#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z3a s GLU 14 N 0.00 1.42 0.35 -1.46 2.02 -1.26 -5.06 118.70 114.71 1z3a s GLU 14 Ca 0.00 -2.11 -0.28 0.00 0.02 0.00 0.00 54.97 52.60 1z3a s GLU 14 Cb 0.00 -2.55 -0.10 0.00 0.10 0.00 0.00 34.13 31.58 1z3a s GLU 14 CO 0.00 -1.14 1.37 0.54 0.02 0.00 0.00 175.26 176.04 1z3a s VAL 15 N 0.26 2.48 0.02 2.63 0.11 -1.26 -4.82 120.40 119.81 1z3a s VAL 15 Ca 0.17 0.48 -0.36 0.00 -2.93 0.00 0.00 61.98 59.34 1z3a s VAL 15 Cb -0.25 -3.30 -0.15 0.00 -1.53 0.00 0.00 36.38 31.15 1z3a s VAL 15 CO -0.00 0.11 1.53 1.21 -3.33 0.00 0.00 175.10 174.61 1z3a n GLU 16 N 0.61 1.48 -0.96 1.54 2.13 -1.26 -1.17 120.64 123.01 1z3a n GLU 16 Ca 0.01 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.36 1z3a n GLU 16 Cb 0.41 -2.24 0.00 0.00 0.27 0.00 0.00 31.44 29.88 1z3a n GLU 16 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1z3a n PHE 17 N 3.68 0.00 -1.63 4.31 3.72 -1.26 -5.02 117.46 121.26 1z3a n PHE 17 Ca 0.20 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.31 1z3a n PHE 17 Cb 0.21 -0.65 0.15 0.00 -0.94 0.00 0.00 39.48 38.24 1z3a n PHE 17 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1z3a s SER 18 N -2.15 3.36 0.22 4.37 1.04 -0.32 -4.85 113.70 115.38 1z3a s SER 18 Ca 0.00 0.77 -0.08 0.00 0.48 0.00 0.00 55.95 57.12 1z3a s SER 18 Cb 0.00 -1.19 0.18 0.00 0.10 0.00 0.00 66.02 65.11 1z3a s SER 18 CO 0.00 -2.62 1.85 0.45 0.98 0.00 0.00 173.24 173.89 1z3a h HIS 19 N -1.55 1.15 -0.57 5.02 3.86 -1.95 -2.16 115.15 118.94 1z3a h HIS 19 Ca -0.48 -0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 58.64 1z3a h HIS 19 Cb 1.31 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 29.39 1z3a h HIS 19 CO -0.22 0.79 0.09 0.93 0.86 0.00 0.00 177.93 180.38 1z3a h GLU 20 N 1.17 0.92 -0.23 2.45 3.07 -1.92 0.15 114.58 120.19 1z3a h GLU 20 Ca 0.30 -0.23 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1z3a h GLU 20 Cb 0.02 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 1z3a h GLU 20 CO -0.05 0.86 0.15 -0.92 -1.40 0.00 0.00 179.01 177.65 1z3a h TYR 21 N 0.87 0.30 -0.29 4.33 3.20 -1.67 -0.04 116.97 123.67 1z3a h TYR 21 Ca 0.18 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.88 1z3a h TYR 21 Cb 0.39 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.56 1z3a h TYR 21 CO 0.02 0.21 -0.51 -1.49 -1.64 0.00 0.00 178.16 174.76 1z3a h TRP 22 N 0.30 1.00 -0.26 -3.82 -0.00 -1.14 -2.81 115.95 109.22 1z3a h TRP 22 Ca 0.08 -0.34 -0.02 0.00 -0.00 0.00 0.00 58.89 58.61 1z3a h TRP 22 Cb -0.01 -0.19 -0.01 0.00 -0.00 0.00 0.00 29.16 28.94 1z3a h TRP 22 CO -0.06 1.14 0.07 1.98 -0.00 0.00 0.00 178.44 181.57 1z3a h MET 23 N 0.63 0.37 -0.42 0.49 4.05 -0.53 -0.78 114.93 118.73 1z3a h MET 23 Ca 0.02 -0.05 -0.09 0.00 -0.28 0.00 0.00 59.70 59.31 1z3a h MET 23 Cb 1.09 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.81 1z3a h MET 23 CO 0.11 0.34 -0.11 -0.09 0.23 0.00 0.00 176.91 177.40 1z3a h ARG 24 N 0.37 0.75 -0.69 0.39 2.43 -0.80 0.72 114.38 117.55 1z3a h ARG 24 Ca 0.09 -0.24 -0.07 0.00 -0.81 0.00 0.00 59.98 58.95 1z3a h ARG 24 Cb 0.14 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1z3a h ARG 24 CO -0.00 0.83 0.17 1.25 -1.51 0.00 0.00 179.97 180.70 1z3a h HIS 25 N 0.68 1.16 -0.53 2.20 2.76 -1.05 -2.09 115.15 118.28 1z3a h HIS 25 Ca 0.12 -0.14 -0.01 0.00 -2.20 0.00 0.00 60.37 58.14 1z3a h HIS 25 Cb 0.58 -0.33 -0.03 0.00 1.55 0.00 0.00 27.41 29.18 1z3a h HIS 25 CO 0.03 0.94 0.27 0.00 -1.30 0.00 0.00 177.93 177.87 1z3a h ALA 26 N 1.12 1.47 -0.03 5.26 0.00 -0.01 -1.29 119.26 125.79 1z3a h ALA 26 Ca 0.22 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1z3a h ALA 26 Cb 0.37 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1z3a h ALA 26 CO 0.00 0.43 -0.31 -0.07 0.00 0.00 0.00 179.25 179.30 1z3a h LEU 27 N 0.75 0.06 -0.90 0.00 3.38 -0.41 0.13 115.31 118.32 1z3a h LEU 27 Ca 0.19 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 1z3a h LEU 27 Cb 0.06 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1z3a h LEU 27 CO -0.03 0.38 -0.08 0.74 0.09 0.00 0.00 178.44 179.54 1z3a h THR 28 N 0.05 1.25 -0.11 0.22 2.02 -0.58 -2.22 112.91 113.54 1z3a h THR 28 Ca 0.01 -1.09 -0.19 0.00 0.77 0.00 0.00 66.41 65.91 1z3a h THR 28 Cb 0.59 1.01 -0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1z3a h THR 28 CO 0.04 0.37 -0.73 -0.07 0.37 0.00 0.00 175.52 175.50 1z3a h LEU 29 N 0.67 0.63 -1.91 2.58 3.38 -0.92 -2.98 115.31 116.76 1z3a h LEU 29 Ca 0.12 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1z3a h LEU 29 Cb 0.53 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 1z3a h LEU 29 CO 0.03 1.16 -0.09 0.00 0.09 0.00 0.00 178.44 179.63 1z3a h ALA 30 N 0.83 1.71 0.00 1.53 0.00 -0.47 -0.80 119.26 122.06 1z3a h ALA 30 Ca -0.03 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1z3a h ALA 30 Cb 1.32 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1z3a h ALA 30 CO 0.13 0.11 -0.65 0.87 0.00 0.00 0.00 179.25 179.72 1z3a h LYS 31 N 0.00 0.00 -0.63 0.00 1.57 -1.25 -1.38 116.57 114.88 1z3a h LYS 31 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 1z3a h LYS 31 Cb 0.17 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 1z3a h LYS 31 CO 0.01 0.65 0.26 0.00 -0.57 0.00 0.00 179.45 179.80 1z3a h ARG 32 N 0.00 0.94 -0.62 