#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b9d h PRO 58 N 0.00 0.00 -0.59 -1.46 0.13 -1.97 -3.05 132.00 125.05 1b9d h PRO 58 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1b9d h PRO 58 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1b9d h PRO 58 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 1b9d n GLY 59 N 0.03 2.87 3.72 1.56 0.00 -1.26 -4.94 105.19 107.16 1b9d n GLY 59 Ca 0.01 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.84 1b9d n GLY 59 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b9d s ILE 60 N -1.85 5.34 0.08 -0.61 1.01 -1.15 -0.91 121.20 123.11 1b9d s ILE 60 Ca 0.48 0.40 0.08 0.00 0.00 0.00 0.00 60.65 61.60 1b9d s ILE 60 Cb 0.31 -3.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.19 1b9d s ILE 60 CO 0.23 0.40 -0.20 0.26 0.00 0.00 0.00 174.94 175.62 1b9d s TRP 61 N 0.51 1.75 -0.11 3.97 0.52 -0.69 -2.00 118.94 122.89 1b9d s TRP 61 Ca 0.13 -0.40 -0.01 0.00 0.02 0.00 0.00 56.10 55.84 1b9d s TRP 61 Cb -0.12 -0.99 -0.03 0.00 -1.15 0.00 0.00 33.47 31.18 1b9d s TRP 61 CO 0.02 0.15 -0.07 -1.14 0.02 0.00 0.00 176.95 175.93 1b9d s GLN 62 N -1.59 3.21 -0.08 4.98 2.00 0.20 -0.54 119.66 127.83 1b9d s GLN 62 Ca 0.06 -0.56 -0.00 0.00 -2.00 0.00 0.00 55.36 52.86 1b9d s GLN 62 Cb -0.09 -2.72 0.02 0.00 0.80 0.00 0.00 33.01 31.02 1b9d s GLN 62 CO 0.03 0.43 -0.05 -0.51 -0.50 0.00 0.00 175.29 174.69 1b9d s LEU 63 N -0.16 1.03 0.16 3.68 1.02 -0.45 -0.55 118.68 123.42 1b9d s LEU 63 Ca 0.02 -0.20 -0.01 0.00 0.02 0.00 0.00 54.13 53.96 1b9d s LEU 63 Cb -0.13 -0.63 -0.04 0.00 0.02 0.00 0.00 46.19 45.41 1b9d s LEU 63 CO 0.03 -0.12 0.09 -1.81 0.02 0.00 0.00 176.35 174.55 1b9d s ASP 64 N 1.58 0.24 0.03 2.29 1.01 -0.59 -4.32 116.67 116.91 1b9d s ASP 64 Ca 0.01 -1.28 0.06 0.00 0.71 0.00 0.00 52.55 52.05 1b9d s ASP 64 Cb -0.13 0.33 -0.03 0.00 1.01 0.00 0.00 42.92 44.10 1b9d s ASP 64 CO -0.05 -0.78 -0.16 0.00 0.21 0.00 0.00 175.17 174.39 1b9d s THR 66 N -0.93 0.72 -0.04 0.00 2.01 0.34 -4.96 115.64 112.77 1b9d s THR 66 Ca 0.15 -1.46 0.03 0.00 0.31 0.00 0.00 61.69 60.72 1b9d s THR 66 Cb -0.11 -1.11 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 1b9d s THR 66 CO 0.05 -0.55 -0.13 -1.00 -0.69 0.00 0.00 174.62 172.30 1b9d s HIS 67 N -2.24 2.73 -0.27 4.92 3.76 -1.26 -0.54 115.29 122.40 1b9d s HIS 67 Ca 0.00 -0.13 -0.13 0.00 -0.15 0.00 0.00 55.06 54.65 1b9d s HIS 67 Cb -0.04 -1.63 0.09 0.00 1.11 0.00 0.00 32.58 32.11 1b9d s HIS 67 CO -0.01 0.22 0.62 -1.17 -0.85 0.00 0.00 174.74 173.56 1b9d s LEU 68 N -0.83 -0.87 -1.88 0.89 2.96 -0.88 -4.96 118.68 113.11 1b9d s LEU 68 Ca 0.12 1.42 0.00 0.00 -0.22 0.00 0.00 54.13 55.45 1b9d s LEU 68 Cb -0.11 2.16 0.00 0.00 0.50 0.00 0.00 46.19 48.74 1b9d s LEU 68 CO 0.01 -0.23 0.00 -0.62 -1.32 0.00 0.00 176.35 174.20 1b9d n GLU 69 N 4.68 -1.64 -0.89 1.98 1.02 -1.26 -0.81 120.64 123.72 1b9d n GLU 69 Ca -0.18 1.06 0.00 0.00 -0.02 0.00 0.00 57.16 58.03 1b9d n GLU 69 Cb 0.55 -5.66 0.00 0.00 -0.02 0.00 0.00 31.44 26.31 1b9d n GLU 69 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b9d n GLY 70 N -0.86 0.69 3.64 0.62 0.00 -1.26 -5.02 105.19 102.99 1b9d n GLY 70 Ca -0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 1b9d n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b9d s LYS 71 N -0.11 2.00 -0.11 1.61 1.02 0.01 -5.12 119.74 119.04 1b9d s LYS 71 Ca 0.00 -2.01 0.01 0.00 0.02 0.00 0.00 55.97 53.99 1b9d s LYS 71 Cb 0.00 -1.74 -0.02 0.00 -0.52 0.00 0.00 37.83 35.56 1b9d s LYS 71 CO 0.00 -0.03 -0.14 0.08 -0.92 0.00 0.00 175.35 174.34 1b9d s VAL 72 N -2.66 3.01 -0.22 3.17 1.01 -1.24 -2.06 120.40 121.41 1b9d s VAL 72 Ca 0.36 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 1b9d s VAL 72 Cb 0.07 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.21 1b9d s VAL 72 CO 0.19 0.54 -0.07 -0.63 0.00 0.00 0.00 175.10 175.12 1b9d s ILE 73 N 0.12 3.08 -0.18 2.22 1.01 0.30 -0.13 121.20 127.62 1b9d s ILE 73 Ca -0.07 -0.63 -0.20 0.00 0.00 0.00 0.00 60.65 59.76 1b9d s ILE 73 Cb -0.15 -2.40 -0.03 0.00 0.01 0.00 0.00 42.46 39.89 1b9d s ILE 73 CO 0.05 0.42 0.57 -0.22 0.00 0.00 0.00 174.94 175.76 1b9d s LEU 74 N 1.43 4.17 -0.17 2.97 0.20 -0.03 -0.51 118.68 126.73 1b9d s LEU 74 Ca 0.05 0.78 0.01 0.00 0.69 0.00 0.00 54.13 55.66 1b9d s LEU 74 Cb -0.14 -2.80 0.02 0.00 -0.43 0.00 0.00 46.19 42.84 1b9d s LEU 74 CO -0.05 -0.20 -0.18 -0.69 -0.29 0.00 0.00 176.35 174.94 1b9d s VAL 75 N 1.61 1.90 -0.11 1.68 1.01 0.88 -2.26 120.40 125.11 1b9d s VAL 75 Ca 0.27 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.38 1b9d s VAL 75 Cb -0.16 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 1b9d s VAL 75 CO 0.10 0.51 -0.02 0.00 0.00 0.00 0.00 175.10 175.70 1b9d s ALA 76 N 1.35 3.14 -0.06 5.51 0.00 -0.19 -1.55 121.76 129.96 1b9d s ALA 76 Ca 0.05 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.22 1b9d s ALA 76 Cb -0.13 -1.49 0.01 0.00 0.00 