#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 7paz s ASN 2 N 0.00 4.04 -0.09 4.31 2.47 -1.26 -1.42 114.94 122.99 7paz s ASN 2 Ca 0.00 -0.36 0.01 0.00 0.42 0.00 0.00 52.86 52.92 7paz s ASN 2 Cb 0.00 -0.74 0.02 0.00 -1.45 0.00 0.00 41.25 39.09 7paz s ASN 2 CO 0.00 0.25 -0.09 -0.63 -3.72 0.00 0.00 177.10 172.92 7paz s ILE 3 N -0.97 1.01 -0.13 -5.21 1.09 -0.37 -4.97 121.20 111.65 7paz s ILE 3 Ca 0.16 -0.33 -0.16 0.00 -1.10 0.00 0.00 60.65 59.22 7paz s ILE 3 Cb -0.11 -1.00 -0.05 0.00 -1.06 0.00 0.00 42.46 40.25 7paz s ILE 3 CO 0.07 0.35 0.37 -0.70 -0.10 0.00 0.00 174.94 174.93 7paz s GLU 4 N 1.32 4.26 -0.11 2.79 2.12 -1.26 -0.21 118.70 127.61 7paz s GLU 4 Ca -0.03 0.25 0.03 0.00 0.36 0.00 0.00 54.97 55.59 7paz s GLU 4 Cb -0.14 -3.41 0.01 0.00 0.26 0.00 0.00 34.13 30.84 7paz s GLU 4 CO -0.04 0.24 -0.21 0.08 -0.54 0.00 0.00 175.26 174.79 7paz s VAL 5 N 0.42 1.88 -0.10 3.70 1.01 0.44 -4.56 120.40 123.18 7paz s VAL 5 Ca 0.21 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 7paz s VAL 5 Cb -0.14 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 7paz s VAL 5 CO 0.07 0.52 0.13 -1.00 0.00 0.00 0.00 175.10 174.81 7paz s HIS 6 N 0.56 3.54 -0.25 5.22 3.76 -0.29 0.19 115.29 128.01 7paz s HIS 6 Ca -0.14 0.47 -0.10 0.00 -0.15 0.00 0.00 55.06 55.14 7paz s HIS 6 Cb -0.17 -1.91 -0.04 0.00 1.11 0.00 0.00 32.58 31.57 7paz s HIS 6 CO 0.05 0.70 0.14 -1.64 -0.85 0.00 0.00 174.74 173.14 7paz s MET 7 N -1.10 3.94 0.07 1.40 -1.94 -0.07 -1.69 119.30 119.90 7paz s MET 7 Ca 0.16 -0.34 0.02 0.00 -1.71 0.00 0.00 55.69 53.83 7paz s MET 7 Cb -0.12 -3.51 -0.03 0.00 2.01 0.00 0.00 34.83 33.18 7paz s MET 7 CO 0.05 -0.05 -0.08 -0.51 -0.01 0.00 0.00 175.02 174.42 7paz s LEU 8 N 1.35 2.34 0.25 -0.03 1.43 -0.28 -2.48 118.68 121.26 7paz s LEU 8 Ca 0.07 -0.71 0.02 0.00 -1.03 0.00 0.00 54.13 52.48 7paz s LEU 8 Cb -0.15 -0.18 0.32 0.00 0.03 0.00 0.00 46.19 46.21 7paz s LEU 8 CO 0.06 -0.27 1.64 0.78 0.23 0.00 0.00 176.35 178.79 7paz h ASN 9 N 3.97 0.44 -3.39 2.29 2.35 -1.91 0.07 115.58 119.40 7paz h ASN 9 Ca -0.36 -0.19 -0.26 0.00 -0.55 0.00 0.00 56.30 54.93 7paz h ASN 9 Cb 1.19 -0.12 -0.33 0.00 0.05 0.00 0.00 38.32 39.11 7paz h ASN 9 CO 0.48 0.81 -0.63 -0.75 -1.65 0.00 0.00 177.43 175.69 7paz s LYS 10 N -4.19 0.06 0.20 0.81 2.36 -1.26 -0.16 119.74 117.56 7paz s LYS 10 Ca -0.06 0.38 0.00 0.00 -2.55 0.00 0.00 55.97 53.74 7paz s LYS 10 Cb 0.13 -0.21 -0.00 0.00 -1.05 0.00 0.00 37.83 36.69 7paz s LYS 10 CO 0.80 -0.19 0.25 0.41 1.55 0.00 0.00 175.35 178.17 7paz n GLY 11 N 4.41 2.78 0.41 5.54 0.00 0.20 -4.97 105.19 113.55 7paz n GLY 11 Ca -0.23 -1.59 0.20 0.00 0.00 0.00 0.00 46.02 44.41 7paz n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 7paz h ALA 12 N 1.73 2.26 -0.31 4.61 0.00 -2.01 0.23 119.26 125.77 7paz h ALA 12 Ca -0.15 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.78 7paz h ALA 12 Cb 0.68 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.46 7paz h ALA 12 CO 0.21 -0.56 0.00 0.39 0.00 0.00 0.00 179.25 179.29 7paz n GLU 13 N -4.51 2.08 0.00 0.00 -0.58 -1.26 -5.05 120.64 111.31 7paz n GLU 13 Ca 0.20 -1.63 0.00 0.00 -0.42 0.00 0.00 57.16 55.31 7paz n GLU 13 Cb 0.75 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 30.19 7paz n GLU 13 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 7paz n GLY 14 N 1.29 0.23 3.89 0.62 0.00 0.79 -5.04 105.19 106.96 7paz n GLY 14 Ca 0.17 -1.79 -0.34 0.00 0.00 0.00 0.00 46.02 44.06 7paz n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 7paz s ALA 15 N -1.73 3.85 -0.33 4.61 0.00 -1.26 0.61 121.76 127.51 7paz s ALA 15 Ca 0.00 -0.59 -0.12 0.00 0.00 0.00 0.00 51.96 51.25 7paz s ALA 15 Cb 0.00 -2.06 0.02 0.00 0.00 0.00 0.00 23.12 21.08 7paz s ALA 15 CO 0.00 0.66 0.33 -1.33 0.00 0.00 0.00 175.76 175.42 7paz n MET 16 N 0.99 -2.41 -4.15 0.00 2.81 0.78 -4.87 117.12 110.28 7paz n MET 16 Ca -0.10 2.06 -0.10 0.00 -1.81 0.00 0.00 57.70 57.75 7paz n MET 16 Cb 0.53 -4.38 -0.10 0.00 -0.71 0.00 0.00 33.22 28.55 7paz n MET 16 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 7paz s VAL 17 N -1.89 0.61 -0.20 2.03 -7.23 0.01 -3.97 120.40 109.76 7paz s VAL 17 Ca 0.15 -1.83 -0.09 0.00 -1.81 0.00 0.00 61.98 58.41 7paz s VAL 17 Cb -0.03 -1.55 -0.05 0.00 0.56 0.00 0.00 36.38 35.32 7paz s VAL 17 CO 0.69 -0.84 0.11 -0.36 -0.31 0.00 0.00 175.10 174.39 7paz s PHE 18 N -3.43 3.33 -0.17 2.82 0.08 -1.26 -1.13 117.98 118.22 7paz s PHE 18 Ca 0.09 0.20 -0.00 0.00 0.12 0.00 0.00 56.93 57.34 7paz s PHE 18 Cb 0.04 -2.16 0.04 0.00 -0.57 0.00 0.00 43.02 40.37 7paz s PHE 18 CO -0.05 0.18 -0.07 -1.21 -0.10 0.00 0.00 175.22 173.97 7paz s GLU 19 N 0.53 1.65 0.66 0.44 2.02 -0.68 -3.12 118.70 120.20 7paz s GLU 19 Ca 0.06 -0.58 -0.11 0.00 0.02 0.00 0.00 54.97 54.36 7paz s GLU 19 Cb -0.12 -2.09 -0.01 0.00 0.10 0.00 0.00 34.13 32.01 7paz s GLU 19 CO 0.00 -0.41 1.06 -1.25 0.02 0.00 0.00 175.26 174.68 7paz s PRO 20 N 1.57 3.22 0.00 0.39 0.04 -1.26 -1.14 135.00 137.81 7paz s PRO 20 Ca 0.01 0.68 0.16 0.00 0.04 0.00 0.00 61.00 61.88 7paz s PRO 20 Cb -0.15 -2.04 0.12 0.00 0.04 0.00 0.00 34.50 32.47 7paz s PRO 20 CO -0.08 -0.83 0.99 0.00 0.04 0.00 0.00 177.00 177.12 7paz n ALA 21 N -2.91 2.47 -4.03 8.56 0.00 -1.18 -4.78 120.51 118.64 7paz n ALA 21 Ca 0.06 -0.62 -0.31 0.00 0.00 0.00 0.00 53.44 52.57 7paz n ALA 21 Cb 0.55 -0.53 -0.16 0.00 0.00 0.00 0.00 19.45 19.31 7paz n ALA 21 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 7paz s TYR 22 N -1.30 2.56 -0.17 0.00 5.04 -1.26 -0.24 117.35 121.99 7paz s TYR 22 Ca 0.18 -1.65 0.01 0.00 -2.44 0.00 0.00 57.07 53.17 7paz s TYR 22 Cb 0.13 -1.72 0.02 0.00 0.35 0.00 0.00 41.96 40.74 7paz s TYR 22 CO 0.20 -0.76 -0.18 0.42 -1.34 0.00 0.00 175.55 173.88 7paz s ILE 23 N 1.35 1.88 -0.25 3.14 1.01 -0.50 -5.00 121.20 122.83 7paz s ILE 23 Ca -0.00 -0.83 -0.10 0.00 0.00 0.00 0.00 60.65 59.72 7paz s ILE 23 Cb -0.16 -1.71 -0.05 0.00 0.01 0.00 0.00 42.46 40.55 7paz s ILE 23 CO -0.09 0.51 0.15 -0.75 0.00 0.00 0.00 174.94 174.76 7paz s LYS 24 N 1.33 3.98 0.21 2.79 2.20 -1.26 0.12 119.74 129.10 7paz s LYS 24 Ca 0.04 -0.32 -0.02 0.00 -0.36 0.00 0.00 55.97 55.31 7paz s LYS 24 Cb -0.13 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.64 7paz s LYS 24 CO -0.11 -0.01 0.18 0.00 -0.36 0.00 0.00 175.35 175.04 7paz s ALA 25 N 1.23 1.00 0.24 3.13 0.00 -0.31 -4.93 121.76 122.12 7paz s ALA 25 Ca 0.07 -1.60 0.12 0.00 0.00 0.00 0.00 51.96 50.54 7paz s ALA 25 Cb -0.14 1.35 -0.05 0.00 0.00 0.00 0.00 23.12 24.28 7paz s ALA 25 CO 0.06 -0.63 -0.20 -0.80 0.00 0.00 0.00 175.76 174.19 7paz s ASN 26 N -3.14 3.59 0.24 0.00 0.02 -1.26 -2.39 114.94 112.00 7paz s ASN 26 Ca 0.37 -0.93 -0.31 0.00 -1.02 0.00 0.00 52.86 50.97 7paz s ASN 26 Cb 0.06 -0.32 -0.13 0.00 0.02 0.00 0.00 41.25 40.87 7paz s ASN 26 CO 0.12 0.07 1.38 -2.65 0.02 0.00 0.00 177.10 176.05 7paz n PRO 27 N -0.24 1.99 0.00 -0.60 -0.02 -1.26 -1.01 135.00 133.86 7paz n PRO 27 Ca -0.08 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 7paz n PRO 27 Cb 0.58 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 7paz n PRO 27 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 7paz n GLY 28 N 2.05 3.13 3.65 -1.23 0.00 0.53 -4.99 105.19 108.34 7paz n GLY 28 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 7paz n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 7paz s ASP 29 N -0.17 2.77 0.11 1.61 1.01 -0.18 -4.74 116.67 117.08 7paz s ASP 29 Ca 0.00 1.79 0.10 0.00 0.71 0.00 0.00 52.55 55.15 7paz s ASP 29 Cb 0.00 -2.39 -0.04 0.00 1.01 0.00 0.00 42.92 41.51 7paz s ASP 29 CO 0.00 -3.13 -0.27 0.42 0.21 0.00 0.00 175.17 172.41 7paz s THR 30 N -2.71 2.20 -0.14 -1.27 -4.23 -0.51 -2.18 115.64 106.80 7paz s THR 30 Ca 0.66 -1.65 0.02 0.00 -1.18 0.00 0.00 61.69 59.54 7paz s THR 30 Cb -0.21 -1.93 0.00 0.00 1.34 0.00 0.00 72.50 71.70 7paz s THR 30 CO 0.59 0.16 -0.19 -0.69 -0.54 0.00 0.00 174.62 173.95 7paz s VAL 31 N -0.99 2.35 -0.20 2.29 1.01 0.74 -1.24 120.40 124.36 7paz s VAL 31 Ca 0.13 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 7paz s VAL 31 Cb -0.10 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.31 7paz s VAL 31 CO 0.05 0.54 -0.05 -0.89 0.00 0.00 0.00 175.10 174.75 7paz s THR 32 N 0.72 3.45 -0.29 3.92 2.01 0.70 -1.19 115.64 124.96 7paz s THR 32 Ca -0.08 -0.48 -0.14 0.00 0.31 0.00 0.00 61.69 61.30 7paz