#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ow2 s HIS 5 N 0.00 1.69 0.25 4.31 -3.43 -1.26 -0.96 115.29 115.88 1ow2 s HIS 5 Ca 0.00 -1.63 0.11 0.00 -0.80 0.00 0.00 55.06 52.74 1ow2 s HIS 5 Cb 0.00 -0.63 -0.05 0.00 -1.43 0.00 0.00 32.58 30.47 1ow2 s HIS 5 CO 0.00 -0.92 -0.19 0.14 -2.00 0.00 0.00 174.74 171.77 1ow2 s VAL 6 N -3.36 2.29 -0.32 -5.38 -7.23 0.70 -4.54 120.40 102.56 1ow2 s VAL 6 Ca 0.39 -2.29 -0.11 0.00 -1.81 0.00 0.00 61.98 58.17 1ow2 s VAL 6 Cb 0.02 -2.20 -0.01 0.00 0.56 0.00 0.00 36.38 34.75 1ow2 s VAL 6 CO 0.27 -0.39 0.18 -0.63 -0.31 0.00 0.00 175.10 174.23 1ow2 s ILE 7 N -2.44 4.82 0.35 -0.62 -1.09 -1.26 -2.42 121.20 118.54 1ow2 s ILE 7 Ca 0.26 -0.37 -0.26 0.00 -2.23 0.00 0.00 60.65 58.05 1ow2 s ILE 7 Cb -0.05 -3.48 -0.09 0.00 -1.58 0.00 0.00 42.46 37.26 1ow2 s ILE 7 CO 0.12 0.03 1.03 -0.76 -1.23 0.00 0.00 174.94 174.13 1ow2 s LEU 8 N 1.65 4.30 0.04 2.97 1.43 -0.80 0.78 118.68 129.05 1ow2 s LEU 8 Ca 0.05 2.02 0.06 0.00 -1.03 0.00 0.00 54.13 55.24 1ow2 s LEU 8 Cb -0.17 -4.00 -0.02 0.00 0.03 0.00 0.00 46.19 42.02 1ow2 s LEU 8 CO 0.08 -0.28 -0.18 -0.76 0.23 0.00 0.00 176.35 175.44 1ow2 s LEU 9 N -2.18 2.17 0.00 1.79 1.43 -0.65 -1.68 118.68 119.56 1ow2 s LEU 9 Ca 0.52 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 53.13 1ow2 s LEU 9 Cb -0.23 -0.82 0.00 0.00 0.03 0.00 0.00 46.19 45.17 1ow2 s LEU 9 CO 0.29 0.11 0.00 -0.46 0.23 0.00 0.00 176.35 176.52 1ow2 n ASN 10 N 1.87 0.00 -0.07 2.29 2.04 0.10 -4.54 115.26 116.95 1ow2 n ASN 10 Ca -0.17 -0.75 -0.09 0.00 -0.44 0.00 0.00 54.58 53.13 1ow2 n ASN 10 Cb 0.54 0.00 -0.02 0.00 -2.53 0.00 0.00 39.78 37.76 1ow2 n ASN 10 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ow2 h ALA 11 N -1.91 -0.24 -2.20 -2.53 0.00 -1.99 -3.39 119.26 107.00 1ow2 h ALA 11 Ca 0.00 0.07 -0.49 0.00 0.00 0.00 0.00 54.91 54.49 1ow2 h ALA 11 Cb 0.00 0.65 0.21 0.00 0.00 0.00 0.00 17.79 18.65 1ow2 h ALA 11 CO 0.00 -0.74 0.07 1.04 0.00 0.00 0.00 179.25 179.62 1ow2 n GLN 12 N -5.41 -1.19 -1.09 0.00 6.02 -1.26 -4.80 117.38 109.65 1ow2 n GLN 12 Ca -0.01 -0.30 -0.17 0.00 -0.01 0.00 0.00 57.00 56.51 1ow2 n GLN 12 Cb 0.33 -2.27 -0.14 0.00 1.02 0.00 0.00 30.24 29.18 1ow2 n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ow2 n GLY 13 N 0.62 3.29 3.42 1.08 0.00 -1.26 -4.87 105.19 107.48 1ow2 n GLY 13 Ca 0.08 -1.30 -0.33 0.00 0.00 0.00 0.00 46.02 44.47 1ow2 n GLY 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ow2 s VAL 14 N 1.00 3.47 0.37 1.61 1.01 -1.26 -4.85 120.40 121.75 1ow2 s VAL 14 Ca 0.67 -0.50 -0.28 0.00 0.00 0.00 0.00 61.98 61.86 1ow2 s VAL 14 Cb 0.30 -2.50 -0.11 0.00 0.00 0.00 0.00 36.38 34.06 1ow2 s VAL 14 CO -0.02 0.50 1.47 -2.65 0.00 0.00 0.00 175.10 174.40 1ow2 n PRO 15 N 3.67 2.62 0.00 2.72 -0.02 -1.26 0.03 135.00 142.76 1ow2 n PRO 15 Ca -0.18 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1ow2 n PRO 15 Cb 0.52 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1ow2 n PRO 15 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1ow2 n THR 16 N 0.46 0.00 -2.04 3.45 -2.24 -0.67 -4.85 114.28 108.39 1ow2 n THR 16 Ca 0.02 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1ow2 n THR 16 Cb 0.38 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 1ow2 n THR 16 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ow2 n GLY 17 N 0.43 0.04 3.25 3.38 0.00 -1.25 -5.02 105.19 106.00 1ow2 n GLY 17 Ca 0.00 -1.34 -0.14 0.00 0.00 0.00 0.00 46.02 44.54 1ow2 n GLY 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ow2 s THR 18 N -3.19 0.87 -0.15 2.61 -4.23 -1.26 -1.91 115.64 108.38 1ow2 s THR 18 Ca 0.00 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.43 1ow2 s THR 18 Cb 0.00 -2.02 0.06 0.00 1.34 0.00 0.00 72.50 71.87 1ow2 s THR 18 CO 0.00 -0.58 0.35 -0.22 -0.54 0.00 0.00 174.62 173.64 1ow2 s LEU 19 N -3.18 0.03 0.13 4.79 0.20 -1.01 -4.92 118.68 114.71 1ow2 s LEU 19 Ca 0.21 0.77 -0.35 0.00 0.69 0.00 0.00 54.13 55.46 1ow2 s LEU 19 Cb 0.05 1.13 -0.16 0.00 -0.43 0.00 0.00 46.19 46.78 1ow2 s LEU 19 CO 0.03 -0.19 1.27 1.21 -0.29 0.00 0.00 176.35 178.38 1ow2 n GLU 20 N 4.35 1.21 0.01 1.98 0.00 -1.26 -0.22 120.64 126.71 1ow2 n GLU 20 Ca -0.23 0.43 -0.11 0.00 0.00 0.00 0.00 57.16 57.26 1ow2 n GLU 20 Cb 0.54 -2.01 -0.04 0.00 0.00 0.00 0.00 31.44 29.92 1ow2 n GLU 20 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 1ow2 h LYS 21 N 4.06 -0.39 0.41 5.31 3.64 -1.29 0.29 116.57 128.60 1ow2 h LYS 21 Ca -0.46 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.94 1ow2 h LYS 21 Cb 1.34 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 33.22 1ow2 h LYS 21 CO 0.75 -0.26 -0.39 -0.92 -2.27 0.00 0.00 179.45 176.35 1ow2 h TYR 22 N -0.40 -1.06 -0.65 1.91 3.20 -1.90 -1.67 116.97 116.39 1ow2 h TYR 22 Ca 0.09 0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.11 1ow2 h TYR 22 Cb 0.55 0.41 -0.04 0.00 1.54 0.00 0.00 36.73 39.19 1ow2 h TYR 22 CO -0.40 -0.55 0.45 0.00 -1.64 0.00 0.00 178.16 176.02 1ow2 h ALA 23 N -0.44 2.23 0.00 1.82 0.00 -1.89 -0.68 119.26 120.31 1ow2 h ALA 23 Ca -0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ow2 h ALA 23 Cb 0.72 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1ow2 h ALA 23 CO -0.05 -0.41 -0.01 0.00 0.00 0.00 0.00 179.25 178.79 1ow2 h ALA 24 N 1.68 1.00 -3.03 0.00 0.00 0.01 -3.40 119.26 115.53 1ow2 h ALA 24 Ca 0.31 -0.01 -0.70 0.00 0.00 0.00 0.00 54.91 54.51 1ow2 h ALA 24 Cb 0.85 -0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.33 1ow2 h ALA 24 CO -0.07 0.01 -0.53 -1.01 0.00 0.00 0.00 179.25 177.65 1ow2 s HIS 25 N -3.71 3.42 0.00 0.00 3.76 -0.26 -4.41 115.29 114.08 1ow2 s HIS 25 Ca 0.01 -1.92 0.00 0.00 -0.15 0.00 0.00 55.06 53.00 1ow2 s HIS 25 Cb 0.09 -2.93 0.00 0.00 1.11 0.00 0.00 32.58 30.85 1ow2 s HIS 25 CO 0.54 -0.89 0.00 0.25 -0.85 0.00 0.00 174.74 173.78 1ow2 n THR 26 N 4.75 0.00 1.09 1.30 -2.24 -1.26 -4.87 114.28 113.04 1ow2 n THR 26 Ca -0.08 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.83 1ow2 n THR 26 Cb 0.42 0.00 0.39 0.00 -2.10 0.00 0.00 70.33 69.05 1ow2 n THR 26 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ow2 n ALA 27 N -3.00 