#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zr4 s ALA 2 N 0.00 2.87 0.32 3.04 0.00 -1.26 -4.87 121.76 121.86 1zr4 s ALA 2 Ca 0.00 -2.03 -0.26 0.00 0.00 0.00 0.00 51.96 49.66 1zr4 s ALA 2 Cb 0.00 -4.30 -0.10 0.00 0.00 0.00 0.00 23.12 18.72 1zr4 s ALA 2 CO 0.00 -3.33 0.96 -0.51 0.00 0.00 0.00 175.76 172.89 1zr4 s LEU 3 N 4.74 4.35 0.06 0.00 1.02 -1.26 -1.96 118.68 125.62 1zr4 s LEU 3 Ca 0.38 1.89 0.01 0.00 0.02 0.00 0.00 54.13 56.43 1zr4 s LEU 3 Cb -0.05 -3.99 -0.03 0.00 0.02 0.00 0.00 46.19 42.14 1zr4 s LEU 3 CO -0.00 -0.11 -0.05 -0.36 0.02 0.00 0.00 176.35 175.85 1zr4 s PHE 4 N -1.57 0.63 0.28 0.29 0.40 0.28 -4.83 117.98 113.47 1zr4 s PHE 4 Ca 0.50 -0.82 0.08 0.00 -0.60 0.00 0.00 56.93 56.10 1zr4 s PHE 4 Cb -0.20 -0.40 -0.06 0.00 0.51 0.00 0.00 43.02 42.87 1zr4 s PHE 4 CO 0.26 -0.21 -0.10 0.20 0.70 0.00 0.00 175.22 176.06 1zr4 s GLY 5 N -2.45 1.86 -0.25 4.36 0.00 -1.03 0.26 107.32 110.07 1zr4 s GLY 5 Ca 0.01 -1.91 -0.14 0.00 0.00 0.00 0.00 44.72 42.69 1zr4 s GLY 5 CO -0.05 -1.89 0.61 -0.47 0.00 0.00 0.00 173.10 171.30 1zr4 s TYR 6 N -2.85 -0.95 0.04 1.90 5.04 -0.59 -2.35 117.35 117.59 1zr4 s TYR 6 Ca 0.29 1.91 0.01 0.00 -2.44 0.00 0.00 57.07 56.84 1zr4 s TYR 6 Cb 0.02 0.54 -0.03 0.00 0.35 0.00 0.00 41.96 42.84 1zr4 s TYR 6 CO 0.13 -0.49 -0.06 0.00 -1.34 0.00 0.00 175.55 173.79 1zr4 s ALA 7 N 1.66 0.48 -0.00 3.97 0.00 -1.03 -4.41 121.76 122.43 1zr4 s ALA 7 Ca -0.10 -0.85 -0.21 0.00 0.00 0.00 0.00 51.96 50.81 1zr4 s ALA 7 Cb -0.06 0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.22 1zr4 s ALA 7 CO -0.18 -0.14 0.46 0.50 0.00 0.00 0.00 175.76 176.41 1zr4 s ARG 8 N -2.14 0.88 -0.04 0.00 3.52 -1.26 -2.63 118.95 117.28 1zr4 s ARG 8 Ca -0.07 -0.11 -0.08 0.00 -0.13 0.00 0.00 55.73 55.35 1zr4 s ARG 8 Cb -0.06 0.40 0.01 0.00 -1.56 0.00 0.00 34.95 33.75 1zr4 s ARG 8 CO -0.02 -0.28 0.18 0.54 -0.81 0.00 0.00 175.30 174.92 1zr4 s VAL 9 N -1.67 0.03 0.00 7.11 0.11 -0.98 -4.95 120.40 120.05 1zr4 s VAL 9 Ca -0.10 -0.29 0.00 0.00 -2.93 0.00 0.00 61.98 58.66 1zr4 s VAL 9 Cb -0.02 -0.36 0.00 0.00 -1.53 0.00 0.00 36.38 34.47 1zr4 s VAL 9 CO 0.04 -0.16 0.00 -1.54 -3.33 0.00 0.00 175.10 170.11 1zr4 n SER 10 N 2.29 0.00 -3.82 3.54 3.41 -1.26 -2.68 113.62 115.10 1zr4 n SER 10 Ca -0.17 -0.27 -0.19 0.00 -0.26 0.00 0.00 58.87 57.98 1zr4 n SER 10 Cb 0.57 0.52 -0.09 0.00 -0.26 0.00 0.00 64.21 64.96 1zr4 n SER 10 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1zr4 s THR 11 N -0.52 0.21 0.47 6.66 2.01 -1.26 -5.00 115.64 118.20 1zr4 s THR 11 Ca 0.00 -2.00 0.35 0.00 0.31 0.00 0.00 61.69 60.35 1zr4 s THR 11 Cb 0.00 -2.49 0.55 0.00 0.01 0.00 0.00 72.50 70.57 1zr4 s THR 11 CO 0.00 0.00 1.62 0.28 -0.69 0.00 0.00 174.62 175.83 1zr4 h SER 12 N 2.20 0.17 0.00 3.53 0.02 -2.04 -3.09 113.55 114.33 1zr4 h SER 12 Ca -0.31 0.10 -0.46 0.00 -0.84 0.00 0.00 61.79 60.27 1zr4 h SER 12 Cb 1.25 0.09 0.03 0.00 0.14 0.00 0.00 62.40 63.90 1zr4 h SER 12 CO 0.47 -0.13 2.40 1.67 -1.14 0.00 0.00 176.83 180.10 1zr4 n GLN 13 N -4.48 1.73 -0.78 3.45 7.27 -1.26 -4.75 117.38 118.56 1zr4 n GLN 13 Ca 0.38 -1.54 -0.08 0.00 0.07 0.00 0.00 57.00 55.83 1zr4 n GLN 13 Cb 1.56 -2.60 -0.12 0.00 2.41 0.00 0.00 30.24 31.50 1zr4 n GLN 13 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 1zr4 n GLN 14 N 5.32 1.57 -0.34 3.69 6.02 -1.17 -4.58 117.38 127.89 1zr4 n GLN 14 Ca 0.44 -0.68 0.00 0.00 -0.01 0.00 0.00 57.00 56.75 1zr4 n GLN 14 Cb 0.23 -1.74 0.00 0.00 1.02 0.00 0.00 30.24 29.75 1zr4 n GLN 14 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1zr4 n SER 15 N 2.33 3.75 -0.29 1.08 3.41 -1.26 -4.21 113.62 118.43 1zr4 n SER 15 Ca 0.29 -1.98 0.28 0.00 -0.26 0.00 0.00 58.87 57.20 1zr4 n SER 15 Cb 0.73 -0.79 0.63 0.00 -0.26 0.00 0.00 64.21 64.52 1zr4 n SER 15 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1zr4 h LEU 16 N 3.15 0.22 -0.18 1.04 5.85 -1.93 0.34 115.31 123.81 1zr4 h LEU 16 Ca 0.00 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1zr4 h LEU 16 Cb 0.72 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1zr4 h LEU 16 CO 0.00 0.05 0.04 0.44 -0.34 0.00 0.00 178.44 178.62 1zr4 h ASP 17 N 0.20 0.02 -0.54 1.25 3.32 -1.99 -0.11 116.42 118.56 1zr4 h ASP 17 Ca 0.55 0.03 0.04 0.00 0.02 0.00 0.00 57.03 57.66 1zr4 h ASP 17 Cb 1.78 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 41.33 1zr4 h ASP 17 CO -0.15 0.04 0.36 0.40 -1.72 0.00 0.00 179.24 178.17 1zr4 h ILE 18 N 0.11 1.05 0.04 0.35 2.04 -0.68 0.88 117.51 121.30 1zr4 h ILE 18 Ca 0.08 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1zr4 h ILE 18 Cb 0.07 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1zr4 h ILE 18 CO -0.10 0.11 -0.02 1.56 0.00 0.00 0.00 178.15 179.70 1zr4 h GLN 19 N 0.60 -0.05 -0.25 2.37 4.20 -1.13 -2.81 115.11 118.03 1zr4 h GLN 19 Ca 0.22 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.87 1zr4 h GLN 19 Cb 0.14 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1zr4 h GLN 19 CO -0.06 0.35 -0.15 0.28 -0.67 0.00 0.00 178.83 178.58 1zr4 h VAL 20 N -0.47 1.22 -0.30 -0.54 2.07 -0.12 -0.91 116.25 117.22 1zr4 h VAL 20 Ca -0.01 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 1zr4 h VAL 20 Cb 0.43 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1zr4 h VAL 20 CO 0.01 0.32 0.09 0.03 0.02 0.00 0.00 177.57 178.04 1zr4 h ARG 21 N 0.38 0.46 -0.84 1.57 3.08 -0.94 0.15 114.38 118.25 1zr4 h ARG 21 Ca 0.07 -0.10 0.16 0.00 0.07 0.00 0.00 59.98 60.18 1zr4 h ARG 21 Cb 0.49 -0.07 -0.10 0.00 0.08 0.00 0.00 29.97 30.37 1zr4 h ARG 21 CO 0.03 0.51 0.41 0.00 -1.07 0.00 0.00 179.97 179.85 1zr4 h ALA 22 N 0.93 1.26 -0.49 0.04 0.00 -1.12 0.21 119.26 120.09 1zr4 h ALA 22 Ca 0.10 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1zr4 h ALA 22 Cb 0.24 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1zr4 h ALA 22 CO -0.00 -0.14 0.16 -0.07 0.00 0.00 0.00 179.25 179.19 1zr4 h LEU 23 N 0.57 0.71 -0.40 0.00 3.38 -0.74 -2.98 115.31 115.84 1zr4 h LEU 23 Ca 0.47 -0.20 -0.18 0.00 0.09 0.00 0.00 57.88 58.05 1zr4 h LEU 23 Cb 0.70 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1zr4 h LEU 23 CO -0.39 0.72 -0.77 0.11 0.09 0.00 0.00 178.44 178.20 1zr4 h LYS 24 N 0.66 0.26 0.00 1.13 1.57 0.13 -2.32 116.57 117.99 1zr4 h LYS 24 Ca 0.16 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1zr4 h LYS 24 Cb 0.26 