s THR 32 Cb -0.16 -2.55 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 7paz s THR 32 CO 0.01 0.44 0.34 -0.36 -0.69 0.00 0.00 174.62 174.36 7paz s PHE 33 N 1.21 3.23 -0.24 4.92 0.40 -0.42 -0.42 117.98 126.67 7paz s PHE 33 Ca 0.03 0.27 -0.00 0.00 -0.60 0.00 0.00 56.93 56.63 7paz s PHE 33 Cb -0.14 -2.56 0.03 0.00 0.51 0.00 0.00 43.02 40.85 7paz s PHE 33 CO -0.01 -0.26 -0.10 0.42 0.70 0.00 0.00 175.22 175.97 7paz s ILE 34 N 2.01 2.56 -0.99 0.64 1.01 0.13 -2.00 121.20 124.56 7paz s ILE 34 Ca 0.13 -1.15 -0.23 0.00 0.00 0.00 0.00 60.65 59.40 7paz s ILE 34 Cb -0.16 -2.31 0.05 0.00 0.01 0.00 0.00 42.46 40.06 7paz s ILE 34 CO 0.11 0.21 1.42 -2.16 0.00 0.00 0.00 174.94 174.51 7paz s PRO 35 N 1.27 3.55 0.41 2.79 0.04 -1.26 -0.89 135.00 140.91 7paz s PRO 35 Ca -0.01 -1.08 0.09 0.00 0.04 0.00 0.00 61.00 60.04 7paz s PRO 35 Cb -0.17 -5.23 0.87 0.00 0.04 0.00 0.00 34.50 30.01 7paz s PRO 35 CO -0.06 -2.18 2.00 -0.39 0.04 0.00 0.00 177.00 176.41 7paz h VAL 36 N 6.68 1.12 -3.35 -0.36 -1.51 -1.85 -3.40 116.25 113.59 7paz h VAL 36 Ca 0.16 -0.45 -0.67 0.00 -1.23 0.00 0.00 66.70 64.51 7paz h VAL 36 Cb 1.01 0.90 -0.14 0.00 -2.13 0.00 0.00 31.29 30.94 7paz h VAL 36 CO 1.40 0.16 -0.64 -1.81 -1.23 0.00 0.00 177.57 175.45 7paz s ASP 37 N -6.83 5.15 0.65 4.19 1.01 -1.18 -5.08 116.67 114.58 7paz s ASP 37 Ca -0.07 0.00 -0.11 0.00 0.71 0.00 0.00 52.55 53.09 7paz s ASP 37 Cb 0.16 -1.35 -0.01 0.00 1.01 0.00 0.00 42.92 42.73 7paz s ASP 37 CO 0.73 0.28 1.04 -0.54 0.21 0.00 0.00 175.17 176.89 7paz s LYS 38 N -1.56 3.22 0.00 8.23 3.01 -1.26 -4.49 119.74 126.89 7paz s LYS 38 Ca 0.20 0.54 0.00 0.00 -1.01 0.00 0.00 55.97 55.70 7paz s LYS 38 Cb -0.12 -2.08 0.00 0.00 -1.01 0.00 0.00 37.83 34.63 7paz s LYS 38 CO 0.10 -0.77 0.00 0.41 0.51 0.00 0.00 175.35 175.60 7paz n GLY 39 N -2.83 1.08 3.07 -3.33 0.00 -1.26 -4.98 105.19 96.94 7paz n GLY 39 Ca 0.06 -0.39 -0.08 0.00 0.00 0.00 0.00 46.02 45.61 7paz n GLY 39 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 7paz s HIS 40 N -2.26 0.38 0.15 1.61 3.76 -1.26 -4.87 115.29 112.80 7paz s HIS 40 Ca 0.00 -0.81 -0.02 0.00 -0.15 0.00 0.00 55.06 54.08 7paz s HIS 40 Cb 0.00 -0.28 0.01 0.00 1.11 0.00 0.00 32.58 33.42 7paz s HIS 40 CO 0.00 -0.34 0.23 0.27 -0.85 0.00 0.00 174.74 174.05 7paz n ASN 41 N 0.58 -0.64 -3.86 1.40 6.94 -1.26 -0.24 115.26 118.17 7paz n ASN 41 Ca -0.17 -1.77 -0.13 0.00 -0.02 0.00 0.00 54.58 52.48 7paz n ASN 41 Cb 0.59 1.17 -0.15 0.00 -2.36 0.00 0.00 39.78 39.03 7paz n ASN 41 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 7paz s VAL 42 N -2.60 0.06 -0.13 3.53 0.11 -1.26 -4.10 120.40 116.01 7paz s VAL 42 Ca 0.11 0.01 -0.17 0.00 -2.93 0.00 0.00 61.98 59.01 7paz s VAL 42 Cb -0.01 -0.09 0.04 0.00 -1.53 0.00 0.00 36.38 34.80 7paz s VAL 42 CO 0.08 0.04 0.44 -0.70 -3.33 0.00 0.00 175.10 171.63 7paz s GLU 43 N 0.23 0.59 0.34 1.54 2.12 0.81 -1.17 118.70 123.15 7paz s GLU 43 Ca -0.02 0.45 -0.26 0.00 0.36 0.00 0.00 54.97 55.50 7paz s GLU 43 Cb -0.03 0.28 -0.09 0.00 0.26 0.00 0.00 34.13 34.54 7paz s GLU 43 CO -0.01 -0.10 1.00 -1.54 -0.54 0.00 0.00 175.26 174.07 7paz s SER 44 N -0.15 7.14 0.06 -1.70 1.04 -0.67 -1.42 113.70 118.01 7paz s SER 44 Ca -0.03 1.98 -0.20 0.00 0.48 0.00 0.00 55.95 58.18 7paz s SER 44 Cb -0.03 -2.59 -0.06 0.00 0.10 0.00 0.00 66.02 63.43 7paz s SER 44 CO 0.02 -0.22 0.59 -0.63 0.98 0.00 0.00 173.24 173.98 7paz s ILE 45 N -1.54 4.75 0.29 -1.02 1.01 -1.07 -4.81 121.20 118.80 7paz s ILE 45 Ca 0.51 1.25 -0.30 0.00 0.00 0.00 0.00 60.65 62.12 7paz s ILE 45 Cb -0.22 -3.92 -0.11 0.00 0.01 0.00 0.00 42.46 38.22 7paz s ILE 45 CO 0.28 0.53 1.47 -1.59 0.00 0.00 0.00 174.94 175.62 7paz s LYS 46 N -0.93 4.22 -0.13 2.79 0.00 -1.26 -2.06 119.74 122.38 7paz s LYS 46 Ca 0.30 2.39 0.00 0.00 0.00 0.00 0.00 55.97 58.66 7paz s LYS 46 Cb -0.19 -3.07 0.00 0.00 0.00 0.00 0.00 37.83 34.57 7paz s LYS 46 CO 0.19 -0.45 0.00 -3.47 0.00 0.00 0.00 175.35 171.62 7paz n ASP 47 N 1.85 -4.64 -1.11 0.03 2.03 -1.26 -4.85 116.55 108.60 7paz n ASP 47 Ca 0.05 0.03 0.01 0.00 0.52 0.00 0.00 54.79 55.40 7paz n ASP 47 Cb 0.40 -2.25 0.13 0.00 -0.72 0.00 0.00 41.12 38.68 7paz n ASP 47 