3.13 -1.88 6.98 0.00 -1.26 0.82 120.51 125.29 1ow2 n ALA 27 Ca 0.00 -0.29 -0.16 0.00 0.00 0.00 0.00 53.44 52.98 1ow2 n ALA 27 Cb 0.00 -1.22 0.07 0.00 0.00 0.00 0.00 19.45 18.30 1ow2 n ALA 27 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ow2 n ASP 28 N -1.31 4.12 -4.69 0.00 8.00 -1.26 -4.69 116.55 116.72 1ow2 n ASP 28 Ca 0.08 -3.79 -0.44 0.00 0.71 0.00 0.00 54.79 51.35 1ow2 n ASP 28 Cb 0.33 -0.41 -0.03 0.00 -0.02 0.00 0.00 41.12 40.98 1ow2 n ASP 28 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1ow2 n THR 29 N -0.83 0.28 -2.62 -3.53 -1.04 -1.26 -4.98 114.28 100.31 1ow2 n THR 29 Ca 0.38 -0.05 -0.32 0.00 -2.04 0.00 0.00 64.05 62.02 1ow2 n THR 29 Cb 0.89 -1.96 -0.04 0.00 -1.82 0.00 0.00 70.33 67.40 1ow2 n THR 29 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1ow2 s ARG 30 N 2.37 4.00 0.14 -2.82 0.52 -1.26 -4.70 118.95 117.20 1ow2 s ARG 30 Ca 0.82 0.90 -0.34 0.00 -0.52 0.00 0.00 55.73 56.59 1ow2 s ARG 30 Cb -0.55 -2.21 -0.14 0.00 0.52 0.00 0.00 34.95 32.57 1ow2 s ARG 30 CO 0.39 -0.15 1.55 -0.11 0.02 0.00 0.00 175.30 177.00 1ow2 n LEU 31 N -1.22 2.88 -4.10 2.53 7.94 -1.26 -4.65 117.00 119.13 1ow2 n LEU 31 Ca 0.06 1.09 -0.11 0.00 -1.11 0.00 0.00 56.01 55.94 1ow2 n LEU 31 Cb 0.54 -1.39 -0.08 0.00 0.53 0.00 0.00 43.42 43.02 1ow2 n LEU 31 CO 0.44 -0.40 -0.06 -1.38 -1.11 0.00 0.00 177.39 174.88 1ow2 s HIS 32 N 0.95 0.77 0.26 1.96 -3.43 -0.60 -1.63 115.29 113.57 1ow2 s HIS 32 Ca 0.80 -1.07 -0.22 0.00 -0.80 0.00 0.00 55.06 53.77 1ow2 s HIS 32 Cb -0.72 -0.22 -0.09 0.00 -1.43 0.00 0.00 32.58 30.12 1ow2 s HIS 32 CO 0.40 -0.78 0.80 -1.17 -2.00 0.00 0.00 174.74 171.99 1ow2 s LEU 33 N -3.08 4.35 0.00 5.38 2.96 0.23 -1.48 118.68 127.04 1ow2 s LEU 33 Ca 0.30 1.57 -0.03 0.00 -0.22 0.00 0.00 54.13 55.75 1ow2 s LEU 33 Cb 0.04 -3.73 0.01 0.00 0.50 0.00 0.00 46.19 43.01 1ow2 s LEU 33 CO 0.09 0.00 0.41 0.00 -1.32 0.00 0.00 176.35 175.54 1ow2 n ALA 34 N 0.69 -0.41 -2.62 5.97 0.00 0.16 -4.35 120.51 119.95 1ow2 n ALA 34 Ca -0.01 -1.24 -0.09 0.00 0.00 0.00 0.00 53.44 52.10 1ow2 n ALA 34 Cb 0.51 1.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.88 1ow2 n ALA 34 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1ow2 s PHE 35 N -3.41 0.28 -0.00 0.00 -0.12 0.37 -3.77 117.98 111.32 1ow2 s PHE 35 Ca 0.22 -0.68 0.01 0.00 -0.05 0.00 0.00 56.93 56.43 1ow2 s PHE 35 Cb -0.01 -0.07 -0.00 0.00 -0.63 0.00 0.00 43.02 42.31 1ow2 s PHE 35 CO 0.15 -0.62 -0.03 0.45 -0.05 0.00 0.00 175.22 175.12 1ow2 s SER 36 N -2.91 0.37 -0.02 1.98 0.15 -1.11 -1.86 113.70 110.30 1ow2 s SER 36 Ca 0.11 -0.05 0.03 0.00 0.70 0.00 0.00 55.95 56.73 1ow2 s SER 36 Cb 0.04 -0.06 -0.00 0.00 -1.71 0.00 0.00 66.02 64.30 1ow2 s SER 36 CO -0.06 0.03 -0.09 -0.55 1.20 0.00 0.00 173.24 173.77 1ow2 s SER 37 N 0.01 1.13 -0.26 5.45 0.15 0.05 0.45 113.70 120.67 1ow2 s SER 37 Ca 0.00 -0.17 -0.08 0.00 0.70 0.00 0.00 55.95 56.40 1ow2 s SER 37 Cb -0.02 -0.24 -0.03 0.00 -1.71 0.00 0.00 66.02 64.03 1ow2 s SER 37 CO -0.00 0.08 0.09 0.26 1.20 0.00 0.00 173.24 174.87 1ow2 s TRP 38 N 0.04 3.11 -0.13 3.44 0.52 0.08 -2.01 118.94 124.00 1ow2 s TRP 38 Ca -0.00 -0.42 -0.06 0.00 0.02 0.00 0.00 56.10 55.63 1ow2 s TRP 38 Cb -0.07 -2.27 -0.04 0.00 -1.15 0.00 0.00 33.47 29.95 1ow2 s TRP 38 CO 0.00 -0.37 0.09 -0.51 0.02 0.00 0.00 176.95 176.19 1ow2 s LEU 39 N 1.62 4.08 0.00 2.99 1.43 -1.26 -1.98 118.68 125.56 1ow2 s LEU 39 Ca 0.06 0.31 0.07 0.00 -1.03 0.00 0.00 54.13 53.54 1ow2 s LEU 39 Cb -0.16 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.06 1ow2 s LEU 39 CO 0.05 0.35 -0.22 -0.36 0.23 0.00 0.00 176.35 176.40 1ow2 s PHE 40 N -0.68 1.96 0.82 0.29 0.40 -0.59 -0.83 117.98 119.35 1ow2 s PHE 40 Ca 0.12 -0.38 -0.06 0.00 -0.60 0.00 0.00 56.93 56.02 1ow2 s PHE 40 Cb -0.12 -1.23 0.17 0.00 0.51 0.00 0.00 43.02 42.35 1ow2 s PHE 40 CO 0.02 0.02 1.13 0.54 0.70 0.00 0.00 175.22 177.63 1ow2 s ASN 41 N -0.76 3.78 0.33 1.36 2.20 0.38 -1.42 114.94 120.82 1ow2 s ASN 41 Ca 0.09 -0.26 0.09 0.00 -0.94 0.00 0.00 52.86 51.83 1ow2 s ASN 41 Cb -0.09 0.08 0.83 0.00 -2.00 0.00 0.00 41.25 40.07 1ow2 s ASN 41 CO 0.00 -2.26 1.79 0.00 -2.94 0.00 0.00 177.10 173.70 1ow2 h ALA 42 N -0.96 1.82 0.00 3.54 0.00 -1.84 0.42 119.26 122.23 1ow2 h ALA 42 Ca -0.38 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ow2 h ALA 42 Cb 1.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1ow2 h ALA 42 CO 0.36 -0.17 0.00 0.87 0.00 0.00 0.00 179.25 180.31 1ow2 h LYS 43 N 0.68 0.00 0.00 0.00 1.57 -1.88 -1.02 116.57 115.91 1ow2 h LYS 43 Ca 0.56 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.34 1ow2 h LYS 43 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1ow2 h LYS 43 CO -0.33 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 178.96 1ow2 n GLY 44 N -0.37 0.58 3.77 3.86 0.00 0.15 -4.04 105.19 109.13 1ow2 n GLY 44 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1ow2 n GLY 44 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ow2 s GLN 45 N -0.87 4.44 0.04 1.61 -0.21 -1.26 -4.15 119.66 119.26 1ow2 s GLN 45 Ca 0.00 1.75 -0.26 0.00 0.02 0.00 0.00 55.36 56.87 1ow2 s GLN 45 Cb 0.00 -2.96 -0.05 0.00 1.00 0.00 0.00 33.01 31.00 1ow2 s GLN 45 CO 0.00 0.05 0.80 -1.17 -2.12 0.00 0.00 175.29 172.84 1ow2 s LEU 46 N -1.88 4.43 -0.17 2.90 2.96 -0.35 -0.47 118.68 126.10 1ow2 s LEU 46 Ca 0.49 1.47 -0.29 0.00 -0.22 0.00 0.00 54.13 55.59 1ow2 s LEU 46 Cb -0.30 -3.28 -0.00 0.00 0.50 0.00 0.00 46.19 43.11 1ow2 s LEU 46 CO 0.38 -0.03 1.03 -0.22 -1.32 0.00 0.00 176.35 176.19 1ow2 s LEU 47 N 0.13 4.17 -0.01 -0.68 2.96 -0.01 -1.48 118.68 123.76 1ow2 s LEU 47 Ca 0.40 1.46 0.02 0.00 -0.22 0.00 0.00 54.13 55.80 1ow2 s LEU 47 Cb -0.21 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.90 1ow2 s LEU 47 CO 0.24 -0.58 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.95 1ow2 s VAL 48 N 2.69 3.78 0.23 1.68 1.01 0.63 -3.15 120.40 127.26 1ow2 s VAL 48 Ca 0.46 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.86 1ow2 s VAL 48 Cb -0.17 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 1ow2 s VAL 48 CO 0.12 0.43 -0.14 0.42 0.00 0.00 0.00 175.10 175.93 1ow2 s THR 49 N -0.98 1.84 -0.28 3.92 -4.23 -0.72 -0.74 115.64 114.45 1ow2 s THR 49 Ca 0.17 -2.23 -0.02 0.00 -1.18 0.00 0.00 61.69 58.43 1ow2 s THR 49 Cb -0.11 -2.14 0.04 0.00 1.34 0.00 0.00 72.50 71.63 1ow2 s THR 49 CO 0.07 -0.53 -0.02 -0.60 -0.54 0.00 0.00 174.62 173.00 1ow2 s ARG 50 N -3.63 2.59 0.33 3.99 3.52 0.24 0.13 118.95 126.11 1ow2 s ARG 50 Ca 0.25 -1.15 -0.28 0.00 -0.13 0.00 0.00 55.73 54.42 1ow2 s ARG 50 Cb -0.01 -3.11 -0.13 0.00 -1.56 0.00 0.00 34.95 30.15 1ow2 s ARG 50 CO 0.09 -0.53 1.16 0.54 -0.81 0.00 0.00 175.30 175.75 1ow2 n ARG 51 N 4.64 1.78 -0.92 5.12 1.74 -0.53 0.36 116.66 128.85 1ow2 n ARG 51 Ca -0.14 0.62 -0.32 0.00 -0.77 0.00 0.00 57.85 57.24 1ow2 n ARG 51 Cb 0.45 -2.13 0.14 0.00 -1.02 0.00 0.00 32.46 29.89 1ow2 n ARG 51 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ow2 s ALA 52 N -1.10 1.71 -0.05 7.54 0.00 -0.40 -0.41 121.76 129.04 1ow2 s ALA 52 Ca 0.57 0.60 0.30 0.00 0.00 0.00 0.00 51.96 53.44 1ow2 s ALA 52 Cb -0.61 -3.43 1.36 0.00 0.00 0.00 0.00 23.12 20.44 1ow2 s ALA 52 CO 0.61 -2.45 1.91 -0.07 0.00 0.00 0.00 175.76 175.75 1ow2 h LEU 53 N -1.47 0.00 -0.62 0.00 3.38 -1.91 -2.54 115.31 112.15 1ow2 h LEU 53 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1ow2 h LEU 53 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1ow2 h LEU 53 CO 0.44 0.00 -0.37 -1.54 0.09 0.00 0.00 178.44 177.07 1ow2 n SER 54 N -2.70 1.34 -4.76 -0.43 3.41 -1.26 -4.75 113.62 104.46 1ow2 n SER 54 Ca 0.00 -1.08 -0.41 0.00 -0.26 0.00 0.00 58.87 57.12 1ow2 n SER 54 Cb 0.22 0.28 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 1ow2 n SER 54 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ow2 n LYS 55 N -0.51 2.66 -0.00 4.33 4.76 -0.98 -4.91 118.16 123.51 1ow2 n LYS 55 Ca 0.11 0.94 -0.04 0.00 -2.87 0.00 0.00 58.31 56.44 1ow2 n LYS 55 Cb 0.39 -2.68 0.18 0.00 -1.84 0.00 0.00 35.03 31.08 1ow2 n LYS 55 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1ow2 h LYS 56 N 3.54 0.53 -5.91 1.97 3.64 -1.91 -3.35 116.57 115.09 1ow2 h LYS 56 Ca -0.49 -0.20 -0.68 0.00 -1.27 0.00 0.00 60.65 58.00 1ow2 h LYS 56 Cb 1.24 -0.03 -0.29 0.00 -0.41 0.00 0.00 32.23 32.74 1ow2 h LYS 56 CO 0.69 0.74 -0.83 0.00 -2.27 0.00 0.00 179.45 177.78 1ow2 s ALA 57 N -4.51 2.38 -1.41 5.00 0.00 -1.26 -4.72 121.76 117.24 1ow2 s ALA 57 Ca -0.07 -0.99 -0.09 0.00 0.00 0.00 0.00 51.96 50.80 1ow2 s ALA 57 Cb 0.14 -0.87 0.01 0.00 0.00 0.00 0.00 23.12 22.40 1ow2 s ALA 57 CO 0.80 0.41 0.31 0.91 0.00 0.00 0.00 175.76 178.19 1ow2 n TRP 58 N 2.95 -1.43 -1.89 0.00 8.01 -1.26 -4.91 117.44 118.90 1ow2 n TRP 58 Ca -0.18 0.51 -0.38 0.00 -1.31 0.00 0.00 57.50 56.15 1ow2 n TRP 58 Cb 0.52 -3.08 0.03 0.00 -2.01 0.00 0.00 31.31 26.78 1ow2 n TRP 58 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.69 175.43 1ow2 s PRO 59 N -7.09 3.17 -1.70 -0.99 0.04 -1.26 -2.85 135.00 124.32 1ow2 s PRO 59 Ca 0.14 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1ow2 s PRO 59 Cb -0.07 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.26 1ow2 s PRO 59 CO 0.96 -1.12 0.00 0.41 0.04 0.00 0.00 177.00 177.29 1ow2 n GLY 60 N 0.67 1.59 3.87 0.56 0.00 0.45 -4.90 105.19 107.42 1ow2 n GLY 60 Ca 0.11 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 1ow2 n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ow2 s VAL 61 N -2.52 5.43 0.18 1.61 1.01 -1.13 -4.79 120.40 120.19 1ow2 s VAL 61 Ca 0.00 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.86 1ow2 s VAL 61 Cb 0.00 -3.36 -0.08 0.00 0.00 0.00 0.00 36.38 32.94 1ow2 s VAL 61 CO 0.00 0.61 1.06 0.26 0.00 0.00 0.00 175.10 177.03 1ow2 s TRP 62 N -1.03 3.67 0.10 5.22 0.52 -1.26 -1.45 118.94 124.72 1ow2 s TRP 62 Ca 0.15 1.68 -0.02 0.00 0.02 0.00 0.00 56.10 57.93 1ow2 s TRP 62 Cb -0.12 -3.20 0.01 0.00 -1.15 0.00 0.00 33.47 29.00 1ow2 s TRP 62 CO 0.04 -0.34 0.17 -2.37 0.02 0.00 0.00 176.95 174.47 1ow2 n THR 63 N 2.27 0.00 -1.74 2.01 5.66 0.12 -1.20 114.28 121.39 1ow2 n THR 63 Ca 0.02 -0.40 -0.30 0.00 -3.05 0.00 0.00 64.05 60.32 1ow2 n THR 63 Cb 0.47 0.29 0.18 0.00 -1.55 0.00 0.00 70.33 69.72 1ow2 n THR 63 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1ow2 s ASN 64 N -1.59 2.86 0.19 1.09 2.20 -1.26 -1.76 114.94 116.67 1ow2 s ASN 64 Ca 0.06 0.43 -0.12 0.00 -0.94 0.00 0.00 52.86 52.30 1ow2 s ASN 64 Cb -0.01 -0.58 0.20 0.00 -2.00 0.00 0.00 41.25 38.86 1ow2 s ASN 64 CO 0.05 -2.91 1.75 0.28 -2.94 0.00 0.00 177.10 173.34 1ow2 h SER 65 N -1.76 0.24 -5.00 3.54 0.02 -1.52 -3.37 113.55 105.70 1ow2 h SER 65 Ca -0.45 0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 60.50 1ow2 h SER 65 Cb 1.26 0.03 -0.19 0.00 0.14 0.00 0.00 62.40 63.65 1ow2 h SER 65 CO 0.41 0.16 0.14 0.54 -1.14 0.00 0.00 176.83 176.94 1ow2 s VAL 66 N -6.12 0.01 0.08 2.27 0.11 -0.85 -4.73 120.40 111.17 1ow2 s VAL 66 Ca -0.13 -0.06 -0.17 0.00 -2.93 0.00 0.00 61.98 58.69 1ow2 s VAL 66 Cb 0.15 -0.96 0.04 0.00 -1.53 0.00 0.00 36.38 34.08 1ow2 s VAL 66 CO 0.74 -0.03 0.41 0.00 -3.33 0.00 0.00 175.10 172.88 1ow2 s ALA 67 N -1.43 -0.97 0.00 1.54 0.00 -1.26 -0.77 121.76 118.86 1ow2 s ALA 67 Ca -0.10 0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.01 1ow2 s ALA 67 Cb -0.01 0.50 0.00 0.00 0.00 0.00 0.00 23.12 23.61 1ow2 s ALA 67 CO 0.07 -0.54 0.00 0.41 0.00 0.00 0.00 175.76 175.71 1ow2 n GLY 68 N 0.19 -0.81 2.95 0.00 0.00 -0.77 -5.00 105.19 101.74 1ow2 n GLY 68 Ca -0.17 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.87 1ow2 n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ow2 s HIS 69 N -3.00 2.34 0.55 1.61 3.76 -1.26 -0.48 115.29 118.81 1ow2 s HIS 69 Ca 0.00 -1.65 -0.22 0.00 -0.15 0.00 0.00 55.06 53.04 1ow2 s HIS 69 Cb 0.00 -1.57 -0.05 0.00 1.11 0.00 0.00 32.58 32.07 1ow2 s HIS 69 CO 0.00 -0.75 1.37 -2.14 -0.85 0.00 0.00 174.74 172.37 1ow2 s PRO 70 N 1.42 3.13 0.45 8.40 0.02 -1.26 -4.98 135.00 142.18 1ow2 s PRO 70 Ca -0.04 2.27 0.08 0.00 0.02 0.00 0.00 61.00 63.32 1ow2 s PRO 70 Cb -0.18 -2.27 0.00 0.00 0.02 0.00 0.00 34.50 32.08 1ow2 s PRO 70 CO -0.07 -1.20 0.44 -0.65 -0.33 0.00 0.00 177.00 175.19 1ow2 s GLN 71 N -2.90 2.51 0.17 5.54 -1.52 -1.26 -4.39 119.66 117.81 1ow2 s GLN 71 Ca 0.71 -1.58 -0.34 