#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uld s LEU 2 N 0.00 4.33 0.12 -0.89 2.96 -1.26 -0.79 118.68 123.15 1uld s LEU 2 Ca 0.00 0.66 0.05 0.00 -0.22 0.00 0.00 54.13 54.63 1uld s LEU 2 Cb 0.00 -2.43 -0.04 0.00 0.50 0.00 0.00 46.19 44.22 1uld s LEU 2 CO 0.00 0.18 -0.13 -0.31 -1.32 0.00 0.00 176.35 174.77 1uld s TYR 3 N -0.10 1.33 -0.33 5.38 1.51 0.81 -5.00 117.35 120.94 1uld s TYR 3 Ca 0.19 -0.59 0.02 0.00 -1.01 0.00 0.00 57.07 55.68 1uld s TYR 3 Cb -0.14 -0.69 0.09 0.00 -0.11 0.00 0.00 41.96 41.10 1uld s TYR 3 CO 0.07 0.12 0.05 -1.01 -1.11 0.00 0.00 175.55 173.66 1uld s HIS 4 N -2.30 3.57 -0.41 2.71 3.76 -1.26 -1.23 115.29 120.13 1uld s HIS 4 Ca 0.09 -2.60 -0.20 0.00 -0.15 0.00 0.00 55.06 52.20 1uld s HIS 4 Cb -0.04 -2.69 0.01 0.00 1.11 0.00 0.00 32.58 30.97 1uld s HIS 4 CO 0.02 -0.92 0.61 -1.17 -0.85 0.00 0.00 174.74 172.43 1uld s LEU 5 N 1.04 4.44 0.37 0.89 2.96 -0.73 -4.87 118.68 122.78 1uld s LEU 5 Ca 0.04 -0.20 -0.16 0.00 -0.22 0.00 0.00 54.13 53.60 1uld s LEU 5 Cb -0.20 -2.70 -0.09 0.00 0.50 0.00 0.00 46.19 43.70 1uld s LEU 5 CO -0.06 -0.68 0.80 -0.36 -1.32 0.00 0.00 176.35 174.73 1uld s PHE 6 N 2.70 3.38 0.35 5.38 0.40 -1.26 -0.39 117.98 128.53 1uld s PHE 6 Ca 0.22 1.29 -0.28 0.00 -0.60 0.00 0.00 56.93 57.55 1uld s PHE 6 Cb -0.15 -2.60 -0.11 0.00 0.51 0.00 0.00 43.02 40.68 1uld s PHE 6 CO 0.17 -0.02 1.38 0.54 0.70 0.00 0.00 175.22 177.99 1uld s VAL 7 N -2.14 2.47 -1.38 -0.44 0.11 -1.26 -2.30 120.40 115.46 1uld s VAL 7 Ca 0.56 0.48 -0.08 0.00 -2.93 0.00 0.00 61.98 60.00 1uld s VAL 7 Cb -0.10 -3.30 0.01 0.00 -1.53 0.00 0.00 36.38 31.46 1uld s VAL 7 CO 0.20 0.11 1.06 0.59 -3.33 0.00 0.00 175.10 173.73 1uld n ASN 8 N 0.72 -6.30 -0.57 3.54 3.02 0.37 -4.95 115.26 111.09 1uld n ASN 8 Ca 0.01 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 54.07 1uld n ASN 8 Cb 0.41 -4.96 0.00 0.00 -0.61 0.00 0.00 39.78 34.61 1uld n ASN 8 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1uld n ASN 9 N -2.86 0.00 -3.42 6.41 2.85 -0.97 -5.01 115.26 112.27 1uld n ASN 9 Ca -0.01 -0.57 -0.08 0.00 -0.11 0.00 0.00 54.58 53.80 1uld n ASN 9 Cb 0.57 0.00 -0.00 0.00 1.24 0.00 0.00 39.78 41.59 1uld n ASN 9 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1uld s GLN 10 N -0.72 1.99 -0.04 1.20 -2.07 -1.26 -1.56 119.66 117.19 1uld s GLN 10 Ca 0.00 -1.24 0.01 0.00 -1.82 0.00 0.00 55.36 52.31 1uld s GLN 10 Cb 0.00 0.60 0.02 0.00 -1.09 0.00 0.00 33.01 32.54 1uld s GLN 10 CO 0.00 -0.91 -0.06 0.14 -1.32 0.00 0.00 175.29 173.14 1uld s VAL 11 N -3.15 0.59 -0.14 3.63 -7.23 -0.34 -4.79 120.40 108.97 1uld s VAL 11 Ca 0.15 -0.19 -0.24 0.00 -1.81 0.00 0.00 61.98 59.89 1uld s VAL 11 Cb -0.05 -0.59 -0.02 0.00 0.56 0.00 0.00 36.38 36.28 1uld s VAL 11 CO 0.10 0.22 0.76 -0.75 -0.31 0.00 0.00 175.10 175.13 1uld s LYS 12 N 0.68 4.33 0.14 4.82 2.47 -1.26 -1.90 119.74 129.02 1uld s LYS 12 Ca -0.10 0.92 -0.30 0.00 -1.56 0.00 0.00 55.97 54.94 1uld s LYS 12 Cb -0.13 -3.53 -0.07 0.00 -1.46 0.00 0.00 37.83 32.64 1uld s LYS 12 CO 0.00 -0.19 1.09 -0.51 0.16 0.00 0.00 175.35 175.90 1uld s LEU 13 N 1.67 4.46 0.45 5.43 1.43 0.46 -4.92 118.68 127.66 1uld s LEU 13 Ca 0.37 2.00 0.18 0.00 -1.03 0.00 0.00 54.13 55.65 1uld s LEU 13 Cb -0.17 -3.59 1.06 0.00 0.03 0.00 0.00 46.19 43.52 1uld s LEU 13 CO 0.14 -0.24 1.97 -0.61 0.23 0.00 0.00 176.35 177.84 1uld h GLN 14 N 5.58 0.00 -4.83 1.70 5.75 -1.95 -3.43 115.11 117.93 1uld h GLN 14 Ca -0.43 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 57.74 1uld h GLN 14 Cb 1.21 0.00 -0.22 0.00 1.07 0.00 0.00 27.48 29.55 1uld h GLN 14 CO 0.74 0.21 -0.75 -0.80 -2.65 0.00 0.00 178.83 175.58 1uld s ASN 15 N -6.72 1.13 0.25 -0.69 -0.87 -1.26 -5.12 114.94 101.66 1uld s ASN 15 Ca -0.03 -0.56 -0.31 0.00 -1.57 0.00 0.00 52.86 50.39 1uld s ASN 15 Cb 0.14 0.00 -0.13 0.00 -0.02 0.00 0.00 41.25 41.25 1uld s ASN 15 CO 0.67 -0.15 1.42 0.47 -2.57 0.00 0.00 177.10 176.94 1uld n ASP 16 N 1.45 2.87 -4.54 -1.22 9.92 -1.26 -4.91 116.55 118.86 1uld n ASP 16 Ca -0.22 1.14 -0.43 0.00 -0.53 0.00 0.00 54.79 54.75 1uld n ASP 16 Cb 0.55 -1.45 -0.05 0.00 -0.64 0.00 0.00 41.12 39.53 1uld n ASP 16 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1uld s PHE 17 N -0.08 2.91 0.17 1.24 5.36 0.72 -4.92 117.98 123.39 1uld s PHE 17 Ca 0.67 0.19 0.04 0.00 -0.96 0.00 0.00 56.93 56.87 1uld s PHE 17 Cb -0.63 -3.89 -0.01 0.00 -0.34 0.00 0.00 43.02 38.14 1uld s PHE 17 CO 0.50 -1.13 0.14 0.36 -1.46 0.00 0.00 175.22 173.63 1uld n LYS 18 N 7.08 0.25 -1.52 10.12 2.85 -1.26 -1.57 118.16 134.11 1uld n LYS 18 Ca 0.04 -1.68 -0.52 0.00 -1.05 0.00 0.00 58.31 55.09 1uld n LYS 18 Cb 0.48 1.34 -0.05 0.00 -0.65 0.00 0.00 35.03 36.15 1uld n LYS 18 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1uld n PRO 19 N -0.33 0.56 0.00 -1.58 -0.02 -1.26 0.05 135.00 132.42 1uld n PRO 19 Ca 0.03 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1uld n PRO 19 Cb 0.30 -1.60 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1uld n PRO 19 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1uld n GLU 20 N 1.55 0.00 -2.26 -0.52 -0.58 0.59 -4.97 120.64 114.46 