#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z83 h MET 1 N 0.00 0.73 -0.47 4.33 1.85 -2.02 -2.55 114.93 116.79 1z83 h MET 1 Ca 0.00 -0.58 0.09 0.00 -0.61 0.00 0.00 59.70 58.60 1z83 h MET 1 Cb 0.00 0.12 -0.08 0.00 0.43 0.00 0.00 31.60 32.07 1z83 h MET 1 CO 0.00 1.20 -0.04 1.49 -0.40 0.00 0.00 176.91 179.16 1z83 h GLU 2 N 0.50 0.07 -0.60 0.39 4.22 -1.98 -0.96 114.58 116.22 1z83 h GLU 2 Ca -0.04 -0.00 -0.10 0.00 0.08 0.00 0.00 59.36 59.30 1z83 h GLU 2 Cb 1.37 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.58 1z83 h GLU 2 CO 0.15 0.04 0.00 0.93 -2.18 0.00 0.00 179.01 177.96 1z83 h GLU 3 N 0.07 1.06 -0.80 1.92 5.08 -1.96 -3.01 114.58 116.94 1z83 h GLU 3 Ca 0.24 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1z83 h GLU 3 Cb 0.36 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 1z83 h GLU 3 CO -0.43 1.03 0.50 0.87 -1.00 0.00 0.00 179.01 179.98 1z83 h LYS 4 N 0.97 1.07 0.00 2.33 1.57 -0.99 -2.34 116.57 119.17 1z83 h LYS 4 Ca 0.17 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1z83 h LYS 4 Cb 0.55 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1z83 h LYS 4 CO 0.03 0.73 0.00 -0.07 -0.57 0.00 0.00 179.45 179.57 1z83 h LEU 5 N 1.09 0.00 -1.14 2.94 3.38 -1.06 -2.28 115.31 118.23 1z83 h LEU 5 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1z83 h LEU 5 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1z83 h LEU 5 CO -0.06 0.00 -0.20 0.29 0.09 0.00 0.00 178.44 178.56 1z83 n LYS 6 N -2.71 1.54 0.00 1.13 5.02 -0.88 -4.10 118.16 118.15 1z83 n LYS 6 Ca -0.01 -1.14 0.07 0.00 -2.02 0.00 0.00 58.31 55.21 1z83 n LYS 6 Cb 0.14 -1.48 0.05 0.00 -0.02 0.00 0.00 35.03 33.73 1z83 n LYS 6 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1z83 n LYS 7 N 0.27 0.99 -4.09 1.97 5.02 -0.86 -4.97 118.16 116.49 1z83 n LYS 7 Ca 0.13 -1.30 -0.35 0.00 -2.02 0.00 0.00 58.31 54.77 1z83 n LYS 7 Cb 0.46 -1.26 -0.07 0.00 -0.02 0.00 0.00 35.03 34.13 1z83 n LYS 7 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1z83 s THR 8 N -1.19 4.93 0.11 -0.18 -1.32 -1.22 -5.07 115.64 111.70 1z83 s THR 8 Ca 0.16 -0.13 -0.31 0.00 -1.21 0.00 0.00 61.69 60.20 1z83 s THR 8 Cb 0.12 -3.17 -0.09 0.00 -1.51 0.00 0.00 72.50 67.84 1z83 s THR 8 CO 0.18 0.51 1.64 0.20 -2.21 0.00 0.00 174.62 174.95 1z83 s ASN 9 N -1.27 6.58 -0.13 8.08 -0.87 -1.26 -4.95 114.94 121.12 1z83 s ASN 9 Ca 0.18 2.56 0.02 0.00 -1.57 0.00 0.00 52.86 54.04 1z83 s ASN 9 Cb -0.12 -2.57 0.01 0.00 -0.02 0.00 0.00 41.25 38.55 1z83 s ASN 9 CO 0.08 -0.88 -0.17 -0.63 -2.57 0.00 0.00 177.10 172.93 1z83 s ILE 10 N 2.15 1.68 -0.18 0.60 1.01 -1.26 -1.10 121.20 124.10 1z83 s ILE 10 Ca 0.73 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 60.65 1z83 s ILE 10 Cb -0.42 -1.52 0.02 0.00 0.01 0.00 0.00 42.46 40.54 1z83 s ILE 10 CO 0.32 0.48 -0.19 -0.63 0.00 0.00 0.00 174.94 174.92 1z83 s ILE 11 N 1.02 2.13 -0.07 2.92 1.01 -0.56 -0.43 121.20 127.21 1z83 s ILE 11 Ca -0.05 -0.92 -0.28 0.00 0.00 0.00 0.00 60.65 59.40 1z83 s ILE 11 Cb -0.15 -1.89 -0.02 0.00 0.01 0.00 0.00 42.46 40.41 1z83 s ILE 11 CO -0.03 0.54 0.94 -0.36 0.00 0.00 0.00 174.94 176.02 1z83 s PHE 12 N 1.24 3.56 -0.32 3.97 0.08 -0.51 -0.42 117.98 125.58 1z83 s PHE 12 Ca 0.04 1.55 -0.09 0.00 0.12 0.00 0.00 56.93 58.55 1z83 s PHE 12 Cb -0.13 -3.10 0.01 0.00 -0.57 0.00 0.00 43.02 39.22 1z83 s PHE 12 CO -0.11 -0.12 0.13 0.08 -0.10 0.00 0.00 175.22 175.10 1z83 s VAL 13 N 1.56 4.29 -0.02 -0.44 1.01 0.88 -0.30 120.40 127.37 1z83 s VAL 13 Ca 0.47 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.85 1z83 s VAL 13 Cb -0.19 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 1z83 s VAL 13 CO 0.21 -0.02 -0.26 -0.69 0.00 0.00 0.00 175.10 174.34 1z83 s VAL 14 N 1.54 2.04 0.00 2.92 1.01 -0.05 -2.83 120.40 125.02 1z83 s VAL 14 Ca 0.03 -1.10 0.00 0.00 0.00 0.00 0.00 61.98 60.91 1z83 s VAL 14 Cb -0.18 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.51 1z83 s VAL 14 CO 0.05 0.58 0.00 0.61 0.00 0.00 0.00 175.10 176.33 1z83 n GLY 15 N 2.49 1.57 3.62 4.51 0.00 -1.26 -0.61 105.19 115.52 1z83 n GLY 15 Ca -0.16 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 1z83 n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1z83 s GLY 16 N 0.00 1.56 -0.01 -0.02 0.00 -1.26 -4.85 107.32 102.74 1z83 s GLY 16 Ca 0.00 -0.57 -0.30 0.00 0.00 0.00 0.00 44.72 43.85 1z83 s GLY 16 CO 0.00 0.16 1.76 2.56 0.00 0.00 0.00 173.10 177.57 1z83 s PRO 17 N -5.08 4.17 -0.01 2.90 0.04 -1.26 -1.79 135.00 133.97 1z83 s PRO 17 Ca 0.68 2.35 0.00 0.00 0.04 0.00 0.00 61.00 64.07 1z83 s PRO 17 Cb -0.16 -3.98 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1z83 s PRO 17 CO 0.58 -0.86 0.00 0.41 0.04 0.00 0.00 177.00 177.16 1z83 n GLY 18 N 4.24 0.47 0.28 0.56 0.00 -1.26 -4.66 105.19 104.82 1z83 n GLY 18 Ca 0.18 -0.24 0.19 0.00 0.00 0.00 0.00 46.02 46.14 1z83 n GLY 18 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1z83 h SER 19 N 0.00 0.00 0.00 1.61 4.64 -1.68 -3.43 113.55 114.69 1z83 h SER 19 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1z83 h SER 19 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1z83 h SER 19 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1z83 n GLY 20 N -0.56 1.24 0.04 -0.77 0.00 -1.26 -4.78 105.19 99.09 1z83 n GLY 20 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1z83 n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1z83 h LYS 21 N 0.07 -0.01 -0.30 1.61 1.57 -1.90 -1.12 116.57 116.49 1z83 h LYS 21 Ca 0.00 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1z83 h LYS 21 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1z83 h LYS 21 CO 0.00 -0.00 0.13 0.78 -0.57 0.00 0.00 179.45 179.79 1z83 h GLY 22 N -0.01 0.39 0.54 3.86 0.00 -1.98 0.24 103.07 106.11 1z83 h GLY 22 Ca -0.00 -0.09 0.07 0.00 0.00 0.00 0.00 47.33 47.31 1z83 h GLY 22 CO 0.00 0.07 0.20 -0.84 0.00 0.00 0.00 176.54 175.97 1z83 h THR 23 N 0.29 0.84 -0.20 4.70 2.02 -1.96 -1.82 112.91 116.78 1z83 h THR 23 Ca 0.13 -0.14 -0.21 0.00 0.77 0.00 0.00 66.41 66.96 1z83 h THR 23 Cb 0.06 0.41 0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1z83 h THR 23 CO -0.10 0.07 -0.69 1.56 0.37 0.00 0.00 175.52 176.74 1z83 h GLN 24 N 0.40 0.80 -0.74 6.66 1.08 -0.98 -3.19 115.11 119.14 1z83 h GLN 24 Ca 0.25 -0.59 0.07 0.00 -1.45 0.00 0.00 58.65 56.93 1z83 h GLN 24 Cb 0.26 0.10 -0.05 0.00 -0.05 0.00 0.00 27.48 27.74 1z83 h GLN 24 CO -0.24 1.21 0.48 0.00 -0.95 0.00 0.00 178.83 179.34 1z83 h GLU 26 N 0.73 0.67 -0.43 0.00 4.39 -1.32 -0.41 114.58 118.22 1z83 h GLU 26 Ca 0.32 -0.27 -0.07 0.00 0.34 0.00 0.00 59.36 59.69 1z83 h GLU 26 Cb 0.32 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 1z83 h GLU 26 CO -0.11 0.85 -0.02 0.87 -1.16 