0.00 -1.95 0.00 0.00 55.36 52.21 1ow2 s GLN 71 Cb -0.41 -2.41 -0.14 0.00 -0.22 0.00 0.00 33.01 29.83 1ow2 s GLN 71 CO 0.49 -0.32 1.49 -0.11 -0.25 0.00 0.00 175.29 176.58 1ow2 n LEU 72 N -1.68 2.85 0.00 2.90 7.94 -1.26 -0.81 117.00 126.94 1ow2 n LEU 72 Ca 0.04 1.10 0.00 0.00 -1.11 0.00 0.00 56.01 56.05 1ow2 n LEU 72 Cb 0.62 -1.39 0.00 0.00 0.53 0.00 0.00 43.42 43.18 1ow2 n LEU 72 CO 0.41 -0.47 0.00 0.61 -1.11 0.00 0.00 177.39 176.83 1ow2 n GLY 73 N 2.94 0.65 3.81 -3.96 0.00 -1.26 -5.02 105.19 102.36 1ow2 n GLY 73 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1ow2 n GLY 73 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ow2 s GLU 74 N -0.27 3.22 0.52 1.61 2.12 0.01 -5.08 118.70 120.84 1ow2 s GLU 74 Ca 0.00 -0.35 -0.13 0.00 0.36 0.00 0.00 54.97 54.85 1ow2 s GLU 74 Cb 0.00 -2.98 -0.06 0.00 0.26 0.00 0.00 34.13 31.35 1ow2 s GLU 74 CO 0.00 0.70 0.95 -1.54 -0.54 0.00 0.00 175.26 174.83 1ow2 s SER 75 N -1.43 6.48 0.27 -1.70 1.04 -1.26 -4.66 113.70 112.43 1ow2 s SER 75 Ca 0.20 1.41 0.00 0.00 0.48 0.00 0.00 55.95 58.05 1ow2 s SER 75 Cb -0.12 -2.45 0.57 0.00 0.10 0.00 0.00 66.02 64.12 1ow2 s SER 75 CO 0.10 -0.63 1.77 0.78 0.98 0.00 0.00 173.24 176.24 1ow2 h ASN 76 N 0.59 0.61 -0.13 7.02 -0.26 -1.98 0.31 115.58 121.74 1ow2 h ASN 76 Ca -0.46 0.09 -0.16 0.00 -0.56 0.00 0.00 56.30 55.21 1ow2 h ASN 76 Cb 1.19 -0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 38.43 1ow2 h ASN 76 CO 0.62 0.25 -0.50 -0.33 -1.06 0.00 0.00 177.43 176.41 1ow2 h GLU 77 N 0.68 0.70 0.00 0.81 3.07 -1.96 -1.03 114.58 116.85 1ow2 h GLU 77 Ca 0.49 -0.41 -0.10 0.00 -0.50 0.00 0.00 59.36 58.84 1ow2 h GLU 77 Cb 0.69 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.62 1ow2 h GLU 77 CO -0.36 1.03 -0.47 -0.44 -1.40 0.00 0.00 179.01 177.38 1ow2 h ASP 78 N 0.55 0.00 0.16 1.42 3.32 -1.56 -2.46 116.42 117.86 1ow2 h ASP 78 Ca 0.02 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.09 1ow2 h ASP 78 Cb 1.06 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.58 1ow2 h ASP 78 CO 0.10 0.47 -0.28 0.00 -1.72 0.00 0.00 179.24 177.81 1ow2 h ALA 79 N 1.53 -0.50 -0.71 3.45 0.00 0.26 0.11 119.26 123.39 1ow2 h ALA 79 Ca -0.00 -0.06 0.14 0.00 0.00 0.00 0.00 54.91 54.99 1ow2 h ALA 79 Cb 0.87 0.44 -0.10 0.00 0.00 0.00 0.00 17.79 19.00 1ow2 h ALA 79 CO 0.06 -0.83 0.23 0.28 0.00 0.00 0.00 179.25 179.00 1ow2 h VAL 80 N -0.52 0.62 -0.12 0.00 2.07 -0.98 -0.87 116.25 116.45 1ow2 h VAL 80 Ca 0.02 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1ow2 h VAL 80 Cb 0.53 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1ow2 h VAL 80 CO -0.13 0.07 0.01 0.40 0.02 0.00 0.00 177.57 177.94 1ow2 h ILE 81 N 0.36 1.23 -0.64 4.57 2.04 -1.03 -0.81 117.51 123.23 1ow2 h ILE 81 Ca 0.39 -0.73 0.02 0.00 1.00 0.00 0.00 64.86 65.55 1ow2 h ILE 81 Cb 0.61 1.49 -0.04 0.00 -0.74 0.00 0.00 36.82 38.14 1ow2 h ILE 81 CO -0.43 0.21 0.40 -0.09 0.00 0.00 0.00 178.15 178.25 1ow2 h ARG 82 N -0.05 0.78 -0.03 2.37 2.43 -0.58 -1.89 114.38 117.41 1ow2 h ARG 82 Ca 0.03 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 1ow2 h ARG 82 Cb 0.31 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1ow2 h ARG 82 CO 0.00 0.51 -0.61 0.00 -1.51 0.00 0.00 179.97 178.37 1ow2 h ARG 83 N 0.80 0.12 -0.52 0.20 2.47 -1.00 0.20 114.38 116.65 1ow2 h ARG 83 Ca 0.25 -0.08 -0.11 0.00 -1.26 0.00 0.00 59.98 58.78 1ow2 h ARG 83 Cb -0.01 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.30 1ow2 h ARG 83 CO -0.09 0.69 -0.09 0.00 0.56 0.00 0.00 179.97 181.04 1ow2 h ARG 85 N 0.86 -0.07 -0.17 0.00 3.08 -0.93 0.12 114.38 117.26 1ow2 h ARG 85 Ca 0.14 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1ow2 h ARG 85 Cb 0.63 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 1ow2 h ARG 85 CO 0.04 0.21 0.08 -0.92 -1.07 0.00 0.00 179.97 178.31 1ow2 h TYR 86 N -0.36 0.24 0.04 3.04 3.20 -0.43 0.14 116.97 122.85 1ow2 h TYR 86 Ca -0.01 -0.01 -0.30 0.00 3.14 0.00 0.00 58.73 61.55 1ow2 h TYR 86 Cb 0.32 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.47 1ow2 h TYR 86 CO 0.02 0.27 -1.71 0.93 -1.64 0.00 0.00 178.16 176.02 1ow2 h GLU 87 N 0.15 0.08 0.00 1.82 5.08 -0.79 -3.40 114.58 117.52 1ow2 h GLU 87 Ca 0.06 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1ow2 h GLU 87 Cb 0.11 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1ow2 h GLU 87 CO -0.01 0.73 0.00 1.28 -1.00 0.00 0.00 179.01 180.01 1ow2 n LEU 88 N -3.19 0.19 -1.88 1.33 4.77 -0.78 -0.92 117.00 116.51 1ow2 n LEU 88 Ca -0.19 -0.56 -0.17 0.00 -0.03 0.00 0.00 56.01 55.07 1ow2 n LEU 88 Cb 1.04 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 42.09 1ow2 n LEU 88 CO 0.45 0.05 -0.18 0.61 -1.33 0.00 0.00 177.39 176.99 1ow2 n GLY 89 N 0.74 0.69 3.58 -0.72 0.00 0.51 -0.09 105.19 109.90 1ow2 n GLY 89 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1ow2 n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ow2 s VAL 90 N -2.58 3.89 0.45 1.61 0.11 -0.61 -4.21 120.40 119.06 1ow2 s VAL 90 Ca 0.00 -0.40 -0.14 0.00 -2.93 0.00 0.00 61.98 58.51 1ow2 s VAL 90 Cb 0.00 -2.63 -0.08 0.00 -1.53 0.00 0.00 36.38 32.14 1ow2 s VAL 90 CO 0.00 0.57 0.88 -1.61 -3.33 0.00 0.00 175.10 171.62 1ow2 s GLU 91 N -0.50 3.91 0.25 1.54 0.41 -1.26 -3.59 118.70 119.45 1ow2 s GLU 91 Ca 0.08 0.76 0.01 0.00 -0.41 0.00 0.00 54.97 55.41 1ow2 s GLU 91 Cb -0.12 -2.25 -0.04 0.00 -1.78 0.00 0.00 34.13 29.93 1ow2 s GLU 91 CO 0.02 -0.14 0.13 0.96 -0.49 0.00 0.00 175.26 175.74 1ow2 s ILE 92 N -2.46 0.30 0.68 -1.63 -4.36 -1.26 -0.99 121.20 111.49 1ow2 s ILE 92 Ca 0.56 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.84 1ow2 s ILE 92 Cb -0.10 -2.56 0.00 0.00 1.25 0.00 0.00 42.46 41.05 1ow2 s ILE 92 CO 0.29 0.00 1.07 0.42 0.24 0.00 0.00 174.94 176.96 1ow2 s THR 93 N -3.85 3.89 -0.11 8.37 -4.23 0.13 -4.80 115.64 115.04 1ow2 s THR 93 Ca 0.38 0.61 -0.36 0.00 -1.18 0.00 0.00 61.69 61.14 1ow2 s THR 93 Cb 0.07 -3.57 -0.13 0.00 1.34 0.00 0.00 72.50 70.21 1ow2 s THR 93 CO 0.14 -0.80 1.79 -2.65 -0.54 0.00 0.00 174.62 172.56 1ow2 n PRO 94 N -2.97 1.86 -1.68 3.99 -0.02 -1.26 -4.53 135.00 130.39 1ow2 n PRO 94 Ca 0.07 0.68 -0.45 0.00 -2.02 