#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pz4 h ILE -1 N 0.00 0.86 -3.39 -0.61 2.04 -2.11 -3.40 117.51 110.90 1pz4 h ILE -1 Ca 0.00 -0.20 -0.58 0.00 1.00 0.00 0.00 64.86 65.08 1pz4 h ILE -1 Cb 0.00 0.24 -0.09 0.00 -0.74 0.00 0.00 36.82 36.23 1pz4 h ILE -1 CO 0.00 0.10 -0.01 -0.60 0.00 0.00 0.00 178.15 177.64 1pz4 s ARG 0 N -5.55 4.29 -0.26 2.37 3.52 -1.26 -4.99 118.95 117.06 1pz4 s ARG 0 Ca -0.09 0.55 -0.43 0.00 -0.13 0.00 0.00 55.73 55.63 1pz4 s ARG 0 Cb 0.21 -3.50 -0.20 0.00 -1.56 0.00 0.00 34.95 29.90 1pz4 s ARG 0 CO 0.77 -0.03 1.39 -0.12 -0.81 0.00 0.00 175.30 176.50 1pz4 n MET 1 N 4.31 0.12 -4.03 5.12 1.56 -1.26 -4.93 117.12 118.01 1pz4 n MET 1 Ca -0.04 0.04 -0.36 0.00 -0.27 0.00 0.00 57.70 57.07 1pz4 n MET 1 Cb 0.51 -1.56 -0.08 0.00 2.15 0.00 0.00 33.22 34.24 1pz4 n MET 1 CO 0.00 0.00 0.00 -1.54 -0.73 0.00 0.00 175.97 173.70 1pz4 s SER 2 N 1.73 5.92 0.03 6.12 1.04 -1.26 -5.09 113.70 122.18 1pz4 s SER 2 Ca 0.98 0.29 0.06 0.00 0.48 0.00 0.00 55.95 57.76 1pz4 s SER 2 Cb -1.36 -1.89 -0.02 0.00 0.10 0.00 0.00 66.02 62.85 1pz4 s SER 2 CO 0.70 0.34 -0.19 -0.76 0.98 0.00 0.00 173.24 174.31 1pz4 s LEU 3 N -0.61 2.13 0.29 2.42 1.43 -1.26 -5.02 118.68 118.05 1pz4 s LEU 3 Ca 0.12 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.75 1pz4 s LEU 3 Cb -0.12 -0.89 0.44 0.00 0.03 0.00 0.00 46.19 45.66 1pz4 s LEU 3 CO 0.02 0.15 1.92 0.11 0.23 0.00 0.00 176.35 178.79 1pz4 h LYS 4 N 5.12 1.11 0.00 1.70 1.57 -1.99 -1.97 116.57 122.11 1pz4 h LYS 4 Ca -0.40 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1pz4 h LYS 4 Cb 1.16 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1pz4 h LYS 4 CO 0.45 0.73 0.00 -1.13 -0.57 0.00 0.00 179.45 178.93 1pz4 n SER 5 N -4.45 0.64 -0.07 0.86 3.41 -1.26 -2.13 113.62 110.62 1pz4 n SER 5 Ca 0.13 0.71 0.10 0.00 -0.26 0.00 0.00 58.87 59.55 1pz4 n SER 5 Cb 0.12 -0.83 0.48 0.00 -0.26 0.00 0.00 64.21 63.72 1pz4 n SER 5 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1pz4 h ASP 6 N 0.00 0.41 -0.59 4.04 3.32 -1.76 -1.37 116.42 120.46 1pz4 h ASP 6 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1pz4 h ASP 6 Cb 0.20 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1pz4 h ASP 6 CO 0.00 0.26 0.34 -0.08 -1.72 0.00 0.00 179.24 178.04 1pz4 h GLU 7 N 0.46 0.81 -0.56 3.56 4.81 -1.61 -1.22 114.58 120.83 1pz4 h GLU 7 Ca 0.25 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.35 1pz4 h GLU 7 Cb 0.39 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1pz4 h GLU 7 CO -0.07 0.60 0.19 0.28 -0.73 0.00 0.00 179.01 179.29 1pz4 h VAL 8 N 0.80 1.23 -0.28 