#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ppw s HIS 5 N 0.00 1.70 0.17 4.31 -3.43 -1.26 -0.46 115.29 116.32 1ppw s HIS 5 Ca 0.00 -1.43 0.10 0.00 -0.80 0.00 0.00 55.06 52.93 1ppw s HIS 5 Cb 0.00 -0.91 -0.04 0.00 -1.43 0.00 0.00 32.58 30.20 1ppw s HIS 5 CO 0.00 -0.55 -0.21 0.14 -2.00 0.00 0.00 174.74 172.11 1ppw s VAL 6 N -3.44 2.09 -0.39 -5.38 -7.23 0.36 -4.62 120.40 101.80 1ppw s VAL 6 Ca 0.33 -1.95 -0.17 0.00 -1.81 0.00 0.00 61.98 58.39 1ppw s VAL 6 Cb 0.03 -1.97 0.01 0.00 0.56 0.00 0.00 36.38 35.02 1ppw s VAL 6 CO 0.19 -0.19 0.42 -0.63 -0.31 0.00 0.00 175.10 174.59 1ppw s ILE 7 N -1.78 5.10 0.40 -0.62 1.01 -1.26 -0.52 121.20 123.53 1ppw s ILE 7 Ca 0.18 -0.13 -0.24 0.00 0.00 0.00 0.00 60.65 60.45 1ppw s ILE 7 Cb -0.07 -3.96 -0.09 0.00 0.01 0.00 0.00 42.46 38.35 1ppw s ILE 7 CO 0.08 -0.29 1.05 -0.76 0.00 0.00 0.00 174.94 175.02 1ppw s LEU 8 N 2.14 4.15 0.16 2.97 1.43 0.10 0.80 118.68 130.43 1ppw s LEU 8 Ca 0.13 2.04 0.04 0.00 -1.03 0.00 0.00 54.13 55.31 1ppw s LEU 8 Cb -0.17 -4.17 -0.05 0.00 0.03 0.00 0.00 46.19 41.84 1ppw s LEU 8 CO 0.13 -0.48 -0.07 -0.76 0.23 0.00 0.00 176.35 175.40 1ppw s LEU 9 N -2.60 2.42 0.00 1.79 1.43 -0.97 -1.33 118.68 119.42 1ppw s LEU 9 Ca 0.57 -1.07 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 1ppw s LEU 9 Cb -0.22 -0.27 0.00 0.00 0.03 0.00 0.00 46.19 45.73 1ppw s LEU 9 CO 0.28 -0.41 0.00 -0.46 0.23 0.00 0.00 176.35 175.99 1ppw n ASN 10 N -0.22 0.63 0.00 2.29 2.04 -0.59 -4.52 115.26 114.88 1ppw n ASN 10 Ca -0.09 -0.87 0.00 0.00 -0.44 0.00 0.00 54.58 53.18 1ppw n ASN 10 Cb 0.61 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.86 1ppw n ASN 10 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ppw n ALA 11 N -3.00 0.00 -0.95 -2.53 0.00 -1.26 -3.99 120.51 108.78 1ppw n ALA 11 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1ppw n ALA 11 Cb 0.00 0.32 0.13 0.00 0.00 0.00 0.00 19.45 19.91 1ppw n ALA 11 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ppw s GLN 12 N -1.92 1.52 -1.43 0.00 -0.21 -1.26 -4.78 119.66 111.58 1ppw s GLN 12 Ca 0.00 1.51 -0.10 0.00 0.02 0.00 0.00 55.36 56.79 1ppw s GLN 12 Cb 0.00 -1.79 -0.07 0.00 1.00 0.00 0.00 33.01 32.16 1ppw s GLN 12 CO 0.00 -2.25 2.64 0.41 -2.12 0.00 0.00 175.29 173.97 1ppw n GLY 13 N -0.07 3.98 3.42 3.09 0.00 -1.26 -4.86 105.19 109.50 1ppw n GLY 13 Ca 0.12 -1.38 -0.35 0.00 0.00 0.00 0.00 46.02 44.41 1ppw n GLY 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ppw s VAL 14 N 2.70 3.78 0.53 1.61 1.01 -1.26 -4.86 120.40 123.91 1ppw s VAL 14 Ca 0.60 -0.37 -0.22 0.00 0.00 0.00 0.00 61.98 61.99 1ppw s VAL 14 Cb 0.16 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 1ppw s VAL 14 CO -0.05 0.44 1.28 -2.84 0.00 0.00 0.00 175.10 173.93 1ppw s PRO 15 N 0.98 3.27 0.00 2.72 0.02 -1.26 -1.55 135.00 139.19 1ppw s PRO 15 Ca 0.01 2.05 0.00 0.00 0.02 0.00 0.00 61.00 63.08 1ppw s PRO 15 Cb -0.14 -2.25 0.00 0.00 0.02 0.00 0.00 34.50 32.13 1ppw s PRO 15 CO 0.01 -1.03 0.00 0.25 -0.33 0.00 0.00 177.00 175.91 1ppw n THR 16 N -0.97 0.00 -3.84 0.99 -2.24 -0.44 -4.90 114.28 102.87 1ppw n THR 16 Ca 0.10 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1ppw n THR 16 Cb 0.46 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 1ppw n THR 16 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ppw n GLY 17 N 0.68 -0.97 3.41 3.38 0.00 -1.25 -5.02 105.19 105.41 1ppw n GLY 17 Ca 0.00 -1.22 -0.20 0.00 0.00 0.00 0.00 46.02 44.60 1ppw n GLY 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ppw s THR 18 N -2.97 1.36 -0.16 2.61 -4.23 -1.26 -0.72 115.64 110.27 1ppw s THR 18 Ca 0.00 -2.07 -0.11 0.00 -1.18 0.00 0.00 61.69 58.33 1ppw s THR 18 Cb 0.00 -2.50 0.05 0.00 1.34 0.00 0.00 72.50 71.39 1ppw s THR 18 CO 0.00 -0.24 0.40 -0.22 -0.54 0.00 0.00 174.62 174.02 1ppw s LEU 19 N -3.42 0.14 0.06 4.79 0.20 0.33 -4.86 118.68 115.91 1ppw s LEU 19 Ca 0.31 0.85 -0.38 0.00 0.69 0.00 0.00 54.13 55.60 1ppw s LEU 19 Cb 0.06 1.34 -0.18 0.00 -0.43 0.00 0.00 46.19 46.98 1ppw s LEU 19 CO 0.12 -0.17 1.24 1.21 -0.29 0.00 0.00 176.35 178.46 1ppw n GLU 20 N 3.72 0.73 0.28 1.98 0.00 -1.26 0.14 120.64 126.22 1ppw n GLU 20 Ca -0.19 0.26 -0.16 0.00 0.00 0.00 0.00 57.16 57.06 1ppw n GLU 20 Cb 0.56 -1.85 -0.08 0.00 0.00 0.00 0.00 31.44 30.06 1ppw n GLU 20 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 1ppw h LYS 21 N 3.99 -0.78 0.03 5.31 3.64 -1.02 -1.07 116.57 126.66 1ppw h LYS 21 Ca -0.49 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1ppw h LYS 21 Cb 1.37 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 33.35 1ppw h LYS 21 CO 0.73 -0.52 -0.17 -0.92 -2.27 0.00 0.00 179.45 176.30 1ppw h TYR 22 N -0.81 -0.50 -1.54 1.91 3.20 -1.90 -1.89 116.97 115.45 1ppw h TYR 22 Ca -0.05 0.01 0.48 0.00 3.14 0.00 0.00 58.73 62.31 1ppw h TYR 22 Cb 0.68 0.21 -0.11 0.00 1.54 0.00 0.00 36.73 39.06 1ppw h TYR 22 CO -0.14 -0.19 1.05 0.00 -1.64 0.00 0.00 178.16 177.24 1ppw h ALA 23 N -1.21 3.17 0.02 1.82 0.00 -1.93 -2.40 119.26 118.73 1ppw h ALA 23 Ca -0.00 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ppw h ALA 23 Cb 0.24 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ppw h ALA 23 CO -0.10 -1.76 -0.01 0.00 0.00 0.00 0.00 179.25 177.38 1ppw h ALA 24 N 1.38 -0.03 -1.34 0.00 0.00 -0.36 -3.41 119.26 115.50 1ppw h ALA 24 Ca 0.84 -0.29 -0.56 0.00 0.00 0.00 0.00 54.91 54.91 1ppw h ALA 24 Cb 2.98 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 20.70 1ppw h ALA 24 CO -0.25 -0.22 1.10 -1.01 0.00 0.00 0.00 179.25 178.87 1ppw s HIS 25 N -3.81 2.36 0.00 0.00 4.02 -0.91 -4.27 115.29 112.68 1ppw s HIS 25 Ca -0.16 -0.23 0.00 0.00 1.02 0.00 0.00 55.06 55.69 1ppw s HIS 25 Cb 0.01 -4.62 0.00 0.00 -1.02 0.00 0.00 32.58 26.95 1ppw s HIS 25 CO 0.66 -2.02 0.00 0.25 1.02 0.00 0.00 174.74 174.65 1ppw n THR 26 N 6.42 0.00 0.98 1.30 -2.24 -1.26 -4.87 114.28 114.61 1ppw n THR 26 Ca 0.08 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.96 1ppw n THR 26 Cb 0.49 0.00 0.53 0.00 -2.10 0.00 0.00 70.33 69.25 1ppw n THR 26 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ppw n ALA 27 N -3.00 