#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ziy s LEU 2 N 0.00 2.53 -0.23 3.17 1.43 -1.26 -4.58 118.68 119.73 1ziy s LEU 2 Ca 0.00 -1.02 -0.29 0.00 -1.03 0.00 0.00 54.13 51.79 1ziy s LEU 2 Cb 0.00 -0.37 0.01 0.00 0.03 0.00 0.00 46.19 45.86 1ziy s LEU 2 CO 0.00 -0.32 1.09 -0.89 0.23 0.00 0.00 176.35 176.46 1ziy s THR 3 N -3.31 4.57 0.26 5.49 2.01 0.36 -4.89 115.64 120.13 1ziy s THR 3 Ca 0.17 1.88 -0.31 0.00 0.31 0.00 0.00 61.69 63.75 1ziy s THR 3 Cb 0.02 -4.27 -0.13 0.00 0.01 0.00 0.00 72.50 68.13 1ziy s THR 3 CO 0.01 -0.23 1.38 1.21 -0.69 0.00 0.00 174.62 176.31 1ziy n GLU 4 N 6.49 2.05 0.00 4.92 2.13 -1.26 -2.57 120.64 132.39 1ziy n GLU 4 Ca 0.12 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.67 1ziy n GLU 4 Cb 0.46 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.80 1ziy n GLU 4 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ziy n GLY 5 N 1.91 2.41 3.67 8.31 0.00 -1.26 -5.01 105.19 115.22 1ziy n GLY 5 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1ziy n GLY 5 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ziy s ILE 6 N -2.71 4.76 -0.04 -0.61 -1.09 -1.06 -5.01 121.20 115.44 1ziy s ILE 6 Ca 0.00 1.92 -0.01 0.00 -2.23 0.00 0.00 60.65 60.33 1ziy s ILE 6 Cb 0.00 -4.26 0.03 0.00 -1.58 0.00 0.00 42.46 36.65 1ziy s ILE 6 CO 0.00 -0.08 0.03 -0.55 -1.23 0.00 0.00 174.94 173.11 1ziy s SER 7 N 1.18 0.85 -0.09 3.58 0.15 -1.26 -4.08 113.70 114.03 1ziy s SER 7 Ca 0.43 0.02 0.03 0.00 0.70 0.00 0.00 55.95 57.14 1ziy s SER 7 Cb -0.16 -0.19 -0.01 0.00 -1.71 0.00 0.00 66.02 63.94 1ziy s SER 7 CO 0.11 -0.19 -0.19 -0.63 1.20 0.00 0.00 173.24 173.54 1ziy s ILE 8 N 1.68 2.57 -0.13 6.45 1.01 0.13 -4.93 121.20 127.97 1ziy s ILE 8 Ca -0.01 -0.86 -0.14 0.00 0.00 0.00 0.00 60.65 59.64 1ziy s ILE 8 Cb -0.13 -2.01 -0.05 0.00 0.01 0.00 0.00 42.46 40.29 1ziy s ILE 8 CO -0.03 0.56 0.33 -1.58 0.00 0.00 0.00 174.94 174.22 1ziy s GLN 9 N -0.02 4.21 0.68 2.79 0.74 -1.26 -1.01 119.66 125.79 1ziy s GLN 9 Ca -0.06 0.19 0.02 0.00 0.05 0.00 0.00 55.36 55.56 1ziy s GLN 9 Cb -0.15 -3.40 0.12 0.00 1.10 0.00 0.00 33.01 30.68 1ziy s GLN 9 CO 0.05 0.29 0.94 0.45 -0.55 0.00 0.00 175.29 176.47 1ziy s SER 10 N 0.28 4.54 0.45 6.67 0.15 -0.43 -4.84 113.70 120.52 1ziy s SER 10 Ca 0.19 -0.48 0.23 0.00 0.70 0.00 0.00 55.95 56.59 1ziy s SER 10 Cb -0.14 0.06 1.24 0.00 -1.71 0.00 0.00 66.02 65.47 1ziy s SER 10 CO 0.06 -1.73 1.83 0.10 1.20 0.00 0.00 173.24 174.70 1ziy h TYR 11 N -0.35 0.40 -0.59 3.44 -0.00 -1.87 -1.81 116.97 116.19 1ziy h TYR 11 Ca -0.35 0.01 0.00 0.00 -0.00 0.00 0.00 58.73 58.40 1ziy h TYR 11 Cb 1.27 -0.12 0.00 0.00 -0.00 0.00 0.00 36.73 37.88 1ziy h TYR 11 CO -0.04 0.07 0.00 -0.40 -0.00 0.00 0.00 178.16 177.78 1ziy n ASP 12 N -4.46 3.63 0.00 0.10 5.75 -1.26 -4.96 116.55 115.35 1ziy n ASP 12 Ca 0.22 -2.03 0.00 0.00 -0.01 0.00 0.00 54.79 52.97 1ziy n ASP 12 Cb 0.89 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1ziy n ASP 12 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ziy n GLY 13 N 1.20 1.74 3.78 6.12 0.00 -0.68 -5.03 105.19 112.31 1ziy n GLY 13 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1ziy n GLY 13 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ziy s HIS 14 N -2.41 2.54 0.17 1.61 5.04 -1.26 -4.70 115.29 116.28 1ziy s HIS 14 Ca 0.00 1.19 0.09 0.00 -1.54 0.00 0.00 55.06 54.80 1ziy s HIS 14 Cb 0.00 -4.01 -0.04 0.00 0.04 0.00 0.00 32.58 28.57 1ziy s HIS 14 CO 0.00 -3.01 -0.11 0.95 -2.34 0.00 0.00 174.74 170.23 1ziy s THR 15 N -1.14 3.12 0.05 0.89 -4.23 -1.26 -1.32 115.64 111.75 1ziy s THR 15 Ca 0.55 -1.65 -0.10 0.00 -1.18 0.00 0.00 61.69 59.30 1ziy s THR 15 Cb -0.46 -2.53 0.01 0.00 1.34 0.00 0.00 72.50 70.85 1ziy s THR 15 CO 0.62 -0.09 0.22 0.72 -0.54 0.00 0.00 174.62 175.55 1ziy s PHE 16 N -1.64 0.03 0.83 3.99 -0.12 -0.18 -4.92 117.98 115.96 1ziy s PHE 16 Ca 0.24 -0.26 -0.06 0.00 -0.05 0.00 0.00 56.93 56.80 1ziy s PHE 16 Cb -0.09 -0.00 0.17 0.00 -0.63 0.00 0.00 43.02 42.47 1ziy s PHE 16 CO 0.14 -0.46 1.14 0.20 -0.05 0.00 0.00 175.22 176.19 1ziy s GLY 17 N -2.17 1.77 0.04 1.99 0.00 -1.26 -0.70 107.32 106.99 1ziy s GLY 17 Ca -0.04 -1.70 -0.27 0.00 0.00 0.00 0.00 44.72 42.71 1ziy s GLY 17 CO -0.05 -1.00 0.66 0.00 0.00 0.00 0.00 173.10 172.72 1ziy s ALA 18 N -3.45 -1.70 -0.22 3.20 0.00 -1.26 -1.44 121.76 116.89 1ziy s ALA 18 Ca 0.71 0.94 -0.14 0.00 0.00 0.00 0.00 51.96 53.47 1ziy s ALA 18 Cb -0.03 0.40 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 1ziy s ALA 18 CO 0.48 -0.56 0.33 -1.17 0.00 0.00 0.00 175.76 174.84 1ziy s LEU 19 N -1.94 4.13 -0.04 0.00 2.96 0.09 -0.49 118.68 123.39 1ziy s LEU 19 Ca -0.05 0.38 0.07 0.00 -0.22 0.00 0.00 54.13 54.31 1ziy s LEU 19 Cb -0.01 -2.40 -0.01 0.00 0.50 0.00 0.00 46.19 44.27 1ziy s LEU 19 CO -0.01 -0.05 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.03 1ziy s VAL 20 N 1.34 1.98 -0.22 1.68 1.01 -1.26 -0.21 120.40 124.71 1ziy s VAL 20 Ca 0.16 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1ziy s VAL 20 Cb -0.15 -1.66 0.05 0.00 0.00 0.00 0.00 36.38 34.62 1ziy s VAL 20 CO 0.07 0.55 -0.12 -0.83 0.00 0.00 0.00 175.10 174.78 1ziy s GLY 21 N -0.32 1.43 0.60 4.51 0.00 -0.04 -4.95 107.32 108.55 1ziy s GLY 21 Ca 0.02 -1.42 -0.16 0.00 0.00 0.00 0.00 44.72 43.16 1ziy s GLY 21 CO 0.02 0.62 1.07 -1.35 0.00 0.00 0.00 173.10 173.46 1ziy s SER 22 N 1.27 5.63 0.57 1.64 1.04 -1.26 -0.96 113.70 121.62 1ziy s SER 22 Ca -0.03 1.88 -0.14 0.00 0.48 0.00 0.00 55.95 58.14 1ziy s SER 22 Cb -0.17 -2.54 -0.06 0.00 0.10 0.00 0.00 66.02 63.35 1ziy s SER 22 CO -0.08 -1.27 1.01 -2.16 0.98 0.00 0.00 173.24 171.72 1ziy s PRO 23 N -4.02 3.73 0.31 4.02 0.04 -1.26 -4.86 135.00 132.97 1ziy s PRO 23 Ca 0.65 0.90 0.01 0.00 0.04 0.00 0.00 61.00 62.59 1ziy s PRO 23 Cb -0.17 -2.10 0.54 0.00 0.04 0.00 0.00 34.50 32.80 1ziy s PRO 23 CO 0.37 -0.45 1.92 0.00 0.04 0.00 0.00 177.00 178.88 1ziy h ALA 24 N 0.36 1.52 -3.20 8.56 0.00 -1.79 -3.40 119.26 121.30 1ziy h ALA 24 Ca -0.46 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.17 1ziy h ALA 24 Cb 1.19 -0.27 -0.32 0.00 0.00 0.00 0.00 17.79 18.38 1ziy h ALA 24 CO 0.61 0.36 -0.60 0.21 0.00 0.00 0.00 179.25 179.83 1ziy s LYS 25 N -5.89 0.09 0.10 0.00 2.47 -1.26 -5.17 119.74 110.08 1ziy s LYS 25 Ca -0.11 0.43 0.01 0.00 -1.56 0.00 0.00 55.97 54.73 1ziy s LYS 25 Cb 0.19 -0.19 -0.04 0.00 -1.46 0.00 0.00 37.83 36.33 1ziy s LYS 25 CO 0.80 -0.20 0.23 0.00 0.16 0.00 0.00 175.35 176.34 1ziy s ALA 26 N 1.43 3.97 0.50 3.13 0.00 -1.26 -4.36 121.76 125.17 1ziy s ALA 26 Ca -0.06 -0.92 -0.18 0.00 0.00 0.00 0.00 51.96 50.79 1ziy s ALA 26 Cb -0.12 -1.79 -0.08 0.00 0.00 0.00 0.00 23.12 21.14 1ziy s ALA 26 CO -0.06 0.71 1.00 -1.25 0.00 0.00 0.00 175.76 176.17 1ziy s PRO 27 N -2.78 3.85 0.04 0.00 0.04 -1.26 -5.14 135.00 129.75 1ziy s PRO 27 Ca 0.35 1.15 -0.13 0.00 0.04 0.00 0.00 61.00 62.40 1ziy s PRO 27 Cb -0.12 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.32 1ziy s PRO 27 CO 0.28 -0.36 0.29 0.00 0.04 0.00 0.00 177.00 177.25 1ziy s ALA 28 N -2.31 -0.66 0.68 8.56 0.00 0.03 -4.76 121.76 123.30 1ziy s ALA 28 Ca 0.63 0.01 -0.14 0.00 0.00 0.00 0.00 51.96 52.45 1ziy s ALA 28 Cb -0.13 0.29 0.01 0.00 0.00 0.00 0.00 23.12 23.30 1ziy s ALA 28 CO 0.25 -0.39 1.12 -1.25 0.00 0.00 0.00 175.76 175.49 1ziy s PRO 29 N -2.41 2.62 -0.10 0.00 0.04 -1.26 -0.99 135.00 132.89 1ziy s PRO 29 Ca -0.06 1.43 -0.00 0.00 0.04 0.00 0.00 61.00 62.41 1ziy s PRO 29 Cb -0.01 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.58 1ziy s PRO 29 CO -0.02 -1.40 -0.09 0.08 0.04 0.00 0.00 177.00 175.61 1ziy s VAL 30 N -2.34 3.49 -0.22 -0.36 1.01 -0.76 -1.53 120.40 119.69 1ziy s VAL 30 Ca 0.68 -0.53 -0.06 0.00 0.00 0.00 0.00 61.98 62.07 1ziy s VAL 30 Cb -0.21 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1ziy s VAL 30 CO 0.44 0.55 0.02 -0.63 0.00 0.00 0.00 175.10 175.47 1ziy s ILE 31 N -0.20 3.96 -0.15 2.22 -1.09 -0.41 -1.19 121.20 124.35 1ziy s ILE 31 Ca 0.02 -0.30 -0.21 0.00 -2.23 