#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rop s THR 21 N 0.00 2.24 0.30 1.55 2.01 -1.26 -1.53 115.64 118.94 2rop s THR 21 Ca 0.00 -1.83 0.03 0.00 0.31 0.00 0.00 61.69 60.20 2rop s THR 21 Cb 0.00 -2.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 2rop s THR 21 CO 0.00 0.01 0.29 -1.48 -0.69 0.00 0.00 174.62 172.75 2rop s LEU 22 N -2.24 1.41 -0.08 4.42 0.05 -1.25 -5.04 118.68 115.95 2rop s LEU 22 Ca 0.16 -1.58 0.01 0.00 0.05 0.00 0.00 54.13 52.77 2rop s LEU 22 Cb -0.09 0.73 -0.02 0.00 -2.05 0.00 0.00 46.19 44.75 2rop s LEU 22 CO 0.07 -1.05 -0.11 -1.10 -0.55 0.00 0.00 176.35 173.60 2rop s GLN 23 N -3.57 2.86 -0.07 1.48 -1.52 -1.26 -4.27 119.66 113.30 2rop s GLN 23 Ca 0.38 -0.64 -0.09 0.00 -1.95 0.00 0.00 55.36 53.05 2rop s GLN 23 Cb 0.03 -2.53 0.02 0.00 -0.22 0.00 0.00 33.01 30.31 2rop s GLN 23 CO 0.22 0.51 0.25 -0.48 -0.25 0.00 0.00 175.29 175.54 2rop s LEU 24 N -0.42 1.06 -0.35 2.90 2.34 -1.22 -4.70 118.68 118.29 2rop s LEU 24 Ca 0.05 0.38 -0.10 0.00 0.06 0.00 0.00 54.13 54.52 2rop s LEU 24 Cb -0.12 0.91 0.02 0.00 -0.56 0.00 0.00 46.19 46.43 2rop s LEU 24 CO 0.02 -0.17 0.18 -0.60 -1.06 0.00 0.00 176.35 174.72 2rop s ARG 25 N -0.23 2.98 0.14 1.48 6.06 -0.86 -0.89 118.95 127.63 2rop s ARG 25 Ca -0.03 -0.97 -0.24 0.00 -2.50 0.00 0.00 55.73 51.99 2rop s ARG 25 Cb -0.03 -3.66 -0.07 0.00 0.06 0.00 0.00 34.95 31.25 2rop s ARG 25 CO 0.01 -0.60 0.74 0.42 -2.50 0.00 0.00 175.30 173.36 2rop s ILE 26 N 1.56 4.47 -0.25 4.11 1.01 -1.26 -0.99 121.20 129.85 2rop s ILE 26 Ca 0.03 1.61 -0.12 0.00 0.00 0.00 0.00 60.65 62.17 2rop s ILE 26 Cb -0.18 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.15 2rop s ILE 26 CO 0.06 0.51 0.21 -0.62 0.00 0.00 0.00 174.94 175.11 2rop s ASP 27 N -1.03 6.13 0.00 3.58 2.15 0.05 -4.43 116.67 123.12 2rop s ASP 27 Ca 0.35 0.13 0.00 0.00 0.43 0.00 0.00 52.55 53.46 2rop s ASP 27 Cb -0.22 -2.13 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 2rop s ASP 27 CO 0.25 -0.01 0.00 0.61 -0.17 0.00 0.00 175.17 175.85 2rop n GLY 28 N 4.52 0.98 0.00 2.66 0.00 -1.26 -3.44 105.19 108.65 2rop n GLY 28 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2rop n GLY 28 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2rop n MET 29 N -0.69 0.00 0.23 1.61 0.00 -1.26 -2.23 117.12 114.79 2rop n MET 29 Ca 0.00 0.33 0.17 0.00 0.00 0.00 0.00 57.70 58.21 2rop n MET 29 Cb 0.00 -1.55 0.87 0.00 0.00 0.00 0.00 33.22 32.54 2rop n MET 29 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2rop h HIS 30 N 0.00 0.00 -3.77 3.17 3.86 -1.95 -3.35 115.15 113.11 2rop h HIS 30 Ca 0.00 0.00 -0.64 0.00 -1.16 0.00 0.00 60.37 58.57 2rop h HIS 30 Cb 0.10 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 28.41 2rop h HIS 30 CO 0.00 0.00 -0.34 0.00 0.86 0.00 0.00 177.93 178.45 2rop h LYS 32 N 8.29 0.00 -0.59 0.00 3.11 -1.89 -1.18 116.57 124.32 2rop h LYS 32 Ca -0.32 0.00 0.17 0.00 -2.81 0.00 0.00 60.65 57.69 2rop h LYS 32 Cb 1.17 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.37 2rop h LYS 32 CO 0.62 0.00 0.47 0.66 -2.81 0.00 0.00 179.45 178.39 2rop h SER 33 N 0.00 0.00 0.15 4.20 4.64 -1.94 -2.85 113.55 117.75 2rop h SER 33 Ca 0.07 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 2rop h SER 33 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2rop h SER 33 CO -0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 175.89 2rop h VAL 35 N -0.26 1.17 0.35 0.00 3.04 -1.70 -3.34 116.25 115.51 2rop h VAL 35 Ca -0.02 -2.09 -0.00 0.00 -1.01 0.00 0.00 66.70 63.58 2rop h VAL 35 Cb 0.20 2.20 -0.02 0.00 -2.01 0.00 0.00 31.29 31.67 2rop h VAL 35 CO 0.03 0.55 -0.33 0.25 -1.01 0.00 0.00 177.57 177.06 2rop h LEU 36 N 0.00 -0.89 -1.17 3.16 7.12 -1.49 0.15 115.31 122.19 2rop h LEU 36 Ca -0.01 0.08 -0.06 0.00 0.13 0.00 0.00 57.88 58.02 2rop h LEU 36 Cb 1.16 0.30 -0.02 0.00 -0.53 0.00 0.00 40.66 41.57 2rop h LEU 36 CO 0.07 -0.47 -0.11 -0.55 -0.13 0.00 0.00 178.44 177.25 2rop h ASN 37 N -0.70 0.43 -0.25 1.25 7.08 -1.70 -1.81 115.58 119.87 2rop h ASN 37 Ca -0.02 -0.10 0.01 0.00 -3.08 0.00 0.00 56.30 53.11 2rop h ASN 37 Cb 0.63 -0.11 -0.02 0.00 -2.08 0.00 0.00 38.32 36.74 2rop h ASN 37 CO -0.05 0.58 0.13 0.40 -2.08 0.00 0.00 177.43 176.40 2rop h ILE 38 N 0.42 1.00 -0.30 6.14 2.04 -1.60 -2.83 117.51 122.37 2rop h ILE 38 Ca 0.08 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 2rop h ILE 38 Cb 0.45 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 2rop h ILE 38 CO 0.03 0.05 0.02 -0.08 0.00 0.00 0.00 178.15 178.16 2rop h GLU 39 N 0.27 0.46 -0.41 2.37 4.81 -0.25 -1.34 114.58 120.49 2rop h GLU 39 Ca 0.10 -0.08 -0.12 0.00 -0.13 0.00 0.00 59.36 59.13 2rop h GLU 39 Cb 0.02 