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1zr4 h LYS 24 CO -0.01 0.91 -0.00 -0.44 -0.57 0.00 0.00 179.45 179.34 1zr4 h ASP 25 N 0.17 0.00 -0.51 0.86 3.45 -0.61 -1.00 116.42 118.78 1zr4 h ASP 25 Ca -0.03 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.43 1zr4 h ASP 25 Cb 1.36 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.13 1zr4 h ASP 25 CO 0.12 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 177.80 1zr4 n ALA 26 N -2.21 2.42 -0.37 3.45 0.00 -0.89 -4.95 120.51 117.96 1zr4 n ALA 26 Ca -0.03 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.42 1zr4 n ALA 26 Cb 0.08 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1zr4 n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zr4 n GLY 27 N 1.45 0.76 3.75 0.00 0.00 -0.38 -5.06 105.19 105.70 1zr4 n GLY 27 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1zr4 n GLY 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zr4 s VAL 28 N -2.32 4.62 0.18 1.61 1.01 -1.08 -5.00 120.40 119.42 1zr4 s VAL 28 Ca 0.00 1.73 0.03 0.00 0.00 0.00 0.00 61.98 63.75 1zr4 s VAL 28 Cb 0.00 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 1zr4 s VAL 28 CO 0.00 0.38 0.31 -0.54 0.00 0.00 0.00 175.10 175.25 1zr4 s LYS 29 N -0.21 3.43 0.35 2.72 1.02 -1.26 -4.17 119.74 121.62 1zr4 s LYS 29 Ca 0.40 -0.65 0.04 0.00 0.02 0.00 0.00 55.97 55.77 1zr4 s LYS 29 Cb -0.21 -2.94 0.68 0.00 -0.52 0.00 0.00 37.83 34.83 1zr4 s LYS 29 CO 0.25 0.49 1.96 0.00 -0.92 0.00 0.00 175.35 177.13 1zr4 h ALA 30 N 1.82 1.63 -0.41 5.17 0.00 -1.97 -0.94 119.26 124.57 1zr4 h ALA 30 Ca -0.50 -0.03 0.16 0.00 0.00 0.00 0.00 54.91 54.55 1zr4 h ALA 30 Cb 1.21 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.71 1zr4 h ALA 30 CO 0.66 0.26 0.23 -1.71 0.00 0.00 0.00 179.25 178.69 1zr4 n ASN 31 N -4.47 0.12 -1.28 0.00 5.15 -1.26 -2.67 115.26 110.86 1zr4 n ASN 31 Ca 0.10 0.61 0.04 0.00 -0.60 0.00 0.00 54.58 54.74 1zr4 n ASN 31 Cb 0.19 -0.30 0.04 0.00 -0.53 0.00 0.00 39.78 39.17 1zr4 n ASN 31 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1zr4 n ARG 32 N -3.79 0.15 -3.47 1.20 1.74 -0.36 -5.06 116.66 107.08 1zr4 n ARG 32 Ca 0.15 -1.99 -0.38 0.00 -0.77 0.00 0.00 57.85 54.86 1zr4 n ARG 32 Cb 0.51 -0.22 -0.06 0.00 -1.02 0.00 0.00 32.46 31.66 1zr4 n ARG 32 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1zr4 s ILE 33 N -0.32 5.14 -0.11 0.55 1.01 -1.09 -2.47 121.20 123.91 1zr4 s ILE 33 Ca 0.30 0.80 0.03 0.00 0.00 0.00 0.00 60.65 61.78 1zr4 s ILE 33 Cb 0.34 -3.72 0.01 0.00 0.01 0.00 0.00 42.46 39.10 1zr4 s ILE 33 CO -0.14 0.48 -0.20 -0.36 0.00 0.00 0.00 174.94 174.72 1zr4 s PHE 34 N -0.32 2.28 0.15 3.97 0.40 -0.99 -4.95 117.98 118.52 1zr4 s PHE 34 Ca 0.23 -1.02 0.07 0.00 -0.60 0.00 0.00 56.93 55.61 1zr4 s PHE 34 Cb -0.15 -1.57 -0.04 0.00 0.51 0.00 0.00 43.02 41.76 1zr4 s PHE 34 CO 0.10 -0.47 -0.05 0.99 0.70 0.00 0.00 175.22 176.50 1zr4 s THR 35 N 0.68 3.53 -0.20 0.64 2.01 -1.26 -2.47 115.64 118.57 1zr4 s THR 35 Ca -0.12 -1.39 -0.05 0.00 0.31 0.00 0.00 61.69 60.43 1zr4 s THR 35 Cb -0.16 -2.73 0.10 0.00 0.01 0.00 0.00 72.50 69.72 1zr4 s THR 35 CO 0.03 -0.03 0.38 -1.81 -0.69 0.00 0.00 174.62 172.50 1zr4 s ASP 36 N -2.65 0.01 -0.76 3.53 1.01 -1.08 -3.85 116.67 112.88 1zr4 s ASP 36 Ca 0.25 0.70 -0.13 0.00 0.71 0.00 0.00 52.55 54.08 1zr4 s ASP 36 Cb -0.10 1.16 0.20 0.00 1.01 0.00 0.00 42.92 45.19 1zr4 s ASP 36 CO 0.16 -0.25 0.69 -0.54 0.21 0.00 0.00 175.17 175.44 1zr4 s LYS 37 N 2.56 3.40 -0.80 8.23 1.02 -1.26 -2.33 119.74 130.55 1zr4 s LYS 37 Ca 0.03 -2.33 -0.26 0.00 0.02 0.00 0.00 55.97 53.43 1zr4 s LYS 37 Cb -0.13 -4.34 -0.14 0.00 -0.52 0.00 0.00 37.83 32.69 1zr4 s LYS 37 CO -0.13 -1.29 2.40 0.00 -0.92 0.00 0.00 175.35 175.42 1zr4 s ALA 38 N 0.42 0.67 -1.57 5.17 0.00 -1.09 -4.76 121.76 120.59 1zr4 s ALA 38 Ca 0.15 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.28 1zr4 s ALA 38 Cb -0.15 -4.58 0.00 0.00 0.00 0.00 0.00 23.12 18.39 1zr4 s ALA 38 CO -0.06 -5.98 0.04 0.45 0.00 0.00 0.00 175.76 170.21 1zr4 n SER 39 N 18.78 0.02 0.00 0.00 2.88 -1.26 -4.64 113.62 129.40 1zr4 n SER 39 Ca 0.47 -0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.90 1zr4 n SER 39 Cb 0.43 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 1zr4 n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1zr4 n GLY 40 N -0.05 0.49 3.87 0.46 0.00 -1.26 -5.04 105.19 103.67 1zr4 n GLY 40 Ca 0.00 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 1zr4 n GLY 40 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zr4 s SER 41 N -2.27 6.63 0.01 1.61 0.01 -1.26 -4.98 113.70 113.44 1zr4 s SER 41 Ca 0.00 0.86 -0.02 0.00 1.31 0.00 0.00 55.95 58.11 1zr4 s SER 41 Cb 0.00 -2.20 -0.00 0.00 0.21 0.00 0.00 66.02 64.02 1zr4 s SER 41 CO 0.00 0.01 0.11 -1.20 0.41 0.00 0.00 173.24 172.57 1zr4 n SER 42 N 0.19 -0.06 -2.73 2.44 7.64 -1.26 -3.52 113.62 116.31 1zr4 n SER 42 Ca -0.02 0.12 -0.06 0.00 1.01 0.00 0.00 58.87 59.92 1zr4 n SER 42 Cb 0.52 -0.02 0.04 0.00 -1.01 0.00 0.00 64.21 63.74 1zr4 n SER 42 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1zr4 n SER 43 N -3.60 -2.61 -4.01 6.43 3.41 -1.26 -5.06 113.62 106.92 1zr4 n SER 43 Ca 0.00 -2.70 -0.43 0.00 -0.26 0.00 0.00 58.87 55.48 1zr4 n SER 43 Cb 0.01 1.51 0.01 0.00 -0.26 0.00 0.00 64.21 65.48 1zr4 n SER 43 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1zr4 n ASP 44 N 2.04 6.43 -4.28 4.04 9.92 -1.23 -4.93 116.55 128.53 1zr4 n ASP 44 Ca 0.10 -3.41 -0.44 0.00 -0.53 0.00 0.00 54.79 50.51 1zr4 n ASP 44 Cb 0.63 -1.27 -0.03 0.00 -0.64 0.00 0.00 41.12 39.81 1zr4 n ASP 44 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1zr4 s ARG 45 N -2.78 3.57 -0.07 -1.24 1.70 -1.26 -4.76 118.95 114.11 1zr4 s ARG 45 Ca 0.31 -2.73 -0.25 0.00 -0.47 0.00 0.00 55.73 52.59 1zr4 s ARG 45 Cb 0.05 -4.32 -0.24 0.00 -0.57 0.00 0.00 34.95 29.87 1zr4 s ARG 45 CO 0.11 -1.26 0.99 0.87 -1.08 0.00 0.00 175.30 174.93 1zr4 h LYS 46 N 7.24 0.13 -0.22 3.89 1.79 -1.91 -3.03 116.57 124.45 1zr4 h LYS 46 Ca 0.11 -0.14 0.03 0.00 -2.18 0.00 0.00 60.65 58.47 1zr4 h LYS 46 Cb 0.97 0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 31.61 1zr4 h LYS 46 CO 0.82 0.91 -0.32 0.78 -1.08 0.00 0.00 179.45 180.56 1zr4 h GLY 47 N -0.59 -1.41 0.33 3.86 0.00 -1.91 -1.63 103.07 101.71 1zr4 h GLY 47 Ca -0.03 0.77 0.07 0.00 0.00 0.00 0.00 47.33 48.14 1zr4 h GLY 47 CO 0.04 -0.39 -0.03 -2.00 0.00 0.00 0.00 176.54 174.16 1zr4 h LEU 48 N -0.23 -0.22 -2.00 3.11 5.85 -1.82 -0.84 115.31 119.15 1zr4 h LEU 48 Ca 0.04 0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.94 1zr4 h LEU 48 Cb 0.34 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1zr4 h LEU 48 CO -0.33 -0.07 0.39 0.44 -0.34 0.00 0.00 178.44 178.53 1zr4 h ASP 49 N 0.07 0.00 0.56 1.25 5.19 -1.26 0.60 116.42 122.84 1zr4 h ASP 49 Ca 0.19 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 1zr4 h ASP 49 Cb 0.