3.15 3.08 -1.09 -0.09 114.38 119.75 1z3a h ARG 32 Ca -0.01 -0.17 0.01 0.00 0.07 0.00 0.00 59.98 59.89 1z3a h ARG 32 Cb 1.19 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 31.05 1z3a h ARG 32 CO 0.08 0.79 0.40 0.00 -1.07 0.00 0.00 179.97 180.17 1z3a h ALA 33 N 1.10 0.79 -0.27 0.04 0.00 -1.16 -1.64 119.26 118.12 1z3a h ALA 33 Ca 0.21 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.15 1z3a h ALA 33 Cb 0.19 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 1z3a h ALA 33 CO -0.02 0.20 -0.22 2.35 0.00 0.00 0.00 179.25 181.56 1z3a h TRP 34 N 0.82 -0.56 -0.96 0.00 2.91 -0.47 -1.27 115.95 116.41 1z3a h TRP 34 Ca 0.23 0.04 0.04 0.00 1.13 0.00 0.00 58.89 60.32 1z3a h TRP 34 Cb -0.08 0.29 -0.06 0.00 -0.51 0.00 0.00 29.16 28.81 1z3a h TRP 34 CO -0.03 -0.29 0.63 -0.44 -1.03 0.00 0.00 178.44 177.27 1z3a h ASP 35 N -0.21 1.05 0.00 2.65 3.32 -0.57 -0.42 116.42 122.24 1z3a h ASP 35 Ca 0.15 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1z3a h ASP 35 Cb 0.43 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1z3a h ASP 35 CO -0.39 0.72 0.00 -0.62 -1.72 0.00 0.00 179.24 177.23 1z3a n GLU 36 N -4.44 0.85 -2.84 3.56 1.02 -0.62 -4.87 120.64 113.30 1z3a n GLU 36 Ca 0.13 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.11 1z3a n GLU 36 Cb 0.10 -1.27 0.03 0.00 -0.02 0.00 0.00 31.44 30.28 1z3a n GLU 36 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1z3a n ARG 37 N -0.77 -3.69 -4.17 3.49 1.74 -0.17 -4.93 116.66 108.16 1z3a n ARG 37 Ca 0.11 0.66 -0.23 0.00 -0.77 0.00 0.00 57.85 57.62 1z3a n ARG 37 Cb 0.05 -5.01 -0.06 0.00 -1.02 0.00 0.00 32.46 26.42 1z3a n ARG 37 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1z3a s GLU 38 N -5.41 2.42 -0.04 5.56 0.41 -0.58 -5.02 118.70 116.04 1z3a s GLU 38 Ca 0.23 -1.42 -0.36 0.00 -0.41 0.00 0.00 54.97 53.01 1z3a s GLU 38 Cb -0.10 -2.23 -0.14 0.00 -1.78 0.00 0.00 34.13 29.88 1z3a s GLU 38 CO 0.29 0.25 1.67 0.28 -0.49 0.00 0.00 175.26 177.25 1z3a n VAL 39 N -1.06 0.26 -2.39 2.63 0.31 -1.26 -4.04 118.33 112.79 1z3a n VAL 39 Ca -0.05 -0.05 -0.38 0.00 -0.01 0.00 0.00 64.34 63.86 1z3a n VAL 39 Cb 0.60 -1.43 -0.03 0.00 -0.91 0.00 0.00 33.84 32.07 1z3a n VAL 39 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1z3a s PRO 40 N 2.47 3.16 -0.05 5.55 0.04 -1.26 -4.60 135.00 140.31 1z3a s PRO 40 Ca 0.89 -0.53 0.03 0.00 0.04 0.00 0.00 61.00 61.43 1z3a s PRO 40 Cb -0.83 -4.90 0.01 0.00 0.04 0.00 0.00 34.50 28.81 1z3a s PRO 40 CO 0.51 -2.51 -0.13 0.08 0.04 0.00 0.00 177.00 174.99 1z3a s VAL 41 N 6.73 1.15 0.17 -0.36 1.01 -1.26 -4.71 120.40 123.12 1z3a s VAL 41 Ca 0.51 -0.53 0.07 0.00 0.00 0.00 0.00 61.98 62.04 1z3a s VAL 41 Cb -0.05 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 1z3a s VAL 41 CO 0.01 0.35 -0.15 -0.83 0.00 0.00 0.00 175.10 174.48 1z3a s GLY 42 N 0.37 1.31 -0.06 4.51 0.00 -1.26 -1.54 107.32 110.65 1z3a s GLY 42 Ca -0.09 -1.51 -0.14 0.00 0.00 0.00 0.00 44.72 42.99 1z3a s GLY 42 CO 0.03 -1.58 0.32 0.00 0.00 0.00 0.00 173.10 171.87 1z3a s ALA 43 N -2.50 -0.81 -0.03 3.20 0.00 0.31 -1.74 121.76 120.19 1z3a s ALA 43 Ca 0.17 0.60 0.02 0.00 0.00 0.00 0.00 51.96 52.75 1z3a s ALA 43 Cb -0.03 -0.20 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1z3a s ALA 43 CO 0.05 -0.22 -0.07 0.54 0.00 0.00 0.00 175.76 176.06 1z3a s VAL 44 N -0.68 0.68 -0.21 0.00 0.11 0.09 -0.34 120.40 120.05 1z3a s VAL 44 Ca -0.08 -0.28 -0.08 0.00 -2.93 0.00 0.00 61.98 58.61 1z3a s VAL 44 Cb -0.04 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.15 1z3a s VAL 44 CO 0.03 0.23 0.07 -0.22 -3.33 0.00 0.00 175.10 171.87 1z3a s LEU 45 N 0.34 3.69 -0.02 2.54 2.96 0.84 -0.55 118.68 128.48 1z3a s LEU 45 Ca -0.05 -0.03 0.07 0.00 -0.22 0.00 0.00 54.13 53.90 1z3a s LEU 45 Cb -0.09 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.62 1z3a s LEU 45 CO 0.00 0.09 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.20 1z3a s VAL 46 N 0.90 1.85 -0.05 1.68 1.01 0.06 -0.46 120.40 125.38 1z3a s VAL 46 Ca 0.04 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.01 1z3a s VAL 46 Cb -0.14 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.74 1z3a s VAL 46 CO 0.03 0.52 0.02 -2.28 0.00 0.00 0.00 175.10 173.39 1z3a s HIS 47 N -0.53 0.41 -1.48 5.22 2.46 -0.30 -0.72 115.29 120.35 1z3a s HIS 47 Ca 0.09 -0.00 -0.05 0.00 0.47 0.00 0.00 55.06 55.56 1z3a s HIS 47 Cb -0.09 -0.62 0.04 0.00 -0.13 0.00 0.00 32.58 31.78 1z3a s HIS 47 CO -0.01 -0.24 0.55 0.09 -2.47 0.00 0.00 174.74 172.66 1z3a n ASN 48 N 4.96 -1.33 -2.23 9.88 3.02 -1.26 -1.52 115.26 126.79 1z3a n ASN 48 Ca -0.10 -0.98 -0.17 0.00 -0.03 0.00 0.00 54.58 53.29 1z3a n ASN 48 Cb 0.50 -3.08 -0.02 0.00 -0.61 0.00 0.00 39.78 36.57 1z3a n ASN 48 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1z3a n ASN 49 N -2.91 -4.91 -4.26 6.41 5.03 -1.26 -4.98 115.26 108.37 1z3a n ASN 49 Ca -0.20 0.15 -0.28 0.00 0.87 0.00 0.00 54.58 55.12 1z3a n ASN 49 Cb 0.63 -4.18 -0.15 0.00 -1.02 0.00 0.00 39.78 35.06 1z3a n ASN 49 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1z3a s ARG 50 N -4.71 1.69 -0.08 3.52 1.81 -0.57 -5.08 118.95 115.53 1z3a s ARG 50 Ca 0.00 -0.88 -0.30 0.00 -1.72 0.00 0.00 55.73 52.83 1z3a s ARG 50 Cb 0.00 -1.71 -0.03 0.00 -0.45 0.00 0.00 34.95 32.76 1z3a s ARG 50 CO 0.00 0.46 