0.00 0.00 60.65 57.93 1ziy s ILE 31 Cb -0.13 -2.82 -0.03 0.00 -1.58 0.00 0.00 42.46 37.90 1ziy s ILE 31 CO 0.03 0.39 0.64 -0.69 -1.23 0.00 0.00 174.94 174.08 1ziy s VAL 32 N 1.34 5.04 -0.23 2.92 1.01 -0.16 -0.80 120.40 129.52 1ziy s VAL 32 Ca 0.04 1.25 -0.08 0.00 0.00 0.00 0.00 61.98 63.19 1ziy s VAL 32 Cb -0.15 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 1ziy s VAL 32 CO 0.01 0.17 0.10 -0.63 0.00 0.00 0.00 175.10 174.75 1ziy s ILE 33 N 1.47 4.84 -0.34 2.22 1.01 0.21 -1.41 121.20 129.21 1ziy s ILE 33 Ca 0.31 -0.00 -0.15 0.00 0.00 0.00 0.00 60.65 60.81 1ziy s ILE 33 Cb -0.16 -3.24 -0.01 0.00 0.01 0.00 0.00 42.46 39.06 1ziy s ILE 33 CO 0.12 0.37 0.38 0.00 0.00 0.00 0.00 174.94 175.81 1ziy s ALA 34 N 1.06 3.50 1.01 9.38 0.00 0.70 -4.01 121.76 133.40 1ziy s ALA 34 Ca 0.05 -1.16 -0.13 0.00 0.00 0.00 0.00 51.96 50.73 1ziy s ALA 34 Cb -0.14 -2.83 0.14 0.00 0.00 0.00 0.00 23.12 20.29 1ziy s ALA 34 CO 0.04 -1.05 0.75 0.00 0.00 0.00 0.00 175.76 175.49 1ziy n GLN 35 N 5.41 -1.00 0.00 0.00 10.64 -1.26 -2.05 117.38 129.12 1ziy n GLN 35 Ca -0.09 -0.25 0.00 0.00 -1.83 0.00 0.00 57.00 54.84 1ziy n GLN 35 Cb 0.49 -2.09 0.00 0.00 -0.86 0.00 0.00 30.24 27.79 1ziy n GLN 35 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1ziy n GLU 36 N -3.36 1.31 -0.20 2.61 1.02 -1.18 -0.97 120.64 119.86 1ziy n GLU 36 Ca 0.07 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.26 1ziy n GLU 36 Cb 0.54 0.00 0.14 0.00 -0.02 0.00 0.00 31.44 32.11 1ziy n GLU 36 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1ziy n ILE 37 N 0.00 0.56 -0.53 -3.67 -5.35 -1.26 -4.05 119.36 105.06 1ziy n ILE 37 Ca 0.00 -0.45 0.08 0.00 -0.27 0.00 0.00 62.75 62.11 1ziy n ILE 37 Cb 0.00 0.09 0.27 0.00 -1.74 0.00 0.00 39.64 38.26 1ziy n ILE 37 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1ziy n PHE 38 N 0.38 1.02 -3.96 4.28 3.72 -1.26 -4.66 117.46 116.98 1ziy n PHE 38 Ca 0.11 -0.61 0.00 0.00 -0.05 0.00 0.00 57.45 56.89 1ziy n PHE 38 Cb 0.34 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 1ziy n PHE 38 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ziy n GLY 39 N 0.71 -1.59 3.35 1.37 0.00 -1.26 -0.89 105.19 106.88 1ziy n GLY 39 Ca 0.21 -1.33 -0.46 0.00 0.00 0.00 0.00 46.02 44.43 1ziy n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ziy s VAL 40 N 0.00 5.51 0.00 1.61 1.01 -1.11 -4.60 120.40 122.83 1ziy s VAL 40 Ca 0.00 -2.40 0.00 0.00 0.00 0.00 0.00 61.98 59.58 1ziy s VAL 40 Cb 0.00 -4.52 0.00 0.00 0.00 0.00 0.00 36.38 31.86 1ziy s VAL 40 CO 0.00 -1.11 0.00 -0.46 0.00 0.00 0.00 175.10 173.53 1ziy n ASN 41 N 4.28 0.97 -0.34 3.32 6.94 -1.26 -0.61 115.26 128.55 1ziy n ASN 41 Ca 0.16 0.00 0.01 0.00 -0.02 0.00 0.00 54.58 54.73 1ziy n ASN 41 Cb 0.47 0.00 0.16 0.00 -2.36 0.00 0.00 39.78 38.04 1ziy n ASN 41 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ziy h ALA 42 N 0.46 1.29 -0.25 -2.53 0.00 -1.92 -0.99 119.26 115.32 1ziy h ALA 42 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1ziy h ALA 42 Cb 0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1ziy h ALA 42 CO 0.00 0.39 -0.52 0.35 0.00 0.00 0.00 179.25 179.47 1ziy h PHE 43 N 1.10 0.88 -0.67 0.00 3.57 -1.95 -0.28 116.94 119.59 1ziy h PHE 43 Ca 0.40 -0.30 -0.03 0.00 3.53 0.00 0.00 57.97 61.57 1ziy h PHE 43 Cb 0.15 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 1ziy h PHE 43 CO -0.01 1.07 0.29 0.52 -2.23 0.00 0.00 178.31 177.95 1ziy h MET 44 N 0.55 0.98 -0.66 1.11 2.86 -1.72 -0.22 114.93 117.83 1ziy h MET 44 Ca 0.02 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.46 1ziy h MET 44 Cb 1.09 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 32.55 1ziy h MET 44 CO 0.11 0.80 0.25 -0.09 1.06 0.00 0.00 176.91 179.03 1ziy h ARG 45 N 0.93 0.98 -0.28 1.72 2.43 -0.56 0.33 114.38 119.94 1ziy h ARG 45 Ca 0.23 -0.17 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 1ziy h ARG 45 Cb 0.16 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1ziy h ARG 45 CO -0.02 0.81 -0.28 0.93 -1.51 0.00 0.00 179.97 179.90 1ziy h GLU 46 N 0.96 0.57 -0.11 0.20 5.08 -0.82 -0.55 114.58 119.90 1ziy h GLU 46 Ca 0.22 -0.23 -0.17 0.00 -1.00 0.00 0.00 59.36 58.18 1ziy h GLU 46 Cb 0.21 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1ziy h GLU 46 CO -0.02 0.79 -0.66 1.15 -1.00 0.00 0.00 179.01 179.28 1ziy h THR 47 N 0.49 1.36 -0.25 1.13 2.02 -0.28 -1.07 112.91 116.30 1ziy h THR 47 Ca 0.07 -2.00 -0.02 0.00 0.77 0.00 0.00 66.41 65.22 1ziy h THR 47 Cb 0.74 1.99 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 1ziy h THR 47 CO 0.06 0.61 0.09 0.58 0.37 0.00 0.00 175.52 177.23 1ziy h VAL 48 N 0.32 1.18 -0.68 3.16 2.07 -0.51 -1.97 116.25 119.82 1ziy h VAL 48 Ca -0.02 -0.57 0.04 0.00 0.82 0.00 0.00 66.70 66.97 1ziy h VAL 48 Cb 1.21 1.09 -0.05 0.00 -1.52 0.00 0.00 31.29 32.02 1ziy h VAL 48 CO 0.12 0.19 0.41 -1.28 0.02 0.00 0.00 177.57 177.02 1ziy h SER 49 N 0.25 0.65 0.19 0.57 0.87 -0.89 -1.30 113.55 113.89 1ziy h SER 49 Ca 0.08 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1ziy h SER 49 Cb 0.21 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1ziy h SER 49 CO -0.00 0.44 -0.09 -0.25 -0.53 0.00 0.00 176.83 176.40 1ziy h TRP 50 N 0.79 -0.23 -0.36 2.24 7.01 -1.10 -0.15 115.95 124.15 1ziy h TRP 50 Ca 0.28 -0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.21 1ziy h TRP 50 Cb 0.08 0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.19 1ziy h TRP 50 CO -0.05 -0.08 -0.05 -0.07 -2.79 0.00 0.00 178.44 175.39 1ziy h LEU 51 N -0.32 0.55 -0.62 0.65 3.38 -1.03 -1.50 115.31 116.43 1ziy h LEU 51 Ca -0.03 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 1ziy h LEU 51 Cb 0.25 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1ziy h LEU 51 CO 0.04 0.66 -0.05 0.58 0.09 0.00 0.00 178.44 179.76 1ziy h VAL 52 N 0.55 1.27 0.00 1.22 2.07 -1.03 -0.52 116.25 119.81 1ziy h VAL 52 Ca 0.11 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1ziy h VAL 52 Cb 0.42 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1ziy h VAL 52 CO 0.02 0.43 -0.03 0.44 0.02 0.00 0.00 177.57 178.45 1ziy h ASP 53 N 0.93 0.00 -0.71 0.57 3.32 -0.18 -1.57 116.42 118.78 1ziy h ASP 53 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1ziy h ASP 53 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1ziy h ASP 53 CO 0.04 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 177.59 1ziy n GLN 54 N -3.23 2.83 -0.44 3.56 1.13 -0.65 -4.95 117.38 115.65 1ziy n GLN 54 Ca -0.02 -2.67 0.00 0.00 -1.94 0.00 0.00 57.00 52.38 1ziy n GLN 54 Cb 0.19 -1.59 0.00 0.00 0.11 0.00 0.00 30.24 28.95 1ziy n GLN 54 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ziy n GLY 55 N 1.56 0.73 3.82 1.08 0.00 -0.59 -5.05 105.19 106.73 1ziy n GLY 55 Ca 0.24 -0.45 -0.24 0.00 0.00 0.00 0.00 46.02 45.57 1ziy n GLY 55 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ziy s TYR 56 N -2.00 2.37 0.35 1.61 2.02 -0.26 -4.67 117.35 116.76 1ziy s TYR 56 Ca 0.00 -0.64 0.06 0.00 -0.37 0.00 0.00 57.07 56.13 1ziy s TYR 56 Cb 0.00 -1.99 -0.01 0.00 -0.40 0.00 0.00 41.96 39.56 1ziy s TYR 56 CO 0.00 -0.05 0.49 0.00 -1.57 0.00 0.00 175.55 174.41 1ziy s ALA 57 N -2.62 4.22 -0.02 3.71 0.00 -0.58 -4.08 121.76 122.39 1ziy s ALA 57 Ca 0.40 -1.44 -0.07 0.00 0.00 0.00 0.00 51.96 50.85 1ziy s ALA 57 Cb 0.00 -1.71 0.01 0.00 0.00 0.00 0.00 23.12 21.42 1ziy s ALA 57 CO 0.23 -0.07 0.15 0.00 0.00 0.00 0.00 175.76 176.07 1ziy s ALA 58 N -2.21 -0.37 -0.07 0.00 0.00 -0.14 -1.29 121.76 117.68 1ziy s ALA 58 Ca 0.46 0.05 -0.01 0.00 0.00 0.00 0.00 51.96 52.46 1ziy s ALA 58 Cb -0.10 0.00 0.03 0.00 0.00 0.00 0.00 23.12 23.05 1ziy s ALA 58 CO 0.32 -0.18 -0.01 0.08 0.00 0.00 0.00 175.76 175.97 1ziy s VAL 59 N -0.98 0.49 -0.33 0.00 1.01 0.02 -0.86 120.40 119.74 1ziy s VAL 59 Ca -0.11 0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1ziy s VAL 59 Cb -0.06 -0.61 0.08 0.00 0.00 0.00 0.00 36.38 35.80 1ziy s VAL 59 CO 0.01 0.27 0.04 0.00 0.00 0.00 0.00 175.10 175.42 1ziy s PRO 61 N 1.06 3.96 -1.14 0.00 