#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 5.19 -0.04 3.34 2.01 -1.26 -1.79 115.64 123.10 2rop s THR 21 Ca 0.00 0.11 0.06 0.00 0.31 0.00 0.00 61.69 62.16 2rop s THR 21 Cb 0.00 -3.34 -0.01 0.00 0.01 0.00 0.00 72.50 69.16 2rop s THR 21 CO 0.00 0.48 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.99 2rop s LEU 22 N 0.09 2.00 -0.18 4.42 0.20 -0.98 -4.98 118.68 119.24 2rop s LEU 22 Ca 0.08 -0.41 -0.13 0.00 0.69 0.00 0.00 54.13 54.36 2rop s LEU 22 Cb -0.12 -1.13 -0.05 0.00 -0.43 0.00 0.00 46.19 44.47 2rop s LEU 22 CO -0.00 0.21 0.26 -1.58 -0.29 0.00 0.00 176.35 174.95 2rop s GLN 23 N -0.18 4.21 -0.02 1.98 2.00 -1.26 -1.92 119.66 124.47 2rop s GLN 23 Ca -0.00 0.01 -0.02 0.00 -2.00 0.00 0.00 55.36 53.34 2rop s GLN 23 Cb -0.11 -3.46 0.00 0.00 0.80 0.00 0.00 33.01 30.25 2rop s GLN 23 CO 0.02 0.18 0.06 -0.48 -0.50 0.00 0.00 175.29 174.57 2rop s LEU 24 N 0.66 1.79 -0.27 3.68 2.34 -0.66 -4.61 118.68 121.60 2rop s LEU 24 Ca 0.14 0.07 -0.06 0.00 0.06 0.00 0.00 54.13 54.34 2rop s LEU 24 Cb -0.13 0.23 0.00 0.00 -0.56 0.00 0.00 46.19 45.73 2rop s LEU 24 CO 0.03 -0.06 0.04 -0.60 -1.06 0.00 0.00 176.35 174.71 2rop s ARG 25 N -0.14 3.17 0.12 1.48 3.00 -0.12 -0.17 118.95 126.30 2rop s ARG 25 Ca -0.02 -0.79 -0.30 0.00 -1.00 0.00 0.00 55.73 53.62 2rop s ARG 25 Cb -0.01 -3.26 -0.06 0.00 0.00 0.00 0.00 34.95 31.62 2rop s ARG 25 CO 0.00 -0.37 1.08 0.42 0.00 0.00 0.00 175.30 176.44 2rop s ILE 26 N 1.49 4.13 -0.45 4.11 1.01 -1.20 -0.59 121.20 129.70 2rop s ILE 26 Ca 0.03 1.72 -0.13 0.00 0.00 0.00 0.00 60.65 62.27 2rop s ILE 26 Cb -0.16 -4.10 0.08 0.00 0.01 0.00 0.00 42.46 38.29 2rop s ILE 26 CO 0.01 0.24 0.34 -1.81 0.00 0.00 0.00 174.94 173.71 2rop s ASP 27 N 0.27 5.93 0.00 3.58 1.11 0.13 -4.38 116.67 123.31 2rop s ASP 27 Ca 0.51 -1.41 0.00 0.00 0.18 0.00 0.00 52.55 51.83 2rop s ASP 27 Cb -0.27 -2.10 0.00 0.00 1.07 0.00 0.00 42.92 41.62 2rop s ASP 27 CO 0.32 -0.60 0.00 0.61 1.18 0.00 0.00 175.17 176.68 2rop n GLY 28 N 5.08 1.03 0.29 0.21 0.00 -1.26 -1.09 105.19 109.45 2rop n GLY 28 Ca -0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 2rop n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rop h MET 29 N 1.29 0.72 0.00 1.61 -0.00 -1.82 -3.44 114.93 113.29 2rop h MET 29 Ca 0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 59.70 59.53 2rop h MET 29 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 31.60 31.50 2rop h MET 29 CO 0.00 0.71 0.00 1.58 -0.00 0.00 0.00 176.91 179.20 2rop n HIS 30 N -4.25 0.00 -3.76 -0.10 -0.00 -1.26 -4.34 115.22 101.51 2rop n HIS 30 Ca 0.03 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.11 2rop n HIS 30 Cb 0.26 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 30.09 2rop n HIS 30 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2rop h LYS 32 N 2.30 0.12 0.00 0.00 3.11 -2.01 -2.17 116.57 117.92 2rop h LYS 32 Ca -0.30 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.53 2rop h LYS 32 Cb 1.25 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 32.46 2rop h LYS 32 CO 0.41 0.08 0.52 0.66 -2.81 0.00 0.00 179.45 178.31 2rop h SER 33 N 0.12 0.00 -0.58 4.20 4.64 -1.97 0.10 113.55 120.07 2rop h SER 33 Ca 0.32 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.69 2rop h SER 33 Cb 1.10 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.15 2rop h SER 33 CO -0.04 0.00 0.32 0.00 -0.87 0.00 0.00 176.83 176.24 2rop n VAL 35 N -4.81 0.65 0.39 0.00 3.14 0.35 -3.51 118.33 114.54 2rop n VAL 35 Ca 0.06 0.16 -0.16 0.00 -2.96 0.00 0.00 64.34 61.44 2rop n VAL 35 Cb 0.13 -0.92 -0.08 0.00 -1.06 0.00 0.00 33.84 31.90 2rop n VAL 35 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 2rop h LEU 36 N 0.00 -0.85 -1.39 6.55 6.46 -1.74 0.16 115.31 124.50 2rop h LEU 36 Ca 0.00 0.01 0.03 0.00 -0.12 0.00 0.00 57.88 57.80 2rop h LEU 36 Cb 0.15 0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 40.27 2rop h LEU 36 CO 0.00 -0.50 0.43 -0.55 -0.62 0.00 0.00 178.44 177.21 2rop h ASN 37 N -1.21 0.69 -0.39 1.25 7.08 -1.82 -1.16 115.58 120.02 2rop h ASN 37 Ca -0.10 -0.01 0.03 0.00 -3.08 0.00 0.00 56.30 53.14 2rop h ASN 37 Cb 0.78 -0.16 -0.03 0.00 -2.08 0.00 0.00 38.32 36.83 2rop h ASN 37 CO 0.17 0.48 0.20 0.40 -2.08 0.00 0.00 177.43 176.60 2rop h ILE 38 N 0.81 0.98 -0.10 6.14 2.04 -1.67 -2.32 117.51 123.39 2rop h ILE 38 Ca 0.26 -0.14 -0.07 0.00 1.00 0.00 0.00 64.86 65.91 2rop h ILE 38 Cb 0.03 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 2rop h ILE 38 CO -0.07 0.07 -0.25 -0.08 0.00 0.00 0.00 178.15 177.83 2rop h GLU 39 N 0.41 0.17 -0.27 2.37 4.22 -0.03 0.18 114.58 