#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n0g n GLN 23 N 0.00 -0.03 -2.57 -1.08 -0.00 -1.26 0.11 117.38 112.55 1n0g n GLN 23 Ca 0.00 1.15 -0.08 0.00 -0.00 0.00 0.00 57.00 58.07 1n0g n GLN 23 Cb 0.00 -2.31 0.04 0.00 -0.00 0.00 0.00 30.24 27.97 1n0g n GLN 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n0g n GLY 24 N -1.53 3.31 0.00 2.61 0.00 -1.26 -4.64 105.19 103.68 1n0g n GLY 24 Ca 0.38 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1n0g n GLY 24 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1n0g n HIS 25 N -0.62 0.00 -4.00 1.61 8.25 0.12 -3.09 115.22 117.49 1n0g n HIS 25 Ca 0.19 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.34 1n0g n HIS 25 Cb 0.85 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.81 1n0g n HIS 25 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1n0g s MET 26 N -0.37 1.93 -0.64 -0.41 -1.94 -0.46 -4.97 119.30 112.45 1n0g s MET 26 Ca 0.00 -1.13 -0.27 0.00 -1.71 0.00 0.00 55.69 52.57 1n0g s MET 26 Cb 0.00 -2.71 0.01 0.00 2.01 0.00 0.00 34.83 34.14 1n0g s MET 26 CO 0.00 -0.57 1.48 -0.51 -0.01 0.00 0.00 175.02 175.41 1n0g s LEU 27 N 1.27 3.28 0.24 -0.03 1.43 -1.17 -4.90 118.68 118.79 1n0g s LEU 27 Ca -0.07 0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.08 1n0g s LEU 27 Cb -0.19 -2.73 -0.05 0.00 0.03 0.00 0.00 46.19 43.25 1n0g s LEU 27 CO -0.06 -1.94 0.05 -0.76 0.23 0.00 0.00 176.35 173.88 1n0g s LEU 28 N 6.74 1.89 0.00 1.79 1.43 -1.26 0.88 118.68 130.14 1n0g s LEU 28 Ca 0.50 -1.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.29 1n0g s LEU 28 Cb -0.10 -0.08 0.00 0.00 0.03 0.00 0.00 46.19 46.03 1n0g s LEU 28 CO 0.20 -0.64 0.00 0.61 0.23 0.00 0.00 176.35 176.75 1n0g n GLY 29 N -0.43 -2.49 2.98 -3.19 0.00 -1.26 -4.17 105.19 96.63 1n0g n GLY 29 Ca -0.03 -1.64 -0.23 0.00 0.00 0.00 0.00 46.02 44.12 1n0g n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n0g s THR 30 N -0.63 0.97 -0.09 2.61 2.01 -1.26 -0.87 115.64 118.38 1n0g s THR 30 Ca 0.00 -0.37 0.03 0.00 0.31 0.00 0.00 61.69 61.66 1n0g s THR 30 Cb 0.00 -0.91 0.01 0.00 0.01 0.00 0.00 72.50 71.61 1n0g s THR 30 CO 0.00 0.32 -0.18 -0.36 -0.69 0.00 0.00 174.62 173.71 1n0g s PHE 31 N 0.79 2.06 -0.40 4.92 0.08 0.97 -4.96 117.98 121.44 1n0g s PHE 31 Ca -0.13 -0.84 -0.16 0.00 0.12 0.00 0.00 56.93 55.92 1n0g s PHE 31 Cb -0.15 -1.43 0.01 0.00 -0.57 0.00 0.00 43.02 40.89 1n0g s PHE 31 CO 0.02 -0.38 0.38 -0.80 -0.10 0.00 0.00 175.22 174.35 1n0g s ASN 32 N 0.56 6.16 0.33 1.36 0.01 -1.26 -0.69 114.94 121.41 1n0g s ASN 32 Ca -0.15 -0.66 0.03 0.00 -0.71 0.00 0.00 52.86 51.37 1n0g s ASN 32 Cb -0.17 -2.20 -0.04 0.00 0.41 0.00 0.00 41.25 39.26 1n0g s ASN 32 CO 0.05 -0.50 0.14 0.27 -1.51 0.00 0.00 177.10 175.56 1n0g s ILE 33 N 1.98 0.48 0.17 0.60 -4.36 -0.59 -4.99 121.20 114.49 1n0g s ILE 33 Ca 0.10 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.57 1n0g s ILE 33 Cb -0.17 -2.50 -0.04 0.00 1.25 0.00 0.00 42.46 40.99 1n0g s ILE 33 CO 0.12 0.00 -0.18 0.42 0.24 0.00 0.00 174.94 175.55 1n0g s THR 34 N -3.47 1.80 -0.34 8.37 -4.23 -1.26 0.21 115.64 116.72 1n0g s THR 34 Ca 0.33 -1.96 -0.29 0.00 -1.18 0.00 0.00 61.69 58.59 1n0g s THR 34 Cb 0.05 -1.87 0.02 0.00 1.34 0.00 0.00 72.50 72.04 1n0g s THR 34 CO 0.17 -0.36 1.09 -0.22 -0.54 0.00 0.00 174.62 174.76 1n0g s LEU 35 N -2.77 3.90 0.80 4.79 1.98 -1.26 -4.65 118.68 121.47 1n0g s LEU 35 Ca 0.17 0.99 -0.11 0.00 -2.89 0.00 0.00 54.13 52.30 1n0g s LEU 35 Cb -0.05 -3.54 0.07 0.00 0.66 0.00 0.00 46.19 43.33 1n0g s LEU 35 CO 0.07 -0.93 1.10 -0.62 -1.89 0.00 0.00 176.35 174.08 1n0g s ASP 36 N 1.78 4.19 0.05 3.68 2.15 -0.57 -4.79 116.67 123.17 1n0g s ASP 36 Ca 0.46 1.90 0.03 0.00 0.43 0.00 0.00 52.55 55.37 1n0g s ASP 36 Cb -0.12 -2.53 0.15 0.00 -0.30 0.00 0.00 42.92 40.12 1n0g s ASP 36 CO 0.17 -2.25 1.01 0.00 -0.17 0.00 0.00 175.17 173.94 1n0g n ALA 37 N -3.64 0.85 -0.60 3.66 0.00 -1.26 0.28 120.51 119.80 1n0g n ALA 37 Ca 0.10 0.03 0.07 0.00 0.00 0.00 0.00 53.44 53.63 1n0g n ALA 37 Cb 0.53 -0.88 0.21 0.00 0.00 0.00 0.00 19.45 19.30 1n0g n ALA 37 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1n0g n LYS 38 N -1.53 2.91 -1.99 0.00 5.02 -1.26 -4.95 118.16 116.36 1n0g n LYS 38 Ca -0.00 -2.46 -0.14 0.00 -2.02 0.00 0.00 58.31 53.69 1n0g n LYS 38 Cb 0.09 -1.57 -0.02 0.00 -0.02 0.00 0.00 35.03 33.51 1n0g n LYS 38 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1n0g n ASN 39 N -0.01 -4.50 -4.97 4.39 5.03 0.14 -4.82 115.26 110.51 1n0g n ASN 39 Ca 0.17 0.11 -0.21 0.00 0.87 0.00 0.00 54.58 55.51 1n0g n ASN 39 Cb 0.67 -3.53 -0.01 0.00 -1.02 0.00 0.00 39.78 35.88 1n0g n ASN 39 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1n0g s ARG 40 N -4.22 3.36 -0.01 3.52 0.52 -1.25 -1.48 118.95 119.39 1n0g s ARG 40 Ca 0.00 -0.75 0.05 0.00 -0.52 0.00 0.00 55.73 54.51 1n0g s ARG 40 Cb 0.00 -2.83 -0.01 0.00 0.52 0.00 