#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 2.76 -0.03 1.55 -4.23 -1.26 -1.93 115.64 112.51 2rop s THR 21 Ca 0.00 -1.72 -0.02 0.00 -1.18 0.00 0.00 61.69 58.78 2rop s THR 21 Cb 0.00 -2.96 0.01 0.00 1.34 0.00 0.00 72.50 70.89 2rop s THR 21 CO 0.00 -0.13 0.06 -0.22 -0.54 0.00 0.00 174.62 173.79 2rop s LEU 22 N -3.86 1.56 -0.28 4.79 0.20 -1.22 -4.99 118.68 114.88 2rop s LEU 22 Ca 0.39 0.12 -0.12 0.00 0.69 0.00 0.00 54.13 55.21 2rop s LEU 22 Cb -0.01 0.17 -0.05 0.00 -0.43 0.00 0.00 46.19 45.88 2rop s LEU 22 CO 0.22 -0.05 0.23 -1.10 -0.29 0.00 0.00 176.35 175.36 2rop s GLN 23 N 0.31 3.97 -0.05 1.98 -1.52 -1.26 -4.12 119.66 118.97 2rop s GLN 23 Ca -0.02 -0.25 -0.04 0.00 -1.95 0.00 0.00 55.36 53.10 2rop s GLN 23 Cb -0.03 -3.66 0.01 0.00 -0.22 0.00 0.00 33.01 29.11 2rop s GLN 23 CO -0.01 -0.19 0.12 -0.48 -0.25 0.00 0.00 175.29 174.47 2rop s LEU 24 N 1.81 1.49 -0.06 2.90 2.34 -1.26 -4.93 118.68 120.98 2rop s LEU 24 Ca 0.09 0.24 -0.04 0.00 0.06 0.00 0.00 54.13 54.48 2rop s LEU 24 Cb -0.16 0.40 -0.04 0.00 -0.56 0.00 0.00 46.19 45.83 2rop s LEU 24 CO 0.11 -0.05 0.13 -0.60 -1.06 0.00 0.00 176.35 174.88 2rop s ARG 25 N 0.15 3.32 0.14 1.48 6.06 -1.02 -1.36 118.95 127.72 2rop s ARG 25 Ca -0.01 -0.29 0.05 0.00 -2.50 0.00 0.00 55.73 52.98 2rop s ARG 25 Cb -0.02 -3.06 -0.04 0.00 0.06 0.00 0.00 34.95 31.90 2rop s ARG 25 CO -0.00 0.71 0.07 0.42 -2.50 0.00 0.00 175.30 174.00 2rop s ILE 26 N -1.15 4.24 -0.08 4.11 -1.09 -1.26 -0.13 121.20 125.84 2rop s ILE 26 Ca 0.21 -1.09 -0.02 0.00 -2.23 0.00 0.00 60.65 57.52 2rop s ILE 26 Cb -0.12 -3.11 -0.03 0.00 -1.58 0.00 0.00 42.46 37.61 2rop s ILE 26 CO 0.11 -0.03 0.02 -0.62 -1.23 0.00 0.00 174.94 173.19 2rop s ASP 27 N -2.80 5.37 0.00 3.58 2.15 0.58 -4.55 116.67 121.00 2rop s ASP 27 Ca 0.29 0.18 0.00 0.00 0.43 0.00 0.00 52.55 53.45 2rop s ASP 27 Cb -0.11 -1.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.98 2rop s ASP 27 CO 0.21 0.38 0.00 0.61 -0.17 0.00 0.00 175.17 176.20 2rop n GLY 28 N 2.08 0.80 0.00 2.66 0.00 -1.26 -3.45 105.19 106.02 2rop n GLY 28 Ca -0.19 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.25 0.34 0.01 1.61 0.00 -1.26 -3.79 117.12 111.78 2rop n MET 29 Ca 0.00 0.09 0.23 0.00 0.00 0.00 0.00 57.70 58.01 2rop n MET 29 Cb 0.00 -1.50 0.70 0.00 0.00 0.00 0.00 33.22 32.42 2rop n MET 29 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 175.97 177.09 2rop h HIS 30 N 0.00 0.00 -3.86 3.17 2.07 -1.94 -3.38 115.15 111.20 2rop h HIS 30 Ca 0.00 0.00 -0.68 0.00 -2.85 0.00 0.00 60.37 56.84 2rop h HIS 30 Cb 0.09 0.00 -0.24 0.00 2.57 0.00 0.00 27.41 29.84 2rop h HIS 30 CO 0.00 0.00 -0.77 0.00 -3.07 0.00 0.00 177.93 174.09 2rop h LYS 32 N 5.64 0.00 -0.94 0.00 6.56 -1.93 -2.20 116.57 123.72 2rop h LYS 32 Ca -0.42 0.00 0.25 0.00 -1.06 0.00 0.00 60.65 59.43 2rop h LYS 32 Cb 1.17 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.78 2rop h LYS 32 CO 0.51 0.00 0.65 0.77 -2.06 0.00 0.00 179.45 179.33 2rop h SER 33 N 0.00 0.15 0.48 0.86 0.02 -1.95 -1.70 113.55 111.42 2rop h SER 33 Ca 0.00 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 2rop h SER 33 Cb 0.20 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2rop h SER 33 CO 0.00 0.05 -0.23 0.00 -1.14 0.00 0.00 176.83 175.51 2rop h VAL 35 N -1.05 1.06 0.80 0.00 3.04 -1.72 -3.19 116.25 115.18 2rop h VAL 35 Ca -0.07 -0.47 -0.04 0.00 -1.01 0.00 0.00 66.70 65.12 2rop h VAL 35 Cb 0.58 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.12 2rop h VAL 35 CO 0.11 0.13 -0.45 0.25 -1.01 0.00 0.00 177.57 176.60 2rop h LEU 36 N 0.00 -1.10 -1.35 3.16 7.12 -1.31 0.18 115.31 122.01 2rop h LEU 36 Ca -0.00 0.05 -0.06 0.00 0.13 0.00 0.00 57.88 58.00 2rop h LEU 36 Cb 0.24 0.31 -0.01 0.00 -0.53 0.00 0.00 40.66 40.67 2rop h LEU 36 CO 0.02 -0.71 -0.23 -0.55 -0.13 0.00 0.00 178.44 176.84 2rop h ASN 37 N -1.15 0.14 0.22 1.25 7.08 -1.61 -0.10 115.58 121.41 2rop h ASN 37 Ca -0.11 -0.03 -0.01 0.00 -3.08 0.00 0.00 56.30 53.07 2rop h ASN 37 Cb 0.91 -0.04 0.00 0.00 -2.08 0.00 0.00 38.32 37.11 2rop h ASN 37 CO 0.14 0.38 -0.11 0.40 -2.08 0.00 0.00 177.43 176.16 2rop h ILE 38 N 0.13 0.82 -0.66 6.14 2.04 -1.52 -2.91 117.51 121.56 2rop h ILE 38 Ca 0.02 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.63 2rop h ILE 38 Cb 0.48 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 2rop h ILE 38 CO 0.03 0.05 0.22 -0.08 0.00 0.00 0.00 178.15 178.37 2rop h GLU 39 N -0.40 0.99 -0.32 2.37 4.22 -0.46 -0.93 114.58 120.05 2rop h GLU 39 Ca -0.03 -0.19 -0.08 0.00 0.08 0.00 0.00 59.36 59.14 2rop h GLU 39 Cb 0.30 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2rop