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 2rop h GLU 39 CO -0.07 0.47 -0.21 0.93 -0.73 0.00 0.00 179.01 179.40 2rop h GLU 40 N 0.44 0.86 0.01 1.92 4.39 -1.26 -3.37 114.58 117.58 2rop h GLU 40 Ca 0.10 -0.38 -0.31 0.00 0.34 0.00 0.00 59.36 59.11 2rop h GLU 40 Cb 0.27 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.85 2rop h GLU 40 CO 0.01 1.03 -1.84 0.09 -1.16 0.00 0.00 179.01 177.13 2rop n ASN 41 N -4.21 0.91 -4.59 1.42 3.02 -1.03 -4.89 115.26 105.89 2rop n ASN 41 Ca -0.01 0.33 -0.39 0.00 -0.03 0.00 0.00 54.58 54.48 2rop n ASN 41 Cb 0.44 -0.02 -0.09 0.00 -0.61 0.00 0.00 39.78 39.50 2rop n ASN 41 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2rop s ILE 42 N -2.58 5.18 0.00 2.41 -1.09 -0.53 -3.80 121.20 120.80 2rop s ILE 42 Ca -0.08 0.44 0.00 0.00 -2.23 0.00 0.00 60.65 58.78 2rop s ILE 42 Cb 0.08 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.25 2rop s ILE 42 CO 0.82 0.12 0.00 0.61 -1.23 0.00 0.00 174.94 175.26 2rop n GLY 43 N 4.77 0.67 0.00 6.18 0.00 -1.26 -4.09 105.19 111.46 2rop n GLY 43 Ca -0.09 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.03 2rop n GLY 43 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2rop n GLN 44 N 0.00 0.45 -2.84 1.61 6.02 -1.23 -4.34 117.38 117.04 2rop n GLN 44 Ca 0.00 -0.07 -0.33 0.00 -0.01 0.00 0.00 57.00 56.59 2rop n GLN 44 Cb 0.00 -1.47 -0.07 0.00 1.02 0.00 0.00 30.24 29.72 2rop n GLN 44 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2rop s LEU 45 N -3.53 3.96 0.00 1.08 1.02 -1.22 -4.96 118.68 115.02 2rop s LEU 45 Ca 0.02 1.67 0.00 0.00 0.02 0.00 0.00 54.13 55.83 2rop s LEU 45 Cb 0.15 -4.49 0.00 0.00 0.02 0.00 0.00 46.19 41.87 2rop s LEU 45 CO 0.84 -0.34 0.00 -0.11 0.02 0.00 0.00 176.35 176.76 2rop n LEU 46 N -0.58 0.00 -0.40 1.79 7.94 -1.26 -0.93 117.00 123.56 2rop n LEU 46 Ca 0.07 0.00 0.09 0.00 -1.11 0.00 0.00 56.01 55.05 2rop n LEU 46 Cb 0.54 0.00 0.18 0.00 0.53 0.00 0.00 43.42 44.67 2rop n LEU 46 CO 0.38 0.00 0.62 0.61 -1.11 0.00 0.00 177.39 177.89 2rop n GLY 47 N -0.87 4.39 3.21 -3.96 0.00 -1.26 -4.96 105.19 101.75 2rop n GLY 47 Ca 0.00 -1.02 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 2rop n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rop s VAL 48 N -2.69 2.81 -0.13 1.61 1.01 -0.11 -0.67 120.40 122.22 2rop s VAL 48 Ca 0.34 -0.82 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2rop s VAL 48 Cb 0.28 -2.31 -0.25 0.00 0.00 0.00 0.00 36.38 34.10 2rop s VAL 48 CO 0.05 0.37 0.33 1.67 0.00 0.00 0.00 175.10 177.52 2rop n GLN 49 N 4.70 0.75 -3.97 2.72 7.27 -0.78 -3.43 117.38 124.62 2rop n GLN 49 Ca -0.18 0.27 -0.10 0.00 0.07 0.00 0.00 57.00 57.06 2rop n GLN 49 Cb 0.49 -1.70 -0.07 0.00 2.41 0.00 0.00 30.24 31.37 2rop n GLN 49 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2rop s SER 50 N -7.01 0.02 0.05 1.69 0.01 -1.13 -4.65 113.70 102.67 2rop s SER 50 Ca -0.23 -0.90 0.06 0.00 1.31 0.00 0.00 55.95 56.19 2rop s SER 50 Cb 0.07 0.46 -0.02 0.00 0.21 0.00 0.00 66.02 66.73 2rop s SER 50 CO 0.75 -0.93 -0.18 -0.51 0.41 0.00 0.00 173.24 172.78 2rop s ILE 51 N -3.98 1.45 0.06 1.44 1.10 -1.26 -1.73 121.20 118.28 2rop s ILE 51 Ca 0.19 -1.15 -0.03 0.00 -0.51 0.00 0.00 60.65 59.15 2rop s ILE 51 Cb 0.03 -1.28 -0.03 0.00 0.15 0.00 0.00 42.46 41.33 2rop s ILE 51 CO 0.02 0.10 0.04 -1.58 -2.11 0.00 0.00 174.94 171.41 2rop s GLN 52 N -1.23 0.66 0.00 3.50 2.00 0.44 -4.98 119.66 120.05 2rop s GLN 52 Ca 0.05 -1.10 -0.01 0.00 -2.00 0.00 0.00 55.36 52.30 2rop s GLN 52 Cb -0.09 0.24 -0.01 0.00 0.80 0.00 0.00 33.01 33.96 2rop s GLN 52 CO 0.02 -0.15 0.01 0.14 -0.50 0.00 0.00 175.29 174.81 2rop s VAL 53 N -3.73 0.05 -0.37 1.34 -7.23 -1.26 -0.76 120.40 108.43 2rop s VAL 53 Ca 0.05 -0.38 0.13 0.00 -1.81 0.00 0.00 61.98 59.97 2rop s VAL 53 Cb 0.06 -0.15 0.37 0.00 0.56 0.00 0.00 36.38 37.22 2rop s VAL 53 CO -0.10 -0.21 0.78 -1.20 -0.31 0.00 0.00 175.10 174.07 2rop n SER 54 N 2.43 1.15 0.25 4.85 7.64 -0.30 -4.89 113.62 124.75 2rop n SER 54 Ca -0.17 -3.00 0.08 0.00 1.01 0.00 0.00 58.87 56.78 2rop n SER 54 Cb 0.58 -0.60 0.63 0.00 -1.01 0.00 0.00 64.21 63.80 2rop n SER 54 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2rop h LEU 55 N 2.99 0.02 -2.71 -3.43 -0.00 -1.93 -1.67 115.31 108.58 2rop h LEU 55 Ca 0.07 -0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.95 2rop h LEU 55 Cb 0.98 -0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.63 2rop h LEU 55 CO 0.52 0.02 -0.00 1.05 -0.00 0.00 0.00 178.44 180.02 2rop h GLU 56 N 0.02 0.00 -0.03 1.13 4.11 -1.94 -1.72 114.58 116.14 2rop h GLU 56 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2rop h GLU 56 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2rop h GLU 56 CO -0.00 0.00 0.00 -1.71 0.07 0.00 0.00 179.01 177.37 2rop n ASN 57 N -3.13 1.66 -1.72 3.06 2.85 -0.67 -5.01 115.26 112.29 2rop n ASN 57 Ca -0.02 -1.36 -0.18 0.00 -0.11 0.00 0.00 54.58 52.91 2rop n ASN 57 Cb 0.11 -0.02 -0.06 0.00 1.24 0.00 0.00 39.78 41.05 2rop n ASN 57 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2rop n LYS 58 N 0.33 -1.50 -3.71 1.20 5.02 -0.65 -4.98 118.16 113.87 2rop n LYS 58 Ca 0.04 1.03 -0.29 0.00 -2.02 0.00 0.00 58.31 57.08 2rop n LYS 58 Cb 0.18 -5.44 -0.04 0.00 -0.02 0.00 0.00 35.03 29.72 2rop n LYS 58 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2rop s THR 59 N -2.62 5.21 0.21 -0.18 -4.23 -1.08 -4.08 115.64 108.85 2rop s THR 59 Ca 0.00 -0.27 0.10 0.00 -1.18 0.00 0.00 61.69 60.33 2rop s THR 59 Cb 0.00 -3.70 -0.04 0.00 1.34 0.00 0.00 72.50 70.10 2rop s THR 59 CO 0.00 -0.10 -0.13 0.00 -0.54 0.00 0.00 174.62 173.85 2rop s ALA 60 N -1.79 2.86 -0.08 3.99 0.00 -0.07 -1.15 121.76 125.53 2rop s ALA 60 Ca 0.39 -1.58 0.02 0.00 0.00 0.00 0.00 51.96 50.78 2rop s ALA 60 Cb -0.11 -0.60 0.01 0.00 0.00 0.00 0.00 23.12 22.42 2rop s ALA 60 CO 0.28 0.41 -0.13 -0.65 0.00 0.00 0.00 175.76 175.67 2rop s GLN 61 N -2.99 1.85 -0.07 0.00 1.11 0.06 -3.39 119.66 116.23 2rop s GLN 61 Ca 0.25 -0.45 0.04 0.00 0.01 0.00 0.00 55.36 55.22 2rop s GLN 61 Cb -0.08 -1.56 -0.01 0.00 -1.01 0.00 0.00 33.01 30.35 2rop s GLN 61 CO 0.15 -0.01 -0.21 0.54 0.01 0.00 0.00 175.29 175.77 2rop s VAL 62 N 0.80 2.44 -0.99 1.09 0.11 -1.26 -0.42 120.40 122.17 2rop s VAL 62 Ca -0.12 -0.92 -0.04 0.00 -2.93 0.00 0.00 61.98 57.97 2rop s VAL 62 Cb -0.15 -1.93 0.25 0.00 -1.53 0.00 0.00 36.38 33.01 2rop s VAL 62 CO 0.02 0.57 0.96 0.29 -3.33 0.00 0.00 175.10 173.61 2rop n LYS 63 N 2.95 3.11 -3.06 1.54 5.02 -0.70 -3.75 118.16 123.27 2rop n LYS 63 Ca -0.18 -4.48 -0.19 0.00 -2.02 0.00 0.00 58.31 51.44 2rop n LYS 63 Cb 0.52 -2.47 0.04 0.00 -0.02 0.00 0.00 35.03 33.10 2rop n LYS 63 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2rop s TYR 64 N -1.48 1.93 0.02 2.13 -0.85 -0.58 -1.87 117.35 116.64 2rop s TYR 64 Ca 0.30 -0.61 0.07 0.00 -0.52 0.00 0.00 57.07 56.30 2rop s TYR 64 Cb -0.07 -2.26 -0.02 0.00 0.38 0.00 0.00 41.96 39.99 2rop s TYR 64 CO -0.09 -0.86 -0.21 0.16 -1.52 0.00 0.00 175.55 173.03 2rop s ASP 65 N -4.54 2.44 0.00 -0.18 1.47 0.16 0.11 116.67 116.13 2rop s ASP 65 Ca 0.58 -0.45 0.15 0.00 1.18 0.00 0.00 52.55 54.01 2rop s ASP 65 Cb -0.07 -0.23 0.77 0.00 -0.34 0.00 0.00 42.92 43.05 2rop s ASP 65 CO 0.36 0.20 1.52 -0.81 0.68 0.00 0.00 175.17 177.12 2rop n PRO 66 N 2.18 1.22 -0.07 2.11 -0.04 -1.26 -3.39 135.00 135.75 2rop n PRO 66 Ca -0.16 -0.34 -0.20 0.00 -0.04 0.00 0.00 63.50 62.75 2rop n PRO 66 Cb 0.53 -1.26 -0.12 0.00 -0.04 0.00 0.00 33.50 32.61 2rop n PRO 66 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2rop h SER 67 N 0.65 0.09 0.00 3.54 0.87 -1.96 -3.43 113.55 113.31 2rop h SER 67 Ca 0.00 -0.68 0.00 0.00 -1.23 0.00 0.00 61.79 59.88 2rop h SER 67 Cb 0.14 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 2rop h SER 67 CO 0.00 1.44 -1.56 0.00 -0.53 0.00 0.00 176.83 176.18 2rop n THR 69 N -1.93 0.00 -3.46 0.00 5.66 -1.22 -4.66 114.28 108.67 2rop n THR 69 Ca -0.01 -1.73 -0.12 0.00 -3.05 0.00 0.00 64.05 59.15 2rop n THR 69 Cb 0.45 0.98 -0.03 0.00 -1.55 0.00 0.00 70.33 70.19 2rop n THR 69 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2rop s SER 70 N -2.92 -0.51 0.29 1.09 1.04 -1.26 -4.52 113.70 106.90 2rop s SER 70 Ca 0.28 0.11 0.03 0.00 0.48 0.00 0.00 55.95 56.85 2rop s SER 70 Cb -0.00 0.52 0.72 0.00 0.10 0.00 0.00 66.02 67.36 2rop s SER 70 CO 0.20 -0.80 1.67 -0.65 0.98 0.00 0.00 173.24 174.65 2rop h PRO 71 N 2.15 0.29 -0.20 4.02 0.11 -1.98 -1.17 132.00 135.22 2rop h PRO 71 Ca -0.29 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.65 2rop h PRO 71 Cb 1.26 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2rop h PRO 71 CO 0.36 0.19 -0.50 -0.39 -0.21 0.00 0.00 178.00 177.45 2rop h VAL 72 N 0.30 1.32 -0.43 3.15 -1.51 -1.99 0.04 116.25 117.13 2rop h VAL 72 Ca 0.56 -1.73 -0.08 0.00 -1.23 0.00 0.00 66.70 64.22 2rop h VAL 72 Cb 1.10 1.71 -0.01 0.00 -2.13 0.00 0.00 31.29 31.95 2rop h VAL 72 CO -0.59 0.54 -0.06 0.00 -1.23 0.00 0.00 177.57 176.23 2rop h ALA 73 N 1.03 0.59 -0.12 5.19 0.00 -1.77 -2.29 119.26 121.89 2rop h ALA 73 Ca 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2rop h ALA 73 Cb 1.03 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2rop h ALA 73 CO 0.09 0.43 0.01 -0.07 0.00 0.00 0.00 179.25 179.72 2rop h LEU 74 N 0.64 0.19 -0.01 0.00 3.38 -1.13 -1.94 115.31 116.45 2rop h LEU 74 Ca 0.12 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.83 2rop h LEU 74 Cb 