#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n0f n HIS 25 N 0.00 0.00 -4.43 1.61 -0.00 -1.26 -4.25 115.22 106.89 1n0f n HIS 25 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.53 1n0f n HIS 25 Cb 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 29.99 29.84 1n0f n HIS 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1n0f s MET 26 N -1.92 0.83 -0.34 -1.40 0.23 -1.26 -5.03 119.30 110.41 1n0f s MET 26 Ca 0.00 -0.36 -0.19 0.00 -1.03 0.00 0.00 55.69 54.12 1n0f s MET 26 Cb 0.00 -0.80 -0.00 0.00 -1.53 0.00 0.00 34.83 32.50 1n0f s MET 26 CO 0.00 0.21 0.54 -0.51 -2.03 0.00 0.00 175.02 173.23 1n0f s LEU 27 N -0.21 4.31 0.14 0.18 1.43 -0.98 -4.93 118.68 118.62 1n0f s LEU 27 Ca 0.03 0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.21 1n0f s LEU 27 Cb -0.04 -2.63 -0.04 0.00 0.03 0.00 0.00 46.19 43.51 1n0f s LEU 27 CO -0.00 -0.49 -0.05 -0.76 0.23 0.00 0.00 176.35 175.28 1n0f s LEU 28 N 2.45 2.38 0.00 1.79 1.43 -1.26 0.94 118.68 126.40 1n0f s LEU 28 Ca 0.20 -1.07 0.00 0.00 -1.03 0.00 0.00 54.13 52.23 1n0f s LEU 28 Cb -0.15 -0.15 0.00 0.00 0.03 0.00 0.00 46.19 45.92 1n0f s LEU 28 CO 0.13 -0.46 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1n0f n GLY 29 N -0.16 1.07 3.36 -3.19 0.00 -1.26 -4.41 105.19 100.61 1n0f n GLY 29 Ca -0.10 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.62 1n0f n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n0f s THR 30 N -1.89 2.38 -0.01 2.61 2.01 -1.26 0.72 115.64 120.19 1n0f s THR 30 Ca 0.00 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 61.01 1n0f s THR 30 Cb 0.00 -1.86 0.01 0.00 0.01 0.00 0.00 72.50 70.65 1n0f s THR 30 CO 0.00 0.57 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.11 1n0f s PHE 31 N -0.66 0.38 -0.25 4.92 0.08 0.17 -4.96 117.98 117.65 1n0f s PHE 31 Ca 0.11 -0.06 -0.11 0.00 0.12 0.00 0.00 56.93 56.99 1n0f s PHE 31 Cb -0.10 -0.31 -0.05 0.00 -0.57 0.00 0.00 43.02 41.99 1n0f s PHE 31 CO -0.00 -0.05 0.18 -0.80 -0.10 0.00 0.00 175.22 174.44 1n0f s ASN 32 N 0.28 6.10 0.29 1.36 0.01 -1.26 -0.55 114.94 121.16 1n0f s ASN 32 Ca -0.03 0.09 -0.00 0.00 -0.71 0.00 0.00 52.86 52.21 1n0f s ASN 32 Cb -0.06 -2.11 -0.02 0.00 0.41 0.00 0.00 41.25 39.47 1n0f s ASN 32 CO -0.01 0.03 0.31 0.27 -1.51 0.00 0.00 177.10 176.20 1n0f s ILE 33 N 1.26 0.00 0.00 0.60 -4.36 -0.20 -5.00 121.20 113.51 1n0f s ILE 33 Ca 0.08 -1.82 0.07 0.00 -0.26 0.00 0.00 60.65 58.72 1n0f s ILE 33 Cb -0.14 -2.50 -0.03 0.00 1.25 0.00 0.00 42.46 41.04 1n0f s ILE 33 CO 0.06 0.00 -0.22 -0.89 0.24 0.00 0.00 174.94 174.14 1n0f s THR 34 N -3.61 2.48 -0.43 8.37 2.01 -1.26 0.64 115.64 123.84 1n0f s THR 34 Ca 0.35 -1.11 -0.21 0.00 0.31 0.00 0.00 61.69 61.03 1n0f s THR 34 Cb 0.03 -1.96 0.02 0.00 0.01 0.00 0.00 72.50 70.60 1n0f s THR 34 CO 0.19 0.47 0.68 -0.22 -0.69 0.00 0.00 174.62 175.05 1n0f s LEU 35 N -1.00 4.39 1.15 4.42 0.20 -1.26 -4.55 118.68 122.04 1n0f s LEU 35 Ca 0.12 -0.19 -0.17 0.00 0.69 0.00 0.00 54.13 54.58 1n0f s LEU 35 Cb -0.10 -2.80 0.26 0.00 -0.43 0.00 0.00 46.19 43.12 1n0f s LEU 35 CO 0.02 -0.78 1.08 1.51 -0.29 0.00 0.00 176.35 177.88 1n0f s ASP 36 N 2.00 1.30 0.58 3.68 3.84 -0.41 -4.67 116.67 123.00 1n0f s ASP 36 Ca 0.25 0.91 0.31 0.00 -0.00 0.00 0.00 52.55 54.02 1n0f s ASP 36 Cb -0.14 -1.36 1.77 0.00 -1.38 0.00 0.00 42.92 41.81 1n0f s ASP 36 CO 0.19 -3.92 2.20 0.00 -0.00 0.00 0.00 175.17 173.64 1n0f h ALA 37 N -2.44 1.34 -0.42 2.11 0.00 -1.95 -2.02 119.26 115.88 1n0f h ALA 37 Ca -0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1n0f h ALA 37 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1n0f h ALA 37 CO 0.44 0.05 0.00 1.63 0.00 0.00 0.00 179.25 181.37 1n0f n LYS 38 N -3.62 2.42 -2.12 0.00 5.02 -1.26 -4.91 118.16 113.68 1n0f n LYS 38 Ca -0.02 -1.69 -0.09 0.00 -2.02 0.00 0.00 58.31 54.48 1n0f n LYS 38 Cb 0.14 -1.53 -0.01 0.00 -0.02 0.00 0.00 35.03 33.62 1n0f n LYS 38 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1n0f n ASN 39 N 0.68 -3.29 -4.67 4.39 5.03 -0.76 -4.87 115.26 111.77 1n0f n ASN 39 Ca 0.15 0.01 -0.29 0.00 0.87 0.00 0.00 54.58 55.32 1n0f n ASN 39 Cb 0.51 -2.51 -0.08 0.00 -1.02 0.00 0.00 39.78 36.68 1n0f n ASN 39 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1n0f s ARG 40 N -4.37 2.47 0.09 3.52 0.52 -1.26 -0.89 118.95 119.04 1n0f s ARG 40 Ca 0.00 -0.92 0.09 0.00 -0.52 0.00 0.00 55.73 54.38 1n0f s ARG 40 Cb 0.00 -2.47 -0.03 0.00 0.52 0.00 0.00 34.95 32.96 1n0f s ARG 40 CO 0.00 0.52 -0.24 0.42 0.02 0.00 0.00 175.30 176.02 1n0f s ILE 41 N -1.40 1.95 -0.23 1.52 1.01 -0.50 -1.28 121.20 122.26 1n0f s ILE 41 Ca 0.26 -1.52 -0.07 0.00 0.00 0.00 0.00 60.65 59.31 1n0f s ILE 41 Cb -0.11 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 1n0f s ILE 41 CO 0.18 0.11 0.06 -0.44 0.00 0.00 0.00 174.94 174.84 1n0f s SER 42 N -1.71 5.14 0.17 3.58 0.01 -1.26 -1.00 113.70 118.62 1n0f s SER 42 Ca 0.10 -0.17 -0.31 0.00 1.31 0.00 0.00 55.95 56.88 1n0f s SER 42 Cb -0.10 -1.91 -0.09 0.00 0.21 0.00 0.00 66.02 64.13 1n0f s SER 42 CO 0.04 0.01 1.47 -0.76 0.41 0.00 0.00 173.24 174.40 1n0f s LEU 43 N 1.36 4.38 0.00 2.44 1.43 0.68 -4.85 118.68 124.12 1n0f s LEU 43 Ca 0.05 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.67 1n0f s LEU 43 Cb -0.15 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.47 1n0f s LEU 43 CO 0.03 -0.72 0.00 -2.65 0.23 0.00 0.00 176.35 173.24 1n0f n PRO 44 N 3.51 0.00 0.00 1.29 -0.02 -1.26 -4.63 135.00 133.89 1n0f n PRO 44 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1n0f n PRO 44 Cb 0.40 -0.