h GLU 39 CO 0.05 0.84 -0.12 1.49 -2.18 0.00 0.00 179.01 179.09 2rop h GLU 40 N 0.96 0.55 0.00 1.92 4.57 -1.03 -3.22 114.58 118.33 2rop h GLU 40 Ca 0.22 -0.16 -0.14 0.00 -1.18 0.00 0.00 59.36 58.10 2rop h GLU 40 Cb 0.26 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 2rop h GLU 40 CO -0.01 0.66 -1.56 0.09 -1.18 0.00 0.00 179.01 177.01 2rop n ASN 41 N -4.19 0.62 -4.49 1.04 3.02 -1.10 -4.91 115.26 105.24 2rop n ASN 41 Ca 0.01 0.26 -0.36 0.00 -0.03 0.00 0.00 54.58 54.46 2rop n ASN 41 Cb 0.33 0.60 -0.12 0.00 -0.61 0.00 0.00 39.78 39.98 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 -3.04 4.40 0.00 2.41 -1.09 -0.37 -4.30 121.20 119.21 2rop s ILE 42 Ca -0.04 -0.15 0.00 0.00 -2.23 0.00 0.00 60.65 58.23 2rop s ILE 42 Cb 0.09 -3.03 0.00 0.00 -1.58 0.00 0.00 42.46 37.94 2rop s ILE 42 CO 0.83 0.37 0.00 0.61 -1.23 0.00 0.00 174.94 175.52 2rop n GLY 43 N 4.53 1.48 0.21 6.18 0.00 -1.26 -4.49 105.19 111.83 2rop n GLY 43 Ca -0.16 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.01 2rop n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rop n GLN 44 N 0.00 1.22 -0.68 1.61 10.64 -1.26 -4.10 117.38 124.81 2rop n GLN 44 Ca 0.00 -0.42 -0.06 0.00 -1.83 0.00 0.00 57.00 54.69 2rop n GLN 44 Cb 0.00 -1.49 0.04 0.00 -0.86 0.00 0.00 30.24 27.93 2rop n GLN 44 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2rop n LEU 45 N -0.52 0.00 0.00 2.61 4.77 -1.23 -5.09 117.00 117.54 2rop n LEU 45 Ca 0.21 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 2rop n LEU 45 Cb 0.23 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2rop n LEU 45 CO 0.18 -0.69 0.10 -0.11 -1.33 0.00 0.00 177.39 175.54 2rop n LEU 46 N 0.00 0.96 0.11 2.23 7.94 -1.26 -4.57 117.00 122.41 2rop n LEU 46 Ca 0.04 0.20 -0.03 0.00 -1.11 0.00 0.00 56.01 55.11 2rop n LEU 46 Cb 0.14 0.00 0.09 0.00 0.53 0.00 0.00 43.42 44.18 2rop n LEU 46 CO 0.10 0.00 0.40 1.23 -1.11 0.00 0.00 177.39 178.01 2rop h GLY 47 N 0.00 0.03 -4.98 -3.96 0.00 -1.90 -3.42 103.07 88.83 2rop h GLY 47 Ca 0.00 -0.04 -0.56 0.00 0.00 0.00 0.00 47.33 46.73 2rop h GLY 47 CO 0.00 0.04 0.27 0.14 0.00 0.00 0.00 176.54 176.99 2rop s VAL 48 N -3.39 4.94 -0.02 4.60 1.01 -1.26 -1.85 120.40 124.43 2rop s VAL 48 Ca -0.01 1.67 0.06 0.00 0.00 0.00 0.00 61.98 63.70 2rop s VAL 48 Cb 0.12 -4.15 -0.09 0.00 0.00 0.00 0.00 36.38 32.26 2rop s VAL 48 CO 0.78 0.15 0.10 0.00 0.00 0.00 0.00 175.10 176.13 2rop n GLN 49 N 4.33 1.08 -4.02 2.72 10.64 -0.73 -3.56 117.38 127.83 2rop n GLN 49 Ca 0.03 -0.04 -0.10 0.00 -1.83 0.00 0.00 57.00 55.06 2rop n GLN 49 Cb 0.50 -1.14 -0.08 0.00 -0.86 0.00 0.00 30.24 28.66 2rop n GLN 49 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2rop s SER 50 N -3.00 0.10 -0.00 2.61 0.15 -1.04 -4.71 113.70 107.80 2rop s SER 50 Ca -0.02 -0.99 -0.01 0.00 0.70 0.00 0.00 55.95 55.62 2rop s SER 50 Cb 0.03 0.41 -0.00 0.00 -1.71 0.00 0.00 66.02 64.75 2rop s SER 50 CO 0.24 -0.87 0.02 -0.51 1.20 0.00 0.00 173.24 173.32 2rop s ILE 51 N -4.01 0.02 0.05 6.45 1.10 -1.26 -2.14 121.20 121.42 2rop s ILE 51 Ca 0.21 -0.20 -0.04 0.00 -0.51 0.00 0.00 60.65 60.10 2rop s ILE 51 Cb 0.04 -0.10 -0.02 0.00 0.15 0.00 0.00 42.46 42.53 2rop s ILE 51 CO 0.02 -0.11 0.07 -1.58 -2.11 0.00 0.00 174.94 171.23 2rop s GLN 52 N -0.33 0.60 -0.10 3.50 0.74 0.23 -4.99 119.66 119.32 2rop s GLN 52 Ca -0.04 -0.88 0.02 0.00 0.05 0.00 0.00 55.36 54.51 2rop s GLN 52 Cb -0.02 0.23 -0.02 0.00 1.10 0.00 0.00 33.01 34.30 2rop s GLN 52 CO -0.00 -0.14 -0.16 0.08 -0.55 0.00 0.00 175.29 174.52 2rop s VAL 53 N -2.98 2.86 -0.46 1.34 1.01 -1.26 -0.62 120.40 120.28 2rop s VAL 53 Ca -0.02 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.27 2rop s VAL 53 Cb 0.01 -2.16 0.40 0.00 0.00 0.00 0.00 36.38 34.64 2rop s VAL 53 CO -0.06 0.55 1.04 -1.20 0.00 0.00 0.00 175.10 175.43 2rop n SER 54 N 3.16 4.21 0.27 3.32 7.64 -0.70 -4.85 113.62 126.66 2rop n SER 54 Ca -0.18 -3.59 0.17 0.00 1.01 0.00 0.00 58.87 56.28 2rop n SER 54 Cb 0.53 -0.50 0.72 0.00 -1.01 0.00 0.00 64.21 63.94 2rop n SER 54 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2rop h LEU 55 N 2.73 0.00 -1.35 -3.43 7.12 -1.91 -1.18 115.31 117.29 2rop h LEU 55 Ca 0.21 0.00 0.06 0.00 0.13 0.00 0.00 57.88 58.28 2rop h LEU 55 Cb 0.84 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.93 2rop h LEU 55 CO 0.80 0.00 0.49 -0.08 -0.13 0.00 0.00 178.44 179.51 2rop h GLU 56 N 0.00 0.78 -0.01 1.25 4.81 -1.91 -2.41 114.58 117.09 2rop h GLU 56 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2rop h GLU 56 Cb 0.44 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.65 