0.32 2.07 -1.41 -1.80 116.25 117.18 1pz4 h VAL 8 Ca 0.21 -0.76 -0.08 0.00 0.82 0.00 0.00 66.70 66.89 1pz4 h VAL 8 Cb 0.02 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1pz4 h VAL 8 CO -0.04 0.29 -0.18 -0.26 0.02 0.00 0.00 177.57 177.40 1pz4 h PHE 9 N 0.78 0.54 -0.60 1.57 -1.00 -1.07 0.22 116.94 117.38 1pz4 h PHE 9 Ca 0.18 -0.10 -0.06 0.00 2.81 0.00 0.00 57.97 60.81 1pz4 h PHE 9 Cb 0.25 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 39.65 1pz4 h PHE 9 CO 0.01 0.65 0.14 0.00 -1.61 0.00 0.00 178.31 177.50 1pz4 h ALA 10 N 1.37 0.79 -0.59 2.45 0.00 -0.96 -1.37 119.26 120.96 1pz4 h ALA 10 Ca 0.08 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1pz4 h ALA 10 Cb 0.57 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1pz4 h ALA 10 CO 0.04 0.51 0.10 0.87 0.00 0.00 0.00 179.25 180.76 1pz4 h LYS 11 N 0.88 0.94 -0.39 0.00 1.57 -0.87 -1.95 116.57 116.75 1pz4 h LYS 11 Ca 0.19 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1pz4 h LYS 11 Cb 0.36 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1pz4 h LYS 11 CO 0.00 0.87 0.11 0.82 -0.57 0.00 0.00 179.45 180.69 1pz4 h ILE 12 N 0.89 1.22 -0.68 1.86 2.04 -0.70 -0.99 117.51 121.15 1pz4 h ILE 12 Ca 0.18 -0.73 0.02 0.00 1.00 0.00 0.00 64.86 65.33 1pz4 h ILE 12 Cb 0.38 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 1pz4 h ILE 12 CO 0.01 0.26 0.45 0.00 0.00 0.00 0.00 178.15 178.86 1pz4 h ALA 13 N 0.96 1.57 -0.54 1.87 0.00 -1.01 -1.07 119.26 121.04 1pz4 h ALA 13 Ca 0.13 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1pz4 h ALA 13 Cb 0.27 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1pz4 h ALA 13 CO -0.00 0.38 -0.01 -0.22 0.00 0.00 0.00 179.25 179.40 1pz4 h LYS 14 N 0.87 0.92 -0.42 0.00 3.64 -0.92 -2.60 116.57 118.05 1pz4 h LYS 14 Ca 0.26 -0.27 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1pz4 h LYS 14 Cb -0.02 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1pz4 h LYS 14 CO -0.06 0.92 0.15 -0.09 -2.27 0.00 0.00 179.45 178.09 1pz4 h ARG 15 N 0.85 0.60 0.00 1.90 9.65 0.06 -1.91 114.38 125.53 1pz4 h ARG 15 Ca 0.16 -0.09 -0.02 0.00 -1.10 0.00 0.00 59.98 58.93 1pz4 h ARG 15 Cb 0.51 -0.11 -0.00 0.00 -1.39 0.00 0.00 29.97 28.98 1pz4 h ARG 15 CO 0.03 0.52 -0.08 -0.07 2.80 0.00 0.00 179.97 183.17 1pz4 h LEU 16 N 0.60 0.00 -1.86 3.80 3.38 -0.94 -2.23 115.31 118.06 1pz4 h LEU 16 Ca 0.14 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1pz4 h LEU 16 Cb 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1pz4 h LEU 16 CO -0.01 0.08 -0.14 -0.33 0.09 0.00 0.00 178.44 178.13 1pz4 h GLU 17 N 0.00 0.00 -0.56 