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.90 1n0f n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n0f n ALA 45 N -0.14 0.00 -0.02 3.55 0.00 -1.26 -4.24 120.51 118.39 1n0f n ALA 45 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1n0f n ALA 45 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1n0f n ALA 45 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1n0f h LYS 46 N 0.00 -0.12 0.00 0.00 1.57 -2.02 -2.05 116.57 113.95 1n0f h LYS 46 Ca 0.00 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1n0f h LYS 46 Cb 0.00 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1n0f h LYS 46 CO 0.00 -0.08 -0.19 -0.07 -0.57 0.00 0.00 179.45 178.55 1n0f h LEU 47 N -0.12 0.00 -1.09 2.94 4.07 -1.90 -3.29 115.31 115.91 1n0f h LEU 47 Ca 0.11 0.00 0.02 0.00 0.08 0.00 0.00 57.88 58.08 1n0f h LEU 47 Cb 0.28 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 41.97 1n0f h LEU 47 CO -0.25 0.19 0.61 -0.09 -1.08 0.00 0.00 178.44 177.82 1n0f h ARG 48 N 0.00 1.19 -0.01 1.13 2.43 -1.63 -2.99 114.38 114.50 1n0f h ARG 48 Ca -0.00 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1n0f h ARG 48 Cb 0.83 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 1n0f h ARG 48 CO 0.02 0.79 -0.20 0.00 -1.51 0.00 0.00 179.97 179.07 1n0f h ALA 49 N 1.44 -0.65 -0.85 2.80 0.00 -1.61 -2.59 119.26 117.78 1n0f h ALA 49 Ca 0.35 -0.03 0.32 0.00 0.00 0.00 0.00 54.91 55.55 1n0f h ALA 49 Cb -0.09 0.69 -0.16 0.00 0.00 0.00 0.00 17.79 18.24 1n0f h ALA 49 CO -0.09 -0.72 0.31 0.34 0.00 0.00 0.00 179.25 179.09 1n0f n PHE 50 N -3.63 0.84 -3.47 0.00 7.35 -1.13 -4.25 117.46 113.17 1n0f n PHE 50 Ca -0.03 1.02 -0.37 0.00 -0.76 0.00 0.00 57.45 57.31 1n0f n PHE 50 Cb 0.15 -1.32 -0.07 0.00 0.35 0.00 0.00 39.48 38.59 1n0f n PHE 50 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1n0f s PHE 51 N -5.48 3.52 0.00 -5.13 0.08 -0.98 -4.98 117.98 105.01 1n0f s PHE 51 Ca -0.09 0.74 0.00 0.00 0.12 0.00 0.00 56.93 57.70 1n0f s PHE 51 Cb 0.28 -2.39 0.00 0.00 -0.57 0.00 0.00 43.02 40.33 1n0f s PHE 51 CO 0.67 0.28 0.00 0.39 -0.10 0.00 0.00 175.22 176.46 1n0f n GLU 52 N 3.34 0.73 0.00 0.44 1.02 -1.26 -4.90 120.64 120.01 1n0f n GLU 52 Ca -0.11 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 56.92 1n0f n GLU 52 Cb 0.52 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.97 1n0f n GLU 52 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1n0f h GLY 53 N 0.00 0.64 -2.43 0.62 0.00 -1.97 -3.44 103.07 96.50 1n0f h GLY 53 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 47.33 46.24 1n0f h GLY 53 CO 0.00 0.71 -0.61 -1.35 0.00 0.00 0.00 176.54 175.29 1n0f s SER 54 N -6.95 0.67 0.23 0.19 1.04 -1.26 -0.18 113.70 107.44 1n0f s SER 54 Ca -0.08 -1.42 -0.00 0.00 0.48 0.00 0.00 55.95 54.93 1n0f s SER 54 Cb 0.11 0.32 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 1n0f s SER 54 CO 0.85 -0.82 0.18 0.27 0.98 0.00 0.00 173.24 174.70 1n0f s ILE 55 N -3.95 0.00 -0.02 -1.02 -5.25 -0.20 -4.46 121.20 106.30 1n0f s ILE 55 Ca 0.38 -1.96 0.05 0.00 -0.99 0.00 0.00 60.65 58.13 1n0f s ILE 55 Cb 0.07 -2.49 -0.03 0.00 2.95 0.00 0.00 42.46 42.96 1n0f s ILE 55 CO 0.14 0.00 -0.17 -0.69 -1.79 0.00 0.00 174.94 172.43 1n0f s VAL 56 N -4.00 2.81 -0.06 8.37 1.01 -0.04 -0.55 120.40 127.94 1n0f s VAL 56 Ca 0.38 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 61.38 1n0f s VAL 56 Cb 0.06 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1n0f s VAL 56 CO 0.15 0.52 -0.15 0.00 0.00 0.00 0.00 175.10 175.62 1n0f n ILE 57 N 2.12 1.06 -0.97 2.22 3.06 -1.26 -1.76 119.36 123.83 1n0f n ILE 57 Ca -0.17 0.10 0.04 0.00 -2.50 0.00 0.00 62.75 60.22 1n0f n ILE 57 Cb 0.52 -1.81 -0.02 0.00 0.54 0.00 0.00 39.64 38.87 1n0f n ILE 57 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 1n0f n ASN 58 N -3.75 -2.71 -4.82 9.51 0.23 -1.20 -3.12 115.26 109.40 1n0f n ASN 58 Ca -0.13 0.55 -0.37 0.00 -0.53 0.00 0.00 54.58 54.10 1n0f n ASN 58 Cb 0.41 -2.70 -0.06 0.00 -2.08 0.00 0.00 39.78 35.35 1n0f n ASN 58 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1n0f s ARG 59 N -4.67 4.20 0.00 -3.83 1.70 -1.26 -1.47 118.95 