#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2i s PHE 26 N -1.15 2.76 0.00 0.00 5.36 -1.26 -1.72 117.98 121.97 1h2i s PHE 26 Ca 0.04 0.73 0.00 0.00 -0.96 0.00 0.00 56.93 56.74 1h2i s PHE 26 Cb -0.00 -4.09 0.00 0.00 -0.34 0.00 0.00 43.02 38.59 1h2i s PHE 26 CO 0.03 -3.70 0.00 0.41 -1.46 0.00 0.00 175.22 170.50 1h2i n GLY 27 N 2.35 2.02 0.01 13.12 0.00 -0.53 -4.85 105.19 117.29 1h2i n GLY 27 Ca 0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.12 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 2.85 -2.09 1.61 6.02 -0.70 -3.98 117.38 119.09 1h2i n GLN 28 Ca 0.00 -1.58 -0.29 0.00 -0.01 0.00 0.00 57.00 55.12 1h2i n GLN 28 Cb 0.00 -1.04 0.04 0.00 1.02 0.00 0.00 30.24 30.26 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 -5.20 1.03 0.31 0.00 0.74 -1.26 -4.23 119.66 111.05 1h2i s GLN 30 Ca 0.56 -0.30 -0.29 0.00 0.05 0.00 0.00 55.36 55.38 1h2i s GLN 30 Cb -0.11 -0.95 -0.10 0.00 1.10 0.00 0.00 33.01 32.95 1h2i s GLN 30 CO 0.49 0.09 1.26 0.71 -0.55 0.00 0.00 175.29 177.30 1h2i s TYR 31 N 0.30 3.18 0.58 1.67 1.51 -1.26 -5.00 117.35 118.33 1h2i s TYR 31 Ca -0.05 1.46 -0.16 0.00 -1.01 0.00 0.00 57.07 57.31 1h2i s TYR 31 Cb -0.10 -3.59 -0.05 0.00 -0.11 0.00 0.00 41.96 38.12 1h2i s TYR 31 CO 0.01 -1.58 1.04 0.95 -1.11 0.00 0.00 175.55 174.85 1h2i s THR 32 N -1.03 4.03 0.30 -0.71 -4.23 -1.26 -4.81 115.64 107.92 1h2i s THR 32 Ca 0.49 0.94 0.04 0.00 -1.18 0.00 0.00 61.69 61.98 1h2i s THR 32 Cb -0.38 -3.48 0.29 0.00 1.34 0.00 0.00 72.50 70.27 1h2i s THR 32 CO 0.49 -0.58 1.82 0.00 -0.54 0.00 0.00 174.62 175.81 1h2i h ALA 33 N 0.50 1.61 -0.11 3.99 0.00 -1.99 -0.30 119.26 122.96 1h2i h ALA 33 Ca -0.47 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1h2i h ALA 33 Cb 1.21 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1h2i h ALA 33 CO 0.59 0.10 0.02 1.49 0.00 0.00 0.00 179.25 181.44 1h2i h GLU 34 N 0.89 0.18 -0.51 0.00 4.81 -1.99 -0.63 114.58 117.32 1h2i h GLU 34 Ca 0.52 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.60 1h2i h GLU 34 Cb 0.65 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 1h2i h GLU 34 CO -0.29 0.38 -0.08 1.49 -0.73 0.00 0.00 179.01 179.78 1h2i h GLU 35 N -0.05 0.95 -0.11 1.92 4.81 -1.85 -1.75 114.58 118.50 1h2i h GLU 35 Ca 0.03 -0.35 0.03 0.00 -0.13 0.00 0.00 59.36 58.95 1h2i h GLU 35 Cb 0.29 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1h2i h GLU 35 CO 0.00 1.01 -0.08 -0.92 -0.73 0.00 0.00 179.01 178.29 1h2i h TYR 36 N 0.82 -0.20 -0.44 0.92 3.20 -0.98 -0.54 116.97 119.75 1h2i h TYR 36 Ca 0.13 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.02 1h2i h TYR 36 Cb 0.63 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 1h2i h TYR 36 CO 0.05 -0.13 0.29 0.37 -1.64 0.00 0.00 178.16 177.10 1h2i h GLN 37 N -0.09 0.57 -0.27 1.82 4.15 -1.02 1.00 115.11 121.27 1h2i h GLN 37 Ca 0.07 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1h2i h GLN 37 Cb 0.19 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 1h2i h GLN 37 CO -0.16 0.38 0.18 0.00 -1.93 0.00 0.00 178.83 177.30 1h2i h ALA 38 N 1.16 0.35 -0.44 3.38 0.00 -1.03 -2.36 119.26 120.31 1h2i h ALA 38 Ca 0.16 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1h2i h ALA 38 Cb -0.07 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1h2i h ALA 38 CO -0.03 -0.18 0.03 0.82 0.00 0.00 0.00 179.25 179.89 1h2i h ILE 39 N 0.37 1.26 -0.60 0.00 2.04 -0.82 -0.34 117.51 119.41 1h2i h ILE 39 Ca 0.10 -0.98 0.11 0.00 1.00 0.00 0.00 64.86 65.09 1h2i h ILE 39 Cb -0.04 1.02 -0.09 0.00 -0.74 0.00 0.00 36.82 36.98 1h2i h ILE 39 CO -0.02 0.34 0.13 1.56 0.00 0.00 0.00 178.15 180.16 1h2i h GLN 40 N 0.61 0.25 -0.00 2.37 1.08 -0.62 0.59 115.11 119.39 1h2i h GLN 40 Ca 0.13 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.31 1h2i h GLN 40 Cb 0.45 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.82 1h2i h GLN 40 CO 0.02 0.17 -0.00 0.87 -0.95 0.00 0.00 178.83 178.94 1h2i h LYS 41 N 0.26 0.01 -0.98 1.46 1.57 -1.23 -3.17 116.57 114.48 1h2i h LYS 41 Ca 0.32 -0.00 0.09 0.00 -1.87 0.00 0.00 60.65 59.18 1h2i h LYS 41 Cb 0.47 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.71 1h2i h LYS 41 CO -0.40 0.33 0.62 0.00 -0.57 0.00 0.00 179.45 179.43 1h2i h ALA 42 N 0.68 1.41 0.00 3.86 0.00 -0.45 -1.96 119.26 122.79 1h2i h ALA 42 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1h2i h ALA 42 Cb 0.33 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1h2i h ALA 42 CO 0.00 0.34 -0.03 -0.07 0.00 0.00 0.00 179.25 179.49 1h2i h LEU 43 N 1.08 0.00 -1.34 0.00 3.38 -0.88 -2.51 115.31 115.04 1h2i h LEU 43 Ca 0.45 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.35 1h2i h LEU 43 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1h2i h LEU 43 CO -0.21 0.03 -0.31 0.03 0.09 0.00 0.00 178.44 178.07 1h2i h ARG 44 N 0.00 0.00 -6.89 1.13 3.08 -1.38 0.34 114.38 110.67 1h2i h ARG 44 Ca -0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 1h2i h ARG 44 Cb 0.08 0.00 0.11 0.00 0.08 0.00 0.00 29.97 30.25 1h2i h ARG 44 CO 0.00 0.31 0.66 1.04 -1.07 0.00 0.00 179.97 180.92 1h2i n GLN 45 N -3.89 2.38 -2.75 0.04 6.02 -0.95 -4.61 117.38 113.63 1h2i n GLN 45 Ca -0.02 0.84 -0.27 0.00 -0.01 0.00 0.00 57.00 57.54 1h2i n GLN 45 Cb 0.39 -2.55 -0.01 0.00 1.02 0.00 0.00 30.24 29.10 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 -2.12 3.56 0.01 -1.09 0.52 -1.26 -1.42 118.95 117.14 1h2i s ARG 46 Ca 0.56 0.16 -0.02 0.00 -0.52 0.00 0.00 55.73 55.91 1h2i s ARG 46 Cb -0.50 -2.41 -0.04 0.00 0.52 0.00 0.00 34.95 32.52 1h2i s ARG 46 CO 0.62 -0.14 0.18 -0.48 0.02 0.00 0.00 175.30 175.49 1h2i s LEU 47 N -4.59 4.31 1.24 2.53 2.34 -1.26 -4.92 118.68 118.33 1h2i s LEU 47 Ca 0.47 0.30 -0.19 0.00 0.06 0.00 0.00 54.13 54.78 1h2i s LEU 47 Cb -0.10 -2.66 0.30 0.00 -0.56 0.00 0.00 46.19 43.17 1h2i s LEU 47 CO 0.42 0.24 1.05 -0.83 -1.06 0.00 0.00 176.35 176.18 1h2i s GLY 48 N -2.06 1.53 0.56 -3.48 0.00 -1.26 -4.90 107.32 97.72 1h2i s GLY 48 Ca 0.29 -0.77 0.28 0.00 0.00 0.00 0.00 44.72 44.52 1h2i s GLY 48 CO 0.20 0.11 2.18 -2.55 0.00 0.00 0.00 