#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 1.19 0.22 4.31 -3.43 -1.26 -2.08 115.29 114.24 1ppw s HIS 5 Ca 0.00 -1.35 0.11 0.00 -0.80 0.00 0.00 55.06 53.02 1ppw s HIS 5 Cb 0.00 -0.38 -0.04 0.00 -1.43 0.00 0.00 32.58 30.72 1ppw s HIS 5 CO 0.00 -0.88 -0.16 0.14 -2.00 0.00 0.00 174.74 171.84 1ppw s VAL 6 N -3.67 2.74 -0.30 -5.38 -7.23 -0.41 -4.71 120.40 101.44 1ppw s VAL 6 Ca 0.35 -2.01 -0.11 0.00 -1.81 0.00 0.00 61.98 58.40 1ppw s VAL 6 Cb 0.03 -2.38 -0.02 0.00 0.56 0.00 0.00 36.38 34.57 1ppw s VAL 6 CO 0.18 -0.22 0.18 -0.63 -0.31 0.00 0.00 175.10 174.30 1ppw s ILE 7 N -1.97 4.92 0.15 -0.62 1.01 -1.26 -2.68 121.20 120.76 1ppw s ILE 7 Ca 0.25 -0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.41 1ppw s ILE 7 Cb -0.07 -3.45 -0.07 0.00 0.01 0.00 0.00 42.46 38.87 1ppw s ILE 7 CO 0.14 0.12 1.20 -0.76 0.00 0.00 0.00 174.94 175.64 1ppw s LEU 8 N 1.68 4.43 -0.03 2.97 1.43 0.25 -1.28 118.68 128.14 1ppw s LEU 8 Ca 0.06 2.17 0.06 0.00 -1.03 0.00 0.00 54.13 55.39 1ppw s LEU 8 Cb -0.17 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.43 1ppw s LEU 8 CO 0.08 -0.39 -0.21 -0.76 0.23 0.00 0.00 176.35 175.30 1ppw s LEU 9 N 0.12 2.34 0.00 1.79 1.43 -0.90 -0.99 118.68 122.47 1ppw s LEU 9 Ca 0.54 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 53.28 1ppw s LEU 9 Cb -0.32 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.47 1ppw s LEU 9 CO 0.34 0.33 0.00 -0.46 0.23 0.00 0.00 176.35 176.79 1ppw n ASN 10 N 2.35 0.00 -0.21 2.29 2.04 -0.27 -4.74 115.26 116.72 1ppw n ASN 10 Ca -0.16 -0.87 -0.09 0.00 -0.44 0.00 0.00 54.58 53.01 1ppw n ASN 10 Cb 0.52 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.73 1ppw n ASN 10 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ppw h ALA 11 N -1.63 -0.35 -2.38 -2.53 0.00 -2.01 -3.37 119.26 106.99 1ppw h ALA 11 Ca 0.00 0.10 -0.48 0.00 0.00 0.00 0.00 54.91 54.53 1ppw h ALA 11 Cb 0.00 0.97 0.13 0.00 0.00 0.00 0.00 17.79 18.89 1ppw h ALA 11 CO 0.00 -0.84 0.29 -1.14 0.00 0.00 0.00 179.25 177.56 1ppw s GLN 12 N -5.82 1.63 0.00 0.00 -0.44 -1.26 -4.88 119.66 108.89 1ppw s GLN 12 Ca -0.14 0.70 -0.03 0.00 -2.50 0.00 0.00 55.36 53.38 1ppw s GLN 12 Cb 0.13 -1.86 -0.14 0.00 -1.64 0.00 0.00 33.01 29.49 1ppw s GLN 12 CO 0.66 -1.95 2.67 0.41 0.50 0.00 0.00 175.29 177.58 1ppw n GLY 13 N -1.65 2.57 3.65 2.59 0.00 -1.26 -4.83 105.19 106.25 1ppw n GLY 13 Ca 0.07 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 45.04 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 0.84 5.00 0.19 1.61 1.01 -1.26 -4.80 120.40 123.00 1ppw s VAL 14 Ca 0.36 1.17 -0.33 0.00 0.00 0.00 0.00 61.98 63.18 1ppw s VAL 14 Cb 0.17 -3.94 -0.14 0.00 0.00 0.00 0.00 36.38 32.47 1ppw s VAL 14 CO 0.00 0.08 1.47 -2.65 0.00 0.00 0.00 175.10 174.00 1ppw n PRO 15 N 5.31 2.00 0.00 2.72 -0.02 -1.26 -1.12 135.00 142.63 1ppw n PRO 15 Ca -0.01 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1ppw n PRO 15 Cb 0.49 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1ppw n PRO 15 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1ppw n THR 16 N 2.64 0.00 -3.53 3.45 -2.24 -0.16 -4.90 114.28 109.54 1ppw n THR 16 Ca 0.15 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1ppw n THR 16 Cb 0.29 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.57 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 0.57 -1.30 3.25 3.38 0.00 -1.25 -5.02 105.19 104.81 1ppw n GLY 17 Ca 0.00 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 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 -3.00 0.62 0.01 2.61 -4.23 -1.26 -0.58 115.64 109.81 1ppw s THR 18 Ca 0.00 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.52 1ppw s THR 18 Cb 0.00 -2.20 -0.01 0.00 1.34 0.00 0.00 72.50 71.62 1ppw s THR 18 CO 0.00 -0.39 0.01 -0.76 -0.54 0.00 0.00 174.62 172.93 1ppw s LEU 19 N -3.19 2.08 0.41 4.79 1.43 -1.09 -4.92 118.68 118.20 1ppw s LEU 19 Ca 0.26 -0.39 -0.26 0.00 -1.03 0.00 0.00 54.13 52.72 1ppw s LEU 19 Cb 0.06 0.20 -0.10 0.00 0.03 0.00 0.00 46.19 46.38 1ppw s LEU 19 CO 0.05 -0.28 1.23 1.21 0.23 0.00 0.00 176.35 178.79 1ppw n GLU 20 N 1.73 1.85 -0.09 1.70 0.00 -1.26 -1.29 120.64 123.27 1ppw n GLU 20 Ca -0.23 0.66 -0.10 0.00 0.00 0.00 0.00 57.16 57.49 1ppw n GLU 20 Cb 0.56 -2.32 -0.03 0.00 0.00 0.00 0.00 31.44 29.65 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 2.05 0.43 -0.16 5.31 3.64 -1.70 -2.48 116.57 123.65 1ppw h LYS 21 Ca -0.47 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 58.82 1ppw h LYS 21 Cb 1.30 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.05 1ppw h LYS 21 CO 0.60 0.48 0.08 -0.92 -2.27 0.00 0.00 179.45 177.41 1ppw h TYR 22 N 0.29 0.23 0.00 1.91 3.20 -1.90 -2.28 116.97 118.42 1ppw h TYR 22 Ca 0.09 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.95 1ppw h TYR 22 Cb 0.22 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.42 1ppw h TYR 22 CO 0.00 0.26 0.00 0.00 -1.64 0.00 0.00 178.16 176.78 1ppw n ALA 23 N -2.20 1.15 0.10 1.82 0.00 -1.17 -2.42 120.51 117.79 1ppw n ALA 23 Ca -0.04 0.13 0.08 0.00 0.00 0.00 0.00 53.44 53.60 1ppw n ALA 23 Cb 0.09 -1.25 -0.00 0.00 0.00 0.00 0.00 19.45 18.29 1ppw n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ppw h ALA 24 N 2.06 0.60 -2.54 0.00 0.00 -0.93 -3.44 119.26 115.01 1ppw h ALA 24 Ca 0.00 -0.25 -0.72 0.00 0.00 0.00 0.00 54.91 53.94 1ppw h ALA 24 Cb 0.06 0.07 -0.21 0.00 0.00 0.00 0.00 17.79 17.71 1ppw h ALA 24 CO 0.00 0.28 -0.44 -1.01 0.00 0.00 0.00 179.25 178.08 1ppw s HIS 25 N -3.21 3.24 0.00 0.00 3.76 -1.01 -4.49 115.29 113.58 1ppw s HIS 25 Ca -0.00 -0.62 0.00 0.00 -0.15 0.00 0.00 55.06 54.29 1ppw s HIS 25 Cb 0.09 -2.57 0.00 0.00 1.11 0.00 0.00 32.58 31.21 1ppw s HIS 25 CO 0.78 -0.59 0.00 0.25 -0.85 0.00 0.00 174.74 174.33 1ppw n THR 26 N 5.14 0.00 0.61 1.30 -2.24 -1.26 -4.92 114.28 112.91 1ppw n THR 26 Ca -0.11 