0.58 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 2rop h LEU 74 CO 0.03 0.42 -0.14 -0.61 0.09 0.00 0.00 178.44 178.24 2rop h GLN 75 N -0.04 -0.22 -0.81 1.13 4.15 -1.00 0.19 115.11 118.50 2rop h GLN 75 Ca 0.03 0.02 0.13 0.00 0.77 0.00 0.00 58.65 59.60 2rop h GLN 75 Cb 0.32 0.05 -0.09 0.00 0.21 0.00 0.00 27.48 27.97 2rop h GLN 75 CO 0.00 -0.15 0.42 0.00 -1.93 0.00 0.00 178.83 177.17 2rop h ARG 76 N -0.23 0.62 0.46 1.69 3.08 -1.42 -2.09 114.38 116.48 2rop h ARG 76 Ca 0.05 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 2rop h ARG 76 Cb 0.30 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2rop h ARG 76 CO -0.14 0.41 -0.22 0.00 -1.07 0.00 0.00 179.97 178.95 2rop h ALA 77 N 1.51 -0.61 -0.09 0.04 0.00 -0.87 -3.30 119.26 115.94 2rop h ALA 77 Ca 0.42 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 55.03 2rop h ALA 77 Cb 0.54 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2rop h ALA 77 CO -0.33 -0.59 -0.60 -0.84 0.00 0.00 0.00 179.25 176.89 2rop h ILE 78 N -1.13 1.37 0.00 0.00 3.07 -0.93 -2.36 117.51 117.54 2rop h ILE 78 Ca -0.06 -1.96 0.00 0.00 1.55 0.00 0.00 64.86 64.39 2rop h ILE 78 Cb 0.51 1.97 0.00 0.00 -0.27 0.00 0.00 36.82 39.03 2rop h ILE 78 CO 0.10 0.58 0.00 1.21 -1.05 0.00 0.00 178.15 179.00 2rop n GLU 79 N -3.88 0.08 -0.17 0.16 2.13 -0.79 -2.43 120.64 115.74 2rop n GLU 79 Ca -0.03 0.32 0.08 0.00 0.66 0.00 0.00 57.16 58.19 2rop n GLU 79 Cb 0.62 -1.66 0.17 0.00 0.27 0.00 0.00 31.44 30.84 2rop n GLU 79 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2rop n ALA 80 N -1.62 2.32 0.28 4.31 0.00 -0.90 -4.44 120.51 120.46 2rop n ALA 80 Ca 0.03 -1.02 -0.17 0.00 0.00 0.00 0.00 53.44 52.28 2rop n ALA 80 Cb 0.20 -0.60 -0.08 0.00 0.00 0.00 0.00 19.45 18.97 2rop n ALA 80 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2rop h LEU 81 N 2.98 -1.07-10.37 0.00 3.38 -1.35 -3.43 115.31 105.44 2rop h LEU 81 Ca 0.00 0.08 -0.45 0.00 0.09 0.00 0.00 57.88 57.60 2rop h LEU 81 Cb 0.78 0.35 0.16 0.00 0.09 0.00 0.00 40.66 42.03 2rop h LEU 81 CO 0.00 -0.57 0.20 -2.16 0.09 0.00 0.00 178.44 176.00 2rop s PRO 82 N -5.97 0.41 -0.75 1.13 0.04 -1.26 -4.92 135.00 123.69 2rop s PRO 82 Ca -0.17 0.47 -0.07 0.00 0.04 0.00 0.00 61.00 61.27 2rop s PRO 82 Cb 0.05 -1.74 -0.14 0.00 0.04 0.00 0.00 34.50 32.71 2rop s PRO 82 CO 0.62 -2.73 2.79 -0.35 0.04 0.00 0.00 177.00 177.37 2rop n PRO 83 N -4.17 2.40 -1.89 0.56 -0.04 -1.26 -4.46 135.00 126.15 2rop n PRO 83 Ca 0.05 -1.41 -0.09 0.00 -0.04 0.00 0.00 63.50 62.01 2rop n PRO 83 Cb 0.58 -2.33 -0.01 0.00 -0.04 0.00 0.00 33.50 31.70 2rop n PRO 83 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rop n GLY 84 N 3.20 0.32 0.00 0.55 0.00 -1.26 -4.96 105.19 103.04 2rop n GLY 84 Ca 0.51 -0.56 0.10 0.00 0.00 0.00 0.00 46.02 46.07 2rop n GLY 84 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rop n ASN 85 N 0.44 0.61 -3.74 1.61 2.85 -1.26 -4.85 115.26 110.92 2rop n ASN 85 Ca -0.10 -0.57 -0.26 0.00 -0.11 0.00 0.00 54.58 53.54 2rop n ASN 85 Cb 0.49 1.41 -0.17 0.00 1.24 0.00 0.00 39.78 42.75 2rop n ASN 85 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 2rop s PHE 86 N -3.18 0.83 0.31 1.20 0.08 -1.26 -4.92 117.98 111.04 2rop s PHE 86 Ca 0.01 -0.55 -0.02 0.00 0.12 0.00 0.00 56.93 56.50 2rop s PHE 86 Cb 0.15 -0.92 -0.04 0.00 -0.57 0.00 0.00 43.02 41.64 2rop s PHE 86 CO 0.87 -0.49 0.54 0.15 -0.10 0.00 0.00 175.22 176.18 2rop s LYS 87 N 1.92 3.55 -0.04 0.44 -0.14 -1.22 -4.72 119.74 119.52 2rop s LYS 87 Ca 0.02 -0.19 0.05 0.00 -1.36 0.00 0.00 55.97 54.49 2rop s LYS 87 Cb -0.15 -2.67 -0.01 0.00 -1.68 0.00 0.00 37.83 33.32 2rop s LYS 87 CO -0.07 0.19 -0.20 0.14 -0.76 0.00 0.00 175.35 174.66 2rop s VAL 88 N -2.18 1.61 -0.21 3.17 -7.23 -1.26 -0.77 120.40 113.52 2rop s VAL 88 Ca 0.41 -0.83 -0.04 0.00 -1.81 0.00 0.00 61.98 59.71 2rop s VAL 88 Cb -0.10 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.46 2rop s VAL 88 CO 0.33 0.46 -0.04 -0.55 -0.31 0.00 0.00 175.10 174.99 2rop s SER 89 N -0.14 4.39 0.00 4.85 0.15 -0.16 -4.96 113.70 117.82 2rop s SER 89 Ca -0.01 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.29 2rop s SER 89 Cb -0.11 -1.75 0.00 0.00 -1.71 0.00 0.00 66.02 62.45 2rop s SER 89 CO 0.02 0.01 0.00 0.18 1.20 0.00 0.00 173.24 174.64 2rop n LEU 90 N 4.61 0.00 0.00 3.45 4.32 -1.26 -2.02 117.00 126.10 2rop n LEU 90 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.81 2rop n LEU 90 Cb 0.51 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.31 2rop n LEU 90 CO 0.29 -0.20 0.00 1.07 -1.22 0.00 0.00 177.39 177.33 2rop n THR 120 N -0.40 0.00 -3.69 -5.08 5.66 -1.26 -5.06 114.28 104.44 2rop n THR 120 Ca 0.00 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.89 