#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aw5 s THR 3 N 0.00 2.02 0.04 3.57 -4.23 -1.26 -5.09 115.64 110.69 1aw5 s THR 3 Ca 0.00 -1.57 -0.30 0.00 -1.18 0.00 0.00 61.69 58.64 1aw5 s THR 3 Cb 0.00 -1.79 -0.08 0.00 1.34 0.00 0.00 72.50 71.97 1aw5 s THR 3 CO 0.00 0.11 1.84 0.00 -0.54 0.00 0.00 174.62 176.03 1aw5 s ALA 4 N -1.01 3.64 0.06 3.99 0.00 -1.26 -4.98 121.76 122.21 1aw5 s ALA 4 Ca 0.11 1.26 -0.15 0.00 0.00 0.00 0.00 51.96 53.17 1aw5 s ALA 4 Cb -0.10 -3.79 -0.06 0.00 0.00 0.00 0.00 23.12 19.17 1aw5 s ALA 4 CO 0.04 -1.41 0.48 -2.00 0.00 0.00 0.00 175.76 172.88 1aw5 s GLU 5 N 3.81 4.00 -0.24 0.00 2.12 -1.26 -5.07 118.70 122.06 1aw5 s GLU 5 Ca 0.82 0.50 -0.02 0.00 0.36 0.00 0.00 54.97 56.63 1aw5 s GLU 5 Cb -0.41 -3.14 0.08 0.00 0.26 0.00 0.00 34.13 30.92 1aw5 s GLU 5 CO 0.37 0.62 0.07 -0.06 -0.54 0.00 0.00 175.26 175.71 1aw5 s PHE 6 N -1.20 1.16 0.87 5.30 0.08 -1.26 -5.13 117.98 117.79 1aw5 s PHE 6 Ca 0.29 -1.14 -0.11 0.00 0.12 0.00 0.00 56.93 56.09 1aw5 s PHE 6 Cb -0.17 -1.23 0.11 0.00 -0.57 0.00 0.00 43.02 41.17 1aw5 s PHE 6 CO 0.17 -0.72 1.10 -0.51 -0.10 0.00 0.00 175.22 175.15 1aw5 s LEU 7 N 1.81 2.64 0.09 -0.37 1.43 -1.26 -4.99 118.68 118.03 1aw5 s LEU 7 Ca 0.04 1.81 -0.15 0.00 -1.03 0.00 0.00 54.13 54.79 1aw5 s LEU 7 Cb -0.17 -4.30 -0.06 0.00 0.03 0.00 0.00 46.19 41.68 1aw5 s LEU 7 CO -0.17 -2.61 0.51 -1.83 0.23 0.00 0.00 176.35 172.47 1aw5 s GLU 8 N -4.82 4.01 0.30 1.70 -1.05 -1.26 -5.07 118.70 112.51 1aw5 s GLU 8 Ca 0.64 0.51 0.04 0.00 -0.15 0.00 0.00 54.97 56.01 1aw5 s GLU 8 Cb -0.19 -3.09 -0.06 0.00 -0.44 0.00 0.00 34.13 30.35 1aw5 s GLU 8 CO 0.57 0.58 0.03 0.95 0.95 0.00 0.00 175.26 178.35 1aw5 s THR 9 N -1.27 1.19 0.75 1.83 -4.23 -1.26 -5.14 115.64 107.51 1aw5 s THR 9 Ca 0.32 -2.02 -0.08 0.00 -1.18 0.00 0.00 61.69 58.72 1aw5 s THR 9 Cb -0.17 -2.66 0.08 0.00 1.34 0.00 0.00 72.50 71.09 1aw5 s THR 9 CO 0.18 -0.10 1.08 -1.61 -0.54 0.00 0.00 174.62 173.63 1aw5 s GLU 10 N -3.87 1.98 0.73 3.99 2.02 -1.26 -5.00 118.70 117.28 1aw5 s GLU 10 Ca 0.34 -0.22 -0.16 0.00 0.02 0.00 0.00 54.97 54.96 1aw5 s GLU 10 Cb 0.07 -2.10 0.04 0.00 0.10 0.00 0.00 34.13 32.25 1aw5 s GLU 10 CO 0.14 -1.44 1.25 -2.30 0.02 0.00 0.00 175.26 172.93 1aw5 n PRO 11 N -3.09 0.65 -1.91 0.39 -0.02 -1.26 -4.89 135.00 124.88 1aw5 n PRO 11 Ca 0.09 0.29 -0.40 0.00 -2.02 0.00 0.00 63.50 61.46 1aw5 n PRO 11 Cb 0.61 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1aw5 n PRO 11 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1aw5 s THR 12 N -1.75 2.29 0.07 3.45 2.01 -1.26 -5.00 115.64 115.44 1aw5 s THR 12 Ca 0.78 0.27 -0.11 0.00 0.31 0.00 0.00 61.69 62.94 1aw5 s THR 12 Cb -0.34 -3.17 -0.06 0.00 0.01 0.00 0.00 72.50 68.95 1aw5 s THR 12 CO 0.45 0.05 0.41 -1.61 -0.69 0.00 0.00 174.62 173.23 1aw5 s GLU 13 N -2.23 3.80 0.28 4.92 2.02 -1.26 -4.99 118.70 121.25 1aw5 s GLU 13 Ca 0.56 0.24 -0.01 0.00 0.02 0.00 0.00 54.97 55.79 1aw5 s GLU 13 Cb -0.42 -3.04 0.40 0.00 0.10 0.00 0.00 34.13 31.17 1aw5 s GLU 13 CO 0.55 0.58 1.80 0.82 0.02 0.00 0.00 175.26 179.04 1aw5 h ILE 14 N 3.05 1.23 0.00 -1.63 2.04 -1.97 -1.95 117.51 118.28 1aw5 h ILE 14 Ca -0.50 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 64.47 1aw5 h ILE 14 Cb 1.20 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 1aw5 h ILE 14 CO 0.65 0.32 0.01 -1.54 0.00 0.00 0.00 178.15 177.60 1aw5 n SER 15 N -4.25 0.27 0.10 1.72 3.41 -1.26 -0.91 113.62 112.70 1aw5 n SER 15 Ca 0.03 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.37 1aw5 n SER 15 Cb 0.26 -0.65 0.02 0.00 -0.26 0.00 0.00 64.21 63.58 1aw5 n SER 15 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1aw5 h SER 16 N 0.00 0.00 -2.48 4.04 0.02 -1.75 -3.45 113.55 109.93 1aw5 h SER 16 Ca 0.00 -0.03 -0.61 0.00 -0.84 0.00 0.00 61.79 60.31 1aw5 h SER 16 Cb 0.02 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 62.43 1aw5 h SER 16 CO 0.00 0.01 0.74 -0.69 -1.14 0.00 0.00 176.83 175.76 1aw5 s VAL 17 N -3.34 4.19 -0.07 2.27 1.01 -0.09 -4.83 120.40 119.54 1aw5 s VAL 17 Ca 0.00 -0.31 0.13 0.00 0.00 0.00 0.00 61.98 61.81 1aw5 s VAL 17 Cb 0.10 -4.77 -0.19 0.00 0.00 0.00 0.00 36.38 31.52 1aw5 s VAL 17 CO 0.78 -1.59 0.18 0.18 0.00 0.00 0.00 175.10 174.66 1aw5 n LEU 18 N 8.07 0.00 -0.15 3.92 4.77 -1.26 -4.66 117.00 127.69 1aw5 n LEU 18 Ca 0.02 0.00 0.28 0.00 -0.03 0.00 0.00 56.01 56.28 1aw5 n LEU 18 Cb 0.47 0.16 0.72 0.00 -2.33 0.00 0.00 43.42 42.44 1aw5 n LEU 18 CO 0.65 0.16 1.26 0.00 -1.33 0.00 0.00 177.39 178.12 1aw5 h ALA 19 N 0.99 2.75 0.00 -1.18 0.00 -1.91 -0.48 119.26 119.42 1aw5 h ALA 19 Ca -0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1aw5 h ALA 19 Cb 1.23 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1aw5 h ALA 19 CO 0.01 -1.11 0.00 0.41 0.00 0.00 0.00 179.25 178.56 1aw5 n GLY 20 N -1.67 -0.88 0.01 0.00 0.00 -1.26 -2.46 105.19 98.93 1aw5 n GLY 20 Ca 0.18 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.26 1aw5 n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aw5 n GLY 21 N 0.00 -1.33 2.96 -0.02 0.00 -0.19 -4.65 105.19 101.97 1aw5 n GLY 21 Ca 0.06 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 1aw5 n GLY 21 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1aw5 s TYR 22 N -3.02 -0.94 0.00 1.61 1.13 -1.03 -4.83 117.35 110.27 1aw5 s TYR 22 Ca 0.11 -0.32 0.00 0.00 -1.41 0.00 0.00 57.07 55.45 1aw5 s TYR 22 Cb 0.17 -0.08 0.00 0.00 -1.10 0.00 0.00 41.96 40.95 1aw5 s TYR 22 CO 0.67 -1.06 0.00 0.27 -2.51 0.00 0.00 175.55 172.92 1aw5 n ASN 23 N 4.35 0.67 -4.60 -0.18 0.23 -1.26 -4.92 115.26 109.55 1aw5 n ASN 23 Ca 0.11 0.00 -0.30 0.00 -0.53 0.00 0.00 54.58 53.86 1aw5 n ASN 23 Cb 0.50 0.11 -0.10 0.00 -2.08 0.00 0.00 39.78 38.22 1aw5 n ASN 23 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1aw5 s HIS 24 N -0.51 2.81 0.41 -2.53 5.04 -1.26 -5.02 115.29 114.24 1aw5 s HIS 24 Ca 0.00 -0.11 0.16 0.00 -1.54 0.00 0.00 55.06 53.56 1aw5 s HIS 24 Cb 0.00 -1.48 1.04 0.00 0.04 0.00 0.00 32.58 32.18 1aw5 s HIS 24 CO 0.00 0.42 1.88 -1.35 -2.34 0.00 0.00 174.74 173.36 1aw5 h PRO 25 N 3.75 0.43 -0.10 2.88 0.11 -2.01 0.36 132.00 137.43 1aw5 h PRO 25 Ca -0.48 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.46 1aw5 h PRO 25 Cb 1.17 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1aw5 h PRO 25 CO 0.54 0.28 -0.54 1.25 -0.21 0.00 0.00 178.00 179.33 1aw5 h LEU 26 N 0.44 0.31 -0.51 2.35 5.85 -2.01 -2.68 115.31 119.06 1aw5 h LEU 26 Ca 0.43 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1aw5 h LEU 26 Cb 0.98 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1aw5 h LEU 26 CO -0.16 0.79 0.00 0.18 -0.34 0.00 0.00 178.44 178.92 1aw5 n LEU 27 N -3.93 0.50 0.22 2.25 4.77 0.11 -1.89 117.00 119.02 1aw5 n LEU 27 Ca -0.02 0.62 0.12 0.00 -0.03 0.00 0.00 56.01 56.70 1aw5 n LEU 27 Cb 0.57 -0.55 0.17 0.00 -2.33 0.00 0.00 43.42 41.28 1aw5 n LEU 27 CO 0.44 -0.48 0.79 0.03 -1.33 0.00 0.00 177.39 176.85 1aw5 h ARG 28 N 0.00 0.00 0.09 3.23 3.08 -1.34 -2.39 114.38 117.06 1aw5 h ARG 28 Ca 0.00 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.72 1aw5 h ARG 28 Cb 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1aw5 h ARG 28 CO 0.00 0.00 -1.77 1.96 -1.07 0.00 0.00 179.97 179.09 1aw5 h GLN 29 N 0.00 0.19 -0.54 0.04 1.08 -1.49 -3.35 115.11 111.05 1aw5 h GLN 29 Ca 0.00 -0.33 -0.03 0.00 -1.45 0.00 0.00 58.65 56.84 1aw5 h GLN 29 Cb 1.00 0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 28.53 1aw5 h GLN 29 CO 0.00 0.99 0.23 -1.49 -0.95 0.00 0.00 178.83 177.61 1aw5 h TRP 30 N 0.05 0.77 0.00 2.96 4.06 -1.37 -2.49 115.95 119.93 1aw5 h TRP 30 Ca -0.33 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.59 1aw5 h TRP 30 Cb 2.03 -0.24 0.00 0.00 -1.00 0.00 0.00 29.16 29.95 1aw5 h TRP 30 CO 0.05 0.59 0.00 1.04 -3.56 0.00 0.00 178.44 176.56 1aw5 n GLN 31 N -4.35 0.76 -3.87 0.49 1.13 -0.90 -4.85 117.38 105.79 1aw5 n GLN 31 Ca 0.04 0.01 -0.36 0.00 -1.94 0.00 0.00 57.00 54.76 1aw5 n GLN 31 Cb 0.15 -1.50 -0.08 0.00 0.11 0.00 0.00 30.24 28.92 1aw5 n GLN 31 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1aw5 s SER 32 N -2.17 6.11 0.56 1.08 1.04 -0.94 -4.96 113.70 114.43 1aw5 s SER 32 Ca 0.39 0.28 0.25 0.00 0.48 0.00 0.00 55.95 57.35 1aw5 s SER 32 Cb 0.20 -2.02 1.52 0.00 0.10 0.00 0.00 66.02 65.81 1aw5 s SER 32 CO 0.36 0.27 2.10 -0.33 0.98 0.00 0.00 173.24 176.62 1aw5 h GLU 33 N 6.01 0.00 -1.82 4.02 5.08 -1.88 -3.43 114.58 122.55 1aw5 h GLU 33 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1aw5 h GLU 33 Cb 1.18 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.21 1aw5 h GLU 33 CO 0.68 0.00 0.29 -0.98 -1.00 0.00 0.00 179.01 178.00 1aw5 s ARG 34 N -4.83 0.75 0.09 2.33 1.70 -1.26 -5.12 118.95 112.61 1aw5 s ARG 34 Ca -0.05 0.62 0.03 0.00 -0.47 0.00 0.00 55.73 55.87 1aw5 s ARG 34 Cb 0.17 0.36 -0.04 0.00 -0.57 0.00 0.00 34.95 34.87 1aw5 s ARG 34 CO 0.62 -0.14 0.07 -0.65 -1.08 0.00 0.00 175.30 174.12 1aw5 s GLN 35 N -0.17 2.83 -0.25 3.89 -0.21 -1.26 -4.82 119.66 119.67 1aw5 s GLN 35 Ca -0.01 -0.73 -0.29 0.00 0.02 0.00 0.00 55.36 54.35 1aw5 s GLN 35 Cb -0.03 -2.69 -0.02 0.00 1.00 0.00 0.00 33.01 31.26 1aw5 s GLN 35 CO 0.01 0.56 1.64 -1.17 -2.12 0.00 0.00 175.29 174.21 1aw5 s LEU 36 N -2.43 3.81 0.40 2.90 2.96 -1.26 -5.03 118.68 120.02 1aw5 s LEU 36 Ca 0.29 1.53 0.08 0.00 -0.22 0.00 0.00 54.13 55.81 1aw5 s LEU 36 Cb -0.12 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 1aw5 s LEU 36 CO 0.22 -1.35 0.31 0.42 -1.32 0.00 0.00 176.35 174.63 1aw5 s THR 37 N 5.52 2.74 -0.03 3.68 -4.23 -1.26 -5.04 115.64 117.03 1aw5 s THR 37 Ca 0.73 -1.44 0.13 0.00 -1.18 0.00 0.00 61.69 59.93 1aw5 s THR 37 Cb -0.24 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 70.58 1aw5 s THR 37 CO 0.30 -0.04 1.44 0.11 -0.54 0.00 0.00 174.62 175.90 1aw5 h LYS 38 N 1.18 0.00 -2.99 3.99 1.57 -1.95 -3.38 116.57 114.98 1aw5 h LYS 38 Ca -0.42 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 57.74 1aw5 h LYS 38 Cb 1.26 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.59 1aw5 h LYS 38 CO 0.60 0.62 3.55 0.27 -0.57 0.00 0.00 179.45 183.92 1aw5 n ASN 39 N -3.31 8.28 -0.35 0.86 2.04 -1.26 -4.64 115.26 116.88 1aw5 n ASN 39 Ca 0.01 -2.54 0.00 0.00 -0.44 0.00 0.00 54.58 51.61 1aw5 n ASN 39 Cb 0.76 -1.51 0.00 0.00 -2.53 0.00 0.00 39.78 36.49 1aw5 n ASN 39 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 1aw5 n LEU 41 N 3.58 0.00 -3.93 -4.53 4.77 -1.26 -4.96 117.00 110.67 1aw5 n LEU 41 Ca 0.74 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 56.44 1aw5 n LEU 41 Cb 0.25 -0.52 -0.17 0.00 -2.33 0.00 0.00 43.42 40.66 1aw5 n LEU 41 CO 0.81 0.00 -0.45 -0.63 -1.33 0.00 0.00 177.39 175.79 1aw5 s ILE 42 N -1.15 1.19 -0.22 -0.08 1.01 0.16 -4.28 121.20 117.82 1aw5 s ILE 42 Ca 0.00 -0.46 -0.19 0.00 0.00 0.00 0.00 60.65 60.01 1aw5 s ILE 42 Cb 0.00 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 1aw5 s ILE 42 CO 0.00 0.34 0.55 0.12 0.00 0.00 0.00 174.94 175.95 