1uld n GLU 20 Ca 0.17 0.00 -0.37 0.00 -0.42 0.00 0.00 57.16 56.54 1uld n GLU 20 Cb 0.19 -0.80 -0.01 0.00 -0.57 0.00 0.00 31.44 30.25 1uld n GLU 20 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1uld s SER 21 N -2.16 6.23 -0.05 1.62 0.01 0.11 -3.41 113.70 116.06 1uld s SER 21 Ca 0.00 2.32 0.02 0.00 1.31 0.00 0.00 55.95 59.60 1uld s SER 21 Cb 0.00 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.64 1uld s SER 21 CO 0.00 -0.88 -0.07 -0.69 0.41 0.00 0.00 173.24 172.01 1uld s VAL 22 N -1.51 0.72 -0.25 3.43 1.01 -0.42 -1.11 120.40 122.28 1uld s VAL 22 Ca 0.62 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 62.35 1uld s VAL 22 Cb -0.29 -0.70 0.03 0.00 0.00 0.00 0.00 36.38 35.42 1uld s VAL 22 CO 0.36 0.26 -0.08 0.00 0.00 0.00 0.00 175.10 175.64 1uld s ALA 23 N 0.76 2.65 -0.47 5.51 0.00 0.82 -0.13 121.76 130.90 1uld s ALA 23 Ca -0.12 -1.49 -0.13 0.00 0.00 0.00 0.00 51.96 50.23 1uld s ALA 23 Cb -0.14 -1.64 0.09 0.00 0.00 0.00 0.00 23.12 21.43 1uld s ALA 23 CO 0.01 -0.83 0.37 0.00 0.00 0.00 0.00 175.76 175.31 1uld s ALA 24 N 1.29 3.47 -0.17 0.00 0.00 0.65 -0.90 121.76 126.10 1uld s ALA 24 Ca -0.01 -2.29 -0.15 0.00 0.00 0.00 0.00 51.96 49.52 1uld s ALA 24 Cb -0.17 -2.94 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 1uld s ALA 24 CO -0.05 -1.80 0.34 0.42 0.00 0.00 0.00 175.76 174.67 1uld s ILE 25 N 1.52 5.27 -0.02 0.00 1.01 0.13 -1.26 121.20 127.85 1uld s ILE 25 Ca 0.04 0.63 0.02 0.00 0.00 0.00 0.00 60.65 61.34 1uld s ILE 25 Cb -0.25 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.55 1uld s ILE 25 CO 0.03 0.35 -0.08 -0.13 0.00 0.00 0.00 174.94 175.11 1uld s ARG 26 N 0.69 0.83 -0.03 2.79 0.52 0.18 -0.94 118.95 123.00 1uld s ARG 26 Ca 0.18 -0.25 -0.01 0.00 -0.52 0.00 0.00 55.73 55.13 1uld s ARG 26 Cb -0.14 -0.79 -0.04 0.00 0.52 0.00 0.00 34.95 34.51 1uld s ARG 26 CO 0.06 0.09 0.05 0.45 0.02 0.00 0.00 175.30 175.96 1uld s SER 27 N 0.23 5.47 0.00 0.23 0.15 -0.56 0.13 113.70 119.35 1uld s SER 27 Ca -0.03 0.12 0.24 0.00 0.70 0.00 0.00 55.95 56.98 1uld s SER 27 Cb -0.08 -1.54 1.17 0.00 -1.71 0.00 0.00 66.02 63.86 1uld s SER 27 CO 0.00 0.30 1.78 -1.54 1.20 0.00 0.00 173.24 174.99 1uld n SER 28 N 1.48 0.76 -3.64 5.45 3.41 -1.26 -3.81 113.62 116.01 1uld n SER 28 Ca -0.15 -1.43 -0.07 0.00 -0.26 0.00 0.00 58.87 56.96 1uld n SER 28 Cb 0.53 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.43 1uld n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uld s ALA 29 N -1.94 -1.60 -0.21 7.33 0.00 -0.84 -4.75 121.76 119.75 1uld s ALA 29 Ca 0.35 0.35 -0.01 0.00 0.00 0.00 0.00 51.96 52.65 1uld s ALA 29 Cb 0.18 0.67 0.06 0.00 0.00 0.00 0.00 23.12 24.03 1uld s ALA 29 CO 0.28 -0.89 -0.01 0.12 0.00 0.00 0.00 175.76 175.26 1uld s PHE 30 N -3.47 1.72 -0.71 0.00 5.36 -1.19 -3.87 117.98 115.82 1uld s PHE 30 Ca 0.08 -1.29 -0.23 0.00 -0.96 0.00 0.00 56.93 54.53 1uld s PHE 30 Cb -0.02 -1.31 0.07 0.00 -0.34 0.00 0.00 43.02 41.42 1uld s PHE 30 CO -0.03 -0.68 1.05 -0.80 -1.46 0.00 0.00 175.22 173.29 1uld s ASN 31 N 1.63 6.23 0.24 6.13 0.01 0.10 -4.91 114.94 124.37 1uld s ASN 31 Ca -0.03 -1.04 -0.12 0.00 -0.71 0.00 0.00 52.86 50.97 1uld s ASN 31 Cb -0.18 -2.44 0.33 0.00 0.41 0.00 0.00 41.25 39.37 1uld s ASN 31 CO -0.07 -1.47 1.59 0.28 -1.51 0.00 0.00 177.10 175.92 1uld h SER 32 N 9.57 -0.84 -0.51 -1.22 0.02 -1.93 0.14 113.55 118.79 1uld h SER 32 Ca -0.22 0.25 -0.21 0.00 -0.84 0.00 0.00 61.79 60.77 1uld h SER 32 Cb 1.06 0.53 -0.13 0.00 0.14 0.00 0.00 62.40 64.01 1uld h SER 32 CO 1.20 -0.28 0.27 0.29 -1.14 0.00 0.00 176.83 177.17 1uld n LYS 33 N -5.53 2.19 -1.52 3.45 4.76 -1.26 -4.96 118.16 115.29 1uld n LYS 33 Ca 0.11 -1.78 -0.31 0.00 -2.87 0.00 0.00 58.31 53.47 1uld n LYS 33 Cb 0.42 -1.76 0.06 0.00 -1.84 0.00 0.00 35.03 31.90 1uld n LYS 33 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1uld s GLY 34 N -0.37 1.68 0.00 0.72 0.00 0.04 -5.06 107.32 104.33 1uld s GLY 34 Ca 0.33 0.13 0.00 0.00 0.00 0.00 0.00 44.72 45.18 1uld s GLY 34 CO 0.07 0.45 0.00 0.61 0.00 0.00 0.00 173.10 174.23 1uld n GLY 35 N -1.79 2.33 3.70 0.20 0.00 0.20 -4.76 105.19 105.06 1uld n GLY 35 Ca 0.08 -2.01 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 1uld n GLY 35 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1uld n THR 36 N 0.00 0.13 -4.85 2.61 -1.04 -1.26 -4.35 114.28 105.52 1uld n THR 36 Ca 0.00 -0.02 -0.27 0.00 -2.04 0.00 0.00 64.05 61.72 1uld n THR 36 Cb 0.00 -1.92 -0.16 0.00 -1.82 0.00 0.00 70.33 66.43 1uld n THR 36 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1uld s THR 37 N 1.70 1.48 0.03 12.58 2.01 -0.08 -4.38 115.64 128.98 1uld s THR 37 Ca 0.79 -0.72 0.08 0.00 0.31 0.00 0.00 61.69 62.14 1uld s THR 37 Cb -0.55 -1.28 -0.02 0.00 0.01 0.00 0.00 72.50 70.65 1uld s THR 37 CO 0.36 0.43 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.81 1uld s VAL 38 N 0.19 1.76 -0.07 3.82 1.01 0.61 -0.52 120.40 127.20 1uld s VAL 38 Ca -0.08 -1.18 0.01 0.00 0.00 0.00 0.00 61.98 60.73 1uld s VAL 38 Cb -0.13 -1.52 0.02 0.00 0.00 0.00 0.00 36.38 34.75 1uld s VAL 38 CO 0.03 0.29 -0.09 -0.36 0.00 0.00 0.00 175.10 174.98 1uld s PHE 