#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 4.27 0.10 -0.89 2.96 -1.26 -0.72 118.68 123.14 1uld s LEU 2 Ca 0.00 0.73 0.07 0.00 -0.22 0.00 0.00 54.13 54.71 1uld s LEU 2 Cb 0.00 -2.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.06 1uld s LEU 2 CO 0.00 0.04 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.59 1uld s TYR 3 N 0.51 1.51 -0.32 5.38 1.51 0.34 -5.00 117.35 121.28 1uld s TYR 3 Ca 0.23 -0.47 -0.02 0.00 -1.01 0.00 0.00 57.07 55.80 1uld s TYR 3 Cb -0.15 -0.82 0.06 0.00 -0.11 0.00 0.00 41.96 40.95 1uld s TYR 3 CO 0.08 0.15 0.04 -1.01 -1.11 0.00 0.00 175.55 173.71 1uld s HIS 4 N -1.49 3.34 -0.42 2.71 3.76 -1.26 -1.19 115.29 120.73 1uld s HIS 4 Ca 0.05 -1.98 -0.17 0.00 -0.15 0.00 0.00 55.06 52.81 1uld s HIS 4 Cb -0.09 -2.34 0.02 0.00 1.11 0.00 0.00 32.58 31.28 1uld s HIS 4 CO 0.03 -0.83 0.45 -1.17 -0.85 0.00 0.00 174.74 172.37 1uld s LEU 5 N 1.23 4.82 0.32 0.89 2.96 -0.81 -4.89 118.68 123.20 1uld s LEU 5 Ca -0.02 -0.63 -0.18 0.00 -0.22 0.00 0.00 54.13 53.09 1uld s LEU 5 Cb -0.20 -2.41 -0.09 0.00 0.50 0.00 0.00 46.19 43.98 1uld s LEU 5 CO -0.02 -0.59 0.79 -0.36 -1.32 0.00 0.00 176.35 174.85 1uld s PHE 6 N 2.19 3.43 0.53 5.38 0.40 -1.26 -1.11 117.98 127.54 1uld s PHE 6 Ca 0.13 1.36 -0.22 0.00 -0.60 0.00 0.00 56.93 57.59 1uld s PHE 6 Cb -0.17 -2.63 -0.05 0.00 0.51 0.00 0.00 43.02 40.67 1uld s PHE 6 CO 0.14 0.11 1.37 0.54 0.70 0.00 0.00 175.22 178.08 1uld s VAL 7 N -1.91 2.07 -1.50 -0.44 0.11 -1.26 -2.16 120.40 115.31 1uld s VAL 7 Ca 0.53 0.05 -0.13 0.00 -2.93 0.00 0.00 61.98 59.51 1uld s VAL 7 Cb -0.12 -3.03 0.07 0.00 -1.53 0.00 0.00 36.38 31.78 1uld s VAL 7 CO 0.18 0.00 1.02 0.59 -3.33 0.00 0.00 175.10 173.56 1uld n ASN 8 N -0.87 -5.09 -1.09 3.54 3.02 0.51 -4.92 115.26 110.37 1uld n ASN 8 Ca 0.09 -0.73 -0.01 0.00 -0.03 0.00 0.00 54.58 53.91 1uld n ASN 8 Cb 0.44 -4.12 0.00 0.00 -0.61 0.00 0.00 39.78 35.50 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 -2.87 -0.08 -3.72 6.41 2.85 -0.63 -5.00 115.26 112.22 1uld n ASN 9 Ca 0.03 -1.08 -0.08 0.00 -0.11 0.00 0.00 54.58 53.34 1uld n ASN 9 Cb 0.53 0.15 -0.02 0.00 1.24 0.00 0.00 39.78 41.68 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 -2.02 1.79 -0.04 1.20 -2.07 -1.26 -0.80 119.66 116.47 1uld s GLN 10 Ca 0.01 -1.20 0.03 0.00 -1.82 0.00 0.00 55.36 52.39 1uld s GLN 10 Cb -0.00 0.56 0.00 0.00 -1.09 0.00 0.00 33.01 32.48 1uld s GLN 10 CO 0.01 -0.80 -0.13 0.14 -1.32 0.00 0.00 175.29 173.19 1uld s VAL 11 N -3.64 1.09 -0.21 3.63 -7.23 -0.55 -4.81 120.40 108.68 1uld s VAL 11 Ca 0.17 -0.52 -0.23 0.00 -1.81 0.00 0.00 61.98 59.59 1uld s VAL 11 Cb -0.04 -0.95 -0.02 0.00 0.56 0.00 0.00 36.38 35.93 1uld s VAL 11 CO 0.09 0.33 0.74 -0.75 -0.31 0.00 0.00 175.10 175.19 1uld s LYS 12 N 0.19 4.22 0.29 4.82 2.47 -1.26 -2.01 119.74 128.45 1uld s LYS 12 Ca -0.05 0.80 -0.29 0.00 -1.56 0.00 0.00 55.97 54.87 1uld s LYS 12 Cb -0.11 -3.60 -0.10 0.00 -1.46 0.00 0.00 37.83 32.56 1uld s LYS 12 CO 0.01 -0.35 1.20 -0.51 0.16 0.00 0.00 175.35 175.87 1uld s LEU 13 N 2.28 4.49 0.35 5.43 1.43 0.05 -4.93 118.68 127.77 1uld s LEU 13 Ca 0.33 2.44 0.07 0.00 -1.03 0.00 0.00 54.13 55.94 1uld s LEU 13 Cb -0.16 -3.63 0.65 0.00 0.03 0.00 0.00 46.19 43.08 1uld s LEU 13 CO 0.10 -0.34 1.85 -0.61 0.23 0.00 0.00 176.35 177.57 1uld h GLN 14 N 3.88 0.31 -5.08 1.70 5.75 -1.96 -3.43 115.11 116.28 1uld h GLN 14 Ca -0.47 -0.09 -0.35 0.00 -0.15 0.00 0.00 58.65 57.59 1uld h GLN 14 Cb 1.22 -0.03 -0.18 0.00 1.07 0.00 0.00 27.48 29.55 1uld h GLN 14 CO 0.68 0.49 -0.74 -0.80 -2.65 0.00 0.00 178.83 175.80 1uld s ASN 15 N -6.85 1.58 0.31 -0.69 -0.87 -1.26 -5.12 114.94 102.04 1uld s ASN 15 Ca -0.06 -0.79 -0.29 0.00 -1.57 0.00 0.00 52.86 50.15 1uld s ASN 15 Cb 0.15 -0.01 -0.11 0.00 -0.02 0.00 0.00 41.25 41.26 1uld s ASN 15 CO 0.75 -0.22 1.50 -1.81 -2.57 0.00 0.00 177.10 174.76 1uld s ASP 16 N -2.37 6.46 -0.47 -1.22 1.11 -1.26 -4.91 116.67 114.00 1uld s ASP 16 Ca 0.05 2.90 -0.27 0.00 0.18 0.00 0.00 52.55 55.41 1uld s ASP 16 Cb -0.04 -2.64 0.03 0.00 1.07 0.00 0.00 42.92 41.33 1uld s ASP 16 CO 0.01 -0.82 1.04 0.12 1.18 0.00 0.00 175.17 176.69 1uld s PHE 17 N -0.44 2.86 0.18 4.23 5.36 0.11 -4.89 117.98 125.40 1uld s PHE 17 Ca 0.58 0.55 0.02 0.00 -0.96 0.00 0.00 56.93 57.12 1uld s PHE 17 Cb -0.45 -4.22 -0.01 0.00 -0.34 0.00 0.00 43.02 38.00 1uld s PHE 17 CO 0.52 -1.19 0.09 0.36 -1.46 0.00 0.00 175.22 173.53 1uld n LYS 18 N 7.53 0.61 -1.60 10.12 2.85 -1.26 -1.47 118.16 134.94 1uld n LYS 18 Ca 0.09 -1.61 -0.47 0.00 -1.05 0.00 0.00 58.31 55.27 1uld n LYS 18 Cb 0.49 0.99 -0.03 0.00 -0.65 0.00 0.00 35.03 35.82 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 -0.40 1.36 0.00 -1.58 -0.02 -1.26 -0.26 135.00 132.85 1uld n PRO 19 Ca -0.01 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1uld n PRO 19 Cb 0.29 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 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 1.68 0.00 -1.86 -0.52 -0.58 0.78 -4.96 120.64 115.19 1uld n GLU 20 Ca 0.14 