113.62 1n0f s ARG 59 Ca 0.00 0.77 0.00 0.00 -0.47 0.00 0.00 55.73 56.03 1n0f s ARG 59 Cb 0.00 -3.00 0.00 0.00 -0.57 0.00 0.00 34.95 31.38 1n0f s ARG 59 CO 0.00 0.48 0.00 0.41 -1.08 0.00 0.00 175.30 175.11 1n0f n GLY 60 N 1.03 2.87 3.93 3.88 0.00 -1.26 -4.66 105.19 110.99 1n0f n GLY 60 Ca -0.05 -2.04 -0.27 0.00 0.00 0.00 0.00 46.02 43.66 1n0f n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n0f s PHE 61 N 1.78 3.48 -1.78 1.61 0.08 -1.26 -4.23 117.98 117.67 1n0f s PHE 61 Ca 0.00 0.27 0.00 0.00 0.12 0.00 0.00 56.93 57.32 1n0f s PHE 61 Cb 0.00 -1.80 0.00 0.00 -0.57 0.00 0.00 43.02 40.65 1n0f s PHE 61 CO 0.00 0.41 0.00 0.39 -0.10 0.00 0.00 175.22 175.92 1n0f n GLU 62 N -0.65 -1.44 -2.74 0.44 4.71 -1.26 -3.37 120.64 116.33 1n0f n GLU 62 Ca -0.05 1.02 -0.11 0.00 -0.01 0.00 0.00 57.16 58.01 1n0f n GLU 62 Cb 0.54 -5.47 0.05 0.00 -1.01 0.00 0.00 31.44 25.55 1n0f n GLU 62 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1n0f n ASN 63 N -1.40 -4.74 0.00 1.62 3.02 -1.26 -5.02 115.26 107.48 1n0f n ASN 63 Ca -0.21 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 53.86 1n0f n ASN 63 Cb 0.65 -3.74 0.00 0.00 -0.61 0.00 0.00 39.78 36.09 1n0f n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0f n LEU 65 N -0.97 -3.94 -4.71 0.00 4.32 -1.26 -2.61 117.00 107.83 1n0f n LEU 65 Ca 0.00 1.39 -0.30 0.00 -0.02 0.00 0.00 56.01 57.08 1n0f n LEU 65 Cb 0.00 -1.99 -0.08 0.00 -1.62 0.00 0.00 43.42 39.74 1n0f n LEU 65 CO 0.00 -1.01 -0.32 -1.61 -1.22 0.00 0.00 177.39 173.23 1n0f s GLU 66 N -1.70 2.62 -0.05 3.23 2.02 -0.54 -1.33 118.70 122.95 1n0f s GLU 66 Ca 0.00 -0.81 0.04 0.00 0.02 0.00 0.00 54.97 54.22 1n0f s GLU 66 Cb 0.00 -2.58 -0.00 0.00 0.10 0.00 0.00 34.13 31.65 1n0f s GLU 66 CO 0.00 0.54 -0.18 0.08 0.02 0.00 0.00 175.26 175.72 1n0f s VAL 67 N -1.35 1.52 0.04 2.63 1.01 0.27 -4.21 120.40 120.31 1n0f s VAL 67 Ca 0.27 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 1n0f s VAL 67 Cb -0.12 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1n0f s VAL 67 CO 0.19 0.44 0.07 -0.13 0.00 0.00 0.00 175.10 175.66 1n0f s ARG 68 N 0.05 0.56 0.57 2.72 0.52 -0.72 -0.98 118.95 121.67 1n0f s ARG 68 Ca -0.05 -0.79 -0.19 0.00 -0.52 0.00 0.00 55.73 54.18 1n0f s ARG 68 Cb -0.12 0.21 -0.05 0.00 0.52 0.00 0.00 34.95 35.52 1n0f s ARG 68 CO 0.03 -0.13 1.15 0.15 0.02 0.00 0.00 175.30 176.51 1n0f s LYS 69 N -2.64 3.19 0.25 3.54 1.02 -1.26 -0.86 119.74 122.98 1n0f s LYS 69 Ca -0.05 1.65 -0.05 0.00 0.02 0.00 0.00 55.97 57.54 1n0f s LYS 69 Cb -0.01 -1.98 0.32 0.00 -0.52 0.00 0.00 37.83 35.64 1n0f s LYS 69 CO -0.05 -0.99 1.90 -1.35 -0.92 0.00 0.00 175.35 173.94 1n0f h PRO 70 N 0.99 1.18 -0.74 -1.68 0.11 -1.90 -0.11 132.00 129.86 1n0f h PRO 70 Ca -0.50 -0.07 0.08 0.00 0.11 0.00 0.00 66.00 65.62 1n0f h PRO 70 Cb 1.27 -0.27 -0.06 0.00 0.11 0.00 0.00 31.00 32.05 1n0f h PRO 70 CO 0.56 0.78 0.41 1.96 -0.21 0.00 0.00 178.00 181.50 1n0f h GLN 71 N 1.22 0.69 0.00 1.05 7.50 -1.97 0.14 115.11 123.74 1n0f h GLN 71 Ca 0.39 -0.04 -0.11 0.00 0.50 0.00 0.00 58.65 59.38 1n0f h GLN 71 Cb 0.01 -0.16 -0.02 0.00 0.05 0.00 0.00 27.48 27.37 1n0f h GLN 71 CO -0.13 0.46 -0.55 -0.44 -1.50 0.00 0.00 178.83 176.67 1n0f h ASP 72 N 0.71 0.00 -0.32 1.46 3.32 -1.61 -2.30 116.42 117.69 1n0f h ASP 72 Ca 0.35 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.29 1n0f h ASP 72 Cb 0.28 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1n0f h ASP 72 CO -0.22 0.55 -0.19 0.15 -1.72 0.00 0.00 179.24 177.81 1n0f h PHE 73 N 0.00 0.89 0.01 4.55 3.57 0.72 -1.13 116.94 125.55 1n0f h PHE 73 Ca -0.01 -0.19 0.02 0.00 3.53 0.00 0.00 57.97 61.32 1n0f h PHE 73 Cb 0.97 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.47 1n0f h PHE 73 CO 0.00 0.91 -0.11 0.37 -2.23 0.00 0.00 178.31 177.25 1n0f h GLN 74 N 0.70 -0.19 -0.41 1.11 5.75 -0.46 -1.74 115.11 119.87 1n0f h GLN 74 Ca 0.10 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.58 1n0f h GLN 74 Cb 0.69 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.27 1n0f h GLN 74 CO 0.05 -0.13 0.11 0.87 -2.65 0.00 0.00 178.83 177.08 1n0f h LYS 75 N -0.20 0.60 -0.45 1.69 1.57 -1.12 -2.59 116.57 116.06 1n0f h LYS 75 Ca 0.04 -0.10 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 1n0f h LYS 75 Cb 0.25 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1n0f h LYS 75 CO -0.11 0.54 -0.09 -0.92 -0.57 0.00 0.00 179.45 178.29 1n0f h TYR 76 N 0.58 0.89 -0.40 -1.35 3.20 -0.76 -3.10 116.97 116.03 1n0f h TYR 76 Ca 0.14 -0.16 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 1n0f h TYR 76 Cb 0.21 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 1n0f h TYR 76 CO 0.01 0.86 0.12 0.35 -1.64 0.00 0.00 178.16 177.87 1n0f h PHE 77 N 0.74 0.65 -0.89 -3.82 3.57 -0.94 -2.89 116.94 113.35 1n0f h PHE 77 Ca 0.13 -0.07 0.15 0.00 3.53 0.00 0.00 57.97 