39 N -0.74 1.21 -0.04 5.22 0.40 -0.46 -0.69 117.98 122.87 1uld s PHE 39 Ca 0.08 -0.45 0.05 0.00 -0.60 0.00 0.00 56.93 56.02 1uld s PHE 39 Cb -0.09 -0.96 -0.01 0.00 0.51 0.00 0.00 43.02 42.47 1uld s PHE 39 CO 0.01 -0.29 -0.20 -0.80 0.70 0.00 0.00 175.22 174.64 1uld s ASN 40 N 0.97 2.47 -0.32 1.36 0.01 0.17 -1.07 114.94 118.52 1uld s ASN 40 Ca -0.09 -0.40 -0.11 0.00 -0.71 0.00 0.00 52.86 51.55 1uld s ASN 40 Cb -0.15 -0.58 -0.01 0.00 0.41 0.00 0.00 41.25 40.92 1uld s ASN 40 CO 0.00 0.20 0.18 -0.36 -1.51 0.00 0.00 177.10 175.62 1uld s PHE 41 N -0.15 3.20 0.05 2.20 0.40 -0.11 0.20 117.98 123.77 1uld s PHE 41 Ca -0.01 -0.46 0.03 0.00 -0.60 0.00 0.00 56.93 55.89 1uld s PHE 41 Cb -0.11 -2.40 -0.04 0.00 0.51 0.00 0.00 43.02 40.98 1uld s PHE 41 CO 0.02 -0.43 0.03 -0.51 0.70 0.00 0.00 175.22 175.03 1uld s LEU 42 N 1.65 3.63 0.75 -0.37 1.43 0.62 -1.39 118.68 124.99 1uld s LEU 42 Ca 0.05 -0.05 -0.09 0.00 -1.03 0.00 0.00 54.13 53.01 1uld s LEU 42 Cb -0.17 -2.25 0.07 0.00 0.03 0.00 0.00 46.19 43.87 1uld s LEU 42 CO 0.08 0.21 1.09 -0.94 0.23 0.00 0.00 176.35 177.02 1uld s SER 43 N -2.08 4.69 0.49 2.29 1.04 -0.53 0.76 113.70 120.36 1uld s SER 43 Ca 0.25 0.61 0.20 0.00 0.48 0.00 0.00 55.95 57.49 1uld s SER 43 Cb -0.12 -1.20 1.24 0.00 0.10 0.00 0.00 66.02 66.05 1uld s SER 43 CO 0.17 -1.73 2.06 0.00 0.98 0.00 0.00 173.24 174.72 1uld h ALA 44 N -0.80 1.60 -0.08 5.32 0.00 -1.91 0.44 119.26 123.84 1uld h ALA 44 Ca -0.45 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1uld h ALA 44 Cb 1.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1uld h ALA 44 CO 0.63 0.16 0.00 0.41 0.00 0.00 0.00 179.25 180.45 1uld n GLY 45 N -1.02 -0.59 2.28 0.00 0.00 -1.26 -4.89 105.19 99.70 1uld n GLY 45 Ca -0.02 -0.14 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 1uld n GLY 45 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uld n GLU 46 N -0.33 -0.99 -3.06 1.61 1.02 0.15 -4.75 120.64 114.29 1uld n GLU 46 Ca 0.08 0.70 -0.36 0.00 -0.02 0.00 0.00 57.16 57.56 1uld n GLU 46 Cb 0.10 -4.87 -0.06 0.00 -0.02 0.00 0.00 31.44 26.59 1uld n GLU 46 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1uld s ASN 47 N -2.53 7.06 -0.72 1.62 0.01 -1.26 -3.88 114.94 115.23 1uld s ASN 47 Ca 0.00 1.46 -0.20 0.00 -0.71 0.00 0.00 52.86 53.42 1uld s ASN 47 Cb 0.00 -2.44 0.10 0.00 0.41 0.00 0.00 41.25 39.33 1uld s ASN 47 CO 0.00 -0.02 0.92 -0.63 -1.51 0.00 0.00 177.10 175.86 1uld s ILE 48 N -1.60 4.65 0.12 0.60 1.01 0.15 -1.46 121.20 124.67 1uld s ILE 48 Ca 0.46 -1.00 -0.14 0.00 0.00 0.00 0.00 60.65 59.97 1uld s ILE 48 Cb -0.16 -4.64 -0.04 0.00 0.01 0.00 0.00 42.46 37.63 1uld s ILE 48 CO 0.21 -1.35 1.50 -0.07 0.00 0.00 0.00 174.94 175.23 1uld h LEU 49 N 10.49 0.80 -7.16 2.97 3.38 -1.48 -1.26 115.31 123.04 1uld h LEU 49 Ca -0.15 -0.40 -0.34 0.00 0.09 0.00 0.00 57.88 57.08 1uld h LEU 49 Cb 1.06 -0.22 -0.37 0.00 0.09 0.00 0.00 40.66 41.22 1uld h LEU 49 CO 1.12 1.02 -0.68 -0.22 0.09 0.00 0.00 178.44 179.77 1uld s LEU 50 N -9.16 0.04 -0.17 1.67 2.96 -1.14 -4.61 118.68 108.28 1uld s LEU 50 Ca -0.12 0.02 -0.04 0.00 -0.22 0.00 0.00 54.13 53.77 1uld s LEU 50 Cb 0.10 0.11 -0.03 0.00 0.50 0.00 0.00 46.19 46.87 1uld s LEU 50 CO 0.83 -0.28 -0.03 -2.28 -1.32 0.00 0.00 176.35 173.27 1uld s HIS 51 N 2.24 3.02 -0.26 5.38 5.65 0.82 -0.93 115.29 131.21 1uld s HIS 51 Ca 0.04 -0.37 0.02 0.00 0.25 0.00 0.00 55.06 55.00 1uld s HIS 51 Cb -0.13 -1.99 0.07 0.00 -1.18 0.00 0.00 32.58 29.35 1uld s HIS 51 CO -0.07 -0.11 -0.04 0.42 -0.65 0.00 0.00 174.74 174.30 1uld s ILE 52 N 0.56 1.74 -0.36 0.89 1.01 -0.23 -1.88 121.20 122.93 1uld s ILE 52 Ca -0.03 -1.52 -0.06 0.00 0.00 0.00 0.00 60.65 59.05 1uld s ILE 52 Cb -0.14 -2.04 0.06 0.00 0.01 0.00 0.00 42.46 40.34 1uld s ILE 52 CO 0.03 -0.22 0.13 -0.55 0.00 0.00 0.00 174.94 174.33 1uld s SER 53 N 1.27 5.31 -0.36 3.58 0.15 0.25 -1.36 113.70 122.54 1uld s SER 53 Ca -0.02 -1.35 -0.19 0.00 0.70 0.00 0.00 55.95 55.09 1uld s SER 53 Cb -0.19 -1.86 0.00 0.00 -1.71 0.00 0.00 66.02 62.26 1uld s SER 53 CO -0.08 -0.39 0.56 -0.63 1.20 0.00 0.00 173.24 173.90 1uld s ILE 54 N 1.35 4.97 -0.36 6.45 1.01 0.32 -0.50 121.20 134.44 1uld s ILE 54 Ca 0.00 0.40 0.01 0.00 0.00 0.00 0.00 60.65 61.06 1uld s ILE 54 Cb -0.21 -4.01 0.10 0.00 0.01 0.00 0.00 42.46 38.35 1uld s ILE 54 CO 0.01 -0.27 0.09 -0.13 0.00 0.00 0.00 174.94 174.64 1uld s ARG 55 N 2.51 1.78 0.12 2.79 0.52 -0.07 -0.90 118.95 125.70 1uld s ARG 55 Ca 0.21 -1.78 -0.19 0.00 -0.52 0.00 0.00 55.73 53.45 1uld s ARG 55 Cb -0.15 -3.32 -0.05 0.00 0.52 0.00 0.00 34.95 31.95 1uld s ARG 55 CO 0.14 -0.94 1.72 -1.35 0.02 0.00 0.00 175.30 174.89 1uld h PRO 56 N 7.80 0.37 0.31 3.54 0.11 -1.82 0.20 132.00 142.52 1uld h PRO 56 Ca -0.09 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.97 1uld h PRO 56 Cb 1.03 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 1uld h PRO 56 CO 0.58 0.33 -0.26 0.78 -0.21 0.00 0.00 178.00 179.21 1uld h GLY 57 N 0.31 -0.62 2.00 -0.55 0.00 -1.94 -2.10 103.07 100.18 1uld h GLY 57 Ca 0.09 0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.72 1uld h GLY 57 CO -0.01 -0.24 0.00 -2.09 0.00 0.00 0.00 176.54 174.19 1uld h GLU 58 N -0.59 0.00 -5.78 4.80 4.81 -1.99 -3.47 114.58 112.37 1uld h GLU 58 Ca -0.02 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 58.86 1uld h GLU 58 Cb 0.52 0.00 0.14 0.00 0.63 0.00 0.00 28.75 30.04 1uld h GLU 58 CO -0.03 0.00 -0.79 -1.71 -0.73 0.00 0.00 179.01 175.75 1uld n ASN 59 N -2.31 -1.99 -4.00 1.04 5.15 0.65 -4.96 115.26 108.83 1uld n ASN 59 Ca 0.03 -0.69 -0.10 0.00 -0.60 0.00 0.00 54.58 53.23 1uld n ASN 59 Cb 0.32 -4.80 -0.07 0.00 -0.53 0.00 0.00 39.78 34.70 1uld n ASN 59 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1uld s VAL 60 N -3.45 0.05 -0.13 3.44 -7.23 -0.82 -1.91 120.40 110.35 1uld s VAL 60 Ca 0.02 -1.49 -0.00 0.00 -1.81 0.00 0.00 61.98 58.70 1uld s VAL 60 Cb -0.00 -1.99 0.03 0.00 0.56 0.00 0.00 36.38 34.98 1uld s VAL 60 CO 0.76 -0.22 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.62 1uld s ILE 61 N -4.00 1.08 -0.19 -0.62 1.01 -0.02 -0.89 121.20 117.56 1uld s ILE 61 Ca 0.21 -0.40 -0.07 0.00 0.00 0.00 0.00 60.65 60.39 1uld s ILE 61 Cb 0.03 -1.14 -0.04 0.00 0.01 0.00 0.00 42.46 41.33 1uld s ILE 61 CO 0.03 0.31 0.06 -0.69 0.00 0.00 0.00 174.94 174.64 1uld s VAL 62 N 1.68 4.71 -0.09 2.92 1.01 0.34 -2.08 120.40 128.89 1uld s VAL 62 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1uld s VAL 62 Cb -0.13 -3.13 -0.02 0.00 0.00 0.00 0.00 36.38 33.10 1uld s VAL 62 CO -0.08 0.45 -0.09 -0.36 0.00 0.00 0.00 175.10 175.01 1uld s PHE 63 N 0.49 2.87 0.39 5.22 0.40 -0.00 -0.58 117.98 126.76 1uld s PHE 63 Ca 0.03 -0.22 -0.15 0.00 -0.60 0.00 0.00 56.93 55.99 1uld s PHE 63 Cb -0.13 -1.76 0.05 0.00 0.51 0.00 0.00 43.02 41.69 1uld s PHE 63 CO 0.01 0.11 0.78 1.21 0.70 0.00 0.00 175.22 178.03 1uld s ASN 64 N -0.33 0.06 0.11 1.36 3.84 -0.79 -1.47 114.94 117.72 1uld s ASN 64 Ca 0.04 -1.18 -0.05 0.00 0.21 0.00 0.00 52.86 51.89 1uld s ASN 64 Cb -0.13 0.85 -0.02 0.00 -0.55 0.00 0.00 41.25 41.40 1uld s ASN 64 CO 0.02 -1.68 0.11 -0.44 -2.79 0.00 0.00 177.10 172.33 1uld s SER 65 N -3.08 0.25 -0.26 -4.21 0.01 -1.26 -0.13 113.70 105.02 1uld s SER 65 Ca 0.16 -0.95 -0.26 0.00 1.31 0.00 0.00 55.95 56.21 1uld s SER 65 Cb -0.05 0.31 0.14 0.00 0.21 0.00 0.00 66.02 66.63 1uld s SER 65 CO 0.12 -0.73 1.13 -0.60 0.41 0.00 0.00 173.24 173.57 1uld s ARG 66 N -3.95 0.40 0.65 12.44 3.52 -0.48 -2.45 118.95 129.09 1uld s ARG 66 Ca 0.13 0.35 -0.13 0.00 -0.13 0.00 0.00 55.73 55.96 1uld s ARG 66 Cb 0.06 0.19 -0.01 0.00 -1.56 0.00 0.00 34.95 33.63 1uld s ARG 66 CO -0.05 -0.07 1.06 -0.51 -0.81 0.00 0.00 175.30 174.91 1uld s LEU 67 N -0.18 3.28 0.17 -0.88 1.43 -1.26 0.31 118.68 121.55 1uld s LEU 67 Ca 0.03 1.69 -0.25 0.00 -1.03 0.00 0.00 54.13 54.57 1uld s LEU 67 Cb -0.04 -4.51 0.02 0.00 0.03 0.00 0.00 46.19 41.70 1uld s LEU 67 CO -0.07 -1.31 1.42 1.17 0.23 0.00 0.00 176.35 177.80 1uld n LYS 68 N -2.67 -0.35 -0.73 1.70 4.81 -1.25 -1.18 118.16 118.49 1uld n LYS 68 Ca 0.08 1.40 -0.02 0.00 -0.87 0.00 0.00 58.31 58.90 1uld n LYS 68 Cb 0.53 -2.06 0.22 0.00 0.02 0.00 0.00 35.03 33.74 1uld n LYS 68 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1uld n ASN 69 N -5.21 3.08 -4.37 3.14 4.13 -1.26 -5.01 115.26 109.75 1uld n ASN 69 Ca 0.04 -3.51 -0.17 0.00 1.68 0.00 0.00 54.58 52.63 1uld n ASN 69 Cb 0.28 -0.62 0.05 0.00 -1.54 0.00 0.00 39.78 37.94 1uld n ASN 69 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1uld n GLY 70 N -0.91 2.10 3.97 7.41 0.00 -0.32 -5.13 105.19 112.30 1uld n GLY 70 Ca 0.32 -2.22 -0.21 0.00 0.00 0.00 0.00 46.02 43.90 1uld n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uld s ALA 71 N -2.58 3.92 0.50 4.61 0.00 -1.26 -4.66 121.76 122.29 1uld s ALA 71 Ca 0.45 -1.18 -0.22 0.00 0.00 0.00 0.00 51.96 51.01 1uld s ALA 71 Cb -0.04 -1.88 -0.06 0.00 0.00 0.00 0.00 23.12 21.14 1uld s ALA 71 CO 0.29 -0.01 1.23 -1.58 0.00 0.00 0.00 175.76 175.68 1uld s TRP 72 N -2.22 2.65 0.00 0.00 0.52 -1.26 -4.49 118.94 114.13 1uld s TRP 72 Ca 0.41 1.49 0.00 0.00 0.02 0.00 0.00 56.10 58.02 1uld s TRP 72 Cb -0.09 -3.51 0.00 0.00 -1.15 0.00 0.00 33.47 28.71 1uld s TRP 72 CO 0.33 -1.99 0.00 0.41 0.02 0.00 0.00 176.95 175.72 1uld n GLY 73 N 0.52 -0.02 3.77 0.98 0.00 -1.02 -5.00 105.19 104.42 1uld n GLY 73 Ca 0.09 -1.78 -0.39 0.00 0.00 0.00 0.00 46.02 43.94 1uld n GLY 73 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uld s PRO 74 N -0.43 4.14 0.35 1.61 0.04 -1.26 -4.90 135.00 134.54 1uld s PRO 74 Ca 0.00 2.03 -0.21 0.00 0.04 0.00 0.00 61.00 62.87 1uld s PRO 74 Cb 0.00 -2.84 -0.10 0.00 0.04 0.00 0.00 34.50 31.60 1uld s PRO 74 CO 0.00 -0.31 0.87 -1.21 0.04 0.00 0.00 177.00 176.39 1uld s GLU 75 N -2.09 4.27 -0.30 4.56 2.02 -1.26 -4.81 118.70 121.08 1uld s GLU 75 Ca 0.54 1.03 0.03 0.00 0.02 0.00 0.00 54.97 56.59 1uld s GLU 75 Cb -0.35 -2.49 0.09 0.00 0.10 0.00 0.00 34.13 31.47 1uld s GLU 75 CO 0.46 0.15 0.01 -1.21 0.02 0.00 0.00 175.26 174.69 1uld s GLU 76 N -2.68 1.55 0.28 1.61 2.02 -0.54 -4.99 118.70 115.94 1uld s GLU 76 Ca 0.55 -1.53 0.10 0.00 0.02 0.00 0.00 54.97 54.10 1uld s GLU 76 Cb -0.13 -2.89 -0.05 0.00 0.10 0.00 0.00 34.13 31.17 1uld s GLU 76 CO 0.18 -0.82 -0.05 -0.98 0.02 0.00 0.00 175.26 173.60 1uld s ARG 77 N 1.11 2.12 0.09 1.61 1.70 -1.26 -0.82 118.95 123.50 1uld s ARG 77 Ca 0.04 -1.53 -0.07 0.00 -0.47 0.00 0.00 55.73 53.70 1uld s ARG 77 Cb -0.19 -2.05 -0.01 0.00 -0.57 0.00 0.00 34.95 32.13 1uld s ARG 77 CO -0.09 0.34 0.15 0.96 -1.08 0.00 0.00 175.30 175.57 1uld s ILE 78 N -2.39 0.15 0.44 4.99 -4.36 -0.88 -4.98 121.20 114.18 1uld s ILE 78 Ca 0.31 -1.33 -0.23 0.00 -0.26 0.00 0.00 60.65 59.14 1uld s ILE 78 Cb -0.06 -1.42 -0.08 0.00 1.25 0.00 0.00 42.46 42.16 1uld s ILE 78 CO 0.19 -0.69 1.15 -2.16 0.24 0.00 0.00 174.94 173.67 1uld s PRO 79 N -3.88 3.84 0.11 0.37 0.04 -1.26 -0.84 135.00 133.38 1uld s PRO 79 Ca 0.06 1.76 -0.13 0.00 0.04 0.00 0.00 61.00 62.73 1uld s PRO 79 Cb 0.05 -2.46 -0.09 0.00 0.04 0.00 0.00 34.50 32.04 1uld s PRO 79 CO -0.10 -0.48 1.40 -0.92 0.04 0.00 0.00 177.00 176.95 1uld h TYR 80 N 2.18 1.00 -6.49 0.56 3.20 -1.61 -3.42 116.97 112.38 1uld h TYR 80 Ca -0.49 -0.34 -0.04 0.00 3.14 0.00 0.00 58.73 61.00 1uld h TYR 80 Cb 1.24 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 39.32 1uld h TYR 80 CO 0.54 1.14 -0.08 0.00 -1.64 0.00 0.00 178.16 178.12 1uld n ALA 81 N -2.54 -1.13 -3.52 1.82 0.00 -1.26 -2.82 120.51 111.05 1uld n ALA 81 Ca -0.04 -0.04 -0.21 0.00 0.00 0.00 0.00 53.44 53.15 1uld n ALA 81 Cb 0.57 -0.14 0.03 0.00 0.00 0.00 0.00 19.45 19.91 1uld n ALA 81 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1uld n GLU 82 N -1.01 -1.37 0.06 0.00 1.02 -1.26 -4.91 120.64 113.16 1uld n GLU 82 Ca -0.02 0.81 0.12 0.00 -0.02 0.00 0.00 57.16 58.06 1uld n GLU 82 Cb 0.05 -4.26 0.12 0.00 -0.02 0.00 0.00 31.44 27.33 1uld n GLU 82 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1uld h LYS 83 N -0.90 0.00 -6.05 3.49 1.79 -1.85 -3.44 116.57 109.61 1uld h LYS 83 Ca -0.49 0.00 -0.68 0.00 -2.18 0.00 0.00 60.65 57.30 1uld h LYS 83 Cb 1.27 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 31.75 1uld h LYS 83 CO 0.41 0.00 -0.66 -0.06 -1.08 0.00 0.00 179.45 178.06 1uld s PHE 84 N -3.20 3.05 -0.46 -1.35 0.40 -1.26 -1.57 117.98 113.59 1uld s PHE 84 Ca 0.05 0.11 -0.17 0.00 -0.60 0.00 0.00 56.93 56.32 1uld s PHE 84 Cb 0.13 -1.75 0.05 0.00 0.51 0.00 0.00 43.02 41.96 1uld s PHE 84 CO 0.75 0.40 0.47 0.50 0.70 0.00 0.00 175.22 178.04 1uld s ARG 85 N -0.83 3.06 0.72 0.44 3.52 -1.26 -4.99 118.95 119.61 1uld s ARG 85 Ca 0.13 -0.99 -0.12 0.00 -0.13 0.00 0.00 55.73 54.61 1uld s ARG 85 Cb -0.11 -4.06 0.03 0.00 -1.56 0.00 0.00 34.95 29.25 1uld s ARG 85 CO 0.02 -1.01 1.09 -1.25 -0.81 0.00 0.00 175.30 173.33 1uld s PRO 86 N 2.11 2.59 0.00 5.12 0.04 -1.26 -2.51 135.00 141.08 1uld s PRO 86 Ca 0.10 1.21 0.26 0.00 0.04 0.00 0.00 61.00 62.61 1uld s PRO 86 Cb -0.20 -1.94 0.73 0.00 0.04 0.00 0.00 34.50 33.13 1uld s PRO 86 CO 0.11 -1.39 1.56 -0.35 0.04 0.00 0.00 177.00 176.96 1uld n PRO 87 N -3.03 1.70 -3.64 0.56 -0.04 -1.26 -4.89 135.00 124.40 1uld n PRO 87 Ca 0.09 -1.15 -0.27 0.00 -0.04 0.00 0.00 63.50 62.12 1uld n PRO 87 Cb 0.53 -1.48 -0.10 0.00 -0.04 0.00 0.00 33.50 32.41 1uld n PRO 87 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1uld n ASN 88 N 0.36 3.26 -4.78 3.54 5.03 -1.17 -1.98 115.26 119.52 1uld n ASN 88 Ca 0.16 -3.30 -0.33 0.00 0.87 0.00 0.00 54.58 51.98 1uld n ASN 88 Cb 0.42 -0.71 0.04 0.00 -1.02 0.00 0.00 39.78 38.51 1uld n ASN 88 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1uld s PRO 89 N -1.94 2.93 0.08 3.52 0.04 -1.05 -4.74 135.00 133.84 1uld s PRO 89 Ca 0.33 1.34 0.02 0.00 0.04 0.00 0.00 61.00 62.73 1uld s PRO 89 Cb 0.06 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 1uld s PRO 89 CO -0.09 -1.14 -0.07 -1.54 0.04 0.00 0.00 177.00 174.20 1uld s SER 90 N -2.64 1.04 -0.05 6.66 1.04 -1.26 -1.50 113.70 117.00 1uld s SER 90 Ca 0.66 -0.87 -0.01 0.00 0.48 0.00 0.00 55.95 56.21 1uld s SER 90 Cb -0.19 0.08 0.03 0.00 0.10 0.00 0.00 66.02 66.03 1uld s SER 90 CO 0.40 -0.39 0.02 -0.63 0.98 0.00 0.00 173.24 173.62 1uld s ILE 91 N -2.96 0.16 -0.13 -1.02 1.01 -0.11 -3.78 121.20 114.36 1uld s ILE 91 Ca 0.05 0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.95 1uld s ILE 91 Cb 0.01 -0.33 0.01 0.00 0.01 0.00 0.00 42.46 42.15 1uld s ILE 91 CO -0.03 0.20 -0.22 -0.89 0.00 0.00 0.00 174.94 173.99 1uld s THR 92 N 1.78 2.05 -0.11 2.92 2.01 -0.04 0.20 115.64 124.45 1uld s THR 92 Ca 0.01 -0.98 0.03 0.00 0.31 0.00 0.00 61.69 61.05 1uld s THR 92 Cb -0.13 -1.80 -0.00 0.00 0.01 0.00 0.00 72.50 70.58 1uld s THR 92 CO -0.03 0.55 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.54 1uld s VAL 93 N 0.67 2.28 -0.06 3.82 1.01 -0.08 -0.57 120.40 127.46 1uld s VAL 93 Ca -0.11 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 60.97 1uld s VAL 93 Cb -0.16 -1.89 -0.00 0.00 0.00 0.00 0.00 36.38 34.33 1uld s VAL 93 CO 0.01 0.55 -0.18 -0.63 0.00 0.00 0.00 175.10 174.85 1uld s ILE 94 N 0.34 1.57 -0.45 2.22 1.01 0.53 -0.13 121.20 126.29 1uld s ILE 94 Ca -0.17 -0.77 -0.22 0.00 0.00 0.00 0.00 60.65 59.48 1uld s ILE 94 Cb -0.18 -1.36 0.03 0.00 0.01 0.00 0.00 42.46 40.96 1uld s ILE 94 CO 0.08 0.45 0.75 -0.62 0.00 0.00 0.00 174.94 175.60 1uld s ASP 95 N 0.20 6.39 -0.33 3.58 -1.08 -0.26 -0.54 116.67 124.62 1uld s ASP 95 Ca -0.09 -0.17 0.09 0.00 -0.52 0.00 0.00 52.55 51.86 1uld s ASP 95 Cb -0.14 -2.37 0.70 0.00 -1.46 0.00 0.00 42.92 39.65 1uld s ASP 95 CO 0.04 -0.88 1.77 1.41 0.52 0.00 0.00 175.17 178.03 1uld n HIS 96 N 6.59 2.34 0.00 -5.34 8.25 0.25 -0.30 115.22 127.01 1uld n HIS 96 Ca 0.01 -1.33 0.00 0.00 -0.26 0.00 0.00 57.72 56.14 1uld n HIS 96 Cb 0.48 -0.69 0.00 0.00 1.12 0.00 0.00 29.99 30.90 1uld n HIS 96 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1uld n GLY 97 N -0.44 2.13 0.22 -1.41 0.00 -1.26 -4.18 105.19 100.25 1uld n GLY 97 Ca 0.42 -0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.38 1uld n GLY 97 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1uld n ASP 98 N 4.02 1.26 -3.60 1.61 5.68 -1.26 -4.92 116.55 119.35 1uld n ASP 98 Ca 0.00 -1.02 -0.09 0.00 -0.50 0.00 0.00 54.79 53.18 1uld n ASP 98 Cb 0.00 0.51 -0.02 0.00 -1.14 0.00 0.00 41.12 40.47 1uld n ASP 98 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1uld s ARG 99 N -2.72 1.31 0.05 0.11 1.70 -1.26 -1.92 118.95 116.22 1uld s ARG 99 Ca 0.16 -0.60 0.01 0.00 -0.47 0.00 0.00 55.73 54.82 1uld s ARG 99 Cb 0.18 0.53 -0.04 0.00 -0.57 0.00 0.00 34.95 35.05 1uld s ARG 99 CO 0.67 -0.59 0.12 -0.06 -1.08 0.00 0.00 175.30 174.36 1uld s PHE 100 N -3.61 3.32 -0.12 5.89 0.40 0.34 -0.58 117.98 123.62 1uld s PHE 100 Ca 0.06 0.17 0.00 0.00 -0.60 0.00 0.00 56.93 56.56 1uld s PHE 100 Cb -0.02 -1.70 -0.02 0.00 0.51 0.00 0.00 43.02 41.79 1uld s PHE 100 CO -0.05 0.55 -0.13 -1.14 0.70 0.00 0.00 175.22 175.16 1uld s GLN 101 N -2.24 3.32 -0.12 0.44 0.74 0.30 -1.07 119.66 121.03 1uld s GLN 101 Ca 0.29 -0.69 0.02 0.00 0.05 0.00 0.00 55.36 55.04 1uld s GLN 101 Cb -0.12 -2.61 0.01 0.00 1.10 0.00 0.00 33.01 31.39 1uld s GLN 101 CO 0.21 0.24 -0.18 0.42 -0.55 0.00 0.00 175.29 175.44 1uld s ILE 102 N 0.27 1.76 -0.07 -2.34 1.09 0.79 -0.35 121.20 122.35 1uld s ILE 102 Ca -0.09 -0.80 0.05 0.00 -1.10 0.00 0.00 60.65 58.71 1uld s ILE 102 Cb -0.16 -1.58 -0.00 0.00 -1.06 0.00 0.00 42.46 39.66 1uld s ILE 102 CO 0.05 0.49 -0.21 -0.13 -0.10 0.00 0.00 174.94 175.05 1uld s ARG 103 N 0.93 2.36 0.00 2.79 1.81 0.26 -0.05 118.95 127.05 1uld s ARG 103 Ca -0.06 -0.75 0.00 0.00 -1.72 0.00 0.00 55.73 53.19 1uld s ARG 103 Cb -0.15 -1.93 0.00 0.00 -0.45 0.00 0.00 34.95 32.42 1uld s ARG 103 CO -0.02 0.25 0.00 1.19 -0.68 0.00 0.00 175.30 176.03 1uld n PHE 104 N 3.26 -0.59 0.09 -0.53 3.01 -1.26 -0.86 117.46 120.58 1uld n PHE 104 Ca -0.19 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.16 1uld n PHE 104 Cb 0.52 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.92 1uld n PHE 104 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1uld h ASP 105 N 0.00 0.33 -2.88 4.37 3.32 -1.38 -3.47 116.42 116.70 1uld h ASP 105 Ca 0.00 -0.30 -0.54 0.00 0.02 0.00 0.00 57.03 56.21 1uld h ASP 105 Cb 0.00 -0.10 -0.13 0.00 0.22 0.00 0.00 39.33 39.31 1uld h ASP 105 CO 0.00 1.16 -0.55 -0.31 -1.72 0.00 0.00 179.24 177.82 1uld s TYR 106 N -2.96 1.86 0.02 4.55 1.51 -0.63 -4.96 117.35 116.75 1uld s TYR 106 Ca -0.03 -1.13 0.00 0.00 -1.01 0.00 0.00 57.07 54.90 1uld s TYR 106 Cb 0.09 -1.25 0.00 0.00 -0.11 0.00 0.00 41.96 40.68 1uld s TYR 106 CO 0.85 -0.13 0.00 0.41 -1.11 0.00 0.00 175.55 175.58 1uld n GLY 107 N -0.87 -2.16 3.96 0.71 0.00 -1.26 -4.86 105.19 100.71 1uld n GLY 107 Ca -0.06 -1.47 -0.23 0.00 0.00 0.00 0.00 46.02 44.26 1uld n GLY 107 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uld s THR 108 N -0.78 2.93 0.58 2.61 -4.23 -1.26 -4.90 115.64 110.59 1uld s THR 108 Ca 0.00 -0.49 -0.19 0.00 -1.18 0.00 0.00 61.69 59.83 1uld s THR 108 Cb 0.00 -3.13 -0.04 0.00 1.34 0.00 0.00 72.50 70.67 1uld s THR 108 CO 0.00 -0.11 1.19 -0.44 -0.54 0.00 0.00 174.62 174.72 1uld s SER 109 N -4.39 5.32 -0.12 3.99 0.01 -1.26 -4.76 113.70 112.49 1uld s SER 109 Ca 0.56 2.34 -0.01 0.00 1.31 0.00 0.00 55.95 60.14 1uld s SER 109 Cb -0.10 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.51 1uld s SER 109 CO 0.40 -1.50 -0.08 -0.63 0.41 0.00 0.00 173.24 171.84 1uld s ILE 110 N -1.64 3.55 -0.12 1.44 1.09 0.93 -4.94 121.20 121.52 1uld s ILE 110 Ca 0.76 -0.50 -0.00 0.00 -1.10 0.00 0.00 60.65 59.81 1uld s ILE 110 Cb -0.29 -2.51 -0.02 0.00 -1.06 0.00 0.00 42.46 38.58 1uld s ILE 110 CO 0.31 0.53 -0.10 -0.31 -0.10 0.00 0.00 174.94 175.28 1uld s TYR 111 N 0.02 2.87 -0.20 3.97 1.51 -1.26 -0.15 117.35 124.11 1uld s TYR 111 Ca -0.02 -0.39 -0.00 0.00 -1.01 0.00 0.00 57.07 55.65 1uld s TYR 111 Cb -0.14 -1.82 0.05 0.00 -0.11 0.00 0.00 41.96 39.94 1uld s TYR 111 CO 0.03 -0.03 -0.05 -0.47 -1.11 0.00 0.00 175.55 173.93 1uld s TYR 112 N 0.03 1.98 0.27 2.71 5.04 -0.24 -4.97 117.35 122.18 1uld s TYR 112 Ca -0.03 -1.40 -0.30 0.00 -2.44 0.00 0.00 57.07 52.91 1uld s TYR 112 Cb -0.14 -1.42 -0.10 0.00 0.35 0.00 0.00 41.96 40.64 1uld s TYR 112 CO 0.04 -0.70 1.44 -0.80 -1.34 0.00 0.00 175.55 174.19 1uld s ASN 113 N 1.54 6.63 0.38 4.32 0.01 -1.26 -0.50 114.94 126.05 1uld s ASN 113 Ca -0.03 2.71 -0.27 0.00 -0.71 0.00 0.00 52.86 54.56 1uld s ASN 113 Cb -0.17 -2.63 -0.10 0.00 0.41 0.00 0.00 41.25 