#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1au0 s PRO 2 N 0.00 4.12 -1.31 0.00 0.04 -1.26 -4.89 135.00 131.71 1au0 s PRO 2 Ca 0.00 2.58 -0.17 0.00 0.04 0.00 0.00 61.00 63.45 1au0 s PRO 2 Cb 0.00 -3.03 0.02 0.00 0.04 0.00 0.00 34.50 31.52 1au0 s PRO 2 CO 0.00 -0.65 2.01 -0.25 0.04 0.00 0.00 177.00 178.15 1au0 n ASP 3 N 2.52 4.02 -3.65 6.66 8.00 -1.26 -4.85 116.55 127.98 1au0 n ASP 3 Ca 0.10 -2.84 -0.14 0.00 0.71 0.00 0.00 54.79 52.62 1au0 n ASP 3 Cb 0.37 -1.63 -0.07 0.00 -0.02 0.00 0.00 41.12 39.77 1au0 n ASP 3 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1au0 s SER 4 N 3.98 -0.33 -0.12 -2.24 0.01 -1.26 -4.48 113.70 109.26 1au0 s SER 4 Ca 0.52 0.12 -0.07 0.00 1.31 0.00 0.00 55.95 57.84 1au0 s SER 4 Cb 0.10 0.43 0.05 0.00 0.21 0.00 0.00 66.02 66.80 1au0 s SER 4 CO 0.01 -0.63 0.28 0.54 0.41 0.00 0.00 173.24 173.85 1au0 s VAL 5 N -2.12 -0.03 -0.27 3.43 0.11 -1.17 -5.00 120.40 115.34 1au0 s VAL 5 Ca -0.07 0.11 -0.02 0.00 -2.93 0.00 0.00 61.98 59.07 1au0 s VAL 5 Cb -0.01 -0.43 0.09 0.00 -1.53 0.00 0.00 36.38 34.50 1au0 s VAL 5 CO 0.00 0.05 0.08 -0.62 -3.33 0.00 0.00 175.10 171.28 1au0 s ASP 6 N 1.09 3.61 0.17 3.54 2.15 -1.26 -1.80 116.67 124.17 1au0 s ASP 6 Ca -0.08 -1.33 0.20 0.00 0.43 0.00 0.00 52.55 51.77 1au0 s ASP 6 Cb -0.08 -0.71 0.84 0.00 -0.30 0.00 0.00 42.92 42.67 1au0 s ASP 6 CO -0.08 -0.38 1.60 -1.22 -0.17 0.00 0.00 175.17 174.92 1au0 n TYR 7 N 4.97 0.52 -0.04 -5.34 4.01 -0.30 -3.23 117.16 117.75 1au0 n TYR 7 Ca -0.05 0.21 -0.10 0.00 -0.16 0.00 0.00 57.90 57.80 1au0 n TYR 7 Cb 0.44 -0.84 -0.04 0.00 -0.31 0.00 0.00 39.34 38.58 1au0 n TYR 7 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1au0 h ARG 8 N 0.00 0.25 -0.82 -0.72 3.08 -1.95 -2.42 114.38 111.81 1au0 h ARG 8 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1au0 h ARG 8 Cb 0.29 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1au0 h ARG 8 CO 0.00 0.22 0.00 0.36 -1.07 0.00 0.00 179.97 179.48 1au0 n LYS 9 N -4.92 0.90 0.00 0.04 2.85 -1.20 -2.85 118.16 112.97 1au0 n LYS 9 Ca -0.04 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.22 1au0 n LYS 9 Cb 0.06 -1.41 0.00 0.00 -0.65 0.00 0.00 35.03 33.03 1au0 n LYS 9 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1au0 n LYS 10 N -0.00 0.10 -0.92 -1.58 5.02 -0.92 -5.00 118.16 114.86 1au0 n LYS 10 Ca 0.00 -0.36 0.00 0.00 -2.02 0.00 0.00 58.31 55.93 1au0 n LYS 10 Cb 0.20 -0.85 0.00 0.00 -0.02 0.00 0.00 35.03 34.36 1au0 n LYS 10 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1au0 n GLY 11 N 0.12 0.45 0.02 0.72 0.00 -1.13 -4.93 105.19 100.43 1au0 n GLY 11 Ca 0.00 -0.83 0.12 0.00 0.00 0.00 0.00 46.02 45.31 1au0 n GLY 11 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1au0 n TYR 12 N -2.92 0.18 -4.66 1.61 4.02 -1.15 -4.62 117.16 109.62 1au0 n TYR 12 Ca 0.00 0.05 -0.26 0.00 -0.01 0.00 0.00 57.90 57.68 1au0 n TYR 12 Cb 0.00 -0.37 -0.14 0.00 -0.02 0.00 0.00 39.34 38.81 1au0 n TYR 12 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1au0 s VAL 13 N -3.08 1.75 0.33 -0.72 0.11 -1.26 -3.72 120.40 113.81 1au0 s VAL 13 Ca 0.08 -1.25 0.04 0.00 -2.93 0.00 0.00 61.98 57.92 1au0 s VAL 13 Cb 0.16 -1.52 -0.02 0.00 -1.53 0.00 0.00 36.38 33.47 1au0 s VAL 13 CO 0.74 0.22 0.49 0.42 -3.33 0.00 0.00 175.10 173.63 1au0 s THR 14 N -0.82 4.61 0.48 5.04 -4.23 -1.26 -5.00 115.64 114.46 1au0 s THR 14 Ca 0.08 -0.80 -0.21 0.00 -1.18 0.00 0.00 61.69 59.58 1au0 s THR 14 Cb -0.09 -3.64 -0.10 0.00 1.34 0.00 0.00 72.50 70.01 1au0 s THR 14 CO 0.02 -0.32 0.69 -0.81 -0.54 0.00 0.00 174.62 173.66 1au0 n PRO 15 N -1.68 0.77 -2.04 3.99 -0.04 -1.26 -4.87 135.00 129.86 1au0 n PRO 15 Ca -0.03 0.28 -0.42 0.00 -0.04 0.00 0.00 63.50 63.29 1au0 n PRO 15 Cb 0.57 -1.76 -0.03 0.00 -0.04 0.00 0.00 33.50 32.25 1au0 n PRO 15 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1au0 s VAL 16 N -1.51 3.04 0.25 0.52 1.01 -1.26 -5.01 120.40 117.45 1au0 s VAL 16 Ca 0.66 0.68 0.07 0.00 0.00 0.00 0.00 61.98 63.39 1au0 s VAL 16 Cb -0.52 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 1au0 s VAL 16 CO 0.55 0.04 0.22 -0.54 0.00 0.00 0.00 175.10 175.37 1au0 s LYS 17 N 1.56 2.98 -0.20 2.72 3.01 -1.26 -4.53 119.74 124.03 1au0 s LYS 17 Ca 0.68 -1.03 -0.05 0.00 -1.01 0.00 0.00 55.97 54.57 1au0 s LYS 17 Cb -0.39 -2.60 -0.02 0.00 -1.01 0.00 0.00 37.83 33.81 1au0 s LYS 17 CO 0.31 0.39 -0.01 1.21 0.51 0.00 0.00 175.35 177.76 1au0 s ASN 18 N -3.86 4.68 0.46 2.83 2.47 -1.26 -2.14 114.94 118.11 1au0 s ASN 18 Ca 0.33 -0.25 0.28 0.00 0.42 0.00 0.00 52.86 53.64 1au0 s ASN 18 Cb -0.08 -1.80 0.89 0.00 -1.45 0.00 0.00 41.25 38.82 1au0 s ASN 18 CO 0.25 0.04 1.80 0.06 -3.72 0.00 0.00 177.10 175.54 1au0 h GLN 19 N 7.65 0.00 0.00 0.43 3.07 -1.13 -3.45 115.11 121.68 1au0 h GLN 19 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.37 1au0 h GLN 19 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.74 1au0 h GLN 19 CO 0.60 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.93 1au0 n GLY 20 N 0.55 0.52 0.83 0.06 0.00 -1.26 -3.40 105.19 102.48 1au0 n GLY 20 Ca 0.02 -0.89 0.09 0.00 0.00 0.00 0.00 46.02 45.24 1au0 n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1au0 n GLN 21 N 7.67 2.05 -3.63 1.61 1.13 -1.26 -4.89 117.38 120.07 1au0 n GLN 21 Ca 0.00 -1.62 -0.37 0.00 -1.94 0.00 0.00 57.00 53.07 1au0 n GLN 21 Cb 0.00 -1.39 -0.06 0.00 0.11 0.00 0.00 30.24 28.89 1au0 n GLN 21 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1au0 n GLY 23 N 2.31 4.61 1.52 0.00 0.00 -0.19 -4.52 105.19 108.93 1au0 n GLY 23 Ca -0.15 -1.76 -0.08 0.00 0.00 0.00 0.00 46.02 44.03 1au0 n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1au0 n SER 24 N 2.50 3.27 0.24 1.61 3.41 -1.26 -3.79 113.62 119.60 1au0 n SER 24 Ca 0.67 -3.58 0.07 0.00 -0.26 0.00 0.00 58.87 55.78 1au0 n SER 24 Cb 0.30 -0.69 0.59 0.00 -0.26 0.00 0.00 64.21 64.15 1au0 n SER 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1au0 h TRP 26 N 0.00 0.00 -0.06 0.00 5.08 -1.83 -1.02 115.95 118.12 1au0 h TRP 26 Ca -0.00 0.00 -0.15 0.00 1.08 0.00 0.00 58.89 59.82 1au0 h TRP 26 Cb 0.19 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.36 1au0 h TRP 26 CO 0.00 0.41 -0.55 0.00 -1.28 0.00 0.00 178.44 177.02 1au0 h ALA 27 N 1.59 0.15 -0.23 0.11 0.00 -1.35 -2.12 119.26 117.40 1au0 h ALA 27 Ca -0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1au0 h ALA 27 Cb 0.75 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1au0 h ALA 27 CO 0.05 0.38 0.12 0.74 0.00 0.00 0.00 179.25 180.54 1au0 h PHE 28 N 0.04 0.33 0.10 0.00 -1.00 -1.17 -1.70 116.94 113.55 1au0 h PHE 28 Ca -0.05 -0.01 0.02 0.00 2.81 0.00 0.00 57.97 60.73 1au0 h PHE 28 Cb 1.22 -0.10 -0.03 0.00 3.61 0.00 0.00 35.95 40.65 1au0 h PHE 28 CO 0.13 0.32 -0.25 1.03 -1.61 0.00 0.00 178.31 177.92 1au0 h SER 29 N 0.25 -0.72 -0.26 2.17 0.87 -1.23 0.86 113.55 115.49 1au0 h SER 29 Ca 0.08 0.09 0.06 0.00 -1.23 0.00 0.00 61.79 60.79 1au0 h SER 29 Cb 0.11 0.28 -0.07 0.00 -0.44 0.00 0.00 62.40 62.27 1au0 h SER 29 CO -0.01 -0.34 -0.23 0.28 -0.53 0.00 0.00 176.83 176.00 1au0 h SER 30 