0.00 34.95 32.62 1n0g s ARG 40 CO 0.00 0.28 -0.16 -1.50 0.02 0.00 0.00 175.30 173.94 1n0g s ILE 41 N -2.09 1.29 -0.46 1.52 1.10 0.11 -1.51 121.20 121.17 1n0g s ILE 41 Ca 0.38 -0.74 -0.13 0.00 -0.51 0.00 0.00 60.65 59.64 1n0g s ILE 41 Cb -0.09 -1.08 0.07 0.00 0.15 0.00 0.00 42.46 41.51 1n0g s ILE 41 CO 0.31 0.33 0.35 -0.44 -2.11 0.00 0.00 174.94 173.38 1n0g s SER 42 N -0.47 5.99 0.39 4.50 0.01 -1.26 0.29 113.70 123.15 1n0g s SER 42 Ca 0.06 -1.38 -0.27 0.00 1.31 0.00 0.00 55.95 55.67 1n0g s SER 42 Cb -0.06 -2.12 -0.11 0.00 0.21 0.00 0.00 66.02 63.94 1n0g s SER 42 CO -0.00 -0.61 1.31 0.18 0.41 0.00 0.00 173.24 174.52 1n0g n LEU 43 N 5.11 3.99 -1.48 2.44 4.77 -0.91 -4.78 117.00 126.13 1n0g n LEU 43 Ca -0.12 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 57.02 1n0g n LEU 43 Cb 0.43 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.01 1n0g n LEU 43 CO 0.45 -0.49 0.00 -2.65 -1.33 0.00 0.00 177.39 173.37 1n0g n PRO 44 N 0.25 0.00 0.00 3.23 -0.02 -1.26 -4.81 135.00 132.39 1n0g n PRO 44 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1n0g n PRO 44 Cb 0.38 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 1n0g n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n0g n ALA 45 N 1.40 0.00 -0.34 3.55 0.00 -1.26 -3.71 120.51 120.15 1n0g n ALA 45 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 1n0g n ALA 45 Cb 0.00 0.00 0.37 0.00 0.00 0.00 0.00 19.45 19.82 1n0g n ALA 45 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1n0g h LYS 46 N 0.00 0.62 -0.23 0.00 2.10 -1.97 -0.17 116.57 116.93 1n0g h LYS 46 Ca 0.00 -0.04 -0.02 0.00 -2.00 0.00 0.00 60.65 58.59 1n0g h LYS 46 Cb 0.00 -0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 31.18 1n0g h LYS 46 CO 0.00 0.41 0.06 -0.07 -2.00 0.00 0.00 179.45 177.86 1n0g h LEU 47 N 0.64 0.34 -1.23 7.07 4.07 -1.90 -2.97 115.31 121.33 1n0g h LEU 47 Ca 0.60 -0.22 0.41 0.00 0.08 0.00 0.00 57.88 58.75 1n0g h LEU 47 Cb 1.10 -0.09 -0.11 0.00 1.08 0.00 0.00 40.66 42.64 1n0g h LEU 47 CO -0.40 0.47 0.81 0.54 -1.08 0.00 0.00 178.44 178.79 1n0g n ARG 48 N -4.75 -0.02 0.12 1.13 1.74 -0.08 0.82 116.66 115.62 1n0g n ARG 48 Ca -0.03 1.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.96 1n0g n ARG 48 Cb 0.16 -2.04 -0.05 0.00 -1.02 0.00 0.00 32.46 29.51 1n0g n ARG 48 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1n0g h ALA 49 N 1.21 -0.90 -0.76 7.54 0.00 -1.56 -2.90 119.26 121.89 1n0g h ALA 49 Ca 0.73 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.71 1n0g h ALA 49 Cb 2.49 0.57 -0.15 0.00 0.00 0.00 0.00 17.79 20.71 1n0g h ALA 49 CO -0.31 -0.94 -0.19 0.34 0.00 0.00 0.00 179.25 178.15 1n0g n PHE 50 N -4.01 0.27 -2.75 0.00 7.35 0.24 -4.51 117.46 114.06 1n0g n PHE 50 Ca -0.06 0.93 -0.26 0.00 -0.76 0.00 0.00 57.45 57.31 1n0g n PHE 50 Cb 0.24 -0.94 0.01 0.00 0.35 0.00 0.00 39.48 39.13 1n0g n PHE 50 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1n0g s PHE 51 N -5.96 3.38 0.00 -5.13 0.08 -1.09 -5.02 117.98 104.24 1n0g s PHE 51 Ca -0.11 0.56 0.00 0.00 0.12 0.00 0.00 56.93 57.50 1n0g s PHE 51 Cb 0.21 -2.38 0.00 0.00 -0.57 0.00 0.00 43.02 40.28 1n0g s PHE 51 CO 0.60 -0.40 0.00 0.39 -0.10 0.00 0.00 175.22 175.70 1n0g n GLU 52 N -2.25 0.00 -0.11 0.44 -0.58 -1.26 -4.92 120.64 111.96 1n0g n GLU 52 Ca 0.01 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.79 1n0g n GLU 52 Cb 0.57 0.00 0.05 0.00 -0.57 0.00 0.00 31.44 31.49 1n0g n GLU 52 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1n0g n GLY 53 N 5.00 2.43 3.29 0.62 0.00 -1.26 -4.90 105.19 110.37 1n0g n GLY 53 Ca 0.00 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 1n0g n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n0g s SER 54 N -1.56 -0.26 0.30 1.61 1.04 -1.26 0.04 113.70 113.60 1n0g s SER 54 Ca 0.12 0.14 -0.05 0.00 0.48 0.00 0.00 55.95 56.65 1n0g s SER 54 Cb 0.10 0.36 -0.00 0.00 0.10 0.00 0.00 66.02 66.58 1n0g s SER 54 CO 0.01 -0.51 0.43 0.27 0.98 0.00 0.00 173.24 174.42 1n0g s ILE 55 N -1.55 0.00 -0.15 -1.02 -5.25 0.21 -4.30 121.20 109.15 1n0g s ILE 55 Ca -0.12 -1.61 0.01 0.00 -0.99 0.00 0.00 60.65 57.95 1n0g s ILE 55 Cb -0.04 -2.52 0.02 0.00 2.95 0.00 0.00 42.46 42.87 1n0g s ILE 55 CO 0.04 0.00 -0.18 -0.69 -1.79 0.00 0.00 174.94 172.32 1n0g s VAL 56 N -3.42 1.80 -0.08 8.37 1.01 -0.75 -0.35 120.40 126.97 1n0g s VAL 56 Ca 0.30 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.45 1n0g s VAL 56 Cb 0.00 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 1n0g s VAL 56 CO 0.17 0.50 -0.06 -0.29 0.00 0.00 0.00 175.10 175.42 1n0g h ILE 57 N 5.95 0.00 -3.02 2.22 6.09 -1.88 -2.60 117.51 124.27 1n0g h ILE 57 Ca -0.37 -0.67 0.00 0.00 -1.37 0.00 0.00 64.86 62.45 1n0g h ILE 57 Cb 1.16 0.00 0.00 0.00 0.47 0.00 0.00 36.82 38.45 1n0g h ILE 57 CO 0.55 0.00 -0.52 -0.46 -3.07 0.00 0.00 178.15 174.65 1n0g n ASN 58 N -3.85 -4.70 -4.76 2.19 