#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hzm s ILE 2 N 0.00 1.24 -0.99 2.02 -0.00 -1.26 -5.07 121.20 117.13 1hzm s ILE 2 Ca 0.00 -0.55 -0.23 0.00 -0.00 0.00 0.00 60.65 59.86 1hzm s ILE 2 Cb 0.00 -1.11 0.05 0.00 -0.00 0.00 0.00 42.46 41.39 1hzm s ILE 2 CO 0.00 0.38 1.44 -1.81 -0.00 0.00 0.00 174.94 174.94 1hzm s ASP 3 N 0.54 6.46 -1.04 4.36 1.11 -1.26 -3.80 116.67 123.03 1hzm s ASP 3 Ca -0.13 -1.34 -0.04 0.00 0.18 0.00 0.00 52.55 51.22 1hzm s ASP 3 Cb -0.15 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.27 1hzm s ASP 3 CO 0.04 -1.55 0.89 0.41 1.18 0.00 0.00 175.17 176.13 1hzm n THR 4 N 6.84 -3.60 -3.51 -1.27 -1.04 -1.26 -3.97 114.28 106.47 1hzm n THR 4 Ca 0.30 -0.20 -0.37 0.00 -2.04 0.00 0.00 64.05 61.74 1hzm n THR 4 Cb 0.51 -4.01 0.04 0.00 -1.82 0.00 0.00 70.33 65.05 1hzm n THR 4 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1hzm n LEU 5 N -3.85 -2.67 -0.08 -4.42 -0.00 -1.25 -4.95 117.00 99.79 1hzm n LEU 5 Ca -0.11 -0.19 -0.19 0.00 -0.00 0.00 0.00 56.01 55.52 1hzm n LEU 5 Cb 0.59 -1.68 -0.13 0.00 -0.00 0.00 0.00 43.42 42.21 1hzm n LEU 5 CO 0.51 -0.07 -1.12 -1.14 -0.00 0.00 0.00 177.39 175.57 1hzm n ARG 6 N -0.36 0.69 0.00 1.47 0.63 -1.25 -4.81 116.66 113.03 1hzm n ARG 6 Ca -0.10 0.19 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 1hzm n ARG 6 Cb 0.68 -1.60 0.00 0.00 0.45 0.00 0.00 32.46 31.99 1hzm n ARG 6 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1hzm n PRO 7 N -3.31 -1.20 -0.07 -0.14 -0.02 -1.26 -5.03 135.00 123.97 1hzm n PRO 7 Ca -0.39 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 60.96 1hzm n PRO 7 Cb 1.02 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 34.46 1hzm n PRO 7 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1hzm n VAL 8 N -2.61 1.21 0.00 -1.45 0.31 -1.26 -4.71 118.33 109.82 1hzm n VAL 8 Ca 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1hzm n VAL 8 Cb 0.00 -1.92 0.00 0.00 -0.91 0.00 0.00 33.84 31.01 1hzm n VAL 8 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1hzm n PRO 9 N -3.98 1.84 -0.63 5.55 -0.02 -1.26 -4.32 135.00 132.18 1hzm n PRO 9 Ca -0.23 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 60.94 1hzm n PRO 9 Cb 0.55 0.00 0.19 0.00 -0.02 0.00 0.00 33.50 34.22 1hzm n PRO 9 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1hzm n PHE 10 N -0.44 -1.44 -1.56 6.00 1.16 -1.26 -2.49 117.46 117.43 1hzm n PHE 10 Ca 0.00 0.07 -0.19 0.00 -1.87 0.00 0.00 57.45 55.46 1hzm n PHE 10 Cb 0.00 -1.57 -0.08 0.00 -1.61 0.00 0.00 39.48 36.22 1hzm n PHE 10 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1hzm n ALA 11 N -4.57 -0.29 -1.87 1.98 0.00 -1.26 -4.62 120.51 109.88 1hzm n ALA 11 Ca 0.01 0.31 -0.05 0.00 0.00 0.00 0.00 53.44 53.71 1hzm n ALA 11 Cb 0.61 -1.89 -0.04 0.00 0.00 0.00 0.00 19.45 18.13 1hzm n ALA 11 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1hzm n SER 12 N -1.16 -0.69 -0.71 0.00 3.41 -1.04 -4.45 113.62 108.98 1hzm n SER 12 Ca -0.19 -1.37 0.05 0.00 -0.26 0.00 0.00 58.87 57.10 1hzm n SER 12 Cb 0.62 0.21 0.09 0.00 -0.26 0.00 0.00 64.21 64.88 1hzm n SER 12 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1hzm n GLU 13 N -0.04 0.71 -3.82 4.33 2.13 -1.24 -4.52 120.64 118.19 1hzm n GLU 13 Ca -0.19 -2.25 -0.37 0.00 0.66 0.00 0.00 57.16 55.02 1hzm n GLU 13 Cb 0.56 -0.88 -0.13 0.00 0.27 0.00 0.00 31.44 31.26 1hzm n GLU 13 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 1hzm s MET 14 N -1.50 2.54 0.00 5.31 -1.94 -1.26 -4.74 119.30 117.70 1hzm s MET 14 Ca 0.27 -1.22 0.00 0.00 -1.71 0.00 0.00 55.69 53.03 1hzm s MET 14 Cb 0.27 -3.35 0.00 0.00 2.01 0.00 0.00 34.83 33.76 1hzm s MET 14 CO -0.06 -0.65 0.00 0.00 -0.01 0.00 0.00 175.02 174.30 1hzm n ALA 15 N 4.73 0.08 -0.12 3.03 0.00 -1.26 -4.90 120.51 122.08 1hzm n ALA 15 Ca -0.13 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.15 1hzm n ALA 15 Cb 0.44 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.77 1hzm n ALA 15 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1hzm n ILE 16 N -0.74 1.43 -2.70 0.00 -6.64 -1.26 -4.33 119.36 105.12 1hzm n ILE 16 Ca 0.00 -0.61 -0.04 0.00 -1.77 0.00 0.00 62.75 60.33 1hzm n ILE 16 Cb 0.00 -1.21 0.03 0.00 -1.44 0.00 0.00 39.64 37.02 1hzm n ILE 16 CO 0.00 0.00 0.00 -1.20 -1.77 0.00 0.00 176.55 173.58 1hzm n SER 17 N -3.14 -2.10 -0.03 7.28 7.64 -1.26 -1.45 113.62 120.56 1hzm n SER 17 Ca -0.42 -1.64 -0.04 0.00 1.01 0.00 0.00 58.87 57.77 1hzm n SER 17 Cb 1.01 1.07 -0.01 0.00 -1.01 0.00 0.00 64.21 65.27 1hzm n SER 17 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1hzm n LYS 18 N 2.63 0.26 -0.59 1.43 4.01 0.43 -4.19 118.16 122.14 1hzm n LYS 18 Ca 0.13 0.10 0.00 0.00 -0.51 0.00 0.00 58.31 58.03 1hzm n LYS 18 Cb 0.62 -0.92 0.00 0.00 -0.51 0.00 0.00 35.03 34.22 1hzm n LYS 18 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 1hzm n THR 19 N -3.81 0.00 -3.93 -0.18 5.66 -1.08 -1.81 114.28 109.13 1hzm n THR 19 Ca -0.07 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.65 1hzm n THR 19 Cb 0.26 0.00 -0.17 0.00 -1.55 0.00 0.00 70.33 68.87 1hzm n THR 19 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1hzm s VAL 20 N -2.46 1.23 0.07 1.08 1.01 -1.26 -4.48 120.40 115.59 1hzm s VAL 20 Ca 0.00 -0.56 -0.18 0.00 0.00 0.00 0.00 61.98 61.25 1hzm s VAL 20 Cb 0.00 -1.29 0.04 0.00 0.00 0.00 0.00 36.38 35.13 1hzm s VAL 20 CO 0.00 0.28 0.42 0.00 0.00 0.00 0.00 175.10 175.80 1hzm s ALA 21 N 1.60 -1.02 0.00 5.51 0.00 -1.26 -4.46 121.76 122.13 1hzm s ALA 21 Ca 0.03 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.21 1hzm s ALA 21 Cb -0.14 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.46 1hzm s ALA 21 CO -0.09 -0.53 0.00 -2.67 0.00 0.00 0.00 175.76 172.48 1hzm n TRP 22 N 0.23 0.00 -1.35 0.00 2.14 -1.26 -4.59 117.44 112.61 1hzm n TRP 22 Ca -0.18 0.00 0.14 0.00 2.07 0.00 0.00 57.50 59.54 1hzm n TRP 22 Cb 0.61 0.00 -0.08 0.00 -0.81 0.00 0.00 31.31 31.03 1hzm n TRP 22 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1hzm n LEU 23 N 0.00 -0.95 0.17 5.67 4.77 -1.26 -2.36 117.00 123.03 1hzm n LEU 23 Ca 0.00 2.17 0.19 0.00 -0.03 0.00 0.00 56.01 58.33 1hzm n LEU 23 Cb 0.00 -2.90 0.76 0.00 -2.33 0.00 0.00 43.42 38.95 1hzm n LEU 23 CO 0.00 -1.79 1.16 -1.13 -1.33 0.00 0.00 177.39 174.30 1hzm h ASN 24 N -1.30 0.00 0.16 -1.43 -1.24 -2.01 -2.24 115.58 107.53 1hzm h ASN 24 Ca -0.17 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 56.84 1hzm h ASN 24 Cb 1.19 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.22 1hzm h ASN 24 CO 0.06 0.00 -0.28 -0.33 -1.29 0.00 0.00 177.43 175.59 1hzm h GLU 25 N 0.00 -0.46 0.17 6.67 3.07 -1.99 0.18 114.58 122.22 1hzm h GLU 25 Ca 0.13 0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.02 1hzm h GLU 25 Cb 0.95 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.96 1hzm h GLU 25 CO -0.00 -0.31 -0.08 1.96 -1.40 0.00 0.00 179.01 179.18 1hzm h GLN 26 N -0.48 -0.22 -0.83 2.33 7.50 -1.03 0.13 115.11 122.52 1hzm h GLN 26 Ca -0.02 0.02 0.24 0.00 0.50 0.00 0.00 58.65 59.39 1hzm h GLN 26 Cb 0.44 0.05 -0.03 0.00 0.05 0.00 0.00 27.48 27.99 1hzm h GLN 26 CO -0.10 -0.01 0.75 -0.07 -1.50 0.00 0.00 178.83 177.90 1hzm h LEU 27 N -0.41 0.00 0.09 1.46 4.07 -1.41 0.69 115.31 119.80 1hzm h LEU 27 Ca -0.02 0.00 -0.33 0.00 0.08 0.00 0.00 57.88 57.60 1hzm h LEU 27 Cb 0.32 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 1hzm h LEU 27 CO 0.04 0.00 -1.83 1.21 -1.08 0.00 0.00 178.44 176.78 1hzm n GLU 28 N -3.80 0.70 0.00 1.13 2.13 0.61 -4.57 120.64 116.85 1hzm n GLU 28 Ca 0.17 0.34 0.00 0.00 0.66 0.00 0.00 57.16 58.33 1hzm n GLU 28 Cb 1.04 -1.71 0.00 0.00 0.27 0.00 0.00 31.44 31.04 1hzm n GLU 28 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1hzm n LEU 29 N -3.74 0.00 -3.80 4.31 4.32 0.42 -4.84 117.00 113.67 1hzm n LEU 29 Ca -0.33 0.45 -0.35 0.00 -0.02 0.00 0.00 56.01 55.77 1hzm n LEU 29 Cb 0.95 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 42.78 1hzm n LEU 29 CO 0.35 0.00 -0.11 0.61 -1.22 0.00 0.00 177.39 177.03 1hzm n GLY 30 N -0.91 -0.90 0.00 -0.72 0.00 -1.18 -4.86 105.19 96.63 1hzm n GLY 30 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1hzm n GLY 30 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hzm n ASN 31 N -2.58 0.00 -1.87 1.61 3.02 -1.26 -4.70 115.26 109.49 1hzm n ASN 31 Ca -0.11 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.45 1hzm n ASN 31 Cb 0.59 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.81 1hzm n ASN 31 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1hzm n GLU 32 N -0.92 0.84 -0.01 3.52 0.28 -1.26 -4.80 120.64 118.29 1hzm n GLU 32 Ca 0.00 -2.68 0.01 0.00 -0.16 0.00 0.00 57.16 54.33 1hzm n GLU 32 Cb 0.00 -0.74 0.02 0.00 1.43 0.00 0.00 31.44 32.14 1hzm n GLU 32 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1hzm n ARG 33 N -0.04 0.50 -3.74 3.44 5.12 -1.26 -4.74 116.66 115.94 1hzm n ARG 33 Ca 0.09 -0.95 0.01 0.00 -1.93 0.00 0.00 57.85 55.07 1hzm n ARG 33 Cb 0.99 -1.05 0.00 0.00 -1.16 0.00 0.00 32.46 31.25 1hzm n ARG 33 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1hzm s LEU 34 N -0.45 -0.05 -0.28 0.55 0.20 -1.26 -4.24 118.68 113.15 1hzm s LEU 34 Ca 0.03 -0.23 0.01 0.00 0.69 0.00 0.00 54.13 54.63 1hzm s LEU 34 Cb 0.02 1.51 0.15 0.00 -0.43 0.00 0.00 46.19 47.44 1hzm s LEU 34 CO 0.03 -0.42 0.36 -0.22 -0.29 0.00 0.00 176.35 175.81 1hzm s LEU 35 N -3.21 -0.58 0.76 -0.68 2.96 0.54 -4.49 118.68 113.99 1hzm s LEU 35 Ca 0.18 -0.42 -0.05 0.00 -0.22 0.00 0.00 54.13 53.62 1hzm s LEU 35 Cb 0.02 0.90 0.12 0.00 0.50 0.00 0.00 46.19 47.74 1hzm s LEU 35 CO -0.02 -0.36 1.06 -0.76 -1.32 0.00 0.00 176.35 174.95 1hzm s LEU 36 N 2.48 2.90 -0.24 -0.68 2.01 0.41 -2.31 118.68 123.25 1hzm s LEU 36 Ca 0.10 -0.01 -0.03 0.00 0.01 0.00 0.00 54.13 54.19 1hzm s LEU 36 Cb -0.13 -2.37 0.10 0.00 0.01 0.00 0.00 46.19 43.80 1hzm s LEU 36 CO -0.29 -1.95 0.19 -0.04 1.01 0.00 0.00 176.35 175.27 1hzm s MET 37 N -5.31 0.20 -0.21 1.70 -1.94 0.22 -0.31 119.30 113.66 1hzm s MET 37 Ca 0.66 -0.13 -0.29 0.00 -1.71 0.00 0.00 55.69 54.22 1hzm s MET 37 Cb -0.06 -1.15 0.14 0.00 2.01 0.00 0.00 34.83 35.76 1hzm s MET 37 CO 0.46 -0.86 1.08 0.16 -0.01 0.00 0.00 175.02 175.85 1hzm s ASP 38 N 2.24 -0.32 0.44 3.03 -4.77 -0.98 -2.39 116.67 113.91 1hzm s ASP 38 Ca 0.07 0.42 0.00 0.00 -3.30 0.00 0.00 52.55 49.75 1hzm s ASP 38 Cb -0.15 0.36 0.00 0.00 -1.09 0.00 0.00 