N -0.45 -0.74 -0.26 6.23 0.02 -1.27 -0.58 113.55 116.50 1au0 h SER 30 Ca 0.03 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1au0 h SER 30 Cb 0.48 0.36 -0.01 0.00 0.14 0.00 0.00 62.40 63.36 1au0 h SER 30 CO -0.16 -0.27 0.17 0.58 -1.14 0.00 0.00 176.83 176.01 1au0 h VAL 31 N -0.23 1.08 -0.55 2.27 2.07 -0.98 -1.69 116.25 118.22 1au0 h VAL 31 Ca 0.14 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 1au0 h VAL 31 Cb 0.45 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1au0 h VAL 31 CO -0.39 0.08 0.08 1.23 0.02 0.00 0.00 177.57 178.59 1au0 h GLY 32 N 0.39 0.95 1.38 2.17 0.00 0.77 -0.16 103.07 108.57 1au0 h GLY 32 Ca 0.10 -0.60 -0.19 0.00 0.00 0.00 0.00 47.33 46.64 1au0 h GLY 32 CO -0.02 0.55 -0.68 0.00 0.00 0.00 0.00 176.54 176.40 1au0 h ALA 33 N 1.25 0.52 -0.48 3.60 0.00 -0.83 -2.58 119.26 120.75 1au0 h ALA 33 Ca 0.17 -0.57 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1au0 h ALA 33 Cb 0.38 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1au0 h ALA 33 CO 0.01 0.71 0.14 -0.07 0.00 0.00 0.00 179.25 180.04 1au0 h LEU 34 N 0.44 0.65 -0.28 0.00 3.38 -0.75 -2.43 115.31 116.32 1au0 h LEU 34 Ca -0.02 -0.10 -0.19 0.00 0.09 0.00 0.00 57.88 57.66 1au0 h LEU 34 Cb 1.27 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1au0 h LEU 34 CO 0.13 0.63 -0.60 -0.33 0.09 0.00 0.00 178.44 178.36 1au0 h GLU 35 N 0.69 0.84 -0.55 1.13 5.08 -0.95 -2.08 114.58 118.73 1au0 h GLU 35 Ca 0.16 -0.57 0.01 0.00 -1.00 0.00 0.00 59.36 57.96 1au0 h GLU 35 Cb 0.22 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 1au0 h GLU 35 CO -0.01 1.19 0.37 0.78 -1.00 0.00 0.00 179.01 180.34 1au0 h GLY 36 N 0.69 0.78 1.19 -3.84 0.00 -1.12 -1.95 103.07 98.82 1au0 h GLY 36 Ca -0.00 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 46.91 1au0 h GLY 36 CO 0.13 0.29 -0.24 1.46 0.00 0.00 0.00 176.54 178.17 1au0 h GLN 37 N 0.75 0.92 -0.01 4.80 1.08 -1.46 -2.25 115.11 118.94 1au0 h GLN 37 Ca 0.20 -0.40 0.03 0.00 -1.45 0.00 0.00 58.65 57.04 1au0 h GLN 37 Cb -0.09 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.27 1au0 h GLN 37 CO -0.04 1.06 -0.27 1.25 -0.95 0.00 0.00 178.83 179.87 1au0 h LEU 38 N 0.79 -0.81 -0.85 1.46 5.85 -0.99 0.20 115.31 120.95 1au0 h LEU 38 Ca 0.10 0.11 0.08 0.00 0.84 0.00 0.00 57.88 59.01 1au0 h LEU 38 Cb 0.80 0.33 -0.07 0.00 0.37 0.00 0.00 40.66 42.10 1au0 h LEU 38 CO 0.07 -0.34 0.51 0.50 -0.34 0.00 0.00 178.44 178.84 1au0 h LYS 39 N -0.41 0.86 -0.11 1.25 1.63 -1.28 0.85 116.57 119.37 1au0 h LYS 39 Ca 0.07 -0.05 0.02 0.00 -0.85 0.00 0.00 60.65 59.83 1au0 h LYS 39 Cb 0.50 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.92 1au0 h LYS 39 CO -0.24 0.57 -0.02 -0.22 -3.45 0.00 0.00 179.45 176.09 1au0 h LYS 40 N 0.89 0.01 0.13 1.90 3.64 -0.58 0.15 116.57 122.71 1au0 h LYS 40 Ca 0.39 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.76 1au0 h LYS 40 Cb 0.27 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1au0 h LYS 40 CO -0.21 0.01 -0.06 0.87 -2.27 0.00 0.00 179.45 177.79 1au0 h LYS 41 N 0.01 -0.16 0.00 1.90 1.79 -0.26 -3.37 116.57 116.48 1au0 h LYS 41 Ca 0.05 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1au0 h LYS 41 Cb 0.07 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 1au0 h LYS 41 CO -0.10 -0.11 0.00 0.25 -1.08 0.00 0.00 179.45 178.41 1au0 n THR 42 N -3.70 0.62 -0.94 -0.16 -2.24 0.22 -4.92 114.28 103.17 1au0 n THR 42 Ca -0.02 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1au0 n THR 42 Cb 0.07 -0.74 0.00 0.00 -2.10 0.00 0.00 70.33 67.56 1au0 n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1au0 n GLY 43 N 0.95 0.82 3.03 3.38 0.00 0.04 -5.00 105.19 108.41 1au0 n GLY 43 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 1au0 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1au0 s LYS 44 N -0.15 1.19 0.11 1.61 1.02 -1.26 -4.97 119.74 117.31 1au0 s LYS 44 Ca 0.00 -0.37 -0.18 0.00 0.02 0.00 0.00 55.97 55.44 1au0 s LYS 44 Cb 0.00 -1.08 -0.07 0.00 -0.52 0.00 0.00 37.83 36.16 1au0 s LYS 44 CO 0.00 0.13 0.58 -1.17 -0.92 0.00 0.00 175.35 173.97 1au0 s LEU 45 N 0.22 4.45 0.00 3.17 2.96 -1.26 -4.03 118.68 124.20 1au0 s LEU 45 Ca -0.04 1.23 -0.09 0.00 -0.22 0.00 0.00 54.13 55.00 1au0 s LEU 45 Cb -0.10 -3.10 0.01 0.00 0.50 0.00 0.00 46.19 43.50 1au0 s LEU 45 CO 0.01 0.19 0.17 -0.22 -1.32 0.00 0.00 176.35 175.18 1au0 s LEU 46 N -1.48 1.42 -0.29 -0.68 1.98 -1.26 -5.08 118.68 113.29 1au0 s LEU 46 Ca 0.33 -0.17 -0.23 0.00 -2.89 0.00 0.00 54.13 51.18 1au0 s LEU 46 Cb -0.18 0.80 -0.00 0.00 0.66 0.00 0.00 46.19 47.47 1au0 s LEU 46 CO 0.19 -0.40 0.75 0.20 -1.89 0.00 0.00 176.35 175.20 1au0 s ASN 47 N -1.43 6.64 0.57 3.68 -0.87 -1.26 -4.89 114.94 117.38 1au0 s ASN 47 Ca -0.14 0.67 -0.06 0.00 -1.57 0.00 0.00 52.86 51.76 1au0 s ASN 47 Cb -0.07 -2.39 -0.01 0.00 -0.02 0.00 0.00 41.25 38.77 1au0 s ASN 47 CO 0.02 -0.55 0.89 -0.76 -2.57 0.00 0.00 177.10 174.13 1au0 s LEU 48 N 2.83 3.32 -0.50 0.60 1.43 -1.26 -0.82 118.68 124.28 1au0 s LEU 48 Ca 0.31 0.86 -0.21 0.00 -1.03 0.00 0.00 54.13 54.06 1au0 s LEU 48 Cb -0.15 -3.74 0.04 0.00 0.03 0.00 0.00 46.19 42.37 1au0 s LEU 48 CO 0.11 -0.93 0.73 -0.55 0.23 0.00 0.00 176.35 175.94 1au0 s SER 49 N -4.24 6.29 0.25 2.29 0.15 -0.60 -4.13 113.70 113.71 1au0 s SER 49 Ca 0.52 -0.56 0.05 0.00 0.70 0.00 0.00 55.95 56.67 1au0 s SER 49 Cb -0.11 -2.34 0.30 0.00 -1.71 0.00 0.00 66.02 62.16 1au0 s SER 49 CO 0.46 -0.96 1.59 -0.65 1.20 0.00 0.00 173.24 174.89 1au0 h PRO 50 N 9.05 0.23 -0.75 5.44 0.11 -1.87 -2.96 132.00 141.26 1au0 h PRO 50 Ca -0.26 -0.15 -0.04 0.00 0.11 0.00 0.00 66.00 65.66 1au0 h PRO 50 Cb 1.09 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1au0 h PRO 50 CO 0.98 0.73 0.30 0.37 -0.21 0.00 0.00 178.00 180.17 1au0 h GLN 51 N 0.18 1.12 -0.68 1.05 5.75 -1.86 -1.82 115.11 118.84 1au0 h GLN 51 Ca -0.00 -0.20 0.15 0.00 -0.15 0.00 0.00 58.65 58.45 1au0 h GLN 51 Cb 1.05 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 29.37 1au0 h GLN 51 CO 0.09 0.91 0.46 -0.97 -2.65 0.00 0.00 178.83 176.66 1au0 h ASN 52 N 1.09 0.27 0.20 -0.69 -0.00 -1.73 -0.52 115.58 114.20 1au0 h ASN 52 Ca 0.25 0.01 -0.27 0.00 -0.00 0.00 0.00 56.30 56.29 1au0 h ASN 52 Cb 0.21 -0.04 0.03 0.00 -0.00 0.00 0.00 38.32 38.52 1au0 h ASN 52 CO -0.02 0.14 -1.19 -0.07 -0.00 0.00 0.00 177.43 176.29 1au0 h LEU 53 N 0.29 0.68 -0.46 0.34 3.38 -1.48 -2.91 115.31 115.15 1au0 h LEU 53 Ca 0.33 -0.94 0.06 0.00 0.09 0.00 0.00 57.88 57.42 1au0 h LEU 53 Cb 0.88 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.36 1au0 h LEU 53 CO -0.08 1.57 0.17 0.58 0.09 0.00 0.00 178.44 180.78 1au0 h VAL 54 N -0.09 0.87 0.00 1.22 2.07 -0.32 -1.44 116.25 118.55 1au0 h VAL 54 Ca -0.21 -0.12 -0.12 0.00 0.82 0.00 0.00 66.70 67.07 1au0 h VAL 54 Cb 1.93 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1au0 h VAL 54 CO 0.22 0.06 -0.85 0.44 0.02 0.00 0.00 177.57 177.47 1au0 h ASP 55 N 0.35 0.00 0.00 0.57 3.32 -1.45 -3.39 116.42 115.82 1au0 h ASP 55 Ca 0.21 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.91 1au0 h ASP 55 Cb 0.20 