1aw5 s PHE 43 N 1.63 3.33 0.29 3.97 5.36 -1.01 -2.09 117.98 129.46 1aw5 s PHE 43 Ca 0.04 0.77 -0.29 0.00 -0.96 0.00 0.00 56.93 56.48 1aw5 s PHE 43 Cb -0.13 -2.73 -0.10 0.00 -0.34 0.00 0.00 43.02 39.72 1aw5 s PHE 43 CO -0.09 -0.20 1.16 -2.14 -1.46 0.00 0.00 175.22 172.49 1aw5 s PRO 44 N 1.99 4.56 -0.08 10.12 0.02 -1.26 -1.26 135.00 149.09 1aw5 s PRO 44 Ca 0.24 1.92 0.02 0.00 0.02 0.00 0.00 61.00 63.20 1aw5 s PRO 44 Cb -0.16 -3.16 0.01 0.00 0.02 0.00 0.00 34.50 31.22 1aw5 s PRO 44 CO 0.09 0.10 -0.13 -0.51 -0.33 0.00 0.00 177.00 176.22 1aw5 s LEU 45 N -1.53 1.65 -0.45 -5.54 1.43 0.57 -4.86 118.68 109.96 1aw5 s LEU 45 Ca 0.46 -0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 53.10 1aw5 s LEU 45 Cb -0.34 -0.92 0.09 0.00 0.03 0.00 0.00 46.19 45.05 1aw5 s LEU 45 CO 0.44 0.03 0.33 -0.36 0.23 0.00 0.00 176.35 177.02 1aw5 s PHE 46 N 0.79 3.33 -0.22 0.29 0.40 -1.26 -0.57 117.98 120.75 1aw5 s PHE 46 Ca -0.12 -1.46 -0.15 0.00 -0.60 0.00 0.00 56.93 54.60 1aw5 s PHE 46 Cb -0.16 -3.20 -0.04 0.00 0.51 0.00 0.00 43.02 40.13 1aw5 s PHE 46 CO 0.02 -0.89 0.38 0.42 0.70 0.00 0.00 175.22 175.85 1aw5 s ILE 47 N 1.47 5.20 0.34 0.64 1.01 -0.08 -1.62 121.20 128.17 1aw5 s ILE 47 Ca 0.04 0.65 -0.10 0.00 0.00 0.00 0.00 60.65 61.23 1aw5 s ILE 47 Cb -0.25 -3.71 -0.07 0.00 0.01 0.00 0.00 42.46 38.45 1aw5 s ILE 47 CO 0.02 0.24 0.69 -0.55 0.00 0.00 0.00 174.94 175.34 1aw5 s SER 48 N 1.15 6.58 0.18 3.58 0.15 0.12 0.34 113.70 125.81 1aw5 s SER 48 Ca 0.18 1.06 -0.13 0.00 0.70 0.00 0.00 55.95 57.76 1aw5 s SER 48 Cb -0.15 -2.29 0.08 0.00 -1.71 0.00 0.00 66.02 61.96 1aw5 s SER 48 CO 0.08 -0.27 1.80 -0.78 1.20 0.00 0.00 173.24 175.27 1aw5 h ASP 49 N 1.76 0.73 -2.40 5.45 1.82 -1.83 -3.39 116.42 118.56 1aw5 h ASP 49 Ca -0.47 -0.08 -0.53 0.00 -0.39 0.00 0.00 57.03 55.56 1aw5 h ASP 49 Cb 1.18 -0.19 -0.05 0.00 0.68 0.00 0.00 39.33 40.96 1aw5 h ASP 49 CO 0.65 0.60 1.21 0.21 -1.61 0.00 0.00 179.24 180.30 1aw5 s ASN 50 N -5.87 5.78 0.26 2.28 2.47 -1.26 -4.87 114.94 113.72 1aw5 s ASN 50 Ca -0.13 0.26 0.08 0.00 0.42 0.00 0.00 52.86 53.49 1aw5 s ASN 50 Cb 0.13 -2.54 0.45 0.00 -1.45 0.00 0.00 41.25 37.84 1aw5 s ASN 50 CO 0.77 -1.99 1.09 -2.65 -3.72 0.00 0.00 177.10 170.60 1aw5 n PRO 51 N 8.97 0.06 0.00 0.43 -0.02 -1.26 -0.21 135.00 142.97 1aw5 n PRO 51 Ca 0.15 0.48 0.05 0.00 -2.02 0.00 0.00 63.50 62.16 1aw5 n PRO 51 Cb 0.50 -2.05 -0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1aw5 n PRO 51 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1aw5 n ASP 52 N -1.83 1.29 -4.15 2.55 8.00 -1.26 -0.19 116.55 120.96 1aw5 n ASP 52 Ca -0.01 -1.14 -0.35 0.00 0.71 0.00 0.00 54.79 54.00 1aw5 n ASP 52 Cb 0.37 0.47 0.08 0.00 -0.02 0.00 0.00 41.12 42.02 1aw5 n ASP 52 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1aw5 n ASP 53 N -0.23 -3.72 0.00 -2.24 -0.08 0.70 -4.73 116.55 106.26 1aw5 n ASP 53 Ca 0.05 0.11 0.00 0.00 -1.51 0.00 0.00 54.79 53.44 1aw5 n ASP 53 Cb 0.23 -0.83 0.00 0.00 2.34 0.00 0.00 41.12 42.86 1aw5 n ASP 53 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1aw5 n PHE 54 N -3.35 0.00 -3.63 -0.67 -0.00 -0.65 -2.59 117.46 106.58 1aw5 n PHE 54 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.45 57.08 1aw5 n PHE 54 Cb 0.62 0.00 -0.10 0.00 -0.00 0.00 0.00 39.48 39.99 1aw5 n PHE 54 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1aw5 s THR 55 N 0.00 5.34 0.08 -2.13 2.01 -0.85 -4.90 115.64 115.19 1aw5 s THR 55 Ca 0.00 0.18 -0.31 0.00 0.31 0.00 0.00 61.69 61.88 1aw5 s THR 55 Cb 0.00 -3.52 -0.09 0.00 0.01 0.00 0.00 72.50 68.90 1aw5 s THR 55 CO 0.00 0.30 1.74 -1.61 -0.69 0.00 0.00 174.62 174.36 1aw5 s GLU 56 N 1.37 4.17 0.78 4.92 2.02 -1.26 -1.30 118.70 129.40 1aw5 s GLU 56 Ca 0.07 2.44 -0.02 0.00 0.02 0.00 0.00 54.97 57.49 1aw5 s GLU 56 Cb -0.15 -3.66 0.16 0.00 0.10 0.00 0.00 34.13 30.59 1aw5 s GLU 56 CO 0.07 -0.80 1.07 -0.89 0.02 0.00 0.00 175.26 174.74 1aw5 n ILE 57 N 4.83 0.00 -3.66 -1.63 5.41 -0.91 -4.95 119.36 118.45 1aw5 n ILE 57 Ca 0.17 -1.54 -0.14 0.00 1.00 0.00 0.00 62.75 62.23 1aw5 n ILE 57 Cb 0.40 -0.96 -0.08 0.00 -0.71 0.00 0.00 39.64 38.29 1aw5 n ILE 57 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1aw5 s ASP 58 N -5.29 -0.60 0.08 4.38 2.15 -1.26 -4.81 116.67 111.33 1aw5 s ASP 58 Ca 0.69 1.05 0.00 0.00 0.43 0.00 0.00 52.55 54.72 1aw5 s ASP 58 Cb -0.04 1.05 0.00 0.00 -0.30 0.00 0.00 42.92 43.63 1aw5 s ASP 58 CO 0.46 -0.28 0.00 -0.24 -0.17 0.00 0.00 175.17 174.94 1aw5 n SER 59 N 2.37 -0.74 0.00 -0.34 2.88 -1.26 -4.94 113.62 111.60 1aw5 n SER 59 Ca -0.15 0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 1aw5 n SER 59 Cb 0.56 1.00 0.00 0.00 -0.75 0.00 0.00 64.21 65.02 1aw5 n SER 59 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aw5 n ALA 60 N -2.49 0.00 -0.57 -1.46 0.00 -1.26 -5.02 120.51 109.72 1aw5 n ALA 60 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1aw5 n ALA 60 Cb 0.00 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.71 1aw5 n ALA 60 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1aw5 s PRO 61 N 0.00 -1.72 0.00 0.00 0.04 -1.26 -4.86 135.00 127.19 1aw5 s PRO 61 Ca 0.00 0.44 0.00 0.00 0.04 0.00 0.00 61.00 61.48 1aw5 s PRO 61 Cb 0.00 -1.49 0.00 0.00 0.04 0.00 0.00 34.50 33.05 1aw5 s PRO 61 CO 0.00 -4.15 0.89 0.09 0.04 0.00 0.00 177.00 173.87 1aw5 n ASN 62 N -5.16 0.00 -4.90 6.66 3.02 -1.26 -4.97 115.26 108.64 1aw5 n ASN 62 Ca 0.07 -1.79 -0.33 0.00 -0.03 0.00 0.00 54.58 52.50 1aw5 n ASN 62 Cb 0.57 -0.16 -0.05 0.00 -0.61 0.00 0.00 39.78 39.54 1aw5 n ASN 62 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1aw5 s ILE 63 N 0.00 5.31 0.40 2.41 -4.36 -1.26 -5.05 121.20 118.66 1aw5 s ILE 63 Ca 0.00 -0.07 0.03 0.00 -0.26 0.00 0.00 60.65 60.35 1aw5 s ILE 63 Cb 0.00 -3.60 -0.03 0.00 1.25 0.00 0.00 42.46 40.08 1aw5 s ILE 63 CO 0.00 0.21 0.09 0.20 0.24 0.00 0.00 174.94 175.69 1aw5 s ASN 64 N -2.15 2.91 -0.68 4.36 0.01 -1.26 -2.14 114.94 115.98 1aw5 s ASN 64 Ca 0.33 -1.60 -0.05 0.00 -0.71 0.00 0.00 52.86 50.83 1aw5 s ASN 64 Cb -0.13 0.36 0.18 0.00 0.41 0.00 0.00 41.25 42.07 1aw5 s ASN 64 CO 0.22 -0.84 0.52 -0.60 -1.51 0.00 0.00 177.10 174.89 1aw5 s ARG 65 N -3.78 2.81 0.44 -0.60 3.52 -0.42 -4.13 118.95 116.79 1aw5 s ARG 65 Ca 0.24 -2.55 0.03 0.00 -0.13 0.00 0.00 55.73 53.32 1aw5 s ARG 65 Cb 0.04 -3.89 0.00 0.00 -1.56 0.00 0.00 34.95 29.55 1aw5 s ARG 65 CO 0.13 -1.20 0.64 0.42 -0.81 0.00 0.00 175.30 174.48 1aw5 s ILE 66 N -0.07 3.68 0.26 4.11 1.01 -0.64 -1.63 121.20 127.91 1aw5 s ILE 66 Ca 0.18 -0.68 0.09 0.00 0.00 0.00 0.00 60.65 60.23 1aw5 s ILE 66 Cb -0.18 -3.33 -0.05 0.00 0.01 0.00 0.00 42.46 38.91 1aw5 s ILE 66 CO -0.05 -0.20 -0.15 -0.83 0.00 0.00 0.00 174.94 173.72 1aw5 s GLY 67 N -4.26 1.73 0.60 6.18 0.00 -1.07 0.15 107.32 110.66 1aw5 s GLY 67 Ca 0.50 -1.82 0.28 0.00 0.00 0.00 0.00 44.72 43.67 1aw5 s GLY 67 CO 0.36 -1.87 1.58 -2.08 0.00 0.00 0.00 173.10 171.09 1aw5 h VAL 68 N 2.36 0.15 0.00 1.40 2.07 -1.82 0.16 116.25 120.58 1aw5 h VAL 68 Ca -0.39 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1aw5 h VAL 68 Cb 1.24 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1aw5 h VAL 68 CO 0.63 0.00 -0.24 0.59 0.02 0.00 0.00 177.57 178.56 1aw5 n ASN 69 N -3.43 0.53 -0.00 0.57 3.02 0.73 -3.87 115.26 112.81 1aw5 n ASN 69 Ca 0.16 0.31 0.04 0.00 -0.03 0.00 0.00 54.58 55.05 1aw5 n ASN 69 Cb 1.11 -0.30 -0.04 0.00 -0.61 0.00 0.00 39.78 39.94 1aw5 n ASN 69 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1aw5 n ARG 70 N -1.91 3.97 -0.04 3.52 5.12 0.52 -4.68 116.66 123.15 1aw5 n ARG 70 Ca 0.05 -0.01 0.16 0.00 -1.93 0.00 0.00 57.85 56.13 1aw5 n ARG 70 Cb 0.39 -0.90 0.60 0.00 -1.16 0.00 0.00 32.46 31.40 1aw5 n ARG 70 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1aw5 h LEU 71 N 0.00 0.18 -0.12 0.55 5.85 -1.55 -2.61 115.31 117.61 1aw5 h LEU 71 Ca 0.00 0.01 -0.21 0.00 0.84 0.00 0.00 57.88 58.52 1aw5 h LEU 71 Cb 0.20 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1aw5 h LEU 71 CO 0.00 0.10 -0.97 0.50 -0.34 0.00 0.00 178.44 177.73 1aw5 h LYS 72 N 0.19 0.06 0.00 1.25 3.64 -1.83 -2.74 116.57 117.14 1aw5 h LYS 72 Ca 0.27 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 1aw5 h LYS 72 Cb 0.81 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.65 1aw5 h LYS 72 CO -0.05 0.97 -0.34 -0.44 -2.27 0.00 0.00 179.45 177.33 1aw5 h ASP 73 N 0.02 0.00 0.42 4.20 3.32 -1.80 -3.06 116.42 119.52 1aw5 h ASP 73 Ca -0.03 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.71 1aw5 h ASP 73 Cb 1.68 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.22 1aw5 h ASP 73 CO 0.13 0.15 -1.56 0.22 -1.72 0.00 0.00 179.24 176.47 1aw5 h TYR 74 N 0.00 0.48 0.00 4.55 3.20 -1.57 -3.37 116.97 120.26 1aw5 h TYR 74 Ca -0.01 -0.35 0.00 0.00 3.14 0.00 0.00 58.73 61.51 1aw5 h TYR 74 Cb 1.12 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.37 1aw5 h TYR 74 CO 0.00 1.41 -0.81 1.28 -1.64 0.00 0.00 178.16 178.40 1aw5 n LEU 75 N -3.47 0.67 0.35 2.82 4.77 -1.03 -4.20 117.00 116.92 1aw5 n LEU 75 Ca -0.17 0.15 -0.16 0.00 -0.03 0.00 0.00 56.01 55.79 1aw5 n LEU 75 Cb 1.05 -0.14 -0.08 0.00 -2.33 0.00 0.00 43.42 41.92 1aw5 n LEU 75 CO 0.51 -0.03 0.49 0.50 -1.33 0.00 0.00 177.39 177.52 1aw5 h LYS 76 N 0.00 -0.88 -0.58 3.23 3.64 -1.69 0.35 116.57 120.65 1aw5 h LYS 76 Ca 0.00 0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.49 1aw5 h LYS 76 Cb 0.76 0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.75 1aw5 h LYS 76 CO 0.00 -0.55 0.38 -1.00 -2.27 0.00 0.00 179.45 176.01 1aw5 h PRO 77 N -1.11 0.58 0.21 1.90 0.13 -1.77 -0.60 132.00 131.34 1aw5 h PRO 77 Ca -0.09 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 64.99 1aw5 h PRO 77 Cb 0.73 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.73 1aw5 h PRO 77 CO 0.15 0.39 -0.10 -0.07 -0.23 0.00 0.00 178.00 178.14 1aw5 h LEU 78 N 0.60 -0.24 -0.87 1.56 3.38 -1.70 -1.91 115.31 116.13 1aw5 h LEU 78 Ca 0.24 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1aw5 h LEU 78 Cb 0.20 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1aw5 h LEU 78 CO -0.07 0.09 0.55 0.58 0.09 0.00 0.00 178.44 179.68 1aw5 h VAL 79 N -0.59 1.23 -0.31 1.22 2.07 0.09 -1.88 116.25 118.08 1aw5 h VAL 79 Ca -0.03 -0.48 -0.06 0.00 0.82 0.00 0.00 66.70 66.95 1aw5 h VAL 79 Cb 0.43 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 1aw5 h VAL 79 CO 0.05 0.24 -0.07 0.00 0.02 0.00 0.00 177.57 177.80 1aw5 h ALA 80 N 1.30 1.29 0.00 1.67 0.00 -1.13 -1.67 119.26 120.72 1aw5 h ALA 80 Ca 0.32 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1aw5 h ALA 80 Cb -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1aw5 h ALA 80 CO -0.06 0.47 0.00 1.63 0.00 0.00 0.00 179.25 181.29 1aw5 n LYS 81 N -4.23 0.68 0.00 0.00 5.02 -0.72 -4.88 118.16 114.02 1aw5 n LYS 81 Ca 0.01 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1aw5 n LYS 81 Cb 0.29 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 1aw5 n LYS 81 