#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hpn s VAL 2 N 0.00 3.34 -0.21 2.62 1.01 -0.58 -4.97 120.40 121.60 3hpn s VAL 2 Ca 0.00 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.31 3hpn s VAL 2 Cb 0.00 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 3hpn s VAL 2 CO 0.00 0.43 0.42 -0.69 0.00 0.00 0.00 175.10 175.26 3hpn s VAL 3 N 1.42 5.17 -0.17 2.92 1.01 -1.26 -1.40 120.40 128.09 3hpn s VAL 3 Ca 0.05 0.74 0.07 0.00 0.00 0.00 0.00 61.98 62.84 3hpn s VAL 3 Cb -0.14 -3.75 -0.22 0.00 0.00 0.00 0.00 36.38 32.26 3hpn s VAL 3 CO -0.03 0.22 0.16 0.18 0.00 0.00 0.00 175.10 175.63 3hpn n LEU 4 N 4.71 1.67 -3.80 3.92 4.77 0.78 -4.97 117.00 124.07 3hpn n LEU 4 Ca -0.07 0.09 -0.12 0.00 -0.03 0.00 0.00 56.01 55.87 3hpn n LEU 4 Cb 0.51 -0.36 -0.11 0.00 -2.33 0.00 0.00 43.42 41.13 3hpn n LEU 4 CO 0.40 0.69 -0.11 -0.22 -1.33 0.00 0.00 177.39 176.82 3hpn s LEU 5 N -6.27 1.17 -0.35 2.23 2.96 -1.08 -4.96 118.68 112.37 3hpn s LEU 5 Ca -0.19 0.30 0.03 0.00 -0.22 0.00 0.00 54.13 54.05 3hpn s LEU 5 Cb 0.07 0.82 0.16 0.00 0.50 0.00 0.00 46.19 47.75 3hpn s LEU 5 CO 0.75 -0.17 0.41 -0.62 -1.32 0.00 0.00 176.35 175.39 3hpn s ASP 6 N -0.31 0.74 0.13 3.68 3.68 -1.25 -0.60 116.67 122.73 3hpn s ASP 6 Ca -0.04 -1.19 -0.20 0.00 2.13 0.00 0.00 52.55 53.26 3hpn s ASP 6 Cb -0.03 0.83 -0.03 0.00 -1.45 0.00 0.00 42.92 42.24 3hpn s ASP 6 CO 0.01 -0.28 1.73 0.15 0.13 0.00 0.00 175.17 176.91 3hpn h PHE 7 N 7.37 0.03 0.00 -5.34 3.57 -1.36 -2.54 116.94 118.67 3hpn h PHE 7 Ca 0.01 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3hpn h PHE 7 Cb 1.08 0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.84 3hpn h PHE 7 CO 0.29 -0.01 0.00 0.00 -2.23 0.00 0.00 178.31 176.36 3hpn h ALA 8 N 1.16 1.00 -2.47 2.41 0.00 -1.81 -3.22 119.26 116.34 3hpn h ALA 8 Ca 0.09 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.54 3hpn h ALA 8 Cb 0.11 0.00 0.12 0.00 0.00 0.00 0.00 17.79 18.02 3hpn h ALA 8 CO -0.14 0.00 0.38 0.00 0.00 0.00 0.00 179.25 179.49 3hpn s ALA 9 N -3.75 2.34 -0.05 0.00 0.00 -0.96 -4.84 121.76 114.50 3hpn s ALA 9 Ca -0.01 -0.73 -0.02 0.00 0.00 0.00 0.00 51.96 51.20 3hpn s ALA 9 Cb 0.10 -2.94 -0.06 0.00 0.00 0.00 0.00 23.12 20.22 3hpn s ALA 9 CO 0.41 -2.00 1.26 0.00 0.00 0.00 0.00 175.76 175.44 3hpn n ALA 10 N -3.53 2.28 0.00 0.00 0.00 -1.26 -1.75 120.51 116.25 3hpn n ALA 10 Ca 0.09 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.05 3hpn n ALA 10 Cb 0.60 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.72 3hpn n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hpn n GLY 11 N 3.03 -0.30 0.11 0.00 0.00 -1.26 -5.00 105.19 101.77 3hpn n GLY 11 Ca 0.11 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 3hpn n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hpn n GLY 12 N 0.00 -1.58 0.00 -0.02 0.00 -0.72 -3.27 105.19 99.60 3hpn n GLY 12 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 3hpn n GLY 12 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3hpn n GLU 13 N -2.23 0.11 -3.26 1.61 0.00 -1.21 -4.57 120.64 111.08 3hpn n GLU 13 Ca 0.05 -0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.85 3hpn n GLU 13 Cb 0.37 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.25 3hpn n GLU 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3hpn s LEU 14 N -2.89 4.29 0.00 -1.84 2.01 -1.20 -4.55 118.68 114.49 3hpn s LEU 14 Ca 0.17 1.18 0.00 0.00 0.01 0.00 0.00 54.13 55.50 3hpn s LEU 14 Cb 0.19 -3.50 0.00 0.00 0.01 0.00 0.00 46.19 42.89 3hpn s LEU 14 CO 0.52 0.03 0.00 0.61 1.01 0.00 0.00 176.35 178.52 3hpn n GLY 15 N 0.54 0.83 3.84 -3.19 0.00 -1.26 -4.88 105.19 101.07 3hpn n GLY 15 Ca -0.03 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 3hpn n GLY 15 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3hpn s TRP 16 N -2.00 3.46 -0.11 1.61 0.52 -1.26 -3.10 118.94 118.05 3hpn s TRP 16 Ca 0.00 0.36 -0.05 0.00 0.02 0.00 0.00 56.10 56.42 3hpn s TRP 16 Cb 0.00 -1.84 -0.04 0.00 -1.15 0.00 0.00 33.47 30.45 3hpn s TRP 16 CO 0.00 0.63 0.08 -1.17 0.02 0.00 0.00 176.95 176.51 3hpn s LEU 17 N -1.51 4.02 -0.05 2.99 0.20 -0.51 -4.96 118.68 118.87 3hpn s LEU 17 Ca 0.21 0.30 0.05 0.00 0.69 0.00 0.00 54.13 55.39 3hpn s LEU 17 Cb -0.12 -1.96 -0.01 0.00 -0.43 0.00 0.00 46.19 43.67 3hpn s LEU 17 CO 0.11 0.37 -0.20 0.42 -0.29 0.00 0.00 176.35 176.76 3hpn s THR 18 N -0.81 1.69 -0.14 3.68 -4.23 -1.26 -0.16 115.64 114.41 3hpn s THR 18 Ca 0.13 -0.87 -0.06 0.00 -1.18 0.00 0.00 61.69 59.71 3hpn s THR 18 Cb -0.12 -1.43 0.06 0.00 1.34 0.00 0.00 72.50 72.35 3hpn s THR 18 CO 0.03 0.48 0.30 -2.28 -0.54 0.00 0.00 174.62 172.61 3hpn s HIS 19 N -0.09 -0.47 0.77 3.99 5.04 -0.12 -3.83 115.29 120.59 3hpn s HIS 19 Ca -0.03 1.03 -0.11 0.00 -1.54 0.00 0.00 55.06 54.42 3hpn s HIS 19 Cb -0.12 0.09 0.05 0.00 0.04 0.00 0.00 32.58 32.65 3hpn s HIS 19 CO 0.02 -0.32 1.09 -1.25 -2.34 0.00 0.00 174.74 171.94 3hpn s PRO 20 N 1.82 2.29 -0.09 2.88 0.05 -1.26 0.56 135.00 141.24 3hpn s PRO 20 Ca -0.05 1.07 -0.05 0.00 0.05 0.00 0.00 61.00 62.02 3hpn s PRO 20 Cb -0.11 -1.91 -0.04 0.00 0.05 0.00 0.00 34.50 32.50 3hpn s PRO 20 CO -0.10 -1.59 0.10 -0.47 0.05 0.00 0.00 177.00 174.99 3hpn s TYR 21 N -2.95 3.44 0.00 0.56 5.04 -1.25 -4.49 117.35 117.70 3hpn s TYR 21 Ca 0.61 0.39 0.00 0.00 -2.44 0.00 0.00 57.07 55.63 3hpn s TYR 21 Cb -0.16 -1.87 0.00 0.00 0.35 0.00 0.00 41.96 40.27 3hpn s TYR 21 CO 0.56 0.64 0.00 0.41 -1.34 0.00 0.00 175.55 175.82 3hpn n GLY 22 N 1.89 3.28 0.00 8.97 0.00 -1.26 -4.95 105.19 113.12 3hpn n GLY 22 Ca -0.18 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.82 3hpn n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hpn n LYS 23 N 0.00 0.00 0.00 1.61 5.02 -1.26 -5.04 118.16 118.48 3hpn n LYS 23 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3hpn n LYS 23 