0.04 -1.26 -0.73 135.00 136.94 1ziy s PRO 61 Ca 0.03 1.52 -0.21 0.00 0.04 0.00 0.00 61.00 62.38 1ziy s PRO 61 Cb -0.20 -2.37 0.06 0.00 0.04 0.00 0.00 34.50 32.03 1ziy s PRO 61 CO -0.05 -0.32 1.57 0.34 0.04 0.00 0.00 177.00 178.57 1ziy s ASP 62 N -1.65 6.65 0.47 6.66 2.15 -0.52 -4.79 116.67 125.63 1ziy s ASP 62 Ca 0.62 -1.89 0.30 0.00 0.43 0.00 0.00 52.55 52.01 1ziy s ASP 62 Cb -0.22 -2.57 1.15 0.00 -0.30 0.00 0.00 42.92 40.98 1ziy s ASP 62 CO 0.27 -1.36 1.88 -0.07 -0.17 0.00 0.00 175.17 175.72 1ziy h LEU 63 N 12.65 0.00 -1.21 -1.34 3.38 -1.92 -2.11 115.31 124.75 1ziy h LEU 63 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1ziy h LEU 63 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1ziy h LEU 63 CO 1.44 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 178.75 1ziy n TYR 64 N -2.88 0.38 0.29 1.13 4.01 -1.26 -4.17 117.16 114.65 1ziy n TYR 64 Ca 0.01 -0.19 0.15 0.00 -0.16 0.00 0.00 57.90 57.72 1ziy n TYR 64 Cb 0.32 0.00 0.86 0.00 -0.31 0.00 0.00 39.34 40.22 1ziy n TYR 64 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ziy h ALA 65 N 3.76 1.31 0.00 -0.72 0.00 -1.58 0.38 119.26 122.41 1ziy h ALA 65 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ziy h ALA 65 Cb 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1ziy h ALA 65 CO 0.00 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1ziy h ARG 66 N 0.00 0.00 0.00 0.00 3.08 -1.83 -3.33 114.38 112.29 1ziy h ARG 66 Ca -0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 1ziy h ARG 66 Cb 0.18 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 1ziy h ARG 66 CO 0.01 0.00 -1.55 1.04 -1.07 0.00 0.00 179.97 178.40 1ziy n GLN 67 N -2.57 0.23 -3.19 0.04 6.02 -0.33 -5.01 117.38 112.58 1ziy n GLN 67 Ca 0.02 0.07 0.02 0.00 -0.01 0.00 0.00 57.00 57.11 1ziy n GLN 67 Cb 0.31 -1.05 -0.01 0.00 1.02 0.00 0.00 30.24 30.51 1ziy n GLN 67 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ziy s ALA 68 N -2.19 -2.40 0.33 -1.58 0.00 0.12 -5.15 121.76 110.90 1ziy s ALA 68 Ca -0.13 0.55 -0.29 0.00 0.00 0.00 0.00 51.96 52.09 1ziy s ALA 68 Cb 0.04 -2.66 -0.12 0.00 0.00 0.00 0.00 23.12 20.38 1ziy s ALA 68 CO 0.20 -2.07 1.38 -2.30 0.00 0.00 0.00 175.76 172.97 1ziy n PRO 69 N 4.81 2.30 -1.07 0.00 -0.02 -1.25 -2.95 135.00 136.81 1ziy n PRO 69 Ca 0.09 0.81 -0.03 0.00 -2.02 0.00 0.00 63.50 62.35 1ziy n PRO 69 Cb 0.56 -2.45 -0.01 0.00 -0.02 0.00 0.00 33.50 31.57 1ziy n PRO 69 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ziy n GLY 70 N 1.04 0.58 3.71 -1.23 0.00 -1.26 -4.99 105.19 103.04 1ziy n GLY 70 Ca 0.05 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 1ziy n GLY 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ziy s THR 71 N -2.08 3.56 -0.28 2.61 2.01 -1.15 -4.85 115.64 115.46 1ziy s THR 71 Ca 0.00 1.11 -0.01 0.00 0.31 0.00 0.00 61.69 63.10 1ziy s THR 71 Cb 0.00 -3.71 0.13 0.00 0.01 0.00 0.00 72.50 68.93 1ziy s THR 71 CO 0.00 0.08 0.28 0.00 -0.69 0.00 0.00 174.62 174.29 1ziy s ALA 72 N 1.18 -0.41 -0.11 7.40 0.00 -1.26 -2.74 121.76 125.83 1ziy s ALA 72 Ca 0.63 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 52.25 1ziy s ALA 72 Cb -0.34 -1.75 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 1ziy s ALA 72 CO 0.30 -1.67 0.04 -0.51 0.00 0.00 0.00 175.76 173.92 1ziy s LEU 73 N 2.35 3.80 -0.41 0.00 1.43 -0.06 -4.96 118.68 120.83 1ziy s LEU 73 Ca 0.09 0.22 -0.28 0.00 -1.03 0.00 0.00 54.13 53.13 1ziy s LEU 73 Cb -0.14 -1.90 0.02 0.00 0.03 0.00 0.00 46.19 44.21 1ziy s LEU 73 CO -0.32 0.36 1.03 -0.62 0.23 0.00 0.00 176.35 177.04 1ziy s ASP 74 N -0.77 6.68 0.00 2.29 -1.08 -1.26 -4.80 116.67 117.73 1ziy s ASP 74 Ca 0.12 0.55 0.11 0.00 -0.52 0.00 0.00 52.55 52.81 1ziy s ASP 74 Cb -0.12 -2.51 0.55 0.00 -1.46 0.00 0.00 42.92 39.39 1ziy s ASP 74 CO 0.03 -1.04 1.21 -0.81 0.52 0.00 0.00 175.17 175.08 1ziy n PRO 75 N 7.25 0.18 0.00 4.34 -0.04 -1.26 -1.36 135.00 144.11 1ziy n PRO 75 Ca 0.10 0.16 0.12 0.00 -0.04 0.00 0.00 63.50 63.83 1ziy n PRO 75 Cb 0.48 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.55 1ziy n PRO 75 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1ziy n GLN 76 N -1.25 1.08 -3.60 0.54 6.02 -1.26 -4.82 117.38 114.09 1ziy n GLN 76 Ca 0.05 -0.83 -0.38 0.00 -0.01 0.00 0.00 57.00 55.84 1ziy n GLN 76 Cb 0.08 -1.48 -0.11 0.00 1.02 0.00 0.00 30.24 29.75 1ziy n GLN 76 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1ziy s ASP 77 N -2.49 6.05 0.21 1.08 -1.08 -0.46 -4.99 116.67 114.98 1ziy s ASP 77 Ca 0.20 0.02 -0.09 0.00 -0.52 0.00 0.00 52.55 52.16 1ziy s ASP 77 Cb 0.18 -2.12 0.24 0.00 -1.46 0.00 0.00 42.92 39.76 1ziy s ASP 77 CO 0.56 -0.03 1.83 -0.33 0.52 0.00 0.00 175.17 177.72 1ziy h GLU 78 N 8.21 0.79 -0.67 4.34 5.08 -1.87 -0.51 114.58 129.94 1ziy h GLU 78 Ca -0.35 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 57.90 1ziy h GLU 78 Cb 1.19 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.23 1ziy h GLU 78 CO 0.57 0.52 0.17 0.00 -1.00 0.00 0.00 179.01 179.28 1ziy h ARG 79 N 0.82 1.06 -0.20 2.33 3.08 -1.94 -0.94 114.38 118.59 1ziy h ARG 79 Ca 0.31 -0.24 -0.14 0.00 0.07 0.00 0.00 59.98 59.97 1ziy h ARG 79 Cb 0.11 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1ziy h ARG 79 CO -0.15 0.93 -0.48 1.96 -1.07 0.00 0.00 179.97 181.16 1ziy h GLN 80 N 1.01 0.52 -0.47 0.04 4.20 -1.67 -1.59 115.11 117.14 1ziy h GLN 80 Ca 0.21 -0.30 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 1ziy h GLN 80 Cb 0.34 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 1ziy h GLN 80 CO -0.00 0.89 0.03 0.00 -0.67 0.00 0.00 178.83 179.08 1ziy h ARG 81 N 0.41 0.76 -0.52 1.46 3.08 -0.70 0.92 114.38 119.79 1ziy h ARG 81 Ca 0.02 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 59.83 1ziy h ARG 81 Cb 1.00 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.93 1ziy h ARG 81 CO 0.09 0.75 0.12 0.93 -1.07 0.00 0.00 179.97 180.79 1ziy h GLU 82 N 0.72 0.84 -0.38 0.04 5.08 -0.87 -0.40 114.58 119.61 1ziy h GLU 82 Ca 0.15 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1ziy h GLU 82 Cb 0.40 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1ziy h GLU 82 CO 0.01 0.80 -0.06 0.37 -1.00 0.00 0.00 179.01 179.13 1ziy h GLN 83 N 0.73 0.63 -0.77 2.33 5.75 -0.90 -2.52 115.11 120.36 1ziy h GLN 83 Ca 0.16 -0.17 -0.03 0.00 -0.15 0.00 0.00 58.65 58.45 1ziy h GLN 83 Cb 0.34 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.79 1ziy h GLN 83 CO 0.00 0.70 0.34 0.00 -2.65 0.00 0.00 178.83 177.22 1ziy h ALA 84 N 1.35 0.99 -0.43 3.38 0.00 -0.11 -1.62 119.26 122.81 1ziy h ALA 84 Ca 0.11 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1ziy h ALA 84 Cb 0.47 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ziy h ALA 84 CO 0.02 0.58 -0.20 1.88 0.00 0.00 0.00 179.25 181.54 1ziy h TYR 85 N 1.09 0.97 -0.64 0.00 0.05 -0.82 -0.87 116.97 116.76 1ziy h TYR 85 Ca 0.26 -0.22 -0.07 0.00 0.05 0.00 0.00 58.73 58.75 1ziy h TYR 85 Cb 0.16 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.64 1ziy h TYR 85 CO 0.01 0.98 0.11 -0.22 -1.05 0.00 0.00 178.16 177.99 1ziy h LYS 86 N 0.75 1.06 -0.53 4.88 3.64 -1.21 -0.65 116.57 124.50 1ziy h LYS 86 Ca 0.11 -0.28 -0.09 0.00 -1.27 0.00 0.00 60.65 59.11 1ziy h LYS 86 Cb 0.73 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 1ziy h LYS 86 CO 0.06 0.98 -0.03 -0.07 -2.27 0.00 0.00 179.45 178.11 1ziy h LEU 87 N 0.97 0.94 -0.57 5.20 3.38 -1.09 -2.33 115.31 121.83 1ziy h LEU 87 Ca 0.20 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1ziy h LEU 87 Cb 0.43 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1ziy h LEU 87 CO 0.01 1.04 0.22 -0.25 0.09 0.00 0.00 178.44 179.55 1ziy h TRP 88 N 0.83 0.86 -0.25 1.13 7.01 -0.97 -1.35 115.95 123.21 1ziy h TRP 88 Ca 0.15 -0.07 -0.03 0.00 2.11 0.00 0.00 58.89 61.05 1ziy h TRP 88 Cb 0.57 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.36 1ziy h TRP 88 CO 0.04 0.70 0.02 0.37 -2.79 0.00 0.00 178.44 176.79 1ziy h GLN 89 N 0.78 0.37 -0.02 2.65 5.75 -0.89 -1.65 115.11 122.10 1ziy h GLN 89 Ca 