2.09 -2.72 6.98 0.00 -1.26 -0.30 120.51 122.30 1ppw n ALA 27 Ca 0.00 -0.10 -0.06 0.00 0.00 0.00 0.00 53.44 53.28 1ppw n ALA 27 Cb 0.00 -1.34 0.04 0.00 0.00 0.00 0.00 19.45 18.15 1ppw n ALA 27 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ppw n ASP 28 N -1.29 1.34 -4.64 0.00 3.85 -1.26 -4.70 116.55 109.85 1ppw n ASP 28 Ca 0.10 -2.48 -0.47 0.00 -0.71 0.00 0.00 54.79 51.22 1ppw n ASP 28 Cb 0.17 -0.45 -0.04 0.00 -1.35 0.00 0.00 41.12 39.45 1ppw n ASP 28 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 1ppw n THR 29 N -0.26 0.60 -2.34 2.12 -1.04 -1.21 -4.99 114.28 107.16 1ppw n THR 29 Ca 0.08 -0.15 -0.27 0.00 -2.04 0.00 0.00 64.05 61.67 1ppw n THR 29 Cb 0.82 -1.25 0.03 0.00 -1.82 0.00 0.00 70.33 68.11 1ppw n THR 29 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1ppw s ARG 30 N 0.01 2.93 0.33 -2.82 0.52 -1.26 -4.79 118.95 113.86 1ppw s ARG 30 Ca 0.74 0.05 -0.29 0.00 -0.52 0.00 0.00 55.73 55.71 1ppw s ARG 30 Cb -0.75 -2.25 -0.12 0.00 0.52 0.00 0.00 34.95 32.36 1ppw s ARG 30 CO 0.47 -0.73 1.40 -0.11 0.02 0.00 0.00 175.30 176.36 1ppw n LEU 31 N -2.62 3.93 -3.56 2.53 7.94 -1.26 -4.69 117.00 119.27 1ppw n LEU 31 Ca 0.05 1.20 -0.10 0.00 -1.11 0.00 0.00 56.01 56.05 1ppw n LEU 31 Cb 0.57 -1.53 -0.02 0.00 0.53 0.00 0.00 43.42 42.98 1ppw n LEU 31 CO 0.53 -0.23 0.48 -1.38 -1.11 0.00 0.00 177.39 175.68 1ppw s HIS 32 N -0.82 -0.40 0.21 1.96 -3.43 -0.97 -2.28 115.29 109.56 1ppw s HIS 32 Ca 0.58 0.13 -0.30 0.00 -0.80 0.00 0.00 55.06 54.67 1ppw s HIS 32 Cb -0.54 0.60 -0.08 0.00 -1.43 0.00 0.00 32.58 31.12 1ppw s HIS 32 CO 0.59 -0.90 0.93 -1.17 -2.00 0.00 0.00 174.74 172.18 1ppw s LEU 33 N -2.77 4.62 0.23 5.38 2.96 0.24 -2.19 118.68 127.15 1ppw s LEU 33 Ca 0.05 1.90 -0.10 0.00 -0.22 0.00 0.00 54.13 55.75 1ppw s LEU 33 Cb -0.02 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.08 1ppw s LEU 33 CO -0.06 0.13 0.39 0.00 -1.32 0.00 0.00 176.35 175.49 1ppw s ALA 34 N -1.00 0.05 0.13 5.97 0.00 -0.32 -4.27 121.76 122.32 1ppw s ALA 34 Ca 0.41 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 51.35 1ppw s ALA 34 Cb -0.25 1.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 1ppw s ALA 34 CO 0.31 -0.79 -0.01 -0.59 0.00 0.00 0.00 175.76 174.69 1ppw s PHE 35 N -4.04 1.00 -0.02 0.00 -0.12 -0.64 -3.68 117.98 110.49 1ppw s PHE 35 Ca 0.25 -1.04 0.00 0.00 -0.05 0.00 0.00 56.93 56.10 1ppw s PHE 35 Cb 0.01 -0.58 0.02 0.00 -0.63 0.00 0.00 43.02 41.84 1ppw s PHE 35 CO 0.09 -0.27 0.00 0.45 -0.05 0.00 0.00 175.22 175.44 1ppw s SER 36 N -3.09 0.26 -0.01 1.98 0.15 -0.97 -1.49 113.70 110.53 1ppw s SER 36 Ca 0.19 -0.01 0.04 0.00 0.70 0.00 0.00 55.95 56.88 1ppw s SER 36 Cb 0.06 -0.13 -0.01 0.00 -1.71 0.00 0.00 66.02 64.23 1ppw s SER 36 CO 0.00 -0.08 -0.14 -0.55 1.20 0.00 0.00 173.24 173.67 1ppw s SER 37 N 0.75 1.65 -0.22 5.45 0.15 0.13 -0.14 113.70 121.47 1ppw s SER 37 Ca -0.07 -0.27 -0.04 0.00 0.70 0.00 0.00 55.95 56.26 1ppw s SER 37 Cb -0.10 -0.18 -0.01 0.00 -1.71 0.00 0.00 66.02 64.02 1ppw s SER 37 CO -0.02 0.16 -0.03 0.26 1.20 0.00 0.00 173.24 174.81 1ppw s TRP 38 N -0.38 2.98 -0.08 3.44 0.52 0.58 -2.12 118.94 123.87 1ppw s TRP 38 Ca 0.05 -0.80 0.00 0.00 0.02 0.00 0.00 56.10 55.38 1ppw s TRP 38 Cb -0.06 -2.10 -0.03 0.00 -1.15 0.00 0.00 33.47 30.13 1ppw s TRP 38 CO -0.00 -0.47 -0.08 -0.51 0.02 0.00 0.00 176.95 175.91 1ppw s LEU 39 N 1.37 3.08 -0.02 2.99 1.43 -1.26 -2.17 118.68 124.11 1ppw s LEU 39 Ca 0.04 -0.09 0.06 0.00 -1.03 0.00 0.00 54.13 53.12 1ppw s LEU 39 Cb -0.14 -1.68 -0.02 0.00 0.03 0.00 0.00 46.19 44.38 1ppw s LEU 39 CO -0.01 0.31 -0.20 -0.36 0.23 0.00 0.00 176.35 176.32 1ppw s PHE 40 N -0.53 1.83 0.81 0.29 0.40 -0.62 -0.26 117.98 119.90 1ppw s PHE 40 Ca 0.08 -0.35 -0.11 0.00 -0.60 0.00 0.00 56.93 55.95 1ppw s PHE 40 Cb -0.12 -1.18 0.10 0.00 0.51 0.00 0.00 43.02 42.34 1ppw s PHE 40 CO 0.02 -0.04 1.15 0.54 0.70 0.00 0.00 175.22 177.59 1ppw s ASN 41 N -0.45 4.27 0.31 1.36 2.20 0.84 -0.91 114.94 122.55 1ppw s ASN 41 Ca 0.07 0.49 0.07 0.00 -0.94 0.00 0.00 52.86 52.55 1ppw s ASN 41 Cb -0.08 -0.92 0.83 0.00 -2.00 0.00 0.00 41.25 39.08 1ppw s ASN 41 CO -0.01 -2.00 1.70 0.00 -2.94 0.00 0.00 177.10 173.86 1ppw h ALA 42 N -1.02 1.63 0.00 3.54 0.00 -1.83 0.52 119.26 122.10 1ppw h ALA 42 Ca -0.45 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ppw h ALA 42 Cb 1.30 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1ppw h ALA 42 CO 0.56 -0.34 0.00 0.87 0.00 0.00 0.00 179.25 180.34 1ppw h LYS 43 N 0.46 0.00 0.00 0.00 1.57 -1.87 0.12 116.57 116.84 1ppw h LYS 43 Ca 0.61 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.39 1ppw h LYS 43 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1ppw h LYS 43 CO -0.52 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 178.77 1ppw n GLY 44 N -0.74 0.84 3.78 3.86 0.00 0.18 -4.08 105.19 109.03 1ppw n GLY 44 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1ppw n GLY 44 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ppw s GLN 45 N -0.92 4.49 -0.05 1.61 -0.21 -1.25 -4.16 119.66 119.16 1ppw s GLN 45 Ca 0.00 1.35 -0.22 0.00 0.02 0.00 0.00 55.36 56.51 1ppw s GLN 45 Cb 0.00 -2.71 -0.04 0.00 1.00 0.00 0.00 33.01 31.26 1ppw s GLN 45 CO 0.00 0.19 0.64 -1.17 -2.12 0.00 0.00 175.29 172.82 1ppw s LEU 46 N -2.23 4.34 -0.38 2.90 2.96 0.00 -0.11 118.68 126.16 1ppw s LEU 46 Ca 0.52 1.13 -0.24 0.00 -0.22 0.00 0.00 54.13 55.32 1ppw s LEU 46 Cb -0.18 -2.98 0.01 0.00 0.50 0.00 0.00 46.19 43.54 1ppw s LEU 46 CO 0.24 -0.03 0.85 -0.22 -1.32 0.00 0.00 176.35 175.87 1ppw s LEU 47 N 0.48 4.07 -0.09 -0.68 2.96 0.64 -1.42 118.68 124.64 1ppw s LEU 47 Ca 0.34 0.40 -0.08 0.00 -0.22 0.00 0.00 54.13 54.57 1ppw s LEU 47 Cb -0.18 -3.13 -0.04 0.00 0.50 0.00 0.00 46.19 43.34 1ppw s LEU 47 CO 0.17 -0.82 0.18 -0.69 -1.32 0.00 0.00 176.35 173.87 1ppw s VAL 48 N 3.32 5.43 0.25 1.68 1.01 0.13 -3.39 120.40 128.84 1ppw s VAL 48 Ca 0.35 0.28 0.06 0.00 0.00 0.00 0.00 61.98 62.67 1ppw s VAL 48 Cb -0.12 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 1ppw s VAL 48 CO 0.19 0.59 -0.06 0.42 0.00 0.00 0.00 175.10 176.23 1ppw s THR 49 