121.62 2rop h GLU 39 Ca 0.17 -0.05 -0.08 0.00 0.08 0.00 0.00 59.36 59.47 2rop h GLU 39 Cb 0.07 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2rop h GLU 39 CO -0.11 0.41 -0.19 0.93 -2.18 0.00 0.00 179.01 177.87 2rop h GLU 40 N 0.15 0.49 0.03 1.92 4.39 -0.74 -3.35 114.58 117.47 2rop h GLU 40 Ca 0.03 -0.16 -0.36 0.00 0.34 0.00 0.00 59.36 59.20 2rop h GLU 40 Cb 0.53 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 29.09 2rop h GLU 40 CO 0.04 0.66 -2.04 0.09 -1.16 0.00 0.00 179.01 176.59 2rop n ASN 41 N -4.16 1.98 -4.50 1.42 3.02 -0.92 -4.93 115.26 107.17 2rop n ASN 41 Ca 0.00 0.22 -0.42 0.00 -0.03 0.00 0.00 54.58 54.36 2rop n ASN 41 Cb 0.36 -0.78 -0.10 0.00 -0.61 0.00 0.00 39.78 38.65 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 -2.49 5.25 0.00 2.41 -1.09 0.61 -3.93 121.20 121.96 2rop s ILE 42 Ca -0.31 -0.37 0.00 0.00 -2.23 0.00 0.00 60.65 57.74 2rop s ILE 42 Cb 0.09 -3.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.14 2rop s ILE 42 CO 0.62 -0.16 0.00 0.61 -1.23 0.00 0.00 174.94 174.78 2rop n GLY 43 N 5.11 0.40 0.00 6.18 0.00 -1.25 -4.49 105.19 111.14 2rop n GLY 43 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.23 -1.07 1.61 10.64 -1.10 -4.28 117.38 122.95 2rop n GLN 44 Ca 0.00 -0.50 -0.29 0.00 -1.83 0.00 0.00 57.00 54.38 2rop n GLN 44 Cb 0.00 -0.86 0.20 0.00 -0.86 0.00 0.00 30.24 28.72 2rop n GLN 44 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2rop s LEU 45 N -0.12 1.27 0.34 2.61 1.02 -0.98 -4.95 118.68 117.86 2rop s LEU 45 Ca 0.00 1.11 0.07 0.00 0.02 0.00 0.00 54.13 55.33 2rop s LEU 45 Cb 0.00 -3.16 0.74 0.00 0.02 0.00 0.00 46.19 43.79 2rop s LEU 45 CO 0.00 -3.48 1.87 0.17 0.02 0.00 0.00 176.35 174.92 2rop h LEU 46 N -2.14 0.73 -2.53 1.79 -0.00 -1.99 -3.26 115.31 107.91 2rop h LEU 46 Ca -0.54 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.37 2rop h LEU 46 Cb 1.33 -0.11 0.00 0.00 -0.00 0.00 0.00 40.66 41.88 2rop h LEU 46 CO 0.53 0.38 -0.03 0.61 -0.00 0.00 0.00 178.44 179.94 2rop n GLY 47 N -1.41 1.89 2.95 0.17 0.00 -1.26 -4.90 105.19 102.62 2rop n GLY 47 Ca 0.17 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.01 1.21 -0.02 1.61 1.01 -1.23 -0.52 120.40 121.44 2rop s VAL 48 Ca 0.05 -0.40 0.10 0.00 0.00 0.00 0.00 61.98 61.73 2rop s VAL 48 Cb 0.04 -1.19 -0.16 0.00 0.00 0.00 0.00 36.38 35.08 2rop s VAL 48 CO 0.00 0.40 0.21 0.00 0.00 0.00 0.00 175.10 175.71 2rop n GLN 49 N 4.86 0.56 -4.10 2.72 0.00 -1.19 -2.32 117.38 117.91 2rop n GLN 49 Ca -0.14 -0.09 -0.10 0.00 0.00 0.00 0.00 57.00 56.67 2rop n GLN 49 Cb 0.50 -1.25 -0.09 0.00 0.00 0.00 0.00 30.24 29.40 2rop n GLN 49 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2rop s SER 50 N -3.34 0.17 -0.01 2.61 0.15 -1.24 -4.65 113.70 107.39 2rop s SER 50 Ca -0.04 -1.14 -0.01 0.00 0.70 0.00 0.00 55.95 55.46 2rop s SER 50 Cb 0.06 0.37 0.01 0.00 -1.71 0.00 0.00 66.02 64.75 2rop s SER 50 CO 0.44 -0.83 0.04 -0.51 1.20 0.00 0.00 173.24 173.58 2rop s ILE 51 N -4.05 -0.01 -0.08 6.45 1.10 -1.26 -2.43 121.20 120.92 2rop s ILE 51 Ca 0.26 0.03 0.03 0.00 -0.51 0.00 0.00 60.65 60.45 2rop s ILE 51 Cb 0.06 -0.06 0.01 0.00 0.15 0.00 0.00 42.46 42.61 2rop s ILE 51 CO 0.04 0.01 -0.17 -1.58 -2.11 0.00 0.00 174.94 171.14 2rop s GLN 52 N 0.16 2.21 -0.38 3.50 0.74 0.30 -4.98 119.66 121.22 2rop s GLN 52 Ca -0.01 -0.59 -0.14 0.00 0.05 0.00 0.00 55.36 54.67 2rop s GLN 52 Cb -0.02 -1.76 0.00 0.00 1.10 0.00 0.00 33.01 32.34 2rop s GLN 52 CO -0.00 0.07 0.30 0.08 -0.55 0.00 0.00 175.29 175.18 2rop s VAL 53 N 0.59 5.24 -0.40 1.34 1.01 -1.26 -0.61 120.40 126.31 2rop s VAL 53 Ca -0.15 -0.40 0.09 0.00 0.00 0.00 0.00 61.98 61.51 2rop s VAL 53 Cb -0.16 -3.86 0.43 0.00 0.00 0.00 0.00 36.38 32.79 2rop s VAL 53 CO 0.05 -0.19 1.07 -1.20 0.00 0.00 0.00 175.10 174.82 2rop n SER 54 N 5.21 3.77 0.16 3.32 7.64 -1.11 -4.92 113.62 127.69 2rop n SER 54 Ca -0.11 -3.42 0.12 0.00 1.01 0.00 0.00 58.87 56.47 2rop n SER 54 Cb 0.48 -0.48 0.58 0.00 -1.01 0.00 0.00 64.21 63.79 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 2.69 0.00 -1.72 -3.43 -0.00 -1.88 -2.72 115.31 108.26 2rop h LEU 55 Ca 0.19 0.00 0.44 0.00 -0.00 0.00 0.00 57.88 58.50 2rop h LEU 55 Cb 1.01 0.00 -0.09 0.00 -0.00 0.00 0.00 40.66 41.58 2rop h LEU 55 CO 0.74 0.00 1.00 1.05 -0.00 0.00 0.00 178.44 181.23 2rop h GLU 56 N 0.00 0.07 0.00 1.13 4.11 -1.91 0.01 114.58 117.99 2rop h GLU 56 Ca 0.00 -0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.41 2rop h GLU 56 Cb 0.18 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 2rop h GLU 56 CO 0.00 0.05 -0.31 -1.71 0.07 0.00 0.00 