0.00 0.00 63.50 61.78 1ow2 n PRO 94 Cb 0.56 -2.47 -0.04 0.00 -0.02 0.00 0.00 33.50 31.53 1ow2 n PRO 94 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ow2 n PRO 95 N 5.82 2.36 -3.53 0.52 -0.02 -1.26 -4.83 135.00 134.06 1ow2 n PRO 95 Ca 0.23 0.85 -0.38 0.00 -2.02 0.00 0.00 63.50 62.19 1ow2 n PRO 95 Cb 0.25 -2.66 -0.06 0.00 -0.02 0.00 0.00 33.50 31.00 1ow2 n PRO 95 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1ow2 s GLU 96 N 1.50 3.97 0.02 -0.52 2.12 -0.06 -4.92 118.70 120.82 1ow2 s GLU 96 Ca 0.80 0.30 -0.30 0.00 0.36 0.00 0.00 54.97 56.13 1ow2 s GLU 96 Cb -0.62 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.44 1ow2 s GLU 96 CO 0.38 0.56 1.18 0.45 -0.54 0.00 0.00 175.26 177.29 1ow2 s SER 97 N -0.61 7.09 0.00 -1.70 0.15 -1.26 -1.68 113.70 115.69 1ow2 s SER 97 Ca 0.22 1.93 0.00 0.00 0.70 0.00 0.00 55.95 58.80 1ow2 s SER 97 Cb -0.15 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 1ow2 s SER 97 CO 0.10 -0.49 0.00 2.30 1.20 0.00 0.00 173.24 176.36 1ow2 n ILE 98 N 4.12 0.00 -2.79 6.45 -5.35 -0.09 -4.88 119.36 116.82 1ow2 n ILE 98 Ca 0.09 -0.12 -0.08 0.00 -0.27 0.00 0.00 62.75 62.38 1ow2 n ILE 98 Cb 0.47 0.58 0.03 0.00 -1.74 0.00 0.00 39.64 38.97 1ow2 n ILE 98 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ow2 n TYR 99 N -1.11 -3.33 0.24 4.28 4.19 -1.08 -3.80 117.16 116.54 1ow2 n TYR 99 Ca 0.00 -1.74 0.11 0.00 3.31 0.00 0.00 57.90 59.58 1ow2 n TYR 99 Cb 0.00 1.42 0.56 0.00 0.49 0.00 0.00 39.34 41.80 1ow2 n TYR 99 CO 0.00 0.00 0.00 -1.00 0.91 0.00 0.00 176.86 176.77 1ow2 h PRO 100 N 4.40 0.00 -0.65 2.98 0.13 -1.90 -0.77 132.00 136.19 1ow2 h PRO 100 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1ow2 h PRO 100 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1ow2 h PRO 100 CO 0.22 0.20 0.00 -0.40 -0.23 0.00 0.00 178.00 177.79 1ow2 n ASP 101 N -3.50 4.31 -4.74 1.44 5.75 -1.26 -4.26 116.55 114.30 1ow2 n ASP 101 Ca -0.01 -2.26 -0.42 0.00 -0.01 0.00 0.00 54.79 52.09 1ow2 n ASP 101 Cb 0.36 -0.52 -0.02 0.00 -1.03 0.00 0.00 41.12 39.91 1ow2 n ASP 101 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1ow2 s PHE 102 N -1.49 2.97 -0.07 2.11 5.36 -1.10 -4.92 117.98 120.83 1ow2 s PHE 102 Ca 0.48 0.81 -0.03 0.00 -0.96 0.00 0.00 56.93 57.23 1ow2 s PHE 102 Cb 0.29 -3.93 0.04 0.00 -0.34 0.00 0.00 43.02 39.08 1ow2 s PHE 102 CO 0.27 -3.20 0.15 0.50 -1.46 0.00 0.00 175.22 171.48 1ow2 s ARG 103 N 0.15 0.09 0.03 10.12 3.52 -1.26 -0.56 118.95 131.04 1ow2 s ARG 103 Ca 0.64 0.39 -0.13 0.00 -0.13 0.00 0.00 55.73 56.50 1ow2 s ARG 103 Cb -0.44 -0.19 0.02 0.00 -1.56 0.00 0.00 34.95 32.78 1ow2 s ARG 103 CO 0.40 -0.18 0.29 1.52 -0.81 0.00 0.00 175.30 176.52 1ow2 s TYR 104 N 1.26 -0.10 -0.03 5.12 1.13 -0.06 -4.97 117.35 119.69 1ow2 s TYR 104 Ca -0.08 0.02 0.03 0.00 -1.41 0.00 0.00 57.07 55.63 1ow2 s TYR 104 Cb -0.12 0.08 0.00 0.00 -1.10 0.00 0.00 41.96 40.82 1ow2 s TYR 104 CO -0.06 -0.46 -0.11 0.50 -2.51 0.00 0.00 175.55 172.91 1ow2 s ARG 105 N -2.19 1.17 -0.10 -3.49 3.52 -1.26 -0.56 118.95 116.04 1ow2 s ARG 105 Ca -0.08 -0.37 -0.30 0.00 -0.13 0.00 0.00 55.73 54.85 1ow2 s ARG 105 Cb -0.02 -1.06 0.09 0.00 -1.56 0.00 0.00 34.95 32.40 1ow2 s ARG 105 CO -0.01 0.14 0.79 0.00 -0.81 0.00 0.00 175.30 175.40 1ow2 s ALA 106 N 0.19 -1.83 -0.15 6.12 0.00 -0.60 -5.02 121.76 120.47 1ow2 s ALA 106 Ca -0.04 1.46 -0.03 0.00 0.00 0.00 0.00 51.96 53.35 1ow2 s ALA 106 Cb -0.10 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 1ow2 s ALA 106 CO 0.01 -0.35 -0.06 0.99 0.00 0.00 0.00 175.76 176.35 1ow2 s THR 107 N -1.03 3.65 0.63 0.00 2.01 -1.26 -1.21 115.64 118.43 1ow2 s THR 107 Ca -0.07 -0.45 -0.05 0.00 0.31 0.00 0.00 61.69 61.43 1ow2 s THR 107 Cb -0.01 -2.58 0.03 0.00 0.01 0.00 0.00 72.50 69.96 1ow2 s THR 107 CO 0.06 0.51 0.93 1.51 -0.69 0.00 0.00 174.62 176.94 1ow2 s ASP 108 N 0.33 5.26 0.17 3.53 -4.77 -0.61 -4.92 116.67 115.66 1ow2 s ASP 108 Ca -0.06 0.53 0.10 0.00 -3.30 0.00 0.00 52.55 49.82 1ow2 s ASP 108 Cb -0.15 -1.38 0.55 0.00 -1.09 0.00 0.00 42.92 40.85 1ow2 s ASP 108 CO 0.04 -1.27 1.25 -2.65 0.70 0.00 0.00 175.17 173.24 1ow2 n PRO 109 N -2.68 0.07 -0.01 2.11 -0.02 -1.26 -1.01 135.00 132.20 1ow2 n PRO 109 Ca 0.06 0.53 0.03 0.00 -2.02 0.00 0.00 63.50 62.10 1ow2 n PRO 109 Cb 0.59 -1.81 0.03 0.00 -0.02 0.00 0.00 33.50 32.30 1ow2 n PRO 109 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ow2 n SER 110 N -1.84 1.67 0.00 2.55 2.88 -1.26 -4.97 113.62 112.65 1ow2 n SER 110 Ca -0.01 -1.37 0.00 0.00 -1.33 0.00 0.00 58.87 56.16 1ow2 n SER 110 Cb 0.11 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 1ow2 n SER 110 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ow2 n GLY 111 N 0.31 0.53 3.71 0.46 0.00 -0.18 -5.06 105.19 104.96 1ow2 n GLY 111 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1ow2 n GLY 111 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ow2 s ILE 112 N -2.00 3.41 -0.05 -0.61 -1.09 -1.26 -4.29 121.20 115.31 1ow2 s ILE 112 Ca 0.00 0.96 -0.10 0.00 -2.23 0.00 0.00 60.65 59.28 1ow2 s ILE 112 Cb 0.00 -3.61 -0.05 0.00 -1.58 0.00 0.00 42.46 37.22 1ow2 s ILE 112 CO 0.00 0.05 0.27 -0.69 -1.23 0.00 0.00 174.94 173.34 1ow2 s VAL 113 N 1.56 5.28 -0.11 2.92 1.01 0.24 -1.57 120.40 129.73 1ow2 s VAL 113 Ca 0.65 0.44 0.03 0.00 0.00 0.00 0.00 61.98 63.09 1ow2 s VAL 113 Cb -0.35 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1ow2 s VAL 113 CO 0.29 0.55 -0.20 -1.61 0.00 0.00 0.00 175.10 174.12 1ow2 s GLU 114 N -1.22 3.14 -0.30 2.72 0.41 -0.35 -4.26 118.70 118.85 1ow2 s GLU 114 Ca 0.21 -0.82 -0.01 0.00 -0.41 0.00 0.00 54.97 53.95 1ow2 s GLU 114 Cb -0.14 -2.40 0.09 0.00 -1.78 0.00 0.00 34.13 29.90 1ow2 s GLU 114 CO 0.10 0.20 0.08 1.21 -0.49 0.00 0.00 175.26 176.36 1ow2 s ASN 115 N 0.32 3.99 0.06 -0.19 2.47 -1.26 -1.56 114.94 118.76 1ow2 s ASN 115 Ca -0.16 -1.59 0.02 0.00 0.42 0.00 0.00 52.86 51.55 1ow2 s ASN 115 Cb -0.17 -0.91 -0.03 0.00 -1.45 0.00 0.00 41.25 38.69 1ow2 s ASN 115 CO 0.08 -0.40 -0.07 -1.61 -3.72 0.00 0.00 177.10 171.38 1ow2 s GLU 116 N 1.57 0.61 -0.43 0.43 2.02 0.28 -1.56 118.70 121.62 1ow2 s GLU 116 Ca 0.08 -0.94 -0.15 0.00 0.02 