173.10 173.04 1h2i h PRO 49 N -2.74 0.00 0.00 2.90 0.11 -1.96 -2.42 132.00 127.89 1h2i h PRO 49 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1h2i h PRO 49 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1h2i h PRO 49 CO 0.37 0.05 0.00 -0.85 -0.21 0.00 0.00 178.00 177.36 1h2i n GLU 50 N -3.84 0.08 -0.10 1.05 0.00 -1.26 -2.53 120.64 114.03 1h2i n GLU 50 Ca -0.03 0.25 -0.12 0.00 0.00 0.00 0.00 57.16 57.27 1h2i n GLU 50 Cb 0.14 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 29.94 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 -1.38 0.00 -2.82 -1.84 4.02 -0.91 -4.99 117.16 109.23 1h2i n TYR 51 Ca 0.04 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.52 1h2i n TYR 51 Cb 0.10 -0.96 -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 4.52 0.31 -0.72 -1.09 -1.05 -4.41 121.20 116.28 1h2i s ILE 52 Ca -0.17 1.92 0.03 0.00 -2.23 0.00 0.00 60.65 60.19 1h2i s ILE 52 Cb 0.07 -4.25 -0.05 0.00 -1.58 0.00 0.00 42.46 36.65 1h2i s ILE 52 CO 0.73 0.36 0.09 -0.94 -1.23 0.00 0.00 174.94 173.95 1h2i s SER 53 N -0.19 1.91 0.12 3.58 1.04 -0.03 -4.98 113.70 115.16 1h2i s SER 53 Ca 0.43 -1.44 -0.09 0.00 0.48 0.00 0.00 55.95 55.33 1h2i s SER 53 Cb -0.23 0.14 -0.00 0.00 0.10 0.00 0.00 66.02 66.03 1h2i s SER 53 CO 0.28 -0.73 0.24 -0.94 0.98 0.00 0.00 173.24 173.07 1h2i s SER 54 N -3.43 0.06 0.20 7.02 1.04 -1.26 -1.11 113.70 116.22 1h2i s SER 54 Ca 0.35 -0.73 -0.04 0.00 0.48 0.00 0.00 55.95 56.01 1h2i s SER 54 Cb 0.07 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 1h2i s SER 54 CO 0.15 -0.81 0.21 0.00 0.98 0.00 0.00 173.24 173.77 1h2i s ARG 55 N -3.90 1.24 -0.25 4.02 1.70 -0.64 -4.95 118.95 116.16 1h2i s ARG 55 Ca 0.10 -1.47 -0.17 0.00 -0.47 0.00 0.00 55.73 53.71 1h2i s ARG 55 Cb 0.04 0.32 -0.03 0.00 -0.57 0.00 0.00 34.95 34.71 1h2i s ARG 55 CO -0.06 -0.43 0.48 -1.64 -1.08 0.00 0.00 175.30 172.57 1h2i s MET 56 N -4.09 4.07 0.71 3.89 -1.94 -1.26 -1.35 119.30 119.32 1h2i s MET 56 Ca 0.31 0.27 -0.11 0.00 -1.71 0.00 0.00 55.69 54.45 1h2i s MET 56 Cb 0.05 -3.64 0.01 0.00 2.01 0.00 0.00 34.83 33.27 1h2i s MET 56 CO 0.09 -0.30 1.07 0.00 -0.01 0.00 0.00 175.02 175.86 1h2i s ALA 57 N 2.15 2.70 0.36 3.03 0.00 0.78 -4.89 121.76 125.89 1h2i s ALA 57 Ca 0.20 -0.10 0.08 0.00 0.00 0.00 0.00 51.96 52.14 1h2i s ALA 57 Cb -0.16 -3.11 0.79 0.00 0.00 0.00 0.00 23.12 20.65 1h2i s ALA 57 CO 0.09 -1.22 1.90 0.78 0.00 0.00 0.00 175.76 177.30 1h2i h GLY 58 N -0.72 1.12 -0.88 0.00 0.00 -1.98 0.01 103.07 100.62 1h2i h GLY 58 Ca -0.45 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 46.58 1h2i h GLY 58 CO 0.60 0.14 0.00 0.61 0.00 0.00 0.00 176.54 177.88 1h2i n GLY 59 N -1.44 0.73 3.30 4.60 0.00 -1.26 -4.74 105.19 106.39 1h2i n GLY 59 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 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 0.19 -0.53 3.09 -0.02 0.00 -0.01 -4.99 105.19 102.91 1h2i n GLY 60 Ca 0.00 0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 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 1.30 0.34 1.61 -2.07 -1.21 -4.89 119.66 108.74 1h2i s GLN 61 Ca 0.44 -0.49 -0.29 0.00 -1.82 0.00 0.00 55.36 53.20 1h2i s GLN 61 Cb -0.20 -1.20 -0.11 0.00 -1.09 0.00 0.00 33.01 30.41 1h2i s GLN 61 CO 0.54 0.24 1.51 1.17 -1.32 0.00 0.00 175.29 177.43 1h2i n LYS 62 N 3.00 2.62 -3.81 9.60 4.81 -1.26 -0.16 118.16 132.95 1h2i n LYS 62 Ca -0.16 0.92 -0.25 0.00 -0.87 0.00 0.00 58.31 57.95 1h2i n LYS 62 Cb 0.54 -2.66 -0.17 0.00 0.02 0.00 0.00 35.03 32.76 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 -0.63 0.61 0.23 3.15 1.01 -0.46 -4.86 120.40 119.47 1h2i s VAL 63 Ca 0.58 -0.08 -0.11 0.00 0.00 0.00 0.00 61.98 62.37 1h2i s VAL 63 Cb -0.50 -0.76 -0.07 0.00 0.00 0.00 0.00 36.38 35.05 1h2i s VAL 63 CO 0.57 0.25 0.58 0.00 0.00 0.00 0.00 175.10 176.51 1h2i s TYR 65 N -1.79 -0.18 -0.07 0.00 -0.85 -0.26 -4.99 117.35 109.21 1h2i s TYR 65 Ca 0.47 -0.10 0.02 0.00 -0.52 0.00 0.00 57.07 56.94 1h2i s TYR 65 Cb -0.12 0.62 -0.03 0.00 0.38 0.00 0.00 41.96 42.82 1h2i s TYR 65 CO 0.20 -0.80 -0.12 0.42 -1.52 0.00 0.00 175.55 173.73 1h2i s ILE 66 N -3.30 3.23 0.29 -3.49 1.01 -1.26 -0.85 121.20 116.83 1h2i s ILE 66 Ca 0.11 -0.65 -0.29 0.00 0.00 0.00 0.00 60.65 59.82 1h2i s ILE 66 Cb -0.02 -2.29 -0.09 0.00 0.01 0.00 0.00 42.46 40.07 1h2i s ILE 66 CO 0.00 0.58 1.07 -1.61 0.00 0.00 0.00 174.94 174.98 1h2i s GLU 67 N -0.57 4.59 0.28 2.79 2.02 -1.26 -4.91 118.70 121.64 1h2i s GLU 67 Ca 0.08 1.72 -0.03 0.00 0.02 0.00 0.00 54.97 56.76 1h2i s GLU 67 Cb -0.12 -3.10 0.58 0.00 0.10 0.00 0.00 34.13 31.60 1h2i s GLU 67 CO 0.01 0.20 1.60 0.78 0.02 0.00 0.00 175.26 177.88 1h2i h GLY 68 N 3.64 1.02 2.00 -1.39 0.00 -1.99 0.11 103.07 106.47 1h2i h GLY 68 Ca -0.47 0.14 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 1h2i h GLY 68 CO 0.66 -0.39 -0.12 1.12 0.00 0.00 0.00 176.54 177.82 1h2i h HIS 69 N 0.07 0.00 -0.09 5.60 2.07 -2.00 -0.04 115.15 120.76 1h2i h HIS 69 Ca 0.50 0.00 -0.23 0.00 -2.85 0.00 0.00 60.37 57.79 1h2i h HIS 69 Cb 0.94 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.93 1h2i h HIS 69 CO -0.47 0.12 -0.84 0.00 -3.07 0.00 0.00 177.93 173.66 1h2i h ARG 70 N 0.00 0.66 -0.53 5.12 2.47 -1.16 -2.57 114.38 118.37 1h2i h ARG 70 Ca -0.00 -0.59 -0.06 0.00 -1.26 0.00 0.00 59.98 58.07 1h2i h ARG 70 Cb 0.24 0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.68 1h2i h ARG 70 CO 0.02 1.20 0.08 0.28 0.56 0.00 0.00 179.97 182.11 1h2i h VAL 71 N 0.43 1.25 -0.32 2.04 2.07 -0.91 0.63 116.25 121.43 1h2i h VAL 71 Ca -0.07 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1h2i h VAL 71 Cb 1.47 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 1h2i h VAL 71 CO 0.16 0.35 0.21 0.40 0.02 0.00 0.00 177.57 178.71 1h2i h ILE 72 N 0.77 1.08 -0.56 4.57 2.04 -1.00 -0.83 117.51 123.57 1h2i h ILE 72 Ca 0.16 -0.15 -0.09 0.00 1.00 0.00 0.00 64.86 65.78 1h2i h ILE 72 Cb 0.41 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1h2i h ILE 72 CO 0.01 0.08 -0.01 0.78 0.00 0.00 0.00 178.15 179.01 1h2i h ASN 73 N 0.43 0.96 -0.60 