0.19 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 1ziy h GLN 89 Cb 0.20 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.69 1ziy h GLN 89 CO -0.02 0.38 -0.05 0.00 -2.65 0.00 0.00 178.83 176.49 1ziy n ALA 90 N -2.49 2.63 -2.11 3.38 0.00 -0.90 -4.95 120.51 116.08 1ziy n ALA 90 Ca 0.01 -0.53 -0.42 0.00 0.00 0.00 0.00 53.44 52.50 1ziy n ALA 90 Cb 0.19 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 1ziy n ALA 90 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ziy s PHE 91 N -2.07 3.23 -0.53 0.00 5.36 -0.53 -4.96 117.98 118.48 1ziy s PHE 91 Ca 0.33 1.01 -0.23 0.00 -0.96 0.00 0.00 56.93 57.07 1ziy s PHE 91 Cb 0.20 -3.68 0.04 0.00 -0.34 0.00 0.00 43.02 39.25 1ziy s PHE 91 CO 0.35 -2.31 0.87 0.34 -1.46 0.00 0.00 175.22 173.01 1ziy s ASP 92 N 0.90 6.32 0.21 6.13 -1.08 -1.26 -4.93 116.67 122.96 1ziy s ASP 92 Ca 0.63 -0.44 -0.08 0.00 -0.52 0.00 0.00 52.55 52.14 1ziy s ASP 92 Cb -0.37 -2.40 0.14 0.00 -1.46 0.00 0.00 42.92 38.82 1ziy s ASP 92 CO 0.33 -1.14 1.75 0.24 0.52 0.00 0.00 175.17 176.87 1ziy h MET 93 N 9.22 1.16 -0.45 4.34 2.86 -1.97 -0.32 114.93 129.77 1ziy h MET 93 Ca -0.26 -0.23 -0.07 0.00 -2.06 0.00 0.00 59.70 57.07 1ziy h MET 93 Cb 1.08 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.55 1ziy h MET 93 CO 1.05 0.97 0.01 0.93 1.06 0.00 0.00 176.91 180.94 1ziy h GLU 94 N 1.12 0.78 0.00 1.72 3.07 -2.00 -0.69 114.58 118.58 1ziy h GLU 94 Ca 0.25 -0.24 -0.08 0.00 -0.50 0.00 0.00 59.36 58.79 1ziy h GLU 94 Cb 0.27 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 1ziy h GLU 94 CO -0.01 0.84 -0.37 0.00 -1.40 0.00 0.00 179.01 178.07 1ziy h ALA 95 N 0.91 1.34 -0.44 3.43 0.00 -1.90 -2.18 119.26 120.43 1ziy h ALA 95 Ca 0.13 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 1ziy h ALA 95 Cb 0.48 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ziy h ALA 95 CO 0.02 0.46 -0.13 0.78 0.00 0.00 0.00 179.25 180.38 1ziy h GLY 96 N 1.19 0.87 1.17 0.00 0.00 -0.10 -0.01 103.07 106.19 1ziy h GLY 96 Ca -0.00 -0.68 -0.10 0.00 0.00 0.00 0.00 47.33 46.55 1ziy h GLY 96 CO 0.05 0.62 -0.05 -2.08 0.00 0.00 0.00 176.54 175.08 1ziy h VAL 97 N 0.72 1.26 -0.26 4.60 2.07 -0.70 -1.19 116.25 122.75 1ziy h VAL 97 Ca 0.12 -1.18 -0.10 0.00 0.82 0.00 0.00 66.70 66.36 1ziy h VAL 97 Cb 0.62 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1ziy h VAL 97 CO 0.04 0.42 -0.24 1.23 0.02 0.00 0.00 177.57 179.04 1ziy h GLY 98 N 0.98 0.55 1.16 2.17 0.00 -1.00 -0.79 103.07 106.14 1ziy h GLY 98 Ca 0.15 -0.44 -0.16 0.00 0.00 0.00 0.00 47.33 46.88 1ziy h GLY 98 CO 0.04 0.41 -0.41 -0.55 0.00 0.00 0.00 176.54 176.02 1ziy h ASP 99 N 0.45 0.98 -0.71 0.19 3.32 -0.74 -1.99 116.42 117.91 1ziy h ASP 99 Ca 0.07 -0.46 -0.07 0.00 0.02 0.00 0.00 57.03 56.59 1ziy h ASP 99 Cb 0.66 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 1ziy h ASP 99 CO 0.05 1.25 0.18 -0.07 -1.72 0.00 0.00 179.24 178.93 1ziy h LEU 100 N 0.73 1.07 -0.77 1.55 3.38 -0.97 -0.78 115.31 119.52 1ziy h LEU 100 Ca 0.05 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.82 1ziy h LEU 100 Cb 1.01 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1ziy h LEU 100 CO 0.10 1.02 0.50 -0.08 0.09 0.00 0.00 178.44 180.07 1ziy h GLU 101 N 1.08 0.96 -0.43 1.13 4.81 -0.80 0.52 114.58 121.85 1ziy h GLU 101 Ca 0.23 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.31 1ziy h GLU 101 Cb 0.36 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1ziy h GLU 101 CO 0.00 0.63 -0.09 0.00 -0.73 0.00 0.00 179.01 178.82 1ziy h ALA 102 N 1.31 1.03 -0.08 2.92 0.00 -1.00 -0.85 119.26 122.59 1ziy h ALA 102 Ca 0.30 -0.30 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1ziy h ALA 102 Cb -0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1ziy h ALA 102 CO -0.10 0.59 -0.64 0.00 0.00 0.00 0.00 179.25 179.10 1ziy h ALA 103 N 1.21 0.75 -0.39 0.00 0.00 -0.48 -1.84 119.26 118.51 1ziy h ALA 103 Ca 0.12 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 1ziy h ALA 103 Cb 0.56 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1ziy h ALA 103 CO 0.03 0.74 -0.25 0.82 0.00 0.00 0.00 179.25 180.59 1ziy h ILE 104 N 0.22 1.28 -0.53 0.00 2.04 -0.58 0.92 117.51 120.86 1ziy h ILE 104 Ca -0.01 -1.41 -0.01 0.00 1.00 0.00 0.00 64.86 64.43 1ziy h ILE 104 Cb 1.17 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 1ziy h ILE 104 CO 0.10 0.47 0.28 0.03 0.00 0.00 0.00 178.15 179.03 1ziy h ARG 105 N 0.66 0.75 -0.81 2.37 3.08 -1.09 -1.26 114.38 118.07 1ziy h ARG 105 Ca 0.08 -0.09 0.01 0.00 0.07 0.00 0.00 59.98 60.04 1ziy h ARG 105 Cb 0.82 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.69 1ziy h ARG 105 CO 0.07 0.59 0.53 -0.92 -1.07 0.00 0.00 179.97 179.18 1ziy h TYR 106 N 0.71 1.02 -0.42 3.04 5.03 -1.08 -2.66 116.97 122.60 1ziy h TYR 106 Ca 0.18 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.51 1ziy h TYR 106 Cb 0.07 -0.34 -0.02 0.00 1.55 0.00 0.00 36.73 37.99 1ziy h TYR 106 CO -0.01 0.64 0.23 0.00 -1.32 0.00 0.00 178.16 177.70 1ziy h ALA 107 N 1.29 0.54 -0.51 1.82 0.00 -0.12 -2.92 119.26 119.36 1ziy h ALA 107 Ca 0.30 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1ziy h ALA 107 Cb -0.12 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1ziy h ALA 107 CO -0.06 0.06 0.34 0.00 0.00 0.00 0.00 179.25 179.59 1ziy h ARG 108 N 0.55 0.53 -0.57 0.00 3.08 -0.90 -2.97 114.38 114.09 1ziy h ARG 108 Ca 0.15 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 1ziy h ARG 108 Cb 0.05 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 1ziy h ARG 108 CO -0.02 0.35 0.08 -2.39 -1.07 0.00 0.00 179.97 176.91 1ziy n HIS 109 N -4.47 2.00 -2.68 3.04 1.44 -1.11 -4.45 115.22 108.99 1ziy n HIS 109 Ca 0.06 -0.91 -0.34 0.00 -2.01 0.00 0.00 57.72 54.52 1ziy n HIS 109 Cb 0.18 -0.54 -0.05 0.00 0.12 0.00 0.00 29.99 29.70 1ziy n HIS 109 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1ziy s GLN 110 N -2.86 4.10 0.55 -1.40 -1.52 -1.13 -4.93 119.66 112.48 1ziy s GLN 110 Ca 0.53 1.28 0.29 0.00 -1.95 0.00 0.00 55.36 55.51 1ziy s GLN 110 Cb 0.41 -2.25 1.46 0.00 -0.22 0.00 0.00 33.01 32.41 1ziy s GLN 110 CO 0.14 -0.16 1.91 -1.00 -0.25 0.00 0.00 175.29 175.93 1ziy h PRO 111 N 1.98 0.00 -0.12 2.91 0.13 -1.93 -1.71 132.00 133.26 1ziy h PRO 111 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1ziy h PRO 111 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1ziy h PRO 111 CO 0.61 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.86 1ziy n TYR 112 N -4.09 0.13 -2.69 1.56 0.18 -1.26 -4.95 117.16 106.04 1ziy n TYR 112 Ca 0.13 -0.07 -0.40 0.00 1.88 0.00 0.00 57.90 59.45 1ziy n TYR 112 Cb 0.79 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.69 1ziy n TYR 112 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1ziy s SER 113 N -1.81 7.53 0.00 9.48 0.15 -0.64 -0.79 113.70 127.62 1ziy s SER 113 Ca 0.34 2.01 0.17 0.00 0.70 0.00 0.00 55.95 59.18 1ziy s SER 113 Cb 0.20 -2.61 0.55 0.00 -1.71 0.00 0.00 66.02 62.45 1ziy s SER 113 CO 0.31 0.07 1.42 -0.46 1.20 0.00 0.00 173.24 175.78 1ziy n ASN 114 N 1.34 1.98 0.00 5.45 6.94 -0.17 -4.60 115.26 126.21 1ziy n ASN 114 Ca -0.01 -1.86 0.00 0.00 -0.02 0.00 0.00 54.58 52.69 1ziy n ASN 114 Cb 0.47 -0.19 0.00 0.00 -2.36 0.00 0.00 39.78 37.70 1ziy n ASN 114 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ziy n GLY 115 N 1.15 1.50 3.71 4.83 0.00 -1.26 -4.96 105.19 110.16 1ziy n GLY 115 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1ziy n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ziy s LYS 116 N -0.39 3.04 -0.03 1.61 -0.14 -1.26 -4.97 119.74 117.61 1ziy s LYS 116 Ca 0.00 -0.37 0.03 0.00 -1.36 0.00 0.00 55.97 54.26 1ziy s LYS 116 Cb 0.00 -2.84 0.00 0.00 -1.68 0.00 0.00 37.83 33.31 1ziy s LYS 116 CO 0.00 0.71 -0.10 0.08 -0.76 0.00 0.00 175.35 175.29 1ziy s VAL 117 N -0.90 0.84 0.35 3.17 1.01 -1.26 -1.83 120.40 121.78 1ziy s VAL 117 Ca 0.14 -0.39 0.09 0.00 0.00 0.00 0.00 61.98 61.81 1ziy s VAL 117 Cb -0.11 -0.75 -0.07 0.00 0.00 0.00 0.00 36.38 35.45 1ziy s VAL 117 CO 0.03 