0.00 0.00 23.12 21.51 1b9d s ALA 76 CO -0.12 0.43 -0.15 0.08 0.00 0.00 0.00 175.76 176.00 1b9d s VAL 77 N -0.36 1.32 -0.39 0.00 1.01 0.29 -1.19 120.40 121.07 1b9d s VAL 77 Ca 0.06 -0.60 -0.29 0.00 0.00 0.00 0.00 61.98 61.15 1b9d s VAL 77 Cb -0.12 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.11 1b9d s VAL 77 CO 0.02 0.39 1.11 -2.28 0.00 0.00 0.00 175.10 174.35 1b9d s HIS 78 N 0.45 2.98 0.20 5.22 2.46 -0.09 -0.63 115.29 125.89 1b9d s HIS 78 Ca -0.12 0.96 -0.11 0.00 0.47 0.00 0.00 55.06 56.26 1b9d s HIS 78 Cb -0.15 -4.05 0.21 0.00 -0.13 0.00 0.00 32.58 28.46 1b9d s HIS 78 CO 0.04 -1.03 1.79 0.28 -2.47 0.00 0.00 174.74 173.35 1b9d h VAL 79 N 5.98 0.95 -0.08 0.89 2.07 -1.73 -0.09 116.25 124.23 1b9d h VAL 79 Ca -0.22 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 67.04 1b9d h VAL 79 Cb 1.06 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1b9d h VAL 79 CO 1.08 0.11 -0.22 0.00 0.02 0.00 0.00 177.57 178.55 1b9d h ALA 80 N 1.33 1.48 0.00 1.67 0.00 -1.81 -3.32 119.26 118.60 1b9d h ALA 80 Ca 0.27 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1b9d h ALA 80 Cb 0.18 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1b9d h ALA 80 CO -0.18 0.38 -1.75 -1.13 0.00 0.00 0.00 179.25 176.56 1b9d n SER 81 N -4.22 1.96 0.00 0.00 3.41 -1.06 -5.00 113.62 108.71 1b9d n SER 81 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1b9d n SER 81 Cb 0.32 1.13 0.00 0.00 -0.26 0.00 0.00 64.21 65.40 1b9d n SER 81 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b9d n GLY 82 N 2.04 0.72 3.77 5.00 0.00 -0.07 -4.56 105.19 112.08 1b9d n GLY 82 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 1b9d n GLY 82 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1b9d s TYR 83 N -2.58 3.25 0.11 1.61 6.14 -1.24 -4.77 117.35 119.87 1b9d s TYR 83 Ca 0.00 1.60 0.10 0.00 0.64 0.00 0.00 57.07 59.41 1b9d s TYR 83 Cb 0.00 -3.35 -0.04 0.00 0.42 0.00 0.00 41.96 38.99 1b9d s TYR 83 CO 0.00 -1.04 -0.25 0.42 0.64 0.00 0.00 175.55 175.32 1b9d s ILE 84 N -1.34 2.07 -0.02 3.14 1.01 -1.26 -0.91 121.20 123.89 1b9d s ILE 84 Ca 0.52 -1.65 0.05 0.00 0.00 0.00 0.00 60.65 59.57 1b9d s ILE 84 Cb -0.31 -1.84 -0.01 0.00 0.01 0.00 0.00 42.46 40.31 1b9d s ILE 84 CO 0.39 0.07 -0.16 -1.61 0.00 0.00 0.00 174.94 173.63 1b9d s GLU 85 N -1.92 1.45 0.07 2.79 2.02 -0.33 -4.97 118.70 117.81 1b9d s GLU 85 Ca 0.11 -0.58 -0.11 0.00 0.02 0.00 0.00 54.97 54.42 1b9d s GLU 85 Cb -0.10 -1.35 0.01 0.00 0.10 0.00 0.00 34.13 32.79 1b9d s GLU 85 CO 0.05 0.31 0.24 0.00 0.02 0.00 0.00 175.26 175.87 1b9d s ALA 86 N -0.22 -0.44 0.04 5.21 0.00 -1.26 -1.02 121.76 124.07 1b9d s ALA 86 Ca 0.03 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.66 1b9d s ALA 86 Cb -0.08 0.41 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 1b9d s ALA 86 CO 0.00 -0.46 -0.04 -1.21 0.00 0.00 0.00 175.76 174.05 1b9d s GLU 87 N -3.20 0.45 -0.24 0.00 0.41 -0.96 -4.99 118.70 110.18 1b9d s GLU 87 Ca -0.00 -0.84 -0.10 0.00 -0.41 0.00 0.00 54.97 53.62 1b9d s GLU 87 Cb 0.02 0.06 -0.05 0.00 -1.78 0.00 0.00 34.13 32.38 1b9d s GLU 87 CO -0.07 -0.05 0.14 0.08 -0.49 0.00 0.00 175.26 174.86 1b9d s VAL 88 N -2.25 5.09 0.17 2.63 1.01 -1.26 -0.85 120.40 124.94 1b9d s VAL 88 Ca -0.07 0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.08 1b9d s VAL 88 Cb -0.04 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 1b9d s VAL 88 CO -0.03 0.34 -0.06 0.27 0.00 0.00 0.00 175.10 175.62 1b9d s ILE 89 N 1.17 3.42 0.21 2.22 -4.36 0.82 -4.98 121.20 119.71 1b9d s ILE 89 Ca 0.06 -1.52 0.11 0.00 -0.26 0.00 0.00 60.65 59.05 1b9d s ILE 89 Cb -0.14 -2.69 -0.05 0.00 1.25 0.00 0.00 42.46 40.83 1b9d s ILE 89 CO 0.05 -0.08 1.54 1.55 0.24 0.00 0.00 174.94 178.24 1b9d h PRO 90 N 2.92 0.00 -2.27 0.37 0.13 -1.97 -3.29 132.00 127.88 1b9d h PRO 90 Ca -0.47 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.59 1b9d h PRO 90 Cb 1.20 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.13 1b9d h PRO 90 CO 0.55 0.67 0.05 0.00 -0.23 0.00 0.00 178.00 179.04 1b9d s ALA 91 N -3.38 -1.51 -0.41 -0.56 0.00 -1.26 -4.84 121.76 109.81 1b9d s ALA 91 Ca -0.00 1.23 -0.28 0.00 0.00 0.00 0.00 51.96 52.91 1b9d s ALA 91 Cb 0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.97 1b9d s ALA 91 CO 0.77 -0.33 1.71 -2.00 0.00 0.00 0.00 175.76 175.90 1b9d s GLU 92 N -0.81 3.27 0.08 0.00 2.12 -1.26 -4.83 118.70 117.26 1b9d s GLU 92 Ca -0.09 1.14 -0.05 0.00 0.36 0.00 0.00 54.97 56.34 1b9d s GLU 92 Cb -0.02 -4.19 -0.02 0.00 0.26 0.00 0.00 34.13 30.16 1b9d s GLU 92 CO 0.06 -1.94 0.09 0.95 -0.54 0.00 0.00 175.26 173.88 1b9d s THR 93 N 6.90 0.16 0.32 -1.70 -4.23 -1.26 -5.03 115.64 110.80 1b9d s THR 93 Ca 0.72 -1.55 0.05 0.00 -1.18 0.00 0.00 61.69 59.73 1b9d s THR 93 Cb -0.18 -1.54 0.11 0.00 1.34 0.00 0.00 72.50 72.22 1b9d s THR 93 CO 0.31 -0.75 1.80 1.23 -0.54 0.00 0.00 174.62 176.67 1b9d h GLY 94 N 2.92 0.45 0.97 