0.23 -1.25 -2.94 115.26 100.17 1n0g n ASN 58 Ca -0.02 0.88 -0.41 0.00 -0.53 0.00 0.00 54.58 54.50 1n0g n ASN 58 Cb 0.09 -3.49 -0.03 0.00 -2.08 0.00 0.00 39.78 34.27 1n0g n ASN 58 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1n0g s ARG 59 N -4.11 4.47 0.01 -3.83 3.52 -1.26 -0.75 118.95 117.00 1n0g s ARG 59 Ca 0.00 2.01 0.00 0.00 -0.13 0.00 0.00 55.73 57.61 1n0g s ARG 59 Cb 0.00 -3.15 0.00 0.00 -1.56 0.00 0.00 34.95 30.24 1n0g s ARG 59 CO 0.00 -0.06 0.01 0.41 -0.81 0.00 0.00 175.30 174.85 1n0g n GLY 60 N 1.39 2.51 3.85 8.12 0.00 -1.26 -4.60 105.19 115.20 1n0g n GLY 60 Ca 0.01 -2.15 -0.34 0.00 0.00 0.00 0.00 46.02 43.54 1n0g n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n0g s PHE 61 N 0.44 3.55 -1.04 1.61 0.08 -1.26 -4.05 117.98 117.30 1n0g s PHE 61 Ca 0.01 1.01 -0.03 0.00 0.12 0.00 0.00 56.93 58.04 1n0g s PHE 61 Cb -0.00 -2.34 0.00 0.00 -0.57 0.00 0.00 43.02 40.11 1n0g s PHE 61 CO 0.00 0.37 0.34 0.39 -0.10 0.00 0.00 175.22 176.23 1n0g n GLU 62 N 0.50 -2.89 -3.59 0.44 4.71 -1.26 -3.44 120.64 115.11 1n0g n GLU 62 Ca -0.03 0.61 -0.22 0.00 -0.01 0.00 0.00 57.16 57.50 1n0g n GLU 62 Cb 0.52 -4.82 0.07 0.00 -1.01 0.00 0.00 31.44 26.20 1n0g n GLU 62 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1n0g n ASN 63 N -0.97 -4.45 -0.00 1.62 3.02 -1.26 -4.96 115.26 108.26 1n0g n ASN 63 Ca -0.09 -0.61 0.06 0.00 -0.03 0.00 0.00 54.58 53.90 1n0g n ASN 63 Cb 0.59 -4.87 -0.08 0.00 -0.61 0.00 0.00 39.78 34.80 1n0g n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0g n LEU 65 N -1.87 -4.76 -4.78 0.00 4.32 -1.26 -2.42 117.00 106.23 1n0g n LEU 65 Ca -0.02 2.16 -0.22 0.00 -0.02 0.00 0.00 56.01 57.91 1n0g n LEU 65 Cb 0.28 -2.20 -0.05 0.00 -1.62 0.00 0.00 43.42 39.83 1n0g n LEU 65 CO 0.23 -0.93 -0.20 -1.61 -1.22 0.00 0.00 177.39 173.66 1n0g s GLU 66 N -1.87 2.75 -0.07 3.23 2.02 0.07 -1.52 118.70 123.32 1n0g s GLU 66 Ca 0.00 -1.17 -0.03 0.00 0.02 0.00 0.00 54.97 53.80 1n0g s GLU 66 Cb 0.00 -2.45 0.04 0.00 0.10 0.00 0.00 34.13 31.81 1n0g s GLU 66 CO 0.00 0.37 0.06 0.08 0.02 0.00 0.00 175.26 175.80 1n0g s VAL 67 N -2.20 -0.09 0.19 2.63 1.01 0.16 -4.09 120.40 118.01 1n0g s VAL 67 Ca 0.33 0.31 0.06 0.00 0.00 0.00 0.00 61.98 62.68 1n0g s VAL 67 Cb -0.07 -0.24 -0.05 0.00 0.00 0.00 0.00 36.38 36.02 1n0g s VAL 67 CO 0.24 0.10 -0.11 -0.13 0.00 0.00 0.00 175.10 175.19 1n0g s ARG 68 N 2.16 1.23 0.38 2.72 0.52 -0.98 -1.08 118.95 123.89 1n0g s ARG 68 Ca 0.04 -1.55 -0.25 0.00 -0.52 0.00 0.00 55.73 53.45 1n0g s ARG 68 Cb -0.13 -0.88 -0.09 0.00 0.52 0.00 0.00 34.95 34.37 1n0g s ARG 68 CO -0.04 0.11 1.08 0.15 0.02 0.00 0.00 175.30 176.62 1n0g s LYS 69 N -3.71 4.24 0.27 3.54 1.02 -1.26 -1.81 119.74 122.02 1n0g s LYS 69 Ca 0.21 1.62 -0.03 0.00 0.02 0.00 0.00 55.97 57.79 1n0g s LYS 69 Cb 0.01 -2.69 0.56 0.00 -0.52 0.00 0.00 37.83 35.20 1n0g s LYS 69 CO 0.05 -0.10 1.63 -1.35 -0.92 0.00 0.00 175.35 174.65 1n0g h PRO 70 N 2.77 0.11 -0.30 -1.68 0.11 -1.88 -0.31 132.00 130.82 1n0g h PRO 70 Ca -0.48 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.67 1n0g h PRO 70 Cb 1.22 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 1n0g h PRO 70 CO 0.63 0.07 0.04 1.96 -0.21 0.00 0.00 178.00 180.50 1n0g h GLN 71 N 0.12 0.14 -0.92 1.05 7.50 -1.96 -0.87 115.11 120.17 1n0g h GLN 71 Ca 0.48 -0.01 0.02 0.00 0.50 0.00 0.00 58.65 59.64 1n0g h GLN 71 Cb 0.91 -0.03 -0.05 0.00 0.05 0.00 0.00 27.48 28.36 1n0g h GLN 71 CO -0.71 0.09 0.61 -0.44 -1.50 0.00 0.00 178.83 176.88 1n0g h ASP 72 N 0.14 1.04 -1.00 1.46 3.32 -1.46 -1.04 116.42 118.88 1n0g h ASP 72 Ca 0.14 -0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.18 1n0g h ASP 72 Cb 0.17 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.42 1n0g h ASP 72 CO -0.21 0.74 0.67 0.15 -1.72 0.00 0.00 179.24 178.87 1n0g h PHE 73 N 1.22 1.26 -0.49 4.55 3.57 -0.63 0.14 116.94 126.56 1n0g h PHE 73 Ca 0.35 0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.97 1n0g h PHE 73 Cb -0.09 -0.43 -0.08 0.00 2.79 0.00 0.00 35.95 38.14 1n0g h PHE 73 CO -0.01 0.80 -0.02 0.37 -2.23 0.00 0.00 178.31 177.22 1n0g h GLN 74 N 1.36 0.09 -0.25 1.11 5.75 0.15 -1.45 115.11 121.87 1n0g h GLN 74 Ca 0.37 -0.01 -0.07 0.00 -0.15 0.00 0.00 58.65 58.79 1n0g h GLN 74 Cb -0.16 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.37 1n0g h GLN 74 CO -0.08 0.06 -0.13 0.87 -2.65 0.00 0.00 178.83 176.90 1n0g h LYS 75 N 0.09 0.53 -1.01 1.69 1.57 -0.90 -2.90 116.57 115.64 1n0g h LYS 75 Ca 0.25 -0.24 0.24 0.00 -1.87 0.00 0.00 60.65 59.03 1n0g h LYS 75 Cb 0.37 -0.01 -0.12 0.00 0.08 0.00 0.00 32.23 32.55 1n0g h LYS 75 CO -0.42 0.80 0.61 -0.92 -0.57 0.00 0.00 179.45 178.94 1n0g h TYR 76 N 0.25 0.97 -0.68 -1.35 3.20 -0.40 0.25 116.97 119.20 1n0g h TYR 76 Ca 0.05 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 1n0g h TYR 76 Cb 0.64 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 