N -1.06 1.53 -0.22 3.92 -4.23 -0.61 -1.28 115.64 113.69 1ppw s THR 49 Ca 0.17 -2.12 0.01 0.00 -1.18 0.00 0.00 61.69 58.58 1ppw s THR 49 Cb -0.13 -2.34 0.05 0.00 1.34 0.00 0.00 72.50 71.42 1ppw s THR 49 CO 0.06 -0.37 -0.11 -0.60 -0.54 0.00 0.00 174.62 173.07 1ppw s ARG 50 N -3.74 2.13 0.52 3.99 3.52 -0.24 0.68 118.95 125.81 1ppw s ARG 50 Ca 0.28 -1.02 -0.21 0.00 -0.13 0.00 0.00 55.73 54.64 1ppw s ARG 50 Cb 0.03 -2.60 -0.07 0.00 -1.56 0.00 0.00 34.95 30.75 1ppw s ARG 50 CO 0.10 -0.47 1.08 0.54 -0.81 0.00 0.00 175.30 175.74 1ppw n ARG 51 N 4.60 1.29 -1.83 5.12 1.74 -0.19 -0.82 116.66 126.57 1ppw n ARG 51 Ca -0.15 0.48 -0.32 0.00 -0.77 0.00 0.00 57.85 57.09 1ppw n ARG 51 Cb 0.45 -2.23 0.03 0.00 -1.02 0.00 0.00 32.46 29.69 1ppw n ARG 51 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ppw s ALA 52 N -1.37 2.70 0.46 7.54 0.00 -0.78 -2.37 121.76 127.94 1ppw s ALA 52 Ca 0.70 0.27 0.38 0.00 0.00 0.00 0.00 51.96 53.30 1ppw s ALA 52 Cb -0.47 -3.21 1.93 0.00 0.00 0.00 0.00 23.12 21.37 1ppw s ALA 52 CO 0.52 -1.00 2.21 -0.07 0.00 0.00 0.00 175.76 177.41 1ppw h LEU 53 N -0.06 0.00 0.00 0.00 3.38 -1.92 -1.66 115.31 115.05 1ppw h LEU 53 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1ppw h LEU 53 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1ppw h LEU 53 CO 0.57 0.02 -0.15 -1.54 0.09 0.00 0.00 178.44 177.43 1ppw n SER 54 N -3.23 0.26 -4.76 -0.43 3.41 -1.26 -4.76 113.62 102.84 1ppw n SER 54 Ca -0.02 0.31 -0.41 0.00 -0.26 0.00 0.00 58.87 58.49 1ppw n SER 54 Cb 0.17 -0.32 -0.01 0.00 -0.26 0.00 0.00 64.21 63.79 1ppw n SER 54 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1ppw s LYS 55 N -3.02 4.12 0.14 4.33 -0.14 -0.63 -4.89 119.74 119.64 1ppw s LYS 55 Ca 0.12 2.58 -0.15 0.00 -1.36 0.00 0.00 55.97 57.16 1ppw s LYS 55 Cb 0.18 -3.00 0.01 0.00 -1.68 0.00 0.00 37.83 33.33 1ppw s LYS 55 CO 0.59 -0.59 1.66 -0.22 -0.76 0.00 0.00 175.35 176.03 1ppw h LYS 56 N 4.04 0.68 -6.11 1.68 3.64 -1.90 -3.35 116.57 115.24 1ppw h LYS 56 Ca -0.49 -0.15 -0.68 0.00 -1.27 0.00 0.00 60.65 58.06 1ppw h LYS 56 Cb 1.23 -0.10 -0.20 0.00 -0.41 0.00 0.00 32.23 32.75 1ppw h LYS 56 CO 0.73 0.66 -0.70 0.00 -2.27 0.00 0.00 179.45 177.87 1ppw s ALA 57 N -5.40 2.94 -1.23 5.00 0.00 -1.26 -4.63 121.76 117.17 1ppw s ALA 57 Ca -0.13 -0.90 -0.29 0.00 0.00 0.00 0.00 51.96 50.64 1ppw s ALA 57 Cb 0.11 -1.21 0.03 0.00 0.00 0.00 0.00 23.12 22.05 1ppw s ALA 57 CO 0.77 0.55 0.65 0.91 0.00 0.00 0.00 175.76 178.64 1ppw n TRP 58 N 2.32 -1.49 -2.26 0.00 8.01 -1.26 -4.94 117.44 117.82 1ppw n TRP 58 Ca -0.18 0.20 -0.36 0.00 -1.31 0.00 0.00 57.50 55.85 1ppw n TRP 58 Cb 0.53 -2.95 -0.00 0.00 -2.01 0.00 0.00 31.31 26.88 1ppw n TRP 58 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.69 175.43 1ppw s PRO 59 N -7.12 3.57 -0.97 -0.99 0.04 -1.26 -3.41 135.00 124.86 1ppw s PRO 59 Ca 0.44 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1ppw s PRO 59 Cb -0.23 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.10 1ppw s PRO 59 CO 0.95 -0.69 0.00 0.41 0.04 0.00 0.00 177.00 177.71 1ppw n GLY 60 N 0.30 1.05 3.68 0.56 0.00 -1.00 -4.94 105.19 104.84 1ppw n GLY 60 Ca 0.09 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1ppw n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ppw s VAL 61 N -2.22 4.46 0.30 1.61 1.01 -1.22 -4.81 120.40 119.54 1ppw s VAL 61 Ca 0.00 -0.18 -0.29 0.00 0.00 0.00 0.00 61.98 61.51 1ppw s VAL 61 Cb 0.00 -2.91 -0.09 0.00 0.00 0.00 0.00 36.38 33.37 1ppw s VAL 61 CO 0.00 0.57 1.12 0.26 0.00 0.00 0.00 175.10 177.05 1ppw s TRP 62 N -0.59 3.47 0.25 5.22 0.52 -1.26 -1.02 118.94 125.53 1ppw s TRP 62 Ca 0.10 1.66 -0.08 0.00 0.02 0.00 0.00 56.10 57.80 1ppw s TRP 62 Cb -0.12 -3.31 0.03 0.00 -1.15 0.00 0.00 33.47 28.93 1ppw s TRP 62 CO 0.02 -0.71 0.48 -2.37 0.02 0.00 0.00 176.95 174.39 1ppw n THR 63 N 0.96 0.00 -1.60 2.01 5.66 0.21 -1.32 114.28 120.20 1ppw n THR 63 Ca -0.00 -0.72 -0.30 0.00 -3.05 0.00 0.00 64.05 59.97 1ppw n THR 63 Cb 0.45 0.65 0.22 0.00 -1.55 0.00 0.00 70.33 70.11 1ppw n THR 63 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1ppw s ASN 64 N -2.35 1.97 0.14 1.09 2.20 -1.26 -1.58 114.94 115.15 1ppw s ASN 64 Ca 0.12 0.31 -0.19 0.00 -0.94 0.00 0.00 52.86 52.15 1ppw s ASN 64 Cb -0.03 -0.34 0.01 0.00 -2.00 0.00 0.00 41.25 38.89 1ppw s ASN 64 CO 0.09 -3.44 1.69 0.28 -2.94 0.00 0.00 177.10 172.77 1ppw h SER 65 N -2.13 -0.25 -3.63 3.54 0.02 -1.55 -3.37 113.55 106.18 1ppw h SER 65 Ca -0.44 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.59 1ppw h SER 65 Cb 1.24 0.16 -0.22 0.00 0.14 0.00 0.00 62.40 63.73 1ppw h SER 65 CO 0.31 -0.09 0.17 0.54 -1.14 0.00 0.00 176.83 176.62 1ppw s VAL 66 N -6.21 0.00 0.17 2.27 0.11 -0.90 -4.73 120.40 111.12 1ppw s VAL 66 Ca -0.14 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 58.98 1ppw s VAL 66 Cb 0.11 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1ppw s VAL 66 CO 0.69 0.00 -0.14 0.00 -3.33 0.00 0.00 175.10 172.32 1ppw n GLY 68 N -0.04 0.90 2.98 0.00 0.00 -0.55 -4.98 105.19 103.49 1ppw n GLY 68 Ca -0.11 -0.82 -0.28 0.00 0.00 0.00 0.00 46.02 44.81 1ppw n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ppw s HIS 69 N -3.59 1.82 0.47 1.61 3.76 -1.26 -1.61 115.29 116.48 1ppw s HIS 69 Ca 0.00 -0.94 -0.24 0.00 -0.15 0.00 0.00 55.06 53.73 1ppw s HIS 69 Cb 0.00 -1.39 -0.07 0.00 1.11 0.00 0.00 32.58 32.23 1ppw s HIS 69 CO 0.00 -0.55 1.31 -2.14 -0.85 0.00 0.00 174.74 172.51 1ppw s PRO 70 N 1.44 3.62 0.42 8.40 0.02 -1.26 -5.01 135.00 142.63 1ppw s PRO 70 Ca 0.02 2.15 0.08 0.00 0.02 0.00 0.00 61.00 63.27 1ppw s PRO 70 Cb -0.13 -2.52 -0.00 0.00 0.02 0.00 0.00 34.50 31.87 1ppw s PRO 70 CO -0.07 -0.78 0.49 -0.65 -0.33 0.00 0.00 177.00 175.66 1ppw s GLN 71 N -2.57 2.69 -0.10 5.54 -1.52 -1.26 -4.44 119.66 118.00 1ppw s GLN 71 Ca 0.63 -1.38 -0.39 0.00 -1.95 0.00 0.00 55.36 52.27 1ppw s GLN 71 Cb -0.38 -2.59 -0.17 0.00 -0.22 0.00 0.00 33.01 29.65 1ppw s GLN 71 CO 0.47 -0.24 1.44 -0.11 -0.25 0.00 0.00 175.29 176.60 1ppw n LEU 72 N -1.72 1.53 0.00 2.90 7.94 -1.26 -1.31 117.00 125.09 1ppw n LEU 72 Ca 0.06 