2rop h GLU 56 CO 0.00 0.52 -0.70 -1.71 -0.73 0.00 0.00 179.01 176.39 2rop n ASN 57 N -4.48 1.22 -0.42 1.04 2.85 -0.56 -4.99 115.26 109.92 2rop n ASN 57 Ca 0.11 -1.02 -0.05 0.00 -0.11 0.00 0.00 54.58 53.50 2rop n ASN 57 Cb 0.21 0.65 -0.02 0.00 1.24 0.00 0.00 39.78 41.85 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 -0.99 -0.78 -3.51 1.20 5.02 -0.56 -5.03 118.16 113.51 2rop n LYS 58 Ca 0.07 0.58 -0.20 0.00 -2.02 0.00 0.00 58.31 56.73 2rop n LYS 58 Cb 0.37 -4.39 -0.01 0.00 -0.02 0.00 0.00 35.03 30.98 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 -2.00 4.38 0.42 -0.18 -4.23 -1.00 -4.55 115.64 108.48 2rop s THR 59 Ca 0.00 -0.90 0.07 0.00 -1.18 0.00 0.00 61.69 59.68 2rop s THR 59 Cb 0.00 -3.54 0.01 0.00 1.34 0.00 0.00 72.50 70.31 2rop s THR 59 CO 0.00 -0.24 0.58 0.00 -0.54 0.00 0.00 174.62 174.42 2rop s ALA 60 N -2.19 4.40 -0.12 3.99 0.00 -0.46 -1.73 121.76 125.65 2rop s ALA 60 Ca 0.43 -1.59 -0.04 0.00 0.00 0.00 0.00 51.96 50.76 2rop s ALA 60 Cb -0.09 -1.69 0.05 0.00 0.00 0.00 0.00 23.12 21.38 2rop s ALA 60 CO 0.32 -0.29 0.07 -1.14 0.00 0.00 0.00 175.76 174.72 2rop s GLN 61 N -4.37 0.05 -0.15 0.00 2.00 0.21 -4.10 119.66 113.30 2rop s GLN 61 Ca 0.53 0.09 -0.05 0.00 -2.00 0.00 0.00 55.36 53.93 2rop s GLN 61 Cb -0.10 -1.30 -0.04 0.00 0.80 0.00 0.00 33.01 32.38 2rop s GLN 61 CO 0.33 -0.52 0.03 0.54 -0.50 0.00 0.00 175.29 175.17 2rop s VAL 62 N 2.13 4.50 -0.46 1.34 0.11 -1.26 -0.60 120.40 126.16 2rop s VAL 62 Ca 0.03 -0.15 -0.06 0.00 -2.93 0.00 0.00 61.98 58.87 2rop s VAL 62 Cb -0.14 -2.97 0.12 0.00 -1.53 0.00 0.00 36.38 31.85 2rop s VAL 62 CO -0.06 0.52 0.30 -0.54 -3.33 0.00 0.00 175.10 171.98 2rop s LYS 63 N -0.05 2.30 0.37 1.54 1.02 -0.91 -3.46 119.74 120.56 2rop s LYS 63 Ca 0.05 -1.86 0.04 0.00 0.02 0.00 0.00 55.97 54.22 2rop s LYS 63 Cb -0.12 -3.78 -0.02 0.00 -0.52 0.00 0.00 37.83 33.39 2rop s LYS 63 CO 0.02 -1.15 0.15 2.48 -0.92 0.00 0.00 175.35 175.93 2rop n TYR 64 N 4.66 0.05 -5.02 3.18 4.11 -0.81 -1.78 117.16 121.55 2rop n TYR 64 Ca -0.04 -2.45 -0.27 0.00 -0.00 0.00 0.00 57.90 55.14 2rop n TYR 64 Cb 0.41 0.02 -0.16 0.00 -0.00 0.00 0.00 39.34 39.61 2rop n TYR 64 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 2rop s ASP 65 N -3.32 2.44 0.00 9.48 1.11 -0.77 -0.61 116.67 125.00 2rop s ASP 65 Ca 0.21 -0.38 0.00 0.00 0.18 0.00 0.00 52.55 52.56 2rop s ASP 65 Cb 0.01 -0.27 0.00 0.00 1.07 0.00 0.00 42.92 43.73 2rop s ASP 65 CO 0.15 0.26 0.79 -0.81 1.18 0.00 0.00 175.17 176.74 2rop n PRO 66 N 2.56 0.85 0.07 8.23 -0.04 -1.26 -3.69 135.00 141.72 2rop n PRO 66 Ca -0.15 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.42 2rop n PRO 66 Cb 0.53 -1.06 -0.02 0.00 -0.04 0.00 0.00 33.50 32.91 2rop n PRO 66 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2rop n SER 67 N -0.42 0.66 0.00 3.54 3.41 -1.26 -4.52 113.62 115.03 2rop n SER 67 Ca 0.00 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2rop n SER 67 Cb 0.03 0.75 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 2rop n SER 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rop n THR 69 N -1.01 0.00 -3.46 0.00 5.66 -1.25 -4.76 114.28 109.46 2rop n THR 69 Ca 0.00 -1.67 -0.14 0.00 -3.05 0.00 0.00 64.05 59.20 2rop n THR 69 Cb 0.01 0.93 -0.03 0.00 -1.55 0.00 0.00 70.33 69.69 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 -2.82 -0.58 0.29 1.09 1.04 -1.26 -4.57 113.70 106.89 2rop s SER 70 Ca 0.27 0.24 0.02 0.00 0.48 0.00 0.00 55.95 56.96 2rop s SER 70 Cb 0.00 0.56 0.72 0.00 0.10 0.00 0.00 66.02 67.40 2rop s SER 70 CO 0.19 -0.82 1.62 -0.65 0.98 0.00 0.00 173.24 174.56 2rop h PRO 71 N 2.33 0.11 -0.54 4.02 0.11 -2.00 -0.67 132.00 135.36 2rop h PRO 71 Ca -0.31 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.73 2rop h PRO 71 Cb 1.25 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2rop h PRO 71 CO 0.38 0.07 0.06 -0.39 -0.21 0.00 0.00 178.00 177.91 2rop h VAL 72 N 0.12 1.24 -0.26 3.15 -1.51 -1.99 -0.27 116.25 116.73 2rop h VAL 72 Ca 0.56 -0.96 -0.19 0.00 -1.23 0.00 0.00 66.70 64.88 2rop h VAL 72 Cb 1.16 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 31.08 2rop h VAL 72 CO -0.75 0.35 -0.57 0.00 -1.23 0.00 0.00 177.57 175.36 2rop h ALA 73 N 1.24 0.42 -0.22 5.19 0.00 -1.68 -2.94 119.26 121.27 2rop h ALA 73 Ca 0.17 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 2rop h ALA 73 Cb 0.41 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2rop h ALA 73 CO 0.01 0.66 0.12 -0.07 0.00 0.00 0.00 179.25 179.97 2rop h LEU 74 N 0.62 0.27 -0.05 0.00 3.38 -1.00 -0.73 115.31 117.81 2rop h LEU 74 Ca 0.00 