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.79 1zr4 h ASP 49 CO -0.34 0.00 -1.36 -0.11 -3.12 0.00 0.00 179.24 174.30 1zr4 n LEU 50 N -3.47 0.52 -0.03 1.55 7.94 -0.40 -4.20 117.00 118.90 1zr4 n LEU 50 Ca 0.04 0.16 -0.17 0.00 -1.11 0.00 0.00 56.01 54.94 1zr4 n LEU 50 Cb 0.53 -0.04 -0.08 0.00 0.53 0.00 0.00 43.42 44.35 1zr4 n LEU 50 CO 0.23 -0.09 0.33 0.25 -1.11 0.00 0.00 177.39 177.00 1zr4 h LEU 51 N 0.00 0.73 0.00 -1.96 5.85 0.10 -3.13 115.31 116.91 1zr4 h LEU 51 Ca 0.00 -0.64 0.00 0.00 0.84 0.00 0.00 57.88 58.08 1zr4 h LEU 51 Cb 0.96 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1zr4 h LEU 51 CO 0.00 1.25 0.00 -2.11 -0.34 0.00 0.00 178.44 177.24 1zr4 n ARG 52 N -4.13 0.59 0.07 1.25 1.85 -0.95 -2.33 116.66 113.00 1zr4 n ARG 52 Ca -0.08 0.02 0.09 0.00 -1.00 0.00 0.00 57.85 56.88 1zr4 n ARG 52 Cb 0.65 -1.50 -0.04 0.00 -1.05 0.00 0.00 32.46 30.52 1zr4 n ARG 52 CO 0.00 0.00 0.00 -1.33 -0.01 0.00 0.00 177.63 176.29 1zr4 n MET 53 N -1.07 0.62 -0.01 2.89 2.81 -1.18 -4.42 117.12 116.75 1zr4 n MET 53 Ca 0.15 0.09 0.06 0.00 -1.81 0.00 0.00 57.70 56.20 1zr4 n MET 53 Cb 0.10 -1.77 -0.11 0.00 -0.71 0.00 0.00 33.22 30.73 1zr4 n MET 53 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1zr4 n LYS 54 N -2.66 0.50 -2.64 0.03 4.81 -0.99 -4.98 118.16 112.23 1zr4 n LYS 54 Ca -0.03 -0.12 -0.40 0.00 -0.87 0.00 0.00 58.31 56.89 1zr4 n LYS 54 Cb 0.62 -1.33 -0.05 0.00 0.02 0.00 0.00 35.03 34.29 1zr4 n LYS 54 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 1zr4 s VAL 55 N -2.92 3.91 0.08 3.15 -7.23 -1.15 -5.05 120.40 111.19 1zr4 s VAL 55 Ca -0.05 1.86 0.01 0.00 -1.81 0.00 0.00 61.98 62.00 1zr4 s VAL 55 Cb 0.09 -4.19 -0.04 0.00 0.56 0.00 0.00 36.38 32.80 1zr4 s VAL 55 CO 0.57 0.42 -0.06 -1.59 -0.31 0.00 0.00 175.10 174.13 1zr4 s LYS 56 N -1.08 0.74 -0.18 4.82 -2.85 -1.26 -5.00 119.74 114.94 1zr4 s LYS 56 Ca 0.43 -1.20 -0.28 0.00 -1.00 0.00 0.00 55.97 53.92 1zr4 s LYS 56 Cb -0.28 -0.15 -0.13 0.00 -2.06 0.00 0.00 37.83 35.21 1zr4 s LYS 56 CO 0.35 -0.02 0.88 -1.91 0.10 0.00 0.00 175.35 174.75 1zr4 n GLU 57 N 0.28 0.00 0.00 1.78 2.13 -1.18 -1.90 120.64 121.75 1zr4 n GLU 57 Ca -0.15 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.67 1zr4 n GLU 57 Cb 0.60 -0.98 0.00 0.00 0.27 0.00 0.00 31.44 31.33 1zr4 n GLU 57 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1zr4 n GLY 58 N 1.85 3.26 3.54 8.31 0.00 -1.09 -5.02 105.19 116.04 1zr4 n GLY 58 Ca 0.17 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 1zr4 n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1zr4 n ASP 59 N 0.14 -0.90 -3.66 1.61 8.00 -0.80 -0.72 116.55 120.22 1zr4 n ASP 59 Ca 0.00 0.14 -0.20 0.00 0.71 0.00 0.00 54.79 55.44 1zr4 n ASP 59 Cb 0.00 -1.33 -0.18 0.00 -0.02 0.00 0.00 41.12 39.59 1zr4 n ASP 59 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1zr4 s VAL 60 N -2.50 -0.13 0.14 2.53 1.01 -0.83 -3.76 120.40 116.87 1zr4 s VAL 60 Ca 0.66 0.34 -0.16 0.00 0.00 0.00 0.00 61.98 62.81 1zr4 s VAL 60 Cb -0.23 -0.23 -0.07 0.00 0.00 0.00 0.00 36.38 35.85 1zr4 s VAL 60 CO 0.62 0.11 0.58 -0.63 0.00 0.00 0.00 175.10 175.79 1zr4 s ILE 61 N 2.18 4.79 -0.03 2.22 1.01 -0.97 -0.55 121.20 129.85 1zr4 s ILE 61 Ca 0.04 0.99 0.07 0.00 0.00 0.00 0.00 60.65 61.76 1zr4 s ILE 61 Cb -0.13 -3.79 -0.02 0.00 0.01 0.00 0.00 42.46 38.54 1zr4 s ILE 61 CO -0.04 0.31 -0.25 -0.76 0.00 0.00 0.00 174.94 174.19 1zr4 s LEU 62 N -1.77 2.08 0.05 2.97 1.02 0.14 -1.68 118.68 121.51 1zr4 s LEU 62 Ca 0.37 -0.47 0.01 0.00 0.02 0.00 0.00 54.13 54.06 1zr4 s LEU 62 Cb -0.16 -1.36 -0.03 0.00 0.02 0.00 0.00 46.19 44.66 1zr4 s LEU 62 CO 0.19 0.31 -0.05 0.68 0.02 0.00 0.00 176.35 177.50 1zr4 s VAL 63 N -0.52 0.41 -0.09 -1.59 -7.23 -0.92 -1.54 120.40 108.92 1zr4 s VAL 63 Ca 0.07 -1.42 -0.24 0.00 -1.81 0.00 0.00 61.98 58.58 1zr4 s VAL 63 Cb -0.11 -1.00 -0.20 0.00 0.56 0.00 0.00 36.38 35.63 1zr4 s VAL 63 CO 0.00 -0.67 0.86 0.50 -0.31 0.00 0.00 175.10 175.48 1zr4 h LYS 64 N 3.84 -0.05 -5.42 4.82 3.64 -1.88 0.14 116.57 121.66 1zr4 h LYS 64 Ca -0.34 0.00 -0.50 0.00 -1.27 0.00 0.00 60.65 58.54 1zr4 h LYS 64 Cb 1.18 0.01 -0.14 0.00 -0.41 0.00 0.00 32.23 32.88 1zr4 h LYS 64 CO 0.52 0.60 -0.64 0.15 -2.27 0.00 0.00 179.45 177.81 1zr4 s LYS 65 N -2.98 1.65 0.06 1.90 1.02 -1.26 -1.13 119.74 119.01 1zr4 s LYS 65 Ca -0.15 -1.88 -0.25 0.00 0.02 0.00 0.00 55.97 53.70 1zr4 s LYS 65 Cb -0.01 -1.11 -0.16 0.00 -0.52 0.00 0.00 37.83 36.03 1zr4 s LYS 65 CO 0.58 -0.06 1.62 -0.07 -0.92 0.00 0.00 175.35 176.49 1zr4 h LEU 66 N 2.14 -0.14 -1.09 3.17 3.38 -1.98 -3.21 115.31 117.58 1zr4 h LEU 66 Ca -0.41 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1zr4 h LEU 66 Cb 1.24 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1zr4 h LEU 66 CO 0.70 -0.01 0.00 -0.90 0.09 0.00 0.00 178.44 178.32 1zr4 n ASP 67 N -5.12 0.38 -0.06 -0.43 5.75 -1.26 -2.72 116.55 113.09 1zr4 n ASP 67 Ca -0.08 -0.64 -0.07 0.00 -0.01 0.00 0.00 54.79 53.99 1zr4 n ASP 67 Cb 0.13 -0.16 -0.02 0.00 -1.03 0.00 0.00 41.12 40.04 1zr4 n ASP 67 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1zr4 n ARG 68 N 0.39 0.41 -0.27 0.11 5.12 -1.21 -4.64 116.66 116.56 1zr4 n ARG 68 Ca 0.00 0.16 0.07 0.00 -1.93 0.00 0.00 57.85 56.16 1zr4 n ARG 68 Cb 0.09 -1.21 0.20 0.00 -1.16 0.00 0.00 32.46 30.37 1zr4 n ARG 68 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1zr4 h LEU 69 N -0.77 -0.21 -8.03 0.55 5.85 -1.71 -3.41 115.31 107.57 1zr4 h LEU 69 Ca 0.00 0.19 -0.39 0.00 0.84 0.00 0.00 57.88 58.52 1zr4 h LEU 69 Cb 0.77 0.31 -0.29 0.00 0.37 0.00 0.00 40.66 41.82 1zr4 h LEU 69 CO 0.00 -0.16 -0.78 -0.83 -0.34 0.00 0.00 178.44 176.33 1zr4 s GLY 70 N -3.76 0.44 0.08 3.75 0.00 -1.25 -4.97 107.32 101.61 1zr4 s GLY 70 Ca -0.13 -0.38 -0.21 0.00 0.00 0.00 0.00 44.72 44.00 1zr4 s GLY 70 CO 0.76 -0.31 1.61 3.21 0.00 0.00 0.00 173.10 178.37 1zr4 h