0.00 0.00 179.01 179.44 1z83 h LYS 27 N 0.59 0.70 -0.14 2.33 1.57 -1.46 -0.76 116.57 119.40 1z83 h LYS 27 Ca 0.08 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1z83 h LYS 27 Cb 0.71 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 1z83 h LYS 27 CO 0.05 0.73 -0.01 0.82 -0.57 0.00 0.00 179.45 180.48 1z83 h ILE 28 N 0.66 1.26 -0.32 1.86 2.04 -1.16 -1.33 117.51 120.52 1z83 h ILE 28 Ca 0.13 -0.86 0.05 0.00 1.00 0.00 0.00 64.86 65.18 1z83 h ILE 28 Cb 0.43 1.56 -0.05 0.00 -0.74 0.00 0.00 36.82 38.02 1z83 h ILE 28 CO 0.02 0.25 0.02 0.58 0.00 0.00 0.00 178.15 179.02 1z83 h VAL 29 N -0.02 0.79 -0.73 1.67 2.07 -0.75 0.13 116.25 119.41 1z83 h VAL 29 Ca 0.04 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1z83 h VAL 29 Cb 0.39 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1z83 h VAL 29 CO 0.01 0.02 0.46 1.56 0.02 0.00 0.00 177.57 179.64 1z83 h GLN 30 N 0.12 0.98 0.20 1.57 4.20 -1.06 0.51 115.11 121.65 1z83 h GLN 30 Ca 0.15 -0.08 -0.34 0.00 0.06 0.00 0.00 58.65 58.45 1z83 h GLN 30 Cb 0.19 -0.21 0.02 0.00 0.30 0.00 0.00 27.48 27.78 1z83 h GLN 30 CO -0.24 0.68 -1.64 -0.22 -0.67 0.00 0.00 178.83 176.74 1z83 h LYS 31 N 1.00 0.42 0.00 1.46 3.64 -0.77 -3.40 116.57 118.92 1z83 h LYS 31 Ca 0.27 -0.73 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1z83 h LYS 31 Cb -0.07 0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1z83 h LYS 31 CO -0.05 1.35 -0.59 0.66 -2.27 0.00 0.00 179.45 178.54 1z83 n TYR 32 N -3.66 0.00 -1.44 1.91 4.02 0.42 -5.03 117.16 113.37 1z83 n TYR 32 Ca -0.23 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.58 1z83 n TYR 32 Cb 1.07 -0.03 -0.03 0.00 -0.02 0.00 0.00 39.34 40.33 1z83 n TYR 32 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1z83 n GLY 33 N 1.32 0.83 3.79 2.72 0.00 0.17 -5.00 105.19 109.02 1z83 n GLY 33 Ca 0.01 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.11 1z83 n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1z83 s TYR 34 N -2.34 2.67 -0.26 1.61 1.51 -1.26 -4.33 117.35 114.96 1z83 s TYR 34 Ca 0.00 1.08 -0.14 0.00 -1.01 0.00 0.00 57.07 57.00 1z83 s TYR 34 Cb 0.00 -3.20 -0.04 0.00 -0.11 0.00 0.00 41.96 38.61 1z83 s TYR 34 CO 0.00 -2.02 0.33 0.99 -1.11 0.00 0.00 175.55 173.74 1z83 s THR 35 N -3.16 5.21 -0.21 -0.71 2.01 0.26 -4.63 115.64 114.41 1z83 s THR 35 Ca 0.62 0.51 -0.14 0.00 0.31 0.00 0.00 61.69 62.99 1z83 s THR 35 Cb -0.15 -3.66 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 1z83 s THR 35 CO 0.54 0.20 0.31 -2.28 -0.69 0.00 0.00 174.62 172.70 1z83 s HIS 36 N 1.81 3.37 -0.12 4.92 2.46 -1.26 -0.92 115.29 125.55 1z83 s HIS 36 Ca 0.14 0.49 0.02 0.00 0.47 0.00 0.00 55.06 56.17 1z83 s HIS 36 Cb -0.15 -2.42 0.02 0.00 -0.13 0.00 0.00 32.58 29.89 1z83 s HIS 36 CO 0.09 0.05 -0.16 -0.51 -2.47 0.00 0.00 174.74 171.74 1z83 s LEU 37 N 1.11 1.78 -0.23 8.88 1.43 -0.41 -4.97 118.68 126.28 1z83 s LEU 37 Ca 0.15 -0.47 -0.06 0.00 -1.03 0.00 0.00 54.13 52.72 1z83 s LEU 37 Cb -0.14 -1.17 -0.02 0.00 0.03 0.00 0.00 46.19 44.88 1z83 s LEU 37 CO 0.06 0.01 0.03 -0.55 0.23 0.00 0.00 176.35 176.13 1z83 s SER 38 N 1.07 4.86 0.37 2.29 0.15 -1.26 -1.18 113.70 120.00 1z83 s SER 38 Ca -0.04 -0.26 0.06 0.00 0.70 0.00 0.00 55.95 56.41 1z83 s SER 38 Cb -0.15 -1.86 0.74 0.00 -1.71 0.00 0.00 66.02 63.04 1z83 s SER 38 CO -0.04 -0.02 1.97 0.71 1.20 0.00 0.00 173.24 177.07 1z83 h THR 39 N 5.56 1.15 -0.42 6.45 1.35 -1.82 -1.30 112.91 123.88 1z83 h THR 39 Ca -0.39 -0.47 0.07 0.00 -0.55 0.00 0.00 66.41 65.07 1z83 h THR 39 Cb 1.17 0.70 -0.06 0.00 -1.73 0.00 0.00 68.15 68.24 1z83 h THR 39 CO 0.59 0.18 0.07 1.23 -0.25 0.00 0.00 175.52 177.34 1z83 h GLY 40 N 0.70 0.49 0.98 5.82 0.00 -1.90 0.08 103.07 109.24 1z83 h GLY 40 Ca 0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.44 1z83 h GLY 40 CO -0.01 -0.05 0.29 -0.55 0.00 0.00 0.00 176.54 176.21 1z83 h ASP 41 N 0.20 0.61 -0.44 0.19 3.32 -1.72 0.01 116.42 118.59 1z83 h ASP 41 Ca 0.20 -0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.20 1z83 h ASP 41 Cb 0.26 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1z83 h ASP 41 CO -0.28 0.51 0.25 -0.07 -1.72 0.00 0.00 179.24 177.93 1z83 h LEU 42 N 0.67 0.39 -0.48 1.55 3.38 -1.08 0.40 115.31 120.15 1z83 h LEU 42 Ca 0.18 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1z83 h LEU 42 Cb 0.02 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1z83 h LEU 42 CO -0.03 0.28 0.01 -0.07 0.09 0.00 0.00 178.44 178.72 1z83 h LEU 43 N 0.50 0.82 -1.17 1.67 3.38 -0.73 -2.44 115.31 117.34 1z83 h LEU 43 Ca 0.18 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 1z83 h LEU 43 Cb 0.03 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1z83 h LEU 43 CO -0.09 0.92 -0.24 0.03 0.09 0.00 0.00 178.44 179.15 1z83 h ARG 44 N 0.70 0.27 -0.56 1.13 3.08 -0.75 -1.15 114.38 117.10 1z83 h ARG 44 Ca 0.14 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 1z83 h ARG 44 Cb 0.50 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 1z83 h ARG 44 CO 0.02 0.51 0.30 0.77 -1.07 0.00 0.00 179.97 180.50 1z83 h SER 45 N 0.25 0.71 -0.68 7.04 0.02 -0.71 -0.90 113.55 119.28 1z83 h SER 45 Ca 0.04 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1z83 h SER 45 Cb 0.57 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 1z83 h SER 45 CO 0.04 0.61 0.42 -0.08 -1.14 0.00 0.00 176.83 176.68 1z83 h GLU 46 N 0.75 0.91 -0.32 3.45 4.57 -0.86 -2.37 114.58 120.72 1z83 h GLU 46 Ca 0.20 -0.07 0.04 0.00 -1.18 0.00 0.00 59.36 58.34 1z83 h GLU 46 Cb 0.06 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.42 1z83 h GLU 46 CO -0.03 0.64 0.10 0.28 -1.18 0.00 0.00 179.01 178.82 1z83 h VAL 47 N 0.92 0.90 -0.86 0.32 2.07 -0.94 -2.55 116.25 116.11 1z83 h VAL 47 Ca 0.25 -0.08 0.21 0.00 0.82 0.00 0.00 66.70 67.89 1z83 h VAL 47 Cb -0.05 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.31 1z83 h VAL 47 CO -0.05 0.04 0.58 0.28 0.02 0.00 0.00 177.57 178.45 1z83 h SER 48 N 0.23 0.29 0.04 0.57 0.02 -0.68 -1.24 113.55 112.79 1z83 h SER 48 Ca 0.14 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1z83 h SER 48 Cb 0.13 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1z83 h SER 48 CO -0.16 0.12 0.00 0.77 -1.14 0.00 0.00 176.83 176.42 1z83 h SER 49 N 0.29 0.00 0.00 3.07 4.64 -0.99 -3.46 113.55 117.10 1z83 h SER 49 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1z83 h SER 49 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1z83 h SER 49 CO -0.13 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.44 1z83 n GLY 50 N -1.09 0.73 3.74 -0.77 0.00 -0.47 -5.05 105.19 102.28 1z83 n GLY 50 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1z83 n GLY 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1z83 s