179.01 177.11 2rop n ASN 57 N -4.34 1.65 -1.65 3.06 5.15 -1.22 -4.95 115.26 112.96 2rop n ASN 57 Ca 0.35 -3.00 -0.17 0.00 -0.60 0.00 0.00 54.58 51.16 2rop n ASN 57 Cb 1.50 -0.40 -0.04 0.00 -0.53 0.00 0.00 39.78 40.31 2rop n ASN 57 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2rop n LYS 58 N -0.93 -1.30 -3.07 1.20 4.76 -0.01 -5.01 118.16 113.80 2rop n LYS 58 Ca 0.13 0.99 -0.22 0.00 -2.87 0.00 0.00 58.31 56.33 2rop n LYS 58 Cb 0.71 -5.34 0.01 0.00 -1.84 0.00 0.00 35.03 28.57 2rop n LYS 58 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2rop s THR 59 N -2.75 4.05 0.02 -0.18 -4.23 -1.03 -3.22 115.64 108.30 2rop s THR 59 Ca 0.00 -0.57 -0.04 0.00 -1.18 0.00 0.00 61.69 59.90 2rop s THR 59 Cb 0.00 -3.48 -0.01 0.00 1.34 0.00 0.00 72.50 70.34 2rop s THR 59 CO 0.00 -0.32 0.05 0.00 -0.54 0.00 0.00 174.62 173.82 2rop s ALA 60 N -2.49 -0.05 -0.05 3.99 0.00 0.76 -2.75 121.76 121.16 2rop s ALA 60 Ca 0.47 -0.45 0.04 0.00 0.00 0.00 0.00 51.96 52.03 2rop s ALA 60 Cb -0.10 0.16 -0.00 0.00 0.00 0.00 0.00 23.12 23.18 2rop s ALA 60 CO 0.37 -0.21 -0.19 -0.65 0.00 0.00 0.00 175.76 175.08 2rop s GLN 61 N -1.75 2.00 -0.11 0.00 -0.21 0.22 -1.65 119.66 118.16 2rop s GLN 61 Ca -0.13 -0.67 -0.05 0.00 0.02 0.00 0.00 55.36 54.54 2rop s GLN 61 Cb -0.07 -1.70 -0.04 0.00 1.00 0.00 0.00 33.01 32.20 2rop s GLN 61 CO -0.01 0.25 0.09 0.54 -2.12 0.00 0.00 175.29 174.04 2rop s VAL 62 N 0.07 5.07 -0.63 1.09 0.11 -0.81 -0.54 120.40 124.77 2rop s VAL 62 Ca -0.06 0.04 -0.12 0.00 -2.93 0.00 0.00 61.98 58.91 2rop s VAL 62 Cb -0.13 -3.19 0.16 0.00 -1.53 0.00 0.00 36.38 31.70 2rop s VAL 62 CO 0.03 0.61 0.55 -0.54 -3.33 0.00 0.00 175.10 172.42 2rop s LYS 63 N -0.94 3.04 0.16 1.54 -0.14 -1.02 -2.33 119.74 120.05 2rop s LYS 63 Ca 0.14 -2.06 0.11 0.00 -1.36 0.00 0.00 55.97 52.80 2rop s LYS 63 Cb -0.12 -4.20 -0.04 0.00 -1.68 0.00 0.00 37.83 31.79 2rop s LYS 63 CO 0.03 -1.27 -0.24 1.52 -0.76 0.00 0.00 175.35 174.63 2rop s TYR 64 N 0.90 2.23 -0.39 3.18 -0.85 -0.74 -3.15 117.35 118.52 2rop s TYR 64 Ca 0.10 -0.38 -0.16 0.00 -0.52 0.00 0.00 57.07 56.11 2rop s TYR 64 Cb -0.22 -1.15 0.01 0.00 0.38 0.00 0.00 41.96 40.99 2rop s TYR 64 CO -0.02 0.41 0.39 -0.51 -1.52 0.00 0.00 175.55 174.29 2rop s ASP 65 N -2.40 6.18 0.00 -0.18 1.11 0.33 -0.99 116.67 120.71 2rop s ASP 65 Ca 0.17 -0.54 0.05 0.00 0.18 0.00 0.00 52.55 52.41 2rop s ASP 65 Cb -0.09 -2.20 0.26 0.00 1.07 0.00 0.00 42.92 41.96 2rop s ASP 65 CO 0.08 -0.47 0.87 -2.65 1.18 0.00 0.00 175.17 174.17 2rop n PRO 66 N 5.46 0.11 0.11 8.23 -0.02 -1.26 -2.47 135.00 145.17 2rop n PRO 66 Ca -0.08 0.12 0.12 0.00 -2.02 0.00 0.00 63.50 61.63 2rop n PRO 66 Cb 0.48 -1.50 0.22 0.00 -0.02 0.00 0.00 33.50 32.68 2rop n PRO 66 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2rop h SER 67 N 0.00 0.00 0.00 2.55 4.64 -1.95 -3.39 113.55 115.40 2rop h SER 67 Ca 0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2rop h SER 67 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2rop h SER 67 CO 0.00 0.04 -0.78 0.00 -0.87 0.00 0.00 176.83 175.22 2rop s THR 69 N -1.74 0.00 0.07 0.00 -1.32 -1.11 -4.86 115.64 106.67 2rop s THR 69 Ca 0.00 -1.89 -0.27 0.00 -1.21 0.00 0.00 61.69 58.32 2rop s THR 69 Cb 0.00 -2.55 0.09 0.00 -1.51 0.00 0.00 72.50 68.53 2rop s THR 69 CO 0.00 0.00 0.85 -0.94 -2.21 0.00 0.00 174.62 172.32 2rop s SER 70 N -3.34 -0.35 0.17 8.08 1.04 -1.26 -4.42 113.70 113.61 2rop s SER 70 Ca 0.38 -0.11 -0.16 0.00 0.48 0.00 0.00 55.95 56.54 2rop s SER 70 Cb 0.02 0.46 0.11 0.00 0.10 0.00 0.00 66.02 66.71 2rop s SER 70 CO 0.26 -0.77 1.68 -0.65 0.98 0.00 0.00 173.24 174.74 2rop h PRO 71 N 2.00 0.06 -0.51 4.02 0.11 -2.02 -0.59 132.00 135.06 2rop h PRO 71 Ca -0.24 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.79 2rop h PRO 71 Cb 1.25 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 2rop h PRO 71 CO 0.31 0.04 0.01 -0.24 -0.21 0.00 0.00 178.00 177.90 2rop h VAL 72 N 0.06 1.25 -0.55 3.15 3.04 -1.99 -0.34 116.25 120.86 2rop h VAL 72 Ca 0.20 -1.03 -0.10 0.00 -1.01 0.00 0.00 66.70 64.76 2rop h VAL 72 Cb 0.30 0.84 -0.02 0.00 -2.01 0.00 0.00 31.29 30.41 2rop h VAL 72 CO -0.38 0.37 -0.07 0.00 -1.01 0.00 0.00 177.57 176.48 2rop h ALA 73 N 1.21 0.75 -0.14 3.17 0.00 -1.86 -2.85 119.26 119.54 2rop h ALA 73 Ca 0.15 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2rop h ALA 73 Cb 0.46 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2rop h ALA 73 CO 0.02 0.63 -0.03 -0.07 0.00 0.00 0.00 179.25 179.80 2rop h LEU 74 N 0.89 0.27 -0.38 0.00 3.38 -0.92 -3.17 115.31 115.39 2rop h LEU 74 Ca 0.15 