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.94 2rop h LEU 74 Cb 1.19 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.82 2rop h LEU 74 CO 0.13 0.27 -0.29 -0.61 0.09 0.00 0.00 178.44 178.03 2rop h GLN 75 N 0.25 -0.39 -0.33 1.13 4.15 -1.10 -1.79 115.11 117.03 2rop h GLN 75 Ca 0.08 0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.50 2rop h GLN 75 Cb 0.05 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 2rop h GLN 75 CO -0.01 -0.26 0.12 0.00 -1.93 0.00 0.00 178.83 176.74 2rop h ARG 76 N -0.41 0.47 0.36 1.69 3.08 -1.35 -2.71 114.38 115.51 2rop h ARG 76 Ca 0.07 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 2rop h ARG 76 Cb 0.51 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.48 2rop h ARG 76 CO -0.28 0.41 -0.17 0.00 -1.07 0.00 0.00 179.97 178.86 2rop h ALA 77 N 1.66 -0.48 0.00 0.04 0.00 -0.78 -3.37 119.26 116.33 2rop h ALA 77 Ca 0.12 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2rop h ALA 77 Cb 0.13 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2rop h ALA 77 CO -0.01 -0.52 -0.45 -0.84 0.00 0.00 0.00 179.25 177.44 2rop h ILE 78 N -0.98 1.03 0.00 0.00 3.07 -1.29 -3.30 117.51 116.04 2rop h ILE 78 Ca -0.05 -1.71 -0.07 0.00 1.55 0.00 0.00 64.86 64.58 2rop h ILE 78 Cb 0.52 2.01 -0.01 0.00 -0.27 0.00 0.00 36.82 39.06 2rop h ILE 78 CO 0.08 0.44 -0.34 -0.08 -1.05 0.00 0.00 178.15 177.20 2rop h GLU 79 N 0.00 0.00 -0.25 0.16 4.81 -1.64 -2.90 114.58 114.76 2rop h GLU 79 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2rop h GLU 79 Cb 0.97 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.35 2rop h GLU 79 CO 0.06 0.34 0.00 0.00 -0.73 0.00 0.00 179.01 178.67 2rop n ALA 80 N -2.41 2.49 0.00 2.92 0.00 -1.24 -4.18 120.51 118.09 2rop n ALA 80 Ca -0.02 -0.58 -0.09 0.00 0.00 0.00 0.00 53.44 52.75 2rop n ALA 80 Cb 0.40 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.78 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 2.22 -0.58-10.31 0.00 3.38 -1.71 -3.43 115.31 104.88 2rop h LEU 81 Ca 0.00 0.10 -0.49 0.00 0.09 0.00 0.00 57.88 57.58 2rop h LEU 81 Cb 0.50 0.27 0.15 0.00 0.09 0.00 0.00 40.66 41.66 2rop h LEU 81 CO 0.00 -0.24 0.25 -2.16 0.09 0.00 0.00 178.44 176.38 2rop s PRO 82 N -6.12 1.39 -0.21 1.13 0.04 -1.26 -4.93 135.00 125.03 2rop s PRO 82 Ca -0.15 0.99 -0.06 0.00 0.04 0.00 0.00 61.00 61.82 2rop s PRO 82 Cb 0.10 -1.81 -0.21 0.00 0.04 0.00 0.00 34.50 32.62 2rop s PRO 82 CO 0.67 -2.20 3.45 -0.35 0.04 0.00 0.00 177.00 178.62 2rop n PRO 83 N -3.88 2.23 -2.11 0.56 -0.04 -1.26 -4.51 135.00 125.99 2rop n PRO 83 Ca 0.08 -1.30 -0.03 0.00 -0.04 0.00 0.00 63.50 62.21 2rop n PRO 83 Cb 0.54 -2.09 0.02 0.00 -0.04 0.00 0.00 33.50 31.92 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 2.39 0.37 0.83 0.55 0.00 -1.26 -5.02 105.19 103.05 2rop n GLY 84 Ca 0.47 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.56 0.71 -4.76 1.61 2.85 -1.26 -5.07 115.26 107.78 2rop n ASN 85 Ca -0.04 0.00 -0.36 0.00 -0.11 0.00 0.00 54.58 54.07 2rop n ASN 85 Cb 0.53 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.47 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 -1.68 3.41 0.14 1.20 0.08 -1.26 -4.74 117.98 115.12 2rop s PHE 86 Ca 0.00 0.33 0.07 0.00 0.12 0.00 0.00 56.93 57.45 2rop s PHE 86 Cb 0.00 -2.02 -0.04 0.00 -0.57 0.00 0.00 43.02 40.39 2rop s PHE 86 CO 0.00 0.44 -0.05 0.21 -0.10 0.00 0.00 175.22 175.73 2rop s LYS 87 N -0.29 2.28 -0.13 0.44 2.47 -1.22 -4.81 119.74 118.48 2rop s LYS 87 Ca 0.10 -1.06 -0.06 0.00 -1.56 0.00 0.00 55.97 53.38 2rop s LYS 87 Cb -0.12 -2.34 -0.04 0.00 -1.46 0.00 0.00 37.83 33.87 2rop s LYS 87 CO 0.01 0.48 0.11 0.08 0.16 0.00 0.00 175.35 176.19 2rop s VAL 88 N -1.49 5.23 -0.30 4.02 1.01 -1.26 -0.31 120.40 127.30 2rop s VAL 88 Ca 0.25 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.28 2rop s VAL 88 Cb -0.10 -3.28 0.02 0.00 0.00 0.00 0.00 36.38 33.02 2rop s VAL 88 CO 0.16 0.59 0.06 -0.44 0.00 0.00 0.00 175.10 175.47 2rop s SER 89 N -0.74 5.04 0.16 3.32 0.01 0.82 -4.97 113.70 117.34 2rop s SER 89 Ca 0.13 -0.90 0.02 0.00 1.31 0.00 0.00 55.95 56.51 2rop s SER 89 Cb -0.12 -1.83 0.02 0.00 0.21 0.00 0.00 66.02 64.30 2rop s SER 89 CO 0.03 -0.23 0.15 0.18 0.41 0.00 0.00 173.24 173.78 2rop n LEU 90 N 4.80 0.00 0.00 2.44 7.99 -1.26 -2.44 117.00 128.53 2rop n LEU 90 Ca -0.14 -0.80 0.00 0.00 -0.01 0.00 0.00 56.01 55.06 2rop n LEU 90 Cb 0.46 -0.04 0.00 0.00 -0.11 0.00 0.00 43.42 43.73 2rop n LEU 90 CO 0.30 -0.41 0.00 0.41 -1.51 0.00 0.00 177.39 176.18 2rop n THR 120 N -1.02 0.00 -3.84 -5.08 -1.04 -1.26 -5.08 114.28 96.96 2rop n THR 120 Ca 0.01 