42.92 42.04 1hzm s ASP 38 CO -0.24 -0.24 0.00 0.00 0.70 0.00 0.00 175.17 175.39 1hzm n ARG 40 N -0.07 0.00 0.21 0.00 0.63 -1.26 -0.81 116.66 115.36 1hzm n ARG 40 Ca 0.00 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.84 1hzm n ARG 40 Cb 0.00 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 32.87 1hzm n ARG 40 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 1hzm h PRO 41 N 0.00 -0.53 -1.43 -0.14 0.11 -1.94 -3.14 132.00 124.92 1hzm h PRO 41 Ca 0.00 0.04 -0.55 0.00 0.11 0.00 0.00 66.00 65.60 1hzm h PRO 41 Cb 0.00 0.12 -0.22 0.00 0.11 0.00 0.00 31.00 31.01 1hzm h PRO 41 CO 0.00 -0.36 0.69 1.04 -0.21 0.00 0.00 178.00 179.16 1hzm n GLN 42 N -3.54 2.37 -0.52 1.05 6.02 -1.26 -4.74 117.38 116.76 1hzm n GLN 42 Ca -0.07 -2.63 0.41 0.00 -0.01 0.00 0.00 57.00 54.70 1hzm n GLN 42 Cb 0.22 -2.05 0.64 0.00 1.02 0.00 0.00 30.24 30.08 1hzm n GLN 42 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 1hzm n GLU 43 N -0.22 -0.01 0.18 -1.09 0.28 -1.19 0.08 120.64 118.67 1hzm n GLU 43 Ca 0.49 0.98 -0.10 0.00 -0.16 0.00 0.00 57.16 58.37 1hzm n GLU 43 Cb 0.56 -2.11 -0.05 0.00 1.43 0.00 0.00 31.44 31.27 1hzm n GLU 43 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 1hzm h LEU 44 N 0.00 -0.45 0.41 -1.84 4.07 -1.90 -1.56 115.31 114.05 1hzm h LEU 44 Ca 0.78 -0.07 -0.02 0.00 0.08 0.00 0.00 57.88 58.65 1hzm h LEU 44 Cb 2.87 0.12 0.00 0.00 1.08 0.00 0.00 40.66 44.72 1hzm h LEU 44 CO -0.18 -0.00 -0.20 0.22 -1.08 0.00 0.00 178.44 177.20 1hzm h TYR 45 N -1.07 -0.51 -0.97 1.13 5.03 -0.75 -1.57 116.97 118.26 1hzm h TYR 45 Ca -0.05 -0.01 0.18 0.00 2.58 0.00 0.00 58.73 61.43 1hzm h TYR 45 Cb 0.49 0.17 -0.09 0.00 1.55 0.00 0.00 36.73 38.85 1hzm h TYR 45 CO 0.02 -0.21 0.61 1.05 -1.32 0.00 0.00 178.16 178.31 1hzm h GLU 46 N -0.78 0.67 -0.67 1.82 -0.00 -0.87 0.86 114.58 115.61 1hzm h GLU 46 Ca -0.06 -0.04 -0.02 0.00 -0.00 0.00 0.00 59.36 59.24 1hzm h GLU 46 Cb 0.53 -0.15 -0.03 0.00 -0.00 0.00 0.00 28.75 29.10 1hzm h GLU 46 CO 0.09 0.44 0.33 1.03 -0.00 0.00 0.00 179.01 180.90 1hzm h SER 47 N 0.69 0.84 -0.94 3.06 0.87 -1.07 -1.54 113.55 115.46 1hzm h SER 47 Ca 0.53 -0.08 0.12 0.00 -1.23 0.00 0.00 61.79 61.13 1hzm h SER 47 Cb 0.92 -0.22 -0.08 0.00 -0.44 0.00 0.00 62.40 62.58 1hzm h SER 47 CO -0.29 0.71 0.57 0.28 -0.53 0.00 0.00 176.83 177.57 1hzm h SER 48 N 0.94 0.82 -0.71 6.23 0.02 0.18 0.22 113.55 121.25 1hzm h SER 48 Ca 0.23 0.05 0.20 0.00 -0.84 0.00 0.00 61.79 61.44 1hzm h SER 48 Cb 0.08 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.48 1hzm h SER 48 CO -0.03 0.43 0.68 1.12 -1.14 0.00 0.00 176.83 177.89 1hzm h HIS 49 N 0.90 0.00 -0.96 3.45 2.07 -0.72 -3.42 115.15 116.48 1hzm h HIS 49 Ca 0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.99 1hzm h HIS 49 Cb 0.48 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.46 1hzm h HIS 49 CO -0.03 0.00 0.00 1.51 -3.07 0.00 0.00 177.93 176.34 1hzm n ILE 50 N -3.75 0.00 0.00 6.12 3.06 0.76 -4.91 119.36 120.64 1hzm n ILE 50 Ca 0.14 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.39 1hzm n ILE 50 Cb 0.93 0.00 0.00 0.00 0.54 0.00 0.00 39.64 41.11 1hzm n ILE 50 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 1hzm n GLU 51 N 0.00 0.00 -3.54 9.51 1.02 -1.25 -4.76 120.64 121.62 1hzm n GLU 51 Ca 0.00 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.86 1hzm n GLU 51 Cb 0.00 -0.49 -0.11 0.00 -0.02 0.00 0.00 31.44 30.82 1hzm n GLU 51 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1hzm s SER 52 N -1.40 2.72 0.64 1.62 0.15 -1.26 -4.33 113.70 111.85 1hzm s SER 52 Ca 0.00 -2.81 -0.17 0.00 0.70 0.00 0.00 55.95 53.67 1hzm s SER 52 Cb 0.00 -0.69 -0.01 0.00 -1.71 0.00 0.00 66.02 63.61 1hzm s SER 52 CO 0.00 -0.22 1.16 0.00 1.20 0.00 0.00 173.24 175.38 1hzm s ALA 53 N 0.24 2.44 0.15 5.45 0.00 -1.26 -0.44 121.76 128.33 1hzm s ALA 53 Ca 0.24 0.77 0.05 0.00 0.00 0.00 0.00 51.96 53.02 1hzm s ALA 53 Cb -0.11 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 1hzm s ALA 53 CO -0.09 -1.30 0.12 0.42 0.00 0.00 0.00 175.76 174.91 1hzm s ILE 54 N -2.00 4.46 -0.96 0.00 1.01 0.58 -4.79 121.20 119.49 1hzm s ILE 54 Ca 0.72 -1.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.09 1hzm s ILE 54 Cb -0.25 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 38.95 1hzm s ILE 54 CO 0.38 -0.07 1.78 0.21 0.00 0.00 0.00 174.94 177.24 1hzm s ASN 55 N -2.97 5.61 0.31 3.58 2.47 -1.26 -2.32 114.94 120.36 1hzm s ASN 55 Ca 0.30 -1.00 -0.08 0.00 0.42 0.00 0.00 52.86 52.51 1hzm s ASN 55 Cb -0.10 -2.56 -0.06 0.00 -1.45 0.00 0.00 41.25 37.07 1hzm s ASN 55 CO 0.23 -2.33 0.62 0.68 -3.72 0.00 0.00 177.10 172.58 1hzm s VAL 56 N 8.35 4.93 -0.66 -5.21 -7.23 0.01 -3.79 120.40 116.81 1hzm s VAL 56 Ca 0.62 0.33 -0.12 0.00 -1.81 0.00 0.00 61.98 61.00 1hzm s VAL 56 Cb -0.04 -3.70 0.17 0.00 0.56 0.00 0.00 36.38 33.36 1hzm s VAL 56 CO -0.03 -0.32 0.57 0.00 -0.31 0.00 0.00 175.10 175.01 1hzm s ALA 57 N -2.10 3.76 0.49 1.32 0.00 -1.26 -4.32 121.76 119.65 1hzm s ALA 57 Ca 0.47 -2.97 0.04 0.00 0.00 0.00 0.00 51.96 49.50 1hzm s ALA 57 Cb -0.11 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 19.81 1hzm s ALA 57 CO 0.28 -2.11 0.12 0.96 0.00 0.00 0.00 