3.99 0.00 -1.93 -1.83 103.07 107.64 1b9d h GLY 94 Ca -0.34 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 46.65 1b9d h GLY 94 CO 0.60 0.30 0.23 1.46 0.00 0.00 0.00 176.54 179.13 1b9d h GLN 95 N 0.38 0.74 -0.47 4.80 7.50 -1.96 0.56 115.11 126.67 1b9d h GLN 95 Ca 0.07 -0.12 -0.11 0.00 0.50 0.00 0.00 58.65 58.99 1b9d h GLN 95 Cb 0.53 -0.13 -0.01 0.00 0.05 0.00 0.00 27.48 27.91 1b9d h GLN 95 CO 0.03 0.63 -0.15 0.93 -1.50 0.00 0.00 178.83 178.78 1b9d h GLU 96 N 0.68 0.93 -0.32 1.46 4.39 -1.77 -0.96 114.58 119.01 1b9d h GLU 96 Ca 0.17 -0.38 -0.00 0.00 0.34 0.00 0.00 59.36 59.50 1b9d h GLU 96 Cb 0.14 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 1b9d h GLU 96 CO -0.02 1.03 0.19 1.15 -1.16 0.00 0.00 179.01 180.21 1b9d h THR 97 N 0.78 1.11 -0.54 1.13 2.02 -0.93 -1.45 112.91 115.03 1b9d h THR 97 Ca 0.11 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 1b9d h THR 97 Cb 0.71 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 1b9d h THR 97 CO 0.05 0.11 0.28 0.00 0.37 0.00 0.00 175.52 176.33 1b9d h ALA 98 N 1.07 0.69 -0.67 6.16 0.00 -0.80 -1.29 119.26 124.43 1b9d h ALA 98 Ca 0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1b9d h ALA 98 Cb 0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1b9d h ALA 98 CO -0.02 0.24 0.29 -0.92 0.00 0.00 0.00 179.25 178.83 1b9d h TYR 99 N 0.72 1.00 -0.85 0.00 3.20 -1.02 -0.88 116.97 119.14 1b9d h TYR 99 Ca 0.19 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1b9d h TYR 99 Cb 0.09 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.01 1b9d h TYR 99 CO -0.01 0.77 0.49 0.35 -1.64 0.00 0.00 178.16 178.12 1b9d h PHE 100 N 0.94 1.13 -0.61 -3.82 3.04 -1.03 -1.49 116.94 115.10 1b9d h PHE 100 Ca 0.22 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.15 1b9d h PHE 100 Cb 0.18 -0.37 -0.03 0.00 2.56 0.00 0.00 35.95 38.29 1b9d h PHE 100 CO 0.01 0.76 0.32 -0.07 -2.02 0.00 0.00 178.31 177.32 1b9d h LEU 101 N 1.18 0.76 -0.45 0.59 3.38 -0.96 0.29 115.31 120.10 1b9d h LEU 101 Ca 0.30 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 1b9d h LEU 101 Cb -0.02 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1b9d h LEU 101 CO -0.05 0.65 -0.07 0.25 0.09 0.00 0.00 178.44 179.30 1b9d h LEU 102 N 0.82 0.84 0.24 1.67 5.85 -0.80 -0.85 115.31 123.09 1b9d h LEU 102 Ca 0.21 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.60 1b9d h LEU 102 Cb 0.06 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 1b9d h LEU 102 CO -0.03 0.99 -0.30 0.11 -0.34 0.00 0.00 178.44 178.87 1b9d h LYS 103 N 0.68 -0.57 -0.83 1.25 1.57 -1.09 -2.23 116.57 115.35 1b9d h LYS 103 Ca 0.12 0.04 0.15 0.00 -1.87 0.00 0.00 60.65 59.09 1b9d h LYS 103 Cb 0.60 0.13 -0.10 0.00 0.08 0.00 0.00 32.23 32.94 1b9d h LYS 103 CO 0.04 -0.38 0.40 1.25 -0.57 0.00 0.00 179.45 180.19 1b9d h LEU 104 N -0.59 0.46 -1.23 2.94 5.85 -0.71 -2.47 115.31 119.55 1b9d h LEU 104 Ca 0.00 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1b9d h LEU 104 Cb 0.57 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 1b9d h LEU 104 CO -0.10 0.18 -0.08 0.00 -0.34 0.00 0.00 178.44 178.10 1b9d h ALA 105 N 1.56 1.01 -0.00 1.25 0.00 -1.03 -0.97 119.26 121.08 1b9d h ALA 105 Ca 0.46 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1b9d h ALA 105 Cb 0.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1b9d h ALA 105 CO -0.38 0.10 -0.22 0.41 0.00 0.00 0.00 179.25 179.15 1b9d n GLY 106 N 0.16 -1.16 0.09 0.00 0.00 -0.85 -4.10 105.19 99.32 1b9d n GLY 106 Ca 0.01 -0.26 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 1b9d n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b9d n ARG 107 N -1.25 1.09 -4.13 1.61 1.74 -0.48 -5.03 116.66 110.20 1b9d n ARG 107 Ca 0.09 0.04 -0.11 0.00 -0.77 0.00 0.00 57.85 57.10 1b9d n ARG 107 Cb 0.32 -1.41 -0.10 0.00 -1.02 0.00 0.00 32.46 30.25 1b9d n ARG 107 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1b9d s TRP 108 N -2.39 0.81 -1.05 -1.55 0.52 -0.54 -5.09 118.94 109.64 1b9d s TRP 108 Ca -0.15 -0.79 -0.22 0.00 0.02 0.00 0.00 56.10 54.95 1b9d s TRP 108 Cb 0.06 -0.47 0.03 0.00 -1.15 0.00 0.00 33.47 31.93 1b9d s TRP 108 CO 0.59 -0.14 1.59 -1.25 0.02 0.00 0.00 176.95 177.75 1b9d s PRO 109 N -3.15 3.46 -0.31 4.98 0.04 -1.26 -4.31 135.00 134.45 1b9d s PRO 109 Ca 0.05 -1.14 -0.23 0.00 0.04 0.00 0.00 61.00 59.72 1b9d s PRO 109 Cb 0.01 -5.34 0.00 0.00 0.04 0.00 0.00 34.50 29.21 1b9d s PRO 109 CO -0.03 -2.46 0.79 0.08 0.04 0.00 0.00 177.00 175.41 1b9d s VAL 110 N 5.85 4.79 -0.22 -0.36 1.01 -1.26 -4.45 120.40 125.76 1b9d s VAL 110 Ca 0.52 1.16 -0.01 0.00 0.00 0.00 0.00 61.98 63.66 1b9d s VAL 110 Cb -0.00 -4.15 -0.14 0.00 0.00 0.00 0.00 36.38 32.09 1b9d s VAL 110 CO -0.05 -0.26 -0.21 2.29 0.00 0.00 0.00 175.10 176.87 1b9d n LYS 111 N 6.21 0.55 -3.99 2.72 2.85 -0.08 -4.66 118.16 121.75 1b9d n LYS 111 Ca 0.04 0.14 -0.09 0.00 -1.05 0.00 0.00 58.31 57.35 1b9d n LYS 111 Cb 0.48 -1.43 -0.11 0.00 -0.65 0.00 0.00 35.03 33.32 1b9d n LYS 111 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1b9d s THR 112 N -2.44 0.12 -0.03 0.58 -4.23 -0.93 -1.80 115.64 106.91 1b9d s THR 112 Ca -0.30 -1.01 0.03 0.00 -1.18 0.00 0.00 61.69 59.23 1b9d s THR 112 Cb 0.09 -0.41 0.00 0.00 1.34 0.00 0.00 72.50 73.52 1b9d s THR 112 CO 0.50 -0.56 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.20 1b9d s VAL 113 N -1.74 1.09 0.23 2.29 1.01 -0.59 -1.70 120.40 120.99 1b9d s VAL 113 Ca -0.13 -0.53 0.09 0.00 0.00 0.00 0.00 61.98 61.41 1b9d s VAL 113 Cb -0.08 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 1b9d s VAL 113 CO -0.02 0.32 -0.05 -2.28 0.00 0.00 0.00 175.10 173.08 1b9d s HIS 114 N 0.12 2.66 0.14 5.22 5.04 0.30 -0.95 115.29 127.81 1b9d s HIS 114 Ca -0.03 -0.22 -0.08 0.00 -1.54 0.00 0.00 55.06 53.18 1b9d s HIS 114 Cb -0.10 -1.23 -0.01 0.00 0.04 0.00 0.00 32.58 31.28 1b9d s HIS 114 CO 0.01 0.58 0.24 -0.08 -2.34 0.00 0.00 174.74 173.15 1b9d s THR 115 N -2.07 0.09 -2.26 0.89 -1.32 -1.26 -1.34 115.64 108.38 1b9d s THR 115 Ca 0.29 -1.36 0.22 0.00 -1.21 0.00 0.00 61.69 59.63 1b9d s THR 115 Cb -0.07 -1.70 0.50 0.00 -1.51 0.00 0.00 72.50 69.72 1b9d s THR 115 CO 0.18 -0.42 1.46 0.47 -2.21 0.00 0.00 174.62 174.10 1b9d n ASP 116 N -0.16 3.40 -3.57 8.08 8.00 -1.26 -4.58 116.55 126.46 1b9d n ASP 116 Ca -0.10 -1.98 -0.29 0.00 0.71 0.00 0.00 54.79 53.14 1b9d n ASP 116 Cb 0.63 -0.33 -0.12 0.00 -0.02 0.00 0.00 41.12 41.28 1b9d n ASP 116 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1b9d s ASN 117 N -1.28 3.10 0.47 -2.24 3.04 -1.26 -5.01 114.94 111.76 1b9d s ASN 117 Ca 0.41 -2.53 0.15 0.00 0.04 0.00 0.00 52.86 50.94 1b9d s ASN 117 Cb 0.23 -0.69 1.13 0.00 -1.54 0.00 0.00 41.25 40.38 1b9d s ASN 117 CO 0.31 -0.27 2.04 1.23 -3.04 0.00 0.00 177.10 177.38 1b9d h GLY 118 N 6.67 0.31 2.00 1.21 0.00 -2.00 -1.16 103.07 110.11 1b9d h GLY 118 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1b9d h GLY 118 CO 0.38 0.07 0.00 1.48 0.00 0.00 0.00 176.54 178.47 1b9d h SER 119 N 0.25 0.00 0.33 0.19 4.64 -1.99 -1.43 113.55 115.54 1b9d h SER 119 Ca 0.17 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1b9d h SER 119 Cb 0.37 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1b9d h SER 119 CO -0.03 0.00 -0.01 0.78 -0.87 0.00 0.00 176.83 176.70 1b9d h ASN 120 N 0.00 0.00 -0.31 4.97 2.35 -1.65 -2.88 115.58 118.07 1b9d h ASN 120 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1b9d h ASN 120 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.40 1b9d h ASN 120 CO 0.00 0.01 0.00 0.49 -1.65 0.00 0.00 177.43 176.28 1b9d n PHE 121 N -3.15 0.81 0.31 1.19 3.72 -0.54 -4.71 117.46 115.09 1b9d n PHE 121 Ca -0.02 -0.73 0.12 0.00 -0.05 0.00 0.00 57.45 56.77 1b9d n PHE 121 Cb 0.15 -0.21 0.08 0.00 -0.94 0.00 0.00 39.48 38.56 1b9d n PHE 121 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1b9d h THR 122 N 1.98 0.00 -4.08 4.37 1.35 -1.66 -3.41 112.91 111.46 1b9d h THR 122 Ca 0.00 -0.78 -0.51 0.00 -0.55 0.00 0.00 66.41 64.57 1b9d h THR 122 Cb 1.20 1.34 0.08 0.00 -1.73 0.00 0.00 68.15 69.05 1b9d h THR 122 CO 0.15 0.00 0.45 -0.94 -0.25 0.00 0.00 175.52 174.93 1b9d s SER 123 N -4.93 5.65 0.23 5.36 1.04 -1.26 -4.86 113.70 114.92 1b9d s SER 123 Ca 0.03 2.25 -0.07 0.00 0.48 0.00 0.00 55.95 58.64 1b9d s SER 123 Cb 0.11 -2.59 0.39 0.00 0.10 0.00 0.00 66.02 64.03 1b9d s SER 123 CO 0.75 -1.27 1.70 0.74 0.98 0.00 0.00 173.24 176.14 1b9d h THR 124 N 1.21 0.60 -0.27 2.02 2.02 -1.99 -1.84 112.91 114.66 1b9d h THR 124 Ca -0.50 -0.11 0.03 0.00 0.77 0.00 0.00 66.41 66.60 1b9d h THR 124 Cb 1.27 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 1b9d h THR 124 CO 0.57 0.06 0.10 0.74 0.37 0.00 0.00 175.52 177.35 1b9d h THR 125 N 0.31 0.93 -0.50 3.16 2.02 -1.92 0.65 112.91 117.56 1b9d h THR 125 Ca 0.37 -0.08 -0.10 0.00 0.77 0.00 0.00 66.41 67.37 1b9d h THR 125 Cb 0.58 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1b9d h THR 125 CO -0.44 0.04 -0.08 0.58 0.37 0.00 0.00 175.52 175.99 1b9d h VAL 126 N 0.22 1.27 -0.97 3.16 2.07 -1.73 -2.25 116.25 118.03 1b9d h VAL 126 Ca 0.12 -1.20 0.04 0.00 0.82 0.00 0.00 66.70 66.48 1b9d h VAL 126 Cb 0.09 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 1b9d h VAL 126 CO -0.12 0.42 0.63 0.11 0.02 0.00 0.00 177.57 178.63 1b9d h LYS 127 N 0.80 1.17 -0.54 1.57 1.57 -1.11 -0.94 116.57 119.09 1b9d h LYS 127 Ca 0.13 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.76 1b9d h LYS 127 Cb 0.63 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1b9d h LYS 127 CO 0.04 0.78 0.01 0.00 -0.57 0.00 0.00 179.45 179.71 1b9d h ALA 128 N 1.44 1.01 -0.41 3.86 0.00 -0.60 0.63 119.26 125.20 1b9d h ALA 128 Ca 0.39 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1b9d h ALA 128 Cb 0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1b9d h ALA 128 CO -0.12 0.61 -0.03 0.00 0.00 0.00 