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.83 2rop n THR 120 Cb 0.18 -0.00 -0.17 0.00 -1.82 0.00 0.00 70.33 68.52 2rop n THR 120 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2rop s SER 122 N 1.42 0.31 -0.08 0.00 0.15 -0.15 -4.93 113.70 110.42 2rop s SER 122 Ca -0.04 -0.68 0.01 0.00 0.70 0.00 0.00 55.95 55.93 2rop s SER 122 Cb -0.13 0.17 -0.03 0.00 -1.71 0.00 0.00 66.02 64.32 2rop s SER 122 CO -0.03 -0.46 -0.09 -0.89 1.20 0.00 0.00 173.24 172.98 2rop s THR 123 N -2.64 3.54 0.13 6.45 2.01 -1.26 -0.66 115.64 123.21 2rop s THR 123 Ca -0.05 -0.53 0.00 0.00 0.31 0.00 0.00 61.69 61.43 2rop s THR 123 Cb -0.01 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.00 2rop s THR 123 CO -0.05 0.58 0.01 0.28 -0.69 0.00 0.00 174.62 174.74 2rop s THR 124 N -0.53 0.41 -0.17 -0.82 -1.32 -0.72 -5.00 115.64 107.50 2rop s THR 124 Ca 0.08 -1.93 -0.04 0.00 -1.21 0.00 0.00 61.69 58.60 2rop s THR 124 Cb -0.12 -1.95 -0.02 0.00 -1.51 0.00 0.00 72.50 68.90 2rop s THR 124 CO 0.02 -0.60 -0.04 -0.22 -2.21 0.00 0.00 174.62 171.57 2rop s LEU 125 N -3.08 3.16 0.01 9.08 1.98 -1.26 -1.72 118.68 126.86 2rop s LEU 125 Ca 0.20 -0.19 0.04 0.00 -2.89 0.00 0.00 54.13 51.29 2rop s LEU 125 Cb 0.07 -1.77 -0.03 0.00 0.66 0.00 0.00 46.19 45.12 2rop s LEU 125 CO 0.00 0.13 -0.10 -0.63 -1.89 0.00 0.00 176.35 173.87 2rop s ILE 126 N 0.58 3.42 -0.22 6.68 -1.09 -0.02 -3.02 121.20 127.52 2rop s ILE 126 Ca -0.03 -0.89 -0.07 0.00 -2.23 0.00 0.00 60.65 57.44 2rop s ILE 126 Cb -0.14 -2.48 -0.03 0.00 -1.58 0.00 0.00 42.46 38.23 2rop s ILE 126 CO 0.03 0.37 0.05 0.00 -1.23 0.00 0.00 174.94 174.16 2rop s ALA 127 N -0.98 3.15 -0.00 9.38 0.00 -0.20 -0.98 121.76 132.12 2rop s ALA 127 Ca 0.17 -1.03 0.04 0.00 0.00 0.00 0.00 51.96 51.13 2rop s ALA 127 Cb -0.11 -1.96 -0.01 0.00 0.00 0.00 0.00 23.12 21.04 2rop s ALA 127 CO 0.07 -0.29 -0.11 0.42 0.00 0.00 0.00 175.76 175.85 2rop s ILE 128 N 1.25 0.88 -0.51 0.00 1.01 0.18 -0.30 121.20 123.72 2rop s ILE 128 Ca 0.04 -0.54 0.07 0.00 0.00 0.00 0.00 60.65 60.23 2rop s ILE 128 Cb -0.15 -0.75 0.28 0.00 0.01 0.00 0.00 42.46 41.86 2rop s ILE 128 CO 0.03 0.20 0.71 0.00 0.00 0.00 0.00 174.94 175.88 2rop n ALA 129 N 2.68 3.35 -2.67 9.38 0.00 0.25 -4.71 120.51 128.79 2rop n ALA 129 Ca -0.14 -4.12 -0.04 0.00 0.00 0.00 0.00 53.44 49.13 2rop n ALA 129 Cb 0.56 -0.85 0.02 0.00 0.00 0.00 0.00 19.45 19.18 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 0.73 -0.23 0.61 0.00 0.00 -1.26 -3.70 105.19 101.34 2rop n GLY 130 Ca 0.27 -0.04 -0.07 0.00 0.00 0.00 0.00 46.02 46.17 2rop n GLY 130 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2rop n MET 131 N -0.54 0.25 0.00 1.61 2.00 -1.26 -4.88 117.12 114.31 2rop n MET 131 Ca -0.22 0.10 0.00 0.00 0.00 0.00 0.00 57.70 57.59 2rop n MET 131 Cb 0.69 -0.93 0.00 0.00 0.00 0.00 0.00 33.22 32.98 2rop n MET 131 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 2rop n THR 132 N -3.83 0.00 -4.46 2.03 5.66 -1.26 -4.65 114.28 107.76 2rop n THR 132 Ca -0.12 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.68 2rop n THR 132 Cb 0.37 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.00 2rop n THR 132 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2rop h ALA 134 N 5.88 1.83 -0.13 0.00 0.00 -2.00 -0.81 119.26 124.03 2rop h ALA 134 Ca -0.32 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 2rop h ALA 134 Cb 1.17 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2rop h ALA 134 CO 0.49 0.05 -0.12 0.77 0.00 0.00 0.00 179.25 180.44 2rop h SER 135 N 0.61 0.20 -0.32 0.00 0.02 -1.96 0.01 113.55 112.12 2rop h SER 135 Ca 0.30 -0.04 -0.17 0.00 -0.84 0.00 0.00 61.79 61.04 2rop h SER 135 Cb 0.38 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 2rop h SER 135 CO -0.10 0.35 -0.48 0.00 -1.14 0.00 0.00 176.83 175.46 2rop h VAL 137 N 0.71 0.43 -0.55 0.00 2.07 -0.48 0.99 116.25 119.40 2rop h VAL 137 Ca 0.04 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.60 2rop h VAL 137 Cb 1.08 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2rop h VAL 137 CO 0.11 0.00 0.37 0.45 0.02 0.00 0.00 177.57 178.52 2rop h HIS 138 N -0.48 0.58 -0.21 1.57 3.86 -1.02 0.04 115.15 119.49 2rop h HIS 138 Ca 0.02 0.01 -0.12 0.00 -1.16 0.00 0.00 60.37 59.13 2rop h HIS 138 Cb 0.50 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.77 2rop h HIS 138 CO -0.23 0.33 -0.34 0.77 0.86 0.00 0.00 177.93 179.32 2rop h SER 139 N 0.60 0.66 0.09 2.45 0.02 -0.69 -0.78 113.55 115.90 2rop h SER 139 Ca 0.23 -0.53 -0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2rop h SER 139 Cb 0.16 