#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 2.42 -0.05 1.55 2.01 -1.26 -2.19 115.64 118.12 2rop s THR 21 Ca 0.00 -1.32 -0.02 0.00 0.31 0.00 0.00 61.69 60.66 2rop s THR 21 Cb 0.00 -1.98 0.04 0.00 0.01 0.00 0.00 72.50 70.56 2rop s THR 21 CO 0.00 0.34 0.11 -0.22 -0.69 0.00 0.00 174.62 174.16 2rop s LEU 22 N -1.36 0.72 -0.10 4.42 0.20 -1.12 -4.99 118.68 116.45 2rop s LEU 22 Ca 0.13 0.22 -0.12 0.00 0.69 0.00 0.00 54.13 55.05 2rop s LEU 22 Cb -0.10 0.21 -0.05 0.00 -0.43 0.00 0.00 46.19 45.82 2rop s LEU 22 CO 0.04 -0.16 0.29 -1.58 -0.29 0.00 0.00 176.35 174.65 2rop s GLN 23 N 1.29 3.94 -0.01 1.98 2.00 -1.26 -1.76 119.66 125.84 2rop s GLN 23 Ca -0.07 0.13 -0.04 0.00 -2.00 0.00 0.00 55.36 53.38 2rop s GLN 23 Cb -0.12 -3.30 -0.00 0.00 0.80 0.00 0.00 33.01 30.39 2rop s GLN 23 CO -0.05 0.52 0.08 -0.48 -0.50 0.00 0.00 175.29 174.86 2rop s LEU 24 N -0.40 1.76 -0.33 3.68 2.34 -0.24 -4.56 118.68 120.93 2rop s LEU 24 Ca 0.18 -0.16 -0.05 0.00 0.06 0.00 0.00 54.13 54.16 2rop s LEU 24 Cb -0.14 0.42 0.04 0.00 -0.56 0.00 0.00 46.19 45.96 2rop s LEU 24 CO 0.07 -0.25 0.08 -0.60 -1.06 0.00 0.00 176.35 174.59 2rop s ARG 25 N -0.97 2.56 0.28 1.48 3.00 0.02 -0.67 118.95 124.65 2rop s ARG 25 Ca -0.11 -1.22 -0.18 0.00 -1.00 0.00 0.00 55.73 53.22 2rop s ARG 25 Cb -0.06 -3.40 -0.09 0.00 0.00 0.00 0.00 34.95 31.40 2rop s ARG 25 CO 0.00 -0.67 0.74 0.42 0.00 0.00 0.00 175.30 175.80 2rop s ILE 26 N 1.36 4.60 -0.09 4.11 1.01 -1.26 -1.31 121.20 129.62 2rop s ILE 26 Ca -0.02 1.15 -0.09 0.00 0.00 0.00 0.00 60.65 61.68 2rop s ILE 26 Cb -0.20 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 2rop s ILE 26 CO 0.02 0.01 0.21 -0.62 0.00 0.00 0.00 174.94 174.56 2rop s ASP 27 N -1.95 6.50 0.00 3.58 2.15 0.06 -4.43 116.67 122.58 2rop s ASP 27 Ca 0.49 0.60 0.00 0.00 0.43 0.00 0.00 52.55 54.07 2rop s ASP 27 Cb -0.13 -2.12 0.00 0.00 -0.30 0.00 0.00 42.92 40.37 2rop s ASP 27 CO 0.19 0.38 0.00 0.61 -0.17 0.00 0.00 175.17 176.18 2rop n GLY 28 N 1.96 1.13 0.18 2.66 0.00 -1.26 -3.71 105.19 106.14 2rop n GLY 28 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.97 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 3.44 0.00 0.00 1.61 -0.00 -1.96 -1.84 114.93 116.18 2rop h MET 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2rop h MET 29 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 2rop h MET 29 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.91 178.49 2rop n HIS 30 N -2.41 0.56 0.56 -0.10 -0.00 -1.26 -2.62 115.22 109.96 2rop n HIS 30 Ca -0.00 0.26 0.13 0.00 -0.00 0.00 0.00 57.72 58.11 2rop n HIS 30 Cb 0.13 -0.92 0.43 0.00 -0.00 0.00 0.00 29.99 29.62 2rop n HIS 30 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2rop n LYS 32 N -2.25 0.00 0.27 0.00 0.00 -1.08 -4.52 118.16 110.58 2rop n LYS 32 Ca 0.05 0.00 0.18 0.00 0.00 0.00 0.00 58.31 58.54 2rop n LYS 32 Cb 0.37 0.00 0.98 0.00 0.00 0.00 0.00 35.03 36.38 2rop n LYS 32 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.40 178.17 2rop h SER 33 N 0.00 0.00 0.24 3.14 0.02 -1.92 -2.75 113.55 112.28 2rop h SER 33 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2rop h SER 33 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2rop h SER 33 CO 0.00 0.00 -0.12 0.00 -1.14 0.00 0.00 176.83 175.57 2rop h VAL 35 N -0.55 1.10 -0.35 0.00 3.04 -1.79 -3.27 116.25 114.44 2rop h VAL 35 Ca -0.03 -1.57 0.07 0.00 -1.01 0.00 0.00 66.70 64.16 2rop h VAL 35 Cb 0.40 1.90 -0.06 0.00 -2.01 0.00 0.00 31.29 31.52 2rop h VAL 35 CO 0.05 0.42 -0.05 0.25 -1.01 0.00 0.00 177.57 177.23 2rop h LEU 36 N 0.00 -0.24 -1.03 3.16 5.85 -1.61 -0.03 115.31 121.40 2rop h LEU 36 Ca -0.00 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2rop h LEU 36 Cb 0.86 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 2rop h LEU 36 CO 0.06 -0.08 0.52 0.78 -0.34 0.00 0.00 178.44 179.37 2rop h ASN 37 N 0.04 1.05 -0.03 1.25 2.35 -1.69 0.36 115.58 118.91 2rop h ASN 37 Ca 0.17 -0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2rop h ASN 37 Cb 0.25 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 2rop h ASN 37 CO -0.33 0.81 0.00 0.40 -1.65 0.00 0.00 177.43 176.67 2rop h ILE 38 N 1.20 1.22 -0.65 2.81 2.04 -1.55 -2.92 117.51 119.67 2rop h ILE 38 Ca 0.31 -0.67 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 2rop h ILE 38 Cb -0.04 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2rop h ILE 38 CO -0.06 0.18 0.23 -0.08 0.00 0.00 0.00 178.15 178.42 2rop h GLU 39 N -0.21 1.00 -0.54 2.37 4.22 -0.54 -1.36 114.58 119.51 2rop h GLU 39 Ca 0.01 -0.20 -0.10 0.00 0.08 