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 7paz n MET 48 N -0.98 1.54 -4.25 -0.67 2.81 -0.87 -4.94 117.12 109.76 7paz n MET 48 Ca -0.01 -3.16 -0.17 0.00 -1.81 0.00 0.00 57.70 52.55 7paz n MET 48 Cb 0.29 -1.36 -0.11 0.00 -0.71 0.00 0.00 33.22 31.33 7paz n MET 48 CO 0.00 0.00 0.00 0.96 1.51 0.00 0.00 175.97 178.44 7paz s ILE 49 N -2.76 1.32 1.20 2.02 -4.36 -1.26 -0.31 121.20 117.06 7paz s ILE 49 Ca 0.38 -1.86 -0.19 0.00 -0.26 0.00 0.00 60.65 58.72 7paz s ILE 49 Cb 0.38 -1.67 0.29 0.00 1.25 0.00 0.00 42.46 42.71 7paz s ILE 49 CO -0.07 -0.53 1.12 -2.16 0.24 0.00 0.00 174.94 173.53 7paz s PRO 50 N -3.07 -1.21 0.00 0.37 0.04 -1.23 -4.93 135.00 124.97 7paz s PRO 50 Ca 0.12 -0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.06 7paz s PRO 50 Cb -0.02 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 32.92 7paz s PRO 50 CO 0.03 -3.70 0.00 -0.85 0.04 0.00 0.00 177.00 172.52 7paz n GLU 51 N -4.74 0.00 -0.30 4.56 0.00 -1.26 -2.34 120.64 116.56 7paz n GLU 51 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.37 7paz n GLU 51 Cb 0.60 0.00 0.18 0.00 0.00 0.00 0.00 31.44 32.22 7paz n GLU 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 7paz n GLY 52 N -0.32 4.71 3.79 -1.84 0.00 -1.26 -5.05 105.19 105.22 7paz n GLY 52 Ca 0.00 -1.15 -0.34 0.00 0.00 0.00 0.00 46.02 44.54 7paz n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 7paz s ALA 53 N -2.95 2.69 0.24 4.61 0.00 -0.99 -5.00 121.76 120.36 7paz s ALA 53 Ca 0.36 0.58 -0.09 0.00 0.00 0.00 0.00 51.96 52.81 7paz s ALA 53 Cb 0.32 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 20.08 7paz s ALA 53 CO 0.03 -0.82 0.56 -2.00 0.00 0.00 0.00 175.76 173.52 7paz s GLU 54 N -3.72 3.79 0.68 0.00 2.56 -1.26 -4.91 118.70 115.84 7paz s GLU 54 Ca 0.67 0.26 -0.11 0.00 0.00 0.00 0.00 54.97 55.79 7paz s GLU 54 Cb -0.19 -2.64 -0.00 0.00 2.00 0.00 0.00 34.13 33.30 7paz s GLU 54 CO 0.32 0.30 1.06 -1.59 -0.56 0.00 0.00 175.26 174.79 7paz s LYS 55 N -2.92 3.03 0.09 4.30 -2.85 -1.26 -5.05 119.74 115.08 7paz s LYS 55 Ca 0.47 0.96 -0.11 0.00 -1.00 0.00 0.00 55.97 56.29 7paz s LYS 55 Cb -0.11 -2.00 0.01 0.00 -2.06 0.00 0.00 37.83 33.67 7paz s LYS 55 CO 0.22 -1.03 0.26 -0.59 0.10 0.00 0.00 175.35 174.32 7paz s PHE 56 N -3.00 0.02 -0.20 1.78 -0.71 -1.26 -5.00 117.98 109.61 7paz s PHE 56 Ca 0.58 -0.39 -0.08 0.00 -1.04 0.00 0.00 56.93 56.00 7paz s PHE 56 Cb -0.14 0.05 0.08 0.00 -1.21 0.00 0.00 43.02 41.80 7paz s PHE 56 CO 0.53 -0.59 0.44 0.21 -1.34 0.00 0.00 175.22 174.48 7paz s LYS 57 N -3.71 0.39 0.61 1.99 2.20 -1.26 -1.67 119.74 118.28 7paz s LYS 57 Ca 0.03 0.98 0.02 0.00 -0.36 0.00 0.00 55.97 56.64 7paz s LYS 57 Cb 0.03 0.21 0.07 0.00 -1.51 0.00 0.00 37.83 36.64 7paz s LYS 57 CO -0.11 -0.21 0.85 -1.54 -0.36 0.00 0.00 175.35 173.98 7paz s SER 58 N 2.11 4.93 0.32 1.43 1.04 -0.32 -5.02 113.70 118.20 7paz s SER 58 Ca -0.05 -0.24 -0.14 0.00 0.48 0.00 0.00 55.95 55.99 7paz s SER 58 Cb -0.10 -0.43 -0.08 0.00 0.10 0.00 0.00 66.02 65.50 7paz s SER 58 CO -0.14 -1.41 0.72 -0.54 0.98 0.00 0.00 173.24 172.85 7paz s LYS 59 N -4.87 3.95 0.32 4.02 1.02 -1.26 -4.63 119.74 118.29 7paz s LYS 59 Ca 0.61 0.60 -0.29 0.00 0.02 0.00 0.00 55.97 56.91 7paz s LYS 59 Cb -0.08 -2.45 -0.11 0.00 -0.52 0.00 0.00 37.83 34.67 7paz s LYS 59 CO 0.40 0.16 1.45 0.42 -0.92 0.00 0.00 175.35 176.85 7paz s ILE 60 N -2.00 2.36 0.00 2.17 1.01 -1.26 -1.99 121.20 121.49 7paz s ILE 60 Ca 0.53 0.34 0.00 0.00 0.00 0.00 0.00 60.65 61.52 7paz s ILE 60 Cb -0.10 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.15 7paz s ILE 60 CO 0.19 0.07 0.00 0.59 0.00 0.00 0.00 174.94 175.79 7paz n ASN 61 N 1.23 -0.64 -4.87 3.58 3.02 0.67 -4.95 115.26 113.29 7paz n ASN 61 Ca 0.03 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.24 7paz n ASN 61 Cb 0.40 -1.51 -0.05 0.00 -0.61 0.00 0.00 39.78 38.00 7paz n ASN 61 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 7paz s GLU 62 N -0.64 3.73 0.22 3.52 -1.05 -0.84 -4.83 118.70 118.80 7paz s GLU 62 Ca 0.00 0.12 -0.30 0.00 -0.15 0.00 0.00 54.97 54.64 7paz s GLU 62 Cb 0.00 -2.94 -0.09 0.00 -0.44 0.00 0.00 34.13 30.66 7paz s GLU 62 CO 0.00 0.53 1.28 -0.80 0.95 