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 3hpn n LYS 23 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hpn n GLY 24 N 5.00 0.50 3.74 0.72 0.00 -1.26 -4.66 105.19 109.23 3hpn n GLY 24 Ca 0.00 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 3hpn n GLY 24 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3hpn n TRP 25 N 0.00 2.65 -3.72 1.61 7.02 -1.26 -4.69 117.44 119.06 3hpn n TRP 25 Ca 0.00 0.48 -0.15 0.00 -1.02 0.00 0.00 57.50 56.82 3hpn n TRP 25 Cb 0.00 -2.48 -0.15 0.00 -2.42 0.00 0.00 31.31 26.26 3hpn n TRP 25 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3hpn s ASP 26 N -0.17 0.22 -0.07 -0.99 -1.08 -0.38 -4.84 116.67 109.37 3hpn s ASP 26 Ca 0.55 0.32 -0.30 0.00 -0.52 0.00 0.00 52.55 52.60 3hpn s ASP 26 Cb -0.52 0.23 -0.02 0.00 -1.46 0.00 0.00 42.92 41.14 3hpn s ASP 26 CO 0.62 -0.19 1.07 -0.22 0.52 0.00 0.00 175.17 176.97 3hpn s LEU 27 N 1.62 4.28 0.08 -1.34 2.96 -1.26 -0.94 118.68 124.08 3hpn s LEU 27 Ca -0.04 1.66 0.06 0.00 -0.22 0.00 0.00 54.13 55.59 3hpn s LEU 27 Cb -0.12 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 3hpn s LEU 27 CO -0.06 -0.46 -0.16 -0.04 -1.32 0.00 0.00 176.35 174.31 3hpn s MET 28 N 1.87 0.91 -0.25 1.98 -1.94 -0.51 -4.98 119.30 116.36 3hpn s MET 28 Ca 0.52 -1.03 -0.03 0.00 -1.71 0.00 0.00 55.69 53.44 3hpn s MET 28 Cb -0.21 -0.97 0.01 0.00 2.01 0.00 0.00 34.83 35.67 3hpn s MET 28 CO 0.21 0.22 -0.02 -1.14 -0.01 0.00 0.00 175.02 174.28 3hpn s GLN 29 N -1.85 3.02 0.38 2.03 0.74 -1.26 -1.59 119.66 121.14 3hpn s GLN 29 Ca 0.01 -0.87 0.03 0.00 0.05 0.00 0.00 55.36 54.58 3hpn s GLN 29 Cb -0.10 -3.09 -0.01 0.00 1.10 0.00 0.00 33.01 30.91 3hpn s GLN 29 CO 0.03 -0.37 0.57 -0.80 -0.55 0.00 0.00 175.29 174.17 3hpn s ASN 30 N 1.40 5.96 -0.06 6.67 0.01 0.29 -4.93 114.94 124.28 3hpn s ASN 30 Ca 0.02 0.12 0.01 0.00 -0.71 0.00 0.00 52.86 52.30 3hpn s ASN 30 Cb -0.16 -1.50 0.02 0.00 0.41 0.00 0.00 41.25 40.02 3hpn s ASN 30 CO -0.02 -0.52 -0.06 -0.63 -1.51 0.00 0.00 177.10 174.36 3hpn s ILE 31 N -2.36 0.67 -0.07 0.60 1.01 -1.26 0.43 121.20 120.22 3hpn s ILE 31 Ca 0.45 -0.17 -0.01 0.00 0.00 0.00 0.00 60.65 60.92 3hpn s ILE 31 Cb -0.10 -0.69 0.03 0.00 0.01 0.00 0.00 42.46 41.71 3hpn s ILE 31 CO 0.35 0.27 -0.01 -0.32 0.00 0.00 0.00 174.94 175.22 3hpn s MET 32 N 1.08 0.70 -1.33 2.79 1.75 -0.59 -4.80 119.30 118.90 3hpn s MET 32 Ca -0.08 0.05 -0.09 0.00 -1.25 0.00 0.00 55.69 54.31 3hpn s MET 32 Cb -0.14 -0.97 0.00 0.00 2.84 0.00 0.00 34.83 36.56 3hpn s MET 32 CO -0.01 -0.26 0.51 0.09 -0.65 0.00 0.00 175.02 174.70 3hpn n ASN 33 N 4.91 -1.93 0.00 1.11 3.02 -1.26 -0.92 115.26 120.20 3hpn n ASN 33 Ca -0.11 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.37 3hpn n ASN 33 Cb 0.50 -2.85 0.00 0.00 -0.61 0.00 0.00 39.78 36.82 3hpn n ASN 33 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3hpn n ASP 34 N -2.80 -1.50 -4.59 6.41 9.92 -1.26 -4.97 116.55 117.76 3hpn n ASP 34 Ca -0.23 0.00 -0.41 0.00 -0.53 0.00 0.00 54.79 53.62 3hpn n ASP 34 Cb 0.65 -2.51 -0.08 0.00 -0.64 0.00 0.00 41.12 38.54 3hpn n ASP 34 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 3hpn s MET 35 N -1.14 3.86 0.17 -1.24 -1.94 -0.09 -5.05 119.30 113.87 3hpn s MET 35 Ca 0.00 0.10 -0.32 0.00 -1.71 0.00 0.00 55.69 53.76 3hpn s MET 35 Cb 0.00 -3.73 -0.11 0.00 2.01 0.00 0.00 34.83 33.00 3hpn s MET 35 CO 0.00 -0.49 1.74 -1.25 -0.01 0.00 0.00 175.02 175.01 3hpn s PRO 36 N 2.36 4.14 -0.23 2.03 0.04 -1.26 -1.54 135.00 140.55 3hpn s PRO 36 Ca 0.20 2.57 0.01 0.00 0.04 0.00 0.00 61.00 63.82 3hpn s PRO 36 Cb -0.15 -3.27 0.06 0.00 0.04 0.00 0.00 34.50 31.17 3hpn s PRO 36 CO 0.11 -0.77 -0.06 -1.50 0.04 0.00 0.00 177.00 174.82 3hpn s ILE 37 N 1.75 1.56 0.32 0.56 2.07 0.17 -4.95 121.20 122.68 3hpn s ILE 37 Ca 0.76 -1.19 -0.06 0.00 -1.41 0.00 0.00 60.65 58.76 3hpn s ILE 37 Cb -0.48 -1.79 -0.05 0.00 0.13 0.00 0.00 42.46 40.27 3hpn s ILE 37 CO 0.33 -0.05 0.61 -0.31 -1.91 0.00 0.00 174.94 173.61 3hpn s TYR 38 N 1.39 3.48 0.03 3.50 1.51 -1.26 -0.55 117.35 125.44 3hpn s TYR 38 Ca -0.05 0.71 -0.20 0.00 -1.01 0.00 0.00 57.07 56.52 3hpn s TYR 38 Cb -0.18 -2.17 0.04 0.00 -0.11 0.00 0.00 41.96 39.54 3hpn s TYR 38 CO -0.06 0.10 0.45 0.00 -1.11 0.00 0.00 175.55 174.92 3hpn s MET 39 N -3.70 0.92 -0.20 -0.62 0.23 -0.62 -4.77 119.30 110.54 3hpn s MET 39 Ca 0.45 -0.25 -0.09 0.00 -1.03 0.00 0.00 55.69 54.77 3hpn s MET 39 Cb -0.11 0.42 -0.05 0.00 -1.53 0.00 0.00 34.83 33.57 3hpn s MET 39 CO 0.31 -0.31 0.11 0.71 -2.03 0.00 0.00 175.02 173.81 3hpn s TYR 40 N -2.18 3.32 0.01 3.16 1.51 -0.23 -1.43 117.35 121.50 3hpn s TYR 40 Ca -0.07 0.18 -0.00 0.00 -1.01 0.00 0.00 57.07 56.17 3hpn s TYR 40 Cb -0.01 -2.15 -0.01 0.00 -0.11 0.00 0.00 41.96 39.68 3hpn s TYR 40 CO -0.00 0.17 -0.01 0.45 -1.11 0.00 0.00 175.55 175.05 3hpn s SER 41 N 0.53 0.08 -0.15 2.29 0.15 -0.12 0.15 113.70 116.64 3hpn s SER 41 Ca 0.06 -0.18 -0.14 0.00 0.70 0.00 0.00 55.95 56.40 3hpn s SER 41 Cb -0.12 0.04 0.04 0.00 -1.71 0.00 0.00 66.02 64.26 3hpn s SER 41 CO 0.00 -0.11 0.39 0.54 1.20 0.00 0.00 173.24 175.27 3hpn s VAL 42 N -0.52 0.00 -0.39 4.45 0.11 -0.84 -1.25 120.40 121.96 3hpn s VAL 42 Ca -0.06 -0.01 0.11 0.00 -2.93 0.00 0.00 61.98 59.10 3hpn s VAL 42 Cb -0.04 -0.55 0.37 0.00 -1.53 0.00 0.00 36.38 34.64 3hpn s VAL 42 CO -0.00 -0.00 0.99 0.00 -3.33 0.00 0.00 175.10 172.75 3hpn n ASN 44 N 0.07 5.56 -0.27 0.00 5.03 -1.26 -4.71 115.26 119.69 3hpn n ASN 44 Ca 0.12 -3.12 0.11 0.00 0.87 0.00 0.00 54.58 52.56 3hpn n ASN 44 Cb 0.74 -1.43 0.10 0.00 -1.02 0.00 0.00 39.78 38.18 3hpn n ASN 44 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 3hpn n VAL 45 N 3.03 0.00 1.02 2.41 0.24 -1.26 -4.28 118.33 119.49 3hpn n VAL 45 Ca 0.31 -0.14 0.12 0.00 -2.04 0.00 0.00 64.34 62.59 3hpn n VAL 45 Cb 0.38 0.85 0.06 0.00 -1.47 0.00 0.00 