61.71 1n0f h PHE 77 Cb 0.58 -0.19 -0.10 0.00 2.79 0.00 0.00 35.95 39.04 1n0f h PHE 77 CO 0.03 0.60 0.49 0.93 -2.23 0.00 0.00 178.31 178.13 1n0f h GLU 78 N 0.50 0.67 0.00 1.11 5.08 -1.44 0.51 114.58 121.02 1n0f h GLU 78 Ca 0.13 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1n0f h GLU 78 Cb 0.26 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1n0f h GLU 78 CO -0.00 0.44 0.14 1.96 -1.00 0.00 0.00 179.01 180.55 1n0f h GLN 79 N 0.69 0.00 0.09 2.33 4.20 -1.49 -0.97 115.11 119.96 1n0f h GLN 79 Ca 0.49 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.87 1n0f h GLN 79 Cb 0.68 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 1n0f h GLN 79 CO -0.35 0.00 -1.81 1.19 -0.67 0.00 0.00 178.83 177.19 1n0f n PHE 80 N -2.29 1.15 0.14 2.96 3.72 0.18 -3.87 117.46 119.44 1n0f n PHE 80 Ca -0.01 0.31 0.06 0.00 -0.05 0.00 0.00 57.45 57.75 1n0f n PHE 80 Cb 0.18 -1.14 0.31 0.00 -0.94 0.00 0.00 39.48 37.89 1n0f n PHE 80 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1n0f n ASN 81 N -3.77 0.30 -0.00 4.37 4.13 -0.38 0.20 115.26 120.11 1n0f n ASN 81 Ca -0.33 0.53 0.07 0.00 1.68 0.00 0.00 54.58 56.53 1n0f n ASN 81 Cb 0.94 -0.49 0.43 0.00 -1.54 0.00 0.00 39.78 39.13 1n0f n ASN 81 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1n0f n SER 82 N -1.95 0.00 -4.71 6.41 3.41 -1.18 -4.73 113.62 110.87 1n0f n SER 82 Ca -0.01 -1.55 -0.35 0.00 -0.26 0.00 0.00 58.87 56.70 1n0f n SER 82 Cb 0.29 -0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.15 1n0f n SER 82 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1n0f s PHE 83 N -2.00 3.33 0.00 7.33 0.08 0.53 -5.04 117.98 122.21 1n0f s PHE 83 Ca 0.22 0.23 0.00 0.00 0.12 0.00 0.00 56.93 57.50 1n0f s PHE 83 Cb 0.10 -1.99 0.00 0.00 -0.57 0.00 0.00 43.02 40.56 1n0f s PHE 83 CO 0.17 0.38 0.00 -2.30 -0.10 0.00 0.00 175.22 173.37 1n0f n PRO 84 N 2.83 0.00 0.00 0.24 -0.02 -1.26 -4.78 135.00 132.01 1n0f n PRO 84 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1n0f n PRO 84 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.01 1n0f n PRO 84 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n0f n SER 85 N -2.27 0.00 0.06 2.55 2.88 -1.26 -4.61 113.62 110.98 1n0f n SER 85 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 1n0f n SER 85 Cb 0.00 0.00 0.31 0.00 -0.75 0.00 0.00 64.21 63.77 1n0f n SER 85 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1n0f n THR 86 N -0.10 0.37 -2.94 2.46 -2.24 -1.26 -4.70 114.28 105.86 1n0f n THR 86 Ca 0.00 -0.22 -0.40 0.00 -2.27 0.00 0.00 64.05 61.16 1n0f n THR 86 Cb 0.00 -0.29 -0.04 0.00 -2.10 0.00 0.00 70.33 67.89 1n0f n THR 86 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1n0f s GLN 87 N -3.11 4.48 0.16 -0.78 -1.52 -1.26 -4.98 119.66 112.65 1n0f s GLN 87 Ca 0.09 1.06 -0.19 0.00 -1.95 0.00 0.00 55.36 54.37 1n0f s GLN 87 Cb 0.14 -3.44 0.07 0.00 -0.22 0.00 0.00 33.01 29.56 1n0f s GLN 87 CO 0.65 0.05 1.65 -0.22 -0.25 0.00 0.00 175.29 177.18 1n0f h LYS 88 N 6.67 -0.09 -0.94 2.91 3.64 -2.01 -1.92 116.57 124.83 1n0f h LYS 88 Ca -0.41 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.00 1n0f h LYS 88 Cb 1.20 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.99 1n0f h LYS 88 CO 0.75 -0.06 0.62 -0.44 -2.27 0.00 0.00 179.45 178.04 1n0f h ASP 89 N -0.09 1.04 -0.98 4.20 3.32 -1.97 -1.04 116.42 120.89 1n0f h ASP 89 Ca 0.17 -0.01 0.10 0.00 0.02 0.00 0.00 57.03 57.31 1n0f h ASP 89 Cb 0.36 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 39.59 1n0f h ASP 89 CO -0.40 0.72 0.61 0.74 -1.72 0.00 0.00 179.24 179.19 1n0f h THR 90 N 1.21 0.96 -0.39 0.35 2.02 -1.72 -0.38 112.91 114.96 1n0f h THR 90 Ca 0.37 -0.35 -0.15 0.00 0.77 0.00 0.00 66.41 67.05 1n0f h THR 90 Cb -0.04 -0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.22 1n0f h THR 90 CO -0.11 0.18 -0.33 0.03 0.37 0.00 0.00 175.52 175.67 1n0f h ARG 91 N 1.01 0.91 -0.75 6.66 3.08 -0.96 -1.66 114.38 122.67 1n0f h ARG 91 Ca 0.47 -0.46 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1n0f h ARG 91 Cb 0.39 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 1n0f h ARG 91 CO -0.24 1.11 0.34 1.15 -1.07 0.00 0.00 179.97 181.26 1n0f h THR 92 N 0.73 1.25 -0.31 2.04 2.02 -0.68 0.75 112.91 118.70 1n0f h THR 92 Ca 0.07 -0.72 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 1n0f h THR 92 Cb 0.91 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1n0f h THR 92 CO 0.08 0.30 0.11 0.25 0.37 0.00 0.00 175.52 176.63 1n0f h LEU 93 N 1.06 0.44 -0.80 2.58 5.85 -0.97 0.46 115.31 123.93 1n0f h LEU 93 Ca 0.25 -0.19 -0.10 0.00 0.84 0.00 0.00 57.88 58.69 1n0f h LEU 93 Cb 0.15 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1n0f h LEU 93 CO -0.03 0.51 -0.15 0.11 -0.34 0.00 0.00 178.44 178.54 1n0f h LYS 94 N 0.34 0.74 -0.33 1.25 1.57 -0.98 -1.91 116.57 117.26 1n0f h LYS 94 Ca 0.10 