2rop n THR 120 Cb 0.00 -0.03 -0.11 0.00 -1.55 0.00 0.00 70.33 68.64 2rop n THR 120 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2rop s SER 122 N 1.61 -0.08 -0.04 0.00 0.01 -0.70 -4.96 113.70 109.54 2rop s SER 122 Ca -0.08 0.11 -0.04 0.00 1.31 0.00 0.00 55.95 57.25 2rop s SER 122 Cb -0.09 0.26 -0.04 0.00 0.21 0.00 0.00 66.02 66.35 2rop s SER 122 CO -0.12 -0.15 0.17 -0.89 0.41 0.00 0.00 173.24 172.66 2rop s THR 123 N -0.40 5.43 0.17 1.44 2.01 -1.26 -0.51 115.64 122.51 2rop s THR 123 Ca -0.05 -0.06 -0.01 0.00 0.31 0.00 0.00 61.69 61.88 2rop s THR 123 Cb -0.03 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 2rop s THR 123 CO 0.01 0.41 0.08 0.28 -0.69 0.00 0.00 174.62 174.71 2rop s THR 124 N -1.23 0.15 -0.08 -0.82 -1.32 -0.46 -4.99 115.64 106.88 2rop s THR 124 Ca 0.24 -1.96 0.04 0.00 -1.21 0.00 0.00 61.69 58.80 2rop s THR 124 Cb -0.12 -2.28 -0.01 0.00 -1.51 0.00 0.00 72.50 68.57 2rop s THR 124 CO 0.14 -0.24 -0.21 -0.22 -2.21 0.00 0.00 174.62 171.88 2rop s LEU 125 N -3.13 2.29 -0.04 9.08 0.20 -1.26 -1.45 118.68 124.37 2rop s LEU 125 Ca 0.31 -0.45 0.07 0.00 0.69 0.00 0.00 54.13 54.75 2rop s LEU 125 Cb 0.07 -1.45 -0.01 0.00 -0.43 0.00 0.00 46.19 44.36 2rop s LEU 125 CO 0.07 0.22 -0.24 -0.63 -0.29 0.00 0.00 176.35 175.48 2rop s ILE 126 N -0.00 1.97 -0.23 6.68 -1.09 0.01 -0.97 121.20 127.56 2rop s ILE 126 Ca -0.07 -1.04 -0.09 0.00 -2.23 0.00 0.00 60.65 57.22 2rop s ILE 126 Cb -0.15 -1.65 -0.04 0.00 -1.58 0.00 0.00 42.46 39.03 2rop s ILE 126 CO 0.05 0.55 0.12 0.00 -1.23 0.00 0.00 174.94 174.43 2rop s ALA 127 N -0.30 3.48 -0.08 9.38 0.00 0.20 -0.81 121.76 133.61 2rop s ALA 127 Ca 0.01 -0.89 0.04 0.00 0.00 0.00 0.00 51.96 51.12 2rop s ALA 127 Cb -0.12 -2.18 -0.00 0.00 0.00 0.00 0.00 23.12 20.82 2rop s ALA 127 CO 0.02 -0.15 -0.22 0.42 0.00 0.00 0.00 175.76 175.83 2rop s ILE 128 N 0.98 1.91 -0.57 0.00 1.09 -0.03 -0.52 121.20 124.05 2rop s ILE 128 Ca 0.06 -0.94 0.04 0.00 -1.10 0.00 0.00 60.65 58.70 2rop s ILE 128 Cb -0.14 -1.65 0.38 0.00 -1.06 0.00 0.00 42.46 40.00 2rop s ILE 128 CO 0.03 0.53 1.21 0.00 -0.10 0.00 0.00 174.94 176.61 2rop n ALA 129 N 3.42 5.19 -2.71 9.38 0.00 0.27 -4.67 120.51 131.39 2rop n ALA 129 Ca -0.19 -4.44 -0.07 0.00 0.00 0.00 0.00 53.44 48.73 2rop n ALA 129 Cb 0.53 -0.87 0.10 0.00 0.00 0.00 0.00 19.45 19.21 2rop n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rop n GLY 130 N -0.39 0.93 3.05 0.00 0.00 -1.26 -4.37 105.19 103.15 2rop n GLY 130 Ca 0.39 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 46.19 2rop n GLY 130 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2rop s MET 131 N 0.21 0.70 -0.29 1.61 1.00 -1.26 -4.91 119.30 116.35 2rop s MET 131 Ca 0.21 -0.47 -0.14 0.00 0.00 0.00 0.00 55.69 55.29 2rop s MET 131 Cb 0.35 -0.65 0.13 0.00 0.00 0.00 0.00 34.83 34.66 2rop s MET 131 CO -0.08 0.17 0.84 -0.08 0.00 0.00 0.00 175.02 175.87 2rop s THR 132 N -0.53 -0.40 0.25 2.05 -1.32 -1.26 -5.07 115.64 109.36 2rop s THR 132 Ca 0.01 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.49 2rop s THR 132 Cb -0.05 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 2rop s THR 132 CO 0.00 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.41 2rop h ALA 134 N -0.56 2.03 0.00 0.00 0.00 -2.01 -1.79 119.26 116.92 2rop h ALA 134 Ca -0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2rop h ALA 134 Cb 0.55 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2rop h ALA 134 CO 0.03 -0.12 -0.24 0.66 0.00 0.00 0.00 179.25 179.58 2rop h SER 135 N 0.31 0.00 -0.18 0.00 4.64 -1.98 -0.32 113.55 116.01 2rop h SER 135 Ca 0.20 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.47 2rop h SER 135 Cb 0.40 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2rop h SER 135 CO -0.04 0.24 -0.09 0.00 -0.87 0.00 0.00 176.83 176.07 2rop h VAL 137 N 0.07 0.29 0.00 0.00 2.07 -1.37 0.15 116.25 117.46 2rop h VAL 137 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2rop h VAL 137 Cb 0.57 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2rop h VAL 137 CO 0.03 0.00 0.00 0.45 0.02 0.00 0.00 177.57 178.07 2rop h HIS 138 N -0.47 0.00 -0.02 1.57 3.86 -1.08 0.95 115.15 119.95 2rop h HIS 138 Ca 0.06 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.21 2rop h HIS 138 Cb 0.56 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.04 2rop h HIS 138 CO -0.35 0.00 -0.23 0.77 0.86 0.00 0.00 177.93 178.97 2rop h SER 139 N 0.00 0.24 0.28 2.45 0.02 -0.57 -2.29 113.55 113.69 2rop h SER 139 Ca 0.00 -0.72 -0.01 0.00 -0.84 0.00 0.00 61.79 60.22 2rop h SER 139 Cb 0.49 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2rop h SER 139 CO 0.00 0.92 -0.14 0.40 -1.14 0.00 