33.84 33.66 3hpn n VAL 45 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 3hpn n MET 46 N -0.67 1.61 -4.22 7.34 2.81 -1.26 -3.59 117.12 119.14 3hpn n MET 46 Ca 0.09 -1.32 -0.17 0.00 -1.81 0.00 0.00 57.70 54.49 3hpn n MET 46 Cb 0.39 -1.47 -0.14 0.00 -0.71 0.00 0.00 33.22 31.28 3hpn n MET 46 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3hpn s SER 47 N -2.30 0.74 0.89 7.83 1.04 -1.26 -4.98 113.70 115.65 3hpn s SER 47 Ca 0.22 -0.11 -0.06 0.00 0.48 0.00 0.00 55.95 56.48 3hpn s SER 47 Cb 0.19 -0.08 0.10 0.00 0.10 0.00 0.00 66.02 66.32 3hpn s SER 47 CO 0.47 0.08 0.58 0.61 0.98 0.00 0.00 173.24 175.96 3hpn n GLY 48 N 2.93 -0.81 2.49 7.32 0.00 -1.26 -4.48 105.19 111.38 3hpn n GLY 48 Ca -0.13 -1.76 -0.18 0.00 0.00 0.00 0.00 46.02 43.95 3hpn n GLY 48 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hpn n ASP 49 N -3.29 -5.23 -4.71 1.61 10.43 -1.26 -4.93 116.55 109.17 3hpn n ASP 49 Ca 0.08 -0.09 -0.42 0.00 2.57 0.00 0.00 54.79 56.93 3hpn n ASP 49 Cb 0.27 -4.23 -0.03 0.00 1.84 0.00 0.00 41.12 38.97 3hpn n ASP 49 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 3hpn s GLN 50 N -5.08 4.51 -0.41 -1.24 -1.52 -1.26 -4.95 119.66 109.71 3hpn s GLN 50 Ca 0.08 1.59 0.07 0.00 -1.95 0.00 0.00 55.36 55.15 3hpn s GLN 50 Cb -0.04 -3.39 0.22 0.00 -0.22 0.00 0.00 33.01 29.58 3hpn s GLN 50 CO 0.10 -0.12 0.51 -3.47 -0.25 0.00 0.00 175.29 172.07 3hpn n ASP 51 N 3.75 -0.44 -4.64 5.90 4.64 -1.24 -4.26 116.55 120.26 3hpn n ASP 51 Ca 0.07 -2.67 -0.35 0.00 -1.38 0.00 0.00 54.79 50.46 3hpn n ASP 51 Cb 0.49 -0.29 -0.10 0.00 -1.04 0.00 0.00 41.12 40.17 3hpn n ASP 51 CO 0.00 0.00 0.00 0.20 -0.82 0.00 0.00 177.20 176.58 3hpn s ASN 52 N -0.80 5.28 -0.06 1.67 0.01 -0.31 -4.45 114.94 116.28 3hpn s ASN 52 Ca 0.34 0.09 0.05 0.00 -0.71 0.00 0.00 52.86 52.63 3hpn s ASN 52 Cb 0.13 -1.67 -0.00 0.00 0.41 0.00 0.00 41.25 40.12 3hpn s ASN 52 CO -0.14 0.30 -0.20 0.26 -1.51 0.00 0.00 177.10 175.80 3hpn s TRP 53 N -0.38 2.04 -0.16 2.20 0.52 0.19 0.29 118.94 123.64 3hpn s TRP 53 Ca 0.08 -0.63 0.01 0.00 0.02 0.00 0.00 56.10 55.57 3hpn s TRP 53 Cb -0.12 -1.36 0.02 0.00 -1.15 0.00 0.00 33.47 30.86 3hpn s TRP 53 CO 0.02 -0.22 -0.16 -1.17 0.02 0.00 0.00 176.95 175.45 3hpn s LEU 54 N 0.04 1.81 -0.10 2.99 2.96 0.35 -0.95 118.68 125.79 3hpn s LEU 54 Ca -0.06 -0.53 0.04 0.00 -0.22 0.00 0.00 54.13 53.35 3hpn s LEU 54 Cb -0.13 -1.26 -0.01 0.00 0.50 0.00 0.00 46.19 45.29 3hpn s LEU 54 CO 0.03 -0.04 -0.22 -0.60 -1.32 0.00 0.00 176.35 174.21 3hpn s ARG 55 N 1.42 3.01 0.96 1.98 3.52 0.77 0.04 118.95 130.66 3hpn s ARG 55 Ca 0.05 -0.84 -0.11 0.00 -0.13 0.00 0.00 55.73 54.70 3hpn s ARG 55 Cb -0.13 -2.35 0.17 0.00 -1.56 0.00 0.00 34.95 31.08 3hpn s ARG 55 CO -0.11 0.24 1.09 0.95 -0.81 0.00 0.00 175.30 176.66 3hpn s THR 56 N 0.21 2.40 1.07 4.11 -4.23 -0.63 -1.42 115.64 117.14 3hpn s THR 56 Ca -0.13 0.13 -0.13 0.00 -1.18 0.00 0.00 61.69 60.37 3hpn s THR 56 Cb -0.16 -2.41 0.18 0.00 1.34 0.00 0.00 72.50 71.44 3hpn s THR 56 CO 0.07 -0.17 0.72 -0.46 -0.54 0.00 0.00 174.62 174.25 3hpn n ASN 57 N -4.20 -1.46 -4.72 3.99 6.94 -1.18 -4.71 115.26 109.92 3hpn n ASN 57 Ca 0.07 0.06 -0.42 0.00 -0.02 0.00 0.00 54.58 54.27 3hpn n ASN 57 Cb 0.54 -1.24 -0.03 0.00 -2.36 0.00 0.00 39.78 36.70 3hpn n ASN 57 CO 0.00 0.00 0.00 0.86 -1.03 0.00 0.00 177.26 177.09 3hpn s TRP 58 N -2.42 3.00 -0.14 -2.53 -0.00 -1.26 -4.73 118.94 110.85 3hpn s TRP 58 Ca 0.64 0.56 0.02 0.00 -0.00 0.00 0.00 56.10 57.32 3hpn s TRP 58 Cb -0.21 -4.00 0.01 0.00 -0.00 0.00 0.00 33.47 29.27 3hpn s TRP 58 CO 0.64 -3.68 -0.21 0.08 -0.00 0.00 0.00 176.95 173.79 3hpn s VAL 59 N 1.04 1.99 0.39 5.86 1.01 -0.34 -4.97 120.40 125.38 3hpn s VAL 59 Ca 0.71 -0.93 -0.27 0.00 0.00 0.00 0.00 61.98 61.49 3hpn s VAL 59 Cb -0.46 -1.77 -0.09 0.00 0.00 0.00 0.00 36.38 34.06 3hpn s VAL 59 CO 0.33 0.54 1.31 -0.31 0.00 0.00 0.00 175.10 176.96 3hpn s TYR 60 N 0.91 2.86 0.03 5.22 1.51 -1.26 -0.11 117.35 126.51 3hpn s TYR 60 Ca -0.05 1.40 -0.09 0.00 -1.01 0.00 0.00 57.07 57.32 3hpn s TYR 60 Cb -0.15 -3.69 -0.31 0.00 -0.11 0.00 0.00 41.96 37.70 3hpn s TYR 60 CO -0.03 -2.07 0.98 -0.09 -1.11 0.00 0.00 175.55 173.22 3hpn h ARG 61 N 2.86 0.38 0.00 -0.62 2.43 -1.28 -3.46 114.38 114.69 3hpn h ARG 61 Ca -0.49 -0.65 0.00 0.00 -0.81 0.00 0.00 59.98 58.02 3hpn h ARG 61 Cb 1.24 0.24 0.00 0.00 -0.42 0.00 0.00 29.97 31.03 3hpn h ARG 61 CO 0.63 1.29 0.00 0.41 -1.51 0.00 0.00 179.97 180.80 3hpn n GLY 62 N 1.67 3.54 1.08 2.80 0.00 -1.26 -2.20 105.19 110.82 3hpn n GLY 62 Ca -0.15 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 45.96 3hpn n GLY 62 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3hpn n GLU 63 N 14.00 2.41 -1.66 1.61 0.28 -1.26 -4.97 120.64 131.05 3hpn n GLU 63 Ca 0.00 -2.17 -0.46 0.00 -0.16 0.00 0.00 57.16 54.37 3hpn n GLU 63 Cb 0.00 -1.49 -0.03 0.00 1.43 0.00 0.00 31.44 31.35 3hpn n GLU 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3hpn n ALA 64 N 1.42 0.94 -0.08 -1.84 0.00 -0.94 -4.92 120.51 115.09 3hpn n ALA 64 Ca 0.18 0.43 -0.12 0.00 0.00 0.00 0.00 53.44 53.93 3hpn n ALA 64 Cb 0.59 -2.27 -0.07 0.00 0.00 0.00 0.00 19.45 17.70 3hpn n ALA 64 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3hpn n GLU 65 N 2.52 0.39 -4.70 0.00 1.02 -1.26 -4.65 120.64 113.96 3hpn n GLU 65 Ca 0.14 0.10 -0.30 0.00 -0.02 0.00 0.00 57.16 57.08 3hpn n GLU 65 Cb 0.29 -1.28 -0.17 0.00 -0.02 0.00 0.00 31.44 30.26 3hpn n GLU 65 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3hpn s ARG 66 N -2.31 2.64 0.10 3.49 3.52 -1.26 -0.35 118.95 124.76 3hpn s ARG 66 Ca -0.22 -0.72 0.05 0.00 -0.13 0.00 0.00 55.73 54.71 3hpn s ARG 66 Cb 0.06 -2.13 -0.04 0.00 -1.56 0.00 0.00 34.95 31.28 3hpn s ARG 66 CO 0.35 0.01 0.01 0.96 -0.81 0.00 0.00 175.30 175.82 3hpn s ILE 67 N 0.77 4.04 -0.09 4.11 -4.36 -0.57 -4.45 121.20 120.65 3hpn s ILE 67 Ca -0.10 -1.00 0.01 0.00 -0.26 0.00 0.00 60.65 59.30 3hpn s ILE 67 Cb -0.16 -2.94 -0.03 0.00 1.25 0.00 0.00 42.46 40.59 3hpn s ILE 67 CO 0.01 0.10 -0.10 -0.36 0.24 0.00 0.00 174.94 174.83 3hpn s PHE 68 N -1.34 2.86 -0.21 1.37 0.40 0.31 -1.86 117.98 119.50 3hpn s PHE 68 Ca 0.26 -0.20 0.01 0.00 -0.60 0.00 0.00 56.93 56.40 3hpn s PHE 68 Cb -0.12 -1.75 0.05 0.00 0.51 0.00 0.00 43.02 41.71 3hpn s PHE 68 CO 0.19 0.14 -0.10 0.42 0.70 0.00 0.00 175.22 176.56 3hpn s ILE 69 N -0.41 1.74 -0.20 0.64 1.01 0.15 -0.85 121.20 123.27 3hpn s ILE 69 Ca 0.05 -1.13 -0.05 0.00 0.00 0.00 0.00 60.65 59.52 3hpn s ILE 69 Cb -0.12 -1.83 -0.02 0.00 0.01 0.00 0.00 42.46 40.49 3hpn s ILE 69 CO 0.02 0.12 0.01 -0.70 0.00 0.00 0.00 174.94 174.39 3hpn s GLU 70 N 1.34 3.62 -0.13 2.79 2.12 0.26 -1.01 118.70 127.69 3hpn s GLU 70 Ca -0.03 -0.51 0.01 0.00 0.36 0.00 0.00 54.97 54.80 3hpn s GLU 70 Cb -0.17 -3.10 -0.00 0.00 0.26 0.00 0.00 34.13 31.12 3hpn s GLU 70 CO -0.08 0.00 -0.17 -0.51 -0.54 0.00 0.00 175.26 173.96 3hpn s LEU 71 N 1.04 2.43 -0.11 2.70 1.43 0.23 -0.54 118.68 125.85 3hpn s LEU 71 Ca 0.02 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.69 3hpn s LEU 71 Cb -0.14 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 3hpn s LEU 71 CO 0.02 0.12 -0.20 -0.54 0.23 0.00 0.00 176.35 175.98 3hpn s LYS 72 N 0.57 3.13 0.16 1.70 1.02 -0.62 -0.73 119.74 124.96 3hpn s LYS 72 Ca -0.10 -0.81 -0.22 0.00 0.02 0.00 0.00 55.97 54.85 3hpn s LYS 72 Cb -0.16 -2.41 0.07 0.00 -0.52 0.00 0.00 37.83 34.81 3hpn s LYS 72 CO 0.04 0.21 0.58 -0.59 -0.92 0.00 0.00 175.35 174.67 3hpn s PHE 73 N 0.29 -0.50 0.13 3.18 -0.12 -0.71 -0.30 117.98 119.96 3hpn s PHE 73 Ca -0.15 0.28 0.10 0.00 -0.05 0.00 0.00 56.93 57.12 3hpn s PHE 73 Cb -0.17 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.71 3hpn s PHE 73 CO 0.07 -0.83 -0.24 0.95 -0.05 0.00 0.00 175.22 175.12 3hpn s THR 74 N -3.75 2.07 -0.08 -4.49 -4.23 -0.58 -0.28 115.64 104.31 3hpn s THR 74 Ca 0.01 -1.74 0.01 0.00 -1.18 0.00 0.00 61.69 58.79 3hpn s THR 74 Cb -0.01 -1.87 0.02 0.00 1.34 0.00 0.00 72.50 71.98 3hpn s THR 74 CO -0.13 -0.02 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.16 3hpn s VAL 75 N -1.25 0.92 0.10 2.29 1.01 -1.26 -1.14 120.40 121.06 3hpn s VAL 75 Ca 0.13 -0.30 -0.27 0.00 0.00 0.00 0.00 61.98 61.54 3hpn s VAL 75 Cb -0.09 -0.90 -0.06 0.00 0.00 0.00 0.00 36.38 35.32 3hpn s VAL 75 CO 0.06 0.32 0.83 -0.60 0.00 0.00 0.00 175.10 175.72 3hpn s ARG 76 N 1.13 4.59 0.18 2.72 3.52 -0.08 -1.19 118.95 129.82 3hpn s ARG 76 Ca -0.06 1.22 -0.33 0.00 -0.13 0.00 0.00 55.73 56.43 3hpn s ARG 76 Cb -0.14 -3.34 -0.13 0.00 -1.56 0.00 0.00 34.95 29.78 3hpn s ARG 76 CO -0.01 0.33 1.67 -3.47 -0.81 0.00 0.00 175.30 173.01 3hpn n ASP 77 N 2.51 3.62 0.28 -2.12 4.64 -0.52 -4.58 116.55 120.39 3hpn n ASP 77 Ca -0.02 1.06 0.16 0.00 -1.38 0.00 0.00 54.79 54.62 3hpn n ASP 77 Cb 0.49 -1.51 0.83 0.00 -1.04 0.00 0.00 41.12 39.90 3hpn n ASP 77 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3hpn n ASN 79 N -3.36 0.25 -1.12 0.00 5.03 -1.26 -3.31 115.26 111.49 3hpn n ASN 79 Ca -0.01 -1.12 0.07 0.00 0.87 0.00 0.00 54.58 54.38 3hpn n ASN 79 Cb 0.22 -0.00 0.24 0.00 -1.02 0.00 0.00 39.78 39.22 3hpn n ASN 79 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 3hpn n SER 80 N -0.78 3.26 -4.14 6.41 3.41 -0.71 -4.65 113.62 116.42 3hpn n SER 80 Ca 0.22 -2.23 -0.37 0.00 -0.26 0.00 0.00 58.87 56.23 3hpn n SER 80 Cb 0.15 -0.44 -0.10 0.00 -0.26 0.00 0.00 64.21 63.55 3hpn n SER 80 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3hpn s PHE 81 N -1.64 3.52 0.52 7.33 0.40 -1.21 -4.97 117.98 121.94 3hpn s PHE 81 Ca 0.35 -2.37 -0.19 0.00 -0.60 0.00 0.00 56.93 54.13 3hpn s PHE 81 Cb 0.22 -3.29 -0.11 0.00 0.51 0.00 0.00 43.02 40.35 3hpn s PHE 81 CO 0.19 -0.95 0.39 -2.30 0.70 0.00 0.00 175.22 173.25 3hpn n PRO 82 N 4.40 0.42 0.00 0.24 -0.02 -1.26 -2.97 135.00 135.80 3hpn n PRO 82 Ca -0.01 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 3hpn n PRO 82 Cb 0.41 -1.51 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 3hpn n PRO 82 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hpn n GLY 83 N 1.93 2.61 0.00 -1.23 0.00 -1.26 -4.65 105.19 102.60 3hpn n GLY 83 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3hpn n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hpn n GLY 84 N -1.55 -1.35 3.55 -0.02 0.00 -1.16 -5.04 105.19 99.62 3hpn n GLY 84 Ca 0.00 0.45 -0.17 0.00 0.00 0.00 0.00 46.02 46.30 3hpn n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hpn n ALA 85 N 0.00 -2.70 0.30 4.61 0.00 -1.26 -4.89 120.51 116.57 3hpn n ALA 85 Ca 0.00 -0.19 0.15 0.00 0.00 0.00 0.00 53.44 53.40 3hpn n ALA 85 Cb 0.00 -1.14 0.50 0.00 0.00 0.00 0.00 19.45 18.81 3hpn n ALA 85 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3hpn h SER 86 N -0.14 0.00 -0.56 0.00 4.64 -1.95 -2.88 113.55 112.66 3hpn h SER 86 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 3hpn h SER 86 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3hpn h SER 86 CO 0.35 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.77 3hpn n SER 87 N -2.95 3.42 -4.77 4.97 3.41 -1.26 -4.97 113.62 111.48 3hpn n SER 87 Ca 0.02 -1.98 -0.39 0.00 -0.26 0.00 0.00 58.87 56.26 3hpn n SER 87 Cb 0.37 -0.37 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 3hpn n SER 87 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hpn s LYS 89 N -2.00 1.83 -0.18 0.00 -0.14 0.16 -4.95 119.74 114.47 3hpn s LYS 89 Ca 0.52 -1.75 0.15 0.00 -1.36 0.00 0.00 55.97 53.53 3hpn s LYS 89 Cb -0.30 -1.83 0.38 0.00 -1.68 0.00 0.00 37.83 34.40 3hpn s LYS 89 CO 0.38 0.28 1.23 0.39 -0.76 0.00 0.00 175.35 176.87 3hpn n GLU 90 N -0.72 1.57 -4.19 1.68 1.02 -1.26 -4.12 120.64 114.62 3hpn n GLU 90 Ca -0.05 -2.94 -0.12 0.00 -0.02 0.00 0.00 57.16 54.03 3hpn n GLU 90 Cb 0.61 -1.60 -0.10 0.00 -0.02 0.00 0.00 31.44 30.33 3hpn n GLU 90 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3hpn s THR 91 N -3.05 0.44 0.24 2.62 -4.23 -1.26 -4.30 115.64 106.10 3hpn s THR 91 Ca 0.36 -1.94 0.01 0.00 -1.18 0.00 0.00 61.69 58.94 3hpn s THR 91 Cb 0.33 -2.03 -0.04 0.00 1.34 0.00 0.00 72.50 72.10 3hpn s THR 91 CO -0.01 -0.53 0.15 0.72 -0.54 0.00 0.00 174.62 174.41 3hpn s PHE 92 N -3.81 1.36 0.03 3.99 -0.12 -0.79 -4.57 117.98 114.07 3hpn s PHE 92 Ca 0.22 -1.39 0.06 0.00 -0.05 0.00 0.00 56.93 55.77 3hpn s PHE 92 Cb 0.07 -0.67 -0.03 0.00 -0.63 0.00 0.00 43.02 41.75 3hpn s PHE 92 CO 0.02 -0.61 -0.14 -0.80 -0.05 0.00 0.00 175.22 173.64 3hpn s ASN 93 N -3.24 4.10 -0.17 1.98 0.01 -0.58 0.46 114.94 117.50 3hpn s ASN 93 Ca 0.39 -0.32 -0.04 0.00 -0.71 0.00 0.00 52.86 52.18 3hpn s ASN 93 Cb 0.06 -0.78 -0.02 0.00 0.41 0.00 0.00 41.25 40.92 3hpn s ASN 93 CO 0.15 0.27 -0.04 -0.22 -1.51 0.00 0.00 177.10 175.75 3hpn s LEU 94 N -1.43 3.14 0.27 0.60 2.96 -0.69 -1.76 118.68 121.76 3hpn s LEU 94 Ca 0.16 -0.21 0.05 0.00 -0.22 0.00 0.00 54.13 53.91 3hpn s LEU 94 Cb -0.11 -1.77 -0.06 0.00 0.50 0.00 0.00 46.19 44.76 3hpn s LEU 94 CO 0.06 0.11 -0.03 -0.31 -1.32 0.00 0.00 176.35 174.86 3hpn s TYR 95 N 0.69 1.82 0.17 5.38 1.51 0.26 0.23 117.35 127.42 3hpn s TYR 95 Ca -0.02 -0.79 -0.13 0.00 -1.01 0.00 0.00 57.07 55.11 3hpn s TYR 95 Cb -0.14 -1.06 0.01 0.00 -0.11 0.00 0.00 41.96 40.65 3hpn s TYR 95 CO 0.02 0.15 0.39 1.52 -1.11 0.00 0.00 175.55 176.52 3hpn s TYR 96 N -3.17 0.12 -0.09 2.71 -0.85 -0.50 -0.00 117.35 115.56 3hpn s TYR 96 Ca 0.30 -0.48 -0.11 0.00 -0.52 0.00 0.00 57.07 56.26 3hpn s TYR 96 Cb 0.05 0.16 0.03 0.00 0.38 0.00 0.00 41.96 42.57 3hpn s TYR 96 CO 0.11 -0.79 0.29 0.00 -1.52 0.00 0.00 175.55 173.64 3hpn s ALA 97 N -3.91 -0.73 0.04 9.51 0.00 -0.65 -0.15 121.76 125.88 3hpn s ALA 97 Ca 0.12 0.73 0.00 0.00 0.00 0.00 0.00 51.96 52.82 3hpn s ALA 97 Cb 0.01 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 3hpn s ALA 97 CO -0.03 -0.16 0.16 -1.21 0.00 0.00 0.00 175.76 174.52 3hpn s GLU 98 N -0.10 3.27 0.08 0.00 2.02 -1.26 -0.43 118.70 122.27 3hpn s GLU 98 Ca -0.02 -0.48 -0.26 0.00 0.02 0.00 0.00 54.97 54.23 3hpn s GLU 98 Cb -0.03 -2.96 0.07 0.00 0.10 0.00 0.00 34.13 31.31 3hpn s GLU 98 CO 0.01 0.62 0.63 -1.54 0.02 0.00 0.00 175.26 175.00 3hpn s SER 99 N -2.29 -0.60 0.00 -0.19 1.04 -0.75 -4.96 113.70 105.95 3hpn s SER 99 Ca 0.31 0.28 0.28 0.00 0.48 0.00 0.00 55.95 57.30 3hpn s SER 99 Cb -0.13 0.58 1.09 0.00 0.10 0.00 0.00 66.02 67.66 3hpn s SER 99 CO 0.23 -0.83 1.77 0.47 0.98 0.00 0.00 173.24 175.87 3hpn n ASP 100 N 0.12 0.81 -3.86 7.02 8.00 -1.26 -1.02 116.55 126.36 3hpn n ASP 100 Ca -0.18 -0.88 -0.11 0.00 0.71 0.00 0.00 54.79 54.33 3hpn n ASP 100 Cb 0.62 0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.64 3hpn n ASP 100 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 3hpn s LEU 101 N -2.36 1.42 -0.05 0.64 2.34 -1.26 -4.74 118.68 114.67 3hpn s LEU 101 Ca 0.31 -0.34 -0.30 0.00 0.06 0.00 0.00 54.13 53.86 3hpn s LEU 101 Cb 0.20 0.89 -0.03 0.00 -0.56 0.00 0.00 46.19 46.69 3hpn s LEU 101 CO 0.45 -0.52 1.22 -0.62 -1.06 0.00 0.00 176.35 175.83 3hpn s ASP 102 N -1.95 7.03 0.11 1.48 -1.08 -1.26 -4.93 116.67 116.07 3hpn s ASP 102 Ca -0.07 1.84 0.24 0.00 -0.52 0.00 0.00 52.55 54.03 3hpn s ASP 102 Cb -0.02 -2.56 0.92 0.00 -1.46 0.00 0.00 42.92 39.80 3hpn s ASP 102 CO -0.03 -0.60 1.73 -1.22 0.52 0.00 0.00 175.17 175.57 3hpn n TYR 103 N 5.27 0.42 0.00 -5.34 4.01 -1.26 -5.00 117.16 115.26 3hpn n TYR 103 Ca 0.11 0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.99 3hpn n TYR 103 Cb 0.46 -0.73 0.00 0.00 -0.31 0.00 0.00 39.34 38.76 3hpn n TYR 103 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hpn n GLY 104 N 0.75 3.82 0.77 2.72 0.00 -1.26 -2.36 105.19 109.63 3hpn n GLY 104 Ca 0.05 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.15 3hpn n GLY 104 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hpn n THR 105 N 0.00 0.29 -2.72 2.61 -2.24 -1.26 -4.71 114.28 106.25 3hpn n THR 105 Ca 0.00 -0.48 -0.43 0.00 -2.27 0.00 0.00 64.05 60.87 3hpn n THR 105 Cb 0.00 0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 68.84 3hpn n THR 105 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3hpn s ASN 106 N -1.56 6.80 -0.08 3.42 3.04 -0.99 -4.98 114.94 120.59 3hpn s ASN 106 Ca 0.34 -2.34 -0.15 0.00 0.04 0.00 0.00 52.86 50.75 3hpn s ASN 106 Cb 0.19 -2.50 -0.05 0.00 -1.54 0.00 0.00 41.25 37.35 3hpn s ASN 106 CO 0.28 -1.11 0.38 0.12 -3.04 0.00 0.00 177.10 173.73 3hpn s PHE 107 N 3.46 3.59 -0.12 0.43 5.36 -1.26 -4.89 117.98 124.54 3hpn s PHE 107 Ca 0.46 0.83 -0.03 0.00 -0.96 0.00 0.00 56.93 57.24 3hpn s PHE 107 Cb 0.00 -2.36 0.05 0.00 -0.34 0.00 0.00 43.02 40.37 3hpn s PHE 107 CO -0.00 0.40 0.05 -0.65 -1.46 0.00 0.00 175.22 173.56 3hpn s GLN 108 N -0.17 0.32 0.29 10.12 -0.21 -1.26 -5.03 119.66 123.72 3hpn s GLN 108 Ca 0.22 -0.02 0.02 0.00 0.02 0.00 0.00 55.36 55.61 3hpn s GLN 108 Cb -0.15 -1.39 0.74 0.00 1.00 0.00 0.00 33.01 33.20 3hpn s GLN 108 CO 0.09 -0.49 1.62 0.87 -2.12 0.00 0.00 175.29 175.26 3hpn h LYS 109 N 8.36 0.13 0.00 2.91 1.57 -1.98 -1.31 116.57 126.25 3hpn h LYS 109 Ca -0.16 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 3hpn h LYS 109 Cb 1.13 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 3hpn h LYS 109 CO 0.26 0.08 -0.08 0.00 -0.57 0.00 0.00 179.45 179.14 3hpn h ARG 110 N 0.13 0.00 0.00 3.15 3.08 -2.03 -1.97 114.38 116.75 3hpn h ARG 110 Ca 0.57 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.62 3hpn h ARG 110 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 3hpn h ARG 110 CO -0.73 0.08 0.00 1.28 -1.07 0.00 0.00 179.97 179.53 3hpn n LEU 111 N -3.54 0.25 -4.88 3.04 4.77 -0.49 -4.86 117.00 111.29 3hpn n LEU 111 Ca -0.02 0.53 -0.34 0.00 -0.03 0.00 0.00 56.01 56.16 3hpn n LEU 111 Cb 0.21 -0.46 -0.05 0.00 -2.33 0.00 0.00 43.42 40.79 3hpn n LEU 111 CO 0.28 -0.12 0.02 -0.36 -1.33 0.00 0.00 177.39 175.89 3hpn s PHE 112 N -3.05 3.55 -0.13 -1.77 0.40 -0.74 -4.73 117.98 111.51 3hpn s PHE 112 Ca 0.11 0.66 -0.04 0.00 -0.60 0.00 0.00 56.93 57.06 3hpn s PHE 112 Cb 0.15 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.58 3hpn s PHE 112 CO 0.50 0.52 0.01 0.99 0.70 0.00 0.00 175.22 177.94 3hpn s THR 113 N -1.44 4.35 0.20 0.64 2.01 0.79 -4.91 115.64 117.27 3hpn s THR 113 Ca 0.34 -0.21 -0.30 0.00 0.31 0.00 0.00 61.69 61.82 3hpn s THR 113 Cb -0.13 -2.88 -0.09 0.00 0.01 0.00 0.00 72.50 69.41 3hpn s THR 113 CO 0.19 0.54 1.32 -0.75 -0.69 0.00 0.00 174.62 175.23 3hpn s LYS 114 N -0.26 4.38 -0.14 4.92 2.20 -1.26 -1.41 119.74 128.16 3hpn s LYS 114 Ca 0.06 2.07 -0.11 0.00 -0.36 0.00 0.00 55.97 57.63 3hpn s LYS 114 Cb -0.12 -3.19 -0.07 0.00 -1.51 0.00 0.00 37.83 32.94 3hpn s LYS 114 CO 0.02 -0.27 -0.01 0.82 -0.36 0.00 0.00 175.35 175.56 3hpn h ILE 115 N 3.75 0.29 -1.71 5.43 2.04 -0.56 -3.48 117.51 123.27 3hpn h ILE 115 Ca -0.45 -1.30 0.14 0.00 1.00 0.00 0.00 64.86 64.25 3hpn h ILE 115 Cb 1.21 0.63 -0.20 0.00 -0.74 0.00 0.00 36.82 37.72 3hpn h ILE 115 CO 0.77 0.10 0.62 -0.62 0.00 0.00 0.00 178.15 179.03 3hpn s ASP 116 N -5.93 -0.29 -0.04 1.72 3.68 -1.20 -5.03 116.67 109.59 3hpn s ASP 116 Ca -0.14 0.16 -0.30 0.00 2.13 0.00 0.00 52.55 54.40 3hpn s ASP 116 Cb 0.02 0.27 -0.04 0.00 -1.45 0.00 0.00 42.92 41.71 3hpn s ASP 116 CO 0.27 -0.37 1.35 -0.89 0.13 0.00 0.00 175.17 175.65 3hpn s THR 117 N -1.98 3.91 -0.22 1.71 2.01 -1.26 -1.70 115.64 118.11 3hpn s THR 117 Ca 0.04 1.25 -0.14 0.00 0.31 0.00 0.00 61.69 63.14 3hpn s THR 117 Cb -0.01 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 3hpn s THR 117 CO -0.04 -0.02 0.33 -0.63 -0.69 0.00 0.00 174.62 173.57 3hpn s ILE 118 N 2.58 5.24 -0.02 1.82 -1.09 0.17 -4.98 121.20 124.92 3hpn s ILE 118 Ca 0.61 0.56 0.03 0.00 -2.23 0.00 0.00 60.65 59.62 3hpn s ILE 118 Cb -0.29 -3.67 -0.00 0.00 -1.58 0.00 0.00 42.46 36.93 3hpn s ILE 118 CO 0.24 0.27 -0.12 0.00 -1.23 0.00 0.00 174.94 174.10 3hpn s ALA 119 N 1.30 1.06 0.11 9.38 0.00 -1.26 -1.88 121.76 130.47 3hpn s ALA 119 Ca 0.16 -0.47 -0.30 0.00 0.00 0.00 0.00 51.96 51.34 3hpn s ALA 119 Cb -0.14 -0.34 -0.06 0.00 0.00 0.00 0.00 23.12 22.57 3hpn s ALA 119 CO 0.07 0.20 1.17 -1.25 0.00 0.00 0.00 175.76 175.96 3hpn s PRO 120 N 0.01 4.48 0.25 0.00 0.04 -1.26 -4.91 135.00 133.61 3hpn s PRO 120 Ca -0.01 1.77 -0.06 0.00 0.04 0.00 0.00 61.00 62.74 3hpn s PRO 120 Cb -0.08 -3.32 0.28 0.00 0.04 0.00 0.00 34.50 31.43 3hpn s PRO 120 CO 0.01 -0.15 1.91 -0.44 0.04 0.00 0.00 177.00 178.36 3hpn h ASP 121 N 6.16 1.07 -3.47 6.66 3.45 -1.98 -3.42 116.42 124.89 3hpn h ASP 121 Ca -0.43 -0.02 -0.58 0.00 0.43 0.00 0.00 57.03 56.44 3hpn h ASP 121 Cb 1.21 -0.25 -0.39 0.00 -0.56 0.00 0.00 39.33 39.34 3hpn h ASP 121 CO 0.78 0.75 -0.77 -1.61 -1.57 0.00 0.00 179.24 176.81 3hpn s GLU 122 N -6.10 1.20 0.40 3.56 0.41 -1.26 -5.11 118.70 111.79 3hpn s GLU 122 Ca -0.13 -0.82 -0.24 0.00 -0.41 0.00 0.00 54.97 53.37 3hpn s GLU 122 Cb 0.18 -2.39 -0.09 0.00 -1.78 0.00 0.00 34.13 30.05 3hpn s GLU 122 CO 0.81 -0.66 1.03 0.42 -0.49 0.00 0.00 175.26 176.37 3hpn s ILE 123 N 1.56 3.84 -0.37 -1.63 1.09 -1.26 -4.65 121.20 119.78 3hpn s ILE 123 Ca -0.02 1.39 -0.20 0.00 -1.10 0.00 0.00 60.65 60.71 3hpn s ILE 123 Cb -0.18 -3.71 0.01 0.00 -1.06 0.00 0.00 42.46 37.52 3hpn s ILE 123 CO -0.08 -0.01 0.63 -0.89 -0.10 0.00 0.00 174.94 174.48 3hpn s THR 124 N -1.71 4.88 0.60 2.92 2.01 -0.34 -4.84 115.64 119.17 3hpn s THR 124 Ca 0.58 0.50 -0.09 0.00 0.31 0.00 0.00 61.69 62.99 3hpn s THR 124 Cb -0.20 -4.09 -0.02 0.00 0.01 0.00 0.00 72.50 68.20 3hpn s THR 124 CO 0.25 -0.35 0.96 0.68 -0.69 0.00 0.00 174.62 175.47 3hpn s VAL 125 N 2.71 4.24 0.30 3.82 -7.23 -1.26 -1.43 120.40 121.55 3hpn s VAL 125 Ca 0.24 0.43 0.04 0.00 -1.81 0.00 0.00 61.98 60.88 3hpn s VAL 125 Cb -0.14 -3.69 0.35 0.00 0.56 0.00 0.00 36.38 33.46 3hpn s VAL 125 CO 0.15 -0.81 1.61 -1.28 -0.31 0.00 0.00 175.10 174.46 3hpn h SER 126 N -0.24 -0.17 1.53 4.85 0.87 -1.93 -1.14 113.55 117.33 3hpn h SER 126 Ca -0.45 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 3hpn h SER 126 Cb 1.22 0.36 0.00 0.00 -0.44 0.00 0.00 62.40 63.54 3hpn h SER 126 CO 0.62 -0.27 0.00 0.77 -0.53 0.00 0.00 176.83 177.42 3hpn h SER 127 N 0.10 0.00 -0.61 6.23 4.64 -2.02 -3.27 113.55 118.62 3hpn h SER 127 Ca 0.60 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.91 3hpn h SER 127 Cb 1.28 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.34 3hpn h SER 127 CO -0.78 0.00 0.35 0.44 -0.87 0.00 0.00 176.83 175.97 3hpn h ASP 128 N 0.00 0.76 -0.16 4.97 3.45 -1.53 -1.64 116.42 122.27 3hpn h ASP 128 Ca 0.00 -0.05 -0.00 0.00 0.43 0.00 0.00 57.03 57.41 3hpn h ASP 128 Cb 0.77 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 39.34 3hpn h ASP 128 CO 0.00 0.61 0.09 -0.26 -1.57 0.00 0.00 179.24 178.11 3hpn h PHE 129 N 0.86 0.21 0.00 4.55 -1.00 -1.66 0.12 116.94 120.04 3hpn h PHE 129 Ca 0.22 -0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.88 3hpn h PHE 129 Cb 0.01 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 39.49 3hpn h PHE 129 CO 0.00 0.19 -0.58 0.93 -1.61 0.00 0.00 178.31 177.25 3hpn h GLU 130 N 0.17 0.00 0.00 1.51 5.08 -1.74 -2.47 114.58 117.13 3hpn h GLU 130 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3hpn h GLU 130 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3hpn h GLU 130 CO -0.01 0.58 0.00 0.00 -1.00 0.00 0.00 179.01 178.58 3hpn n ALA 131 N -2.37 2.19 -3.36 3.43 0.00 -0.62 -4.89 120.51 114.89 3hpn n ALA 131 Ca -0.01 -0.11 -0.24 0.00 