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.69 1au0 h ASP 55 CO -0.21 0.48 -2.32 0.00 -1.72 0.00 0.00 179.24 175.47 1au0 s VAL 57 N -2.46 3.82 0.66 0.00 1.01 -0.56 -4.75 120.40 118.13 1au0 s VAL 57 Ca -0.10 -1.29 0.41 0.00 0.00 0.00 0.00 61.98 60.99 1au0 s VAL 57 Cb 0.06 -4.85 0.41 0.00 0.00 0.00 0.00 36.38 32.00 1au0 s VAL 57 CO 0.78 -1.53 2.27 0.77 0.00 0.00 0.00 175.10 177.39 1au0 h SER 58 N 8.93 0.00 0.73 3.32 4.64 -1.88 0.12 113.55 129.41 1au0 h SER 58 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1au0 h SER 58 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1au0 h SER 58 CO 1.35 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 176.98 1au0 h GLU 59 N 0.00 0.00 -6.22 4.77 3.07 -1.94 -3.44 114.58 110.82 1au0 h GLU 59 Ca 0.00 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.36 1au0 h GLU 59 Cb 0.15 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 1au0 h GLU 59 CO -0.00 0.00 -0.32 -0.80 -1.40 0.00 0.00 179.01 176.49 1au0 s ASN 60 N -4.81 5.05 0.00 1.42 0.02 0.41 -4.95 114.94 112.07 1au0 s ASN 60 Ca 0.02 -0.81 0.26 0.00 -1.02 0.00 0.00 52.86 51.31 1au0 s ASN 60 Cb 0.09 -0.30 0.90 0.00 0.02 0.00 0.00 41.25 41.96 1au0 s ASN 60 CO 0.43 -0.83 1.66 -0.67 0.02 0.00 0.00 177.10 177.71 1au0 n ASP 61 N -1.70 1.70 0.00 -1.22 -0.08 0.24 -4.98 116.55 110.51 1au0 n ASP 61 Ca 0.05 -1.60 0.00 0.00 -1.51 0.00 0.00 54.79 51.73 1au0 n ASP 61 Cb 0.62 -0.03 0.00 0.00 2.34 0.00 0.00 41.12 44.05 1au0 n ASP 61 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1au0 n GLY 62 N 1.19 1.77 0.00 0.27 0.00 -1.16 -2.77 105.19 104.49 1au0 n GLY 62 Ca 0.18 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 45.81 1au0 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1au0 h GLY 64 N 4.06 0.00 0.00 0.00 0.00 -1.71 -0.48 103.07 104.95 1au0 h GLY 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1au0 h GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1au0 n GLY 65 N 1.40 1.28 0.00 4.60 0.00 -1.12 -4.93 105.19 106.43 1au0 n GLY 65 Ca -0.09 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1au0 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1au0 n GLY 66 N -1.41 1.53 3.69 -0.02 0.00 -1.26 0.79 105.19 108.51 1au0 n GLY 66 Ca 0.00 -0.85 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 1au0 n GLY 66 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1au0 s TYR 67 N -2.00 3.10 0.19 1.61 2.02 -1.26 -4.77 117.35 116.24 1au0 s TYR 67 Ca 0.00 0.10 -0.11 0.00 -0.37 0.00 0.00 57.07 56.69 1au0 s TYR 67 Cb 0.00 -1.69 0.11 0.00 -0.40 0.00 0.00 41.96 39.99 1au0 s TYR 67 CO 0.00 0.47 1.79 0.52 -1.57 0.00 0.00 175.55 176.76 1au0 h MET 68 N 4.39 0.96 -0.95 -0.62 2.86 -1.95 -2.44 114.93 117.18 1au0 h MET 68 Ca -0.49 -0.13 0.14 0.00 -2.06 0.00 0.00 59.70 57.16 1au0 h MET 68 Cb 1.18 -0.18 -0.08 0.00 0.06 0.00 0.00 31.60 32.58 1au0 h MET 68 CO 0.58 0.75 0.60 1.79 1.06 0.00 0.00 176.91 181.69 1au0 h THR 69 N 0.94 0.85 -0.32 2.22 1.35 -1.96 0.48 112.91 116.46 1au0 h THR 69 Ca 0.23 -0.28 -0.08 0.00 -0.55 0.00 0.00 66.41 65.74 1au0 h THR 69 Cb 0.09 -0.04 -0.02 0.00 -1.73 0.00 0.00 68.15 66.46 1au0 h THR 69 CO -0.03 0.15 -0.13 0.78 -0.25 0.00 0.00 175.52 176.04 1au0 h ASN 70 N 0.82 0.54 0.27 5.36 -0.26 -1.86 -0.76 115.58 119.70 1au0 h ASN 70 Ca 0.48 -0.15 -0.17 0.00 -0.56 0.00 0.00 56.30 55.91 1au0 h ASN 70 Cb 0.65 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 37.76 1au0 h ASN 70 CO -0.25 0.70 -0.66 0.00 -1.06 0.00 0.00 177.43 176.16 1au0 h ALA 71 N 1.35 0.70 0.54 -0.83 0.00 -0.87 -2.32 119.26 117.83 1au0 h ALA 71 Ca 0.09 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1au0 h ALA 71 Cb 0.52 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.24 1au0 h ALA 71 CO 0.03 0.74 -0.26 0.74 0.00 0.00 0.00 179.25 180.51 1au0 h PHE 72 N 0.26 -0.67 -1.08 0.00 0.04 -0.62 -2.51 116.94 112.36 1au0 h PHE 72 Ca -0.02 -0.02 0.29 0.00 2.80 0.00 0.00 57.97 61.03 1au0 h PHE 72 Cb 1.21 0.22 -0.09 0.00 2.20 0.00 0.00 35.95 39.48 1au0 h PHE 72 CO 0.04 -0.34 0.70 0.37 -0.60 0.00 0.00 178.31 178.48 1au0 h GLN 73 N -0.96 0.31 -0.16 1.51 5.75 -1.16 0.31 115.11 120.70 1au0 h GLN 73 Ca -0.07 -0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.36 1au0 h GLN 73 Cb 0.63 -0.07 -0.00 0.00 1.07 0.00 0.00 27.48 29.10 1au0 h GLN 73 CO 0.12 0.20 -0.08 -0.92 -2.65 0.00 0.00 178.83 175.50 1au0 h TYR 74 N 0.32 0.40 0.00 3.99 3.20 -1.17 -0.88 116.97 122.82 1au0 h TYR 74 Ca 0.61 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 62.37 1au0 h TYR 74 Cb 1.69 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.87 1au0 h TYR 74 CO -0.00 0.66 -0.08 0.28 -1.64 0.00 0.00 178.16 177.38 1au0 h VAL 75 N 0.02 0.29 0.07 1.81 2.07 -0.52 0.57 116.25 120.56 1au0 h VAL 75 Ca 0.04 -0.54 -0.14 0.00 0.82 0.00 0.00 66.70 66.87 1au0 h VAL 75 Cb 0.55 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1au0 h VAL 75 CO 0.02 0.08 -0.70 -0.61 0.02 0.00 0.00 177.57 176.38 1au0 h GLN 76 N 0.00 0.15 0.00 1.57 4.15 -1.28 -1.00 115.11 118.69 1au0 h GLN 76 Ca -0.00 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1au0 h GLN 76 Cb 0.41 0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.20 1au0 h GLN 76 CO 0.01 1.12 0.00 1.57 -1.93 0.00 0.00 178.83 179.60 1au0 h LYS 77 N -0.65 0.00 0.00 1.69 2.10 -0.99 -3.09 116.57 115.64 1au0 h LYS 77 Ca -0.15 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.50 1au0 h LYS 77 Cb 1.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.73 1au0 h LYS 77 CO 0.04 0.00 -1.79 -1.71 -2.00 0.00 0.00 179.45 173.99 1au0 n ASN 78 N -3.07 0.52 -3.28 7.07 5.15 0.18 -5.04 115.26 116.78 1au0 n ASN 78 Ca 0.03 -0.12 -0.12 0.00 -0.60 0.00 0.00 54.58 53.77 1au0 n ASN 78 Cb 0.45 1.80 0.03 0.00 -0.53 0.00 0.00 39.78 41.53 1au0 n ASN 78 CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 1au0 n ARG 79 N -2.10 -1.67 0.00 1.20 1.85 -0.42 -4.99 116.66 110.52 1au0 n ARG 79 Ca -0.03 1.04 0.00 0.00 -1.00 0.00 0.00 57.85 57.87 1au0 n ARG 79 Cb 0.49 -5.30 0.00 0.00 -1.05 0.00 0.00 32.46 26.60 1au0 n ARG 79 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1au0 n GLY 80 N -1.54 4.68 2.86 2.89 0.00 -0.97 -4.94 105.19 108.17 1au0 n GLY 80 Ca -0.06 -0.82 -0.17 0.00 0.00 0.00 0.00 46.02 44.97 1au0 n GLY 80 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1au0 s ILE 81 N -1.21 0.25 0.93 -0.61 2.07 -0.99 -4.78 121.20 116.87 1au0 s ILE 81 Ca 0.00 -0.02 -0.12 0.00 -1.41 0.00 0.00 60.65 59.10 1au0 s ILE 81 Cb 0.00 -0.29 0.15 0.00 0.13 0.00 0.00 42.46 42.45 1au0 s ILE 81 CO 0.00 0.13 1.10 -1.81 -1.91 0.00 0.00 174.94 172.45 1au0 s ASP 82 N 0.64 3.21 0.57 4.50 1.01 -1.26 -0.69 116.67 124.65 1au0 s ASP 82 Ca -0.07 1.26 0.01 0.00 0.71 0.00 0.00 52.55 54.46 1au0 s ASP 82 Cb -0.10 -1.93 0.04 0.00 1.01 0.00 0.00 42.92 41.94 1au0 s ASP 82 CO -0.01 -2.78 0.80 -0.94 0.21 0.00 0.00 175.17 172.46 1au0 s SER 83 N -3.57 5.19 0.12 0.27 1.04 -1.08 -1.56 113.70 114.11 1au0 s SER 83 Ca 0.64 -0.01 -0.20 0.00 0.48 0.00 0.00 55.95 56.86 1au0 s SER 83 Cb -0.17 -0.83 -0.08 0.00 0.10 0.00 0.00 66.02 