0.00 176.83 176.88 2rop h ILE 140 N -0.42 0.74 -0.53 3.27 2.04 -0.45 0.67 117.51 122.83 2rop h ILE 140 Ca -0.02 -0.61 0.14 0.00 1.00 0.00 0.00 64.86 65.37 2rop h ILE 140 Cb 0.94 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 2rop h ILE 140 CO 0.05 0.12 0.37 -0.08 0.00 0.00 0.00 178.15 178.61 2rop h GLU 141 N -0.72 0.07 0.03 2.37 4.81 -1.01 0.68 114.58 120.81 2rop h GLU 141 Ca -0.04 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2rop h GLU 141 Cb 0.49 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2rop h GLU 141 CO 0.06 0.05 -0.01 0.78 -0.73 0.00 0.00 179.01 179.15 2rop h GLY 142 N 0.07 -0.04 0.25 1.92 0.00 -1.24 -3.35 103.07 100.68 2rop h GLY 142 Ca 0.25 0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.59 2rop h GLY 142 CO -0.02 -0.02 -0.05 -0.33 0.00 0.00 0.00 176.54 176.13 2rop h MET 143 N -0.78 -0.13 0.00 4.80 2.86 -0.47 -3.38 114.93 117.83 2rop h MET 143 Ca -0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2rop h MET 143 Cb 0.69 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.38 2rop h MET 143 CO 0.01 0.37 0.00 0.82 1.06 0.00 0.00 176.91 179.17 2rop h ILE 144 N -0.88 0.00 0.00 -1.22 1.08 -1.10 -2.50 117.51 112.88 2rop h ILE 144 Ca -0.01 -0.53 0.00 0.00 -0.39 0.00 0.00 64.86 63.93 2rop h ILE 144 Cb 0.56 1.50 0.00 0.00 -3.07 0.00 0.00 36.82 35.81 2rop h ILE 144 CO 0.02 0.00 0.00 -1.54 -0.69 0.00 0.00 178.15 175.94 2rop n SER 145 N -2.99 0.00 -1.19 1.72 3.41 -1.26 -4.19 113.62 109.11 2rop n SER 145 Ca 0.01 -0.56 -0.05 0.00 -0.26 0.00 0.00 58.87 58.01 2rop n SER 145 Cb 0.32 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.40 2rop n SER 145 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rop n GLN 146 N -0.97 2.21 -0.02 4.33 6.02 -0.94 -4.79 117.38 123.22 2rop n GLN 146 Ca 0.12 -3.55 0.01 0.00 -0.01 0.00 0.00 57.00 53.57 2rop n GLN 146 Cb 0.06 -1.77 0.01 0.00 1.02 0.00 0.00 30.24 29.56 2rop n GLN 146 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 2rop n LEU 147 N -0.89 1.30 -0.86 1.08 -0.00 -1.26 -5.11 117.00 111.26 2rop n LEU 147 Ca 0.27 -1.36 0.00 0.00 -0.00 0.00 0.00 56.01 54.91 2rop n LEU 147 Cb 0.81 -0.02 0.00 0.00 -0.00 0.00 0.00 43.42 44.21 2rop n LEU 147 CO 0.11 0.34 -0.09 1.21 -0.00 0.00 0.00 177.39 178.96 2rop n GLU 148 N -0.37 -1.10 -0.17 1.47 2.13 -1.26 -4.95 120.64 116.38 2rop n GLU 148 Ca 0.01 1.18 0.00 0.00 0.66 0.00 0.00 57.16 59.01 2rop n GLU 148 Cb 0.37 -0.90 0.00 0.00 0.27 0.00 0.00 31.44 31.17 2rop n GLU 148 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2rop n GLY 149 N 0.38 1.06 2.98 8.31 0.00 -1.26 -4.71 105.19 111.94 2rop n GLY 149 Ca 0.00 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 2rop n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rop s VAL 150 N -2.00 2.40 -0.07 1.61 0.11 -1.26 -1.06 120.40 120.12 2rop s VAL 150 Ca 0.00 -2.82 -0.15 0.00 -2.93 0.00 0.00 61.98 56.08 2rop s VAL 150 Cb 0.00 -2.72 -0.11 0.00 -1.53 0.00 0.00 36.38 32.02 2rop s VAL 150 CO 0.00 -0.70 0.57 -0.61 -3.33 0.00 0.00 175.10 171.02 2rop h GLN 151 N 7.05 -0.19 -3.37 1.54 4.15 -1.14 -3.47 115.11 119.68 2rop h GLN 151 Ca -0.06 0.01 -0.27 0.00 0.77 0.00 0.00 58.65 59.10 2rop h GLN 151 Cb 0.95 0.04 -0.33 0.00 0.21 0.00 0.00 27.48 28.36 2rop h GLN 151 CO 0.60 0.15 -0.66 -1.14 -1.93 0.00 0.00 178.83 175.85 2rop s GLN 152 N -2.72 0.03 -0.03 1.69 0.74 -1.21 -5.01 119.66 113.15 2rop s GLN 152 Ca -0.09 0.29 -0.01 0.00 0.05 0.00 0.00 55.36 55.60 2rop s GLN 152 Cb -0.00 -0.21 0.03 0.00 1.10 0.00 0.00 33.01 33.93 2rop s GLN 152 CO 0.32 -0.17 0.06 -1.50 -0.55 0.00 0.00 175.29 173.46 2rop s ILE 153 N 1.14 -0.07 -0.05 -2.34 2.07 -1.26 -0.61 121.20 120.08 2rop s ILE 153 Ca -0.09 0.23 -0.02 0.00 -1.41 0.00 0.00 60.65 59.36 2rop s ILE 153 Cb -0.12 -0.13 0.04 0.00 0.13 0.00 0.00 42.46 42.38 2rop s ILE 153 CO -0.05 0.09 0.10 -0.55 -1.91 0.00 0.00 174.94 172.63 2rop s SER 154 N 1.20 -0.01 -0.01 4.50 0.15 -0.37 -5.01 113.70 114.15 2rop s SER 154 Ca -0.08 0.21 0.01 0.00 0.70 0.00 0.00 55.95 56.79 2rop s SER 154 Cb -0.13 0.09 -0.00 0.00 -1.71 0.00 0.00 66.02 64.28 2rop s SER 154 CO -0.04 -0.15 -0.04 0.54 1.20 0.00 0.00 173.24 174.76 2rop s VAL 155 N 1.18 0.30 -0.01 4.45 0.11 -1.26 -0.49 120.40 124.68 2rop s VAL 155 Ca -0.09 -0.15 -0.05 0.00 -2.93 0.00 0.00 61.98 58.77 2rop s VAL 155 Cb -0.12 -0.27 0.00 0.00 -1.53 0.00 0.00 36.38 34.46 2rop s VAL 155 CO -0.05 0.09 0.10 -0.94 -3.33 0.00 0.00 175.10 170.97 2rop s SER 156 N -0.01 0.01 0.41 3.54 1.04 -0.54 -4.90 113.70 113.26 2rop s SER 156 Ca 0.01 -0.10 0.22 0.00 0.48 0.00 0.00 55.95 56.56 2rop s SER 156 Cb -0.02 0.20 0.77 0.00 0.10 0.00 0.00 66.02 67.07 2rop s SER 156 CO -0.00 -0.24 1.76 -0.07 0.98 0.00 0.00 173.24 175.67 2rop h LEU 157 N 4.96 0.00 -0.82 2.42 3.38 -1.94 -1.57 115.31 121.74 2rop h LEU 157 Ca -0.29 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.78 2rop h LEU 157 Cb 1.20 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.87 2rop h LEU 157 CO 0.42 0.27 0.45 0.00 0.09 0.00 0.00 178.44 179.67 2rop h ALA 158 N 1.73 1.17 0.00 1.53 0.00 -1.97 -2.12 119.26 119.60 2rop h ALA 158 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2rop h ALA 158 Cb 0.85 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2rop h ALA 158 CO 0.04 0.05 -0.78 0.39 0.00 0.00 0.00 179.25 178.95 2rop n GLU 159 N -4.78 2.67 -2.19 0.00 1.02 -1.26 -5.03 120.64 111.08 2rop n GLU 159 Ca 0.14 -0.03 -0.02 0.00 -0.02 0.00 0.00 57.16 57.23 2rop n GLU 159 Cb 0.30 -1.04 0.01 0.00 -0.02 0.00 0.00 31.44 30.69 2rop n GLU 159 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rop n GLY 160 N 1.47 0.36 2.98 0.62 0.00 -0.80 -4.91 105.19 104.90 2rop n GLY 160 Ca 0.01 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 2rop n GLY 160 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rop s THR 161 N -3.04 0.23 -0.06 2.61 -4.23 -0.63 -0.85 115.64 109.67 2rop s THR 161 Ca 0.00 -0.71 0.03 0.00 -1.18 0.00 0.00 61.69 59.83 2rop s THR 161 Cb -0.00 -0.31 -0.03 0.00 1.34 0.00 0.00 72.50 73.50 2rop s THR 161 CO 0.09 -0.31 -0.13 0.00 -0.54 0.00 0.00 174.62 173.72 2rop s ALA 162 N -1.03 2.70 -0.17 3.99 0.00 0.00 -1.46 121.76 125.79 2rop s ALA 162 Ca -0.10 -0.96 -0.02 0.00 0.00 0.00 0.00 51.96 50.88 2rop s ALA 162 Cb -0.07 -1.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.02 2rop s ALA 162 CO -0.00 0.54 -0.08 -0.08 0.00 0.00 0.00 175.76 176.14 2rop s THR 163 N -0.68 3.34 -0.03 0.00 -1.32 0.35 -0.81 115.64 116.49 2rop s THR 163 Ca 0.10 -0.53 -0.02 0.00 -1.21 0.00 0.00 61.69 60.03 2rop s THR 163 Cb -0.11 -2.47 0.02 0.00 -1.51 0.00 0.00 72.50 68.43 2rop s THR 163 CO 0.01 0.48 0.07 0.54 -2.21 0.00 0.00 174.62 173.51 2rop s VAL 164 N 0.84 -0.03 -0.37 5.08 0.11 -0.53 -1.24 120.40 124.26 2rop s VAL 164 Ca -0.02 0.11 -0.17 0.00 -2.93 0.00 0.00 61.98 58.96 2rop s VAL 164 Cb -0.15 -0.12 0.00 0.00 -1.53 0.00 0.00 36.38 34.58 2rop s VAL 164 CO 0.01 0.04 0.47 -0.22 -3.33 0.00 0.00 175.10 172.08 2rop s LEU 165 N 0.61 4.47 0.31 2.54 1.98 0.22 -1.36 118.68 127.45 2rop s LEU 165 Ca -0.05 -0.22 0.09 0.00 -2.89 0.00 0.00 54.13 51.06 2rop s LEU 165 Cb -0.07 -2.50 -0.04 0.00 0.66 0.00 0.00 46.19 44.24 2rop s LEU 165 CO -0.02 -0.49 0.10 -0.72 -1.89 0.00 0.00 176.35 173.33 2rop s TYR 166 N 2.29 2.73 -0.62 5.38 1.13 0.33 -0.49 117.35 128.09 2rop s TYR 166 Ca 0.16 -0.31 -0.17 0.00 -1.41 0.00 0.00 57.07 55.34 2rop s TYR 166 Cb -0.16 -1.47 0.13 0.00 -1.10 0.00 0.00 41.96 39.36 2rop s TYR 166 CO 0.13 0.45 0.66 -0.80 -2.51 0.00 0.00 175.55 173.48 2rop s ASN 167 N -3.79 6.29 0.12 -0.18 -0.87 -0.22 -1.72 114.94 114.58 2rop s ASN 167 Ca 0.35 -1.77 0.18 0.00 -1.57 0.00 0.00 52.86 50.05 2rop s ASN 167 Cb -0.04 -2.26 0.76 0.00 -0.02 0.00 0.00 41.25 39.68 2rop s ASN 167 CO 0.22 -0.95 1.55 -2.65 -2.57 0.00 0.00 177.10 172.70 2rop n PRO 168 N 5.62 0.09 0.16 -0.60 -0.02 -1.26 -0.81 135.00 138.19 2rop n PRO 168 Ca -0.06 0.36 0.05 0.00 -2.02 0.00 0.00 63.50 61.82 2rop n PRO 168 Cb 0.42 -1.67 0.12 0.00 -0.02 0.00 0.00 33.50 32.35 2rop n PRO 168 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2rop h ALA 169 N 2.35 0.78 0.00 3.55 0.00 -1.93 -3.39 119.26 120.61 2rop h ALA 169 Ca 0.00 -0.36 -0.34 0.00 0.00 0.00 0.00 54.91 54.22 2rop h ALA 169 Cb 0.27 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 2rop h ALA 169 CO 0.00 0.49 -1.91 0.28 0.00 0.00 0.00 179.25 178.11 2rop n VAL 170 N -3.25 1.53 -4.11 0.00 0.31 0.01 -5.04 118.33 107.79 2rop n VAL 170 Ca 0.02 -0.20 -0.15 0.00 -0.01 0.00 0.00 64.34 64.00 2rop n VAL 170 Cb 0.65 -1.98 -0.12 0.00 -0.91 0.00 0.00 33.84 31.48 2rop n VAL 170 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2rop s ILE 171 N -2.46 0.71 -0.02 2.52 2.07 -0.51 -5.01 121.20 118.51 2rop s ILE 171 Ca -0.34 -1.11 -0.07 0.00 -1.41 0.00 0.00 60.65 57.72 2rop s ILE 171 Cb 0.10 -0.74 -0.05 0.00 0.13 0.00 0.00 42.46 41.91 2rop s ILE 171 CO 0.52 -0.31 0.25 -0.55 -1.91 0.00 0.00 174.94 172.94 2rop s SER 172 N -1.56 6.50 0.37 4.50 0.15 -1.26 -4.28 113.70 118.12 2rop s SER 172 Ca -0.07 0.57 0.27 0.00 0.70 0.00 0.00 55.95 57.42 2rop s SER 172 Cb -0.10 -2.10 1.27 0.00 -1.71 0.00 0.00 66.02 63.38 2rop s SER 172 CO 0.01 0.29 1.81 1.55 1.20 0.00 0.00 173.24 178.10 2rop h PRO 173 N 4.22 0.00 0.00 5.44 0.13 -1.99 -1.90 132.00 137.91 2rop h PRO 173 Ca -0.51 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.54 2rop h PRO 173 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2rop h PRO 173 CO 0.64 0.00 -0.38 0.93 -0.23 0.00 0.00 178.00 178.96 2rop h GLU 174 N 0.00 0.00 0.00 0.86 5.08 -2.02 -3.03 114.58 115.47 2rop h GLU 174 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2rop h GLU 174 Cb 0.