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.08 1ppw n LEU 72 Cb 0.60 -1.10 0.00 0.00 0.53 0.00 0.00 43.42 43.45 1ppw n LEU 72 CO 0.41 -0.99 0.00 0.61 -1.11 0.00 0.00 177.39 176.30 1ppw n GLY 73 N 2.99 3.07 3.80 -3.96 0.00 -1.26 -5.03 105.19 104.80 1ppw n GLY 73 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 1ppw n GLY 73 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ppw s GLU 74 N -0.30 4.41 0.27 1.61 2.12 -0.43 -5.08 118.70 121.30 1ppw s GLU 74 Ca 0.00 1.05 -0.20 0.00 0.36 0.00 0.00 54.97 56.18 1ppw s GLU 74 Cb 0.00 -2.96 -0.09 0.00 0.26 0.00 0.00 34.13 31.34 1ppw s GLU 74 CO 0.00 0.41 0.77 -1.54 -0.54 0.00 0.00 175.26 174.37 1ppw s SER 75 N -1.51 7.04 0.38 -1.70 1.04 -1.26 -4.72 113.70 112.96 1ppw s SER 75 Ca 0.43 1.47 0.18 0.00 0.48 0.00 0.00 55.95 58.51 1ppw s SER 75 Cb -0.19 -2.44 1.12 0.00 0.10 0.00 0.00 66.02 64.61 1ppw s SER 75 CO 0.23 -0.05 1.71 0.78 0.98 0.00 0.00 173.24 176.89 1ppw h ASN 76 N 3.09 0.47 0.72 7.02 -0.26 -1.98 0.38 115.58 125.02 1ppw h ASN 76 Ca -0.48 0.13 -0.20 0.00 -0.56 0.00 0.00 56.30 55.19 1ppw h ASN 76 Cb 1.19 0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 38.50 1ppw h ASN 76 CO 0.65 -0.01 -0.92 -0.33 -1.06 0.00 0.00 177.43 175.76 1ppw h GLU 77 N 0.35 0.12 -0.09 0.81 3.07 -1.98 -2.64 114.58 114.23 1ppw h GLU 77 Ca 0.68 -0.15 -0.11 0.00 -0.50 0.00 0.00 59.36 59.28 1ppw h GLU 77 Cb 1.69 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.64 1ppw h GLU 77 CO -0.42 0.95 -0.43 -0.44 -1.40 0.00 0.00 179.01 177.27 1ppw h ASP 78 N 0.06 0.21 -0.20 1.42 3.32 -0.69 -2.32 116.42 118.22 1ppw h ASP 78 Ca -0.04 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 56.90 1ppw h ASP 78 Cb 1.59 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 41.07 1ppw h ASP 78 CO 0.13 0.62 0.02 0.00 -1.72 0.00 0.00 179.24 178.29 1ppw h ALA 79 N 1.39 0.27 -0.13 3.45 0.00 -1.11 0.23 119.26 123.36 1ppw h ALA 79 Ca 0.01 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.78 1ppw h ALA 79 Cb 0.84 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.49 1ppw h ALA 79 CO 0.07 -0.04 -0.32 0.28 0.00 0.00 0.00 179.25 179.23 1ppw h VAL 80 N 0.12 0.28 -0.59 0.00 2.07 -1.32 0.19 116.25 117.01 1ppw h VAL 80 Ca 0.06 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.60 1ppw h VAL 80 Cb 0.35 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 1ppw h VAL 80 CO 0.01 0.00 0.37 0.40 0.02 0.00 0.00 177.57 178.36 1ppw h ILE 81 N -0.40 1.09 0.58 4.57 2.04 -1.13 -1.01 117.51 123.25 1ppw h ILE 81 Ca 0.09 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1ppw h ILE 81 Cb 0.55 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1ppw h ILE 81 CO -0.35 0.13 -0.34 -0.09 0.00 0.00 0.00 178.15 177.50 1ppw h ARG 82 N 0.73 -0.84 -0.88 2.37 2.43 -0.06 -2.73 114.38 115.41 1ppw h ARG 82 Ca 0.23 0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.47 1ppw h ARG 82 Cb -0.01 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 1ppw h ARG 82 CO -0.09 -0.56 0.58 0.00 -1.51 0.00 0.00 179.97 178.40 1ppw h ARG 83 N -0.87 1.15 -0.97 0.20 2.47 -0.43 -0.07 114.38 115.85 1ppw h ARG 83 Ca -0.07 -0.07 0.07 0.00 -1.26 0.00 0.00 59.98 58.65 1ppw h ARG 83 Cb 0.70 -0.26 -0.07 0.00 -1.65 0.00 0.00 29.97 28.69 1ppw h ARG 83 CO 0.08 0.76 0.62 0.00 0.56 0.00 0.00 179.97 181.99 1ppw h ARG 85 N 1.10 0.54 -0.16 0.00 3.08 -0.92 -0.23 114.38 117.78 1ppw h ARG 85 Ca 0.43 -0.32 -0.11 0.00 0.07 0.00 0.00 59.98 60.05 1ppw h ARG 85 Cb 0.22 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1ppw h ARG 85 CO -0.19 0.91 -0.34 -0.92 -1.07 0.00 0.00 179.97 178.37 1ppw h TYR 86 N 0.21 0.65 0.02 3.04 3.20 -0.63 0.77 116.97 124.23 1ppw h TYR 86 Ca 0.02 -0.24 -0.26 0.00 3.14 0.00 0.00 58.73 61.40 1ppw h TYR 86 Cb 0.85 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.96 1ppw h TYR 86 CO 0.09 0.97 -1.36 0.93 -1.64 0.00 0.00 178.16 177.14 1ppw h GLU 87 N 0.15 0.03 0.00 1.82 5.08 -0.66 -3.40 114.58 117.60 1ppw h GLU 87 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1ppw h GLU 87 Cb 0.93 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1ppw h GLU 87 CO 0.07 0.81 0.00 1.28 -1.00 0.00 0.00 179.01 180.17 1ppw n LEU 88 N -3.24 0.16 -0.88 1.33 4.77 -0.20 -1.18 117.00 117.76 1ppw n LEU 88 Ca -0.09 -0.38 -0.11 0.00 -0.03 0.00 0.00 56.01 55.39 1ppw n LEU 88 Cb 1.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.04 1ppw n LEU 88 CO 0.47 0.04 -0.11 0.61 -1.33 0.00 0.00 177.39 177.07 1ppw n GLY 89 N 0.44 1.19 3.62 -0.72 0.00 0.26 0.14 105.19 110.12 1ppw n GLY 89 Ca 0.00 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1ppw n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ppw s VAL 90 N -2.23 3.74 0.30 1.61 0.11 -0.91 -4.26 120.40 118.77 1ppw s VAL 90 Ca 0.00 -0.81 -0.16 0.00 -2.93 0.00 0.00 61.98 58.08 1ppw s VAL 90 Cb 0.00 -2.66 -0.09 0.00 -1.53 0.00 0.00 36.38 32.10 1ppw s VAL 90 CO 0.00 0.34 0.74 -1.61 -3.33 0.00 0.00 175.10 171.23 1ppw s GLU 91 N -1.60 4.06 0.09 1.54 0.41 -1.26 -3.81 118.70 118.13 1ppw s GLU 91 Ca 0.19 0.72 -0.00 0.00 -0.41 0.00 0.00 54.97 55.47 1ppw s GLU 91 Cb -0.11 -2.53 -0.04 0.00 -1.78 0.00 0.00 34.13 29.67 1ppw s GLU 91 CO 0.10 0.21 -0.01 0.96 -0.49 0.00 0.00 175.26 176.03 1ppw s ILE 92 N -1.88 0.30 0.68 -1.63 -4.36 -1.26 -0.16 121.20 112.89 1ppw s ILE 92 Ca 0.52 -1.87 -0.11 0.00 -0.26 0.00 0.00 60.65 58.92 1ppw s ILE 92 Cb -0.12 -1.75 -0.00 0.00 1.25 0.00 0.00 42.46 41.84 1ppw s ILE 92 CO 0.18 -0.78 1.06 0.42 0.24 0.00 0.00 174.94 176.06 1ppw s THR 93 N -3.89 4.00 -0.02 8.37 -4.23 -0.22 -4.84 115.64 114.81 1ppw s THR 93 Ca 0.14 0.65 -0.36 0.00 -1.18 0.00 0.00 61.69 60.94 1ppw s THR 93 Cb 0.07 -3.56 -0.14 0.00 1.34 0.00 0.00 72.50 70.21 1ppw s THR 93 CO -0.05 -0.85 1.67 -2.65 -0.54 0.00 0.00 174.62 172.21 1ppw n PRO 94 N -2.99 1.80 -1.81 3.99 -0.02 -1.26 -4.53 135.00 130.17 1ppw n PRO 94 Ca 0.07 0.65 -0.41 0.00 -2.02 0.00 0.00 63.50 61.79 1ppw n PRO 94 Cb 0.55 -2.41 -0.01 0.00 -0.02 0.00 0.00 33.50 31.61 1ppw n PRO 94 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1ppw s PRO 95 N 2.42 4.12 -0.12 0.52 0.02 -1.26 -4.79 135.00 