0.00 0.00 59.36 59.14 2rop h GLU 39 Cb 0.29 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 2rop h GLU 39 CO 0.00 0.86 -0.08 1.49 -2.18 0.00 0.00 179.01 179.10 2rop h GLU 40 N 0.93 0.99 0.00 1.92 4.81 -0.98 -3.32 114.58 118.92 2rop h GLU 40 Ca 0.21 -0.34 -0.15 0.00 -0.13 0.00 0.00 59.36 58.95 2rop h GLU 40 Cb 0.26 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 2rop h GLU 40 CO -0.01 1.01 -1.48 0.09 -0.73 0.00 0.00 179.01 177.89 2rop n ASN 41 N -4.16 0.73 -4.51 1.04 3.02 -1.10 -4.88 115.26 105.40 2rop n ASN 41 Ca 0.02 0.32 -0.38 0.00 -0.03 0.00 0.00 54.58 54.51 2rop n ASN 41 Cb 0.38 0.39 -0.12 0.00 -0.61 0.00 0.00 39.78 39.82 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 -2.99 4.83 0.00 2.41 -1.09 -0.53 -4.37 121.20 119.47 2rop s ILE 42 Ca -0.04 -0.10 0.00 0.00 -2.23 0.00 0.00 60.65 58.28 2rop s ILE 42 Cb 0.09 -3.34 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 2rop s ILE 42 CO 0.82 0.22 0.00 0.61 -1.23 0.00 0.00 174.94 175.35 2rop n GLY 43 N 5.00 1.04 0.19 6.18 0.00 -1.26 -4.53 105.19 111.81 2rop n GLY 43 Ca -0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.01 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 0.73 -1.64 1.61 3.00 -1.26 -4.21 117.38 115.61 2rop n GLN 44 Ca 0.00 -0.38 -0.29 0.00 -0.01 0.00 0.00 57.00 56.32 2rop n GLN 44 Cb 0.00 -1.49 0.13 0.00 0.00 0.00 0.00 30.24 28.87 2rop n GLN 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2rop s LEU 45 N -2.53 2.14 0.02 1.08 1.43 -1.25 -5.03 118.68 114.54 2rop s LEU 45 Ca 0.25 0.89 -0.21 0.00 -1.03 0.00 0.00 54.13 54.02 2rop s LEU 45 Cb 0.19 -3.23 -0.12 0.00 0.03 0.00 0.00 46.19 43.06 2rop s LEU 45 CO 0.52 -2.41 1.08 0.25 0.23 0.00 0.00 176.35 176.02 2rop h LEU 46 N -1.40 -0.64 0.05 1.79 6.46 -2.01 -3.36 115.31 116.20 2rop h LEU 46 Ca -0.49 0.02 -0.20 0.00 -0.12 0.00 0.00 57.88 57.09 2rop h LEU 46 Cb 1.33 0.16 0.02 0.00 -0.73 0.00 0.00 40.66 41.44 2rop h LEU 46 CO 0.62 -0.37 -0.80 1.23 -0.62 0.00 0.00 178.44 178.49 2rop h GLY 47 N -0.92 0.51 -4.84 3.75 0.00 -1.92 -3.44 103.07 96.21 2rop h GLY 47 Ca -0.08 -1.00 -0.56 0.00 0.00 0.00 0.00 47.33 45.70 2rop h GLY 47 CO 0.13 0.88 0.68 0.14 0.00 0.00 0.00 176.54 178.36 2rop s VAL 48 N -3.02 4.57 -0.22 4.60 1.01 -1.26 -2.09 120.40 123.98 2rop s VAL 48 Ca -0.12 1.86 -0.12 0.00 0.00 0.00 0.00 61.98 63.60 2rop s VAL 48 Cb 0.04 -4.20 -0.18 0.00 0.00 0.00 0.00 36.38 32.04 2rop s VAL 48 CO 0.85 -0.04 -0.00 1.67 0.00 0.00 0.00 175.10 177.58 2rop n GLN 49 N 5.44 0.63 -4.04 2.72 7.27 -0.25 -3.79 117.38 125.35 2rop n GLN 49 Ca 0.10 0.34 -0.11 0.00 0.07 0.00 0.00 57.00 57.41 2rop n GLN 49 Cb 0.47 -1.62 -0.06 0.00 2.41 0.00 0.00 30.24 31.44 2rop n GLN 49 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2rop s SER 50 N -7.03 0.16 -0.06 1.69 0.15 -1.00 -4.48 113.70 103.13 2rop s SER 50 Ca -0.32 -1.12 -0.02 0.00 0.70 0.00 0.00 55.95 55.18 2rop s SER 50 Cb 0.09 0.58 0.04 0.00 -1.71 0.00 0.00 66.02 65.02 2rop s SER 50 CO 0.60 -1.14 0.12 -0.51 1.20 0.00 0.00 173.24 173.50 2rop s ILE 51 N -3.79 -0.13 0.12 6.45 1.10 -1.26 -0.88 121.20 122.81 2rop s ILE 51 Ca 0.27 0.28 0.11 0.00 -0.51 0.00 0.00 60.65 60.79 2rop s ILE 51 Cb 0.00 -0.22 -0.04 0.00 0.15 0.00 0.00 42.46 42.36 2rop s ILE 51 CO 0.12 0.12 -0.27 0.00 -2.11 0.00 0.00 174.94 172.80 2rop s GLN 52 N 1.68 1.43 0.18 3.50 -2.07 -0.39 -5.00 119.66 118.99 2rop s GLN 52 Ca -0.03 -1.32 0.06 0.00 -1.82 0.00 0.00 55.36 52.25 2rop s GLN 52 Cb -0.12 -1.88 -0.04 0.00 -1.09 0.00 0.00 33.01 29.88 2rop s GLN 52 CO -0.05 0.45 0.12 0.14 -1.32 0.00 0.00 175.29 174.63 2rop s VAL 53 N -1.04 4.35 -0.36 3.63 -7.23 -1.26 -0.55 120.40 117.93 2rop s VAL 53 Ca 0.13 -1.21 0.13 0.00 -1.81 0.00 0.00 61.98 59.23 2rop s VAL 53 Cb -0.10 -3.24 0.37 0.00 0.56 0.00 0.00 36.38 33.97 2rop s VAL 53 CO 0.06 -0.16 0.78 -0.24 -0.31 0.00 0.00 175.10 175.23 2rop n SER 54 N -0.47 1.01 0.25 4.85 2.88 0.17 -4.88 113.62 117.43 2rop n SER 54 Ca -0.08 -2.95 0.12 0.00 -1.33 0.00 0.00 58.87 54.62 2rop n SER 54 Cb 0.55 -0.60 0.62 0.00 -0.75 0.00 0.00 64.21 64.03 2rop n SER 54 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2rop h LEU 55 N 3.00 0.00 -0.45 2.46 3.38 -1.89 -1.04 115.31 120.77 2rop h LEU 55 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2rop h LEU 55 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2rop h LEU 55 CO 0.50 0.16 0.00 -1.84 0.09 0.00 0.00 178.44 177.36 2rop n GLU 56 N -3.49 0.06 0.00 1.13 0.28 -1.26 -1.56 120.64 115.80 2rop n GLU 56 Ca -0.01 0.46 0.00 0.00 -0.16 0.00 0.00 57.16 57.45 2rop n GLU 