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1aw5 n GLY 82 N 0.52 0.85 3.74 0.72 0.00 -0.63 -4.89 105.19 105.50 1aw5 n GLY 82 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1aw5 n GLY 82 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1aw5 s LEU 83 N 0.00 4.35 0.00 0.99 2.96 -0.83 -4.62 118.68 121.53 1aw5 s LEU 83 Ca 0.00 2.91 0.00 0.00 -0.22 0.00 0.00 54.13 56.82 1aw5 s LEU 83 Cb 0.00 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 43.07 1aw5 s LEU 83 CO 0.00 -0.93 0.16 0.54 -1.32 0.00 0.00 176.35 174.80 1aw5 n ARG 84 N 2.78 3.64 -3.67 1.98 5.12 -1.26 -4.60 116.66 120.64 1aw5 n ARG 84 Ca 0.11 -0.16 -0.13 0.00 -1.93 0.00 0.00 57.85 55.74 1aw5 n ARG 84 Cb 0.37 -0.62 -0.07 0.00 -1.16 0.00 0.00 32.46 30.99 1aw5 n ARG 84 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1aw5 s SER 85 N -0.56 -0.28 0.01 0.55 0.15 -1.26 -1.08 113.70 111.22 1aw5 s SER 85 Ca 0.00 0.03 -0.06 0.00 0.70 0.00 0.00 55.95 56.62 1aw5 s SER 85 Cb 0.00 0.41 -0.00 0.00 -1.71 0.00 0.00 66.02 64.72 1aw5 s SER 85 CO 0.00 -0.63 0.11 0.68 1.20 0.00 0.00 173.24 174.60 1aw5 s VAL 86 N -2.28 0.09 -0.16 4.45 -7.23 -0.98 -2.42 120.40 111.88 1aw5 s VAL 86 Ca -0.06 -0.78 0.01 0.00 -1.81 0.00 0.00 61.98 59.34 1aw5 s VAL 86 Cb -0.01 -0.49 0.01 0.00 0.56 0.00 0.00 36.38 36.45 1aw5 s VAL 86 CO -0.01 -0.43 -0.19 -0.51 -0.31 0.00 0.00 175.10 173.65 1aw5 s ILE 87 N -1.60 2.23 -0.08 -0.62 2.07 -0.39 -1.24 121.20 121.57 1aw5 s ILE 87 Ca -0.13 -0.91 -0.27 0.00 -1.41 0.00 0.00 60.65 57.93 1aw5 s ILE 87 Cb -0.07 -1.92 -0.02 0.00 0.13 0.00 0.00 42.46 40.58 1aw5 s ILE 87 CO 0.00 0.53 0.89 -0.76 -1.91 0.00 0.00 174.94 173.70 1aw5 s LEU 88 N 1.02 4.28 -0.25 8.50 1.43 -0.21 -0.31 118.68 133.14 1aw5 s LEU 88 Ca -0.02 1.41 0.02 0.00 -1.03 0.00 0.00 54.13 54.51 1aw5 s LEU 88 Cb -0.15 -3.38 0.06 0.00 0.03 0.00 0.00 46.19 42.75 1aw5 s LEU 88 CO -0.06 -0.31 -0.08 -0.36 0.23 0.00 0.00 176.35 175.77 1aw5 s PHE 89 N 1.50 2.84 0.15 0.29 0.08 0.27 -2.05 117.98 121.06 1aw5 s PHE 89 Ca 0.45 -2.05 -0.26 0.00 0.12 0.00 0.00 56.93 55.19 1aw5 s PHE 89 Cb -0.19 -1.76 -0.08 0.00 -0.57 0.00 0.00 43.02 40.43 1aw5 s PHE 89 CO 0.20 -0.83 0.79 0.20 -0.10 0.00 0.00 175.22 175.48 1aw5 s GLY 90 N 1.24 2.92 -0.63 4.36 0.00 -1.26 -0.90 107.32 113.05 1aw5 s GLY 90 Ca -0.07 0.37 0.05 0.00 0.00 0.00 0.00 44.72 45.07 1aw5 s GLY 90 CO -0.06 0.93 0.45 0.14 0.00 0.00 0.00 173.10 174.57 1aw5 s VAL 91 N -0.98 2.32 -0.27 1.40 1.01 0.15 -4.89 120.40 119.15 1aw5 s VAL 91 Ca 0.37 -3.86 -0.29 0.00 0.00 0.00 0.00 61.98 58.20 1aw5 s VAL 91 Cb -0.23 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 1aw5 s VAL 91 CO 0.26 -1.04 1.76 -2.16 0.00 0.00 0.00 175.10 173.93 1aw5 s PRO 92 N -1.05 3.52 -0.22 2.72 0.04 -1.26 -2.74 135.00 136.00 1aw5 s PRO 92 Ca 0.26 1.59 0.12 0.00 0.04 0.00 0.00 61.00 63.01 1aw5 s PRO 92 Cb -0.04 -4.15 -0.22 0.00 0.04 0.00 0.00 34.50 30.13 1aw5 s PRO 92 CO -0.16 -1.64 -0.03 1.28 0.04 0.00 0.00 177.00 176.49 1aw5 n LEU 93 N 9.61 1.03 -4.67 -3.56 4.77 -1.26 -4.94 117.00 117.98 1aw5 n LEU 93 Ca 0.22 -0.05 -0.58 0.00 -0.03 0.00 0.00 56.01 55.57 1aw5 n LEU 93 Cb 0.46 0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.49 1aw5 n LEU 93 CO 0.67 0.65 1.15 -0.38 -1.33 0.00 0.00 177.39 178.15 1aw5 n ILE 94 N -2.93 0.17 0.00 -0.08 5.41 -1.26 -4.77 119.36 115.90 1aw5 n ILE 94 Ca -0.37 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.34 1aw5 n ILE 94 Cb 1.10 -0.94 0.00 0.00 -0.71 0.00 0.00 39.64 39.09 1aw5 n ILE 94 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1aw5 n PRO 95 N 4.24 0.00 -2.70 0.38 -0.01 -1.26 -2.94 135.00 132.71 1aw5 n PRO 95 Ca 0.25 0.00 -0.06 0.00 -0.01 0.00 0.00 63.50 63.68 1aw5 n PRO 95 Cb 0.11 -1.70 0.08 0.00 -0.01 0.00 0.00 33.50 31.98 1aw5 n PRO 95 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1aw5 n GLY 96 N -0.77 1.57 0.24 -1.23 0.00 -1.26 -4.94 105.19 98.80 1aw5 n GLY 96 Ca 0.00 -0.69 -0.16 0.00 0.00 0.00 0.00 46.02 45.17 1aw5 n GLY 96 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1aw5 n THR 97 N -0.55 1.03 -1.96 2.61 -2.24 -1.15 -5.02 114.28 106.99 1aw5 n THR 97 Ca 0.01 -0.33 -0.41 0.00 -2.27 0.00 0.00 64.05 61.05 1aw5 n THR 97 Cb 0.84 -1.43 -0.01 0.00 -2.10 0.00 0.00 70.33 67.63 1aw5 n THR 97 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1aw5 s LYS 98 N -2.35 4.17 0.25 -0.78 1.02 -1.26 -4.46 119.74 116.33 1aw5 s LYS 98 Ca -0.25 2.37 -0.03 0.00 0.02 0.00 0.00 55.97 58.07 1aw5 s LYS 98 Cb 0.08 -2.97 0.01 0.00 -0.52 0.00 0.00 37.83 34.44 1aw5 s LYS 98 CO 0.37 -0.40 0.39 -0.40 -0.92 0.00 0.00 175.35 174.39 1aw5 n ASP 99 N 0.52 -1.10 0.25 2.83 5.68 -0.92 -4.50 116.55 119.32 1aw5 n ASP 99 Ca 0.01 -2.27 0.14 0.00 -0.50 0.00 0.00 54.79 52.17 1aw5 n ASP 99 Cb 0.41 1.98 0.60 0.00 -1.14 0.00 0.00 41.12 42.97 1aw5 n ASP 99 CO 0.00 0.00 0.00 1.55 -1.33 0.00 0.00 177.20 177.42 1aw5 h PRO 100 N 0.00 0.00 -0.41 0.11 0.13 -1.93 -0.25 132.00 129.66 1aw5 h PRO 100 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 1aw5 h PRO 100 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1aw5 h PRO 100 CO 0.27 0.11 0.00 1.33 -0.23 0.00 0.00 178.00 179.47 1aw5 n VAL 101 N -3.27 1.48 -3.11 1.56 0.24 -1.26 -4.63 118.33 109.34 1aw5 n VAL 101 Ca 0.00 -1.26 -0.21 0.00 -2.04 0.00 0.00 64.34 60.84 1aw5 n VAL 101 Cb 0.35 0.24 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 1aw5 n VAL 101 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1aw5 n GLY 102 N 0.44 -0.50 0.29 7.63 0.00 -1.14 -4.82 105.19 107.10 1aw5 n GLY 102 Ca 0.17 0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.34 1aw5 n GLY 102 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1aw5 h THR 103 N -0.86 0.26 0.00 2.61 2.02 -1.85 0.33 112.91 115.43 1aw5 h THR 103 Ca -0.42 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1aw5 h THR 103 Cb 1.29 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1aw5 h THR 103 CO 0.50 0.02 0.00 0.00 0.37 0.00 0.00 175.52 176.41 1aw5 n ALA 104 N -3.01 1.46 -0.07 6.16 0.00 -1.26 -3.75 120.51 120.05 1aw5 n ALA 104 Ca 0.16 -0.03 -0.08 0.00 0.00 0.00 0.00 53.44 53.48 1aw5 n ALA 104 Cb 0.53 -1.12 -0.02 0.00 0.00 0.00 0.00 19.45 18.85 1aw5 n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aw5 h ALA 105 N 2.31 -0.19 -0.58 0.00 0.00 -0.67 -2.34 119.26 117.78 1aw5 h ALA 105 Ca 0.00 0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 1aw5 h ALA 105 Cb 0.08 0.60 -0.10 0.00 0.00 0.00 0.00 17.79 18.37 1aw5 h ALA 105 CO 0.00 -0.71 0.17 -0.40 0.00 0.00 0.00 179.25 178.31 1aw5 n ASP 106 N -5.40 4.23 -4.54 0.00 5.68 -1.25 -4.92 116.55 110.36 1aw5 n ASP 106 Ca -0.00 -3.28 -0.45 0.00 -0.50 0.00 0.00 54.79 50.55 1aw5 n ASP 106 Cb 0.32 -0.69 -0.05 0.00 -1.14 0.00 0.00 41.12 39.56 1aw5 n ASP 106 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1aw5 n ASP 107 N -0.42 2.68 0.20 -1.12 2.03 -0.88 -4.77 116.55 114.27 1aw5 n ASP 107 Ca 0.36 0.19 0.06 0.00 0.52 0.00 0.00 54.79 55.91 1aw5 n ASP 107 Cb 1.24 -1.44 0.30 0.00 -0.72 0.00 0.00 41.12 40.49 1aw5 n ASP 107 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1aw5 h PRO 108 N 14.63 0.00 -0.07 -0.67 0.11 -1.94 0.76 132.00 144.81 1aw5 h PRO 108 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1aw5 h PRO 108 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1aw5 h PRO 108 CO 1.01 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.80 1aw5 n ALA 109 N -1.52 2.35 -1.93 -0.75 0.00 -1.26 -4.55 120.51 112.85 1aw5 n ALA 109 Ca -0.01 -2.16 -0.28 0.00 0.00 0.00 0.00 53.44 50.99 1aw5 n ALA 109 Cb 0.50 -0.38 0.11 0.00 0.00 0.00 0.00 19.45 19.69 1aw5 n ALA 109 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1aw5 s GLY 110 N -2.21 1.69 0.15 0.00 0.00 0.26 -4.90 107.32 102.30 1aw5 s GLY 110 Ca 0.27 -0.98 -0.18 0.00 0.00 0.00 0.00 44.72 43.84 1aw5 s GLY 110 CO 0.04 -0.42 1.71 -2.55 0.00 0.00 0.00 173.10 171.88 1aw5 h PRO 111 N -1.05 0.08 0.88 2.90 0.11 -1.85 -2.48 132.00 130.59 1aw5 h PRO 111 Ca -0.44 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 1aw5 h PRO 111 Cb 1.29 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 32.39 1aw5 h PRO 111 CO 0.54 0.05 -0.42 0.28 -0.21 0.00 0.00 178.00 178.24 1aw5 h VAL 112 N 0.08 0.03 0.00 3.15 2.07 -1.90 0.76 116.25 120.45 1aw5 h VAL 112 Ca 0.14 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1aw5 h VAL 112 Cb 0.19 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.99 1aw5 h VAL 112 CO -0.24 0.00 0.00 0.40 0.02 0.00 0.00 177.57 177.75 1aw5 h ILE 113 N -1.29 0.00 0.00 4.57 2.04 -1.81 -0.38 117.51 120.64 1aw5 h ILE 113 Ca -0.12 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1aw5 h ILE 113 Cb 0.91 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.15 1aw5 h ILE 113 CO 0.20 0.00 -1.14 0.00 0.00 0.00 0.00 178.15 177.21 1aw5 n GLN 114 N -2.97 0.56 0.08 2.37 1.13 -0.94 -2.83 117.38 114.80 1aw5 n GLN 114 Ca -0.01 0.06 -0.10 0.00 -1.94 0.00 0.00 57.00 55.01 1aw5 n GLN 114 Cb 0.17 -1.75 -0.09 0.00 0.11 0.00 0.00 30.24 28.68 1aw5 n GLN 114 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1aw5 h GLY 115 N 4.09 0.14 0.79 1.08 0.00 0.60 -2.63 103.07 107.14 1aw5 h GLY 115 Ca 0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 46.89 1aw5 h GLY 115 CO 0.00 0.29 -0.37 -2.22 0.00 0.00 0.00 176.54 174.23 1aw5 h ILE 116 N 0.05 1.38 -0.25 2.60 2.04 -1.21 -2.28 117.51 119.85 1aw5 h ILE 116 Ca -0.05 -1.71 -0.10 0.00 1.00 0.00 0.00 64.86 64.00 1aw5 h ILE 116 Cb 1.75 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 39.99 1aw5 h ILE 116 CO 0.15 0.50 -0.27 0.03 0.00 0.00 0.00 178.15 178.57 1aw5 h ARG 117 N 0.02 0.48 0.01 2.37 3.08 -1.59 -1.85 114.38 116.91 1aw5 h ARG 117 Ca -0.02 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 1aw5 h ARG 117 Cb 1.00 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.03 1aw5 h ARG 117 CO 0.08 0.71 -0.01 0.35 -1.07 0.00 0.00 179.97 180.04 1aw5 h PHE 118 N 0.43 -0.02 0.09 3.04 3.04 -1.51 -3.24 116.94 118.78 1aw5 h PHE 118 Ca 0.06 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.01 1aw5 h PHE 118 Cb 0.69 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.20 1aw5 h PHE 118 CO 0.02 0.55 -0.10 0.82 -2.02 0.00 0.00 178.31 177.59 1aw5 h ILE 119 N -0.60 0.78 0.00 1.41 2.04 -1.38 -1.49 117.51 118.27 1aw5 h ILE 119 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1aw5 h ILE 119 Cb 0.58 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1aw5 h ILE 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 178.15 178.69 1aw5 n ARG 120 N -5.21 0.04 -0.05 2.37 5.12 -0.70 -0.18 116.66 118.04 1aw5 n ARG 120 Ca -0.07 0.20 -0.06 0.00 -1.93 0.00 0.00 57.85 55.99 1aw5 n ARG 120 Cb 0.14 -1.50 -0.07 0.00 -1.16 0.00 0.00 32.46 29.87 1aw5 n ARG 120 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1aw5 n GLU 121 N -1.22 1.73 -0.00 5.56 2.13 -0.65 -4.39 120.64 123.80 1aw5 n GLU 121 Ca 0.01 0.02 0.11 0.00 0.66 0.00 0.00 57.16 57.96 1aw5 n GLU 121 Cb 0.01 -1.24 -0.15 0.00 0.27 0.00 0.00 31.44 30.33 1aw5 n GLU 121 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1aw5 n LYS 122 N -2.52 0.61 -3.08 5.31 4.01 -0.67 -4.68 118.16 117.14 1aw5 n LYS 122 Ca -0.18 -0.16 -0.16 0.00 -0.51 0.00 0.00 58.31 57.30 1aw5 n LYS 122 Cb 0.78 -1.54 -0.01 0.00 -0.51 0.00 0.00 35.03 33.75 1aw5 n LYS 122 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 1aw5 n PHE 123 N -2.25 -0.64 0.41 2.13 3.72 0.74 -4.97 117.46 116.61 1aw5 n PHE 123 Ca -0.03 -3.37 0.00 0.00 -0.05 0.00 0.00 57.45 54.00 1aw5 n PHE 123 Cb 0.55 0.10 0.00 0.00 -0.94 0.00 0.00 39.48 39.19 1aw5 n PHE 123 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1aw5 n PRO 124 N 0.44 0.21 -0.05 -1.08 -0.04 -1.23 -1.54 135.00 131.71 1aw5 n PRO 124 Ca 0.20 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.60 1aw5 n PRO 124 Cb 0.66 -1.00 -0.14 0.00 -0.04 0.00 0.00 33.50 32.97 1aw5 n PRO 124 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1aw5 n GLU 125 N -0.49 0.66 -2.32 0.54 1.02 -1.26 -4.95 120.64 113.85 1aw5 n GLU 125 Ca 0.00 0.09 -0.41 0.00 -0.02 0.00 0.00 57.16 56.82 1aw5 n GLU 125 Cb 0.00 -1.64 -0.03 0.00 -0.02 0.00 0.00 31.44 29.75 1aw5 n GLU 125 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1aw5 s LEU 126 N -5.59 4.45 -0.30 -4.62 1.43 -0.59 -4.94 118.68 108.52 1aw5 s LEU 126 Ca -0.07 2.34 -0.19 0.00 -1.03 0.00 0.00 54.13 55.17 1aw5 s LEU 126 Cb 0.08 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.67 1aw5 s LEU 126 CO 0.83 -0.40 0.56 -0.47 0.23 0.00 0.00 176.35 177.11 1aw5 s TYR 127 N -0.28 3.22 -0.28 0.29 5.04 -0.24 -4.97 117.35 120.13 1aw5 s TYR 127 Ca 0.52 0.50 -0.18 0.00 -2.44 0.00 0.00 57.07 55.48 1aw5 s TYR 127 Cb -0.34 -2.89 -0.02 0.00 0.35 0.00 0.00 41.96 39.06 1aw5 s TYR 127 CO 0.39 -0.43 0.51 0.42 -1.34 0.00 0.00 175.55 175.11 1aw5 s ILE 128 N 2.46 5.05 0.04 3.14 1.01 -1.26 -2.31 121.20 129.33 1aw5 s ILE 128 Ca 0.22 0.75 0.04 0.00 0.00 0.00 0.00 60.65 61.67 1aw5 s ILE 128 Cb -0.15 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 1aw5 s ILE 128 CO 0.11 0.01 -0.07 -0.63 0.00 0.00 0.00 174.94 174.37 1aw5 s ILE 129 N 2.34 3.61 -0.05 2.92 1.01 -0.37 -0.84 121.20 129.82 1aw5 s ILE 129 Ca 0.21 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.94 1aw5 s ILE 129 Cb -0.16 -2.62 0.01 0.00 0.01 0.00 0.00 42.46 39.71 1aw5 s ILE 129 CO 0.10 0.29 -0.08 0.00 0.00 0.00 0.00 174.94 175.25 1aw5 s ASP 131 N 0.63 6.93 -0.24 0.00 2.15 -0.87 0.43 116.67 125.71 1aw5 s ASP 131 Ca -0.11 2.45 0.01 0.00 0.43 0.00 0.00 52.55 55.34 1aw5 s ASP 131 Cb -0.13 -2.62 0.04 0.00 -0.30 0.00 0.00 42.92 39.90 1aw5 s ASP 131 CO 0.01 -0.46 -0.12 -0.69 -0.17 0.00 0.00 175.17 173.74 1aw5 s VAL 132 N -0.42 2.34 0.13 1.11 1.01 0.11 -4.80 120.40 119.87 1aw5 s VAL 132 Ca 0.53 -1.29 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 1aw5 s VAL 132 Cb -0.36 -2.22 0.04 0.00 0.00 0.00 0.00 36.38 33.84 1aw5 s VAL 132 CO 0.42 0.18 0.60 0.00 0.00 0.00 0.00 175.10 176.30 1aw5 n LEU 134 N 0.00 0.53 -0.18 0.00 4.77 -1.26 -4.84 117.00 116.02 1aw5 n LEU 134 Ca -0.02 -0.57 -0.01 0.00 -0.03 0.00 0.00 56.01 55.37 1aw5 n LEU 134 Cb 0.35 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.53 1aw5 n LEU 134 CO 0.14 0.13 0.97 0.00 -1.33 0.00 0.00 177.39 177.30 1aw5 n GLU 136 N -5.01 0.99 0.00 0.00 1.02 -1.26 -3.62 120.64 112.75 1aw5 n GLU 136 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 1aw5 n GLU 136 Cb 0.25 -1.30 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 1aw5 n GLU 136 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1aw5 n TYR 137 N -0.80 0.00 -3.80 -0.32 4.01 -0.57 -4.63 117.16 111.05 1aw5 n TYR 137 Ca 0.14 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.54 1aw5 n TYR 137 Cb 0.07 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.04 1aw5 n TYR 137 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1aw5 s THR 138 N -0.28 5.34 0.43 -0.72 -4.23 -0.35 -2.15 115.64 113.67 1aw5 s THR 138 Ca 0.00 0.08 0.09 0.00 -1.18 0.00 0.00 61.69 60.68 1aw5 s THR 138 Cb 0.00 -3.56 0.27 0.00 1.34 0.00 0.00 72.50 70.55 1aw5 s THR 138 CO 0.00 0.35 2.07 0.77 -0.54 0.00 0.00 174.62 177.27 1aw5 h SER 139 N 3.91 0.39 1.03 3.99 4.64 -1.27 -2.00 113.55 124.24 1aw5 h SER 139 Ca -0.50 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 60.67 1aw5 h SER 139 Cb 1.19 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 1aw5 h SER 139 CO 0.67 0.28 -0.71 1.12 -0.87 0.00 0.00 176.83 177.31 1aw5 h HIS 140 N 0.45 0.00 0.00 4.77 -0.00 -1.93 -3.48 115.15 114.96 1aw5 h HIS 140 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.50 1aw5 h HIS 140 Cb -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.39 1aw5 h HIS 140 CO -0.00 0.71 0.00 0.41 -0.00 0.00 0.00 177.93 179.05 1aw5 n GLY 141 N 0.95 0.65 3.94 6.13 0.00 -0.75 -5.06 105.19 111.05 1aw5 n GLY 141 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1aw5 n GLY 141 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1aw5 s HIS 142 N -2.11 3.23 -1.43 1.61 3.76 -1.26 -4.72 115.29 114.38 1aw5 s HIS 142 Ca 0.00 0.43 -0.09 0.00 -0.15 0.00 0.00 55.06 55.25 1aw5 s HIS 142 Cb 0.00 -2.52 0.05 0.00 1.11 0.00 0.00 32.58 31.22 1aw5 s HIS 142 CO 0.00 -0.59 2.41 0.00 -0.85 0.00 0.00 174.74 175.71 1aw5 n GLY 144 N 2.96 1.66 3.64 0.00 0.00 -1.26 -4.83 105.19 107.36 1aw5 n GLY 144 Ca 0.60 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 1aw5 n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aw5 s VAL 145 N -1.37 4.88 0.73 1.61 1.01 -1.26 -4.96 120.40 121.04 1aw5 s VAL 145 Ca 0.00 1.47 -0.11 0.00 0.00 0.00 0.00 61.98 63.34 1aw5 s VAL 145 Cb 0.00 -4.07 0.03 0.00 0.00 0.00 0.00 36.38 32.33 1aw5 s VAL 145 CO 0.00 -0.03 1.10 -0.76 0.00 0.00 0.00 175.10 175.40 1aw5 s LEU 146 N 2.64 2.83 0.41 3.92 1.02 -1.26 -0.21 118.68 128.03 1aw5 s LEU 146 Ca 0.33 1.19 0.01 0.00 0.02 0.00 0.00 54.13 55.69 1aw5 s LEU 146 Cb -0.15 -3.94 -0.01 0.00 0.02 0.00 0.00 46.19 42.10 1aw5 s LEU 146 CO 0.08 -1.51 0.62 -0.31 0.02 0.00 0.00 176.35 175.25 1aw5 s TYR 147 N -3.30 3.24 -0.43 0.29 2.02 -0.09 -4.61 117.35 114.48 1aw5 s TYR 147 Ca 0.59 0.17 -0.30 0.00 -0.37 0.00 0.00 57.07 57.16 1aw5 s TYR 147 Cb -0.12 -2.20 -0.09 0.00 -0.40 0.00 0.00 41.96 39.15 1aw5 s TYR 147 CO 0.52 -0.23 2.34 -3.47 -1.57 0.00 0.00 175.55 173.14 1aw5 n ASP 148 N -1.96 2.32 -3.75 2.29 2.03 -1.26 -2.36 116.55 113.86 1aw5 n ASP 148 Ca 0.00 -0.01 -0.25 0.00 0.52 0.00 0.00 54.79 55.05 1aw5 n ASP 148 Cb 0.58 -1.43 0.02 0.00 -0.72 0.00 0.00 41.12 39.57 1aw5 n ASP 148 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1aw5 n ASP 149 N 12.65 -2.37 0.00 1.67 9.92 -1.26 -4.92 116.55 132.24 1aw5 n ASP 149 Ca 0.39 -0.93 0.00 0.00 -0.53 0.00 0.00 54.79 53.72 1aw5 n ASP 149 Cb 0.38 -3.62 0.00 0.00 -0.64 0.00 0.00 41.12 37.24 1aw5 n ASP 149 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1aw5 n GLY 150 N -1.71 3.96 3.34 0.44 0.00 -1.00 -5.18 105.19 105.05 1aw5 n GLY 150 Ca -0.23 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.27 1aw5 n GLY 150 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1aw5 n THR 151 N 0.00 0.00 -2.87 2.61 -1.04 -1.26 -4.58 114.28 107.15 1aw5 n THR 151 Ca 0.00 -0.69 -0.41 0.00 -2.04 0.00 0.00 64.05 60.91 1aw5 n THR 151 Cb 0.00 -1.41 -0.04 0.00 -1.82 0.00 0.00 70.33 67.05 1aw5 n THR 151 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1aw5 s ILE 152 N -3.27 4.76 -0.99 12.58 1.01 -1.26 -0.91 121.20 133.13 1aw5 s ILE 152 Ca 0.66 1.81 -0.22 0.00 0.00 0.00 0.00 60.65 62.90 1aw5 s ILE 152 Cb -0.04 -4.20 0.07 0.00 0.01 0.00 0.00 42.46 38.30 1aw5 s ILE 152 CO 0.48 0.28 1.35 0.21 0.00 0.00 0.00 174.94 177.26 1aw5 s ASN 153 N 0.36 6.53 0.13 3.58 3.84 0.71 -4.83 114.94 125.25 1aw5 s ASN 153 Ca 0.44 -1.60 -0.25 0.00 0.21 0.00 0.00 52.86 51.65 1aw5 s ASN 153 Cb -0.21 -2.52 -0.06 0.00 -0.55 0.00 0.00 41.25 37.92 1aw5 s ASN 153 CO 0.25 -1.38 1.33 -1.14 -2.79 0.00 0.00 177.10 173.36 1aw5 n ARG 154 N 8.21 -0.36 -0.12 0.43 0.63 -1.26 -0.98 116.66 123.21 1aw5 n ARG 154 Ca 0.30 1.30 -0.05 0.00 -0.92 0.00 0.00 57.85 58.48 1aw5 n ARG 154 Cb 0.50 -1.92 0.03 0.00 0.45 0.00 0.00 32.46 31.52 1aw5 n ARG 154 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1aw5 h GLU 155 N 0.00 0.17 -0.05 -0.14 4.81 -1.95 -1.43 114.58 115.98 1aw5 h GLU 155 Ca 0.13 -0.01 -0.20 0.00 -0.13 0.00 0.00 59.36 59.15 1aw5 h GLU 155 Cb 0.33 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1aw5 h GLU 155 CO -0.76 0.11 -0.81 -0.09 -0.73 0.00 0.00 179.01 176.73 1aw5 h ARG 156 N 0.17 0.41 -0.25 1.92 9.65 -1.80 -2.44 114.38 122.04 1aw5 h ARG 156 Ca 0.19 -0.37 -0.01 0.00 -1.10 0.00 0.00 59.98 58.69 1aw5 h ARG 156 Cb 0.25 0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.90 1aw5 h ARG 156 CO -0.27 1.02 0.10 0.77 2.80 0.00 0.00 179.97 184.39 1aw5 h SER 157 N 0.26 0.35 -0.29 -3.80 0.02 -0.79 -1.14 113.55 108.15 1aw5 h SER 157 Ca -0.05 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.69 1aw5 h SER 157 Cb 1.41 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 1aw5 h SER 157 CO 0.14 0.42 0.01 0.58 -1.14 0.00 0.00 176.83 176.84 1aw5 h VAL 158 N 0.25 1.25 -0.60 2.27 2.07 -1.32 0.17 116.25 120.35 1aw5 h VAL 158 Ca 0.08 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 1aw5 h VAL 158 Cb 0.18 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1aw5 h VAL 158 CO -0.01 0.29 0.35 -1.28 0.02 0.00 0.00 177.57 176.94 1aw5 h SER 159 N 0.30 0.71 -0.06 0.57 0.87 -1.45 0.30 113.55 114.79 1aw5 h SER 159 Ca 0.08 -0.04 -0.08 0.00 -1.23 0.00 0.00 61.79 60.52 1aw5 h SER 159 Cb 0.41 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 1aw5 h SER 159 CO 0.01 0.55 -0.28 -0.09 -0.53 0.00 0.00 176.83 176.50 1aw5 h ARG 160 N 0.82 0.30 -0.48 2.24 9.65 -0.87 -3.21 114.38 122.82 1aw5 h ARG 160 Ca 0.21 -0.24 -0.04 0.00 -1.10 0.00 0.00 59.98 58.81 1aw5 h ARG 160 Cb -0.02 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 1aw5 h ARG 160 CO -0.04 0.88 0.11 -0.07 2.80 0.00 0.00 179.97 183.65 1aw5 h LEU 161 N -0.22 0.67 -1.08 3.80 3.38 -0.05 -2.49 115.31 119.31 1aw5 h LEU 161 Ca -0.02 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1aw5 h LEU 161 Cb 0.93 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 1aw5 h LEU 161 CO 0.06 0.67 0.35 0.00 0.09 0.00 0.00 178.44 179.61 1aw5 h ALA 162 N 1.43 1.29 0.01 1.53 0.00 -0.49 -1.97 119.26 121.06 1aw5 h ALA 162 Ca 0.16 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1aw5 h ALA 162 Cb 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1aw5 h ALA 162 CO -0.00 0.56 -0.00 0.00 0.00 0.00 0.00 179.25 179.80 1aw5 h ALA 163 N 1.39 -0.01 -0.28 0.00 0.00 -1.47 -1.27 119.26 117.62 1aw5 h ALA 163 Ca 0.25 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1aw5 h ALA 163 Cb 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1aw5 h ALA 163 CO -0.03 -0.37 0.02 0.28 0.00 0.00 0.00 179.25 179.15 1aw5 h VAL 164 N -0.29 0.82 -0.30 0.00 2.07 -1.28 0.64 116.25 