0.26 -0.08 -0.83 0.00 0.00 0.00 175.10 174.48 1ziy s GLY 118 N 0.19 2.22 -0.01 4.51 0.00 -0.33 -1.70 107.32 112.20 1ziy s GLY 118 Ca -0.03 -2.12 0.01 0.00 0.00 0.00 0.00 44.72 42.59 1ziy s GLY 118 CO 0.01 -2.03 -0.05 -2.27 0.00 0.00 0.00 173.10 168.76 1ziy s LEU 119 N -3.61 1.80 -0.08 0.66 0.20 -0.70 -0.98 118.68 115.95 1ziy s LEU 119 Ca 0.33 -0.09 0.02 0.00 0.69 0.00 0.00 54.13 55.07 1ziy s LEU 119 Cb 0.04 -0.30 0.02 0.00 -0.43 0.00 0.00 46.19 45.52 1ziy s LEU 119 CO 0.16 0.03 -0.12 -0.69 -0.29 0.00 0.00 176.35 175.44 1ziy s VAL 120 N 0.18 1.16 0.14 1.68 1.01 -0.50 0.06 120.40 124.13 1ziy s VAL 120 Ca -0.02 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.57 1ziy s VAL 120 Cb -0.06 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1ziy s VAL 120 CO -0.00 0.37 -0.15 -0.83 0.00 0.00 0.00 175.10 174.49 1ziy s GLY 121 N 0.97 1.16 -0.04 4.51 0.00 0.26 -0.22 107.32 113.96 1ziy s GLY 121 Ca -0.09 -1.37 0.09 0.00 0.00 0.00 0.00 44.72 43.36 1ziy s GLY 121 CO -0.00 -1.43 1.07 -1.72 0.00 0.00 0.00 173.10 171.02 1ziy n TYR 122 N 0.39 0.00 0.00 1.90 4.02 -0.87 -0.80 117.16 121.79 1ziy n TYR 122 Ca -0.14 -0.40 0.00 0.00 -0.01 0.00 0.00 57.90 57.35 1ziy n TYR 122 Cb 0.57 -0.10 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 1ziy n TYR 122 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 176.86 175.74 1ziy n LEU 124 N -0.32 0.00 0.24 7.72 7.94 -1.26 -3.11 117.00 128.22 1ziy n LEU 124 Ca 0.06 0.00 0.10 0.00 -1.11 0.00 0.00 56.01 55.05 1ziy n LEU 124 Cb 0.75 0.00 0.63 0.00 0.53 0.00 0.00 43.42 45.33 1ziy n LEU 124 CO -0.01 0.00 0.93 1.23 -1.11 0.00 0.00 177.39 178.44 1ziy h GLY 125 N 0.00 0.00 1.35 -3.96 0.00 -1.23 -1.30 103.07 97.93 1ziy h GLY 125 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.12 1ziy h GLY 125 CO 0.00 0.00 -0.74 -1.33 0.00 0.00 0.00 176.54 174.47 1ziy h GLY 126 N 0.77 0.71 1.13 4.60 0.00 -1.70 0.15 103.07 108.74 1ziy h GLY 126 Ca -0.00 -0.99 -0.15 0.00 0.00 0.00 0.00 47.33 46.19 1ziy h GLY 126 CO 0.02 0.88 -0.34 0.00 0.00 0.00 0.00 176.54 177.10 1ziy h ALA 127 N 0.72 0.60 -0.46 3.60 0.00 -1.77 -2.65 119.26 119.30 1ziy h ALA 127 Ca -0.04 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 1ziy h ALA 127 Cb 1.35 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1ziy h ALA 127 CO 0.14 0.68 -0.02 -0.07 0.00 0.00 0.00 179.25 179.98 1ziy h LEU 128 N 0.79 0.75 -1.17 0.00 3.38 -1.18 -2.32 115.31 115.55 1ziy h LEU 128 Ca 0.07 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 1ziy h LEU 128 Cb 0.94 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 1ziy h LEU 128 CO 0.09 0.83 0.48 0.00 0.09 0.00 0.00 178.44 179.93 1ziy h ALA 129 N 1.25 1.39 -0.36 1.53 0.00 -0.38 -0.27 119.26 122.42 1ziy h ALA 129 Ca 0.14 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1ziy h ALA 129 Cb 0.47 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ziy h ALA 129 CO 0.02 0.54 -0.13 0.35 0.00 0.00 0.00 179.25 180.03 1ziy h PHE 130 N 1.06 0.82 -0.38 0.00 3.57 -1.09 -0.55 116.94 120.37 1ziy h PHE 130 Ca 0.28 -0.19 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 1ziy h PHE 130 Cb -0.07 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.46 1ziy h PHE 130 CO 0.00 0.90 0.03 -0.07 -2.23 0.00 0.00 178.31 176.94 1ziy h LEU 131 N 0.51 0.54 -0.40 0.59 3.38 -0.99 -0.58 115.31 118.36 1ziy h LEU 131 Ca 0.08 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 1ziy h LEU 131 Cb 0.66 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1ziy h LEU 131 CO 0.04 0.60 -0.24 0.58 0.09 0.00 0.00 178.44 179.52 1ziy h VAL 132 N 0.56 1.28 -0.54 1.22 2.07 -0.92 -2.09 116.25 117.83 1ziy h VAL 132 Ca 0.12 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.25 1ziy h VAL 132 Cb 0.32 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1ziy h VAL 132 CO 0.01 0.46 0.32 0.00 0.02 0.00 0.00 177.57 178.39 1ziy h ALA 133 N 0.80 0.69 0.00 1.67 0.00 -0.46 -0.30 119.26 121.66 1ziy h ALA 133 Ca 0.08 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1ziy h ALA 133 Cb 0.80 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1ziy h ALA 133 CO 0.07 0.18 -0.13 0.00 0.00 0.00 0.00 179.25 179.37 1ziy h ALA 134 N 1.16 1.49 0.02 0.00 0.00 -0.87 -2.56 119.26 118.50 1ziy h ALA 134 Ca 0.19 -0.12 -0.23 0.00 0.00 0.00 0.00 54.91 54.75 1ziy h ALA 134 Cb -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1ziy h ALA 134 CO -0.04 0.16 -1.15 0.87 0.00 0.00 0.00 179.25 179.10 1ziy h LYS 135 N 0.00 0.05 0.00 0.00 1.79 -0.68 -3.40 116.57 114.33 1ziy h LYS 135 Ca -0.00 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1ziy h LYS 135 Cb 0.28 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1ziy h LYS 135 CO 0.02 0.97 0.00 0.41 -1.08 0.00 0.00 179.45 179.77 1ziy n GLY 136 N 1.41 0.59 0.24 3.86 0.00 -0.19 -4.98 105.19 106.12 1ziy n GLY 136 Ca -0.04 -0.79 0.16 0.00 0.00 0.00 0.00 46.02 45.34 1ziy n GLY 136 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1ziy h TYR 137 N 0.00 0.00 -2.58 1.61 0.05 -1.84 -3.46 116.97 110.75 1ziy h TYR 137 Ca 0.00 0.00 -0.51 0.00 0.05 0.00 0.00 58.73 58.27 1ziy h TYR 137 Cb 0.16 0.00 -0.14 0.00 1.01 0.00 0.00 36.73 37.76 1ziy h TYR 137 CO 0.00 0.00 -0.67 0.14 -1.05 0.00 0.00 178.16 176.58 1ziy s VAL 138 N -3.55 1.69 0.07 -2.88 -7.23 -1.26 -4.97 120.40 102.27 1ziy s VAL 138 Ca 0.02 -2.13 -0.15 0.00 -1.81 0.00 0.00 61.98 57.92 1ziy s VAL 138 Cb 0.09 -2.47 -0.22 0.00 0.56 0.00 0.00 36.38 34.34 1ziy s VAL 138 CO 0.52 -0.29 1.20 0.44 -0.31 0.00 0.00 175.10 176.67 1ziy h ASP 139 N 2.25 0.87 -4.45 4.85 3.32 -1.65 -3.46 116.42 118.15 1ziy h ASP 139 Ca -0.40 -0.72 -0.14 0.00 0.02 0.00 0.00 57.03 55.79 1ziy h ASP 139 Cb 1.24 -0.27 -0.23 0.00 0.22 0.00 0.00 39.33 40.29 1ziy h ASP 139 CO 0.67 1.47 -0.40 -0.13 -1.72 0.00 0.00 179.24 179.14 1ziy s ARG 140 N -3.40 0.45 0.05 3.56 0.52 -1.24 -3.98 118.95 114.91 1ziy s ARG 140 Ca -0.10 0.01 0.05 0.00 -0.52 0.00 0.00 55.73 55.16 1ziy s ARG 140 Cb 0.07 0.20 -0.02 0.00 0.52 0.00 0.00 34.95 35.72 1ziy s ARG 140 CO 0.91 -0.10 -0.15 0.00 0.02 0.00 0.00 175.30 175.98 1ziy s ALA 141 N -0.67 1.21 -0.03 2.13 0.00 -0.78 -1.72 121.76 121.89 1ziy s ALA 141 Ca -0.08 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.01 1ziy s ALA 141 Cb -0.04 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.92 1ziy s ALA 141 CO 0.02 0.22 -0.06 0.08 0.00 0.00 0.00 175.76 176.02 1ziy s VAL 142 N -0.97 0.55 -0.06 0.00 1.01 0.11 -0.34 120.40 120.70 1ziy s VAL 142 Ca 0.01 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 61.84 1ziy s VAL 142 Cb -0.08 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.77 1ziy s VAL 142 CO 0.02 0.20 -0.18 -0.83 0.00 0.00 0.00 175.10 174.31 1ziy s GLY 143 N 0.50 1.01 -0.21 4.51 0.00 0.49 -0.58 107.32 113.03 1ziy s GLY 143 Ca -0.07 -0.71 -0.07 0.00 0.00 0.00 0.00 44.72 43.88 1ziy s GLY 143 CO 0.00 -0.25 0.06 -0.19 0.00 0.00 0.00 173.10 172.72 1ziy s TYR 144 N 0.25 3.13 -1.22 1.90 1.51 0.02 -0.97 117.35 121.97 1ziy s TYR 144 Ca -0.10 -0.22 -0.10 0.00 -1.01 0.00 0.00 57.07 55.64 1ziy s TYR 144 Cb -0.14 -2.15 0.01 0.00 -0.11 0.00 0.00 41.96 39.57 1ziy s TYR 144 CO 0.04 -0.14 0.18 2.48 -1.11 0.00 0.00 175.55 177.01 1ziy n TYR 145 N 4.27 -1.09 -2.16 2.71 0.18 0.10 -4.33 117.16 116.84 1ziy n TYR 145 Ca -0.16 0.36 -0.40 0.00 1.88 0.00 0.00 57.90 59.57 1ziy n TYR 145 Cb 0.52 -2.36 -0.02 0.00 -0.38 0.00 0.00 39.34 37.10 1ziy n TYR 145 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1ziy s GLY 146 N -4.04 3.00 0.10 -7.48 0.00 -1.26 -4.80 107.32 92.83 1ziy s GLY 146 Ca 0.14 1.21 -0.17 0.00 0.00 0.00 0.00 44.72 45.89 1ziy s GLY 146 CO 0.84 1.85 0.55 0.14 0.00 0.00 0.00 173.10 176.48 1ziy s VAL 147 N -1.16 4.80 -1.08 1.40 1.01 -1.26 -4.43 120.40 119.68 1ziy s VAL 147 Ca 0.49 1.06 0.00 0.00 0.00 0.00 0.00 61.98 63.53 1ziy s VAL 147 Cb -0.39 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.17 1ziy s VAL 147 CO 0.51 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.66 1ziy n GLY 148 N 1.38 0.52 0.26 4.51 0.00 -1.26 -4.73 105.19 105.87 1ziy n GLY 148 Ca -0.09 -0.45 0.11 0.00 0.00 0.00 0.00 46.02 45.59 1ziy n GLY 148 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ziy h LEU 149 N 0.00 0.00 -2.48 0.99 3.38 -1.97 -2.31 115.31 112.92 1ziy h LEU 149 Ca -0.25 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 1ziy h LEU 149 Cb 0.99 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 1ziy h LEU 149 CO 0.33 0.13 -0.00 1.05 0.09 0.00 0.00 178.44 180.04 1ziy h GLU 150 N 0.00 0.00 -0.10 1.13 9.09 -1.91 -1.70 114.58 121.09 1ziy h GLU 150 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1ziy h GLU 150 Cb 0.