65.04 1au0 s SER 83 CO 0.56 -1.21 1.76 -0.08 0.98 0.00 0.00 173.24 175.25 1au0 h GLU 84 N -0.00 0.17 0.00 4.02 4.57 -1.13 0.36 114.58 122.57 1au0 h GLU 84 Ca -0.42 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 1au0 h GLU 84 Cb 1.30 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 1au0 h GLU 84 CO 0.52 0.11 0.00 0.22 -1.18 0.00 0.00 179.01 178.68 1au0 h ASP 85 N 0.18 0.00 1.01 1.04 3.58 -1.95 -0.71 116.42 119.56 1au0 h ASP 85 Ca 0.06 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.49 1au0 h ASP 85 Cb 0.00 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 1au0 h ASP 85 CO -0.04 0.00 -1.01 0.00 -2.88 0.00 0.00 179.24 175.31 1au0 h ALA 86 N 2.01 0.55 -0.52 -0.78 0.00 -1.46 -3.42 119.26 115.63 1au0 h ALA 86 Ca 0.00 -0.13 -0.26 0.00 0.00 0.00 0.00 54.91 54.52 1au0 h ALA 86 Cb 0.20 0.04 -0.18 0.00 0.00 0.00 0.00 17.79 17.85 1au0 h ALA 86 CO 0.00 0.15 -0.58 0.98 0.00 0.00 0.00 179.25 179.80 1au0 n TYR 87 N -2.74 -3.02 -1.30 0.00 4.19 -0.04 -4.80 117.16 109.45 1au0 n TYR 87 Ca -0.01 -1.94 -0.36 0.00 3.31 0.00 0.00 57.90 58.89 1au0 n TYR 87 Cb 0.59 1.28 0.07 0.00 0.49 0.00 0.00 39.34 41.77 1au0 n TYR 87 CO 0.00 0.00 0.00 -2.30 0.91 0.00 0.00 176.86 175.47 1au0 n PRO 88 N 1.93 0.35 -2.82 2.98 -0.02 -0.36 -4.43 135.00 132.63 1au0 n PRO 88 Ca 0.13 0.16 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 1au0 n PRO 88 Cb 0.60 -1.83 -0.04 0.00 -0.02 0.00 0.00 33.50 32.21 1au0 n PRO 88 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1au0 s TYR 89 N -1.87 3.16 -2.56 6.00 5.04 -1.26 -4.78 117.35 121.08 1au0 s TYR 89 Ca 0.66 0.91 0.23 0.00 -2.44 0.00 0.00 57.07 56.44 1au0 s TYR 89 Cb -0.36 -3.46 0.43 0.00 0.35 0.00 0.00 41.96 38.92 1au0 s TYR 89 CO 0.57 -0.69 1.40 1.33 -1.34 0.00 0.00 175.55 176.82 1au0 n VAL 90 N 5.74 0.37 -1.44 3.14 0.24 -1.26 -4.96 118.33 120.16 1au0 n VAL 90 Ca 0.07 -0.65 -0.11 0.00 -2.04 0.00 0.00 64.34 61.61 1au0 n VAL 90 Cb 0.48 1.00 -0.04 0.00 -1.47 0.00 0.00 33.84 33.80 1au0 n VAL 90 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1au0 n GLY 91 N 1.43 1.09 3.67 7.63 0.00 -1.26 -4.96 105.19 112.80 1au0 n GLY 91 Ca 0.18 -0.49 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 1au0 n GLY 91 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1au0 s GLN 92 N -3.16 0.82 0.30 1.61 -2.07 -1.26 -4.46 119.66 111.45 1au0 s GLN 92 Ca 0.00 -0.43 -0.28 0.00 -1.82 0.00 0.00 55.36 52.82 1au0 s GLN 92 Cb 0.00 0.29 -0.09 0.00 -1.09 0.00 0.00 33.01 32.12 1au0 s GLN 92 CO 0.00 -0.37 1.07 -1.21 -1.32 0.00 0.00 175.29 173.46 1au0 s GLU 93 N -2.91 4.56 0.30 9.60 2.02 -1.26 -4.97 118.70 126.04 1au0 s GLU 93 Ca 0.12 1.71 -0.16 0.00 0.02 0.00 0.00 54.97 56.65 1au0 s GLU 93 Cb 0.01 -3.05 0.02 0.00 0.10 0.00 0.00 34.13 31.21 1au0 s GLU 93 CO -0.01 0.17 0.66 -1.83 0.02 0.00 0.00 175.26 174.26 1au0 s GLU 94 N -1.65 1.86 0.30 1.61 -1.05 -1.26 -5.11 118.70 113.39 1au0 s GLU 94 Ca 0.47 -1.23 -0.30 0.00 -0.15 0.00 0.00 54.97 53.77 1au0 s GLU 94 Cb -0.29 0.57 -0.11 0.00 -0.44 0.00 0.00 34.13 33.86 1au0 s GLU 94 CO 0.37 -0.83 1.56 -1.12 0.95 0.00 0.00 175.26 176.19 1au0 s SER 95 N -3.01 6.39 0.15 0.83 0.01 -1.26 -4.60 113.70 112.22 1au0 s SER 95 Ca 0.16 2.94 -0.33 0.00 1.31 0.00 0.00 55.95 60.03 1au0 s SER 95 Cb -0.04 -2.64 -0.13 0.00 0.21 0.00 0.00 66.02 63.42 1au0 s SER 95 CO 0.10 -0.89 1.66 0.00 0.41 0.00 0.00 173.24 174.53 1au0 n MET 97 N 4.00 2.47 -1.68 0.00 2.81 -1.26 -5.03 117.12 118.44 1au0 n MET 97 Ca 0.17 -3.82 -0.46 0.00 -1.81 0.00 0.00 57.70 51.78 1au0 n MET 97 Cb 0.31 -1.85 -0.04 0.00 -0.71 0.00 0.00 33.22 30.93 1au0 n MET 97 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 1au0 n TYR 98 N -0.52 2.40 -3.53 2.03 9.36 -1.26 -4.92 117.16 120.72 1au0 n TYR 98 Ca 0.24 -0.09 -0.41 0.00 3.32 0.00 0.00 57.90 60.95 1au0 n TYR 98 Cb 0.84 -2.70 -0.07 0.00 -0.63 0.00 0.00 39.34 36.78 1au0 n TYR 98 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1au0 s ASN 99 N 3.79 5.88 0.48 2.98 2.47 -1.26 -4.97 114.94 124.31 1au0 s ASN 99 Ca 0.90 -2.40 0.37 0.00 0.42 0.00 0.00 52.86 52.15 1au0 s ASN 99 Cb -0.61 -2.03 1.55 0.00 -1.45 0.00 0.00 41.25 38.72 1au0 s ASN 99 CO 0.47 -0.57 1.60 1.55 -3.72 0.00 0.00 177.10 176.43 1au0 h PRO 100 N 7.87 0.03 -0.53 0.43 0.13 -1.99 0.36 132.00 138.29 1au0 h PRO 100 Ca -0.07 -0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.94 1au0 h PRO 100 Cb 1.03 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 1au0 h PRO 100 CO 0.80 0.02 -0.12 1.79 -0.23 0.00 0.00 178.00 180.26 1au0 h THR 101 N 0.03 1.27 0.00 1.56 1.35 -2.01 -2.63 112.91 112.48 1au0 h THR 101 Ca 0.87 -1.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1au0 h THR 101 Cb 3.02 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 70.42 1au0 h THR 101 CO -0.29 0.45 0.00 0.61 -0.25 0.00 0.00 175.52 176.04 1au0 n GLY 102 N -0.26 -0.64 3.65 5.82 0.00 0.13 -4.86 105.19 109.03 1au0 n GLY 102 Ca 0.01 -0.08 -0.46 0.00 0.00 0.00 0.00 46.02 45.49 1au0 n GLY 102 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1au0 n LYS 103 N -0.82 1.91 0.00 1.61 4.81 -0.99 -2.63 118.16 122.04 1au0 n LYS 103 Ca 0.10 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.22 1au0 n LYS 103 Cb 0.04 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 32.73 1au0 n LYS 103 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1au0 n ALA 104 N 2.50 1.55 -3.47 3.14 0.00 0.14 -4.88 120.51 119.49 1au0 n ALA 104 Ca 0.15 -0.24 -0.10 0.00 0.00 0.00 0.00 53.44 53.24 1au0 n ALA 104 Cb 0.28 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.71 1au0 n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1au0 s ALA 105 N -0.17 -1.73 0.15 0.00 0.00 -1.21 -5.00 121.76 113.80 1au0 s ALA 105 Ca 0.00 0.83 -0.00 0.00 0.00 0.00 0.00 51.96 52.79 1au0 s ALA 105 Cb 0.00 0.56 -0.04 0.00 0.00 0.00 0.00 23.12 23.64 1au0 s ALA 105 CO 0.00 -0.70 0.04 0.15 0.00 0.00 0.00 175.76 175.25 1au0 s LYS 106 N -3.24 1.00 -0.04 0.00 1.02 -1.26 -2.34 119.74 114.89 1au0 s LYS 106 Ca 0.02 -1.48 -0.20 0.00 0.02 0.00 0.00 55.97 54.33 1au0 s LYS 106 Cb -0.01 0.07 0.04 0.00 -0.52 0.00 0.00 37.83 37.41 1au0 s LYS 106 CO -0.10 -0.22 0.44 0.00 -0.92 0.00 0.00 175.35 174.55 1au0 n ARG 108 N 1.26 3.21 0.00 0.00 1.85 -0.04 -4.18 116.66 118.75 1au0 n ARG 108 Ca -0.20 -3.95 0.00 0.00 -1.00 0.00 0.00 57.85 52.70 1au0 n ARG 108 Cb 0.56 -2.27 0.00 0.00 -1.05 0.00 0.00 32.46 29.70 1au0 n ARG 108 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1au0 n GLY 109 N -0.66 0.43 3.58 2.89 0.00 -1.26 -4.80 105.19 105.37 1au0 n GLY 109 Ca 0.49 -2.19 -0.08 0.00 0.00 0.00 0.00 46.02 44.24 1au0 n GLY 109 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1au0 s TYR 110 N -0.04 -0.26 -0.08 1.61 1.13 -1.26 -2.20 117.35 116.25 1au0 s TYR 110 Ca 0.00 0.37 0.03 0.00 -1.41 0.00 0.00 57.07 56.06 1au0 s TYR 110 Cb 0.00 0.48 0.01 0.00 -1.10 0.00 0.00 41.96 41.35 1au0 s TYR 110 CO 0.00 -0.29 -0.18 1.03 -2.51 0.00 0.00 175.55 173.60 1au0 s ARG 111 N -1.61 2.27 0.49 -3.49 0.52 0.78 -4.89 118.95 113.02 1au0 s ARG 111 Ca 0.03 -0.63 -0.06 