0.00 0.00 54.97 53.97 1ow2 s GLU 116 Cb -0.17 -0.20 0.04 0.00 0.10 0.00 0.00 34.13 33.89 1ow2 s GLU 116 CO -0.22 0.01 0.35 0.08 0.02 0.00 0.00 175.26 175.50 1ow2 s VAL 117 N -2.21 5.23 -0.52 2.63 1.01 -0.55 -0.89 120.40 125.11 1ow2 s VAL 117 Ca -0.03 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.23 1ow2 s VAL 117 Cb -0.04 -4.01 0.17 0.00 0.00 0.00 0.00 36.38 32.50 1ow2 s VAL 117 CO -0.02 -0.41 0.41 0.00 0.00 0.00 0.00 175.10 175.08 1ow2 n PRO 119 N 2.45 2.32 -4.42 0.00 -0.04 -1.25 -4.21 135.00 129.85 1ow2 n PRO 119 Ca 0.26 0.82 -0.35 0.00 -0.04 0.00 0.00 63.50 64.20 1ow2 n PRO 119 Cb 0.43 -2.51 -0.10 0.00 -0.04 0.00 0.00 33.50 31.28 1ow2 n PRO 119 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ow2 s VAL 120 N -0.31 4.14 0.30 0.52 1.01 -0.31 -2.75 120.40 122.99 1ow2 s VAL 120 Ca 0.63 -0.31 0.08 0.00 0.00 0.00 0.00 61.98 62.39 1ow2 s VAL 120 Cb -0.57 -2.74 -0.06 0.00 0.00 0.00 0.00 36.38 33.01 1ow2 s VAL 120 CO 0.53 0.59 -0.10 -0.36 0.00 0.00 0.00 175.10 175.76 1ow2 s PHE 121 N -0.67 2.15 0.01 5.22 0.40 0.17 -0.91 117.98 124.35 1ow2 s PHE 121 Ca 0.11 -0.57 0.03 0.00 -0.60 0.00 0.00 56.93 55.90 1ow2 s PHE 121 Cb -0.12 -1.18 -0.01 0.00 0.51 0.00 0.00 43.02 42.22 1ow2 s PHE 121 CO 0.02 0.45 -0.11 0.00 0.70 0.00 0.00 175.22 176.29 1ow2 s ALA 122 N -2.80 0.90 0.28 5.36 0.00 -0.68 -0.74 121.76 124.09 1ow2 s ALA 122 Ca 0.30 -0.58 -0.08 0.00 0.00 0.00 0.00 51.96 51.61 1ow2 s ALA 122 Cb 0.02 -0.17 -0.00 0.00 0.00 0.00 0.00 23.12 22.96 1ow2 s ALA 122 CO 0.14 0.18 0.45 0.00 0.00 0.00 0.00 175.76 176.53 1ow2 s ALA 123 N -0.53 0.27 -0.07 0.00 0.00 -0.84 -0.88 121.76 119.70 1ow2 s ALA 123 Ca 0.02 -1.20 0.03 0.00 0.00 0.00 0.00 51.96 50.80 1ow2 s ALA 123 Cb -0.06 1.12 -0.02 0.00 0.00 0.00 0.00 23.12 24.16 1ow2 s ALA 123 CO 0.00 -0.81 -0.15 1.03 0.00 0.00 0.00 175.76 175.84 1ow2 s ARG 124 N -3.60 2.78 0.47 0.00 0.52 -1.26 -1.55 118.95 116.31 1ow2 s ARG 124 Ca 0.27 -0.71 -0.21 0.00 -0.52 0.00 0.00 55.73 54.57 1ow2 s ARG 124 Cb 0.00 -2.44 -0.09 0.00 0.52 0.00 0.00 34.95 32.94 1ow2 s ARG 124 CO 0.14 0.48 1.02 0.95 0.02 0.00 0.00 175.30 177.90 1ow2 s THR 125 N -0.35 3.92 -0.03 0.02 -4.23 -0.51 0.21 115.64 114.68 1ow2 s THR 125 Ca 0.03 1.21 0.04 0.00 -1.18 0.00 0.00 61.69 61.79 1ow2 s THR 125 Cb -0.12 -3.49 0.06 0.00 1.34 0.00 0.00 72.50 70.29 1ow2 s THR 125 CO 0.02 -0.25 0.89 0.35 -0.54 0.00 0.00 174.62 175.09 1ow2 n THR 126 N -0.86 0.64 -3.92 3.99 -2.24 -0.16 -4.45 114.28 107.29 1ow2 n THR 126 Ca 0.09 -0.73 -0.09 0.00 -2.27 0.00 0.00 64.05 61.05 1ow2 n THR 126 Cb 0.53 0.49 -0.05 0.00 -2.10 0.00 0.00 70.33 69.19 1ow2 n THR 126 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ow2 s SER 127 N -1.11 -0.09 0.88 3.42 1.04 -1.25 -4.89 113.70 111.70 1ow2 s SER 127 Ca 0.07 -0.80 -0.11 0.00 0.48 0.00 0.00 55.95 55.59 1ow2 s SER 127 Cb 0.06 0.54 0.12 0.00 0.10 0.00 0.00 66.02 66.84 1ow2 s SER 127 CO 0.01 -1.04 1.11 0.00 0.98 0.00 0.00 173.24 174.29 1ow2 s ALA 128 N -3.97 1.64 0.27 5.32 0.00 -1.26 -4.68 121.76 119.08 1ow2 s ALA 128 Ca 0.18 0.34 -0.15 0.00 0.00 0.00 0.00 51.96 52.32 1ow2 s ALA 128 Cb 0.00 -3.34 -0.08 0.00 0.00 0.00 0.00 23.12 19.71 1ow2 s ALA 128 CO 0.03 -2.41 0.68 -0.51 0.00 0.00 0.00 175.76 173.56 1ow2 s LEU 129 N -6.34 4.17 -0.44 0.00 1.43 -1.26 -4.41 118.68 111.82 1ow2 s LEU 129 Ca 0.64 1.23 0.05 0.00 -1.03 0.00 0.00 54.13 55.03 1ow2 s LEU 129 Cb -0.20 -3.82 0.19 0.00 0.03 0.00 0.00 46.19 42.39 1ow2 s LEU 129 CO 0.58 -0.10 0.42 1.67 0.23 0.00 0.00 176.35 179.15 1ow2 n GLN 130 N 0.04 0.58 -1.64 1.70 -0.06 0.87 -5.00 117.38 113.87 1ow2 n GLN 130 Ca 0.01 -3.38 -0.46 0.00 -2.00 0.00 0.00 57.00 51.17 1ow2 n GLN 130 Cb 0.52 -1.64 -0.03 0.00 -4.06 0.00 0.00 30.24 25.03 1ow2 n GLN 130 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 1ow2 n ILE 131 N 2.30 0.96 -3.05 1.69 2.08 -1.24 -3.06 119.36 119.04 1ow2 n ILE 131 Ca 0.27 -0.24 -0.42 0.00 0.56 0.00 0.00 62.75 62.91 1ow2 n ILE 131 Cb 0.48 -1.27 -0.06 0.00 -0.75 0.00 0.00 39.64 38.04 1ow2 n ILE 131 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1ow2 s ASN 132 N 0.18 6.44 0.00 4.38 3.84 -0.10 -4.94 114.94 124.74 1ow2 s ASN 132 Ca 0.69 0.09 0.23 0.00 0.21 0.00 0.00 52.86 54.08 1ow2 s ASN 132 Cb -0.71 -2.35 1.27 0.00 -0.55 0.00 0.00 41.25 38.90 1ow2 s ASN 132 CO 0.51 -0.70 1.83 -0.90 -2.79 0.00 0.00 177.10 175.04 1ow2 n ASP 133 N 6.26 0.23 0.05 -4.21 5.68 -1.26 -1.17 116.55 122.14 1ow2 n ASP 133 Ca 0.00 -1.35 0.11 0.00 -0.50 0.00 0.00 54.79 53.06 1ow2 n ASP 133 Cb 0.48 -0.01 0.45 0.00 -1.14 0.00 0.00 41.12 40.91 1ow2 n ASP 133 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1ow2 n ASP 134 N -0.69 0.31 0.00 -1.12 8.00 -1.26 -4.16 116.55 117.64 1ow2 n ASP 134 Ca 0.17 0.55 0.00 0.00 0.71 0.00 0.00 54.79 56.22 1ow2 n ASP 134 Cb 0.11 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 1ow2 n ASP 134 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1ow2 n GLU 135 N -1.82 1.87 -4.15 -1.24 -0.58 -0.74 -4.74 120.64 109.25 1ow2 n GLU 135 Ca 0.05 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 56.58 1ow2 n GLU 135 Cb 0.28 -0.89 -0.16 0.00 -0.57 0.00 0.00 31.44 30.10 1ow2 n GLU 135 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1ow2 s VAL 136 N -1.77 0.59 -0.54 2.62 1.01 -0.31 -1.27 120.40 120.73 1ow2 s VAL 136 Ca 0.00 -0.13 0.14 0.00 0.00 0.00 0.00 61.98 61.98 1ow2 s VAL 136 Cb 0.00 -0.62 -0.16 0.00 0.00 0.00 0.00 36.38 35.60 1ow2 s VAL 136 CO 0.00 0.24 0.53 1.15 0.00 0.00 0.00 175.10 177.02 1ow2 n MET 137 N 4.17 2.18 -3.53 2.72 0.00 0.16 -4.24 117.12 118.58 1ow2 n MET 137 Ca -0.22 -0.02 -0.13 0.00 0.00 0.00 0.00 57.70 57.33 1ow2 n MET 137 Cb 0.51 -1.17 -0.05 0.00 0.00 0.00 0.00 33.22 32.51 1ow2 n MET 137 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1ow2 s ASP 138 N -2.50 -0.49 0.18 3.17 -1.08 -1.22 -4.99 116.67 109.74 1ow2 s ASP 138 Ca 0.03 0.40 -0.09 0.00 -0.52 0.00 0.00 52.55 52.37 1ow2 s ASP 138 Cb 0.10 0.43 -0.01 0.00 -1.46 0.00 0.00 42.92 41.98 1ow2 s ASP 138 CO 0.56 -0.55 0.31 -0.72 0.52 0.00 0.00 175.17 175.29 1ow2 s TYR 139 N -1.76 0.42 -0.04 -5.34 -0.85 -1.26 0.79 