ARG 71 N 5.95 0.24 -4.57 2.90 3.08 -1.87 -3.43 114.38 116.68 1zr4 h ARG 71 Ca -0.31 -0.05 -0.31 0.00 0.07 0.00 0.00 59.98 59.38 1zr4 h ARG 71 Cb 1.18 -0.04 -0.24 0.00 0.08 0.00 0.00 29.97 30.95 1zr4 h ARG 71 CO 0.50 0.34 -0.75 0.16 -1.07 0.00 0.00 179.97 179.14 1zr4 s ASP 72 N -5.57 0.87 0.31 7.04 3.84 -1.26 -5.03 116.67 116.86 1zr4 s ASP 72 Ca -0.14 -0.37 0.06 0.00 -0.00 0.00 0.00 52.55 52.10 1zr4 s ASP 72 Cb 0.07 -0.02 0.75 0.00 -1.38 0.00 0.00 42.92 42.33 1zr4 s ASP 72 CO 0.70 -0.08 1.78 0.74 -0.00 0.00 0.00 175.17 178.32 1zr4 h THR 73 N 4.69 0.72 0.16 2.11 2.02 -1.90 -0.97 112.91 119.75 1zr4 h THR 73 Ca -0.33 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 1zr4 h THR 73 Cb 1.20 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1zr4 h THR 73 CO 0.45 0.14 -0.08 0.00 0.37 0.00 0.00 175.52 176.40 1zr4 h ALA 74 N 1.64 -0.22 0.11 6.16 0.00 -1.99 -2.10 119.26 122.86 1zr4 h ALA 74 Ca 0.57 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.39 1zr4 h ALA 74 Cb 0.89 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 1zr4 h ALA 74 CO -0.36 -0.55 -0.32 0.22 0.00 0.00 0.00 179.25 178.24 1zr4 h ASP 75 N -0.36 -0.91 -0.02 0.00 1.82 -1.79 -3.15 116.42 112.00 1zr4 h ASP 75 Ca -0.02 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.73 1zr4 h ASP 75 Cb 0.29 0.35 -0.00 0.00 0.68 0.00 0.00 39.33 40.64 1zr4 h ASP 75 CO 0.04 -0.40 0.01 -0.03 -1.61 0.00 0.00 179.24 177.25 1zr4 h MET 76 N -0.53 0.00 -0.03 0.28 4.05 -1.11 -1.26 114.93 116.32 1zr4 h MET 76 Ca 0.03 0.00 -0.19 0.00 -0.28 0.00 0.00 59.70 59.26 1zr4 h MET 76 Cb 0.57 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.36 1zr4 h MET 76 CO -0.19 0.00 -0.81 0.82 0.23 0.00 0.00 176.91 176.96 1zr4 h ILE 77 N 0.00 1.42 -0.10 1.77 2.04 -1.35 -2.68 117.51 118.62 1zr4 h ILE 77 Ca 0.01 -2.34 -0.01 0.00 1.00 0.00 0.00 64.86 63.52 1zr4 h ILE 77 Cb 0.03 2.28 -0.00 0.00 -0.74 0.00 0.00 36.82 38.39 1zr4 h ILE 77 CO -0.00 0.69 0.03 -0.61 0.00 0.00 0.00 178.15 178.26 1zr4 h GLN 78 N 0.20 0.15 -0.45 2.37 5.75 -1.21 -1.33 115.11 120.59 1zr4 h GLN 78 Ca -0.04 -0.03 0.09 0.00 -0.15 0.00 0.00 58.65 58.51 1zr4 h GLN 78 Cb 1.41 -0.02 -0.10 0.00 1.07 0.00 0.00 27.48 29.84 1zr4 h GLN 78 CO 0.13 0.30 -0.28 -0.07 -2.65 0.00 0.00 178.83 176.27 1zr4 h LEU 79 N -0.03 -0.93 -0.60 -2.39 3.38 -1.43 0.06 115.31 113.37 1zr4 h LEU 79 Ca 0.03 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1zr4 h LEU 79 Cb 0.22 0.47 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 1zr4 h LEU 79 CO -0.00 -0.28 0.39 0.40 0.09 0.00 0.00 178.44 179.04 1zr4 h ILE 80 N -0.18 1.16 -0.65 1.22 2.04 -1.37 -2.00 117.51 117.73 1zr4 h ILE 80 Ca 0.20 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.79 1zr4 h ILE 80 Cb 0.51 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 1zr4 h ILE 80 CO -0.56 0.15 0.42 0.50 0.00 0.00 0.00 178.15 178.66 1zr4 h LYS 81 N 0.81 0.82 0.27 2.37 3.64 -0.47 0.89 116.57 124.89 1zr4 h LYS 81 Ca 0.22 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1zr4 h LYS 81 Cb -0.09 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.54 1zr4 h LYS 81 CO -0.05 0.54 -0.22 0.93 -2.27 0.00 0.00 179.45 178.39 1zr4 h GLU 82 N 0.84 -0.45 -0.84 1.90 4.39 -0.67 -2.59 114.58 117.15 1zr4 h GLU 82 Ca 0.25 0.03 0.14 0.00 0.34 0.00 0.00 59.36 60.11 1zr4 h GLU 82 Cb -0.05 0.10 -0.14 0.00 -0.10 0.00 0.00 28.75 28.56 1zr4 h GLU 82 CO -0.07 -0.30 -0.37 0.74 -1.16 0.00 0.00 179.01 177.85 1zr4 h PHE 83 N -0.47 -1.03 -0.33 4.33 0.05 -1.29 -0.80 116.94 117.40 1zr4 h PHE 83 Ca -0.04 0.09 0.07 0.00 3.82 0.00 0.00 57.97 61.92 1zr4 h PHE 83 Cb 0.39 0.57 -0.08 0.00 2.00 0.00 0.00 35.95 38.84 1zr4 h PHE 83 CO -0.08 -0.40 -0.28 0.22 -0.18 0.00 0.00 178.31 177.59 1zr4 h ASP 84 N -0.06 -0.93 -0.57 2.17 3.58 -0.70 0.29 116.42 120.20 1zr4 h ASP 84 Ca 0.30 0.17 0.07 0.00 0.42 0.00 0.00 57.03 57.99 1zr4 h ASP 84 Cb 0.58 0.44 -0.06 0.00 1.72 0.00 0.00 39.33 42.01 1zr4 h ASP 84 CO -0.87 -0.30 0.24 0.00 -2.88 0.00 0.00 179.24 175.43 1zr4 h ALA 85 N 0.80 0.73 -0.02 -0.78 0.00 -0.91 0.11 119.26 119.19 1zr4 h ALA 85 Ca 0.16 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1zr4 h ALA 85 Cb 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1zr4 h ALA 85 CO -0.47 -0.14 0.05 0.37 0.00 0.00 0.00 179.25 179.06 1zr4 h GLN 86 N 0.45 0.00 0.00 0.00 4.15 0.61 -3.46 115.11 116.86 1zr4 h GLN 86 Ca 0.27 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.69 1zr4 h GLN 86 Cb 0.28 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.97 1zr4 h GLN 86 CO -0.24 0.00 0.00 0.41 -1.93 0.00 0.00 178.83 177.07 1zr4 n GLY 87 N -1.18 1.07 3.38 2.39 0.00 0.75 -3.11 105.19 108.49 1zr4 n GLY 87 Ca -0.02 -0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 1zr4 n GLY 87 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1zr4 s VAL 88 N -2.00 2.26 0.33 1.61 -7.23 -0.80 -2.67 120.40 111.90 1zr4 s VAL 88 Ca 0.00 -1.63 0.09 0.00 -1.81 0.00 0.00 61.98 58.64 1zr4 s VAL 88 Cb 0.00 -1.96 -0.06 0.00 0.56 0.00 0.00 36.38 34.92 1zr4 s VAL 88 CO 0.00 0.18 -0.05 -0.94 -0.31 0.00 0.00 175.10 173.98 1zr4 s SER 89 N -1.80 3.98 -0.06 4.85 1.04 -1.25 -3.45 113.70 117.01 1zr4 s SER 89 Ca 0.13 -1.05 0.06 0.00 0.48 0.00 0.00 55.95 55.57 1zr4 s SER 89 Cb -0.10 -0.46 -0.01 0.00 0.10 0.00 0.00 66.02 65.55 1zr4 s SER 89 CO 0.05 -0.19 -0.24 -0.63 0.98 0.00 0.00 173.24 173.21 1zr4 s ILE 90 N -2.54 2.15 -0.15 -1.02 1.01 -1.26 -2.29 121.20 117.10 1zr4 s ILE 90 Ca 0.33 -1.03 -0.02 0.00 0.00 0.00 0.00 60.65 59.94 1zr4 s ILE 90 Cb -0.00 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.66 1zr4 s ILE 90 CO 0.18 0.57 -0.09 -0.60 0.00 0.00 0.00 174.94 175.00 1zr4 s ARG 91 N -0.12 3.48 -0.25 2.79 3.52 -0.67 -1.63 118.95 126.07 1zr4 s ARG 91 Ca -0.05 -0.62 -0.08 0.00 -0.13 0.00 0.00 55.73 54.85 1zr4 s ARG 91 Cb -0.14 -2.78 -0.04 0.00 -1.56 0.00 0.00 34.95 30.43 1zr4 s ARG 91 CO 0.04 0.17 0.11 -0.06 -0.81 0.00 0.00 175.30 174.75 1zr4 s PHE 92 N 0.50 3.14 -0.01 5.12 0.40 -0.10 -2.17 117.98 124.86 1zr4 s PHE 92 Ca -0.06 -0.22 -0.23 0.00 -0.60 0.00 0.00 56.93 55.81 1zr4 s PHE 92 Cb -0.15 -2.27 -0.14 0.00 0.51 0.00 0.00 43.02 40.97 1zr4 s PHE 92 CO 0.04 -0.27 1.01 0.82 0.70 0.00 0.00 175.22 177.52 1zr4 h ILE 93 N 5.45 0.27 -0.41 0.64 2.04 -0.73 0.11 117.51 124.88 1zr4 h ILE 93 Ca -0.37 -0.52 -0.11 0.00 1.00 0.00 0.00 