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.51 2rop h SER 139 CO -0.06 1.06 -0.04 0.40 -1.14 0.00 0.00 176.83 177.05 2rop h ILE 140 N 0.28 1.05 -0.93 3.27 2.04 -0.36 0.13 117.51 122.98 2rop h ILE 140 Ca 0.02 -0.49 0.16 0.00 1.00 0.00 0.00 64.86 65.54 2rop h ILE 140 Cb 0.93 1.37 -0.08 0.00 -0.74 0.00 0.00 36.82 38.30 2rop h ILE 140 CO 0.08 0.12 0.59 -0.08 0.00 0.00 0.00 178.15 178.86 2rop h GLU 141 N -0.34 0.67 0.25 2.37 4.81 -1.07 -1.46 114.58 119.81 2rop h GLU 141 Ca -0.01 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2rop h GLU 141 Cb 0.29 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2rop h GLU 141 CO 0.02 0.44 -0.12 0.78 -0.73 0.00 0.00 179.01 179.40 2rop h GLY 142 N 0.69 -0.36 0.77 1.92 0.00 -0.92 -3.35 103.07 101.81 2rop h GLY 142 Ca 0.49 0.13 -0.04 0.00 0.00 0.00 0.00 47.33 47.91 2rop h GLY 142 CO -0.24 -0.13 -0.06 -0.33 0.00 0.00 0.00 176.54 175.78 2rop h MET 143 N -1.05 0.33 -0.41 4.80 2.86 -0.58 -3.25 114.93 117.63 2rop h MET 143 Ca -0.03 -0.13 -0.09 0.00 -2.06 0.00 0.00 59.70 57.38 2rop h MET 143 Cb 0.37 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 2rop h MET 143 CO 0.06 0.62 -0.13 0.82 1.06 0.00 0.00 176.91 179.34 2rop h ILE 144 N 0.01 1.26 0.00 -1.22 1.08 -1.49 -2.71 117.51 114.44 2rop h ILE 144 Ca 0.04 -1.18 0.00 0.00 -0.39 0.00 0.00 64.86 63.33 2rop h ILE 144 Cb 0.51 1.08 0.00 0.00 -3.07 0.00 0.00 36.82 35.34 2rop h ILE 144 CO 0.02 0.40 0.08 -0.24 -0.69 0.00 0.00 178.15 177.72 2rop n SER 145 N -4.16 0.00 -0.07 1.72 2.88 -1.23 -2.48 113.62 110.29 2rop n SER 145 Ca 0.01 0.39 0.12 0.00 -1.33 0.00 0.00 58.87 58.07 2rop n SER 145 Cb 0.37 -0.39 0.33 0.00 -0.75 0.00 0.00 64.21 63.77 2rop n SER 145 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2rop n GLN 146 N -1.38 0.24 -3.70 -1.46 6.02 -1.02 -4.96 117.38 111.11 2rop n GLN 146 Ca 0.00 -0.13 -0.24 0.00 -0.01 0.00 0.00 57.00 56.62 2rop n GLN 146 Cb 0.08 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.84 2rop n GLN 146 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 2rop s LEU 147 N -2.85 2.87 0.70 1.08 0.05 -1.03 -5.11 118.68 114.38 2rop s LEU 147 Ca 0.15 -1.11 -0.16 0.00 0.05 0.00 0.00 54.13 53.06 2rop s LEU 147 Cb 0.18 -1.38 -0.00 0.00 -2.05 0.00 0.00 46.19 42.94 2rop s LEU 147 CO 0.63 -1.08 0.99 -1.84 -0.55 0.00 0.00 176.35 174.51 2rop n GLU 148 N -1.81 0.61 0.00 1.48 0.28 -1.26 -3.99 120.64 115.95 2rop n GLU 148 Ca 0.02 0.26 0.00 0.00 -0.16 0.00 0.00 57.16 57.28 2rop n GLU 148 Cb 0.63 -2.24 0.00 0.00 1.43 0.00 0.00 31.44 31.27 2rop n GLU 148 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2rop n GLY 149 N 1.11 1.13 3.56 -1.84 0.00 -1.26 -4.88 105.19 103.01 2rop n GLY 149 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 3.82 0.03 1.61 0.11 -1.26 -0.93 120.40 123.79 2rop s VAL 150 Ca 0.00 -0.40 -0.16 0.00 -2.93 0.00 0.00 61.98 58.49 2rop s VAL 150 Cb 0.00 -4.91 -0.35 0.00 -1.53 0.00 0.00 36.38 29.59 2rop s VAL 150 CO 0.00 -1.81 1.02 -0.61 -3.33 0.00 0.00 175.10 170.37 2rop h GLN 151 N 10.13 0.57 -3.39 1.54 4.15 -1.56 -3.46 115.11 123.09 2rop h GLN 151 Ca 0.06 -0.92 -0.16 0.00 0.77 0.00 0.00 58.65 58.39 2rop h GLN 151 Cb 1.02 0.34 -0.23 0.00 0.21 0.00 0.00 27.48 28.81 2rop h GLN 151 CO 1.37 1.44 -0.49 -1.14 -1.93 0.00 0.00 178.83 178.07 2rop s GLN 152 N -2.68 0.35 -0.01 1.69 2.00 -0.97 -5.01 119.66 115.04 2rop s GLN 152 Ca -0.09 -0.06 -0.00 0.00 -2.00 0.00 0.00 55.36 53.21 2rop s GLN 152 Cb 0.04 0.15 0.01 0.00 0.80 0.00 0.00 33.01 34.01 2rop s GLN 152 CO 0.95 -0.07 0.02 -1.50 -0.50 0.00 0.00 175.29 174.18 2rop s ILE 153 N -0.62 -0.01 -0.01 -2.34 2.07 -1.26 -0.43 121.20 118.60 2rop s ILE 153 Ca -0.07 0.04 0.00 0.00 -1.41 0.00 0.00 60.65 59.21 2rop s ILE 153 Cb -0.04 -0.04 0.01 0.00 0.13 0.00 0.00 42.46 42.52 2rop s ILE 153 CO 0.01 0.01 0.00 -0.55 -1.91 0.00 0.00 174.94 172.50 2rop s SER 154 N 0.18 0.15 -0.00 4.50 0.15 -0.66 -4.95 113.70 113.08 2rop s SER 154 Ca -0.01 -0.01 -0.06 0.00 0.70 0.00 0.00 55.95 56.56 2rop s SER 154 Cb -0.02 -0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.23 2rop s SER 154 CO -0.01 -0.04 0.12 0.54 1.20 0.00 0.00 173.24 175.06 2rop s VAL 155 N 0.37 0.08 0.00 4.45 0.11 -1.26 -0.56 120.40 123.59 2rop s VAL 155 Ca -0.03 -0.64 -0.04 0.00 -2.93 0.00 0.00 61.98 58.34 2rop s VAL 155 Cb -0.05 -0.39 -0.01 0.00 -1.53 0.00 0.00 36.38 34.40 2rop s VAL 155 CO -0.01 -0.35 0.07 -0.55 -3.33 0.00 0.00 175.10 170.93 2rop s SER 156 N -1.24 0.09 0.47 3.54 0.15 -0.71 -4.97 113.70 111.03 2rop s SER 156 Ca -0.13 -0.26 0.27 0.00 0.70 0.00 0.00 55.95 56.52 2rop s SER 156 Cb -0.07 0.16 1.03 