1n0g h TYR 76 CO 0.06 0.09 0.24 0.35 -1.64 0.00 0.00 178.16 177.27 1n0g h PHE 77 N 0.58 1.03 -0.63 -3.82 3.57 -1.08 -2.90 116.94 113.70 1n0g h PHE 77 Ca 0.63 -0.08 0.13 0.00 3.53 0.00 0.00 57.97 62.18 1n0g h PHE 77 Cb 1.22 -0.31 -0.10 0.00 2.79 0.00 0.00 35.95 39.55 1n0g h PHE 77 CO -0.01 0.80 0.09 0.93 -2.23 0.00 0.00 178.31 177.90 1n0g h GLU 78 N 0.98 0.20 -0.44 1.11 4.39 -0.48 0.25 114.58 120.60 1n0g h GLU 78 Ca 0.22 -0.01 0.13 0.00 0.34 0.00 0.00 59.36 60.04 1n0g h GLU 78 Cb 0.23 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 1n0g h GLU 78 CO -0.01 0.13 0.63 1.96 -1.16 0.00 0.00 179.01 180.55 1n0g h GLN 79 N 0.21 0.00 0.11 2.33 4.20 -1.44 -1.75 115.11 118.77 1n0g h GLN 79 Ca 0.33 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.80 1n0g h GLN 79 Cb 0.53 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.31 1n0g h GLN 79 CO -0.47 0.00 -1.20 0.74 -0.67 0.00 0.00 178.83 177.23 1n0g h PHE 80 N 0.00 0.43 -1.01 2.96 0.04 -0.62 -3.23 116.94 115.50 1n0g h PHE 80 Ca 0.21 -0.31 0.29 0.00 2.80 0.00 0.00 57.97 60.95 1n0g h PHE 80 Cb 1.46 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 39.55 1n0g h PHE 80 CO 0.00 1.47 0.72 -0.91 -0.60 0.00 0.00 178.31 178.99 1n0g h ASN 81 N -0.39 0.03 -0.30 2.17 2.35 -1.22 1.22 115.58 119.44 1n0g h ASN 81 Ca -0.25 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.56 1n0g h ASN 81 Cb 1.68 -0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.99 1n0g h ASN 81 CO 0.07 0.01 -0.10 -1.28 -1.65 0.00 0.00 177.43 174.47 1n0g h SER 82 N 0.02 -0.35 -3.38 5.81 0.87 -1.53 -3.41 113.55 111.58 1n0g h SER 82 Ca 0.48 0.10 -0.53 0.00 -1.23 0.00 0.00 61.79 60.62 1n0g h SER 82 Cb 1.89 0.21 0.06 0.00 -0.44 0.00 0.00 62.40 64.13 1n0g h SER 82 CO -0.02 -0.13 0.78 -0.36 -0.53 0.00 0.00 176.83 176.57 1n0g s PHE 83 N -6.20 2.97 0.00 2.24 0.08 0.42 -4.95 117.98 112.54 1n0g s PHE 83 Ca -0.14 0.98 0.00 0.00 0.12 0.00 0.00 56.93 57.89 1n0g s PHE 83 Cb 0.12 -3.87 0.00 0.00 -0.57 0.00 0.00 43.02 38.71 1n0g s PHE 83 CO 0.70 -2.84 0.00 -2.30 -0.10 0.00 0.00 175.22 170.68 1n0g n PRO 84 N 2.29 0.00 0.00 0.24 -0.02 -1.26 -4.89 135.00 131.36 1n0g n PRO 84 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1n0g n PRO 84 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.88 1n0g n PRO 84 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n0g n SER 85 N 0.00 0.00 -0.01 2.55 2.88 -1.26 -4.87 113.62 112.91 1n0g n SER 85 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 1n0g n SER 85 Cb 0.00 0.00 0.44 0.00 -0.75 0.00 0.00 64.21 63.90 1n0g n SER 85 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1n0g n THR 86 N 0.00 0.00 -2.99 2.46 -2.24 -1.26 -4.65 114.28 105.60 1n0g n THR 86 Ca 0.00 -0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 1n0g n THR 86 Cb 0.00 -0.10 -0.05 0.00 -2.10 0.00 0.00 70.33 68.08 1n0g n THR 86 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1n0g s GLN 87 N -2.96 4.27 0.26 -0.78 -1.52 -1.26 -4.94 119.66 112.73 1n0g s GLN 87 Ca 0.14 0.85 -0.02 0.00 -1.95 0.00 0.00 55.36 54.38 1n0g s GLN 87 Cb 0.18 -3.57 0.54 0.00 -0.22 0.00 0.00 33.01 29.94 1n0g s GLN 87 CO 0.61 -0.27 1.73 -0.22 -0.25 0.00 0.00 175.29 176.88 1n0g h LYS 88 N 7.36 0.45 -0.09 2.91 3.64 -2.00 -1.15 116.57 127.68 1n0g h LYS 88 Ca -0.31 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.07 1n0g h LYS 88 Cb 1.14 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 1n0g h LYS 88 CO 0.81 0.30 -0.04 -0.44 -2.27 0.00 0.00 179.45 177.80 1n0g h ASP 89 N 0.46 -0.13 -0.58 4.20 3.32 -1.96 -0.99 116.42 120.74 1n0g h ASP 89 Ca 0.46 0.03 0.12 0.00 0.02 0.00 0.00 57.03 57.66 1n0g h ASP 89 Cb 0.73 0.08 -0.10 0.00 0.22 0.00 0.00 39.33 40.27 1n0g h ASP 89 CO -0.43 -0.05 0.02 0.74 -1.72 0.00 0.00 179.24 177.79 1n0g h THR 90 N -0.03 0.54 -0.58 0.35 2.02 -1.59 0.66 112.91 114.29 1n0g h THR 90 Ca 0.05 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1n0g h THR 90 Cb 0.10 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 1n0g h THR 90 CO -0.11 0.02 0.28 0.03 0.37 0.00 0.00 175.52 176.12 1n0g h ARG 91 N 0.14 0.81 -0.39 6.66 3.08 -1.01 -1.46 114.38 122.21 1n0g h ARG 91 Ca 0.30 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 60.19 1n0g h ARG 91 Cb 0.48 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1n0g h ARG 91 CO -0.48 0.62 -0.01 1.15 -1.07 0.00 0.00 179.97 180.18 1n0g h THR 92 N 0.81 1.26 0.63 2.04 2.02 0.41 -1.91 112.91 118.16 1n0g h THR 92 Ca 0.20 -1.03 -0.03 0.00 0.77 0.00 0.00 66.41 66.33 1n0g h THR 92 Cb 0.08 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1n0g h THR 92 CO -0.03 0.35 -0.44 -0.07 0.37 0.00 0.00 175.52 175.70 1n0g h LEU 93 N 0.52 -1.15 -0.85 2.58 3.38 -0.75 0.96 115.31 120.01 1n0g h LEU 93 Ca 0.11 0.07 0.20 0.00 0.09 0.00 0.00 57.88 58.35 1n0g h LEU 93 Cb 0.49 0.35 -0.12 0.00 0.09 0.00 0.00 