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.53 1n0f h LYS 94 Cb 0.22 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1n0f h LYS 94 CO -0.01 0.85 -0.13 0.00 -0.57 0.00 0.00 179.45 179.60 1n0f h ARG 95 N 0.67 0.67 0.00 3.15 3.08 -0.65 -0.64 114.38 120.65 1n0f h ARG 95 Ca 0.11 -0.28 -0.05 0.00 0.07 0.00 0.00 59.98 59.82 1n0f h ARG 95 Cb 0.63 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 1n0f h ARG 95 CO 0.04 0.87 -0.25 -0.07 -1.07 0.00 0.00 179.97 179.49 1n0f h LEU 96 N 0.44 0.00 0.00 3.04 3.38 -0.76 -2.95 115.31 118.46 1n0f h LEU 96 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1n0f h LEU 96 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1n0f h LEU 96 CO 0.04 0.25 -0.15 0.40 0.09 0.00 0.00 178.44 179.07 1n0f h ILE 97 N 0.00 0.00 0.00 1.22 2.04 -1.11 -3.40 117.51 116.26 1n0f h ILE 97 Ca -0.00 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1n0f h ILE 97 Cb 0.46 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1n0f h ILE 97 CO 0.03 0.00 0.00 -0.26 0.00 0.00 0.00 178.15 177.92 1n0f h PHE 98 N -0.36 0.00 0.00 1.37 0.04 -1.26 -1.85 116.94 114.87 1n0f h PHE 98 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1n0f h PHE 98 Cb 0.15 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.30 1n0f h PHE 98 CO -0.06 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 177.65 1n0f n ALA 99 N -2.04 2.05 -0.05 2.45 0.00 -1.11 -2.73 120.51 119.07 1n0f n ALA 99 Ca -0.00 -0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1n0f n ALA 99 Cb 0.21 -1.42 0.09 0.00 0.00 0.00 0.00 19.45 18.34 1n0f n ALA 99 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1n0f n ASN 100 N -2.02 2.47 -4.86 0.00 3.02 -0.71 -5.01 115.26 108.15 1n0f n ASN 100 Ca 0.05 -1.89 -0.31 0.00 -0.03 0.00 0.00 54.58 52.40 1n0f n ASN 100 Cb 0.33 -0.13 -0.02 0.00 -0.61 0.00 0.00 39.78 39.34 1n0f n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0f s ALA 101 N -0.94 3.15 0.00 5.41 0.00 -1.11 -3.27 121.76 125.00 1n0f s ALA 101 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 51.96 52.11 1n0f s ALA 101 Cb 0.08 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1n0f s ALA 101 CO 0.11 -0.31 0.00 0.09 0.00 0.00 0.00 175.76 175.65 1n0f n ASN 102 N -1.86 0.01 -2.64 0.00 5.03 -1.26 -4.68 115.26 109.86 1n0f n ASN 102 Ca 0.05 -0.30 -0.03 0.00 0.87 0.00 0.00 54.58 55.17 1n0f n ASN 102 Cb 0.54 0.01 -0.03 0.00 -1.02 0.00 0.00 39.78 39.29 1n0f n ASN 102 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1n0f n PHE 103 N -0.01 -3.30 -4.11 3.10 3.72 -1.24 -4.80 117.46 110.81 1n0f n PHE 103 Ca 0.00 1.93 -0.13 0.00 -0.05 0.00 0.00 57.45 59.20 1n0f n PHE 103 Cb 0.07 -3.10 -0.11 0.00 -0.94 0.00 0.00 39.48 35.40 1n0f n PHE 103 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1n0f s VAL 104 N -0.47 0.68 -0.07 -4.37 1.01 0.28 -4.95 120.40 112.52 1n0f s VAL 104 Ca -0.17 -1.37 -0.09 0.00 0.00 0.00 0.00 61.98 60.36 1n0f s VAL 104 Cb 0.01 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 1n0f s VAL 104 CO 0.45 -0.50 0.23 -1.81 0.00 0.00 0.00 175.10 173.48 1n0f s ASP 105 N -2.04 6.52 -0.29 3.32 1.01 -1.26 -1.04 116.67 122.89 1n0f s ASP 105 Ca -0.02 0.61 -0.19 0.00 0.71 0.00 0.00 52.55 53.65 1n0f s ASP 105 Cb -0.06 -2.12 -0.02 0.00 1.01 0.00 0.00 42.92 41.74 1n0f s ASP 105 CO -0.01 0.36 0.59 -0.69 0.21 0.00 0.00 175.17 175.63 1n0f s VAL 106 N -1.09 4.99 1.21 -1.27 1.01 0.75 -4.55 120.40 121.43 1n0f s VAL 106 Ca 0.20 0.89 -0.17 0.00 0.00 0.00 0.00 61.98 62.89 1n0f s VAL 106 Cb -0.13 -3.94 0.29 0.00 0.00 0.00 0.00 36.38 32.59 1n0f s VAL 106 CO 0.09 -0.05 1.05 1.51 0.00 0.00 0.00 175.10 177.70 1n0f s ASP 107 N 1.59 0.82 0.27 3.32 3.84 -0.11 -4.81 116.67 121.59 1n0f s ASP 107 Ca 0.24 0.94 -0.02 0.00 -0.00 0.00 0.00 52.55 53.71 1n0f s ASP 107 Cb -0.15 -1.40 0.43 0.00 -1.38 0.00 0.00 42.92 40.41 1n0f s ASP 107 CO 0.10 -4.22 1.87 0.71 -0.00 0.00 0.00 175.17 173.63 1n0f h THR 108 N -2.64 1.05 0.00 2.11 1.35 -1.96 0.52 112.91 113.34 1n0f h THR 108 Ca -0.50 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 64.97 1n0f h THR 108 Cb 1.32 -0.17 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 1n0f h THR 108 CO 0.41 0.21 0.00 0.00 -0.25 0.00 0.00 175.52 175.89 1n0f n ALA 109 N -2.36 2.26 -1.68 6.62 0.00 -1.26 -4.86 120.51 119.23 1n0f n ALA 109 Ca 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1n0f n ALA 109 Cb 0.21 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1n0f n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n0f n GLY 110 N 0.46 0.49 3.87 0.00 0.00 0.17 -4.78 105.19 105.40 1n0f n GLY 110 Ca 0.14 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 45.08 1n0f n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n0f s ARG 111 N -3.43 3.12 -0.06 1.61 3.00 -1.26 -0.23 118.95 121.71 1n0f s ARG 111 Ca 