117.35 109.30 1ow2 s TYR 139 Ca -0.04 -0.77 -0.03 0.00 -0.52 0.00 0.00 57.07 55.71 1ow2 s TYR 139 Cb -0.00 -0.03 0.01 0.00 0.38 0.00 0.00 41.96 42.31 1ow2 s TYR 139 CO 0.01 -0.77 0.10 -1.14 -1.52 0.00 0.00 175.55 172.23 1ow2 s GLN 140 N -3.98 0.11 -0.18 -3.49 2.00 0.08 -4.98 119.66 109.22 1ow2 s GLN 140 Ca 0.19 0.14 -0.15 0.00 -2.00 0.00 0.00 55.36 53.53 1ow2 s GLN 140 Cb 0.03 0.05 -0.04 0.00 0.80 0.00 0.00 33.01 33.85 1ow2 s GLN 140 CO 0.02 -0.01 0.36 -1.58 -0.50 0.00 0.00 175.29 173.58 1ow2 s TRP 141 N 0.06 3.42 0.35 1.67 0.52 -1.26 -0.27 118.94 123.43 1ow2 s TRP 141 Ca -0.00 0.63 -0.01 0.00 0.02 0.00 0.00 56.10 56.74 1ow2 s TRP 141 Cb -0.01 -2.46 0.00 0.00 -1.15 0.00 0.00 33.47 29.86 1ow2 s TRP 141 CO 0.00 0.10 0.46 0.00 0.02 0.00 0.00 176.95 177.53 1ow2 s ASP 143 N -3.27 7.25 0.20 0.00 1.01 -1.26 -1.21 116.67 119.39 1ow2 s ASP 143 Ca 0.32 1.52 -0.13 0.00 0.71 0.00 0.00 52.55 54.96 1ow2 s ASP 143 Cb -0.00 -2.52 0.21 0.00 1.01 0.00 0.00 42.92 41.62 1ow2 s ASP 143 CO 0.22 -0.22 1.66 0.25 0.21 0.00 0.00 175.17 177.29 1ow2 h LEU 144 N 6.81 -0.32 -1.68 1.23 5.85 -1.92 0.60 115.31 125.86 1ow2 h LEU 144 Ca -0.41 0.14 0.10 0.00 0.84 0.00 0.00 57.88 58.55 1ow2 h LEU 144 Cb 1.21 0.27 -0.03 0.00 0.37 0.00 0.00 40.66 42.48 1ow2 h LEU 144 CO 0.75 -0.12 0.38 0.00 -0.34 0.00 0.00 178.44 179.12 1ow2 h ALA 145 N 1.51 2.06 -0.16 1.25 0.00 -1.99 -0.74 119.26 121.19 1ow2 h ALA 145 Ca 0.27 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 1ow2 h ALA 145 Cb 0.42 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1ow2 h ALA 145 CO -0.49 -0.19 -0.13 -0.44 0.00 0.00 0.00 179.25 178.00 1ow2 h ASP 146 N 0.36 0.39 -0.20 0.00 3.32 -1.30 -0.81 116.42 118.16 1ow2 h ASP 146 Ca 0.26 -0.46 0.03 0.00 0.02 0.00 0.00 57.03 56.88 1ow2 h ASP 146 Cb 0.56 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 1ow2 h ASP 146 CO -0.07 0.77 0.04 0.58 -1.72 0.00 0.00 179.24 178.84 1ow2 h VAL 147 N 0.01 0.91 0.00 -1.35 2.07 -0.65 0.23 116.25 117.47 1ow2 h VAL 147 Ca 0.03 -0.04 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1ow2 h VAL 147 Cb 0.65 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1ow2 h VAL 147 CO 0.03 0.02 -0.16 -0.07 0.02 0.00 0.00 177.57 177.41 1ow2 h LEU 148 N 0.12 0.00 -0.16 2.57 3.38 -1.09 0.52 115.31 120.65 1ow2 h LEU 148 Ca 0.09 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1ow2 h LEU 148 Cb 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1ow2 h LEU 148 CO -0.12 0.16 -0.27 0.45 0.09 0.00 0.00 178.44 178.75 1ow2 h HIS 149 N 0.00 0.58 -0.53 1.13 3.86 0.06 0.92 115.15 121.17 1ow2 h HIS 149 Ca -0.00 -0.20 0.04 0.00 -1.16 0.00 0.00 60.37 59.04 1ow2 h HIS 149 Cb 0.45 -0.11 -0.04 0.00 1.06 0.00 0.00 27.41 28.77 1ow2 h HIS 149 CO 0.00 0.90 0.29 0.78 0.86 0.00 0.00 177.93 180.76 1ow2 h GLY 150 N 0.10 0.75 0.96 2.45 0.00 0.45 -0.45 103.07 107.32 1ow2 h GLY 150 Ca 0.01 -0.21 0.01 0.00 0.00 0.00 0.00 47.33 47.14 1ow2 h GLY 150 CO 0.06 0.16 0.32 -2.22 0.00 0.00 0.00 176.54 174.85 1ow2 h ILE 151 N 0.58 1.10 -0.59 2.60 2.04 0.07 0.59 117.51 123.88 1ow2 h ILE 151 Ca 0.23 -0.22 -0.06 0.00 1.00 0.00 0.00 64.86 65.81 1ow2 h ILE 151 Cb 0.09 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 1ow2 h ILE 151 CO -0.13 0.12 0.16 0.44 0.00 0.00 0.00 178.15 178.73 1ow2 h ASP 152 N 0.64 0.89 0.09 1.72 3.32 -0.20 -2.56 116.42 120.33 1ow2 h ASP 152 Ca 0.19 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 1ow2 h ASP 152 Cb -0.04 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.28 1ow2 h ASP 152 CO -0.06 0.89 -0.04 0.00 -1.72 0.00 0.00 179.24 178.30 1ow2 h ALA 153 N 1.04 -0.12 -2.21 3.45 0.00 -0.79 -3.40 119.26 117.23 1ow2 h ALA 153 Ca 0.19 -0.27 -0.58 0.00 0.00 0.00 0.00 54.91 54.25 1ow2 h ALA 153 Cb 0.33 0.05 -0.40 0.00 0.00 0.00 0.00 17.79 17.77 1ow2 h ALA 153 CO -0.00 -0.25 -0.87 0.25 0.00 0.00 0.00 179.25 178.37 1ow2 n THR 154 N -4.87 0.48 0.30 0.00 -2.24 0.17 -4.95 114.28 103.17 1ow2 n THR 154 Ca -0.08 -4.42 0.19 0.00 -2.27 0.00 0.00 64.05 57.47 1ow2 n THR 154 Cb 0.29 -1.99 0.99 0.00 -2.10 0.00 0.00 70.33 67.52 1ow2 n THR 154 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1ow2 h PRO 155 N 4.39 0.00 0.00 -0.78 0.13 -1.61 -1.50 132.00 132.63 1ow2 h PRO 155 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1ow2 h PRO 155 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1ow2 h PRO 155 CO 0.60 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.70 1ow2 n TRP 156 N -2.88 0.53 1.37 1.56 4.27 -1.26 -3.00 117.44 118.02 1ow2 n TRP 156 Ca -0.02 0.18 0.03 0.00 -3.89 0.00 0.00 57.50 53.80 1ow2 n TRP 156 Cb 0.10 -0.79 0.09 0.00 -1.36 0.00 0.00 31.31 29.35 1ow2 n TRP 156 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1ow2 n ALA 157 N -1.67 2.47 -2.15 -1.67 0.00 -0.56 -4.87 120.51 112.05 1ow2 n ALA 157 Ca 0.04 -0.35 -0.08 0.00 0.00 0.00 0.00 53.44 53.06 1ow2 n ALA 157 Cb 0.30 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.66 1ow2 n ALA 157 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ow2 s PHE 158 N -1.73 0.59 0.45 0.00 0.08 -1.16 -4.55 117.98 111.65 1ow2 s PHE 158 Ca 0.13 -1.01 -0.25 0.00 0.12 0.00 0.00 56.93 55.92 1ow2 s PHE 158 Cb 0.07 -0.41 -0.08 0.00 -0.57 0.00 0.00 43.02 42.03 1ow2 s PHE 158 CO 0.09 -0.32 1.41 -1.54 -0.10 0.00 0.00 175.22 174.76 1ow2 s SER 159 N -2.87 5.87 0.56 1.36 1.04 -0.34 -4.85 113.70 114.47 1ow2 s SER 159 Ca 0.07 2.88 0.33 0.00 0.48 0.00 0.00 55.95 59.71 1ow2 s SER 159 Cb 0.06 -2.65 1.59 0.00 0.10 0.00 0.00 66.02 65.12 1ow2 s SER 159 CO -0.08 -1.17 2.09 1.55 0.98 0.00 0.00 173.24 176.60 1ow2 h PRO 160 N 2.29 0.00 -0.37 4.02 0.13 -1.92 -2.67 132.00 133.48 1ow2 h PRO 160 Ca -0.51 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 1ow2 h PRO 160 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1ow2 h PRO 160 CO 0.61 0.07 0.02 0.11 -0.23 0.00 0.00 178.00 178.58 1ow2 h TRP 161 N 0.00 0.69 -0.83 1.56 0.09 -1.98 0.40 115.95 115.89 1ow2 h TRP 161 Ca -0.00 -0.11 0.04 0.00 0.09 0.00 0.00 58.89 58.91 1ow2 h TRP 161 Cb 0.36 -0.18 -0.05 0.00 0.08 0.00 0.00 29.16 29.36 1ow2 h TRP 161 CO 0.00 0.72 0.52 1.98 0.09 