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.76 1ppw n THR 26 Cb 0.47 0.00 0.40 0.00 -2.10 0.00 0.00 70.33 69.10 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 1.84 -2.04 6.98 0.00 -1.26 -1.41 120.51 121.62 1ppw n ALA 27 Ca 0.00 -0.05 -0.15 0.00 0.00 0.00 0.00 53.44 53.24 1ppw n ALA 27 Cb 0.00 -1.31 0.06 0.00 0.00 0.00 0.00 19.45 18.19 1ppw n ALA 27 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ppw n ASP 28 N -1.61 3.90 -4.70 0.00 8.00 -1.26 -4.69 116.55 116.18 1ppw n ASP 28 Ca 0.04 -3.56 -0.44 0.00 0.71 0.00 0.00 54.79 51.54 1ppw n ASP 28 Cb 0.23 -0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 40.91 1ppw n ASP 28 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1ppw n THR 29 N -0.74 0.51 -3.11 -3.53 -1.04 -1.19 -4.97 114.28 100.20 1ppw n THR 29 Ca 0.35 -0.13 -0.31 0.00 -2.04 0.00 0.00 64.05 61.92 1ppw n THR 29 Cb 0.91 -1.75 -0.04 0.00 -1.82 0.00 0.00 70.33 67.62 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 0.27 3.81 0.15 -2.82 0.52 -1.26 -4.71 118.95 114.91 1ppw s ARG 30 Ca 0.71 0.40 -0.34 0.00 -0.52 0.00 0.00 55.73 55.98 1ppw s ARG 30 Cb -0.58 -2.49 -0.15 0.00 0.52 0.00 0.00 34.95 32.26 1ppw s ARG 30 CO 0.42 0.12 1.51 -0.11 0.02 0.00 0.00 175.30 177.26 1ppw n LEU 31 N -0.79 2.73 -4.09 2.53 7.94 -1.26 -4.73 117.00 119.33 1ppw n LEU 31 Ca 0.02 1.10 -0.13 0.00 -1.11 0.00 0.00 56.01 55.88 1ppw n LEU 31 Cb 0.53 -1.37 -0.05 0.00 0.53 0.00 0.00 43.42 43.06 1ppw n LEU 31 CO 0.46 -0.49 0.09 -1.38 -1.11 0.00 0.00 177.39 174.95 1ppw s HIS 32 N 0.74 0.92 0.18 1.96 -3.43 -0.42 -2.12 115.29 113.12 1ppw s HIS 32 Ca 0.79 -1.17 -0.27 0.00 -0.80 0.00 0.00 55.06 53.62 1ppw s HIS 32 Cb -0.75 -0.10 -0.08 0.00 -1.43 0.00 0.00 32.58 30.22 1ppw s HIS 32 CO 0.41 -1.02 0.82 -1.17 -2.00 0.00 0.00 174.74 171.78 1ppw s LEU 33 N -3.17 4.61 0.31 5.38 2.96 -0.40 -1.03 118.68 127.34 1ppw s LEU 33 Ca 0.30 1.72 -0.14 0.00 -0.22 0.00 0.00 54.13 55.80 1ppw s LEU 33 Cb 0.01 -3.38 0.02 0.00 0.50 0.00 0.00 46.19 43.34 1ppw s LEU 33 CO 0.16 0.19 0.63 0.00 -1.32 0.00 0.00 176.35 176.01 1ppw s ALA 34 N -1.14 -0.42 0.11 5.97 0.00 0.19 -4.44 121.76 122.02 1ppw s ALA 34 Ca 0.37 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.53 1ppw s ALA 34 Cb -0.24 0.92 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 1ppw s ALA 34 CO 0.28 -0.92 -0.09 -0.59 0.00 0.00 0.00 175.76 174.43 1ppw s PHE 35 N -3.31 1.04 0.17 0.00 -0.12 -0.16 -3.30 117.98 112.29 1ppw s PHE 35 Ca 0.19 -0.74 0.11 0.00 -0.05 0.00 0.00 56.93 56.44 1ppw s PHE 35 Cb -0.03 -0.57 -0.04 0.00 -0.63 0.00 0.00 43.02 41.75 1ppw s PHE 35 CO 0.11 -0.03 -0.23 -1.12 -0.05 0.00 0.00 175.22 173.91 1ppw s SER 36 N -2.72 3.20 -0.12 1.98 0.01 -0.91 -1.92 113.70 113.22 1ppw s SER 36 Ca 0.09 -0.84 -0.07 0.00 1.31 0.00 0.00 55.95 56.44 1ppw s SER 36 Cb 0.00 -0.22 0.04 0.00 0.21 0.00 0.00 66.02 66.05 1ppw s SER 36 CO -0.01 0.09 0.28 -0.55 0.41 0.00 0.00 173.24 173.46 1ppw s SER 37 N -2.56 -0.31 -0.27 2.44 0.15 0.19 -1.08 113.70 112.27 1ppw s SER 37 Ca 0.18 0.59 -0.07 0.00 0.70 0.00 0.00 55.95 57.36 1ppw s SER 37 Cb -0.08 0.50 -0.01 0.00 -1.71 0.00 0.00 66.02 64.73 1ppw s SER 37 CO 0.08 -0.15 0.06 0.26 1.20 0.00 0.00 173.24 174.69 1ppw s TRP 38 N 1.03 3.10 -0.18 3.44 0.52 -0.13 -2.37 118.94 124.34 1ppw s TRP 38 Ca -0.07 -0.77 -0.07 0.00 0.02 0.00 0.00 56.10 55.20 1ppw s TRP 38 Cb -0.08 -2.23 -0.04 0.00 -1.15 0.00 0.00 33.47 29.97 1ppw s TRP 38 CO -0.07 -0.50 0.05 -0.51 0.02 0.00 0.00 176.95 175.94 1ppw s LEU 39 N 1.54 3.75 0.15 2.99 1.43 -1.26 -2.16 118.68 125.12 1ppw s LEU 39 Ca 0.04 0.05 0.09 0.00 -1.03 0.00 0.00 54.13 53.28 1ppw s LEU 39 Cb -0.16 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 1ppw s LEU 39 CO 0.02 0.17 -0.11 -0.36 0.23 0.00 0.00 176.35 176.30 1ppw s PHE 40 N 0.39 2.64 0.61 0.29 0.40 0.26 -1.08 117.98 121.48 1ppw s PHE 40 Ca 0.02 -0.22 0.07 0.00 -0.60 0.00 0.00 56.93 56.21 1ppw s PHE 40 Cb -0.13 -1.33 0.10 0.00 0.51 0.00 0.00 43.02 42.17 1ppw s PHE 40 CO 0.01 0.47 0.84 0.54 0.70 0.00 0.00 175.22 177.77 1ppw s ASN 41 N -2.57 4.93 0.50 1.36 2.20 0.14 -1.74 114.94 119.75 1ppw s ASN 41 Ca 0.23 -0.72 0.25 0.00 -0.94 0.00 0.00 52.86 51.67 1ppw s ASN 41 Cb -0.10 0.20 1.32 0.00 -2.00 0.00 0.00 41.25 40.67 1ppw s ASN 41 CO 0.14 -1.46 1.93 0.00 -2.94 0.00 0.00 177.10 174.77 1ppw h ALA 42 N 0.02 2.50 0.00 3.54 0.00 -1.91 0.53 119.26 123.93 1ppw h ALA 42 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1ppw h ALA 42 Cb 1.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1ppw h ALA 42 CO 0.41 -0.72 -0.08 1.63 0.00 0.00 0.00 179.25 180.49 1ppw n LYS 43 N -4.38 0.08 -0.28 0.00 4.01 -1.26 -4.92 118.16 111.42 1ppw n LYS 43 Ca 0.15 0.06 0.00 0.00 -0.51 0.00 0.00 58.31 58.01 1ppw n LYS 43 Cb 0.72 -1.59 0.00 0.00 -0.51 0.00 0.00 35.03 33.65 1ppw n LYS 43 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ppw n GLY 44 N 1.44 0.85 3.76 0.72 0.00 0.18 -5.02 105.19 107.13 1ppw n GLY 44 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.72 4.75 0.11 1.61 -0.21 -1.26 -4.69 119.66 119.24 1ppw s GLN 45 Ca 0.00 1.46 -0.30 0.00 0.02 0.00 0.00 55.36 56.54 1ppw s GLN 45 Cb 0.00 -3.11 -0.06 0.00 1.00 0.00 0.00 33.01 30.84 1ppw s GLN 45 CO 0.00 0.41 0.98 -1.17 -2.12 0.00 0.00 175.29 173.40 1ppw s LEU 46 N -1.50 4.48 -0.26 2.90 2.96 0.12 -0.68 118.68 126.71 1ppw s LEU 46 Ca 0.44 1.82 -0.16 0.00 -0.22 0.00 0.00 54.13 56.01 1ppw s LEU 46 Cb -0.24 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.83 1ppw s LEU 46 CO 0.30 -0.11 0.43 -0.22 -1.32 0.00 0.00 176.35 175.43 1ppw s LEU 47 N 0.08 4.06 -0.13 -0.68 2.96 -0.24 -0.75 118.68 123.98 1ppw s LEU 47 Ca 0.48 0.41 -0.04 0.00 -0.22 0.00 0.00 54.13 54.76 1ppw s LEU 47 Cb -0.24 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 1ppw s LEU 47 CO 0.30 -0.21 0.03 -0.69 -1.32 0.00 0.00 176.35 