40.66 41.47 1n0g h LEU 93 CO 0.02 -0.65 0.31 0.11 0.09 0.00 0.00 178.44 178.32 1n0g h LYS 94 N -1.02 0.33 -0.16 1.13 1.57 -1.29 -0.20 116.57 116.93 1n0g h LYS 94 Ca -0.08 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 1n0g h LYS 94 Cb 0.83 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 1n0g h LYS 94 CO 0.05 0.22 -0.12 0.00 -0.57 0.00 0.00 179.45 179.03 1n0g h ARG 95 N 0.34 0.36 0.00 3.15 3.08 -1.09 -0.43 114.38 119.79 1n0g h ARG 95 Ca 0.51 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.36 1n0g h ARG 95 Cb 0.95 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.00 1n0g h ARG 95 CO -0.54 0.71 -0.12 -0.07 -1.07 0.00 0.00 179.97 178.88 1n0g h LEU 96 N 0.02 0.00 0.00 3.04 3.38 0.40 -2.80 115.31 119.35 1n0g h LEU 96 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1n0g h LEU 96 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1n0g h LEU 96 CO 0.03 0.12 -0.56 -0.38 0.09 0.00 0.00 178.44 177.74 1n0g n ILE 97 N -4.20 1.29 0.24 1.22 5.41 -0.20 -4.40 119.36 118.72 1n0g n ILE 97 Ca -0.02 0.23 0.10 0.00 1.00 0.00 0.00 62.75 64.05 1n0g n ILE 97 Cb 0.20 -2.29 0.61 0.00 -0.71 0.00 0.00 39.64 37.45 1n0g n ILE 97 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1n0g h PHE 98 N -0.90 0.00 0.00 1.39 0.04 -1.19 -0.56 116.94 115.72 1n0g h PHE 98 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1n0g h PHE 98 Cb 0.56 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.71 1n0g h PHE 98 CO -0.24 0.18 0.00 0.00 -0.60 0.00 0.00 178.31 177.65 1n0g n ALA 99 N -2.33 2.53 0.06 2.45 0.00 -1.05 -3.06 120.51 119.12 1n0g n ALA 99 Ca -0.02 -0.17 0.01 0.00 0.00 0.00 0.00 53.44 53.27 1n0g n ALA 99 Cb 0.29 -1.48 0.01 0.00 0.00 0.00 0.00 19.45 18.27 1n0g n ALA 99 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1n0g n ASN 100 N -1.11 1.15 -4.81 0.00 3.02 -0.27 -5.01 115.26 108.22 1n0g n ASN 100 Ca 0.19 -1.08 -0.33 0.00 -0.03 0.00 0.00 54.58 53.32 1n0g n ASN 100 Cb 0.15 -0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.28 1n0g n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0g s ALA 101 N -0.15 2.95 0.00 5.41 0.00 -0.90 -3.93 121.76 125.14 1n0g s ALA 101 Ca 0.02 0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1n0g s ALA 101 Cb 0.01 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1n0g s ALA 101 CO 0.02 -0.19 0.00 0.09 0.00 0.00 0.00 175.76 175.68 1n0g n ASN 102 N -1.03 2.48 -1.36 0.00 4.13 -1.26 -4.79 115.26 113.43 1n0g n ASN 102 Ca 0.08 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.34 1n0g n ASN 102 Cb 0.53 0.28 0.00 0.00 -1.54 0.00 0.00 39.78 39.06 1n0g n ASN 102 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1n0g n PHE 103 N -1.17 -1.40 -4.15 3.10 3.72 -1.25 -4.95 117.46 111.36 1n0g n PHE 103 Ca 0.00 0.84 -0.15 0.00 -0.05 0.00 0.00 57.45 58.08 1n0g n PHE 103 Cb 0.21 -2.53 -0.14 0.00 -0.94 0.00 0.00 39.48 36.08 1n0g n PHE 103 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1n0g s VAL 104 N -0.17 0.42 0.04 -4.37 1.01 0.52 -4.95 120.40 112.90 1n0g s VAL 104 Ca 0.00 -0.31 -0.20 0.00 0.00 0.00 0.00 61.98 61.47 1n0g s VAL 104 Cb 0.00 -0.37 -0.06 0.00 0.00 0.00 0.00 36.38 35.95 1n0g s VAL 104 CO 0.00 0.06 0.58 -1.81 0.00 0.00 0.00 175.10 173.93 1n0g s ASP 105 N -0.28 7.02 -0.13 3.32 1.01 -1.26 -0.62 116.67 125.73 1n0g s ASP 105 Ca 0.01 1.21 -0.25 0.00 0.71 0.00 0.00 52.55 54.22 1n0g s ASP 105 Cb -0.03 -2.36 -0.02 0.00 1.01 0.00 0.00 42.92 41.52 1n0g s ASP 105 CO -0.00 0.20 0.81 -0.69 0.21 0.00 0.00 175.17 175.70 1n0g s VAL 106 N -0.69 4.92 1.05 -1.27 1.01 0.11 -4.57 120.40 120.97 1n0g s VAL 106 Ca 0.30 1.62 -0.16 0.00 0.00 0.00 0.00 61.98 63.73 1n0g s VAL 106 Cb -0.19 -4.13 0.22 0.00 0.00 0.00 0.00 36.38 32.29 1n0g s VAL 106 CO 0.18 0.10 1.18 1.51 0.00 0.00 0.00 175.10 178.07 1n0g s ASP 107 N 1.05 2.24 0.23 3.32 3.84 0.65 -4.78 116.67 123.23 1n0g s ASP 107 Ca 0.39 0.63 -0.07 0.00 -0.00 0.00 0.00 52.55 53.50 1n0g s ASP 107 Cb -0.17 -0.91 0.40 0.00 -1.38 0.00 0.00 42.92 40.86 1n0g s ASP 107 CO 0.15 -3.30 1.69 0.71 -0.00 0.00 0.00 175.17 174.42 1n0g h THR 108 N -2.02 0.54 0.00 2.11 1.35 -1.96 0.34 112.91 113.27 1n0g h THR 108 Ca -0.47 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 1n0g h THR 108 Cb 1.29 0.