64.86 64.86 1zr4 h ILE 93 Cb 1.18 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1zr4 h ILE 93 CO 0.58 0.05 -0.17 0.44 0.00 0.00 0.00 178.15 179.04 1zr4 h ASP 94 N -1.06 0.87 1.19 1.72 5.19 -1.37 -2.90 116.42 120.06 1zr4 h ASP 94 Ca -0.07 -0.39 -0.01 0.00 -0.62 0.00 0.00 57.03 55.94 1zr4 h ASP 94 Cb 0.58 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 39.85 1zr4 h ASP 94 CO 0.11 1.07 -0.04 0.44 -3.12 0.00 0.00 179.24 177.69 1zr4 h ASP 95 N 0.66 0.00 -6.16 6.45 3.32 -1.75 -3.47 116.42 115.48 1zr4 h ASP 95 Ca 0.09 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.71 1zr4 h ASP 95 Cb 0.73 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.32 1zr4 h ASP 95 CO 0.06 0.04 -0.85 0.61 -1.72 0.00 0.00 179.24 177.38 1zr4 n GLY 96 N 0.27 -0.31 3.17 2.75 0.00 0.02 -5.01 105.19 106.07 1zr4 n GLY 96 Ca 0.01 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 1zr4 n GLY 96 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1zr4 s ILE 97 N -3.71 0.15 -0.27 -0.61 -4.36 -1.18 -5.00 121.20 106.21 1zr4 s ILE 97 Ca 0.02 -1.66 -0.25 0.00 -0.26 0.00 0.00 60.65 58.50 1zr4 s ILE 97 Cb -0.01 -1.69 0.09 0.00 1.25 0.00 0.00 42.46 42.10 1zr4 s ILE 97 CO 0.83 -0.67 0.85 -0.94 0.24 0.00 0.00 174.94 175.25 1zr4 s SER 98 N -2.95 -0.62 0.00 4.36 1.04 -1.26 -0.92 113.70 113.34 1zr4 s SER 98 Ca 0.13 1.17 0.00 0.00 0.48 0.00 0.00 55.95 57.73 1zr4 s SER 98 Cb 0.07 1.18 0.00 0.00 0.10 0.00 0.00 66.02 67.36 1zr4 s SER 98 CO -0.05 -0.22 0.64 0.41 0.98 0.00 0.00 173.24 174.99 1zr4 n THR 99 N 2.40 0.56 0.05 2.02 -1.04 -0.65 -3.79 114.28 113.82 1zr4 n THR 99 Ca -0.13 0.50 -0.01 0.00 -2.04 0.00 0.00 64.05 62.37 1zr4 n THR 99 Cb 0.55 -1.50 0.29 0.00 -1.82 0.00 0.00 70.33 67.85 1zr4 n THR 99 CO 0.00 0.00 0.00 -2.24 -0.64 0.00 0.00 175.07 172.19 1zr4 h ASP 100 N 0.00 0.39 -4.48 8.00 3.04 -1.95 -3.43 116.42 118.00 1zr4 h ASP 100 Ca 0.00 -0.10 -0.11 0.00 -3.24 0.00 0.00 57.03 53.57 1zr4 h ASP 100 Cb 0.71 -0.10 0.00 0.00 -1.04 0.00 0.00 39.33 38.90 1zr4 h ASP 100 CO 0.00 0.57 -0.03 -1.54 -2.04 0.00 0.00 179.24 176.21 1zr4 n SER 101 N -4.21 0.67 -0.09 4.15 3.41 -1.25 -5.06 113.62 111.25 1zr4 n SER 101 Ca 0.00 -1.37 -0.23 0.00 -0.26 0.00 0.00 58.87 57.01 1zr4 n SER 101 Cb 0.32 -0.08 -0.12 0.00 -0.26 0.00 0.00 64.21 64.08 1zr4 n SER 101 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1zr4 n TYR 102 N -1.19 0.84 0.28 7.33 0.53 -1.26 -3.45 117.16 120.23 1zr4 n TYR 102 Ca 0.03 0.31 0.12 0.00 -1.02 0.00 0.00 57.90 57.33 1zr4 n TYR 102 Cb 0.14 -1.09 0.54 0.00 -1.03 0.00 0.00 39.34 37.90 1zr4 n TYR 102 CO 0.00 0.00 0.00 -0.89 -1.02 0.00 0.00 176.86 174.95 1zr4 n ILE 103 N -4.15 0.93 0.26 -0.72 -0.00 -1.26 -2.00 119.36 112.41 1zr4 n ILE 103 Ca -0.37 0.48 -0.12 0.00 -0.00 0.00 0.00 62.75 62.74 1zr4 n ILE 103 Cb 0.81 -1.45 -0.06 0.00 -0.00 0.00 0.00 39.64 38.93 1zr4 n ILE 103 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 1zr4 h GLY 104 N 1.13 -0.73 0.76 7.39 0.00 -1.80 -1.85 103.07 107.97 1zr4 h GLY 104 Ca 0.00 0.27 0.06 0.00 0.00 0.00 0.00 47.33 47.66 1zr4 h GLY 104 CO 0.00 -0.27 0.56 0.50 0.00 0.00 0.00 176.54 177.34 1zr4 h LYS 105 N -1.11 1.01 0.15 4.80 1.57 -1.51 -0.85 116.57 120.63 1zr4 h LYS 105 Ca -0.07 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1zr4 h LYS 105 Cb 0.59 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 1zr4 h LYS 105 CO 0.12 0.67 -0.36 1.98 -0.57 0.00 0.00 179.45 181.28 1zr4 h MET 106 N 1.04 -0.59 -0.40 3.15 4.05 -1.45 -0.72 114.93 120.01 1zr4 h MET 106 Ca 0.38 0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.90 1zr4 h MET 106 Cb 0.13 0.13 -0.05 0.00 -0.80 0.00 0.00 31.60 31.02 1zr4 h MET 106 CO -0.16 -0.39 0.10 0.28 0.23 0.00 0.00 176.91 176.97 1zr4 h VAL 107 N -0.61 0.82 -0.09 -5.77 2.07 -0.76 0.02 116.25 111.93 1zr4 h VAL 107 Ca 0.02 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.49 1zr4 h VAL 107 Cb 0.63 0.56 -0.06 0.00 -1.52 0.00 0.00 31.29 30.89 1zr4 h VAL 107 CO -0.19 0.04 -0.54 0.58 0.02 0.00 0.00 177.57 177.48 1zr4 h VAL 108 N 0.24 0.00 -0.34 2.57 2.07 -0.80 0.23 116.25 120.22 1zr4 h VAL 108 Ca 0.19 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.79 1zr4 h VAL 108 Cb 0.21 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.90 1zr4 h VAL 108 CO -0.23 0.00 -0.22 0.74 0.02 0.00 0.00 177.57 177.88 1zr4 h THR 109 N -0.62 0.41 -0.92 2.57 2.02 -0.80 0.36 112.91 115.94 1zr4 h THR 109 Ca 0.02 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.29 1zr4 h THR 109 Cb 0.70 0.41 -0.06 0.00 -1.74 0.00 0.00 68.15 67.45 1zr4 h THR 109 CO -0.41 0.00 0.59 0.40 0.37 0.00 0.00 175.52 176.47 1zr4 h ILE 110 N -0.17 1.00 0.17 3.11 2.04 -0.29 -0.55 117.51 122.82 1zr4 h ILE 110 Ca 0.17 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 1zr4 h ILE 110 Cb 0.44 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1zr4 h ILE 110 CO -0.44 0.18 -0.08 -0.07 0.00 0.00 0.00 178.15 177.73 1zr4 h LEU 111 N 0.97 -0.19 -1.86 1.44 3.38 0.35 -2.78 115.31 116.62 1zr4 h LEU 111 Ca 0.41 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1zr4 h LEU 111 Cb 0.33 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1zr4 h LEU 111 CO -0.17 0.31 -0.08 0.77 0.09 0.00 0.00 178.44 179.35 1zr4 h SER 112 N -0.76 0.00 -0.23 -0.43 4.64 -0.73 -2.11 113.55 113.93 1zr4 h SER 112 Ca -0.02 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.17 1zr4 h SER 112 Cb 0.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 1zr4 h SER 112 CO 0.04 0.08 -0.31 0.00 -0.87 0.00 0.00 176.83 175.76 1zr4 h ALA 113 N 1.92 0.81 0.00 5.18 0.00 -1.04 -0.51 119.26 125.62 1zr4 h ALA 113 Ca -0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 54.91 54.41 1zr4 h ALA 113 Cb 0.39 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1zr4 h ALA 113 CO 0.01 0.65 -0.42 0.28 0.00 0.00 0.00 179.25 179.76 1zr4 h VAL 114 N 0.63 0.92 0.63 0.00 2.07 -1.13 -3.05 116.25 116.32 1zr4 h VAL 114 Ca 0.07 -1.71 -0.03 0.00 0.82 0.00 0.00 66.70 65.84 1zr4 h VAL 114 Cb 0.84 2.04 0.01 0.00 -1.52 0.00 0.00 31.29 32.66 1zr4 h VAL 114 CO 0.07 0.42 -0.30 0.00 0.02 0.00 0.00 177.57 177.78 1zr4 h ALA 115 N 1.58 -1.05 -0.95 1.67 0.00 -0.85 -2.73 119.26 116.94 1zr4 h ALA 115 Ca -0.00 -0.18 0.23 0.00 0.00 0.00 0.00 54.91 54.95 1zr4 h ALA 115 Cb 1.01 0.33 -0.12 0.00 0.00 0.00 0.00 17.79 19.00 1zr4 h ALA 115 CO 0.06 -0.98 0.49 