135.90 1ppw s PRO 95 Ca 0.88 2.56 -0.06 0.00 0.02 0.00 0.00 61.00 64.40 1ppw s PRO 95 Cb -0.80 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 30.69 1ppw s PRO 95 CO 0.49 -0.54 0.10 -2.00 -0.33 0.00 0.00 177.00 174.72 1ppw s GLU 96 N -1.69 3.45 -0.17 5.54 2.12 0.81 -4.91 118.70 123.85 1ppw s GLU 96 Ca 0.55 -0.22 -0.28 0.00 0.36 0.00 0.00 54.97 55.39 1ppw s GLU 96 Cb -0.46 -3.12 -0.01 0.00 0.26 0.00 0.00 34.13 30.79 1ppw s GLU 96 CO 0.59 0.68 0.94 0.45 -0.54 0.00 0.00 175.26 177.38 1ppw s SER 97 N -0.77 7.08 0.00 -1.70 0.15 -1.26 -1.03 113.70 116.17 1ppw s SER 97 Ca 0.13 1.34 0.00 0.00 0.70 0.00 0.00 55.95 58.12 1ppw s SER 97 Cb -0.12 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 1ppw s SER 97 CO 0.03 -0.49 0.08 2.30 1.20 0.00 0.00 173.24 176.35 1ppw n ILE 98 N 4.85 0.00 -2.73 6.45 -5.35 -0.60 -4.89 119.36 117.09 1ppw n ILE 98 Ca 0.08 -0.42 -0.07 0.00 -0.27 0.00 0.00 62.75 62.07 1ppw n ILE 98 Cb 0.48 1.03 0.05 0.00 -1.74 0.00 0.00 39.64 39.46 1ppw n ILE 98 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ppw n TYR 99 N -0.70 -2.62 0.26 4.28 4.19 -1.15 -3.58 117.16 117.85 1ppw n TYR 99 Ca 0.00 -1.42 0.15 0.00 3.31 0.00 0.00 57.90 59.94 1ppw n TYR 99 Cb 0.01 1.43 0.59 0.00 0.49 0.00 0.00 39.34 41.86 1ppw n TYR 99 CO 0.00 0.00 0.00 -1.00 0.91 0.00 0.00 176.86 176.77 1ppw h PRO 100 N 3.90 0.00 -0.51 2.98 0.13 -1.90 -2.17 132.00 134.42 1ppw h PRO 100 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 1ppw h PRO 100 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1ppw h PRO 100 CO 0.16 0.07 0.00 -0.40 -0.23 0.00 0.00 178.00 177.59 1ppw n ASP 101 N -3.19 3.29 -4.74 1.44 5.75 -1.26 -4.37 116.55 113.47 1ppw n ASP 101 Ca 0.01 -1.97 -0.41 0.00 -0.01 0.00 0.00 54.79 52.40 1ppw n ASP 101 Cb 0.35 -0.34 -0.02 0.00 -1.03 0.00 0.00 41.12 40.08 1ppw n ASP 101 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1ppw s PHE 102 N -1.32 2.96 -0.03 2.11 5.36 -1.06 -4.92 117.98 121.08 1ppw s PHE 102 Ca 0.41 0.89 -0.02 0.00 -0.96 0.00 0.00 56.93 57.25 1ppw s PHE 102 Cb 0.22 -3.90 0.02 0.00 -0.34 0.00 0.00 43.02 39.01 1ppw s PHE 102 CO 0.30 -3.04 0.07 0.50 -1.46 0.00 0.00 175.22 171.59 1ppw s ARG 103 N -0.15 0.05 -0.16 10.12 3.52 -1.26 -0.68 118.95 130.39 1ppw s ARG 103 Ca 0.62 0.16 -0.18 0.00 -0.13 0.00 0.00 55.73 56.20 1ppw s ARG 103 Cb -0.44 -0.06 0.05 0.00 -1.56 0.00 0.00 34.95 32.93 1ppw s ARG 103 CO 0.42 -0.07 0.48 1.52 -0.81 0.00 0.00 175.30 176.84 1ppw s TYR 104 N 0.46 -0.50 -0.07 5.12 -0.85 0.57 -4.96 117.35 117.12 1ppw s TYR 104 Ca -0.04 1.18 0.05 0.00 -0.52 0.00 0.00 57.07 57.75 1ppw s TYR 104 Cb -0.05 0.19 -0.00 0.00 0.38 0.00 0.00 41.96 42.47 1ppw s TYR 104 CO -0.02 -0.29 -0.23 0.50 -1.52 0.00 0.00 175.55 174.00 1ppw s ARG 105 N 0.01 2.51 -0.12 -3.49 3.52 -1.26 -1.18 118.95 118.94 1ppw s ARG 105 Ca -0.02 -0.81 -0.30 0.00 -0.13 0.00 0.00 55.73 54.46 1ppw s ARG 105 Cb -0.03 -2.05 0.09 0.00 -1.56 0.00 0.00 34.95 31.40 1ppw s ARG 105 CO 0.02 0.28 0.82 0.00 -0.81 0.00 0.00 175.30 175.60 1ppw s ALA 106 N 0.07 -1.84 -0.10 6.12 0.00 -0.64 -5.02 121.76 120.35 1ppw s ALA 106 Ca -0.09 1.49 -0.02 0.00 0.00 0.00 0.00 51.96 53.34 1ppw s ALA 106 Cb -0.15 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.53 1ppw s ALA 106 CO 0.05 -0.34 -0.03 0.99 0.00 0.00 0.00 175.76 176.44 1ppw s THR 107 N -1.00 4.05 0.57 0.00 2.01 -1.26 -1.26 115.64 118.76 1ppw s THR 107 Ca -0.06 -0.33 -0.02 0.00 0.31 0.00 0.00 61.69 61.58 1ppw s THR 107 Cb -0.01 -2.71 0.03 0.00 0.01 0.00 0.00 72.50 69.82 1ppw s THR 107 CO 0.05 0.57 0.84 1.51 -0.69 0.00 0.00 174.62 176.90 1ppw s ASP 108 N -0.49 5.36 0.59 3.53 -4.77 -0.07 -4.90 116.67 115.92 1ppw s ASP 108 Ca 0.08 0.33 0.29 0.00 -3.30 0.00 0.00 52.55 49.95 1ppw s ASP 108 Cb -0.12 -1.27 1.49 0.00 -1.09 0.00 0.00 42.92 41.94 1ppw s ASP 108 CO 0.02 -1.14 1.91 -0.65 0.70 0.00 0.00 175.17 176.01 1ppw h PRO 109 N -0.08 0.00 -0.47 2.11 0.11 -1.99 0.33 132.00 132.02 1ppw h PRO 109 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1ppw h PRO 109 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1ppw h PRO 109 CO 0.57 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.23 1ppw n SER 110 N -3.71 3.31 0.00 -2.05 3.41 -1.26 -4.95 113.62 108.37 1ppw n SER 110 Ca 0.08 -1.96 0.00 0.00 -0.26 0.00 0.00 58.87 56.72 1ppw n SER 110 Cb 0.64 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 1ppw n SER 110 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ppw n GLY 111 N 1.06 0.86 3.73 5.00 0.00 0.12 -5.05 105.19 110.91 1ppw n GLY 111 Ca 0.17 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1ppw n GLY 111 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ppw s ILE 112 N -2.00 4.14 -0.18 -0.61 1.01 -1.26 -4.17 121.20 118.13 1ppw s ILE 112 Ca 0.00 1.78 -0.07 0.00 0.00 0.00 0.00 60.65 62.36 1ppw s ILE 112 Cb 0.00 -4.13 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 1ppw s ILE 112 CO 0.00 0.27 0.05 -0.69 0.00 0.00 0.00 174.94 174.57 1ppw s VAL 113 N 0.01 4.69 -0.03 2.92 1.01 0.59 -0.89 120.40 128.70 1ppw s VAL 113 Ca 0.49 -0.07 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 1ppw s VAL 113 Cb -0.27 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 1ppw s VAL 113 CO 0.32 0.46 0.17 -1.61 0.00 0.00 0.00 175.10 174.45 1ppw s GLU 114 N 0.38 3.42 -0.35 2.72 0.41 -0.39 -4.26 118.70 120.65 1ppw s GLU 114 Ca 0.02 -0.30 0.04 0.00 -0.41 0.00 0.00 54.97 54.33 1ppw s GLU 114 Cb -0.13 -3.10 0.17 0.00 -1.78 0.00 0.00 34.13 29.29 1ppw s GLU 114 CO 0.00 0.69 0.48 1.21 -0.49 0.00 0.00 175.26 177.16 1ppw s ASN 115 N -1.79 -0.17 0.03 -0.19 2.47 -1.26 -1.61 114.94 112.42 1ppw s ASN 115 Ca 0.25 -0.76 0.02 0.00 0.42 0.00 0.00 52.86 52.79 1ppw s ASN 115 Cb -0.12 1.30 -0.02 0.00 -1.45 0.00 0.00 41.25 40.96 1ppw s ASN 115 CO 0.16 -0.27 -0.07 -1.61 -3.72 0.00 0.00 177.10 171.60 1ppw s GLU 116 N 2.07 0.47 -0.48 0.43 2.02 -0.32 -2.29 118.70 120.60 1ppw s GLU 116 Ca 0.13 -0.65 -0.23 0.00 0.02 0.00 0.00 54.97 54.25 1ppw s GLU 116 Cb -0.11 -0.24 0.03 0.00 0.10 0.00 0.00 34.13 33.92 1ppw s GLU 116 CO -0.16 0.04 0.79 0.08 0.02 0.00 