#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n9b s PRO 27 N 0.00 0.43 0.68 1.43 0.04 -1.26 -4.96 135.00 131.36 1n9b s PRO 27 Ca 0.00 0.09 -0.17 0.00 0.04 0.00 0.00 61.00 60.96 1n9b s PRO 27 Cb 0.00 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.77 1n9b s PRO 27 CO 0.00 -2.64 1.19 1.04 0.04 0.00 0.00 177.00 176.63 1n9b n GLN 28 N -4.03 0.84 -0.15 4.56 1.13 -1.26 -4.61 117.38 113.87 1n9b n GLN 28 Ca 0.10 0.35 -0.03 0.00 -1.94 0.00 0.00 57.00 55.47 1n9b n GLN 28 Cb 0.59 -2.43 0.04 0.00 0.11 0.00 0.00 30.24 28.55 1n9b n GLN 28 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1n9b h PRO 29 N 0.17 0.05 -0.63 -1.09 0.11 -1.93 -0.48 132.00 128.20 1n9b h PRO 29 Ca -0.49 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 1n9b h PRO 29 Cb 1.34 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.41 1n9b h PRO 29 CO 0.51 0.03 0.16 -0.07 -0.21 0.00 0.00 178.00 178.41 1n9b h LEU 30 N 0.05 0.92 -0.68 2.35 3.38 -1.98 -0.28 115.31 119.08 1n9b h LEU 30 Ca 0.23 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1n9b h LEU 30 Cb 0.35 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1n9b h LEU 30 CO -0.44 0.89 0.35 -0.33 0.09 0.00 0.00 178.44 179.00 1n9b h GLU 31 N 0.94 0.96 -0.45 1.13 3.07 -1.71 -1.54 114.58 116.98 1n9b h GLU 31 Ca 0.20 -0.12 -0.09 0.00 -0.50 0.00 0.00 59.36 58.85 1n9b h GLU 31 Cb 0.33 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 1n9b h GLU 31 CO -0.00 0.74 -0.08 0.37 -1.40 0.00 0.00 179.01 178.64 1n9b h GLN 32 N 0.93 0.85 -0.61 2.33 5.75 -0.55 -1.34 115.11 122.47 1n9b h GLN 32 Ca 0.24 -0.31 0.05 0.00 -0.15 0.00 0.00 58.65 58.48 1n9b h GLN 32 Cb 0.07 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.52 1n9b h GLN 32 CO -0.03 0.94 0.33 0.82 -2.65 0.00 0.00 178.83 178.24 1n9b h ILE 33 N 0.69 0.96 -0.50 2.39 2.04 -0.73 -0.02 117.51 122.35 1n9b h ILE 33 Ca 0.12 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 1n9b h ILE 33 Cb 0.61 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1n9b h ILE 33 CO 0.04 0.11 0.21 0.11 0.00 0.00 0.00 178.15 178.62 1n9b h LYS 34 N 0.62 0.75 -0.97 2.37 1.57 -1.12 -2.01 116.57 117.78 1n9b h LYS 34 Ca 0.27 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1n9b h LYS 34 Cb 0.16 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 1n9b h LYS 34 CO -0.17 0.65 0.63 -0.07 -0.57 0.00 0.00 179.45 179.92 1n9b h LEU 35 N 0.67 1.13 -0.73 2.94 3.38 -0.76 -1.42 115.31 120.52 1n9b h LEU 35 Ca 0.17 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1n9b h LEU 35 Cb 0.18 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1n9b h LEU 35 CO -0.02 0.83 0.44 0.77 0.09 0.00 0.00 178.44 180.55 1n9b h SER 36 N 1.33 0.89 -0.69 -0.43 4.64 -0.51 0.08 113.55 118.84 1n9b h SER 36 Ca 0.36 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.59 1n9b h SER 36 Cb -0.13 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 61.70 1n9b h SER 36 CO -0.07 0.69 0.38 -0.33 -0.87 0.00 0.00 176.83 176.63 1n9b h GLU 37 N 1.00 0.97 -0.59 4.77 5.08 -0.73 -0.23 114.58 124.86 1n9b h GLU 37 Ca 0.26 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1n9b h GLU 37 Cb -0.03 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.01 1n9b h GLU 37 CO -0.05 0.73 0.28 0.66 -1.00 0.00 0.00 179.01 179.63 1n9b h SER 38 N 0.95 0.77 0.14 1.42 4.64 -0.85 0.46 113.55 121.07 1n9b h SER 38 Ca 0.24 -0.13 -0.22 0.00 -0.47 0.00 0.00 61.79 61.22 1n9b h SER 38 Cb 0.04 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 1n9b h SER 38 CO -0.04 0.68 -0.84 1.56 -0.87 0.00 0.00 176.83 177.32 1n9b h GLN 39 N 0.80 0.55 0.00 4.77 4.20 -0.79 -3.25 115.11 121.39 1n9b h GLN 39 Ca 0.20 -0.50 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1n9b h GLN 39 Cb 0.12 0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.02 1n9b h GLN 39 CO -0.03 1.13 -0.40 -0.07 -0.67 0.00 0.00 178.83 178.79 1n9b h LEU 40 N 0.35 0.00 1.34 1.46 3.38 -0.99 -3.48 115.31 117.37 1n9b h LEU 40 Ca -0.06 -0.03 -0.38 0.00 0.09 0.00 0.00 57.88 57.50 1n9b h LEU 40 Cb 1.46 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 42.08 1n9b h LEU 40 CO 0.16 0.01 -0.37 -1.20 0.09 0.00 0.00 178.44 177.13 1n9b n SER 41 N -2.74 -5.04 -4.46 -0.43 7.64 0.15 -4.20 113.62 104.54 1n9b n SER 41 Ca 0.03 0.39 -0.29 0.00 1.01 0.00 0.00 58.87 60.01 1n9b n SER 41 Cb 0.51 -4.45 -0.08 0.00 -1.01 0.00 0.00 64.21 59.18 1n9b n SER 41 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1n9b s GLY 42 N -2.50 2.78 -0.07 0.23 0.00 -1.21 -4.32 107.32 102.22 1n9b s GLY 42 Ca 0.00 -0.93 -0.15 0.00 0.00 0.00 0.00 44.72 43.64 1n9b s GLY 42 CO 0.00 -2.02 0.39 -1.60 0.00 0.00 0.00 173.10 169.87 1n9b s ARG 43 N -3.80 4.09 -0.05 2.90 3.52 -0.41 -4.52 118.95 120.68 1n9b s ARG 43 Ca 0.16 0.32 0.02 0.00 -0.13 0.00 0.00 55.73 56.11 1n9b s ARG 43 Cb 0.03 -3.32 -0.03 0.00 -1.56 0.00 0.00 34.95 30.06 1n9b s ARG 43 CO 0.09 0.45 -0.08 0.08 -0.81 0.00 0.00 175.30 175.03 1n9b s VAL 44 N -0.26 3.58 -0.04 7.11 1.01 -1.26 -1.10 120.40 129.43 1n9b s VAL 44 Ca 0.22 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.67 1n9b s VAL 44 Cb -0.15 -2.47 -0.00 0.00 0.00 0.00 0.00 36.38 33.76 1n9b s VAL 44 CO 0.10 0.57 -0.16 -0.83 0.00 0.00 0.00 175.10 174.78 1n9b s GLY 45 N -0.89 0.86 -0.09 4.51 0.00 0.53 -4.58 107.32 107.66 1n9b s GLY 45 Ca 0.13 -0.62 -0.14 0.00 0.00 0.00 0.00 44.72 44.09 1n9b s GLY 45 CO 0.02 -0.29 0.35 -0.29 0.00 0.00 0.00 173.10 172.89 1n9b s MET 46 N 0.09 0.51 0.01 2.90 1.75 0.11 -0.77 119.30 123.89 1n9b s MET 46 Ca -0.04 0.27 0.03 0.00 -1.25 0.00 0.00 55.69 54.69 1n9b s MET 46 Cb -0.11 0.24 -0.01 0.00 2.84 0.00 0.00 34.83 37.79 1n9b s MET 46 CO 0.02 -0.10 -0.09 0.42 -0.65 0.00 0.00 175.02 174.62 1n9b s ILE 47 N -0.33 0.69 -0.15 10.11 -1.09 -0.42 -1.11 121.20 128.90 1n9b s ILE 47 Ca -0.05 -0.58 0.02 0.00 -2.23 0.00 0.00 60.65 57.81 1n9b s ILE 47 Cb -0.03 -0.62 0.01 0.00 -1.58 0.00 0.00 42.46 40.24 1n9b s ILE 47 CO 0.02 0.05 -0.19 -0.70 -1.23 0.00 0.00 174.94 172.88 1n9b s GLU 48 N -0.60 2.79 -0.00 2.79 2.12 0.42 -1.11 118.70 125.11 1n9b s GLU 48 Ca 0.00 -0.76 0.01 0.00 0.36 0.00 0.00 54.97 54.58 1n9b s GLU 48 Cb -0.05 -2.34 -0.00 0.00 0.26 0.00 0.00 34.13 31.99 1n9b s GLU 48 CO 0.00 -0.10 -0.03 1.41 -0.54 0.00 0.00 175.26 175.99 1n9b s MET 49 N 1.05 0.27 0.10 4.30 1.75 -0.02 -0.43 119.30 126.32 1n9b s MET 49 Ca -0.02 -0.13 -0.31 0.00 -1.25 0.00 0.00 55.69 53.98 1n9b s MET 49 Cb -0.14 -0.26 -0.09 0.00 2.84 0.00 0.00 34.83 37.18 1n9b s MET 49 CO -0.06 0.07 1.59 0.34 -0.65 0.00 0.00 175.02 176.32 1n9b s ASP 50 N -0.09 6.62 0.14 1.11 2.15 0.23 -0.27 116.67 126.56 1n9b s ASP 50 Ca 0.01 2.50 -0.14 0.00 0.43 0.00 0.00 52.55 55.36 1n9b s ASP 50 Cb -0.01 -2.57 0.01 0.00 -0.30 0.00 0.00 42.92 40.04 1n9b s ASP 50 CO -0.00 -0.84 1.62 0.25 -0.17 0.00 0.00 175.17 176.02 1n9b h LEU 51 N 7.82 0.74 -0.37 -1.34 5.85 -1.41 0.79 115.31 127.40 1n9b h LEU 51 Ca -0.42 -0.27 -0.08 0.00 0.84 0.00 0.00 57.88 57.95 1n9b h LEU 51 Cb 1.20 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 1n9b h LEU 51 CO 0.92 0.83 -0.07 0.00 -0.34 0.00 0.00 178.44 179.77 1n9b h ALA 52 N 0.95 0.50 0.00 1.25 0.00 -1.91 -3.37 119.26 116.68 1n9b h ALA 52 Ca 0.14 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1n9b h ALA 52 Cb 0.41 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1n9b h ALA 52 CO 0.01 0.34 -1.44 -1.13 0.00 0.00 0.00 179.25 177.03 1n9b n SER 53 N -4.41 2.38 0.00 0.00 3.41 -1.22 -5.01 113.62 108.78 1n9b n SER 53 Ca -0.02 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 1n9b n SER 53 Cb 0.33 1.47 0.00 0.00 -0.26 0.00 0.00 64.21 65.76 1n9b n SER 53 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n9b n GLY 54 N 1.84 0.78 3.67 5.00 0.00 0.27 -5.02 105.19 111.73 1n9b n GLY 54 Ca -0.02 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.53 1n9b n GLY 54 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1n9b n ARG 55 N -2.29 2.11 -3.09 1.61 0.63 -1.26 -4.66 116.66 109.72 1n9b n ARG 55 Ca 0.00 0.77 -0.40 0.00 -0.92 0.00 0.00 57.85 57.29 1n9b n ARG 55 Cb 0.00 -2.55 -0.06 0.00 0.45 0.00 0.00 32.46 30.30 1n9b n ARG 55 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1n9b s THR 56 N 1.94 5.00 0.00 5.15 2.01 -1.26 -0.60 115.64 127.88 1n9b s THR 56 Ca 0.84 1.23 0.00 0.00 0.31 0.00 0.00 61.69 64.07 1n9b s THR 56 Cb -0.70 -3.96 0.00 0.00 0.01 0.00 0.00 72.50 67.85 1n9b s THR 56 CO 0.43 0.10 0.00 0.18 -0.69 0.00 0.00 174.62 174.64 1n9b n LEU 57 N 5.11 0.00 -4.77 4.42 4.32 0.42 -5.00 117.00 121.51 1n9b n LEU 57 Ca -0.01 0.00 -0.41 0.00 -0.02 0.00 0.00 56.01 55.58 1n9b n LEU 57 Cb 0.50 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.28 1n9b n LEU 57 CO 0.44 0.00 1.00 -0.89 -1.22 0.00 0.00 177.39 176.72 1n9b s THR 58 N 1.83 2.68 -0.29 -5.08 2.01 -1.24 -4.80 115.64 110.76 1n9b s THR 58 Ca 0.00 0.67 -0.01 0.00 0.31 0.00 0.00 61.69 62.66 1n9b s THR 58 Cb 0.00 -3.43 0.18 0.00 0.01 0.00 0.00 72.50 69.26 1n9b s THR 58 CO 0.00 0.16 0.57 0.00 -0.69 0.00 0.00 174.62 174.66 1n9b s ALA 59 N -1.04 -2.10 -0.09 7.40 0.00 -1.26 -0.43 121.76 124.23 1n9b s ALA 59 Ca 0.50 1.68 -0.01 0.00 0.00 0.00 0.00 51.96 54.14 1n9b s ALA 59 Cb -0.40 -2.12 0.03 0.00 0.00 0.00 0.00 23.12 20.62 1n9b s ALA 59 CO 0.53 -1.34 -0.05 -0.46 0.00 0.00 0.00 175.76 174.43 1n9b s TRP 60 N 2.82 1.16 -1.49 0.00 -0.11 -0.27 -4.67 118.94 116.38 1n9b s TRP 60 Ca 0.19 -0.51 -0.13 0.00 1.22 0.00 0.00 56.10 56.88 1n9b s TRP 60 Cb -0.15 -1.05 0.09 0.00 -1.50 0.00 0.00 33.47 30.87 1n9b s TRP 60 CO -0.21 -0.42 0.76 0.54 -4.62 0.00 0.00 176.95 173.00 1n9b n ARG 61 N 4.92 -4.29 0.20 5.86 1.74 -1.26 -0.72 116.66 123.12 1n9b n ARG 61 Ca -0.12 0.53 0.14 0.00 -0.77 0.00 0.00 57.85 57.63 1n9b n ARG 61 Cb 0.50 -5.33 0.49 0.00 -1.02 0.00 0.00 32.46 27.11 1n9b n ARG 61 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1n9b h ALA 62 N 0.96 1.00 -0.49 7.54 0.00 -1.83 -2.25 119.26 124.19 1n9b h ALA 62 Ca -0.53 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1n9b h ALA 62 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1n9b h ALA 62 CO 0.64 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.64 1n9b n ASP 63 N -2.76 3.64 -4.90 0.00 8.00 -1.26 -1.24 116.55 118.03 1n9b n ASP 63 Ca 0.02 -2.20 -0.31 0.00 0.71 0.00 0.00 54.79 53.02 1n9b n ASP 63 Cb 0.35 -0.40 -0.04 0.00 -0.02 0.00 0.00 41.12 41.01 1n9b n ASP 63 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1n9b s GLU 64 N -1.37 3.60 0.21 -1.24 2.02 -0.85 -4.97 118.70 116.10 1n9b s GLU 64 Ca 0.37 -0.14 -0.28 0.00 0.02 0.00 0.00 54.97 54.94 1n9b s GLU 64 Cb 0.22 -2.84 -0.09 0.00 0.10 0.00 0.00 34.13 31.52 1n9b s GLU 64 CO 0.21 0.45 0.88 1.03 0.02 0.00 0.00 175.26 177.85 1n9b s ARG 65 N -2.81 4.75 0.02 1.61 0.52 -1.26 -4.18 118.95 117.59 1n9b s ARG 65 Ca 0.41 1.37 0.01 0.00 -0.52 0.00 0.00 55.73 56.99 1n9b s ARG 65 Cb -0.12 -3.28 -0.01 0.00 0.52 0.00 0.00 34.95 32.06 1n9b s ARG 65 CO 0.26 0.53 -0.03 -0.06 0.02 0.00 0.00 175.30 176.01 1n9b s PHE 66 N -1.13 0.30 0.29 -0.53 0.40 -0.09 -4.98 117.98 112.25 1n9b s PHE 66 Ca 0.39 -0.33 -0.30 0.00 -0.60 0.00 0.00 56.93 56.09 1n9b s PHE 66 Cb -0.25 -0.20 -0.12 0.00 0.51 0.00 0.00 43.02 42.97 1n9b s PHE 66 CO 0.30 -0.10 1.60 -0.35 0.70 0.00 0.00 175.22 177.37 1n9b n PRO 67 N 2.12 2.71 -0.03 0.24 -0.04 -1.26 -1.43 135.00 137.32 1n9b n PRO 67 Ca -0.19 0.96 -0.13 0.00 -0.04 0.00 0.00 63.50 64.10 1n9b n PRO 67 Cb 0.57 -2.75 -0.01 0.00 -0.04 0.00 0.00 33.50 31.27 1n9b n PRO 67 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1n9b h MET 68 N 4.85 0.72 0.00 0.54 2.86 -1.63 -3.46 114.93 118.80 1n9b h MET 68 Ca -0.47 -0.49 0.00 0.00 -2.06 0.00 0.00 59.70 56.68 1n9b h MET 68 Cb 1.22 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.96 1n9b h MET 68 CO 0.80 1.11 0.00 -1.33 1.06 0.00 0.00 176.91 178.55 1n9b n MET 69 N -3.96 0.00 0.00 1.72 2.81 -1.26 -1.88 117.12 114.55 1n9b n MET 69 Ca -0.05 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.91 1n9b n MET 69 Cb 0.65 0.00 0.29 0.00 -0.71 0.00 0.00 33.22 33.45 1n9b n MET 69 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1n9b n SER 70 N -2.03 0.00 0.31 7.83 2.88 -1.26 -2.23 113.62 119.13 1n9b n SER 70 Ca 0.00 0.36 0.21 0.00 -1.33 0.00 0.00 58.87 58.11 1n9b n SER 70 Cb 0.00 -0.42 1.05 0.00 -0.75 0.00 0.00 64.21 64.08 1n9b n SER 70 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1n9b h THR 71 N 0.00 0.00 0.00 2.46 1.35 -1.44 -1.74 112.91 113.54 1n9b h THR 71 Ca 0.00 -0.14 -0.01 0.00 -0.55 0.00 0.00 66.41 65.71 1n9b h THR 71 Cb 0.18 1.12 -0.00 0.00 -1.73 0.00 0.00 68.15 67.72 1n9b h THR 71 CO 0.00 0.00 -0.03 2.19 -0.25 0.00 0.00 175.52 177.43 1n9b h PHE 72 N 0.00 0.00 0.00 4.73 -5.15 -1.60 -2.97 116.94 111.94 1n9b h PHE 72 Ca 0.00 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.74 1n9b h PHE 72 Cb 0.15 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.31 1n9b h PHE 72 CO 0.00 0.03 -0.12 0.87 -2.00 0.00 0.00 178.31 177.08 1n9b h LYS 73 N 0.00 0.00 -0.32 6.09 1.57 -1.57 -0.77 116.57 121.58 1n9b h LYS 73 Ca -0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1n9b h LYS 73 Cb 0.10 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1n9b h LYS 73 CO 0.00 0.12 -0.12 -0.39 -0.57 0.00 0.00 179.45 178.49 1n9b h VAL 74 N 0.00 1.29 -0.57 0.50 -1.51 -1.75 -2.20 116.25 112.02 1n9b h VAL 74 Ca -0.00 -1.21 -0.04 0.00 -1.23 0.00 0.00 66.70 64.22 1n9b h VAL 74 Cb 0.33 1.41 -0.02 0.00 -2.13 0.00 0.00 31.29 30.88 1n9b h VAL 74 CO 0.02 0.39 0.20 -0.37 -1.23 0.00 0.00 177.57 176.57 1n9b h VAL 75 N 0.41 1.23 -0.35 7.19 -1.51 -1.50 -1.33 116.25 120.38 1n9b h VAL 75 Ca 0.07 -0.76 0.08 0.00 -1.23 0.00 0.00 66.70 64.86 1n9b h VAL 75 Cb 0.64 0.66 -0.08 0.00 -2.13 0.00 0.00 31.29 30.39 1n9b h VAL 75 CO 0.04 0.29 -0.16 0.25 -1.23 0.00 0.00 177.57 176.76 1n9b h LEU 76 N 0.78 -0.54 -0.84 4.19 5.85 -1.12 -1.32 115.31 122.31 1n9b h LEU 76 Ca 0.19 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 1n9b h LEU 76 Cb 0.25 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 41.58 1n9b h LEU 76 CO -0.01 -0.19 -0.13 0.00 -0.34 0.00 0.00 178.44 177.77 1n9b h GLY 78 N 2.67 1.07 1.22 0.00 0.00 -0.43 -0.37 103.07 107.24 1n9b h GLY 78 Ca -0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 47.33 46.84 1n9b h GLY 78 CO 0.02 0.39 -0.03 0.00 0.00 0.00 0.00 176.54 176.92 1n9b h ALA 79 N 1.28 0.94 -0.20 3.60 0.00 -0.48 -0.71 119.26 123.69 1n9b h ALA 79 Ca 0.28 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1n9b h ALA 79 Cb -0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1n9b h ALA 79 CO -0.06 0.63 0.13 0.28 0.00 0.00 0.00 179.25 180.23 1n9b h VAL 80 N 0.86 1.07 -0.57 0.00 2.07 -1.05 -2.29 116.25 116.34 1n9b h VAL 80 Ca 0.15 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1n9b h VAL 80 Cb 0.54 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 1n9b h VAL 80 CO 0.03 0.06 0.28 -0.07 0.02 0.00 0.00 177.57 177.90 1n9b h LEU 81 N 0.25 0.71 -0.87 2.57 3.38 -0.82 -1.06 115.31 119.46 1n9b h LEU 81 Ca 0.07 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1n9b h LEU 81 Cb -0.00 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 1n9b h LEU 81 CO -0.01 0.60 0.58 0.00 0.09 0.00 0.00 178.44 179.69 1n9b h ALA 82 N 1.52 1.11 -0.65 1.53 0.00 -0.87 0.08 119.26 121.98 1n9b h ALA 82 Ca 0.20 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1n9b h ALA 82 Cb 0.07 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1n9b h ALA 82 CO -0.03 0.51 0.25 0.00 0.00 0.00 0.00 179.25 179.99 1n9b h ARG 83 N 1.18 0.97 -0.28 0.00 3.08 -0.76 -2.12 114.38 116.46 1n9b h ARG 83 Ca 0.32 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 60.20 1n9b h ARG 83 Cb -0.13 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.74 1n9b h ARG 83 CO -0.07 0.82 0.15 0.28 -1.07 0.00 0.00 179.97 180.08 1n9b h VAL 84 N 0.91 1.01 -0.28 2.04 2.07 -0.65 -0.42 116.25 120.93 1n9b h VAL 84 Ca 0.21 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.63 1n9b h VAL 84 Cb 0.22 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1n9b h VAL 84 CO -0.02 0.06 0.17 0.44 0.02 0.00 0.00 177.57 178.24 1n9b h ASP 85 N 0.31 0.33 0.62 0.57 3.32 -0.81 -1.25 116.42 119.52 1n9b h ASP 85 Ca 0.11 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1n9b h ASP 85 Cb 0.01 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1n9b h ASP 85 CO -0.06 0.26 -0.06 0.00 -1.72 0.00 0.00 179.24 177.66 1n9b n ALA 86 N -2.49 2.58 -0.84 3.45 0.00 -0.81 -4.92 120.51 117.48 1n9b n ALA 86 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1n9b n ALA 86 Cb 0.08 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.11 1n9b n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n9b n GLY 87 N 1.35 0.53 0.48 0.00 0.00 -0.47 -4.93 105.19 102.15 1n9b n GLY 87 Ca 0.12 -0.47 0.12 0.00 0.00 0.00 0.00 46.02 45.79 1n9b n GLY 87 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1n9b n ASP 88 N 0.86 1.86 -3.73 1.61 8.00 -0.22 -4.95 116.55 119.97 1n9b n ASP 88 Ca 0.00 -1.41 -0.10 0.00 0.71 0.00 0.00 54.79 53.99 1n9b n ASP 88 Cb 0.00 0.33 -0.05 0.00 -0.02 0.00 0.00 41.12 41.37 1n9b n ASP 88 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1n9b s GLU 89 N -2.42 1.06 -0.02 -1.24 2.56 -1.13 -4.90 118.70 112.61 1n9b s GLU 89 Ca 0.22 -0.84 0.02 0.00 0.00 0.00 0.00 54.97 54.37 1n9b s GLU 89 Cb 0.19 0.43 0.00 0.00 2.00 0.00 0.00 34.13 36.76 1n9b s GLU 89 CO 0.52 -0.40 -0.08 -0.65 -0.56 0.00 0.00 175.26 174.10 1n9b s GLN 90 N -3.84 0.83 0.55 4.30 -0.21 -1.26 -4.15 119.66 115.87 1n9b s GLN 90 Ca 0.06 -0.25 0.28 0.00 0.02 0.00 0.00 55.36 55.47 1n9b s GLN 90 Cb 0.02 -0.79 1.61 0.00 1.00 0.00 0.00 33.01 34.85 1n9b s GLN 90 CO -0.10 0.08 2.16 -0.07 -2.12 0.00 0.00 175.29 175.24 1n9b h LEU 91 N 6.44 0.00 -0.62 2.90 3.38 -1.96 -2.17 115.31 123.28 1n9b h LEU 91 Ca -0.33 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1n9b h LEU 91 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 1n9b h LEU 91 CO 0.49 0.07 -0.04 -0.33 0.09 0.00 0.00 178.44 178.72 1n9b h GLU 92 N 0.00 0.00 -6.57 1.13 3.07 -1.95 0.17 114.58 110.42 1n9b h GLU 92 Ca -0.00 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.33 1n9b h GLU 92 Cb 0.18 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.13 1n9b h GLU 92 CO 0.01 0.04 1.00 0.50 -1.40 0.00 0.00 179.01 179.15 1n9b s ARG 93 N -3.40 4.17 -0.06 2.33 3.52 -0.81 -4.68 118.95 120.01 1n9b s ARG 93 Ca 0.04 2.49 -0.23 0.00 -0.13 0.00 0.00 55.73 57.90 1n9b s ARG 93 Cb 0.07 -3.