1.72 2.35 -1.20 0.45 115.58 119.68 1h2i h ASN 73 Ca 0.12 -0.27 0.03 0.00 -0.55 0.00 0.00 56.30 55.63 1h2i h ASN 73 Cb -0.05 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.03 1h2i h ASN 73 CO -0.03 1.02 0.36 -0.07 -1.65 0.00 0.00 177.43 177.06 1h2i h LEU 74 N 0.90 0.59 -0.20 1.61 3.38 -0.52 -0.70 115.31 120.36 1h2i h LEU 74 Ca 0.16 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1h2i h LEU 74 Cb 0.54 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1h2i h LEU 74 CO 0.03 0.41 0.06 0.00 0.09 0.00 0.00 178.44 179.03 1h2i h ALA 75 N 1.27 0.26 -0.90 1.53 0.00 -0.51 0.91 119.26 121.82 1h2i h ALA 75 Ca 0.25 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1h2i h ALA 75 Cb 0.04 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1h2i h ALA 75 CO -0.11 -0.12 0.59 -0.91 0.00 0.00 0.00 179.25 178.70 1h2i h ASN 76 N 0.15 1.04 0.48 0.00 2.35 -0.63 0.41 115.58 119.38 1h2i h ASN 76 Ca 0.06 -0.03 -0.20 0.00 -0.55 0.00 0.00 56.30 55.58 1h2i h ASN 76 Cb 0.23 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1h2i h ASN 76 CO -0.00 0.76 -0.86 -0.33 -1.65 0.00 0.00 177.43 175.35 1h2i h GLU 77 N 1.23 0.27 -0.18 0.81 4.39 -0.88 0.35 114.58 120.57 1h2i h GLU 77 Ca 0.33 -0.27 -0.18 0.00 0.34 0.00 0.00 59.36 59.58 1h2i h GLU 77 Cb -0.13 0.07 0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1h2i h GLU 77 CO -0.07 0.97 -0.57 1.98 -1.16 0.00 0.00 179.01 180.16 1h2i h MET 78 N 0.16 0.71 0.00 2.33 4.05 -0.30 -3.37 114.93 118.50 1h2i h MET 78 Ca -0.05 -0.52 0.00 0.00 -0.28 0.00 0.00 59.70 58.85 1h2i h MET 78 Cb 1.47 0.09 0.00 0.00 -0.80 0.00 0.00 31.60 32.36 1h2i h MET 78 CO 0.14 1.14 -0.54 1.19 0.23 0.00 0.00 176.91 179.07 1h2i n PHE 79 N -4.10 0.00 0.00 1.39 3.72 0.09 -4.98 117.46 113.58 1h2i n PHE 79 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1h2i n PHE 79 Cb 0.64 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.15 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 1.31 1.68 0.32 1.37 0.00 0.12 -3.38 105.19 106.61 1h2i n GLY 80 Ca 0.01 -1.64 0.17 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.33 1.61 -0.00 -1.90 0.93 116.97 117.28 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 -3.64 4.24 -0.16 0.10 2.04 -1.26 -4.54 115.26 112.04 1h2i n ASN 82 Ca -0.01 -2.96 0.08 0.00 -0.44 0.00 0.00 54.58 51.26 1h2i n ASN 82 Cb 0.20 -0.56 -0.06 0.00 -2.53 0.00 0.00 39.78 36.83 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 -0.22 -0.39 3.19 4.83 0.00 0.32 -4.72 105.19 108.20 1h2i n GLY 83 Ca 0.22 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.42 0.46 0.18 1.61 1.48 -1.25 -1.49 118.94 117.51 1h2i s TRP 84 Ca 0.10 -0.90 -0.18 0.00 -1.06 0.00 0.00 56.10 54.06 1h2i s TRP 84 Cb 0.14 -0.24 0.04 0.00 -1.16 0.00 0.00 33.47 32.24 1h2i s TRP 84 CO 0.61 -0.53 0.53 0.00 -4.06 0.00 0.00 176.95 173.51 1h2i s ALA 85 N -3.94 -1.06 -0.08 2.67 0.00 0.62 -4.96 121.76 115.01 1h2i s ALA 85 Ca 0.12 -0.08 -0.20 0.00 0.00 0.00 0.00 51.96 51.80 1h2i s ALA 85 Cb 0.06 0.84 0.04 0.00 0.00 0.00 0.00 23.12 24.06 1h2i s ALA 85 CO -0.06 -0.79 0.47 -3.38 0.00 0.00 0.00 175.76 172.01 1h2i s HIS 86 N -3.85 -0.43 0.15 0.00 -3.43 -1.26 0.56 115.29 107.03 1h2i s HIS 86 Ca 0.07 0.86 0.02 0.00 -0.80 0.00 0.00 55.06 55.21 1h2i s HIS 86 Cb -0.01 0.21 -0.04 0.00 -1.43 0.00 0.00 32.58 31.31 1h2i s HIS 86 CO -0.05 -0.40 -0.01 -1.54 -2.00 0.00 0.00 174.74 170.73 1h2i s SER 87 N -0.74 1.13 -0.44 7.38 1.04 -0.11 -4.98 113.70 116.98 1h2i s SER 87 Ca -0.08 -1.13 -0.15 0.00 0.48 0.00 0.00 55.95 55.07 1h2i s SER 87 Cb -0.03 0.12 0.04 0.00 0.10 0.00 0.00 66.02 66.26 1h2i s SER 87 CO 0.05 -0.55 0.34 -0.63 0.98 0.00 0.00 173.24 173.43 1h2i s ILE 88 N -3.68 5.25 0.28 -1.02 1.01 -1.26 -0.94 121.20 120.84 1h2i s ILE 88 Ca 0.21 -0.83 0.07 0.00 0.00 0.00 0.00 60.65 60.10 1h2i s ILE 88 Cb 0.06 -4.02 0.01 0.00 0.01 0.00 0.00 42.46 38.52 1h2i s ILE 88 CO 0.01 -0.43 1.66 0.71 0.00 0.00 0.00 174.94 176.90 1h2i h THR 89 N 5.69 1.35 -1.42 2.92 1.35 -0.82 -3.46 112.91 118.50 1h2i h THR 89 Ca -0.28 -1.71 0.12 0.00 -0.55 0.00 0.00 66.41 64.00 1h2i h THR 89 Cb 1.12 1.84 -0.26 0.00 -1.73 0.00 0.00 68.15 69.12 1h2i h THR 89 CO 0.80 0.50 0.64 -1.58 -0.25 0.00 0.00 175.52 175.62 1h2i s GLN 90 N -3.97 0.42 -0.06 4.72 0.74 -1.20 -5.00 119.66 115.31 1h2i s GLN 90 Ca -0.04 0.22 0.01 0.00 0.05 0.00 0.00 55.36 55.60 1h2i s GLN 90 Cb 0.13 0.20 0.02 0.00 1.10 0.00 0.00 33.01 34.46 1h2i s GLN 90 CO 0.77 -0.11 -0.08 -1.14 -0.55 0.00 0.00 175.29 174.19 1h2i s GLN 91 N -0.65 1.28 -0.08 1.67 0.74 -1.26 0.04 119.66 121.40 1h2i s GLN 91 Ca 0.02 -0.24 0.02 0.00 0.05 0.00 0.00 55.36 55.21 1h2i s GLN 91 Cb -0.02 -1.19 0.01 0.00 1.10 0.00 0.00 33.01 32.91 1h2i s GLN 91 CO -0.04 -0.08 -0.13 1.21 -0.55 0.00 0.00 175.29 175.71 1h2i s ASN 92 N 0.99 1.97 -0.33 6.67 3.84 0.08 -5.00 114.94 123.15 1h2i s ASN 92 Ca -0.09 -0.33 -0.27 0.00 0.21 0.00 0.00 52.86 52.38 1h2i s ASN 92 Cb -0.15 -0.89 0.01 0.00 -0.55 0.00 0.00 41.25 39.68 1h2i s ASN 92 CO 0.00 0.02 0.97 -0.69 -2.79 0.00 0.00 177.10 174.61 1h2i s VAL 93 N 0.83 4.59 0.16 -5.21 1.01 -1.26 -1.17 120.40 119.35 1h2i s VAL 93 Ca -0.11 1.47 -0.06 0.00 0.00 0.00 0.00 61.98 63.27 1h2i s VAL 93 Cb -0.15 -4.34 -0.09 0.00 0.00 0.00 0.00 36.38 31.80 1h2i s VAL 93 CO 0.02 -0.45 1.43 0.44 0.00 0.00 0.00 175.10 176.54 1h2i h ASP 94 N 8.21 0.73 -3.72 3.32 3.45 -0.95 -3.48 116.42 123.97 1h2i h ASP 94 Ca -0.22 -0.43 0.18 0.00 0.43 0.00 0.00 57.03 57.00 1h2i h ASP 94 Cb 1.07 -0.21 -0.24 0.00 -0.56 0.00 0.00 39.33 39.39 1h2i h ASP 94 CO 0.99 1.18 0.77 0.72 -1.57 0.00 0.00 179.24 181.33 1h2i s PHE 95 N -3.89 -0.18 -0.31 4.55 -0.12 -1.19 -4.99 117.98 111.84 1h2i s PHE 95 Ca -0.08 0.27 -0.01 0.00 -0.05 0.00 0.00 56.93 57.06 1h2i s PHE 95 Cb 0.10 0.48 0.10 0.00 -0.63 0.00 0.00 43.02 43.08 1h2i s PHE 95 CO 0.86 -0.19 0.10 0.08 -0.05 0.00 0.00 175.22 176.03 1h2i s VAL 96 N -1.36 0.85 -0.10 -2.49 1.01 -1.26 -2.59 120.40 114.46 1h2i s VAL 96 Ca 0.05 -1.40 -0.02 0.00 0.00 0.00 0.00 61.98 60.61 1h2i s VAL 96 Cb -0.01 