38.76 1uld s ASN 113 CO -0.07 -0.71 1.40 -0.54 -1.51 0.00 0.00 177.10 175.67 1uld s LYS 114 N -0.63 4.09 -0.01 -0.60 1.02 -0.81 -4.88 119.74 117.93 1uld s LYS 114 Ca 0.58 2.38 0.08 0.00 0.02 0.00 0.00 55.97 59.03 1uld s LYS 114 Cb -0.42 -2.92 -0.11 0.00 -0.52 0.00 0.00 37.83 33.86 1uld s LYS 114 CO 0.46 -0.47 0.26 0.54 -0.92 0.00 0.00 175.35 175.21 1uld n ARG 115 N 0.40 1.97 -4.13 1.68 1.74 -1.26 -4.96 116.66 112.10 1uld n ARG 115 Ca 0.02 -0.04 -0.22 0.00 -0.77 0.00 0.00 57.85 56.83 1uld n ARG 115 Cb 0.41 -1.07 -0.17 0.00 -1.02 0.00 0.00 32.46 30.62 1uld n ARG 115 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1uld s ILE 116 N -2.24 0.70 -1.43 0.55 1.01 -1.26 -5.06 121.20 113.47 1uld s ILE 116 Ca -0.00 -0.17 -0.11 0.00 0.00 0.00 0.00 60.65 60.37 1uld s ILE 116 Cb 0.06 -0.73 0.05 0.00 0.01 0.00 0.00 42.46 41.85 1uld s ILE 116 CO 0.35 0.28 2.33 0.29 0.00 0.00 0.00 174.94 178.19 1uld n LYS 117 N 4.35 3.51 -4.10 2.79 4.76 -1.26 -4.86 118.16 123.34 1uld n LYS 117 Ca -0.19 -2.87 -0.08 0.00 -2.87 0.00 0.00 58.31 52.29 1uld n LYS 117 Cb 0.51 -2.98 -0.10 0.00 -1.84 0.00 0.00 35.03 30.61 1uld n LYS 117 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1uld s GLU 118 N 1.59 0.64 0.28 1.97 2.02 -1.26 -5.16 118.70 118.77 1uld s GLU 118 Ca 0.51 -1.19 -0.01 0.00 0.02 0.00 0.00 54.97 54.31 1uld s GLU 118 Cb 0.14 0.08 -0.04 0.00 0.10 0.00 0.00 34.13 34.42 1uld s GLU 118 CO -0.06 -0.08 0.48 -0.80 0.02 0.00 0.00 175.26 174.82 1uld s ASN 119 N -2.79 6.36 0.17 -0.19 0.01 -1.26 -5.02 114.94 112.21 1uld s ASN 119 Ca 0.06 0.46 -0.24 0.00 -0.71 0.00 0.00 52.86 52.43 1uld s ASN 119 Cb 0.05 -2.03 -0.08 0.00 0.41 0.00 0.00 41.25 39.60 1uld s ASN 119 CO -0.08 -0.17 0.75 0.00 -1.51 0.00 0.00 177.10 176.09 1uld s ALA 120 N -2.09 3.46 -0.11 0.60 0.00 -0.61 -4.30 121.76 118.70 1uld s ALA 120 Ca 0.40 0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.68 1uld s ALA 120 Cb -0.10 -2.91 -0.01 0.00 0.00 0.00 0.00 23.12 20.10 1uld s ALA 120 CO 0.32 0.31 0.20 0.00 0.00 0.00 0.00 175.76 176.59 1uld n ALA 121 N 1.48 2.29 -3.30 0.00 0.00 0.23 -0.20 120.51 121.01 1uld n ALA 121 Ca -0.06 -0.18 -0.14 0.00 0.00 0.00 0.00 53.44 53.07 1uld n ALA 121 Cb 0.49 -0.06 -0.06 0.00 0.00 0.00 0.00 19.45 19.83 1uld n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uld s ALA 122 N -0.87 -1.28 -0.10 0.00 0.00 -0.92 -0.40 121.76 118.19 1uld s ALA 122 Ca 0.01 0.60 0.03 0.00 0.00 0.00 0.00 51.96 52.60 1uld s ALA 122 Cb 0.01 0.33 0.01 0.00 0.00 0.00 0.00 23.12 23.47 1uld s ALA 122 CO 0.05 -0.47 -0.19 0.42 0.00 0.00 0.00 175.76 175.57 1uld s ILE 123 N -2.28 1.67 0.14 0.00 1.01 -0.80 -0.28 121.20 120.67 1uld s ILE 123 Ca -0.06 -0.78 0.07 0.00 0.00 0.00 0.00 60.65 59.88 1uld s ILE 123 Cb -0.01 -1.48 -0.04 0.00 0.01 0.00 0.00 42.46 40.94 1uld s ILE 123 CO -0.00 0.47 -0.05 0.00 0.00 0.00 0.00 174.94 175.36 1uld s ALA 124 N 0.62 3.10 -0.11 9.38 0.00 0.13 -1.20 121.76 133.68 1uld s ALA 124 Ca -0.14 -1.30 -0.02 0.00 0.00 0.00 0.00 51.96 50.50 1uld s ALA 124 Cb -0.16 -0.96 0.04 0.00 0.00 0.00 0.00 23.12 22.03 1uld s ALA 124 CO 0.04 0.57 0.02 -0.47 0.00 0.00 0.00 175.76 175.92 1uld s TYR 125 N -1.49 0.75 -0.03 0.00 5.04 -0.60 -0.66 117.35 120.36 1uld s TYR 125 Ca 0.25 -0.38 0.05 0.00 -2.44 0.00 0.00 57.07 54.54 1uld s TYR 125 Cb -0.10 -0.86 -0.01 0.00 0.35 0.00 0.00 41.96 41.34 1uld s TYR 125 CO 0.16 -0.42 -0.17 -0.80 -1.34 0.00 0.00 175.55 172.98 1uld s ASN 126 N 1.95 2.11 -0.30 4.32 0.01 0.13 0.14 114.94 123.31 1uld s ASN 126 Ca 0.03 -0.34 -0.24 0.00 -0.71 0.00 0.00 52.86 51.60 1uld s ASN 126 Cb -0.14 -0.43 0.18 0.00 0.41 0.00 0.00 41.25 41.28 1uld s ASN 126 CO -0.06 0.18 1.38 0.00 -1.51 0.00 0.00 177.10 177.09 1uld s ALA 127 N -0.17 -2.23 -0.02 0.60 0.00 -1.26 -0.28 121.76 118.40 1uld s ALA 127 Ca 0.01 1.73 -0.05 0.00 0.00 0.00 0.00 51.96 53.65 1uld s ALA 127 Cb -0.09 -1.76 -0.29 0.00 0.00 0.00 0.00 23.12 20.99 1uld s ALA 127 CO 0.01 -0.13 0.78 1.49 0.00 0.00 0.00 175.76 177.90 1uld h GLU 128 N 3.44 0.29 -2.49 0.00 4.57 -1.96 -3.41 114.58 115.02 1uld h GLU 128 Ca -0.27 -0.50 -0.59 0.00 -1.18 0.00 0.00 59.36 56.82 1uld h GLU 128 Cb 1.19 0.19 -0.39 0.00 -0.16 0.00 0.00 28.75 29.58 1uld h GLU 128 CO 0.17 1.16 -0.91 1.21 -1.18 0.00 0.00 179.01 179.47 1uld s ASN 129 N -7.06 2.10 0.48 1.04 2.47 -1.26 -5.05 114.94 107.65 1uld s ASN 129 Ca -0.11 -2.94 -0.24 0.00 0.42 0.00 0.00 52.86 49.98 1uld s ASN 129 Cb 0.06 -0.55 -0.07 0.00 -1.45 0.00 0.00 41.25 39.24 1uld s ASN 129 CO 0.85 -0.19 1.43 -0.55 -3.72 0.00 0.00 177.10 174.91 1uld s SER 130 N 0.14 5.67 0.43 -4.21 0.15 -1.26 0.61 113.70 115.23 1uld s SER 130 Ca 0.29 2.92 0.24 0.00 0.70 0.00 0.00 55.95 60.09 1uld s SER 130 Cb -0.03 -2.65 0.61 0.00 -1.71 0.00 0.00 66.02 62.24 1uld s SER 130 CO -0.15 -1.32 1.70 0.25 1.20 0.00 0.00 173.24 174.92 1uld h LEU 131 N 2.07 0.00-10.00 3.45 5.85 -1.83 -3.42 115.31 111.43 1uld h LEU 131 Ca -0.51 0.00 -0.67 0.00 0.84 0.00 0.00 57.88 57.54 1uld h LEU 131 Cb 1.28 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 42.18 1uld h LEU 131 CO 0.60 0.14 -0.52 -0.36 -0.34 0.00 0.00 