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.81 2rop h LEU 74 Cb 0.63 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.25 2rop h LEU 74 CO 0.04 0.57 0.09 -0.61 0.09 0.00 0.00 178.44 178.62 2rop h GLN 75 N -0.03 0.21 0.00 1.13 4.15 -1.01 0.16 115.11 119.72 2rop h GLN 75 Ca 0.04 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.40 2rop h GLN 75 Cb 0.45 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 2rop h GLN 75 CO 0.01 0.14 -0.19 0.00 -1.93 0.00 0.00 178.83 176.86 2rop h ARG 76 N 0.22 0.00 0.22 1.69 3.08 -1.59 -0.71 114.38 117.29 2rop h ARG 76 Ca 0.18 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 2rop h ARG 76 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2rop h ARG 76 CO -0.22 0.19 -0.11 0.00 -1.07 0.00 0.00 179.97 178.76 2rop h ALA 77 N 1.81 -0.37 0.00 0.04 0.00 -1.35 -3.37 119.26 116.02 2rop h ALA 77 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2rop h ALA 77 Cb 0.34 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2rop h ALA 77 CO 0.02 -0.35 0.00 -0.84 0.00 0.00 0.00 179.25 178.09 2rop h ILE 78 N -0.84 0.00 -0.08 0.00 3.07 -0.91 -2.59 117.51 116.17 2rop h ILE 78 Ca -0.03 -0.46 -0.20 0.00 1.55 0.00 0.00 64.86 65.72 2rop h ILE 78 Cb 0.23 1.36 -0.00 0.00 -0.27 0.00 0.00 36.82 38.14 2rop h ILE 78 CO 0.05 0.00 -0.77 -0.33 -1.05 0.00 0.00 178.15 176.05 2rop h GLU 79 N 0.00 0.46 -0.63 0.16 5.08 -1.34 -3.30 114.58 115.01 2rop h GLU 79 Ca 0.00 -0.39 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 2rop h GLU 79 Cb 0.55 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2rop h GLU 79 CO 0.00 1.03 0.00 0.00 -1.00 0.00 0.00 179.01 179.04 2rop n ALA 80 N -2.53 2.87 -0.10 3.43 0.00 -1.03 -4.50 120.51 118.65 2rop n ALA 80 Ca -0.05 -1.26 -0.08 0.00 0.00 0.00 0.00 53.44 52.05 2rop n ALA 80 Cb 0.73 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.15 2rop n ALA 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2rop h LEU 81 N 3.48 -1.05-10.68 0.00 5.85 -1.55 -3.43 115.31 107.94 2rop h LEU 81 Ca 0.00 0.18 -0.46 0.00 0.84 0.00 0.00 57.88 58.44 2rop h LEU 81 Cb 1.16 0.49 0.08 0.00 0.37 0.00 0.00 40.66 42.75 2rop h LEU 81 CO 0.15 -0.32 0.11 -2.16 -0.34 0.00 0.00 178.44 175.88 2rop s PRO 82 N -6.00 1.77 -0.40 5.25 0.04 -1.26 -4.99 135.00 129.40 2rop s PRO 82 Ca -0.15 -0.98 -0.06 0.00 0.04 0.00 0.00 61.00 59.86 2rop s PRO 82 Cb 0.13 -2.32 -0.18 0.00 0.04 0.00 0.00 34.50 32.18 2rop s PRO 82 CO 0.68 -1.39 2.92 -0.35 0.04 0.00 0.00 177.00 178.90 2rop n PRO 83 N -2.82 2.06 -2.12 0.56 -0.04 -1.26 -4.50 135.00 126.87 2rop n PRO 83 Ca 0.14 -1.14 -0.03 0.00 -0.04 0.00 0.00 63.50 62.43 2rop n PRO 83 Cb 0.60 -2.13 0.01 0.00 -0.04 0.00 0.00 33.50 31.94 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 2.91 0.38 0.00 0.55 0.00 -1.26 -5.01 105.19 102.76 2rop n GLY 84 Ca 0.44 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.44 2.88 -3.75 1.61 5.15 -1.26 -5.05 115.26 113.40 2rop n ASN 85 Ca -0.04 0.00 -0.26 0.00 -0.60 0.00 0.00 54.58 53.68 2rop n ASN 85 Cb 0.53 0.21 -0.17 0.00 -0.53 0.00 0.00 39.78 39.82 2rop n ASN 85 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2rop s PHE 86 N -1.61 0.87 0.52 1.20 0.08 -1.26 -4.63 117.98 113.15 2rop s PHE 86 Ca 0.00 -0.58 0.07 0.00 0.12 0.00 0.00 56.93 56.54 2rop s PHE 86 Cb 0.00 -0.94 0.05 0.00 -0.57 0.00 0.00 43.02 41.57 2rop s PHE 86 CO 0.00 -0.50 0.72 0.15 -0.10 0.00 0.00 175.22 175.49 2rop s LYS 87 N 1.91 2.49 -0.02 0.44 1.02 -0.25 -4.64 119.74 120.69 2rop s LYS 87 Ca 0.02 -1.32 0.01 0.00 0.02 0.00 0.00 55.97 54.70 2rop s LYS 87 Cb -0.15 -2.65 0.01 0.00 -0.52 0.00 0.00 37.83 34.52 2rop s LYS 87 CO -0.07 -0.66 -0.05 0.14 -0.92 0.00 0.00 175.35 173.80 2rop s VAL 88 N -2.59 0.47 -0.20 3.17 -7.23 -1.26 -0.70 120.40 112.05 2rop s VAL 88 Ca 0.59 -0.17 -0.06 0.00 -1.81 0.00 0.00 61.98 60.53 2rop s VAL 88 Cb -0.08 -0.45 -0.03 0.00 0.56 0.00 0.00 36.38 36.39 2rop s VAL 88 CO 0.37 0.17 0.02 -0.44 -0.31 0.00 0.00 175.10 174.90 2rop s SER 89 N 0.36 4.97 0.01 4.85 0.01 0.24 -4.92 113.70 119.22 2rop s SER 89 Ca -0.04 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.05 2rop s SER 89 Cb -0.08 -1.85 0.00 0.00 0.21 0.00 0.00 66.02 64.29 2rop s SER 89 CO -0.00 0.07 0.00 0.18 0.41 0.00 0.00 173.24 173.89 2rop n LEU 90 N 4.24 0.00 -0.17 2.44 4.77 -1.26 -0.94 117.00 126.08 2rop n LEU 90 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 2rop n LEU 90 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2rop n LEU 90 CO 0.32 -0.03 0.00 1.07 -1.33 0.00 0.00 177.39 177.42 2rop n THR 120 N -0.07 0.00 -1.32 -5.08 5.66 -1.26 -4.98 