0.00 -0.52 0.00 0.00 55.73 54.55 1au0 s ARG 111 Cb -0.01 -1.80 0.11 0.00 0.52 0.00 0.00 34.95 33.77 1au0 s ARG 111 CO -0.03 0.12 0.67 0.39 0.02 0.00 0.00 175.30 176.48 1au0 n GLU 112 N 3.60 -0.38 -4.45 3.54 1.02 -1.26 -0.60 120.64 122.10 1au0 n GLU 112 Ca -0.21 -1.28 -0.20 0.00 -0.02 0.00 0.00 57.16 55.46 1au0 n GLU 112 Cb 0.52 -0.62 -0.15 0.00 -0.02 0.00 0.00 31.44 31.18 1au0 n GLU 112 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1au0 s ILE 113 N -2.25 0.87 -0.33 -3.67 -1.09 -1.13 -4.83 121.20 108.76 1au0 s ILE 113 Ca 0.40 -0.52 -0.42 0.00 -2.23 0.00 0.00 60.65 57.88 1au0 s ILE 113 Cb -0.01 -0.74 -0.16 0.00 -1.58 0.00 0.00 42.46 39.96 1au0 s ILE 113 CO 0.28 0.20 1.73 -2.65 -1.23 0.00 0.00 174.94 173.27 1au0 n PRO 114 N 2.70 0.92 -1.68 2.79 -0.02 -1.26 -4.75 135.00 133.70 1au0 n PRO 114 Ca -0.14 0.34 -0.56 0.00 -2.02 0.00 0.00 63.50 61.11 1au0 n PRO 114 Cb 0.56 -1.99 -0.07 0.00 -0.02 0.00 0.00 33.50 31.98 1au0 n PRO 114 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1au0 n GLU 115 N 5.19 1.19 -0.97 -0.52 1.02 -1.26 -0.88 120.64 124.41 1au0 n GLU 115 Ca 0.28 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.85 1au0 n GLU 115 Cb 0.09 -2.16 0.00 0.00 -0.02 0.00 0.00 31.44 29.35 1au0 n GLU 115 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1au0 n GLY 116 N 4.51 0.50 3.22 0.62 0.00 0.96 -4.99 105.19 110.01 1au0 n GLY 116 Ca 0.28 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 1au0 n GLY 116 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1au0 s ASN 117 N -2.84 5.87 0.23 1.61 3.84 -0.06 -4.92 114.94 118.66 1au0 s ASN 117 Ca 0.00 -2.27 0.07 0.00 0.21 0.00 0.00 52.86 50.87 1au0 s ASN 117 Cb 0.00 -2.04 0.20 0.00 -0.55 0.00 0.00 41.25 38.87 1au0 s ASN 117 CO 0.00 -0.61 1.52 -0.33 -2.79 0.00 0.00 177.10 174.89 1au0 h GLU 118 N 8.05 0.12 0.02 0.43 5.08 -1.89 -1.44 114.58 124.94 1au0 h GLU 118 Ca -0.11 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1au0 h GLU 118 Cb 1.04 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1au0 h GLU 118 CO 0.82 0.76 -0.01 0.87 -1.00 0.00 0.00 179.01 180.46 1au0 h LYS 119 N 0.08 -0.02 -0.72 2.33 1.79 -1.99 -1.44 116.57 116.59 1au0 h LYS 119 Ca -0.01 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.44 1au0 h LYS 119 Cb 1.24 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.86 1au0 h LYS 119 CO 0.10 0.20 0.38 0.00 -1.08 0.00 0.00 179.45 179.05 1au0 h ALA 120 N 0.74 1.31 -0.57 3.86 0.00 -1.96 -1.61 119.26 121.03 1au0 h ALA 120 Ca -0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1au0 h ALA 120 Cb 0.23 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1au0 h ALA 120 CO 0.00 0.55 0.09 1.25 0.00 0.00 0.00 179.25 181.15 1au0 h LEU 121 N 1.01 0.90 -0.38 0.00 5.85 -1.12 -0.53 115.31 121.05 1au0 h LEU 121 Ca 0.25 -0.26 0.03 0.00 0.84 0.00 0.00 57.88 58.74 1au0 h LEU 121 Cb 0.05 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1au0 h LEU 121 CO -0.04 0.93 0.20 0.50 -0.34 0.00 0.00 178.44 179.69 1au0 h LYS 122 N 0.84 0.39 -0.89 1.25 3.64 -0.56 -0.50 116.57 120.73 1au0 h LYS 122 Ca 0.17 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.55 1au0 h LYS 122 Cb 0.41 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.10 1au0 h LYS 122 CO 0.01 0.26 0.59 0.00 -2.27 0.00 0.00 179.45 178.04 1au0 h ARG 123 N 0.40 1.15 0.29 1.90 3.08 -1.02 -0.20 114.38 119.98 1au0 h ARG 123 Ca 0.16 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1au0 h ARG 123 Cb 0.05 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.85 1au0 h ARG 123 CO -0.10 0.76 -0.14 0.00 -1.07 0.00 0.00 179.97 179.42 1au0 h ALA 124 N 1.46 -0.39 -0.24 0.04 0.00 -0.30 0.18 119.26 120.01 1au0 h ALA 124 Ca 0.33 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1au0 h ALA 124 Cb -0.10 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1au0 h ALA 124 CO -0.08 -0.57 0.16 0.28 0.00 0.00 0.00 179.25 179.04 1au0 h VAL 125 N -0.68 0.99 -0.01 0.00 2.07 -0.95 0.48 116.25 118.15 1au0 h VAL 125 Ca -0.04 -0.07 -0.12 0.00 0.82 0.00 0.00 66.70 67.29 1au0 h VAL 125 Cb 0.47 0.77 0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1au0 h VAL 125 CO 0.06 0.04 -0.45 0.00 0.02 0.00 0.00 177.57 177.24 1au0 h ALA 126 N 1.87 0.07 0.03 1.67 0.00 -0.87 -2.92 119.26 119.11 1au0 h ALA 126 Ca 0.10 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1au0 h ALA 126 Cb 0.15 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1au0 h ALA 126 CO -0.02 0.24 -0.02 0.00 0.00 0.00 0.00 179.25 179.46 1au0 h ARG 127 N -0.25 -0.04 0.12 0.00 -0.00 -0.15 -3.41 114.38 110.64 1au0 h ARG 127 Ca -0.05 0.00 -0.19 0.00 -0.50 0.00 0.00 59.98 59.24 1au0 h ARG 127 Cb 1.17 0.01 0.01 0.00 0.00 0.00 0.00 29.97 31.16 1au0 h ARG 127 CO 0.09 0.32 -0.91 0.28 0.00 0.00 0.00 179.97 179.75 1au0 h VAL 128 N -0.99 1.39 0.00 2.04 2.07 -0.24 -3.51 116.25 117.01 1au0 h VAL 128 Ca -0.00 -2.47 0.00 0.00 0.82 0.00 0.00 66.70 65.04 1au0 h VAL 128 Cb 0.38 3.06 0.00 0.00 -1.52 0.00 0.00 31.29 33.21 1au0 h VAL 128 CO 0.01 0.69 0.00 0.61 0.02 0.00 0.00 177.57 178.90 1au0 n GLY 129 N 1.67 0.39 3.58 2.17 0.00 -1.07 -4.86 105.19 107.08 1au0 n GLY 129 Ca -0.17 -2.14 -0.55 0.00 0.00 0.00 0.00 46.02 43.16 1au0 n GLY 129 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1au0 n PRO 130 N 0.00 1.12 -4.20 1.61 -0.02 -1.26 -4.07 135.00 128.19 1au0 n PRO 130 Ca 0.00 0.37 -0.32 0.00 -2.02 0.00 0.00 63.50 61.53 1au0 n PRO 130 Cb 0.00 -2.22 -0.08 0.00 -0.02 0.00 0.00 33.50 31.18 1au0 n PRO 130 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1au0 s VAL 131 N 5.09 4.37 -0.24 -1.45 1.01 -1.03 -4.54 120.40 123.60 1au0 s VAL 131 Ca 1.04 -0.56 -0.20 0.00 0.00 0.00 0.00 61.98 62.26 1au0 s VAL 131 Cb -1.00 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1au0 s VAL 131 CO 0.59 0.34 0.60 -0.44 0.00 0.00 0.00 175.10 176.19 1au0 s SER 132 N -1.71 6.56 0.30 3.32 0.01 -0.77 -0.79 113.70 120.63 1au0 s SER 132 Ca 0.22 0.68 0.08 0.00 1.31 0.00 0.00 55.95 58.24 1au0 s SER 132 Cb -0.12 -2.32 -0.06 0.00 0.21 0.00 0.00 66.02 63.73 1au0 s SER 132 CO 0.13 -0.33 -0.08 0.68 0.41 0.00 0.00 173.24 174.05 1au0 s VAL 133 N 2.33 1.88 -0.03 3.43 -7.23 -0.82 -1.43 120.40 118.54 1au0 s VAL 133 Ca 0.25 -2.17 0.03 0.00 -1.81 0.00 0.00 61.98 58.28 1au0 s VAL 133 Cb -0.16 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.29 1au0 s VAL 133 CO 0.09 -0.28 -0.11 0.00 -0.31 0.00 0.00 175.10 174.48 1au0 s ALA 134 N -2.86 1.05 0.33 1.32 0.00 -1.25 0.11 121.76 120.47 1au0 s ALA 134 Ca 0.30 -0.44 0.04 0.00 0.00 0.00 0.00 51.96 51.87 1au0 s ALA 134 Cb 0.03 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 1au0 s ALA 134 CO 0.13 0.18 0.19 0.96 0.00 0.00 0.00 175.76 177.23 1au0 s ILE 135 N 0.13 0.24 -0.44 0.00 -4.36 0.38 -4.36 121.20 112.81 1au0 s ILE 135 Ca -0.03 -2.00 -0.22 0.00 -0.26 0.00 0.00 60.65 58.14 1au0 s ILE 135 Cb -0.09 -2.47 0.02 0.00 1.25 0.00 0.00 42.46 41.17 1au0 s ILE 135 CO 0.01 0.00 0.73 -0.62 0.24 0.00 0.00 174.94 175.30 1au0 s ASP 136 N -3.40 6.39 0.00 4.36 2.15 -1.17 -1.27 116.67 123.73 1au0 s ASP 136 