0.00 175.26 176.04 1ppw s VAL 117 N -1.20 4.62 -0.50 2.63 1.01 -0.93 -0.32 120.40 125.72 1ppw s VAL 117 Ca -0.09 0.25 0.05 0.00 0.00 0.00 0.00 61.98 62.19 1ppw s VAL 117 Cb -0.09 -4.36 0.19 0.00 0.00 0.00 0.00 36.38 32.12 1ppw s VAL 117 CO 0.00 -0.82 0.45 0.00 0.00 0.00 0.00 175.10 174.73 1ppw n PRO 119 N 2.17 1.26 -4.56 0.00 -0.02 -1.24 -4.41 135.00 128.21 1ppw n PRO 119 Ca 0.26 0.46 -0.33 0.00 -2.02 0.00 0.00 63.50 61.87 1ppw n PRO 119 Cb 0.45 -2.01 -0.11 0.00 -0.02 0.00 0.00 33.50 31.82 1ppw n PRO 119 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ppw s VAL 120 N -1.30 3.60 0.20 -1.45 1.01 -0.84 -2.30 120.40 119.31 1ppw s VAL 120 Ca 0.64 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 62.00 1ppw s VAL 120 Cb -0.55 -2.52 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 1ppw s VAL 120 CO 0.56 0.48 -0.11 -0.36 0.00 0.00 0.00 175.10 175.67 1ppw s PHE 121 N -0.91 1.58 0.09 5.22 0.40 0.80 -1.55 117.98 123.61 1ppw s PHE 121 Ca 0.15 -0.67 0.06 0.00 -0.60 0.00 0.00 56.93 55.87 1ppw s PHE 121 Cb -0.11 -0.78 -0.03 0.00 0.51 0.00 0.00 43.02 42.60 1ppw s PHE 121 CO 0.05 0.23 -0.15 0.00 0.70 0.00 0.00 175.22 176.05 1ppw s ALA 122 N -3.12 1.40 0.30 5.36 0.00 -0.20 -0.31 121.76 125.19 1ppw s ALA 122 Ca 0.22 -1.14 -0.17 0.00 0.00 0.00 0.00 51.96 50.86 1ppw s ALA 122 Cb 0.01 -0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.03 1ppw s ALA 122 CO 0.05 0.18 0.66 0.00 0.00 0.00 0.00 175.76 176.66 1ppw s ALA 123 N -1.54 -0.79 -0.11 0.00 0.00 -0.92 -0.14 121.76 118.26 1ppw s ALA 123 Ca 0.03 -0.59 -0.04 0.00 0.00 0.00 0.00 51.96 51.36 1ppw s ALA 123 Cb -0.08 0.89 -0.04 0.00 0.00 0.00 0.00 23.12 23.89 1ppw s ALA 123 CO 0.03 -0.97 0.04 1.03 0.00 0.00 0.00 175.76 175.89 1ppw s ARG 124 N -3.60 3.31 0.28 0.00 1.81 -1.26 -1.59 118.95 117.90 1ppw s ARG 124 Ca 0.16 -0.34 -0.28 0.00 -1.72 0.00 0.00 55.73 53.55 1ppw s ARG 124 Cb -0.04 -2.97 -0.09 0.00 -0.45 0.00 0.00 34.95 31.39 1ppw s ARG 124 CO 0.09 0.62 0.95 0.95 -0.68 0.00 0.00 175.30 177.23 1ppw s THR 125 N -0.62 4.11 0.00 0.02 -4.23 -0.09 -1.06 115.64 113.76 1ppw s THR 125 Ca 0.11 1.93 0.00 0.00 -1.18 0.00 0.00 61.69 62.55 1ppw s THR 125 Cb -0.12 -4.15 0.00 0.00 1.34 0.00 0.00 72.50 69.57 1ppw s THR 125 CO 0.02 0.32 0.82 0.35 -0.54 0.00 0.00 174.62 175.59 1ppw n THR 126 N 1.01 0.66 -4.17 3.99 -2.24 0.77 -4.42 114.28 109.87 1ppw n THR 126 Ca 0.00 -0.80 -0.13 0.00 -2.27 0.00 0.00 64.05 60.84 1ppw n THR 126 Cb 0.48 0.69 -0.08 0.00 -2.10 0.00 0.00 70.33 69.32 1ppw n THR 126 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ppw s SER 127 N -0.66 0.47 0.85 3.42 1.04 -1.24 -4.91 113.70 112.67 1ppw s SER 127 Ca 0.00 -1.39 -0.10 0.00 0.48 0.00 0.00 55.95 54.93 1ppw s SER 127 Cb 0.00 0.47 0.11 0.00 0.10 0.00 0.00 66.02 66.70 1ppw s SER 127 CO 0.00 -0.97 1.12 0.00 0.98 0.00 0.00 173.24 174.36 1ppw s ALA 128 N -3.90 1.82 0.26 5.32 0.00 -1.26 -4.71 121.76 119.29 1ppw s ALA 128 Ca 0.36 0.40 -0.29 0.00 0.00 0.00 0.00 51.96 52.43 1ppw s ALA 128 Cb 0.04 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.72 1ppw s ALA 128 CO 0.15 -2.29 0.96 -0.51 0.00 0.00 0.00 175.76 174.07 1ppw s LEU 129 N -6.28 4.57 -0.51 0.00 1.43 -1.26 -4.47 118.68 112.16 1ppw s LEU 129 Ca 0.64 1.97 0.04 0.00 -1.03 0.00 0.00 54.13 55.74 1ppw s LEU 129 Cb -0.20 -3.70 0.16 0.00 0.03 0.00 0.00 46.19 42.48 1ppw s LEU 129 CO 0.57 0.07 0.36 -1.10 0.23 0.00 0.00 176.35 176.48 1ppw s GLN 130 N -1.41 1.49 0.25 1.70 -1.52 0.12 -4.99 119.66 115.31 1ppw s GLN 130 Ca 0.44 -2.45 -0.31 0.00 -1.95 0.00 0.00 55.36 51.08 1ppw s GLN 130 Cb -0.25 -2.30 -0.12 0.00 -0.22 0.00 0.00 33.01 30.12 1ppw s GLN 130 CO 0.31 -1.29 1.62 -0.89 -0.25 0.00 0.00 175.29 174.79 1ppw n ILE 131 N 2.79 0.60 -3.14 1.08 2.08 -1.24 -2.76 119.36 118.77 1ppw n ILE 131 Ca 0.20 -0.15 -0.42 0.00 0.56 0.00 0.00 62.75 62.94 1ppw n ILE 131 Cb 0.40 -1.88 -0.07 0.00 -0.75 0.00 0.00 39.64 37.34 1ppw n ILE 131 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1ppw s ASN 132 N 0.72 6.36 0.00 4.38 3.84 -0.33 -4.96 114.94 124.96 1ppw s ASN 132 Ca 0.69 -0.11 0.17 0.00 0.21 0.00 0.00 52.86 53.83 1ppw s ASN 132 Cb -0.53 -2.31 0.73 0.00 -0.55 0.00 0.00 41.25 38.59 1ppw s ASN 132 CO 0.43 -0.65 1.51 -0.90 -2.79 0.00 0.00 177.10 174.70 1ppw n ASP 133 N 6.08 1.11 0.15 -4.21 5.68 -1.26 -1.38 116.55 122.71 1ppw n ASP 133 Ca -0.02 -1.69 0.13 0.00 -0.50 0.00 0.00 54.79 52.71 1ppw n ASP 133 Cb 0.48 -0.09 0.42 0.00 -1.14 0.00 0.00 41.12 40.80 1ppw n ASP 133 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1ppw h ASP 134 N 1.41 0.00 0.00 -1.12 3.32 -1.96 -3.38 116.42 114.69 1ppw h ASP 134 Ca 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 1ppw h ASP 134 Cb 0.31 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1ppw h ASP 134 CO 0.00 0.00 -1.37 -0.62 -1.72 0.00 0.00 179.24 175.53 1ppw n GLU 135 N -2.47 1.95 -4.27 3.56 -0.58 -0.51 -4.75 120.64 113.56 1ppw n GLU 135 Ca 0.04 0.01 -0.23 0.00 -0.42 0.00 0.00 57.16 56.56 1ppw n GLU 135 Cb 0.38 -1.14 -0.17 0.00 -0.57 0.00 0.00 31.44 29.95 1ppw n GLU 135 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1ppw s VAL 136 N -2.13 0.88 -0.31 2.62 1.01 -0.48 -1.86 120.40 120.12 1ppw s VAL 136 Ca -0.05 -0.29 0.19 0.00 0.00 0.00 0.00 61.98 61.82 1ppw s VAL 136 Cb 0.02 -0.86 -0.26 0.00 0.00 0.00 0.00 36.38 35.28 1ppw s VAL 136 CO 0.19 0.31 0.54 1.15 0.00 0.00 0.00 175.10 177.29 1ppw n MET 137 N 4.18 0.71 -3.45 2.72 0.00 0.00 -4.10 117.12 117.19 1ppw n MET 137 Ca -0.21 -0.11 -0.12 0.00 0.00 0.00 0.00 57.70 57.26 1ppw n MET 137 Cb 0.51 -1.42 -0.03 0.00 0.00 0.00 0.00 33.22 32.29 1ppw n MET 137 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1ppw s ASP 138 N -3.67 -0.54 0.25 3.17 -1.08 -1.23 -5.01 116.67 108.57 1ppw s ASP 138 Ca -0.02 0.11 -0.13 0.00 -0.52 0.00 0.00 52.55 51.99 1ppw s ASP 138 Cb 0.13 0.54 -0.00 0.00 -1.46 0.00 0.00 42.92 42.12 1ppw s ASP 138 CO 0.77 -0.83 0.48 -0.72 0.52 0.00 0.00 175.17 175.39 1ppw s TYR 139 N -3.20 0.37 -0.25 -5.34 -0.85 -1.26 -1.07 117.35 105.75 1ppw s TYR 139 Ca 0.00 -0.73 -0.22 0.00 -0.52 0.00 0.00 