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 1n0g h THR 108 CO 0.43 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 175.75 1n0g n ALA 109 N -2.67 2.35 -1.44 6.62 0.00 -1.26 -4.83 120.51 119.29 1n0g n ALA 109 Ca 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 53.44 53.47 1n0g n ALA 109 Cb 0.42 -1.18 -0.01 0.00 0.00 0.00 0.00 19.45 18.68 1n0g n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n0g n GLY 110 N 0.41 0.45 3.95 0.00 0.00 0.12 -4.83 105.19 105.28 1n0g n GLY 110 Ca 0.08 -0.91 -0.24 0.00 0.00 0.00 0.00 46.02 44.96 1n0g n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n0g s ARG 111 N -2.93 3.48 -0.08 1.61 3.00 -1.25 -2.14 118.95 120.65 1n0g s ARG 111 Ca 0.00 -0.45 0.01 0.00 0.00 0.00 0.00 55.73 55.29 1n0g s ARG 111 Cb 0.00 -2.76 0.02 0.00 0.00 0.00 0.00 34.95 32.21 1n0g s ARG 111 CO 0.00 0.28 -0.08 0.08 0.00 0.00 0.00 175.30 175.58 1n0g s VAL 112 N -2.13 0.93 -0.28 3.52 1.01 0.15 -0.25 120.40 123.34 1n0g s VAL 112 Ca 0.38 -0.30 -0.27 0.00 0.00 0.00 0.00 61.98 61.79 1n0g s VAL 112 Cb -0.10 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.38 1n0g s VAL 112 CO 0.32 0.33 0.96 -0.22 0.00 0.00 0.00 175.10 176.49 1n0g s LEU 113 N 1.18 4.04 -0.19 3.92 2.96 -1.26 0.06 118.68 129.38 1n0g s LEU 113 Ca -0.06 1.05 -0.20 0.00 -0.22 0.00 0.00 54.13 54.70 1n0g s LEU 113 Cb -0.14 -3.38 -0.03 0.00 0.50 0.00 0.00 46.19 43.14 1n0g s LEU 113 CO -0.02 -0.71 0.58 -0.63 -1.32 0.00 0.00 176.35 174.26 1n0g s ILE 114 N 3.24 5.06 0.71 6.68 1.01 -0.55 -4.96 121.20 132.39 1n0g s ILE 114 Ca 0.40 1.09 -0.16 0.00 0.00 0.00 0.00 60.65 61.99 1n0g s ILE 114 Cb -0.14 -3.90 -0.01 0.00 0.01 0.00 0.00 42.46 38.42 1n0g s ILE 114 CO 0.11 0.15 0.87 -2.65 0.00 0.00 0.00 174.94 173.41 1n0g n PRO 115 N 4.86 0.49 0.35 2.79 -0.02 -1.26 -4.72 135.00 137.48 1n0g n PRO 115 Ca -0.03 0.22 -0.18 0.00 -2.02 0.00 0.00 63.50 61.49 1n0g n PRO 115 Cb 0.50 -2.13 -0.09 0.00 -0.02 0.00 0.00 33.50 31.77 1n0g n PRO 115 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1n0g h ASN 116 N -0.23 -1.00 -0.52 2.55 2.35 -1.98 0.26 115.58 117.03 1n0g h ASN 116 Ca -0.47 0.06 0.10 0.00 -0.55 0.00 0.00 56.30 55.44 1n0g h ASN 116 Cb 1.34 0.30 -0.09 0.00 0.05 0.00 0.00 38.32 39.91 1n0g h ASN 116 CO 0.46 -0.61 -0.08 -0.55 -1.65 0.00 0.00 177.43 175.01 1n0g h ASN 117 N -0.96 -0.38 -0.60 5.81 7.08 -1.99 0.58 115.58 125.12 1n0g h ASN 117 Ca -0.08 0.14 -0.03 0.00 -3.08 0.00 0.00 56.30 53.26 1n0g h ASN 117 Cb 0.78 0.28 -0.03 0.00 -2.08 0.00 0.00 38.32 37.28 1n0g h ASN 117 CO 0.07 -0.14 0.28 -0.07 -2.08 0.00 0.00 177.43 175.49 1n0g h LEU 118 N 0.04 0.82 0.36 6.14 4.07 -1.89 0.35 115.31 125.22 1n0g h LEU 118 Ca 0.26 -0.10 -0.01 0.00 0.08 0.00 0.00 57.88 58.10 1n0g h LEU 118 Cb 0.40 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 41.92 1n0g h LEU 118 CO -0.50 0.72 -0.20 0.40 -1.08 0.00 0.00 178.44 177.78 1n0g h ILE 119 N 0.90 0.58 -0.30 1.22 1.08 0.33 -0.90 117.51 120.42 1n0g h ILE 119 Ca 0.22 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.70 1n0g h ILE 119 Cb 0.14 0.58 -0.02 0.00 -3.07 0.00 0.00 36.82 34.45 1n0g h ILE 119 CO -0.02 0.00 0.18 0.78 -0.69 0.00 0.00 178.15 178.40 1n0g h ASN 120 N -0.53 0.30 -0.79 1.72 2.35 0.39 -1.48 115.58 117.54 1n0g h ASN 120 Ca -0.04 -0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.79 1n0g h ASN 120 Cb 0.42 -0.07 -0.07 0.00 0.05 0.00 0.00 38.32 38.66 1n0g h ASN 120 CO 0.06 0.22 0.44 0.44 -1.65 0.00 0.00 177.43 176.94 1n0g h ASP 121 N 0.37 0.63 -0.40 5.81 5.19 -0.14 -1.26 116.42 126.62 1n0g h ASP 121 Ca 0.11 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.57 1n0g h ASP 121 Cb -0.02 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.42 1n0g h ASP 121 CO -0.04 0.37 0.00 0.00 -3.12 0.00 0.00 179.24 176.44 1n0g n ALA 122 N -2.38 2.56 -3.83 3.45 0.00 -0.36 -4.80 120.51 115.15 1n0g n ALA 122 Ca 0.13 -0.78 -0.30 0.00 0.00 0.00 0.00 53.44 52.48 1n0g n ALA 122 Cb 0.26 -0.98 -0.01 0.00 0.00 0.00 0.00 19.45 18.72 1n0g n ALA 122 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1n0g n LYS 123 N 0.67 -3.57 -2.24 0.00 4.76 -0.48 -4.36 118.16 112.94 1n0g n LYS 123 Ca 0.14 0.43 -0.43 0.00 -2.87 0.00 0.00 58.31 55.59 1n0g n LYS 123 Cb 0.42 -5.18 -0.02 0.00 -1.84 0.00 0.00 35.03 28.40 1n0g n LYS 123 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1n0g s LEU 124 N -6.94 4.25 0.00 -0.35 1.02 -0.62 -4.81 118.68 111.23 1n0g s LEU 124 Ca 0.60 1.95 0.00 0.00 0.02 0.00 0.00 54.13 56.70 1n0g s LEU 124 Cb -0.32 -3.54 0.00 0.00 0.02 0.00 0.00 46.19 42.35 1n0g s LEU 124 CO 0.73 -0.82 0.00 -0.67 0.02 0.00 0.00 176.35 175.62 1n0g n ASP 125 N 6.67 0.00 -3.77 2.29 2.03 -1.26 -4.83 116.55 117.68 1n0g n ASP 125 Ca 0.15 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.33 1n0g n ASP 125 Cb 0.44 0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.70 1n0g n ASP 125 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1n0g s LYS 126 N 0.10 0.14 0.00 -0.67 2.20 -1.26 -4.66 119.74 115.58 1n0g s LYS 126 Ca 0.00 0.35 0.00 0.00 -0.36 0.00 0.00 55.97 55.96 1n0g s LYS 126 Cb 0.00 -0.09 0.00 0.00 -1.51 0.00 0.00 37.83 36.23 1n0g s LYS 126 CO 0.00 -0.12 0.00 0.39 -0.36 0.00 0.00 175.35 175.26 1n0g n GLU 127 N 3.85 0.00 -4.32 4.03 1.02 -1.26 -4.86 120.64 119.10 1n0g n GLU 127 Ca -0.22 0.22 -0.24 0.00 -0.02 0.00 0.00 57.16 56.89 1n0g n GLU 127 Cb 0.54 -0.33 -0.08 0.00 -0.02 0.00 0.00 31.44 31.54 1n0g n GLU 127 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1n0g