0.00 0.00 175.26 177.22 7paz s ASN 63 N -1.94 6.92 -0.05 0.83 -0.87 -1.26 -4.67 114.94 113.90 7paz s ASN 63 Ca 0.36 2.41 0.02 0.00 -1.57 0.00 0.00 52.86 54.08 7paz s ASN 63 Cb -0.13 -2.62 0.01 0.00 -0.02 0.00 0.00 41.25 38.49 7paz s ASN 63 CO 0.20 -0.49 -0.11 -0.47 -2.57 0.00 0.00 177.10 173.66 7paz s TYR 64 N -0.13 1.24 -0.32 2.20 5.04 -0.85 -4.97 117.35 119.56 7paz s TYR 64 Ca 0.55 -0.40 -0.07 0.00 -2.44 0.00 0.00 57.07 54.71 7paz s TYR 64 Cb -0.36 -0.92 0.03 0.00 0.35 0.00 0.00 41.96 41.06 7paz s TYR 64 CO 0.40 -0.21 0.10 0.08 -1.34 0.00 0.00 175.55 174.58 7paz s VAL 65 N 0.52 3.86 -0.15 3.14 1.01 -1.26 -1.30 120.40 126.22 7paz s VAL 65 Ca -0.10 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.80 7paz s VAL 65 Cb -0.13 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 7paz s VAL 65 CO 0.02 -0.08 0.23 -0.22 0.00 0.00 0.00 175.10 175.06 7paz s LEU 66 N 1.44 4.28 -0.26 3.92 2.96 -0.33 -4.94 118.68 125.75 7paz s LEU 66 Ca 0.00 0.47 -0.10 0.00 -0.22 0.00 0.00 54.13 54.28 7paz s LEU 66 Cb -0.19 -2.27 -0.05 0.00 0.50 0.00 0.00 46.19 44.19 7paz s LEU 66 CO 0.03 0.19 0.16 -0.89 -1.32 0.00 0.00 176.35 174.52 7paz s THR 67 N 0.05 5.18 -0.23 3.68 2.01 -1.26 -0.19 115.64 124.89 7paz s THR 67 Ca 0.15 0.12 -0.12 0.00 0.31 0.00 0.00 61.69 62.15 7paz s THR 67 Cb -0.13 -3.44 -0.05 0.00 0.01 0.00 0.00 72.50 68.89 7paz s THR 67 CO 0.03 0.29 0.23 0.54 -0.69 0.00 0.00 174.62 175.03 7paz s VAL 68 N 1.52 5.31 0.00 3.82 0.11 -0.93 -4.98 120.40 125.26 7paz s VAL 68 Ca 0.07 0.34 0.00 0.00 -2.93 0.00 0.00 61.98 59.46 7paz s VAL 68 Cb -0.15 -3.57 0.00 0.00 -1.53 0.00 0.00 36.38 31.13 7paz s VAL 68 CO 0.08 0.32 0.00 0.41 -3.33 0.00 0.00 175.10 172.58 7paz n THR 69 N 4.29 0.00 -1.67 5.04 -1.04 -1.26 -0.35 114.28 119.29 7paz n THR 69 Ca -0.13 0.04 -0.46 0.00 -2.04 0.00 0.00 64.05 61.46 7paz n THR 69 Cb 0.52 -0.77 -0.04 0.00 -1.82 0.00 0.00 70.33 68.22 7paz n THR 69 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 7paz n GLN 70 N -1.50 2.18 -1.54 -2.82 1.13 -1.26 -4.43 117.38 109.14 7paz n GLN 70 Ca 0.00 0.79 -0.32 0.00 -1.94 0.00 0.00 57.00 55.52 7paz n GLN 70 Cb 0.00 -2.55 0.07 0.00 0.11 0.00 0.00 30.24 27.87 7paz n GLN 70 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 7paz s PRO 71 N 0.74 2.51 0.00 -1.09 0.02 -1.26 -4.83 135.00 131.09 7paz s PRO 71 Ca 0.77 1.35 0.00 0.00 0.02 0.00 0.00 61.00 63.14 7paz s PRO 71 Cb -0.66 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 31.94 7paz s PRO 71 CO 0.39 -1.47 0.00 0.41 -0.33 0.00 0.00 177.00 176.00 7paz n GLY 72 N -0.64 0.70 3.76 0.52 0.00 0.27 -4.75 105.19 105.05 7paz n GLY 72 Ca 0.10 -2.15 -0.31 0.00 0.00 0.00 0.00 46.02 43.66 7paz n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 7paz s ALA 73 N -1.35 3.53 -0.08 4.61 0.00 -1.26 -0.26 121.76 126.95 7paz s ALA 73 Ca 0.00 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.98 7paz s ALA 73 Cb 0.00 -1.43 0.01 0.00 0.00 0.00 0.00 23.12 21.70 7paz s ALA 73 CO 0.00 0.74 -0.15 0.71 0.00 0.00 0.00 175.76 177.06 7paz s TYR 74 N -1.35 1.76 -0.20 0.00 1.51 0.17 -3.52 117.35 115.73 7paz s TYR 74 Ca 0.28 -0.70 -0.07 0.00 -1.01 0.00 0.00 57.07 55.57 7paz s TYR 74 Cb -0.12 -1.26 -0.03 0.00 -0.11 0.00 0.00 41.96 40.44 7paz s TYR 74 CO 0.20 -0.34 0.04 -1.17 -1.11 0.00 0.00 175.55 173.17 7paz s LEU 75 N 0.67 3.55 0.29 -1.29 2.96 0.58 -1.73 118.68 123.71 7paz s LEU 75 Ca -0.14 -0.07 0.08 0.00 -0.22 0.00 0.00 54.13 53.78 7paz s LEU 75 Cb -0.16 -1.91 -0.06 0.00 0.50 0.00 0.00 46.19 44.56 7paz s LEU 75 CO 0.04 0.10 -0.10 0.68 -1.32 0.00 0.00 176.35 175.75 7paz s VAL 76 N 0.81 1.92 0.23 1.68 -7.23 -0.02 -2.61 120.40 115.18 7paz s VAL 76 Ca 0.02 -2.19 -0.03 0.00 -1.81 0.00 0.00 61.98 57.97 7paz s VAL 76 Cb -0.14 -2.43 -0.03 0.00 0.56 0.00 0.00 36.38 34.34 7paz s VAL 76 CO 0.02 -0.32 0.24 -1.59 -0.31 0.00 0.00 175.10 173.14 7paz s LYS 77 N -3.66 1.37 -0.27 4.82 -2.85 -0.51 -1.43 119.74 117.22 7paz s LYS 77 Ca 0.29 -1.59 -0.16 0.00 -1.00 0.00 0.00 55.97 53.51 7paz s LYS 77 Cb 0.02 0.33 -0.03 0.00 -2.06 0.00 0.00 37.83 36.09 7paz s LYS 77 CO 0.13 -0.49 0.44 0.00 0.10 0.00 0.00 175.35 175.52 7paz h THR 79 N 