57.07 55.60 1ppw s TYR 139 Cb -0.01 0.19 0.07 0.00 0.38 0.00 0.00 41.96 42.59 1ppw s TYR 139 CO -0.09 -1.00 0.65 -1.14 -1.52 0.00 0.00 175.55 172.45 1ppw s GLN 140 N -3.99 0.75 -0.23 -3.49 2.00 -0.40 -4.99 119.66 109.30 1ppw s GLN 140 Ca 0.23 0.95 -0.17 0.00 -2.00 0.00 0.00 55.36 54.36 1ppw s GLN 140 Cb -0.01 0.33 -0.03 0.00 0.80 0.00 0.00 33.01 34.10 1ppw s GLN 140 CO 0.09 -0.10 0.48 -1.58 -0.50 0.00 0.00 175.29 173.68 1ppw s TRP 141 N 0.54 3.31 0.23 1.67 0.52 -1.26 0.22 118.94 124.17 1ppw s TRP 141 Ca -0.02 0.65 0.03 0.00 0.02 0.00 0.00 56.10 56.78 1ppw s TRP 141 Cb -0.05 -2.66 -0.05 0.00 -1.15 0.00 0.00 33.47 29.57 1ppw s TRP 141 CO -0.02 -0.18 0.02 0.00 0.02 0.00 0.00 176.95 176.80 1ppw s ASP 143 N -3.29 7.17 0.20 0.00 1.01 -1.26 -0.82 116.67 119.68 1ppw s ASP 143 Ca 0.30 1.40 -0.14 0.00 0.71 0.00 0.00 52.55 54.82 1ppw s ASP 143 Cb 0.06 -2.46 0.20 0.00 1.01 0.00 0.00 42.92 41.73 1ppw s ASP 143 CO 0.09 -0.04 1.65 0.25 0.21 0.00 0.00 175.17 177.32 1ppw h LEU 144 N 6.05 -0.45 -0.83 1.23 5.85 -1.93 -1.37 115.31 123.86 1ppw h LEU 144 Ca -0.43 0.16 0.11 0.00 0.84 0.00 0.00 57.88 58.56 1ppw h LEU 144 Cb 1.20 0.32 -0.08 0.00 0.37 0.00 0.00 40.66 42.48 1ppw h LEU 144 CO 0.72 -0.16 0.47 0.00 -0.34 0.00 0.00 178.44 179.13 1ppw h ALA 145 N 1.54 1.21 0.09 1.25 0.00 -1.98 1.44 119.26 122.81 1ppw h ALA 145 Ca 0.27 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 1ppw h ALA 145 Cb 0.42 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ppw h ALA 145 CO -0.55 0.06 -0.06 -0.44 0.00 0.00 0.00 179.25 178.26 1ppw h ASP 146 N 0.76 -0.15 -0.73 0.00 3.32 -1.70 0.25 116.42 118.17 1ppw h ASP 146 Ca 0.42 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.50 1ppw h ASP 146 Cb 0.44 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.99 1ppw h ASP 146 CO -0.27 -0.10 0.47 0.58 -1.72 0.00 0.00 179.24 178.20 1ppw h VAL 147 N -0.15 1.14 -0.24 -1.35 2.07 0.28 0.38 116.25 118.37 1ppw h VAL 147 Ca -0.00 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 67.14 1ppw h VAL 147 Cb 0.13 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 1ppw h VAL 147 CO 0.00 0.17 -0.10 -0.07 0.02 0.00 0.00 177.57 177.60 1ppw h LEU 148 N 0.94 0.36 -0.71 2.57 3.38 0.21 -1.53 115.31 120.53 1ppw h LEU 148 Ca 0.28 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 1ppw h LEU 148 Cb -0.04 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1ppw h LEU 148 CO -0.09 0.50 -0.27 0.45 0.09 0.00 0.00 178.44 179.13 1ppw h HIS 149 N 0.36 0.79 -0.56 1.13 3.86 0.12 -2.70 115.15 118.16 1ppw h HIS 149 Ca 0.07 -0.19 -0.06 0.00 -1.16 0.00 0.00 60.37 59.04 1ppw h HIS 149 Cb 0.40 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 1ppw h HIS 149 CO 0.01 0.89 0.13 0.78 0.86 0.00 0.00 177.93 180.60 1ppw h GLY 150 N 0.98 0.96 1.79 2.45 0.00 0.54 -2.31 103.07 107.49 1ppw h GLY 150 Ca 0.08 -0.61 -0.06 0.00 0.00 0.00 0.00 47.33 46.74 1ppw h GLY 150 CO 0.06 0.56 -0.16 -2.22 0.00 0.00 0.00 176.54 174.79 1ppw h ILE 151 N 0.80 1.20 -0.06 2.60 2.04 -1.24 -1.60 117.51 121.23 1ppw h ILE 151 Ca 0.17 -0.87 -0.24 0.00 1.00 0.00 0.00 64.86 64.92 1ppw h ILE 151 Cb 0.35 1.25 0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1ppw h ILE 151 CO 0.00 0.27 -0.90 0.44 0.00 0.00 0.00 178.15 177.96 1ppw h ASP 152 N 0.24 0.90 -0.22 1.72 5.19 -1.33 -2.74 116.42 120.19 1ppw h ASP 152 Ca 0.05 -0.69 -0.18 0.00 -0.62 0.00 0.00 57.03 55.58 1ppw h ASP 152 Cb 0.43 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 39.67 1ppw h ASP 152 CO 0.03 1.47 -0.59 0.00 -3.12 0.00 0.00 179.24 177.03 1ppw h ALA 153 N 0.45 0.36 -1.50 3.45 0.00 -1.10 -3.40 119.26 117.53 1ppw h ALA 153 Ca -0.09 -0.53 -0.47 0.00 0.00 0.00 0.00 54.91 53.81 1ppw h ALA 153 Cb 1.55 -0.05 -0.33 0.00 0.00 0.00 0.00 17.79 18.96 1ppw h ALA 153 CO 0.18 0.60 -0.95 0.25 0.00 0.00 0.00 179.25 179.33 1ppw n THR 154 N -4.05 -0.52 0.29 0.00 -2.24 -0.63 -5.00 114.28 102.12 1ppw n THR 154 Ca -0.06 -3.38 0.15 0.00 -2.27 0.00 0.00 64.05 58.49 1ppw n THR 154 Cb 0.65 -1.09 0.87 0.00 -2.10 0.00 0.00 70.33 68.66 1ppw n THR 154 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1ppw h PRO 155 N 4.00 0.00 0.00 -0.78 0.13 -1.66 -2.17 132.00 131.52 1ppw h PRO 155 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1ppw h PRO 155 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1ppw h PRO 155 CO 0.43 0.05 0.00 -2.67 -0.23 0.00 0.00 178.00 175.57 1ppw n TRP 156 N -3.67 0.58 1.71 1.56 4.27 -1.26 -2.46 117.44 118.17 1ppw n TRP 156 Ca -0.02 0.23 0.13 0.00 -3.89 0.00 0.00 57.50 53.95 1ppw n TRP 156 Cb 0.15 -0.87 0.63 0.00 -1.36 0.00 0.00 31.31 29.85 1ppw n TRP 156 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1ppw n ALA 157 N -1.70 2.61 -2.37 -1.67 0.00 -0.81 -4.92 120.51 111.65 1ppw n ALA 157 Ca 0.02 -0.31 -0.18 0.00 0.00 0.00 0.00 53.44 52.97 1ppw n ALA 157 Cb 0.21 -1.29 -0.10 0.00 0.00 0.00 0.00 19.45 18.26 1ppw n ALA 157 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ppw s PHE 158 N -1.96 1.70 0.46 0.00 0.08 -1.03 -4.47 117.98 112.76 1ppw s PHE 158 Ca 0.37 -1.08 -0.25 0.00 0.12 0.00 0.00 56.93 56.10 1ppw s PHE 158 Cb 0.19 -1.05 -0.08 0.00 -0.57 0.00 0.00 43.02 41.51 1ppw s PHE 158 CO 0.30 -0.18 1.42 -1.54 -0.10 0.00 0.00 175.22 175.12 1ppw s SER 159 N -3.38 5.80 0.33 1.36 1.04 -0.43 -4.88 113.70 113.53 1ppw s SER 159 Ca 0.37 2.91 0.02 0.00 0.48 0.00 0.00 55.95 59.72 1ppw s SER 159 Cb 0.08 -2.65 0.56 0.00 0.10 0.00 0.00 66.02 64.11 1ppw s SER 159 CO 0.14 -1.23 1.93 -0.65 0.98 0.00 0.00 173.24 174.41 1ppw h PRO 160 N 2.22 0.78 -0.38 4.02 0.11 -1.92 -2.53 132.00 134.29 1ppw h PRO 160 Ca -0.51 -0.10 -0.12 0.00 0.11 0.00 0.00 66.00 65.38 1ppw h PRO 160 Cb 1.27 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1ppw h PRO 160 CO 0.61 0.61 -0.26 0.11 -0.21 0.00 0.00 178.00 178.85 1ppw h TRP 161 N 0.78 0.92 -0.82 0.65 0.09 -1.99 -0.38 115.95 115.20 1ppw h TRP 161 Ca 0.19 -0.22 0.11 0.00 0.09 0.00 0.00 58.89 59.06 1ppw h TRP 161 Cb 0.09 -0.21 -0.08 0.00 0.08 0.00 0.00 29.16 29.04 1ppw h TRP 161 CO 0.01 0.97 0.44 1.98 0.09 0.00 0.00 178.44 181.93 1ppw h MET 162 