56 Cb 0.32 -1.67 0.00 0.00 1.43 0.00 0.00 31.44 31.52 2rop n GLU 56 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2rop n ASN 57 N -1.80 1.51 -0.60 -1.84 5.15 -0.50 -5.01 115.26 112.17 2rop n ASN 57 Ca 0.01 -1.65 -0.08 0.00 -0.60 0.00 0.00 54.58 52.26 2rop n ASN 57 Cb 0.09 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.31 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 -0.33 -1.58 -3.46 1.20 4.01 -0.60 -4.99 118.16 112.42 2rop n LYS 58 Ca 0.00 0.74 -0.19 0.00 -0.51 0.00 0.00 58.31 58.35 2rop n LYS 58 Cb 0.23 -5.06 -0.01 0.00 -0.51 0.00 0.00 35.03 29.67 2rop n LYS 58 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 2rop s THR 59 N -1.77 3.44 0.03 -0.18 -4.23 -0.55 -4.12 115.64 108.26 2rop s THR 59 Ca 0.00 -1.15 -0.01 0.00 -1.18 0.00 0.00 61.69 59.35 2rop s THR 59 Cb 0.00 -3.18 -0.02 0.00 1.34 0.00 0.00 72.50 70.63 2rop s THR 59 CO 0.00 -0.10 -0.01 0.00 -0.54 0.00 0.00 174.62 173.98 2rop s ALA 60 N -2.30 0.16 -0.04 3.99 0.00 0.15 -0.66 121.76 123.06 2rop s ALA 60 Ca 0.47 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.75 2rop s ALA 60 Cb -0.08 0.19 0.01 0.00 0.00 0.00 0.00 23.12 23.24 2rop s ALA 60 CO 0.30 -0.23 -0.11 1.14 0.00 0.00 0.00 175.76 176.87 2rop s GLN 61 N -2.14 1.25 -0.09 0.00 -2.07 0.29 -1.08 119.66 115.83 2rop s GLN 61 Ca -0.10 -0.36 -0.12 0.00 -1.82 0.00 0.00 55.36 52.97 2rop s GLN 61 Cb -0.05 -1.12 -0.05 0.00 -1.09 0.00 0.00 33.01 30.71 2rop s GLN 61 CO -0.03 0.09 0.29 0.54 -1.32 0.00 0.00 175.29 174.86 2rop s VAL 62 N 0.36 5.26 -0.77 3.63 0.11 -0.72 -1.26 120.40 127.01 2rop s VAL 62 Ca -0.07 0.56 -0.07 0.00 -2.93 0.00 0.00 61.98 59.47 2rop s VAL 62 Cb -0.11 -3.59 0.20 0.00 -1.53 0.00 0.00 36.38 31.34 2rop s VAL 62 CO 0.01 0.53 0.65 -0.54 -3.33 0.00 0.00 175.10 172.43 2rop s LYS 63 N -0.57 3.14 0.50 1.54 1.02 -0.06 -2.78 119.74 122.54 2rop s LYS 63 Ca 0.19 -2.69 0.02 0.00 0.02 0.00 0.00 55.97 53.51 2rop s LYS 63 Cb -0.14 -4.06 0.02 0.00 -0.52 0.00 0.00 37.83 33.13 2rop s LYS 63 CO 0.08 -1.23 0.14 2.48 -0.92 0.00 0.00 175.35 175.89 2rop n TYR 64 N 3.39 0.51 -4.98 3.18 4.11 -0.93 -1.09 117.16 121.35 2rop n TYR 64 Ca 0.13 -2.36 -0.29 0.00 -0.00 0.00 0.00 57.90 55.39 2rop n TYR 64 Cb 0.41 -0.36 -0.15 0.00 -0.00 0.00 0.00 39.34 39.23 2rop n TYR 64 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 2rop s ASP 65 N -3.84 2.78 0.00 9.48 -1.08 -0.89 0.21 116.67 123.33 2rop s ASP 65 Ca 0.11 -0.49 0.12 0.00 -0.52 0.00 0.00 52.55 51.77 2rop s ASP 65 Cb -0.01 -0.28 0.53 0.00 -1.46 0.00 0.00 42.92 41.71 2rop s ASP 65 CO 0.07 0.25 1.37 -0.81 0.52 0.00 0.00 175.17 176.57 2rop n PRO 66 N 2.18 1.33 -0.02 4.34 -0.04 -1.26 -4.21 135.00 137.32 2rop n PRO 66 Ca -0.16 -0.51 -0.12 0.00 -0.04 0.00 0.00 63.50 62.67 2rop n PRO 66 Cb 0.52 -1.22 -0.10 0.00 -0.04 0.00 0.00 33.50 32.66 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 0.91 -0.04 0.36 3.54 0.87 -1.97 -3.39 113.55 113.83 2rop h SER 67 Ca 0.00 -0.64 0.00 0.00 -1.23 0.00 0.00 61.79 59.92 2rop h SER 67 Cb 0.20 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2rop h SER 67 CO 0.00 0.67 -1.22 0.00 -0.53 0.00 0.00 176.83 175.75 2rop s THR 69 N -3.26 0.00 0.15 0.00 -1.32 -1.26 -4.95 115.64 105.01 2rop s THR 69 Ca 0.01 -1.61 -0.18 0.00 -1.21 0.00 0.00 61.69 58.71 2rop s THR 69 Cb 0.14 -2.53 0.04 0.00 -1.51 0.00 0.00 72.50 68.64 2rop s THR 69 CO 0.83 0.00 0.48 -0.94 -2.21 0.00 0.00 174.62 172.78 2rop s SER 70 N -3.18 -0.30 0.21 8.08 1.04 -1.26 -4.55 113.70 113.72 2rop s SER 70 Ca 0.30 -0.31 -0.10 0.00 0.48 0.00 0.00 55.95 56.32 2rop s SER 70 Cb 0.00 0.53 0.28 0.00 0.10 0.00 0.00 66.02 66.93 2rop s SER 70 CO 0.17 -0.94 1.74 -0.65 0.98 0.00 0.00 173.24 174.54 2rop h PRO 71 N 2.24 0.39 -0.73 4.02 0.11 -2.00 -0.72 132.00 135.32 2rop h PRO 71 Ca -0.32 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.73 2rop h PRO 71 Cb 1.27 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2rop h PRO 71 CO 0.42 0.26 0.31 -0.24 -0.21 0.00 0.00 178.00 178.55 2rop h VAL 72 N 0.41 1.25 -0.49 3.15 3.04 -1.99 -1.10 116.25 120.52 2rop h VAL 72 Ca 0.31 -0.74 -0.10 0.00 -1.01 0.00 0.00 66.70 65.15 2rop h VAL 72 Cb 0.38 0.38 -0.02 0.00 -2.01 0.00 0.00 31.29 30.02 2rop h VAL 72 CO -0.31 0.30 -0.11 0.00 -1.01 0.00 0.00 177.57 176.45 2rop h ALA 73 N 1.15 0.89 -0.62 3.17 0.00 -1.77 -2.03 119.26 120.04 2rop h ALA 73 Ca 0.25 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2rop h ALA 73 Cb 0.18 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2rop h ALA 73 CO -0.02 0.64 0.07 -0.07 0.00 0.00 0.00 179.25 