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.49 1uld n GLU 20 Cb 0.27 -0.29 0.03 0.00 -0.57 0.00 0.00 31.44 30.88 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 -0.48 5.43 -0.05 1.62 0.01 0.65 -3.71 113.70 117.17 1uld s SER 21 Ca 0.00 2.70 0.01 0.00 1.31 0.00 0.00 55.95 59.97 1uld s SER 21 Cb 0.00 -2.63 0.02 0.00 0.21 0.00 0.00 66.02 63.62 1uld s SER 21 CO 0.00 -1.46 -0.05 -0.69 0.41 0.00 0.00 173.24 171.45 1uld s VAL 22 N -1.34 0.62 -0.25 3.43 1.01 -0.23 -1.50 120.40 122.16 1uld s VAL 22 Ca 0.70 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.52 1uld s VAL 22 Cb -0.39 -0.65 0.03 0.00 0.00 0.00 0.00 36.38 35.38 1uld s VAL 22 CO 0.46 0.25 -0.08 0.00 0.00 0.00 0.00 175.10 175.74 1uld s ALA 23 N 1.05 2.65 -0.50 5.51 0.00 0.42 0.42 121.76 131.31 1uld s ALA 23 Ca -0.09 -1.51 -0.14 0.00 0.00 0.00 0.00 51.96 50.22 1uld s ALA 23 Cb -0.14 -1.64 0.11 0.00 0.00 0.00 0.00 23.12 21.45 1uld s ALA 23 CO -0.01 -0.87 0.42 0.00 0.00 0.00 0.00 175.76 175.31 1uld s ALA 24 N 1.28 3.54 -0.17 0.00 0.00 0.31 -1.06 121.76 125.66 1uld s ALA 24 Ca -0.01 -2.42 -0.18 0.00 0.00 0.00 0.00 51.96 49.35 1uld s ALA 24 Cb -0.17 -3.08 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 1uld s ALA 24 CO -0.05 -1.90 0.48 0.42 0.00 0.00 0.00 175.76 174.70 1uld s ILE 25 N 1.54 5.16 -0.04 0.00 1.01 0.64 -1.55 121.20 127.96 1uld s ILE 25 Ca 0.04 0.91 0.01 0.00 0.00 0.00 0.00 60.65 61.61 1uld s ILE 25 Cb -0.27 -3.81 0.02 0.00 0.01 0.00 0.00 42.46 38.41 1uld s ILE 25 CO 0.03 0.25 -0.06 -0.13 0.00 0.00 0.00 174.94 175.03 1uld s ARG 26 N 1.15 0.93 -0.06 2.79 0.52 0.73 -0.64 118.95 124.36 1uld s ARG 26 Ca 0.24 -0.16 -0.05 0.00 -0.52 0.00 0.00 55.73 55.24 1uld s ARG 26 Cb -0.15 -0.89 -0.04 0.00 0.52 0.00 0.00 34.95 34.39 1uld s ARG 26 CO 0.09 -0.05 0.17 0.45 0.02 0.00 0.00 175.30 175.99 1uld s SER 27 N 0.80 6.40 0.00 0.23 0.15 -0.40 -0.58 113.70 120.30 1uld s SER 27 Ca -0.12 0.44 0.15 0.00 0.70 0.00 0.00 55.95 57.12 1uld s SER 27 Cb -0.14 -2.05 0.52 0.00 -1.71 0.00 0.00 66.02 62.64 1uld s SER 27 CO 0.01 0.34 1.39 -1.54 1.20 0.00 0.00 173.24 174.64 1uld n SER 28 N 1.49 1.66 -3.48 5.45 3.41 -1.26 -3.96 113.62 116.93 1uld n SER 28 Ca -0.15 -1.85 -0.10 0.00 -0.26 0.00 0.00 58.87 56.50 1uld n SER 28 Cb 0.54 -0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 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 -1.67 -1.63 -0.32 7.33 0.00 -1.06 -4.80 121.76 119.60 1uld s ALA 29 Ca 0.27 0.55 -0.01 0.00 0.00 0.00 0.00 51.96 52.77 1uld s ALA 29 Cb 0.14 0.76 0.10 0.00 0.00 0.00 0.00 23.12 24.13 1uld s ALA 29 CO 0.20 -0.78 0.12 0.12 0.00 0.00 0.00 175.76 175.42 1uld s PHE 30 N -3.59 1.43 -0.95 0.00 5.36 -1.19 -3.85 117.98 115.18 1uld s PHE 30 Ca 0.03 -1.63 -0.23 0.00 -0.96 0.00 0.00 56.93 54.15 1uld s PHE 30 Cb -0.01 -1.54 0.06 0.00 -0.34 0.00 0.00 43.02 41.19 1uld s PHE 30 CO -0.10 -0.86 1.35 -0.80 -1.46 0.00 0.00 175.22 173.35 1uld s ASN 31 N 1.58 6.46 0.41 6.13 0.01 -0.26 -4.84 114.94 124.45 1uld s ASN 31 Ca 0.11 -1.40 0.22 0.00 -0.71 0.00 0.00 52.86 51.07 1uld s ASN 31 Cb -0.18 -2.53 1.19 0.00 0.41 0.00 0.00 41.25 40.14 1uld s ASN 31 CO -0.24 -1.47 1.75 0.28 -1.51 0.00 0.00 177.10 175.91 1uld h SER 32 N 9.64 0.38 -1.38 -1.22 0.02 -1.95 -0.89 113.55 118.16 1uld h SER 32 Ca 0.11 0.09 -0.64 0.00 -0.84 0.00 0.00 61.79 60.51 1uld h SER 32 Cb 1.02 0.03 -0.24 0.00 0.14 0.00 0.00 62.40 63.35 1uld h SER 32 CO 1.34 0.03 0.79 0.29 -1.14 0.00 0.00 176.83 178.15 1uld n LYS 33 N -4.61 2.55 -4.17 3.45 4.76 -1.26 -4.96 118.16 113.92 1uld n LYS 33 Ca 0.27 -2.97 -0.23 0.00 -2.87 0.00 0.00 58.31 52.51 1uld n LYS 33 Cb 1.00 -2.17 -0.07 0.00 -1.84 0.00 0.00 35.03 31.95 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 -0.78 1.91 0.00 0.72 0.00 -0.34 -5.04 107.32 103.79 1uld s GLY 34 Ca 0.54 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 43.45 1uld s GLY 34 CO -0.23 -1.77 0.00 0.61 0.00 0.00 0.00 173.10 171.71 1uld n GLY 35 N -1.08 1.69 3.71 0.20 0.00 0.12 -4.73 105.19 105.11 1uld n GLY 35 Ca -0.04 -1.99 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 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 -4.94 2.61 -1.04 -1.26 -4.24 114.28 105.54 1uld n THR 36 Ca 0.00 -0.03 -0.29 0.00 -2.04 0.00 0.00 64.05 61.69 1uld n THR 36 Cb 0.00 -1.91 -0.17 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 0.98 1.65 0.00 12.58 2.01 0.12 -4.41 115.64 128.57 1uld s THR 37 Ca 0.74 -0.78 0.08 0.00 0.31 0.00 0.00 61.69 62.05 1uld s THR 37 Cb -0.53 -1.45 -0.02 0.00 0.01 0.00 0.00 72.50 70.51 1uld s THR 37 CO 0.35 0.47 -0.26 -0.69 -0.69 0.00 0.00 174.62 173.80 1uld s VAL 38 N 0.47 2.07 -0.08 3.82 1.01 0.12 0.07 120.40 127.88 1uld s VAL 38 Ca -0.17 -1.21 0.02 0.00 0.00 0.00 0.00 61.98 60.62 1uld s VAL 38 Cb -0.17 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.49 1uld s VAL 38 CO 0.07 0.50 -0.12 -0.36 0.00 0.00 0.00 175.10 175.18 1uld s PHE 39 N -0.68 1.54 -0.03 5.22 0.40 -0.97 -0.19 117.98 123.27 1uld s PHE 39 Ca 0.11 -0.64 0.06 0.00 -0.60 0.00 0.00 56.93 