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.12 1n9b s ARG 93 CO 0.62 -0.73 0.69 0.15 -0.81 0.00 0.00 175.30 175.22 1n9b s LYS 94 N 1.77 4.43 -0.22 5.12 1.02 -1.26 -0.93 119.74 129.66 1n9b s LYS 94 Ca 0.75 0.86 -0.07 0.00 0.02 0.00 0.00 55.97 57.53 1n9b s LYS 94 Cb -0.46 -3.44 -0.03 0.00 -0.52 0.00 0.00 37.83 33.39 1n9b s LYS 94 CO 0.33 0.10 0.05 0.42 -0.92 0.00 0.00 175.35 175.32 1n9b s ILE 95 N 0.70 4.32 -0.55 2.17 -1.09 0.12 -4.94 121.20 121.93 1n9b s ILE 95 Ca 0.37 -0.18 -0.10 0.00 -2.23 0.00 0.00 60.65 58.50 1n9b s ILE 95 Cb -0.18 -2.98 0.14 0.00 -1.58 0.00 0.00 42.46 37.86 1n9b s ILE 95 CO 0.18 0.40 0.45 -1.00 -1.23 0.00 0.00 174.94 173.73 1n9b s HIS 96 N 1.11 3.44 0.40 3.97 3.76 -1.26 -1.80 115.29 124.91 1n9b s HIS 96 Ca 0.04 -1.89 0.08 0.00 -0.15 0.00 0.00 55.06 53.14 1n9b s HIS 96 Cb -0.14 -3.57 -0.02 0.00 1.11 0.00 0.00 32.58 29.96 1n9b s HIS 96 CO 0.03 -0.98 0.40 1.52 -0.85 0.00 0.00 174.74 174.85 1n9b s TYR 97 N 1.07 2.77 0.27 1.40 1.13 -1.26 -5.04 117.35 117.68 1n9b s TYR 97 Ca 0.08 -0.44 0.10 0.00 -1.41 0.00 0.00 57.07 55.40 1n9b s TYR 97 Cb -0.24 -2.14 -0.04 0.00 -1.10 0.00 0.00 41.96 38.44 1n9b s TYR 97 CO -0.02 -0.11 -0.02 1.03 -2.51 0.00 0.00 175.55 173.92 1n9b s ARG 98 N -4.14 2.25 0.45 -3.49 0.52 -1.26 -4.84 118.95 108.43 1n9b s ARG 98 Ca 0.48 -1.44 0.12 0.00 -0.52 0.00 0.00 55.73 54.37 1n9b s ARG 98 Cb -0.05 -2.13 1.00 0.00 0.52 0.00 0.00 34.95 34.29 1n9b s ARG 98 CO 0.29 0.36 2.03 0.37 0.02 0.00 0.00 175.30 178.37 1n9b h GLN 99 N 1.93 0.14 0.00 3.54 4.15 -1.99 -0.04 115.11 122.84 1n9b h GLN 99 Ca -0.44 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 58.96 1n9b h GLN 99 Cb 1.25 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.91 1n9b h GLN 99 CO 0.60 0.21 0.00 -0.56 -1.93 0.00 0.00 178.83 177.15 1n9b h GLN 100 N 0.14 0.00 0.00 1.69 3.07 -2.05 -2.08 115.11 115.88 1n9b h GLN 100 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.77 1n9b h GLN 100 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.74 1n9b h GLN 100 CO 0.01 0.00 0.00 -0.44 0.09 0.00 0.00 178.83 178.49 1n9b h ASP 101 N 0.00 0.00 -3.83 0.06 3.32 -1.40 -3.46 116.42 111.11 1n9b h ASP 101 Ca 0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 1n9b h ASP 101 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1n9b h ASP 101 CO 0.00 0.00 0.41 -0.76 -1.72 0.00 0.00 179.24 177.17 1n9b s LEU 102 N -4.61 4.47 0.50 1.55 1.43 -0.78 -4.93 118.68 116.31 1n9b s LEU 102 Ca 0.10 2.07 0.05 0.00 -1.03 0.00 0.00 54.13 55.32 1n9b s LEU 102 Cb 0.12 -3.78 -0.00 0.00 0.03 0.00 0.00 46.19 42.55 1n9b s LEU 102 CO 0.60 -0.11 0.22 0.68 0.23 0.00 0.00 176.35 177.97 1n9b s VAL 103 N -1.33 1.68 0.17 -1.59 -7.23 -1.26 -5.07 120.40 105.78 1n9b s VAL 103 Ca 0.47 -1.70 -0.33 0.00 -1.81 0.00 0.00 61.98 58.60 1n9b s VAL 103 Cb -0.26 -2.38 -0.14 0.00 0.56 0.00 0.00 36.38 34.16 1n9b s VAL 103 CO 0.33 0.00 1.58 -0.67 -0.31 0.00 0.00 175.10 176.04 1n9b n ASP 104 N -1.47 3.20 -1.74 4.85 2.03 -1.26 -4.16 116.55 117.99 1n9b n ASP 104 Ca -0.07 1.09 -0.00 0.00 0.52 0.00 0.00 54.79 56.32 1n9b n ASP 104 Cb 0.65 -1.45 0.00 0.00 -0.72 0.00 0.00 41.12 39.60 1n9b n ASP 104 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1n9b n TYR 105 N 3.36 -0.77 -2.89 -0.67 9.36 -1.26 -4.60 117.16 119.69 1n9b n TYR 105 Ca 0.16 0.34 -0.19 0.00 3.32 0.00 0.00 57.90 61.53 1n9b n TYR 105 Cb 0.30 -2.00 -0.01 0.00 -0.63 0.00 0.00 39.34 37.00 1n9b n TYR 105 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1n9b n SER 106 N 0.03 2.37 0.10 2.98 7.64 -1.26 -1.10 113.62 124.39 1n9b n SER 106 Ca 0.00 -3.19 0.04 0.00 1.01 0.00 0.00 58.87 56.74 1n9b n SER 106 Cb 0.02 -0.56 0.46 0.00 -1.01 0.00 0.00 64.21 63.11 1n9b n SER 106 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1n9b h PRO 107 N 2.93 0.30 0.00 1.43 0.13 -1.94 -1.00 132.00 133.85 1n9b h PRO 107 Ca 0.09 -0.04 -0.32 0.00 -0.87 0.00 0.00 66.00 64.86 1n9b h PRO 107 Cb 0.91 -0.06 -0.05 0.00 0.13 0.00 0.00 31.00 31.94 1n9b h PRO 107 CO 0.62 0.29 -1.78 0.28 -0.23 0.00 0.00 178.00 177.18 1n9b n VAL 108 N -4.41 1.53 0.22 1.56 0.31 -1.26 -4.57 118.33 111.71 1n9b n VAL 108 Ca 0.00 -0.17 0.07 0.00 -0.01 0.00 0.00 64.34 64.24 1n9b n VAL 108 Cb 0.15 -2.00 0.53 0.00 -0.91 0.00 0.00 33.84 31.61 1n9b n VAL 108 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1n9b h SER 109 N -1.00 0.00 0.60 4.52 4.64 -1.95 -1.02 113.55 119.34 1n9b h SER 109 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1n9b h SER 109 Cb 1.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 1n9b h SER 109 CO -0.29 0.22 0.00 1.05 -0.87 0.00 0.00 176.83 176.94 1n9b h GLU 110 N 0.00 0.00 -0.00 4.77 4.11 -1.42 -2.62 114.58 119.41 1n9b h GLU 110 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1n9b h GLU 110 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1n9b h GLU 110 CO 0.03 0.00 -0.17 1.63 0.07 0.00 0.00 179.01 180.57 1n9b n LYS 111 N -2.52 0.56 -1.37 1.06 5.02 -0.39 -4.23 118.16 116.29 1n9b n LYS 111 Ca 0.01 -0.22 -0.02 0.00 -2.02 0.00 0.00 58.31 56.06 1n9b n LYS 111 Cb 0.20 -1.50 0.11 0.00 -0.02 0.00 0.00 35.03 33.82 1n9b n LYS 111 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1n9b n HIS 112 N -1.03 0.78 0.22 2.13 8.25 -0.99 -4.73 115.22 119.85 1n9b n HIS 112 Ca 0.12 -1.52 0.08 0.00 -0.26 0.00 0.00 57.72 56.14 1n9b n HIS 112 Cb 0.30 -0.25 0.52 0.00 1.12 0.00 0.00 29.99 31.69 1n9b n HIS 112 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1n9b h LEU 113 N 1.45 0.00 0.06 2.41 3.38 -1.74 -0.31 115.31 120.57 1n9b h LEU 113 Ca 0.02 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.71 1n9b h LEU 113 Cb 1.35 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.07 1n9b h LEU 113 CO 0.22 0.24 -1.50 0.00 0.09 0.00 0.00 178.44 177.49 1n9b h ALA 114 N 1.76 0.44 -0.00 1.53 0.00 -1.91 -3.41 119.26 117.66 1n9b h ALA 114 Ca -0.00 -1.18 0.00 0.00 0.00 0.00 0.00 54.91 53.72 1n9b h ALA 114 Cb 0.53 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1n9b h ALA 114 CO 0.03 1.30 -0.07 -0.40 0.00 0.00 0.00 179.25 180.11 1n9b n ASP 115 N -3.32 0.39 -0.25 0.00 5.75 -1.18 -5.11 116.55 112.83 1n9b n ASP 115 Ca -0.14 -0.70 0.03 0.00 -0.01 0.00 0.00 54.79 53.98 1n9b n ASP 115 Cb 1.02 0.73 -0.01 0.00 -1.03 0.00 0.00 41.12 41.84 1n9b n ASP 115 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n9b n GLY 116 N 0.81 -1.42 2.95 6.12 0.00 -0.14 -4.94 105.19 108.57 1n9b n GLY 116 Ca 0.01 -1.47 -0.11 0.00 0.00 0.00 0.00 46.02 44.45 1n9b n GLY 116 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1n9b s MET 117 N -1.27 0.24 0.72 1.61 -1.94 -0.74 -4.87 119.30 113.05 1n9b s MET 117 Ca 0.00 -0.42 -0.11 0.00 -1.71 0.00 0.00 55.69 53.46 1n9b s MET 117 Cb 0.00 0.01 0.02 0.00 2.01 0.00 0.00 34.83 36.87 1n9b s MET 117 CO 0.00 -0.02 1.07 0.95 -0.01 0.00 0.00 175.02 177.01 1n9b s THR 118 N -0.94 3.79 0.21 2.05 -4.23 -1.26 -0.70 115.64 114.57 1n9b s THR 118 Ca -0.10 0.58 -0.09 0.00 -1.18 0.00 0.00 61.69 60.91 1n9b s THR 118 Cb -0.07 -3.24 0.16 0.00 1.34 0.00 0.00 72.50 70.69 1n9b s THR 118 CO -0.01 -0.76 1.74 0.58 -0.54 0.00 0.00 174.62 175.64 1n9b h VAL 119 N -0.86 0.75 -0.68 2.29 2.07 -0.89 0.75 116.25 119.70 1n9b h VAL 119 Ca -0.44 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 66.86 1n9b h VAL 119 Cb 1.22 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 1n9b h VAL 119 CO 0.55 0.08 0.13 1.23 0.02 0.00 0.00 177.57 179.58 1n9b h GLY 120 N 0.42 1.18 1.31 2.17 0.00 -1.23 -1.08 103.07 105.84 1n9b h GLY 120 Ca 0.32 -0.76 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1n9b h GLY 120 CO -0.32 0.71 0.45 0.83 0.00 0.00 0.00 176.54 178.20 1n9b h GLU 121 N 1.03 0.92 -0.37 4.80 5.08 -1.60 -0.80 114.58 123.64 1n9b h GLU 121 Ca 0.21 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1n9b h GLU 121 Cb 0.41 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1n9b h GLU 121 CO 0.01 0.62 0.15 -0.07 -1.00 0.00 0.00 179.01 178.72 1n9b h LEU 122 N 0.95 0.51 -0.69 1.33 3.38 -0.32 0.69 115.31 121.15 1n9b h LEU 122 Ca 0.25 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1n9b h LEU 122 Cb -0.08 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1n9b h LEU 122 CO -0.05 0.54 0.35 0.00 0.09 0.00 0.00 178.44 179.36 1n9b h ALA 124 N 1.17 1.00 -0.49 0.00 0.00 -0.90 -0.18 119.26 119.85 1n9b h ALA 124 Ca 0.24 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1n9b h ALA 124 Cb 0.09 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1n9b h ALA 124 CO -0.03 0.40 0.03 0.00 0.00 0.00 0.00 179.25 179.65 1n9b h ALA 125 N 1.29 0.66 0.05 0.00 0.00 -0.46 0.19 119.26 120.99 1n9b h ALA 125 Ca 0.29 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1n9b h ALA 125 Cb -0.12 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1n9b h ALA 125 CO -0.07 0.44 -0.02 0.00 0.00 0.00 0.00 179.25 179.60 1n9b h ALA 126 N 0.94 -0.06 0.03 0.00 0.00 -0.63 -1.45 119.26 118.10 1n9b h ALA 126 Ca 0.14 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1n9b h ALA 126 Cb 0.47 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.30 1n9b h ALA 126 CO 0.02 -0.50 -0.44 0.82 0.00 0.00 0.00 179.25 179.15 1n9b h ILE 127 N -0.13 1.54 0.00 0.00 2.04 -1.00 -2.26 117.51 117.70 1n9b h ILE 127 Ca -0.01 -2.17 -0.00 