117.91 1aw5 h VAL 164 Ca -0.00 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.51 1aw5 h VAL 164 Cb 0.29 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 1aw5 h VAL 164 CO 0.00 0.02 0.11 0.00 0.02 0.00 0.00 177.57 177.72 1aw5 h ALA 165 N 1.23 0.34 -0.14 1.67 0.00 -1.34 -0.13 119.26 120.89 1aw5 h ALA 165 Ca 0.13 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1aw5 h ALA 165 Cb 0.16 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1aw5 h ALA 165 CO -0.21 -0.29 -0.32 0.28 0.00 0.00 0.00 179.25 178.71 1aw5 h VAL 166 N 0.24 1.27 -0.29 0.00 2.07 -0.86 -2.34 116.25 116.35 1aw5 h VAL 166 Ca 0.13 -1.29 -0.15 0.00 0.82 0.00 0.00 66.70 66.20 1aw5 h VAL 166 Cb 0.10 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1aw5 h VAL 166 CO -0.13 0.39 -0.44 0.78 0.02 0.00 0.00 177.57 178.19 1aw5 h ASN 167 N 0.23 0.78 -0.31 0.57 2.35 -0.24 0.17 115.58 119.13 1aw5 h ASN 167 Ca 0.03 -0.37 -0.05 0.00 -0.55 0.00 0.00 56.30 55.36 1aw5 h ASN 167 Cb 0.68 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1aw5 h ASN 167 CO 0.05 1.11 -0.01 1.88 -1.65 0.00 0.00 177.43 178.81 1aw5 h TYR 168 N 0.58 0.61 -0.72 1.19 0.05 -0.89 -0.19 116.97 117.60 1aw5 h TYR 168 Ca 0.04 -0.11 0.00 0.00 0.05 0.00 0.00 58.73 58.71 1aw5 h TYR 168 Cb 0.99 -0.16 -0.04 0.00 1.01 0.00 0.00 36.73 38.54 1aw5 h TYR 168 CO 0.05 0.69 0.46 0.00 -1.05 0.00 0.00 178.16 178.31 1aw5 h ALA 169 N 0.83 0.91 0.00 3.88 0.00 -1.27 -0.65 119.26 122.97 1aw5 h ALA 169 Ca 0.09 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1aw5 h ALA 169 Cb 0.46 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1aw5 h ALA 169 CO 0.02 0.36 -0.13 0.87 0.00 0.00 0.00 179.25 180.37 1aw5 h LYS 170 N 0.98 0.00 -0.00 0.00 1.57 -0.36 -0.36 116.57 118.39 1aw5 h LYS 170 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1aw5 h LYS 170 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1aw5 h LYS 170 CO -0.05 0.13 -0.07 0.00 -0.57 0.00 0.00 179.45 178.88 1aw5 n ALA 171 N -2.40 2.69 0.00 3.86 0.00 -0.11 -4.91 120.51 119.63 1aw5 n ALA 171 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1aw5 n ALA 171 Cb 0.21 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.28 1aw5 n ALA 171 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aw5 n GLY 172 N 1.26 1.19 3.68 0.00 0.00 -0.15 -4.64 105.19 106.53 1aw5 n GLY 172 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1aw5 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw5 s ALA 173 N -2.00 3.52 0.34 4.61 0.00 -0.68 -4.91 121.76 122.64 1aw5 s ALA 173 Ca 0.00 0.50 0.10 0.00 0.00 0.00 0.00 51.96 52.56 1aw5 s ALA 173 Cb 0.00 -3.52 0.62 0.00 0.00 0.00 0.00 23.12 20.22 1aw5 s ALA 173 CO 0.00 -0.83 1.79 0.45 0.00 0.00 0.00 175.76 177.17 1aw5 h HIS 174 N 7.52 0.14 -3.50 0.00 -0.00 -1.72 -3.39 115.15 114.19 1aw5 h HIS 174 Ca -0.31 -0.03 -0.16 0.00 -0.00 0.00 0.00 60.37 59.87 1aw5 h HIS 174 Cb 1.14 -0.03 -0.23 0.00 -0.00 0.00 0.00 27.41 28.29 1aw5 h HIS 174 CO 0.74 0.47 -0.53 0.00 -0.00 0.00 0.00 177.93 178.61 1aw5 s VAL 176 N -0.83 2.75 -0.48 0.00 -7.23 -1.02 0.61 120.40 114.20 1aw5 s VAL 176 Ca -0.09 -0.76 -0.04 0.00 -1.81 0.00 0.00 61.98 59.28 1aw5 s VAL 176 Cb -0.05 -2.14 0.13 0.00 0.56 0.00 0.00 36.38 34.87 1aw5 s VAL 176 CO 0.01 0.53 0.29 0.00 -0.31 0.00 0.00 175.10 175.61 1aw5 s ALA 177 N 0.47 3.30 -0.14 1.32 0.00 0.17 -1.60 121.76 125.29 1aw5 s ALA 177 Ca -0.11 -2.74 -0.29 0.00 0.00 0.00 0.00 51.96 48.82 1aw5 s ALA 177 Cb -0.16 -2.54 -0.02 0.00 0.00 0.00 0.00 23.12 20.40 1aw5 s ALA 177 CO 0.05 -1.90 1.29 -2.14 0.00 0.00 0.00 175.76 173.06 1aw5 s PRO 178 N 0.83 4.24 -0.32 0.00 0.02 -1.24 0.05 135.00 138.59 1aw5 s PRO 178 Ca 0.10 1.72 0.06 0.00 0.02 0.00 0.00 61.00 62.91 1aw5 s PRO 178 Cb -0.22 -3.75 0.46 0.00 0.02 0.00 0.00 34.50 31.00 1aw5 s PRO 178 CO -0.04 -0.68 1.29 -1.13 -0.33 0.00 0.00 177.00 176.11 1aw5 n SER 179 N 6.43 4.86 0.00 2.53 3.41 -0.59 -2.55 113.62 127.70 1aw5 n SER 179 Ca 0.14 -3.77 0.00 0.00 -0.26 0.00 0.00 58.87 54.98 1aw5 n SER 179 Cb 0.45 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1aw5 n SER 179 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1aw5 n ASP 180 N -0.78 0.00 0.00 4.04 5.75 -1.26 -4.94 116.55 119.36 1aw5 n ASP 180 Ca 0.44 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.22 1aw5 n ASP 180 Cb 0.92 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.01 1aw5 n ASP 180 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 1aw5 n ILE 182 N 0.00 0.00 -1.67 2.12 5.41 -1.26 -4.33 119.36 119.63 1aw5 n ILE 182 Ca 0.00 0.00 -0.60 0.00 1.00 0.00 0.00 62.75 63.15 1aw5 n ILE 182 Cb 0.00 0.00 -0.08 0.00 -0.71 0.00 0.00 39.64 38.85 1aw5 n ILE 182 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1aw5 n ASP 183 N 0.00 1.55 0.00 4.38 8.00 -1.26 -2.14 116.55 127.08 1aw5 n ASP 183 Ca 0.00 1.13 0.00 0.00 0.71 0.00 0.00 54.79 56.63 1aw5 n ASP 183 Cb 0.00 -1.04 0.00 0.00 -0.02 0.00 0.00 41.12 40.06 1aw5 n ASP 183 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aw5 n GLY 184 N 3.47 0.64 0.25 0.44 0.00 -1.26 -4.94 105.19 103.78 1aw5 n GLY 184 Ca 0.26 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.32 1aw5 n GLY 184 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1aw5 h ARG 185 N 1.71 0.20 -0.87 1.61 -0.00 -1.83 -2.74 114.38 112.47 1aw5 h ARG 185 Ca 0.00 -0.03 -0.02 0.00 -0.00 0.00 0.00 59.98 59.93 1aw5 h ARG 185 Cb 0.07 -0.03 -0.04 0.00 -0.00 0.00 0.00 29.97 29.97 1aw5 h ARG 185 CO 0.00 0.28 0.47 0.82 -0.00 0.00 0.00 179.97 181.54 1aw5 h ILE 186 N 0.19 1.25 -0.42 0.08 1.08 -1.90 0.25 117.51 118.05 1aw5 h ILE 186 Ca 0.04 -0.63 -0.04 0.00 -0.39 0.00 0.00 64.86 63.84 1aw5 h ILE 186 Cb 0.24 0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.06 1aw5 h ILE 186 CO 0.01 0.29 0.12 -0.09 -0.69 0.00 0.00 178.15 177.79 1aw5 h ARG 187 N 1.21 0.65 -0.13 2.37 2.43 -1.57 0.11 114.38 119.46 1aw5 h ARG 187 Ca 0.30 -0.15 -0.18 0.00 -0.81 0.00 0.00 59.98 59.15 1aw5 h ARG 187 Cb 0.04 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1aw5 h ARG 187 CO -0.05 0.65 -0.67 -0.44 -1.51 0.00 0.00 179.97 177.96 1aw5 h ASP 188 N 0.53 0.59 -0.47 -3.80 3.32 -1.37 0.25 116.42 115.47 1aw5 h ASP 188 Ca 0.13 -0.36 -0.13 0.00 0.02 0.00 0.00 57.03 56.69 1aw5 h ASP 188 Cb 0.28 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1aw5 h ASP 188 CO -0.00 1.10 -0.21 0.40 -1.72 0.00 0.00 179.24 178.80 1aw5 h ILE 189 N 0.37 1.27 -0.19 0.35 2.04 -0.86 0.14 117.51 120.63 1aw5 h ILE 189 Ca -0.02 -1.38 -0.04 0.00 1.00 0.00 0.00 64.86 64.42 1aw5 h ILE 189 Cb 1.24 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 38.46 1aw5 h ILE 189 CO 0.12 0.47 -0.05 0.50 0.00 0.00 0.00 178.15 179.20 1aw5 h LYS 190 N 0.83 0.37 -0.24 2.37 1.63 -0.64 -0.67 116.57 120.22 1aw5 h LYS 190 Ca 0.11 -0.14 0.01 0.00 -0.85 0.00 0.00 60.65 59.77 1aw5 h LYS 190 Cb 0.79 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.39 1aw5 h LYS 190 CO 0.07 0.63 0.15 -0.09 -3.45 0.00 0.00 179.45 176.75 1aw5 h ARG 191 N 0.08 0.29 -0.88 1.90 9.65 -0.42 -0.09 114.38 124.92 1aw5 h ARG 191 Ca 0.05 -0.02 0.05 0.00 -1.10 0.00 0.00 59.98 58.96 1aw5 h ARG 191 Cb 0.49 -0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 28.95 1aw5 h ARG 191 CO 0.02 0.19 0.57 0.78 2.80 0.00 0.00 179.97 184.34 1aw5 h GLY 192 N 0.30 1.26 1.35 2.80 0.00 -0.61 0.84 103.07 109.02 1aw5 h GLY 192 Ca 0.09 -0.41 -0.13 0.00 0.00 0.00 0.00 47.33 46.87 1aw5 h GLY 192 CO -0.03 0.33 -0.34 1.41 0.00 0.00 0.00 176.54 177.91 1aw5 h LEU 193 N 1.04 0.76 0.65 3.11 3.38 -0.44 -0.82 115.31 123.00 1aw5 h LEU 193 Ca 0.37 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1aw5 h LEU 193 Cb 0.13 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1aw5 h LEU 193 CO -0.12 1.03 -0.35 0.40 0.09 0.00 0.00 178.44 179.49 1aw5 h ILE 194 N 0.61 0.29 -0.72 1.22 2.04 0.39 0.25 117.51 121.58 1aw5 h ILE 194 Ca 0.06 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.05 1aw5 h ILE 194 Cb 0.86 0.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 1aw5 h ILE 194 CO 0.08 0.00 0.48 0.78 0.00 0.00 0.00 178.15 179.49 1aw5 h ASN 195 N -0.93 0.41 -0.19 1.72 2.35 -0.84 0.40 115.58 118.51 1aw5 h ASN 195 Ca -0.09 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1aw5 h ASN 195 Cb 0.73 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.03 1aw5 h ASN 195 CO 0.12 0.23 0.00 0.00 -1.65 0.00 0.00 177.43 176.13 1aw5 n ALA 196 N -2.51 2.48 -3.82 -0.83 0.00 -0.32 -4.90 120.51 110.61 1aw5 n ALA 196 Ca 0.13 -0.34 -0.29 0.00 0.00 0.00 0.00 53.44 52.94 1aw5 n ALA 196 Cb 0.47 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 18.96 1aw5 n ALA 196 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1aw5 n ASN 197 N 0.06 -4.89 0.00 0.00 4.13 0.14 -4.86 115.26 109.84 1aw5 n ASN 197 Ca 0.06 -0.72 0.00 0.00 1.68 0.00 0.00 54.58 55.61 1aw5 n ASN 197 Cb 0.17 -3.91 0.00 0.00 -1.54 0.00 0.00 39.78 34.50 1aw5 n ASN 197 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1aw5 n LEU 198 N -4.60 0.99 -0.16 3.41 4.77 0.75 -4.81 117.00 117.36 1aw5 n LEU 198 Ca 0.03 -0.99 -0.01 0.00 -0.03 0.00 0.00 56.01 55.01 1aw5 n LEU 198 Cb 0.53 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.85 1aw5 n LEU 198 CO 0.72 0.25 1.11 0.00 -1.33 0.00 0.00 177.39 178.14 1aw5 h ALA 199 N 0.00 1.36 -0.05 -1.18 0.00 -1.81 -2.32 119.26 115.25 1aw5 h ALA 199 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1aw5 h ALA 199 Cb 0.40 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1aw5 h ALA 199 CO 0.00 0.50 0.00 -2.39 0.00 0.00 0.00 179.25 177.36 1aw5 n HIS 200 N -4.35 0.07 -1.24 0.00 1.44 -1.26 -3.82 115.22 106.05 1aw5 n HIS 200 Ca 0.06 -0.03 0.00 0.00 -2.01 0.00 0.00 57.72 55.73 1aw5 n HIS 200 Cb 0.13 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.24 1aw5 n HIS 200 CO 0.00 0.00 0.00 0.36 -2.81 0.00 0.00 176.34 173.89 1aw5 n LYS 201 N -0.37 0.00 -4.10 -1.40 2.85 -0.95 -5.04 118.16 109.14 1aw5 n LYS 201 Ca 0.03 -0.10 -0.33 0.00 -1.05 0.00 0.00 58.31 56.86 1aw5 n LYS 201 Cb 0.05 -0.38 -0.16 0.00 -0.65 0.00 0.00 35.03 33.90 1aw5 n LYS 201 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1aw5 s THR 202 N 0.00 2.15 -0.25 0.58 2.01 -0.92 -4.81 115.64 114.40 1aw5 s THR 202 Ca 0.00 -1.08 -0.26 0.00 0.31 0.00 0.00 61.69 60.66 1aw5 s THR 202 Cb 0.00 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.52 1aw5 s THR 202 CO 0.00 0.40 0.90 0.12 -0.69 0.00 0.00 174.62 175.36 1aw5 s PHE 203 N 1.25 3.30 -0.55 4.92 2.19 -0.60 -4.83 117.98 123.66 1aw5 s PHE 203 Ca 0.02 1.22 -0.22 0.00 0.33 0.00 0.00 56.93 58.28 1aw5 s PHE 203 Cb -0.15 -3.17 0.06 0.00 -1.31 0.00 0.00 43.02 38.45 1aw5 s PHE 203 CO -0.11 -0.46 0.80 0.08 1.83 0.00 0.00 175.22 177.37 1aw5 s VAL 204 N 3.01 4.60 -0.94 3.12 1.01 -1.26 -2.44 120.40 127.50 1aw5 s VAL 204 Ca 0.38 -0.22 -0.16 0.00 0.00 0.00 0.00 61.98 61.99 1aw5 s VAL 204 Cb -0.15 -4.46 0.18 0.00 0.00 0.00 0.00 36.38 31.95 1aw5 s VAL 204 CO 0.08 -1.04 1.03 -0.22 0.00 0.00 0.00 175.10 174.94 1aw5 s LEU 205 N 3.35 5.79 0.08 3.92 2.96 -0.63 -0.26 118.68 133.89 1aw5 s LEU 205 Ca 0.22 -2.51 -0.30 0.00 -0.22 0.00 0.00 54.13 51.31 1aw5 s LEU 205 Cb -0.17 -2.31 -0.06 0.00 0.50 0.00 0.00 46.19 44.15 1aw5 s LEU 205 CO 0.14 -0.79 1.17 -0.55 -1.32 0.00 0.00 176.35 175.00 1aw5 s SER 206 N 2.82 7.13 -1.29 3.68 0.15 -0.86 -3.64 113.70 121.68 1aw5 s SER 206 Ca 0.28 2.01 -0.16 0.00 0.70 0.00 0.00 55.95 58.78 1aw5 s SER 206 Cb -0.07 -2.58 0.10 0.00 -1.71 0.00 0.00 66.02 61.76 1aw5 s SER 206 CO -0.08 -0.41 1.72 -1.22 1.20 0.00 0.00 173.24 174.44 1aw5 n TYR 207 N 3.62 4.52 -0.27 3.44 4.02 -1.06 0.45 117.16 131.89 1aw5 n TYR 207 Ca 0.08 -3.00 -0.05 0.00 -0.01 0.00 0.00 57.90 54.91 1aw5 n TYR 207 Cb 0.47 -2.45 0.06 0.00 -0.02 0.00 0.00 39.34 37.39 1aw5 n TYR 207 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1aw5 h ALA 208 N 7.14 0.93 -3.48 -0.72 0.00 -1.82 -3.38 119.26 117.94 1aw5 h ALA 208 Ca 0.42 -0.07 -0.65 0.00 0.00 0.00 0.00 54.91 54.62 1aw5 h ALA 208 Cb 0.83 -0.30 -0.41 0.00 0.00 0.00 0.00 17.79 17.92 1aw5 h ALA 208 CO 1.46 0.38 -0.66 0.00 0.00 0.00 0.00 179.25 180.42 1aw5 s ALA 209 N -6.06 3.15 -0.32 0.00 0.00 -1.03 -4.56 121.76 112.93 1aw5 s ALA 209 Ca -0.13 -3.01 -0.01 0.00 0.00 0.00 0.00 51.96 48.81 1aw5 s ALA 209 Cb 0.15 -2.09 0.07 0.00 0.00 0.00 0.00 23.12 21.25 1aw5 s ALA 209 CO 0.78 -1.91 0.04 0.21 0.00 0.00 0.00 175.76 174.88 1aw5 s LYS 210 N 0.12 2.18 0.33 0.00 2.20 -1.26 -0.81 119.74 122.49 1aw5 s LYS 210 Ca 0.15 -1.48 -0.07 0.00 -0.36 0.00 0.00 55.97 54.21 1aw5 s LYS 210 Cb -0.24 -3.23 -0.06 0.00 -1.51 0.00 0.00 37.83 32.79 1aw5 s LYS 210 CO -0.03 -0.76 0.62 -0.06 -0.36 0.00 0.00 175.35 174.77 1aw5 s PHE 211 N 1.16 3.47 0.09 4.03 0.40 -0.32 -2.79 117.98 124.03 1aw5 s PHE 211 Ca -0.00 0.77 -0.16 0.00 -0.60 0.00 0.00 56.93 56.94 1aw5 s PHE 211 Cb -0.20 -2.22 -0.07 0.00 0.51 0.00 0.00 43.02 41.05 1aw5 s PHE 211 CO -0.03 0.08 0.53 -1.54 0.70 0.00 0.00 175.22 174.95 1aw5 s SER 212 N -3.16 6.90 0.08 1.36 1.04 -0.51 -4.60 113.70 114.81 1aw5 s SER 212 Ca 0.46 1.11 -0.12 0.00 0.48 0.00 0.00 55.95 57.89 1aw5 s SER 212 Cb -0.11 -2.30 0.04 0.00 0.10 0.00 0.00 66.02 63.75 1aw5 s SER 212 CO 0.30 0.20 0.57 0.61 0.98 0.00 0.00 173.24 175.91 1aw5 n GLY 213 N 1.30 0.85 1.56 7.32 0.00 -1.26 -4.49 105.19 110.48 1aw5 n GLY 213 Ca -0.09 -1.03 0.04 0.00 0.00 0.00 0.00 46.02 44.95 1aw5 n GLY 213 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1aw5 n ASN 214 N -0.92 4.53 -0.66 1.61 4.05 -1.26 -4.05 115.26 118.56 1aw5 n ASN 214 Ca -0.01 -2.72 0.12 0.00 0.45 0.00 0.00 54.58 52.43 1aw5 n ASN 214 Cb 0.31 -0.65 0.23 0.00 1.23 0.00 0.00 39.78 40.91 1aw5 n ASN 214 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1aw5 n LEU 215 N 0.43 2.19 -0.09 1.20 4.77 -1.26 -4.15 117.00 120.08 1aw5 n LEU 215 Ca 0.22 -0.73 -0.11 0.00 -0.03 0.00 0.00 56.01 55.36 1aw5 n LEU 215 Cb 0.98 -0.01 -0.15 0.00 -2.33 0.00 0.00 43.42 41.90 1aw5 n LEU 215 CO 0.25 0.37 -1.06 -1.22 -1.33 0.00 0.00 177.39 174.41 1aw5 n TYR 216 N 0.55 0.19 -3.65 -1.77 4.01 -1.26 -0.48 117.16 114.76 1aw5 n TYR 216 Ca 0.14 0.07 -0.03 0.00 -0.16 0.00 0.00 57.90 57.92 1aw5 n TYR 216 Cb 0.48 -1.03 -0.07 0.00 -0.31 0.00 0.00 39.34 38.41 1aw5 n TYR 216 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1aw5 s GLY 217 N -5.51 0.32 0.84 2.72 0.00 -1.26 -4.65 107.32 99.78 1aw5 s GLY 217 Ca -0.11 3.46 -0.17 0.00 0.00 0.00 0.00 44.72 47.90 1aw5 s GLY 217 CO 0.81 1.99 -0.33 -1.55 0.00 0.00 0.00 173.10 174.03 1aw5 n PRO 218 N 1.77 0.01 0.00 2.90 -0.04 -1.26 -4.80 135.00 133.58 1aw5 n PRO 218 Ca -0.11 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1aw5 n PRO 218 Cb 0.57 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.82 1aw5 n PRO 218 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1aw5 n ALA 219 N -2.36 0.00 -0.65 0.55 0.00 -1.26 -5.09 120.51 111.69 1aw5 n ALA 219 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1aw5 n ALA 219 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1aw5 n ALA 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aw5 s TYR 235 N -2.24 1.25 -0.30 0.00 1.51 -1.26 -4.97 117.35 111.34 1aw5 s TYR 235 Ca 0.00 -0.25 -0.10 0.00 -1.01 0.00 0.00 57.07 55.71 1aw5 s TYR 235 Cb 0.00 -4.18 0.14 0.00 -0.11 0.00 0.00 41.96 37.81 1aw5 s TYR 235 CO 0.00 -5.27 0.69 -0.65 -1.11 0.00 0.00 175.55 169.21 1aw5 s GLN 236 N 4.88 0.54 0.45 -0.62 -0.21 -1.26 -4.79 119.66 118.65 1aw5 s GLN 236 Ca 0.91 1.30 -0.25 0.00 0.02 0.00 0.00 55.36 57.34 1aw5 s GLN 236 Cb -0.41 0.78 -0.08 0.00 1.00 0.00 0.00 33.01 34.30 1aw5 s GLN 236 CO 0.40 -0.24 1.43 -0.51 -2.12 0.00 0.00 175.29 174.26 1aw5 s LEU 237 N 2.84 4.10 0.32 2.90 1.43 -1.12 -4.61 118.68 124.55 1aw5 s LEU 237 Ca -0.02 2.94 -0.26 0.00 -1.03 0.00 0.00 54.13 55.75 1aw5 s LEU 237 Cb -0.12 -3.94 -0.10 0.00 0.03 0.00 0.00 46.19 42.06 1aw5 s LEU 237 CO -0.19 -1.20 0.95 -2.16 0.23 0.00 0.00 176.35 173.98 1aw5 s PRO 238 N -2.47 4.58 0.39 1.29 0.04 -1.26 -1.43 135.00 136.14 1aw5 s PRO 238 Ca 0.61 1.36 0.21 0.00 0.04 0.00 0.00 61.00 63.22 1aw5 s PRO 238 Cb -0.44 -2.82 1.22 0.00 0.04 0.00 0.00 34.50 32.50 1aw5 s PRO 238 CO 0.57 0.27 1.66 -1.00 0.04 0.00 0.00 177.00 178.54 1aw5 h PRO 239 N 3.21 0.23 -0.00 0.56 0.14 -1.94 0.35 132.00 134.54 1aw5 h PRO 239 Ca -0.47 -0.01 0.00 0.00 0.14 0.00 0.00 66.00 65.66 1aw5 h PRO 239 Cb 1.19 -0.05 0.00 0.00 0.14 0.00 0.00 31.00 32.28 1aw5 h PRO 239 CO 0.65 0.15 -0.13 0.00 0.14 0.00 0.00 178.00 178.81 1aw5 n ALA 240 N -2.40 2.77 -1.92 -0.56 0.00 -1.26 -4.68 120.51 112.46 1aw5 n ALA 240 Ca 0.33 -0.25 -0.32 0.00 0.00 0.00 0.00 53.44 53.21 1aw5 n ALA 240 Cb 1.14 -1.34 -0.06 0.00 0.00 0.00 0.00 19.45 19.19 1aw5 n ALA 240 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aw5 n GLY 241 N 1.34 1.38 0.11 0.00 0.00 0.12 -4.71 105.19 103.43 1aw5 n GLY 241 Ca 0.12 -0.83 -0.19 0.00 0.00 0.00 0.00 46.02 45.12 1aw5 n GLY 241 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1aw5 h ARG 242 N 9.25 0.26 -0.89 1.61 2.43 -1.84 -3.05 114.38 122.15 1aw5 h ARG 242 Ca 0.27 -0.45 -0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1aw5 h ARG 242 Cb 0.88 0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 30.56 1aw5 h ARG 242 CO 1.37 1.21 0.54 0.78 -1.51 0.00 0.00 179.97 182.37 1aw5 h GLY 243 N -0.43 1.29 1.11 2.80 0.00 -2.00 -1.08 103.07 104.76 1aw5 h GLY 243 Ca -0.13 -0.53 -0.11 0.00 0.00 0.00 0.00 47.33 46.56 1aw5 h GLY 243 CO 0.13 0.51 -0.09 1.41 0.00 0.00 0.00 176.54 178.50 1aw5 h LEU 244 N 1.22 1.04 -0.89 3.11 3.38 -1.95 -1.63 115.31 119.59 1aw5 h LEU 244 Ca 0.32 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1aw5 h LEU 244 Cb -0.06 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.37 1aw5 h LEU 244 CO -0.06 1.14 0.43 0.00 0.09 0.00 0.00 178.44 180.04 1aw5 h ALA 245 N 0.95 1.14 -0.31 1.53 0.00 -1.34 0.65 119.26 121.88 1aw5 h ALA 245 Ca 0.15 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 1aw5 h ALA 245 Cb 0.66 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1aw5 h ALA 245 CO 0.05 0.66 -0.48 0.00 0.00 0.00 0.00 179.25 179.48 1aw5 h ARG 246 N 1.22 0.88 -0.15 0.00 3.08 -1.01 -1.59 114.38 116.81 1aw5 h ARG 246 Ca 0.30 -0.53 -0.14 0.00 0.07 0.00 0.00 59.98 59.68 1aw5 h ARG 246 Cb 0.09 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1aw5 h ARG 246 CO -0.04 1.17 -0.50 0.00 -1.07 0.00 0.00 179.97 179.53 1aw5 h ARG 247 N 0.67 0.41 -0.19 0.04 3.08 -1.09 -2.27 114.38 115.03 1aw5 h ARG 247 Ca 0.03 -0.23 -0.13 0.00 0.07 0.00 0.00 59.98 59.72 1aw5 h ARG 247 Cb 1.08 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 1aw5 h ARG 247 CO 0.11 0.81 -0.42 0.00 -1.07 0.00 0.00 179.97 179.40 1aw5 h ALA 248 N 1.15 0.93 -0.05 0.04 0.00 -0.82 0.12 119.26 120.62 1aw5 h ALA 248 Ca 0.01 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1aw5 h ALA 248 Cb 0.99 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1aw5 h ALA 248 CO 0.09 0.63 -0.00 -0.07 0.00 0.00 0.00 179.25 179.90 1aw5 h LEU 249 N 0.36 0.09 -0.56 0.00 3.38 -1.09 -1.89 115.31 115.60 1aw5 h LEU 249 Ca 0.03 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 1aw5 h LEU 249 Cb 0.89 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 1aw5 h LEU 249 CO 0.08 0.39 0.17 -0.08 0.09 0.00 0.00 178.44 179.09 1aw5 h GLU 250 N -0.20 0.88 0.76 1.13 4.81 -1.35 -3.22 114.58 117.39 1aw5 h GLU 250 Ca 0.01 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.02 1aw5 h GLU 250 Cb 0.34 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 1aw5 h GLU 250 CO 0.00 0.80 -0.46 -0.09 -0.73 0.00 0.00 179.01 178.53 1aw5 h ARG 251 N 0.79 -1.10 -1.47 1.92 2.43 -0.69 -2.38 114.38 113.88 1aw5 h ARG 251 Ca 0.18 0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1aw5 h ARG 251 Cb 0.29 0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1aw5 h ARG 251 CO -0.01 -0.74 0.00 -0.25 -1.51 0.00 0.00 179.97 177.47 1aw5 n ASP 252 N -5.38 0.00 0.00 -3.80 9.92 -0.72 -1.08 116.55 115.49 1aw5 n ASP 252 Ca -0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.12 1aw5 n ASP 252 Cb 0.48 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 1aw5 n ASP 252 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1aw5 n SER 254 N 0.75 0.00 -0.10 -2.24 7.64 -0.90 -1.03 113.62 117.74 1aw5 n SER 254 Ca 0.00 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.03 1aw5 n SER 254 Cb 0.00 0.00 0.72 0.00 -1.01 0.00 0.00 64.21 63.92 1aw5 n SER 254 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1aw5 n GLU 255 N 0.00 0.83 0.00 1.43 1.02 -0.24 -4.94 120.64 118.74 1aw5 n GLU 255 Ca 0.00 -0.21 0.00 0.00 -0.02 0.00 0.00 57.16 56.93 1aw5 n GLU 255 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1aw5 n GLU 255 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1aw5 n GLY 256 N 1.20 1.13 3.70 0.62 0.00 -1.18 -3.71 105.19 106.95 1aw5 n GLY 256 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1aw5 n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw5 n ALA 257 N -0.27 1.28 0.61 4.61 0.00 -0.19 -4.79 120.51 121.74 1aw5 n ALA 257 Ca 0.00 0.34 0.08 0.00 0.00 0.00 0.00 53.44 53.86 1aw5 n ALA 257 Cb 0.00 -2.25 -0.11 0.00 0.00 0.00 0.00 19.45 17.09 1aw5 n ALA 257 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1aw5 n ASP 258 N 0.66 0.84 -3.74 0.00 8.00 0.64 -4.93 116.55 118.01 1aw5 n ASP 258 Ca 0.05 -0.67 -0.10 0.00 0.71 0.00 0.00 54.79 54.78 1aw5 n ASP 258 Cb 0.37 1.21 -0.04 0.00 -0.02 0.00 0.00 41.12 42.64 1aw5 n ASP 258 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1aw5 s GLY 259 N -3.01 -0.06 0.06 0.44 0.00 -1.14 -4.16 107.32 99.46 1aw5 s GLY 259 Ca 0.03 -0.27 0.04 0.00 0.00 0.00 0.00 44.72 44.53 1aw5 s GLY 259 CO 0.72 -0.34 -0.12 -0.42 0.00 0.00 0.00 173.10 172.94 1aw5 s ILE 260 N -3.87 0.90 0.02 0.90 -1.09 -0.66 -2.04 121.20 115.37 1aw5 s ILE 260 Ca 0.09 -1.26 0.08 0.00 -2.23 0.00 0.00 60.65 57.33 1aw5 s ILE 260 Cb 0.00 -0.94 -0.02 