55.86 1uld s PHE 39 Cb -0.10 -1.16 -0.01 0.00 0.51 0.00 0.00 43.02 42.26 1uld s PHE 39 CO 0.00 -0.36 -0.22 -0.80 0.70 0.00 0.00 175.22 174.54 1uld s ASN 40 N 0.95 2.65 -0.29 1.36 0.01 0.19 -1.59 114.94 118.22 1uld s ASN 40 Ca -0.09 -0.42 -0.08 0.00 -0.71 0.00 0.00 52.86 51.56 1uld s ASN 40 Cb -0.15 -0.42 -0.01 0.00 0.41 0.00 0.00 41.25 41.08 1uld s ASN 40 CO 0.00 0.26 0.10 -0.36 -1.51 0.00 0.00 177.10 175.59 1uld s PHE 41 N -0.40 3.14 0.03 2.20 0.40 -0.33 0.18 117.98 123.21 1uld s PHE 41 Ca 0.05 -0.67 0.04 0.00 -0.60 0.00 0.00 56.93 55.75 1uld s PHE 41 Cb -0.10 -2.29 -0.04 0.00 0.51 0.00 0.00 43.02 41.11 1uld s PHE 41 CO 0.00 -0.47 -0.07 -0.51 0.70 0.00 0.00 175.22 174.87 1uld s LEU 42 N 1.57 3.13 0.83 -0.37 1.43 -0.33 -1.20 118.68 123.74 1uld s LEU 42 Ca 0.04 -0.21 -0.10 0.00 -1.03 0.00 0.00 54.13 52.83 1uld s LEU 42 Cb -0.17 -1.84 0.13 0.00 0.03 0.00 0.00 46.19 44.35 1uld s LEU 42 CO 0.04 0.25 1.17 -0.94 0.23 0.00 0.00 176.35 177.10 1uld s SER 43 N -1.66 4.00 0.37 2.29 1.04 -0.46 0.49 113.70 119.78 1uld s SER 43 Ca 0.19 0.31 0.04 0.00 0.48 0.00 0.00 55.95 56.97 1uld s SER 43 Cb -0.11 -0.64 0.71 0.00 0.10 0.00 0.00 66.02 66.08 1uld s SER 43 CO 0.10 -2.15 2.01 0.00 0.98 0.00 0.00 173.24 174.18 1uld h ALA 44 N -1.09 1.58 -0.06 5.32 0.00 -1.91 0.17 119.26 123.27 1uld h ALA 44 Ca -0.43 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1uld h ALA 44 Cb 1.28 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1uld h ALA 44 CO 0.49 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.52 1uld n GLY 45 N -1.38 -0.40 2.34 0.00 0.00 -1.26 -4.86 105.19 99.63 1uld n GLY 45 Ca 0.05 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.27 -1.44 -2.75 1.61 1.02 0.60 -4.69 120.64 114.73 1uld n GLU 46 Ca 0.02 0.87 -0.37 0.00 -0.02 0.00 0.00 57.16 57.67 1uld n GLU 46 Cb 0.09 -5.38 -0.06 0.00 -0.02 0.00 0.00 31.44 26.07 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 -2.19 7.25 -0.93 1.62 0.01 -1.26 -4.07 114.94 115.39 1uld s ASN 47 Ca 0.00 1.86 -0.18 0.00 -0.71 0.00 0.00 52.86 53.84 1uld s ASN 47 Cb 0.00 -2.58 0.15 0.00 0.41 0.00 0.00 41.25 39.23 1uld s ASN 47 CO 0.00 -0.13 1.08 -0.63 -1.51 0.00 0.00 177.10 175.91 1uld s ILE 48 N -1.63 4.88 0.10 0.60 1.01 0.11 -1.35 121.20 124.92 1uld s ILE 48 Ca 0.51 -1.77 -0.22 0.00 0.00 0.00 0.00 60.65 59.18 1uld s ILE 48 Cb -0.19 -4.74 -0.12 0.00 0.01 0.00 0.00 42.46 37.43 1uld s ILE 48 CO 0.24 -1.44 1.73 -0.07 0.00 0.00 0.00 174.94 175.40 1uld h LEU 49 N 9.96 0.11 -7.63 2.97 3.38 -1.40 -1.19 115.31 121.50 1uld h LEU 49 Ca 0.16 -0.04 -0.44 0.00 0.09 0.00 0.00 57.88 57.65 1uld h LEU 49 Cb 1.02 -0.03 -0.36 0.00 0.09 0.00 0.00 40.66 41.38 1uld h LEU 49 CO 1.06 0.11 -0.78 -0.22 0.09 0.00 0.00 178.44 178.70 1uld s LEU 50 N -10.12 0.99 -0.13 1.67 2.96 -1.16 -4.54 118.68 108.34 1uld s LEU 50 Ca -0.13 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 53.66 1uld s LEU 50 Cb 0.07 -0.51 0.00 0.00 0.50 0.00 0.00 46.19 46.25 1uld s LEU 50 CO 0.68 -0.12 -0.19 -2.28 -1.32 0.00 0.00 176.35 173.12 1uld s HIS 51 N 1.48 2.70 -0.32 5.38 5.65 0.54 -1.18 115.29 129.54 1uld s HIS 51 Ca -0.02 -1.08 0.03 0.00 0.25 0.00 0.00 55.06 54.24 1uld s HIS 51 Cb -0.13 -1.82 0.09 0.00 -1.18 0.00 0.00 32.58 29.54 1uld s HIS 51 CO -0.03 -0.47 0.03 0.42 -0.65 0.00 0.00 174.74 174.04 1uld s ILE 52 N 0.65 2.03 -0.46 0.89 1.01 -0.62 -1.93 121.20 122.77 1uld s ILE 52 Ca -0.10 -2.04 -0.16 0.00 0.00 0.00 0.00 60.65 58.35 1uld s ILE 52 Cb -0.16 -2.43 0.05 0.00 0.01 0.00 0.00 42.46 39.93 1uld s ILE 52 CO 0.02 -0.49 0.42 -0.55 0.00 0.00 0.00 174.94 174.34 1uld s SER 53 N 1.06 6.16 -0.54 3.58 0.15 0.11 -2.30 113.70 121.92 1uld s SER 53 Ca 0.07 -1.09 -0.20 0.00 0.70 0.00 0.00 55.95 55.43 1uld s SER 53 Cb -0.19 -2.20 0.07 0.00 -1.71 0.00 0.00 66.02 61.99 1uld s SER 53 CO -0.10 -0.64 0.70 -0.63 1.20 0.00 0.00 173.24 173.77 1uld s ILE 54 N 1.87 4.78 -0.51 6.45 1.01 0.11 -0.32 121.20 134.59 1uld s ILE 54 Ca 0.07 -0.52 -0.06 0.00 0.00 0.00 0.00 60.65 60.14 1uld s ILE 54 Cb -0.21 -4.39 0.13 0.00 0.01 0.00 0.00 42.46 38.00 1uld s ILE 54 CO 0.09 -0.95 0.35 -0.13 0.00 0.00 0.00 174.94 174.30 1uld s ARG 55 N 2.87 2.40 0.06 2.79 0.52 -0.58 0.12 118.95 127.13 1uld s ARG 55 Ca 0.16 -2.02 -0.32 0.00 -0.52 0.00 0.00 55.73 53.03 1uld s ARG 55 Cb -0.19 -3.79 -0.19 0.00 0.52 0.00 0.00 34.95 31.30 1uld s ARG 55 CO 0.11 -1.15 1.54 -1.35 0.02 0.00 0.00 175.30 174.47 1uld h PRO 56 N 7.92 -0.89 0.00 3.54 0.11 -1.81 -1.82 132.00 139.06 1uld h PRO 56 Ca -0.12 0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1uld h PRO 56 Cb 1.03 0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1uld h PRO 56 CO 0.76 -0.57 0.00 0.41 -0.21 0.00 0.00 178.00 178.39 1uld n GLY 57 N -1.33 0.00 0.00 -0.55 0.00 -1.26 0.49 105.19 102.54 1uld n GLY 57 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1uld n GLY 57 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1uld n GLU 58 N -0.90 0.00 -4.18 1.61 2.13 -1.04 -5.02 120.64 113.24 1uld n GLU 58 Ca 0.00 -0.47 -0.30 0.00 0.66 0.00 0.00 57.16 57.04 1uld n GLU 58 Cb 0.00 -0.78 -0.06 0.00 0.27 0.00 0.00 31.44 30.87 1uld n GLU 58 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1uld n ASN 59 N -0.07 -0.27 -3.64 4.31 5.15 0.18 -4.93 115.26 115.99 1uld n ASN 59 Ca 0.00 -1.14 -0.15 0.00 -0.60 0.00 0.00 54.58 52.69 1uld n ASN 59 Cb 0.17 -2.31 -0.07 0.00 -0.53 0.00 0.00 39.78 37.04 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 -4.00 0.03 -0.16 3.44 -7.23 -0.96 -2.03 120.40 109.49 1uld s VAL 60 Ca 0.16 -0.21 0.01 0.00 -1.81 0.00 0.00 61.98 60.13 1uld s VAL 60 Cb -0.09 -0.80 0.00 0.00 0.56 0.00 0.00 36.38 36.05 1uld s VAL 60 CO 0.95 -0.11 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.82 1uld s ILE 61 N -1.09 2.46 -0.12 -0.62 1.01 0.11 -1.52 121.20 121.43 1uld s ILE 61 Ca -0.11 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 59.68 1uld s ILE 61 Cb -0.03 -2.03 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 1uld s ILE 61 CO 0.06 0.52 -0.03 -0.69 0.00 0.00 0.00 174.94 174.81 1uld s VAL 62 N 0.90 4.00 -0.06 2.92 1.01 0.57 -0.94 120.40 128.79 1uld s VAL 62 Ca -0.04 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.62 1uld s VAL 62 Cb -0.15 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.49 1uld s VAL 62 CO -0.02 0.54 -0.12 -0.36 0.00 0.00 0.00 175.10 175.14 1uld s PHE 63 N -0.19 2.78 0.22 5.22 0.40 0.75 0.05 117.98 127.21 1uld s PHE 63 Ca 0.04 -0.16 -0.22 0.00 -0.60 0.00 0.00 56.93 55.98 1uld s PHE 63 Cb -0.13 -1.68 0.06 0.00 0.51 0.00 0.00 43.02 41.78 1uld s PHE 63 CO 0.02 0.18 0.92 1.21 0.70 0.00 0.00 175.22 178.25 1uld s ASN 64 N -0.61 -0.11 0.18 1.36 3.84 -0.81 -1.85 114.94 116.94 1uld s ASN 64 Ca 0.09 -0.64 0.01 0.00 0.21 0.00 0.00 52.86 52.53 1uld s ASN 64 Cb -0.11 0.59 -0.05 0.00 -0.55 0.00 0.00 41.25 41.13 1uld s ASN 64 CO 0.01 -1.13 0.03 -0.44 -2.79 0.00 0.00 177.10 172.79 1uld s SER 65 N -3.09 0.99 -0.28 -4.21 0.01 -1.26 -0.34 113.70 105.52 1uld s SER 65 Ca 0.15 -1.22 -0.25 0.00 1.31 0.00 0.00 55.95 55.94 1uld s SER 65 Cb -0.03 0.17 0.13 0.00 0.21 0.00 0.00 66.02 66.50 1uld s SER 65 CO 0.05 -0.64 1.09 -0.60 0.41 0.00 0.00 173.24 173.56 1uld s ARG 66 N -3.97 0.43 0.63 12.44 3.52 -0.45 -3.31 118.95 128.24 1uld s ARG 66 Ca 0.27 0.52 -0.14 0.00 -0.13 0.00 0.00 55.73 56.25 1uld s ARG 66 Cb 0.07 0.21 -0.02 0.00 -1.56 0.00 0.00 34.95 33.65 1uld s ARG 66 CO 0.05 -0.05 1.06 -0.51 -0.81 0.00 0.00 175.30 175.04 1uld s LEU 67 N 0.24 3.38 0.23 -0.88 1.43 -1.26 0.08 118.68 121.90 1uld s LEU 67 Ca 0.03 1.79 -0.14 0.00 -1.03 0.00 0.00 54.13 54.78 1uld s LEU 67 Cb -0.05 -4.53 0.29 0.00 0.03 0.00 0.00 46.19 41.94 1uld s LEU 67 CO -0.08 -1.31 1.58 0.50 0.23 0.00 0.00 176.35 177.28 1uld h LYS 68 N 0.07 -0.03 -1.13 1.70 3.64 -1.84 -0.40 116.57 118.59 1uld h LYS 68 Ca -0.46 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.32 1uld h LYS 68 Cb 1.22 0.01 -0.39 0.00 -0.41 0.00 0.00 32.23 32.66 1uld h LYS 68 CO 0.57 -0.02 -0.32 0.09 -2.27 0.00 0.00 179.45 177.50 1uld n ASN 69 N -5.51 5.61 -4.66 4.20 4.13 -1.26 -5.03 115.26 112.74 1uld n ASN 69 Ca 0.10 -3.76 -0.31 0.00 1.68 0.00 0.00 54.58 52.30 1uld n ASN 69 Cb 0.41 -0.55 -0.08 0.00 -1.54 0.00 0.00 39.78 38.01 1uld n ASN 69 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1uld s GLY 70 N -3.03 2.87 0.28 7.41 0.00 -0.16 -5.15 107.32 109.54 1uld s GLY 70 Ca 0.53 -0.85 -0.01 0.00 0.00 0.00 0.00 44.72 44.39 1uld s GLY 70 CO -0.08 -2.13 0.49 0.00 0.00 0.00 0.00 173.10 171.38 1uld s ALA 71 N -2.90 3.74 0.33 3.20 0.00 -1.26 -4.60 121.76 120.26 1uld s ALA 71 Ca 0.14 -0.82 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 1uld s ALA 71 Cb 0.03 -2.09 -0.10 0.00 0.00 0.00 0.00 23.12 20.96 1uld s ALA 71 CO 0.07 0.20 1.38 -1.58 0.00 0.00 0.00 175.76 175.83 1uld s TRP 72 N -2.10 2.93 0.00 0.00 0.52 -1.26 -4.61 118.94 114.42 1uld s TRP 72 Ca 0.40 1.28 0.00 0.00 0.02 0.00 0.00 56.10 57.80 1uld s TRP 72 Cb -0.10 -3.79 0.00 0.00 -1.15 0.00 0.00 33.47 28.43 1uld s TRP 72 CO 0.32 -2.29 0.00 0.41 0.02 0.00 0.00 176.95 175.41 1uld n GLY 73 N 0.99 0.06 3.77 0.98 0.00 -1.21 -4.99 105.19 104.79 1uld n GLY 73 Ca 0.02 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.42 4.13 0.32 1.61 0.04 -1.26 -4.92 135.00 134.51 1uld s PRO 74 Ca 0.00 2.43 -0.17 0.00 0.04 0.00 0.00 61.00 63.30 1uld s PRO 74 Cb 0.00 -2.96 -0.09 0.00 0.04 0.00 0.00 34.50 31.49 1uld s PRO 74 CO 0.00 -0.45 0.77 -1.21 0.04 0.00 0.00 177.00 176.15 1uld s GLU 75 N -2.05 4.09 -0.29 4.56 2.02 -1.26 -4.79 118.70 120.98 1uld s GLU 75 Ca 0.53 0.79 0.00 0.00 0.02 0.00 0.00 54.97 56.31 1uld s GLU 75 Cb -0.44 -2.47 0.09 0.00 0.10 0.00 0.00 34.13 31.41 1uld s GLU 75 CO 0.59 0.16 0.05 -1.21 0.02 0.00 0.00 175.26 174.87 1uld s GLU 76 N -2.84 1.09 0.26 1.61 2.02 -0.77 -4.98 118.70 115.09 1uld s GLU 76 Ca 0.54 -1.17 0.10 0.00 0.02 0.00 0.00 54.97 54.46 1uld s GLU 76 Cb -0.11 -2.41 -0.05 0.00 0.10 0.00 0.00 34.13 31.67 1uld s GLU 76 CO 0.17 -0.85 -0.07 -0.98 0.02 0.00 0.00 175.26 173.55 1uld s ARG 77 N 1.43 2.09 