174.47 1ppw s VAL 48 N 2.05 4.55 0.34 1.68 1.01 -0.69 -3.31 120.40 126.04 1ppw s VAL 48 Ca 0.18 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.09 1ppw s VAL 48 Cb -0.16 -2.97 -0.07 0.00 0.00 0.00 0.00 36.38 33.18 1ppw s VAL 48 CO 0.09 0.55 -0.03 0.42 0.00 0.00 0.00 175.10 176.14 1ppw s THR 49 N -0.37 1.83 -0.16 3.92 -4.23 -0.76 -0.74 115.64 115.13 1ppw s THR 49 Ca 0.08 -2.09 0.02 0.00 -1.18 0.00 0.00 61.69 58.52 1ppw s THR 49 Cb -0.12 -2.73 0.01 0.00 1.34 0.00 0.00 72.50 71.00 1ppw s THR 49 CO 0.02 -0.13 -0.20 -0.60 -0.54 0.00 0.00 174.62 173.17 1ppw s ARG 50 N -3.72 3.04 0.32 3.99 3.52 0.15 -1.52 118.95 124.73 1ppw s ARG 50 Ca 0.33 -0.83 -0.29 0.00 -0.13 0.00 0.00 55.73 54.81 1ppw s ARG 50 Cb 0.06 -2.51 -0.10 0.00 -1.56 0.00 0.00 34.95 30.84 1ppw s ARG 50 CO 0.16 -0.07 1.33 1.03 -0.81 0.00 0.00 175.30 176.93 1ppw s ARG 51 N 0.97 4.34 0.86 5.12 0.52 -0.39 -1.28 118.95 129.08 1ppw s ARG 51 Ca -0.03 2.24 -0.12 0.00 -0.52 0.00 0.00 55.73 57.29 1ppw s ARG 51 Cb -0.15 -3.07 0.09 0.00 0.52 0.00 0.00 34.95 32.33 1ppw s ARG 51 CO -0.05 -0.23 0.99 0.00 0.02 0.00 0.00 175.30 176.03 1ppw n ALA 52 N 1.01 -0.84 0.41 2.13 0.00 -0.51 -1.00 120.51 121.70 1ppw n ALA 52 Ca 0.01 -0.44 0.11 0.00 0.00 0.00 0.00 53.44 53.11 1ppw n ALA 52 Cb 0.42 -2.12 0.45 0.00 0.00 0.00 0.00 19.45 18.19 1ppw n ALA 52 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ppw n LEU 53 N -2.99 0.51 -0.09 0.00 4.77 -1.26 -2.48 117.00 115.47 1ppw n LEU 53 Ca 0.12 0.63 0.13 0.00 -0.03 0.00 0.00 56.01 56.85 1ppw n LEU 53 Cb 0.51 -0.56 0.35 0.00 -2.33 0.00 0.00 43.42 41.39 1ppw n LEU 53 CO 0.49 -0.50 0.59 -1.54 -1.33 0.00 0.00 177.39 175.10 1ppw n SER 54 N -2.07 0.63 -4.72 -1.43 3.41 -1.26 -4.75 113.62 103.43 1ppw n SER 54 Ca 0.02 -0.43 -0.38 0.00 -0.26 0.00 0.00 58.87 57.82 1ppw n SER 54 Cb 0.21 0.13 0.05 0.00 -0.26 0.00 0.00 64.21 64.34 1ppw n SER 54 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ppw n LYS 55 N -1.18 1.40 -0.04 4.33 4.76 -1.03 -4.91 118.16 121.49 1ppw n LYS 55 Ca 0.09 0.53 -0.15 0.00 -2.87 0.00 0.00 58.31 55.90 1ppw n LYS 55 Cb 0.33 -2.49 -0.08 0.00 -1.84 0.00 0.00 35.03 30.96 1ppw n LYS 55 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1ppw h LYS 56 N 1.03 0.50 -5.85 1.97 3.64 -1.92 -3.38 116.57 112.57 1ppw h LYS 56 Ca -0.50 -0.36 -0.67 0.00 -1.27 0.00 0.00 60.65 57.85 1ppw h LYS 56 Cb 1.32 0.06 -0.14 0.00 -0.41 0.00 0.00 32.23 33.06 1ppw h LYS 56 CO 0.55 0.98 -0.60 0.00 -2.27 0.00 0.00 179.45 178.11 1ppw s ALA 57 N -3.87 3.37 -1.34 5.00 0.00 -1.26 -4.64 121.76 119.02 1ppw s ALA 57 Ca -0.13 -0.78 -0.14 0.00 0.00 0.00 0.00 51.96 50.92 1ppw s ALA 57 Cb 0.06 -1.59 0.01 0.00 0.00 0.00 0.00 23.12 21.60 1ppw s ALA 57 CO 0.81 0.55 0.45 0.91 0.00 0.00 0.00 175.76 178.48 1ppw n TRP 58 N 2.27 -1.53 -2.06 0.00 8.01 -1.26 -4.93 117.44 117.95 1ppw n TRP 58 Ca -0.19 0.47 -0.37 0.00 -1.31 0.00 0.00 57.50 56.10 1ppw n TRP 58 Cb 0.54 -3.18 0.02 0.00 -2.01 0.00 0.00 31.31 26.67 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 -6.90 3.38 -1.69 -0.99 0.04 -1.26 -3.05 135.00 124.53 1ppw s PRO 59 Ca 0.23 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1ppw s PRO 59 Cb -0.11 -2.24 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1ppw s PRO 59 CO 0.94 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 177.49 1ppw n GLY 60 N 0.53 0.87 3.78 0.56 0.00 -0.17 -4.93 105.19 105.83 1ppw n GLY 60 Ca 0.10 -0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.74 4.84 0.04 1.61 1.01 -1.17 -4.79 120.40 119.20 1ppw s VAL 61 Ca 0.00 -0.20 -0.26 0.00 0.00 0.00 0.00 61.98 61.52 1ppw s VAL 61 Cb 0.00 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 1ppw s VAL 61 CO 0.00 0.48 0.82 0.26 0.00 0.00 0.00 175.10 176.67 1ppw s TRP 62 N -1.08 3.72 0.24 5.22 0.52 -1.26 -1.27 118.94 125.03 1ppw s TRP 62 Ca 0.19 1.53 -0.05 0.00 0.02 0.00 0.00 56.10 57.79 1ppw s TRP 62 Cb -0.12 -2.90 0.02 0.00 -1.15 0.00 0.00 33.47 29.32 1ppw s TRP 62 CO 0.09 0.20 0.39 -2.37 0.02 0.00 0.00 176.95 175.28 1ppw n THR 63 N 3.07 0.00 -1.08 2.01 5.66 -0.57 -0.37 114.28 122.99 1ppw n THR 63 Ca -0.00 -0.92 -0.21 0.00 -3.05 0.00 0.00 64.05 59.87 1ppw n THR 63 Cb 0.50 0.67 0.17 0.00 -1.55 0.00 0.00 70.33 70.12 1ppw n THR 63 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1ppw n ASN 64 N -1.61 -1.28 0.34 1.09 0.23 -1.26 -1.83 115.26 110.95 1ppw n ASN 64 Ca -0.02 -1.06 -0.17 0.00 -0.53 0.00 0.00 54.58 52.80 1ppw n ASN 64 Cb 0.38 -0.70 -0.09 0.00 -2.08 0.00 0.00 39.78 37.29 1ppw n ASN 64 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1ppw h SER 65 N -1.94 -0.70 -3.75 0.53 0.02 -1.51 -3.35 113.55 102.85 1ppw h SER 65 Ca -0.29 0.01 -0.17 0.00 -0.84 0.00 0.00 61.79 60.51 1ppw h SER 65 Cb 0.86 0.18 -0.26 0.00 0.14 0.00 0.00 62.40 63.32 1ppw h SER 65 CO 0.19 -0.48 -0.42 0.54 -1.14 0.00 0.00 176.83 175.52 1ppw s VAL 66 N -5.95 -0.01 0.06 2.27 0.11 -1.00 -4.68 120.40 111.20 1ppw s VAL 66 Ca -0.17 0.02 0.03 0.00 -2.93 0.00 0.00 61.98 58.93 1ppw s VAL 66 Cb 0.03 -0.37 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 1ppw s VAL 66 CO 0.61 0.01 -0.10 0.00 -3.33 0.00 0.00 175.10 172.29 1ppw n GLY 68 N 1.26 1.04 2.78 0.00 0.00 -0.81 -5.00 105.19 104.46 1ppw n GLY 68 Ca -0.21 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.65 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 -4.50 1.70 0.46 1.61 3.76 -1.26 -0.99 115.29 116.07 1ppw s HIS 69 Ca 0.00 -1.52 -0.25 0.00 -0.15 0.00 0.00 55.06 53.14 1ppw s HIS 69 Cb 0.00 -1.52 -0.08 0.00 1.11 0.00 0.00 32.58 32.09 1ppw s HIS 69 CO 0.00 -0.78 1.44 -2.14 -0.85 0.00 0.00 174.74 172.41 1ppw s PRO 70 N 1.62 3.65 0.66 8.40 0.02 -1.26 -4.93 135.00 143.15 1ppw s PRO 70 Ca 0.04 2.45 -0.04 0.00 0.02 0.00 0.00 61.00 63.46 1ppw s PRO 70 Cb -0.18 -2.64 0.05 0.00 0.02 0.00 0.00 34.50 31.76 1ppw s PRO 70 