0.00 179.25 179.70 1b9d h ALA 129 N 1.17 0.56 -0.86 0.00 0.00 -0.76 0.54 119.26 119.90 1b9d h ALA 129 Ca 0.16 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1b9d h ALA 129 Cb 0.48 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1b9d h ALA 129 CO 0.02 0.37 0.42 0.00 0.00 0.00 0.00 179.25 180.07 1b9d h TRP 131 N 1.23 -0.23 -0.38 0.00 7.01 -0.69 0.41 115.95 123.30 1b9d h TRP 131 Ca 0.30 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.28 1b9d h TRP 131 Cb 0.10 0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.22 1b9d h TRP 131 CO 0.01 -0.14 0.19 2.35 -2.79 0.00 0.00 178.44 178.06 1b9d h TRP 132 N -0.25 0.53 0.00 2.65 7.01 -0.71 -2.76 115.95 122.43 1b9d h TRP 132 Ca -0.02 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.96 1b9d h TRP 132 Cb 0.19 -0.17 0.00 0.00 -2.10 0.00 0.00 29.16 27.08 1b9d h TRP 132 CO -0.07 0.44 0.00 0.00 -2.79 0.00 0.00 178.44 176.02 1b9d n ALA 133 N -2.26 2.55 -2.29 2.65 0.00 -0.65 -4.92 120.51 115.59 1b9d n ALA 133 Ca -0.00 -0.17 -0.07 0.00 0.00 0.00 0.00 53.44 53.20 1b9d n ALA 133 Cb 0.10 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.07 1b9d n ALA 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b9d n GLY 134 N 0.99 0.18 3.91 0.00 0.00 -0.18 -5.00 105.19 105.08 1b9d n GLY 134 Ca 0.19 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 1b9d n GLY 134 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b9d s ILE 135 N -2.51 5.27 0.25 -0.61 1.01 -0.04 -4.87 121.20 119.70 1b9d s ILE 135 Ca 0.04 -0.13 0.08 0.00 0.00 0.00 0.00 60.65 60.64 1b9d s ILE 135 Cb -0.02 -3.62 -0.05 0.00 0.01 0.00 0.00 42.46 38.78 1b9d s ILE 135 CO 0.05 0.12 -0.11 -0.54 0.00 0.00 0.00 174.94 174.46 1b9d s LYS 136 N -2.50 1.46 0.13 2.79 -0.14 -0.75 -4.54 119.74 116.20 1b9d s LYS 136 Ca 0.37 -1.69 -0.27 0.00 -1.36 0.00 0.00 55.97 53.02 1b9d s LYS 136 Cb -0.13 -1.18 -0.07 0.00 -1.68 0.00 0.00 37.83 34.77 1b9d s LYS 136 CO 0.25 0.13 0.83 -1.14 -0.76 0.00 0.00 175.35 174.66 1b9d s GLN 137 N -3.67 4.62 -0.20 1.68 0.74 -1.26 -1.54 119.66 120.03 1b9d s GLN 137 Ca 0.26 1.23 -0.27 0.00 0.05 0.00 0.00 55.36 56.64 1b9d s GLN 137 Cb 0.01 -3.31 -0.00 0.00 1.10 0.00 0.00 33.01 30.80 1b9d s GLN 137 CO 0.10 0.42 0.92 -2.00 -0.55 0.00 0.00 175.29 174.18 1b9d s GLU 138 N -0.65 4.28 -0.02 1.67 2.12 -0.12 -4.79 118.70 121.18 1b9d s GLU 138 Ca 0.39 1.17 0.09 0.00 0.36 0.00 0.00 54.97 56.98 1b9d s GLU 138 Cb -0.23 -3.61 0.29 0.00 0.26 0.00 0.00 34.13 30.84 1b9d s GLU 138 CO 0.27 -0.47 1.18 1.19 -0.54 0.00 0.00 175.26 176.89 1b9d n PHE 139 N 5.72 0.51 0.00 5.30 3.72 -1.26 -4.67 117.46 126.78 1b9d n PHE 139 Ca 0.08 -0.23 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 1b9d n PHE 139 Cb 0.48 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.95 1b9d n PHE 139 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b9d n GLY 140 N 0.83 3.47 0.04 1.37 0.00 -1.26 -5.23 105.19 104.40 1b9d n GLY 140 Ca 0.11 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.20 1b9d n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b9d n GLY 149 N -0.27 -1.24 0.12 -0.02 0.00 -1.26 -5.20 105.19 97.32 1b9d n GLY 149 Ca 0.00 -0.25 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 1b9d n GLY 149 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1b9d h VAL 150 N 0.18 0.88 -0.35 1.61 3.04 -2.00 -2.93 116.25 116.68 1b9d h VAL 150 Ca 0.00 -0.14 -0.05 0.00 -1.01 0.00 0.00 66.70 65.50 1b9d h VAL 150 Cb 0.47 0.97 -0.02 0.00 -2.01 0.00 0.00 31.29 30.70 1b9d h VAL 150 CO 0.00 0.03 -0.01 0.40 -1.01 0.00 0.00 177.57 176.98 1b9d h ILE 151 N -0.27 1.21 -0.35 3.17 2.04 -1.98 -2.59 117.51 118.74 1b9d h ILE 151 Ca -0.02 -0.83 -0.14 0.00 1.00 0.00 0.00 64.86 64.87 1b9d h ILE 151 Cb 0.21 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1b9d h ILE 151 CO 0.03 0.28 -0.35 -0.33 0.00 0.00 0.00 178.15 177.79 1b9d h GLU 152 N 0.53 0.79 0.00 2.37 5.08 -2.01 -3.02 114.58 118.32 1b9d h GLU 152 Ca 0.11 -0.39 -0.06 0.00 -1.00 0.00 0.00 59.36 58.03 1b9d h GLU 152 Cb 0.36 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1b9d h GLU 152 CO 0.01 1.01 -0.29 0.66 -1.00 0.00 0.00 179.01 179.41 1b9d h SER 153 N 0.66 0.00 1.44 1.42 4.64 -1.32 -3.23 113.55 117.16 1b9d h SER 153 Ca 0.07 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1b9d h SER 153 Cb 0.89 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1b9d h SER 153 CO 0.08 0.29 -0.56 0.24 -0.87 0.00 0.00 176.83 176.00 1b9d h MET 154 N 0.00 0.00 0.00 4.77 2.86 -1.35 -3.20 114.93 118.01 1b9d h MET 154 Ca -0.00 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.44 1b9d h MET 154 Cb 0.89 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.51 1b9d h MET 154 CO 0.04 0.01 -1.48 0.09 1.06 0.00 0.00 176.91 176.63 1b9d n ASN 155 N -2.88 0.87 0.08 1.22 4.13 -1.16 -2.28 115.26 115.24 1b9d n ASN 155 Ca 0.02 0.39 0.04 0.00 1.68 0.00 0.00 54.58 56.71 1b9d n