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1h2i s VAL 96 CO -0.04 -0.68 -0.01 -1.81 0.00 0.00 0.00 175.10 172.56 1h2i s ASP 97 N 1.61 5.14 -0.35 3.32 1.01 0.08 -4.94 116.67 122.53 1h2i s ASP 97 Ca 0.10 0.09 -0.04 0.00 0.71 0.00 0.00 52.55 53.40 1h2i s ASP 97 Cb -0.17 -1.52 0.07 0.00 1.01 0.00 0.00 42.92 42.31 1h2i s ASP 97 CO -0.25 0.33 0.12 -0.22 0.21 0.00 0.00 175.17 175.36 1h2i s LEU 98 N -0.62 4.53 0.00 1.23 2.96 -1.26 0.61 118.68 126.12 1h2i s LEU 98 Ca 0.10 -1.46 0.12 0.00 -0.22 0.00 0.00 54.13 52.67 1h2i s LEU 98 Cb -0.12 -1.82 0.22 0.00 0.50 0.00 0.00 46.19 44.97 1h2i s LEU 98 CO 0.02 -0.39 1.10 0.59 -1.32 0.00 0.00 176.35 176.35 1h2i n ASN 99 N 4.71 2.55 0.00 3.68 5.03 -0.83 -4.96 115.26 125.44 1h2i n ASN 99 Ca -0.10 -1.78 0.00 0.00 0.87 0.00 0.00 54.58 53.58 1h2i n ASN 99 Cb 0.43 -0.14 0.00 0.00 -1.02 0.00 0.00 39.78 39.05 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 0.62 0.00 0.00 6.41 3.02 -1.26 -4.91 115.26 119.14 1h2i n ASN 100 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 1h2i n ASN 100 Cb 0.38 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 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 2.05 3.54 7.41 0.00 -1.26 -5.03 105.19 111.90 1h2i n GLY 101 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.84 2.05 -0.08 1.61 1.02 -1.26 -4.47 119.74 117.78 1h2i s LYS 102 Ca 0.00 -1.04 -0.05 0.00 0.02 0.00 0.00 55.97 54.90 1h2i s LYS 102 Cb 0.00 -2.25 -0.04 0.00 -0.52 0.00 0.00 37.83 35.02 1h2i s LYS 102 CO 0.00 0.51 0.15 -0.06 -0.92 0.00 0.00 175.35 175.03 1h2i s PHE 103 N -1.14 3.56 -0.22 3.18 0.40 0.11 -1.97 117.98 121.90 1h2i s PHE 103 Ca 0.19 0.45 0.02 0.00 -0.60 0.00 0.00 56.93 56.99 1h2i s PHE 103 Cb -0.11 -1.89 0.05 0.00 0.51 0.00 0.00 43.02 41.58 1h2i s PHE 103 CO 0.11 0.70 -0.12 0.71 0.70 0.00 0.00 175.22 177.32 1h2i s TYR 104 N -1.14 2.83 -0.07 0.36 1.51 0.20 -1.22 117.35 119.82 1h2i s TYR 104 Ca 0.20 -1.92 0.03 0.00 -1.01 0.00 0.00 57.07 54.36 1h2i s TYR 104 Cb -0.12 -1.80 0.01 0.00 -0.11 0.00 0.00 41.96 39.93 1h2i s TYR 104 CO 0.10 -0.81 -0.16 0.08 -1.11 0.00 0.00 175.55 173.64 1h2i s VAL 105 N 1.26 1.41 -0.14 0.71 1.01 0.58 -0.74 120.40 124.48 1h2i s VAL 105 Ca -0.04 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1h2i s VAL 105 Cb -0.17 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 34.97 1h2i s VAL 105 CO -0.08 0.41 -0.16 -0.83 0.00 0.00 0.00 175.10 174.45 1h2i s GLY 106 N 0.56 1.16 0.01 4.51 0.00 -1.07 -1.78 107.32 110.70 1h2i s GLY 106 Ca -0.16 -0.91 0.04 0.00 0.00 0.00 0.00 44.72 43.69 1h2i s GLY 106 CO 0.05 0.33 -0.13 0.14 0.00 0.00 0.00 173.10 173.49 1h2i s VAL 107 N 1.22 1.06 0.17 1.40 1.01 -0.03 -0.20 120.40 125.03 1h2i s VAL 107 Ca -0.00 -0.72 0.11 0.00 0.00 0.00 0.00 61.98 61.37 1h2i s VAL 107 Cb -0.14 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1h2i s VAL 107 CO -0.07 0.19 -0.24 0.00 0.00 0.00 0.00 175.10 174.98 1h2i s ALA 109 N -1.47 0.01 -0.26 0.00 0.00 -0.41 -0.74 121.76 118.89 1h2i s ALA 109 Ca 0.19 -0.08 -0.05 0.00 0.00 0.00 0.00 51.96 52.01 1h2i s ALA 109 Cb -0.09 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.05 1h2i s ALA 109 CO 0.09 -0.03 0.02 -0.06 0.00 0.00 0.00 175.76 175.79 1h2i s PHE 110 N -0.23 3.07 -0.13 0.00 0.40 0.11 -0.05 117.98 121.14 1h2i s PHE 110 Ca -0.03 -0.98 0.00 0.00 -0.60 0.00 0.00 56.93 55.33 1h2i s PHE 110 Cb -0.02 -2.18 -0.01 0.00 0.51 0.00 0.00 43.02 41.32 1h2i s PHE 110 CO -0.00 -0.56 -0.14 0.08 0.70 0.00 0.00 175.22 175.29 1h2i s VAL 111 N 1.48 2.90 -0.24 -0.44 1.01 -0.58 -0.04 120.40 124.49 1h2i s VAL 111 Ca 0.04 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 1h2i s VAL 111 Cb -0.16 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 1h2i s VAL 111 CO -0.00 0.52 0.02 -0.60 0.00 0.00 0.00 175.10 175.04 1h2i s ARG 112 N 0.47 3.46 0.01 2.72 3.52 -0.12 -1.88 118.95 127.13 1h2i s ARG 112 Ca -0.10 -0.59 0.00 0.00 -0.13 0.00 0.00 55.73 54.91 1h2i s ARG 112 Cb -0.16 -3.18 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 1h2i s ARG 112 CO 0.05 -0.22 0.08 0.54 -0.81 0.00 0.00 175.30 174.93 1h2i s VAL 113 N 1.54 4.69 0.03 7.11 0.11 -0.37 -0.93 120.40 132.58 1h2i s VAL 113 Ca 0.06 -0.45 0.00 0.00 -2.93 0.00 0.00 61.98 58.66 1h2i s VAL 113 Cb -0.15 -3.16 -0.02 0.00 -1.53 0.00 0.00 36.38 31.52 1h2i s VAL 113 CO 0.00 0.32 -0.04 -1.58 -3.33 0.00 0.00 175.10 170.48 1h2i s GLN 114 N -1.81 0.36 0.35 1.54 0.74 0.19 -2.08 119.66 118.95 1h2i s GLN 114 Ca 0.24 -0.66 0.04 0.00 0.05 0.00 0.00 55.36 55.03 1h2i s GLN 114 Cb -0.12 0.05 -0.01 0.00 1.10 0.00 0.00 33.01 34.02 1h2i s GLN 114 CO 0.15 -0.04 0.51 -0.51 -0.55 0.00 0.00 175.29 174.85 1h2i s LEU 115 N -1.54 3.94 0.12 3.68 1.02 -0.19 -0.28 118.68 125.44 1h2i s LEU 115 Ca -0.14 0.01 0.10 0.00 0.02 0.00 0.00 54.13 54.12 1h2i s LEU 115 Cb -0.09 -2.91 0.50 0.00 0.02 0.00 0.00 46.19 43.71 1h2i s LEU 115 CO -0.01 -0.44 1.30 2.29 0.02 0.00 0.00 176.35 179.51 1h2i n LYS 116 N -1.73 0.06 -0.03 1.70 2.85 -0.56 -0.67 118.16 119.78 1h2i n LYS 116 Ca -0.01 0.52 -0.12 0.00 -1.05 0.00 0.00 58.31 57.65 1h2i n LYS 116 Cb 0.58 -1.67 0.02 0.00 -0.65 0.00 0.00 35.03 33.30 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 0.77 0.00 -5.58 -0.00 -1.84 -0.61 116.42 109.17 1h2i h ASP 117 Ca 0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 57.03 56.62 1h2i h ASP 117 Cb 0.04 -0.22 0.00 0.00 -0.00 0.00 0.00 39.33 39.15 1h2i h ASP 117 CO 0.00 1.16 0.00 0.61 -0.00 0.00 0.00 179.24 181.01 1h2i n GLY 118 N 0.30 1.60 3.77 -0.78 0.00 0.15 -4.60 105.19 105.62 1h2i n GLY 118 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.77 5.15 0.25 1.61 1.04 -1.26 -4.77 113.70 113.96 1h2i s SER 119 Ca 0.00 2.06 -0.21 0.00 0.48 0.00 0.00 55.95 58.29 1h2i s SER 119 Cb 0.00 -2.56 0.03 0.00 0.10 0.00 0.00 66.02 63.59 1h2i s SER 119 CO 0.00 -1.60 0.67 -0.72 0.98 0.00 0.00 173.24 172.57 1h2i s TYR 120 N -2.20 -0.22 -0.17 5.02 -0.85 -1.26 -1.02 117.35 116.65 1h2i s TYR 120 Ca 0.69 -0.17 -0.15 0.00 -0.52 0.00 0.00 57.07 56.91 1h2i s TYR 120 Cb -0.22 0.63 0.05 0.00 0.38 