CO -0.16 -0.86 0.94 -0.65 -0.33 0.00 0.00 177.00 175.94 1ppw s GLN 71 N -2.48 2.33 0.30 5.54 -1.52 -1.26 -4.46 119.66 118.11 1ppw s GLN 71 Ca 0.62 -0.40 -0.30 0.00 -1.95 0.00 0.00 55.36 53.33 1ppw s GLN 71 Cb -0.44 -2.27 -0.12 0.00 -0.22 0.00 0.00 33.01 29.96 1ppw s GLN 71 CO 0.57 -1.06 1.52 1.28 -0.25 0.00 0.00 175.29 177.35 1ppw n LEU 72 N -2.74 4.13 -0.27 2.90 4.77 -1.26 -1.48 117.00 123.04 1ppw n LEU 72 Ca 0.08 1.16 -0.04 0.00 -0.03 0.00 0.00 56.01 57.19 1ppw n LEU 72 Cb 0.60 -1.56 -0.02 0.00 -2.33 0.00 0.00 43.42 40.12 1ppw n LEU 72 CO 0.50 -0.02 -0.03 0.61 -1.33 0.00 0.00 177.39 177.12 1ppw n GLY 73 N 1.79 0.53 3.65 -0.72 0.00 -1.26 -4.99 105.19 104.19 1ppw n GLY 73 Ca 0.08 -0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.73 3.78 0.46 1.61 2.12 -0.55 -5.08 118.70 119.31 1ppw s GLU 74 Ca 0.00 -0.35 -0.24 0.00 0.36 0.00 0.00 54.97 54.74 1ppw s GLU 74 Cb 0.00 -3.13 -0.07 0.00 0.26 0.00 0.00 34.13 31.19 1ppw s GLU 74 CO 0.00 0.37 1.25 -1.54 -0.54 0.00 0.00 175.26 174.80 1ppw s SER 75 N 0.09 6.03 0.29 -1.70 1.04 -1.26 -4.67 113.70 113.51 1ppw s SER 75 Ca 0.05 2.53 0.02 0.00 0.48 0.00 0.00 55.95 59.03 1ppw s SER 75 Cb -0.12 -2.62 0.71 0.00 0.10 0.00 0.00 66.02 64.08 1ppw s SER 75 CO 0.01 -1.03 1.67 0.78 0.98 0.00 0.00 173.24 175.64 1ppw h ASN 76 N 2.15 0.12 -0.43 7.02 -0.26 -1.98 0.69 115.58 122.89 1ppw h ASN 76 Ca -0.50 0.18 -0.10 0.00 -0.56 0.00 0.00 56.30 55.33 1ppw h ASN 76 Cb 1.26 0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 38.71 1ppw h ASN 76 CO 0.60 -0.10 -0.08 -0.33 -1.06 0.00 0.00 177.43 176.47 1ppw h GLU 77 N 0.27 0.88 -0.16 0.81 3.07 -1.95 -2.06 114.58 115.44 1ppw h GLU 77 Ca 0.55 -0.29 -0.12 0.00 -0.50 0.00 0.00 59.36 59.00 1ppw h GLU 77 Cb 1.08 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.90 1ppw h GLU 77 CO -0.60 0.93 -0.40 -0.44 -1.40 0.00 0.00 179.01 177.09 1ppw h ASP 78 N 0.80 0.39 -0.11 1.42 3.32 -1.28 -2.54 116.42 118.42 1ppw h ASP 78 Ca 0.14 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1ppw h ASP 78 Cb 0.59 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.03 1ppw h ASP 78 CO 0.04 0.75 0.02 0.00 -1.72 0.00 0.00 179.24 178.33 1ppw h ALA 79 N 1.27 0.14 -0.09 3.45 0.00 -0.73 0.18 119.26 123.48 1ppw h ALA 79 Ca 0.03 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.83 1ppw h ALA 79 Cb 0.85 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1ppw h ALA 79 CO 0.07 -0.21 -0.15 0.28 0.00 0.00 0.00 179.25 179.24 1ppw h VAL 80 N -0.05 0.62 -0.59 0.00 2.07 -1.40 0.62 116.25 117.52 1ppw h VAL 80 Ca 0.03 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.60 1ppw h VAL 80 Cb 0.28 0.62 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1ppw h VAL 80 CO 0.00 0.00 0.32 0.40 0.02 0.00 0.00 177.57 178.31 1ppw h ILE 81 N -0.20 0.97 -0.08 4.57 2.04 -1.31 0.43 117.51 123.93 1ppw h ILE 81 Ca 0.08 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1ppw h ILE 81 Cb 0.31 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 1ppw h ILE 81 CO -0.21 0.11 0.05 -0.09 0.00 0.00 0.00 178.15 178.01 1ppw h ARG 82 N 0.61 0.12 0.00 2.37 2.43 -0.14 -1.09 114.38 118.67 1ppw h ARG 82 Ca 0.26 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.35 1ppw h ARG 82 Cb 0.15 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1ppw h ARG 82 CO -0.16 0.16 -0.32 0.00 -1.51 0.00 0.00 179.97 178.14 1ppw h ARG 83 N 0.05 0.00 -0.57 0.20 2.47 0.79 0.27 114.38 117.58 1ppw h ARG 83 Ca 0.03 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.64 1ppw h ARG 83 Cb 0.07 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.37 1ppw h ARG 83 CO -0.00 0.32 -0.06 0.00 0.56 0.00 0.00 179.97 180.78 1ppw h ARG 85 N 0.95 0.91 -0.04 0.00 3.08 -0.83 -2.15 114.38 116.28 1ppw h ARG 85 Ca 0.16 -0.37 -0.09 0.00 0.07 0.00 0.00 59.98 59.75 1ppw h ARG 85 Cb 0.63 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1ppw h ARG 85 CO 0.04 1.02 -0.31 -0.92 -1.07 0.00 0.00 179.97 178.73 1ppw h TYR 86 N 0.74 0.40 0.00 3.04 3.20 -0.52 0.49 116.97 124.32 1ppw h TYR 86 Ca 0.11 -0.19 -0.25 0.00 3.14 0.00 0.00 58.73 61.54 1ppw h TYR 86 Cb 0.71 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.88 1ppw h TYR 86 CO 0.05 0.94 -1.38 0.93 -1.64 0.00 0.00 178.16 177.06 1ppw h GLU 87 N -0.25 0.00 0.00 1.82 5.08 0.13 -3.40 114.58 117.96 1ppw h GLU 87 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1ppw h GLU 87 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1ppw h GLU 87 CO 0.06 0.72 0.00 1.28 -1.00 0.00 0.00 179.01 180.07 1ppw n LEU 88 N -3.18 1.29 -2.44 1.33 4.77 -0.89 -1.42 117.00 116.46 1ppw n LEU 88 Ca -0.09 -1.29 -0.11 0.00 -0.03 0.00 0.00 56.01 54.48 1ppw n LEU 88 Cb 1.00 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.08 1ppw n LEU 88 CO 0.46 0.32 -0.14 0.61 -1.33 0.00 0.00 177.39 177.31 1ppw n GLY 89 N -0.21 -0.50 3.53 -0.72 0.00 0.16 -1.14 105.19 106.32 1ppw n GLY 89 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.56 3.38 0.27 1.61 0.11 -0.88 -4.26 120.40 118.07 1ppw s VAL 90 Ca 0.00 -0.61 -0.12 0.00 -2.93 0.00 0.00 61.98 58.32 1ppw s VAL 90 Cb 0.00 -2.36 -0.08 0.00 -1.53 0.00 0.00 36.38 32.41 1ppw s VAL 90 CO 0.00 0.59 0.63 -1.61 -3.33 0.00 0.00 175.10 171.37 1ppw s GLU 91 N -0.80 3.89 0.21 1.54 0.41 -1.26 -3.53 118.70 119.15 1ppw s GLU 91 Ca 0.12 0.45 -0.00 0.00 -0.41 0.00 0.00 54.97 55.13 1ppw s GLU 91 Cb -0.11 -2.56 -0.04 0.00 -1.78 0.00 0.00 34.13 29.64 1ppw s GLU 91 CO 0.01 0.25 0.10 0.96 -0.49 0.00 0.00 175.26 176.10 1ppw s ILE 92 N -1.88 0.21 0.61 -1.63 -4.36 -1.26 -0.16 121.20 112.72 1ppw s ILE 92 Ca 0.50 -1.99 -0.08 0.00 -0.26 0.00 0.00 60.65 58.82 1ppw s ILE 92 Cb -0.11 -2.45 -0.01 0.00 1.25 0.00 0.00 42.46 41.14 1ppw s ILE 92 CO 0.20 -0.09 0.95 0.42 0.24 0.00 0.00 174.94 176.66 1ppw s THR 93 N -4.00 3.99 -0.08 8.37 -4.23 0.53 -4.79 115.64 115.42 1ppw s