1.17 0.08 -0.68 0.00 0.00 175.30 176.33 1z3a s VAL 51 N -0.63 4.35 -0.40 3.52 1.01 -1.26 -1.15 120.40 125.84 1z3a s VAL 51 Ca 0.09 1.67 0.04 0.00 0.00 0.00 0.00 61.98 63.77 1z3a s VAL 51 Cb -0.09 -4.07 0.02 0.00 0.00 0.00 0.00 36.38 32.24 1z3a s VAL 51 CO 0.00 -0.02 0.53 2.30 0.00 0.00 0.00 175.10 177.92 1z3a n ILE 52 N 4.69 0.00 -3.60 2.22 -0.00 0.39 -4.93 119.36 118.12 1z3a n ILE 52 Ca 0.11 -0.49 -0.13 0.00 -0.00 0.00 0.00 62.75 62.24 1z3a n ILE 52 Cb 0.46 1.06 -0.07 0.00 -0.00 0.00 0.00 39.64 41.10 1z3a n ILE 52 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 1z3a s GLY 53 N -0.47 -0.41 0.04 3.28 0.00 -1.09 -3.04 107.32 105.63 1z3a s GLY 53 Ca 0.04 2.06 0.02 0.00 0.00 0.00 0.00 44.72 46.83 1z3a s GLY 53 CO 0.06 1.52 -0.07 -0.54 0.00 0.00 0.00 173.10 174.07 1z3a s GLU 54 N -0.17 0.49 0.16 2.90 2.02 -1.26 -0.11 118.70 122.73 1z3a s GLU 54 Ca -0.02 -0.75 -0.22 0.00 0.02 0.00 0.00 54.97 54.01 1z3a s GLU 54 Cb -0.03 -0.20 0.06 0.00 0.10 0.00 0.00 34.13 34.06 1z3a s GLU 54 CO 0.01 0.03 0.57 0.20 0.02 0.00 0.00 175.26 176.09 1z3a s GLY 55 N -1.60 -0.53 0.06 -1.39 0.00 0.54 -3.68 107.32 100.71 1z3a s GLY 55 Ca -0.11 0.36 -0.04 0.00 0.00 0.00 0.00 44.72 44.93 1z3a s GLY 55 CO -0.00 0.07 0.04 0.66 0.00 0.00 0.00 173.10 173.87 1z3a s TRP 56 N -3.77 0.37 0.11 1.90 -2.14 -1.26 -0.53 118.94 113.61 1z3a s TRP 56 Ca 0.02 -0.84 -0.31 0.00 2.66 0.00 0.00 56.10 57.63 1z3a s TRP 56 Cb -0.01 -0.26 -0.08 0.00 -3.10 0.00 0.00 33.47 30.02 1z3a s TRP 56 CO -0.12 -0.41 1.48 1.21 -2.66 0.00 0.00 176.95 176.45 1z3a s ASN 57 N -2.73 6.73 -0.36 -2.66 3.04 -0.59 -3.65 114.94 114.72 1z3a s ASN 57 Ca 0.04 2.41 0.12 0.00 0.04 0.00 0.00 52.86 55.47 1z3a s ASN 57 Cb 0.05 -2.58 0.41 0.00 -1.54 0.00 0.00 41.25 37.59 1z3a s ASN 57 CO -0.09 -0.74 1.37 -2.11 -3.04 0.00 0.00 177.10 172.49 1z3a n ARG 58 N 4.34 1.29 -0.07 0.43 1.85 -0.32 -4.70 116.66 119.49 1z3a n ARG 58 Ca 0.13 -1.84 -0.01 0.00 -1.00 0.00 0.00 57.85 55.12 1z3a n ARG 58 Cb 0.41 -0.09 0.25 0.00 -1.05 0.00 0.00 32.46 31.99 1z3a n ARG 58 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 1z3a h PRO 59 N 1.77 0.70 0.06 2.89 0.13 -1.73 -1.85 132.00 133.96 1z3a h PRO 59 Ca -0.32 -0.13 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1z3a h PRO 59 Cb 1.29 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1z3a h PRO 59 CO -0.04 0.64 -0.03 0.82 -0.23 0.00 0.00 178.00 179.16 1z3a h ILE 60 N 0.67 1.15 0.00 -3.56 2.04 -1.93 -0.48 117.51 115.41 1z3a h ILE 60 Ca 0.15 -0.76 -0.05 0.00 1.00 0.00 0.00 64.86 65.21 1z3a h ILE 60 Cb 0.27 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1z3a h ILE 60 CO -0.00 0.19 -0.23 1.23 0.00 0.00 0.00 178.15 179.34 1z3a h GLY 61 N -0.42 0.00 0.42 5.37 0.00 -1.91 -2.82 103.07 103.70 1z3a h GLY 61 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1z3a h GLY 61 CO 0.01 0.00 -0.70 0.54 0.00 0.00 0.00 176.54 176.39 1z3a n ARG 62 N -3.58 0.11 -3.54 4.80 5.12 -0.70 -4.95 116.66 113.92 1z3a n ARG 62 Ca -0.01 -0.08 -0.19 0.00 -1.93 0.00 0.00 57.85 55.64 1z3a n ARG 62 Cb 0.37 -1.50 0.07 0.00 -1.16 0.00 0.00 32.46 30.24 1z3a n ARG 62 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1z3a n HIS 63 N -1.37 -2.11 -3.47 -1.55 8.25 -0.27 -4.97 115.22 109.73 1z3a n HIS 63 Ca 0.05 0.91 -0.16 0.00 -0.26 0.00 0.00 57.72 58.26 1z3a n HIS 63 Cb 0.34 -4.83 -0.12 0.00 1.12 0.00 0.00 29.99 26.51 1z3a n HIS 63 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1z3a s ASP 64 N -4.32 1.02 0.15 0.41 -1.08 -0.73 -5.01 116.67 107.12 1z3a s ASP 64 Ca 0.02 -0.05 0.15 0.00 -0.52 0.00 0.00 52.55 52.16 1z3a s ASP 64 Cb -0.01 0.58 0.72 0.00 -1.46 0.00 0.00 42.92 42.75 1z3a s ASP 64 CO 0.76 -0.31 1.47 -0.81 0.52 0.00 0.00 175.17 176.80 1z3a n PRO 65 N 5.33 0.09 -0.10 4.34 -0.04 -1.26 -1.82 135.00 141.54 1z3a n PRO 65 Ca -0.05 0.46 0.11 0.00 -0.04 0.00 0.00 63.50 63.98 1z3a n PRO 65 Cb 0.50 -1.72 0.16 0.00 -0.04 0.00 0.00 33.50 32.39 1z3a n PRO 65 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1z3a n THR 66 N -1.90 0.28 -1.09 0.52 -2.24 -1.26 -4.74 114.28 103.85 1z3a n THR 66 Ca 0.01 -0.64 -0.32 0.00 -2.27 0.00 0.00 64.05 60.83 1z3a n THR 66 Cb 0.11 1.20 -0.02 0.00 -2.10 0.00 0.00 70.33 69.52 1z3a n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1z3a n ALA 67 N 1.36 6.47 -2.24 6.98 0.00 -0.76 -4.73 120.51 127.60 1z3a n ALA 67 Ca 0.16 -2.93 -0.25 0.00 0.00 0.00 0.00 53.44 50.42 1z3a n ALA 67 Cb 0.58 -3.23 0.02 0.00 0.00 0.00 0.00 19.45 16.81 1z3a n ALA 67 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1z3a s HIS 68 N 2.65 3.32 0.18 0.00 3.76 -1.26 -1.18 115.29 122.77 1z3a s HIS 68 Ca 0.58 0.53 -0.14 0.00 -0.15 0.00 0.00 55.06 55.88 1z3a s HIS 68 Cb 0.15 -2.45 0.16 0.00 1.11 0.00 0.00 32.58 31.55 1z3a s HIS 68 CO -0.05 -0.50 1.71 0.00 -0.85 0.00 0.00 174.74 175.05 1z3a h ALA 69 N 0.15 0.48 -0.33 -1.40 0.00 -1.84 -2.17 119.26 114.16 1z3a h ALA 69 Ca -0.46 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1z3a h ALA 69 Cb 1.24 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1z3a h ALA 69 CO 0.60 -0.34 0.20 0.93 0.00 0.00 0.00 179.25 180.64 1z3a h GLU 70 N 0.19 0.45 -0.37 0.00 3.07 -1.90 -1.42 114.58 114.60 1z3a h GLU 70 Ca 0.23 -0.04 0.01 0.00 -0.50 0.00 0.00 59.36 59.06 1z3a h GLU 70 Cb 0.31 