114.28 107.23 2rop n THR 120 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2rop n THR 120 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 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 -0.20 -0.03 0.00 0.00 0.01 0.23 -4.89 113.70 108.82 2rop s SER 122 Ca 0.00 -0.09 -0.04 0.00 1.31 0.00 0.00 55.95 57.13 2rop s SER 122 Cb 0.00 0.24 -0.04 0.00 0.21 0.00 0.00 66.02 66.43 2rop s SER 122 CO 0.00 -0.34 0.22 -0.89 0.41 0.00 0.00 173.24 172.64 2rop s THR 123 N -1.18 5.39 0.04 1.44 2.01 -1.26 -0.69 115.64 121.39 2rop s THR 123 Ca -0.13 -0.07 -0.07 0.00 0.31 0.00 0.00 61.69 61.74 2rop s THR 123 Cb -0.06 -3.55 -0.01 0.00 0.01 0.00 0.00 72.50 68.89 2rop s THR 123 CO 0.02 0.32 0.13 -0.89 -0.69 0.00 0.00 174.62 173.51 2rop s THR 124 N -1.34 0.13 -0.08 -0.82 2.01 -0.07 -4.96 115.64 110.51 2rop s THR 124 Ca 0.28 -1.03 0.02 0.00 0.31 0.00 0.00 61.69 61.27 2rop s THR 124 Cb -0.13 -0.92 -0.02 0.00 0.01 0.00 0.00 72.50 71.44 2rop s THR 124 CO 0.18 -0.57 -0.15 -0.22 -0.69 0.00 0.00 174.62 173.18 2rop s LEU 125 N -2.14 2.67 -0.00 4.42 0.20 -1.26 -0.84 118.68 121.72 2rop s LEU 125 Ca -0.05 -0.27 0.07 0.00 0.69 0.00 0.00 54.13 54.57 2rop s LEU 125 Cb -0.01 -1.56 -0.02 0.00 -0.43 0.00 0.00 46.19 44.17 2rop s LEU 125 CO -0.05 0.27 -0.22 -0.63 -0.29 0.00 0.00 176.35 175.44 2rop s ILE 126 N -0.30 1.70 -0.19 6.68 -1.09 0.20 -1.78 121.20 126.43 2rop s ILE 126 Ca 0.02 -0.99 -0.06 0.00 -2.23 0.00 0.00 60.65 57.39 2rop s ILE 126 Cb -0.13 -1.43 -0.03 0.00 -1.58 0.00 0.00 42.46 39.29 2rop s ILE 126 CO 0.03 0.42 0.03 0.00 -1.23 0.00 0.00 174.94 174.19 2rop s ALA 127 N -0.57 3.20 0.02 9.38 0.00 0.30 -0.80 121.76 133.30 2rop s ALA 127 Ca 0.08 -0.87 0.07 0.00 0.00 0.00 0.00 51.96 51.25 2rop s ALA 127 Cb -0.08 -1.83 -0.03 0.00 0.00 0.00 0.00 23.12 21.18 2rop s ALA 127 CO -0.00 0.02 -0.20 0.42 0.00 0.00 0.00 175.76 176.00 2rop s ILE 128 N 0.68 2.59 -0.49 0.00 1.09 -0.51 -0.47 121.20 124.09 2rop s ILE 128 Ca 0.01 -1.17 0.07 0.00 -1.10 0.00 0.00 60.65 58.47 2rop s ILE 128 Cb -0.14 -2.04 0.37 0.00 -1.06 0.00 0.00 42.46 39.59 2rop s ILE 128 CO 0.02 0.40 0.96 0.00 -0.10 0.00 0.00 174.94 176.22 2rop n ALA 129 N 1.80 4.26 -2.66 9.38 0.00 0.28 -4.75 120.51 128.82 2rop n ALA 129 Ca -0.16 -4.27 -0.04 0.00 0.00 0.00 0.00 53.44 48.97 2rop n ALA 129 Cb 0.52 -0.73 0.08 0.00 0.00 0.00 0.00 19.45 19.32 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 -0.21 0.86 2.67 0.00 0.00 -1.26 -4.11 105.19 103.15 2rop n GLY 130 Ca 0.30 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 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 0.12 0.74 -0.12 1.61 1.00 -1.26 -4.94 119.30 116.44 2rop s MET 131 Ca 0.12 -1.22 0.19 0.00 0.00 0.00 0.00 55.69 54.78 2rop s MET 131 Cb 0.30 -1.87 -0.27 0.00 0.00 0.00 0.00 34.83 33.00 2rop s MET 131 CO -0.08 -1.05 0.27 -2.37 0.00 0.00 0.00 175.02 171.79 2rop n THR 132 N 4.55 0.94 -4.28 2.05 5.66 -1.26 -5.00 114.28 116.94 2rop n THR 132 Ca 0.01 -0.73 -0.23 0.00 -3.05 0.00 0.00 64.05 60.05 2rop n THR 132 Cb 0.40 -0.35 -0.12 0.00 -1.55 0.00 0.00 70.33 68.71 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 4.03 1.25 -0.68 0.00 0.00 -1.99 -1.61 119.26 120.26 2rop h ALA 134 Ca -0.45 -0.07 0.18 0.00 0.00 0.00 0.00 54.91 54.57 2rop h ALA 134 Cb 1.18 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 2rop h ALA 134 CO 0.41 0.10 0.48 0.66 0.00 0.00 0.00 179.25 180.89 2rop h SER 135 N 0.00 0.08 -0.48 0.00 4.64 -2.02 -1.80 113.55 113.97 2rop h SER 135 Ca -0.00 0.01 0.08 0.00 -0.47 0.00 0.00 61.79 61.40 2rop h SER 135 Cb 0.26 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.32 2rop h SER 135 CO 0.01 0.04 0.32 0.00 -0.87 0.00 0.00 176.83 176.33 2rop h VAL 137 N 0.31 0.52 0.00 0.00 2.07 -1.51 -1.98 116.25 115.67 2rop h VAL 137 Ca 0.21 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.71 2rop h VAL 137 Cb 0.44 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 2rop h VAL 137 CO -0.05 0.00 -0.10 0.45 0.02 0.00 0.00 177.57 177.89 2rop h HIS 138 N -0.45 0.00 0.12 1.57 3.86 -1.61 0.22 115.15 118.86 2rop h HIS 138 Ca 0.01 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 2rop h HIS 138 Cb 0.44 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.91 2rop h HIS 138 CO -0.17 0.10 -0.06 0.77 0.86 0.00 0.00 177.93 179.44 2rop h SER 139 N 0.00 -0.14 0.11 2.45 0.02 -1.41 -1.97 113.55 112.61 2rop h SER 139 Ca -0.00 -0.40 -0.01 0.00 -0.84 0.00 0.00 61.79 60.54 2rop h SER 139 Cb 0.39 0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.97 2rop h SER 139 CO 0.01 0.38 -0.05 0.40 -1.14 0.00 0.00 176.83 