THR 93 Ca 0.36 0.30 -0.35 0.00 -1.18 0.00 0.00 61.69 60.82 1ppw s THR 93 Cb 0.07 -3.59 -0.13 0.00 1.34 0.00 0.00 72.50 70.19 1ppw s THR 93 CO 0.11 -0.68 1.81 -2.65 -0.54 0.00 0.00 174.62 172.66 1ppw n PRO 94 N -2.67 2.00 -1.70 3.99 -0.02 -1.26 -4.58 135.00 130.76 1ppw n PRO 94 Ca 0.05 0.73 -0.43 0.00 -2.02 0.00 0.00 63.50 61.83 1ppw n PRO 94 Cb 0.56 -2.54 -0.01 0.00 -0.02 0.00 0.00 33.50 31.50 1ppw n PRO 94 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ppw n PRO 95 N 5.93 2.20 -4.92 0.52 -0.02 -1.26 -4.82 135.00 132.63 1ppw n PRO 95 Ca 0.22 0.77 -0.29 0.00 -2.02 0.00 0.00 63.50 62.19 1ppw n PRO 95 Cb 0.27 -2.40 -0.15 0.00 -0.02 0.00 0.00 33.50 31.20 1ppw n PRO 95 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1ppw s GLU 96 N -1.51 1.74 0.23 -0.52 -1.05 0.19 -4.90 118.70 112.88 1ppw s GLU 96 Ca 0.58 -1.01 -0.30 0.00 -0.15 0.00 0.00 54.97 54.09 1ppw s GLU 96 Cb -0.57 -1.84 -0.10 0.00 -0.44 0.00 0.00 34.13 31.18 1ppw s GLU 96 CO 0.59 0.48 1.42 0.45 0.95 0.00 0.00 175.26 179.15 1ppw s SER 97 N -1.06 6.71 0.00 0.83 0.15 -1.26 -0.24 113.70 118.84 1ppw s SER 97 Ca 0.10 2.59 0.00 0.00 0.70 0.00 0.00 55.95 59.34 1ppw s SER 97 Cb -0.10 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 1ppw s SER 97 CO 0.01 -0.67 0.00 2.30 1.20 0.00 0.00 173.24 176.09 1ppw n ILE 98 N 2.56 0.00 -2.75 6.45 -5.35 -0.37 -4.87 119.36 115.04 1ppw n ILE 98 Ca 0.07 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.52 1ppw n ILE 98 Cb 0.41 0.16 0.02 0.00 -1.74 0.00 0.00 39.64 38.48 1ppw n ILE 98 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1ppw s TYR 99 N -1.08 -1.26 0.05 4.28 6.14 -1.11 -4.11 117.35 120.26 1ppw s TYR 99 Ca 0.00 -0.42 0.25 0.00 0.64 0.00 0.00 57.07 57.54 1ppw s TYR 99 Cb 0.00 0.25 0.86 0.00 0.42 0.00 0.00 41.96 43.49 1ppw s TYR 99 CO 0.00 -0.99 1.80 -1.00 0.64 0.00 0.00 175.55 176.00 1ppw h PRO 100 N 4.84 0.00 -0.32 4.97 0.13 -1.93 0.10 132.00 139.79 1ppw h PRO 100 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1ppw h PRO 100 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1ppw h PRO 100 CO -0.02 0.19 0.00 -0.40 -0.23 0.00 0.00 178.00 177.54 1ppw n ASP 101 N -3.30 4.25 -4.75 1.44 5.75 -1.26 -4.34 116.55 114.34 1ppw n ASP 101 Ca 0.01 -3.00 -0.41 0.00 -0.01 0.00 0.00 54.79 51.38 1ppw n ASP 101 Cb 0.45 -0.57 -0.03 0.00 -1.03 0.00 0.00 41.12 39.93 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 -2.81 3.32 -0.05 2.11 5.36 -1.22 -4.93 117.98 119.76 1ppw s PHE 102 Ca 0.45 1.44 -0.07 0.00 -0.96 0.00 0.00 56.93 57.79 1ppw s PHE 102 Cb 0.36 -3.50 0.01 0.00 -0.34 0.00 0.00 43.02 39.55 1ppw s PHE 102 CO 0.10 -1.38 0.18 0.50 -1.46 0.00 0.00 175.22 173.16 1ppw s ARG 103 N -0.96 0.30 -0.03 10.12 3.00 -1.26 -0.54 118.95 129.57 1ppw s ARG 103 Ca 0.50 0.08 -0.30 0.00 -1.00 0.00 0.00 55.73 55.02 1ppw s ARG 103 Cb -0.35 0.13 0.08 0.00 0.00 0.00 0.00 34.95 34.81 1ppw s ARG 103 CO 0.43 -0.05 0.70 1.52 0.00 0.00 0.00 175.30 177.90 1ppw s TYR 104 N -0.31 -0.61 -0.05 5.12 -0.85 -0.13 -4.98 117.35 115.54 1ppw s TYR 104 Ca -0.04 0.97 0.05 0.00 -0.52 0.00 0.00 57.07 57.52 1ppw s TYR 104 Cb -0.03 0.44 -0.00 0.00 0.38 0.00 0.00 41.96 42.74 1ppw s TYR 104 CO 0.01 -0.61 -0.20 0.50 -1.52 0.00 0.00 175.55 173.72 1ppw s ARG 105 N -1.54 2.08 0.27 -3.49 3.52 -1.26 0.12 118.95 118.65 1ppw s ARG 105 Ca -0.08 -0.71 -0.19 0.00 -0.13 0.00 0.00 55.73 54.62 1ppw s ARG 105 Cb -0.00 -1.78 0.01 0.00 -1.56 0.00 0.00 34.95 31.63 1ppw s ARG 105 CO 0.06 0.28 0.65 0.00 -0.81 0.00 0.00 175.30 175.48 1ppw s ALA 106 N 0.01 -0.95 -0.05 6.12 0.00 0.28 -4.97 121.76 122.20 1ppw s ALA 106 Ca -0.05 -0.45 0.03 0.00 0.00 0.00 0.00 51.96 51.48 1ppw s ALA 106 Cb -0.13 0.91 0.01 0.00 0.00 0.00 0.00 23.12 23.91 1ppw s ALA 106 CO 0.03 -0.98 -0.11 0.99 0.00 0.00 0.00 175.76 175.69 1ppw s THR 107 N -3.94 1.01 0.54 0.00 2.01 -1.26 -0.60 115.64 113.40 1ppw s THR 107 Ca 0.14 -0.44 -0.03 0.00 0.31 0.00 0.00 61.69 61.67 1ppw s THR 107 Cb -0.04 -0.92 0.01 0.00 0.01 0.00 0.00 72.50 71.56 1ppw s THR 107 CO 0.07 0.32 0.81 1.51 -0.69 0.00 0.00 174.62 176.64 1ppw s ASP 108 N 0.45 5.62 0.66 3.53 -4.77 0.26 -4.90 116.67 117.51 1ppw s ASP 108 Ca -0.09 0.48 0.40 0.00 -3.30 0.00 0.00 52.55 50.04 1ppw s ASP 108 Cb -0.13 -1.55 2.18 0.00 -1.09 0.00 0.00 42.92 42.33 1ppw s ASP 108 CO 0.02 -0.96 2.26 -0.65 0.70 0.00 0.00 175.17 176.54 1ppw h PRO 109 N 0.04 0.00 -0.02 2.11 0.11 -2.00 0.82 132.00 133.06 1ppw h PRO 109 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1ppw h PRO 109 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1ppw h PRO 109 CO 0.59 0.00 -0.04 -1.13 -0.21 0.00 0.00 178.00 177.20 1ppw n SER 110 N -3.15 1.92 0.00 -2.05 3.41 -1.26 -4.92 113.62 107.57 1ppw n SER 110 Ca -0.02 -1.59 0.00 0.00 -0.26 0.00 0.00 58.87 56.99 1ppw n SER 110 Cb 0.15 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 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 1.25 0.87 3.73 5.00 0.00 0.28 -5.08 105.19 111.25 1ppw n GLY 111 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.02 4.23 -0.10 -0.61 -1.09 -1.25 -4.15 121.20 116.22 1ppw s ILE 112 Ca 0.00 1.90 -0.03 0.00 -2.23 0.00 0.00 60.65 60.29 1ppw s ILE 112 Cb 0.00 -4.21 -0.03 0.00 -1.58 0.00 0.00 42.46 36.63 1ppw s ILE 112 CO 0.00 0.31 0.01 -0.69 -1.23 0.00 0.00 174.94 173.35 1ppw s VAL 113 N -0.16 4.40 -0.11 2.92 1.01 -0.50 0.90 120.40 128.86 1ppw s VAL 113 Ca 0.48 -0.21 -0.02 0.00 0.00 0.00 0.00 61.98 62.23 1ppw s VAL 113 Cb -0.26 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 1ppw s VAL 113 CO 0.32 0.59 -0.04 -1.61 0.00 0.00 0.00 175.10 174.36 1ppw s GLU 114 N -0.76 3.18 -0.32 2.72 0.41 0.23 -4.39 118.70 119.78 1ppw s GLU 114 Ca 0.12 -0.50 -0.02 0.00 -0.41 0.00 0.00 54.97 54.15 1ppw s GLU 114 Cb -0.12 -2.77 0.12 0.00 -1.78 0.00 0.00 34.13 29.58 1ppw s GLU 114 CO 0.02 0.50 