 1h2i h SER 157 Cb 1.16 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.70 1h2i h SER 157 CO -0.10 0.00 -0.06 -0.26 -1.14 0.00 0.00 176.83 175.27 1h2i h PHE 158 N 0.00 0.00 0.00 3.45 -1.00 -1.42 -3.49 116.94 114.48 1h2i h PHE 158 Ca 0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.81 1h2i h PHE 158 Cb 0.46 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.02 1h2i h PHE 158 CO 0.00 0.06 0.00 0.41 -1.61 0.00 0.00 178.31 177.17 1h2i n GLY 159 N 1.02 0.35 0.18 -1.45 0.00 -0.69 -4.94 105.19 99.67 1h2i n GLY 159 Ca 0.03 -1.57 -0.08 0.00 0.00 0.00 0.00 46.02 44.41 1h2i n GLY 159 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1h2i h ASN 160 N 0.00 0.45 -0.07 1.61 2.35 -1.48 -1.43 115.58 117.01 1h2i h ASN 160 Ca 0.00 -0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.76 1h2i h ASN 160 Cb 0.00 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 1h2i h ASN 160 CO 0.00 0.32 0.22 0.00 -1.65 0.00 0.00 177.43 176.32 1h2i h ALA 161 N 1.16 1.41 -0.47 -0.83 0.00 0.90 0.12 119.26 121.56 1h2i h ALA 161 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1h2i h ALA 161 Cb -0.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1h2i h ALA 161 CO -0.04 -0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.23 1h2i n LEU 162 N -3.22 4.44 0.00 0.00 7.99 -0.84 -4.93 117.00 120.45 1h2i n LEU 162 Ca -0.01 -2.67 0.00 0.00 -0.01 0.00 0.00 56.01 53.32 1h2i n LEU 162 Cb 0.30 -0.54 0.00 0.00 -0.11 0.00 0.00 43.42 43.07 1h2i n LEU 162 CO 0.20 0.72 0.00 0.61 -1.51 0.00 0.00 177.39 177.40 1h2i n GLY 163 N 0.41 0.77 0.29 -0.72 0.00 0.42 -3.82 105.19 102.55 1h2i n GLY 163 Ca 0.23 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.43 1h2i n GLY 163 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1h2i h ASN 164 N 0.00 0.00 -0.28 1.61 -0.00 -1.22 -2.75 115.58 112.95 1h2i h ASN 164 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 56.30 56.11 1h2i h ASN 164 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 1h2i h ASN 164 CO 0.00 0.03 -0.55 0.00 -0.00 0.00 0.00 177.43 176.91 1h2i n ILE 166 N -4.00 0.00 -0.06 0.00 0.00 -1.04 0.77 119.36 115.03 1h2i n ILE 166 Ca -0.04 0.85 0.05 0.00 0.00 0.00 0.00 62.75 63.61 1h2i n ILE 166 Cb 0.63 -1.45 0.12 0.00 0.00 0.00 0.00 39.64 38.94 1h2i n ILE 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1h2i n LEU 167 N -2.92 2.65 -4.53 9.51 -0.00 -1.26 -4.91 117.00 115.54 1h2i n LEU 167 Ca 0.23 -1.83 -0.42 0.00 -0.00 0.00 0.00 56.01 53.99 1h2i n LEU 167 Cb 1.12 -0.17 -0.03 0.00 -0.00 0.00 0.00 43.42 44.34 1h2i n LEU 167 CO 0.23 0.64 0.95 -0.62 -0.00 0.00 0.00 177.39 178.59 1h2i s ASP 168 N -0.97 6.28 0.49 1.45 3.68 0.23 -4.93 116.67 122.90 1h2i s ASP 168 Ca 0.19 -0.40 0.27 0.00 2.13 0.00 0.00 52.55 54.74 1h2i s ASP 168 Cb 0.10 -2.50 1.34 0.00 -1.45 0.00 0.00 42.92 40.42 1h2i s