179.86 2rop h LEU 74 N 0.81 1.02 -0.48 0.00 3.38 -1.00 -2.15 115.31 116.89 2rop h LEU 74 Ca 0.13 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2rop h LEU 74 Cb 0.63 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2rop h LEU 74 CO 0.04 1.04 0.28 -0.61 0.09 0.00 0.00 178.44 179.28 2rop h GLN 75 N 0.96 0.54 -0.62 1.13 4.15 -0.93 -0.90 115.11 119.44 2rop h GLN 75 Ca 0.18 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.55 2rop h GLN 75 Cb 0.48 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.02 2rop h GLN 75 CO 0.02 0.36 0.31 0.00 -1.93 0.00 0.00 178.83 177.59 2rop h ARG 76 N 0.56 0.86 0.44 1.69 2.47 -1.24 -3.05 114.38 116.10 2rop h ARG 76 Ca 0.19 -0.10 -0.02 0.00 -1.26 0.00 0.00 59.98 58.79 2rop h ARG 76 Cb 0.03 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 28.18 2rop h ARG 76 CO -0.09 0.65 -0.21 0.00 0.56 0.00 0.00 179.97 180.88 2rop h ALA 77 N 1.48 -0.60 -0.05 0.04 0.00 -0.82 -3.37 119.26 115.95 2rop h ALA 77 Ca 0.22 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2rop h ALA 77 Cb 0.06 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2rop h ALA 77 CO -0.03 -0.56 -0.69 -0.84 0.00 0.00 0.00 179.25 177.14 2rop h ILE 78 N -1.13 1.42 0.00 0.00 3.07 -1.27 -3.24 117.51 116.37 2rop h ILE 78 Ca -0.06 -2.18 0.00 0.00 1.55 0.00 0.00 64.86 64.17 2rop h ILE 78 Cb 0.45 2.15 0.00 0.00 -0.27 0.00 0.00 36.82 39.14 2rop h ILE 78 CO 0.10 0.64 0.00 -0.08 -1.05 0.00 0.00 178.15 177.76 2rop h GLU 79 N 0.15 0.00 -0.66 0.16 4.81 -1.73 -2.70 114.58 114.62 2rop h GLU 79 Ca -0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2rop h GLU 79 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2rop h GLU 79 CO 0.10 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.38 2rop n ALA 80 N -2.07 2.56 0.06 2.92 0.00 -1.22 -4.32 120.51 118.43 2rop n ALA 80 Ca 0.01 -1.22 -0.12 0.00 0.00 0.00 0.00 53.44 52.10 2rop n ALA 80 Cb 0.30 -0.97 -0.07 0.00 0.00 0.00 0.00 19.45 18.70 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 3.81 -0.05-10.39 0.00 3.38 -1.62 -3.45 115.31 106.99 2rop h LEU 81 Ca 0.00 -0.03 -0.44 0.00 0.09 0.00 0.00 57.88 57.51 2rop h LEU 81 Cb 0.99 0.01 0.17 0.00 0.09 0.00 0.00 40.66 41.93 2rop h LEU 81 CO 0.05 -0.01 0.18 -2.16 0.09 0.00 0.00 178.44 176.59 2rop s PRO 82 N -6.06 -0.18 0.00 1.13 0.04 -1.26 -4.92 135.00 123.75 2rop s PRO 82 Ca -0.13 0.26 -0.02 0.00 0.04 0.00 0.00 61.00 61.15 2rop s PRO 82 Cb 0.06 -1.69 -0.07 0.00 0.04 0.00 0.00 34.50 32.83 2rop s PRO 82 CO 0.66 -3.08 2.12 -0.35 0.04 0.00 0.00 177.00 176.39 2rop n PRO 83 N -4.38 1.10 -2.24 0.56 -0.04 -1.26 -4.61 135.00 124.14 2rop n PRO 83 Ca 0.08 -0.27 -0.06 0.00 -0.04 0.00 0.00 63.50 63.21 2rop n PRO 83 Cb 0.58 -1.36 0.03 0.00 -0.04 0.00 0.00 33.50 32.72 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 1.91 0.13 0.39 0.55 0.00 -1.26 -5.02 105.19 101.89 2rop n GLY 84 Ca 0.12 -0.01 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 -2.09 0.95 -4.54 1.61 2.85 -1.26 -5.02 115.26 107.76 2rop n ASN 85 Ca -0.04 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.02 2rop n ASN 85 Cb 0.55 0.00 -0.10 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 -1.47 3.22 0.22 1.20 0.08 -1.26 -4.80 117.98 115.16 2rop s PHE 86 Ca 0.00 -0.06 0.05 0.00 0.12 0.00 0.00 56.93 57.04 2rop s PHE 86 Cb 0.00 -2.61 -0.03 0.00 -0.57 0.00 0.00 43.02 39.80 2rop s PHE 86 CO 0.00 -0.40 0.27 0.15 -0.10 0.00 0.00 175.22 175.14 2rop s LYS 87 N 1.94 3.22 -0.02 0.44 1.02 -1.24 -4.78 119.74 120.32 2rop s LYS 87 Ca 0.10 -0.83 0.05 0.00 0.02 0.00 0.00 55.97 55.31 2rop s LYS 87 Cb -0.17 -2.78 -0.01 0.00 -0.52 0.00 0.00 37.83 34.35 2rop s LYS 87 CO 0.11 0.44 -0.17 0.14 -0.92 0.00 0.00 175.35 174.96 2rop s VAL 88 N -1.95 1.35 -0.06 3.17 -7.23 -1.26 -0.76 120.40 113.65 2rop s VAL 88 Ca 0.33 -0.72 0.02 0.00 -1.81 0.00 0.00 61.98 59.81 2rop s VAL 88 Cb -0.09 -1.13 0.01 0.00 0.56 0.00 0.00 36.38 35.73 2rop s VAL 88 CO 0.27 0.38 -0.12 -0.55 -0.31 0.00 0.00 175.10 174.77 2rop s SER 89 N -0.33 1.74 0.00 4.85 0.15 -0.43 -4.96 113.70 114.73 2rop s SER 89 Ca 0.05 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.41 2rop s SER 89 Cb -0.07 -0.78 0.00 0.00 -1.71 0.00 0.00 66.02 63.45 2rop s SER 89 CO -0.00 0.04 0.00 0.18 1.20 0.00 0.00 173.24 174.66 2rop n LEU 90 N 3.76 0.00 0.00 3.45 4.77 -1.26 -0.80 117.00 126.92 2rop n LEU 90 Ca -0.23 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 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 0.25 0.00 0.00 1.07 -1.33 0.00 0.00 177.39 177.38 2rop n THR 120 N 0.00 0.00 -2.72 -5.08 5.66 -1.26 -5.00 114.28 105.87 2rop n THR 120 Ca 0.00 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.99 2rop n THR 120 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 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 -1.34 0.33 -0.19 0.00 0.15 -0.17 -4.97 113.70 107.52 2rop s SER 122 Ca -0.07 -0.69 -0.11 0.00 0.70 0.00 0.00 55.95 55.78 2rop s SER 122 Cb 0.00 0.14 -0.05 0.00 -1.71 0.00 0.00 66.02 64.41 2rop s SER 122 CO 0.74 -0.42 0.16 -0.89 1.20 0.00 0.00 173.24 174.03 2rop s THR 123 N -2.45 5.39 0.14 6.45 2.01 -1.26 -0.28 115.64 125.64 2rop s THR 123 Ca -0.07 0.26 0.08 0.00 0.31 0.00 0.00 61.69 62.27 2rop s THR 123 Cb -0.03 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.94 2rop s THR 123 CO -0.05 0.43 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.24 2rop s THR 124 N 0.41 1.70 -0.18 -0.82 2.01 -0.54 -4.98 115.64 113.23 2rop s THR 124 Ca 0.10 -1.77 -0.08 0.00 0.31 0.00 0.00 61.69 60.24 2rop s THR 124 Cb -0.11 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.65 2rop s THR 124 CO -0.01 -0.26 0.08 -0.22 -0.69 0.00 0.00 174.62 173.53 2rop s LEU 125 N -2.41 3.95 -0.06 4.42 0.20 -1.26 -1.70 118.68 121.82 2rop s LEU 125 Ca 0.12 0.14 0.04 0.00 0.69 0.00 0.00 54.13 55.12 2rop s LEU 125 Cb -0.07 -2.00 -0.02 0.00 -0.43 0.00 0.00 46.19 43.67 2rop s LEU 125 CO 0.05 0.19 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.51 2rop s ILE 126 N 0.29 2.89 -0.22 6.68 -1.09 0.20 -2.55 121.20 127.40 2rop s ILE 126 Ca 0.05 -0.78 -0.08 0.00 -2.23 0.00 0.00 60.65 57.62 2rop s ILE 126 Cb -0.12 -2.13 -0.04 0.00 -1.58 0.00 0.00 42.46 38.60 2rop s ILE 126 CO -0.00 0.58 0.07 0.00 -1.23 0.00 0.00 174.94 174.36 2rop s ALA 127 N -0.56 3.30 -0.04 9.38 0.00 -0.30 -1.04 121.76 132.50 2rop s ALA 127 Ca 0.08 -0.93 0.05 0.00 0.00 0.00 0.00 51.96 51.15 2rop s ALA 127 Cb -0.11 -2.02 -0.02 0.00 0.00 0.00 0.00 23.12 20.96 2rop s ALA 127 CO 0.01 -0.16 -0.18 0.42 0.00 0.00 0.00 175.76 175.86 2rop s ILE 128 N 1.00 2.77 -0.83 0.00 1.09 -0.38 -0.71 121.20 124.14 2rop s ILE 128 Ca 0.04 -0.84 0.02 0.00 -1.10 0.00 0.00 60.65 58.77 2rop s ILE 128 Cb -0.14 -2.05 0.27 0.00 -1.06 0.00 0.00 42.46 39.48 2rop s ILE 128 CO 0.03 0.59 1.05 0.00 -0.10 0.00 0.00 174.94 176.51 2rop n ALA 129 N 2.36 4.52 -2.66 9.38 0.00 0.68 -4.69 120.51 130.11 2rop n ALA 129 Ca -0.17 -4.78 -0.04 0.00 0.00 0.00 0.00 53.44 48.45 2rop n ALA 129 Cb 0.52 -1.54 0.04 0.00 0.00 0.00 0.00 19.45 18.47 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 1.11 -0.95 3.16 0.00 0.00 -1.26 -2.47 105.19 104.78 2rop n GLY 130 Ca 0.28 0.32 -0.12 0.00 0.00 0.00 0.00 46.02 46.50 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 0.04 0.81 0.00 1.61 1.00 -1.26 -5.00 119.30 116.51 2rop s MET 131 Ca 0.11 -1.23 0.00 0.00 0.00 0.00 0.00 55.69 54.56 2rop s MET 131 Cb 0.17 -0.31 0.00 0.00 0.00 0.00 0.00 34.83 34.69 2rop s MET 131 CO -0.09 0.02 0.00 -2.37 0.00 0.00 0.00 175.02 172.58 2rop n THR 132 N 0.26 0.00 -4.10 2.05 5.66 -1.26 -5.12 114.28 111.77 2rop n THR 132 Ca -0.14 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.53 2rop n THR 132 Cb 0.59 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.30 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 3.99 1.71 -0.15 0.00 0.00 -2.00 -1.65 119.26 121.16 2rop h ALA 134 Ca -0.49 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.44 2rop h ALA 134 Cb 1.18 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2rop h ALA 134 CO 0.63 0.04 0.23 0.66 0.00 0.00 0.00 179.25 180.81 2rop h SER 135 N 0.00 0.00 -0.30 0.00 4.64 -2.02 0.20 113.55 116.07 2rop h SER 135 Ca -0.00 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.41 2rop h SER 135 Cb 0.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2rop h SER 135 CO 0.00 0.00 0.26 0.00 -0.87 0.00 0.00 176.83 176.22 2rop h VAL 137 N 0.00 0.53 0.00 0.00 2.07 -1.15 -1.48 116.25 116.22 2rop h VAL 137 Ca 0.14 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.66 2rop h VAL 137 Cb 0.66 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2rop h VAL 137 CO -0.00 0.00 0.00 1.41 0.02 0.00 0.00 177.57 179.00 2rop n HIS 138 N -5.32 0.84 0.08 1.57 8.25 -0.75 -0.04 115.22 119.85 2rop n HIS 138 Ca -0.03 0.33 -0.09 0.00 -0.26 0.00 0.00 57.72 57.66 2rop n HIS 138 Cb 0.24 -1.02 -0.06 0.00 1.12 0.00 0.00 29.99 30.26 2rop n HIS 138 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2rop h SER 139 N 0.00 -0.23 0.56 0.41 0.02 -1.27 -2.89 113.55 110.14 2rop h SER 139 Ca 0.00 -0.25 -0.03 0.00 -0.84 0.00 0.00 61.79 60.67 2rop h SER 