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.11 1z3a h GLU 70 CO -0.33 0.34 0.23 0.82 -1.40 0.00 0.00 179.01 178.67 1z3a h ILE 71 N 0.43 1.06 -0.37 3.13 1.08 -1.77 0.12 117.51 121.18 1z3a h ILE 71 Ca 0.12 -0.16 0.01 0.00 -0.39 0.00 0.00 64.86 64.44 1z3a h ILE 71 Cb 0.01 0.56 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 1z3a h ILE 71 CO -0.02 0.08 0.23 -0.03 -0.69 0.00 0.00 178.15 177.73 1z3a h MET 72 N 0.46 0.46 -0.66 2.37 4.05 -1.16 0.07 114.93 120.53 1z3a h MET 72 Ca 0.14 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.47 1z3a h MET 72 Cb -0.02 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 30.65 1z3a h MET 72 CO -0.05 0.31 0.17 0.00 0.23 0.00 0.00 176.91 177.56 1z3a h ALA 73 N 1.15 0.87 -0.51 0.39 0.00 -1.01 -2.07 119.26 118.08 1z3a h ALA 73 Ca 0.14 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 1z3a h ALA 73 Cb -0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1z3a h ALA 73 CO -0.05 0.58 -0.04 -0.07 0.00 0.00 0.00 179.25 179.67 1z3a h LEU 74 N 0.98 0.92 -0.87 0.00 3.38 -0.64 -1.34 115.31 117.75 1z3a h LEU 74 Ca 0.21 -0.32 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 1z3a h LEU 74 Cb 0.36 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1z3a h LEU 74 CO 0.00 1.03 -0.17 0.03 0.09 0.00 0.00 178.44 179.42 1z3a h ARG 75 N 0.80 0.65 -0.47 1.13 3.08 -0.90 -1.43 114.38 117.24 1z3a h ARG 75 Ca 0.14 -0.23 -0.14 0.00 0.07 0.00 0.00 59.98 59.83 1z3a h ARG 75 Cb 0.58 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1z3a h ARG 75 CO 0.03 0.78 -0.24 0.37 -1.07 0.00 0.00 179.97 179.85 1z3a h GLN 76 N 0.58 0.99 -0.89 0.04 4.15 -1.22 -2.83 115.11 115.93 1z3a h GLN 76 Ca 0.09 -0.43 0.01 0.00 0.77 0.00 0.00 58.65 59.09 1z3a h GLN 76 Cb 0.62 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.24 1z3a h GLN 76 CO 0.04 1.11 0.59 0.78 -1.93 0.00 0.00 178.83 179.42 1z3a h GLY 77 N 0.87 1.25 1.05 2.39 0.00 -0.93 0.16 103.07 107.86 1z3a h GLY 77 Ca 0.10 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 1z3a h GLY 77 CO 0.07 0.45 0.59 -1.33 0.00 0.00 0.00 176.54 176.32 1z3a h GLY 78 N 1.20 1.36 0.68 4.60 0.00 -1.16 0.41 103.07 110.15 1z3a h GLY 78 Ca 0.33 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 1z3a h GLY 78 CO -0.07 0.53 -0.11 -2.00 0.00 0.00 0.00 176.54 174.88 1z3a h LEU 79 N 1.30 0.28 -0.86 3.11 5.85 -1.13 0.14 115.31 124.00 1z3a h LEU 79 Ca 0.34 -0.49 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1z3a h LEU 79 Cb -0.09 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 1z3a h LEU 79 CO -0.07 0.72 0.48 0.58 -0.34 0.00 0.00 178.44 179.81 1z3a h VAL 80 N -0.15 1.25 -0.00 1.05 2.07 -0.25 -2.61 116.25 117.61 1z3a h VAL 80 Ca 0.02 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1z3a h VAL 80 Cb 0.64 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1z3a h VAL 80 CO 0.03 0.28 -0.26 0.23 0.02 0.00 0.00 177.57 177.86 1z3a n MET 81 N -4.38 0.49 -3.88 1.57 2.81 0.14 -4.93 117.12 108.94 1z3a n MET 81 Ca 0.09 -0.24 -0.26 0.00 -1.81 0.00 0.00 57.70 55.48 1z3a n MET 81 Cb 0.09 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.11 1z3a n MET 81 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1z3a n GLN 82 N -1.04 -4.41 -3.64 0.03 1.13 0.37 -4.96 117.38 104.86 1z3a n GLN 82 Ca 0.10 0.53 -0.07 0.00 -1.94 0.00 0.00 57.00 55.62 1z3a n GLN 82 Cb 0.32 -5.05 -0.07 0.00 0.11 0.00 0.00 30.24 25.56 1z3a n GLN 82 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1z3a s ASN 83 N -4.02 -0.81 0.33 1.08 3.84 -0.52 -5.01 114.94 109.82 1z3a s ASN 83 Ca 0.23 1.33 0.26 0.00 0.21 0.00 0.00 52.86 54.89 1z3a s ASN 83 Cb -0.12 1.34 0.94 0.00 -0.55 0.00 0.00 41.25 42.86 1z3a s ASN 83 CO 0.85 -0.21 1.78 0.10 -2.79 0.00 0.00 177.10 176.82 1z3a h TYR 84 N 6.51 0.00 -3.48 0.43 -0.00 -1.93 -3.39 116.97 115.10 1z3a h TYR 84 Ca -0.29 0.00 -0.60 0.00 0.00 0.00 0.00 58.73 57.83 1z3a h TYR 84 Cb 1.21 0.00 -0.11 0.00 0.00 0.00 0.00 36.73 37.83 1z3a h TYR 84 CO 0.10 0.00 -0.12 1.03 -0.00 0.00 0.00 178.16 179.17 1z3a s ARG 85 N -3.32 4.17 -0.72 0.10 0.52 -1.26 -4.59 118.95 113.85 1z3a s ARG 85 Ca 0.06 0.30 0.02 0.00 -0.52 0.00 0.00 55.73 55.58 1z3a s ARG 85 Cb 0.09 -3.56 0.35 0.00 0.52 0.00 0.00 34.95 32.36 1z3a s ARG 85 CO 0.51 -0.11 1.40 1.28 0.02 0.00 0.00 175.30 178.41 1z3a n LEU 86 N 4.67 5.82 -4.54 2.53 4.77 0.95 -5.03 117.00 126.18 1z3a n LEU 86 Ca -0.07 -5.37 -0.52 0.00 -0.03 0.00 0.00 56.01 50.02 1z3a n LEU 86 Cb 0.51 -0.79 -0.05 0.00 -2.33 0.00 0.00 43.42 40.75 1z3a n LEU 86 CO 0.41 2.15 0.63 -0.38 -1.33 0.00 0.00 177.39 178.87 1z3a n ILE 87 N -0.29 0.56 -0.81 -0.08 2.08 -1.26 -2.16 119.36 117.40 1z3a n ILE 87 Ca 0.41 -0.14 0.00 0.00 0.56 0.00 0.00 62.75 63.58 1z3a n ILE 87 Cb 0.38 -0.50 0.00 0.00 -0.75 0.00 0.00 39.64 38.77 1z3a n ILE 87 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1z3a n ASP 88 N 1.98 -2.43 -4.85 4.38 8.00 -1.26 -4.86 116.55 117.51 1z3a n ASP 88 Ca 0.18 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.36 1z3a n ASP 88 Cb 0.19 -2.17 -0.00 0.00 -0.02 0.00 0.00 41.12 39.11 1z3a n ASP 88 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1z3a s ALA 89 N -1.60 3.00 -0.12 2.24 0.00 -0.92 -4.51 121.76 119.85 1z3a s ALA 89 Ca 0.00 0.09 0.02 0.00 0.00 0.00 0.00 51.96 52.07 