0.00 0.00 178.44 181.75 1ow2 h MET 162 N 0.47 0.96 -0.20 0.12 4.05 -1.85 -0.79 114.93 117.69 1ow2 h MET 162 Ca 0.11 -0.06 -0.04 0.00 -0.28 0.00 0.00 59.70 59.43 1ow2 h MET 162 Cb 0.42 -0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 31.00 1ow2 h MET 162 CO 0.01 0.64 -0.04 0.28 0.23 0.00 0.00 176.91 178.03 1ow2 h VAL 163 N 0.99 1.28 -0.60 -5.77 2.07 -1.19 -1.07 116.25 111.96 1ow2 h VAL 163 Ca 0.35 -1.01 0.02 0.00 0.82 0.00 0.00 66.70 66.88 1ow2 h VAL 163 Cb 0.08 1.55 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 1ow2 h VAL 163 CO -0.14 0.31 0.37 0.24 0.02 0.00 0.00 177.57 178.37 1ow2 h MET 164 N 0.10 0.72 -0.67 1.57 2.86 0.30 -1.30 114.93 118.50 1ow2 h MET 164 Ca 0.05 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 1ow2 h MET 164 Cb 0.48 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 1ow2 h MET 164 CO 0.02 0.47 0.24 1.96 1.06 0.00 0.00 176.91 180.66 1ow2 h GLN 165 N 0.74 1.02 0.00 1.72 4.20 -1.08 -2.98 115.11 118.73 1ow2 h GLN 165 Ca 0.24 -0.20 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 1ow2 h GLN 165 Cb 0.01 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 1ow2 h GLN 165 CO -0.09 0.87 -0.18 0.00 -0.67 0.00 0.00 178.83 178.76 1ow2 h ALA 166 N 1.10 0.97 -0.46 3.87 0.00 -0.84 -3.03 119.26 120.87 1ow2 h ALA 166 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ow2 h ALA 166 Cb 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ow2 h ALA 166 CO -0.01 0.22 0.00 0.25 0.00 0.00 0.00 179.25 179.71 1ow2 n THR 167 N -3.26 0.61 -2.80 0.00 -2.24 -0.52 -4.61 114.28 101.45 1ow2 n THR 167 Ca 0.01 -0.69 -0.42 0.00 -2.27 0.00 0.00 64.05 60.68 1ow2 n THR 167 Cb 0.46 0.53 -0.04 0.00 -2.10 0.00 0.00 70.33 69.18 1ow2 n THR 167 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ow2 s ASN 168 N -1.22 6.82 0.20 3.42 3.84 -1.14 -4.98 114.94 121.88 1ow2 s ASN 168 Ca 0.37 0.91 -0.11 0.00 0.21 0.00 0.00 52.86 54.24 1ow2 s ASN 168 Cb 0.20 -2.47 0.25 0.00 -0.55 0.00 0.00 41.25 38.68 1ow2 s ASN 168 CO 0.27 -0.71 1.71 0.08 -2.79 0.00 0.00 177.10 175.67 1ow2 h ARG 169 N 8.00 0.25 -0.03 0.43 0.11 -1.89 0.18 114.38 121.43 1ow2 h ARG 169 Ca -0.22 -0.02 -0.21 0.00 0.10 0.00 0.00 59.98 59.63 1ow2 h ARG 169 Cb 1.08 -0.06 0.02 0.00 1.11 0.00 0.00 29.97 32.12 1ow2 h ARG 169 CO 0.95 0.17 -0.82 0.93 0.10 0.00 0.00 179.97 181.29 1ow2 h GLU 170 N 0.26 0.61 -0.88 0.08 3.07 -1.93 -0.74 114.58 115.03 1ow2 h GLU 170 Ca 0.29 -0.61 0.10 0.00 -0.50 0.00 0.00 59.36 58.63 1ow2 h GLU 170 Cb 0.41 0.17 -0.08 0.00 -0.84 0.00 0.00 28.75 28.41 1ow2 h GLU 170 CO -0.37 1.22 0.53 0.00 -1.40 0.00 0.00 179.01 178.99 1ow2 h ALA 171 N 0.40 1.28 -0.09 3.43 0.00 -1.56 0.34 119.26 123.05 1ow2 h ALA 171 Ca -0.09 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ow2 h ALA 171 Cb 1.49 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 1ow2 h ALA 171 CO 0.16 0.16 0.06 -0.09 0.00 0.00 0.00 179.25 179.54 1ow2 h ARG 172 N 0.88 0.11 -0.54 0.00 2.43 -0.49 0.10 114.38 116.87 1ow2 h ARG 172 Ca 0.42 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.56 1ow2 h ARG 172 Cb 0.37 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1ow2 h ARG 172 CO -0.24 0.07 0.23 -0.22 -1.51 0.00 0.00 179.97 178.30 1ow2 h LYS 173 N 0.12 0.80 -0.69 0.20 3.64 -0.10 -1.32 116.57 119.21 1ow2 h LYS 173 Ca 0.03 -0.14 0.05 0.00 -1.27 0.00 0.00 60.65 59.32 1ow2 h LYS 173 Cb -0.01 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.63 1ow2 h LYS 173 CO -0.01 0.69 0.41 0.00 -2.27 0.00 0.00 179.45 178.27 1ow2 h ARG 174 N 0.73 0.74 -0.36 1.90 3.08 -0.17 -1.07 114.38 119.24 1ow2 h ARG 174 Ca 0.18 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 1ow2 h ARG 174 Cb 0.18 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 1ow2 h ARG 174 CO -0.02 0.49 0.21 -0.07 -1.07 0.00 0.00 179.97 179.51 1ow2 h LEU 175 N 0.76 0.42 -1.64 3.04 3.38 0.06 -0.31 115.31 121.02 1ow2 h LEU 175 Ca 0.30 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 1ow2 h LEU 175 Cb 0.13 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1ow2 h LEU 175 CO -0.15 0.33 0.18 0.28 0.09 0.00 0.00 178.44 179.16 1ow2 h SER 176 N 0.49 0.37 -0.28 -0.43 0.02 -0.12 -1.66 113.55 111.93 1ow2 h SER 176 Ca 0.13 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1ow2 h SER 176 Cb -0.01 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1ow2 h SER 176 CO -0.02 0.29 0.19 0.00 -1.14 0.00 0.00 176.83 176.15 1ow2 h ALA 177 N 1.77 1.87 -0.00 3.77 0.00 -0.72 -1.42 119.26 124.53 1ow2 h ALA 177 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ow2 h ALA 177 Cb -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1ow2 h ALA 177 CO -0.02 0.11 -0.09 1.19 0.00 0.00 0.00 179.25 180.44 1ow2 n PHE 178 N -4.50 0.00 0.73 0.00 3.01 -0.63 -3.45 117.46 112.62 1ow2 n PHE 178 Ca 0.02 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.61 1ow2 n PHE 178 Cb 0.12 -0.27 0.48 0.00 -0.01 0.00 0.00 39.48 39.79 1ow2 n PHE 178 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1ow2 n THR 179 N -1.19 0.44 -2.00 4.37 -2.24 -0.53 -4.42 114.28 108.70 1ow2 n THR 179 Ca 0.13 -0.13 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 1ow2 n THR 179 Cb 0.28 -0.62 -0.00 0.00 -2.10 0.00 0.00 70.33 67.89 1ow2 n THR 179 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1ow2 s GLN 180 N -3.08 3.93 0.65 -0.78 0.74 -1.22 -4.27 119.66 115.62 1ow2 s GLN 180 Ca 0.11 2.21 -0.17 0.00 0.05 0.00 0.00 55.36 57.57 1ow2 s GLN 180 Cb 0.14 -2.75 -0.01 0.00 1.10 0.00 0.00 33.01 31.49 1ow2 s GLN 180 CO 0.55 -0.54 1.17 -1.17 -0.55 0.00 0.00 175.29 174.74 1ow2 s LEU 181 N -2.46 3.49 -0.14 3.68 0.20 -1.26 -4.22 118.68 117.97 1ow2 s LEU 181 Ca 0.57 2.25 -0.05 0.00 0.69 0.00 0.00 54.13 57.58 1ow2 s LEU 181 Cb -0.39 -4.58 0.07 0.00 -0.43 0.00 0.00 46.19 40.85 1ow2 s LEU 181 CO 0.51 -1.76 0.30 -0.54 -0.29 0.00 0.00 176.35 174.56 1ow2 s LYS 182 N -3.71 0.20 0.00 1.98 1.02 -0.39 -4.99 119.74 113.86 1ow2 s LYS 182 Ca 0.73 0.78 0.22 0.00 0.02 0.00 0.00 55.97 57.71 1ow2 s LYS 182 Cb -0.26 0.02 0.17 0.00 -0.52 0.00 0.00 37.83 37.24 1ow2 s LYS 182 CO 0.38 -0.25 1.18 1.28 -0.92 0.00 0.00 175.35 177.02