5.40 1.07 -0.14 0.00 2.02 -1.91 0.26 112.91 119.61 7paz h THR 79 Ca -0.30 -0.26 -0.16 0.00 0.77 0.00 0.00 66.41 66.45 7paz h THR 79 Cb 1.15 0.24 0.01 0.00 -1.74 0.00 0.00 68.15 67.81 7paz h THR 79 CO 0.68 0.14 -0.55 0.40 0.37 0.00 0.00 175.52 176.56 7paz h ILE 80 N 0.76 1.33 -0.10 3.11 5.03 -1.91 -3.37 117.51 122.37 7paz h ILE 80 Ca 0.27 -1.82 -0.02 0.00 -0.12 0.00 0.00 64.86 63.18 7paz h ILE 80 Cb 0.13 2.05 -0.01 0.00 -3.03 0.00 0.00 36.82 35.96 7paz h ILE 80 CO -0.08 0.56 -0.10 1.41 -0.68 0.00 0.00 178.15 179.25 7paz n HIS 81 N -4.15 0.33 -0.17 1.37 8.25 -0.99 -4.71 115.22 115.14 7paz n HIS 81 Ca -0.07 -1.14 -0.02 0.00 -0.26 0.00 0.00 57.72 56.23 7paz n HIS 81 Cb 0.62 -0.24 0.06 0.00 1.12 0.00 0.00 29.99 31.55 7paz n HIS 81 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 7paz h TYR 82 N 0.69 -0.18 -0.13 4.41 3.20 -0.66 0.30 116.97 124.60 7paz h TYR 82 Ca 0.03 0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.98 7paz h TYR 82 Cb 1.17 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.60 7paz h TYR 82 CO 0.37 -0.19 0.10 0.00 -1.64 0.00 0.00 178.16 176.80 7paz h ALA 83 N 1.52 1.98 -0.38 1.82 0.00 -1.86 -0.03 119.26 122.30 7paz h ALA 83 Ca 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 7paz h ALA 83 Cb 0.41 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 7paz h ALA 83 CO -0.51 -0.17 0.00 -1.33 0.00 0.00 0.00 179.25 177.24 7paz n MET 84 N -4.27 3.34 -0.24 0.00 2.81 0.07 -4.79 117.12 114.04 7paz n MET 84 Ca 0.00 -1.99 0.00 0.00 -1.81 0.00 0.00 57.70 53.90 7paz n MET 84 Cb 0.22 -1.92 0.00 0.00 -0.71 0.00 0.00 33.22 30.81 7paz n MET 84 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 7paz n GLY 85 N 0.51 0.88 3.52 3.03 0.00 -0.03 -4.90 105.19 108.20 7paz n GLY 85 Ca 0.18 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 7paz n GLY 85 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 7paz s MET 86 N -0.75 3.37 0.11 1.61 -2.45 -1.04 -4.87 119.30 115.28 7paz s MET 86 Ca 0.00 -0.88 -0.01 0.00 -1.25 0.00 0.00 55.69 53.55 7paz s MET 86 Cb 0.00 -4.69 -0.04 0.00 1.25 0.00 0.00 34.83 31.35 7paz s MET 86 CO 0.00 -2.04 0.03 0.96 1.05 0.00 0.00 175.02 175.02 7paz s ILE 87 N 4.68 0.18 -0.02 10.11 -4.36 -1.26 -2.09 121.20 128.43 7paz s ILE 87 Ca 0.36 -1.89 -0.06 0.00 -0.26 0.00 0.00 60.65 58.79 7paz s ILE 87 Cb -0.07 -1.92 0.01 0.00 1.25 0.00 0.00 42.46 41.73 7paz s ILE 87 CO 0.02 -0.60 0.14 0.00 0.24 0.00 0.00 174.94 174.74 7paz s ALA 88 N -3.98 -0.33 -0.15 2.27 0.00 -0.51 -4.45 121.76 114.59 7paz s ALA 88 Ca 0.20 0.07 -0.02 0.00 0.00 0.00 0.00 51.96 52.21 7paz s ALA 88 Cb 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.15 7paz s ALA 88 CO -0.01 -0.16 -0.09 -1.17 0.00 0.00 0.00 175.76 174.33 7paz s LEU 89 N -0.83 2.87 -0.18 0.00 2.96 0.67 -0.84 118.68 123.34 7paz s LEU 89 Ca -0.09 -0.29 -0.04 0.00 -0.22 0.00 0.00 54.13 53.48 7paz s LEU 89 Cb -0.05 -1.68 -0.02 0.00 0.50 0.00 0.00 46.19 44.94 7paz s LEU 89 CO 0.01 0.13 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.51 7paz s ILE 90 N 0.58 3.85 -0.30 6.68 1.01 -0.70 -1.41 121.20 130.90 7paz s ILE 90 Ca -0.06 -0.36 -0.04 0.00 0.00 0.00 0.00 60.65 60.20 7paz s ILE 90 Cb -0.15 -2.71 0.04 0.00 0.01 0.00 0.00 42.46 39.65 7paz s ILE 90 CO 0.03 0.46 0.03 0.00 0.00 0.00 0.00 174.94 175.47 7paz s ALA 91 N 0.68 2.89 -0.40 9.38 0.00 0.12 -0.66 121.76 133.77 7paz s ALA 91 Ca -0.02 -1.69 -0.13 0.00 0.00 0.00 0.00 51.96 50.13 7paz s ALA 91 Cb -0.14 -2.02 0.03 0.00 0.00 0.00 0.00 23.12 20.99 7paz s ALA 91 CO 0.02 -1.20 0.26 0.08 0.00 0.00 0.00 175.76 174.92 7paz s VAL 92 N 1.33 4.88 0.00 0.00 1.01 0.64 -1.16 120.40 127.10 7paz s VAL 92 Ca -0.03 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.12 7paz s VAL 92 Cb -0.19 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.43 7paz s VAL 92 CO -0.00 -0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.40 7paz n GLY 93 N 5.07 -2.59 3.92 4.51 0.00 -1.01 0.97 105.19 116.07 7paz n GLY 93 Ca -0.11 -1.95 -0.28 0.00 0.00 0.00 0.00 46.02 43.67 7paz n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 7paz s ASP 94 N -2.66 6.41 -1.00 1.61 1.11 -1.26 -4.59 116.67 116.29 