176.43 2rop h ILE 140 N -0.72 1.10 -0.89 3.27 2.04 -0.79 0.10 117.51 121.63 2rop h ILE 140 Ca -0.02 -1.06 0.16 0.00 1.00 0.00 0.00 64.86 64.94 2rop h ILE 140 Cb 0.53 1.74 -0.10 0.00 -0.74 0.00 0.00 36.82 38.26 2rop h ILE 140 CO 0.03 0.25 0.46 -0.08 0.00 0.00 0.00 178.15 178.81 2rop h GLU 141 N -0.67 0.60 0.22 2.37 4.81 -0.76 -2.18 114.58 118.97 2rop h GLU 141 Ca -0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2rop h GLU 141 Cb 0.52 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2rop h GLU 141 CO 0.02 0.40 -0.10 0.78 -0.73 0.00 0.00 179.01 179.38 2rop h GLY 142 N 0.62 -0.30 1.27 1.92 0.00 -1.24 -3.33 103.07 102.01 2rop h GLY 142 Ca 0.50 0.11 -0.18 0.00 0.00 0.00 0.00 47.33 47.76 2rop h GLY 142 CO -0.39 -0.11 -0.57 -0.33 0.00 0.00 0.00 176.54 175.14 2rop h MET 143 N -0.84 0.76 -0.16 4.80 2.86 -1.01 -3.26 114.93 118.08 2rop h MET 143 Ca -0.03 -0.49 -0.15 0.00 -2.06 0.00 0.00 59.70 56.97 2rop h MET 143 Cb 0.22 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2rop h MET 143 CO 0.05 1.12 -0.54 0.82 1.06 0.00 0.00 176.91 179.42 2rop h ILE 144 N 0.57 1.33 0.00 -1.22 1.08 -1.56 -2.74 117.51 114.98 2rop h ILE 144 Ca 0.01 -1.79 0.00 0.00 -0.39 0.00 0.00 64.86 62.68 2rop h ILE 144 Cb 1.16 1.79 0.00 0.00 -3.07 0.00 0.00 36.82 36.70 2rop h ILE 144 CO 0.12 0.55 0.00 -0.24 -0.69 0.00 0.00 178.15 177.89 2rop n SER 145 N -3.95 0.00 0.01 1.72 2.88 -1.23 -2.76 113.62 110.28 2rop n SER 145 Ca -0.03 -0.33 0.11 0.00 -1.33 0.00 0.00 58.87 57.30 2rop n SER 145 Cb 0.59 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.11 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 -0.85 0.08 -3.66 -1.46 6.02 -1.03 -5.00 117.38 111.48 2rop n GLN 146 Ca 0.04 -0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 56.82 2rop n GLN 146 Cb 0.02 -1.52 -0.03 0.00 1.02 0.00 0.00 30.24 29.72 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 -3.26 3.50 0.83 1.08 0.05 -1.11 -5.12 118.68 114.66 2rop s LEU 147 Ca 0.08 -0.61 -0.11 0.00 0.05 0.00 0.00 54.13 53.54 2rop s LEU 147 Cb 0.16 -2.16 0.09 0.00 -2.05 0.00 0.00 46.19 42.23 2rop s LEU 147 CO 0.78 -0.51 1.10 -1.61 -0.55 0.00 0.00 176.35 175.56 2rop s GLU 148 N -4.07 1.79 0.00 1.48 0.41 -1.26 -4.01 118.70 113.04 2rop s GLU 148 Ca 0.45 1.13 0.00 0.00 -0.41 0.00 0.00 54.97 56.14 2rop s GLU 148 Cb -0.05 -1.85 0.00 0.00 -1.78 0.00 0.00 34.13 30.46 2rop s GLU 148 CO 0.27 -1.96 0.00 0.41 -0.49 0.00 0.00 175.26 173.50 2rop n GLY 149 N -0.96 2.01 3.55 -1.39 0.00 -1.26 -4.94 105.19 102.20 2rop n GLY 149 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 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 3.79 0.02 1.61 0.11 -1.26 -0.52 120.40 124.14 2rop s VAL 150 Ca 0.00 0.20 -0.21 0.00 -2.93 0.00 0.00 61.98 59.04 2rop s VAL 150 Cb 0.00 -4.92 -0.18 0.00 -1.53 0.00 0.00 36.38 29.75 2rop s VAL 150 CO 0.00 -1.85 1.23 -0.61 -3.33 0.00 0.00 175.10 170.54 2rop h GLN 151 N 9.97 0.35 -3.21 1.54 4.15 -1.31 -3.47 115.11 123.13 2rop h GLN 151 Ca -0.21 -0.25 -0.22 0.00 0.77 0.00 0.00 58.65 58.74 2rop h GLN 151 Cb 1.05 0.04 -0.30 0.00 0.21 0.00 0.00 27.48 28.48 2rop h GLN 151 CO 1.29 0.87 -0.55 -1.14 -1.93 0.00 0.00 178.83 177.37 2rop s GLN 152 N -3.83 0.15 0.01 1.69 0.74 -1.20 -5.00 119.66 112.21 2rop s GLN 152 Ca -0.14 0.38 0.04 0.00 0.05 0.00 0.00 55.36 55.69 2rop s GLN 152 Cb 0.04 -0.10 -0.01 0.00 1.10 0.00 0.00 33.01 34.04 2rop s GLN 152 CO 0.77 -0.13 -0.13 -1.50 -0.55 0.00 0.00 175.29 173.75 2rop s ILE 153 N 0.93 0.99 0.01 -2.34 -1.16 -1.26 -0.68 121.20 117.69 2rop s ILE 153 Ca -0.07 -0.70 0.04 0.00 -0.51 0.00 0.00 60.65 59.41 2rop s ILE 153 Cb -0.09 -0.86 -0.01 0.00 0.61 0.00 0.00 42.46 42.11 2rop s ILE 153 CO -0.05 0.16 -0.12 -0.55 -2.81 0.00 0.00 174.94 171.57 2rop s SER 154 N -0.62 1.37 -0.03 4.50 0.15 -0.26 -4.91 113.70 113.90 2rop s SER 154 Ca 0.03 -0.31 -0.09 0.00 0.70 0.00 0.00 55.95 56.28 2rop s SER 154 Cb -0.06 -0.12 0.01 0.00 -1.71 0.00 0.00 66.02 64.15 2rop s SER 154 CO 0.00 0.08 0.20 0.54 1.20 0.00 0.00 173.24 175.26 2rop s VAL 155 N -0.53 0.05 -0.01 4.45 0.11 -1.26 -0.77 120.40 122.44 2rop s VAL 155 Ca 0.02 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 58.64 2rop s VAL 155 Cb -0.06 -0.44 0.01 0.00 -1.53 0.00 0.00 36.38 34.36 2rop s VAL 155 CO 0.00 -0.24 0.00 -0.55 -3.33 0.00 0.00 175.10 170.98 2rop s SER 156 N -0.92 0.13 0.38 3.54 0.15 -0.33 -4.91 113.70 111.74 2rop s SER 156 Ca -0.10 -0.00 0.28 0.00 0.70 0.00 0.00 55.95 56.82 2rop s SER 156 Cb -0.05 -0.05 1.15 0.00 -1.71 0.00 0.00 66.02 65.36 2rop s SER 156 CO 0.02 -0.04 1.83 -0.07 1.20 0.00 