1.13 5.08 -1.34 -3.10 114.58 115.79 1pz4 h GLU 17 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1pz4 h GLU 17 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1pz4 h GLU 17 CO 0.01 0.14 0.00 0.43 -1.00 0.00 0.00 179.01 178.58 1pz4 n SER 18 N -3.93 5.31 -4.77 1.42 7.64 -0.84 -5.00 113.62 113.46 1pz4 n SER 18 Ca -0.02 -2.83 -0.38 0.00 1.01 0.00 0.00 58.87 56.65 1pz4 n SER 18 Cb 0.23 -0.64 -0.02 0.00 -1.01 0.00 0.00 64.21 62.76 1pz4 n SER 18 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1pz4 s ILE 19 N -2.56 3.14 -0.48 0.44 1.01 -1.18 -4.97 121.20 116.61 1pz4 s ILE 19 Ca 0.52 0.96 -0.18 0.00 0.00 0.00 0.00 60.65 61.95 1pz4 s ILE 19 Cb 0.39 -3.54 0.05 0.00 0.01 0.00 0.00 42.46 39.37 1pz4 s ILE 19 CO 0.17 0.09 0.55 -0.62 0.00 0.00 0.00 174.94 175.13 1pz4 s ASP 20 N -1.13 6.21 0.67 3.58 -1.08 -1.26 -4.92 116.67 118.73 1pz4 s ASP 20 Ca 0.57 -0.91 0.43 0.00 -0.52 0.00 0.00 52.55 52.12 1pz4 s ASP 20 Cb -0.31 -2.26 2.37 0.00 -1.46 0.00 0.00 42.92 41.26 1pz4 s ASP 20 CO 0.39 -0.78 2.35 1.55 0.52 0.00 0.00 175.17 179.19 1pz4 h PRO 21 N 8.89 0.00 0.00 4.34 0.13 -2.01 -0.21 132.00 143.14 1pz4 h PRO 21 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1pz4 h PRO 21 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1pz4 h PRO 21 CO 0.91 0.00 -0.45 0.00 -0.23 0.00 0.00 178.00 178.23 1pz4 n ALA 22 N -2.08 3.35 -3.11 -0.56 0.00 -1.26 -4.44 120.51 112.42 1pz4 n ALA 22 Ca -0.03 -0.31 -0.20 0.00 0.00 0.00 0.00 53.44 52.90 1pz4 n ALA 22 Cb 0.09 -1.17 -0.05 0.00 0.00 0.00 0.00 19.45 18.33 1pz4 n ALA 22 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1pz4 n ASN 23 N -1.55 -0.74 -4.77 0.00 5.15 -0.09 -5.11 115.26 108.14 1pz4 n ASN 23 Ca 0.05 -2.78 -0.38 0.00 -0.60 0.00 0.00 54.58 50.87 1pz4 n ASN 23 Cb 0.34 0.01 -0.03 0.00 -0.53 0.00 0.00 39.78 39.57 1pz4 n ASN 23 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1pz4 s ARG 24 N -0.51 4.13 -0.04 1.20 1.81 -1.22 -4.68 118.95 119.64 1pz4 s ARG 24 Ca 0.34 1.78 0.01 0.00 -1.72 0.00 0.00 55.73 56.13 1pz4 s ARG 24 Cb 0.16 -2.70 -0.03 0.00 -0.45 0.00 0.00 34.95 31.93 1pz4 s ARG 24 CO -0.15 -0.24 -0.03 1.04 -0.68 0.00 0.00 175.30 175.24 1pz4 n GLN 25 N 0.15 0.37 -3.80 3.54 1.13 -1.26 -5.00 117.38 112.52 1pz4 n GLN 25 Ca 0.04 0.02 -0.28 0.00 -1.94 0.00 0.00 57.00 54.84 1pz4 n GLN 25 Cb 0.47 -1.08 -0.16 0.00 0.11 0.00 0.00 30.24 29.57 1pz4 n GLN 25 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1pz4 s VAL 26 N -2.08 0.80 -0.69 5.09 1.01 -1.26 -5.06 120.40 118.21 1pz4 s VAL 26 Ca -0.05 -0.66 0.05 0.00 0.00 0.00 0.00 61.98 61.32 1pz4 s