ASP 168 CO 0.14 -1.51 1.84 0.11 0.13 0.00 0.00 175.17 175.88 1h2i h LYS 169 N 9.63 0.15 -0.05 4.34 1.57 -1.91 0.18 116.57 130.49 1h2i h LYS 169 Ca -0.27 -0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.36 1h2i h LYS 169 Cb 1.06 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1h2i h LYS 169 CO 1.19 0.10 -0.60 -0.44 -0.57 0.00 0.00 179.45 179.13 1h2i h ASP 170 N 0.16 0.18 -0.08 0.86 3.32 -1.95 -0.65 116.42 118.25 1h2i h ASP 170 Ca 0.49 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 57.39 1h2i h ASP 170 Cb 1.66 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 41.16 1h2i h ASP 170 CO -0.10 0.74 -0.15 0.22 -1.72 0.00 0.00 179.24 178.23 1h2i h TYR 171 N 0.12 0.30 -0.47 4.55 3.20 -1.03 -2.36 116.97 121.28 1h2i h TYR 171 Ca -0.01 -0.11 0.05 0.00 3.14 0.00 0.00 58.73 61.80 1h2i h TYR 171 Cb 1.09 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 39.26 1h2i h TYR 171 CO 0.01 0.75 0.22 -0.07 -1.64 0.00 0.00 178.16 177.43 1h2i h LEU 172 N -0.23 0.29 0.14 2.82 3.38 -1.15 -1.31 115.31 119.26 1h2i h LEU 172 Ca 0.00 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1h2i h LEU 172 Cb 0.73 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 1h2i h LEU 172 CO 0.03 0.21 -0.24 -0.09 0.09 0.00 0.00 178.44 178.44 1h2i h ARG 173 N 0.43 -0.44 0.00 1.13 2.43 -1.13 -1.02 114.38 115.78 1h2i h ARG 173 Ca 0.21 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1h2i h ARG 173 Cb 0.14 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1h2i h ARG 173 CO -0.16 -0.29 0.00 -1.13 -1.51 0.00 0.00 179.97 176.87 1h2i n SER 174 N -5.36 0.00 0.09 -3.80 3.41 -0.89 -1.97 113.62 105.09 1h2i n SER 174 Ca -0.07 0.23 -0.19 0.00 -0.26 0.00 0.00 58.87 58.58 1h2i n SER 174 Cb 0.27 -0.37 -0.15 0.00 -0.26 0.00 0.00 64.21 63.71 1h2i n SER 174 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1h2i h LEU 175 N 0.00 0.50 -1.38 1.04 3.38 -0.03 -3.30 115.31 115.51 1h2i h LEU 175 Ca 0.00 -0.63 -0.05 0.00 0.09 0.00 0.00 57.88 57.28 1h2i h LEU 175 Cb 0.20 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1h2i h LEU 175 CO 0.00 1.52 -0.17 0.78 0.09 0.00 0.00 178.44 180.66 1h2i h ASN 176 N 0.09 0.19 0.00 -0.43 2.35 -0.71 -3.07 115.58 114.00 1h2i h ASN 176 Ca -0.24 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 1h2i h ASN 176 Cb 2.04 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 40.36 1h2i h ASN 176 CO 0.19 0.38 0.00 0.29 -1.65 0.00 0.00 177.43 176.64 1h2i n LYS 177 N -4.25 0.82 -4.53 0.81 5.02 -1.17 -4.80 118.16 110.05 1h2i n LYS 177 Ca -0.01 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.03 1h2i n LYS 177 Cb 0.29 -1.09 -0.10 0.00 -0.02 0.00 0.00 35.03 34.10 1h2i n LYS 177 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1h2i s LEU 178 N 0.00 2.41 0.00 -0.35 1.43 -1.16 -5.08 118.68 115.93 1h2i s LEU 178 Ca 