0.00 -1.58 0.00 0.00 42.46 39.92 1aw5 s ILE 260 CO -0.04 -0.31 -0.23 -0.63 -1.23 0.00 0.00 174.94 172.50 1aw5 s ILE 261 N -1.41 1.82 -0.17 2.92 1.01 0.17 0.35 121.20 125.89 1aw5 s ILE 261 Ca -0.04 -1.15 0.01 0.00 0.00 0.00 0.00 60.65 59.47 1aw5 s ILE 261 Cb -0.09 -1.55 0.01 0.00 0.01 0.00 0.00 42.46 40.84 1aw5 s ILE 261 CO 0.01 0.35 -0.19 -0.69 0.00 0.00 0.00 174.94 174.42 1aw5 s VAL 262 N -0.70 2.16 -0.02 2.92 1.01 -0.73 -2.46 120.40 122.58 1aw5 s VAL 262 Ca 0.09 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1aw5 s VAL 262 Cb -0.09 -1.90 0.03 0.00 0.00 0.00 0.00 36.38 34.42 1aw5 s VAL 262 CO 0.01 0.54 0.02 -0.75 0.00 0.00 0.00 175.10 174.92 1aw5 s LYS 263 N 1.15 0.02 0.16 2.72 2.20 0.01 -2.02 119.74 123.98 1aw5 s LYS 263 Ca 0.01 0.16 -0.03 0.00 -0.36 0.00 0.00 55.97 55.76 1aw5 s LYS 263 Cb -0.14 -0.28 0.04 0.00 -1.51 0.00 0.00 37.83 35.94 1aw5 s LYS 263 CO -0.09 -0.16 0.12 -2.30 -0.36 0.00 0.00 175.35 172.57 1aw5 n PRO 264 N 4.15 -1.59 0.03 4.03 -0.02 -1.26 -1.17 135.00 139.16 1aw5 n PRO 264 Ca -0.27 -0.20 -0.01 0.00 -2.02 0.00 0.00 63.50 61.00 1aw5 n PRO 264 Cb 0.50 -0.21 -0.00 0.00 -0.02 0.00 0.00 33.50 33.77 1aw5 n PRO 264 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1aw5 n SER 265 N -3.26 1.05 -0.28 2.55 7.64 -1.19 -4.52 113.62 115.61 1aw5 n SER 265 Ca 0.02 0.14 0.08 0.00 1.01 0.00 0.00 58.87 60.11 1aw5 n SER 265 Cb 0.07 -0.34 0.23 0.00 -1.01 0.00 0.00 64.21 63.15 1aw5 n SER 265 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1aw5 h THR 266 N -0.10 0.66 -0.02 0.44 2.02 -1.92 0.27 112.91 114.25 1aw5 h THR 266 Ca 0.00 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1aw5 h THR 266 Cb 0.10 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1aw5 h THR 266 CO 0.00 0.09 0.00 0.49 0.37 0.00 0.00 175.52 176.47 1aw5 n PHE 267 N -4.95 0.02 -2.07 3.16 3.01 -1.26 -3.78 117.46 111.59 1aw5 n PHE 267 Ca 0.17 -0.01 0.05 0.00 1.01 0.00 0.00 57.45 58.67 1aw5 n PHE 267 Cb 0.47 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 40.04 1aw5 n PHE 267 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1aw5 n TYR 268 N -0.53 0.00 -0.14 1.38 4.02 0.84 -4.85 117.16 117.88 1aw5 n TYR 268 Ca 0.20 -0.92 0.13 0.00 -0.01 0.00 0.00 57.90 57.30 1aw5 n TYR 268 Cb 0.19 -0.19 0.48 0.00 -0.02 0.00 0.00 39.34 39.80 1aw5 n TYR 268 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1aw5 h LEU 269 N 0.95 0.43 -0.97 7.72 3.38 -1.35 0.34 115.31 125.81 1aw5 h LEU 269 Ca -0.12 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 1aw5 h LEU 269 Cb 1.48 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.15 1aw5 h LEU 269 CO 0.05 0.24 -0.20 -2.24 0.09 0.00 0.00 178.44 176.39 1aw5 h ASP 270 N 0.46 0.51 -0.34 -0.43 2.03 -1.88 -0.96 116.42 115.82 1aw5 h ASP 270 Ca 0.33 -0.16 -0.12 0.00 -0.73 0.00 0.00 57.03 56.36 1aw5 h ASP 270 Cb 0.67 -0.14 -0.01 0.00 -0.83 0.00 0.00 39.33 39.01 1aw5 h ASP 270 CO -0.11 0.72 -0.21 0.40 -1.03 0.00 0.00 179.24 179.02 1aw5 h ILE 271 N 0.47 1.27 -0.05 4.15 1.08 -1.35 -0.86 117.51 122.22 1aw5 h ILE 271 Ca 0.08 -1.33 -0.08 0.00 -0.39 0.00 0.00 64.86 63.13 1aw5 h ILE 271 Cb 0.60 1.17 -0.01 0.00 -3.07 0.00 0.00 36.82 35.51 1aw5 h ILE 271 CO 0.04 0.45 -0.35 0.58 -0.69 0.00 0.00 178.15 178.18 1aw5 h VAL 272 N 0.72 1.27 -0.26 1.67 2.07 -0.79 -0.05 116.25 120.88 1aw5 h VAL 272 Ca 0.10 -1.27 -0.12 0.00 0.82 0.00 0.00 66.70 66.23 1aw5 h VAL 272 Cb 0.73 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 1aw5 h VAL 272 CO 0.06 0.37 -0.32 -0.09 0.02 0.00 0.00 177.57 177.61 1aw5 h ARG 273 N 0.09 0.55 -0.31 1.57 9.65 -0.55 0.60 114.38 125.99 1aw5 h ARG 273 Ca 0.01 -0.24 -0.13 0.00 -1.10 0.00 0.00 59.98 58.52 1aw5 h ARG 273 Cb 0.66 -0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 29.22 1aw5 h ARG 273 CO 0.05 0.81 -0.31 -0.44 2.80 0.00 0.00 179.97 182.88 1aw5 h ASP 274 N 0.47 0.81 0.33 -3.80 3.32 -0.57 -2.68 116.42 114.31 1aw5 h ASP 274 Ca 0.06 -0.47 -0.06 0.00 0.02 0.00 0.00 57.03 56.58 1aw5 h ASP 274 Cb 0.79 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 1aw5 h ASP 274 CO 0.06 1.11 -0.27 0.00 -1.72 0.00 0.00 179.24 178.42 1aw5 h ALA 275 N 0.72 1.45 0.00 3.45 0.00 -0.83 0.24 119.26 124.29 1aw5 h ALA 275 Ca 0.05 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1aw5 h ALA 275 Cb 0.88 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1aw5 h ALA 275 CO 0.08 0.34 0.00 0.66 0.00 0.00 0.00 179.25 180.33 1aw5 h SER 276 N 0.00 0.00 0.00 0.00 4.64 -0.54 -0.37 113.55 117.28 1aw5 h SER 276 Ca -0.00 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.93 1aw5 h SER 276 Cb 0.52 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.54 1aw5 h SER 276 CO 0.04 0.00 -2.40 -0.62 -0.87 0.00 0.00 176.83 172.98 1aw5 n GLU 277 N -2.97 0.59 -0.08 4.77 -0.58 -0.65 -3.44 120.64 118.28 1aw5 n GLU 277 Ca 0.01 0.17 -0.11 0.00 -0.42 0.00 0.00 57.16 56.82 1aw5 n GLU 277 Cb 0.31 -1.46 -0.04 0.00 -0.57 0.00 0.00 31.44 29.68 1aw5 n GLU 277 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1aw5 h ILE 278 N -0.30 1.19 -1.27 -3.67 2.04 -0.59 -3.20 117.51 111.72 1aw5 h ILE 278 Ca -0.58 -0.61 -0.67 0.00 1.00 0.00 0.00 64.86 64.00 1aw5 h ILE 278 Cb 1.75 1.14 -0.33 0.00 -0.74 0.00 0.00 36.82 38.64 1aw5 h ILE 278 CO -0.19 0.20 0.43 0.00 0.00 0.00 0.00 178.15 178.59 1aw5 h LYS 280 N 2.35 0.62 -0.16 0.00 2.10 -1.57 -1.07 116.57 118.85 1aw5 h LYS 280 Ca 0.52 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 59.13 1aw5 h LYS 280 Cb 0.76 -0.14 0.00 0.00 -0.90 0.00 0.00 32.23 31.95 1aw5 h LYS 280 CO 1.32 0.41 0.00 -0.25 -2.00 0.00 0.00 179.45 178.93 1aw5 n ASP 281 N -4.86 1.20 -4.38 7.07 8.00 -1.26 -4.87 116.55 117.45 1aw5 n ASP 281 Ca 0.21 -1.74 -0.30 0.00 0.71 0.00 0.00 54.79 53.67 1aw5 n ASP 281 Cb 0.55 -0.10 -0.14 0.00 -0.02 0.00 0.00 41.12 41.41 1aw5 n ASP 281 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1aw5 s LEU 282 N -1.39 2.32 0.10 0.64 1.43 -0.41 -5.09 118.68 116.28 1aw5 s LEU 282 Ca 0.26 -0.59 -0.31 0.00 -1.03 0.00 0.00 54.13 52.47 1aw5 s LEU 282 Cb 0.14 -1.33 -0.09 0.00 0.03 0.00 0.00 46.19 44.93 1aw5 s LEU 282 CO 0.20 0.24 1.69 -2.84 0.23 0.00 0.00 176.35 175.87 1aw5 s PRO 283 N -1.50 4.18 0.06 1.29 0.02 -1.26 -4.85 135.00 132.95 1aw5 s PRO 283 Ca 0.13 2.40 -0.09 0.00 0.02 0.00 0.00 61.00 63.46 1aw5 s PRO 283 Cb -0.10 -3.54 -0.06 0.00 0.02 0.00 0.00 34.50 30.83 1aw5 s PRO 283 CO 0.04 -0.75 0.37 0.42 -0.33 0.00 0.00 177.00 176.75 1aw5 s ILE 284 N 2.47 5.14 -0.05 2.83 -1.09 -1.26 -1.65 121.20 127.59 1aw5 s ILE 284 Ca 0.75 0.41 0.03 0.00 -2.23 0.00 0.00 60.65 59.60 1aw5 s ILE 284 Cb -0.42 -3.63 0.01 0.00 -1.58 0.00 0.00 42.46 36.84 1aw5 s ILE 284 CO 0.33 0.32 -0.11 0.00 -1.23 0.00 0.00 174.94 174.25 1aw5 s ALA 286 N 0.42 3.87 -0.31 0.00 0.00 -0.25 -1.77 121.76 123.72 1aw5 s ALA 286 Ca -0.09 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.26 1aw5 s ALA 286 Cb -0.13 -2.03 0.09 0.00 0.00 0.00 0.00 23.12 21.05 1aw5 s ALA 286 CO 0.02 0.71 0.01 -0.47 0.00 0.00 0.00 175.76 176.03 1aw5 s TYR 287 N -1.53 3.37 -0.73 0.00 6.14 -0.86 -0.63 117.35 123.13 1aw5 s TYR 287 Ca 0.36 -2.65 -0.26 0.00 0.64 0.00 0.00 57.07 55.16 1aw5 s TYR 287 Cb -0.13 -2.49 -0.02 0.00 0.42 0.00 0.00 41.96 39.75 1aw5 s TYR 287 CO 0.24 -0.91 1.77 -1.58 0.64 0.00 0.00 175.55 175.70 1aw5 s HIS 288 N 1.04 1.84 0.65 4.97 5.65 0.60 -3.16 115.29 126.89 1aw5 s HIS 288 Ca 0.05 0.52 -0.17 0.00 0.25 0.00 0.00 55.06 55.71 1aw5 s HIS 288 Cb -0.19 -4.20 -0.01 0.00 -1.18 0.00 0.00 32.58 27.01 1aw5 s HIS 288 CO -0.09 -2.11 1.23 0.14 -0.65 0.00 0.00 174.74 173.26 1aw5 s VAL 289 N 8.57 2.39 0.28 0.89 -7.23 -1.26 -4.50 120.40 119.54 1aw5 s VAL 289 Ca 0.62 0.22 0.02 0.00 -1.81 0.00 0.00 61.98 61.03 1aw5 s VAL 289 Cb -0.10 -2.99 0.28 0.00 0.56 0.00 0.00 36.38 34.13 1aw5 s VAL 289 CO 0.13 -0.07 1.69 0.77 -0.31 0.00 0.00 175.10 177.31 1aw5 h SER 290 N 0.43 0.25 0.53 4.85 4.64 -1.92 0.16 113.55 122.49 1aw5 h SER 290 Ca -0.50 0.15 -0.10 0.00 -0.47 0.00 0.00 61.79 60.88 1aw5 h SER 290 Cb 1.31 0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.53 1aw5 h SER 290 CO 0.53 -0.01 -0.46 1.23 -0.87 0.00 0.00 176.83 177.25 1aw5 h GLY 291 N 0.37 0.00 0.78 -0.77 0.00 -1.05 0.30 103.07 102.70 1aw5 h GLY 291 Ca 0.53 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.70 1aw5 h GLY 291 CO -0.53 0.00 -0.61 0.83 0.00 0.00 0.00 176.54 176.23 1aw5 h GLU 292 N 0.00 0.40 -0.33 4.80 5.08 -0.92 -3.24 114.58 120.37 1aw5 h GLU 292 Ca -0.00 -0.44 0.04 0.00 -1.00 0.00 0.00 59.36 57.95 1aw5 h GLU 292 Cb 0.85 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 30.20 1aw5 h GLU 292 CO 0.06 1.11 0.12 -0.92 -1.00 0.00 0.00 179.01 178.38 1aw5 h TYR 293 N -0.12 0.22 0.00 4.33 3.20 -0.89 -0.86 116.97 122.85 1aw5 h TYR 293 Ca -0.08 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1aw5 h TYR 293 Cb 1.33 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.55 1aw5 h TYR 293 CO 0.15 0.10 0.00 0.00 -1.64 0.00 0.00 178.16 176.77 1aw5 n ALA 294 N -2.31 2.33 0.00 1.82 0.00 0.10 -2.19 120.51 120.26 1aw5 n ALA 294 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1aw5 n ALA 294 Cb 0.11 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1aw5 n ALA 294 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1aw5 n LEU 296 N 1.27 0.00 -0.04 0.00 4.77 -0.33 -2.74 117.00 119.94 1aw5 n LEU 296 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 1aw5 n LEU 296 Cb 0.23 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.26 1aw5 n LEU 296 CO 0.00 0.00 0.72 0.45 -1.33 0.00 0.00 177.39 177.23 1aw5 h HIS 297 N 0.00 0.24 0.47 -1.77 3.86 -1.70 -1.44 115.15 114.81 1aw5 h HIS 297 Ca 0.00 -0.05 -0.02 0.00 -1.16 0.00 0.00 60.37 59.15 1aw5 h HIS 297 Cb 0.00 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 1aw5 h HIS 297 CO 0.00 0.49 -0.30 0.00 0.86 0.00 0.00 177.93 178.99 1aw5 h ALA 298 N 0.72 -0.73 -0.99 2.45 0.00 -1.79 -0.88 119.26 118.03 1aw5 h ALA 298 Ca 0.03 -0.14 0.16 0.00 0.00 0.00 0.00 54.91 54.96 1aw5 h ALA 298 Cb 0.40 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 18.47 1aw5 h ALA 298 CO 0.01 -0.93 0.62 0.00 0.00 0.00 0.00 179.25 178.95 1aw5 h ALA 299 N -0.26 1.65 0.62 0.00 0.00 -1.85 -0.23 119.26 119.19 1aw5 h ALA 299 Ca -0.05 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1aw5 h ALA 299 Cb 0.60 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1aw5 h ALA 299 CO 0.05 0.04 -0.30 0.00 0.00 0.00 0.00 179.25 179.04 1aw5 h ALA 300 N 1.60 -0.83 0.00 0.00 0.00 -0.81 0.47 119.26 119.69 1aw5 h ALA 300 Ca 0.53 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1aw5 h ALA 300 Cb 0.74 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1aw5 h ALA 300 CO -0.32 -0.94 -0.06 1.05 0.00 0.00 0.00 179.25 178.98 1aw5 h GLU 301 N -0.87 0.00 -0.18 0.00 4.11 -0.43 0.45 114.58 117.67 1aw5 h GLU 301 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.35 1aw5 h GLU 301 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1aw5 