175.76 175.00 1hzm s ILE 58 N 0.72 1.53 0.00 0.00 -0.00 -1.26 -3.70 121.20 118.49 1hzm s ILE 58 Ca 0.12 -1.85 -0.03 0.00 -0.00 0.00 0.00 60.65 58.89 1hzm s ILE 58 Cb -0.20 -2.37 -0.02 0.00 -0.00 0.00 0.00 42.46 39.88 1hzm s ILE 58 CO -0.04 0.00 0.77 -0.65 -0.00 0.00 0.00 174.94 175.02 1hzm h PRO 59 N 1.28 -0.10 -0.93 0.37 0.11 -1.97 -3.39 132.00 127.36 1hzm h PRO 59 Ca -0.42 0.01 -0.47 0.00 0.11 0.00 0.00 66.00 65.22 1hzm h PRO 59 Cb 1.30 0.02 -0.42 0.00 0.11 0.00 0.00 31.00 32.01 1hzm h PRO 59 CO 0.71 -0.07 -0.91 0.41 -0.21 0.00 0.00 178.00 177.93 1hzm n GLY 60 N -0.22 4.71 2.74 -0.55 0.00 -1.26 -4.90 105.19 105.71 1hzm n GLY 60 Ca -0.01 -2.19 -0.14 0.00 0.00 0.00 0.00 46.02 43.68 1hzm n GLY 60 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1hzm n ILE 61 N -0.54 -1.79 -3.50 -0.61 2.08 -1.26 0.11 119.36 113.85 1hzm n ILE 61 Ca 0.31 -0.00 -0.20 0.00 0.56 0.00 0.00 62.75 63.41 1hzm n ILE 61 Cb 0.83 -2.99 0.08 0.00 -0.75 0.00 0.00 39.64 36.82 1hzm n ILE 61 CO 0.00 0.00 0.00 0.23 0.56 0.00 0.00 176.55 177.34 1hzm n MET 62 N -3.16 -7.23 -1.73 0.38 2.81 -1.26 -0.65 117.12 106.28 1hzm n MET 62 Ca 0.00 0.82 -0.10 0.00 -1.81 0.00 0.00 57.70 56.62 1hzm n MET 62 Cb 0.54 -5.81 -0.02 0.00 -0.71 0.00 0.00 33.22 27.21 1hzm n MET 62 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1hzm n LEU 63 N -4.53 -1.09 -4.18 4.03 7.99 -1.08 -3.43 117.00 114.71 1hzm n LEU 63 Ca -0.12 0.12 -0.33 0.00 -0.01 0.00 0.00 56.01 55.67 1hzm n LEU 63 Cb 0.61 -1.65 -0.06 0.00 -0.11 0.00 0.00 43.42 42.21 1hzm n LEU 63 CO 0.62 -0.32 -0.36 -1.14 -1.51 0.00 0.00 177.39 174.68 1hzm n ARG 64 N -2.34 -1.29 0.00 3.23 0.63 0.29 -4.87 116.66 112.31 1hzm n ARG 64 Ca -0.11 0.16 0.00 0.00 -0.92 0.00 0.00 57.85 56.98 1hzm n ARG 64 Cb 0.46 -3.60 0.00 0.00 0.45 0.00 0.00 32.46 29.77 1hzm n ARG 64 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1hzm n ARG 65 N -4.62 0.00 -1.20 -0.14 0.00 -1.21 -4.66 116.66 104.83 1hzm n ARG 65 Ca -0.28 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.22 1hzm n ARG 65 Cb 0.67 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 33.04 1hzm n ARG 65 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1hzm n LEU 66 N 0.00 2.37 -3.20 6.15 7.94 -0.76 -4.57 117.00 124.93 1hzm n LEU 66 Ca 0.00 -2.42 0.01 0.00 -1.11 0.00 0.00 56.01 52.49 1hzm n LEU 66 Cb 0.00 -1.15 -0.01 0.00 0.53 0.00 0.00 43.42 42.79 1hzm n LEU 66 CO 0.00 -1.81 0.08 -1.10 -1.11 0.00 0.00 177.39 173.45 1hzm s GLN 67 N 6.61 0.77 0.00 1.96 -0.21 -1.26 -1.93 119.66 125.59 1hzm s GLN 67 Ca 0.68 -0.13 0.00 0.00 0.02 0.00 0.00 55.36 55.93 1hzm s GLN 67 Cb 0.08 0.10 0.00 0.00 1.00 0.00 0.00 33.01 34.19 1hzm s GLN 67 CO 0.21 -1.16 0.00 0.36 -2.12 0.00 0.00 175.29 172.58 1hzm n LYS 68 N 4.60 0.00 -3.05 2.91 -0.00 -1.26 -5.04 118.16 116.31 1hzm n LYS 68 Ca 0.10 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.35 1hzm n LYS 68 Cb 0.56 0.00 0.01 0.00 -0.00 0.00 0.00 35.03 35.60 1hzm n LYS 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1hzm n GLY 69 N 0.00 -1.21 0.00 2.58 0.00 -1.26 -4.93 105.19 100.37 1hzm n GLY 69 Ca 0.00 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.81 1hzm n GLY 69 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1hzm n ASN 70 N -1.24 0.00 -3.80 1.61 5.15 0.14 -4.70 115.26 112.43 1hzm n ASN 70 Ca 0.02 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.57 1hzm n ASN 70 Cb 0.51 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.72 1hzm n ASN 70 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1hzm n LEU 71 N -0.42 -0.88 -4.44 1.20 7.99 -1.26 -4.72 117.00 114.47 1hzm n LEU 71 Ca 0.00 0.98 -0.36 0.00 -0.01 0.00 0.00 56.01 56.62 1hzm n LEU 71 Cb 0.00 -0.81 0.07 0.00 -0.11 0.00 0.00 43.42 42.57 1hzm n LEU 71 CO 0.00 -2.40 -0.00 -2.65 -1.51 0.00 0.00 177.39 170.83 1hzm n PRO 72 N 0.94 0.24 -1.63 3.23 -0.02 -1.26 -3.74 135.00 132.76 1hzm n PRO 72 Ca 0.16 0.12 -0.42 0.00 -2.02 0.00 0.00 63.50 61.33 1hzm n PRO 72 Cb 0.19 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1hzm n PRO 72 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1hzm n VAL 73 N -2.45 2.26 -2.10 -1.45 0.24 -1.12 -0.21 118.33 113.49 1hzm n VAL 73 Ca 0.09 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.34 61.79 1hzm n VAL 73 Cb 0.50 -1.23 -0.02 0.00 -1.47 0.00 0.00 33.84 31.62 1hzm n VAL 73 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1hzm n ARG 74 N 0.35 -2.01 -0.39 7.34 3.00 -1.14 -4.77 116.66 119.04 1hzm n ARG 74 Ca 0.08 0.53 0.32 0.00 -0.01 0.00 0.00 57.85 58.77 1hzm n ARG 74 Cb 0.37 -4.99 0.59 0.00 0.00 0.00 0.00 32.46 28.43 1hzm n ARG 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1hzm h ALA 75 N 1.01 2.48 -2.59 7.54 0.00 -0.89 -3.21 119.26 123.60 1hzm h ALA 75 Ca -0.23 0.12 -0.59 0.00 0.00 0.00 0.00 54.91 54.21 1hzm h ALA 75 Cb 1.03 0.16 -0.39 0.00 0.00 0.00 0.00 17.79 18.59 1hzm h ALA 75 CO 0.29 -1.07 -0.86 -0.48 0.00 0.00 0.00 179.25 177.13 1hzm s LEU 76 N -9.69 1.44 0.00 0.00 -0.00 -1.24 -4.22 118.68 104.98 1hzm s LEU 76 Ca -0.08 -2.55 0.00 0.00 -0.00 0.00 0.00 54.13 51.50 1hzm s LEU 76 Cb 0.29 -0.53 0.00 0.00 -0.00 0.00 0.00 46.19 45.95 1hzm s LEU 76 CO 