Ca 0.35 -0.14 0.15 0.00 0.43 0.00 0.00 52.55 53.35 1au0 s ASP 136 Cb 0.04 -2.36 0.04 0.00 -0.30 0.00 0.00 42.92 40.34 1au0 s ASP 136 CO 0.20 -0.85 0.87 0.00 -0.17 0.00 0.00 175.17 175.22 1au0 n ALA 137 N 6.53 2.87 -2.56 3.66 0.00 -1.26 -4.82 120.51 124.92 1au0 n ALA 137 Ca 0.01 -0.55 -0.41 0.00 0.00 0.00 0.00 53.44 52.49 1au0 n ALA 137 Cb 0.48 -0.52 -0.03 0.00 0.00 0.00 0.00 19.45 19.38 1au0 n ALA 137 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1au0 s SER 138 N -1.60 6.50 -0.30 0.00 0.01 -1.26 -4.69 113.70 112.37 1au0 s SER 138 Ca 0.14 -1.46 -0.17 0.00 1.31 0.00 0.00 55.95 55.77 1au0 s SER 138 Cb 0.12 -2.57 0.20 0.00 0.21 0.00 0.00 66.02 63.98 1au0 s SER 138 CO 0.31 -1.50 1.22 -0.22 0.41 0.00 0.00 173.24 173.45 1au0 s LEU 139 N 4.95 -0.14 0.31 2.44 2.96 -1.26 -4.96 118.68 122.98 1au0 s LEU 139 Ca 0.46 0.22 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 1au0 s LEU 139 Cb -0.00 1.19 0.49 0.00 0.50 0.00 0.00 46.19 48.37 1au0 s LEU 139 CO -0.10 -0.03 1.89 0.74 -1.32 0.00 0.00 176.35 177.53 1au0 h THR 140 N 5.06 1.20 -0.16 3.68 2.02 -2.00 -2.10 112.91 120.61 1au0 h THR 140 Ca -0.21 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.32 1au0 h THR 140 Cb 1.15 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 1au0 h THR 140 CO 0.16 0.26 0.11 0.77 0.37 0.00 0.00 175.52 177.18 1au0 h SER 141 N 0.79 0.19 -0.02 4.18 4.64 -1.97 -1.61 113.55 119.76 1au0 h SER 141 Ca 0.19 -0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.45 1au0 h SER 141 Cb 0.18 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1au0 h SER 141 CO -0.02 0.14 -0.21 0.15 -0.87 0.00 0.00 176.83 176.03 1au0 h PHE 142 N 0.22 0.24 -0.58 4.77 3.57 -1.74 -3.24 116.94 120.18 1au0 h PHE 142 Ca 0.06 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.45 1au0 h PHE 142 Cb -0.02 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 1au0 h PHE 142 CO 0.00 0.88 0.38 1.96 -2.23 0.00 0.00 178.31 179.30 1au0 h GLN 143 N -0.46 0.75 -0.82 1.11 4.20 -0.94 -2.70 115.11 116.26 1au0 h GLN 143 Ca -0.02 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.54 1au0 h GLN 143 Cb 0.92 -0.17 -0.06 0.00 0.30 0.00 0.00 27.48 28.47 1au0 h GLN 143 CO 0.04 0.50 0.13 1.97 -0.67 0.00 0.00 178.83 180.80 1au0 n PHE 144 N -4.69 1.53 -1.81 2.96 1.16 -0.67 -4.75 117.46 111.19 1au0 n PHE 144 Ca 0.04 -0.75 -0.36 0.00 -1.87 0.00 0.00 57.45 54.51 1au0 n PHE 144 Cb 0.03 -0.47 0.06 0.00 -1.61 0.00 0.00 39.48 37.48 1au0 n PHE 144 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 1au0 s TYR 145 N -2.11 2.19 0.00 2.97 6.14 -1.02 -4.95 117.35 120.57 1au0 s TYR 145 Ca 0.35 1.51 0.00 0.00 0.64 0.00 0.00 57.07 59.57 1au0 s TYR 145 Cb 0.28 -3.59 0.00 0.00 0.42 0.00 0.00 41.96 39.07 1au0 s TYR 145 CO 0.09 -2.61 0.00 -1.13 0.64 0.00 0.00 175.55 172.54 1au0 n SER 146 N -1.88 0.00 -3.60 4.32 3.41 -1.26 -3.83 113.62 110.78 1au0 n SER 146 Ca 0.15 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.68 1au0 n SER 146 Cb 0.49 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.39 1au0 n SER 146 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1au0 s LYS 147 N -1.00 0.43 0.00 4.33 -2.85 -1.26 -3.91 119.74 115.48 1au0 s LYS 147 Ca 0.00 0.12 0.00 0.00 -1.00 0.00 0.00 55.97 55.09 1au0 s LYS 147 Cb 0.00 0.20 0.00 0.00 -2.06 0.00 0.00 37.83 35.97 1au0 s LYS 147 CO 0.00 -0.13 0.00 0.41 0.10 0.00 0.00 175.35 175.73 1au0 n GLY 148 N 0.71 -0.91 3.38 0.59 0.00 -1.26 -4.90 105.19 102.80 1au0 n GLY 148 Ca -0.07 -2.18 -0.42 0.00 0.00 0.00 0.00 46.02 43.35 1au0 n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1au0 s VAL 149 N -0.08 4.92 0.14 1.61 1.01 -1.26 -4.16 120.40 122.59 1au0 s VAL 149 Ca 0.00 -0.98 -0.31 0.00 0.00 0.00 0.00 61.98 60.69 1au0 s VAL 149 Cb 0.00 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 32.43 1au0 s VAL 149 CO 0.00 -0.43 1.54 -0.47 0.00 0.00 0.00 175.10 175.74 1au0 s TYR 150 N 1.59 3.02 -0.23 5.22 5.04 0.08 -4.74 117.35 127.34 1au0 s TYR 150 Ca 0.04 0.66 -0.15 0.00 -2.44 0.00 0.00 57.07 55.17 1au0 s TYR 150 Cb -0.22 -3.88 0.07 0.00 0.35 0.00 0.00 41.96 38.28 1au0 s TYR 150 CO 0.07 -3.25 0.57 -0.47 -1.34 0.00 0.00 175.55 171.13 1au0 s TYR 151 N 1.32 -0.79 -0.22 4.97 5.04 -1.26 -1.48 117.35 124.93 1au0 s TYR 151 Ca 0.69 1.70 -0.05 0.00 -2.44 0.00 0.00 57.07 56.97 1au0 s TYR 151 Cb -0.42 0.39 0.11 0.00 0.35 0.00 0.00 41.96 42.39 1au0 s TYR 151 CO 0.31 -0.40 0.41 0.34 -1.34 0.00 0.00 175.55 174.87 1au0 s ASP 152 N 1.14 -0.13 0.00 4.32 -1.08 -1.26 -5.04 116.67 114.63 1au0 s ASP 152 Ca -0.07 0.73 0.00 0.00 -0.52 0.00 0.00 52.55 52.69 1au0 s ASP 152 Cb -0.06 1.30 0.00 0.00 -1.46 0.00 0.00 42.92 42.70 1au0 s ASP 152 CO -0.11 -0.26 0.62 -1.84 0.52 0.00 0.00 175.17 174.10 1au0 n GLU 153 N 5.38 0.00 0.00 4.34 -0.00 -1.26 -1.17 120.64 127.94 1au0 n GLU 153 Ca -0.07 0.19 0.10 0.00 -0.00 0.00 0.00 57.16 57.38 1au0 n GLU 153 Cb 0.50 -1.58 0.02 0.00 -0.00 0.00 0.00 31.44 30.38 1au0 n GLU 153 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1au0 n SER 154 N -1.12 2.02 -4.67 -1.84 7.64 -1.26 -4.93 113.62 109.45 1au0 n SER 154 Ca 0.00 -1.51 -0.43 0.00 1.01 0.00 0.00 58.87 57.94 1au0 n SER 154 Cb 0.08 0.36 -0.03 0.00 -1.01 0.00 0.00 64.21 63.61 1au0 n SER 154 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1au0 s ASN 156 N 3.64 6.19 0.33 0.00 2.47 -1.26 -4.45 114.94 121.85 1au0 s ASN 156 Ca 0.86 -0.97 0.15 0.00 0.42 0.00 0.00 52.86 53.33 1au0 s ASN 156 Cb -0.48 -2.24 0.84 0.00 -1.45 0.00 0.00 41.25 37.93 1au0 s ASN 156 CO 0.41 -0.72 1.40 -1.20 -3.72 0.00 0.00 177.10 173.27 1au0 n SER 157 N 5.69 0.40 0.06 -4.21 7.64 -1.26 -0.12 113.62 121.82 1au0 n SER 157 Ca -0.09 0.61 0.11 0.00 1.01 0.00 0.00 58.87 60.52 1au0 n SER 157 Cb 0.45 -0.59 0.01 0.00 -1.01 0.00 0.00 64.21 63.08 1au0 n SER 157 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1au0 n ASP 158 N -2.12 0.67 -4.06 6.43 9.92 -1.26 -4.58 116.55 121.56 1au0 n ASP 158 Ca -0.01 0.12 -0.38 0.00 -0.53 0.00 0.00 54.79 53.99 1au0 n ASP 158 Cb 0.25 0.68 -0.04 0.00 -0.64 0.00 0.00 41.12 41.37 1au0 n ASP 158 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1au0 n ASN 159 N -2.37 4.82 -4.57 -2.24 2.85 0.83 -5.00 115.26 109.59 1au0 n ASN 159 Ca 0.00 -3.20 -0.43 0.00 -0.11 0.00 0.00 54.58 50.84 1au0 n ASN 159 Cb 0.51 -1.11 -0.04 0.00 1.24 0.00 0.00 39.78 40.37 1au0 n ASN 159 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1au0 s LEU 160 N -1.76 4.03 0.00 1.20 1.43 -1.26 -3.70 118.68 118.62 1au0 s LEU 160 Ca 0.30 0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.54 1au0 s LEU 160 Cb -0.03 -3.18 0.00 0.00 0.03 0.00 0.00 46.19 43.01 1au0 s LEU 160 CO -0.06 -1.02 0.00 -0.46 0.23 0.00 0.00 176.35 175.04 1au0 n ASN 161 N 7.09 2.83 -3.95 2.29 0.23 -0.48 -4.92 115.26 118.34 1au0 n ASN 161 Ca 0.06 -0.16 -0.28 0.00 -0.53 0.00 0.00 54.58 53.66 1au0 n ASN 161 Cb 0.48 0.89 -0.17 0.00 -2.08 0.00 0.00 39.78 38.91 1au0 n ASN 161 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1au0 s HIS 162 N -1.46 1.79 0.36 -2.53 5.04 -0.40 -4.94 115.29 113.15 1au0 s