ASN 155 Cb 0.55 0.10 -0.03 0.00 -1.54 0.00 0.00 39.78 38.86 1b9d n ASN 155 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1b9d h LYS 156 N 0.00 0.00 -0.56 3.52 6.56 -1.74 -2.95 116.57 121.41 1b9d h LYS 156 Ca -0.19 0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.35 1b9d h LYS 156 Cb 1.68 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 33.32 1b9d h LYS 156 CO 0.05 0.24 0.16 1.49 -2.06 0.00 0.00 179.45 179.33 1b9d h GLU 157 N 0.00 0.88 -0.40 3.15 4.81 -1.66 -0.34 114.58 121.02 1b9d h GLU 157 Ca -0.08 -0.20 -0.05 0.00 -0.13 0.00 0.00 59.36 58.90 1b9d h GLU 157 Cb 1.37 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 1b9d h GLU 157 CO 0.03 0.81 0.06 1.25 -0.73 0.00 0.00 179.01 180.43 1b9d h LEU 158 N 0.79 0.65 -1.06 1.64 5.85 -1.48 0.92 115.31 122.62 1b9d h LEU 158 Ca 0.18 -0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 1b9d h LEU 158 Cb 0.30 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 1b9d h LEU 158 CO -0.00 0.75 0.17 0.11 -0.34 0.00 0.00 178.44 179.13 1b9d h LYS 159 N 0.52 0.85 0.29 1.25 1.57 -1.40 0.14 116.57 119.79 1b9d h LYS 159 Ca 0.12 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1b9d h LYS 159 Cb 0.38 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1b9d h LYS 159 CO 0.01 0.73 -0.14 -0.22 -0.57 0.00 0.00 179.45 179.27 1b9d h LYS 160 N 0.82 -0.37 -0.87 3.15 3.64 -0.65 0.09 116.57 122.40 1b9d h LYS 160 Ca 0.19 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1b9d h LYS 160 Cb 0.24 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 1b9d h LYS 160 CO -0.01 -0.23 0.43 0.82 -2.27 0.00 0.00 179.45 178.19 1b9d h ILE 161 N -0.40 1.26 -0.60 2.00 2.04 -0.49 -2.20 117.51 119.13 1b9d h ILE 161 Ca -0.04 -0.71 0.07 0.00 1.00 0.00 0.00 64.86 65.19 1b9d h ILE 161 Cb 0.31 0.14 -0.06 0.00 -0.74 0.00 0.00 36.82 36.46 1b9d h ILE 161 CO 0.06 0.31 0.27 0.40 0.00 0.00 0.00 178.15 179.19 1b9d h ILE 162 N 1.23 0.86 -0.64 -0.67 2.04 -0.46 -1.87 117.51 118.00 1b9d h ILE 162 Ca 0.30 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 66.03 1b9d h ILE 162 Cb 0.09 0.33 -0.05 0.00 -0.74 0.00 0.00 36.82 36.45 1b9d h ILE 162 CO -0.04 0.09 0.38 1.23 0.00 0.00 0.00 178.15 179.81 1b9d h GLY 163 N 0.49 0.92 1.46 5.37 0.00 -0.49 -0.33 103.07 110.50 1b9d h GLY 163 Ca 0.29 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 1b9d h GLY 163 CO -0.24 0.21 0.13 1.46 0.00 0.00 0.00 176.54 178.10 1b9d h GLN 164 N 0.73 0.69 -0.18 4.80 4.20 -0.77 -3.14 115.11 121.43 1b9d h GLN 164 Ca 0.27 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1b9d h GLN 164 Cb 0.08 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.75 1b9d h GLN 164 CO -0.13 0.61 0.00 1.33 -0.67 0.00 0.00 178.83 179.97 1b9d n VAL 165 N -4.32 0.25 -0.34 -0.54 0.24 -0.83 -4.66 118.33 108.13 1b9d n VAL 165 Ca 0.03 -0.63 0.07 0.00 -2.04 0.00 0.00 64.34 61.77 1b9d n VAL 165 Cb 0.19 1.20 0.25 0.00 -1.47 0.00 0.00 33.84 34.01 1b9d n VAL 165 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1b9d h ARG 166 N 4.04 0.96 0.00 7.34 9.65 -1.01 0.13 114.38 135.49 1b9d h ARG 166 Ca 0.00 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1b9d h ARG 166 Cb 0.89 -0.22 0.00 0.00 -1.39 0.00 0.00 29.97 29.25 1b9d h ARG 166 CO 0.00 0.63 0.00 -0.25 2.80 0.00 0.00 179.97 183.15 1b9d n ASP 167 N -4.57 0.00 0.06 -3.80 9.92 -1.26 -2.97 116.55 113.93 1b9d n ASP 167 Ca 0.17 -0.06 0.13 0.00 -0.53 0.00 0.00 54.79 54.51 1b9d n ASP 167 Cb 0.32 -0.29 0.33 0.00 -0.64 0.00 0.00 41.12 40.84 1b9d n ASP 167 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 1b9d n GLN 168 N -1.29 0.20 -4.30 -1.24 7.27 0.46 -4.83 117.38 113.66 1b9d n GLN 168 Ca 0.12 0.11 -0.24 0.00 0.07 0.00 0.00 57.00 57.06 1b9d n GLN 168 Cb 0.21 -1.68 -0.13 0.00 2.41 0.00 0.00 30.24 31.05 1b9d n GLN 168 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1b9d s ALA 169 N -3.10 1.78 -0.03 1.69 0.00 -1.16 -5.04 121.76 115.90 1b9d s ALA 169 Ca 0.10 -1.23 -0.25 0.00 0.00 0.00 0.00 51.96 50.57 1b9d s ALA 169 Cb 0.14 -0.24 -0.21 0.00 0.00 0.00 0.00 23.12 22.81 1b9d s ALA 169 CO 0.64 0.36 1.18 0.93 0.00 0.00 0.00 175.76 178.87 1b9d h GLU 170 N 4.12 0.07 -6.07 0.00 3.07 -1.88 -3.45 114.58 110.44 1b9d h GLU 170 Ca -0.46 -0.05 -0.60 0.00 -0.50 0.00 0.00 59.36 57.76 1b9d h GLU 170 Cb 1.18 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 29.05 1b9d h GLU 170 CO 0.40 0.64 -0.34 -1.01 -1.40 0.00 0.00 179.01 177.30 1b9d s HIS 171 N -3.86 3.52 0.21 4.33 3.76 -1.26 -4.99 115.29 117.01 1b9d s HIS 171 Ca -0.16 0.58 -0.09 0.00 -0.15 0.00 0.00 55.06 55.24 1b9d s HIS 171 Cb 0.01 -2.01 0.26 0.00 1.11 0.00 0.00 32.58 31.96 1b9d s HIS 171 CO 0.70 0.51 1.80 1.25 -0.85 0.00 0.00 174.74 178.15 1b9d h LEU 172 N 3.31 0.54 -1.39 0.89 5.85 -1.93 -2.20 115.31 120.37 1b9d h LEU 172 Ca -0.47 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.35 1b9d h LEU 172 Cb 1.18 