0.00 0.00 41.96 42.80 1h2i s TYR 120 CO 0.39 -1.13 0.45 -1.01 -1.52 0.00 0.00 175.55 172.73 1h2i s HIS 121 N -3.89 -0.52 0.01 -3.49 3.76 -0.88 -5.01 115.29 105.27 1h2i s HIS 121 Ca 0.10 1.24 0.05 0.00 -0.15 0.00 0.00 55.06 56.29 1h2i s HIS 121 Cb -0.04 0.19 -0.02 0.00 1.11 0.00 0.00 32.58 33.82 1h2i s HIS 121 CO 0.03 -0.26 -0.15 -2.00 -0.85 0.00 0.00 174.74 171.50 1h2i s GLU 122 N 0.40 1.14 0.31 1.40 2.12 -1.26 -1.23 118.70 121.58 1h2i s GLU 122 Ca -0.01 -0.67 -0.02 0.00 0.36 0.00 0.00 54.97 54.63 1h2i s GLU 122 Cb -0.04 -1.14 -0.01 0.00 0.26 0.00 0.00 34.13 33.20 1h2i s GLU 122 CO -0.01 0.30 0.40 0.34 -0.54 0.00 0.00 175.26 175.74 1h2i s ASP 123 N -0.73 0.81 0.02 -1.70 -1.08 -0.79 -4.90 116.67 108.30 1h2i s ASP 123 Ca 0.05 -1.45 -0.00 0.00 -0.52 0.00 0.00 52.55 50.63 1h2i s ASP 123 Cb -0.07 0.60 -0.04 0.00 -1.46 0.00 0.00 42.92 41.95 1h2i s ASP 123 CO 0.00 -1.18 0.12 -0.69 0.52 0.00 0.00 175.17 173.94 1h2i s VAL 124 N -3.39 4.91 0.20 1.11 1.01 -1.26 -1.53 120.40 121.44 1h2i s VAL 124 Ca 0.32 -0.44 0.09 0.00 0.00 0.00 0.00 61.98 61.96 1h2i s VAL 124 Cb 0.01 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1h2i s VAL 124 CO 0.19 0.27 -0.18 -0.83 0.00 0.00 0.00 175.10 174.54 1h2i s GLY 125 N -2.02 1.54 0.03 4.51 0.00 0.93 -4.50 107.32 107.80 1h2i s GLY 125 Ca 0.27 -1.63 0.05 0.00 0.00 0.00 0.00 44.72 43.41 1h2i s GLY 125 CO 0.18 -1.69 -0.15 -0.47 0.00 0.00 0.00 173.10 170.97 1h2i s TYR 126 N -2.31 1.36 -0.08 1.90 5.04 -1.26 -1.28 117.35 120.71 1h2i s TYR 126 Ca 0.21 -0.34 0.03 0.00 -2.44 0.00 0.00 57.07 54.53 1h2i s TYR 126 Cb -0.05 -0.82 0.01 0.00 0.35 0.00 0.00 41.96 41.45 1h2i s TYR 126 CO 0.09 0.04 -0.18 0.20 -1.34 0.00 0.00 175.55 174.35 1h2i s GLY 127 N -0.99 1.07 0.01 8.97 0.00 0.30 -3.88 107.32 112.80 1h2i s GLY 127 Ca 0.04 -0.71 0.07 0.00 0.00 0.00 0.00 44.72 44.12 1h2i s GLY 127 CO 0.01 -0.13 -0.22 0.14 0.00 0.00 0.00 173.10 172.91 1h2i s VAL 128 N 0.48 1.72 -0.15 1.40 1.01 -1.26 -0.85 120.40 122.75 1h2i s VAL 128 Ca -0.16 -1.04 -0.04 0.00 0.00 0.00 0.00 61.98 60.73 1h2i s VAL 128 Cb -0.17 -1.45 0.07 0.00 0.00 0.00 0.00 36.38 34.83 1h2i s VAL 128 CO 0.06 0.38 0.15 -0.55 0.00 0.00 0.00 175.10 175.15 1h2i s SER 129 N -0.78 1.51 -0.09 3.32 0.15 -0.74 -4.55 113.70 112.52 1h2i s SER 129 Ca 0.08 -0.18 0.01 0.00 0.70 0.00 0.00 55.95 56.56 1h2i s SER 129 Cb -0.09 0.11 0.02 0.00 -1.71 0.00 0.00 66.02 64.36 1h2i s SER 129 CO 0.00 -0.31 -0.10 -1.61 1.20 0.00 0.00 173.24 172.43 1h2i s GLU 130 N 2.25 1.62 0.00 5.44 2.02 -1.26 -0.31 118.70 128.46 1h2i s GLU 130 Ca 0.04 -0.33 0.00 0.00 0.02 0.00 0.00 54.97 54.70 1h2i s GLU 130 Cb -0.15 -1.52 0.00 0.00 0.10 0.00 0.00 34.13 32.56 1h2i s GLU 130 CO -0.09 -0.14 0.00 0.41 0.02 0.00 0.00 175.26 175.46 1h2i n GLY 131 N 4.47 2.80 3.71 -1.39 0.00 -0.36 -5.01 105.19 109.41 1h2i n GLY 131 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 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 2.62 -0.00 0.99 1.43 -1.26 -4.56 118.68 117.90 1h2i s LEU 132 Ca 0.00 1.80 0.20 0.00 -1.03 0.00 0.00 54.13 55.10 1h2i s LEU 132 Cb 0.00 -4.29 -0.23 0.00 0.03 0.00 0.00 46.19 41.70 1h2i s LEU 132 CO 0.00 -2.63 0.77 0.29 0.23 0.00 0.00 176.35 175.01 1h2i n LYS 133 N -3.90 0.55 -3.17 1.70 5.02 -1.26 -0.71 118.16 116.38 1h2i n LYS 133 Ca 0.09 -0.03 -0.40 0.00 -2.02 0.00 0.00 58.31 55.95 1h2i n LYS 133 Cb 0.53 -1.43 -0.07 0.00 -0.02 0.00 0.00 35.03 34.04 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 -3.09 6.55 0.02 4.39 0.15 -1.26 -4.81 113.70 115.64 1h2i s SER 134 Ca 0.05 0.66 -0.25 0.00 0.70 0.00 0.00 55.95 57.11 1h2i s SER 134 Cb 0.14 -2.32 -0.17 0.00 -1.71 0.00 0.00 66.02 61.97 1h2i s SER 134 CO 0.81 -0.30 1.35 0.50 1.20 0.00 0.00 173.24 176.79 1h2i h LYS 135 N 7.81 -0.27 -0.34 5.44 3.64 -1.98 -1.69 116.57 129.19 1h2i h LYS 135 Ca -0.29 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.18 1h2i h LYS 135 Cb 1.14 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 32.94 1h2i h LYS 135 CO 0.75 0.03 -0.17 0.00 -2.27 0.00 0.00 179.45 177.80 1h2i h ALA 136 N 0.13 0.09 -0.20 5.00 0.00 -1.99 0.54 119.26 122.83 1h2i h ALA 136 Ca -0.03 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1h2i h ALA 136 Cb 0.43 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1h2i h ALA 136 CO 0.05 -0.55 -0.04 -0.07 0.00 0.00 0.00 179.25 178.64 1h2i h LEU 137 N -0.11 0.28 -0.07 0.00 -0.00 -1.97 -0.72 115.31 112.72 1h2i h LEU 137 Ca 0.17 -0.04 -0.03 0.00 -0.00 0.00 0.00 57.88 57.97 1h2i h LEU 137 Cb 0.38 -0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 40.96 1h2i h LEU 137 CO -0.41 0.36 -0.09 0.28 -0.00 0.00 0.00 178.44 178.58 1h2i h SER 138 N 0.29 0.20 -0.31 -0.43 0.02 -0.21 -2.01 113.55 111.11 1h2i h SER 138 Ca 0.07 -0.53 0.01 0.00 -0.84 0.00 0.00 61.79 60.50 1h2i h SER 138 Cb 0.26 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 1h2i h SER 138 CO 0.01 0.68 0.19 -0.07 -1.14 0.00 0.00 176.83 176.51 1h2i h LEU 139 N -0.29 0.33 -0.56 5.07 -0.00 -0.79 -1.72 115.31 117.36 1h2i h LEU 139 Ca 0.01 -0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.91 1h2i h LEU 139 Cb 0.64 -0.08 -0.04 0.00 -0.00 0.00 0.00 40.66 41.19 1h2i h LEU 139 CO 0.02 0.24 0.33 -0.08 -0.00 0.00 0.00 178.44 178.95 1h2i h GLU 140 N 0.40 0.64 -0.26 1.13 4.81 -1.14 0.62 114.58 120.78 1h2i h GLU 140 Ca 0.12 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1h2i h GLU 140 Cb -0.03 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1h2i h GLU 140 CO -0.04 0.42 0.08 -0.22 -0.73 0.00 0.00 179.01 178.53 1h2i h LYS 141 N 0.66 0.39 -0.39 1.92 3.64 -1.14 -2.26 116.57 119.39 1h2i h LYS 141 Ca 0.23 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 1h2i h LYS 141 Cb 0.03 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1h2i h LYS 141 CO -0.10 0.46 -0.07 0.00 -2.27 0.00 0.00 179.45 177.47 1h2i h ALA 142 N 0.92 0.54 -0.19 5.00 0.00 -1.02 -1.57 119.26 122.92 1h2i h ALA 142 Ca 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1h2i h ALA 142 Cb 0.23 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1h2i