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.41 1ziy h GLU 150 CO 0.02 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.71 1ziy n LYS 151 N -3.08 1.80 -0.05 1.06 5.02 -0.87 -4.04 118.16 118.00 1ziy n LYS 151 Ca -0.02 -1.19 0.04 0.00 -2.02 0.00 0.00 58.31 55.12 1ziy n LYS 151 Cb 0.15 -1.45 0.05 0.00 -0.02 0.00 0.00 35.03 33.76 1ziy n LYS 151 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1ziy n GLN 152 N 0.42 2.03 0.27 1.97 1.13 -0.64 -4.80 117.38 117.77 1ziy n GLN 152 Ca 0.18 -1.83 0.17 0.00 -1.94 0.00 0.00 57.00 53.57 1ziy n GLN 152 Cb 0.38 -1.14 0.91 0.00 0.11 0.00 0.00 30.24 30.51 1ziy n GLN 152 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1ziy h LEU 153 N 0.00 0.00 0.00 1.08 4.07 -1.70 -0.22 115.31 118.54 1ziy h LEU 153 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1ziy h LEU 153 Cb 0.76 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.50 1ziy h LEU 153 CO 0.00 0.00 0.00 0.59 -1.08 0.00 0.00 178.44 177.95 1ziy n ASN 154 N -3.72 0.00 -0.15 -0.43 4.13 -1.26 -1.91 115.26 111.92 1ziy n ASN 154 Ca -0.01 0.44 0.12 0.00 1.68 0.00 0.00 54.58 56.81 1ziy n ASN 154 Cb 0.18 -0.47 0.17 0.00 -1.54 0.00 0.00 39.78 38.12 1ziy n ASN 154 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1ziy n LYS 155 N -1.47 0.43 -0.25 3.52 5.02 -0.09 -4.46 118.16 120.85 1ziy n LYS 155 Ca 0.03 -0.29 0.05 0.00 -2.02 0.00 0.00 58.31 56.07 1ziy n LYS 155 Cb 0.13 -1.49 0.15 0.00 -0.02 0.00 0.00 35.03 33.80 1ziy n LYS 155 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1ziy h VAL 156 N 0.72 0.36 0.00 -0.18 2.07 -1.54 -0.88 116.25 116.80 1ziy h VAL 156 Ca 0.00 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1ziy h VAL 156 Cb 0.54 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1ziy h VAL 156 CO 0.00 0.02 0.00 -0.81 0.02 0.00 0.00 177.57 176.80 1ziy n PRO 157 N -5.34 0.08 0.13 1.57 -0.04 -1.26 -2.39 135.00 127.76 1ziy n PRO 157 Ca 0.13 0.13 0.13 0.00 -0.04 0.00 0.00 63.50 63.85 1ziy n PRO 157 Cb 0.46 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.82 1ziy n PRO 157 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1ziy h GLU 158 N 0.00 0.00 -6.31 0.54 5.08 -1.46 -3.44 114.58 109.00 1ziy h GLU 158 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 1ziy h GLU 158 Cb 0.32 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 1ziy h GLU 158 CO 0.00 0.00 1.06 0.08 -1.00 0.00 0.00 179.01 179.15 1ziy s VAL 159 N -3.19 3.88 -0.89 3.13 1.01 -1.00 -4.74 120.40 118.60 1ziy s VAL 159 Ca 0.08 1.00 0.07 0.00 0.00 0.00 0.00 61.98 63.14 1ziy s VAL 159 Cb 0.11 -3.89 0.07 0.00 0.00 0.00 0.00 36.38 32.66 1ziy s VAL 159 CO 0.56 -0.36 0.76 0.29 0.00 0.00 0.00 175.10 176.36 1ziy n LYS 160 N 7.49 0.23 -4.13 2.72 4.76 -1.26 -4.91 118.16 123.06 1ziy n LYS 160 Ca 0.17 -1.01 -0.13 0.00 -2.87 0.00 0.00 58.31 54.47 1ziy n LYS 160 Cb 0.46 -1.14 -0.11 0.00 -1.84 0.00 0.00 35.03 32.39 1ziy n LYS 160 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1ziy s HIS 161 N -0.64 0.89 0.31 2.13 3.76 -1.26 -5.12 115.29 115.37 1ziy s HIS 161 Ca 0.09 -0.64 -0.29 0.00 -0.15 0.00 0.00 55.06 54.07 1ziy s HIS 161 Cb 0.06 -0.51 -0.12 0.00 1.11 0.00 0.00 32.58 33.13 1ziy s HIS 161 CO 0.09 -0.06 1.50 -2.30 -0.85 0.00 0.00 174.74 173.13 1ziy n PRO 162 N 0.82 2.53 -3.77 8.40 -0.02 -1.26 -4.83 135.00 136.88 1ziy n PRO 162 Ca -0.18 0.90 -0.14 0.00 -2.02 0.00 0.00 63.50 62.05 1ziy n PRO 162 Cb 0.57 -2.62 -0.15 0.00 -0.02 0.00 0.00 33.50 31.27 1ziy n PRO 162 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ziy s ALA 163 N -0.45 -0.07 -0.10 3.55 0.00 -0.55 -1.87 121.76 122.27 1ziy s ALA 163 Ca 0.61 0.45 0.03 0.00 0.00 0.00 0.00 51.96 53.05 1ziy s ALA 163 Cb -0.52 -0.32 -0.01 0.00 0.00 0.00 0.00 23.12 22.27 1ziy s ALA 163 CO 0.55 -0.12 -0.21 -1.17 0.00 0.00 0.00 175.76 174.80 1ziy s LEU 164 N 1.05 2.27 -0.07 0.00 2.96 0.54 -1.09 118.68 124.34 1ziy s LEU 164 Ca -0.09 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.39 1ziy s LEU 164 Cb -0.12 -1.46 0.00 0.00 0.50 0.00 0.00 46.19 45.12 1ziy s LEU 164 CO -0.04 0.19 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.63 1ziy s PHE 165 N 0.18 2.03 -0.24 5.38 0.40 0.36 -0.38 117.98 125.71 1ziy s PHE 165 Ca -0.12 -0.71 -0.05 0.00 -0.60 0.00 0.00 56.93 55.44 1ziy s PHE 165 Cb -0.16 -1.38 -0.01 0.00 0.51 0.00 0.00 43.02 41.98 1ziy s PHE 165 CO 0.07 -0.28 0.00 -1.01 0.70 0.00 0.00 175.22 174.70 1ziy s HIS 166 N 0.25 3.03 -0.04 0.36 3.76 -0.14 -0.53 115.29 121.98 1ziy s HIS 166 Ca -0.11 -0.88 0.05 0.00 -0.15 0.00 0.00 55.06 53.98 1ziy s HIS 166 Cb -0.15 -2.16 -0.01 0.00 1.11 0.00 0.00 32.58 31.37 1ziy s HIS 166 CO 0.05 -0.52 -0.20 -1.64 -0.85 0.00 0.00 174.74 171.58 1ziy s MET 167 N 1.50 1.89 0.05 1.40 -1.94 0.04 0.02 119.30 122.27 1ziy s MET 167 Ca 0.05 -0.71 -0.28 0.00 -1.71 0.00 0.00 55.69 53.04 1ziy s MET 167 Cb -0.15 -1.69 -0.05 0.00 2.01 0.00 0.00 34.83 34.95 1ziy s MET 167 CO -0.01 0.34 0.89 0.20 -0.01 0.00 0.00 175.02 176.44 1ziy s GLY 168 N -0.19 2.89 0.51 -0.03 0.00 -1.26 -0.71 107.32 108.53 1ziy s GLY 168 Ca 0.00 0.45 0.30 0.00 0.00 0.00 0.00 44.72 45.48 1ziy s GLY 168 CO 0.01 1.40 1.89 -1.33 0.00 0.00 0.00 173.10 175.07 1ziy h GLY 169 N 6.00 0.00 -2.26 0.20 0.00 -0.27 -3.09 103.07 103.65 1ziy h GLY 169 Ca -0.43 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.83 1ziy h GLY 169 CO 0.73 0.00 0.04 -1.06 0.00 0.00 0.00 176.54 176.25 1ziy n GLN 170 N -3.15 3.06 -2.83 4.80 6.02 0.32 -4.93 117.38 120.67 1ziy n GLN 170 Ca 0.01 -2.98 -0.43 0.00 -0.01 0.00 0.00 57.00 53.59 1ziy n GLN 170 Cb 0.37 -1.95 -0.04 0.00 1.02 0.00 0.00 30.24 29.63 1ziy n GLN 170 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1ziy s ASP 171 N -1.77 6.49 0.00 1.08 -1.08 -1.17 -4.30 116.67 115.92 1ziy s ASP 171 Ca 0.46 0.11 0.19 0.00 -0.52 0.00 0.00 52.55 52.79 1ziy s ASP 171 Cb 0.38 -2.45 1.11 0.00 -1.46 0.00 0.00 42.92 40.50 1ziy s ASP 171 CO 0.09 -1.05 1.63 1.41 0.52 0.00 0.00 175.17 177.77 1ziy n HIS 172 N 7.15 0.00 0.25 -5.34 8.25 -1.26 -0.54 115.22 123.73 1ziy n HIS 172 Ca 0.06 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.66 1ziy n HIS 172 Cb 0.48 0.00 0.35 0.00 1.12 0.00 0.00 29.99 31.94 1ziy n HIS 172 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 1ziy h PHE 173 N 0.00 0.00 -2.98 4.41 0.04 -1.97 -3.36 116.94 113.07 1ziy h PHE 173 Ca 0.00 0.00 -0.62 0.00 2.80 0.00 0.00 57.97 60.15 1ziy h PHE 173 Cb 0.00 0.00 -0.41 0.00 2.20 0.00 0.00 35.95 37.74 1ziy h PHE 173 CO 0.00 0.00 -0.68 0.08 -0.60 0.00 0.00 178.31 177.11 1ziy s VAL 174 N -3.35 2.13 1.02 -0.55 1.01 0.30 -4.75 120.40 116.21 1ziy s VAL 174 Ca 0.05 -3.54 -0.14 0.00 0.00 0.00 0.00 61.98 58.35 1ziy s VAL 174 Cb 0.06 -2.43 0.20 0.00 0.00 0.00 0.00 36.38 34.22 1ziy s VAL 174 CO 0.62 -1.00 1.11 -2.16 0.00 0.00 0.00 175.10 173.68 1ziy s PRO 175 N -0.70 0.21 0.21 2.72 0.04 -1.26 -4.65 135.00 131.58 1ziy s PRO 175 Ca 0.24 0.33 -0.17 0.00 0.04 0.00 0.00 61.00 61.43 1ziy s PRO 175 Cb -0.10 -1.73 0.21 0.00 0.04 0.00 0.00 34.50 32.92 1ziy s PRO 175 CO -0.12 -2.84 1.59 0.00 0.04 0.00 0.00 177.00 175.67 1ziy h ALA 176 N -1.96 0.17 -0.08 8.56 0.00 -1.96 -0.11 119.26 123.88 1ziy h ALA 176 Ca -0.52 0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1ziy h ALA 176 Cb 1.33 0.75 -0.01 0.00 0.00 0.00 0.00 17.79 19.86 1ziy h ALA 176 CO 