0.00 173.24 176.18 2rop h LEU 157 N 6.55 0.00 -0.50 3.45 -0.00 -1.94 -0.41 115.31 122.46 2rop h LEU 157 Ca -0.32 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.53 2rop h LEU 157 Cb 1.18 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.81 2rop h LEU 157 CO 0.50 0.00 0.20 0.00 -0.00 0.00 0.00 178.44 179.14 2rop h ALA 158 N 2.16 0.65 0.00 1.53 0.00 -1.95 -3.34 119.26 118.31 2rop h ALA 158 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2rop h ALA 158 Cb 0.42 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2rop h ALA 158 CO 0.00 0.27 -0.79 0.39 0.00 0.00 0.00 179.25 179.12 2rop n GLU 159 N -4.55 2.34 -1.90 0.00 -0.58 -1.23 -5.03 120.64 109.68 2rop n GLU 159 Ca 0.02 -0.02 -0.02 0.00 -0.42 0.00 0.00 57.16 56.71 2rop n GLU 159 Cb 0.16 -0.93 -0.00 0.00 -0.57 0.00 0.00 31.44 30.09 2rop n GLU 159 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2rop n GLY 160 N 1.81 0.32 3.22 0.62 0.00 -0.19 -4.98 105.19 105.99 2rop n GLY 160 Ca -0.00 -0.83 -0.20 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.10 1.33 0.05 2.61 -4.23 -1.03 -1.43 115.64 110.84 2rop s THR 161 Ca 0.00 -1.50 0.06 0.00 -1.18 0.00 0.00 61.69 59.07 2rop s THR 161 Cb 0.00 -1.34 -0.04 0.00 1.34 0.00 0.00 72.50 72.47 2rop s THR 161 CO 0.00 -0.25 -0.12 0.00 -0.54 0.00 0.00 174.62 173.72 2rop s ALA 162 N -1.53 2.86 -0.14 3.99 0.00 0.02 -1.19 121.76 125.77 2rop s ALA 162 Ca 0.04 -1.16 0.02 0.00 0.00 0.00 0.00 51.96 50.85 2rop s ALA 162 Cb -0.08 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.12 2rop s ALA 162 CO 0.03 0.61 -0.20 0.99 0.00 0.00 0.00 175.76 177.20 2rop s THR 163 N -1.06 2.30 -0.01 0.00 2.01 0.05 -0.63 115.64 118.31 2rop s THR 163 Ca 0.18 -0.90 0.00 0.00 0.31 0.00 0.00 61.69 61.28 2rop s THR 163 Cb -0.11 -1.93 0.01 0.00 0.01 0.00 0.00 72.50 70.47 2rop s THR 163 CO 0.09 0.54 -0.01 0.54 -0.69 0.00 0.00 174.62 175.09 2rop s VAL 164 N 0.72 0.11 -0.43 3.82 0.11 -0.02 -1.11 120.40 123.59 2rop s VAL 164 Ca -0.09 -0.01 -0.18 0.00 -2.93 0.00 0.00 61.98 58.77 2rop s VAL 164 Cb -0.16 -0.13 0.02 0.00 -1.53 0.00 0.00 36.38 34.58 2rop s VAL 164 CO 0.01 0.06 0.51 -0.22 -3.33 0.00 0.00 175.10 172.12 2rop s LEU 165 N 0.25 4.78 0.19 2.54 1.98 0.14 -0.89 118.68 127.67 2rop s LEU 165 Ca -0.02 -0.60 0.08 0.00 -2.89 0.00 0.00 54.13 50.69 2rop s LEU 165 Cb -0.04 -2.48 -0.04 0.00 0.66 0.00 0.00 46.19 44.28 2rop s LEU 165 CO -0.01 -0.66 -0.00 -0.72 -1.89 0.00 0.00 176.35 173.08 2rop s TYR 166 N 2.35 2.81 -0.46 5.38 1.13 0.14 -0.77 117.35 127.92 2rop s TYR 166 Ca 0.15 -0.16 -0.17 0.00 -1.41 0.00 0.00 57.07 55.48 2rop s TYR 166 Cb -0.16 -1.34 0.05 0.00 -1.10 0.00 0.00 41.96 39.40 2rop s TYR 166 CO 0.15 0.53 0.47 1.21 -2.51 0.00 0.00 175.55 175.40 2rop s ASN 167 N -3.08 6.18 0.35 -0.18 3.84 0.32 -0.60 114.94 121.76 2rop s ASN 167 Ca 0.28 -0.99 0.26 0.00 0.21 0.00 0.00 52.86 52.62 2rop s ASN 167 Cb -0.09 -2.22 1.18 0.00 -0.55 0.00 0.00 41.25 39.57 2rop s ASN 167 CO 0.19 -0.68 1.79 -0.65 -2.79 0.00 0.00 177.10 174.95 2rop h PRO 168 N 8.81 0.00 0.00 0.43 0.11 -1.91 0.18 132.00 139.62 2rop h PRO 168 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2rop h PRO 168 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2rop h PRO 168 CO 0.87 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.66 2rop n ALA 169 N -1.84 1.90 -0.02 -0.75 0.00 -1.26 -4.03 120.51 114.50 2rop n ALA 169 Ca 0.01 0.05 -0.02 0.00 0.00 0.00 0.00 53.44 53.47 2rop n ALA 169 Cb 0.18 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.18 2rop n ALA 169 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2rop n VAL 170 N -2.27 0.25 -3.71 0.00 0.31 -0.08 -5.10 118.33 107.73 2rop n VAL 170 Ca 0.03 -0.14 -0.13 0.00 -0.01 0.00 0.00 64.34 64.09 2rop n VAL 170 Cb 0.31 -0.86 -0.07 0.00 -0.91 0.00 0.00 33.84 32.30 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 -2.09 0.06 0.26 2.52 2.07 -0.41 -4.92 121.20 118.69 2rop s ILE 171 Ca -0.03 -0.46 0.10 0.00 -1.41 0.00 0.00 60.65 58.85 2rop s ILE 171 Cb 0.01 -0.82 -0.04 0.00 0.13 0.00 0.00 42.46 41.74 2rop s ILE 171 CO 0.14 -0.25 -0.05 -0.44 -1.91 0.00 0.00 174.94 172.43 2rop s SER 172 N -1.65 4.33 0.37 4.50 0.01 -1.26 -4.10 113.70 115.89 2rop s SER 172 Ca -0.09 -0.71 0.14 0.00 1.31 0.00 0.00 55.95 56.60 2rop s SER 172 Cb -0.03 -0.73 0.98 0.00 0.21 0.00 0.00 66.02 66.46 2rop s SER 172 CO 0.01 0.02 1.78 -0.65 0.41 0.00 0.00 173.24 174.81 2rop h PRO 173 N 2.08 0.50 -0.68 12.44 0.11 -2.00 0.19 132.00 144.65 2rop h PRO 173 Ca -0.44 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.70 2rop h PRO 173 Cb 1.25 