h ALA 142 CO -0.00 0.38 0.10 0.00 0.00 0.00 0.00 179.25 179.73 1h2i h ARG 143 N 0.55 0.27 -0.65 0.00 3.08 -0.86 -1.61 114.38 115.17 1h2i h ARG 143 Ca 0.10 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 1h2i h ARG 143 Cb 0.58 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 1h2i h ARG 143 CO 0.03 0.29 0.14 0.87 -1.07 0.00 0.00 179.97 180.23 1h2i h LYS 144 N 0.19 1.05 -0.04 0.04 1.57 -1.39 -2.81 116.57 115.19 1h2i h LYS 144 Ca 0.07 -0.25 -0.14 0.00 -1.87 0.00 0.00 60.65 58.46 1h2i h LYS 144 Cb 0.10 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1h2i h LYS 144 CO -0.01 0.94 -0.61 0.93 -0.57 0.00 0.00 179.45 180.13 1h2i h GLU 145 N 0.99 0.13 -0.49 3.15 5.08 -1.14 -2.58 114.58 119.72 1h2i h GLU 145 Ca 0.21 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1h2i h GLU 145 Cb 0.37 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1h2i h GLU 145 CO 0.00 0.70 0.31 0.00 -1.00 0.00 0.00 179.01 179.02 1h2i h ALA 146 N 1.28 0.62 0.27 3.43 0.00 -1.06 0.25 119.26 124.06 1h2i h ALA 146 Ca -0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1h2i h ALA 146 Cb 1.10 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1h2i h ALA 146 CO 0.09 0.09 -0.13 0.28 0.00 0.00 0.00 179.25 179.57 1h2i h VAL 147 N 0.65 0.77 -0.98 0.00 2.07 -1.25 0.24 116.25 117.75 1h2i h VAL 147 Ca 0.18 -0.21 0.01 0.00 0.82 0.00 0.00 66.70 67.49 1h2i h VAL 147 Cb -0.04 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 1h2i h VAL 147 CO -0.04 0.05 0.65 0.74 0.02 0.00 0.00 177.57 178.99 1h2i h THR 148 N -0.47 1.25 -0.68 2.57 2.02 -1.33 0.17 112.91 116.44 1h2i h THR 148 Ca -0.04 -0.45 -0.05 0.00 0.77 0.00 0.00 66.41 66.63 1h2i h THR 148 Cb 0.35 -0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.54 1h2i h THR 148 CO 0.06 0.24 0.21 -0.78 0.37 0.00 0.00 175.52 175.62 1h2i h ASP 149 N 1.33 0.99 -0.28 4.18 -0.00 -0.33 -0.59 116.42 121.71 1h2i h ASP 149 Ca 0.36 -0.21 -0.03 0.00 -0.00 0.00 0.00 57.03 57.15 1h2i h ASP 149 Cb -0.15 -0.26 -0.01 0.00 -0.00 0.00 0.00 39.33 38.91 1h2i h ASP 149 CO -0.08 0.94 0.04 1.23 -0.00 0.00 0.00 179.24 181.37 1h2i h GLY 150 N 0.99 0.51 0.97 -0.78 0.00 0.04 0.49 103.07 105.30 1h2i h GLY 150 Ca 0.22 -0.34 0.01 0.00 0.00 0.00 0.00 47.33 47.22 1h2i h GLY 150 CO -0.01 0.32 0.46 -2.00 0.00 0.00 0.00 176.54 175.31 1h2i h LEU 151 N 0.29 0.79 -0.24 3.11 5.85 -0.52 0.14 115.31 124.72 1h2i h LEU 151 Ca 0.09 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1h2i h LEU 151 Cb 0.35 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1h2i h LEU 151 CO 0.01 0.57 0.09 0.11 -0.34 0.00 0.00 178.44 178.87 1h2i h LYS 152 N 0.93 0.37 -0.72 1.25 1.57 -0.84 -1.69 116.57 117.45 1h2i h LYS 152 Ca 0.26 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.93 1h2i h LYS 152 Cb -0.08 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 1h2i h LYS 152 CO -0.07 0.43 0.28 0.00 -0.57 0.00 0.00 179.45 179.52 1h2i h ARG 153 N 0.23 1.07 -0.21 3.15 3.08 -0.40 -2.22 114.38 119.09 1h2i h ARG 153 Ca 0.08 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1h2i h ARG 153 Cb 0.21 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1h2i h ARG 153 CO -0.00 0.87 0.13 0.00 -1.07 0.00 0.00 179.97 179.90 1h2i h ALA 154 N 1.26 0.26 -0.55 0.04 0.00 -0.58 -2.65 119.26 117.04 1h2i h ALA 154 Ca 0.24 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1h2i h ALA 154 Cb 0.21 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1h2i h ALA 154 CO -0.02 -0.25 0.37 -0.07 0.00 0.00 0.00 179.25 179.28 1h2i h LEU 155 N 0.27 0.51 -1.74 0.00 4.07 -1.02 -1.97 115.31 115.42 1h2i h LEU 155 Ca 0.07 -0.00 0.23 0.00 0.08 0.00 0.00 57.88 58.26 1h2i h LEU 155 Cb -0.01 -0.11 -0.05 0.00 1.08 0.00 0.00 40.66 41.57 1h2i h LEU 155 CO -0.02 0.34 0.61 0.03 -1.08 0.00 0.00 178.44 178.33 1h2i h ARG 156 N 0.59 0.20 -0.05 1.13 3.08 -1.02 -0.80 114.38 117.50 1h2i h ARG 156 Ca 0.23 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.28 1h2i h ARG 156 Cb 0.17 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 1h2i h ARG 156 CO -0.06 0.13 0.11 0.77 -1.07 0.00 0.00 179.97 179.85 1h2i h SER 157 N 0.20 0.00 1.68 7.04 0.02 -1.44 -1.60 113.55 119.46 1h2i h SER 157 Ca 0.44 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.39 1h2i h SER 157 Cb 1.41 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.95 1h2i h SER 157 CO -0.10 0.00 -0.04 -0.26 -1.14 0.00 0.00 176.83 175.30 1h2i h PHE 158 N 0.00 0.00 0.00 3.45 -1.00 -1.34 -3.49 116.94 114.55 1h2i h PHE 158 Ca 0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.80 1h2i h PHE 158 Cb 0.25 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.81 1h2i h PHE 158 CO 0.00 0.04 0.00 0.41 -1.61 0.00 0.00 178.31 177.15 1h2i n GLY 159 N 0.80 0.04 0.18 -1.45 0.00 -0.60 -4.94 105.19 99.22 1h2i n GLY 159 Ca 0.03 -1.59 -0.08 0.00 0.00 0.00 0.00 46.02 44.38 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 0.49 0.00 1.61 2.35 -1.55 -0.88 115.58 117.59 1h2i h ASN 160 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1h2i h ASN 160 Cb 0.00 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.25 1h2i h ASN 160 CO 0.00 0.36 0.14 0.00 -1.65 0.00 0.00 177.43 176.28 1h2i h ALA 161 N 1.15 1.11 -0.30 -0.83 0.00 0.24 0.30 119.26 120.94 1h2i h ALA 161 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1h2i h ALA 161 Cb -0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1h2i h ALA 161 CO -0.03 -0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.39 1h2i n LEU 162 N -2.50 3.39 0.00 0.00 7.99 -0.85 -4.94 117.00 120.09 1h2i n LEU 162 Ca -0.02 -2.52 0.00 0.00 -0.01 0.00 0.00 56.01 53.47 1h2i n LEU 162 Cb 0.18 -0.39 0.00 0.00 -0.11 0.00 0.00 43.42 43.10 1h2i n LEU 162 CO 0.12 0.70 0.00 0.61 -1.51 0.00 0.00 177.39 177.30 1h2i n GLY 163 N -0.03 1.02 0.29 -0.72 0.00 0.11 -3.87 105.19 101.99 1h2i n GLY 163 Ca 0.16 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.38 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 -0.04 1.61 -0.00 -1.09 -2.63 115.58 113.43 1h2i h ASN 164 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 