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 1b9d h LEU 172 CO 0.70 0.34 0.47 0.07 -0.34 0.00 0.00 178.44 179.68 1b9d h LYS 173 N 0.67 0.71 -0.23 1.25 2.10 -1.99 0.26 116.57 119.34 1b9d h LYS 173 Ca 0.31 -0.04 -0.02 0.00 -2.00 0.00 0.00 60.65 58.90 1b9d h LYS 173 Cb 0.22 -0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 31.38 1b9d h LYS 173 CO -0.20 0.47 0.07 1.15 -2.00 0.00 0.00 179.45 178.94 1b9d h THR 174 N 0.73 1.20 -0.52 0.07 2.02 -1.82 -2.21 112.91 112.38 1b9d h THR 174 Ca 0.31 -0.64 0.03 0.00 0.77 0.00 0.00 66.41 66.88 1b9d h THR 174 Cb 0.27 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1b9d h THR 174 CO -0.10 0.20 0.34 0.00 0.37 0.00 0.00 175.52 176.34 1b9d h ALA 175 N 0.89 1.75 -0.18 6.16 0.00 -1.01 -0.22 119.26 126.65 1b9d h ALA 175 Ca 0.07 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1b9d h ALA 175 Cb 0.25 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1b9d h ALA 175 CO -0.00 0.20 0.10 0.28 0.00 0.00 0.00 179.25 179.83 1b9d h VAL 176 N 0.59 1.09 0.00 0.00 2.07 -0.72 -0.19 116.25 119.10 1b9d h VAL 176 Ca 0.21 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.45 1b9d h VAL 176 Cb 0.09 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1b9d h VAL 176 CO -0.05 0.08 -0.24 1.56 0.02 0.00 0.00 177.57 178.93 1b9d h GLN 177 N 0.20 0.00 -0.61 1.57 1.08 -0.71 -0.73 115.11 115.91 1b9d h GLN 177 Ca 0.06 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.18 1b9d h GLN 177 Cb 0.04 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.45 1b9d h GLN 177 CO -0.01 0.24 0.05 0.52 -0.95 0.00 0.00 178.83 178.68 1b9d h MET 178 N 0.00 1.04 -0.20 1.46 2.86 -0.74 -1.84 114.93 117.51 1b9d h MET 178 Ca -0.00 -0.30 -0.12 0.00 -2.06 0.00 0.00 59.70 57.22 1b9d h MET 178 Cb 0.80 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1b9d h MET 178 CO 0.03 0.99 -0.37 0.00 1.06 0.00 0.00 176.91 178.62 1b9d h ALA 179 N 1.08 0.98 -0.35 6.32 0.00 -0.45 -0.09 119.26 126.75 1b9d h ALA 179 Ca 0.18 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1b9d h ALA 179 Cb 0.49 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1b9d h ALA 179 CO 0.02 0.61 0.17 0.28 0.00 0.00 0.00 179.25 180.33 1b9d h VAL 180 N 0.38 1.17 -0.86 0.00 2.07 -0.96 0.40 116.25 118.45 1b9d h VAL 180 Ca 0.04 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 1b9d h VAL 180 Cb 0.83 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 1b9d h VAL 180 CO 0.07 0.18 0.53 0.15 0.02 0.00 0.00 177.57 178.52 1b9d h PHE 181 N 0.43 1.12 -0.22 1.57 3.04 -1.06 -0.86 116.94 120.95 1b9d h PHE 181 Ca 0.12 0.01 -0.10 0.00 3.98 0.00 0.00 57.97 61.97 1b9d h PHE 181 Cb 0.13 -0.37 -0.00 0.00 2.56 0.00 0.00 35.95 38.26 1b9d h PHE 181 CO -0.01 0.74 -0.26 0.82 -2.02 0.00 0.00 178.31 177.57 1b9d h ILE 182 N 1.18 1.32 -0.22 1.41 2.04 -0.67 -2.23 117.51 120.34 1b9d h ILE 182 Ca 0.31 -1.44 0.05 0.00 1.00 0.00 0.00 64.86 64.78 1b9d h ILE 182 Cb -0.07 1.73 -0.06 0.00 -0.74 0.00 0.00 36.82 37.68 1b9d h ILE 182 CO -0.06 0.45 -0.16 -0.74 0.00 0.00 0.00 178.15 177.64 1b9d h HIS 183 N 0.26 -0.40 0.00 1.37 2.76 -0.74 -1.87 115.15 116.54 1b9d h HIS 183 Ca 0.03 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.17 1b9d h HIS 183 Cb 0.82 0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.98 1b9d h HIS 183 CO 0.08 -0.23 -0.31 -0.91 -1.30 0.00 0.00 177.93 175.26 1b9d h ASN 184 N -0.16 0.00 0.29 3.26 2.35 -1.00 -2.99 115.58 117.33 1b9d h ASN 184 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1b9d h ASN 184 Cb 0.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1b9d h ASN 184 CO -0.31 0.31 -0.71 0.29 -1.65 0.00 0.00 177.43 175.35 1b9d n LYS 185 N -3.44 0.00 -2.14 0.81 5.02 -0.85 -1.38 118.16 116.17 1b9d n LYS 185 Ca 0.00 -0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 1b9d n LYS 185 Cb 0.48 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.97 1b9d n LYS 185 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1b9d s LYS 186 N -3.00 4.21 -0.01 1.97 2.47 -0.72 -4.71 119.74 119.95 1b9d s LYS 186 Ca 0.10 2.03 -0.29 0.00 -1.56 0.00 0.00 55.97 56.24 1b9d s LYS 186 Cb 0.17 -3.86 -0.03 0.00 -1.46 0.00 0.00 37.83 32.65 1b9d s LYS 186 CO 0.77 -0.77 0.96 1.03 0.16 0.00 0.00 175.35 177.50 1b9d s ARG 187 N 3.63 4.55 -0.85 4.03 0.52 -1.26 -4.17 118.95 125.40 1b9d s ARG 187 Ca 0.67 1.38 -0.04 0.00 -0.52 0.00 0.00 55.73 57.22 1b9d s ARG 187 Cb -0.30 -3.46 0.21 0.00 0.52 0.00 0.00 34.95 31.92 1b9d s ARG 187 CO 0.25 -0.05 0.73 0.15 0.02 0.00 0.00 175.30 176.41 1b9d s LYS 188 N 1.01 3.25 0.00 3.54 1.02 -0.70 -4.91 119.74 122.96 1b9d s LYS 188 Ca 0.51 -2.99 0.00 0.00 0.02 0.00 0.00 55.97 53.51 1b9d s LYS 188 Cb -0.21 -4.03 0.00 0.00 -0.52 0.00 0.00 37.83 33.07 1b9d s LYS 188 CO 0.27 -1.24 0.00 0.41 -0.92 0.00 0.00 175.35 173.87 1b9d n GLY 189 N 2.86 4.08 0.00 -3.33 0.00 -1.26 -4.05 105.19 103.48 1b9d n GLY 189 Ca 0.17 