0.00 -1.41 -0.13 0.00 -1.03 0.00 0.00 54.13 51.56 1h2i s LEU 178 Cb 0.00 -0.56 0.20 0.00 0.03 0.00 0.00 46.19 45.86 1h2i s LEU 178 CO 0.00 -0.59 0.65 -2.65 0.23 0.00 0.00 176.35 174.00 1h2i n PRO 179 N -0.83 -2.64 -2.72 1.29 -0.02 -1.26 -4.99 135.00 123.83 1h2i n PRO 179 Ca -0.04 -1.06 -0.42 0.00 -2.02 0.00 0.00 63.50 59.96 1h2i n PRO 179 Cb 0.67 -1.05 -0.04 0.00 -0.02 0.00 0.00 33.50 33.06 1h2i n PRO 179 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1h2i s ARG 180 N -4.50 4.60 -0.39 -0.52 3.52 -1.26 -5.02 118.95 115.38 1h2i s ARG 180 Ca 0.44 1.42 -0.15 0.00 -0.13 0.00 0.00 55.73 57.30 1h2i s ARG 180 Cb -0.05 -3.43 0.01 0.00 -1.56 0.00 0.00 34.95 29.92 1h2i s ARG 180 CO 0.34 0.05 0.35 -1.14 -0.81 0.00 0.00 175.30 174.08 1h2i s GLN 181 N 0.65 3.19 -0.25 5.12 2.00 -1.26 -5.06 119.66 124.05 1h2i s GLN 181 Ca 0.50 -0.78 -0.13 0.00 -2.00 0.00 0.00 55.36 52.96 1h2i s GLN 181 Cb -0.22 -3.92 -0.05 0.00 0.80 0.00 0.00 33.01 29.63 1h2i s GLN 181 CO 0.28 -0.70 0.26 -0.48 -0.50 0.00 0.00 175.29 174.15 1h2i s LEU 182 N 1.89 4.08 0.17 3.68 2.34 -1.26 -5.04 118.68 124.54 1h2i s LEU 182 Ca 0.09 0.19 -0.14 0.00 0.06 0.00 0.00 54.13 54.32 1h2i s LEU 182 Cb -0.18 -2.25 -0.09 0.00 -0.56 0.00 0.00 46.19 43.11 1h2i s LEU 182 CO 0.12 -0.04 0.18 -2.65 -1.06 0.00 0.00 176.35 172.89 1h2i n PRO 183 N 4.74 0.00 -2.93 1.48 -0.02 -1.26 -4.86 135.00 132.15 1h2i n PRO 183 Ca -0.12 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.00 1h2i n PRO 183 Cb 0.52 -0.57 -0.06 0.00 -0.02 0.00 0.00 33.50 33.36 1h2i n PRO 183 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1h2i s LEU 184 N 2.08 4.26 -0.18 2.45 1.98 -1.26 -5.03 118.68 122.97 1h2i s LEU 184 Ca 0.35 1.62 -0.22 0.00 -2.89 0.00 0.00 54.13 52.99 1h2i s LEU 184 Cb -0.45 -3.95 -0.02 0.00 0.66 0.00 0.00 46.19 42.42 1h2i s LEU 184 CO 0.34 -0.09 0.67 -1.61 -1.89 0.00 0.00 176.35 173.77 1h2i s GLU 185 N -2.28 4.24 -0.17 1.98 0.41 -1.26 -5.04 118.70 116.59 1h2i s GLU 185 Ca 0.50 0.70 -0.13 0.00 -0.41 0.00 0.00 54.97 55.63 1h2i s GLU 185 Cb -0.16 -3.57 -0.05 0.00 -1.78 0.00 0.00 34.13 28.58 1h2i s GLU 185 CO 0.21 -0.23 0.27 0.08 -0.49 0.00 0.00 175.26 175.09 1h2i s VAL 186 N 1.86 5.32 -0.66 2.63 1.01 -1.26 -5.05 120.40 124.25 1h2i s VAL 186 Ca 0.31 0.49 -0.22 0.00 0.00 0.00 0.00 61.98 62.56 1h2i s VAL 186 Cb -0.16 -3.61 0.08 0.00 0.00 0.00 0.00 36.38 32.69 1h2i s VAL 186 CO 0.11 0.39 0.91 -0.62 0.00 0.00 0.00 175.10 175.90 1h2i s ASP 187 N 0.49 6.20 0.00 3.32 3.68 -1.26 -4.91 116.67 124.20 1h2i s ASP 187 Ca 0.15 -1.15 0.00 0.00 2.13 0.00 0.00 52.55 53.68 1h2i s ASP 187 Cb -0.13 -2.39 0.00 0.00 -1.45 0.00 0.00 42.92 38.95 1h2i s ASP 187 CO 0.03 -1.35 0.51 0.18 0.13 0.00 0.00 175.17 174.67 1h2i n LEU 188 N 7.34 1.10 0.21 -1.34 4.77 -1.26 -4.16 117.00 123.65 1h2i n LEU 188 Ca -0.04 -0.55 -0.15 