56.30 56.08 1h2i h ASN 164 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 38.33 1h2i h ASN 164 CO 0.00 0.00 -0.79 0.00 -0.00 0.00 0.00 177.43 176.64 1h2i n ILE 166 N -3.91 0.00 0.05 0.00 0.00 -0.99 0.82 119.36 115.34 1h2i n ILE 166 Ca -0.07 0.80 0.05 0.00 0.00 0.00 0.00 62.75 63.52 1h2i n ILE 166 Cb 0.75 -1.39 0.09 0.00 0.00 0.00 0.00 39.64 39.09 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 -2.68 2.38 -4.55 9.51 -0.00 -1.26 -4.90 117.00 115.49 1h2i n LEU 167 Ca 0.18 -1.63 -0.42 0.00 -0.00 0.00 0.00 56.01 54.15 1h2i n LEU 167 Cb 1.01 -0.12 -0.03 0.00 -0.00 0.00 0.00 43.42 44.29 1h2i n LEU 167 CO 0.18 0.56 1.10 -0.62 -0.00 0.00 0.00 177.39 178.61 1h2i s ASP 168 N -0.91 6.26 0.47 1.45 3.68 0.24 -4.93 116.67 122.94 1h2i s ASP 168 Ca 0.16 -0.31 0.28 0.00 2.13 0.00 0.00 52.55 54.81 1h2i s ASP 168 Cb 0.09 -2.54 1.34 0.00 -1.45 0.00 0.00 42.92 40.35 1h2i s ASP 168 CO 0.12 -1.67 1.79 0.11 0.13 0.00 0.00 175.17 175.65 1h2i h LYS 169 N 9.81 0.18 -0.00 4.34 1.57 -1.91 0.18 116.57 130.74 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 1.05 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.31 1h2i h LYS 169 CO 1.24 0.12 -0.64 -0.44 -0.57 0.00 0.00 179.45 179.15 1h2i h ASP 170 N 0.18 0.00 -0.07 0.86 3.32 -1.95 -0.81 116.42 117.95 1h2i h ASP 170 Ca 0.57 -0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.46 1h2i h ASP 170 Cb 1.87 -0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.43 1h2i h ASP 170 CO -0.15 0.64 -0.59 0.22 -1.72 0.00 0.00 179.24 177.64 1h2i h TYR 171 N 0.00 0.74 -0.51 4.55 3.20 -1.02 -2.49 116.97 121.44 1h2i h TYR 171 Ca -0.01 -0.35 -0.01 0.00 3.14 0.00 0.00 58.73 61.51 1h2i h TYR 171 Cb 1.14 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 1h2i h TYR 171 CO 0.00 1.15 0.29 -0.07 -1.64 0.00 0.00 178.16 177.89 1h2i h LEU 172 N 0.12 0.62 0.07 2.82 3.38 -1.13 -1.59 115.31 119.60 1h2i h LEU 172 Ca -0.05 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 57.86 1h2i h LEU 172 Cb 1.26 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.82 1h2i h LEU 172 CO 0.12 0.52 -0.17 -0.09 0.09 0.00 0.00 178.44 178.91 1h2i h ARG 173 N 0.67 -0.30 0.00 1.13 2.43 -1.17 -1.36 114.38 115.78 1h2i h ARG 173 Ca 0.18 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1h2i h ARG 173 Cb 0.02 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1h2i h ARG 173 CO -0.03 -0.20 0.00 -1.13 -1.51 0.00 0.00 179.97 177.10 1h2i n SER 174 N -5.30 0.00 0.09 -3.80 3.41 -0.94 -2.07 113.62 105.02 1h2i n SER 174 Ca -0.06 0.30 -0.20 0.00 -0.26 0.00 0.00 58.87 58.65 1h2i n SER 174 Cb 0.21 -0.41 -0.15 0.00 -0.26 0.00 0.00 64.21 63.61 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 0.55 -1.38 1.04 3.38 -0.25 -3.29 115.31 115.36 1h2i h LEU 175 Ca 0.00 -0.70 -0.04 0.00 0.09 0.00 0.00 57.88 57.24 1h2i h LEU 175 Cb 0.23 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1h2i h LEU 175 CO 0.00 1.57 0.03 0.78 0.09 0.00 0.00 178.44 180.91 1h2i h ASN 176 N 0.10 0.41 0.00 -0.43 2.35 -0.80 -2.36 115.58 114.85 1h2i h ASN 176 Ca -0.25 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 1h2i h ASN 176 Cb 2.06 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 40.33 1h2i h ASN 176 CO 0.20 0.45 0.00 0.29 -1.65 0.00 0.00 177.43 176.72 1h2i n LYS 177 N -4.33 0.88 -4.66 0.81 5.02 -1.17 -4.72 118.16 110.00 1h2i n LYS 177 Ca 0.01 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.97 1h2i n LYS 177 Cb 0.20 -1.37 -0.12 0.00 -0.02 0.00 0.00 35.03 33.73 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 3.05 0.06 -0.35 1.43 -0.89 -5.08 118.68 116.90 1h2i s LEU 178 Ca 0.00 -0.10 -0.31 0.00 -1.03 0.00 0.00 54.13 52.70 1h2i s LEU 178 Cb 0.00 -1.68 -0.07 0.00 0.03 0.00 0.00 46.19 44.47 1h2i s LEU 178 CO 0.00 0.34 1.43 -2.84 0.23 0.00 0.00 176.35 175.51 1h2i s PRO 179 N -0.93 4.29 0.15 1.29 0.02 -1.26 -4.96 135.00 133.60 1h2i s PRO 179 Ca 0.13 2.07 -0.03 0.00 0.02 0.00 0.00 61.00 63.19 1h2i s PRO 179 Cb -0.11 -3.42 -0.03 0.00 0.02 0.00 0.00 34.50 30.96 1h2i s PRO 179 CO 0.03 -0.53 -0.10 2.89 -0.33 0.00 0.00 177.00 178.95 1h2i n ARG 180 N 4.74 0.00 -3.92 5.54 1.85 -1.26 -4.99 116.66 118.61 1h2i n ARG 180 Ca 0.13 0.00 -0.16 0.00 -1.00 0.00 0.00 57.85 56.81 1h2i n ARG 180 Cb 0.43 -0.19 -0.16 0.00 -1.05 0.00 0.00 32.46 31.49 1h2i n ARG 180 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 1h2i s GLN 181 N -0.30 0.26 -0.24 2.89 -2.07 -1.26 -5.13 119.66 113.81 1h2i s GLN 181 Ca 0.09 0.07 -0.27 0.00 -1.82 0.00 0.00 55.36 53.43 1h2i s GLN 181 Cb -0.06 -0.43 0.00 0.00 -1.09 0.00 0.00 33.01 31.43 1h2i s GLN 181 CO 0.14 -0.12 0.95 -0.48 -1.32 0.00 0.00 175.29 174.47 1h2i s LEU 182 N 0.91 4.09 -0.47 2.60 2.34 -1.26 -4.95 118.68 121.94 1h2i s LEU 182 Ca -0.09 1.23 -0.44 0.00 0.06 0.00 0.00 54.13 54.88 1h2i s LEU 182 Cb -0.12 -3.39 -0.19 0.00 -0.56 0.00 0.00 46.19 41.93 1h2i s LEU 182 CO -0.02 -0.61 1.55 -0.81 -1.06 0.00 0.00 176.35 175.41 1h2i n PRO 183 N 6.20 0.00 -0.46 1.48 -0.04 -1.26 -4.85 135.00 136.07 1h2i n PRO 183 Ca 0.09 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.27 1h2i n PRO 183 Cb 0.47 -1.42 0.27 0.00 -0.04 0.00 0.00 33.50 32.77 1h2i n PRO 183 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1h2i n LEU 184 N 4.02 -1.71 -4.60 1.53 0.00 -1.26 -5.00 117.00 110.00 1h2i n LEU 184 Ca 0.31 -0.20 -0.38 0.00 0.00 0.00 0.00 56.01 55.74 1h2i n LEU 184 Cb -0.06 -1.25 -0.11 0.00 0.00 0.00 0.00 43.42 42.01 1h2i n LEU 184 CO 0.85 -3.36 -0.14 -1.61 0.00 0.00 0.00 177.39 173.14 1h2i s GLU 185 N -4.39 3.97 -0.24 1.96 0.41 -1.26 -5.06 118.70 114.09 1h2i s GLU 185 Ca 0.69 -0.26 -0.29 0.00 -0.41 0.00 0.00 54.97 54.69 1h2i s GLU 185 Cb -0.26 -3.65 0.00 0.00 -1.78 0.00 0.00 34.13 28.44 1h2i s GLU 185 CO 0.66 -0.18 1.18 0.08 -0.49 0.00 0.00 175.26 176.50 1h2i s VAL 186 N 1.76 4.40 -0.11 2.63 1.01 -1.26 -4.99 120.40 123.84 1h2i s VAL 186 Ca 0.08 1.65 -0.27 0.00 0.00 0.00 0.00 61.98 63.44 1h2i s VAL 186 Cb -0.16 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.00 1h2i s VAL 186 CO 