1.96 0.00 0.00 0.00 179.25 180.77 1zr4 h GLN 116 N -0.98 0.48 -0.35 0.00 4.20 -1.05 0.44 115.11 117.85 1zr4 h GLN 116 Ca -0.09 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.53 1zr4 h GLN 116 Cb 0.65 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1zr4 h GLN 116 CO 0.14 0.32 -0.02 0.00 -0.67 0.00 0.00 178.83 178.60 1zr4 h ALA 117 N 1.72 0.47 -0.45 3.87 0.00 -1.59 -0.88 119.26 122.40 1zr4 h ALA 117 Ca 0.60 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1zr4 h ALA 117 Cb 1.13 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1zr4 h ALA 117 CO -0.50 0.26 0.18 0.93 0.00 0.00 0.00 179.25 180.12 1zr4 h GLU 118 N 0.43 0.68 -0.65 0.00 5.08 -0.25 -1.63 114.58 118.23 1zr4 h GLU 118 Ca 0.10 -0.12 0.10 0.00 -1.00 0.00 0.00 59.36 58.44 1zr4 h GLU 118 Cb 0.49 -0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.55 1zr4 h GLU 118 CO 0.02 0.62 0.26 -0.09 -1.00 0.00 0.00 179.01 178.82 1zr4 h ARG 119 N 0.59 0.43 -0.02 2.33 2.43 -0.09 -2.47 114.38 117.57 1zr4 h ARG 119 Ca 0.15 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.15 1zr4 h ARG 119 Cb 0.19 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1zr4 h ARG 119 CO -0.01 0.28 -0.68 1.96 -1.51 0.00 0.00 179.97 180.01 1zr4 h GLN 120 N 0.44 0.09 -0.15 0.20 4.20 -0.80 -2.23 115.11 116.86 1zr4 h GLN 120 Ca 0.34 -0.08 -0.14 0.00 0.06 0.00 0.00 58.65 58.83 1zr4 h GLN 120 Cb 0.43 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1zr4 h GLN 120 CO -0.33 0.74 -0.49 -0.09 -0.67 0.00 0.00 178.83 177.99 1zr4 h ARG 121 N 0.06 0.41 -0.27 1.46 1.12 -0.93 -2.59 114.38 113.64 1zr4 h ARG 121 Ca -0.01 -0.23 -0.05 0.00 -1.11 0.00 0.00 59.98 58.57 1zr4 h ARG 121 Cb 1.21 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 31.17 1zr4 h ARG 121 CO 0.10 0.81 -0.03 0.82 -3.11 0.00 0.00 179.97 178.55 1zr4 h ILE 122 N 0.32 1.27 -0.79 1.20 2.04 -1.31 -2.83 117.51 117.42 1zr4 h ILE 122 Ca 0.02 -1.01 0.12 0.00 1.00 0.00 0.00 64.86 64.99 1zr4 h ILE 122 Cb 0.98 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 38.40 1zr4 h ILE 122 CO 0.09 0.32 0.52 0.25 0.00 0.00 0.00 178.15 179.32 1zr4 h LEU 123 N 0.26 0.58 -0.07 1.44 5.85 -1.14 -0.81 115.31 121.40 1zr4 h LEU 123 Ca 0.07 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.72 1zr4 h LEU 123 Cb 0.48 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1zr4 h LEU 123 CO 0.02 0.33 -0.31 -0.61 -0.34 0.00 0.00 178.44 177.53 1zr4 h GLN 124 N 0.63 0.34 -0.05 1.25 4.15 -1.41 -2.93 115.11 117.09 1zr4 h GLN 124 Ca 0.37 -0.27 0.01 0.00 0.77 0.00 0.00 58.65 59.54 1zr4 h GLN 124 Cb 0.59 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.33 1zr4 h GLN 124 CO -0.14 0.90 0.05 -0.09 -1.93 0.00 0.00 178.83 177.62 1zr4 h ARG 125 N -0.15 0.00 0.00 1.69 2.43 -1.12 -1.39 114.38 115.84 1zr4 h ARG 125 Ca -0.02 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 58.97 1zr4 h ARG 125 Cb 0.95 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.48 1zr4 h ARG 125 CO 0.06 0.00 -0.88 1.15 -1.51 0.00 0.00 179.97 178.80 1zr4 h THR 126 N 0.00 1.56 0.18 0.20 2.02 -1.11 -2.38 112.91 113.38 1zr4 h THR 126 Ca 0.02 -3.09 -0.30 0.00 0.77 0.00 0.00 66.41 63.81 1zr4 h THR 126 Cb 0.12 2.70 0.02 0.00 -1.74 0.00 0.00 68.15 69.25 1zr4 h THR 126 CO -0.00 0.86 -1.34 0.78 0.37 0.00 0.00 175.52 176.19 1zr4 h ASN 127 N 0.00 0.66 -0.61 4.18 2.35 -1.08 -2.99 115.58 118.08 1zr4 h ASN 127 Ca -0.01 -0.69 -0.06 0.00 -0.55 0.00 0.00 56.30 54.99 1zr4 h ASN 127 Cb 1.63 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.76 1zr4 h ASN 127 CO 0.11 1.54 0.14 -0.33 -1.65 0.00 0.00 177.43 177.24 1zr4 h GLU 128 N 0.13 0.99 -0.96 0.81 5.08 -1.54 -2.40 114.58 116.69 1zr4 h GLU 128 Ca -0.19 -0.24 0.24 0.00 -1.00 0.00 0.00 59.36 58.17 1zr4 h GLU 128 Cb 2.05 -0.13 -0.13 0.00 0.50 0.00 0.00 28.75 31.04 1zr4 h GLU 128 CO 0.24 0.90 0.50 0.78 -1.00 0.00 0.00 179.01 180.43 1zr4 h GLY 129 N 0.90 1.76 1.54 -3.84 0.00 -1.46 0.29 103.07 102.27 1zr4 h GLY 129 Ca 0.19 -0.24 -0.12 0.00 0.00 0.00 0.00 47.33 47.16 1zr4 h GLY 129 CO 0.00 -0.28 -0.36 3.21 0.00 0.00 0.00 176.54 179.11 1zr4 h ARG 130 N 0.47 0.51 -0.15 4.80 3.08 -1.28 -2.82 114.38 118.99 1zr4 h ARG 130 Ca 0.62 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 60.35 1zr4 h ARG 130 Cb 1.20 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.24 1zr4 h ARG 130 CO -0.51 0.80 -0.22 1.96 -1.07 0.00 0.00 179.97 180.93 1zr4 h GLN 131 N 0.43 0.42 0.00 0.04 1.08 -0.73 0.57 115.11 116.91 1zr4 h GLN 131 Ca 0.04 -0.25 0.00 0.00 -1.45 0.00 0.00 58.65 57.00 1zr4 h GLN 131 Cb 0.83 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.28 1zr4 h GLN 131 CO 0.07 0.83 0.00 -0.85 -0.95 0.00 0.00 178.83 177.93 1zr4 n GLU 132 N -4.46 0.96 -0.01 1.46 0.28 -0.58 -1.96 120.64 116.32 1zr4 n GLU 132 Ca -0.06 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 56.92 1zr4 n GLU 132 Cb 0.42 -1.21 -0.02 0.00 1.43 0.00 0.00 31.44 32.06 1zr4 n GLU 132 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1zr4 n ALA 133 N -0.71 1.94 -0.03 -1.84 0.00 -1.07 -4.35 120.51 114.45 1zr4 n ALA 133 Ca 0.09 -0.18 -0.14 0.00 0.00 0.00 0.00 53.44 53.22 1zr4 n ALA 133 Cb 0.04 0.18 -0.11 0.00 0.00 0.00 0.00 19.45 19.57 1zr4 n ALA 133 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1zr4 h MET 134 N 0.00 0.12 0.00 0.00 -1.53 0.26 -2.70 114.93 111.08 1zr4 h MET 134 Ca -0.07 -0.10 -0.04 0.00 -3.44 0.00 0.00 59.70 56.05 1zr4 h MET 134 Cb 1.13 0.02 -0.01 0.00 -0.55 0.00 0.00 31.60 32.20 1zr4 h MET 134 CO 0.00 0.77 -0.17 0.00 0.14 0.00 0.00 176.91 177.66 1zr4 h ALA 135 N 0.34 0.97 0.00 0.39 0.00 -1.61 -3.08 119.26 116.28 1zr4 h ALA 135 Ca -0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1zr4 h ALA 135 Cb 0.80 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1zr4 h ALA 135 CO 0.02 0.21 -0.01 -0.22 0.00 0.00 0.00 179.25 179.26 1zr4 h LYS 136 N 0.00 0.00 0.00 0.00 3.64 -1.74 -3.46 116.57 115.00 1zr4 h LYS 136 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1zr4 h LYS 136 Cb 0.80 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1zr4 h LYS 136 CO 0.02 0.01 0.00 0.41 -2.27 0.00 0.00 179.45 177.62 1zr4 n GLY 137 N -1.42 1.26 3.77 5.01 0.00 -1.16 -5.07 105.19 107.58 1zr4 n GLY 137 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 1zr4 n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zr4 s VAL 138 N -2.00 3.68 -0.23 1.61 1.01 -1.02 -5.03 120.40 118.43 1zr4 s VAL 138 Ca 0.00 1.43 -0.11 0.00 0.00 0.00 0.00 61.98 63.30 1zr4 s VAL 138 Cb 0.00 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 1zr4 s VAL 138 CO 0.00 0.15 0.17 -0.69 0.00 0.00 0.00 175.10 174.73 1zr4 s VAL 139 N -1.48 5.36 -0.03 2.92 1.01 -1.26 -4.73 120.40 122.19 1zr4 s VAL 139 Ca 0.53 0.23 -0.02 0.00 0.00 0.00 0.00 61.98 62.71 1zr4 s VAL 139 Cb -0.25 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1zr4 s VAL 139 CO 0.32 0.36 0.13 -0.36 0.00 0.00 0.00 175.10 175.55 1zr4 s PHE 140 N 0.92 3.43 0.00 5.22 0.40 -1.26 -5.05 117.98 121.64 1zr4 s PHE 140 Ca 0.09 0.31 0.00 0.00 -0.60 0.00 0.00 56.93 56.73 1zr4 s PHE 140 Cb -0.13 -1.81 0.00 0.00 0.51 0.00 0.00 43.02 41.59 1zr4 s PHE 140 CO 0.03 0.61 0.00 0.41 0.70 0.00 0.00 175.22 176.98 1zr4 n GLY 141 N 1.24 2.41 2.19 4.36 0.00 -1.26 -5.03 105.19 109.10 1zr4 n GLY 141 Ca -0.13 -1.89 -0.36 0.00 0.00 0.00 0.00 46.02 43.63 1zr4 n GLY 141 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1zr4 n ARG 142 N 1.49 0.00 -2.15 1.61 0.63 -1.26 -4.87 116.66 112.11 1zr4 n ARG 142 Ca 0.00 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.52 1zr4 n ARG 142 Cb 0.00 -0.90 -0.02 0.00 0.45 0.00 0.00 32.46 31.99 1zr4 n ARG 142 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1zr4 s LYS 143 N -0.08 4.38 -0.13 -0.14 -0.14 -1.26 -4.96 119.74 117.42 1zr4 s LYS 143 Ca 0.55 2.17 -0.29 0.00 -1.36 0.00 0.00 55.97 57.04 1zr4 s LYS 143 Cb -0.77 -3.09 -0.03 0.00 -1.68 0.00 0.00 37.83 32.26 1zr4 s LYS 143 CO 0.36 -0.17 1.39 1.03 -0.76 0.00 0.00 175.35 177.20 1zr4 s ARG 144 N -1.58 4.22 -0.06 1.68 0.52 -1.26 -4.91 118.95 117.55 1zr4 s ARG 144 Ca 0.49 1.84 0.06 0.00 -0.52 0.00 0.00 55.73 57.60 1zr4 s ARG 144 Cb -0.39 -3.83 -0.24 0.00 0.52 0.00 0.00 34.95 31.00 1zr4 s ARG 144 CO 0.50 -0.75 0.61 0.87 0.02 0.00 0.00 175.30 176.55 1zr4 h LYS 145 N 8.63 0.09 -6.58 3.54 1.79 -2.04 -3.48 116.57 118.52 1zr4 h LYS 145 Ca -0.31 -0.16 -0.51 0.00 -2.18 0.00 0.00 60.65 57.49 1zr4 h LYS 145 Cb 1.13 0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 31.81 1zr4 h LYS 145 CO 0.96 0.76 0.28 0.42 -1.08 0.00 0.00 179.45 180.79 1zr4 s ILE 146 N -2.59 4.35 -0.88 1.86 1.01 -1.26 -4.97 121.20 118.71 1zr4 s ILE 146 Ca -0.10 1.92 -0.25 0.00 0.00 0.00 0.00 60.65 62.22 1zr4 s ILE 146 Cb 0.08 -4.25 0.03 0.00 0.01 0.00 0.00 42.46 38.33 1zr4 s ILE 146 CO 0.81 0.44 1.44 -0.62 0.00 0.00 0.00 174.94 177.02 1zr4 s ASP 147 N -0.72 6.21 0.18 3.58 2.15 -1.26 -4.86 116.67 121.95 1zr4 s ASP 147 Ca 0.41 -0.92 0.03 0.00 0.43 0.00 0.00 52.55 52.50 1zr4 s ASP 147 Cb -0.24 -2.56 0.05 0.00 -0.30 0.00 0.00 42.92 39.87 1zr4 s ASP 147 CO 0.29 -1.77 1.42 0.03 -0.17 0.00 0.00 175.17 174.97 1zr4 h ARG 148 N 10.27 0.19 0.00 4.34 3.08 -2.00 -2.50 114.38 127.76 1zr4 h ARG 148 Ca -0.01 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.85 1zr4 h ARG 148 Cb 1.03 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1zr4 h ARG 148 CO 1.35 0.90 0.00 -0.25 -1.07 0.00 0.00 179.97 180.90 1zr4 n ASP 149 N -3.70 0.29 -0.52 7.04 8.00 -1.26 -0.33 116.55 126.07 1zr4 n ASP 149 Ca -0.03 0.63 0.12 0.00 0.71 0.00 0.00 54.79 56.22 1zr4 n ASP 149 Cb 0.76 -0.67 0.23 0.00 -0.02 0.00 0.00 41.12 41.42 1zr4 n ASP 149 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1zr4 n ALA 150 N -1.64 3.01 -0.14 2.24 0.00 -0.94 -3.15 120.51 119.89 1zr4 n ALA 150 Ca -0.00 -0.55 -0.28 0.00 0.00 0.00 0.00 53.44 52.61 1zr4 n ALA 150 Cb 0.03 -0.96 -0.10 0.00 0.00 0.00 0.00 19.45 18.42 1zr4 n ALA 150 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1zr4 n VAL 151 N 0.13 1.53 -0.06 0.00 0.31 0.55 -4.17 118.33 116.61 1zr4 n VAL 151 Ca 0.13 -0.41 -0.09 0.00 -0.01 0.00 0.00 64.34 63.97 1zr4 n VAL 151 Cb 0.44 -1.82 -0.02 0.00 -0.91 0.00 0.00 33.84 31.53 1zr4 n VAL 151 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1zr4 h LEU 152 N -0.85 0.13 0.00 7.52 3.38 -1.62 -1.70 115.31 122.17 1zr4 h LEU 152 Ca -0.68 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.31 1zr4 h LEU 152 Cb 1.65 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.40 1zr4 h LEU 152 CO -0.37 0.11 0.00 -3.20 0.09 0.00 0.00 178.44 175.07 1zr4 n ASN 153 N -5.01 0.00 0.00 -0.43 2.85 -1.19 -1.21 115.26 110.26 1zr4 n ASN 153 Ca -0.02 -0.78 0.00 0.00 -0.11 0.00 0.00 54.58 53.67 1zr4 n ASN 153 Cb 0.07 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.09 1zr4 n ASN 153 CO 0.00 0.00 0.00 0.80 -2.11 0.00 0.00 177.26 175.95 1zr4 n MET 154 N -0.74 2.92 -0.01 1.20 1.56 -0.88 -4.56 117.12 116.61 1zr4 n MET 154 Ca 0.06 0.00 -0.21 0.00 -0.27 0.00 0.00 57.70 57.28 1zr4 n MET 154 Cb 0.03 -0.92 -0.14 0.00 2.15 0.00 0.00 33.22 34.34 1zr4 n MET 154 CO 0.00 0.00 0.00 2.35 -0.73 0.00 0.00 175.97 177.59 1zr4 h TRP 155 N 0.00 0.37 0.00 1.12 7.01 -0.95 -3.23 115.95 120.27 1zr4 h TRP 155 Ca 0.00 -0.27 0.00 0.00 2.11 0.00 0.00 58.89 60.73 1zr4 h TRP 155 Cb 0.68 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 27.73 1zr4 h TRP 155 CO 0.00 1.53 0.00 1.04 -2.79 0.00 0.00 178.44 178.22 1zr4 n GLN 156 N -3.99 0.10 -0.33 2.65 6.02 -0.35 -1.00 117.38 120.47 1zr4 n GLN 156 Ca -0.25 0.10 0.08 0.00 -0.01 0.00 0.00 57.00 56.91 1zr4 n GLN 156 Cb 0.86 -1.50 0.23 0.00 1.02 0.00 0.00 30.24 30.85 1zr4 n GLN 156 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1zr4 n GLN 157 N -1.11 3.03 0.00 -1.09 7.27 -1.22 -5.00 117.38 119.26 1zr4 n GLN 157 Ca 0.02 -2.43 0.00 0.00 0.07 0.00 0.00 57.00 54.66 1zr4 n GLN 157 Cb 0.02 -1.53 0.00 0.00 2.41 0.00 0.00 30.24 31.14 1zr4 n GLN 157 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1zr4 n GLY 158 N 0.57 3.06 3.74 1.69 0.00 -0.17 -5.03 105.19 109.05 1zr4 n GLY 158 Ca 0.18 -0.83 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 1zr4 n GLY 158 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1zr4 s LEU 159 N 0.00 3.74 0.45 0.99 1.43 -1.23 -5.00 118.68 119.06 1zr4 s LEU 159 Ca 0.00 2.64 -0.03 0.00 -1.03 0.00 0.00 54.13 55.71 1zr4 s LEU 159 Cb 0.00 -4.44 -0.03 0.00 0.03 0.00 0.00 46.19 41.75 1zr4 s LEU 159 CO 0.00 -1.69 0.72 -0.83 0.23 0.00 0.00 176.35 174.78 1zr4 s GLY 160 N -1.22 1.47 0.14 -3.19 0.00 -1.26 -4.53 107.32 98.73 1zr4 s GLY 160 Ca 0.76 -0.69 -0.18 0.00 0.00 0.00 0.00 44.72 44.60 1zr4 s GLY 160 CO 0.42 -0.55 1.79 0.00 0.00 0.00 0.00 173.10 174.76 1zr4 