0.00 -1.71 0.00 0.00 66.02 65.43 2rop s SER 156 CO 0.01 -0.30 1.86 -0.07 1.20 0.00 0.00 173.24 175.95 2rop h LEU 157 N 4.67 0.00 -0.92 3.45 3.38 -1.95 -2.24 115.31 121.70 2rop h LEU 157 Ca -0.30 0.00 0.18 0.00 0.09 0.00 0.00 57.88 57.85 2rop h LEU 157 Cb 1.20 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.85 2rop h LEU 157 CO 0.41 0.15 0.50 0.00 0.09 0.00 0.00 178.44 179.59 2rop h ALA 158 N 1.85 1.47 0.00 1.53 0.00 -1.96 -2.86 119.26 119.29 2rop h ALA 158 Ca -0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2rop h ALA 158 Cb 0.69 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2rop h ALA 158 CO 0.02 -0.13 0.00 0.39 0.00 0.00 0.00 179.25 179.53 2rop n GLU 159 N -4.87 0.36 -2.74 0.00 1.02 -1.26 -5.03 120.64 108.12 2rop n GLU 159 Ca 0.21 -0.25 -0.07 0.00 -0.02 0.00 0.00 57.16 57.03 2rop n GLU 159 Cb 0.54 -0.72 0.02 0.00 -0.02 0.00 0.00 31.44 31.27 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 0.12 0.44 3.13 0.62 0.00 -1.03 -4.88 105.19 103.59 2rop n GLY 160 Ca 0.00 -0.38 -0.19 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.10 1.02 -0.19 2.61 -4.23 -0.87 -0.65 115.64 110.24 2rop s THR 161 Ca 0.14 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 2rop s THR 161 Cb -0.06 -0.94 0.02 0.00 1.34 0.00 0.00 72.50 72.86 2rop s THR 161 CO 0.22 -0.04 -0.17 0.00 -0.54 0.00 0.00 174.62 174.08 2rop s ALA 162 N -0.88 2.41 -0.38 3.99 0.00 -0.16 -1.74 121.76 124.99 2rop s ALA 162 Ca 0.00 -1.23 -0.15 0.00 0.00 0.00 0.00 51.96 50.59 2rop s ALA 162 Cb -0.08 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.78 2rop s ALA 162 CO 0.01 -0.39 0.30 -0.08 0.00 0.00 0.00 175.76 175.61 2rop s THR 163 N 1.31 5.24 -0.01 0.00 -1.32 0.28 -0.84 115.64 120.29 2rop s THR 163 Ca 0.05 -0.41 0.02 0.00 -1.21 0.00 0.00 61.69 60.14 2rop s THR 163 Cb -0.13 -3.86 -0.00 0.00 -1.51 0.00 0.00 72.50 66.99 2rop s THR 163 CO -0.11 -0.21 -0.07 0.54 -2.21 0.00 0.00 174.62 172.56 2rop s VAL 164 N 1.78 0.57 -0.46 5.08 0.11 -0.70 -1.65 120.40 125.13 2rop s VAL 164 Ca 0.07 -0.29 -0.18 0.00 -2.93 0.00 0.00 61.98 58.65 2rop s VAL 164 Cb -0.18 -0.49 0.04 0.00 -1.53 0.00 0.00 36.38 34.22 2rop s VAL 164 CO 0.11 0.17 0.51 -0.22 -3.33 0.00 0.00 175.10 172.33 2rop s LEU 165 N -0.08 4.97 0.31 2.54 1.98 0.43 -1.75 118.68 127.08 2rop s LEU 165 Ca 0.01 -0.81 0.09 0.00 -2.89 0.00 0.00 54.13 50.54 2rop s LEU 165 Cb -0.04 -2.41 -0.04 0.00 0.66 0.00 0.00 46.19 44.36 2rop s LEU 165 CO -0.00 -0.70 0.05 -0.72 -1.89 0.00 0.00 176.35 173.08 2rop s TYR 166 N 2.28 2.67 -0.39 5.38 1.13 0.17 -1.37 117.35 127.21 2rop s TYR 166 Ca 0.13 -0.33 -0.18 0.00 -1.41 0.00 0.00 57.07 55.28 2rop s TYR 166 Cb -0.18 -1.42 0.01 0.00 -1.10 0.00 0.00 41.96 39.27 2rop s TYR 166 CO 0.13 0.49 0.50 1.21 -2.51 0.00 0.00 175.55 175.36 2rop s ASN 167 N -3.75 6.26 0.03 -0.18 3.84 -0.10 -0.98 114.94 120.06 2rop s ASN 167 Ca 0.34 -0.35 0.25 0.00 0.21 0.00 0.00 52.86 53.32 2rop s ASN 167 Cb -0.04 -2.25 1.06 0.00 -0.55 0.00 0.00 41.25 39.47 2rop s ASN 167 CO 0.21 -0.56 1.81 -0.81 -2.79 0.00 0.00 177.10 174.95 2rop n PRO 168 N 5.76 0.03 0.05 0.43 -0.04 -1.26 -1.25 135.00 138.72 2rop n PRO 168 Ca -0.05 0.09 -0.12 0.00 -0.04 0.00 0.00 63.50 63.37 2rop n PRO 168 Cb 0.48 -1.54 -0.13 0.00 -0.04 0.00 0.00 33.50 32.27 2rop n PRO 168 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rop h ALA 169 N 2.83 0.36 0.02 0.55 0.00 -1.93 -3.42 119.26 117.67 2rop h ALA 169 Ca 0.00 -1.08 -0.37 0.00 0.00 0.00 0.00 54.91 53.46 2rop h ALA 169 Cb 0.46 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 2rop h ALA 169 CO 0.00 1.23 -2.09 0.28 0.00 0.00 0.00 179.25 178.67 2rop n VAL 170 N -3.36 1.56 -4.33 0.00 0.31 -1.01 -5.02 118.33 106.47 2rop n VAL 170 Ca -0.10 -0.35 -0.24 0.00 -0.01 0.00 0.00 64.34 63.63 2rop n VAL 170 Cb 1.01 -1.83 -0.13 0.00 -0.91 0.00 0.00 33.84 31.98 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 -2.47 1.74 0.06 2.52 2.07 -0.38 -4.96 121.20 119.77 2rop s ILE 171 Ca -0.33 -1.52 -0.05 0.00 -1.41 0.00 0.00 60.65 57.34 2rop s ILE 171 Cb 0.10 -1.57 -0.05 0.00 0.13 0.00 0.00 42.46 41.07 2rop s ILE 171 CO 0.58 -0.02 0.30 -0.55 -1.91 0.00 0.00 174.94 173.34 2rop s SER 172 N -1.83 6.49 0.58 4.50 0.15 -1.26 -4.44 113.70 117.89 2rop s SER 172 Ca 0.07 0.55 0.28 0.00 0.70 0.00 0.00 55.95 57.55 2rop s SER 172 Cb -0.10 -2.08 1.54 0.00 -1.71 0.00 0.00 66.02 63.67 2rop s SER 172 CO 0.04 0.18 1.99 -0.65 1.20 0.00 0.00 173.24 175.99 2rop h PRO 173 N 3.50 0.00 -0.28 5.44 0.11 -1.98 -0.30 132.00 138.48 2rop h PRO 173 Ca -0.48 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.52 