s ILE 128 N 0.00 3.22 -0.10 -3.67 -1.09 0.56 -2.43 121.20 117.69 1n0g s ILE 128 Ca 0.00 -1.93 0.01 0.00 -2.23 0.00 0.00 60.65 56.50 1n0g s ILE 128 Cb 0.00 -2.69 0.02 0.00 -1.58 0.00 0.00 42.46 38.21 1n0g s ILE 128 CO 0.00 -0.31 -0.10 -0.69 -1.23 0.00 0.00 174.94 172.61 1n0g s VAL 129 N -2.19 1.13 -0.10 2.92 1.01 0.16 -1.54 120.40 121.79 1n0g s VAL 129 Ca 0.29 -0.41 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 1n0g s VAL 129 Cb -0.07 -1.09 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 1n0g s VAL 129 CO 0.18 0.37 -0.01 -0.76 0.00 0.00 0.00 175.10 174.89 1n0g s LEU 130 N 1.25 3.51 0.04 3.92 1.02 0.13 0.61 118.68 129.16 1n0g s LEU 130 Ca -0.03 0.08 0.05 0.00 0.02 0.00 0.00 54.13 54.24 1n0g s LEU 130 Cb -0.14 -1.81 -0.02 0.00 0.02 0.00 0.00 46.19 44.24 1n0g s LEU 130 CO -0.04 0.33 -0.13 0.27 0.02 0.00 0.00 176.35 176.80 1n0g s ILE 131 N -0.56 1.06 0.02 -0.59 -4.36 -0.92 -0.02 121.20 115.82 1n0g s ILE 131 Ca 0.09 -1.00 -0.21 0.00 -0.26 0.00 0.00 60.65 59.27 1n0g s ILE 131 Cb -0.12 -0.97 -0.06 0.00 1.25 0.00 0.00 42.46 42.56 1n0g s ILE 131 CO 0.02 -0.03 0.63 -0.83 0.24 0.00 0.00 174.94 174.97 1n0g s GLY 132 N -1.16 2.66 -0.27 6.27 0.00 -0.04 -2.17 107.32 112.61 1n0g s GLY 132 Ca 0.01 0.09 0.12 0.00 0.00 0.00 0.00 44.72 44.94 1n0g s GLY 132 CO 0.01 0.76 1.17 -1.06 0.00 0.00 0.00 173.10 173.98 1n0g n GLN 133 N 2.51 2.85 0.00 2.90 1.13 -0.42 -4.50 117.38 121.85 1n0g n GLN 133 Ca -0.07 -3.87 0.00 0.00 -1.94 0.00 0.00 57.00 51.13 1n0g n GLN 133 Cb 0.51 -1.98 0.00 0.00 0.11 0.00 0.00 30.24 28.87 1n0g n GLN 133 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1n0g n PHE 134 N -0.67 0.00 0.45 1.08 7.35 0.25 -3.22 117.46 122.71 1n0g n PHE 134 Ca 0.31 0.00 -0.18 0.00 -0.76 0.00 0.00 57.45 56.81 1n0g n PHE 134 Cb 0.91 0.00 -0.09 0.00 0.35 0.00 0.00 39.48 40.65 1n0g n PHE 134 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1n0g h ASP 135 N 0.00 -0.98 -3.57 -2.13 3.32 -1.93 -3.10 116.42 108.02 1n0g h ASP 135 Ca 0.00 0.03 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 1n0g h ASP 135 Cb 0.00 0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1n0g h ASP 135 CO 0.00 -0.65 -0.08 0.00 -1.72 0.00 0.00 179.24 176.79 1n0g n HIS 136 N -5.56 -0.24 -4.59 4.55 1.44 -1.20 -4.79 115.22 104.84 1n0g n HIS 136 Ca -0.15 -0.49 -0.21 0.00 -2.01 0.00 0.00 57.72 54.86 1n0g n HIS 136 Cb 0.46 -0.07 -0.15 0.00 0.12 0.00 0.00 29.99 30.35 1n0g n HIS 136 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1n0g s LEU 137 N 0.00 2.03 -0.04 2.39 2.96 -0.24 -1.30 118.68 124.47 1n0g s LEU 137 Ca 0.02 -0.24 0.03 0.00 -0.22 0.00 0.00 54.13 53.72 1n0g s LEU 137 Cb -0.00 -0.67 -0.03 0.00 0.50 0.00 0.00 46.19 45.99 1n0g s LEU 137 CO 0.01 0.16 -0.12 -1.61 -1.32 0.00 0.00 176.35 173.47 1n0g s GLU 138 N -0.31 2.54 -0.24 1.98 2.02 -0.92 0.40 118.70 124.16 1n0g s GLU 138 Ca 0.05 -0.68 -0.06 0.00 0.02 0.00 0.00 54.97 54.30 1n0g s GLU 138 Cb -0.05 -2.43 -0.01 0.00 0.10 0.00 0.00 34.13 31.74 1n0g s GLU 138 CO -0.00 0.63 0.02 0.42 0.02 0.00 0.00 175.26 176.34 1n0g s ILE 139 N -0.79 3.82 0.16 -1.63 1.01 -0.58 -2.17 121.20 121.02 1n0g s ILE 139 Ca 0.12 -0.41 0.11 0.00 0.00 0.00 0.00 60.65 60.48 1n0g s ILE 139 Cb -0.11 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 39.52 1n0g s ILE 139 CO 0.02 0.33 -0.25 0.26 0.00 0.00 0.00 174.94 175.30 1n0g s TRP 140 N 1.53 2.32 -0.10 3.97 0.52 0.20 -4.24 118.94 123.14 1n0g s TRP 140 Ca 0.05 -0.36 -0.30 0.00 0.02 0.00 0.00 56.10 55.51 1n0g s TRP 140 Cb -0.15 -1.21 -0.01 0.00 -1.15 0.00 0.00 33.47 30.95 1n0g s TRP 140 CO 0.00 0.41 1.05 0.34 0.02 0.00 0.00 176.95 178.78 1n0g s ASP 141 N -2.34 7.20 0.30 2.95 2.15 -1.26 0.41 116.67 126.08 1n0g s ASP 141 Ca 0.17 1.58 0.00 0.00 0.43 0.00 0.00 52.55 54.73 1n0g s ASP 141 Cb -0.09 -2.56 0.71 0.00 -0.30 0.00 0.00 42.92 40.68 1n0g s ASP 141 CO 0.08 -0.49 1.57 0.50 -0.17 0.00 0.00 175.17 176.66 1n0g h LYS 142 N 7.19 0.00 0.55 4.34 3.64 -1.76 -0.69 116.57 129.84 1n0g h LYS 142 Ca -0.31 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.04 1n0g h LYS 142 Cb 1.15 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.97 1n0g h LYS 142 CO 0.87 0.00 -0.27 -0.22 -2.27 0.00 0.00 179.45 177.56 1n0g h LYS 143 N 0.00 -0.72 -1.24 1.90 1.63 -1.91 -1.78 116.57 114.46 1n0g h LYS 143 Ca 0.58 0.05 0.37 0.00 -0.85 0.00 0.00 60.65 60.80 1n0g h LYS 143 Cb 1.15 0.16 -0.10 0.00 -0.60 0.00 0.00 32.23 32.84 1n0g h LYS 143 CO -0.95 -0.48 0.83 -0.07 -3.45 0.00 0.00 179.45 175.33 1n0g h LEU 144 N -0.88 0.25 -0.06 5.20 3.38 -1.77 0.27 115.31 121.71 1n0g h LEU 144 Ca -0.08 0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 1n0g h LEU 144 Cb 0.57 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1n0g h LEU 144 CO 0.13 -0.04 -0.27 0.22 0.09 0.00 0.00 178.44 178.56 1n0g h TYR 145 N 0.17 0.38 -0.99 1.13 