0.16 1.21 -0.49 0.00 0.00 175.26 176.67 1ppw s ASN 115 N -0.35 3.35 0.01 -0.19 2.47 -1.26 0.10 114.94 119.08 1ppw s ASN 115 Ca 0.06 -1.69 0.00 0.00 0.42 0.00 0.00 52.86 51.65 1ppw s ASN 115 Cb -0.12 -0.42 -0.01 0.00 -1.45 0.00 0.00 41.25 39.25 1ppw s ASN 115 CO 0.02 -0.38 -0.03 -1.61 -3.72 0.00 0.00 177.10 171.38 1ppw s GLU 116 N 1.63 0.22 -0.40 0.43 2.02 0.12 -1.30 118.70 121.42 1ppw s GLU 116 Ca 0.13 -0.34 -0.25 0.00 0.02 0.00 0.00 54.97 54.53 1ppw s GLU 116 Cb -0.19 -0.03 0.02 0.00 0.10 0.00 0.00 34.13 34.03 1ppw s GLU 116 CO -0.21 -0.00 0.88 0.08 0.02 0.00 0.00 175.26 176.03 1ppw s VAL 117 N -0.73 4.59 -0.48 2.63 1.01 -0.20 -0.95 120.40 126.28 1ppw s VAL 117 Ca -0.07 0.94 0.04 0.00 0.00 0.00 0.00 61.98 62.89 1ppw s VAL 117 Cb -0.05 -4.33 0.17 0.00 0.00 0.00 0.00 36.38 32.17 1ppw s VAL 117 CO -0.00 -0.61 0.37 0.00 0.00 0.00 0.00 175.10 174.86 1ppw s PRO 119 N -0.28 4.14 -0.10 0.00 0.04 -1.21 -4.35 135.00 133.24 1ppw s PRO 119 Ca 0.31 2.53 -0.04 0.00 0.04 0.00 0.00 61.00 63.85 1ppw s PRO 119 Cb 0.02 -2.98 -0.04 0.00 0.04 0.00 0.00 34.50 31.54 1ppw s PRO 119 CO -0.19 -0.50 0.04 0.08 0.04 0.00 0.00 177.00 176.47 1ppw s VAL 120 N -1.02 4.69 0.32 -0.36 1.01 0.36 -2.15 120.40 123.24 1ppw s VAL 120 Ca 0.53 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.44 1ppw s VAL 120 Cb -0.46 -3.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.86 1ppw s VAL 120 CO 0.61 0.60 0.06 -0.36 0.00 0.00 0.00 175.10 176.01 1ppw s PHE 121 N -0.87 1.92 0.02 5.22 0.40 -0.24 -1.23 117.98 123.20 1ppw s PHE 121 Ca 0.13 -0.98 -0.03 0.00 -0.60 0.00 0.00 56.93 55.45 1ppw s PHE 121 Cb -0.12 -1.24 -0.01 0.00 0.51 0.00 0.00 43.02 42.16 1ppw s PHE 121 CO 0.03 -0.03 0.04 0.00 0.70 0.00 0.00 175.22 175.96 1ppw s ALA 122 N -3.34 -0.01 0.21 5.36 0.00 0.67 -0.96 121.76 123.69 1ppw s ALA 122 Ca 0.37 -0.50 -0.23 0.00 0.00 0.00 0.00 51.96 51.59 1ppw s ALA 122 Cb 0.09 0.16 0.04 0.00 0.00 0.00 0.00 23.12 23.41 1ppw s ALA 122 CO 0.15 -0.21 0.81 0.00 0.00 0.00 0.00 175.76 176.51 1ppw s ALA 123 N -1.79 -1.43 -0.10 0.00 0.00 -0.92 0.54 121.76 118.05 1ppw s ALA 123 Ca -0.12 -0.03 -0.00 0.00 0.00 0.00 0.00 51.96 51.80 1ppw s ALA 123 Cb -0.07 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.78 1ppw s ALA 123 CO -0.01 -1.01 -0.08 1.03 0.00 0.00 0.00 175.76 175.69 1ppw s ARG 124 N -3.64 3.11 0.48 0.00 0.52 -1.26 -0.58 118.95 117.59 1ppw s ARG 124 Ca 0.10 -0.58 -0.22 0.00 -0.52 0.00 0.00 55.73 54.52 1ppw s ARG 124 Cb -0.04 -2.67 -0.07 0.00 0.52 0.00 0.00 34.95 32.69 1ppw s ARG 124 CO 0.03 0.46 1.15 0.95 0.02 0.00 0.00 175.30 177.90 1ppw s THR 125 N -0.25 3.16 -0.27 0.02 -4.23 -0.71 -0.34 115.64 113.01 1ppw s THR 125 Ca 0.03 0.83 0.02 0.00 -1.18 0.00 0.00 61.69 61.39 1ppw s THR 125 Cb -0.13 -3.39 0.03 0.00 1.34 0.00 0.00 72.50 70.35 1ppw s THR 125 CO 0.03 -0.06 0.73 0.35 -0.54 0.00 0.00 174.62 175.13 1ppw n THR 126 N -0.71 0.32 -4.07 3.99 -2.24 0.77 -4.55 114.28 107.79 1ppw n THR 126 Ca 0.08 -0.66 -0.14 0.00 -2.27 0.00 0.00 64.05 61.07 1ppw n THR 126 Cb 0.49 0.88 -0.04 0.00 -2.10 0.00 0.00 70.33 69.55 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 -0.46 0.70 0.62 3.42 1.04 -1.25 -4.94 113.70 112.83 1ppw s SER 127 Ca 0.04 -1.39 -0.15 0.00 0.48 0.00 0.00 55.95 54.93 1ppw s SER 127 Cb 0.02 0.65 -0.03 0.00 0.10 0.00 0.00 66.02 66.76 1ppw s SER 127 CO 0.03 -1.27 1.06 0.00 0.98 0.00 0.00 173.24 174.04 1ppw s ALA 128 N -3.22 2.73 0.54 5.32 0.00 -1.26 -4.70 121.76 121.16 1ppw s ALA 128 Ca 0.29 0.32 -0.18 0.00 0.00 0.00 0.00 51.96 52.40 1ppw s ALA 128 Cb -0.00 -3.22 -0.06 0.00 0.00 0.00 0.00 23.12 19.84 1ppw s ALA 128 CO 0.18 -0.90 1.04 -0.51 0.00 0.00 0.00 175.76 175.56 1ppw s LEU 129 N -4.74 3.65 -0.23 0.00 1.43 -1.26 -4.47 118.68 113.05 1ppw s LEU 129 Ca 0.62 1.81 -0.04 0.00 -1.03 0.00 0.00 54.13 55.49 1ppw s LEU 129 Cb -0.15 -4.54 0.09 0.00 0.03 0.00 0.00 46.19 41.62 1ppw s LEU 129 CO 0.41 -0.92 0.16 -1.58 0.23 0.00 0.00 176.35 174.66 1ppw s GLN 130 N -3.77 0.17 0.24 1.70 0.74 -0.29 -5.00 119.66 113.45 1ppw s GLN 130 Ca 0.64 -0.16 -0.30 0.00 0.05 0.00 0.00 55.36 55.59 1ppw s GLN 130 Cb -0.15 -1.30 -0.09 0.00 1.10 0.00 0.00 33.01 32.57 1ppw s GLN 130 CO 0.30 -0.83 1.04 0.42 -0.55 0.00 0.00 175.29 175.67 1ppw s ILE 131 N 2.21 3.80 -0.46 -2.34 -1.09 -1.26 -2.25 121.20 119.80 1ppw s ILE 131 Ca 0.06 1.74 -0.16 0.00 -2.23 0.00 0.00 60.65 60.06 1ppw s ILE 131 Cb -0.16 -4.11 0.06 0.00 -1.58 0.00 0.00 42.46 36.67 1ppw s ILE 131 CO -0.22 0.38 0.39 0.21 -1.23 0.00 0.00 174.94 174.48 1ppw s ASN 132 N -0.78 6.15 0.00 3.58 3.84 -0.51 -4.93 114.94 122.29 1ppw s ASN 132 Ca 0.44 -1.16 0.11 0.00 0.21 0.00 0.00 52.86 52.47 1ppw s ASN 132 Cb -0.29 -2.19 0.68 0.00 -0.55 0.00 0.00 41.25 38.90 1ppw s ASN 132 CO 0.36 -0.61 1.24 -0.90 -2.79 0.00 0.00 177.10 174.40 1ppw n ASP 133 N 5.29 0.00 0.20 -4.21 5.68 -1.26 -0.43 116.55 121.83 1ppw n ASP 133 Ca -0.11 -1.14 0.13 0.00 -0.50 0.00 0.00 54.79 53.17 1ppw n ASP 133 Cb 0.45 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 40.73 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 0.00 0.00 0.00 -1.12 3.32 -1.95 -3.40 116.42 113.28 1ppw h ASP 134 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1ppw h ASP 134 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ppw h ASP 134 CO 0.00 0.00 -1.06 -0.62 -1.72 0.00 0.00 179.24 175.84 1ppw n GLU 135 N -2.91 0.48 -5.03 3.56 -0.58 0.43 -4.74 120.64 111.85 1ppw n GLU 135 Ca 0.04 0.01 -0.32 0.00 -0.42 0.00 0.00 57.16 56.46 1ppw n GLU 135 Cb 0.47 -1.02 -0.17 0.00 -0.57 0.00 0.00 31.44 30.15 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 -2.02 2.04 -0.43 2.62 1.01 -0.16 -1.43 120.40 122.02 1ppw s VAL 136 Ca -0.01 -0.99 0.16 0.00 0.00 0.00 0.00 61.98 61.13 1ppw s VAL 136 Cb 0.00 -1.77 -0.21 0.00 0.00 0.00 0.00 36.38 34.40 1ppw s VAL 136 CO 0.03 