0.00 0.00 0.00 53.44 53.08 3hpn n ALA 131 Cb 0.62 -1.37 0.05 0.00 0.00 0.00 0.00 19.45 18.75 3hpn n ALA 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hpn n ARG 132 N -1.26 -6.20 -2.08 0.00 3.00 -0.31 -4.88 116.66 104.93 3hpn n ARG 132 Ca 0.11 0.83 -0.24 0.00 -0.01 0.00 0.00 57.85 58.54 3hpn n ARG 132 Cb 0.17 -5.77 0.02 0.00 0.00 0.00 0.00 32.46 26.88 3hpn n ARG 132 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 3hpn n HIS 133 N -4.72 2.79 -1.99 -1.55 -0.00 0.28 -5.04 115.22 105.00 3hpn n HIS 133 Ca -0.04 -2.31 -0.42 0.00 0.46 0.00 0.00 57.72 55.41 3hpn n HIS 133 Cb 0.58 -0.31 -0.03 0.00 -0.12 0.00 0.00 29.99 30.12 3hpn n HIS 133 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 3hpn s VAL 134 N -4.68 2.66 -0.34 3.57 1.01 -1.25 -4.83 120.40 116.53 3hpn s VAL 134 Ca 0.50 0.52 -0.14 0.00 0.00 0.00 0.00 61.98 62.86 3hpn s VAL 134 Cb 0.41 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.44 3hpn s VAL 134 CO 0.01 0.07 0.31 -0.54 0.00 0.00 0.00 175.10 174.95 3hpn s LYS 135 N 0.17 3.52 -0.28 2.72 1.02 -1.26 -5.03 119.74 120.60 3hpn s LYS 135 Ca 0.63 -0.53 -0.19 0.00 0.02 0.00 0.00 55.97 55.89 3hpn s LYS 135 Cb -0.42 -3.81 -0.02 0.00 -0.52 0.00 0.00 37.83 33.06 3hpn s LYS 135 CO 0.39 -0.49 0.59 -1.17 -0.92 0.00 0.00 175.35 173.74 3hpn s LEU 136 N 1.88 4.10 0.01 3.17 2.96 -1.26 -4.41 118.68 125.12 3hpn s LEU 136 Ca 0.09 0.52 -0.08 0.00 -0.22 0.00 0.00 54.13 54.44 3hpn s LEU 136 Cb -0.17 -2.77 -0.05 0.00 0.50 0.00 0.00 46.19 43.71 3hpn s LEU 136 CO 0.11 -0.38 0.29 0.20 -1.32 0.00 0.00 176.35 175.25 3hpn s ASN 137 N 1.57 6.54 -0.10 3.68 0.01 0.61 -4.93 114.94 122.31 3hpn s ASN 137 Ca 0.24 0.62 0.04 0.00 -0.71 0.00 0.00 52.86 53.05 3hpn s ASN 137 Cb -0.15 -2.11 -0.00 0.00 0.41 0.00 0.00 41.25 39.39 3hpn s ASN 137 CO 0.10 0.26 -0.23 -0.69 -1.51 0.00 0.00 177.10 175.02 3hpn s VAL 138 N -1.28 2.14 -0.03 1.60 1.01 -1.26 -1.73 120.40 120.85 3hpn s VAL 138 Ca 0.27 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 3hpn s VAL 138 Cb -0.13 -1.82 0.03 0.00 0.00 0.00 0.00 36.38 34.45 3hpn s VAL 138 CO 0.15 0.56 0.03 -1.61 0.00 0.00 0.00 175.10 174.23 3hpn s GLU 139 N 0.35 0.11 -0.07 2.72 0.41 0.09 -4.98 118.70 117.31 3hpn s GLU 139 Ca -0.18 0.20 0.01 0.00 -0.41 0.00 0.00 54.97 54.60 3hpn s GLU 139 Cb -0.18 -0.46 -0.03 0.00 -1.78 0.00 0.00 34.13 31.69 3hpn s GLU 139 CO 0.09 -0.22 -0.10 -2.00 -0.49 0.00 0.00 175.26 172.54 3hpn s GLU 140 N 1.45 2.77 0.25 1.61 2.12 -1.26 -0.60 118.70 125.03 3hpn s GLU 140 Ca -0.04 -0.61 0.03 0.00 0.36 0.00 0.00 54.97 54.71 3hpn s GLU 140 Cb -0.13 -2.54 -0.05 0.00 0.26 0.00 0.00 34.13 31.67 3hpn s GLU 140 CO -0.03 0.59 0.04 1.03 -0.54 0.00 0.00 175.26 176.35 3hpn s ARG 141 N -0.62 1.38 0.03 4.30 1.81 -0.18 -4.96 118.95 120.71 3hpn s ARG 141 Ca 0.09 -1.72 -0.01 0.00 -1.72 0.00 0.00 55.73 52.36 3hpn s ARG 141 Cb -0.11 -0.51 -0.02 0.00 -0.45 0.00 0.00 34.95 33.86 3hpn s ARG 141 CO 0.02 -0.18 -0.00 -1.54 -0.68 0.00 0.00 175.30 172.92 3hpn s SER 142 N -3.32 0.30 0.02 0.23 1.04 -1.26 0.29 113.70 111.00 3hpn s SER 142 Ca 0.32 -0.64 0.01 0.00 0.48 0.00 0.00 55.95 56.11 3hpn s SER 142 Cb 0.07 0.15 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 3hpn s SER 142 CO 0.11 -0.43 -0.03 -0.69 0.98 0.00 0.00 173.24 173.18 3hpn s VAL 143 N -2.37 0.19 0.00 5.02 1.01 -0.78 -4.99 120.40 118.48 3hpn s VAL 143 Ca -0.07 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.21 3hpn s VAL 143 Cb -0.03 -0.28 0.00 0.00 0.00 0.00 0.00 36.38 36.07 3hpn s VAL 143 CO -0.04 -0.32 0.00 0.61 0.00 0.00 0.00 175.10 175.35 3hpn n GLY 144 N 2.00 1.79 3.72 4.51 0.00 -1.26 -1.52 105.19 114.43 3hpn n GLY 144 Ca -0.20 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.31 3hpn n GLY 144 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hpn s PRO 145 N -2.00 4.62 0.37 1.61 0.04 -1.26 -5.04 135.00 133.35 3hpn s PRO 145 Ca 0.00 1.50 -0.25 0.00 0.04 0.00 0.00 61.00 62.29 3hpn s PRO 145 Cb 0.00 -3.39 -0.09 0.00 0.04 0.00 0.00 34.50 31.06 3hpn s PRO 145 CO 0.00 0.08 1.04 -0.51 0.04 0.00 0.00 177.00 177.65 3hpn s LEU 146 N 0.33 4.22 0.00 -3.56 1.43 0.52 -4.98 118.68 116.64 3hpn s LEU 146 Ca 0.50 2.03 0.00 0.00 -1.03 0.00 0.00 54.13 55.63 3hpn s LEU 146 Cb -0.24 -4.09 0.00 0.00 0.03 0.00 0.00 46.19 41.89 3hpn s LEU 146 CO 0.30 -0.38 0.00 0.35 0.23 0.00 0.00 176.35 176.85 3hpn n THR 147 N 0.19 0.00 -2.30 5.49 -2.24 -1.26 -4.67 114.28 109.49 3hpn n THR 147 Ca 0.04 -0.07 -0.26 0.00 -2.27 0.00 0.00 64.05 61.49 3hpn n THR 147 Cb 0.49 0.60 0.11 0.00 -2.10 0.00 0.00 70.33 69.43 3hpn n THR 147 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3hpn s ARG 148 N -0.40 1.67 0.27 -0.78 1.81 -1.26 -4.98 118.95 115.28 3hpn s ARG 148 Ca 0.00 -0.62 0.01 0.00 -1.72 0.00 0.00 55.73 53.41 3hpn s ARG 148 Cb 0.00 -2.17 0.36 0.00 -0.45 0.00 0.00 34.95 32.70 3hpn s ARG 148 CO 0.00 -1.55 1.70 -0.22 -0.68 0.00 0.00 175.30 174.55 3hpn h LYS 149 N -0.78 0.53 -4.35 3.54 3.64 -1.85 -3.41 116.57 113.89 3hpn h LYS 149 Ca -0.42 -0.21 -0.34 0.00 -1.27 0.00 0.00 60.65 58.42 3hpn h LYS 149 Cb 1.28 -0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 32.98 3hpn h LYS 149 CO 0.48 0.74 -0.27 0.20 -2.27 0.00 0.00 179.45 178.33 3hpn s GLY 150 N -3.98 1.78 0.21 5.01 0.00 -0.19 -0.93 107.32 109.21 3hpn s GLY 150 Ca -0.07 -1.70 -0.20 0.00 0.00 0.00 0.00 44.72 42.74 3hpn s GLY 150 CO 0.80 -1.14 0.61 -0.11 0.00 0.00 0.00 173.10 173.26 3hpn s PHE 151 N -3.09 -0.26 0.09 1.90 -0.12 0.84 -1.81 117.98 115.53 3hpn s PHE 151 Ca 0.34 -0.07 0.06 0.00 -0.05 0.00 0.00 56.93 57.20 3hpn s PHE 151 Cb 0.00 0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 42.90 3hpn s PHE 151 CO 0.23 -1.00 -0.17 0.71 -0.05 0.00 0.00 175.22 174.95 3hpn s TYR 152 N -3.85 1.44 0.03 3.49 1.51 0.42 -1.20 117.35 119.20 3hpn s TYR 