0.00 1.00 0.00 0.00 64.86 63.68 1n9b h ILE 127 Cb 0.11 2.91 -0.00 0.00 -0.74 0.00 0.00 36.82 39.10 1n9b h ILE 127 CO 0.01 0.60 -0.79 0.71 0.00 0.00 0.00 178.15 178.68 1n9b h THR 128 N -0.43 0.00 0.00 -0.27 1.35 -0.71 -3.36 112.91 109.49 1n9b h THR 128 Ca -0.07 -1.00 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1n9b h THR 128 Cb 1.24 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.26 1n9b h THR 128 CO 0.09 0.00 0.00 0.23 -0.25 0.00 0.00 175.52 175.59 1n9b n MET 129 N -2.77 1.96 -2.58 4.72 2.81 -0.62 -0.70 117.12 119.93 1n9b n MET 129 Ca 0.01 -0.29 -0.21 0.00 -1.81 0.00 0.00 57.70 55.40 1n9b n MET 129 Cb 0.55 -0.78 0.01 0.00 -0.71 0.00 0.00 33.22 32.28 1n9b n MET 129 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1n9b n SER 130 N -0.36 -5.85 -4.66 7.83 7.64 -0.85 -4.92 113.62 112.45 1n9b n SER 130 Ca 0.00 -0.10 -0.42 0.00 1.01 0.00 0.00 58.87 59.35 1n9b n SER 130 Cb 0.01 -4.80 -0.03 0.00 -1.01 0.00 0.00 64.21 58.38 1n9b n SER 130 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1n9b s ASP 131 N -2.29 6.66 0.10 6.43 -1.08 -0.75 -4.90 116.67 120.84 1n9b s ASP 131 Ca 0.10 2.27 -0.08 0.00 -0.52 0.00 0.00 52.55 54.31 1n9b s ASP 131 Cb -0.04 -2.54 -0.18 0.00 -1.46 0.00 0.00 42.92 38.70 1n9b s ASP 131 CO 0.12 -0.92 1.23 0.78 0.52 0.00 0.00 175.17 176.90 1n9b h ASN 132 N 9.40 0.65 -0.28 -0.34 2.35 -1.36 -2.54 115.58 123.45 1n9b h ASN 132 Ca -0.40 -0.56 -0.14 0.00 -0.55 0.00 0.00 56.30 54.66 1n9b h ASN 132 Cb 1.18 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.34 1n9b h ASN 132 CO 0.95 1.37 -0.34 0.28 -1.65 0.00 0.00 177.43 178.04 1n9b h SER 133 N 0.25 0.85 -0.64 5.81 0.02 -1.83 -1.47 113.55 116.54 1n9b h SER 133 Ca -0.12 -0.36 0.05 0.00 -0.84 0.00 0.00 61.79 60.52 1n9b h SER 133 Cb 1.72 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 63.97 1n9b h SER 133 CO 0.19 1.11 0.37 0.00 -1.14 0.00 0.00 176.83 177.36 1n9b h ALA 134 N 0.94 0.85 -0.54 3.77 0.00 -1.89 -0.73 119.26 121.65 1n9b h ALA 134 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1n9b h ALA 134 Cb 0.89 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1n9b h ALA 134 CO 0.08 0.08 0.30 0.00 0.00 0.00 0.00 179.25 179.71 1n9b h ALA 135 N 1.31 0.69 -0.51 0.00 0.00 -1.20 -1.55 119.26 118.01 1n9b h ALA 135 Ca 0.28 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1n9b h ALA 135 Cb 0.12 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1n9b h ALA 135 CO -0.15 0.21 0.02 -0.91 0.00 0.00 0.00 179.25 178.41 1n9b h ASN 136 N 0.73 0.82 -0.45 0.00 2.35 -0.79 0.12 115.58 118.37 1n9b h ASN 136 Ca 0.19 -0.20 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1n9b h ASN 136 Cb 0.04 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1n9b h ASN 136 CO -0.03 0.87 0.24 -0.07 -1.65 0.00 0.00 177.43 176.79 1n9b h LEU 137 N 0.80 0.56 -0.65 1.61 3.38 -0.87 -1.76 115.31 118.38 1n9b h LEU 137 Ca 0.16 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1n9b h LEU 137 Cb 0.45 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1n9b h LEU 137 CO 0.02 0.50 0.05 -0.07 0.09 0.00 0.00 178.44 179.03 1n9b h LEU 138 N 0.58 1.07 -0.89 1.67 3.38 -1.01 -2.95 115.31 117.17 1n9b h LEU 138 Ca 0.16 -0.28 0.03 0.00 0.09 0.00 0.00 57.88 57.88 1n9b h LEU 138 Cb 0.06 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 1n9b h LEU 138 CO -0.02 1.09 0.58 -0.07 0.09 0.00 0.00 178.44 180.10 1n9b h LEU 139 N 1.02 0.96 -2.14 1.67 3.38 -0.44 -0.93 115.31 118.83 1n9b h LEU 139 Ca 0.19 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1n9b h LEU 139 Cb 0.51 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1n9b h LEU 139 CO 0.02 0.66 0.00 0.00 0.09 0.00 0.00 178.44 179.21 1n9b h ALA 140 N 1.37 1.00 0.00 1.53 0.00 -1.15 0.15 119.26 122.15 1n9b h ALA 140 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1n9b h ALA 140 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1n9b h ALA 140 CO -0.12 0.00 0.00 1.79 0.00 0.00 0.00 179.25 180.92 1n9b h THR 141 N 0.00 0.00 -0.47 0.00 1.35 -1.09 -3.29 112.91 109.41 1n9b h THR 141 Ca 0.00 -0.96 0.00 0.00 -0.55 0.00 0.00 66.41 64.90 1n9b h THR 141 Cb 0.28 1.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 1n9b h THR 141 CO 0.00 0.00 0.00 1.33 -0.25 0.00 0.00 175.52 176.60 1n9b n VAL 142 N -3.05 1.78 -0.86 6.82 0.24 -0.90 -4.94 118.33 117.43 1n9b n VAL 142 Ca 0.04 -1.34 0.00 0.00 -2.04 0.00 0.00 64.34 61.00 1n9b n VAL 142 Cb 0.52 0.11 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 1n9b n VAL 142 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n9b n GLY 143 N 0.54 0.76 6.74 7.63 0.00 -1.14 -3.87 105.19 115.86 1n9b n GLY 143 Ca 0.21 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1n9b n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n9b n GLY 144 N -1.99 -1.80 0.29 -0.02 0.00 0.47 -1.49 105.19 100.66 1n9b n GLY 144 Ca 0.00 -1.31 0.05 0.00 0.00 0.00 0.00 46.02 44.76 1n9b n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n9b h PRO 145 N 0.00 0.59 -0.73 1.61 0.11 -1.84 -0.07 132.00 131.67 1n9b h PRO 145 Ca 0.00 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.02 1n9b h PRO 145 Cb 0.01 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 30.96 1n9b h PRO 145 CO 0.00 0.39 0.25 0.00 -0.21 0.00 0.00 178.00 178.43 1n9b h ALA 146 N 1.52 1.06 -0.60 -0.75 0.00 -1.74 -0.95 119.26 117.79 1n9b h ALA 146 Ca 0.42 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 1n9b h ALA 146 Cb 0.55 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1n9b h ALA 146 CO -0.34 0.65 -0.01 0.78 0.00 0.00 0.00 179.25 180.33 1n9b h GLY 147 N 1.11 1.15 1.13 0.00 0.00 -0.05 -0.76 103.07 105.65 1n9b h GLY 147 Ca 0.24 -0.85 -0.10 0.00 0.00 0.00 0.00 47.33 46.62 1n9b h GLY 147 CO -0.01 0.78 -0.00 -2.00 0.00 0.00 0.00 176.54 175.31 1n9b h LEU 148 N 0.97 1.02 -0.64 3.11 5.85 -0.85 -1.19 115.31 123.59 1n9b h LEU 148 Ca 0.17 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 1n9b h LEU 148 Cb 0.57 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 1n9b h LEU 148 CO 0.03 1.07 0.27 0.74 -0.34 0.00 0.00 178.44 180.21 1n9b h THR 149 N 0.95 1.23 -0.78 1.05 2.02 -0.98 -1.37 112.91 115.05 1n9b h THR 149 Ca 0.17 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1n9b h THR 149 Cb 0.55 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 1n9b h THR 149 CO 0.03 0.29 0.50 0.00 0.37 0.00 0.00 175.52 176.70 1n9b h ALA 150 N 1.11 0.98 -0.54 6.16 0.00 -0.90 -1.28 119.26 124.79 1n9b h ALA 150 Ca 0.21 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1n9b h ALA 150 Cb 0.19 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.62 1n9b h ALA 150 CO -0.02 0.42 0.27 0.35 0.00 0.00 0.00 179.25 180.27 1n9b h PHE 151 N 1.06 0.49 -0.51 0.00 3.57 -0.77 -0.83 116.94 119.94 1n9b h PHE 151 Ca 0.28 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.85 1n9b h PHE 151 Cb -0.09 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.47 1n9b h PHE 151 CO -0.01 0.22 0.26 -0.07 -2.23 0.00 0.00 178.31 176.48 1n9b h LEU 152 N 0.51 0.38 -1.27 0.59 3.38 -0.65 -1.52 115.31 116.73 1n9b h LEU 152 Ca 0.25 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 1n9b h LEU 152 Cb 0.18 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1n9b h LEU 152 CO -0.18 0.26 0.41 0.03 0.09 0.00 0.00 178.44 179.04 1n9b h ARG 153 N 0.51 0.90 0.00 1.13 2.47 -0.75 -0.91 114.38 117.73 1n9b h ARG 153 Ca 0.22 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 58.84 1n9b h ARG 153 Cb 0.12 -0.19 -0.00 0.00 -1.65 0.00 0.00 29.97 28.25 1n9b h ARG 153 CO -0.15 0.63 -0.13 1.96 0.56 0.00 0.00 179.97 182.84 1n9b h GLN 154 N 0.92 0.00 -0.58 0.04 4.20 -0.20 -1.92 115.11 117.56 1n9b h GLN 154 Ca 0.24 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.95 1n9b h GLN 154 Cb -0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.74 1n9b h GLN 154 CO -0.05 0.13 0.00 0.44 -0.67 0.00 0.00 178.83 178.69 1n9b n ILE 155 N -3.30 0.77 -0.50 2.54 -5.35 -0.72 -4.96 119.36 107.84 1n9b n ILE 155 Ca 0.00 -0.83 0.00 0.00 -0.27 0.00 0.00 62.75 61.65 1n9b n ILE 155 Cb 0.37 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 38.82 1n9b n ILE 155 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1n9b n GLY 156 N 1.53 0.73 3.47 3.28 0.00 -0.72 -5.04 105.19 108.44 1n9b n GLY 156 Ca 0.21 -0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1n9b n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n9b s ASP 157 N -2.18 6.26 -0.01 1.61 -1.08 -0.40 -4.92 116.67 115.95 1n9b s ASP 157 Ca 0.00 -0.69 0.21 0.00 -0.52 0.00 0.00 52.55 51.55 1n9b s ASP 157 Cb 0.00 -2.31 0.63 0.00 -1.46 0.00 0.00 42.92 39.78 1n9b s ASP 157 CO 0.00 -0.90 1.53 0.59 0.52 0.00 0.00 175.17 176.91 1n9b n ASN 158 N 6.34 3.86 -0.00 -0.34 3.02 -1.26 -3.10 115.26 123.78 1n9b n ASN 158 Ca -0.04 -2.05 -0.00 0.00 -0.03 0.00 0.00 54.58 52.45 1n9b n ASN 158 Cb 0.46 -0.48 -0.00 0.00 -0.61 0.00 0.00 39.78 39.15 1n9b n ASN 158 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1n9b n VAL 159 N 1.50 0.01 -1.78 2.41 0.31 -1.26 -5.04 118.33 114.46 1n9b n VAL 159 Ca 0.24 -0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 64.16 1n9b n VAL 159 Cb 0.63 -1.39 0.01 0.00 -0.91 0.00 0.00 33.84 32.17 1n9b n VAL 159 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1n9b s THR 160 N -2.00 2.03 -0.09 2.52 2.01 -1.26 -4.83 115.64 114.01 1n9b s THR 160 Ca -0.00 0.02 -0.06 0.00 0.31 0.00 0.00 61.69 61.97 1n9b s THR 160 Cb 0.00 -3.01 0.04 0.00 0.01 0.00 0.00 72.50 69.53 1n9b s THR 160 CO 0.00 0.00 0.22 0.00 -0.69 0.00 0.00 174.62 174.15 1n9b s ARG 161 N -2.33 0.20 -0.13 4.92 1.70 -0.40 -4.94 118.95 117.97 1n9b s ARG 161 Ca 0.58 0.42 -0.02 0.00 -0.47 0.00 0.00 55.73 56.24 1n9b s ARG 161 Cb -0.45 -0.05 -0.03 0.00 -0.57 0.00 0.00 34.95 33.86 1n9b s ARG 161 CO 0.59 -0.12 -0.05 -1.17 -1.08 0.00 0.00 175.30 173.48 1n9b s LEU 162 N 0.84 3.21 0.00 -1.89 2.96 -1.26 -2.10 118.68 120.43 1n9b s LEU 162 Ca -0.06 -0.