0.55 0.53 1.15 0.00 0.00 0.00 175.10 177.36 1ppw n MET 137 N 3.70 1.25 -3.56 2.72 0.00 -0.41 -4.08 117.12 116.75 1ppw n MET 137 Ca -0.19 -0.06 -0.06 0.00 0.00 0.00 0.00 57.70 57.38 1ppw n MET 137 Cb 0.52 -1.30 -0.02 0.00 0.00 0.00 0.00 33.22 32.42 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 -3.07 -0.27 0.16 3.17 2.15 -1.24 -5.01 116.67 112.56 1ppw s ASP 138 Ca 0.01 -0.06 -0.24 0.00 0.43 0.00 0.00 52.55 52.69 1ppw s ASP 138 Cb 0.11 0.33 0.06 0.00 -0.30 0.00 0.00 42.92 43.12 1ppw s ASP 138 CO 0.66 -0.54 0.86 -0.72 -0.17 0.00 0.00 175.17 175.25 1ppw s TYR 139 N -2.93 -0.22 -0.23 -5.34 -0.85 -1.26 0.29 117.35 106.80 1ppw s TYR 139 Ca 0.07 -0.08 -0.09 0.00 -0.52 0.00 0.00 57.07 56.44 1ppw s TYR 139 Cb -0.01 0.63 0.09 0.00 0.38 0.00 0.00 41.96 43.06 1ppw s TYR 139 CO -0.06 -0.88 0.52 -1.14 -1.52 0.00 0.00 175.55 172.47 1ppw s GLN 140 N -3.45 0.46 -0.13 -3.49 2.00 0.08 -4.98 119.66 110.14 1ppw s GLN 140 Ca 0.10 1.14 -0.28 0.00 -2.00 0.00 0.00 55.36 54.32 1ppw s GLN 140 Cb -0.02 0.39 -0.01 0.00 0.80 0.00 0.00 33.01 34.17 1ppw s GLN 140 CO 0.00 -0.21 0.94 -1.58 -0.50 0.00 0.00 175.29 173.94 1ppw s TRP 141 N 2.34 3.48 0.26 1.67 0.52 -1.26 -1.70 118.94 124.24 1ppw s TRP 141 Ca -0.05 1.46 -0.09 0.00 0.02 0.00 0.00 56.10 57.44 1ppw s TRP 141 Cb -0.10 -3.12 -0.01 0.00 -1.15 0.00 0.00 33.47 29.09 1ppw s TRP 141 CO -0.16 -0.23 0.43 0.00 0.02 0.00 0.00 176.95 177.01 1ppw s ASP 143 N -3.08 7.29 0.31 0.00 1.01 -1.26 0.14 116.67 121.08 1ppw s ASP 143 Ca 0.26 1.70 0.06 0.00 0.71 0.00 0.00 52.55 55.29 1ppw s ASP 143 Cb 0.01 -2.57 0.84 0.00 1.01 0.00 0.00 42.92 42.20 1ppw s ASP 143 CO 0.12 -0.34 1.67 0.25 0.21 0.00 0.00 175.17 177.08 1ppw h LEU 144 N 7.06 0.25 -0.94 1.23 5.85 -1.91 -1.27 115.31 125.58 1ppw h LEU 144 Ca -0.39 0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.45 1ppw h LEU 144 Cb 1.20 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.40 1ppw h LEU 144 CO 0.78 -0.11 0.06 0.00 -0.34 0.00 0.00 178.44 178.84 1ppw h ALA 145 N 1.79 1.13 -0.35 1.25 0.00 -1.98 0.21 119.26 121.31 1ppw h ALA 145 Ca 0.61 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 55.19 1ppw h ALA 145 Cb 1.28 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1ppw h ALA 145 CO -0.61 0.57 -0.13 -0.44 0.00 0.00 0.00 179.25 178.64 1ppw h ASP 146 N 0.79 0.71 -0.60 0.00 3.32 -1.65 0.21 116.42 119.20 1ppw h ASP 146 Ca 0.16 -0.39 0.04 0.00 0.02 0.00 0.00 57.03 56.87 1ppw h ASP 146 Cb 0.39 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 1ppw h ASP 146 CO 0.01 0.94 0.35 0.58 -1.72 0.00 0.00 179.24 179.39 1ppw h VAL 147 N 0.48 1.01 -0.84 -1.35 2.07 -0.89 0.19 116.25 116.93 1ppw h VAL 147 Ca 0.08 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1ppw h VAL 147 Cb 0.65 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 1ppw h VAL 147 CO 0.04 0.12 0.41 -0.07 0.02 0.00 0.00 177.57 178.09 1ppw h LEU 148 N 0.66 1.10 -0.59 2.57 3.38 -0.54 0.33 115.31 122.22 1ppw h LEU 148 Ca 0.26 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ppw h LEU 148 Cb 0.10 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1ppw h LEU 148 CO -0.14 0.92 0.38 0.45 0.09 0.00 0.00 178.44 180.14 1ppw h HIS 149 N 1.20 0.76 -0.29 1.13 3.86 0.13 0.22 115.15 122.15 1ppw h HIS 149 Ca 0.29 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.47 1ppw h HIS 149 Cb 0.11 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 1ppw h HIS 149 CO 0.01 0.49 0.04 0.78 0.86 0.00 0.00 177.93 180.12 1ppw h GLY 150 N 0.80 0.52 0.66 2.45 0.00 -0.37 0.26 103.07 107.39 1ppw h GLY 150 Ca 0.21 -0.35 0.07 0.00 0.00 0.00 0.00 47.33 47.27 1ppw h GLY 150 CO -0.04 0.32 0.50 -2.22 0.00 0.00 0.00 176.54 175.10 1ppw h ILE 151 N 0.30 1.00 -0.11 2.60 2.04 0.01 0.19 117.51 123.55 1ppw h ILE 151 Ca 0.09 -0.31 -0.12 0.00 1.00 0.00 0.00 64.86 65.52 1ppw h ILE 151 Cb 0.35 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 1ppw h ILE 151 CO 0.01 0.16 -0.47 0.44 0.00 0.00 0.00 178.15 178.29 1ppw h ASP 152 N 0.90 0.29 0.06 1.72 3.32 -0.20 -3.01 116.42 119.50 1ppw h ASP 152 Ca 0.37 -0.14 -0.23 0.00 0.02 0.00 0.00 57.03 57.06 1ppw h ASP 152 Cb 0.23 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1ppw h ASP 152 CO -0.19 0.72 -1.22 0.00 -1.72 0.00 0.00 179.24 176.83 1ppw h ALA 153 N 1.29 0.20 -2.14 3.45 0.00 -0.24 -3.42 119.26 118.40 1ppw h ALA 153 Ca 0.01 -1.07 -0.58 0.00 0.00 0.00 0.00 54.91 53.27 1ppw h ALA 153 Cb 0.92 0.52 -0.40 0.00 0.00 0.00 0.00 17.79 18.83 1ppw h ALA 153 CO 0.08 0.71 -0.90 0.25 0.00 0.00 0.00 179.25 179.39 1ppw n THR 154 N -4.15 0.43 0.18 0.00 -2.24 0.62 -4.96 114.28 104.16 1ppw n THR 154 Ca -0.26 -4.43 0.06 0.00 -2.27 0.00 0.00 64.05 57.15 1ppw n THR 154 Cb 0.78 -2.00 0.54 0.00 -2.10 0.00 0.00 70.33 67.55 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 4.24 0.15 0.00 -0.78 0.13 -1.66 -1.53 132.00 132.55 1ppw h PRO 155 Ca 0.13 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1ppw h PRO 155 Cb 0.80 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1ppw h PRO 155 CO 0.60 0.16 0.00 -2.67 -0.23 0.00 0.00 178.00 175.86 1ppw n TRP 156 N -4.46 0.63 1.46 1.56 4.27 -1.26 -1.42 117.44 118.23 1ppw n TRP 156 Ca -0.01 0.29 0.12 0.00 -3.89 0.00 0.00 57.50 54.01 1ppw n TRP 156 Cb 0.13 -0.97 0.48 0.00 -1.36 0.00 0.00 31.31 29.59 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 -1.73 2.56 -2.35 -1.67 0.00 -0.57 -4.90 120.51 111.85 1ppw n ALA 157 Ca 0.00 -0.42 -0.18 0.00 0.00 0.00 0.00 53.44 52.84 1ppw n ALA 157 Cb 0.11 -1.17 -0.10 0.00 0.00 0.00 0.00 19.45 18.29 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 -1.89 1.63 0.54 0.00 0.08 -0.50 -4.38 117.98 113.45 1ppw s PHE 158 Ca 0.34 -0.94 -0.21 0.00 0.12 0.00 0.00 56.93 56.25 1ppw s PHE 158 Cb 0.18 -0.96 -0.05 0.00 -0.57 0.00 0.00 43.02 41.62 1ppw s PHE 158 CO 0.28 -0.04 1.22 -1.54 -0.10 