SER 51 N -2.45 4.25 0.18 1.61 1.04 -1.26 -4.86 113.70 112.21 1z83 s SER 51 Ca 0.00 2.05 -0.11 0.00 0.48 0.00 0.00 55.95 58.37 1z83 s SER 51 Cb 0.00 -2.55 0.09 0.00 0.10 0.00 0.00 66.02 63.65 1z83 s SER 51 CO 0.00 -2.21 1.72 0.00 0.98 0.00 0.00 173.24 173.73 1z83 h ALA 52 N -0.83 0.82 -0.54 5.32 0.00 -1.96 -1.72 119.26 120.34 1z83 h ALA 52 Ca -0.45 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.22 1z83 h ALA 52 Cb 1.26 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1z83 h ALA 52 CO 0.50 0.47 0.16 0.00 0.00 0.00 0.00 179.25 180.38 1z83 h ARG 53 N 0.89 0.81 -0.67 0.00 3.08 -1.96 -1.55 114.38 114.98 1z83 h ARG 53 Ca 0.20 -0.15 0.05 0.00 0.07 0.00 0.00 59.98 60.15 1z83 h ARG 53 Cb 0.26 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.13 1z83 h ARG 53 CO -0.01 0.71 0.40 0.78 -1.07 0.00 0.00 179.97 180.78 1z83 h GLY 54 N 0.95 0.98 0.80 0.04 0.00 -1.73 -1.75 103.07 102.36 1z83 h GLY 54 Ca 0.18 -0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.25 1z83 h GLY 54 CO -0.01 0.21 0.20 1.70 0.00 0.00 0.00 176.54 178.64 1z83 h LYS 55 N 0.75 0.39 -0.43 4.80 3.64 -0.38 -1.11 116.57 124.24 1z83 h LYS 55 Ca 0.29 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.56 1z83 h LYS 55 Cb 0.11 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 1z83 h LYS 55 CO -0.15 0.26 -0.06 0.87 -2.27 0.00 0.00 179.45 178.11 1z83 h LYS 56 N 0.40 0.73 -0.80 1.90 1.57 -1.21 -2.49 116.57 116.68 1z83 h LYS 56 Ca 0.17 -0.21 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1z83 h LYS 56 Cb 0.07 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1z83 h LYS 56 CO -0.12 0.78 0.33 -0.07 -0.57 0.00 0.00 179.45 179.80 1z83 h LEU 57 N 0.67 1.09 -0.54 2.94 3.38 -1.01 -3.09 115.31 118.76 1z83 h LEU 57 Ca 0.13 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1z83 h LEU 57 Cb 0.50 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1z83 h LEU 57 CO 0.03 0.96 0.19 -1.28 0.09 0.00 0.00 178.44 178.43 1z83 h SER 58 N 1.16 0.76 -0.93 -0.43 0.87 -0.80 -1.80 113.55 112.39 1z83 h SER 58 Ca 0.27 -0.19 0.07 0.00 -1.23 0.00 0.00 61.79 60.71 1z83 h SER 58 Cb 0.20 -0.20 -0.07 0.00 -0.44 0.00 0.00 62.40 61.89 1z83 h SER 58 CO -0.02 0.75 0.58 -0.33 -0.53 0.00 0.00 176.83 177.28 1z83 h GLU 59 N 0.74 1.01 -0.13 2.24 3.07 -1.38 0.18 114.58 120.30 1z83 h GLU 59 Ca 0.18 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 58.94 1z83 h GLU 59 Cb 0.24 -0.23 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1z83 h GLU 59 CO -0.01 0.67 -0.05 0.82 -1.40 0.00 0.00 179.01 179.04 1z83 h ILE 60 N 1.04 1.30 -0.82 3.13 2.04 -1.42 -3.11 117.51 119.67 1z83 h ILE 60 Ca 0.41 -1.04 0.01 0.00 1.00 0.00 0.00 64.86 65.25 1z83 h ILE 60 Cb 0.22 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.98 1z83 h ILE 60 CO -0.19 0.30 0.55 0.24 0.00 0.00 0.00 178.15 179.05 1z83 h MET 61 N -0.06 1.08 0.00 2.37 2.86 -0.92 -1.69 114.93 118.56 1z83 h MET 61 Ca 0.03 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1z83 h MET 61 Cb 0.49 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1z83 h MET 61 CO 0.02 0.71 0.00 0.93 1.06 0.00 0.00 176.91 179.63 1z83 h GLU 62 N 1.11 0.00 -0.07 1.72 5.08 -0.62 -2.00 114.58 119.80 1z83 h GLU 62 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1z83 h GLU 62 Cb -0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1z83 h GLU 62 CO -0.07 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.57 1z83 n LYS 63 N -2.48 2.11 -1.03 2.33 5.02 -0.65 -4.87 118.16 118.60 1z83 n LYS 63 Ca 0.00 -1.62 -0.01 0.00 -2.02 0.00 0.00 58.31 54.66 1z83 n LYS 63 Cb 0.17 -1.47 -0.00 0.00 -0.02 0.00 0.00 35.03 33.71 1z83 n LYS 63 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1z83 n GLY 64 N 1.30 0.49 3.81 0.72 0.00 -0.75 -4.77 105.19 105.99 1z83 n GLY 64 Ca 0.16 -0.64 -0.22 0.00 0.00 0.00 0.00 46.02 45.33 1z83 n GLY 64 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1z83 s GLN 65 N -1.42 2.66 0.08 1.61 -0.21 -1.12 -4.18 119.66 117.07 1z83 s GLN 65 Ca 0.00 -1.31 -0.30 0.00 0.02 0.00 0.00 55.36 53.77 1z83 s GLN 65 Cb 0.00 -2.41 -0.05 0.00 1.00 0.00 0.00 33.01 31.55 1z83 s GLN 65 CO 0.00 0.18 1.00 -0.51 -2.12 0.00 0.00 175.29 173.84 1z83 s LEU 66 N -3.91 4.45 0.76 2.90 1.43 -1.26 -4.40 118.68 118.64 1z83 s LEU 66 Ca 0.38 1.79 -0.11 0.00 -1.03 0.00 0.00 54.13 55.16 1z83 s LEU 66 Cb -0.06 -3.58 0.05 0.00 0.03 0.00 0.00 46.19 42.63 1z83 s LEU 66 CO 0.25 -0.17 1.08 0.68 0.23 0.00 0.00 176.35 178.42 1z83 s VAL 67 N 0.39 3.45 0.28 -1.59 -7.23 -1.26 -4.98 120.40 109.47 1z83 s VAL 67 Ca 0.50 0.47 -0.29 0.00 -1.81 0.00 0.00 61.98 60.84 1z83 s VAL 67 Cb -0.23 -3.19 -0.13 0.00 0.56 0.00 0.00 36.38 33.38 1z83 s VAL 67 CO 0.30 -0.61 1.24 -2.65 -0.31 0.00 0.00 175.10 173.06 1z83 n PRO 68 N -3.33 1.81 -0.11 4.82 -0.02 -1.26 -4.89 135.00 132.01 1z83 n PRO 68 Ca 0.07 0.64 -0.06 0.00 -2.02 0.00 0.00 63.50 62.13 1z83 n PRO 68 Cb 0.55 -2.18 0.02 0.00 -0.02 0.00 0.00 33.50 31.87 1z83 n PRO 68 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1z83 h LEU 69 N 2.93 0.21 -0.81 2.45 6.46 -2.00 -2.61 115.31 121.94 1z83 h LEU 69 Ca -0.44 0.03 -0.06 0.00 -0.12 0.00 0.00 57.88 57.29 1z83 h LEU 69 Cb 1.30 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 41.19 1z83 h LEU 69 CO 0.66 0.16 0.22 -0.08 -0.62 0.00 0.00 178.44 178.78 1z83 h GLU 70 N 0.34 1.10 -0.37 1.25 4.57 -1.99 -0.20 114.58 119.27 1z83 h GLU 70 Ca 0.16 -0.23 -0.03 0.00 -1.18 0.00 0.00 59.36 58.08 1z83 h GLU 70 Cb 0.10 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.52 1z83 h GLU 70 CO -0.14 0.94 0.12 1.15 -1.18 0.00 0.00 179.01 179.90 1z83 h THR 71 N 1.06 1.21 0.02 0.32 2.02 -1.88 -0.79 112.91 114.87 1z83 h THR 71 Ca 0.23 -0.68 -0.27 0.00 0.77 0.00 0.00 66.41 66.46 1z83 h THR 71 Cb 0.30 0.96 0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1z83 h THR 71 CO -0.01 0.24 -1.07 1.62 0.37 0.00 0.00 175.52 176.67 1z83 h VAL 72 N 0.45 1.28 -0.35 3.16 3.04 -1.23 -2.82 116.25 119.78 1z83 h VAL 72 Ca 0.12 -2.27 0.00 0.00 -1.01 0.00 0.00 66.70 63.54 1z83 h VAL 72 Cb 0.25 2.42 -0.02 0.00 -2.01 0.00 0.00 31.29 31.93 1z83 h VAL 72 CO -0.00 0.70 0.22 0.25 -1.01 0.00 0.00 177.57 177.73 1z83 h LEU 73 N 0.38 0.41 -0.80 3.16 5.85 -1.00 -1.46 115.31 121.85 1z83 h LEU 73 Ca -0.14 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.58 1z83 h LEU 73 Cb 1.72 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.61 1z83 h LEU 73 CO 0.21 0.32 0.52 0.44 -0.34 0.00 0.00 178.44 179.58 1z83 h ASP 74 N 0.47 0.87 -0.37 1.25 3.32 -1.19 0.18 116.42 120.94 1z83 h ASP 74 Ca 0.13 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.17 1z83 h ASP 74 Cb -0.03 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1z83 