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 55.73 54.89 1n0f s ARG 111 Cb 0.00 -2.72 0.00 0.00 0.00 0.00 0.00 34.95 32.23 1n0f s ARG 111 CO 0.00 0.44 -0.16 0.08 0.00 0.00 0.00 175.30 175.66 1n0f s VAL 112 N -1.96 1.38 -0.44 3.52 1.01 -0.17 -0.93 120.40 122.81 1n0f s VAL 112 Ca 0.33 -0.66 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 1n0f s VAL 112 Cb -0.09 -1.20 0.03 0.00 0.00 0.00 0.00 36.38 35.11 1n0f s VAL 112 CO 0.26 0.40 0.55 -0.22 0.00 0.00 0.00 175.10 176.10 1n0f s LEU 113 N 0.27 4.69 -0.00 3.92 0.20 -1.26 -1.41 118.68 125.09 1n0f s LEU 113 Ca -0.09 -0.52 -0.30 0.00 0.69 0.00 0.00 54.13 53.91 1n0f s LEU 113 Cb -0.13 -2.56 -0.04 0.00 -0.43 0.00 0.00 46.19 43.03 1n0f s LEU 113 CO 0.03 -0.70 1.09 -0.63 -0.29 0.00 0.00 176.35 175.85 1n0f s ILE 114 N 2.51 4.48 0.38 6.68 1.01 -0.06 -4.97 121.20 131.23 1n0f s ILE 114 Ca 0.18 1.78 -0.26 0.00 0.00 0.00 0.00 60.65 62.34 1n0f s ILE 114 Cb -0.16 -4.14 -0.11 0.00 0.01 0.00 0.00 42.46 38.06 1n0f s ILE 114 CO 0.16 0.10 1.12 -2.65 0.00 0.00 0.00 174.94 173.67 1n0f n PRO 115 N 4.25 1.62 0.06 2.79 -0.02 -1.26 -4.77 135.00 137.67 1n0f n PRO 115 Ca 0.08 0.58 -0.15 0.00 -2.02 0.00 0.00 63.50 61.99 1n0f n PRO 115 Cb 0.48 -2.14 -0.09 0.00 -0.02 0.00 0.00 33.50 31.74 1n0f n PRO 115 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1n0f h ASN 116 N 1.92 -1.52 -0.87 2.55 2.35 -1.97 -0.68 115.58 117.36 1n0f h ASN 116 Ca -0.45 0.17 0.20 0.00 -0.55 0.00 0.00 56.30 55.68 1n0f h ASN 116 Cb 1.32 0.58 -0.12 0.00 0.05 0.00 0.00 38.32 40.15 1n0f h ASN 116 CO 0.59 -0.50 0.37 -0.55 -1.65 0.00 0.00 177.43 175.69 1n0f h ASN 117 N -0.64 0.32 -0.33 5.81 7.08 -2.00 0.37 115.58 126.18 1n0f h ASN 117 Ca 0.03 0.15 -0.05 0.00 -3.08 0.00 0.00 56.30 53.34 1n0f h ASN 117 Cb 0.70 0.13 -0.01 0.00 -2.08 0.00 0.00 38.32 37.06 1n0f h ASN 117 CO -0.34 0.02 -0.00 -0.07 -2.08 0.00 0.00 177.43 174.96 1n0f h LEU 118 N 0.41 0.57 -1.35 6.14 4.07 -1.80 -0.37 115.31 122.98 1n0f h LEU 118 Ca 0.53 -0.31 0.23 0.00 0.08 0.00 0.00 57.88 58.42 1n0f h LEU 118 Cb 0.97 -0.15 -0.09 0.00 1.08 0.00 0.00 40.66 42.47 1n0f h LEU 118 CO -0.51 0.74 0.64 0.40 -1.08 0.00 0.00 178.44 178.63 1n0f h ILE 119 N 0.39 0.61 0.17 1.22 1.08 0.57 -0.97 117.51 120.57 1n0f h ILE 119 Ca 0.09 -0.16 -0.31 0.00 -0.39 0.00 0.00 64.86 64.09 1n0f h ILE 119 Cb 0.45 0.10 0.01 0.00 -3.07 0.00 0.00 36.82 34.31 1n0f h ILE 119 CO 0.02 0.08 -1.49 0.78 -0.69 0.00 0.00 178.15 176.85 1n0f h ASN 120 N 0.46 0.55 0.10 1.72 2.35 -0.76 -2.23 115.58 117.77 1n0f h ASN 120 Ca 0.55 -0.68 0.02 0.00 -0.55 0.00 0.00 56.30 55.64 1n0f h ASN 120 Cb 1.29 -0.18 -0.05 0.00 0.05 0.00 0.00 38.32 39.44 1n0f h ASN 120 CO -0.27 1.55 -0.40 0.44 -1.65 0.00 0.00 177.43 177.10 1n0f h ASP 121 N 0.10 -1.19 -3.58 5.81 3.32 0.27 -3.33 116.42 117.81 1n0f h ASP 121 Ca -0.24 0.14 -0.52 0.00 0.02 0.00 0.00 57.03 56.43 1n0f h ASP 121 Cb 2.06 0.45 -0.03 0.00 0.22 0.00 0.00 39.33 42.03 1n0f h ASP 121 CO 0.20 -0.47 0.23 0.00 -1.72 0.00 0.00 179.24 177.48 1n0f s ALA 122 N -5.93 3.41 -1.50 3.45 0.00 -0.89 -4.89 121.76 115.41 1n0f s ALA 122 Ca -0.16 0.43 -0.09 0.00 0.00 0.00 0.00 51.96 52.13 1n0f s ALA 122 Cb 0.08 -3.03 -0.09 0.00 0.00 0.00 0.00 23.12 20.07 1n0f s ALA 122 CO 0.63 0.25 2.91 1.63 0.00 0.00 0.00 175.76 181.18 1n0f n LYS 123 N 1.69 3.49 -1.85 0.00 4.76 -1.25 -4.64 118.16 120.35 1n0f n LYS 123 Ca -0.04 -2.08 -0.39 0.00 -2.87 0.00 0.00 58.31 52.92 1n0f n LYS 123 Cb 0.48 -2.74 0.02 0.00 -1.84 0.00 0.00 35.03 30.96 1n0f n LYS 123 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1n0f s LEU 124 N 0.16 4.08 0.06 -0.35 1.02 -0.84 -4.82 118.68 117.98 1n0f s LEU 124 Ca 0.67 2.83 0.00 0.00 0.02 0.00 0.00 54.13 57.65 1n0f s LEU 124 Cb 0.18 -4.00 0.00 0.00 0.02 0.00 0.00 46.19 42.39 1n0f s LEU 124 CO -0.06 -1.19 0.00 -0.67 0.02 0.00 0.00 176.35 174.45 1n0f n ASP 125 N -0.30 -0.16 -3.55 2.29 2.03 -1.26 -4.83 116.55 110.77 1n0f n ASP 125 Ca 0.06 0.10 -0.00 0.00 0.52 0.00 0.00 54.79 55.47 1n0f n ASP 125 Cb 0.43 0.25 -0.06 0.00 -0.72 0.00 0.00 41.12 41.02 1n0f n ASP 125 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1n0f s LYS 126 N -1.18 0.27 0.00 -0.67 2.20 -1.26 -4.79 119.74 114.31 1n0f s LYS 126 Ca 0.00 0.54 0.00 0.00 -0.36 0.00 0.00 55.97 56.15 1n0f s LYS 126 Cb 0.00 0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.48 1n0f s LYS 126 CO 0.00 -0.07 0.00 0.39 -0.36 0.00 0.00 175.35 175.31 1n0f n GLU 127 N 4.00 0.00 -4.15 4.03 1.02 -1.26 -4.88 120.64 119.40 1n0f n GLU 127 Ca -0.15 0.18 -0.22 0.00 -0.02 0.00 0.00 57.16 56.95 1n0f n GLU 127 Cb 0.56 -0.40 -0.05 0.00 -0.02 0.00 0.00 31.44 31.53 1n0f n GLU 127 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1n0f s ILE 128 N -0.06 4.26 -0.07 -3.67 -1.09 0.21 -1.79 121.20 118.99 1n0f s ILE 128 Ca 0.00 -1.48 0.01 0.00 -2.23 