0.81 -0.26 0.00 0.49 -0.00 0.00 0.00 176.35 177.39 1hzm n PHE 77 N 3.57 0.00 -1.45 3.48 3.72 -1.21 -4.71 117.46 120.86 1hzm n PHE 77 Ca 0.17 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.31 1hzm n PHE 77 Cb 0.40 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.84 1hzm n PHE 77 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1hzm n THR 78 N -0.46 0.65 0.02 4.37 -2.24 -1.26 -3.60 114.28 111.76 1hzm n THR 78 Ca 0.00 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 1hzm n THR 78 Cb 0.00 -2.07 0.00 0.00 -2.10 0.00 0.00 70.33 66.16 1hzm n THR 78 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hzm n ARG 79 N 8.04 0.00 0.00 -0.78 1.74 -1.26 -5.07 116.66 119.33 1hzm n ARG 79 Ca 0.44 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.52 1hzm n ARG 79 Cb 0.45 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.89 1hzm n ARG 79 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hzm n GLY 80 N 0.27 0.82 0.29 -0.13 0.00 -1.24 -4.96 105.19 100.25 1hzm n GLY 80 Ca 0.00 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.03 1hzm n GLY 80 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1hzm h GLU 81 N 0.00 0.33 0.04 1.61 4.57 -1.91 -1.31 114.58 117.91 1hzm h GLU 81 Ca 0.00 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1hzm h GLU 81 Cb 0.00 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 1hzm h GLU 81 CO 0.00 0.22 -0.26 -0.44 -1.18 0.00 0.00 179.01 177.35 1hzm h ASP 82 N 0.34 -0.80 -0.24 1.04 3.32 -1.81 -0.20 116.42 118.07 1hzm h ASP 82 Ca 0.49 0.09 0.07 0.00 0.02 0.00 0.00 57.03 57.69 1hzm h ASP 82 Cb 0.88 0.30 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 1hzm h ASP 82 CO -0.52 -0.27 0.28 -0.09 -1.72 0.00 0.00 179.24 176.92 1hzm h ARG 83 N -0.36 0.00 0.68 3.56 9.65 -1.64 -2.30 114.38 123.97 1hzm h ARG 83 Ca -0.00 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 1hzm h ARG 83 Cb 0.37 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 28.96 1hzm h ARG 83 CO -0.15 0.00 -0.33 0.22 2.80 0.00 0.00 179.97 182.51 1hzm h ASP 84 N 0.00 -0.77 -0.90 -3.80 1.82 0.10 0.10 116.42 112.96 1hzm h ASP 84 Ca 0.12 0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 56.76 1hzm h ASP 84 Cb 0.67 0.20 -0.04 0.00 0.68 0.00 0.00 39.33 40.84 1hzm h ASP 84 CO -0.00 -0.53 0.49 0.03 -1.61 0.00 0.00 179.24 177.62 1hzm h ARG 85 N -0.96 1.26 0.38 0.28 -0.00 -1.07 -1.10 114.38 113.16 1hzm h ARG 85 Ca -0.09 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.98 59.22 1hzm h ARG 85 Cb 0.70 -0.24 0.00 0.00 0.00 0.00 0.00 29.97 30.43 1hzm h ARG 85 CO 0.15 0.92 -0.18 0.35 0.00 0.00 0.00 179.97 181.21 1hzm h PHE 86 N 1.26 -0.47 -0.41 3.04 3.57 -1.41 0.14 116.94 122.66 1hzm h PHE 86 Ca 0.32 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.92 1hzm h PHE 86 Cb 0.03 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1hzm h PHE 86 CO 0.01 -0.29 0.52 0.00 -2.23 0.00 0.00 178.31 176.32 1hzm h THR 87 N -0.55 0.27 -0.01 4.41 1.03 -0.81 1.31 112.91 118.56 1hzm h THR 87 Ca -0.05 0.00 -0.18 0.00 -0.01 0.00 0.00 66.41 66.17 1hzm h THR 87 Cb 0.39 0.57 0.01 0.00 -1.07 0.00 0.00 68.15 68.05 1hzm h THR 87 CO 0.08 0.00 -0.69 -0.09 -0.01 0.00 0.00 175.52 174.82 1hzm h ARG 88 N 0.00 0.49 -0.50 0.00 2.43 -0.81 -3.29 114.38 112.70 1hzm h ARG 88 Ca 0.19 -0.51 -0.21 0.00 -0.81 0.00 0.00 59.98 58.64 1hzm h ARG 88 Cb 1.22 0.14 -0.13 0.00 -0.42 0.00 0.00 29.97 30.79 1hzm h ARG 88 CO -0.00 1.15 0.11 0.54 -1.51 0.00 0.00 179.97 180.25 1hzm n ARG 89 N -4.14 2.32 -2.99 0.20 3.00 0.80 -5.01 116.66 110.84 1hzm n ARG 89 Ca -0.10 -3.08 -0.35 0.00 -0.01 0.00 0.00 57.85 54.30 1hzm n ARG 89 Cb 0.71 -1.93 -0.06 0.00 0.00 0.00 0.00 32.46 31.18 1hzm n ARG 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1hzm n GLY 91 N 0.35 0.80 0.22 0.00 0.00 -1.26 -4.99 105.19 100.31 1hzm n GLY 91 Ca 0.01 -0.11 -0.12 0.00 0.00 0.00 0.00 46.02 45.80 1hzm n GLY 91 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1hzm h THR 92 N 0.00 0.55 0.00 2.61 2.02 -1.90 -3.48 112.91 112.70 1hzm h THR 92 Ca 0.00 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.53 1hzm h THR 92 Cb 0.00 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1hzm h THR 92 CO 0.00 0.11 0.00 -0.67 0.37 0.00 0.00 175.52 175.33 1hzm n ASP 93 N -5.13 -1.20 -3.78 4.18 -0.08 -1.26 -4.64 116.55 104.63 1hzm n ASP 93 Ca -0.09 0.51 -0.13 0.00 -1.51 0.00 0.00 54.79 53.57 1hzm n ASP 93 Cb 0.27 1.40 -0.11 0.00 2.34 0.00 0.00 41.12 45.02 1hzm n ASP 93 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1hzm s THR 94 N -2.00 0.01 -0.13 5.18 2.01 -1.26 -4.88 115.64 114.57 1hzm s THR 94 Ca 0.00 -0.08 -0.00 0.00 0.31 0.00 0.00 61.69 61.92 1hzm s THR 94 Cb 0.00 -0.41 -0.02 0.00 0.01 0.00 0.00 72.50 72.08 1hzm s THR 94 CO 0.00 -0.05 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.07 1hzm s VAL 95 N -0.08 3.08 -0.01 3.82 1.01 -1.26 -0.34 120.40 126.63 1hzm s VAL 95 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1hzm s VAL 95 Cb -0.03 -2.29 0.01 0.00 0.00 0.00 0.00 36.38 34.08 1hzm s VAL 95 CO 0.01 0.53 0.01 -0.69 0.00 0.00 0.00 175.10 174.96 1hzm s VAL 96 N 0.30 -0.02 0.40 2.92 1.01 -0.98 -2.36 120.40 121.67 