1z3a s ALA 89 Cb 0.00 -3.12 -0.00 0.00 0.00 0.00 0.00 23.12 19.99 1z3a s ALA 89 CO 0.00 -0.58 -0.18 0.99 0.00 0.00 0.00 175.76 175.99 1z3a s THR 90 N -2.86 2.53 -0.27 0.00 2.01 0.10 -1.07 115.64 116.07 1z3a s THR 90 Ca 0.58 -0.84 -0.09 0.00 0.31 0.00 0.00 61.69 61.64 1z3a s THR 90 Cb -0.11 -2.03 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 1z3a s THR 90 CO 0.43 0.54 0.13 -0.22 -0.69 0.00 0.00 174.62 174.81 1z3a s LEU 91 N 0.48 3.80 -0.18 4.42 2.96 -0.31 -0.76 118.68 129.08 1z3a s LEU 91 Ca -0.12 -0.19 -0.08 0.00 -0.22 0.00 0.00 54.13 53.51 1z3a s LEU 91 Cb -0.17 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 1z3a s LEU 91 CO 0.05 -0.07 0.09 -0.31 -1.32 0.00 0.00 176.35 174.79 1z3a s TYR 92 N 1.67 3.34 -0.02 5.38 2.02 0.29 -0.98 117.35 129.05 1z3a s TYR 92 Ca 0.06 0.21 -0.02 0.00 -0.37 0.00 0.00 57.07 56.96 1z3a s TYR 92 Cb -0.16 -2.08 0.01 0.00 -0.40 0.00 0.00 41.96 39.33 1z3a s TYR 92 CO 0.07 0.27 0.06 0.54 -1.57 0.00 0.00 175.55 174.92 1z3a s VAL 93 N 0.19 -0.01 -0.74 0.71 0.11 -0.61 -0.73 120.40 119.33 1z3a s VAL 93 Ca 0.06 0.03 0.16 0.00 -2.93 0.00 0.00 61.98 59.30 1z3a s VAL 93 Cb -0.12 -0.10 0.15 0.00 -1.53 0.00 0.00 36.38 34.79 1z3a s VAL 93 CO -0.00 0.01 1.49 0.35 -3.33 0.00 0.00 175.10 173.62 1z3a n THR 94 N 3.24 1.12 -3.93 5.04 -2.24 -0.71 -1.44 114.28 115.35 1z3a n THR 94 Ca -0.15 0.35 -0.12 0.00 -2.27 0.00 0.00 64.05 61.86 1z3a n THR 94 Cb 0.58 -1.23 -0.14 0.00 -2.10 0.00 0.00 70.33 67.45 1z3a n THR 94 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1z3a s LEU 95 N -3.66 2.03 0.12 3.22 2.96 -1.26 -1.88 118.68 120.21 1z3a s LEU 95 Ca 0.04 -0.08 -0.35 0.00 -0.22 0.00 0.00 54.13 53.52 1z3a s LEU 95 Cb 0.07 -0.04 -0.17 0.00 0.50 0.00 0.00 46.19 46.56 1z3a s LEU 95 CO 0.25 -0.02 1.15 1.21 -1.32 0.00 0.00 176.35 177.62 1z3a n GLU 96 N 2.88 0.85 -2.05 1.98 2.13 0.43 -4.70 120.64 122.17 1z3a n GLU 96 Ca -0.14 0.31 -0.35 0.00 0.66 0.00 0.00 57.16 57.64 1z3a n GLU 96 Cb 0.59 -1.81 0.02 0.00 0.27 0.00 0.00 31.44 30.51 1z3a n GLU 96 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1z3a s PRO 97 N -0.09 3.07 0.98 5.31 0.04 -1.26 -4.69 135.00 138.36 1z3a s PRO 97 Ca 0.79 1.64 -0.16 0.00 0.04 0.00 0.00 61.00 63.31 1z3a s PRO 97 Cb -0.97 -1.96 0.22 0.00 0.04 0.00 0.00 34.50 31.83 1z3a s PRO 97 CO 0.52 -1.08 1.33 0.00 0.04 0.00 0.00 177.00 177.81 1z3a h VAL 99 N -1.70 1.17 0.01 0.00 2.07 -1.92 -0.47 116.25 115.40 1z3a h VAL 99 Ca -0.43 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 66.74 1z3a h VAL 99 Cb 1.21 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1z3a h VAL 99 CO 0.31 0.17 -0.12 -0.03 0.02 0.00 0.00 177.57 177.92 1z3a h MET 100 N 0.76 -0.20 -0.63 1.57 1.85 -1.96 -1.46 114.93 114.86 1z3a h MET 100 Ca 0.20 0.01 -0.07 0.00 -0.61 0.00 0.00 59.70 59.23 1z3a h MET 100 Cb -0.02 0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.03 1z3a h MET 100 CO -0.04 -0.14 0.10 0.00 -0.40 0.00 0.00 176.91 176.43 1z3a h ALA 102 N 1.14 1.12 -0.77 0.00 0.00 -0.95 -0.56 119.26 119.24 1z3a h ALA 102 Ca 0.19 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1z3a h ALA 102 Cb 0.42 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1z3a h ALA 102 CO 0.01 0.57 0.31 0.78 0.00 0.00 0.00 179.25 180.92 1z3a h GLY 103 N 1.21 1.24 1.40 0.00 0.00 -0.84 -1.92 103.07 104.15 1z3a h GLY 103 Ca 0.32 -0.67 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1z3a h GLY 103 CO -0.06 0.63 0.05 0.00 0.00 0.00 0.00 176.54 177.17 1z3a h ALA 104 N 1.16 1.21 -0.73 3.60 0.00 -0.53 -2.01 119.26 121.96 1z3a h ALA 104 Ca 0.26 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1z3a h ALA 104 Cb 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1z3a h ALA 104 CO -0.02 0.53 0.26 0.52 0.00 0.00 0.00 179.25 180.54 1z3a h MET 105 N 0.71 1.10 -0.26 0.00 2.07 -0.54 -0.76 114.93 117.26 1z3a h MET 105 Ca 0.15 -0.21 -0.02 0.00 -2.07 0.00 0.00 59.70 57.55 1z3a h MET 105 Cb 0.36 -0.17 -0.01 0.00 -1.87 0.00 0.00 31.60 29.91 1z3a h MET 105 CO 0.01 0.92 0.09 0.82 1.07 0.00 0.00 176.91 179.82 1z3a h ILE 106 N 1.07 1.18 0.00 -1.22 2.04 -0.88 -2.10 117.51 117.60 1z3a h ILE 106 Ca 0.24 -0.57 -0.05 0.00 1.00 0.00 0.00 64.86 65.48 1z3a h ILE 106 Cb 0.25 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1z3a h ILE 106 CO -0.01 0.19 -0.22 0.45 0.00 0.00 0.00 178.15 178.55 1z3a h HIS 107 N 0.26 0.00 0.00 1.37 3.86 -1.12 -1.83 115.15 117.69 1z3a h HIS 107 Ca 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1z3a h HIS 107 Cb 0.