VAL 26 Cb 0.01 -1.19 0.24 0.00 0.00 0.00 0.00 36.38 35.45 1pz4 s VAL 26 CO 0.10 -0.11 0.77 -0.62 0.00 0.00 0.00 175.10 175.23 1pz4 n GLU 27 N 4.96 2.59 -4.19 2.72 1.02 -1.26 -4.71 120.64 121.77 1pz4 n GLU 27 Ca -0.10 -4.64 -0.11 0.00 -0.02 0.00 0.00 57.16 52.29 1pz4 n GLU 27 Cb 0.47 -2.29 -0.10 0.00 -0.02 0.00 0.00 31.44 29.50 1pz4 n GLU 27 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1pz4 s HIS 28 N -2.34 0.98 -0.19 -0.32 3.76 -1.26 -4.65 115.29 111.26 1pz4 s HIS 28 Ca 0.37 -1.05 -0.04 0.00 -0.15 0.00 0.00 55.06 54.19 1pz4 s HIS 28 Cb 0.11 -0.57 -0.02 0.00 1.11 0.00 0.00 32.58 33.22 1pz4 s HIS 28 CO -0.03 -0.29 -0.04 0.08 -0.85 0.00 0.00 174.74 173.62 1pz4 s VAL 29 N -3.77 3.59 0.08 -0.90 1.01 -1.26 -1.19 120.40 117.95 1pz4 s VAL 29 Ca 0.19 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 61.82 1pz4 s VAL 29 Cb 0.06 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 1pz4 s VAL 29 CO -0.00 0.45 -0.22 -0.31 0.00 0.00 0.00 175.10 175.01 1pz4 s TYR 30 N 1.04 1.94 -0.03 5.22 1.51 -0.30 -1.23 117.35 125.50 1pz4 s TYR 30 Ca 0.01 -0.39 0.06 0.00 -1.01 0.00 0.00 57.07 55.74 1pz4 s TYR 30 Cb -0.15 -1.11 -0.01 0.00 -0.11 0.00 0.00 41.96 40.58 1pz4 s TYR 30 CO 0.00 0.17 -0.22 0.21 -1.11 0.00 0.00 175.55 174.60 1pz4 s LYS 31 N -1.55 2.03 -0.18 -0.62 2.20 -0.26 -0.48 119.74 120.87 1pz4 s LYS 31 Ca 0.09 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 54.90 1pz4 s LYS 31 Cb -0.10 -1.84 0.01 0.00 -1.51 0.00 0.00 37.83 34.39 1pz4 s LYS 31 CO 0.03 0.41 -0.18 -0.06 -0.36 0.00 0.00 175.35 175.20 1pz4 s PHE 32 N -0.32 2.79 -0.36 4.03 0.40 0.10 -0.39 117.98 124.23 1pz4 s PHE 32 Ca 0.03 -1.46 -0.08 0.00 -0.60 0.00 0.00 56.93 54.82 1pz4 s PHE 32 Cb -0.11 -1.93 0.04 0.00 0.51 0.00 0.00 43.02 41.54 1pz4 s PHE 32 CO 0.01 -0.72 0.16 1.03 0.70 0.00 0.00 175.22 176.40 1pz4 s ARG 33 N 1.21 2.68 -0.17 0.44 0.52 0.48 -1.48 118.95 122.63 1pz4 s ARG 33 Ca 0.03 -1.18 -0.16 0.00 -0.52 0.00 0.00 55.73 53.89 1pz4 s ARG 33 Cb -0.14 -3.60 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 1pz4 s ARG 33 CO -0.09 -0.72 0.42 0.42 0.02 0.00 0.00 175.30 175.35 1pz4 s ILE 34 N 1.46 5.20 0.32 1.52 -1.09 0.11 -1.82 121.20 126.89 1pz4 s ILE 34 Ca 0.00 0.77 0.09 0.00 -2.23 0.00 0.00 60.65 59.28 1pz4 s ILE 34 Cb -0.20 -3.75 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 1pz4 s ILE 34 CO 0.04 0.28 0.10 0.42 -1.23 0.00 0.00 174.94 174.56 1pz4 s THR 35 N 1.04 3.20 -0.21 2.92 -4.23 -0.31 -0.98 115.64 117.06 1pz4 s THR 35 Ca 0.21 -1.75 -0.06 0.00 -1.18 0.00 0.00 61.69 58.91 1pz4 s THR 35 Cb -0.15 -2.96 0.10 