h ASP 74 CO -0.03 0.61 0.24 -0.03 -1.72 0.00 0.00 179.24 178.31 1z83 h MET 75 N 1.03 0.47 0.09 3.56 4.05 -1.38 -1.35 114.93 121.39 1z83 h MET 75 Ca 0.31 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.70 1z83 h MET 75 Cb -0.03 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 30.66 1z83 h MET 75 CO -0.10 0.31 -0.04 1.25 0.23 0.00 0.00 176.91 178.56 1z83 h LEU 76 N 0.48 -0.10 -0.93 3.39 5.85 -0.95 -2.68 115.31 120.37 1z83 h LEU 76 Ca 0.14 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1z83 h LEU 76 Cb -0.04 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1z83 h LEU 76 CO -0.04 -0.01 0.48 -0.09 -0.34 0.00 0.00 178.44 178.44 1z83 h ARG 77 N -0.18 1.24 -0.73 1.25 2.43 -0.54 -1.65 114.38 116.20 1z83 h ARG 77 Ca -0.01 -0.15 0.07 0.00 -0.81 0.00 0.00 59.98 59.08 1z83 h ARG 77 Cb 0.15 -0.24 -0.06 0.00 -0.42 0.00 0.00 29.97 29.40 1z83 h ARG 77 CO 0.02 0.91 0.41 -0.44 -1.51 0.00 0.00 179.97 179.36 1z83 h ASP 78 N 1.25 0.61 -0.62 -3.80 3.32 -1.16 -0.66 116.42 115.35 1z83 h ASP 78 Ca 0.31 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.33 1z83 h ASP 78 Cb 0.03 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1z83 h ASP 78 CO -0.05 0.38 0.13 0.00 -1.72 0.00 0.00 179.24 177.98 1z83 h ALA 79 N 1.38 1.00 -0.34 3.45 0.00 -1.04 -1.75 119.26 121.96 1z83 h ALA 79 Ca 0.33 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1z83 h ALA 79 Cb 0.22 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1z83 h ALA 79 CO -0.20 0.64 0.05 0.52 0.00 0.00 0.00 179.25 180.27 1z83 h MET 80 N 0.98 0.57 -0.67 0.00 2.86 -0.91 -3.00 114.93 114.76 1z83 h MET 80 Ca 0.20 -0.15 0.01 0.00 -2.06 0.00 0.00 59.70 57.70 1z83 h MET 80 Cb 0.39 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 1z83 h MET 80 CO 0.01 0.65 0.45 0.28 1.06 0.00 0.00 176.91 179.35 1z83 h VAL 81 N 0.41 1.17 0.00 -2.22 2.07 -0.96 -1.36 116.25 115.35 1z83 h VAL 81 Ca 0.10 -0.31 -0.06 0.00 0.82 0.00 0.00 66.70 67.25 1z83 h VAL 81 Cb 0.36 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1z83 h VAL 81 CO 0.01 0.16 -0.29 0.00 0.02 0.00 0.00 177.57 177.47 1z83 h ALA 82 N 1.58 1.23 -0.01 1.67 0.00 -1.18 -3.29 119.26 119.26 1z83 h ALA 82 Ca 0.25 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1z83 h ALA 82 Cb -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1z83 h ALA 82 CO -0.06 0.36 -0.09 1.63 0.00 0.00 0.00 179.25 181.09 1z83 n LYS 83 N -3.77 1.36 -0.09 0.00 5.02 -0.92 -4.76 118.16 114.99 1z83 n LYS 83 Ca -0.01 -0.71 -0.05 0.00 -2.02 0.00 0.00 58.31 55.52 1z83 n LYS 83 Cb 0.38 -1.07 0.16 0.00 -0.02 0.00 0.00 35.03 34.49 1z83 n LYS 83 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 1z83 h VAL 84 N 1.15 1.25 -0.10 -0.18 3.04 -1.33 -0.36 116.25 119.72 1z83 h VAL 84 Ca 0.00 -1.06 0.03 0.00 -1.01 0.00 0.00 66.70 64.66 1z83 h VAL 84 Cb 0.29 0.96 -0.00 0.00 -2.01 0.00 0.00 31.29 30.53 1z83 h VAL 84 CO 0.00 0.37 0.11 0.78 -1.01 0.00 0.00 177.57 177.82 1z83 h ASN 85 N 0.70 0.00 -0.00 3.17 4.21 -1.86 -2.99 115.58 118.81 1z83 h ASN 85 Ca 0.13 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.64 1z83 h ASN 85 Cb 0.50 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.70 1z83 h ASN 85 CO 0.03 0.00 -0.13 0.35 -1.29 0.00 0.00 177.43 176.39 1z83 n THR 86 N -3.78 0.00 -2.48 2.81 -2.24 -0.97 -5.07 114.28 102.55 1z83 n THR 86 Ca -0.01 -0.44 -0.40 0.00 -2.27 0.00 0.00 64.05 60.94 1z83 n THR 86 Cb 0.22 1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 69.41 1z83 n THR 86 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1z83 s SER 87 N -1.17 7.15 0.03 3.42 0.15 -0.18 -4.94 113.70 118.16 1z83 s SER 87 Ca 0.01 2.23 0.28 0.00 0.70 0.00 0.00 55.95 59.18 1z83 s SER 87 Cb 0.02 -2.62 1.08 0.00 -1.71 0.00 0.00 66.02 62.79 1z83 s SER 87 CO 0.12 -0.22 1.84 0.29 1.20 0.00 0.00 173.24 176.46 1z83 n LYS 88 N 0.92 0.04 0.00 5.44 5.02 -1.26 -4.99 118.16 123.34 1z83 n LYS 88 Ca 0.00 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1z83 n LYS 88 Cb 0.46 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1z83 n LYS 88 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1z83 n GLY 89 N 1.47 3.72 3.34 0.72 0.00 -1.26 -4.65 105.19 108.52 1z83 n GLY 89 Ca 0.07 -1.11 -0.31 0.00 0.00 0.00 0.00 46.02 44.67 1z83 n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1z83 s PHE 90 N -2.00 2.39 -0.29 1.61 0.40 -0.26 -0.58 117.98 119.25 1z83 s PHE 90 Ca 0.00 -0.39 -0.07 0.00 -0.60 0.00 0.00 56.93 55.87 1z83 s PHE 90 Cb 0.00 -1.51 0.01 0.00 0.51 0.00 0.00 43.02 42.03 1z83 s PHE 90 CO 0.00 0.02 0.08 -0.51 0.70 0.00 0.00 175.22 175.50 1z83 s LEU 91 N -0.70 3.83 -0.40 -0.37 1.43 -0.10 -1.50 118.68 120.87 1z83 s LEU 91 Ca 0.10 -0.71 -0.13 0.00 -1.03 0.00 0.00 54.13 52.36 1z83 s LEU 91 Cb -0.10 -1.88 0.03 0.00 0.03 0.00 0.00 46.19 44.27 1z83 s LEU 91 CO -0.00 -0.19 0.27 -0.63 0.23 0.00 0.00 176.35 176.03 1z83 s ILE 92 N 1.50 4.97 -0.34 -0.59 -1.09 0.44 -1.29 121.20 124.79 1z83 s ILE 92 Ca 0.03 -0.78 -0.11 0.00 -2.23 0.00 0.00 60.65 57.56 1z83 s ILE 92 Cb -0.17 -3.79 0.01 0.00 -1.58 0.00 0.00 42.46 36.93 1z83 s ILE 92 CO 0.02 -0.30 0.19 -0.62 -1.23 0.00 0.00 174.94 173.00 1z83 s ASP 93 N 1.68 5.68 0.00 3.58 -1.08 -0.33 -0.09 116.67 126.12 1z83 s ASP 93 Ca 0.04 -0.74 0.00 0.00 -0.52 0.00 0.00 52.55 51.33 1z83 s ASP 93 Cb -0.19 -2.03 0.00 0.00 -1.46 0.00 0.00 42.92 39.24 1z83 s ASP 93 CO 0.08 -0.29 0.00 0.61 0.52 0.00 0.00 175.17 176.09 1z83 n GLY 94 N 5.00 0.57 2.82 2.66 0.00 -1.13 -2.68 105.19 112.43 1z83 n GLY 94 Ca -0.13 -0.36 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 1z83 n GLY 94 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1z83 s TYR 95 N -2.00 0.17 0.23 1.61 5.04 -1.26 -4.39 117.35 116.74 1z83 s TYR 95 Ca 0.00 0.04 -0.20 0.00 -2.44 0.00 0.00 57.07 54.47 1z83 s TYR 95 Cb 0.00 -0.28 -0.08 0.00 0.35 0.00 0.00 41.96 41.95 1z83 s TYR 95 CO 0.00 -0.09 0.73 -1.25 -1.34 0.00 0.00 175.55 173.61 1z83 s PRO 96 N 0.80 4.27 0.00 4.97 0.04 -1.26 -4.68 135.00 139.13 1z83 s PRO 96 Ca -0.07 0.89 0.24 0.00 0.04 0.00 0.00 61.00 62.09 1z83 s PRO 96 Cb -0.10 -2.88 0.19 0.00 0.04 0.00 0.00 34.50 31.75 1z83 s PRO 96 CO -0.02 0.39 1.24 0.54 0.04 0.00 0.00 177.00 179.20 1z83 n ARG 97 N 0.72 1.93 -3.60 4.56 5.12 -1.26 -4.94 116.66 119.19 1z83 n ARG 97 Ca -0.02 -1.57 -0.10 0.00 -1.93 0.00 0.00 57.85 54.22 1z83 n ARG 97 Cb 0.51 -1.47 -0.03 0.00 -1.16 0.00 0.00 32.46 30.31 1z83 n ARG 97 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 1z83 s GLU 98 N -2.15 1.34 0.17 5.56 -1.05 -1.26 -2.74 118.70 118.56 1z83 s GLU 98 Ca 0.26 -0.68 -0.15 0.00 -0.15 0.00 0.00 54.97 54.25 1z83 s GLU 98 Cb 0.19 0.55 0.07 0.00 -0.44 0.00 0.00 34.13 34.51 1z83 s GLU 98 