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.74 1n9b s LEU 162 Cb -0.07 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.86 1n9b s LEU 162 CO -0.05 0.22 0.00 0.47 -1.32 0.00 0.00 176.35 175.67 1n9b n ASP 163 N 3.22 4.49 -4.45 3.68 8.00 -1.26 -4.27 116.55 125.96 1n9b n ASP 163 Ca -0.18 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.08 1n9b n ASP 163 Cb 0.53 0.42 -0.10 0.00 -0.02 0.00 0.00 41.12 41.94 1n9b n ASP 163 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1n9b s ARG 164 N -1.91 1.81 0.43 -1.24 0.52 -1.26 -4.86 118.95 112.43 1n9b s ARG 164 Ca 0.00 -2.04 0.08 0.00 -0.52 0.00 0.00 55.73 53.25 1n9b s ARG 164 Cb 0.00 -1.02 0.01 0.00 0.52 0.00 0.00 34.95 34.47 1n9b s ARG 164 CO 0.00 -0.23 0.59 -1.58 0.02 0.00 0.00 175.30 174.10 1n9b s TRP 165 N -3.14 2.74 0.28 -0.53 0.52 -1.26 -4.71 118.94 112.85 1n9b s TRP 165 Ca 0.31 -0.40 -0.29 0.00 0.02 0.00 0.00 56.10 55.74 1n9b s TRP 165 Cb 0.07 -2.39 -0.10 0.00 -1.15 0.00 0.00 33.47 29.91 1n9b s TRP 165 CO 0.15 -0.47 1.27 -1.21 0.02 0.00 0.00 176.95 176.70 1n9b s GLU 166 N -4.38 4.42 0.00 4.98 0.41 -1.26 -1.62 118.70 121.25 1n9b s GLU 166 Ca 0.55 2.09 0.20 0.00 -0.41 0.00 0.00 54.97 57.41 1n9b s GLU 166 Cb -0.10 -3.13 0.19 0.00 -1.78 0.00 0.00 34.13 29.31 1n9b s GLU 166 CO 0.34 -0.13 1.16 0.25 -0.49 0.00 0.00 175.26 176.38 1n9b n THR 167 N 1.42 0.08 0.27 3.63 -2.24 -1.26 -4.91 114.28 111.27 1n9b n THR 167 Ca 0.02 -0.54 0.12 0.00 -2.27 0.00 0.00 64.05 61.38 1n9b n THR 167 Cb 0.43 1.35 0.76 0.00 -2.10 0.00 0.00 70.33 70.76 1n9b n THR 167 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1n9b h GLU 168 N 3.91 0.00 0.00 -0.78 3.07 -1.77 -2.14 114.58 116.87 1n9b h GLU 168 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1n9b h GLU 168 Cb 0.84 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.75 1n9b h GLU 168 CO 0.00 0.07 0.00 1.47 -1.40 0.00 0.00 179.01 179.15 1n9b n LEU 169 N -3.92 0.33 -0.79 1.33 -0.00 -0.64 -1.98 117.00 111.34 1n9b n LEU 169 Ca -0.02 0.62 0.08 0.00 -0.00 0.00 0.00 56.01 56.69 1n9b n LEU 169 Cb 0.16 -0.62 0.24 0.00 -0.00 0.00 0.00 43.42 43.20 1n9b n LEU 169 CO 0.30 -0.61 0.69 0.59 -0.00 0.00 0.00 177.39 178.36 1n9b n ASN 170 N -1.91 2.30 -0.11 1.45 3.02 -0.80 -4.56 115.26 114.66 1n9b n ASN 170 Ca 0.01 -1.93 -0.02 0.00 -0.03 0.00 0.00 54.58 52.60 1n9b n ASN 170 Cb 0.09 -0.25 0.22 0.00 -0.61 0.00 0.00 39.78 39.24 1n9b n ASN 170 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1n9b h GLU 171 N 2.66 0.78 -5.83 3.52 4.81 -1.60 -3.44 114.58 115.48 1n9b h GLU 171 Ca 0.00 -0.14 -0.38 0.00 -0.13 0.00 0.00 59.36 58.70 1n9b h GLU 171 Cb 0.60 -0.13 0.13 0.00 0.63 0.00 0.00 28.75 29.98 1n9b h GLU 171 CO 0.00 0.69 -0.73 0.00 -0.73 0.00 0.00 179.01 178.24 1n9b n ALA 172 N -2.46 -1.62 -1.77 2.92 0.00 -1.26 -4.71 120.51 111.61 1n9b n ALA 172 Ca 0.04 0.18 -0.40 0.00 0.00 0.00 0.00 53.44 53.26 1n9b n ALA 172 Cb 0.20 -4.07 -0.01 0.00 0.00 0.00 0.00 19.45 15.57 1n9b n ALA 172 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1n9b s LEU 173 N -6.92 4.30 0.23 0.00 1.43 -1.26 -4.90 118.68 111.55 1n9b s LEU 173 Ca 0.34 2.62 -0.31 0.00 -1.03 0.00 0.00 54.13 55.74 1n9b s LEU 173 Cb -0.15 -3.82 -0.13 0.00 0.03 0.00 0.00 46.19 42.11 1n9b s LEU 173 CO 0.74 -0.70 1.49 -2.65 0.23 0.00 0.00 176.35 175.46 1n9b n PRO 174 N 0.38 2.21 -0.89 1.29 -0.02 -1.26 -2.22 135.00 134.50 1n9b n PRO 174 Ca 0.02 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1n9b n PRO 174 Cb 0.43 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 1n9b n PRO 174 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n9b n GLY 175 N 2.45 0.73 3.66 -1.23 0.00 -1.26 -4.99 105.19 104.55 1n9b n GLY 175 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 1n9b n GLY 175 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n9b s ASP 176 N -2.70 6.74 0.04 1.61 -1.08 -0.94 -4.95 116.67 115.38 1n9b s ASP 176 Ca 0.00 0.90 0.28 0.00 -0.52 0.00 0.00 52.55 53.21 1n9b s ASP 176 Cb 0.00 -2.37 1.11 0.00 -1.46 0.00 0.00 42.92 40.20 1n9b s ASP 176 CO 0.00 -0.30 1.86 0.00 0.52 0.00 0.00 175.17 177.26 1n9b n ALA 177 N 5.08 2.41 -1.76 3.66 0.00 -1.26 -4.88 120.51 123.75 1n9b n ALA 177 Ca -0.00 -0.10 -0.40 0.00 0.00 0.00 0.00 53.44 52.93 1n9b n ALA 177 Cb 0.49 -1.44 0.01 0.00 0.00 0.00 0.00 19.45 18.51 1n9b n ALA 177 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1n9b n ARG 178 N -1.64 2.32 -3.49 0.00 1.74 -1.26 -3.54 116.66 110.80 1n9b n ARG 178 Ca 0.07 0.82 -0.22 0.00 -0.77 0.00 0.00 57.85 57.75 1n9b n ARG 178 Cb 0.36 -2.61 0.07 0.00 -1.02 0.00 0.00 32.46 29.26 1n9b n ARG 178 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1n9b n ASP 179 N 0.01 -5.98 -4.46 0.55 8.00 -1.13 -4.90 116.55 108.64 1n9b n ASP 179 Ca 0.04 -0.49 -0.24 0.00 0.71 0.00 0.00 54.79 54.82 1n9b n ASP 179 Cb 0.41 -4.60 -0.10 0.00 -0.02 0.00 0.00 41.12 36.80 1n9b n ASP 179 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1n9b s THR 180 N -3.29 2.42 0.34 -3.53 -4.23 -0.89 -1.63 115.64 104.83 1n9b s THR 180 Ca 0.53 -2.39 0.05 0.00 -1.18 0.00 0.00 61.69 58.70 1n9b s THR 180 Cb -0.23 -2.28 -0.02 0.00 1.34 0.00 0.00 72.50 71.31 1n9b s THR 180 CO 0.66 -0.41 0.19 1.07 -0.54 0.00 0.00 174.62 175.58 1n9b n THR 181 N -0.59 0.00 -4.43 3.99 5.66 -0.51 -1.27 114.28 117.12 1n9b n THR 181 Ca -0.05 -2.19 -0.26 0.00 -3.05 0.00 0.00 64.05 58.50 1n9b n THR 181 Cb 0.60 0.93 -0.11 0.00 -1.55 0.00 0.00 70.33 70.20 1n9b n THR 181 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1n9b s THR 182 N -3.08 2.49 0.21 1.09 -4.23 -1.26 -0.91 115.64 109.95 1n9b s THR 182 Ca 0.27 -2.15 -0.09 0.00 -1.18 0.00 0.00 61.69 58.53 1n9b s THR 182 Cb 0.01 -2.24 0.14 0.00 1.34 0.00 0.00 72.50 71.75 1n9b s THR 182 CO 0.19 -0.23 1.79 -0.65 -0.54 0.00 0.00 174.62 175.18 1n9b h PRO 183 N 2.78 0.60 -0.54 3.99 0.11 -1.69 -0.53 132.00 136.71 1n9b h PRO 183 Ca -0.44 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1n9b h PRO 183 Cb 1.23 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1n9b h PRO 183 CO 0.53 0.40 0.26 0.00 -0.21 0.00 0.00 178.00 178.98 1n9b h ALA 184 N 1.37 0.70 -0.30 -0.75 0.00 -1.52 -0.99 119.26 117.77 1n9b h ALA 184 Ca 0.30 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1n9b h ALA 184 Cb 0.24 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1n9b h ALA 184 CO -0.21 0.27 -0.12 0.77 0.00 0.00 0.00 179.25 179.96 1n9b h SER 185 N 0.73 0.63 -0.42 0.00 0.02 -1.66 -1.75 113.55 111.11 1n9b h SER 185 Ca 0.19 -0.39 -0.03 0.00 -0.84 0.00 0.00 61.79 60.72 1n9b h SER 185 Cb 0.13 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1n9b h SER 185 CO -0.02 0.88 0.14 -0.03 -1.14 0.00 0.00 176.83 176.66 1n9b h MET 186 N 0.38 0.64 -0.45 3.45 -1.53 -1.03 0.40 114.93 116.79 1n9b h MET 186 Ca 0.07 -0.13 0.00 0.00 -3.44 0.00 0.00 59.70 56.20 1n9b h MET 186 Cb 0.63 -0.10 -0.02 0.00 -0.55 0.00 0.00 31.60 31.56 1n9b h MET 186 CO 0.04 0.62 0.28 0.00 0.14 0.00 0.00 176.91 177.99 1n9b h ALA 187 N 0.99 0.57 -0.69 0.39 0.00 -1.14 0.08 119.26 119.45 1n9b h ALA 187 Ca 0.14 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1n9b h ALA 187 Cb 0.23 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1n9b h ALA 187 CO -0.01 0.04 0.25 0.00 0.00 0.00 0.00 179.25 179.53 1n9b h ALA 188 N 1.14 0.90 -0.31 0.00 0.00 -1.10 -1.25 119.26 118.66 1n9b h ALA 188 Ca 0.16 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1n9b h ALA 188 Cb -0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1n9b h ALA 188 CO -0.03 0.55 0.04 1.15 0.00 0.00 0.00 179.25 180.96 1n9b h THR 189 N 1.00 1.24 -0.64 0.00 2.02 -0.66 -0.48 112.91 115.39 1n9b h THR 189 Ca 0.23 -0.82 0.04 0.00 0.77 0.00 0.00 66.41 66.62 1n9b h THR 189 Cb 0.25 1.