0.04 1.61 1.70 -1.26 -0.18 118.95 124.39 1uld s ARG 77 Ca 0.05 -1.51 -0.02 0.00 -0.47 0.00 0.00 55.73 53.78 1uld s ARG 77 Cb -0.18 -2.04 -0.03 0.00 -0.57 0.00 0.00 34.95 32.13 1uld s ARG 77 CO -0.15 0.36 0.01 0.96 -1.08 0.00 0.00 175.30 175.39 1uld s ILE 78 N -2.34 0.17 0.50 4.99 -4.36 -0.12 -4.95 121.20 115.10 1uld s ILE 78 Ca 0.30 -1.39 -0.23 0.00 -0.26 0.00 0.00 60.65 59.07 1uld s ILE 78 Cb -0.06 -1.06 -0.06 0.00 1.25 0.00 0.00 42.46 42.53 1uld s ILE 78 CO 0.18 -0.77 1.40 -2.16 0.24 0.00 0.00 174.94 173.83 1uld s PRO 79 N -3.01 3.40 -0.07 0.37 0.04 -1.26 0.04 135.00 134.51 1uld s PRO 79 Ca -0.02 2.34 -0.23 0.00 0.04 0.00 0.00 61.00 63.13 1uld s PRO 79 Cb 0.01 -2.45 -0.30 0.00 0.04 0.00 0.00 34.50 31.80 1uld s PRO 79 CO -0.07 -1.02 0.85 -0.92 0.04 0.00 0.00 177.00 175.88 1uld h TYR 80 N 1.88 0.43 -3.58 0.56 3.20 -1.68 -3.42 116.97 114.36 1uld h TYR 80 Ca -0.51 -0.32 -0.57 0.00 3.14 0.00 0.00 58.73 60.48 1uld h TYR 80 Cb 1.28 -0.02 0.17 0.00 1.54 0.00 0.00 36.73 39.71 1uld h TYR 80 CO 0.48 1.27 0.04 0.00 -1.64 0.00 0.00 178.16 178.31 1uld n ALA 81 N -2.68 -0.16 -3.14 1.82 0.00 -1.26 -3.23 120.51 111.85 1uld n ALA 81 Ca -0.14 -0.08 -0.23 0.00 0.00 0.00 0.00 53.44 52.99 1uld n ALA 81 Cb 0.76 -2.07 0.04 0.00 0.00 0.00 0.00 19.45 18.17 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 -1.21 -5.10 -0.03 0.00 1.02 -1.26 -4.87 120.64 109.19 1uld n GLU 82 Ca 0.13 0.85 -0.04 0.00 -0.02 0.00 0.00 57.16 58.08 1uld n GLU 82 Cb 0.48 -5.72 -0.03 0.00 -0.02 0.00 0.00 31.44 26.15 1uld n GLU 82 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1uld n LYS 83 N -4.13 0.15 -4.18 3.49 4.76 -1.20 -4.35 118.16 112.70 1uld n LYS 83 Ca -0.09 0.04 -0.33 0.00 -2.87 0.00 0.00 58.31 55.06 1uld n LYS 83 Cb 0.60 -1.09 -0.08 0.00 -1.84 0.00 0.00 35.03 32.62 1uld n LYS 83 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1uld s PHE 84 N -2.12 3.19 -0.31 2.13 0.40 -1.26 -0.59 117.98 119.43 1uld s PHE 84 Ca -0.08 0.15 -0.03 0.00 -0.60 0.00 0.00 56.93 56.38 1uld s PHE 84 Cb 0.02 -1.71 0.05 0.00 0.51 0.00 0.00 43.02 41.89 1uld s PHE 84 CO 0.14 0.51 0.02 0.50 0.70 0.00 0.00 175.22 177.09 1uld s ARG 85 N -1.64 2.46 0.80 0.44 3.52 -1.26 -4.94 118.95 118.33 1uld s ARG 85 Ca 0.21 -1.25 -0.11 0.00 -0.13 0.00 0.00 55.73 54.45 1uld s ARG 85 Cb -0.12 -3.23 0.07 0.00 -1.56 0.00 0.00 34.95 30.12 1uld s ARG 85 CO 0.12 -0.63 1.09 -1.25 -0.81 0.00 0.00 175.30 173.82 1uld s PRO 86 N 1.28 2.04 0.00 5.12 0.04 -1.26 -2.54 135.00 139.68 1uld s PRO 86 Ca -0.05 1.07 0.28 0.00 0.04 0.00 0.00 61.00 62.34 1uld s PRO 86 Cb -0.20 -1.88 1.00 0.00 0.04 0.00 0.00 34.50 33.46 1uld s PRO 86 CO -0.00 -1.77 1.71 -0.35 0.04 0.00 0.00 177.00 176.63 1uld n PRO 87 N -3.60 1.46 -3.42 0.56 -0.04 -1.26 -4.86 135.00 123.84 1uld n PRO 87 Ca 0.08 -0.84 -0.27 0.00 -0.04 0.00 0.00 63.50 62.44 1uld n PRO 87 Cb 0.54 -1.48 -0.08 0.00 -0.04 0.00 0.00 33.50 32.43 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 -0.04 3.17 -4.73 3.54 5.03 -1.19 -2.57 115.26 118.48 1uld n ASN 88 Ca 0.17 -3.31 -0.32 0.00 0.87 0.00 0.00 54.58 51.99 1uld n ASN 88 Cb 0.35 -0.67 0.11 0.00 -1.02 0.00 0.00 39.78 38.55 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 -2.21 1.88 0.12 3.52 0.04 -1.05 -4.69 135.00 132.60 1uld s PRO 89 Ca 0.38 1.42 -0.06 0.00 0.04 0.00 0.00 61.00 62.78 1uld s PRO 89 Cb 0.14 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.82 1uld s PRO 89 CO -0.04 -1.97 0.15 -1.54 0.04 0.00 0.00 177.00 173.65 1uld s SER 90 N -2.84 0.20 -0.04 6.66 1.04 -1.26 -1.27 113.70 116.19 1uld s SER 90 Ca 0.66 -0.92 -0.00 0.00 0.48 0.00 0.00 55.95 56.17 1uld s SER 90 Cb -0.21 0.34 0.03 0.00 0.10 0.00 0.00 66.02 66.27 1uld s SER 90 CO 0.53 -0.76 0.02 -0.63 0.98 0.00 0.00 173.24 173.38 1uld s ILE 91 N -3.95 0.10 -0.17 -1.02 1.01 0.19 -3.92 121.20 113.44 1uld s ILE 91 Ca 0.14 0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.98 1uld s ILE 91 Cb 0.06 -0.25 0.01 0.00 0.01 0.00 0.00 42.46 42.28 1uld s ILE 91 CO -0.04 0.16 -0.16 -0.89 0.00 0.00 0.00 174.94 174.01 1uld s THR 92 N 1.42 2.50 -0.17 2.92 2.01 0.79 -0.26 115.64 124.84 1uld s THR 92 Ca -0.04 -0.81 -0.00 0.00 0.31 0.00 0.00 61.69 61.14 1uld s THR 92 Cb -0.13 -2.06 0.00 0.00 0.01 0.00 0.00 72.50 70.32 1uld s THR 92 CO -0.03 0.51 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.59 1uld s VAL 93 N 1.05 2.70 -0.11 3.82 1.01 -0.23 -0.45 120.40 128.20 1uld s VAL 93 Ca -0.01 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.26 1uld s VAL 93 Cb -0.14 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.08 1uld s VAL 93 CO -0.05 0.50 -0.23 -0.63 0.00 0.00 0.00 175.10 174.69 1uld s ILE 94 N 1.03 2.11 -0.43 2.22 1.01 0.01 -0.44 121.20 126.71 1uld s ILE 94 Ca -0.01 -1.00 -0.23 0.00 0.00 0.00 0.00 60.65 59.41 1uld s ILE 94 Cb -0.15 -1.81 0.02 0.00 0.01 0.00 0.00 42.46 40.54 1uld s ILE 94 CO -0.03 0.56 0.76 -0.62 0.00 0.00 0.00 174.94 175.60 1uld s ASP 95 N 0.41 6.42 -0.30 3.58 -1.08 -0.56 -0.33 116.67 124.81 1uld s ASP 95 Ca -0.17 -0.06 