1hzm s VAL 96 Ca -0.10 0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.05 1hzm s VAL 96 Cb -0.16 -0.04 -0.04 0.00 0.00 0.00 0.00 36.38 36.14 1hzm s VAL 96 CO 0.05 0.04 0.22 -0.76 0.00 0.00 0.00 175.10 174.66 1hzm s LEU 97 N 0.44 3.23 -0.47 3.92 2.01 -0.93 -0.61 118.68 126.27 1hzm s LEU 97 Ca -0.04 -0.92 0.07 0.00 0.01 0.00 0.00 54.13 53.25 1hzm s LEU 97 Cb -0.05 -1.67 0.39 0.00 0.01 0.00 0.00 46.19 44.86 1hzm s LEU 97 CO -0.01 -0.52 1.02 0.00 1.01 0.00 0.00 176.35 177.85 1hzm n TYR 98 N -1.30 3.23 0.18 0.29 4.11 -1.01 -1.52 117.16 121.15 1hzm n TYR 98 Ca -0.00 -3.44 0.07 0.00 -0.00 0.00 0.00 57.90 54.53 1hzm n TYR 98 Cb 0.63 -0.27 0.18 0.00 -0.00 0.00 0.00 39.34 39.88 1hzm n TYR 98 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.86 176.42 1hzm h ASP 99 N 2.78 0.00 -3.90 9.48 3.32 -1.87 -3.47 116.42 122.76 1hzm h ASP 99 Ca 0.19 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.31 1hzm h ASP 99 Cb 0.80 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 1hzm h ASP 99 CO 0.79 0.30 -0.16 1.21 -1.72 0.00 0.00 179.24 179.65 1hzm n GLU 100 N -3.23 -0.56 -1.95 3.56 2.13 -1.25 -4.42 120.64 114.93 1hzm n GLU 100 Ca 0.02 0.41 -0.42 0.00 0.66 0.00 0.00 57.16 57.83 1hzm n GLU 100 Cb 0.60 -0.67 -0.03 0.00 0.27 0.00 0.00 31.44 31.61 1hzm n GLU 100 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1hzm s SER 101 N -5.24 6.61 -0.33 4.31 0.15 -1.25 -3.98 113.70 113.97 1hzm s SER 101 Ca 0.00 2.57 -0.13 0.00 0.70 0.00 0.00 55.95 59.09 1hzm s SER 101 Cb 0.00 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 61.74 1hzm s SER 101 CO 0.00 -0.83 0.34 -0.24 1.20 0.00 0.00 173.24 173.71 1hzm n SER 102 N 4.36 -7.35 0.00 5.45 2.88 -1.26 -4.02 113.62 113.68 1hzm n SER 102 Ca 0.14 0.67 0.00 0.00 -1.33 0.00 0.00 58.87 58.36 1hzm n SER 102 Cb 0.39 -4.15 0.00 0.00 -0.75 0.00 0.00 64.21 59.70 1hzm n SER 102 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1hzm n SER 103 N 0.27 0.00 0.16 -3.46 7.64 -1.26 -0.68 113.62 116.29 1hzm n SER 103 Ca 0.03 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.03 1hzm n SER 103 Cb 0.36 0.00 0.13 0.00 -1.01 0.00 0.00 64.21 63.70 1hzm n SER 103 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1hzm h ASP 104 N 0.00 0.00 0.00 6.43 5.19 -1.72 -2.98 116.42 123.35 1hzm h ASP 104 Ca 0.00 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 1hzm h ASP 104 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1hzm h ASP 104 CO 0.00 0.01 -0.37 -2.67 -3.12 0.00 0.00 179.24 173.09 1hzm n TRP 105 N -2.79 0.00 -1.00 4.55 4.27 -1.26 -2.87 117.44 118.33 1hzm n TRP 105 Ca 0.03 0.00 -0.00 0.00 -3.89 0.00 0.00 57.50 53.64 1hzm n TRP 105 Cb 0.52 -0.01 -0.00 0.00 -1.36 0.00 0.00 31.31 30.46 1hzm n TRP 105 CO 0.00 0.00 0.00 0.09 -2.29 0.00 0.00 177.69 175.49 1hzm n ASN 106 N -1.19 -4.82 -2.50 -0.67 3.02 -1.25 -3.83 115.26 104.02 1hzm n ASN 106 Ca 0.01 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.52 1hzm n ASN 106 Cb 0.10 -2.33 0.01 0.00 -0.61 0.00 0.00 39.78 36.94 1hzm n ASN 106 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1hzm n GLU 107 N -0.58 -1.50 -0.01 3.52 2.13 -1.26 -4.72 120.64 118.21 1hzm n GLU 107 Ca -0.00 1.54 -0.03 0.00 0.66 0.00 0.00 57.16 59.33 1hzm n GLU 107 Cb 0.30 -4.49 -0.01 0.00 0.27 0.00 0.00 31.44 27.51 1hzm n GLU 107 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1hzm n ASN 108 N -0.66 0.98 -2.31 4.31 5.03 -1.25 -4.98 115.26 116.38 1hzm n ASN 108 Ca 0.06 0.02 -0.12 0.00 0.87 0.00 0.00 54.58 55.42 1hzm n ASN 108 Cb 0.37 -0.07 -0.01 0.00 -1.02 0.00 0.00 39.78 39.05 1hzm n ASN 108 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1hzm n THR 109 N -3.01 -0.51 0.00 3.41 -2.24 -1.26 -4.71 114.28 105.96 1hzm n THR 109 Ca -0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1hzm n THR 109 Cb 0.54 -1.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 1hzm n THR 109 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hzm n GLY 110 N -0.73 0.00 0.00 3.38 0.00 -1.26 -5.08 105.19 101.50 1hzm n GLY 110 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1hzm n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hzm n GLY 111 N 2.60 -0.20 0.00 -0.02 0.00 -1.26 -5.16 105.19 101.15 1hzm n GLY 111 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1hzm n GLY 111 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1hzm n GLU 112 N 0.00 0.92 -0.06 1.61 0.28 -1.26 -4.88 120.64 117.24 1hzm n GLU 112 Ca 0.00 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.93 1hzm n GLU 112 Cb 0.00 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 32.85 1hzm n GLU 112 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1hzm n SER 113 N -0.23 1.77 0.00 -1.84 3.41 -1.26 -4.06 113.62 111.41 1hzm n SER 113 Ca 0.00 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 1hzm n SER 113 Cb 0.00 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 1hzm n SER 113 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1hzm n LEU 114 N -4.26 0.00 0.29 1.04 7.99 -1.26 -1.18 117.00 119.62 1hzm n LEU 114 Ca -0.11 0.22 0.15 0.00 -0.01 0.00 0.00 56.01 56.27 1hzm n LEU 114 Cb 0.41 0.00 0.91 0.00 -0.11 0.00 0.00 43.42 44.63 