CO 0.39 -0.58 1.80 0.28 0.95 0.00 0.00 175.26 178.10 1z83 h VAL 99 N 2.11 1.03 -0.26 1.83 2.07 -1.92 -2.52 116.25 118.58 1z83 h VAL 99 Ca -0.31 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.04 1z83 h VAL 99 Cb 1.28 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1z83 h VAL 99 CO 0.37 0.09 0.15 0.06 0.02 0.00 0.00 177.57 178.27 1z83 h GLN 100 N 0.51 0.35 -0.94 1.57 3.07 -1.97 -0.96 115.11 116.74 1z83 h GLN 100 Ca 0.18 -0.03 0.03 0.00 0.09 0.00 0.00 58.65 58.92 1z83 h GLN 100 Cb 0.04 -0.08 -0.05 0.00 0.08 0.00 0.00 27.48 27.47 1z83 h GLN 100 CO -0.10 0.25 0.62 1.96 0.09 0.00 0.00 178.83 181.65 1z83 h GLN 101 N 0.36 1.18 -0.20 0.06 4.20 -1.87 -2.11 115.11 116.73 1z83 h GLN 101 Ca 0.09 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1z83 h GLN 101 Cb -0.00 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.51 1z83 h GLN 101 CO -0.02 0.78 -0.01 0.78 -0.67 0.00 0.00 178.83 179.69 1z83 h GLY 102 N 1.21 0.39 0.79 3.46 0.00 -1.02 -2.22 103.07 105.68 1z83 h GLY 102 Ca 0.36 -0.29 0.02 0.00 0.00 0.00 0.00 47.33 47.42 1z83 h GLY 102 CO -0.10 0.27 0.02 0.83 0.00 0.00 0.00 176.54 177.56 1z83 h GLU 103 N 0.10 0.08 -0.21 4.80 5.08 -1.28 -1.76 114.58 121.39 1z83 h GLU 103 Ca 0.05 -0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 1z83 h GLU 103 Cb 0.42 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1z83 h GLU 103 CO 0.01 0.05 -0.39 1.49 -1.00 0.00 0.00 179.01 179.17 1z83 h GLU 104 N 0.08 0.48 -0.22 2.33 4.57 -1.41 -1.54 114.58 118.87 1z83 h GLU 104 Ca 0.07 -0.24 0.01 0.00 -1.18 0.00 0.00 59.36 58.03 1z83 h GLU 104 Cb 0.08 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 1z83 h GLU 104 CO -0.11 0.80 0.12 0.35 -1.18 0.00 0.00 179.01 178.99 1z83 h PHE 105 N 0.40 0.23 -0.62 0.92 3.57 -1.20 -1.92 116.94 118.32 1z83 h PHE 105 Ca 0.04 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 1z83 h PHE 105 Cb 0.86 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.50 1z83 h PHE 105 CO 0.03 0.14 0.18 0.93 -2.23 0.00 0.00 178.31 177.36 1z83 h GLU 106 N 0.26 0.95 -0.53 1.11 5.08 -1.02 0.35 114.58 120.78 1z83 h GLU 106 Ca 0.09 -0.19 -0.09 0.00 -1.00 0.00 0.00 59.36 58.16 1z83 h GLU 106 Cb -0.00 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1z83 h GLU 106 CO -0.04 0.83 -0.04 0.00 -1.00 0.00 0.00 179.01 178.76 1z83 h ARG 107 N 0.92 0.93 0.00 2.33 2.47 -1.18 -3.22 114.38 116.64 1z83 h ARG 107 Ca 0.20 -0.29 0.00 0.00 -1.26 0.00 0.00 59.98 58.63 1z83 h ARG 107 Cb 0.28 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.52 1z83 h ARG 107 CO -0.01 0.95 -1.05 0.54 0.56 0.00 0.00 179.97 180.96 1z83 n ARG 108 N -4.18 1.00 0.00 0.04 1.74 -0.73 -4.87 116.66 109.67 1z83 n ARG 108 Ca 0.02 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1z83 n ARG 108 Cb 0.35 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 1z83 n ARG 108 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1z83 n ILE 109 N -1.57 0.00 0.00 0.55 5.41 0.12 -5.06 119.36 118.80 1z83 n ILE 109 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1z83 n ILE 109 Cb 0.32 -0.42 0.00 0.00 -0.71 0.00 0.00 39.64 38.83 1z83 n ILE 109 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1z83 n GLY 110 N 2.87 0.27 3.83 7.39 0.00 -1.11 -4.23 105.19 114.22 1z83 n GLY 110 Ca 0.00 -0.92 -0.34 0.00 0.00 0.00 0.00 46.02 44.75 1z83 n GLY 110 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1z83 s GLN 111 N -2.00 4.11 0.49 1.61 -2.07 -1.26 -4.03 119.66 116.50 1z83 s GLN 111 Ca 0.00 0.73 -0.23 0.00 -1.82 0.00 0.00 55.36 54.04 1z83 s GLN 111 Cb 0.00 -2.69 -0.07 0.00 -1.09 0.00 0.00 33.01 29.16 1z83 s GLN 111 CO 0.00 0.30 1.25 -1.25 -1.32 0.00 0.00 175.29 174.28 1z83 s PRO 112 N -2.42 3.55 -0.00 9.60 0.04 -1.26 -4.72 135.00 139.79 1z83 s PRO 112 Ca 0.47 1.99 0.07 0.00 0.04 0.00 0.00 61.00 63.58 1z83 s PRO 112 Cb -0.14 -2.39 -0.24 0.00 0.04 0.00 0.00 34.50 31.77 1z83 s PRO 112 CO 0.19 -0.78 0.83 1.15 0.04 0.00 0.00 177.00 178.43 1z83 h THR 113 N 1.78 1.09 -3.01 1.26 2.02 -1.13 -3.49 112.91 111.45 1z83 h THR 113 Ca -0.50 -2.87 -0.12 0.00 0.77 0.00 0.00 66.41 63.69 1z83 h THR 113 Cb 1.27 2.59 -0.20 0.00 -1.74 0.00 0.00 68.15 70.06 1z83 h THR 113 CO 0.59 0.69 -0.27 -0.22 0.37 0.00 0.00 175.52 176.68 1z83 s LEU 114 N -6.46 0.83 -0.22 2.58 2.96 -1.17 -4.88 118.68 112.31 1z83 s LEU 114 Ca -0.05 0.14 0.02 0.00 -0.22 0.00 0.00 54.13 54.02 1z83 s LEU 114 Cb 0.08 1.27 0.05 0.00 0.50 0.00 0.00 46.19 48.09 1z83 s LEU 114 CO 0.82 -0.42 -0.12 -0.22 -1.32 0.00 0.00 176.35 175.09 1z83 s LEU 115 N -1.20 2.78 -0.35 -0.68 0.20 -0.11 -1.43 118.68 117.89 1z83 s LEU 115 Ca -0.12 -1.08 -0.20 0.00 0.69 0.00 0.00 54.13 53.41 1z83 s LEU 115 Cb -0.05 -1.42 0.00 0.00 -0.43 0.00 0.00 46.19 44.29 1z83 s LEU 115 CO 0.04 -0.14 0.62 -0.22 -0.29 0.00 0.00 176.35 176.36 1z83 s LEU 116 N 1.24 4.27 -0.43 -0.68 2.96 0.58 -0.34 118.68 126.28 1z83 s LEU 116 Ca -0.04 0.13 -0.13 0.00 -0.22 0.00 0.00 54.13 53.87 1z83 s LEU 116 Cb -0.17 -2.77 0.05 0.00 0.50 0.00 0.00 46.19 43.80 1z83 s LEU 116 CO -0.08 -0.58 0.31 -0.47 -1.32 0.00 0.00 176.35 174.21 1z83 s TYR 117 N 2.68 3.26 -0.68 5.38 5.04 -0.25 -0.87 117.35 131.90 1z83 s TYR 117 Ca 0.24 -0.97 -0.19 0.00 -2.44 0.00 0.00 57.07 53.71 1z83 s TYR 117 Cb -0.15 -2.84 0.11 0.00 0.35 0.00 0.00 41.96 39.43 1z83 s TYR 117 CO 0.15 -0.73 0.83 0.08 -1.34 0.00 0.00 175.55 174.54 1z83 s VAL 118 N 1.59 4.76 -0.49 3.14 1.01 0.22 -0.97 120.40 129.66 1z83 s VAL 118 Ca 0.04 -1.07 -0.16 0.00 0.00 0.00 0.00 61.98 60.79 1z83 s VAL 118 Cb -0.22 -4.58 0.09 0.00 0.00 0.00 0.00 36.38 31.67 1z83 s VAL 118 CO 0.07 -1.26 0.45 -0.62 0.00 0.00 0.00 175.10 173.74 1z83 s ASP 119 N 3.53 6.16 0.23 3.32 2.15 -0.39 -4.17 116.67 127.51 1z83 s ASP 119 Ca 0.18 -1.40 0.10 0.00 0.43 0.00 0.00 52.55 51.86 1z83 s ASP 119 Cb -0.18 -2.20 -0.04 0.00 -0.30 0.00 0.00 42.92 40.19 1z83 s ASP 119 CO 0.03 -0.73 -0.11 0.00 -0.17 0.00 0.00 175.17 174.20 1z83 s ALA 120 N 1.75 2.92 0.50 3.66 0.00 -1.26 -0.91 121.76 128.42 1z83 s ALA 120 Ca 0.05 -1.65 -0.10 0.00 0.00 0.00 0.00 51.96 50.26 1z83 s ALA 120 Cb -0.25 -0.59 -0.05 0.00 0.00 0.00 0.00 23.12 22.23 1z83 s ALA 120 CO 0.06 0.35 0.88 0.20 0.00 0.00 0.00 175.76 177.25 1z83 s GLY 121 N -3.25 1.79 0.29 0.00 0.00 -1.26 -4.91 107.32 99.98 1z83 s GLY 121 Ca 0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 44.72 44.80 1z83 s GLY 121 CO 0.16 0.04 1.91 -0.56 0.00 0.00 0.00 173.10 174.64 1z83 h PRO 122 N 0.56 0.95 -0.55 2.90 0.13 -1.99 -1.96 132.00 132.05 1z83 h PRO 122 Ca -0.46 -0.12 -0.09 0.00 -0.87 0.00 0.00 66.00 64.46 1z83 h PRO 122 Cb 1.19 -0.18 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1z83 h PRO 122 CO 0.62 0.72 -0.01 