HIS 162 Ca 0.00 -0.98 -0.23 0.00 -1.54 0.00 0.00 55.06 52.31 1au0 s HIS 162 Cb 0.00 -1.39 -0.10 0.00 0.04 0.00 0.00 32.58 31.13 1au0 s HIS 162 CO 0.00 -0.59 0.92 0.00 -2.34 0.00 0.00 174.74 172.73 1au0 s ALA 163 N 1.61 3.16 0.00 1.58 0.00 -1.26 -0.47 121.76 126.38 1au0 s ALA 163 Ca 0.04 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1au0 s ALA 163 Cb -0.13 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1au0 s ALA 163 CO -0.09 0.18 0.00 1.55 0.00 0.00 0.00 175.76 177.40 1au0 n VAL 164 N 0.04 0.00 -3.71 0.00 3.14 0.12 -4.67 118.33 113.24 1au0 n VAL 164 Ca 0.04 0.00 -0.17 0.00 -2.96 0.00 0.00 64.34 61.25 1au0 n VAL 164 Cb 0.52 0.00 -0.16 0.00 -1.06 0.00 0.00 33.84 33.13 1au0 n VAL 164 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 1au0 s LEU 165 N 0.00 0.50 -0.18 6.55 2.96 -1.18 -1.94 118.68 125.39 1au0 s LEU 165 Ca 0.00 0.14 -0.29 0.00 -0.22 0.00 0.00 54.13 53.76 1au0 s LEU 165 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 46.19 46.71 1au0 s LEU 165 CO 0.00 -0.19 1.01 0.00 -1.32 0.00 0.00 176.35 175.84 1au0 s ALA 166 N 1.68 3.58 -1.57 5.97 0.00 0.03 -0.99 121.76 130.47 1au0 s ALA 166 Ca -0.02 0.23 0.14 0.00 0.00 0.00 0.00 51.96 52.31 1au0 s ALA 166 Cb -0.12 -3.48 0.23 0.00 0.00 0.00 0.00 23.12 19.75 1au0 s ALA 166 CO -0.04 -0.87 1.11 0.28 0.00 0.00 0.00 175.76 176.25 1au0 n VAL 167 N 5.01 0.41 -2.94 0.00 0.31 0.14 -2.47 118.33 118.80 1au0 n VAL 167 Ca 0.10 -0.71 0.00 0.00 -0.01 0.00 0.00 64.34 63.72 1au0 n VAL 167 Cb 0.47 0.97 0.00 0.00 -0.91 0.00 0.00 33.84 34.37 1au0 n VAL 167 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1au0 n GLY 168 N 0.82 -0.16 3.83 2.92 0.00 -1.23 -1.15 105.19 110.21 1au0 n GLY 168 Ca 0.11 -1.33 -0.06 0.00 0.00 0.00 0.00 46.02 44.74 1au0 n GLY 168 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1au0 s TYR 169 N -2.97 0.06 -3.43 1.61 -0.85 -0.75 -1.64 117.35 109.38 1au0 s TYR 169 Ca 0.00 -0.60 0.00 0.00 -0.52 0.00 0.00 57.07 55.95 1au0 s TYR 169 Cb 0.00 0.77 0.00 0.00 0.38 0.00 0.00 41.96 43.11 1au0 s TYR 169 CO 0.00 -1.28 0.00 0.41 -1.52 0.00 0.00 175.55 173.16 1au0 n GLY 170 N -0.58 -0.53 2.62 5.49 0.00 0.25 -3.04 105.19 109.40 1au0 n GLY 170 Ca -0.06 -0.87 -0.27 0.00 0.00 0.00 0.00 46.02 44.82 1au0 n GLY 170 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1au0 s ILE 171 N -3.24 0.01 0.02 -0.61 -1.09 -1.26 -0.41 121.20 114.63 1au0 s ILE 171 Ca 0.00 -0.28 -0.27 0.00 -2.23 0.00 0.00 60.65 57.87 1au0 s ILE 171 Cb 0.00 -0.68 -0.17 0.00 -1.58 0.00 0.00 42.46 40.03 1au0 s ILE 171 CO 0.00 -0.31 1.30 -0.61 -1.23 0.00 0.00 174.94 174.08 1au0 h GLN 172 N 8.39 -0.62 -0.74 2.79 4.15 -1.84 -3.44 115.11 123.81 1au0 h GLN 172 Ca -0.16 0.04 0.04 0.00 0.77 0.00 0.00 58.65 59.34 1au0 h GLN 172 Cb 1.13 0.14 -0.19 0.00 0.21 0.00 0.00 27.48 28.77 1au0 h GLN 172 CO 0.31 -0.32 -0.31 0.21 -1.93 0.00 0.00 178.83 176.80 1au0 s LYS 173 N -5.00 0.54 0.00 1.69 2.20 -1.26 -4.92 119.74 112.99 1au0 s LYS 173 Ca -0.15 0.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.49 1au0 s LYS 173 Cb 0.02 0.12 0.00 0.00 -1.51 0.00 0.00 37.83 36.46 1au0 s LYS 173 CO 0.53 -0.85 0.00 0.41 -0.36 0.00 0.00 175.35 175.09 1au0 n GLY 174 N 4.60 2.18 3.65 5.54 0.00 -1.26 -4.96 105.19 114.95 1au0 n GLY 174 Ca 0.08 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1au0 n GLY 174 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1au0 s ASN 175 N 0.10 6.11 0.28 1.61 -0.87 -1.26 -5.06 114.94 115.85 1au0 s ASN 175 Ca 0.00 0.10 -0.29 0.00 -1.57 0.00 0.00 52.86 51.10 1au0 s ASN 175 Cb 0.00 -2.11 -0.10 0.00 -0.02 0.00 0.00 41.25 39.02 1au0 s ASN 175 CO 0.00 0.05 1.30 -0.54 -2.57 0.00 0.00 177.10 175.34 1au0 s LYS 176 N 1.12 4.39 -0.00 -0.60 1.02 -1.26 -2.33 119.74 122.08 1au0 s LYS 176 Ca 0.08 2.14 -0.16 0.00 0.02 0.00 0.00 55.97 58.04 1au0 s LYS 176 Cb -0.14 -3.12 0.03 0.00 -0.52 0.00 0.00 37.83 34.08 1au0 s LYS 176 CO 0.05 -0.18 0.35 -3.38 -0.92 0.00 0.00 175.35 171.27 1au0 s HIS 177 N -0.70 -0.22 -0.23 3.18 -3.43 0.46 -1.44 115.29 112.92 1au0 s HIS 177 Ca 0.51 0.29 -0.12 0.00 -0.80 0.00 0.00 55.06 54.95 1au0 s HIS 177 Cb -0.38 0.13 -0.05 0.00 -1.43 0.00 0.00 32.58 30.85 1au0 s HIS 177 CO 0.47 -0.44 0.21 -1.58 -2.00 0.00 0.00 174.74 171.40 1au0 s TRP 178 N -1.59 3.34 -0.39 0.38 0.52 0.67 -0.58 118.94 121.29 1au0 s TRP 178 Ca -0.11 0.33 -0.25 0.00 0.02 0.00 0.00 56.10 56.09 1au0 s TRP 178 Cb -0.04 -2.31 0.02 0.00 -1.15 0.00 0.00 33.47 29.98 1au0 s TRP 178 CO 0.03 0.08 0.87 0.42 0.02 0.00 0.00 176.95 178.36 1au0 s ILE 179 N 1.03 4.63 -0.10 2.03 1.01 -0.65 -1.44 121.20 127.70 1au0 s ILE 179 Ca 0.10 0.97 -0.02 0.00 0.00 0.00 0.00 60.65 61.70 1au0 s ILE 179 Cb -0.13 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 38.00 1au0 s ILE 179 CO 0.05 -0.56 -0.00 -0.63 0.00 0.00 0.00 174.94 173.80 1au0 s ILE 180 N 3.37 4.25 -0.44 2.92 -1.09 0.15 -0.68 121.20 129.67 1au0 s ILE 180 Ca 0.35 -0.26 -0.10 0.00 -2.23 0.00 0.00 60.65 58.40 1au0 s ILE 180 Cb -0.12 -2.80 0.09 0.00 -1.58 0.00 0.00 42.46 38.05 1au0 s ILE 180 CO 0.19 0.58 0.31 -0.75 -1.23 0.00 0.00 174.94 174.05 1au0 s LYS 181 N -0.66 2.64 0.90 2.79 2.20 -0.16 -1.45 119.74 126.01 1au0 s LYS 181 Ca 0.11 -1.52 -0.11 0.00 -0.36 0.00 0.00 55.97 54.08 1au0 s LYS 181 Cb -0.12 -3.88 0.20 0.00 -1.51 0.00 0.00 37.83 32.52 1au0 s LYS 181 CO 0.02 -1.03 1.23 1.21 -0.36 0.00 0.00 175.35 176.42 1au0 s ASN 182 N 2.37 3.33 -0.35 1.43 3.84 -0.93 -3.08 114.94 121.55 1au0 s ASN 182 Ca 0.04 -0.08 0.12 0.00 0.21 0.00 0.00 52.86 53.15 1au0 s ASN 182 Cb -0.24 0.01 0.45 0.00 -0.55 0.00 0.00 41.25 40.92 1au0 s ASN 182 CO 0.02 -2.57 1.07 -1.54 -2.79 0.00 0.00 177.10 171.29 1au0 n SER 183 N -3.51 3.18 -2.82 -4.21 3.41 -1.26 -4.67 113.62 103.74 1au0 n SER 183 Ca 0.17 -3.13 -0.29 0.00 -0.26 0.00 0.00 58.87 55.36 1au0 n SER 183 Cb 0.60 -0.47 -0.02 0.00 -0.26 0.00 0.00 64.21 64.06 1au0 n SER 183 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1au0 n TRP 184 N -0.39 3.70 -1.18 7.33 8.01 -1.17 -0.48 117.44 133.26 1au0 n TRP 184 Ca 0.25 -3.51 0.16 0.00 -1.31 0.00 0.00 57.50 53.09 1au0 n TRP 184 Cb 0.78 -0.43 -0.05 0.00 -2.01 0.00 0.00 31.31 29.61 1au0 n TRP 184 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1au0 n GLY 185 N -0.33 -2.12 0.78 6.99 0.00 -0.91 -3.58 105.19 106.02 1au0 n GLY 185 Ca 0.36 -1.20 0.12 0.00 0.00 0.00 0.00 46.02 45.30 1au0 n GLY 185 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1au0 n GLU 186 N -3.79 2.07 0.22 1.61 0.28 -1.26 -3.80 120.64 115.96 1au0 n GLU 186 Ca -0.01 -1.57 0.12 0.00 -0.16 0.00 0.00 57.16 55.55 1au0 n GLU 186 Cb 0.54 -1.47 0.19 0.00 1.43 0.00 0.00 31.44 32.14 1au0 n GLU 186 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 1au0 h ASN 187 N 3.61 0.00 -4.28 -1.84 -0.00 -1.90 -3.17 115.58 107.99 1au0 h ASN 187 Ca 0.00 0.00 -0.49 0.00 -0.00 0.00 0.00 56.30 55.81 1au0 h ASN 187 Cb 0.77 0.00 0.04 0.00 -0.00 0.00 0.00 38.32 39.14 1au0 h ASN 187 CO 0.00 0.00 0.40 0.86 -0.00 0.00 0.00 177.43 178.69 1au0 s TRP 188 N -3.22 3.50 0.00 0.67 -0.00 -1.24 -4.84 118.94 