1hzm n LEU 114 CO 0.17 0.00 1.10 -0.07 -1.51 0.00 0.00 177.39 177.08 1hzm h LEU 115 N 0.00 0.00 -0.96 2.23 -0.00 -1.90 -1.79 115.31 112.89 1hzm h LEU 115 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.91 1hzm h LEU 115 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.61 1hzm h LEU 115 CO 0.00 0.03 0.63 1.23 -0.00 0.00 0.00 178.44 180.33 1hzm h GLY 116 N 0.21 1.39 1.59 0.83 0.00 -1.69 0.98 103.07 106.38 1hzm h GLY 116 Ca -0.00 -0.49 -0.26 0.00 0.00 0.00 0.00 47.33 46.59 1hzm h GLY 116 CO 0.00 0.43 -1.28 -2.00 0.00 0.00 0.00 176.54 173.69 1hzm h LEU 117 N 1.24 0.17 -0.44 3.11 7.12 -0.32 -2.29 115.31 123.90 1hzm h LEU 117 Ca 0.38 -0.21 -0.02 0.00 0.13 0.00 0.00 57.88 58.16 1hzm h LEU 117 Cb -0.04 -0.05 -0.02 0.00 -0.53 0.00 0.00 40.66 40.02 1hzm h LEU 117 CO -0.11 1.17 0.22 0.25 -0.13 0.00 0.00 178.44 179.83 1hzm h LEU 118 N 0.03 0.57 0.05 2.25 7.12 -0.91 -0.37 115.31 124.05 1hzm h LEU 118 Ca -0.13 -0.12 -0.00 0.00 0.13 0.00 0.00 57.88 57.75 1hzm h LEU 118 Cb 1.90 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 41.89 1hzm h LEU 118 CO 0.14 0.53 -0.02 0.25 -0.13 0.00 0.00 178.44 179.21 1hzm h LEU 119 N 0.57 -0.05 -1.04 2.25 7.12 -0.92 -2.25 115.31 120.99 1hzm h LEU 119 Ca 0.15 -0.49 0.24 0.00 0.13 0.00 0.00 57.88 57.92 1hzm h LEU 119 Cb 0.11 0.01 -0.12 0.00 -0.53 0.00 0.00 40.66 40.13 1hzm h LEU 119 CO -0.02 0.48 0.60 0.11 -0.13 0.00 0.00 178.44 179.48 1hzm h LYS 120 N -0.61 0.57 -0.18 1.25 1.79 -1.32 0.14 116.57 118.21 1hzm h LYS 120 Ca -0.01 -0.03 -0.12 0.00 -2.18 0.00 0.00 60.65 58.31 1hzm h LYS 120 Cb 0.54 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 1hzm h LYS 120 CO 0.01 0.37 -0.37 -0.22 -1.08 0.00 0.00 179.45 178.17 1hzm h LYS 121 N 0.58 0.57 -0.60 3.15 3.64 -1.05 0.17 116.57 123.02 1hzm h LYS 121 Ca 0.63 -0.37 0.04 0.00 -1.27 0.00 0.00 60.65 59.68 1hzm h LYS 121 Cb 1.22 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.05 1hzm h LYS 121 CO -0.45 0.98 0.40 -0.07 -2.27 0.00 0.00 179.45 178.04 1hzm h LEU 122 N 0.22 0.59 0.13 5.20 4.07 -0.20 -2.30 115.31 123.02 1hzm h LEU 122 Ca 0.00 -0.01 -0.32 0.00 0.08 0.00 0.00 57.88 57.64 1hzm h LEU 122 Cb 0.97 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 42.57 1hzm h LEU 122 CO 0.08 0.40 -1.58 0.50 -1.08 0.00 0.00 178.44 176.76 1hzm h LYS 123 N 0.68 0.28 -0.65 1.13 3.64 -0.86 -3.30 116.57 117.49 1hzm h LYS 123 Ca 0.24 -0.48 0.12 0.00 -1.27 0.00 0.00 60.65 59.26 1hzm h LYS 123 Cb 0.12 0.18 -0.09 0.00 -0.41 0.00 0.00 32.23 32.03 1hzm h LYS 123 CO -0.07 1.15 0.21 0.22 -2.27 0.00 0.00 179.45 178.69 1hzm h ASP 124 N 0.08 0.14 0.04 4.20 1.82 -0.14 0.33 116.42 122.89 1hzm h ASP 124 Ca -0.27 0.10 -0.00 0.00 -0.39 0.00 0.00 57.03 56.48 1hzm h ASP 124 Cb 2.04 0.11 -0.00 0.00 0.68 0.00 0.00 39.33 42.16 1hzm h ASP 124 CO 0.17 0.07 -0.01 -0.33 -1.61 0.00 0.00 179.24 177.52 1hzm h GLU 125 N 0.35 0.00 0.00 0.28 4.39 -1.56 -3.45 114.58 114.59 1hzm h GLU 125 Ca 0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1hzm h GLU 125 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1hzm h GLU 125 CO -0.38 0.01 0.00 0.41 -1.16 0.00 0.00 179.01 177.89 1hzm n GLY 126 N -1.24 0.42 3.78 -3.84 0.00 0.11 -5.11 105.19 99.31 1hzm n GLY 126 Ca -0.03 -0.63 -0.07 0.00 0.00 0.00 0.00 46.02 45.29 1hzm n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hzm h ARG 128 N 2.00 0.19 -4.76 0.00 9.65 -1.88 -3.37 114.38 116.21 1hzm h ARG 128 Ca -0.22 -0.33 0.00 0.00 -1.10 0.00 0.00 59.98 58.33 1hzm h ARG 128 Cb 1.25 0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 29.93 1hzm h ARG 128 CO 0.26 1.16 -0.82 0.00 2.80 0.00 0.00 179.97 183.37 1hzm n ALA 129 N -3.12 -2.04 -3.24 2.80 0.00 -1.22 -4.81 120.51 108.89 1hzm n ALA 129 Ca -0.32 0.74 -0.13 0.00 0.00 0.00 0.00 53.44 53.74 1hzm n ALA 129 Cb 0.94 -1.87 -0.11 0.00 0.00 0.00 0.00 19.45 18.41 1hzm n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1hzm s PHE 130 N -0.43 -0.35 0.29 0.00 -0.71 -1.00 -4.65 117.98 111.13 1hzm s PHE 130 Ca -0.06 0.85 0.04 0.00 -1.04 0.00 0.00 56.93 56.72 1hzm s PHE 130 Cb 0.00 0.12 0.04 0.00 -1.21 0.00 0.00 43.02 41.97 1hzm s PHE 130 CO 0.16 -0.17 0.32 0.66 -1.34 0.00 0.00 175.22 174.85 1hzm n TYR 131 N 3.01 -1.92 -2.24 3.49 4.01 -0.53 -2.19 117.16 120.79 1hzm n TYR 131 Ca -0.14 -1.13 -0.13 0.00 -0.16 0.00 0.00 57.90 56.34 1hzm n TYR 131 Cb 0.58 -0.26 0.07 0.00 -0.31 0.00 0.00 39.34 39.42 1hzm n TYR 131 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1hzm n LEU 132 N 0.00 0.00 0.00 7.72 4.77 -0.57 -0.43 117.00 128.49 1hzm n LEU 132 Ca 0.04 -1.04 0.00 0.00 -0.03 0.00 0.00 56.01 54.98 1hzm n LEU 132 Cb 0.31 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1hzm n LEU 132 CO 0.19 -0.81 0.00 1.21 -1.33 0.00 0.00 177.39 176.66 1hzm n GLU 133 N -2.08 0.00 0.00 3.23 2.13 -0.75 -3.75 120.64 119.41 1hzm n GLU 133 Ca 0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.91 1hzm n GLU 133 Cb 0.31 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.02 1hzm n GLU 133 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hzm n GLY 134 N -0.49 0.41 3.74 8.31 0.00 -1.01 -3.84 105.19 112.30 1hzm n GLY 134 Ca 0.00 