1.05 -0.23 0.00 0.00 178.00 180.16 1z83 h GLU 123 N 0.96 0.94 -0.38 0.86 9.09 -1.99 -0.53 114.58 123.52 1z83 h GLU 123 Ca 0.24 -0.28 -0.02 0.00 0.05 0.00 0.00 59.36 59.35 1z83 h GLU 123 Cb 0.07 -0.10 -0.02 0.00 -1.65 0.00 0.00 28.75 27.06 1z83 h GLU 123 CO -0.03 0.93 0.17 1.15 0.05 0.00 0.00 179.01 181.28 1z83 h THR 124 N 0.86 1.18 -0.11 -1.06 2.02 -1.89 -0.83 112.91 113.09 1z83 h THR 124 Ca 0.16 -0.53 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 1z83 h THR 124 Cb 0.52 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1z83 h THR 124 CO 0.03 0.19 0.03 0.24 0.37 0.00 0.00 175.52 176.38 1z83 h MET 125 N 0.47 0.17 -0.65 6.66 2.86 -1.15 -2.13 114.93 121.17 1z83 h MET 125 Ca 0.13 -0.04 0.09 0.00 -2.06 0.00 0.00 59.70 57.82 1z83 h MET 125 Cb 0.15 -0.02 -0.07 0.00 0.06 0.00 0.00 31.60 31.71 1z83 h MET 125 CO -0.01 0.32 0.29 1.15 1.06 0.00 0.00 176.91 179.72 1z83 h THR 126 N -0.01 0.81 -0.60 2.22 2.02 -1.00 -1.81 112.91 114.56 1z83 h THR 126 Ca 0.04 -0.17 -0.06 0.00 0.77 0.00 0.00 66.41 66.98 1z83 h THR 126 Cb 0.22 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 1z83 h THR 126 CO -0.00 0.09 0.14 1.56 0.37 0.00 0.00 175.52 177.68 1z83 h GLN 127 N 0.50 0.96 -0.63 6.66 7.50 -0.96 -1.61 115.11 127.53 1z83 h GLN 127 Ca 0.32 -0.23 -0.05 0.00 0.50 0.00 0.00 58.65 59.20 1z83 h GLN 127 Cb 0.37 -0.12 -0.03 0.00 0.05 0.00 0.00 27.48 27.74 1z83 h GLN 127 CO -0.28 0.88 0.21 0.00 -1.50 0.00 0.00 178.83 178.14 1z83 h ARG 128 N 0.87 0.97 -0.18 1.46 3.08 -1.09 -2.09 114.38 117.40 1z83 h ARG 128 Ca 0.19 -0.20 -0.16 0.00 0.07 0.00 0.00 59.98 59.87 1z83 h ARG 128 Cb 0.35 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1z83 h ARG 128 CO 0.00 0.85 -0.56 -0.07 -1.07 0.00 0.00 179.97 179.11 1z83 h LEU 129 N 0.90 0.64 -0.59 3.04 3.38 -1.21 -2.19 115.31 119.28 1z83 h LEU 129 Ca 0.21 -0.35 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 1z83 h LEU 129 Cb 0.27 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1z83 h LEU 129 CO -0.01 1.07 0.04 -0.07 0.09 0.00 0.00 178.44 179.55 1z83 h LEU 130 N 0.43 0.98 -0.07 1.67 3.38 -1.13 -0.37 115.31 120.21 1z83 h LEU 130 Ca 0.00 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.70 1z83 h LEU 130 Cb 1.12 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1z83 h LEU 130 CO 0.11 1.03 -0.04 0.50 0.09 0.00 0.00 178.44 180.12 1z83 h LYS 131 N 0.90 -0.04 -0.80 1.13 1.63 -1.30 -2.61 116.57 115.48 1z83 h LYS 131 Ca 0.17 0.00 0.01 0.00 -0.85 0.00 0.00 60.65 59.98 1z83 h LYS 131 Cb 0.50 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.10 1z83 h LYS 131 CO 0.02 -0.03 0.53 -0.09 -3.45 0.00 0.00 179.45 176.43 1z83 h ARG 132 N -0.05 1.05 -0.27 1.90 2.43 -1.20 -1.56 114.38 116.68 1z83 h ARG 132 Ca 0.04 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 1z83 h ARG 132 Cb 0.11 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 1z83 h ARG 132 CO -0.10 0.69 0.22 0.78 -1.51 0.00 0.00 179.97 180.05 1z83 h GLY 133 N 1.08 0.00 0.96 2.80 0.00 -0.68 -2.41 103.07 104.81 1z83 h GLY 133 Ca 0.30 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.51 1z83 h GLY 133 CO -0.07 0.00 -0.28 0.83 0.00 0.00 0.00 176.54 177.03 1z83 h GLU 134 N 0.00 0.68 -3.35 4.80 3.07 -1.11 -3.36 114.58 115.31 1z83 h GLU 134 Ca 0.13 -0.36 -0.71 0.00 -0.50 0.00 0.00 59.36 57.92 1z83 h GLU 134 Cb 0.56 0.01 -0.35 0.00 -0.84 0.00 0.00 28.75 28.13 1z83 h GLU 134 CO -0.00 0.97 -0.10 0.95 -1.40 0.00 0.00 179.01 179.43 1z83 s THR 135 N -4.35 4.36 0.23 1.13 -4.23 -0.91 -5.03 115.64 106.84 1z83 s THR 135 Ca -0.12 -3.77 -0.13 0.00 -1.18 0.00 0.00 61.69 56.49 1z83 s THR 135 Cb 0.08 -3.71 -0.00 0.00 1.34 0.00 0.00 72.50 70.21 1z83 s THR 135 CO 0.82 -1.07 0.46 -0.44 -0.54 0.00 0.00 174.62 173.86 1z83 s SER 136 N -0.01 -0.10 0.00 3.99 0.01 -1.24 -4.90 113.70 111.46 1z83 s SER 136 Ca 0.26 -0.88 0.00 0.00 1.31 0.00 0.00 55.95 56.65 1z83 s SER 136 Cb -0.08 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.72 1z83 s SER 136 CO -0.12 -1.11 0.00 0.61 0.41 0.00 0.00 173.24 173.04 1z83 n GLY 137 N -0.36 0.36 3.77 3.44 0.00 -1.26 -5.11 105.19 106.03 1z83 n GLY 137 Ca -0.03 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.00 1z83 n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1z83 s ARG 138 N 0.00 4.18 0.00 1.61 0.52 -1.26 -4.93 118.95 119.07 1z83 s ARG 138 Ca 0.00 1.89 0.29 0.00 -0.52 0.00 0.00 55.73 57.39 1z83 s ARG 138 Cb 0.00 -2.81 1.36 0.00 0.52 0.00 0.00 34.95 34.03 1z83 s ARG 138 CO 0.00 -0.22 1.93 1.55 0.02 0.00 0.00 175.30 178.57 1z83 n VAL 139 N 0.34 0.00 -0.03 3.52 3.14 -1.26 -3.93 118.33 120.11 1z83 n VAL 139 Ca 0.03 -0.12 0.05 0.00 -2.96 0.00 0.00 64.34 61.34 1z83 n VAL 139 Cb 0.46 0.02 0.11 0.00 -1.06 0.00 0.00 33.84 33.36 1z83 n VAL 139 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 1z83 n ASP 140 N -0.52 2.55 -1.39 6.55 5.75 -1.26 -4.69 116.55 123.53 1z83 n ASP 140 Ca 0.19 -1.86 0.05 0.00 -0.01 0.00 0.00 54.79 53.16 1z83 n ASP 140 Cb 0.26 -0.15 0.26 0.00 -1.03 0.00 0.00 41.12 40.46 1z83 n ASP 140 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1z83 n ASP 141 N 0.38 4.05 -4.89 -1.12 10.43 -1.25 -4.09 116.55 120.06 1z83 n ASP 141 Ca 0.09 -2.59 -0.29 0.00 2.57 0.00 0.00 54.79 54.57 1z83 n ASP 141 Cb 0.36 -0.61 -0.01 0.00 1.84 0.00 0.00 41.12 42.70 1z83 n ASP 141 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1z83 s ASN 142 N -0.52 6.31 0.19 -2.24 4.22 -1.26 -4.56 114.94 117.09 1z83 s ASN 142 Ca 0.35 1.07 -0.23 0.00 -2.14 0.00 0.00 52.86 51.91 1z83 s ASN 142 Cb 0.27 -2.31 0.09 0.00 1.28 0.00 0.00 41.25 40.58 1z83 s ASN 142 CO 0.11 -0.60 1.56 -0.33 -2.04 0.00 0.00 177.10 175.80 1z83 h GLU 143 N 0.34 -0.13 -0.36 3.55 3.07 -1.98 0.29 114.58 119.35 1z83 h GLU 143 Ca -0.46 0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 58.32 1z83 h GLU 143 Cb 1.20 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.12 1z83 h GLU 143 CO 0.62 -0.09 -0.13 0.93 -1.40 0.00 0.00 179.01 178.94 1z83 h GLU 144 N -0.14 0.64 0.05 2.33 3.07 -1.96 -2.51 114.58 116.05 1z83 h GLU 144 Ca 0.23 -0.20 -0.24 0.00 -0.50 0.00 0.00 59.36 58.65 1z83 h GLU 144 Cb 0.56 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.39 1z83 h GLU 144 CO -0.78 0.74 -1.11 1.15 -1.40 0.00 0.00 179.01 177.62 1z83 h THR 145 N 0.58 1.62 -0.82 1.13 2.02 -1.54 -2.81 112.91 113.10 1z83 h THR 145 Ca 0.10 -3.28 0.05 0.00 0.77 0.00 0.00 66.41 64.05 1z83 h THR 145 Cb 0.56 2.88 -0.05 0.00 -1.74 0.00 0.00 68.15 69.79 1z83 h THR 145 CO 0.03 0.94 0.51 0.40 0.37 0.00 0.00 175.52 177.77 1z83 h ILE 146 N 0.03 1.07 -0.45 3.11 2.04 -0.83 0.13 117.51 122.61 1z83 h ILE 146 Ca -0.06 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1z83 h ILE 