0.00 -0.03 0.00 0.00 56.01 55.24 1h2i n LEU 188 Cb 0.45 -0.47 -0.08 0.00 -2.33 0.00 0.00 43.42 40.99 1h2i n LEU 188 CO 0.62 0.25 0.62 0.74 -1.33 0.00 0.00 177.39 178.30 1h2i h THR 189 N 0.01 0.26 -0.20 -5.08 2.02 -2.05 -2.42 112.91 105.43 1h2i h THR 189 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1h2i h THR 189 Cb 0.51 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1h2i h THR 189 CO 0.00 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.18 1h2i n LYS 190 N -5.46 1.97 -1.58 6.66 5.02 -1.26 -4.97 118.16 118.54 1h2i n LYS 190 Ca -0.09 -0.94 -0.38 0.00 -2.02 0.00 0.00 58.31 54.88 1h2i n LYS 190 Cb 0.37 -1.53 0.04 0.00 -0.02 0.00 0.00 35.03 33.89 1h2i n LYS 190 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1h2i n ALA 191 N 0.19 -0.15 -2.62 7.82 0.00 -0.91 -4.91 120.51 119.93 1h2i n ALA 191 Ca 0.08 0.04 -0.42 0.00 0.00 0.00 0.00 53.44 53.14 1h2i n ALA 191 Cb 0.42 -2.03 -0.03 0.00 0.00 0.00 0.00 19.45 17.81 1h2i n ALA 191 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1h2i s LYS 192 N -2.46 4.41 0.00 0.00 2.20 -1.26 -4.92 119.74 117.71 1h2i s LYS 192 Ca 0.72 1.48 0.00 0.00 -0.36 0.00 0.00 55.97 57.81 1h2i s LYS 192 Cb -0.45 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.34 1h2i s LYS 192 CO 0.50 -0.34 0.14 0.54 -0.36 0.00 0.00 175.35 175.83 1h2i n ARG 193 N 4.97 4.54 -4.62 4.03 1.74 -1.26 -5.04 116.66 121.03 1h2i n ARG 193 Ca 0.09 -0.14 -0.28 0.00 -0.77 0.00 0.00 57.85 56.76 1h2i n ARG 193 Cb 0.48 -0.62 -0.11 0.00 -1.02 0.00 0.00 32.46 31.19 1h2i n ARG 193 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1h2i s GLN 194 N -0.69 1.95 -0.20 5.56 -0.21 -1.26 -5.06 119.66 119.75 1h2i s GLN 194 Ca 0.00 -2.11 -0.12 0.00 0.02 0.00 0.00 55.36 53.15 1h2i s GLN 194 Cb 0.00 -1.59 -0.20 0.00 1.00 0.00 0.00 33.01 32.22 1h2i s GLN 194 CO 0.00 -0.07 0.11 -0.25 -2.12 0.00 0.00 175.29 172.95 1h2i n ASP 195 N -0.97 1.98 -4.50 5.90 10.43 -1.26 -4.95 116.55 123.18 1h2i n ASP 195 Ca -0.05 0.26 -0.49 0.00 2.57 0.00 0.00 54.79 57.08 1h2i n ASP 195 Cb 0.67 -0.83 -0.04 0.00 1.84 0.00 0.00 41.12 42.76 1h2i n ASP 195 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 1h2i n LEU 196 N -3.93 0.30 -3.56 0.64 -0.00 -1.26 -4.96 117.00 104.23 1h2i n LEU 196 Ca -0.38 1.15 -0.29 0.00 -0.00 0.00 0.00 56.01 56.49 1h2i n LEU 196 Cb 0.88 -1.09 -0.12 0.00 -0.00 0.00 0.00 43.42 43.09 1h2i n LEU 196 CO 0.25 -2.06 -0.28 -1.61 -0.00 0.00 0.00 177.39 173.69 1h2i s GLU 197 N -0.83 0.98 0.34 1.96 0.41 -1.26 -5.04 118.70 115.26 1h2i s GLU 197 Ca 0.69 -1.81 0.07 0.00 -0.41 0.00 0.00 54.97 53.50 1h2i s GLU 197 Cb -0.90 -1.81 0.75 0.00 -1.78 0.00 0.00 34.13 30.39 1h2i s GLU 197 CO 0.56 -1.23 1.89 -1.35 -0.49 0.00 0.00 175.26 174.64 1h2i h PRO 198 N 6.59 0.74 0.00 0.39 0.11 -1.98 -0.28 132.00 137.57 1h2i h PRO 198 Ca 0.08 