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 1n9b h THR 189 CO -0.01 0.27 0.38 -0.07 0.37 0.00 0.00 175.52 176.46 1n9b h LEU 190 N 0.33 0.61 -0.76 2.58 -0.00 -0.81 -0.93 115.31 116.34 1n9b h LEU 190 Ca 0.09 0.01 -0.00 0.00 -0.00 0.00 0.00 57.88 57.98 1n9b h LEU 190 Cb 0.36 -0.12 -0.04 0.00 -0.00 0.00 0.00 40.66 40.86 1n9b h LEU 190 CO 0.01 0.42 0.46 -0.09 -0.00 0.00 0.00 178.44 179.23 1n9b h ARG 191 N 0.74 1.03 -0.34 1.13 2.43 -0.97 -0.39 114.38 118.00 1n9b h ARG 191 Ca 0.26 -0.09 0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1n9b h ARG 191 Cb 0.06 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.37 1n9b h ARG 191 CO -0.12 0.73 0.18 0.87 -1.51 0.00 0.00 179.97 180.11 1n9b h LYS 192 N 1.03 0.35 -0.50 0.20 1.57 -0.54 -0.63 116.57 118.05 1n9b h LYS 192 Ca 0.27 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.92 1n9b h LYS 192 Cb -0.04 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 1n9b h LYS 192 CO -0.05 0.23 -0.12 -0.07 -0.57 0.00 0.00 179.45 178.87 1n9b h LEU 193 N 0.36 0.95 0.00 2.94 3.38 -0.77 -2.64 115.31 119.54 1n9b h LEU 193 Ca 0.14 -0.31 -0.22 0.00 0.09 0.00 0.00 57.88 57.58 1n9b h LEU 193 Cb 0.04 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1n9b h LEU 193 CO -0.09 1.07 -1.13 -0.07 0.09 0.00 0.00 178.44 178.31 1n9b h LEU 194 N 0.84 0.00 0.00 1.67 3.38 -0.89 -3.43 115.31 116.88 1n9b h LEU 194 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1n9b h LEU 194 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1n9b h LEU 194 CO 0.05 0.98 -0.20 0.35 0.09 0.00 0.00 178.44 179.70 1n9b n THR 195 N -3.28 0.00 1.67 0.22 -2.24 -0.26 -4.85 114.28 105.54 1n9b n THR 195 Ca -0.03 -0.08 0.14 0.00 -2.27 0.00 0.00 64.05 61.80 1n9b n THR 195 Cb 0.95 0.56 0.64 0.00 -2.10 0.00 0.00 70.33 70.38 1n9b n THR 195 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1n9b n SER 196 N -0.48 0.92 -1.05 3.42 3.41 -0.99 -4.89 113.62 113.95 1n9b n SER 196 Ca 0.00 -1.36 -0.14 0.00 -0.26 0.00 0.00 58.87 57.11 1n9b n SER 196 Cb 0.00 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 63.88 1n9b n SER 196 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n9b n GLN 197 N -0.26 -1.04 -0.12 4.33 6.02 -1.26 -4.88 117.38 120.16 1n9b n GLN 197 Ca 0.20 0.97 -0.13 0.00 -0.01 0.00 0.00 57.00 58.03 1n9b n GLN 197 Cb 0.25 -5.09 -0.02 0.00 1.02 0.00 0.00 30.24 26.40 1n9b n GLN 197 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1n9b h ARG 198 N 0.02 0.92 -6.62 -1.09 3.08 -1.90 -3.43 114.38 105.36 1n9b h ARG 198 Ca -0.28 -0.47 -0.51 0.00 0.07 0.00 0.00 59.98 58.79 1n9b h ARG 198 Cb 0.94 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 1n9b h ARG 198 CO 0.41 1.12 -0.03 -0.51 -1.07 0.00 0.00 179.97 179.90 1n9b s LEU 199 N -8.94 4.00 1.01 3.04 1.43 -1.26 -5.03 118.68 112.93 1n9b s LEU 199 Ca -0.11 0.94 -0.11 0.00 -1.03 0.00 0.00 54.13 53.82 1n9b s LEU 199 Cb 0.11 -3.77 0.20 0.00 0.03 0.00 0.00 46.19 42.76 1n9b s LEU 199 CO 0.87 -0.24 1.08 -0.94 0.23 0.00 0.00 176.35 177.36 1n9b s SER 200 N -2.92 2.27 0.14 2.29 1.04 -1.26 -4.68 113.70 110.58 1n9b s SER 200 Ca 0.48 1.74 -0.17 0.00 0.48 0.00 0.00 55.95 58.48 1n9b s SER 200 Cb -0.11 -2.37 0.01 0.00 0.10 0.00 0.00 66.02 63.66 1n9b s SER 200 CO 0.27 -3.43 1.77 0.00 0.98 0.00 0.00 173.24 172.83 1n9b h ALA 201 N -2.10 0.37 -0.86 5.32 0.00 -1.98 0.45 119.26 120.45 1n9b h ALA 201 Ca -0.52 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1n9b h ALA 201 Cb 1.30 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 1n9b h ALA 201 CO 0.48 -0.25 0.51 -0.09 0.00 0.00 0.00 179.25 179.91 1n9b h ARG 202 N 0.30 1.18 -0.44 0.00 2.43 -1.99 -1.35 114.38 114.51 1n9b h ARG 202 Ca 0.13 -0.12 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 1n9b h ARG 202 Cb 0.06 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1n9b h ARG 202 CO -0.10 0.84 -0.04 0.66 -1.51 0.00 0.00 179.97 179.81 1n9b h SER 203 N 1.19 0.79 -0.69 -3.80 4.64 -1.78 -0.39 113.55 113.52 1n9b h SER 203 Ca 0.31 -0.33 0.05 0.00 -0.47 0.00 0.00 61.79 61.35 1n9b h SER 203 Cb -0.03 -0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 61.79 1n9b h SER 203 CO -0.06 0.94 0.40 1.56 -0.87 0.00 0.00 176.83 178.80 1n9b h GLN 204 N 0.64 0.72 -0.49 4.77 4.20 -0.67 -0.99 115.11 123.28 1n9b h GLN 204 Ca 0.12 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.71 1n9b h GLN 204 Cb 0.56 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 1n9b h GLN 204 CO 0.03 0.48 0.01 0.00 -0.67 0.00 0.00 178.83 178.67 1n9b h ARG 205 N 0.74 0.81 -0.34 1.46 3.08 -1.03 -2.40 114.38 116.71 1n9b h ARG 205 Ca 0.30 -0.22 -0.05 0.00 0.07 0.00 0.00 59.98 60.08 1n9b h ARG 205 Cb 0.15 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1n9b h ARG 205 CO -0.16 0.81 0.03 0.37 -1.07 0.00 0.00 179.97 179.95 1n9b h GLN 206 N 0.76 0.58 -0.45 0.04 5.75 -0.57 -1.42 115.11 119.79 1n9b h GLN 206 Ca 0.15 -0.17 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 1n9b h GLN 206 Cb 0.45 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.92 1n9b h GLN 206 CO 0.02 0.68 0.25 1.25 -2.65 0.00 0.00 178.83 178.38 1n9b h LEU 207 N 0.40 0.57 -0.29 -2.39 5.85 -1.07 -0.95 115.31 117.43 1n9b h LEU 207 Ca 0.10 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.75 1n9b h LEU 207 Cb 0.40 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1n9b h LEU 207 CO 0.01 0.50 0.12 0.25 -0.34 0.00 0.00 178.44 178.98 1n9b h LEU 208 N 0.59 0.17 -0.92 2.25 5.85 -1.41 -2.57 115.31 119.27 1n9b h LEU 208 Ca 0.16 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 1n9b h LEU 208 Cb 0.06 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1n9b h LEU 208 CO -0.03 0.13 0.37 -0.61 -0.34 0.00 0.00 178.44 177.97 1n9b h GLN 209 N 0.27 1.15 -0.73 1.25 5.75 -0.86 -0.39 115.11 121.54 1n9b h GLN 209 Ca 0.12 -0.17 0.05 0.00 -0.15 0.00 0.00 58.65 58.50 1n9b h GLN 209 Cb 0.06 -0.21 -0.05 0.00 1.07 0.00 0.00 27.48 28.36 1n9b h GLN 209 CO -0.10 0.89 0.44 -1.49 -2.65 0.00 0.00 178.83 175.92 1n9b h TRP 210 N 1.14 0.83 -0.57 3.99 6.55 -0.97 -0.92 115.95 125.99 1n9b h TRP 210 Ca 0.27 0.02 -0.08 0.00 0.95 0.00 0.00 58.89 60.06 1n9b h TRP 210 Cb 0.13 -0.26 -0.02 0.00 -0.86 0.00 0.00 29.16 28.14 1n9b h TRP 210 CO 0.01 0.44 0.04 0.52 -1.05 0.00 0.00 178.44 178.40 1n9b h MET 211 N 0.84 0.96 -0.69 0.49 2.86 -0.98 -2.57 114.93 115.83 1n9b h MET 211 Ca 0.31 -0.27 0.04 0.00 -2.06 0.00 0.00 59.70 57.73 1n9b h MET 211 Cb 0.11 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.62 1n9b h MET 211 CO -0.15 0.92 0.45 0.28 1.06 0.00 0.00 176.91 179.48 1n9b h VAL 212 N 0.89 1.07 -0.11 -2.22 2.07 -0.58 -2.30 116.25 115.08 1n9b h VAL 212 Ca 0.17 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1n9b h VAL 212 Cb 0.47 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1n9b h VAL 212 CO 0.02 0.14 0.00 0.47 0.02 0.00 0.00 177.57 178.22 1n9b n ASP 213 N -4.46 0.86 -4.63 0.57 8.00 -0.40 -4.88 116.55 111.61 1n9b n ASP 213 Ca 0.09 -1.69 -0.51 0.00 0.71 0.00 0.00 54.79 53.39 1n9b n ASP 213 Cb 0.16 -0.07 -0.06 0.00 -0.02 0.00 0.00 41.12 41.13 1n9b n ASP 213 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1n9b n ASP 214 N -0.17 2.20 -0.00 -2.24 2.03 -1.05 -4.80 116.55 112.52 1n9b n ASP 214 Ca 0.12 1.10 0.11 0.00 0.52 0.00 0.00 54.79 56.64 1n9b n ASP 214 Cb 0.18 -1.25 -0.14 0.00 -0.72 0.00 0.00 41.12 39.19 1n9b n ASP 214 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1n9b n ARG 215 N 3.35 0.45 -0.02 -0.67 5.12 0.12 -3.44 116.66 121.57 1n9b n ARG 215 Ca 0.19 -0.12 -0.13 0.00 -1.93 0.00 0.00 57.85 55.86 1n9b n ARG 215 Cb 0.21 -1.53 -0.10 0.00 -1.16 0.00 0.00 32.46 29.88 1n9b n ARG 215 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1n9b h VAL 216 N 0.00 1.40 0.00 1.55 2.07 -1.89 -3.42 116.25 115.96 1n9b h VAL 216 Ca 0.00 -1.58 -0.00 0.00 0.82 0.00 0.00 66.70 65.94 1n9b h VAL 216 Cb 0.84 2.42 -0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1n9b h VAL 216 CO 0.00 0.39 -1.00 0.00 0.02 0.00 0.00 177.57 176.97 1n9b n ALA 217 N -2.49 2.00 0.01 1.67 0.00 -1.26 -4.79 120.51 115.65 1n9b n ALA 217 Ca -0.09 -0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.25 1n9b n ALA 217 Cb 0.33 0.10 -0.03 0.00 0.00 0.00 0.00 19.45 19.85 1n9b n ALA 217 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1n9b h GLY 218 N 0.02 -0.16 1.02 0.00 0.00 -1.81 0.71 103.07 102.85 1n9b h GLY 218 Ca -0.00 0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.53 1n9b h GLY 218 CO 0.00 -0.17 0.42 -2.55 0.00 0.00 0.00 176.54 174.24 1n9b h PRO 219 N -0.25 1.15 -0.35 4.80 0.11 -1.83 -0.16 132.00 135.47 1n9b h PRO 219 Ca 0.09 -0.15 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1n9b h PRO 219 Cb 0.38 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.25 1n9b h PRO 219 CO -0.25 0.86 0.18 1.25 -0.21 0.00 0.00 178.00 179.83 1n9b h LEU 220 N 1.14 0.45 -0.65 2.35 5.85 -1.75 -1.70 115.31 121.00 1n9b h LEU 220 Ca 0.28 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.91 1n9b h LEU 220 Cb 0.07 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1n9b h LEU 220 CO -0.04 0.44 0.42 0.40 -0.34 0.00 0.00 178.44 179.32 1n9b h ILE 221 N 0.43 1.12 -0.44 4.05 2.04 -0.47 -2.19 117.51 122.05 1n9b h ILE 221 Ca 0.12 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 1n9b h ILE 221 Cb 0.10 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 1n9b h ILE 221 CO -0.02 0.15 0.18 0.03 0.00 0.00 0.00 178.15 178.49 1n9b h ARG 222 N 0.83 0.63 -0.44 2.37 3.08 -0.74 -1.10 114.38 119.02 1n9b h ARG 222 Ca 0.25 -0.08 0.06 0.00 0.07 0.00 0.00 59.98 60.28 1n9b h ARG 222 Cb -0.03 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 1n9b h ARG 222 CO -0.08 0.52 0.30 0.66 -1.07 0.00 0.00 179.97 180.30 1n9b h SER 223 N 0.63 0.28 -0.07 7.04 4.64 -0.66 -2.73 113.55 122.68 1n9b h SER 223 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1n9b h SER 223 Cb 0.13 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1n9b h SER 223 CO -0.02 0.18 0.00 1.33 -0.87 0.00 0.00 176.83 177.46 1n9b n VAL 224 N -4.47 0.10 -2.99 0.95 0.24 -0.69 -4.96 118.33 