h GLU 301 CO 0.14 0.06 0.00 1.17 0.07 0.00 0.00 179.01 180.45 1aw5 n LYS 302 N -3.96 1.66 -2.44 1.06 4.81 -0.17 -4.90 118.16 114.22 1aw5 n LYS 302 Ca -0.03 -1.00 -0.19 0.00 -0.87 0.00 0.00 58.31 56.23 1aw5 n LYS 302 Cb 0.15 -1.36 -0.00 0.00 0.02 0.00 0.00 35.03 33.84 1aw5 n LYS 302 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1aw5 n GLY 303 N 1.08 -0.40 0.17 3.14 0.00 0.16 -4.87 105.19 104.46 1aw5 n GLY 303 Ca 0.15 -0.08 0.06 0.00 0.00 0.00 0.00 46.02 46.14 1aw5 n GLY 303 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1aw5 h VAL 304 N -0.19 0.56 -2.92 1.61 2.07 -0.26 -3.47 116.25 113.65 1aw5 h VAL 304 Ca -0.45 -1.80 0.05 0.00 0.82 0.00 0.00 66.70 65.33 1aw5 h VAL 304 Cb 1.33 2.27 -0.08 0.00 -1.52 0.00 0.00 31.29 33.29 1aw5 h VAL 304 CO 0.52 0.32 0.26 0.68 0.02 0.00 0.00 177.57 179.37 1aw5 s VAL 305 N -3.05 0.00 -0.40 2.57 -7.23 -1.22 -5.01 120.40 106.07 1aw5 s VAL 305 Ca 0.05 -0.63 -0.15 0.00 -1.81 0.00 0.00 61.98 59.44 1aw5 s VAL 305 Cb 0.07 -1.66 0.01 0.00 0.56 0.00 0.00 36.38 35.37 1aw5 s VAL 305 CO 0.72 0.00 0.31 -0.62 -0.31 0.00 0.00 175.10 175.20 1aw5 s ASP 306 N -2.85 6.11 0.19 4.85 2.15 -1.26 -4.02 116.67 121.84 1aw5 s ASP 306 Ca 0.08 -0.80 -0.18 0.00 0.43 0.00 0.00 52.55 52.08 1aw5 s ASP 306 Cb -0.04 -2.17 0.15 0.00 -0.30 0.00 0.00 42.92 40.56 1aw5 s ASP 306 CO -0.00 -0.44 1.35 -0.11 -0.17 0.00 0.00 175.17 175.81 1aw5 n LEU 307 N 5.21 -0.65 -0.21 -1.34 7.94 -1.26 -0.10 117.00 126.59 1aw5 n LEU 307 Ca -0.11 1.53 0.00 0.00 -1.11 0.00 0.00 56.01 56.32 1aw5 n LEU 307 Cb 0.47 -0.32 0.24 0.00 0.53 0.00 0.00 43.42 44.34 1aw5 n LEU 307 CO 0.41 -1.34 1.21 0.50 -1.11 0.00 0.00 177.39 177.05 1aw5 h LYS 308 N 0.00 0.98 -0.21 1.96 3.64 -1.98 0.18 116.57 121.13 1aw5 h LYS 308 Ca 0.27 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.48 1aw5 h LYS 308 Cb 0.48 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1aw5 h LYS 308 CO -0.86 0.67 -0.22 1.15 -2.27 0.00 0.00 179.45 177.93 1aw5 h THR 309 N 1.00 1.32 0.00 1.00 2.02 -0.93 -2.50 112.91 114.82 1aw5 h THR 309 Ca 0.26 -1.39 0.00 0.00 0.77 0.00 0.00 66.41 66.06 1aw5 h THR 309 Cb -0.06 1.74 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1aw5 h THR 309 CO -0.05 0.43 0.00 -0.29 0.37 0.00 0.00 175.52 175.97 1aw5 h ILE 310 N 0.21 0.00 0.14 3.11 6.09 -0.32 -2.60 117.51 124.13 1aw5 h ILE 310 Ca 0.03 -0.77 -0.30 0.00 -1.37 0.00 0.00 64.86 62.45 1aw5 h ILE 310 Cb 0.77 1.76 0.00 0.00 0.47 0.00 0.00 36.82 39.82 1aw5 h ILE 310 CO 0.05 0.00 -1.45 0.00 -3.07 0.00 0.00 178.15 173.68 1aw5 h ALA 311 N 2.05 0.18 -0.16 0.18 0.00 -0.63 -2.58 119.26 118.29 1aw5 h ALA 311 Ca 0.00 -1.02 -0.21 0.00 0.00 0.00 0.00 54.91 53.68 1aw5 h ALA 311 Cb 0.79 0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.79 1aw5 h ALA 311 CO 0.00 1.05 -0.70 0.74 0.00 0.00 0.00 179.25 180.33 1aw5 h PHE 312 N 0.08 1.03 0.34 0.00 0.04 -1.46 -0.98 116.94 115.99 1aw5 h PHE 312 Ca -0.22 -0.44 -0.02 0.00 2.80 0.00 0.00 57.97 60.10 1aw5 h PHE 312 Cb 2.02 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 40.01 1aw5 h PHE 312 CO 0.07 1.27 -0.16 1.49 -0.60 0.00 0.00 178.31 180.37 1aw5 h GLU 313 N 0.49 -0.44 -0.05 1.51 4.81 -1.57 0.20 114.58 119.54 1aw5 h GLU 313 Ca -0.04 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1aw5 h GLU 313 Cb 1.33 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.81 1aw5 h GLU 313 CO 0.15 -0.27 0.03 0.66 -0.73 0.00 0.00 179.01 178.85 1aw5 h SER 314 N -0.49 0.06 0.94 1.04 4.64 -1.51 -2.34 113.55 115.89 1aw5 h SER 314 Ca -0.05 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.22 1aw5 h SER 314 Cb 0.37 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1aw5 h SER 314 CO 0.08 0.07 -0.09 0.45 -0.87 0.00 0.00 176.83 176.47 1aw5 h HIS 315 N 0.03 0.00 0.00 4.77 3.86 -1.15 -2.42 115.15 120.25 1aw5 h HIS 315 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1aw5 h HIS 315 Cb 0.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.50 1aw5 h HIS 315 CO -0.06 0.09 -0.23 1.96 0.86 0.00 0.00 177.93 180.55 1aw5 h GLN 316 N 0.00 0.00 -0.34 2.45 1.08 -0.28 -3.16 115.11 114.86 1aw5 h GLN 316 Ca -0.00 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.10 1aw5 h GLN 316 Cb 0.58 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.00 1aw5 h GLN 316 CO 0.01 0.00 -0.20 0.78 -0.95 0.00 0.00 178.83 178.47 1aw5 h GLY 317 N 4.13 0.70 0.97 3.46 0.00 -0.92 0.12 103.07 111.53 1aw5 h GLY 317 Ca 0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 46.67 1aw5 h GLY 317 CO 0.00 0.52 -0.12 0.74 0.00 0.00 0.00 176.54 177.68 1aw5 h PHE 318 N 0.57 0.85 -0.53 5.60 0.04 -1.50 0.46 116.94 122.44 1aw5 h PHE 318 Ca 0.09 -0.19 -0.08 0.00 2.80 0.00 0.00 57.97 60.59 1aw5 h PHE 318 Cb 0.66 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.59 1aw5 h PHE 318 CO 0.03 0.90 0.03 -0.07 -0.60 0.00 0.00 178.31 178.60 1aw5 h LEU 319 N 0.55 0.89 -0.44 1.54 4.07 -1.53 0.42 115.31 120.81 1aw5 h LEU 319 Ca 0.09 -0.29 -0.17 0.00 0.08 0.00 0.00 57.88 57.59 1aw5 h LEU 319 Cb 0.64 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 42.14 1aw5 h LEU 319 CO 0.04 0.96 -0.57 -0.09 -1.08 0.00 0.00 178.44 177.70 1aw5 h ARG 320 N 0.79 0.63 0.00 1.13 2.43 -0.70 -2.78 114.38 115.89 1aw5 h ARG 320 Ca 0.15 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 1aw5 h ARG 320 Cb 0.49 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1aw5 h ARG 320 CO 0.02 1.03 0.00 0.00 -1.51 0.00 0.00 179.97 179.51 1aw5 h ALA 321 N 0.88 1.00 0.00 2.80 0.00 -0.76 -3.46 119.26 119.72 1aw5 h ALA 321 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aw5 h ALA 321 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1aw5 h ALA 321 CO 0.11 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.77 1aw5 n GLY 322 N 0.06 0.92 3.79 0.00 0.00 -0.78 -3.24 105.19 105.94 1aw5 n GLY 322 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1aw5 n GLY 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw5 s ALA 323 N -1.35 3.29 -0.65 4.61 0.00 0.14 -4.69 121.76 123.11 1aw5 s ALA 323 Ca 0.00 0.38 0.07 0.00 0.00 0.00 0.00 51.96 52.40 1aw5 s ALA 323 Cb 0.00 -3.04 0.14 0.00 0.00 0.00 0.00 23.12 20.23 1aw5 s ALA 323 CO 0.00 0.24 1.01 2.89 0.00 0.00 0.00 175.76 179.89 1aw5 n ARG 324 N 0.62 1.92 -3.84 0.00 1.85 -0.96 -3.95 116.66 112.30 1aw5 n ARG 324 Ca 0.00 -1.52 -0.12 0.00 -1.00 0.00 0.00 57.85 55.21 1aw5 n ARG 324 Cb 0.50 -1.15 -0.11 0.00 -1.05 0.00 0.00 32.46 30.65 1aw5 n ARG 324 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1aw5 s LEU 325 N -0.85 1.40 -0.03 2.89 1.43 -1.11 -4.94 118.68 117.47 1aw5 s LEU 325 Ca 0.12 0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.30 1aw5 s LEU 325 Cb 0.07 0.67 0.03 0.00 0.03 0.00 0.00 46.19 46.99 1aw5 s LEU 325 CO 0.09 -0.22 0.03 -0.63 0.23 0.00 0.00 176.35 175.86 1aw5 s ILE 326 N -0.64 -0.01 -0.40 -0.59 1.01 -1.26 -1.09 121.20 118.22 1aw5 s ILE 326 Ca -0.07 0.26 -0.19 0.00 0.00 0.00 0.00 60.65 60.65 1aw5 s ILE 326 Cb -0.04 -0.17 0.01 0.00 0.01 0.00 0.00 42.46 42.27 1aw5 s ILE 326 CO 0.01 0.14 0.58 -0.63 0.00 0.00 0.00 174.94 175.04 1aw5 s ILE 327 N 1.51 4.92 0.04 2.92 1.01 0.20 -0.67 121.20 131.14 1aw5 s ILE 327 Ca -0.03 0.17 -0.09 0.00 0.00 0.00 0.00 60.65 60.70 1aw5 s ILE 327 Cb -0.13 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.25 1aw5 s ILE 327 CO -0.03 -0.43 0.18 0.28 0.00 0.00 0.00 174.94 174.94 1aw5 s THR 328 N 2.59 0.12 -2.27 2.92 -1.32 -0.89 -0.29 115.64 116.50 1aw5 s THR 328 Ca 0.20 -0.95 0.27 0.00 -1.21 0.00 0.00 61.69 60.00 1aw5 s THR 328 Cb -0.15 -0.96 0.63 0.00 -1.51 0.00 0.00 72.50 70.52 1aw5 s THR 328 CO 0.16 -0.53 1.85 -1.22 -2.21 0.00 0.00 174.62 172.67 1aw5 n TYR 329 N 0.61 0.04 -0.50 9.09 4.01 -1.26 -3.54 117.16 125.61 1aw5 n TYR 329 Ca -0.18 -0.02 0.10 0.00 -0.16 0.00 0.00 57.90 57.64 1aw5 n TYR 329 Cb 0.59 0.00 0.32 0.00 -0.31 0.00 0.00 39.34 39.94 1aw5 n TYR 329 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1aw5 n LEU 330 N -0.23 4.26 -0.10 7.72 4.77 -1.26 -4.54 117.00 127.61 1aw5 n LEU 330 Ca 0.19 -2.25 -0.09 0.00 -0.03 0.00 0.00 56.01 53.83 1aw5 n LEU 330 Cb 0.25 -0.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.81 1aw5 n LEU 330 CO 0.16 0.87 0.93 0.00 -1.33 0.00 0.00 177.39 178.02 1aw5 h ALA 331 N 3.88 0.41 -0.46 -1.18 0.00 -1.93 -0.63 119.26 119.35 1aw5 h ALA 331 Ca 0.00 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 54.91 1aw5 h ALA 331 Cb 1.21 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.78 1aw5 h ALA 331 CO 0.12 -0.04 -0.23 -1.35 0.00 0.00 0.00 179.25 177.74 1aw5 h PRO 332 N 0.38 -0.13 0.51 0.00 0.11 -1.90 0.22 132.00 131.18 1aw5 h PRO 332 Ca 0.11 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 1aw5 h PRO 332 Cb 0.10 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.24 1aw5 h PRO 332 CO -0.01 -0.09 -0.30 0.93 -0.21 0.00 0.00 178.00 178.32 1aw5 h GLU 333 N -0.14 -0.73 -0.87 1.05 3.07 -1.84 -2.88 114.58 112.25 1aw5 h GLU 333 Ca 0.21 0.05 0.16 0.00 -0.50 0.00 0.00 59.36 59.28 1aw5 h GLU 333 Cb 0.48 0.17 -0.07 0.00 -0.84 0.00 0.00 28.75 28.48 1aw5 h GLU 333 CO -0.54 -0.49 0.56 0.74 -1.40 0.00 0.00 179.01 177.88 1aw5 h PHE 334 N -0.76 0.69 0.00 4.33 0.04 -0.68 0.46 116.94 121.03 1aw5 h PHE 334 Ca -0.06 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1aw5 h PHE 334 Cb 0.61 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 38.54 1aw5 h PHE 334 CO -0.08 0.24 0.00 -0.07 -0.60 0.00 0.00 178.31 177.80 1aw5 h LEU 335 N 0.57 0.00 0.00 1.54 3.38 -0.35 0.12 115.31 120.56 1aw5 h LEU 335 Ca 0.44 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.40 1aw5 h LEU 335 Cb 0.85 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1aw5 h LEU 335 CO -0.19 0.00 -0.56 0.47 0.09 0.00 0.00 178.44 178.25 1aw5 n ASP 336 N -2.60 1.82 -0.32 -0.43 8.00 0.15 -4.22 116.55 118.94 1aw5 n ASP 336 Ca -0.00 0.61 0.06 0.00 0.71 0.00 0.00 54.79 56.17 1aw5 n ASP 336 Cb 0.15 -0.86 0.22 0.00 -0.02 0.00 0.00 41.12 40.61 1aw5 n ASP 336 CO 0.00 0.00 0.00 -0.50 -0.39 0.00 0.00 177.20 176.31 1aw5 h TRP 337 N -1.00 0.93 0.00 1.24 6.55 -0.94 0.88 115.95 123.61 1aw5 h TRP 337 Ca -0.01 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.87 1aw5 h TRP 337 Cb 0.56 -0.28 0.00 0.00 -0.86 0.00 0.00 29.16 28.58 1aw5 h TRP 337 CO -0.23 0.32 0.00 -0.07 -1.05 0.00 0.00 178.44 177.40 1aw5 h LEU 338 N 0.80 0.00 -0.87 -4.49 3.38 -0.99 -2.17 115.31 110.97 1aw5 h LEU 338 Ca 0.46 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.33 1aw5 h LEU 338 Cb 0.54 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1aw5 h LEU 338 CO -0.30 0.00 -0.25 0.44 0.09 0.00 0.00 178.44 178.42 1aw5 h ASP 339 N 0.00 0.56 0.00 -0.43 3.32 -0.99 -3.51 116.42 115.37 1aw5 h ASP 339 Ca 0.00 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1aw5 h ASP 339 Cb 0.40 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1aw5 h ASP 339 CO 0.00 0.80 0.00 -0.62 -1.72 0.00 0.00 179.24 177.70