0.11 0.00 -0.52 0.00 0.00 52.55 51.91 1uld s ASP 95 Cb -0.18 -2.37 0.72 0.00 -1.46 0.00 0.00 42.92 39.63 1uld s ASP 95 CO 0.07 -0.85 1.75 1.41 0.52 0.00 0.00 175.17 178.07 1uld n HIS 96 N 6.57 2.19 0.00 -5.34 8.25 0.10 -0.15 115.22 126.84 1uld n HIS 96 Ca 0.02 -1.15 0.00 0.00 -0.26 0.00 0.00 57.72 56.33 1uld n HIS 96 Cb 0.48 -0.62 0.00 0.00 1.12 0.00 0.00 29.99 30.97 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 -0.18 2.28 0.04 -1.41 0.00 -1.26 -4.13 105.19 100.53 1uld n GLY 97 Ca 0.37 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.45 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 4.40 0.47 -3.61 1.61 5.75 -1.26 -4.86 116.55 119.04 1uld n ASP 98 Ca 0.00 0.31 -0.09 0.00 -0.01 0.00 0.00 54.79 55.00 1uld n ASP 98 Cb 0.00 -0.32 -0.02 0.00 -1.03 0.00 0.00 41.12 39.75 1uld n ASP 98 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1uld s ARG 99 N -3.06 1.38 0.03 0.11 1.70 -1.26 -1.74 118.95 116.10 1uld s ARG 99 Ca 0.11 -0.64 0.00 0.00 -0.47 0.00 0.00 55.73 54.74 1uld s ARG 99 Cb 0.16 0.55 -0.04 0.00 -0.57 0.00 0.00 34.95 35.05 1uld s ARG 99 CO 0.62 -0.62 0.10 -0.06 -1.08 0.00 0.00 175.30 174.26 1uld s PHE 100 N -3.67 3.31 -0.17 5.89 0.40 0.16 -0.72 117.98 123.17 1uld s PHE 100 Ca 0.06 0.19 -0.02 0.00 -0.60 0.00 0.00 56.93 56.55 1uld s PHE 100 Cb -0.03 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.77 1uld s PHE 100 CO -0.04 0.55 -0.08 -1.14 0.70 0.00 0.00 175.22 175.22 1uld s GLN 101 N -2.02 3.46 -0.16 0.44 0.74 0.55 -1.01 119.66 121.66 1uld s GLN 101 Ca 0.26 -0.62 0.01 0.00 0.05 0.00 0.00 55.36 55.07 1uld s GLN 101 Cb -0.12 -2.83 0.01 0.00 1.10 0.00 0.00 33.01 31.16 1uld s GLN 101 CO 0.18 0.09 -0.19 0.42 -0.55 0.00 0.00 175.29 175.24 1uld s ILE 102 N 0.73 2.28 -0.09 -2.34 1.09 0.14 -0.81 121.20 122.20 1uld s ILE 102 Ca -0.04 -0.89 0.04 0.00 -1.10 0.00 0.00 60.65 58.66 1uld s ILE 102 Cb -0.15 -1.95 -0.01 0.00 -1.06 0.00 0.00 42.46 39.29 1uld s ILE 102 CO 0.02 0.53 -0.21 -0.13 -0.10 0.00 0.00 174.94 175.05 1uld s ARG 103 N 0.98 2.91 0.00 2.79 1.81 0.40 -0.10 118.95 127.73 1uld s ARG 103 Ca -0.03 -0.82 0.00 0.00 -1.72 0.00 0.00 55.73 53.16 1uld s ARG 103 Cb -0.15 -2.34 0.00 0.00 -0.45 0.00 0.00 34.95 32.01 1uld s ARG 103 CO -0.04 0.30 0.00 1.19 -0.68 0.00 0.00 175.30 176.07 1uld n PHE 104 N 3.20 0.00 0.10 -0.53 3.01 -1.26 -0.15 117.46 121.82 1uld n PHE 104 Ca -0.18 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.26 1uld n PHE 104 Cb 0.52 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.95 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 0.00 -3.65 4.37 3.32 -0.97 -3.46 116.42 116.03 1uld h ASP 105 Ca 0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 1uld h ASP 105 Cb 0.00 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.42 1uld h ASP 105 CO 0.00 0.73 -0.50 -0.31 -1.72 0.00 0.00 179.24 177.44 1uld s TYR 106 N -2.84 1.78 0.28 4.55 1.51 -0.71 -4.93 117.35 116.99 1uld s TYR 106 Ca 0.02 -1.39 0.00 0.00 -1.01 0.00 0.00 57.07 54.69 1uld s TYR 106 Cb 0.09 -1.07 0.00 0.00 -0.11 0.00 0.00 41.96 40.87 1uld s TYR 106 CO 0.78 -0.44 0.00 0.41 -1.11 0.00 0.00 175.55 175.19 1uld n GLY 107 N -0.89 -2.06 3.72 0.71 0.00 -1.26 -4.82 105.19 100.60 1uld n GLY 107 Ca -0.04 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.44 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 -2.35 1.86 0.59 2.61 -4.23 -1.26 -4.86 115.64 108.00 1uld s THR 108 Ca 0.00 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.36 1uld s THR 108 Cb 0.00 -2.66 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 1uld s THR 108 CO 0.00 0.00 1.03 -0.44 -0.54 0.00 0.00 174.62 174.67 1uld s SER 109 N -4.02 6.05 -0.10 3.99 0.01 -1.26 -4.76 113.70 113.60 1uld s SER 109 Ca 0.68 1.65 -0.02 0.00 1.31 0.00 0.00 55.95 59.57 1uld s SER 109 Cb -0.12 -2.51 -0.03 0.00 0.21 0.00 0.00 66.02 63.57 1uld s SER 109 CO 0.55 -0.98 -0.02 -0.63 0.41 0.00 0.00 173.24 172.56 1uld s ILE 110 N -2.71 4.06 -0.11 1.44 1.09 0.85 -4.93 121.20 120.90 1uld s ILE 110 Ca 0.60 -0.33 0.01 0.00 -1.10 0.00 0.00 60.65 59.84 1uld s ILE 110 Cb -0.13 -2.72 -0.01 0.00 -1.06 0.00 0.00 42.46 38.53 1uld s ILE 110 CO 0.40 0.57 -0.15 -0.31 -0.10 0.00 0.00 174.94 175.35 1uld s TYR 111 N -0.49 2.73 -0.22 3.97 1.51 -1.26 0.25 117.35 123.85 1uld s TYR 111 Ca 0.08 -0.61 0.01 0.00 -1.01 0.00 0.00 57.07 55.54 1uld s TYR 111 Cb -0.12 -1.77 0.05 0.00 -0.11 0.00 0.00 41.96 40.01 1uld s TYR 111 CO 0.02 -0.16 -0.07 -0.47 -1.11 0.00 0.00 175.55 173.76 1uld s TYR 112 N 0.11 2.40 0.34 2.71 5.04 -0.18 -4.96 117.35 122.82 1uld s TYR 112 Ca -0.07 -1.69 -0.29 0.00 -2.44 0.00 0.00 57.07 52.58 1uld s TYR 112 Cb -0.15 -1.60 -0.11 0.00 0.35 0.00 0.00 41.96 40.45 1uld s TYR 112 CO 0.05 -0.76 1.43 -0.80 -1.34 0.00 0.00 175.55 174.13 1uld s ASN 113 N 1.40 6.54 0.12 4.32 0.01 -1.26 -0.67 114.94 125.40 1uld s ASN 113 Ca -0.04 2.87 -0.31 0.00 -0.71 0.00 0.00 52.86 54.67 1uld s ASN 113 Cb -0.18 -2.65 -0.08 0.00 0.41 0.00 0.00 41.25 38.75 1uld s ASN 113 CO -0.07 -0.73 1.37 -0.54 -1.51 0.00 0.00 177.10 175.62 1uld s LYS 114 N -1.65 4.33 -0.14 -0.60 1.02 -0.71 -4.88 119.74 117.12 1uld s LYS 114 Ca 0.53 2.06 0.15 0.00 0.02 0.00 0.00 55.97 58.73 1uld s LYS 114 Cb -0.44 -3.24 -0.21 0.00 -0.52 0.00 0.00 37.83 33.42 1uld s LYS 114 CO 0.56 -0.40 0.10 0.54 -0.92 0.00 0.00 175.35 175.23 1uld n ARG 115 N 3.75 1.25 -4.05 1.68 1.74 -1.26 -4.86 116.66 114.91 1uld n ARG 115 Ca 0.11 -0.03 -0.32 0.00 -0.77 0.00 0.00 57.85 56.84 1uld n ARG 115 Cb 0.43 -1.41 -0.16 0.00 -1.02 0.00 0.00 32.46 30.30 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 -2.51 1.88 -1.43 0.55 1.01 -1.26 -5.04 121.20 114.40 1uld s ILE 116 Ca -0.08 -1.09 -0.12 0.00 0.00 0.00 0.00 60.65 59.37 1uld s ILE 116 Cb 0.06 -1.86 0.06 0.00 0.01 0.00 0.00 42.46 40.72 1uld s ILE 116 CO 0.67 0.27 2.26 0.29 0.00 0.00 0.00 174.94 178.43 1uld n LYS 117 N 4.62 3.30 -4.04 2.79 4.76 -1.26 -4.89 118.16 123.44 1uld n LYS 117 Ca -0.17 -2.84 -0.09 0.00 -2.87 0.00 0.00 58.31 52.34 1uld n LYS 117 Cb 0.47 -3.08 -0.11 0.00 -1.84 0.00 0.00 35.03 30.48 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 2.01 0.47 0.57 1.97 2.02 -1.26 -5.15 118.70 119.33 1uld s GLU 118 Ca 0.49 -0.86 -0.11 0.00 0.02 0.00 0.00 54.97 54.51 1uld s GLU 118 Cb 0.14 0.04 -0.05 0.00 0.10 0.00 0.00 34.13 34.37 1uld s GLU 118 CO -0.06 -0.05 0.97 -0.80 0.02 0.00 0.00 175.26 175.34 1uld s ASN 119 N -2.00 6.31 -0.04 -0.19 0.01 -1.26 -4.97 114.94 112.80 1uld s ASN 119 Ca -0.07 1.35 -0.19 0.00 -0.71 0.00 0.00 52.86 53.24 1uld s ASN 119 Cb -0.04 -2.43 -0.05 0.00 0.41 0.00 0.00 41.25 39.14 1uld s ASN 119 CO -0.03 -0.76 0.54 0.00 -1.51 0.00 0.00 177.10 175.34 1uld s ALA 120 N -2.98 3.51 -0.24 0.60 0.00 -0.54 -4.30 121.76 117.80 1uld s ALA 120 Ca 0.54 -0.06 0.16 0.00 0.00 0.00 0.00 51.96 52.60 1uld s ALA 120 Cb -0.11 -2.67 -0.23 0.00 0.00 0.00 0.00 23.12 20.11 1uld s ALA 120 CO 0.48 0.16 0.46 0.00 0.00 0.00 0.00 175.76 176.86 1uld n ALA 121 N 2.87 3.06 -3.09 0.00 0.00 0.18 0.09 120.51 123.61 1uld n ALA 121 Ca -0.08 -0.41 -0.10 0.00 0.00 0.00 0.00 53.44 52.85 1uld n ALA 121 Cb 0.51 -0.57 -0.04 0.00 0.00 0.00 0.00 19.45 19.35 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 -2.94 -0.93 -0.10 0.00 0.00 -1.00 -0.77 121.76 116.01 1uld s ALA 122 Ca -0.02 -0.10 0.01 0.00 0.00 0.00 0.00 51.96 51.85 1uld s ALA 122 Cb 0.11 0.76 0.02 0.00 0.00 0.00 0.00 23.12 24.00 1uld s ALA 122 CO 0.67 -0.70 -0.12 0.42 0.00 0.00 0.00 175.76 176.03 1uld s ILE 123 N -3.83 1.30 0.20 0.00 1.01 -0.85 -1.19 121.20 117.84 1uld s ILE 123 Ca 0.05 -0.51 0.07 0.00 0.00 0.00 0.00 60.65 60.26 1uld s ILE 123 Cb 0.01 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.22 1uld s ILE 123 CO -0.09 0.40 0.10 0.00 0.00 0.00 0.00 174.94 175.35 1uld s ALA 124 N 1.15 3.44 -0.04 9.38 0.00 0.13 -1.48 121.76 134.34 1uld s ALA 124 Ca -0.04 -1.34 -0.01 0.00 0.00 0.00 0.00 51.96 50.56 1uld s ALA 124 Cb -0.14 -1.20 0.03 0.00 0.00 0.00 0.00 23.12 21.81 1uld s ALA 124 CO -0.03 0.42 0.03 -0.47 0.00 0.00 0.00 175.76 175.71 1uld s TYR 125 N -1.89 0.23 0.01 0.00 5.04 0.02 -0.64 117.35 120.14 1uld s TYR 125 Ca 0.30 0.10 0.01 0.00 -2.44 0.00 0.00 57.07 55.05 1uld s TYR 125 Cb -0.09 -0.50 -0.01 0.00 0.35 0.00 0.00 41.96 41.71 1uld s TYR 125 CO 0.22 -0.19 -0.04 -0.80 -1.34 0.00 0.00 175.55 173.39 1uld s ASN 126 N 1.76 0.45 0.00 4.32 0.01 0.73 0.19 114.94 122.41 1uld s ASN 126 Ca 0.00 -0.26 0.00 0.00 -0.71 0.00 0.00 52.86 51.89 1uld s ASN 126 Cb -0.12 0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.54 1uld s ASN 126 CO -0.03 -0.09 0.00 0.00 -1.51 0.00 0.00 177.10 175.47 1uld n ALA 127 N 2.35 0.00 -0.03 0.60 0.00 -1.26 0.14 120.51 122.31 1uld n ALA 127 Ca -0.17 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.12 1uld n ALA 127 Cb 0.57 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.92 1uld n ALA 127 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1uld h GLU 128 N 0.00 0.22 -2.42 0.00 5.08 -1.96 -3.38 114.58 112.12 1uld h GLU 128 Ca 0.00 -0.17 -0.59 0.00 -1.00 0.00 0.00 59.36 57.60 1uld h GLU 128 Cb 0.00 0.03 -0.40 0.00 0.50 0.00 0.00 28.75 28.88 1uld h GLU 128 CO 0.00 0.81 -0.83 -1.71 -1.00 0.00 0.00 179.01 176.28 1uld n ASN 129 N -4.56 1.37 -4.53 1.42 5.15 -1.26 -5.07 115.26 107.78 1uld n ASN 129 Ca -0.08 -2.87 -0.49 0.00 -0.60 0.00 0.00 54.58 50.54 1uld n ASN 129 Cb 0.43 -0.65 -0.04 0.00 -0.53 0.00 0.00 39.78 39.00 1uld n ASN 129 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1uld n SER 130 N 1.89 0.54 0.14 1.20 2.88 -1.26 -0.70 113.62 118.30 1uld n SER 130 Ca 0.25 1.15 0.13 0.00 -1.33 0.00 0.00 58.87 59.07 1uld n SER 130 Cb 0.45 -1.13 0.42 0.00 -0.75 0.00 0.00 64.21 63.19 1uld n SER 130 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1uld h LEU 131 N 2.44 0.00 -9.74 2.46 5.85 -1.84 -3.44 115.31 111.05 1uld h LEU 131 Ca -0.39 0.00 -0.62 0.00 0.84 0.00 0.00 57.88 57.71 1uld h LEU 131 Cb 1.38 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 42.27 1uld h LEU 131 CO 0.64 0.00 -0.54 -0.36 -0.34 0.00 0.00 