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.68 1z3a h HIS 107 CO -0.00 0.22 0.00 0.77 0.86 0.00 0.00 177.93 179.78 1z3a h SER 108 N 0.00 0.00 -2.65 2.45 0.02 -0.89 -3.45 113.55 109.02 1z3a h SER 108 Ca -0.00 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.59 1z3a h SER 108 Cb 0.40 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 1z3a h SER 108 CO 0.03 0.00 -0.46 0.54 -1.14 0.00 0.00 176.83 175.79 1z3a n ARG 109 N -2.48 -1.63 -1.25 3.45 5.12 -0.69 -0.03 116.66 119.15 1z3a n ARG 109 Ca 0.04 0.86 -0.30 0.00 -1.93 0.00 0.00 57.85 56.52 1z3a n ARG 109 Cb 0.41 -5.37 0.11 0.00 -1.16 0.00 0.00 32.46 26.45 1z3a n ARG 109 CO 0.00 0.00 0.00 0.96 -1.93 0.00 0.00 177.63 176.66 1z3a s ILE 110 N -2.91 3.06 0.10 0.55 -0.00 -1.20 -3.98 121.20 116.82 1z3a s ILE 110 Ca 0.02 0.35 -0.06 0.00 -0.00 0.00 0.00 60.65 60.95 1z3a s ILE 110 Cb -0.01 -2.84 -0.24 0.00 -0.00 0.00 0.00 42.46 39.38 1z3a s ILE 110 CO 0.02 -0.45 1.21 1.23 -0.00 0.00 0.00 174.94 176.95 1z3a h GLY 111 N -1.29 0.44 -3.98 6.27 0.00 -1.31 -3.42 103.07 99.78 1z3a h GLY 111 Ca -0.46 -0.91 -0.07 0.00 0.00 0.00 0.00 47.33 45.89 1z3a h GLY 111 CO 0.53 0.80 0.05 -1.60 0.00 0.00 0.00 176.54 176.32 1z3a s ARG 112 N -2.99 0.98 -0.07 4.80 3.52 -1.14 -0.93 118.95 123.11 1z3a s ARG 112 Ca -0.06 0.00 0.05 0.00 -0.13 0.00 0.00 55.73 55.60 1z3a s ARG 112 Cb 0.08 0.45 -0.01 0.00 -1.56 0.00 0.00 34.95 33.91 1z3a s ARG 112 CO 0.88 -0.32 -0.24 0.54 -0.81 0.00 0.00 175.30 175.35 1z3a s VAL 113 N -1.65 2.03 -0.22 7.11 0.11 0.20 -1.16 120.40 126.82 1z3a s VAL 113 Ca -0.10 -1.04 -0.02 0.00 -2.93 0.00 0.00 61.98 57.90 1z3a s VAL 113 Cb -0.01 -1.73 0.01 0.00 -1.53 0.00 0.00 36.38 33.12 1z3a s VAL 113 CO 0.05 0.56 -0.09 -0.69 -3.33 0.00 0.00 175.10 171.60 1z3a s VAL 114 N 0.01 2.81 0.31 2.04 1.01 -0.15 -1.16 120.40 125.27 1z3a s VAL 114 Ca -0.09 -0.83 0.10 0.00 0.00 0.00 0.00 61.98 61.16 1z3a s VAL 114 Cb -0.15 -2.32 -0.06 0.00 0.00 0.00 0.00 36.38 33.85 1z3a s VAL 114 CO 0.05 0.36 -0.14 0.72 0.00 0.00 0.00 175.10 176.10 1z3a s PHE 115 N 1.36 2.30 0.00 5.22 -0.12 -0.51 -1.57 117.98 124.67 1z3a s PHE 115 Ca 0.03 -0.45 0.00 0.00 -0.05 0.00 0.00 56.93 56.46 1z3a s PHE 115 Cb -0.15 -1.19 0.00 0.00 -0.63 0.00 0.00 43.02 41.06 1z3a s PHE 115 CO -0.06 0.61 0.00 0.41 -0.05 0.00 0.00 175.22 176.12 1z3a n GLY 116 N -0.69 0.84 3.78 1.99 0.00 -0.52 -1.23 105.19 109.36 1z3a n GLY 116 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 1z3a n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z3a s ALA 117 N -4.00 2.78 0.45 4.61 0.00 -0.79 -2.54 121.76 122.27 1z3a s ALA 117 Ca 0.00 0.80 -0.17 0.00 0.00 0.00 0.00 51.96 52.59 1z3a s ALA 117 Cb 0.00 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.69 1z3a s ALA 117 CO 0.00 -0.66 0.92 1.03 0.00 0.00 0.00 175.76 177.05 1z3a s ARG 118 N -3.16 4.04 -0.53 0.00 1.81 -1.26 -0.43 118.95 119.41 1z3a s ARG 118 Ca 0.70 0.93 -0.03 0.00 -1.72 0.00 0.00 55.73 55.61 1z3a s ARG 118 Cb -0.23 -2.21 0.14 0.00 -0.45 0.00 0.00 34.95 32.20 1z3a s ARG 118 CO 0.27 -0.12 0.34 0.34 -0.68 0.00 0.00 175.30 175.45 1z3a s ASP 119 N -2.68 5.30 0.34 0.23 -1.08 -1.26 -4.74 116.67 112.77 1z3a s ASP 119 Ca 0.59 -2.44 0.05 0.00 -0.52 0.00 0.00 52.55 50.23 1z3a s ASP 119 Cb -0.10 -1.86 0.70 0.00 -1.46 0.00 0.00 42.92 40.20 1z3a s ASP 119 CO 0.23 -0.47 1.91 0.00 0.52 0.00 0.00 175.17 177.37 1z3a h ALA 120 N 7.57 1.68 0.00 3.66 0.00 -1.95 -0.16 119.26 130.06 1z3a h ALA 120 Ca -0.08 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.57 1z3a h ALA 120 Cb 1.00 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1z3a h ALA 120 CO 0.72 0.15 -1.51 0.87 0.00 0.00 0.00 179.25 179.48 1z3a h LYS 121 N 0.82 0.00 0.00 0.00 1.57 -1.94 -3.38 116.57 113.64 1z3a h LYS 121 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1z3a h LYS 121 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1z3a h LYS 121 CO -0.15 0.57 0.00 0.25 -0.57 0.00 0.00 179.45 179.55 1z3a n THR 122 N -3.09 0.14 -1.93 -0.16 -2.24 -1.16 -4.64 114.28 101.20 1z3a n THR 122 Ca -0.12 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.10 1z3a n THR 122 Cb 1.00 0.94 -0.01 0.00 -2.10 0.00 0.00 70.33 70.15 1z3a n THR 122 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1z3a s GLY 123 N -0.14 2.62 -0.15 3.38 0.00 -0.08 -4.29 107.32 108.65 1z3a s GLY 123 Ca 0.00 1.43 0.16 0.00 0.00 0.00 0.00 44.72 46.31 1z3a s GLY 123 CO 0.00 2.24 1.54 0.00 0.00 0.00 0.00 173.10 176.88 1z3a n ALA 124 N 1.39 3.14 -2.20 3.20 0.00 0.93 -0.34 120.51 126.62 1z3a n ALA 124 Ca 0.04 -1.88 -0.24 0.00 0.00 0.00 0.00 53.44 51.35 1z3a n ALA 124 Cb 0.40 -0.86 0.01 0.00 0.00 0.00 0.00 19.45 19.00 1z3a n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1z3a n ALA 125 N 0.34 4.97 0.00 0.00 0.00 -1.15 -1.47 120.51 123.20 1z3a n ALA 125 Ca 0.23 -3.95 0.00 0.00 0.00 0.00 0.00 53.44 49.72 1z3a n ALA 125 Cb 0.91 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1z3a n ALA 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1z3a n GLY 126 N -0.62 2.52 0.00 0.00 0.00 -0.67 -4.97 105.19 101.45 1z3a n GLY 126 Ca 0.41 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1z3a n GLY 126 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1z3a n SER 127 N 0.00 0.00 0.07 1.61 7.64 -1.24 -4.46 113.62 117.24 1z3a n SER 127 Ca 0.00 0.30 -0.15 0.00 1.01 0.00 0.00 58.87 60.03 1z3a n SER 127 Cb 0.00 -0.01 -0.07 0.00 -1.01 0.00 0.00 64.21 63.12 1z3a n SER 127 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1z3a h LEU 128 N 0.00 0.59 -7.71 -3.43 5.85 -0.86 -3.47 115.31 106.28 1z3a h LEU 128 Ca 0.00 -0.49 0.13 0.00 0.84 0.00 0.00 57.88 58.36 1z3a h LEU 128 Cb 0.00 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 40.77 1z3a h LEU 128 CO 0.00 1.31 0.39 0.00 -0.34 0.00 0.00 178.44 179.80 1z3a s MET 129 N -3.18 1.36 -0.29 1.25 0.23 -1.11 -5.03 119.30 112.54 1z3a s MET 129 Ca -0.06 -0.74 0.03 0.00 -1.03 0.00 0.00 55.69 53.89 1z3a s MET 129 Cb 0.08 0.48 0.08 0.00 -1.53 0.00 0.00 34.83 33.94 1z3a s MET 129 CO 0.88 -0.62 -0.03 0.34 -2.03 0.00 0.00 175.02 173.56 1z3a s ASP 130 N -2.90 4.49 -0.13 -1.18 -1.08 -1.26 -1.68 116.67 112.94 1z3a s ASP 130 Ca 0.11 -1.70 -0.10 0.00 -0.52 0.00 0.00 52.55 50.35 1z3a s ASP 130 Cb -0.03 -1.51 -0.26 0.00 -1.46 0.00 0.00 42.92 39.67 1z3a s ASP 130 CO 0.03 -0.28 0.38 0.58 0.52 0.00 0.00 175.17 176.39 1z3a h VAL 131 N 6.68 0.71 -0.30 1.11 2.07 -1.65 -3.33 116.25 121.52 1z3a h VAL 131 Ca -0.12 -2.33 0.03 0.00 0.82 0.00 0.00 66.70 65.09 1z3a h VAL 131 Cb 1.03 2.50 -0.02 0.00 -1.52 0.00 0.00 31.29 33.28 1z3a h VAL 131 CO 0.48 0.81 0.20 -0.07 0.02 0.00 0.00 177.57 179.01 1z3a h LEU 132 N -0.09 0.25 -3.10 2.57 3.38 -1.90 -2.64 115.31 113.77 1z3a h LEU 132 Ca -0.40 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1z3a h LEU 132 Cb 1.93 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.62 1z3a h LEU 132 CO 0.05 0.17 0.00 1.41 0.09 0.00 0.00 178.44 180.17 1z3a n HIS 133 N -4.49 0.50 -1.89 1.13 8.25 -1.26 -4.22 115.22 113.23 1z3a n HIS 133 Ca 0.03 -0.83 -0.42 0.00 -0.26 0.00 0.00 57.72 56.24 1z3a n HIS 133 Cb 0.16 -0.20 -0.03 0.00 1.12 0.00 0.00 29.99 31.05 1z3a n HIS 133 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1z3a s HIS 134 N -2.41 2.97 0.54 4.41 5.04 -1.00 -4.88 115.29 119.96 1z3a s HIS 134 Ca 0.32 0.70 0.29 0.00 -1.54 0.00 0.00 55.06 54.84 1z3a s HIS 134 Cb 0.26 -3.96 1.46 0.00 0.04 0.00 0.00 32.58 30.37 1z3a s HIS 134 CO 0.07 -3.42 1.93 -1.00 -2.34 0.00 0.00 174.74 169.98 1z3a h PRO 135 N 6.02 0.00 -0.12 2.88 0.13 -1.93 -2.98 132.00 136.00 1z3a h PRO 135 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1z3a h PRO 135 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1z3a h PRO 135 CO 0.87 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.05 1z3a n GLY 136 N -1.66 0.02 3.80 1.56 0.00 -1.26 -4.93 105.19 102.72 1z3a n GLY 136 Ca 0.14 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 1z3a n GLY 136 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1z3a s MET 137 N -1.85 3.63 0.00 1.61 -1.94 -1.13 -4.95 119.30 114.68 1z3a s MET 137 Ca 0.32 1.29 0.16 0.00 -1.71 0.00 0.00 55.69 55.75 1z3a s MET 137 Cb 0.17 -2.07 0.55 0.00 2.01 0.00 0.00 34.83 35.49 1z3a s MET 137 CO 0.26 -0.56 1.41 0.27 -0.01 0.00 0.00 175.02 176.40 1z3a n ASN 138 N -1.37 1.64 -3.68 3.03 0.23 -1.26 -4.82 115.26 109.04 1z3a n ASN 138 Ca 0.09 -1.83 -0.11 0.00 -0.53 0.00 0.00 54.58 52.20 1z3a n ASN 138 Cb 0.53 -0.15 -0.09 0.00 -2.08 0.00 0.00 39.78 37.98 1z3a n ASN 138 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1z3a s HIS 139 N -1.69 -0.73 -0.26 -2.53 5.04 -1.26 -5.14 115.29 108.72 1z3a s HIS 139 Ca 0.27 1.61 -0.12 0.00 -1.54 0.00 0.00 55.06 55.28 1z3a s HIS 139 Cb 0.14 0.34 -0.05 0.00 0.04 0.00 0.00 32.58 33.06 1z3a s HIS 139 CO 0.21 -0.37 0.23 0.50 -2.34 0.00 0.00 174.74 172.97 1z3a s ARG 140 N 0.96 4.01 -0.19 2.88 3.52 -1.26 -4.94 118.95 123.93 1z3a s ARG 140 Ca -0.05 -0.20 -0.12 0.00 -0.13 0.00 0.00 55.73 55.24 1z3a s ARG 140 Cb -0.05 -3.62 -0.05 0.00 -1.56 0.00 0.00 34.95 29.67 1z3a s ARG 140 CO -0.08 -0.12 0.20 0.08 -0.81 0.00 0.00 175.30 174.56 1z3a s VAL 141 N 1.60 5.36 0.55 7.11 1.01 -1.26 -4.91 120.40 129.85 1z3a s VAL 141 Ca 0.10 0.32 -0.17 0.00 0.00 0.00 0.00 61.98 62.23 1z3a s VAL 141 Cb -0.15 -3.54 -0.06 0.00 0.00 0.00 0.00 36.38 32.63 1z3a s VAL 141 CO 0.09 0.40 1.03 -1.61 0.00 0.00 0.00 175.10 175.02 1z3a s GLU 142 N 0.52 3.59 -0.10 2.72 0.41 -0.11 -4.85 118.70 120.89 1z3a s GLU 142 Ca 0.11 1.19 0.03 0.00 -0.41 0.00 0.00 54.97 55.89 1z3a s GLU 142 Cb -0.12 -2.07 0.01 0.00 -1.78 0.00 0.00 34.13 30.17 1z3a s GLU 142 CO 0.01 -0.58 -0.18 0.42 -0.49 0.00 0.00 175.26 174.44 1z3a s ILE 143 N -2.36 1.64 -0.16 -1.63 1.01 -1.26 -0.63 121.20 117.81 1z3a s ILE 143 Ca 0.64 -0.75 -0.00 0.00 0.00 0.00 0.00 60.65 60.53 1z3a s ILE 143 Cb -0.15 -1.46 -0.00 0.00 0.01 0.00 0.00 42.46 40.86 1z3a s ILE 143 CO 0.31 0.47 -0.13 -0.89 0.00 0.00 0.00 174.94 174.69 1z3a s THR 144 N 0.71 2.82 0.19 2.92 2.01 -0.31 -4.99 115.64 118.99 1z3a s THR 144 Ca -0.12 -0.71 0.09 0.00 0.31 0.00 0.00 61.69 61.26 1z3a s THR 144 Cb -0.16 -2.20 -0.04 0.00 0.01 0.00 0.00 72.50 70.10 1z3a s THR 144 CO 0.03 0.50 -0.09 -1.83 -0.69 0.00 0.00 174.62 172.54 1z3a s GLU 145 N 0.85 2.06 -0.17 4.92 -1.05 -1.26 -1.42 118.70 122.63 1z3a s GLU 145 Ca -0.04 -1.31 0.00 0.00 -0.15 0.00 0.00 54.97 53.47 1z3a s GLU 145 Cb -0.15 -2.14 0.00 0.00 -0.44 0.00 0.00 34.13 31.40 1z3a s GLU 145 CO -0.00 0.42 0.00 0.41 0.95 0.00 0.00 175.26 177.04 1z3a n GLY 146 N -0.09 0.52 3.66 -3.83 0.00 -0.36 -4.92 105.19 100.17 1z3a n GLY 146 Ca -0.10 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 1z3a n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1z3a s ILE 147 N -2.00 3.88 -1.38 -0.61 1.09 -0.94 -2.34 121.20 118.91 1z3a s ILE 147 Ca 0.00 1.09 -0.07 0.00 -1.10 0.00 0.00 60.65 60.57 1z3a s ILE 147 Cb 0.00 -3.70 0.04 0.00 -1.06 0.00 0.00 42.46 37.74 1z3a s ILE 147 CO 0.00 -0.09 0.50 0.18 -0.10 0.00 0.00 174.94 175.44 1z3a n LEU 148 N 6.71 -1.95 -0.29 2.97 4.77 -1.26 -4.09 117.00 123.86 1z3a n LEU 148 Ca 0.15 -0.31 0.17 0.00 -0.03 0.00 0.00 56.01 56.00 1z3a n LEU 148 Cb 0.44 -2.45 0.45 0.00 -2.33 0.00 0.00 43.42 39.52 1z3a n LEU 148 CO 0.59 0.17 1.22 0.00 -1.33 0.00 0.00 177.39 178.03 