0.00 0.00 60.65 56.95 1n0f s ILE 128 Cb 0.00 -3.29 0.02 0.00 -1.58 0.00 0.00 42.46 37.61 1n0f s ILE 128 CO 0.00 -0.34 -0.07 -0.69 -1.23 0.00 0.00 174.94 172.61 1n0f s VAL 129 N -2.14 0.78 -0.17 2.92 1.01 0.64 -1.03 120.40 122.41 1n0f s VAL 129 Ca 0.32 -0.22 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 1n0f s VAL 129 Cb -0.08 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1n0f s VAL 129 CO 0.24 0.29 -0.01 -0.76 0.00 0.00 0.00 175.10 174.86 1n0f s LEU 130 N 1.13 3.35 -0.00 3.92 1.43 0.29 0.18 118.68 128.98 1n0f s LEU 130 Ca -0.07 -0.11 0.08 0.00 -1.03 0.00 0.00 54.13 53.00 1n0f s LEU 130 Cb -0.14 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 1n0f s LEU 130 CO -0.01 0.15 -0.25 0.27 0.23 0.00 0.00 176.35 176.74 1n0f s ILE 131 N 0.47 1.99 0.27 -0.59 -4.36 -0.82 0.43 121.20 118.59 1n0f s ILE 131 Ca -0.02 -1.13 -0.27 0.00 -0.26 0.00 0.00 60.65 58.96 1n0f s ILE 131 Cb -0.14 -1.66 -0.09 0.00 1.25 0.00 0.00 42.46 41.81 1n0f s ILE 131 CO 0.02 0.51 0.92 -0.83 0.24 0.00 0.00 174.94 175.80 1n0f s GLY 132 N -0.73 2.93 -0.16 6.27 0.00 0.22 -1.68 107.32 114.17 1n0f s GLY 132 Ca 0.10 0.53 0.16 0.00 0.00 0.00 0.00 44.72 45.52 1n0f s GLY 132 CO -0.00 1.03 1.19 -1.06 0.00 0.00 0.00 173.10 174.25 1n0f n GLN 133 N 1.02 1.40 0.00 2.90 1.13 -0.04 -4.41 117.38 119.38 1n0f n GLN 133 Ca -0.00 -3.04 0.00 0.00 -1.94 0.00 0.00 57.00 52.01 1n0f n GLN 133 Cb 0.49 -1.21 0.00 0.00 0.11 0.00 0.00 30.24 29.63 1n0f n GLN 133 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1n0f n PHE 134 N -0.50 0.00 -0.07 1.08 7.35 0.27 -3.59 117.46 121.99 1n0f n PHE 134 Ca 0.17 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.72 1n0f n PHE 134 Cb 0.89 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 40.66 1n0f n PHE 134 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1n0f h ASP 135 N 0.00 0.81 -2.47 -2.13 3.32 -1.96 -2.59 116.42 111.40 1n0f h ASP 135 Ca 0.00 -0.53 -0.09 0.00 0.02 0.00 0.00 57.03 56.43 1n0f h ASP 135 Cb 0.00 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 1n0f h ASP 135 CO 0.00 1.18 -0.08 0.00 -1.72 0.00 0.00 179.24 178.62 1n0f n HIS 136 N -4.17 -0.36 -4.38 4.55 1.44 -1.24 -4.75 115.22 106.32 1n0f n HIS 136 Ca -0.05 -0.61 -0.27 0.00 -2.01 0.00 0.00 57.72 54.78 1n0f n HIS 136 Cb 0.56 0.09 -0.12 0.00 0.12 0.00 0.00 29.99 30.63 1n0f n HIS 136 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1n0f s LEU 137 N 0.00 2.37 -0.06 2.39 2.96 -0.15 -0.86 118.68 125.32 1n0f s LEU 137 Ca 0.08 -0.79 0.04 0.00 -0.22 0.00 0.00 54.13 53.24 1n0f s LEU 137 Cb 0.00 -1.10 0.00 0.00 0.50 0.00 0.00 46.19 45.59 1n0f s LEU 137 CO 0.06 0.11 -0.18 -1.61 -1.32 0.00 0.00 176.35 173.41 1n0f s GLU 138 N -2.34 2.14 -0.28 1.98 2.02 -0.67 -0.57 118.70 120.98 1n0f s GLU 138 Ca 0.15 -0.65 -0.09 0.00 0.02 0.00 0.00 54.97 54.40 1n0f s GLU 138 Cb -0.09 -1.75 -0.03 0.00 0.10 0.00 0.00 34.13 32.36 1n0f s GLU 138 CO 0.07 0.19 0.13 0.42 0.02 0.00 0.00 175.26 176.09 1n0f s ILE 139 N 0.25 4.69 0.27 -1.63 1.01 -0.44 -1.95 121.20 123.40 1n0f s ILE 139 Ca -0.10 -0.15 0.12 0.00 0.00 0.00 0.00 60.65 60.51 1n0f s ILE 139 Cb -0.14 -3.27 -0.05 0.00 0.01 0.00 0.00 42.46 39.01 1n0f s ILE 139 CO 0.04 0.23 -0.20 0.26 0.00 0.00 0.00 174.94 175.27 1n0f s TRP 140 N 1.66 2.28 0.02 3.97 0.52 0.13 -4.17 118.94 123.34 1n0f s TRP 140 Ca 0.06 -0.34 -0.29 0.00 0.02 0.00 0.00 56.10 55.55 1n0f s TRP 140 Cb -0.16 -1.00 -0.04 0.00 -1.15 0.00 0.00 33.47 31.13 1n0f s TRP 140 CO 0.07 0.69 0.94 0.34 0.02 0.00 0.00 176.95 179.01 1n0f s ASP 141 N -3.43 7.36 0.20 2.95 2.15 -1.26 -0.26 116.67 124.38 1n0f s ASP 141 Ca 0.29 1.64 -0.12 0.00 0.43 0.00 0.00 52.55 54.79 1n0f s ASP 141 Cb -0.05 -2.56 0.26 0.00 -0.30 0.00 0.00 42.92 40.27 1n0f s ASP 141 CO 0.14 -0.20 1.68 0.50 -0.17 0.00 0.00 175.17 177.12 1n0f h LYS 142 N 6.51 0.14 0.30 4.34 3.64 -1.64 0.10 116.57 129.96 1n0f h LYS 142 Ca -0.41 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 58.94 1n0f h LYS 142 Cb 1.22 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1n0f h LYS 142 CO 0.74 0.09 -0.14 -0.22 -2.27 0.00 0.00 179.45 177.65 1n0f h LYS 143 N 0.14 -0.39 -0.97 1.90 1.63 -1.93 -1.14 116.57 115.82 1n0f h LYS 143 Ca 0.30 0.03 0.15 0.00 -0.85 0.00 0.00 60.65 60.27 1n0f h LYS 143 Cb 0.47 0.09 -0.08 0.00 -0.60 0.00 0.00 32.23 32.10 1n0f h LYS 143 CO -0.47 -0.13 0.61 -0.07 -3.45 0.00 0.00 179.45 175.94 1n0f h LEU 144 N -0.60 0.79 -0.37 5.20 4.07 -1.87 -1.35 115.31 121.18 1n0f h LEU 144 Ca -0.04 0.06 -0.11 0.00 0.08 0.00 0.00 57.88 57.86 1n0f h LEU 144 Cb 0.44 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 1n0f h LEU 144 CO 0.07 0.38 -0.21 0.22 -1.08 0.00 0.00 178.44 177.82 1n0f h TYR 145 N 0.83 0.93 -0.80 1.13 3.20 -0.79 -0.12 116.97 121.35 1n0f h TYR 145 Ca 0.50 -0.24 -0.04 0.00 3.14 0.00 0.00 58.73 62.09 