7paz s ASP 94 Ca 0.00 0.45 -0.14 0.00 0.18 0.00 0.00 52.55 53.03 7paz s ASP 94 Cb 0.00 -2.03 0.01 0.00 1.07 0.00 0.00 42.92 41.97 7paz s ASP 94 CO 0.00 -0.03 0.69 -1.20 1.18 0.00 0.00 175.17 175.81 7paz n SER 95 N -0.50 -5.15 -4.67 0.27 7.64 -1.26 -4.80 113.62 105.15 7paz n SER 95 Ca -0.04 -0.96 -0.43 0.00 1.01 0.00 0.00 58.87 58.44 7paz n SER 95 Cb 0.53 -2.54 -0.03 0.00 -1.01 0.00 0.00 64.21 61.16 7paz n SER 95 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 7paz n PRO 96 N -3.55 2.72 0.17 1.43 -0.04 -1.26 -4.86 135.00 129.61 7paz n PRO 96 Ca -0.17 1.00 0.13 0.00 -0.04 0.00 0.00 63.50 64.41 7paz n PRO 96 Cb 0.61 -2.92 0.67 0.00 -0.04 0.00 0.00 33.50 31.82 7paz n PRO 96 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 7paz h ALA 97 N 10.00 2.16 -0.67 0.55 0.00 -1.92 -2.80 119.26 126.57 7paz h ALA 97 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 7paz h ALA 97 Cb 1.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 7paz h ALA 97 CO 0.94 -0.24 0.00 0.27 0.00 0.00 0.00 179.25 180.22 7paz n ASN 98 N -4.45 4.55 0.11 0.00 6.94 -1.26 -4.61 115.26 116.54 7paz n ASN 98 Ca 0.02 -2.33 -0.13 0.00 -0.02 0.00 0.00 54.58 52.11 7paz n ASN 98 Cb 0.28 -0.55 -0.08 0.00 -2.36 0.00 0.00 39.78 37.06 7paz n ASN 98 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 7paz h LEU 99 N 4.12 -0.21 -1.29 -4.53 5.85 -1.86 -2.21 115.31 115.18 7paz h LEU 99 Ca 0.00 -0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.65 7paz h LEU 99 Cb 1.33 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.36 7paz h LEU 99 CO 0.17 0.00 0.51 0.44 -0.34 0.00 0.00 178.44 179.23 7paz h ASP 100 N -0.43 0.77 -0.06 1.25 3.32 -1.83 -0.52 116.42 118.93 7paz h ASP 100 Ca -0.03 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 7paz h ASP 100 Cb 0.33 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 7paz h ASP 100 CO 0.04 0.51 0.02 -0.61 -1.72 0.00 0.00 179.24 177.48 7paz h GLN 101 N 0.88 0.10 -0.64 3.56 -0.00 -1.83 -1.95 115.11 115.23 7paz h GLN 101 Ca 0.33 -0.02 0.06 0.00 -0.00 0.00 0.00 58.65 59.01 7paz h GLN 101 Cb 0.17 -0.01 -0.05 0.00 0.00 0.00 0.00 27.48 27.59 7paz h GLN 101 CO -0.11 0.29 0.35 0.82 0.00 0.00 0.00 178.83 180.17 7paz h ILE 102 N -0.10 0.96 0.00 2.39 2.04 -0.92 0.03 117.51 121.90 7paz h ILE 102 Ca 0.02 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 7paz h ILE 102 Cb 0.23 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 7paz h ILE 102 CO -0.00 0.12 -0.15 0.58 0.00 0.00 0.00 178.15 178.70 7paz h VAL 103 N 0.64 1.03 0.00 1.67 2.07 -0.95 -2.49 116.25 118.23 7paz h VAL 103 Ca 0.29 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 7paz h VAL 103 Cb 0.19 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 7paz h VAL 103 CO -0.19 0.15 -0.60 0.28 0.02 0.00 0.00 177.57 177.23 7paz h SER 104 N 0.00 0.00 -3.67 0.57 0.02 -0.38 -3.48 113.55 106.61 7paz h SER 104 Ca -0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 7paz h SER 104 Cb 0.28 0.00 0.18 0.00 0.14 0.00 0.00 62.40 63.00 7paz h SER 104 CO 0.02 0.02 0.04 0.00 -1.14 0.00 0.00 176.83 175.77 7paz n ALA 105 N -2.15 -0.36 -1.76 3.77 0.00 -0.14 -4.93 120.51 114.95 7paz n ALA 105 Ca 0.01 -0.17 -0.40 0.00 0.00 0.00 0.00 53.44 52.89 7paz n ALA 105 Cb 0.55 -2.08 -0.05 0.00 0.00 0.00 0.00 19.45 17.87 7paz n ALA 105 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 7paz s LYS 106 N -3.17 4.74 -0.02 0.00 2.20 -1.26 -5.01 119.74 117.22 7paz s LYS 106 Ca 0.73 1.63 -0.30 0.00 -0.36 0.00 0.00 55.97 57.67 7paz s LYS 106 Cb -0.36 -3.21 0.10 0.00 -1.51 0.00 0.00 37.83 32.85 7paz s LYS 106 CO 0.51 0.37 1.00 -1.59 -0.36 0.00 0.00 175.35 175.28 7paz s LYS 107 N -1.34 0.75 0.30 4.03 -2.85 -1.26 -5.14 119.74 114.22 7paz s LYS 107 Ca 0.43 -0.32 -0.28 0.00 -1.00 0.00 0.00 55.97 54.80 7paz s LYS 107 Cb -0.28 0.31 -0.13 0.00 -2.06 0.00 0.00 37.83 35.67 7paz s LYS 107 CO 0.36 -0.33 1.12 -2.30 0.10 0.00 0.00 175.35 174.30 7paz n PRO 108 N -0.27 1.64 -0.23 1.78 -0.02 -1.26 -4.78 135.00 131.85 7paz n PRO 108 Ca -0.06 0.58 0.14 0.00 -2.02 0.00 0.00 63.50 62.13 7paz n PRO 108 Cb 0.61 -2.03 0.44 0.00 -0.02 0.00 0.00 33.50 32.49 7paz n PRO 108 