139 Cb 0.39 0.06 0.01 0.00 0.14 0.00 0.00 62.40 63.00 2rop h SER 139 CO 0.00 0.30 -0.27 0.40 -1.14 0.00 0.00 176.83 176.12 2rop h ILE 140 N -0.95 0.10 -0.52 3.27 2.04 -0.82 -1.30 117.51 119.34 2rop h ILE 140 Ca -0.03 -0.45 0.15 0.00 1.00 0.00 0.00 64.86 65.53 2rop h ILE 140 Cb 0.47 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 2rop h ILE 140 CO 0.05 0.02 0.39 -0.08 0.00 0.00 0.00 178.15 178.52 2rop h GLU 141 N -1.16 0.00 0.28 2.37 4.81 -0.68 -0.17 114.58 120.03 2rop h GLU 141 Ca -0.08 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2rop h GLU 141 Cb 0.60 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.99 2rop h GLU 141 CO 0.13 0.00 -0.13 0.78 -0.73 0.00 0.00 179.01 179.05 2rop h GLY 142 N 0.00 -0.39 0.96 1.92 0.00 -1.39 -3.32 103.07 100.85 2rop h GLY 142 Ca 0.25 0.14 -0.20 0.00 0.00 0.00 0.00 47.33 47.52 2rop h GLY 142 CO -0.00 -0.14 -0.76 -0.33 0.00 0.00 0.00 176.54 175.31 2rop h MET 143 N -0.84 0.54 -0.01 4.80 2.86 -1.10 -3.36 114.93 117.83 2rop h MET 143 Ca -0.04 -0.56 -0.13 0.00 -2.06 0.00 0.00 59.70 56.91 2rop h MET 143 Cb 0.29 0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 2rop h MET 143 CO 0.06 1.19 -0.62 0.82 1.06 0.00 0.00 176.91 179.42 2rop h ILE 144 N 0.12 1.43 0.00 -1.22 1.08 -1.24 -2.83 117.51 114.85 2rop h ILE 144 Ca -0.09 -2.10 0.00 0.00 -0.39 0.00 0.00 64.86 62.28 2rop h ILE 144 Cb 1.44 2.12 0.00 0.00 -3.07 0.00 0.00 36.82 37.31 2rop h ILE 144 CO 0.15 0.60 0.00 -1.54 -0.69 0.00 0.00 178.15 176.67 2rop n SER 145 N -3.82 0.00 -1.30 1.72 3.41 -1.25 -3.29 113.62 109.09 2rop n SER 145 Ca -0.01 0.46 0.02 0.00 -0.26 0.00 0.00 58.87 59.07 2rop n SER 145 Cb 0.62 -0.47 0.27 0.00 -0.26 0.00 0.00 64.21 64.37 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 -1.47 3.05 -4.32 4.33 6.02 -1.07 -4.83 117.38 119.10 2rop n GLN 146 Ca 0.02 -3.00 -0.24 0.00 -0.01 0.00 0.00 57.00 53.77 2rop n GLN 146 Cb 0.06 -1.97 -0.08 0.00 1.02 0.00 0.00 30.24 29.27 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 -2.95 3.00 0.26 1.08 0.05 -1.21 -5.12 118.68 113.80 2rop s LEU 147 Ca 0.47 -0.92 -0.30 0.00 0.05 0.00 0.00 54.13 53.43 2rop s LEU 147 Cb 0.39 -1.42 -0.10 0.00 -2.05 0.00 0.00 46.19 43.01 2rop s LEU 147 CO 0.09 -0.18 1.42 -1.61 -0.55 0.00 0.00 176.35 175.51 2rop s GLU 148 N -3.70 4.28 0.00 1.48 8.01 -1.26 -3.69 118.70 123.81 2rop s GLU 148 Ca 0.34 2.29 0.00 0.00 0.01 0.00 0.00 54.97 57.61 2rop s GLU 148 Cb -0.02 -3.10 0.00 0.00 -4.31 0.00 0.00 34.13 26.70 2rop s GLU 148 CO 0.19 -0.39 0.00 0.41 0.01 0.00 0.00 175.26 175.49 2rop n GLY 149 N 1.97 0.45 0.07 -1.39 0.00 -1.26 -4.79 105.19 100.24 2rop n GLY 149 Ca 0.06 -0.68 0.04 0.00 0.00 0.00 0.00 46.02 45.43 2rop n GLY 149 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2rop n VAL 150 N -2.94 0.75 0.00 1.61 3.14 -1.24 -1.14 118.33 118.50 2rop n VAL 150 Ca 0.00 -0.63 0.00 0.00 -2.96 0.00 0.00 64.34 60.75 2rop n VAL 150 Cb 0.00 -0.39 0.00 0.00 -1.06 0.00 0.00 33.84 32.39 2rop n VAL 150 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 2rop n GLN 151 N -2.63 0.00 -4.48 1.45 7.27 -1.24 -4.26 117.38 113.49 2rop n GLN 151 Ca -0.10 0.00 -0.26 0.00 0.07 0.00 0.00 57.00 56.72 2rop n GLN 151 Cb 0.75 0.00 -0.17 0.00 2.41 0.00 0.00 30.24 33.24 2rop n GLN 151 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2rop s GLN 152 N 0.00 1.76 -0.01 3.69 2.00 -1.22 -5.01 119.66 120.87 2rop s GLN 152 Ca 0.00 -0.41 0.02 0.00 -2.00 0.00 0.00 55.36 52.96 2rop s GLN 152 Cb 0.00 -1.51 0.00 0.00 0.80 0.00 0.00 33.01 32.30 2rop s GLN 152 CO 0.00 -0.03 -0.06 -1.50 -0.50 0.00 0.00 175.29 173.20 2rop s ILE 153 N 0.86 0.54 -0.06 -2.34 2.07 -1.26 -0.39 121.20 120.63 2rop s ILE 153 Ca -0.11 -0.26 -0.03 0.00 -1.41 0.00 0.00 60.65 58.85 2rop s ILE 153 Cb -0.15 -0.48 0.03 0.00 0.13 0.00 0.00 42.46 41.98 2rop s ILE 153 CO 0.01 0.17 0.13 -0.55 -1.91 0.00 0.00 174.94 172.79 2rop s SER 154 N 0.08 -0.10 -0.03 4.50 0.15 -0.85 -5.02 113.70 112.43 2rop s SER 154 Ca -0.01 0.27 -0.05 0.00 0.70 0.00 0.00 55.95 56.86 2rop s SER 154 Cb -0.05 0.19 0.01 0.00 -1.71 0.00 0.00 66.02 64.45 2rop s SER 154 CO -0.00 -0.11 0.12 0.54 1.20 0.00 0.00 173.24 174.98 2rop s VAL 155 N 0.80 0.03 -0.03 4.45 0.11 -1.26 -1.06 120.40 123.44 2rop s VAL 155 Ca -0.06 -0.27 -0.01 0.00 -2.93 0.00 0.00 61.98 58.71 2rop s VAL 155 Cb -0.08 -0.26 0.02 0.00 -1.53 0.00 0.00 36.38 34.53 2rop s VAL 155 CO -0.04 -0.15 0.07 -0.55 -3.33 0.00 0.00 175.10 171.10 2rop s SER 156 N -0.47 -0.02 0.64 3.54 0.15 -0.73 -4.93 113.70 111.88 2rop s SER 156 Ca -0.05 0.13 0.38 0.00 