178.44 177.85 1uld s PHE 132 N -3.21 1.95 0.79 1.25 2.99 -1.26 -1.10 117.98 119.38 1uld s PHE 132 Ca 0.08 -1.01 -0.11 0.00 0.00 0.00 0.00 56.93 55.89 1uld s PHE 132 Cb 0.10 -1.48 0.06 0.00 0.00 0.00 0.00 43.02 41.71 1uld s PHE 132 CO 0.55 0.09 1.08 -1.54 -0.00 0.00 0.00 175.22 175.41 1uld s SER 133 N -3.74 4.51 -0.14 1.36 1.04 -1.25 -4.88 113.70 110.60 1uld s SER 133 Ca 0.18 1.55 -0.01 0.00 0.48 0.00 0.00 55.95 58.14 1uld s SER 133 Cb 0.04 -2.30 0.04 0.00 0.10 0.00 0.00 66.02 63.90 1uld s SER 133 CO 0.10 -1.99 -0.02 -0.55 0.98 0.00 0.00 173.24 171.76 1uld s SER 134 N -3.66 2.39 0.91 7.02 0.15 -1.26 -3.76 113.70 115.49 1uld s SER 134 Ca 0.61 -0.48 -0.07 0.00 0.70 0.00 0.00 55.95 56.70 1uld s SER 134 Cb -0.16 -0.67 0.12 0.00 -1.71 0.00 0.00 66.02 63.60 1uld s SER 134 CO 0.55 -0.21 0.71 -0.81 1.20 0.00 0.00 173.24 174.68 1uld n PRO 135 N 5.01 -0.54 -4.25 5.44 -0.04 -1.26 -4.93 135.00 134.43 1uld n PRO 135 Ca -0.10 -1.23 -0.30 0.00 -0.04 0.00 0.00 63.50 61.83 1uld n PRO 135 Cb 0.49 -0.69 -0.10 0.00 -0.04 0.00 0.00 33.50 33.16 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 -2.43 3.28 0.06 0.52 -7.23 -0.27 -4.73 120.40 109.62 1uld s VAL 136 Ca 0.41 -1.29 -0.26 0.00 -1.81 0.00 0.00 61.98 59.03 1uld s VAL 136 Cb -0.01 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.35 1uld s VAL 136 CO 0.29 0.12 0.83 -0.89 -0.31 0.00 0.00 175.10 175.13 1uld s THR 137 N -1.19 4.67 -0.17 5.32 2.01 0.25 -1.92 115.64 124.60 1uld s THR 137 Ca 0.21 1.76 -0.02 0.00 0.31 0.00 0.00 61.69 63.95 1uld s THR 137 Cb -0.11 -4.18 0.05 0.00 0.01 0.00 0.00 72.50 68.27 1uld s THR 137 CO 0.13 0.35 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.71 1uld s VAL 138 N -0.01 0.78 -0.31 3.82 1.01 -0.34 -0.20 120.40 125.15 1uld s VAL 138 Ca 0.41 -0.53 -0.10 0.00 0.00 0.00 0.00 61.98 61.76 1uld s VAL 138 Cb -0.21 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.05 1uld s VAL 138 CO 0.25 -0.02 0.17 -1.81 0.00 0.00 0.00 175.10 173.69 1uld s ASP 139 N 1.76 5.68 -0.22 3.32 1.01 -0.59 -0.50 116.67 127.14 1uld s ASP 139 Ca 0.00 -0.44 -0.06 0.00 0.71 0.00 0.00 52.55 52.76 1uld s ASP 139 Cb -0.16 -2.04 -0.03 0.00 1.01 0.00 0.00 42.92 41.70 1uld s ASP 139 CO -0.07 -0.18 0.04 -0.69 0.21 0.00 0.00 175.17 174.47 1uld s VAL 140 N 1.65 4.26 0.09 -1.27 1.01 0.10 -0.53 120.40 125.71 1uld s VAL 140 Ca 0.05 -0.20 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1uld s VAL 140 Cb -0.17 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 1uld s VAL 140 CO 0.07 0.40 -0.04 -1.00 0.00 0.00 0.00 175.10 174.54 1uld s HIS 141 N 1.12 2.90 -0.50 5.22 0.09 0.17 -1.31 115.29 122.97 1uld s HIS 141 Ca 0.03 -0.07 0.24 0.00 -0.00 0.00 0.00 55.06 55.26 1uld s HIS 141 Cb -0.14 -1.50 0.35 0.00 -0.00 0.00 0.00 32.58 31.29 1uld s HIS 141 CO 0.02 0.46 1.43 0.78 -0.00 0.00 0.00 174.74 177.43 1uld h GLY 142 N 3.54 0.00 -3.38 -2.22 0.00 -1.86 -0.58 103.07 98.57 1uld h GLY 142 Ca -0.48 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 1uld h GLY 142 CO 0.57 0.00 0.13 0.48 0.00 0.00 0.00 176.54 177.72 1uld s LEU 143 N -5.12 -0.36 0.19 3.11 2.34 -1.24 -3.57 118.68 114.03 1uld s LEU 143 Ca 0.06 0.15 -0.33 0.00 0.06 0.00 0.00 54.13 54.07 1uld s LEU 143 Cb 0.10 2.38 -0.13 0.00 -0.56 0.00 0.00 46.19 47.98 1uld s LEU 143 CO 0.70 -0.82 1.57 -0.11 -1.06 0.00 0.00 176.35 176.63 1uld n LEU 144 N 0.10 3.28 -4.92 1.48 7.94 -1.25 -4.83 117.00 118.80 1uld n LEU 144 Ca -0.18 1.09 -0.28 0.00 -1.11 0.00 0.00 56.01 55.54 1uld n LEU 144 Cb 0.62 -1.46 0.10 0.00 0.53 0.00 0.00 43.42 43.22 1uld n LEU 144 CO 0.17 -0.23 0.73 -2.16 -1.11 0.00 0.00 177.39 174.79 1uld s PRO 145 N 0.68 1.75 0.40 1.96 0.04 -1.26 -5.00 135.00 133.57 1uld s PRO 145 Ca 0.76 -0.21 -0.27 0.00 0.04 0.00 0.00 61.00 61.32 1uld s PRO 145 Cb -0.64 -2.03 -0.10 0.00 0.04 0.00 0.00 34.50 31.76 1uld s PRO 145 CO 0.39 -1.63 1.37 -2.30 0.04 0.00 0.00 177.00 174.87 1uld n PRO 146 N -3.24 2.24 -4.06 0.56 -0.02 -1.26 -4.96 135.00 124.26 1uld n PRO 146 Ca 0.10 0.79 -0.35 0.00 -2.02 0.00 0.00 63.50 62.02 1uld n PRO 146 Cb 0.60 -2.50 -0.08 0.00 -0.02 0.00 0.00 33.50 31.50 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 -1.86 3.94 0.70 2.45 1.43 -1.26 -5.09 118.68 118.99 1uld s LEU 147 Ca 0.58 0.22 -0.13 0.00 -1.03 0.00 0.00 54.13 53.76 1uld s LEU 147 Cb -0.50 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 43.78 1uld s LEU 147 CO 0.60 0.30 1.10 -2.16 0.23 0.00 0.00 176.35 176.42 1uld s PRO 148 N -0.38 2.61 0.55 1.29 0.04 -1.26 -4.88 135.00 132.97 1uld s PRO 148 Ca 0.09 1.30 0.37 0.00 0.04 0.00 0.00 61.00 62.80 1uld s PRO 148 Cb -0.12 -1.93 1.94 0.00 0.04 0.00 0.00 34.50 34.43 1uld s PRO 148 CO 0.02 -1.39 2.12 -1.00 0.04 0.00 0.00 177.00 176.79 1uld h PRO 149 N -0.40 0.00 0.00 0.56 0.13 -2.06 -3.56 132.00 126.67 1uld h PRO 149 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1uld h PRO 149 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1uld h PRO 149 CO 0.53 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.30