1n0f h TYR 145 Cb 0.68 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 1n0f h TYR 145 CO -0.00 0.99 0.33 0.93 -1.64 0.00 0.00 178.16 178.77 1n0f h GLU 146 N 0.59 1.19 -0.51 1.82 5.08 -0.66 -1.35 114.58 120.75 1n0f h GLU 146 Ca 0.08 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 1n0f h GLU 146 Cb 0.77 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 1n0f h GLU 146 CO 0.06 0.96 -0.05 -0.44 -1.00 0.00 0.00 179.01 178.54 1n0f h ASP 147 N 1.16 0.87 -0.67 1.42 3.32 -1.11 0.29 116.42 121.70 1n0f h ASP 147 Ca 0.27 -0.24 0.02 0.00 0.02 0.00 0.00 57.03 57.09 1n0f h ASP 147 Cb 0.20 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.48 1n0f h ASP 147 CO -0.02 0.96 0.43 0.22 -1.72 0.00 0.00 179.24 179.10 1n0f h TYR 148 N 0.81 0.82 -0.31 4.55 3.20 -0.34 -0.40 116.97 125.30 1n0f h TYR 148 Ca 0.14 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.88 1n0f h TYR 148 Cb 0.55 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 1n0f h TYR 148 CO 0.03 0.50 -0.42 -0.07 -1.64 0.00 0.00 178.16 176.56 1n0f h LEU 149 N 0.87 0.84 -0.80 2.82 4.07 -0.81 -3.07 115.31 119.23 1n0f h LEU 149 Ca 0.25 -0.39 -0.01 0.00 0.08 0.00 0.00 57.88 57.81 1n0f h LEU 149 Cb -0.06 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 41.41 1n0f h LEU 149 CO -0.07 1.15 0.44 0.00 -1.08 0.00 0.00 178.44 178.88 1n0f h ALA 150 N 0.89 1.03 -3.00 1.53 0.00 0.29 -3.41 119.26 116.59 1n0f h ALA 150 Ca 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1n0f h ALA 150 Cb 0.98 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1n0f h ALA 150 CO 0.09 0.53 0.00 0.09 0.00 0.00 0.00 179.25 179.96 1n0f n ASN 151 N -4.42 0.00 -1.80 0.00 3.02 -0.23 -4.98 115.26 106.86 1n0f n ASN 151 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1n0f n ASN 151 Cb 0.09 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 1n0f n ASN 151 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1n0f n SER 152 N 0.00 -6.41 -2.58 6.41 3.41 -1.23 -4.94 113.62 108.29 1n0f n SER 152 Ca 0.00 1.27 -0.03 0.00 -0.26 0.00 0.00 58.87 59.85 1n0f n SER 152 Cb 0.00 -4.00 0.03 0.00 -0.26 0.00 0.00 64.21 59.97 1n0f n SER 152 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1n0f n GLU 153 N 0.62 -1.13 -2.12 4.33 1.02 -1.26 -4.98 120.64 117.12 1n0f n GLU 153 Ca 0.00 -0.21 -0.33 0.00 -0.02 0.00 0.00 57.16 56.61 1n0f n GLU 153 Cb 0.00 -0.18 0.00 0.00 -0.02 0.00 0.00 31.44 31.24 1n0f n GLU 153 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1n0f s SER 154 N -1.81 5.93 0.19 1.62 1.04 -1.26 -4.86 113.70 114.55 1n0f s SER 154 Ca 0.08 1.79 -0.13 0.00 0.48 0.00 0.00 55.95 58.17 1n0f s SER 154 Cb -0.01 -2.53 0.21 0.00 0.10 0.00 0.00 66.02 63.79 1n0f s SER 154 CO 0.06 -1.07 1.70 0.25 0.98 0.00 0.00 173.24 175.17 1n0f h LEU 155 N 0.55 -0.09 -0.09 2.42 5.85 -1.99 0.17 115.31 122.14 1n0f h LEU 155 Ca -0.47 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1n0f h LEU 155 Cb 1.21 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.41 1n0f h LEU 155 CO 0.58 -0.02 0.01 -0.33 -0.34 0.00 0.00 178.44 178.34 1n0f h GLU 156 N 0.19 0.14 -0.58 1.25 3.07 -1.99 0.27 114.58 116.94 1n0f h GLU 156 Ca 0.26 -0.04 0.07 0.00 -0.50 0.00 0.00 59.36 59.16 1n0f h GLU 156 Cb 0.38 -0.02 -0.06 0.00 -0.84 0.00 0.00 28.75 28.21 1n0f h GLU 156 CO -0.38 0.36 0.25 1.15 -1.40 0.00 0.00 179.01 179.00 1n0f h THR 157 N -0.10 0.86 -0.31 1.13 2.02 -1.78 -0.64 112.91 114.09 1n0f h THR 157 Ca 0.03 -0.16 -0.10 0.00 0.77 0.00 0.00 66.41 66.95 1n0f h THR 157 Cb 0.29 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 1n0f h THR 157 CO 0.00 0.09 -0.18 0.58 0.37 0.00 0.00 175.52 176.38 1n0f h VAL 158 N 0.47 1.29 -0.19 3.16 2.07 -0.55 -3.20 116.25 119.31 1n0f h VAL 158 Ca 0.28 -1.30 0.01 0.00 0.82 0.00 0.00 66.70 66.50 1n0f h VAL 158 Cb 0.27 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1n0f h VAL 158 CO -0.24 0.42 0.10 0.00 0.02 0.00 0.00 177.57 177.87 1n0f h ALA 159 N 0.75 0.23 -1.22 1.67 0.00 -0.44 -2.18 119.26 118.07 1n0f h ALA 159 Ca 0.07 0.00 0.35 0.00 0.00 0.00 0.00 54.91 55.33 1n0f h ALA 159 Cb 0.72 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.38 1n0f h ALA 159 CO 0.05 -0.32 0.82 1.49 0.00 0.00 0.00 179.25 181.29 1n0f h GLU 160 N 0.21 0.17 0.00 0.00 4.57 -1.12 0.26 114.58 118.67 1n0f h GLU 160 Ca 0.07 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1n0f h GLU 160 Cb 0.00 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.56 1n0f h GLU 160 CO -0.04 0.11 -0.06 0.54 -1.18 0.00 0.00 179.01 178.38 1n0f n ARG 161 N -4.47 0.17 0.00 1.92 1.74 -0.82 -5.13 116.66 110.06 1n0f n ARG 161 Ca 0.30 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.51 1n0f n ARG 161 Cb 1.20 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 30.96 1n0f n ARG 161 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78