0.54 -0.58 -0.09 -1.00 0.00 0.00 0.00 179.25 178.13 1ziy h PRO 177 N -0.08 0.12 -0.31 0.00 0.13 -2.00 -1.87 132.00 127.98 1ziy h PRO 177 Ca 0.30 -0.02 -0.15 0.00 -0.87 0.00 0.00 66.00 65.25 1ziy h PRO 177 Cb 0.56 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.67 1ziy h PRO 177 CO -0.76 0.21 -0.43 0.77 -0.23 0.00 0.00 178.00 177.56 1ziy h SER 178 N 0.11 0.83 -0.64 1.44 0.02 -1.39 -1.91 113.55 112.01 1ziy h SER 178 Ca 0.03 -0.39 -0.03 0.00 -0.84 0.00 0.00 61.79 60.56 1ziy h SER 178 Cb 0.23 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 1ziy h SER 178 CO 0.01 1.14 0.29 -0.09 -1.14 0.00 0.00 176.83 177.05 1ziy h ARG 179 N 0.62 0.93 -0.57 3.45 2.43 -0.60 -0.48 114.38 120.16 1ziy h ARG 179 Ca 0.04 -0.15 -0.05 0.00 -0.81 0.00 0.00 59.98 59.02 1ziy h ARG 179 Cb 0.99 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 1ziy h ARG 179 CO 0.09 0.76 0.18 0.37 -1.51 0.00 0.00 179.97 179.86 1ziy h GLN 180 N 0.88 0.88 -0.39 0.20 4.15 -1.26 0.25 115.11 119.82 1ziy h GLN 180 Ca 0.22 -0.19 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 1ziy h GLN 180 Cb 0.15 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 1ziy h GLN 180 CO -0.02 0.80 0.13 -0.07 -1.93 0.00 0.00 178.83 177.73 1ziy h LEU 181 N 0.80 0.57 -0.45 -2.39 3.38 -0.96 -1.40 115.31 114.85 1ziy h LEU 181 Ca 0.18 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1ziy h LEU 181 Cb 0.28 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1ziy h LEU 181 CO -0.01 0.62 -0.04 0.40 0.09 0.00 0.00 178.44 179.51 1ziy h ILE 182 N 0.49 1.27 -0.51 1.22 2.04 -0.95 -1.10 117.51 119.96 1ziy h ILE 182 Ca 0.13 -1.11 -0.03 0.00 1.00 0.00 0.00 64.86 64.85 1ziy h ILE 182 Cb 0.25 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1ziy h ILE 182 CO -0.00 0.38 0.20 0.74 0.00 0.00 0.00 178.15 179.47 1ziy h THR 183 N 0.66 1.22 -0.14 -0.27 2.02 -0.68 -0.07 112.91 115.65 1ziy h THR 183 Ca 0.12 -0.68 -0.10 0.00 0.77 0.00 0.00 66.41 66.52 1ziy h THR 183 Cb 0.55 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1ziy h THR 183 CO 0.03 0.26 -0.30 -0.33 0.37 0.00 0.00 175.52 175.54 1ziy h GLU 184 N 0.69 0.46 -0.21 6.66 5.08 -1.26 -2.18 114.58 123.83 1ziy h GLU 184 Ca 0.17 -0.30 -0.07 0.00 -1.00 0.00 0.00 59.36 58.16 1ziy h GLU 184 Cb 0.21 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 1ziy h GLU 184 CO -0.01 0.91 -0.14 0.78 -1.00 0.00 0.00 179.01 179.54 1ziy h GLY 185 N 0.07 0.50 1.68 -3.84 0.00 -1.10 -3.08 103.07 97.30 1ziy h GLY 185 Ca 0.00 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 1ziy h GLY 185 CO 0.07 0.43 -0.20 0.74 0.00 0.00 0.00 176.54 177.58 1ziy h PHE 186 N 0.15 0.42 0.00 5.60 -1.00 -1.08 -2.92 116.94 118.10 1ziy h PHE 186 Ca 0.04 -0.07 0.00 0.00 2.81 0.00 0.00 57.97 60.75 1ziy h PHE 186 Cb 0.66 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 40.11 1ziy h PHE 186 CO 0.07 0.57 0.00 0.41 -1.61 0.00 0.00 178.31 177.75 1ziy n GLY 187 N -0.56 -0.54 0.09 -1.45 0.00 -0.82 -1.88 105.19 100.03 1ziy n GLY 187 Ca -0.00 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.13 1ziy n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ziy n ALA 188 N -1.39 2.96 -3.82 4.61 0.00 -1.10 -4.64 120.51 117.12 1ziy n ALA 188 Ca 0.02 -0.29 -0.29 0.00 0.00 0.00 0.00 53.44 52.88 1ziy n ALA 188 Cb 0.04 -1.26 -0.16 0.00 0.00 0.00 0.00 19.45 18.07 1ziy n ALA 188 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ziy s ASN 189 N -2.70 3.34 0.01 0.00 3.84 -0.79 -5.01 114.94 113.63 1ziy s ASN 189 Ca 0.21 -0.99 0.10 0.00 0.21 0.00 0.00 52.86 52.39 1ziy s ASN 189 Cb 0.19 -0.85 0.42 0.00 -0.55 0.00 0.00 41.25 40.46 1ziy s ASN 189 CO 0.55 -0.28 1.31 -0.81 -2.79 0.00 0.00 177.10 175.08 1ziy n PRO 190 N 4.88 0.01 0.04 0.43 -0.04 -1.26 -1.09 135.00 137.97 1ziy n PRO 190 Ca -0.10 0.35 0.12 0.00 -0.04 0.00 0.00 63.50 63.83 1ziy n PRO 190 Cb 0.46 -1.51 0.49 0.00 -0.04 0.00 0.00 33.50 32.89 1ziy n PRO 190 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1ziy n LEU 191 N -1.53 0.30 -4.75 1.53 4.77 -1.26 -4.72 117.00 111.34 1ziy n LEU 191 Ca 0.02 0.54 -0.36 0.00 -0.03 0.00 0.00 56.01 56.19 1ziy n LEU 191 Cb 0.11 -0.46 -0.07 0.00 -2.33 0.00 0.00 43.42 40.67 1ziy n LEU 191 CO 0.09 -0.16 -0.13 -0.76 -1.33 0.00 0.00 177.39 175.10 1ziy s LEU 192 N -3.60 4.25 -0.08 2.23 1.43 -0.25 -1.48 118.68 121.18 1ziy s LEU 192 Ca 0.11 0.36 0.03 0.00 -1.03 0.00 0.00 54.13 53.60 1ziy s LEU 192 Cb 0.14 -2.17 0.01 0.00 0.03 0.00 0.00 46.19 44.19 1ziy s LEU 192 CO 0.48 0.20 -0.18 -1.10 0.23 0.00 0.00 176.35 175.98 1ziy s GLN 193 N 0.14 2.37 -0.04 1.70 -0.21 -0.25 -4.87 119.66 118.50 1ziy s GLN 193 Ca 0.12 -0.66 0.02 0.00 0.02 0.00 0.00 55.36 54.86 1ziy s GLN 193 Cb -0.12 -1.86 0.01 0.00 1.00 0.00 0.00 33.01 32.04 1ziy s GLN 193 CO 0.01 0.12 -0.09 0.54 -2.12 0.00 0.00 175.29 173.75 1ziy s VAL 194 N 0.44 0.85 0.03 1.09 0.11 -1.26 -0.49 120.40 121.17 1ziy s VAL 194 Ca -0.16 -0.37 0.09 0.00 -2.93 0.00 0.00 61.98 58.61 1ziy s VAL 194 Cb -0.16 -0.77 -0.03 0.00 -1.53 0.00 0.00 36.38 33.89 1ziy s VAL 194 CO 0.06 0.27 -0.26 -1.00 -3.33 0.00 0.00 175.10 170.84 1ziy s HIS 195 N 0.37 2.29 -0.08 1.54 3.76 0.31 -4.98 115.29 118.50 1ziy s HIS 195 Ca -0.06 -0.42 -0.00 0.00 -0.15 0.00 0.00 55.06 54.43 1ziy s HIS 195 Cb -0.11 -1.40 -0.03 0.00 1.11 0.00 0.00 32.58 32.15 1ziy s HIS 195 CO 0.01 0.08 -0.05 -1.58 -0.85 0.00 0.00 174.74 172.36 1ziy s TRP 196 N -0.75 3.00 -0.39 1.40 0.52 -1.26 -0.78 118.94 120.68 1ziy s TRP 196 Ca 0.11 0.05 -0.01 0.00 0.02 0.00 0.00 56.10 56.27 1ziy s TRP 196 Cb -0.10 -1.74 0.11 0.00 -1.15 0.00 0.00 33.47 30.58 1ziy s TRP 196 CO 0.01 0.35 0.16 0.71 0.02 0.00 0.00 176.95 178.21 1ziy s TYR 197 N -0.77 3.63 0.37 -1.98 1.51 0.11 -4.92 117.35 115.29 1ziy s TYR 197 Ca 0.12 -2.56 0.12 0.00 -1.01 0.00 0.00 57.07 53.74 1ziy s TYR 197 Cb -0.11 -3.13 0.92 0.00 -0.11 0.00 0.00 41.96 39.53 1ziy s TYR 197 CO 0.02 -0.96 1.83 0.93 -1.11 0.00 0.00 175.55 176.25 1ziy h GLU 198 N 7.94 0.56 -0.65 -0.62 4.39 -1.94 -0.40 114.58 123.86 1ziy h GLU 198 Ca -0.11 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.56 1ziy h GLU 198 Cb 1.04 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.56 1ziy h GLU 198 CO 0.65 0.37 0.00 0.39 -1.16 0.00 0.00 179.01 179.26 1ziy n GLU 199 N -4.61 3.29 -4.26 2.33 -0.58 -1.26 -3.98 120.64 111.57 1ziy n GLU 199 Ca 0.21 -2.58 -0.22 0.00 -0.42 0.00 0.00 57.16 54.15 1ziy n GLU 199 Cb 0.63 -1.77 -0.12 0.00 -0.57 0.00 0.00 31.44 29.60 1ziy n GLU 199 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ziy s ALA 200 N -1.65 1.67 0.00 0.62 0.00 -0.80 -4.88 121.76 116.71 1ziy s ALA 200 Ca 0.47 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 51.21 1ziy s ALA 200 Cb 0.29 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.21 1ziy s ALA 200 CO 0.25 0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.71 1ziy n GLY 201 N 1.02 2.19 3.92 0.00 0.00 -1.26 -0.52 105.19 110.54 1ziy n GLY 201 Ca -0.19 -1.87 -0.27 0.00 0.00 0.00 0.00 46.02 43.68 1ziy n GLY 201 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ziy s HIS 202 N 3.15 2.90 -2.16 1.61 -3.43 -1.26 -4.14 115.29 111.95 1ziy s HIS 202 Ca 0.00 0.55 0.00 0.00 -0.80 0.00 0.00 55.06 54.81 1ziy s HIS 202 Cb 0.00 -3.33 0.00 0.00 -1.43 0.00 0.00 32.58 27.82 1ziy s HIS 202 CO 0.00 -1.58 0.00 0.43 -2.00 0.00 0.00 174.74 171.59 1ziy n SER 203 N -3.09 -5.56 0.23 7.38 7.64 -1.26 -4.72 113.62 114.23 1ziy n SER 203 Ca 0.08 0.45 0.16 0.00 1.01 0.00 0.00 58.87 60.57 1ziy n SER 203 Cb 0.61 -4.87 0.65 0.00 -1.01 0.00 0.00 64.21 59.58 1ziy n SER 203 CO 0.00 0.00 0.00 2.19 -3.01 0.00 0.00 175.04 174.22 1ziy h PHE 204 N 0.00 0.00 -0.02 1.43 -5.15 -1.72 -1.91 116.94 109.58 1ziy h PHE 204 Ca -0.44 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.33 1ziy h PHE 204 Cb 1.36 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.53 1ziy h PHE 204 CO 0.58 0.00 -0.01 0.00 -2.00 0.00 0.00 178.31 176.88 1ziy n ALA 205 N -1.98 2.59 -2.84 12.09 0.00 -1.26 -1.80 120.51 