106.52 1n9b n VAL 224 Ca 0.06 -0.55 -0.39 0.00 -2.04 0.00 0.00 64.34 61.42 1n9b n VAL 224 Cb 0.27 1.24 -0.06 0.00 -1.47 0.00 0.00 33.84 33.82 1n9b n VAL 224 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1n9b s LEU 225 N -1.28 4.52 0.77 1.34 2.96 -0.50 -5.04 118.68 121.44 1n9b s LEU 225 Ca 0.20 1.61 -0.15 0.00 -0.22 0.00 0.00 54.13 55.57 1n9b s LEU 225 Cb 0.14 -3.41 0.04 0.00 0.50 0.00 0.00 46.19 43.45 1n9b s LEU 225 CO 0.20 0.15 1.03 -2.65 -1.32 0.00 0.00 176.35 173.76 1n9b n PRO 226 N 1.33 0.34 -1.62 0.98 -0.02 -1.26 -4.91 135.00 129.84 1n9b n PRO 226 Ca -0.04 0.18 -0.43 0.00 -2.02 0.00 0.00 63.50 61.19 1n9b n PRO 226 Cb 0.49 -2.29 -0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1n9b n PRO 226 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n9b n ALA 227 N -2.87 0.30 0.00 3.55 0.00 -1.26 -2.85 120.51 117.37 1n9b n ALA 227 Ca 0.13 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1n9b n ALA 227 Cb 0.50 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.85 1n9b n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n9b n GLY 228 N 1.09 0.59 3.69 0.00 0.00 -1.26 -4.98 105.19 104.33 1n9b n GLY 228 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1n9b n GLY 228 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1n9b s TRP 229 N -2.16 3.41 0.29 1.61 0.52 -1.13 -0.41 118.94 121.06 1n9b s TRP 229 Ca 0.00 0.61 -0.29 0.00 0.02 0.00 0.00 56.10 56.44 1n9b s TRP 229 Cb 0.00 -2.46 -0.09 0.00 -1.15 0.00 0.00 33.47 29.77 1n9b s TRP 229 CO 0.00 0.08 1.07 0.12 0.02 0.00 0.00 176.95 178.25 1n9b s PHE 230 N 0.98 3.59 -0.00 -1.98 2.19 0.30 -4.88 117.98 118.18 1n9b s PHE 230 Ca 0.18 1.72 0.00 0.00 0.33 0.00 0.00 56.93 59.16 1n9b s PHE 230 Cb -0.14 -3.23 0.00 0.00 -1.31 0.00 0.00 43.02 38.34 1n9b s PHE 230 CO 0.07 -0.44 -0.01 -1.50 1.83 0.00 0.00 175.22 175.17 1n9b s ILE 231 N -1.23 0.06 0.01 3.12 1.10 -1.26 -2.88 121.20 120.12 1n9b s ILE 231 Ca 0.46 -0.02 0.00 0.00 -0.51 0.00 0.00 60.65 60.58 1n9b s ILE 231 Cb -0.30 -0.07 -0.01 0.00 0.15 0.00 0.00 42.46 42.23 1n9b s ILE 231 CO 0.38 0.02 -0.02 0.00 -2.11 0.00 0.00 174.94 173.22 1n9b s ALA 232 N 0.05 0.09 0.13 1.50 0.00 -0.71 -4.77 121.76 118.05 1n9b s ALA 232 Ca -0.00 -0.35 -0.25 0.00 0.00 0.00 0.00 51.96 51.37 1n9b s ALA 232 Cb -0.01 0.08 0.07 0.00 0.00 0.00 0.00 23.12 23.26 1n9b s ALA 232 CO -0.00 -0.09 0.73 0.16 0.00 0.00 0.00 175.76 176.57 1n9b s ASP 233 N -0.84 -0.43 -0.02 0.00 1.47 -0.89 -0.81 116.67 115.15 1n9b s ASP 233 Ca -0.09 -0.12 0.00 0.00 1.18 0.00 0.00 52.55 53.52 1n9b s ASP 233 Cb -0.06 0.55 0.02 0.00 -0.34 0.00 0.00 42.92 43.09 1n9b s ASP 233 CO -0.01 -0.92 0.01 -0.75 0.68 0.00 0.00 175.17 174.18 1n9b s LYS 234 N -3.55 0.19 0.35 2.11 2.47 -0.08 -4.61 119.74 116.61 1n9b s LYS 234 Ca 0.05 0.09 0.07 0.00 -1.56 0.00 0.00 55.97 54.62 1n9b s LYS 234 Cb -0.02 -0.37 -0.02 0.00 -1.46 0.00 0.00 37.83 35.96 1n9b s LYS 234 CO -0.08 -0.12 0.39 0.95 0.16 0.00 0.00 175.35 176.65 1n9b s THR 235 N 0.90 3.63 0.07 3.43 -4.23 -1.26 -1.01 115.64 117.16 1n9b s THR 235 Ca -0.08 -1.19 -0.08 0.00 -1.18 0.00 0.00 61.69 59.16 1n9b s THR 235 Cb -0.12 -3.24 -0.01 0.00 1.34 0.00 0.00 72.50 70.47 1n9b s THR 235 CO -0.02 -0.14 0.16 -0.83 -0.54 0.00 0.00 174.62 173.25 1n9b s GLY 236 N -4.10 0.13 0.00 3.99 0.00 -0.05 -3.65 107.32 103.63 1n9b s GLY 236 Ca 0.44 -0.61 -0.16 0.00 0.00 0.00 0.00 44.72 44.39 1n9b s GLY 236 CO 0.29 -0.78 0.35 0.00 0.00 0.00 0.00 173.10 172.96 1n9b s ALA 237 N -3.46 -0.86 0.03 3.20 0.00 -1.26 -1.06 121.76 118.35 1n9b s ALA 237 Ca 0.02 0.33 0.03 0.00 0.00 0.00 0.00 51.96 52.33 1n9b s ALA 237 Cb 0.03 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.29 1n9b s ALA 237 CO -0.09 -0.32 -0.09 0.45 0.00 0.00 0.00 175.76 175.71 1n9b s SER 238 N -1.56 1.03 0.49 0.00 0.15 0.16 -4.76 113.70 109.21 1n9b s SER 238 Ca -0.11 -0.41 0.27 0.00 0.70 0.00 0.00 55.95 56.41 1n9b s SER 238 Cb -0.03 -0.03 1.25 0.00 -1.71 0.00 0.00 66.02 65.49 1n9b s SER 238 CO 0.02 -0.07 1.96 -0.33 1.20 0.00 0.00 173.24 176.03 1n9b h GLU 240 N 4.99 0.00 -2.31 5.44 4.39 -1.84 -3.26 114.58 121.99 1n9b h GLU 240 Ca -0.34 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 58.79 1n9b h GLU 240 Cb 1.19 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 29.72 1n9b h GLU 240 CO 0.44 0.15 1.32 -2.13 -1.16 0.00 0.00 179.01 177.63 1n9b n ARG 241 N -3.44 3.26 0.00 2.33 0.63 -1.26 -4.78 116.66 113.39 1n9b n ARG 241 Ca -0.01 -2.57 0.00 0.00 -0.92 0.00 0.00 57.85 54.36 1n9b n ARG 241 Cb 0.32 -2.36 0.00 0.00 0.45 0.00 0.00 32.46 30.88 1n9b n ARG 241 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1n9b n GLY 242 N 1.61 2.54 3.80 5.14 0.00 -1.23 -4.53 105.19 112.52 1n9b n GLY 242 Ca 0.56 -0.55 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1n9b n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9b s ALA 243 N -0.87 3.28 -0.00 4.61 0.00 -1.24 -4.59 121.76 122.95 1n9b s ALA 243 Ca 0.00 0.37 -0.05 0.00 0.00 0.00 0.00 51.96 52.28 1n9b s ALA 243 Cb 0.00 -3.03 -0.00 0.00 0.00 0.00 0.00 23.12 20.09 1n9b s ALA 243 CO 0.00 0.24 0.09 0.50 0.00 0.00 0.00 175.76 176.59 1n9b s ARG 244 N -2.09 0.37 0.18 0.00 6.06 -0.98 0.36 118.95 122.85 1n9b s ARG 244 Ca 0.48 -0.35 -0.23 0.00 -2.50 0.00 0.00 55.73 53.13 1n9b s ARG 244 Cb -0.17 0.15 0.06 0.00 0.06 0.00 0.00 34.95 35.05 1n9b s ARG 244 CO 0.22 -0.08 0.66 0.20 -2.50 0.00 0.00 175.30 173.80 1n9b s GLY 245 N -1.14 -0.46 -0.12 8.12 0.00 -0.22 -0.55 107.32 112.95 1n9b s GLY 245 Ca -0.12 0.30 -0.11 0.00 0.00 0.00 0.00 44.72 44.79 1n9b s GLY 245 CO 0.01 0.10 0.32 -0.26 0.00 0.00 0.00 173.10 173.27 1n9b s ILE 246 N -3.74 -0.00 -0.15 0.90 -0.00 0.04 -0.87 121.20 117.38 1n9b s ILE 246 Ca 0.04 0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.71 1n9b s ILE 246 Cb -0.02 -0.46 -0.00 0.00 -0.00 0.00 0.00 42.46 41.98 1n9b s ILE 246 CO -0.07 0.01 -0.15 -0.69 -0.00 0.00 0.00 174.94 174.03 1n9b s VAL 247 N 0.29 2.70 0.05 8.37 1.01 -0.18 -1.26 120.40 131.37 1n9b s VAL 247 Ca -0.01 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 1n9b s VAL 247 Cb -0.03 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 1n9b s VAL 247 CO -0.01 0.52 0.05 0.00 0.00 0.00 0.00 175.10 175.66 1n9b s ALA 248 N 0.74 0.13 -0.11 5.51 0.00 0.07 -0.91 121.76 127.20 1n9b s ALA 248 Ca -0.06 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.11 1n9b s ALA 248 Cb -0.15 0.28 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 1n9b s ALA 248 CO 0.01 -0.35 -0.11 -0.51 0.00 0.00 0.00 175.76 174.80 1n9b s LEU 249 N -2.43 2.84 -0.06 0.00 1.02 0.01 -0.66 118.68 119.39 1n9b s LEU 249 Ca -0.01 -0.24 -0.08 0.00 0.02 0.00 0.00 54.13 53.82 1n9b s LEU 249 Cb 0.02 -1.63 0.02 0.00 0.02 0.00 0.00 46.19 44.62 1n9b s LEU 249 CO -0.07 0.22 0.22 -0.22 0.02 0.00 0.00 176.35 176.52 1n9b s LEU 250 N 0.00 1.19 0.00 1.79 2.96 -0.04 -1.73 118.68 122.85 1n9b s LEU 250 Ca -0.03 0.31 0.00 0.00 -0.22 0.00 0.00 54.13 54.19 1n9b s LEU 250 Cb -0.14 0.80 0.00 0.00 0.50 0.00 0.00 46.19 47.35 1n9b s LEU 250 CO 0.04 -0.16 0.00 0.61 -1.32 0.00 0.00 176.35 175.52 1n9b n GLY 251 N 2.55 0.64 3.90 7.98 0.00 -1.12 -1.24 105.19 117.91 1n9b n GLY 251 Ca -0.15 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 1n9b n GLY 251 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n9b s PRO 252 N -2.00 1.28 -1.51 1.61 0.04 -1.26 -0.54 135.00 132.62 1n9b s PRO 252 Ca 0.00 -0.09 -0.04 0.00 0.04 0.00 0.00 61.00 60.91 1n9b s PRO 252 Cb 0.00 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.66 1n9b s PRO 252 CO 0.00 -2.03 0.37 -1.71 0.04 0.00 0.00 177.00 173.67 1n9b n ASN 254 N -3.57 -5.45 -3.17 6.66 5.15 -0.71 -2.37 115.26 111.79 1n9b n ASN 254 Ca 0.11 -0.18 -0.23 0.00 -0.60 0.00 0.00 54.58 53.68 1n9b n ASN 254 Cb 0.60 -4.47 0.02 0.00 -0.53 0.00 0.00 39.78 35.41 1n9b n ASN 254 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1n9b n ASN 255 N -2.28 -5.23 -4.25 1.20 4.13 0.45 -4.97 115.26 104.31 1n9b n ASN 255 Ca -0.14 -0.33 -0.27 0.00 1.68 0.00 0.00 54.58 55.52 1n9b n ASN 255 Cb 0.62 -4.25 -0.15 0.00 -1.54 0.00 0.00 39.78 34.46 1n9b n ASN 255 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1n9b s LYS 256 N -5.84 1.61 -0.67 3.52 2.20 -1.00 -4.80 119.74 114.76 1n9b s LYS 256 Ca 0.35 -0.87 -0.26 0.00 -0.36 0.00 0.00 55.97 54.82 1n9b s LYS 256 Cb -0.17 -1.64 -0.01 0.00 -1.51 0.00 0.00 37.83 34.50 1n9b s LYS 256 CO 0.43 0.44 1.70 0.00 -0.36 0.00 0.00 175.35 177.56 1n9b s ALA 257 N -0.65 2.31 -0.25 3.13 0.00 -1.26 -2.78 121.76 122.26 1n9b s ALA 257 Ca 0.08 -0.91 -0.01 0.00 0.00 0.00 0.00 51.96 51.12 1n9b s ALA 257 Cb -0.09 -4.31 -0.15 0.00 0.00 0.00 0.00 23.12 18.57 1n9b s ALA 257 CO 0.01 -3.78 -0.24 -1.91 0.00 0.00 0.00 175.76 169.84 1n9b n GLU 258 N 9.22 0.60 -4.27 0.00 2.13 -1.09 -4.87 120.64 122.37 1n9b n GLU 258 Ca 0.17 0.16 -0.19 0.00 0.66 0.00 0.00 57.16 57.96 1n9b n GLU 258 Cb 0.51 -1.48 -0.13 0.00 0.27 0.00 0.00 31.44 30.62 1n9b n GLU 258 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1n9b s ARG 259 N -2.49 0.86 -0.04 5.31 0.52 -0.37 -1.06 118.95 121.68 1n9b s ARG 259 Ca -0.34 -0.82 -0.23 0.00 -0.52 0.00 0.00 55.73 53.82 1n9b s ARG 259 Cb 0.10 -0.87 -0.04 0.00 0.52 0.00 0.00 34.95 34.66 1n9b s ARG 259 CO 0.54 