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 2rop h PRO 173 CO 0.60 0.33 0.45 1.05 -0.21 0.00 0.00 178.00 180.21 2rop h GLU 174 N 0.51 0.69 -0.04 1.05 4.11 -2.00 -1.90 114.58 116.99 2rop h GLU 174 Ca 0.58 -0.04 -0.16 0.00 0.07 0.00 0.00 59.36 59.81 2rop h GLU 174 Cb 1.28 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 2rop h GLU 174 CO -0.33 0.46 -0.69 0.93 0.07 0.00 0.00 179.01 179.45 2rop h GLU 175 N 0.71 0.20 0.18 1.06 5.08 -1.38 -2.06 114.58 118.37 2rop h GLU 175 Ca 0.29 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2rop h GLU 175 Cb 0.23 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2rop h GLU 175 CO -0.09 0.81 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.56 2rop h LEU 176 N 0.14 -0.24 -0.71 1.33 3.38 -0.93 -0.40 115.31 117.88 2rop h LEU 176 Ca -0.02 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2rop h LEU 176 Cb 1.23 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 2rop h LEU 176 CO 0.10 -0.16 0.35 0.08 0.09 0.00 0.00 178.44 178.90 2rop h ARG 177 N -0.26 1.02 -0.57 1.13 0.11 -1.47 -2.78 114.38 111.56 2rop h ARG 177 Ca -0.02 -0.15 0.03 0.00 0.10 0.00 0.00 59.98 59.94 2rop h ARG 177 Cb 0.21 -0.18 -0.03 0.00 1.11 0.00 0.00 29.97 31.08 2rop h ARG 177 CO 0.03 0.79 0.38 0.00 0.10 0.00 0.00 179.97 181.27 2rop h ALA 178 N 1.17 1.68 -0.12 0.08 0.00 -1.12 -1.77 119.26 119.17 2rop h ALA 178 Ca 0.24 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 2rop h ALA 178 Cb 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2rop h ALA 178 CO -0.03 0.27 -0.60 0.00 0.00 0.00 0.00 179.25 178.89 2rop h ALA 179 N 1.66 0.74 -0.29 0.00 0.00 -0.79 0.23 119.26 120.82 2rop h ALA 179 Ca 0.22 -0.54 -0.17 0.00 0.00 0.00 0.00 54.91 54.42 2rop h ALA 179 Cb 0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2rop h ALA 179 CO -0.06 0.71 -0.51 0.82 0.00 0.00 0.00 179.25 180.22 2rop h ILE 180 N 0.31 1.28 -0.33 0.00 5.03 -1.39 -1.72 117.51 120.70 2rop h ILE 180 Ca -0.00 -1.70 0.00 0.00 -0.12 0.00 0.00 64.86 63.04 2rop h ILE 180 Cb 1.13 1.60 -0.02 0.00 -3.03 0.00 0.00 36.82 36.50 2rop h ILE 180 CO 0.10 0.55 0.22 -0.08 -0.68 0.00 0.00 178.15 178.26 2rop h GLU 181 N 0.63 0.43 0.00 2.37 4.22 -1.16 -2.58 114.58 118.50 2rop h GLU 181 Ca 0.02 -0.03 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 2rop h GLU 181 Cb 1.10 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.25 2rop h GLU 181 CO 0.11 0.29 -0.09 0.22 -2.18 0.00 0.00 179.01 177.36 2rop h ASP 182 N 0.45 0.00 -0.39 1.04 3.58 -0.88 -2.45 116.42 117.76 2rop h ASP 182 Ca 0.12 0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.42 2rop h ASP 182 Cb -0.05 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 2rop h ASP 182 CO -0.03 0.09 -0.33 -0.03 -2.88 0.00 0.00 179.24 176.05 2rop h MET 183 N 0.00 0.93 0.00 0.28 4.05 -1.00 -3.47 114.93 115.72 2rop h MET 183 Ca -0.00 -0.46 0.00 0.00 -0.28 0.00 0.00 59.70 58.96 2rop h MET 183 Cb 0.41 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.21 2rop h MET 183 CO 0.01 1.11 0.00 0.41 0.23 0.00 0.00 176.91 178.68 2rop n GLY 184 N 0.04 0.13 0.00 1.39 0.00 -0.93 -5.11 105.19 100.71 2rop n GLY 184 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 -3.89 1.61 3.72 -1.00 -5.03 117.46 112.87 2rop n PHE 185 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 2rop n PHE 185 Cb 0.00 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.41 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 1.66 0.06 0.03 -1.08 0.41 -1.26 -4.31 118.70 114.22 2rop s GLU 186 Ca 0.00 -0.10 -0.00 0.00 -0.41 0.00 0.00 54.97 54.45 2rop s GLU 186 Cb 0.00 0.02 -0.03 0.00 -1.78 0.00 0.00 34.13 32.34 2rop s GLU 186 CO 0.00 -0.01 -0.03 0.00 -0.49 0.00 0.00 175.26 174.73 2rop s ALA 187 N -0.25 0.31 0.01 5.21 0.00 -1.26 -0.55 121.76 125.23 2rop s ALA 187 Ca -0.03 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.04 2rop s ALA 187 Cb -0.02 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.30 2rop s ALA 187 CO -0.00 -0.26 -0.02 0.45 0.00 0.00 0.00 175.76 175.92 2rop s SER 188 N -2.17 0.26 -0.09 0.00 0.15 0.38 -4.87 113.70 107.36 2rop s SER 188 Ca -0.05 -0.20 -0.19 0.00 0.70 0.00 0.00 55.95 56.21 2rop s SER 188 Cb -0.01 0.02 -0.04 0.00 -1.71 0.00 0.00 66.02 64.27 2rop s SER 188 CO -0.05 -0.08 0.54 0.68 1.20 0.00 0.00 173.24 175.52 2rop s VAL 189 N -0.53 5.11 0.00 4.45 -7.23 -1.26 -0.54 120.40 120.41 2rop s VAL 189 Ca -0.05 1.09 0.00 0.00 -1.81 0.00 0.00 61.98 61.21 2rop s VAL 189 Cb -0.04 -3.87 0.00 0.00 0.56 0.00 0.00 36.38 33.03 2rop s VAL 189 CO -0.00 0.34 0.06 1.33 -0.31 0.00 0.00 175.10 176.52