1z3a h ALA 149 N 0.99 2.03 -0.21 -1.18 0.00 -1.70 -1.42 119.26 117.77 1z3a h ALA 149 Ca -0.46 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.43 1z3a h ALA 149 Cb 1.31 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1z3a h ALA 149 CO 0.53 -0.36 -0.11 -0.44 0.00 0.00 0.00 179.25 178.88 1z3a h ASP 150 N 0.53 0.45 -0.20 0.00 3.32 -1.89 0.11 116.42 118.74 1z3a h ASP 150 Ca 0.52 -0.42 -0.14 0.00 0.02 0.00 0.00 57.03 57.01 1z3a h ASP 150 Cb 1.11 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 1z3a h ASP 150 CO -0.25 0.77 -0.38 -0.33 -1.72 0.00 0.00 179.24 177.32 1z3a h GLU 151 N 0.13 0.73 -0.03 3.56 5.08 -1.83 0.19 114.58 122.41 1z3a h GLU 151 Ca 0.04 -0.37 -0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1z3a h GLU 151 Cb 0.60 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 1z3a h GLU 151 CO 0.03 0.99 0.02 0.00 -1.00 0.00 0.00 179.01 179.05 1z3a h ALA 153 N 0.90 1.30 -0.19 0.00 0.00 -0.71 -2.68 119.26 117.88 1z3a h ALA 153 Ca 0.01 -0.36 -0.14 0.00 0.00 0.00 0.00 54.91 54.43 1z3a h ALA 153 Cb 0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1z3a h ALA 153 CO -0.00 0.50 -0.46 0.00 0.00 0.00 0.00 179.25 179.30 1z3a h ALA 154 N 1.55 0.85 -0.44 0.00 0.00 -0.50 -0.15 119.26 120.57 1z3a h ALA 154 Ca 0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1z3a h ALA 154 Cb 0.70 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1z3a h ALA 154 CO 0.05 0.65 0.22 1.25 0.00 0.00 0.00 179.25 181.43 1z3a h LEU 155 N 0.39 0.57 -0.77 0.00 6.46 -0.94 0.23 115.31 121.25 1z3a h LEU 155 Ca 0.03 -0.11 -0.09 0.00 -0.12 0.00 0.00 57.88 57.58 1z3a h LEU 155 Cb 0.95 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.72 1z3a h LEU 155 CO 0.08 0.52 -0.06 -0.07 -0.62 0.00 0.00 178.44 178.29 1z3a h LEU 156 N 0.57 0.85 -0.40 2.25 3.38 -1.32 -1.92 115.31 118.72 1z3a h LEU 156 Ca 0.15 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1z3a h LEU 156 Cb 0.09 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1z3a h LEU 156 CO -0.02 0.95 0.05 -1.28 0.09 0.00 0.00 178.44 178.22 1z3a h SER 157 N 0.79 0.66 0.18 -0.43 0.87 -0.32 -0.64 113.55 114.65 1z3a h SER 157 Ca 0.14 -0.27 -0.03 0.00 -1.23 0.00 0.00 61.79 60.40 1z3a h SER 157 Cb 0.56 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1z3a h SER 157 CO 0.03 0.77 -0.14 0.44 -0.53 0.00 0.00 176.83 177.40 1z3a h ASP 158 N 0.52 0.00 0.04 6.23 3.32 -0.39 -2.67 116.42 123.47 1z3a h ASP 158 Ca 0.12 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.08 1z3a h ASP 158 Cb 0.40 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.96 1z3a h ASP 158 CO 0.01 0.14 -0.37 0.15 -1.72 0.00 0.00 179.24 177.45 1z3a h PHE 159 N 0.00 0.30 0.00 4.55 3.57 -0.68 -2.13 116.94 122.55 1z3a h PHE 159 Ca -0.00 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.31 1z3a h PHE 159 Cb 0.26 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.98 1z3a h PHE 159 CO 0.00 1.07 0.00 1.19 -2.23 0.00 0.00 178.31 178.34 1z3a n PHE 160 N -4.40 0.00 -0.08 0.41 3.72 -0.31 -1.14 117.46 115.66 1z3a n PHE 160 Ca -0.11 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.22 1z3a n PHE 160 Cb 0.60 -0.27 -0.02 0.00 -0.94 0.00 0.00 39.48 38.84 1z3a n PHE 160 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1z3a n ARG 161 N -1.27 0.45 0.30 -1.08 0.63 -1.03 -3.58 116.66 111.08 1z3a n ARG 161 Ca 0.07 0.20 0.10 0.00 -0.92 0.00 0.00 57.85 57.30 1z3a n ARG 161 Cb 0.11 -1.30 0.52 0.00 0.45 0.00 0.00 32.46 32.24 1z3a n ARG 161 CO 0.00 0.00 0.00 1.98 -2.51 0.00 0.00 177.63 177.10 1z3a h MET 162 N -0.85 0.00 0.00 -0.14 4.05 -1.35 0.38 114.93 117.02 1z3a h MET 162 Ca 0.00 0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.37 1z3a h MET 162 Cb 0.82 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.61 1z3a h MET 162 CO 0.00 0.00 -0.30 -0.09 0.23 0.00 0.00 176.91 176.75 1z3a h ARG 163 N 0.00 0.00 0.00 0.39 1.12 -1.31 -3.21 114.38 111.37 1z3a h ARG 163 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1z3a h ARG 163 Cb 1.01 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.97 1z3a h ARG 163 CO 0.00 0.94 0.00 0.54 -3.11 0.00 0.00 179.97 178.34 1z3a n ARG 164 N -4.58 0.12 -0.08 0.20 1.74 0.11 -0.36 116.66 113.82 1z3a n ARG 164 Ca -0.15 0.48 0.00 0.00 -0.77 0.00 0.00 57.85 57.42 1z3a n ARG 164 Cb 0.50 -1.80 0.03 0.00 -1.02 0.00 0.00 32.46 30.18 1z3a n ARG 164 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1z3a n GLN 165 N -2.04 1.33 0.00 5.56 1.13 0.31 -2.83 117.38 120.84 1z3a n GLN 165 Ca 0.01 -0.28 0.00 0.00 -1.94 0.00 0.00 57.00 54.79 1z3a n GLN 165 Cb 0.13 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 28.94 1z3a n GLN 165 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1z3a n GLU 166 N 0.08 1.75 -1.97 -1.09 2.13 0.52 -4.92 120.64 117.14 1z3a n GLU 166 Ca 0.03 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.60 1z3a n GLU 166 Cb 0.35 -0.81 -0.07 0.00 0.27 0.00 0.00 31.44 31.19 1z3a n GLU 166 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 1z3a s ILE 167 N -1.62 3.42 -2.00 6.31 2.07 -1.13 -5.15 121.20 123.11 1z3a s ILE 167 Ca 0.00 -0.65 0.11 0.00 -1.41 0.00 0.00 60.65 58.71 1z3a s ILE 167 Cb 0.00 -4.31 0.32 0.00 0.13 0.00 0.00 42.46 38.59 1z3a s ILE 167 CO 0.00 -0.79 1.11 1.17 -1.91 0.00 0.00 174.94 174.52