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 2rop h GLU 174 CO 0.00 0.38 -0.02 0.93 -1.00 0.00 0.00 179.01 179.30 2rop h GLU 175 N 0.00 0.00 0.39 2.33 4.39 -1.76 -3.37 114.58 116.56 2rop h GLU 175 Ca -0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2rop h GLU 175 Cb 0.81 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 2rop h GLU 175 CO 0.05 0.02 -0.19 -0.07 -1.16 0.00 0.00 179.01 177.67 2rop h LEU 176 N 0.00 -0.44 -1.17 1.33 3.38 -1.61 -3.07 115.31 113.72 2rop h LEU 176 Ca -0.00 -0.13 0.08 0.00 0.09 0.00 0.00 57.88 57.92 2rop h LEU 176 Cb 0.83 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.63 2rop h LEU 176 CO 0.00 -0.06 0.58 0.08 0.09 0.00 0.00 178.44 179.13 2rop h ARG 177 N -0.89 0.92 0.00 1.13 0.11 -1.74 -1.94 114.38 111.97 2rop h ARG 177 Ca -0.05 -0.06 -0.01 0.00 0.10 0.00 0.00 59.98 59.96 2rop h ARG 177 Cb 0.55 -0.21 -0.00 0.00 1.11 0.00 0.00 29.97 31.42 2rop h ARG 177 CO 0.09 0.61 -0.04 0.00 0.10 0.00 0.00 179.97 180.73 2rop h ALA 178 N 1.54 1.78 -0.12 0.08 0.00 -1.71 -1.19 119.26 119.64 2rop h ALA 178 Ca 0.40 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.13 2rop h ALA 178 Cb 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2rop h ALA 178 CO -0.16 0.05 -0.58 0.00 0.00 0.00 0.00 179.25 178.55 2rop h ALA 179 N 1.96 0.78 -0.21 0.00 0.00 -1.25 0.12 119.26 120.66 2rop h ALA 179 Ca -0.00 -0.53 -0.20 0.00 0.00 0.00 0.00 54.91 54.18 2rop h ALA 179 Cb 0.07 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.78 2rop h ALA 179 CO 0.00 0.71 -0.65 0.82 0.00 0.00 0.00 179.25 180.13 2rop h ILE 180 N 0.29 1.28 0.00 0.00 5.03 -1.41 -2.54 117.51 120.15 2rop h ILE 180 Ca -0.00 -1.84 -0.05 0.00 -0.12 0.00 0.00 64.86 62.84 2rop h ILE 180 Cb 1.10 1.85 -0.01 0.00 -3.03 0.00 0.00 36.82 36.73 2rop h ILE 180 CO 0.10 0.59 -0.26 -0.33 -0.68 0.00 0.00 178.15 177.57 2rop h GLU 181 N 0.55 0.00 0.00 2.37 5.08 -1.16 -1.96 114.58 119.47 2rop h GLU 181 Ca -0.02 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 2rop h GLU 181 Cb 1.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 2rop h GLU 181 CO 0.14 0.26 -0.40 0.22 -1.00 0.00 0.00 179.01 178.23 2rop h ASP 182 N 0.00 0.00 0.09 1.42 3.58 -0.72 -3.26 116.42 117.52 2rop h ASP 182 Ca -0.00 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.21 2rop h ASP 182 Cb 0.61 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.67 2rop h ASP 182 CO 0.03 0.40 -0.94 -0.03 -2.88 0.00 0.00 179.24 175.82 2rop h MET 183 N 0.00 0.61 0.00 0.28 4.05 -0.93 -3.48 114.93 115.46 2rop h MET 183 Ca -0.00 -0.61 0.00 0.00 -0.28 0.00 0.00 59.70 58.81 2rop h MET 183 Cb 0.89 0.16 0.00 0.00 -0.80 0.00 0.00 31.60 31.85 2rop h MET 183 CO 0.05 1.22 0.00 0.41 0.23 0.00 0.00 176.91 178.82 2rop n GLY 184 N 0.92 -0.50 0.00 1.39 0.00 -0.95 -5.11 105.19 100.94 2rop n GLY 184 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2rop n GLY 184 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2rop n PHE 185 N 0.00 -0.75 -4.88 1.61 3.72 -1.09 -5.02 117.46 111.05 2rop n PHE 185 Ca 0.00 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.13 2rop n PHE 185 Cb 0.00 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.38 2rop n PHE 185 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2rop s GLU 186 N -0.30 2.01 0.01 -1.08 0.41 -1.26 -4.14 118.70 114.35 2rop s GLU 186 Ca 0.00 -0.63 0.02 0.00 -0.41 0.00 0.00 54.97 53.94 2rop s GLU 186 Cb 0.00 -1.68 -0.01 0.00 -1.78 0.00 0.00 34.13 30.66 2rop s GLU 186 CO 0.00 0.20 -0.06 0.00 -0.49 0.00 0.00 175.26 174.92 2rop s ALA 187 N 0.19 0.44 -0.01 5.21 0.00 -1.26 -0.56 121.76 125.76 2rop s ALA 187 Ca -0.08 -0.41 0.04 0.00 0.00 0.00 0.00 51.96 51.51 2rop s ALA 187 Cb -0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 2rop s ALA 187 CO 0.04 0.05 -0.13 0.45 0.00 0.00 0.00 175.76 176.16 2rop s SER 188 N -0.66 1.59 -0.42 0.00 0.15 0.32 -4.89 113.70 109.79 2rop s SER 188 Ca -0.03 -0.25 -0.23 0.00 0.70 0.00 0.00 55.95 56.14 2rop s SER 188 Cb -0.05 -0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.09 2rop s SER 188 CO -0.00 0.16 0.79 0.54 1.20 0.00 0.00 173.24 175.93 2rop s VAL 189 N -0.29 4.67 -1.54 4.45 0.11 -1.26 -0.63 120.40 125.91 2rop s VAL 189 Ca 0.05 0.62 0.12 0.00 -2.93 0.00 0.00 61.98 59.84 2rop s VAL 189 Cb -0.06 -4.28 0.10 0.00 -1.53 0.00 0.00 36.38 30.61 2rop s VAL 189 CO -0.00 -0.61 0.89 1.33 -3.33 0.00 0.00 175.10 173.37