146 Cb 1.85 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 1z83 h ILE 146 CO 0.16 0.17 0.24 0.11 0.00 0.00 0.00 178.15 178.83 1z83 h LYS 147 N 0.96 0.63 -0.32 2.37 1.57 -1.36 -1.43 116.57 118.98 1z83 h LYS 147 Ca 0.34 -0.08 -0.11 0.00 -1.87 0.00 0.00 60.65 58.94 1z83 h LYS 147 Cb 0.10 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1z83 h LYS 147 CO -0.15 0.51 -0.24 0.87 -0.57 0.00 0.00 179.45 179.87 1z83 h LYS 148 N 0.59 0.62 -0.66 3.15 1.57 -1.22 -1.98 116.57 118.64 1z83 h LYS 148 Ca 0.16 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.64 1z83 h LYS 148 Cb 0.07 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 1z83 h LYS 148 CO -0.02 0.81 0.19 0.00 -0.57 0.00 0.00 179.45 179.86 1z83 h ARG 149 N 0.55 1.02 -0.37 3.15 3.08 -0.75 -1.95 114.38 119.10 1z83 h ARG 149 Ca 0.08 -0.21 -0.08 0.00 0.07 0.00 0.00 59.98 59.83 1z83 h ARG 149 Cb 0.70 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1z83 h ARG 149 CO 0.05 0.88 -0.09 -0.07 -1.07 0.00 0.00 179.97 179.67 1z83 h LEU 150 N 0.98 0.73 -0.45 3.04 3.38 -0.97 -1.82 115.31 120.19 1z83 h LEU 150 Ca 0.21 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1z83 h LEU 150 Cb 0.30 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1z83 h LEU 150 CO -0.01 0.92 0.28 -0.33 0.09 0.00 0.00 178.44 179.40 1z83 h GLU 151 N 0.52 0.61 -0.91 1.13 5.08 -1.16 -1.24 114.58 118.61 1z83 h GLU 151 Ca 0.09 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1z83 h GLU 151 Cb 0.61 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.67 1z83 h GLU 151 CO 0.04 0.43 0.59 1.15 -1.00 0.00 0.00 179.01 180.22 1z83 h THR 152 N 0.61 1.18 0.28 1.13 2.02 -1.35 -1.30 112.91 115.47 1z83 h THR 152 Ca 0.16 -0.40 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 1z83 h THR 152 Cb -0.03 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.28 1z83 h THR 152 CO -0.03 0.21 -0.13 0.22 0.37 0.00 0.00 175.52 176.16 1z83 h TYR 153 N 1.17 -0.35 -0.14 3.16 3.20 -0.70 -1.54 116.97 121.78 1z83 h TYR 153 Ca 0.35 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.14 1z83 h TYR 153 Cb -0.04 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 1z83 h TYR 153 CO -0.01 -0.11 -0.23 1.88 -1.64 0.00 0.00 178.16 178.04 1z83 h TYR 154 N -0.53 0.26 0.07 -3.82 -1.99 -1.12 -1.00 116.97 108.84 1z83 h TYR 154 Ca -0.04 -0.04 -0.11 0.00 2.00 0.00 0.00 58.73 60.54 1z83 h TYR 154 Cb 0.39 -0.07 0.01 0.00 2.00 0.00 0.00 36.73 39.07 1z83 h TYR 154 CO -0.02 0.47 -0.46 -0.22 -0.00 0.00 0.00 178.16 177.93 1z83 h LYS 155 N 0.22 0.18 0.03 4.88 3.64 -1.21 -3.37 116.57 120.95 1z83 h LYS 155 Ca 0.04 -0.30 -0.38 0.00 -1.27 0.00 0.00 60.65 58.74 1z83 h LYS 155 Cb 0.54 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.41 1z83 h LYS 155 CO 0.04 1.12 -2.34 0.00 -2.27 0.00 0.00 179.45 176.00 1z83 n ALA 156 N -2.63 1.27 -0.02 5.00 0.00 -0.58 -4.71 120.51 118.84 1z83 n ALA 156 Ca -0.12 -0.96 -0.21 0.00 0.00 0.00 0.00 53.44 52.15 1z83 n ALA 156 Cb 0.67 -0.25 -0.14 0.00 0.00 0.00 0.00 19.45 19.73 1z83 n ALA 156 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1z83 n THR 157 N -3.38 1.74 -0.36 0.00 -1.04 -0.47 -4.23 114.28 106.54 1z83 n THR 157 Ca -0.42 -0.64 0.07 0.00 -2.04 0.00 0.00 64.05 61.01 1z83 n THR 157 Cb 1.00 -1.68 0.23 0.00 -1.82 0.00 0.00 70.33 68.06 1z83 n THR 157 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1z83 h GLU 158 N 0.06 0.95 -0.12 -2.82 4.81 -1.48 0.96 114.58 116.94 1z83 h GLU 158 Ca -0.45 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 58.76 1z83 h GLU 158 Cb 2.01 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 31.17 1z83 h GLU 158 CO 0.06 0.63 0.38 -1.35 -0.73 0.00 0.00 179.01 178.00 1z83 h PRO 159 N 0.98 0.00 -0.22 0.92 0.11 -1.83 -0.76 132.00 131.21 1z83 h PRO 159 Ca 0.49 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.53 1z83 h PRO 159 Cb 0.48 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1z83 h PRO 159 CO -0.26 0.00 -0.16 0.28 -0.21 0.00 0.00 178.00 177.64 1z83 h VAL 160 N 0.00 1.22 0.16 3.15 2.07 -1.00 -2.42 116.25 119.43 1z83 h VAL 160 Ca 0.06 -1.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 1z83 h VAL 160 Cb 0.82 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1z83 h VAL 160 CO -0.00 0.32 -0.08 0.40 0.02 0.00 0.00 177.57 178.23 1z83 h ILE 161 N 0.35 0.89 -0.80 4.57 1.08 -1.23 -2.23 117.51 120.13 1z83 h ILE 161 Ca 0.06 -0.18 0.01 0.00 -0.39 0.00 0.00 64.86 64.36 1z83 h ILE 161 Cb 0.49 1.00 -0.04 0.00 -3.07 0.00 0.00 36.82 35.21 1z83 h ILE 161 CO 0.03 0.04 0.53 0.00 -0.69 0.00 0.00 178.15 178.06 1z83 h ALA 162 N 0.53 1.42 -0.82 1.87 0.00 -1.63 -0.09 119.26 120.54 1z83 h ALA 162 Ca -0.02 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1z83 h ALA 162 Cb 0.23 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 1z83 h ALA 162 CO 0.04 0.53 0.53 0.35 0.00 0.00 0.00 179.25 180.70 1z83 h PHE 163 N 1.09 1.00 0.00 0.00 3.57 -1.19 -3.18 116.94 118.22 1z83 h PHE 163 Ca 0.29 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.82 1z83 h PHE 163 Cb -0.12 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.29 1z83 h PHE 163 CO 0.00 0.59 -1.27 0.66 -2.23 0.00 0.00 178.31 176.06 1z83 n TYR 164 N -4.56 0.46 -0.25 0.41 4.02 -0.86 -4.17 117.16 112.21 1z83 n TYR 164 Ca 0.10 0.13 -0.03 0.00 -0.01 0.00 0.00 57.90 58.09 1z83 n TYR 164 Cb 0.07 -0.65 0.09 0.00 -0.02 0.00 0.00 39.34 38.83 1z83 n TYR 164 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1z83 h GLU 165 N 0.00 0.81 -0.97 -0.72 5.08 -1.01 -1.70 114.58 116.07 1z83 h GLU 165 Ca 0.00 -0.05 0.32 0.00 -1.00 0.00 0.00 59.36 58.63 1z83 h GLU 165 Cb 0.90 -0.18 -0.18 0.00 0.50 0.00 0.00 28.75 29.79 1z83 h GLU 165 CO 0.00 0.54 0.22 1.63 -1.00 0.00 0.00 179.01 180.40 1z83 n LYS 166 N -4.68 -0.07 0.00 2.33 5.02 -1.24 -1.21 118.16 118.31 1z83 n LYS 166 Ca 0.08 1.41 0.15 0.00 -2.02 0.00 0.00 58.31 57.93 1z83 n LYS 166 Cb 0.11 -2.35 0.78 0.00 -0.02 0.00 0.00 35.03 33.55 1z83 n LYS 166 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1z83 n ARG 167 N -5.35 1.26 -0.79 1.97 1.74 -0.64 -4.92 116.66 109.93 1z83 n ARG 167 Ca 0.28 -0.38 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 1z83 n ARG 167 Cb 0.95 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.89 1z83 n ARG 167 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1z83 n GLY 168 N 1.07 0.75 0.62 -0.13 0.00 -0.35 -4.94 105.19 102.20 1z83 n GLY 168 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1z83 n GLY 168 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1z83 n ILE 169 N -2.41 0.00 -2.71 -0.61 -5.35 -1.25 -4.93 119.36 102.10 1z83 n ILE 169 Ca 0.00 -0.32 -0.41 0.00 -0.27 0.00 0.00 62.75 61.74 1z83 n ILE 169 Cb 