0.10 -0.29 0.90 -0.62 0.00 0.00 0.00 175.10 175.19 1h2i s ASP 187 N 1.89 7.12 -0.07 3.32 3.68 -1.26 -4.92 116.67 126.43 1h2i s ASP 187 Ca 0.50 1.37 0.14 0.00 2.13 0.00 0.00 52.55 56.69 1h2i s ASP 187 Cb -0.17 -2.50 0.42 0.00 -1.45 0.00 0.00 42.92 39.22 1h2i s ASP 187 CO 0.14 -0.36 1.35 0.18 0.13 0.00 0.00 175.17 176.61 1h2i n LEU 188 N 4.78 3.43 0.16 -1.34 4.77 -1.26 -4.70 117.00 122.84 1h2i n LEU 188 Ca 0.05 -2.38 -0.16 0.00 -0.03 0.00 0.00 56.01 53.49 1h2i n LEU 188 Cb 0.49 -0.37 -0.09 0.00 -2.33 0.00 0.00 43.42 41.12 1h2i n LEU 188 CO 0.50 0.72 0.52 0.74 -1.33 0.00 0.00 177.39 178.54 1h2i h THR 189 N 2.17 0.00 -0.20 -5.08 2.02 -2.04 -2.54 112.91 107.24 1h2i h THR 189 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1h2i h THR 189 Cb 1.04 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 1h2i h THR 189 CO 0.10 0.00 0.07 0.29 0.37 0.00 0.00 175.52 176.35 1h2i n LYS 190 N -5.30 1.75 -1.63 6.66 5.02 -1.26 -4.95 118.16 118.46 1h2i n LYS 190 Ca -0.09 -0.83 -0.36 0.00 -2.02 0.00 0.00 58.31 55.01 1h2i n LYS 190 Cb 0.40 -1.54 0.08 0.00 -0.02 0.00 0.00 35.03 33.95 1h2i n LYS 190 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1h2i s ALA 191 N -1.23 2.27 0.11 7.82 0.00 -0.96 -4.93 121.76 124.84 1h2i s ALA 191 Ca 0.15 1.04 -0.30 0.00 0.00 0.00 0.00 51.96 52.84 1h2i s ALA 191 Cb 0.12 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.67 1h2i s ALA 191 CO 0.04 -1.68 1.14 0.21 0.00 0.00 0.00 175.76 175.46 1h2i s LYS 192 N -3.62 4.51 0.00 0.00 2.20 -1.26 -4.88 119.74 116.69 1h2i s LYS 192 Ca 0.78 1.72 0.00 0.00 -0.36 0.00 0.00 55.97 58.11 1h2i s LYS 192 Cb -0.33 -3.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.67 1h2i s LYS 192 CO 0.41 -0.10 0.67 0.54 -0.36 0.00 0.00 175.35 176.51 1h2i n ARG 193 N 3.25 1.09 -4.01 4.03 1.74 -1.26 -5.06 116.66 116.44 1h2i n ARG 193 Ca 0.06 -0.89 -0.10 0.00 -0.77 0.00 0.00 57.85 56.15 1h2i n ARG 193 Cb 0.47 -0.85 -0.11 0.00 -1.02 0.00 0.00 32.46 30.95 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 -0.45 0.39 0.03 5.56 -0.21 -1.26 -5.07 119.66 118.66 1h2i s GLN 194 Ca 0.00 -0.70 -0.21 0.00 0.02 0.00 0.00 55.36 54.47 1h2i s GLN 194 Cb 0.00 0.02 -0.15 0.00 1.00 0.00 0.00 33.01 33.88 1h2i s GLN 194 CO 0.00 -0.03 1.33 -0.44 -2.12 0.00 0.00 175.29 174.03 1h2i h ASP 195 N 4.48 0.31 -2.38 5.90 3.45 -2.05 -3.45 116.42 122.68 1h2i h ASP 195 Ca -0.33 -0.48 -0.55 0.00 0.43 0.00 0.00 57.03 56.10 1h2i h ASP 195 Cb 1.20 -0.09 0.04 0.00 -0.56 0.00 0.00 39.33 39.92 1h2i h ASP 195 CO 0.43 0.73 1.07 -0.11 -1.57 0.00 0.00 179.24 179.79 1h2i n LEU 196 N -4.61 3.83 -4.12 1.55 -0.00 -1.26 -4.99 117.00 107.40 1h2i n LEU 196 Ca -0.06 0.99 -0.37 0.00 -0.00 0.00 0.00 56.01 56.57 1h2i n LEU 196 Cb 0.34 -1.50 -0.11 0.00 -0.00 0.00 0.00 43.42 42.15 1h2i n LEU 196 CO 0.38 0.08 -0.10 -1.61 -0.00 0.00 0.00 177.39 176.14 1h2i s GLU 197 N 2.78 2.19 0.20 1.96 0.41 -1.26 -4.99 118.70 120.00 1h2i s GLU 197 Ca 0.84 -2.02 -0.08 0.00 -0.41 0.00 0.00 54.97 53.29 1h2i s GLU 197 Cb -0.54 -3.65 0.14 0.00 -1.78 0.00 0.00 34.13 28.30 1h2i s GLU 197 CO 0.40 -1.11 1.71 -1.35 -0.49 0.00 0.00 175.26 174.42 1h2i h PRO 198 N 7.78 1.10 -0.88 0.39 0.11 -1.98 0.18 132.00 138.71 1h2i h PRO 198 Ca -0.10 -0.28 0.01 0.00 0.11 0.00 0.00 66.00 65.74 1h2i h PRO 198 Cb 1.02 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 31.95 1h2i h PRO 198 CO 0.71 0.99 0.58 0.66 -0.21 0.00 0.00 178.00 180.74 1h2i h SER 199 N 1.04 1.00 0.19 -2.05 4.64 -2.00 -1.89 113.55 114.48 1h2i h SER 199 Ca 0.21 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.50 1h2i h SER 199 Cb 0.41 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1h2i h SER 199 CO 0.01 0.72 -0.09 0.58 -0.87 0.00 0.00 176.83 177.17 1h2i h VAL 200 N 1.18 0.90 -0.92 0.95 2.07 -1.92 -2.71 116.25 115.79 1h2i h VAL 200 Ca 0.33 -0.80 0.24 0.00 0.82 0.00 0.00 66.70 67.29 1h2i h VAL 200 Cb -0.12 1.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 1h2i h VAL 200 CO -0.08 0.17 0.64 -0.08 0.02 0.00 0.00 177.57 178.24 1h2i h GLU 201 N -0.68 0.17 0.37 1.57 4.57 -0.49 0.36 114.58 120.45 1h2i h GLU 201 Ca -0.03 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 1h2i h GLU 201 Cb 0.48 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.04 1h2i h GLU 201 CO 0.04 0.11 -0.18 0.93 -1.18 0.00 0.00 179.01 178.74 1h2i h GLU 202 N 0.18 -0.48 -1.00 1.92 5.08 -1.30 -2.91 114.58 116.07 1h2i h GLU 202 Ca 0.46 0.03 0.18 0.00 -1.00 0.00 0.00 59.36 59.04 1h2i h GLU 202 Cb 1.52 0.11 -0.10 0.00 0.50 0.00 0.00 28.75 30.78 1h2i h GLU 202 CO -0.09 -0.32 0.62 0.00 -1.00 0.00 0.00 179.01 178.21 1h2i h ALA 203 N -1.36 1.69 -0.02 3.43 0.00 -1.11 -1.23 119.26 120.67 1h2i h ALA 203 Ca -0.05 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1h2i h ALA 203 Cb 0.38 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1h2i h ALA 203 CO 0.08 -0.05 0.01 -0.09 0.00 0.00 0.00 179.25 179.20 1h2i h ARG 204 N 0.77 0.03 0.00 0.00 2.43 -0.99 -1.57 114.38 115.04 1h2i h ARG 204 Ca 0.57 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.73 1h2i h ARG 204 Cb 0.88 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 1h2i h ARG 204 CO -0.36 0.09 0.00 0.98 -1.51 0.00 0.00 179.97 179.18 1h2i n TYR 205 N -5.04 0.00 0.39 2.20 9.36 -0.48 -0.83 117.16 122.77 1h2i n TYR 205 Ca -0.07 0.00 0.11 0.00 3.32 0.00 0.00 57.90 61.26 1h2i n TYR 205 Cb 0.06 -0.11 -0.09 0.00 -0.63 0.00 0.00 39.34 38.58 1h2i n TYR 205 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1h2i n ASN 206 N -1.11 0.46 0.05 2.98 3.02 -0.60 -4.14 115.26 115.92 1h2i n ASN 206 Ca 0.05 -0.25 -0.21 0.00 -0.03 0.00 0.00 54.58 54.13 1h2i n ASN 206 Cb 0.04 1.31 -0.15 0.00 -0.61 0.00 0.00 39.78 40.37 1h2i n ASN 206 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1h2i h SER 207 N 0.00 0.49 0.00 6.41 4.64 -0.84 -3.05 113.55 121.20 1h2i h SER 207 Ca 0.00 -0.91 0.00 0.00 -0.47 0.00 0.00 61.79 60.41 1h2i h SER 207 Cb 0.81 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1h2i h SER 207 CO 0.00 1.53 0.00 0.00 -0.87 0.00 0.00 176.83 177.49