127.31 1ziy n ALA 205 Ca 0.01 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.61 1ziy n ALA 205 Cb 0.26 -1.15 -0.12 0.00 0.00 0.00 0.00 19.45 18.45 1ziy n ALA 205 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1ziy s ARG 206 N -2.02 3.51 0.52 0.00 3.52 -0.72 -4.99 118.95 118.78 1ziy s ARG 206 Ca 0.37 -0.60 0.19 0.00 -0.13 0.00 0.00 55.73 55.57 1ziy s ARG 206 Cb 0.21 -3.55 1.32 0.00 -1.56 0.00 0.00 34.95 31.37 1ziy s ARG 206 CO 0.34 -0.33 2.09 1.79 -0.81 0.00 0.00 175.30 178.38 1ziy h THR 207 N 5.58 0.90 0.00 4.11 1.35 -1.89 -1.35 112.91 121.61 1ziy h THR 207 Ca -0.34 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 1ziy h THR 207 Cb 1.16 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1ziy h THR 207 CO 0.60 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 174.33 1ziy n SER 208 N -4.48 0.06 -4.82 5.36 3.41 -1.26 -4.82 113.62 107.07 1ziy n SER 208 Ca 0.02 0.51 -0.33 0.00 -0.26 0.00 0.00 58.87 58.80 1ziy n SER 208 Cb 0.28 -0.52 -0.07 0.00 -0.26 0.00 0.00 64.21 63.64 1ziy n SER 208 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1ziy s SER 209 N -3.11 6.94 0.12 4.04 0.15 -0.51 -4.91 113.70 116.42 1ziy s SER 209 Ca 0.12 1.72 0.24 0.00 0.70 0.00 0.00 55.95 58.73 1ziy s SER 209 Cb 0.16 -2.54 0.94 0.00 -1.71 0.00 0.00 66.02 62.87 1ziy s SER 209 CO 0.47 -0.36 1.76 -1.54 1.20 0.00 0.00 173.24 174.77 1ziy n SER 210 N -0.55 0.40 -1.11 5.45 3.41 -1.26 -2.24 113.62 117.73 1ziy n SER 210 Ca 0.07 0.56 0.10 0.00 -0.26 0.00 0.00 58.87 59.34 1ziy n SER 210 Cb 0.54 -0.66 0.27 0.00 -0.26 0.00 0.00 64.21 64.10 1ziy n SER 210 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ziy n GLY 211 N 0.87 1.77 3.73 5.00 0.00 -1.26 -4.98 105.19 110.32 1ziy n GLY 211 Ca 0.05 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 1ziy n GLY 211 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ziy s TYR 212 N -1.28 3.02 -0.20 1.61 5.04 -0.95 -4.06 117.35 120.53 1ziy s TYR 212 Ca 0.41 0.69 -0.01 0.00 -2.44 0.00 0.00 57.07 55.72 1ziy s TYR 212 Cb 0.22 -3.94 0.05 0.00 0.35 0.00 0.00 41.96 38.65 1ziy s TYR 212 CO 0.29 -3.37 -0.02 0.08 -1.34 0.00 0.00 175.55 171.19 1ziy s VAL 213 N 0.85 1.05 0.22 3.14 1.01 -0.74 -5.01 120.40 120.91 1ziy s VAL 213 Ca 0.68 -0.82 -0.09 0.00 0.00 0.00 0.00 61.98 61.75 1ziy s VAL 213 Cb -0.44 -1.38 0.17 0.00 0.00 0.00 0.00 36.38 34.73 1ziy s VAL 213 CO 0.35 -0.08 1.86 0.00 0.00 0.00 0.00 175.10 177.23 1ziy h ALA 214 N 8.10 1.02 -0.48 5.51 0.00 -1.94 0.90 119.26 132.36 1ziy h ALA 214 Ca -0.19 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1ziy h ALA 214 Cb 1.10 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1ziy h ALA 214 CO 0.38 0.31 -0.00 0.66 0.00 0.00 0.00 179.25 180.60 1ziy h SER 215 N 0.97 0.83 -0.34 0.00 4.64 -1.96 0.62 113.55 118.31 1ziy h SER 215 Ca 0.31 -0.31 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1ziy h SER 215 Cb 0.00 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 61.87 1ziy h SER 215 CO -0.11 0.94 -0.35 0.00 -0.87 0.00 0.00 176.83 176.44 1ziy h ALA 216 N 0.93 0.50 -0.61 5.18 0.00 -1.78 -1.81 119.26 121.66 1ziy h ALA 216 Ca 0.14 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1ziy h ALA 216 Cb 0.51 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1ziy h ALA 216 CO 0.02 0.57 0.39 0.00 0.00 0.00 0.00 179.25 180.23 1ziy h ALA 217 N 0.74 0.78 -0.43 0.00 0.00 -0.68 0.35 119.26 120.01 1ziy h ALA 217 Ca 0.05 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1ziy h ALA 217 Cb 0.94 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1ziy h ALA 217 CO 0.09 0.23 -0.21 0.00 0.00 0.00 0.00 179.25 179.36 1ziy h ALA 218 N 1.21 0.61 -0.36 0.00 0.00 -0.76 -0.22 119.26 119.72 1ziy h ALA 218 Ca 0.22 -0.38 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1ziy h ALA 218 Cb -0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1ziy h ALA 218 CO -0.05 0.58 -0.29 1.25 0.00 0.00 0.00 179.25 180.75 1ziy h LEU 219 N 0.74 0.89 -0.58 0.00 5.85 -1.15 -1.37 115.31 119.69 1ziy h LEU 219 Ca 0.10 -0.45 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 1ziy h LEU 219 Cb 0.78 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1ziy h LEU 219 CO 0.06 1.15 0.19 0.00 -0.34 0.00 0.00 178.44 179.50 1ziy h ALA 220 N 0.77 0.75 -0.66 1.25 0.00 -0.84 -2.31 119.26 118.22 1ziy h ALA 220 Ca 0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1ziy h ALA 220 Cb 0.87 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1ziy h ALA 220 CO 0.08 0.41 0.35 -0.91 0.00 0.00 0.00 179.25 179.18 1ziy h ASN 221 N 0.81 0.84 0.11 0.00 2.35 -0.93 0.13 115.58 118.90 1ziy h ASN 221 Ca 0.19 -0.11 -0.12 0.00 -0.55 0.00 0.00 56.30 55.71 1ziy h ASN 221 Cb 0.27 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1ziy h ASN 221 CO -0.01 0.71 -0.41 1.05 -1.65 0.00 0.00 177.43 177.12 1ziy h GLU 222 N 0.91 0.38 -0.35 0.81 4.11 -1.10 -1.32 114.58 118.02 1ziy h GLU 222 Ca 0.23 -0.19 -0.02 0.00 0.07 0.00 0.00 59.36 59.46 1ziy h GLU 222 Cb 0.06 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1ziy h GLU 222 CO -0.03 0.73 0.16 0.00 0.07 0.00 0.00 179.01 179.93 1ziy h ARG 223 N 0.32 0.52 -0.59 1.06 3.08 -1.07 -0.03 114.38 117.65 1ziy h ARG 223 Ca 0.03 -0.08 0.04 0.00 0.07 0.00 0.00 59.98 60.03 1ziy h ARG 223 Cb 0.85 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.77 1ziy h ARG 223 CO 0.07 0.49 0.34 1.15 -1.07 0.00 0.00 179.97 180.95 1ziy h THR 224 N 0.43 1.01 -0.16 2.04 2.02 -0.45 -0.11 112.91 117.69 1ziy h THR 224 Ca 0.12 -0.22 -0.16 0.00 0.77 0.00 0.00 66.41 66.92 1ziy h THR 224 Cb 0.15 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1ziy h THR 224 CO -0.01 0.12 -0.56 -0.07 0.37 0.00 0.00 175.52 175.37 1ziy h LEU 225 N 0.65 0.55 -1.05 2.58 3.38 -0.95 0.59 115.31 121.06 1ziy h LEU 225 Ca 0.25 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1ziy h LEU 225 Cb 0.10 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1ziy h LEU 225 CO -0.14 1.00 -0.25 0.44 0.09 0.00 0.00 178.44 179.58 1ziy h ASP 226 N 0.38 0.37 0.20 -0.43 3.32 -0.74 -0.66 116.42 118.85 1ziy h ASP 226 Ca 0.01 -0.12 -0.21 0.00 0.02 0.00 0.00 57.03 56.73 1ziy h ASP 226 Cb 1.09 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1ziy h ASP 226 CO 0.10 0.62 -0.81 0.15 -1.72 0.00 0.00 179.24 177.58 1ziy h PHE 227 N 0.33 0.67 0.00 4.55 3.57 -0.39 -3.17 116.94 122.50 1ziy h PHE 227 Ca 0.05 -0.32 -0.06 0.00 3.53 0.00 0.00 57.97 61.17 1ziy h PHE 227 Cb 0.63 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 1ziy h PHE 227 CO 0.02 1.11 -0.41 -0.07 -2.23 0.00 0.00 178.31 176.72 1ziy h LEU 228 N 0.31 0.00 -1.53 0.59 3.38 -0.61 -3.39 115.31 114.06 1ziy h LEU 228 Ca -0.05 0.00 0.27 0.00 0.09 0.00 0.00 57.88 58.19 1ziy h LEU 228 Cb 1.41 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.09 1ziy h LEU 228 CO 0.14 0.28 0.68 0.00 0.09 0.00 0.00 178.44 179.64 1ziy h ALA 229 N 1.72 2.41 0.00 1.53 0.00 -1.09 -0.58 119.26 123.25 1ziy h ALA 229 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ziy h ALA 229 Cb 1.22 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1ziy h ALA 229 CO 0.03 -0.78 0.00 -2.30 0.00 0.00 0.00 179.25 176.21 1ziy n PRO 230 N -4.51 0.16 0.24 0.00 -0.02 -1.26 -0.85 135.00 128.75 1ziy n PRO 230 Ca 0.24 0.52 0.13 0.00 -2.02 0.00 0.00 63.50 62.37 1ziy n PRO 230 Cb 0.91 -1.89 0.44 0.00 -0.02 0.00 0.00 33.50 32.94 1ziy n PRO 230 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1ziy h LEU 231 N 0.00 0.00 -9.65 2.45 3.38 -1.40 -3.44 115.31 106.65 1ziy h LEU 231 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1ziy h LEU 231 Cb 0.18 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.96 1ziy h LEU 231 CO 0.00 0.08 0.65 -1.10 0.09 0.00 0.00 178.44 178.16 1ziy s GLN 232 N -3.47 4.39 0.00 1.13 -0.21 -0.03 -4.54 119.66 116.92 1ziy s GLN 232 Ca 0.03 2.03 0.25 0.00 0.02 0.00 0.00 55.36 57.69 1ziy s GLN 232 Cb 0.08 -3.21 1.47 0.00 1.00 0.00 0.00 33.01 32.35 1ziy s GLN 232 CO 0.62 -0.27 1.83 -1.13 -2.12 0.00 0.00 175.29 174.22