0.20 0.67 -1.50 0.02 0.00 0.00 175.30 175.24 1n9b s ILE 260 N -1.02 4.99 -0.12 1.52 1.10 0.63 -0.86 121.20 127.44 1n9b s ILE 260 Ca -0.00 1.39 0.01 0.00 -0.51 0.00 0.00 60.65 61.54 1n9b s ILE 260 Cb -0.09 -4.01 0.02 0.00 0.15 0.00 0.00 42.46 38.53 1n9b s ILE 260 CO 0.02 0.31 -0.13 -0.69 -2.11 0.00 0.00 174.94 172.33 1n9b s VAL 261 N 0.47 1.41 -0.15 4.00 1.01 0.16 -0.84 120.40 126.46 1n9b s VAL 261 Ca 0.35 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.78 1n9b s VAL 261 Cb -0.18 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 34.89 1n9b s VAL 261 CO 0.18 0.43 -0.20 -0.69 0.00 0.00 0.00 175.10 174.82 1n9b s VAL 262 N 1.22 2.25 -0.07 2.92 1.01 -0.27 -0.75 120.40 126.71 1n9b s VAL 262 Ca -0.02 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.06 1n9b s VAL 262 Cb -0.14 -1.92 0.02 0.00 0.00 0.00 0.00 36.38 34.34 1n9b s VAL 262 CO -0.05 0.54 -0.06 -0.63 0.00 0.00 0.00 175.10 174.90 1n9b s ILE 263 N 0.87 0.75 0.16 2.22 1.01 -0.39 -1.30 121.20 124.53 1n9b s ILE 263 Ca -0.05 -0.21 0.09 0.00 0.00 0.00 0.00 60.65 60.48 1n9b s ILE 263 Cb -0.15 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.51 1n9b s ILE 263 CO -0.02 0.29 -0.20 -0.31 0.00 0.00 0.00 174.94 174.69 1n9b s TYR 264 N 1.16 1.93 0.05 3.97 2.02 0.05 -0.78 117.35 125.74 1n9b s TYR 264 Ca -0.07 -0.43 -0.08 0.00 -0.37 0.00 0.00 57.07 56.12 1n9b s TYR 264 Cb -0.14 -0.98 -0.00 0.00 -0.40 0.00 0.00 41.96 40.44 1n9b s TYR 264 CO -0.01 0.35 0.16 -0.48 -1.57 0.00 0.00 175.55 173.99 1n9b s LEU 265 N -2.53 1.51 0.13 -1.29 0.05 0.29 -0.34 118.68 116.50 1n9b s LEU 265 Ca 0.15 -0.47 -0.13 0.00 0.05 0.00 0.00 54.13 53.73 1n9b s LEU 265 Cb -0.07 0.86 0.02 0.00 -2.05 0.00 0.00 46.19 44.95 1n9b s LEU 265 CO 0.07 -0.57 0.34 0.00 -0.55 0.00 0.00 176.35 175.64 1n9b s ARG 266 N -2.80 1.05 -1.36 1.48 1.70 -0.26 -2.32 118.95 116.44 1n9b s ARG 266 Ca -0.03 -0.85 -0.09 0.00 -0.47 0.00 0.00 55.73 54.29 1n9b s ARG 266 Cb 0.00 0.43 0.02 0.00 -0.57 0.00 0.00 34.95 34.82 1n9b s ARG 266 CO -0.05 -0.39 1.15 -0.25 -1.08 0.00 0.00 175.30 174.68 1n9b n ASP 267 N -0.19 -5.86 -4.53 -2.89 8.00 -1.26 -1.28 116.55 108.53 1n9b n ASP 267 Ca -0.14 -0.57 -0.32 0.00 0.71 0.00 0.00 54.79 54.47 1n9b n ASP 267 Cb 0.63 -4.94 -0.12 0.00 -0.02 0.00 0.00 41.12 36.67 1n9b n ASP 267 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1n9b s THR 268 N -3.32 3.30 -2.12 -3.53 -1.32 -1.26 -4.11 115.64 103.27 1n9b s THR 268 Ca 0.54 -0.79 0.18 0.00 -1.21 0.00 0.00 61.69 60.41 1n9b s THR 268 Cb -0.24 -2.37 0.46 0.00 -1.51 0.00 0.00 72.50 68.84 1n9b s THR 268 CO 0.74 0.48 1.58 -0.81 -2.21 0.00 0.00 174.62 174.39 1n9b n PRO 269 N 1.90 1.37 -1.77 7.08 -0.04 -1.26 -4.04 135.00 138.23 1n9b n PRO 269 Ca -0.16 -0.55 -0.32 0.00 -0.04 0.00 0.00 63.50 62.42 1n9b n PRO 269 Cb 0.52 -1.32 0.04 0.00 -0.04 0.00 0.00 33.50 32.70 1n9b n PRO 269 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n9b s ALA 270 N -1.88 2.61 0.74 0.55 0.00 -1.26 -4.99 121.76 117.52 1n9b s ALA 270 Ca 0.28 0.33 -0.16 0.00 0.00 0.00 0.00 51.96 52.41 1n9b s ALA 270 Cb 0.14 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.02 1n9b s ALA 270 CO 0.22 -1.12 0.75 -1.13 0.00 0.00 0.00 175.76 174.48 1n9b n SER 271 N -2.57 -0.40 -0.35 0.00 3.41 -1.26 -4.78 113.62 107.68 1n9b n SER 271 Ca 0.09 0.61 0.03 0.00 -0.26 0.00 0.00 58.87 59.33 1n9b n SER 271 Cb 0.53 -1.31 0.17 0.00 -0.26 0.00 0.00 64.21 63.34 1n9b n SER 271 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1n9b h MET 272 N -0.43 1.03 -0.60 4.33 4.05 -1.97 -1.24 114.93 120.11 1n9b h MET 272 Ca -0.46 -0.06 0.04 0.00 -0.28 0.00 0.00 59.70 58.94 1n9b h MET 272 Cb 1.34 -0.23 -0.04 0.00 -0.80 0.00 0.00 31.60 31.86 1n9b h MET 272 CO 0.44 0.68 0.34 0.00 0.23 0.00 0.00 176.91 178.60 1n9b h ALA 273 N 1.45 0.78 -0.26 0.39 0.00 -1.99 -0.14 119.26 119.48 1n9b h ALA 273 Ca 0.42 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.20 1n9b h ALA 273 Cb 0.23 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1n9b h ALA 273 CO -0.19 0.04 -0.41 0.93 0.00 0.00 0.00 179.25 179.61 1n9b h GLU 274 N 0.65 0.63 -0.41 0.00 5.08 -1.78 -0.25 114.58 118.50 1n9b h GLU 274 Ca 0.25 -0.33 0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1n9b h GLU 274 Cb 0.10 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1n9b h GLU 274 CO -0.14 0.93 0.16 0.00 -1.00 0.00 0.00 179.01 178.96 1n9b h ARG 275 N 0.52 0.32 -0.37 2.33 3.08 -0.72 -0.66 114.38 118.88 1n9b h ARG 275 Ca 0.04 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1n9b h ARG 275 Cb 0.94 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.90 1n9b h ARG 275 CO 0.08 0.21 0.23 -0.91 -1.07 0.00 0.00 179.97 178.52 1n9b h ASN 276 N 0.33 0.44 -0.40 7.04 2.35 -0.75 -2.06 115.58 122.52 1n9b h ASN 276 Ca 0.19 -0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.85 1n9b h ASN 276 Cb 0.16 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1n9b h ASN 276 CO -0.18 0.35 0.09 -0.61 -1.65 0.00 0.00 177.43 175.42 1n9b h GLN 277 N 0.49 0.73 -0.28 0.81 4.15 -0.77 -0.75 115.11 119.48 1n9b h GLN 277 Ca 0.13 -0.15 -0.17 0.00 0.77 0.00 0.00 58.65 59.23 1n9b h GLN 277 Cb -0.02 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.57 1n9b h GLN 277 CO -0.03 0.68 -0.50 1.96 -1.93 0.00 0.00 178.83 179.02 1n9b h GLN 278 N 0.70 0.83 -0.52 1.69 1.08 -0.92 0.44 115.11 118.41 1n9b h GLN 278 Ca 0.15 -0.52 -0.00 0.00 -1.45 0.00 0.00 58.65 56.83 1n9b h GLN 278 Cb 0.31 0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 1n9b h GLN 278 CO 0.00 1.15 0.32 0.82 -0.95 0.00 0.00 178.83 180.18 1n9b h ILE 279 N 0.60 1.15 -0.81 2.54 2.04 -1.17 -1.74 117.51 120.12 1n9b h ILE 279 Ca 0.02 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.56 1n9b h ILE 279 Cb 1.10 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 1n9b h ILE 279 CO 0.11 0.15 0.54 0.00 0.00 0.00 0.00 178.15 178.96 1n9b h ALA 280 N 1.16 1.44 -0.65 1.87 0.00 -0.95 -1.32 119.26 120.82 1n9b h ALA 280 Ca 0.19 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1n9b h ALA 280 Cb -0.03 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 1n9b h ALA 280 CO -0.04 0.51 0.19 0.78 0.00 0.00 0.00 179.25 180.69 1n9b h GLY 281 N 1.08 1.07 0.94 0.00 0.00 -0.35 0.78 103.07 106.59 1n9b h GLY 281 Ca 0.31 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1n9b h GLY 281 CO -0.07 0.57 0.16 -2.22 0.00 0.00 0.00 176.54 174.98 1n9b h ILE 282 N 0.96 1.18 -0.89 2.60 2.04 -0.84 -1.86 117.51 120.71 1n9b h ILE 282 Ca 0.21 -0.53 0.06 0.00 1.00 0.00 0.00 64.86 65.60 1n9b h ILE 282 Cb 0.28 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 1n9b h ILE 282 CO -0.01 0.19 0.55 1.23 0.00 0.00 0.00 178.15 180.12 1n9b h GLY 283 N 0.45 1.34 0.86 5.37 0.00 -0.69 -1.43 103.07 108.97 1n9b h GLY 283 Ca 0.12 -0.40 0.03 0.00 0.00 0.00 0.00 47.33 47.08 1n9b h GLY 283 CO -0.01 0.27 0.36 0.00 0.00 0.00 0.00 176.54 177.16 1n9b h ALA 284 N 1.42 0.77 -0.70 3.60 0.00 -0.58 -0.75 119.26 123.01 1n9b h ALA 284 Ca 0.39 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1n9b h ALA 284 Cb 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1n9b h ALA 284 CO -0.17 0.09 0.39 0.00 0.00 0.00 0.00 179.25 179.56 1n9b h ALA 285 N 1.26 0.89 -0.41 0.00 0.00 -0.79 -0.74 119.26 119.48 1n9b h ALA 285 Ca 0.24 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1n9b h ALA 285 Cb 0.03 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1n9b h ALA 285 CO -0.10 0.40 0.26 -0.07 0.00 0.00 0.00 179.25 179.73 1n9b h LEU 286 N 0.96 0.44 -0.65 0.00 3.38 -0.78 -2.10 115.31 116.55 1n9b h LEU 286 Ca 0.25 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 1n9b h LEU 286 Cb 0.02 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 1n9b h LEU 286 CO -0.04 0.32 0.23 0.40 0.09 0.00 0.00 178.44 179.43 1n9b h ILE 287 N 0.53 1.24 0.00 1.22 2.04 -0.81 -2.04 117.51 119.70 1n9b h ILE 287 Ca 0.15 -0.80 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 1n9b h ILE 287 Cb -0.04 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1n9b h ILE 287 CO -0.05 0.31 -0.08 -0.33 0.00 0.00 0.00 178.15 178.00 1n9b h GLU 288 N 0.93 0.00 -1.76 2.37 5.08 -1.06 -3.33 114.58 116.80 1n9b h GLU 288 Ca 0.21 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 58.06 1n9b h GLU 288 Cb 0.25 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.09 1n9b h GLU 288 CO -0.01 0.08 -0.93 0.72 -1.00 0.00 0.00 179.01 177.87 1n9b n HIS 289 N -3.16 2.28 0.07 4.33 8.25 -0.80 -4.93 115.22 121.26 1n9b n HIS 289 Ca 0.02 -3.49 -0.16 0.00 -0.26 0.00 0.00 57.72 53.82 1n9b n HIS 289 Cb 0.43 -0.35 -0.08 0.00 1.12 0.00 0.00 29.99 31.11 1n9b n HIS 289 CO 0.00 0.00 0.00 2.35 0.64 0.00 0.00 176.34 179.33 1n9b h TRP 290 N 2.90 0.73 -3.39 4.41 2.91 -1.50 -3.42 115.95 118.58 1n9b h TRP 290 Ca 0.11 -0.42 -0.59 0.00 1.13 0.00 0.00 58.89 59.12 1n9b h TRP 290 Cb 0.87 -0.07 -0.08 0.00 -0.51 0.00 0.00 29.16 29.36 1n9b h TRP 290 CO 0.66 1.26 0.67 -0.65 -1.03 0.00 0.00 178.44 179.35 1n9b s GLN 291 N -3.16 3.97 0.00 2.65 -1.52 -1.26 -5.08 119.66 115.26 1n9b s GLN 291 Ca -0.07 0.81 0.00 0.00 -1.95 0.00 0.00 55.36 54.15 1n9b s GLN 291 Cb 0.08 -3.75 0.00 0.00 -0.22 0.00 0.00 33.01 29.11 1n9b s GLN 291 CO 0.89 -0.86 0.00 0.54 -0.25 0.00 0.00 175.29 175.61