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.02 1h2i h PRO 198 Cb 0.93 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.86 1h2i h PRO 198 CO 0.38 0.49 -0.58 0.66 -0.21 0.00 0.00 178.00 178.74 1h2i h SER 199 N 0.77 0.00 0.07 -2.05 4.64 -1.99 -1.90 113.55 113.09 1h2i h SER 199 Ca 0.42 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1h2i h SER 199 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1h2i h SER 199 CO -0.18 0.58 -0.04 0.58 -0.87 0.00 0.00 176.83 176.91 1h2i h VAL 200 N 0.00 1.19 -0.66 0.95 2.07 -1.92 -0.35 116.25 117.54 1h2i h VAL 200 Ca -0.01 -1.04 0.18 0.00 0.82 0.00 0.00 66.70 66.65 1h2i h VAL 200 Cb 1.42 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 33.02 1h2i h VAL 200 CO 0.08 0.25 0.47 -0.08 0.02 0.00 0.00 177.57 178.31 1h2i h GLU 201 N -0.58 0.06 0.23 1.57 4.57 -1.02 0.11 114.58 119.53 1h2i h GLU 201 Ca -0.01 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1h2i h GLU 201 Cb 0.49 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 1h2i h GLU 201 CO 0.02 0.04 -0.11 1.49 -1.18 0.00 0.00 179.01 179.27 1h2i h GLU 202 N 0.07 -0.30 -1.00 1.92 4.81 -1.13 -2.08 114.58 116.87 1h2i h GLU 202 Ca 0.31 0.02 0.24 0.00 -0.13 0.00 0.00 59.36 59.81 1h2i h GLU 202 Cb 1.16 0.07 -0.12 0.00 0.63 0.00 0.00 28.75 30.48 1h2i h GLU 202 CO -0.02 -0.20 0.59 0.00 -0.73 0.00 0.00 179.01 178.65 1h2i h ALA 203 N -1.15 1.78 0.42 2.92 0.00 -0.58 0.11 119.26 122.76 1h2i h ALA 203 Ca -0.03 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1h2i h ALA 203 Cb 0.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1h2i h ALA 203 CO 0.05 -0.26 -0.20 -0.09 0.00 0.00 0.00 179.25 178.75 1h2i h ARG 204 N 0.59 -0.55 -0.52 0.00 2.43 -1.07 -1.72 114.38 113.55 1h2i h ARG 204 Ca 0.64 0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.98 1h2i h ARG 204 Cb 1.20 0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.86 1h2i h ARG 204 CO -0.47 -0.30 0.36 -0.92 -1.51 0.00 0.00 179.97 177.13 1h2i h TYR 205 N -0.69 0.10 -0.04 2.20 3.20 -0.13 0.53 116.97 122.14 1h2i h TYR 205 Ca -0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1h2i h TYR 205 Cb 0.50 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.74 1h2i h TYR 205 CO -0.02 0.04 0.00 0.09 -1.64 0.00 0.00 178.16 176.63 1h2i n ASN 206 N -4.41 1.15 0.02 -2.11 3.02 -0.19 -3.66 115.26 109.08 1h2i n ASN 206 Ca 0.09 -1.45 0.12 0.00 -0.03 0.00 0.00 54.58 53.32 1h2i n ASN 206 Cb 0.53 -0.02 0.27 0.00 -0.61 0.00 0.00 39.78 39.95 1h2i n ASN 206 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1h2i n SER 207 N -0.08 0.51 -1.93 6.41 3.41 0.19 -3.95 113.62 118.18 1h2i n SER 207 Ca 0.19 -0.02 -0.18 0.00 -0.26 0.00 0.00 58.87 58.60 1h2i n SER 207 Cb 0.28 0.11 0.04 0.00 -0.26 0.00 0.00 64.21 64.39 1h2i n SER 207 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88