0.00 0.00 175.22 175.04 1ppw s SER 159 N -3.34 5.55 0.39 1.36 1.04 0.50 -4.85 113.70 114.35 1ppw s SER 159 Ca 0.30 2.43 0.09 0.00 0.48 0.00 0.00 55.95 59.25 1ppw s SER 159 Cb 0.06 -2.61 0.78 0.00 0.10 0.00 0.00 66.02 64.35 1ppw s SER 159 CO 0.10 -1.35 1.93 1.55 0.98 0.00 0.00 173.24 176.45 1ppw h PRO 160 N 1.39 0.30 0.01 4.02 0.13 -1.92 -1.50 132.00 134.43 1ppw h PRO 160 Ca -0.50 -0.06 -0.19 0.00 -0.87 0.00 0.00 66.00 64.38 1ppw h PRO 160 Cb 1.28 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1ppw h PRO 160 CO 0.57 0.39 -0.88 0.11 -0.23 0.00 0.00 178.00 177.97 1ppw h TRP 161 N 0.28 0.16 -0.54 1.56 0.09 -1.99 -1.82 115.95 113.69 1ppw h TRP 161 Ca 0.06 -0.09 0.00 0.00 0.09 0.00 0.00 58.89 58.95 1ppw h TRP 161 Cb 0.32 -0.02 -0.03 0.00 0.08 0.00 0.00 29.16 29.52 1ppw h TRP 161 CO 0.01 0.93 0.35 1.98 0.09 0.00 0.00 178.44 181.79 1ppw h MET 162 N 0.06 0.72 -0.06 0.12 4.05 -1.77 0.13 114.93 118.18 1ppw h MET 162 Ca -0.03 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1ppw h MET 162 Cb 1.52 -0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 32.16 1ppw h MET 162 CO 0.13 0.49 0.04 0.28 0.23 0.00 0.00 176.91 178.08 1ppw h VAL 163 N 0.74 1.07 -0.59 -5.77 2.07 -1.14 -1.28 116.25 111.35 1ppw h VAL 163 Ca 0.20 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1ppw h VAL 163 Cb -0.06 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 1ppw h VAL 163 CO -0.04 0.06 0.35 0.24 0.02 0.00 0.00 177.57 178.20 1ppw h MET 164 N 0.03 0.67 -0.25 1.57 2.86 -1.20 -1.27 114.93 117.33 1ppw h MET 164 Ca 0.02 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1ppw h MET 164 Cb 0.06 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1ppw h MET 164 CO -0.00 0.44 0.05 1.96 1.06 0.00 0.00 176.91 180.43 1ppw h GLN 165 N 0.69 0.41 0.00 1.72 4.20 -0.63 -2.49 115.11 119.01 1ppw h GLN 165 Ca 0.24 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1ppw h GLN 165 Cb 0.04 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1ppw h GLN 165 CO -0.11 0.52 0.00 0.00 -0.67 0.00 0.00 178.83 178.57 1ppw n ALA 166 N -2.30 2.12 0.63 3.87 0.00 -0.51 -1.91 120.51 122.41 1ppw n ALA 166 Ca -0.03 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.47 1ppw n ALA 166 Cb 0.19 -1.41 0.21 0.00 0.00 0.00 0.00 19.45 18.44 1ppw n ALA 166 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ppw n THR 167 N -1.71 0.32 -2.76 0.00 -2.24 -0.49 -4.54 114.28 102.85 1ppw n THR 167 Ca 0.06 -0.62 -0.42 0.00 -2.27 0.00 0.00 64.05 60.79 1ppw n THR 167 Cb 0.31 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.56 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 -1.66 7.02 0.14 3.42 3.84 -0.80 -4.95 114.94 121.96 1ppw s ASN 168 Ca 0.35 1.28 -0.24 0.00 0.21 0.00 0.00 52.86 54.46 1ppw s ASN 168 Cb 0.21 -2.50 0.01 0.00 -0.55 0.00 0.00 41.25 38.42 1ppw s ASN 168 CO 0.31 -0.56 1.62 -0.09 -2.79 0.00 0.00 177.10 175.59 1ppw h ARG 169 N 7.45 -0.30 -0.47 0.43 1.12 -1.88 0.47 114.38 121.20 1ppw h ARG 169 Ca -0.23 0.02 0.04 0.00 -1.11 0.00 0.00 59.98 58.70 1ppw h ARG 169 Cb 1.09 0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 31.08 1ppw h ARG 169 CO 0.92 -0.20 0.23 0.93 -3.11 0.00 0.00 179.97 178.74 1ppw h GLU 170 N -0.31 0.45 -0.55 0.20 3.07 -1.94 -2.07 114.58 113.43 1ppw h GLU 170 Ca 0.12 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.93 1ppw h GLU 170 Cb 0.49 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 28.27 1ppw h GLU 170 CO -0.37 0.30 0.28 0.00 -1.40 0.00 0.00 179.01 177.82 1ppw h ALA 171 N 1.26 0.71 -0.16 3.43 0.00 -1.47 -2.07 119.26 120.96 1ppw h ALA 171 Ca 0.21 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1ppw h ALA 171 Cb 0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1ppw h ALA 171 CO -0.15 0.26 -0.08 -0.09 0.00 0.00 0.00 179.25 179.19 1ppw h ARG 172 N 0.74 0.24 0.60 0.00 2.43 -0.71 0.16 114.38 117.85 1ppw h ARG 172 Ca 0.19 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 1ppw h ARG 172 Cb 0.10 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1ppw h ARG 172 CO -0.03 0.34 -0.29 -0.22 -1.51 0.00 0.00 179.97 178.27 1ppw h LYS 173 N 0.24 -0.77 -0.34 0.20 3.11 -0.87 -0.16 116.57 117.97 1ppw h LYS 173 Ca 0.05 0.05 -0.05 0.00 -2.81 0.00 0.00 60.65 57.89 1ppw h LYS 173 Cb 0.30 0.18 -0.02 0.00 -1.00 0.00 0.00 32.23 31.69 1ppw h LYS 173 CO 0.01 -0.48 -0.00 0.00 -2.81 0.00 0.00 179.45 176.18 1ppw h ARG 174 N -0.92 0.53 -0.50 1.90 3.08 -1.15 -2.08 114.38 115.24 1ppw h ARG 174 Ca -0.08 -0.11 -0.06 0.00 0.07 0.00 0.00 59.98 59.80 1ppw h ARG 174 Cb 0.65 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1ppw h ARG 174 CO 0.13 0.56 0.10 -0.07 -1.07 0.00 0.00 179.97 179.62 1ppw h LEU 175 N 0.51 0.78 -8.01 3.04 3.38 -0.59 -3.26 115.31 111.16 1ppw h LEU 175 Ca 0.11 -0.25 -0.53 0.00 0.09 0.00 0.00 57.88 57.30 1ppw h LEU 175 Cb 0.33 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 1ppw h LEU 175 CO 0.01 0.83 1.57 -0.44 0.09 0.00 0.00 178.44 180.50 1ppw s SER 176 N -6.20 6.13 0.00 -0.43 0.01 -0.08 -2.68 113.70 110.46 1ppw s SER 176 Ca -0.13 -1.76 0.00 0.00 1.31 0.00 0.00 55.95 55.37 1ppw s SER 176 Cb 0.11 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.77 1ppw s SER 176 CO 0.80 -1.88 0.00 0.00 0.41 0.00 0.00 173.24 172.57 1ppw n ALA 177 N 10.55 0.00 0.89 1.44 0.00 -1.23 -4.77 120.51 127.39 1ppw n ALA 177 Ca 0.42 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.88 1ppw n ALA 177 Cb 0.48 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.03 1ppw n ALA 177 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ppw n PHE 178 N 0.00 0.00 -0.13 0.00 3.01 -1.09 -5.16 117.46 114.08 1ppw n PHE 178 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1ppw n PHE 178 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1ppw n PHE 178 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02