178.44 177.96 1uld s PHE 132 N -3.34 1.94 0.76 1.25 0.40 -1.26 0.02 117.98 117.75 1uld s PHE 132 Ca 0.04 -0.92 -0.11 0.00 -0.60 0.00 0.00 56.93 55.34 1uld s PHE 132 Cb 0.07 -1.64 0.05 0.00 0.51 0.00 0.00 43.02 42.01 1uld s PHE 132 CO 0.65 0.24 1.08 -1.54 0.70 0.00 0.00 175.22 176.36 1uld s SER 133 N -3.87 4.81 -0.16 1.36 1.04 -1.25 -4.85 113.70 110.78 1uld s SER 133 Ca 0.10 1.40 -0.00 0.00 0.48 0.00 0.00 55.95 57.93 1uld s SER 133 Cb 0.03 -2.19 0.04 0.00 0.10 0.00 0.00 66.02 63.99 1uld s SER 133 CO 0.05 -1.78 -0.08 -0.55 0.98 0.00 0.00 173.24 171.86 1uld s SER 134 N -3.88 2.79 0.85 7.02 0.15 -1.26 -3.75 113.70 115.62 1uld s SER 134 Ca 0.60 -0.61 -0.07 0.00 0.70 0.00 0.00 55.95 56.58 1uld s SER 134 Cb -0.14 -1.01 0.13 0.00 -1.71 0.00 0.00 66.02 63.29 1uld s SER 134 CO 0.54 -0.14 0.78 -0.81 1.20 0.00 0.00 173.24 174.81 1uld n PRO 135 N 4.83 -0.46 -4.25 5.44 -0.04 -1.26 -4.93 135.00 134.33 1uld n PRO 135 Ca -0.13 -1.50 -0.31 0.00 -0.04 0.00 0.00 63.50 61.52 1uld n PRO 135 Cb 0.48 -0.71 -0.09 0.00 -0.04 0.00 0.00 33.50 33.14 1uld n PRO 135 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1uld s VAL 136 N -2.51 3.71 -0.04 0.52 -7.23 0.47 -4.71 120.40 110.60 1uld s VAL 136 Ca 0.47 -1.02 -0.27 0.00 -1.81 0.00 0.00 61.98 59.35 1uld s VAL 136 Cb -0.02 -2.71 -0.03 0.00 0.56 0.00 0.00 36.38 34.18 1uld s VAL 136 CO 0.32 0.20 0.85 -0.89 -0.31 0.00 0.00 175.10 175.27 1uld s THR 137 N -1.19 4.95 -0.15 5.32 2.01 0.12 -1.77 115.64 124.92 1uld s THR 137 Ca 0.22 1.77 -0.00 0.00 0.31 0.00 0.00 61.69 63.99 1uld s THR 137 Cb -0.11 -4.19 0.04 0.00 0.01 0.00 0.00 72.50 68.24 1uld s THR 137 CO 0.14 0.19 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.50 1uld s VAL 138 N 1.00 1.17 -0.26 3.82 1.01 -0.36 0.50 120.40 127.28 1uld s VAL 138 Ca 0.45 -0.57 -0.06 0.00 0.00 0.00 0.00 61.98 61.80 1uld s VAL 138 Cb -0.19 -1.27 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 1uld s VAL 138 CO 0.23 0.22 0.05 -1.81 0.00 0.00 0.00 175.10 173.79 1uld s ASP 139 N 1.62 4.94 -0.19 3.32 1.01 -0.39 -0.14 116.67 126.85 1uld s ASP 139 Ca 0.02 -0.43 -0.04 0.00 0.71 0.00 0.00 52.55 52.81 1uld s ASP 139 Cb -0.14 -1.87 -0.02 0.00 1.01 0.00 0.00 42.92 41.90 1uld s ASP 139 CO -0.08 -0.09 -0.03 -0.69 0.21 0.00 0.00 175.17 174.49 1uld s VAL 140 N 1.54 3.75 0.06 -1.27 1.01 0.03 -0.25 120.40 125.27 1uld s VAL 140 Ca 0.05 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 61.69 1uld s VAL 140 Cb -0.16 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1uld s VAL 140 CO 0.02 0.45 -0.07 -1.00 0.00 0.00 0.00 175.10 174.49 1uld s HIS 141 N 0.91 2.83 -0.41 5.22 0.09 0.81 -1.38 115.29 123.36 1uld s HIS 141 Ca 0.00 -0.09 0.22 0.00 -0.00 0.00 0.00 55.06 55.19 1uld s HIS 141 Cb -0.14 -1.52 0.30 0.00 -0.00 0.00 0.00 32.58 31.22 1uld s HIS 141 CO 0.01 0.40 1.57 0.78 -0.00 0.00 0.00 174.74 177.51 1uld h GLY 142 N 3.99 0.00 -3.22 -2.22 0.00 -1.87 -1.10 103.07 98.66 1uld h GLY 142 Ca -0.48 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 1uld h GLY 142 CO 0.54 0.00 0.04 0.48 0.00 0.00 0.00 176.54 177.60 1uld s LEU 143 N -6.20 -0.00 0.12 3.11 2.34 -1.22 -3.63 118.68 113.19 1uld s LEU 143 Ca 0.06 -0.09 -0.31 0.00 0.06 0.00 0.00 54.13 53.86 1uld s LEU 143 Cb 0.05 2.13 -0.10 0.00 -0.56 0.00 0.00 46.19 47.71 1uld s LEU 143 CO 0.68 -0.85 1.85 -0.22 -1.06 0.00 0.00 176.35 176.76 1uld s LEU 144 N -2.55 4.40 0.76 1.48 2.96 -1.25 -4.83 118.68 119.66 1uld s LEU 144 Ca 0.00 2.76 -0.11 0.00 -0.22 0.00 0.00 54.13 56.56 1uld s LEU 144 Cb 0.00 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 43.17 1uld s LEU 144 CO -0.09 -1.02 1.09 -2.16 -1.32 0.00 0.00 176.35 172.85 1uld s PRO 145 N 2.91 2.43 0.47 0.98 0.04 -1.26 -4.98 135.00 135.59 1uld s PRO 145 Ca 0.82 0.68 -0.24 0.00 0.04 0.00 0.00 61.00 62.31 1uld s PRO 145 Cb -0.46 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.05 1uld s PRO 145 CO 0.37 -1.39 1.22 -2.30 0.04 0.00 0.00 177.00 174.94 1uld n PRO 146 N -3.28 1.68 -4.11 0.56 -0.02 -1.26 -4.96 135.00 123.60 1uld n PRO 146 Ca 0.07 0.61 -0.35 0.00 -2.02 0.00 0.00 63.50 61.81 1uld n PRO 146 Cb 0.56 -2.36 -0.07 0.00 -0.02 0.00 0.00 33.50 31.60 1uld n PRO 146 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1uld s LEU 147 N -1.99 3.96 0.64 2.45 1.43 -1.26 -5.10 118.68 118.81 1uld s LEU 147 Ca 0.65 0.24 -0.15 0.00 -1.03 0.00 0.00 54.13 53.85 1uld s LEU 147 Cb -0.48 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 43.63 1uld s LEU 147 CO 0.54 0.34 1.08 -2.16 0.23 0.00 0.00 176.35 176.39 1uld s PRO 148 N -1.31 3.01 0.07 1.29 0.04 -1.26 -4.87 135.00 131.98 1uld s PRO 148 Ca 0.18 1.27 0.06 0.00 0.04 0.00 0.00 61.00 62.55 1uld s PRO 148 Cb -0.12 -1.99 0.29 0.00 0.04 0.00 0.00 34.50 32.73 1uld s PRO 148 CO 0.08 -1.07 1.17 -0.35 0.04 0.00 0.00 177.00 176.87 1uld n PRO 149 N -2.35 0.03 0.00 0.56 -0.04 -1.26 -5.30 135.00 126.65 1uld n PRO 149 Ca 0.09 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 1uld n PRO 149 Cb 0.52 -1.60 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 1uld n PRO 149 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46