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1b9d n GLY 189 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b9d n GLY 193 N 0.00 1.19 3.97 -0.02 0.00 -1.26 -5.23 105.19 103.83 1b9d n GLY 193 Ca 0.00 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 1b9d n GLY 193 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b9d s TYR 194 N 0.00 2.81 0.61 1.61 2.02 -1.26 -4.76 117.35 118.38 1b9d s TYR 194 Ca 0.00 0.02 -0.05 0.00 -0.37 0.00 0.00 57.07 56.68 1b9d s TYR 194 Cb 0.00 -2.81 0.03 0.00 -0.40 0.00 0.00 41.96 38.77 1b9d s TYR 194 CO 0.00 -0.97 0.90 -1.54 -1.57 0.00 0.00 175.55 172.37 1b9d s SER 195 N -4.45 5.33 0.32 2.29 1.04 -1.26 -1.72 113.70 115.25 1b9d s SER 195 Ca 0.58 0.51 0.00 0.00 0.48 0.00 0.00 55.95 57.53 1b9d s SER 195 Cb -0.10 -1.41 0.53 0.00 0.10 0.00 0.00 66.02 65.14 1b9d s SER 195 CO 0.39 -1.21 1.96 0.00 0.98 0.00 0.00 173.24 175.37 1b9d h ALA 196 N -0.23 1.44 -0.54 5.32 0.00 -1.71 -0.12 119.26 123.41 1b9d h ALA 196 Ca -0.45 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.28 1b9d h ALA 196 Cb 1.28 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1b9d h ALA 196 CO 0.59 0.48 -0.09 0.78 0.00 0.00 0.00 179.25 181.02 1b9d h GLY 197 N 0.96 1.09 1.03 0.00 0.00 -1.55 0.87 103.07 105.46 1b9d h GLY 197 Ca 0.24 -0.85 -0.02 0.00 0.00 0.00 0.00 47.33 46.70 1b9d h GLY 197 CO -0.05 0.78 0.47 0.83 0.00 0.00 0.00 176.54 178.58 1b9d h GLU 198 N 0.90 1.21 -0.42 4.80 5.08 -1.62 -2.95 114.58 121.58 1b9d h GLU 198 Ca 0.15 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 1b9d h GLU 198 Cb 0.64 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1b9d h GLU 198 CO 0.04 0.89 -0.06 0.00 -1.00 0.00 0.00 179.01 178.88 1b9d h ARG 199 N 1.21 0.79 -0.60 2.33 3.08 -0.65 -2.06 114.38 118.48 1b9d h ARG 199 Ca 0.31 -0.28 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 1b9d h ARG 199 Cb 0.03 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1b9d h ARG 199 CO -0.05 0.89 0.13 0.97 -1.07 0.00 0.00 179.97 180.84 1b9d h ILE 200 N 0.62 1.25 -0.17 2.04 2.10 -0.81 -0.48 117.51 122.06 1b9d h ILE 200 Ca 0.11 -0.94 -0.11 0.00 1.08 0.00 0.00 64.86 65.01 1b9d h ILE 200 Cb 0.58 0.71 -0.01 0.00 -1.09 0.00 0.00 36.82 37.00 1b9d h ILE 200 CO 0.03 0.35 -0.36 -0.37 -1.08 0.00 0.00 178.15 176.72 1b9d h VAL 201 N 0.88 1.29 -0.14 2.19 -1.51 -1.42 -0.73 116.25 116.82 1b9d h VAL 201 Ca 0.19 -1.44 -0.01 0.00 -1.23 0.00 0.00 66.70 64.21 1b9d h VAL 201 Cb 0.38 1.56 -0.01 0.00 -2.13 0.00 0.00 31.29 31.09 1b9d h VAL 201 CO 0.01 0.44 0.04 -0.78 -1.23 0.00 0.00 177.57 176.05 1b9d h ASP 202 N 0.30 0.20 -0.12 4.19 3.58 -1.04 0.56 116.42 124.09 1b9d h ASP 202 Ca 0.03 -0.21 0.03 0.00 0.42 0.00 0.00 57.03 57.31 1b9d h ASP 202 Cb 0.78 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.75 1b9d h ASP 202 CO 0.06 0.35 -0.07 0.40 -2.88 0.00 0.00 179.24 177.10 1b9d h ILE 203 N 0.03 0.78 -0.41 2.25 2.04 -0.91 0.61 117.51 121.90 1b9d h ILE 203 Ca 0.04 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.77 1b9d h ILE 203 Cb 0.23 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1b9d h ILE 203 CO -0.00 0.00 -0.26 0.40 0.00 0.00 0.00 178.15 178.29 1b9d h ILE 204 N -0.07 1.28 -0.54 -0.67 1.08 -1.04 -1.11 117.51 116.43 1b9d h ILE 204 Ca 0.07 -1.42 -0.08 0.00 -0.39 0.00 0.00 64.86 63.05 1b9d h ILE 204 Cb 0.18 1.28 -0.02 0.00 -3.07 0.00 0.00 36.82 35.19 1b9d h ILE 204 CO -0.17 0.48 0.04 0.00 -0.69 0.00 0.00 178.15 177.81 1b9d h ALA 205 N 0.81 0.72 -0.63 1.87 0.00 -0.69 -1.29 119.26 120.05 1b9d h ALA 205 Ca 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1b9d h ALA 205 Cb 0.84 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1b9d h ALA 205 CO 0.07 0.51 0.34 1.15 0.00 0.00 0.00 179.25 181.32 1b9d h THR 206 N 0.80 1.20 -0.45 0.00 2.02 -0.81 -1.95 112.91 113.72 1b9d h THR 206 Ca 0.16 -0.52 -0.02 0.00 0.77 0.00 0.00 66.41 66.80 1b9d h THR 206 Cb 0.48 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1b9d h THR 206 CO 0.02 0.22 0.19 -0.78 0.37 0.00 0.00 175.52 175.54 1b9d h ASP 207 N 0.86 0.58 -0.10 4.18 3.58 -0.90 -2.75 116.42 121.88 1b9d h ASP 207 Ca 0.22 -0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.61 1b9d h ASP 207 Cb 0.05 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 40.95 1b9d h ASP 207 CO -0.04 0.52 0.04 0.40 -2.88 0.00 0.00 179.24 177.28 1b9d h ILE 208 N 0.64 1.15 0.00 2.25 2.04 -0.46 -3.30 117.51 119.83 1b9d h ILE 208 Ca 0.16 -0.43 -0.61 0.00 1.00 0.00 0.00 64.86 64.97 1b9d h ILE 208 Cb 0.11 1.26 0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1b9d h ILE 208 CO -0.02 0.13 3.54 0.00 0.00 0.00 0.00 178.15 181.80 1b9d n GLN 209 N -4.92 3.28 -0.65 2.37 6.02 -1.04 -5.13 117.38 117.31 1b9d n GLN 209 Ca -0.06 -2.08 0.00 0.00 -0.01 0.00 0.00 57.00 54.86 1b9d n GLN 209 Cb 0.11 -2.77 0.00 0.00 1.02 0.00 0.00 30.24 28.60 1b9d n GLN 209 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30