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 1hzm n GLY 134 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hzm s GLY 135 N 0.00 2.08 0.48 -0.02 0.00 -1.26 -4.71 107.32 103.88 1hzm s GLY 135 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.08 1hzm s GLY 135 CO 0.00 0.17 0.00 0.69 0.00 0.00 0.00 173.10 173.96 1hzm n PHE 136 N 3.47 -3.13 0.30 1.90 3.72 -1.26 -1.69 117.46 120.77 1hzm n PHE 136 Ca -0.15 1.70 0.17 0.00 -0.05 0.00 0.00 57.45 59.12 1hzm n PHE 136 Cb 0.52 -2.85 0.91 0.00 -0.94 0.00 0.00 39.48 37.13 1hzm n PHE 136 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1hzm h SER 137 N -1.36 0.00 0.10 4.37 4.64 -1.98 -2.51 113.55 116.82 1hzm h SER 137 Ca -0.14 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.18 1hzm h SER 137 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1hzm h SER 137 CO 0.06 0.00 -0.05 0.11 -0.87 0.00 0.00 176.83 176.08 1hzm h LYS 138 N 0.00 -0.13 -0.52 4.77 1.57 -1.99 -0.43 116.57 119.83 1hzm h LYS 138 Ca 0.00 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1hzm h LYS 138 Cb 0.28 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1hzm h LYS 138 CO 0.00 -0.09 0.31 0.74 -0.57 0.00 0.00 179.45 179.84 1hzm h PHE 139 N -0.40 0.68 -0.07 -1.35 0.04 -1.22 -1.53 116.94 113.08 1hzm h PHE 139 Ca -0.01 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.58 1hzm h PHE 139 Cb 0.11 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.03 1hzm h PHE 139 CO 0.04 0.45 -0.73 -0.56 -0.60 0.00 0.00 178.31 176.92 1hzm h GLN 140 N 0.72 0.35 -0.67 1.51 3.07 -1.50 -2.58 115.11 116.01 1hzm h GLN 140 Ca 0.19 -0.29 0.03 0.00 0.09 0.00 0.00 58.65 58.67 1hzm h GLN 140 Cb -0.03 0.06 -0.04 0.00 0.08 0.00 0.00 27.48 27.56 1hzm h GLN 140 CO -0.04 0.94 0.44 0.00 0.09 0.00 0.00 178.83 180.26 1hzm h ALA 141 N 0.98 1.63 0.28 0.06 0.00 -0.07 1.48 119.26 123.62 1hzm h ALA 141 Ca -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1hzm h ALA 141 Cb 1.30 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1hzm h ALA 141 CO 0.12 0.31 -0.14 0.93 0.00 0.00 0.00 179.25 180.47 1hzm h GLU 142 N 0.80 -0.37 -2.13 0.00 5.08 -1.26 -3.40 114.58 113.31 1hzm h GLU 142 Ca 0.27 0.03 -0.55 0.00 -1.00 0.00 0.00 59.36 58.11 1hzm h GLU 142 Cb 0.07 0.08 -0.41 0.00 0.50 0.00 0.00 28.75 28.99 1hzm h GLU 142 CO -0.07 -0.25 -0.91 1.19 -1.00 0.00 0.00 179.01 177.97 1hzm n PHE 143 N -3.94 1.96 0.00 4.33 3.01 -0.99 -4.94 117.46 116.89 1hzm n PHE 143 Ca -0.05 -3.89 0.00 0.00 1.01 0.00 0.00 57.45 54.52 1hzm n PHE 143 Cb 0.15 -0.45 0.00 0.00 -0.01 0.00 0.00 39.48 39.17 1hzm n PHE 143 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1hzm n SER 144 N 0.32 -1.12 -4.53 4.37 3.41 0.51 -4.55 113.62 112.02 1hzm n SER 144 Ca 0.27 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.74 1hzm n SER 144 Cb 0.51 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.36 1hzm n SER 144 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1hzm n LEU 145 N 0.00 0.98 0.00 1.04 4.77 -1.26 -3.90 117.00 118.63 1hzm n LEU 145 Ca 0.00 -1.38 0.00 0.00 -0.03 0.00 0.00 56.01 54.60 1hzm n LEU 145 Cb 0.00 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 39.68 1hzm n LEU 145 CO 0.00 -2.45 0.00 1.41 -1.33 0.00 0.00 177.39 175.02 1hzm n HIS 146 N 15.73 0.00 -3.42 -1.77 8.25 -0.81 -4.92 115.22 128.27 1hzm n HIS 146 Ca 0.50 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.76 1hzm n HIS 146 Cb 0.37 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.53 1hzm n HIS 146 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1hzm s GLU 148 N -4.79 1.22 0.00 0.00 2.02 -1.26 -4.56 118.70 111.32 1hzm s GLU 148 Ca 0.35 -0.49 0.00 0.00 0.02 0.00 0.00 54.97 54.85 1hzm s GLU 148 Cb -0.09 0.53 0.00 0.00 0.10 0.00 0.00 34.13 34.67 1hzm s GLU 148 CO 0.80 -0.54 0.00 -2.37 0.02 0.00 0.00 175.26 173.17 1hzm n THR 149 N -0.36 0.00 -0.97 3.63 5.66 -1.26 -4.40 114.28 116.57 1hzm n THR 149 Ca -0.13 0.00 0.08 0.00 -3.05 0.00 0.00 64.05 60.95 1hzm n THR 149 Cb 0.63 -0.29 0.29 0.00 -1.55 0.00 0.00 70.33 69.42 1hzm n THR 149 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1hzm n ASN 150 N -2.18 4.31 0.00 1.09 2.85 -1.26 -3.45 115.26 116.62 1hzm n ASN 150 Ca 0.00 -3.00 0.00 0.00 -0.11 0.00 0.00 54.58 51.47 1hzm n ASN 150 Cb 0.00 -0.58 0.00 0.00 1.24 0.00 0.00 39.78 40.44 1hzm n ASN 150 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1hzm n LEU 151 N -0.25 2.78 0.00 1.20 7.99 -1.26 -4.88 117.00 122.59 1hzm n LEU 151 Ca 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.23 1hzm n LEU 151 Cb 0.96 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 44.27 1hzm n LEU 151 CO 0.19 0.46 -0.30 -0.67 -1.51 0.00 0.00 177.39 175.56 1hzm n ASP 152 N -2.53 2.32 0.00 -1.43 2.03 -1.26 -4.99 116.55 110.69 1hzm n ASP 152 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1hzm n ASP 152 Cb 0.50 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 1hzm n ASP 152 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1hzm n GLY 153 N 2.70 3.11 0.39 0.27 0.00 -1.22 -5.00 105.19 105.44 1hzm n GLY 153 Ca 0.00 -0.18 0.05 0.00 0.00 0.00 0.00 46.02 45.89 1hzm n GLY 153 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18