h ALA 161 N 0.35 0.36 -0.93 3.20 0.00 -1.98 -2.73 119.26 117.54 1zr4 h ALA 161 Ca -0.47 -0.01 0.19 0.00 0.00 0.00 0.00 54.91 54.62 1zr4 h ALA 161 Cb 1.22 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.81 1zr4 h ALA 161 CO 0.61 -0.19 0.51 1.03 0.00 0.00 0.00 179.25 181.20 1zr4 h SER 162 N 0.36 0.59 0.28 0.00 0.87 -1.97 0.18 113.55 113.86 1zr4 h SER 162 Ca 0.11 0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 1zr4 h SER 162 Cb -0.01 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 1zr4 h SER 162 CO -0.05 0.17 -0.13 -0.74 -0.53 0.00 0.00 176.83 175.55 1zr4 h HIS 163 N 0.62 -0.35 -1.01 2.24 6.17 -1.90 -3.08 115.15 117.83 1zr4 h HIS 163 Ca 0.55 -0.01 0.09 0.00 0.71 0.00 0.00 60.37 61.71 1zr4 h HIS 163 Cb 0.90 0.12 -0.08 0.00 2.52 0.00 0.00 27.41 30.87 1zr4 h HIS 163 CO -0.06 -0.18 0.64 0.82 0.71 0.00 0.00 177.93 179.86 1zr4 h ILE 164 N -0.43 1.00 0.00 6.26 2.04 -0.54 -2.05 117.51 123.79 1zr4 h ILE 164 Ca -0.04 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.41 1zr4 h ILE 164 Cb 0.33 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.22 1zr4 h ILE 164 CO 0.06 0.20 -0.20 0.77 0.00 0.00 0.00 178.15 178.98 1zr4 h SER 165 N 1.09 0.00 0.09 1.72 4.64 -0.96 -2.95 113.55 117.18 1zr4 h SER 165 Ca 0.47 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.52 1zr4 h SER 165 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1zr4 h SER 165 CO -0.22 0.20 -1.37 0.11 -0.87 0.00 0.00 176.83 174.68 1zr4 h LYS 166 N 0.00 0.19 0.63 4.77 1.57 -1.30 -3.02 116.57 119.40 1zr4 h LYS 166 Ca -0.00 -0.32 -0.03 0.00 -1.87 0.00 0.00 60.65 58.43 1zr4 h LYS 166 Cb 0.79 0.12 0.01 0.00 0.08 0.00 0.00 32.23 33.22 1zr4 h LYS 166 CO 0.03 1.15 -0.30 1.15 -0.57 0.00 0.00 179.45 180.91 1zr4 h THR 167 N -0.43 0.00 -4.17 -0.16 2.02 -1.53 -3.39 112.91 105.24 1zr4 h THR 167 Ca -0.31 -0.22 -0.53 0.00 0.77 0.00 0.00 66.41 66.12 1zr4 h THR 167 Cb 1.66 0.00 0.15 0.00 -1.74 0.00 0.00 68.15 68.22 1zr4 h THR 167 CO 0.01 0.00 0.40 -0.04 0.37 0.00 0.00 175.52 176.26 1zr4 s MET 168 N -4.42 2.29 -1.00 6.66 -1.94 -1.12 -4.98 119.30 114.78 1zr4 s MET 168 Ca -0.12 1.72 -0.05 0.00 -1.71 0.00 0.00 55.69 55.53 1zr4 s MET 168 Cb 0.01 -1.86 0.25 0.00 2.01 0.00 0.00 34.83 35.25 1zr4 s MET 168 CO 0.37 -1.71 0.97 -1.71 -0.01 0.00 0.00 175.02 172.93 1zr4 n ASN 169 N -2.59 4.90 -3.86 3.03 5.15 -1.26 -4.54 115.26 116.08 1zr4 n ASN 169 Ca 0.13 -3.12 -0.09 0.00 -0.60 0.00 0.00 54.58 50.90 1zr4 n ASN 169 Cb 0.50 -1.20 -0.07 0.00 -0.53 0.00 0.00 39.78 38.49 1zr4 n ASN 169 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1zr4 s ILE 170 N -1.46 0.10 0.42 -1.44 -4.36 -1.14 -5.09 121.20 108.23 1zr4 s ILE 170 Ca 0.30 -1.17 -0.23 0.00 -0.26 0.00 0.00 60.65 59.28 1zr4 s ILE 170 Cb -0.07 -1.50 -0.08 0.00 1.25 0.00 0.00 42.46 42.05 1zr4 s ILE 170 CO -0.09 -0.48 1.08 0.00 0.24 0.00 0.00 174.94 175.69 1zr4 s ALA 171 N -3.89 3.03 0.28 2.27 0.00 -1.26 -4.62 121.76 117.56 1zr4 s ALA 171 Ca 0.09 0.75 0.20 0.00 0.00 0.00 0.00 51.96 53.00 1zr4 s ALA 171 Cb 0.04 -3.30 0.90 0.00 0.00 0.00 0.00 23.12 20.76 1zr4 s ALA 171 CO -0.07 -0.34 1.85 0.07 0.00 0.00 0.00 175.76 177.26 1zr4 h ARG 172 N 2.27 0.00 -0.78 0.00 0.11 -1.94 -2.05 114.38 111.99 1zr4 h ARG 172 Ca -0.49 0.00 0.18 0.00 0.10 0.00 0.00 59.98 59.77 1zr4 h ARG 172 Cb 1.22 0.00 -0.11 0.00 1.11 0.00 0.00 29.97 32.19 1zr4 h ARG 172 CO 0.61 0.30 0.24 1.03 0.10 0.00 0.00 179.97 182.25 1zr4 h SER 173 N 0.00 0.10 -0.11 0.08 0.87 -2.01 -2.51 113.55 109.97 1zr4 h SER 173 Ca -0.00 0.15 -0.04 0.00 -1.23 0.00 0.00 61.79 60.66 1zr4 h SER 173 Cb 0.69 0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1zr4 h SER 173 CO 0.04 -0.03 -0.11 0.74 -0.53 0.00 0.00 176.83 176.95 1zr4 h THR 174 N 0.31 1.36 -0.50 2.23 2.02 -1.75 -3.24 112.91 113.33 1zr4 h THR 174 Ca 0.46 -1.26 0.10 0.00 0.77 0.00 0.00 66.41 66.47 1zr4 h THR 174 Cb 0.80 1.95 -0.10 0.00 -1.74 0.00 0.00 68.15 69.06 1zr4 h THR 174 CO -0.52 0.36 -0.29 0.58 0.37 0.00 0.00 175.52 176.02 1zr4 h VAL 175 N -0.14 0.24 -0.60 3.16 2.07 -1.43 0.84 116.25 120.39 1zr4 h VAL 175 Ca 0.02 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 1zr4 h VAL 175 Cb 0.63 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1zr4 h VAL 175 CO 0.03 0.00 0.20 1.88 0.02 0.00 0.00 177.57 179.69 1zr4 h TYR 176 N -0.18 0.91 -0.01 1.57 -1.99 -1.67 -2.63 116.97 112.96 1zr4 h TYR 176 Ca 0.21 -0.07 -0.00 0.00 2.00 0.00 0.00 58.73 60.88 1zr4 h TYR 176 Cb 0.52 -0.27 -0.00 0.00 2.00 0.00 0.00 36.73 38.98 1zr4 h TYR 176 CO -0.56 0.73 0.01 -0.22 -0.00 0.00 0.00 178.16 178.11 1zr4 h LYS 177 N 0.87 0.02 -0.86 4.88 3.64 -1.10 -1.33 116.57 122.69 1zr4 h LYS 177 Ca 0.20 -0.00 0.19 0.00 -1.27 0.00 0.00 60.65 59.77 1zr4 h LYS 177 Cb 0.23 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.99 1zr4 h LYS 177 CO -0.01 0.05 0.57 0.28 -2.27 0.00 0.00 179.45 178.08 1zr4 h VAL 178 N -0.03 0.70 0.34 2.00 2.07 -0.75 -2.53 116.25 118.06 1zr4 h VAL 178 Ca 0.00 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1zr4 h VAL 178 Cb 0.04 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1zr4 h VAL 178 CO -0.00 0.07 -0.16 0.40 0.02 0.00 0.00 177.57 177.90 1zr4 h ILE 179 N 0.39 0.35 0.00 4.57 2.04 -0.97 -3.26 117.51 120.62 1zr4 h ILE 179 Ca 0.44 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 1zr4 h ILE 179 Cb 1.11 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.75 1zr4 h ILE 179 CO -0.15 0.08 -0.02 0.78 0.00 0.00 0.00 178.15 178.83 1zr4 h ASN 180 N -1.02 0.00 0.87 1.72 2.35 -0.93 -1.92 115.58 116.66 1zr4 h ASN 180 Ca -0.05 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.48 1zr4 h ASN 180 Cb 0.49 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.84 1zr4 h ASN 180 CO 0.08 0.02 -1.05 -0.08 -1.65 0.00 0.00 177.43 174.75 1zr4 h GLU 181 N 0.00 0.08 -2.23 0.81 4.81 -1.59 -3.38 114.58 113.09 1zr4 h GLU 181 Ca -0.00 -0.14 -0.54 0.00 -0.13 0.00 0.00 59.36 58.55 1zr4 h GLU 181 Cb 0.09 0.05 -0.14 0.00 0.63 0.00 0.00 28.75 29.38 1zr4 h GLU 181 CO 0.00 1.05 1.06 -1.13 -0.73 0.00 0.00 179.01 179.26 1zr4 n SER 182 N -3.42 6.90 -0.79 1.04 3.41 -0.72 -5.13 113.62 114.90 1zr4 n SER 182 Ca -0.02 -3.07 0.10 0.00 -0.26 0.00 0.00 58.87 55.62 1zr4 n SER 182 Cb 0.95 -1.31 0.08 0.00 -0.26 0.00 0.00 64.21 63.67 1zr4 n SER 182 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47