N 0.68 0.69 -0.14 0.12 4.05 -1.83 -0.55 114.93 117.96 1ppw h MET 162 Ca 0.09 -0.04 -0.06 0.00 -0.28 0.00 0.00 59.70 59.41 1ppw h MET 162 Cb 0.79 -0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 31.43 1ppw h MET 162 CO 0.07 0.46 -0.14 0.28 0.23 0.00 0.00 176.91 177.80 1ppw h VAL 163 N 0.71 1.35 -0.51 -5.77 2.07 -1.15 -1.98 116.25 110.97 1ppw h VAL 163 Ca 0.41 -1.30 0.02 0.00 0.82 0.00 0.00 66.70 66.65 1ppw h VAL 163 Cb 0.46 1.90 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 1ppw h VAL 163 CO -0.29 0.38 0.32 0.24 0.02 0.00 0.00 177.57 178.24 1ppw h MET 164 N -0.04 0.63 -0.38 1.57 2.86 -0.63 -1.85 114.93 117.08 1ppw h MET 164 Ca 0.02 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.55 1ppw h MET 164 Cb 0.67 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 1ppw h MET 164 CO 0.03 0.42 -0.05 1.96 1.06 0.00 0.00 176.91 180.33 1ppw h GLN 165 N 0.65 0.71 0.00 1.72 4.20 -1.12 -2.95 115.11 118.32 1ppw h GLN 165 Ca 0.20 -0.25 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 1ppw h GLN 165 Cb -0.03 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1ppw h GLN 165 CO -0.07 0.84 -0.17 0.00 -0.67 0.00 0.00 178.83 178.76 1ppw h ALA 166 N 0.85 1.40 -0.02 3.87 0.00 -1.15 -2.46 119.26 121.75 1ppw h ALA 166 Ca 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ppw h ALA 166 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ppw h ALA 166 CO 0.03 0.21 -0.11 0.25 0.00 0.00 0.00 179.25 179.64 1ppw n THR 167 N -3.88 0.00 -1.95 0.00 -2.24 -0.71 -4.50 114.28 101.00 1ppw n THR 167 Ca -0.02 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 61.05 1ppw n THR 167 Cb 0.27 0.80 -0.03 0.00 -2.10 0.00 0.00 70.33 69.27 1ppw n THR 167 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ppw s ASN 168 N -2.16 6.49 0.38 3.42 3.84 -0.93 -4.89 114.94 121.10 1ppw s ASN 168 Ca 0.31 2.14 0.05 0.00 0.21 0.00 0.00 52.86 55.57 1ppw s ASN 168 Cb 0.20 -2.53 0.75 0.00 -0.55 0.00 0.00 41.25 39.12 1ppw s ASN 168 CO 0.39 -1.08 2.03 0.08 -2.79 0.00 0.00 177.10 175.73 1ppw h ARG 169 N 10.31 0.69 0.16 0.43 0.11 -1.88 0.10 114.38 124.31 1ppw h ARG 169 Ca -0.40 -0.04 -0.22 0.00 0.10 0.00 0.00 59.98 59.43 1ppw h ARG 169 Cb 1.19 -0.16 0.03 0.00 1.11 0.00 0.00 29.97 32.13 1ppw h ARG 169 CO 0.96 0.46 -0.94 0.93 0.10 0.00 0.00 179.97 181.48 1ppw h GLU 170 N 0.71 0.35 -0.71 0.08 3.07 -1.91 -2.22 114.58 113.96 1ppw h GLU 170 Ca 0.20 -0.60 0.01 0.00 -0.50 0.00 0.00 59.36 58.48 1ppw h GLU 170 Cb -0.05 0.22 -0.04 0.00 -0.84 0.00 0.00 28.75 28.05 1ppw h GLU 170 CO -0.05 1.28 0.47 0.00 -1.40 0.00 0.00 179.01 179.32 1ppw h ALA 171 N 0.10 0.90 -0.77 3.43 0.00 -1.55 -2.66 119.26 118.71 1ppw h ALA 171 Ca -0.16 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.75 1ppw h ALA 171 Cb 1.75 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 19.20 1ppw h ALA 171 CO 0.18 0.31 0.47 -0.09 0.00 0.00 0.00 179.25 180.12 1ppw h ARG 172 N 0.95 0.86 -0.30 0.00 2.43 -0.79 -0.21 114.38 117.32 1ppw h ARG 172 Ca 0.26 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.31 1ppw h ARG 172 Cb -0.10 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.24 1ppw h ARG 172 CO -0.06 0.57 -0.10 0.87 -1.51 0.00 0.00 179.97 179.74 1ppw h LYS 173 N 0.88 0.49 -0.60 0.20 1.57 -1.17 0.01 116.57 117.96 1ppw h LYS 173 Ca 0.32 -0.13 -0.07 0.00 -1.87 0.00 0.00 60.65 58.90 1ppw h LYS 173 Cb 0.11 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1ppw h LYS 173 CO -0.15 0.60 0.11 0.00 -0.57 0.00 0.00 179.45 179.43 1ppw h ARG 174 N 0.46 0.98 -0.46 3.15 2.47 -0.82 -0.51 114.38 119.65 1ppw h ARG 174 Ca 0.09 -0.26 0.08 0.00 -1.26 0.00 0.00 59.98 58.63 1ppw h ARG 174 Cb 0.45 -0.12 -0.07 0.00 -1.65 0.00 0.00 29.97 28.59 1ppw h ARG 174 CO 0.02 0.92 0.08 -0.07 0.56 0.00 0.00 179.97 181.49 1ppw h LEU 175 N 0.89 -0.02 -1.08 3.04 3.38 -0.51 -1.58 115.31 119.44 1ppw h LEU 175 Ca 0.18 0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.31 1ppw h LEU 175 Cb 0.41 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 1ppw h LEU 175 CO 0.01 0.02 0.62 0.28 0.09 0.00 0.00 178.44 179.46 1ppw h SER 176 N 0.21 0.97 0.41 -0.43 0.02 -0.25 0.60 113.55 115.08 1ppw h SER 176 Ca 0.23 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1ppw h SER 176 Cb 0.30 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1ppw h SER 176 CO -0.31 0.61 -0.02 0.00 -1.14 0.00 0.00 176.83 175.97 1ppw h ALA 177 N 1.49 1.06 -0.01 3.77 0.00 -0.08 -2.15 119.26 123.34 1ppw h ALA 177 Ca 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1ppw h ALA 177 Cb 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ppw h ALA 177 CO -0.16 0.03 -0.05 1.19 0.00 0.00 0.00 179.25 180.25 1ppw n PHE 178 N -3.20 0.00 1.76 0.00 3.01 0.20 -3.31 117.46 115.91 1ppw n PHE 178 Ca -0.02 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.59 1ppw n PHE 178 Cb 0.18 -0.05 0.72 0.00 -0.01 0.00 0.00 39.48 40.32 1ppw n PHE 178 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1ppw n THR 179 N -0.46 0.01 -2.41 4.37 -2.24 -0.81 -4.44 114.28 108.30 1ppw n THR 179 Ca 0.19 -0.12 -0.39 0.00 -2.27 0.00 0.00 64.05 61.45 1ppw n THR 179 Cb 0.27 -0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.44 1ppw n THR 179 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1ppw s GLN 180 N -1.99 4.41 0.06 -0.78 0.74 -1.21 -4.47 119.66 116.43 1ppw s GLN 180 Ca 0.42 1.81 -0.31 0.00 0.05 0.00 0.00 55.36 57.33 1ppw s GLN 180 Cb 0.21 -2.97 -0.07 0.00 1.10 0.00 0.00 33.01 31.28 1ppw s GLN 180 CO 0.34 0.00 1.39 -1.17 -0.55 0.00 0.00 175.29 175.30 1ppw s LEU 181 N -1.89 4.35 -0.15 3.68 0.20 -1.26 -4.13 118.68 119.48 1ppw s LEU 181 Ca 0.50 2.22 0.01 0.00 0.69 0.00 0.00 54.13 57.55 1ppw s LEU 181 Cb -0.31 -3.57 0.02 0.00 -0.43 0.00 0.00 46.19 41.89 1ppw s LEU 181 CO 0.40 -0.67 -0.18 -0.54 -0.29 0.00 0.00 176.35 175.07 1ppw s LYS 182 N 1.65 2.64 0.00 1.98 -0.14 0.41 -5.01 119.74 121.27 1ppw s LYS 182 Ca 0.64 -0.70 0.31 0.00 -1.36 0.00 0.00 55.97 54.86 1ppw s LYS 182 Cb -0.34 -2.27 1.61 0.00 -1.68 0.00 0.00 37.83 35.15 1ppw s LYS 182 CO 0.29 -0.15 2.06 1.28 -0.76 0.00 0.00 175.35 178.07