0.00 1.34 0.00 0.00 72.50 70.84 1pz4 s THR 35 CO 0.08 -0.24 0.42 -1.58 -0.54 0.00 0.00 174.62 172.76 1pz4 s GLN 36 N -3.80 0.34 -0.88 3.99 0.74 0.30 -0.77 119.66 119.59 1pz4 s GLN 36 Ca 0.36 0.94 -0.05 0.00 0.05 0.00 0.00 55.36 56.66 1pz4 s GLN 36 Cb -0.04 0.19 0.01 0.00 1.10 0.00 0.00 33.01 34.27 1pz4 s GLN 36 CO 0.22 -0.35 0.77 0.41 -0.55 0.00 0.00 175.29 175.79 1pz4 n GLY 37 N 5.39 -0.03 4.44 2.59 0.00 -1.26 -2.75 105.19 113.57 1pz4 n GLY 37 Ca -0.07 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1pz4 n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pz4 n GLY 38 N -1.45 1.00 3.81 -0.02 0.00 -1.26 -4.96 105.19 102.30 1pz4 n GLY 38 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1pz4 n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pz4 s LYS 39 N 0.00 3.92 -0.20 1.61 -2.85 -1.11 -4.93 119.74 116.18 1pz4 s LYS 39 Ca 0.00 1.26 -0.29 0.00 -1.00 0.00 0.00 55.97 55.94 1pz4 s LYS 39 Cb 0.00 -2.12 -0.01 0.00 -2.06 0.00 0.00 37.83 33.64 1pz4 s LYS 39 CO 0.00 -0.32 1.28 0.08 0.10 0.00 0.00 175.35 176.49 1pz4 s VAL 40 N -2.10 4.23 -0.17 1.79 1.01 -1.26 -0.54 120.40 123.36 1pz4 s VAL 40 Ca 0.65 1.46 0.11 0.00 0.00 0.00 0.00 61.98 64.20 1pz4 s VAL 40 Cb -0.14 -4.03 -0.18 0.00 0.00 0.00 0.00 36.38 32.03 1pz4 s VAL 40 CO 0.19 -0.23 -0.01 1.33 0.00 0.00 0.00 175.10 176.38 1pz4 n VAL 41 N 5.63 1.12 -3.65 2.92 0.24 -0.16 -4.95 118.33 119.47 1pz4 n VAL 41 Ca 0.14 -0.62 -0.15 0.00 -2.04 0.00 0.00 64.34 61.68 1pz4 n VAL 41 Cb 0.45 -0.74 -0.08 0.00 -1.47 0.00 0.00 33.84 32.00 1pz4 n VAL 41 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1pz4 s LYS 42 N -2.39 0.77 -0.02 7.34 2.20 -1.13 -5.03 119.74 121.48 1pz4 s LYS 42 Ca -0.13 0.37 0.06 0.00 -0.36 0.00 0.00 55.97 55.91 1pz4 s LYS 42 Cb 0.05 0.37 -0.01 0.00 -1.51 0.00 0.00 37.83 36.72 1pz4 s LYS 42 CO 0.61 -0.18 -0.21 -0.80 -0.36 0.00 0.00 175.35 174.41 1pz4 s ASN 43 N -0.57 2.49 0.02 1.43 0.01 -1.26 -0.72 114.94 116.35 1pz4 s ASN 43 Ca -0.07 -0.39 0.04 0.00 -0.71 0.00 0.00 52.86 51.74 1pz4 s ASN 43 Cb -0.03 -0.36 -0.02 0.00 0.41 0.00 0.00 41.25 41.25 1pz4 s ASN 43 CO 0.04 0.25 -0.13 0.26 -1.51 0.00 0.00 177.10 176.01 1pz4 s TRP 44 N -0.40 1.16 -0.14 2.20 0.52 -0.55 -1.81 118.94 119.92 1pz4 s TRP 44 Ca 0.06 -0.31 0.02 0.00 0.02 0.00 0.00 56.10 55.89 1pz4 s TRP 44 Cb -0.09 -0.71 0.01 0.00 -1.15 0.00 0.00 33.47 31.53 1pz4 s TRP 44 CO -0.00 0.01 -0.22 0.08 0.02 0.00 0.00 176.95 176.85 1pz4 s VAL 45 N -0.68 2.12 -0.40 4.03 1.01 0.37 -0.72 120.40 126.13 1pz4 s VAL 45 Ca 0.02 -0.97 -0.05 0.00 0.00 0.00 0.00 61.98 60.98 1pz4 s VAL 45 Cb -0.07 -1.84 0.09 0.00 0.00 0.00 0.00 36.38 34.56 1pz4 s VAL 45 CO 0.01 0.55 0.21 -0.32 0.00 0.00 0.00 175.10 175.54 1pz4 s MET 46 N 0.75 2.28 -0.62 2.72 1.75 0.37 -1.60 119.30 124.94 1pz4 s MET 46 Ca -0.08 -1.64 -0.20 0.00 -1.25 0.00 0.00 55.69 52.52 1pz4 s MET 46 Cb -0.16 -3.62 0.10 0.00 2.84 0.00 0.00 34.83 33.99 1pz4 s MET 46 CO -0.00 -0.99 0.78 0.34 -0.65 0.00 0.00 175.02 174.50 1pz4 s ASP 47 N 1.93 6.20 0.00 1.11 -1.08 0.52 -1.15 116.67 124.20 1pz4 s ASP 47 Ca 0.05 -1.36 0.28 0.00 -0.52 0.00 0.00 52.55 51.00 1pz4 s ASP 47 Cb -0.23 -2.33 1.16 0.00 -1.46 0.00 0.00 42.92 40.06 1pz4 s ASP 47 CO -0.02 -1.19 1.80 0.18 0.52 0.00 0.00 175.17 176.47 1pz4 n LEU 48 N 6.66 1.19 -0.07 -1.34 4.77 -0.34 -0.91 117.00 126.97 1pz4 n LEU 48 Ca -0.07 -0.38 -0.16 0.00 -0.03 0.00 0.00 56.01 55.37 1pz4 n LEU 48 Cb 0.43 -0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.38 1pz4 n LEU 48 CO 0.59 0.20 0.18 0.11 -1.33 0.00 0.00 177.39 177.15 1pz4 h LYS 49 N 1.82 0.02 0.00 3.23 1.57 -1.83 -3.38 116.57 118.01 1pz4 h LYS 49 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1pz4 h LYS 49 Cb 0.42 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1pz4 h LYS 49 CO 0.00 1.02 -0.88 0.09 -0.57 0.00 0.00 179.45 179.11 1pz4 n ASN 50 N -4.53 0.64 -2.07 0.86 3.02 -1.25 -5.02 115.26 106.91 1pz4 n ASN 50 Ca -0.15 -0.31 -0.00 0.00 -0.03 0.00 0.00 54.58 54.09 1pz4 n ASN 50 Cb 0.55 0.67 0.00 0.00 -0.61 0.00 0.00 39.78 40.38 1pz4 n ASN 50 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1pz4 n VAL 51 N -1.80 -4.39 -3.70 2.41 0.31 -0.09 -5.09 118.33 105.99 1pz4 n VAL 51 Ca 0.03 -0.08 -0.14 0.00 -0.01 0.00 0.00 64.34 64.14 1pz4 n VAL 51 Cb 0.40 -4.77 -0.08 0.00 -0.91 0.00 0.00 33.84 28.47 1pz4 n VAL 51 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 1pz4 s LYS 52 N -2.96 0.73 -0.12 5.55 -2.85 -0.30 -5.02 119.74 114.77 1pz4 s LYS 52 Ca 0.00 0.04 -0.02 0.00 -1.00 0.00 0.00 55.97 54.99 1pz4 s LYS 52 Cb -0.00 0.33 0.04 0.00 -2.06 0.00 0.00 37.83 36.15 1pz4 s LYS 52 CO 0.27 -0.20 0.03 -1.17 0.10 0.00 0.00 175.35 174.39 1pz4 s LEU 53 N -1.04 0.68 0.05 2.77 2.96 -1.26 -0.35 118.68 122.48 1pz4 s LEU 53 Ca -0.11 -0.37 -0.05 0.00 -0.22 0.00 0.00 54.13 53.39 1pz4 s LEU 53 Cb -0.04 -0.42 -0.02 0.00 0.50 0.00 0.00 46.19 46.22 1pz4 s LEU 53 CO 0.05 -0.26 0.08 0.68 -1.32 0.00 0.00 176.35 175.58 1pz4 s VAL 54 N 1.99 0.15 -0.42 1.68 -7.23 -0.63 -5.00 120.40 110.94 1pz4 s VAL 54 Ca 0.03 -1.23 -0.29 0.00 -1.81 0.00 0.00 61.98 58.68 1pz4 s VAL 54 Cb -0.14 -1.03 0.02 0.00 0.56 0.00 0.00 36.38 35.78 1pz4 s VAL 54 CO -0.06 -0.68 