113.82 1au0 s TRP 188 Ca 0.07 1.38 0.00 0.00 -0.00 0.00 0.00 56.10 57.55 1au0 s TRP 188 Cb 0.05 -2.77 0.00 0.00 -0.00 0.00 0.00 33.47 30.75 1au0 s TRP 188 CO 0.66 -0.59 0.00 0.41 -0.00 0.00 0.00 176.95 177.43 1au0 n GLY 189 N -2.14 0.69 3.53 5.86 0.00 -1.25 -1.04 105.19 110.84 1au0 n GLY 189 Ca 0.06 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 1au0 n GLY 189 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1au0 s ASN 190 N -2.49 6.78 -1.53 1.61 3.04 -0.75 -4.33 114.94 117.26 1au0 s ASN 190 Ca 0.00 -2.27 -0.13 0.00 0.04 0.00 0.00 52.86 50.50 1au0 s ASN 190 Cb 0.00 -2.51 0.09 0.00 -1.54 0.00 0.00 41.25 37.29 1au0 s ASN 190 CO 0.00 -1.14 0.95 0.29 -3.04 0.00 0.00 177.10 174.17 1au0 n LYS 191 N 7.58 -5.34 0.00 0.43 5.02 -1.15 -1.57 118.16 123.14 1au0 n LYS 191 Ca 0.38 0.58 0.00 0.00 -2.02 0.00 0.00 58.31 57.26 1au0 n LYS 191 Cb 0.47 -5.44 0.00 0.00 -0.02 0.00 0.00 35.03 30.04 1au0 n LYS 191 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1au0 n GLY 192 N -1.67 3.30 4.01 0.72 0.00 -0.20 -4.77 105.19 106.57 1au0 n GLY 192 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 1au0 n GLY 192 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1au0 s TYR 193 N -2.90 2.57 -0.27 1.61 1.51 -0.61 -2.18 117.35 117.08 1au0 s TYR 193 Ca 0.00 -0.43 -0.17 0.00 -1.01 0.00 0.00 57.07 55.45 1au0 s TYR 193 Cb 0.00 -2.37 0.08 0.00 -0.11 0.00 0.00 41.96 39.55 1au0 s TYR 193 CO 0.00 -0.58 0.67 -1.50 -1.11 0.00 0.00 175.55 173.04 1au0 s ILE 194 N -2.43 -0.00 -0.17 2.71 2.07 -0.53 -1.81 121.20 121.04 1au0 s ILE 194 Ca 0.56 0.01 -0.18 0.00 -1.41 0.00 0.00 60.65 59.63 1au0 s ILE 194 Cb -0.09 -0.97 -0.04 0.00 0.13 0.00 0.00 42.46 41.49 1au0 s ILE 194 CO 0.34 0.00 0.50 -0.76 -1.91 0.00 0.00 174.94 173.12 1au0 s LEU 195 N 1.37 4.19 0.05 8.50 1.02 -1.26 -0.67 118.68 131.88 1au0 s LEU 195 Ca -0.08 0.72 0.08 0.00 0.02 0.00 0.00 54.13 54.87 1au0 s LEU 195 Cb -0.05 -2.70 -0.03 0.00 0.02 0.00 0.00 46.19 43.43 1au0 s LEU 195 CO -0.15 -0.11 -0.21 -0.04 0.02 0.00 0.00 176.35 175.85 1au0 s MET 196 N 1.26 1.96 0.29 1.70 -1.94 -0.52 -0.74 119.30 121.30 1au0 s MET 196 Ca 0.25 -1.04 -0.29 0.00 -1.71 0.00 0.00 55.69 52.90 1au0 s MET 196 Cb -0.15 -2.11 -0.13 0.00 2.01 0.00 0.00 34.83 34.44 1au0 s MET 196 CO 0.10 0.53 1.22 0.00 -0.01 0.00 0.00 175.02 176.85 1au0 n ALA 197 N 1.58 0.63 -3.71 3.03 0.00 -0.55 -0.23 120.51 121.25 1au0 n ALA 197 Ca -0.16 0.39 -0.31 0.00 0.00 0.00 0.00 53.44 53.35 1au0 n ALA 197 Cb 0.52 -2.17 -0.17 0.00 0.00 0.00 0.00 19.45 17.64 1au0 n ALA 197 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1au0 s ARG 198 N -1.35 2.73 0.00 0.00 3.52 -0.52 -4.60 118.95 118.73 1au0 s ARG 198 Ca 0.60 -0.75 0.00 0.00 -0.13 0.00 0.00 55.73 55.46 1au0 s ARG 198 Cb -0.65 -2.26 0.00 0.00 -1.56 0.00 0.00 34.95 30.48 1au0 s ARG 198 CO 0.58 -0.05 0.00 0.09 -0.81 0.00 0.00 175.30 175.11 1au0 n ASN 199 N 4.19 -0.45 -3.65 -2.12 5.03 -1.26 -4.52 115.26 112.47 1au0 n ASN 199 Ca -0.20 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 54.84 1au0 n ASN 199 Cb 0.51 -0.07 -0.00 0.00 -1.02 0.00 0.00 39.78 39.20 1au0 n ASN 199 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1au0 n LYS 200 N -2.15 4.11 -3.13 3.52 5.02 -1.26 -4.72 118.16 119.55 1au0 n LYS 200 Ca 0.00 -3.44 -0.14 0.00 -2.02 0.00 0.00 58.31 52.71 1au0 n LYS 200 Cb 0.00 -2.78 0.01 0.00 -0.02 0.00 0.00 35.03 32.25 1au0 n LYS 200 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1au0 n ASN 201 N 2.80 -6.81 -3.73 4.39 5.03 -1.26 -3.48 115.26 112.19 1au0 n ASN 201 Ca 0.52 0.46 -0.21 0.00 0.87 0.00 0.00 54.58 56.23 1au0 n ASN 201 Cb 0.30 -3.11 -0.01 0.00 -1.02 0.00 0.00 39.78 35.93 1au0 n ASN 201 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1au0 n ASN 202 N 0.40 -1.06 -4.65 6.41 5.15 -1.26 -4.73 115.26 115.52 1au0 n ASN 202 Ca -0.00 -0.67 -0.52 0.00 -0.60 0.00 0.00 54.58 52.79 1au0 n ASN 202 Cb 0.45 -0.82 -0.06 0.00 -0.53 0.00 0.00 39.78 38.83 1au0 n ASN 202 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1au0 n ALA 203 N -2.99 -0.08 -1.04 5.20 0.00 -1.23 -0.88 120.51 119.49 1au0 n ALA 203 Ca -0.10 0.44 -0.03 0.00 0.00 0.00 0.00 53.44 53.75 1au0 n ALA 203 Cb 0.32 -2.22 -0.01 0.00 0.00 0.00 0.00 19.45 17.54 1au0 n ALA 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1au0 n GLY 205 N 0.80 -0.35 0.32 0.00 0.00 -0.05 -3.02 105.19 102.88 1au0 n GLY 205 Ca -0.03 0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1au0 n GLY 205 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1au0 h ILE 206 N -1.39 0.89 -0.94 -0.61 2.10 -1.60 -2.59 117.51 113.37 1au0 h ILE 206 Ca -0.46 -0.02 -0.63 0.00 1.08 0.00 0.00 64.86 64.83 1au0 h ILE 206 Cb 1.32 0.84 -0.31 0.00 -1.09 0.00 0.00 36.82 37.58 1au0 h ILE 206 CO 0.49 0.01 0.59 0.00 -1.08 0.00 0.00 178.15 178.15 1au0 n ALA 207 N -2.58 6.03 0.29 0.18 0.00 -1.26 -4.32 120.51 118.84 1au0 n ALA 207 Ca 0.03 -3.46 0.03 0.00 0.00 0.00 0.00 53.44 50.05 1au0 n ALA 207 Cb 0.31 -1.51 -0.04 0.00 0.00 0.00 0.00 19.45 18.21 1au0 n ALA 207 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1au0 n ASN 208 N -0.92 0.80 -2.72 0.00 4.13 -0.98 -0.03 115.26 115.55 1au0 n ASN 208 Ca 0.59 -0.57 -0.05 0.00 1.68 0.00 0.00 54.58 56.24 1au0 n ASN 208 Cb 0.81 1.05 0.08 0.00 -1.54 0.00 0.00 39.78 40.18 1au0 n ASN 208 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1au0 n LEU 209 N -1.26 0.12 -4.87 3.41 7.94 -1.26 -4.79 117.00 116.30 1au0 n LEU 209 Ca 0.01 -3.36 -0.32 0.00 -1.11 0.00 0.00 56.01 51.23 1au0 n LEU 209 Cb 0.12 0.28 -0.05 0.00 0.53 0.00 0.00 43.42 44.31 1au0 n LEU 209 CO 0.15 1.52 0.33 0.00 -1.11 0.00 0.00 177.39 178.28 1au0 s ALA 210 N -1.89 3.44 0.05 1.96 0.00 -1.26 -3.78 121.76 120.28 1au0 s ALA 210 Ca 0.22 -0.17 -0.27 0.00 0.00 0.00 0.00 51.96 51.74 1au0 s ALA 210 Cb 0.41 -2.60 0.09 0.00 0.00 0.00 0.00 23.12 21.02 1au0 s ALA 210 CO -0.05 0.33 0.90 -1.54 0.00 0.00 0.00 175.76 175.41 1au0 s SER 211 N -2.53 -0.31 -0.07 0.00 1.04 -0.51 -2.84 113.70 108.48 1au0 s SER 211 Ca 0.50 -0.13 -0.10 0.00 0.48 0.00 0.00 55.95 56.71 1au0 s SER 211 Cb -0.11 0.42 0.02 0.00 0.10 0.00 0.00 66.02 66.46 1au0 s SER 211 CO 0.22 -0.72 0.26 0.72 0.98 0.00 0.00 173.24 174.70 1au0 s PHE 212 N -3.19 -0.23 0.51 5.02 -0.12 0.23 -1.85 117.98 118.35 1au0 s PHE 212 Ca 0.07 0.54 -0.17 0.00 -0.05 0.00 0.00 56.93 57.31 1au0 s PHE 212 Cb -0.01 0.08 -0.08 0.00 -0.63 0.00 0.00 43.02 42.38 1au0 s PHE 212 CO -0.06 -0.20 0.99 -1.25 -0.05 0.00 0.00 175.22 174.66 1au0 s PRO 213 N -0.27 3.89 -0.17 1.99 0.04 -1.26 -0.16 135.00 139.06 1au0 s PRO 213 Ca -0.04 1.05 -0.08 0.00 0.04 0.00 0.00 61.00 61.97 1au0 s PRO 213 Cb -0.03 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 1au0 s PRO 213 CO 0.01 -0.32 0.12 0.15 0.04 0.00 0.00 177.00 177.00 1au0 s LYS 214 N -3.86 3.91 0.00 4.56 1.02 -0.93 -4.82 119.74 119.62 1au0 s LYS 214 Ca 0.61 -0.23 0.00 0.00 0.02 0.00 0.00 55.97 56.37 1au0 s LYS 214 Cb -0.11 -3.30 0.00 0.00 -0.52 0.00 0.00 37.83 33.90 1au0 s LYS 214 CO 0.28 0.44 0.27 -0.12 -0.92 0.00 0.00 175.35 175.30