0.70 0.00 0.00 55.95 57.10 2rop s SER 156 Cb -0.04 0.06 2.12 0.00 -1.71 0.00 0.00 66.02 66.45 2rop s SER 156 CO 0.00 -0.10 2.27 -0.07 1.20 0.00 0.00 173.24 176.55 2rop h LEU 157 N 6.86 0.00 -1.88 3.45 -0.00 -1.94 -0.09 115.31 121.70 2rop h LEU 157 Ca -0.38 0.00 0.11 0.00 -0.00 0.00 0.00 57.88 57.61 2rop h LEU 157 Cb 1.15 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.79 2rop h LEU 157 CO 0.46 0.00 0.33 0.00 -0.00 0.00 0.00 178.44 179.23 2rop h ALA 158 N 1.91 2.27 0.00 1.53 0.00 -1.95 -3.30 119.26 119.73 2rop h ALA 158 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2rop h ALA 158 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2rop h ALA 158 CO -0.00 -0.39 -0.22 0.39 0.00 0.00 0.00 179.25 179.03 2rop n GLU 159 N -4.44 3.45 -1.79 0.00 -0.58 -1.12 -5.03 120.64 111.14 2rop n GLU 159 Ca 0.08 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.77 2rop n GLU 159 Cb 0.45 -0.50 -0.01 0.00 -0.57 0.00 0.00 31.44 30.81 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 0.67 0.36 3.35 0.62 0.00 -0.06 -4.94 105.19 105.19 2rop n GLY 160 Ca 0.00 -0.72 -0.28 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.24 2.08 -0.08 2.61 -4.23 -1.15 -1.25 115.64 111.40 2rop s THR 161 Ca 0.00 -1.62 0.02 0.00 -1.18 0.00 0.00 61.69 58.90 2rop s THR 161 Cb 0.00 -1.84 -0.03 0.00 1.34 0.00 0.00 72.50 71.97 2rop s THR 161 CO 0.00 0.10 -0.11 0.00 -0.54 0.00 0.00 174.62 174.07 2rop s ALA 162 N -1.03 2.78 -0.21 3.99 0.00 -0.21 -1.77 121.76 125.31 2rop s ALA 162 Ca 0.12 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 51.12 2rop s ALA 162 Cb -0.10 -1.13 -0.01 0.00 0.00 0.00 0.00 23.12 21.88 2rop s ALA 162 CO 0.05 0.48 -0.06 -0.08 0.00 0.00 0.00 175.76 176.15 2rop s THR 163 N -0.48 3.26 -0.02 0.00 -1.32 -0.22 -0.63 115.64 116.23 2rop s THR 163 Ca 0.07 -0.54 -0.02 0.00 -1.21 0.00 0.00 61.69 59.99 2rop s THR 163 Cb -0.12 -2.46 0.00 0.00 -1.51 0.00 0.00 72.50 68.41 2rop s THR 163 CO 0.02 0.44 0.05 0.54 -2.21 0.00 0.00 174.62 173.46 2rop s VAL 164 N 1.34 0.01 -0.59 5.08 0.11 -0.69 -2.00 120.40 123.66 2rop s VAL 164 Ca 0.04 -0.11 -0.21 0.00 -2.93 0.00 0.00 61.98 58.77 2rop s VAL 164 Cb -0.14 -0.12 0.07 0.00 -1.53 0.00 0.00 36.38 34.66 2rop s VAL 164 CO -0.03 -0.06 0.81 -0.22 -3.33 0.00 0.00 175.10 172.26 2rop s LEU 165 N -0.16 4.79 0.24 2.54 1.98 0.48 -1.47 118.68 127.09 2rop s LEU 165 Ca -0.02 -1.03 0.02 0.00 -2.89 0.00 0.00 54.13 50.21 2rop s LEU 165 Cb -0.02 -2.44 -0.03 0.00 0.66 0.00 0.00 46.19 44.36 2rop s LEU 165 CO 0.00 -1.19 0.41 -0.72 -1.89 0.00 0.00 176.35 172.96 2rop s TYR 166 N 3.30 3.48 -0.68 5.38 1.13 0.62 -3.42 117.35 127.15 2rop s TYR 166 Ca 0.18 0.19 -0.14 0.00 -1.41 0.00 0.00 57.07 55.90 2rop s TYR 166 Cb -0.19 -1.75 0.18 0.00 -1.10 0.00 0.00 41.96 39.10 2rop s TYR 166 CO 0.10 0.35 0.61 -0.80 -2.51 0.00 0.00 175.55 173.31 2rop s ASN 167 N -3.67 6.37 0.37 -0.18 -0.87 -0.29 -1.00 114.94 115.67 2rop s ASN 167 Ca 0.37 -2.32 0.04 0.00 -1.57 0.00 0.00 52.86 49.38 2rop s ASN 167 Cb -0.10 -2.17 0.71 0.00 -0.02 0.00 0.00 41.25 39.67 2rop s ASN 167 CO 0.31 -0.67 2.01 1.55 -2.57 0.00 0.00 177.10 177.73 2rop h PRO 168 N 8.18 0.74 0.00 -0.60 0.13 -1.90 0.12 132.00 138.68 2rop h PRO 168 Ca -0.07 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 2rop h PRO 168 Cb 1.06 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2rop h PRO 168 CO 0.86 0.49 0.00 0.00 -0.23 0.00 0.00 178.00 179.12 2rop n ALA 169 N -2.45 1.45 0.00 -0.56 0.00 -1.26 -3.49 120.51 114.20 2rop n ALA 169 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2rop n ALA 169 Cb 0.08 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.40 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 -1.41 0.00 -3.57 0.00 0.31 0.21 -5.12 118.33 108.75 2rop n VAL 170 Ca 0.03 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.24 2rop n VAL 170 Cb 0.08 -0.66 -0.04 0.00 -0.91 0.00 0.00 33.84 32.31 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 -1.76 0.04 0.01 2.52 2.07 -0.00 -4.89 121.20 119.19 2rop s ILE 171 Ca 0.00 -0.33 -0.05 0.00 -1.41 0.00 0.00 60.65 58.85 2rop s ILE 171 Cb 0.00 -1.06 -0.05 0.00 0.13 0.00 0.00 42.46 41.49 2rop s ILE 171 CO 0.00 -0.18 0.25 -0.55 -1.91 0.00 0.00 174.94 172.55 2rop s SER 172 N -2.48 6.46 0.45 4.50 0.15 -1.26 -4.10 113.70 117.42 2rop s SER 172 Ca -0.01 0.50 0.20 0.00 0.70 0.00 0.00 55.95 57.34 2rop s SER 172 Cb 0.00 -2.07 1.17 0.00 -1.71 0.00 0.00 66.02 63.41 2rop s SER 172 CO -0.08 0.25 1.91 -0.65 1.20 0.00 0.00 173.24 175.86 2rop h PRO 173 N 3.88 0.29 0.00 5.44 0.11 -1.97 -0.71 132.00 139.04 2rop h PRO 173 Ca -0.49 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 2rop h PRO 173 Cb 1.19 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2rop h PRO 173 CO 0.67 0.19 -0.26 0.93 -0.21 0.00 0.00 178.00 179.32 2rop h GLU 174 N 0.30 0.00 0.02 1.05 5.08 -2.00 -1.78 114.58 117.25 2rop h GLU 174 Ca 0.38 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.50 2rop h GLU 174 Cb 1.05 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.31 2rop h GLU 174 CO -0.10 0.26 -1.02 0.93 -1.00 0.00 0.00 179.01 178.08 2rop h GLU 175 N 0.00 0.49 0.19 2.33 5.08 -1.57 -3.21 114.58 117.89 2rop h GLU 175 Ca -0.00 -0.55 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 2rop h GLU 175 Cb 0.57 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 2rop h GLU 175 CO 0.03 1.19 -0.20 1.25 -1.00 0.00 0.00 179.01 180.29 2rop h LEU 176 N 0.26 -0.54 -1.23 1.33 6.46 -0.69 -2.23 115.31 118.68 2rop h LEU 176 Ca -0.11 0.05 0.01 0.00 -0.12 0.00 0.00 57.88 57.72 2rop h LEU 176 Cb 1.67 0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 41.75 2rop h LEU 176 CO 0.18 -0.30 0.53 0.08 -0.62 0.00 0.00 178.44 178.31 2rop h ARG 177 N -0.43 1.03 0.00 1.25 0.11 -1.50 -2.44 114.38 112.40 2rop h ARG 177 Ca 0.00 -0.06 -0.01 0.00 0.10 0.00 0.00 59.98 60.01 2rop h ARG 177 Cb 0.41 -0.23 -0.00 0.00 1.11 0.00 0.00 29.97 31.25 2rop h ARG 177 CO -0.06 0.68 -0.05 0.00 0.10 0.00 0.00 179.97 180.65 2rop h ALA 178 N 1.51 1.31 -0.17 0.08 0.00 -1.43 -1.89 119.26 118.67 2rop h ALA 178 Ca 0.29 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 2rop h ALA 178 Cb -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2rop h ALA 178 CO -0.07 0.06 -0.55 0.00 0.00 0.00 0.00 179.25 178.69 2rop h ALA 179 N 1.95 0.73 -0.27 0.00 0.00 -0.90 0.35 119.26 121.11 2rop h ALA 179 Ca -0.00 -0.51 -0.16 0.00 0.00 0.00 0.00 54.91 54.23 2rop h ALA 179 Cb 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2rop h ALA 179 CO 0.01 0.69 -0.49 0.82 0.00 0.00 0.00 179.25 180.28 2rop h ILE 180 N 0.39 1.29 0.00 0.00 5.03 -1.52 -2.47 117.51 120.23 2rop h ILE 180 Ca 0.01 -1.69 -0.07 0.00 -0.12 0.00 0.00 64.86 62.99 2rop h ILE 180 Cb 1.09 1.60 -0.01 0.00 -3.03 0.00 0.00 36.82 36.47 2rop h ILE 180 CO 0.10 0.54 -0.32 -0.08 -0.68 0.00 0.00 178.15 177.72 2rop h GLU 181 N 0.59 0.00 -0.15 2.37 4.22 -1.14 -2.37 114.58 118.10 2rop h GLU 181 Ca 0.03 0.00 -0.11 0.00 0.08 0.00 0.00 59.36 59.36 2rop h GLU 181 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2rop h GLU 181 CO 0.10 0.32 -0.32 0.22 -2.18 0.00 0.00 179.01 177.15 2rop h ASP 182 N 0.00 0.54 0.11 1.04 3.58 -0.91 -3.31 116.42 117.47 2rop h ASP 182 Ca -0.00 -0.56 -0.01 0.00 0.42 0.00 0.00 57.03 56.87 2rop h ASP 182 Cb 0.71 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.61 2rop h ASP 182 CO 0.04 1.01 -0.07 -0.03 -2.88 0.00 0.00 179.24 177.31 2rop h MET 183 N 0.10 0.00 0.00 0.28 4.05 -1.08 -3.46 114.93 114.82 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 0.92 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.72 2rop h MET 183 CO 0.07 0.07 0.00 0.41 0.23 0.00 0.00 176.91 177.69 2rop n GLY 184 N -1.20 1.12 0.00 1.39 0.00 -0.94 -5.10 105.19 100.46 2rop n GLY 184 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.03 0.00 -4.26 1.61 3.72 -0.94 -5.04 117.46 112.52 2rop n PHE 185 Ca 0.00 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 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 0.84 0.81 -0.03 -1.08 0.41 -1.03 -4.14 118.70 114.47 2rop s GLU 186 Ca 0.00 -0.76 -0.04 0.00 -0.41 0.00 0.00 54.97 53.76 2rop s GLU 186 Cb 0.00 -0.78 0.01 0.00 -1.78 0.00 0.00 34.13 31.58 2rop s GLU 186 CO 0.00 0.19 0.10 0.00 -0.49 0.00 0.00 175.26 175.06 2rop s ALA 187 N -0.97 -0.24 -0.05 5.21 0.00 -1.26 -0.23 121.76 124.22 2rop s ALA 187 Ca -0.01 0.20 0.05 0.00 0.00 0.00 0.00 51.96 52.20 2rop s ALA 187 Cb -0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 2rop s ALA 187 CO 0.01 -0.07 -0.19 0.45 0.00 0.00 0.00 175.76 175.96 2rop s SER 188 N -0.17 2.41 -1.22 0.00 0.15 0.11 -4.87 113.70 110.11 2rop s SER 188 Ca -0.02 -0.40 -0.15 0.00 0.70 0.00 0.00 55.95 56.08 2rop s SER 188 Cb -0.02 -0.65 0.14 0.00 -1.71 0.00 0.00 66.02 63.78 2rop s SER 188 CO 0.00 0.18 1.50 0.68 1.20 0.00 0.00 173.24 176.80 2rop s VAL 189 N -0.04 4.77 -2.00 4.45 -7.23 -1.26 -1.15 120.40 117.94 2rop s VAL 189 Ca -0.03 -2.39 0.23 0.00 -1.81 0.00 0.00 61.98 57.97 2rop s VAL 189 Cb -0.12 -4.98 0.64 0.00 0.56 0.00 0.00 36.38 32.48 2rop s VAL 189 CO 0.02 -1.73 1.72 1.33 -0.31 0.00 0.00 175.10 176.14