2rop h PRO 173 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2rop h PRO 173 CO 0.69 0.00 -0.30 0.93 -0.21 0.00 0.00 178.00 179.11 2rop h GLU 174 N 0.00 0.57 -0.05 1.05 5.08 -2.01 -3.13 114.58 116.09 2rop h GLU 174 Ca 0.17 -0.25 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 2rop h GLU 174 Cb 0.88 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 2rop h GLU 174 CO -0.00 0.81 -0.57 0.93 -1.00 0.00 0.00 179.01 179.18 2rop h GLU 175 N 0.49 0.16 0.52 2.33 5.08 -1.46 -2.48 114.58 119.22 2rop h GLU 175 Ca 0.06 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 2rop h GLU 175 Cb 0.77 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 2rop h GLU 175 CO 0.06 0.69 -0.40 -0.07 -1.00 0.00 0.00 179.01 178.30 2rop h LEU 176 N 0.12 -1.03 -0.78 1.33 3.38 -1.44 -1.70 115.31 115.19 2rop h LEU 176 Ca -0.00 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2rop h LEU 176 Cb 1.04 0.33 -0.04 0.00 0.09 0.00 0.00 40.66 42.08 2rop h LEU 176 CO 0.08 -0.58 0.45 0.08 0.09 0.00 0.00 178.44 178.56 2rop h ARG 177 N -0.89 1.07 -0.50 1.13 0.11 -1.55 -2.52 114.38 111.22 2rop h ARG 177 Ca -0.06 -0.11 0.04 0.00 0.10 0.00 0.00 59.98 59.96 2rop h ARG 177 Cb 0.76 -0.22 -0.03 0.00 1.11 0.00 0.00 29.97 31.59 2rop h ARG 177 CO 0.01 0.77 0.34 0.00 0.10 0.00 0.00 179.97 181.19 2rop h ALA 178 N 1.24 1.82 -0.14 0.08 0.00 -1.34 -0.52 119.26 120.40 2rop h ALA 178 Ca 0.28 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 2rop h ALA 178 Cb -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2rop h ALA 178 CO -0.05 0.11 -0.55 0.00 0.00 0.00 0.00 179.25 178.76 2rop h ALA 179 N 1.72 0.79 -0.14 0.00 0.00 -0.86 -0.63 119.26 120.14 2rop h ALA 179 Ca 0.21 -0.51 -0.22 0.00 0.00 0.00 0.00 54.91 54.39 2rop h ALA 179 Cb 0.19 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.90 2rop h ALA 179 CO -0.06 0.69 -0.79 0.82 0.00 0.00 0.00 179.25 179.92 2rop h ILE 180 N 0.33 1.29 -0.19 0.00 5.03 -1.32 -2.45 117.51 120.20 2rop h ILE 180 Ca 0.01 -2.00 -0.03 0.00 -0.12 0.00 0.00 64.86 62.71 2rop h ILE 180 Cb 1.06 2.01 -0.01 0.00 -3.03 0.00 0.00 36.82 36.85 2rop h ILE 180 CO 0.10 0.63 -0.03 -0.33 -0.68 0.00 0.00 178.15 177.83 2rop h GLU 181 N 0.51 0.27 0.00 2.37 5.08 -1.02 -1.17 114.58 120.63 2rop h GLU 181 Ca -0.05 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2rop h GLU 181 Cb 1.41 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.62 2rop h GLU 181 CO 0.16 0.33 0.00 -3.47 -1.00 0.00 0.00 179.01 175.03 2rop n ASP 182 N -4.35 0.60 0.16 1.42 -0.08 -0.25 -3.13 116.55 110.92 2rop n ASP 182 Ca -0.00 0.61 0.10 0.00 -1.51 0.00 0.00 54.79 53.99 2rop n ASP 182 Cb 0.20 -0.75 0.09 0.00 2.34 0.00 0.00 41.12 43.00 2rop n ASP 182 CO 0.00 0.00 0.00 -0.03 0.12 0.00 0.00 177.20 177.29 2rop h MET 183 N 0.00 0.00 0.00 -0.67 4.05 -0.71 -3.48 114.93 114.12 2rop h MET 183 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2rop h MET 183 Cb 0.48 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.28 2rop h MET 183 CO 0.00 0.08 0.00 0.41 0.23 0.00 0.00 176.91 177.63 2rop n GLY 184 N 1.16 1.56 0.00 1.39 0.00 -1.11 -5.10 105.19 103.09 2rop n GLY 184 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.82 0.00 -4.59 1.61 3.72 -1.09 -5.04 117.46 111.24 2rop n PHE 185 Ca 0.00 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.18 2rop n PHE 185 Cb 0.00 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.39 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 1.59 1.07 0.02 -1.08 2.02 -1.24 -4.29 118.70 116.78 2rop s GLU 186 Ca 0.00 -0.49 0.01 0.00 0.02 0.00 0.00 54.97 54.50 2rop s GLU 186 Cb 0.00 -1.04 -0.02 0.00 0.10 0.00 0.00 34.13 33.17 2rop s GLU 186 CO 0.00 0.28 -0.04 0.00 0.02 0.00 0.00 175.26 175.53 2rop s ALA 187 N -0.34 0.20 -0.03 5.21 0.00 -1.26 -0.58 121.76 124.95 2rop s ALA 187 Ca 0.05 -0.50 -0.03 0.00 0.00 0.00 0.00 51.96 51.47 2rop s ALA 187 Cb -0.05 0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.17 2rop s ALA 187 CO -0.00 -0.09 0.10 0.45 0.00 0.00 0.00 175.76 176.21 2rop s SER 188 N -1.15 -0.09 -0.10 0.00 0.15 0.59 -4.90 113.70 108.20 2rop s SER 188 Ca -0.11 0.17 -0.19 0.00 0.70 0.00 0.00 55.95 56.52 2rop s SER 188 Cb -0.08 0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.39 2rop s SER 188 CO -0.01 -0.05 0.53 0.54 1.20 0.00 0.00 173.24 175.46 2rop s VAL 189 N -0.02 5.13 0.00 4.45 0.11 -1.26 -1.03 120.40 127.78 2rop s VAL 189 Ca -0.01 1.08 0.00 0.00 -2.93 0.00 0.00 61.98 60.12 2rop s VAL 189 Cb -0.01 -3.87 0.00 0.00 -1.53 0.00 0.00 36.38 30.97 2rop s VAL 189 CO 0.00 0.32 0.17 0.55 -3.33 0.00 0.00 175.10 172.81