3.20 -1.09 -1.75 116.97 118.04 1n0g h TYR 145 Ca 0.70 -0.17 0.05 0.00 3.14 0.00 0.00 58.73 62.45 1n0g h TYR 145 Cb 2.22 -0.06 -0.06 0.00 1.54 0.00 0.00 36.73 40.37 1n0g h TYR 145 CO -0.00 0.90 0.64 0.93 -1.64 0.00 0.00 178.16 178.99 1n0g h GLU 146 N -0.24 1.18 0.44 1.82 5.08 0.35 -0.73 114.58 122.49 1n0g h GLU 146 Ca -0.02 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1n0g h GLU 146 Cb 0.93 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1n0g h GLU 146 CO 0.06 0.78 -0.21 -0.44 -1.00 0.00 0.00 179.01 178.19 1n0g h ASP 147 N 1.22 -0.51 -0.81 1.42 3.32 -0.97 -0.71 116.42 119.38 1n0g h ASP 147 Ca 0.41 -0.06 0.17 0.00 0.02 0.00 0.00 57.03 57.57 1n0g h ASP 147 Cb 0.06 0.13 -0.15 0.00 0.22 0.00 0.00 39.33 39.59 1n0g h ASP 147 CO -0.14 -0.24 -0.12 0.22 -1.72 0.00 0.00 179.24 177.23 1n0g h TYR 148 N -0.76 -0.29 -0.38 4.55 3.20 -0.82 1.15 116.97 123.62 1n0g h TYR 148 Ca -0.06 0.07 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1n0g h TYR 148 Cb 0.54 0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.04 1n0g h TYR 148 CO -0.01 -0.33 0.09 -0.07 -1.64 0.00 0.00 178.16 176.21 1n0g h LEU 149 N 0.03 0.51 0.20 2.82 4.07 -0.93 -2.98 115.31 119.03 1n0g h LEU 149 Ca 0.41 -0.07 0.01 0.00 0.08 0.00 0.00 57.88 58.31 1n0g h LEU 149 Cb 0.69 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 42.28 1n0g h LEU 149 CO -0.79 0.52 -0.22 0.00 -1.08 0.00 0.00 178.44 176.86 1n0g h ALA 150 N 1.56 -0.44 -3.00 1.53 0.00 0.29 -3.41 119.26 115.80 1n0g h ALA 150 Ca 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1n0g h ALA 150 Cb 0.21 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1n0g h ALA 150 CO -0.00 -0.78 0.00 0.09 0.00 0.00 0.00 179.25 178.56 1n0g n ASN 151 N -5.35 0.00 -2.07 0.00 3.02 -0.79 -4.95 115.26 105.12 1n0g n ASN 151 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 1n0g n ASN 151 Cb 0.26 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 1n0g n ASN 151 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1n0g n SER 152 N 0.00 -9.34 -3.58 6.41 7.64 -1.25 -4.95 113.62 108.55 1n0g n SER 152 Ca 0.00 1.42 -0.30 0.00 1.01 0.00 0.00 58.87 60.99 1n0g n SER 152 Cb 0.00 -5.23 0.25 0.00 -1.01 0.00 0.00 64.21 58.22 1n0g n SER 152 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1n0g n GLU 153 N 1.62 -3.10 -1.12 1.43 4.71 -1.26 -4.98 120.64 117.94 1n0g n GLU 153 Ca 0.00 -1.79 -0.33 0.00 -0.01 0.00 0.00 57.16 55.03 1n0g n GLU 153 Cb 0.00 -1.65 0.13 0.00 -1.01 0.00 0.00 31.44 28.91 1n0g n GLU 153 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1n0g s SER 154 N -4.56 3.62 0.18 1.62 1.04 -1.26 -4.79 113.70 109.55 1n0g s SER 154 Ca 0.72 2.34 -0.13 0.00 0.48 0.00 0.00 55.95 59.36 1n0g s SER 154 Cb -0.07 -2.58 0.14 0.00 0.10 0.00 0.00 66.02 63.61 1n0g s SER 154 CO 0.55 -2.65 1.79 0.25 0.98 0.00 0.00 173.24 174.17 1n0g h LEU 155 N -0.93 0.41 -1.01 2.42 5.85 -1.99 -1.49 115.31 118.57 1n0g h LEU 155 Ca -0.46 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1n0g h LEU 155 Cb 1.29 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.22 1n0g h LEU 155 CO 0.46 0.28 0.62 -0.33 -0.34 0.00 0.00 178.44 179.13 1n0g h GLU 156 N 0.54 1.29 0.41 1.25 3.07 -1.99 -0.39 114.58 118.76 1n0g h GLU 156 Ca 0.23 -0.09 -0.02 0.00 -0.50 0.00 0.00 59.36 58.98 1n0g h GLU 156 Cb 0.12 -0.28 0.00 0.00 -0.84 0.00 0.00 28.75 27.75 1n0g h GLU 156 CO -0.15 0.87 -0.20 1.15 -1.40 0.00 0.00 179.01 179.28 1n0g h THR 157 N 1.33 0.58 -0.98 1.13 2.02 -1.72 -1.91 112.91 113.36 1n0g h THR 157 Ca 0.35 -0.28 0.06 0.00 0.77 0.00 0.00 66.41 67.32 1n0g h THR 157 Cb -0.12 0.72 -0.06 0.00 -1.74 0.00 0.00 68.15 66.94 1n0g h THR 157 CO -0.07 0.05 0.63 0.58 0.37 0.00 0.00 175.52 177.08 1n0g h VAL 158 N -0.72 1.10 -0.50 3.16 2.07 -1.17 -2.65 116.25 117.55 1n0g h VAL 158 Ca -0.06 -0.40 -0.12 0.00 0.82 0.00 0.00 66.70 66.94 1n0g h VAL 158 Cb 0.51 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1n0g h VAL 158 CO 0.09 0.21 -0.15 0.00 0.02 0.00 0.00 177.57 177.75 1n0g h ALA 159 N 1.44 0.69 -0.90 1.67 0.00 -0.99 -3.10 119.26 118.06 1n0g h ALA 159 Ca 0.42 -0.36 0.21 0.00 0.00 0.00 0.00 54.91 55.17 1n0g h ALA 159 Cb 0.13 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1n0g h ALA 159 CO -0.16 0.62 0.60 1.49 0.00 0.00 0.00 179.25 181.80 1n0g h GLU 160 N 0.83 0.37 0.00 0.00 4.57 -0.96 -0.43 114.58 118.95 1n0g h GLU 160 Ca 0.12 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1n0g h GLU 160 Cb 0.72 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 1n0g h GLU 160 CO 0.05 0.24 0.00 0.54 -1.18 0.00 0.00 179.01 178.67 1n0g n ARG 161 N -4.50 0.02 0.00 1.92 1.74 -1.17 -5.13 116.66 109.54 1n0g n ARG 161 Ca 0.19 0.03 0.07 0.00 -0.77 0.00 0.00 57.85 57.37 1n0g n ARG 161 Cb 0.72 -1.53 0.40 0.00 -1.02 0.00 0.00 32.46 31.03 1n0g n ARG 161 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78