0.00 1.11 -0.04 0.00 -1.74 0.00 0.00 39.64 38.97 1z83 n ILE 169 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1z83 s VAL 170 N -2.26 4.62 -0.11 7.28 1.01 -1.26 -0.93 120.40 128.75 1z83 s VAL 170 Ca 0.25 2.04 0.01 0.00 0.00 0.00 0.00 61.98 64.28 1z83 s VAL 170 Cb 0.19 -4.30 0.02 0.00 0.00 0.00 0.00 36.38 32.29 1z83 s VAL 170 CO 0.44 0.25 -0.13 -0.13 0.00 0.00 0.00 175.10 175.53 1z83 s ARG 171 N 0.41 1.98 -0.08 2.72 1.81 0.53 -4.94 118.95 121.38 1z83 s ARG 171 Ca 0.49 -0.47 -0.02 0.00 -1.72 0.00 0.00 55.73 54.02 1z83 s ARG 171 Cb -0.23 -1.76 -0.03 0.00 -0.45 0.00 0.00 34.95 32.48 1z83 s ARG 171 CO 0.29 -0.12 -0.01 0.21 -0.68 0.00 0.00 175.30 175.00 1z83 s LYS 172 N 1.16 2.97 -0.05 3.54 2.20 -1.26 -1.09 119.74 127.20 1z83 s LYS 172 Ca -0.04 -0.42 0.03 0.00 -0.36 0.00 0.00 55.97 55.18 1z83 s LYS 172 Cb -0.14 -2.77 0.00 0.00 -1.51 0.00 0.00 37.83 33.41 1z83 s LYS 172 CO -0.03 0.69 -0.14 0.14 -0.36 0.00 0.00 175.35 175.65 1z83 s VAL 173 N -0.86 1.25 -0.31 4.02 -7.23 -0.15 -4.95 120.40 112.17 1z83 s VAL 173 Ca 0.13 -0.59 -0.29 0.00 -1.81 0.00 0.00 61.98 59.43 1z83 s VAL 173 Cb -0.11 -1.10 -0.02 0.00 0.56 0.00 0.00 36.38 35.71 1z83 s VAL 173 CO 0.02 0.37 1.76 0.21 -0.31 0.00 0.00 175.10 177.15 1z83 s ASN 174 N 0.29 6.00 0.00 4.85 3.84 -1.26 -1.26 114.94 127.38 1z83 s ASN 174 Ca -0.08 1.37 0.15 0.00 0.21 0.00 0.00 52.86 54.51 1z83 s ASN 174 Cb -0.13 -2.53 0.44 0.00 -0.55 0.00 0.00 41.25 38.49 1z83 s ASN 174 CO 0.03 -1.61 1.36 0.00 -2.79 0.00 0.00 177.10 174.08 1z83 n ALA 175 N 9.88 2.44 -2.07 1.71 0.00 -0.08 -4.73 120.51 127.66 1z83 n ALA 175 Ca 0.22 -0.74 -0.35 0.00 0.00 0.00 0.00 53.44 52.57 1z83 n ALA 175 Cb 0.46 -0.98 -0.06 0.00 0.00 0.00 0.00 19.45 18.87 1z83 n ALA 175 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1z83 s GLU 176 N -1.48 4.20 0.00 0.00 0.41 -1.26 -4.82 118.70 115.75 1z83 s GLU 176 Ca 0.30 0.86 0.00 0.00 -0.41 0.00 0.00 54.97 55.72 1z83 s GLU 176 Cb 0.16 -2.69 0.00 0.00 -1.78 0.00 0.00 34.13 29.82 1z83 s GLU 176 CO 0.21 0.28 0.00 0.41 -0.49 0.00 0.00 175.26 175.68 1z83 n GLY 177 N 0.28 -1.31 3.80 -1.39 0.00 -1.26 -4.77 105.19 100.54 1z83 n GLY 177 Ca 0.00 -2.14 -0.31 0.00 0.00 0.00 0.00 46.02 43.57 1z83 n GLY 177 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1z83 s SER 178 N -3.50 5.12 0.24 1.61 1.04 -1.26 -4.85 113.70 112.10 1z83 s SER 178 Ca 0.00 1.74 -0.04 0.00 0.48 0.00 0.00 55.95 58.13 1z83 s SER 178 Cb 0.00 -2.51 0.42 0.00 0.10 0.00 0.00 66.02 64.02 1z83 s SER 178 CO 0.00 -1.62 1.77 0.58 0.98 0.00 0.00 173.24 174.95 1z83 h VAL 179 N -0.64 0.80 0.00 5.02 2.07 -1.96 -1.12 116.25 120.42 1z83 h VAL 179 Ca -0.44 -0.21 -0.17 0.00 0.82 0.00 0.00 66.70 66.70 1z83 h VAL 179 Cb 1.22 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1z83 h VAL 179 CO 0.55 0.11 -0.79 0.44 0.02 0.00 0.00 177.57 177.90 1z83 h ASP 180 N 0.63 0.00 -0.50 0.57 5.19 -1.98 -0.60 116.42 119.72 1z83 h ASP 180 Ca 0.40 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.71 1z83 h ASP 180 Cb 0.48 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.97 1z83 h ASP 180 CO -0.31 0.79 -0.06 0.77 -3.12 0.00 0.00 179.24 177.31 1z83 h SER 181 N 0.00 0.93 -0.22 6.45 4.64 -1.76 -0.67 113.55 122.92 1z83 h SER 181 Ca -0.01 -0.34 -0.03 0.00 -0.47 0.00 0.00 61.79 60.94 1z83 h SER 181 Cb 1.50 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 1z83 h SER 181 CO 0.10 1.05 0.00 0.58 -0.87 0.00 0.00 176.83 177.69 1z83 h VAL 182 N 0.79 1.25 -0.43 0.95 2.07 -1.12 -3.16 116.25 116.61 1z83 h VAL 182 Ca 0.13 -0.87 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 1z83 h VAL 182 Cb 0.61 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 1z83 h VAL 182 CO 0.04 0.27 0.12 0.15 0.02 0.00 0.00 177.57 178.17 1z83 h PHE 183 N 0.16 0.64 -0.66 1.57 3.57 -1.02 -2.09 116.94 119.11 1z83 h PHE 183 Ca 0.06 -0.04 0.14 0.00 3.53 0.00 0.00 57.97 61.66 1z83 h PHE 183 Cb 0.39 -0.20 -0.11 0.00 2.79 0.00 0.00 35.95 38.83 1z83 h PHE 183 CO 0.03 0.54 0.07 1.03 -2.23 0.00 0.00 178.31 177.76 1z83 h SER 184 N 0.63 -0.15 -0.30 0.41 0.87 -1.08 0.67 113.55 114.59 1z83 h SER 184 Ca 0.15 0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.80 1z83 h SER 184 Cb 0.21 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 1z83 h SER 184 CO -0.01 -0.08 -0.03 1.56 -0.53 0.00 0.00 176.83 177.75 1z83 h GLN 185 N 0.18 0.55 -0.81 2.24 4.20 -1.41 -2.70 115.11 117.36 1z83 h GLN 185 Ca 0.36 -0.19 0.11 0.00 0.06 0.00 0.00 58.65 58.99 1z83 h GLN 185 Cb 0.59 -0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.24 1z83 h GLN 185 CO -0.51 0.71 0.44 0.28 -0.67 0.00 0.00 178.83 179.08 1z83 h VAL 186 N 0.34 0.83 -0.66 -0.54 2.07 -1.01 -2.58 116.25 114.71 1z83 h VAL 186 Ca 0.08 -0.24 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 1z83 h VAL 186 Cb 0.48 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1z83 h VAL 186 CO 0.02 0.13 0.14 0.00 0.02 0.00 0.00 177.57 177.88 1z83 h THR 188 N 1.00 0.80 -0.27 0.00 2.02 -1.15 0.44 112.91 115.74 1z83 h THR 188 Ca 0.21 -0.11 -0.07 0.00 0.77 0.00 0.00 66.41 67.21 1z83 h THR 188 Cb 0.38 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1z83 h THR 188 CO 0.00 0.06 -0.08 0.45 0.37 0.00 0.00 175.52 176.32 1z83 h HIS 189 N 0.31 0.61 -0.28 3.16 3.86 -1.33 -2.90 115.15 118.58 1z83 h HIS 189 Ca 0.24 -0.14 -0.12 0.00 -1.16 0.00 0.00 60.37 59.19 1z83 h HIS 189 Cb 0.27 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 1z83 h HIS 189 CO -0.18 0.76 -0.34 -0.07 0.86 0.00 0.00 177.93 178.96 1z83 h LEU 190 N 0.29 0.64 -1.03 2.43 3.38 -1.02 -2.60 115.31 117.41 1z83 h LEU 190 Ca 0.07 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1z83 h LEU 190 Cb 0.57 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1z83 h LEU 190 CO 0.03 0.93 0.19 0.44 0.09 0.00 0.00 178.44 180.12 1z83 h ASP 191 N 0.52 0.82 -0.37 -0.43 3.32 -0.94 -2.46 116.42 116.89 1z83 h ASP 191 Ca 0.06 -0.13 -0.10 0.00 0.02 0.00 0.00 57.03 56.88 1z83 h ASP 191 Cb 0.83 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 1z83 h ASP 191 CO 0.07 0.77 -0.11 0.00 -1.72 0.00 0.00 179.24 178.25 1z83 h ALA 192 N 1.34 0.97 -0.18 3.45 0.00 -1.30 -3.02 119.26 120.52 1z83 h ALA 192 Ca 0.20 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 1z83 h ALA 192 Cb 0.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1z83 h ALA 192 CO -0.01 0.61 -0.48 1.37 0.00 0.00 0.00 179.25 180.75 1z83 h LEU 193 N 0.73 0.51 -1.78 0.00 -0.00 -1.24 -3.52 115.31 110.01 1z83 h LEU 193 Ca 0.12 -0.25 0.00 0.00 -0.00 0.00 0.00 57.88 57.75 1z83 h LEU 193 Cb 0.60 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 41.11 1z83 h LEU 193 CO 0.04 0.91 0.00 0.18 -0.00 0.00 0.00 178.44 179.57