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 7paz h LYS 109 N 2.30 0.54 -0.24 -0.52 1.63 -2.00 -0.23 116.57 118.06 7paz h LYS 109 Ca -0.42 -0.03 -0.13 0.00 -0.85 0.00 0.00 60.65 59.21 7paz h LYS 109 Cb 1.32 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 32.82 7paz h LYS 109 CO 0.62 0.36 -0.41 0.97 -3.45 0.00 0.00 179.45 177.54 7paz h ILE 110 N 0.56 1.30 -0.16 2.00 6.09 -1.89 -2.73 117.51 122.68 7paz h ILE 110 Ca 0.43 -1.57 -0.14 0.00 -1.37 0.00 0.00 64.86 62.21 7paz h ILE 110 Cb 0.83 1.55 -0.01 0.00 0.47 0.00 0.00 36.82 39.66 7paz h ILE 110 CO -0.17 0.50 -0.49 -0.37 -3.07 0.00 0.00 178.15 174.55 7paz h VAL 111 N 0.47 1.33 -0.07 2.19 -1.51 -1.36 -2.84 116.25 114.46 7paz h VAL 111 Ca 0.04 -1.71 0.03 0.00 -1.23 0.00 0.00 66.70 63.83 7paz h VAL 111 Cb 0.91 1.74 -0.04 0.00 -2.13 0.00 0.00 31.29 31.77 7paz h VAL 111 CO 0.08 0.52 -0.13 -0.61 -1.23 0.00 0.00 177.57 176.20 7paz h GLN 112 N 0.33 -0.18 -0.50 5.19 5.75 -1.19 0.67 115.11 125.17 7paz h GLN 112 Ca 0.02 0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.58 7paz h GLN 112 Cb 0.98 0.04 -0.05 0.00 1.07 0.00 0.00 27.48 29.52 7paz h GLN 112 CO 0.09 -0.12 0.23 0.93 -2.65 0.00 0.00 178.83 177.30 7paz h GLU 113 N -0.19 0.43 -0.37 1.69 5.08 -1.48 0.34 114.58 120.08 7paz h GLU 113 Ca 0.07 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 7paz h GLU 113 Cb 0.29 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 7paz h GLU 113 CO -0.18 0.29 0.24 -0.09 -1.00 0.00 0.00 179.01 178.26 7paz h ARG 114 N 0.45 0.50 -0.84 2.33 9.65 -1.13 -1.08 114.38 124.25 7paz h ARG 114 Ca 0.23 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 59.05 7paz h ARG 114 Cb 0.18 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.61 7paz h ARG 114 CO -0.19 0.36 0.45 1.25 2.80 0.00 0.00 179.97 184.64 7paz h LEU 115 N 0.50 1.07 -0.65 3.80 5.85 0.15 -1.40 115.31 124.63 7paz h LEU 115 Ca 0.14 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.75 7paz h LEU 115 Cb -0.02 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 7paz h LEU 115 CO -0.03 0.87 0.42 -0.33 -0.34 0.00 0.00 178.44 179.03 7paz h GLU 116 N 1.18 0.86 -0.56 1.25 5.08 0.18 -2.21 114.58 120.36 7paz h GLU 116 Ca 0.30 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.49 7paz h GLU 116 Cb 0.05 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 7paz h GLU 116 CO -0.04 0.59 -0.04 0.87 -1.00 0.00 0.00 179.01 179.39 7paz h LYS 117 N 0.88 1.02 -0.74 2.33 6.56 -0.78 -1.92 116.57 123.92 7paz h LYS 117 Ca 0.24 -0.34 -0.06 0.00 -1.06 0.00 0.00 60.65 59.42 7paz h LYS 117 Cb -0.07 -0.08 -0.03 0.00 -0.57 0.00 0.00 32.23 31.47 7paz h LYS 117 CO -0.05 1.03 0.23 -0.39 -2.06 0.00 0.00 179.45 178.21 7paz h VAL 118 N 0.91 1.26 -0.04 0.50 -1.51 -0.84 -2.67 116.25 113.86 7paz h VAL 118 Ca 0.16 -0.91 -0.13 0.00 -1.23 0.00 0.00 66.70 64.59 7paz h VAL 118 Cb 0.59 0.44 -0.01 0.00 -2.13 0.00 0.00 31.29 30.18 7paz h VAL 118 CO 0.04 0.36 -0.58 0.40 -1.23 0.00 0.00 177.57 176.55 7paz h ILE 119 N 1.10 1.40 0.00 7.19 2.04 -1.31 -3.36 117.51 124.57 7paz h ILE 119 Ca 0.24 -1.97 0.00 0.00 1.00 0.00 0.00 64.86 64.13 7paz h ILE 119 Cb 0.31 2.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 7paz h ILE 119 CO -0.01 0.57 0.00 0.00 0.00 0.00 0.00 178.15 178.71 7paz n ALA 120 N -2.45 0.00 -1.65 1.87 0.00 -0.73 -4.12 120.51 113.43 7paz n ALA 120 Ca -0.02 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.25 7paz n ALA 120 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 7paz n ALA 120 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 7paz s SER 121 N -1.11 4.13 0.00 0.00 0.01 -1.17 -3.17 113.70 112.40 7paz s SER 121 Ca 0.00 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.28 7paz s SER 121 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 7paz s SER 121 CO 0.00 -3.62 0.00 0.00 0.41 0.00 0.00 173.24 170.03 7paz n ALA 122 N 17.68 0.00 0.35 1.44 0.00 -1.26 -4.74 120.51 133.98 7paz n ALA 122 Ca 0.45 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.91 7paz n ALA 122 Cb 0.45 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.06 7paz n ALA 122 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67