152 Ca 0.07 -0.45 0.03 0.00 -1.01 0.00 0.00 57.07 55.72 3hpn s TYR 152 Cb -0.03 -0.80 -0.04 0.00 -0.11 0.00 0.00 41.96 40.99 3hpn s TYR 152 CO -0.03 0.12 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.99 3hpn s LEU 153 N -1.84 3.36 0.05 -1.29 1.02 -1.26 -1.63 118.68 117.08 3hpn s LEU 153 Ca 0.02 -0.12 0.01 0.00 0.02 0.00 0.00 54.13 54.06 3hpn s LEU 153 Cb -0.10 -1.98 -0.03 0.00 0.02 0.00 0.00 46.19 44.10 3hpn s LEU 153 CO 0.03 0.25 -0.05 0.00 0.02 0.00 0.00 176.35 176.60 3hpn s ALA 154 N -1.12 0.52 -0.14 4.21 0.00 1.00 -1.61 121.76 124.62 3hpn s ALA 154 Ca 0.20 -0.93 0.01 0.00 0.00 0.00 0.00 51.96 51.24 3hpn s ALA 154 Cb -0.11 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.17 3hpn s ALA 154 CO 0.12 -0.18 -0.14 -0.06 0.00 0.00 0.00 175.76 175.49 3hpn s PHE 155 N -2.42 2.14 -0.26 0.00 0.40 0.11 -0.58 117.98 117.38 3hpn s PHE 155 Ca -0.03 -1.17 -0.10 0.00 -0.60 0.00 0.00 56.93 55.02 3hpn s PHE 155 Cb -0.03 -1.57 -0.05 0.00 0.51 0.00 0.00 43.02 41.88 3hpn s PHE 155 CO -0.03 -0.63 0.16 -1.14 0.70 0.00 0.00 175.22 174.28 3hpn s GLN 156 N 1.39 3.98 -0.22 0.44 0.74 -0.72 -0.49 119.66 124.78 3hpn s GLN 156 Ca 0.03 -0.31 -0.13 0.00 0.05 0.00 0.00 55.36 55.00 3hpn s GLN 156 Cb -0.13 -3.56 -0.05 0.00 1.10 0.00 0.00 33.01 30.37 3hpn s GLN 156 CO -0.09 -0.05 0.26 0.34 -0.55 0.00 0.00 175.29 175.20 3hpn s ASP 157 N 1.38 6.27 0.00 6.67 -1.08 0.15 -1.53 116.67 128.53 3hpn s ASP 157 Ca 0.07 0.31 0.20 0.00 -0.52 0.00 0.00 52.55 52.60 3hpn s ASP 157 Cb -0.15 -2.16 0.27 0.00 -1.46 0.00 0.00 42.92 39.42 3hpn s ASP 157 CO 0.07 0.02 1.22 2.30 0.52 0.00 0.00 175.17 179.30 3hpn n ILE 158 N 4.22 0.29 0.00 4.11 -5.35 -1.26 -1.16 119.36 120.20 3hpn n ILE 158 Ca -0.12 -0.64 0.00 0.00 -0.27 0.00 0.00 62.75 61.72 3hpn n ILE 158 Cb 0.52 1.15 0.00 0.00 -1.74 0.00 0.00 39.64 39.57 3hpn n ILE 158 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hpn n GLY 159 N 1.17 0.88 4.01 3.28 0.00 -1.26 -4.09 105.19 109.17 3hpn n GLY 159 Ca 0.14 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 3hpn n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hpn s ALA 160 N -0.90 4.48 -0.62 4.61 0.00 -1.26 -0.66 121.76 127.42 3hpn s ALA 160 Ca 0.00 -1.71 -0.07 0.00 0.00 0.00 0.00 51.96 50.18 3hpn s ALA 160 Cb 0.00 -1.65 0.16 0.00 0.00 0.00 0.00 23.12 21.63 3hpn s ALA 160 CO 0.00 -0.43 0.48 0.00 0.00 0.00 0.00 175.76 175.80 3hpn s VAL 162 N 0.45 2.57 -0.26 0.00 1.01 -0.57 -0.90 120.40 122.70 3hpn s VAL 162 Ca 0.14 -0.90 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 3hpn s VAL 162 Cb -0.20 -1.97 0.03 0.00 0.00 0.00 0.00 36.38 34.24 3hpn s VAL 162 CO -0.04 0.58 -0.05 0.00 0.00 0.00 0.00 175.10 175.59 3hpn s ALA 163 N -0.44 2.73 -0.50 5.51 0.00 -0.29 -2.00 121.76 126.76 3hpn s ALA 163 Ca 0.05 -1.51 -0.20 0.00 0.00 0.00 0.00 51.96 50.30 3hpn s ALA 163 Cb -0.12 -1.74 0.05 0.00 0.00 0.00 0.00 23.12 21.32 3hpn s ALA 163 CO 0.01 -0.89 0.65 -1.17 0.00 0.00 0.00 175.76 174.36 3hpn s LEU 164 N 1.31 4.87 0.13 0.00 2.96 0.12 -1.52 118.68 126.56 3hpn s LEU 164 Ca -0.01 -0.83 0.22 0.00 -0.22 0.00 0.00 54.13 53.29 3hpn s LEU 164 Cb -0.17 -2.49 -0.10 0.00 0.50 0.00 0.00 46.19 43.93 3hpn s LEU 164 CO -0.04 -0.91 0.87 0.18 -1.32 0.00 0.00 176.35 175.14 3hpn n LEU 165 N 6.27 0.61 -3.66 -0.68 7.99 0.59 -1.07 117.00 127.05 3hpn n LEU 165 Ca -0.06 0.24 -0.12 0.00 -0.01 0.00 0.00 56.01 56.07 3hpn n LEU 165 Cb 0.46 -0.03 -0.08 0.00 -0.11 0.00 0.00 43.42 43.65 3hpn n LEU 165 CO 0.55 -0.12 0.31 -0.55 -1.51 0.00 0.00 177.39 176.06 3hpn s SER 166 N -5.15 -0.72 -0.19 -1.43 0.15 -0.97 -4.58 113.70 100.80 3hpn s SER 166 Ca -0.03 1.30 -0.05 0.00 0.70 0.00 0.00 55.95 57.88 3hpn s SER 166 Cb 0.11 1.27 0.07 0.00 -1.71 0.00 0.00 66.02 65.76 3hpn s SER 166 CO 0.82 -0.22 0.12 -0.69 1.20 0.00 0.00 173.24 174.47 3hpn s VAL 167 N 0.80 -0.14 -0.11 4.45 1.01 -1.26 -1.58 120.40 123.57 3hpn s VAL 167 Ca -0.04 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.74 3hpn s VAL 167 Cb -0.05 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.71 3hpn s VAL 167 CO -0.06 -0.31 -0.15 -0.60 0.00 0.00 0.00 175.10 173.98 3hpn s ARG 168 N 2.17 2.21 -0.11 2.72 3.52 0.30 -1.10 118.95 128.65 3hpn s ARG 168 Ca 0.04 -0.55 0.03 0.00 -0.13 0.00 0.00 55.73 55.11 3hpn s ARG 168 Cb -0.16 -1.89 0.01 0.00 -1.56 0.00 0.00 34.95 31.35 3hpn s ARG 168 CO -0.13 -0.08 -0.21 0.08 -0.81 0.00 0.00 175.30 174.16 3hpn s VAL 169 N 1.03 1.90 0.16 7.11 1.01 0.23 0.90 120.40 132.73 3hpn s VAL 169 Ca -0.06 -0.91 -0.14 0.00 0.00 0.00 0.00 61.98 60.88 3hpn s VAL 169 Cb -0.15 -1.67 0.02 0.00 0.00 0.00 0.00 36.38 34.58 3hpn s VAL 169 CO -0.02 0.52 0.39 -0.72 0.00 0.00 0.00 175.10 175.27 3hpn s TYR 170 N 0.62 0.02 0.17 5.22 -0.85 -0.03 -0.15 117.35 122.34 3hpn s TYR 170 Ca -0.13 -0.37 0.04 0.00 -0.52 0.00 0.00 57.07 56.09 3hpn s TYR 170 Cb -0.17 0.19 -0.05 0.00 0.38 0.00 0.00 41.96 42.32 3hpn s TYR 170 CO 0.03 -0.77 -0.06 1.52 -1.52 0.00 0.00 175.55 174.75 3hpn s TYR 171 N -3.88 1.32 -0.20 -3.49 -0.85 -0.49 0.11 117.35 109.86 3hpn s TYR 171 Ca 0.09 -0.83 -0.18 0.00 -0.52 0.00 0.00 57.07 55.63 3hpn s TYR 171 Cb 0.01 -0.71 -0.03 0.00 0.38 0.00 0.00 41.96 41.61 3hpn s TYR 171 CO -0.05 0.01 0.48 0.15 -1.52 0.00 0.00 175.55 174.62 3hpn s LYS 172 N -3.80 4.18 -0.11 -3.49 1.02 -1.26 -1.53 119.74 114.75 3hpn s LYS 172 Ca 0.20 0.35 0.02 0.00 0.02 0.00 0.00 55.97 56.56 3hpn s LYS 172 Cb 0.04 -3.56 0.01 0.00 -0.52 0.00 0.00 37.83 33.80 3hpn s LYS 172 CO 0.03 -0.13 -0.16 0.21 -0.92 0.00 0.00 175.35 174.38 3hpn s LYS 173 N 1.58 2.29 0.00 1.68 2.20 -1.26 -5.00 119.74 121.23 3hpn s LYS 173 Ca 0.22 -0.59 0.00 0.00 -0.36 0.00 0.00 55.97 55.24 3hpn s LYS 173 Cb -0.15 -1.92 0.00 0.00 -1.51 0.00 0.00 37.83 34.25 3hpn s LYS 173 CO 0.09 -0.04 0.00 0.00 -0.36 0.00 0.00 175.35 175.05