1.29 -0.70 -0.31 0.00 0.00 175.10 174.64 1pz4 s GLU 55 N -2.94 3.68 0.06 4.82 2.12 -1.26 -0.48 118.70 124.70 1pz4 s GLU 55 Ca -0.02 0.84 -0.26 0.00 0.36 0.00 0.00 54.97 55.88 1pz4 s GLU 55 Cb 0.01 -3.96 0.08 0.00 0.26 0.00 0.00 34.13 30.52 1pz4 s GLU 55 CO -0.06 -1.43 0.72 -1.54 -0.54 0.00 0.00 175.26 172.41 1pz4 s SER 56 N 3.19 -0.51 -0.40 -1.70 1.04 -0.75 -4.92 113.70 109.65 1pz4 s SER 56 Ca 0.55 0.14 0.05 0.00 0.48 0.00 0.00 55.95 57.18 1pz4 s SER 56 Cb -0.11 0.51 0.57 0.00 0.10 0.00 0.00 66.02 67.09 1pz4 s SER 56 CO 0.31 -0.77 1.71 -0.67 0.98 0.00 0.00 173.24 174.79 1pz4 n ASP 57 N -0.06 3.62 -4.76 7.02 4.64 -1.26 -3.91 116.55 121.83 1pz4 n ASP 57 Ca -0.15 -3.71 -0.29 0.00 -1.38 0.00 0.00 54.79 49.26 1pz4 n ASP 57 Cb 0.62 -0.75 0.14 0.00 -1.04 0.00 0.00 41.12 40.09 1pz4 n ASP 57 CO 0.00 0.00 0.00 -1.81 -0.82 0.00 0.00 177.20 174.57 1pz4 s ASP 58 N -1.97 3.45 0.61 1.67 1.01 -1.26 -5.04 116.67 115.14 1pz4 s ASP 58 Ca 0.52 1.09 -0.14 0.00 0.71 0.00 0.00 52.55 54.73 1pz4 s ASP 58 Cb 0.45 -1.71 -0.03 0.00 1.01 0.00 0.00 42.92 42.64 1pz4 s ASP 58 CO 0.05 -2.60 1.04 0.00 0.21 0.00 0.00 175.17 173.87 1pz4 s ALA 59 N -3.18 2.85 0.28 5.23 0.00 -1.26 -4.98 121.76 120.70 1pz4 s ALA 59 Ca 0.64 0.18 -0.06 0.00 0.00 0.00 0.00 51.96 52.71 1pz4 s ALA 59 Cb -0.16 -3.17 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 1pz4 s ALA 59 CO 0.55 -0.79 0.41 0.00 0.00 0.00 0.00 175.76 175.92 1pz4 s ALA 60 N -2.79 0.45 0.03 0.00 0.00 -1.26 -4.98 121.76 113.22 1pz4 s ALA 60 Ca 0.59 -1.30 0.11 0.00 0.00 0.00 0.00 51.96 51.36 1pz4 s ALA 60 Cb -0.13 1.17 0.00 0.00 0.00 0.00 0.00 23.12 24.16 1pz4 s ALA 60 CO 0.44 -0.78 1.40 0.93 0.00 0.00 0.00 175.76 177.75 1pz4 h GLU 61 N 2.26 0.00 -3.33 0.00 5.08 -1.55 -3.45 114.58 113.59 1pz4 h GLU 61 Ca -0.29 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 57.88 1pz4 h GLU 61 Cb 1.25 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 30.23 1pz4 h GLU 61 CO 0.40 0.74 -0.54 0.00 -1.00 0.00 0.00 179.01 178.61 1pz4 s ALA 62 N -2.94 -0.39 -0.12 3.43 0.00 -1.19 -1.18 121.76 119.37 1pz4 s ALA 62 Ca 0.02 0.48 0.01 0.00 0.00 0.00 0.00 51.96 52.48 1pz4 s ALA 62 Cb 0.09 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.94 1pz4 s ALA 62 CO 0.78 -0.09 -0.16 0.99 0.00 0.00 0.00 175.76 177.29 1pz4 s THR 63 N 0.20 1.58 -0.18 0.00 2.01 -0.41 -1.10 115.64 117.74 1pz4 s THR 63 Ca -0.01 -0.67 -0.04 0.00 0.31 0.00 0.00 61.69 61.28 1pz4 s THR 63 Cb -0.02 -1.45 -0.02 0.00 0.01 0.00 0.00 72.50 71.02 1pz4 s THR 63 CO -0.01 0.46 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.58 1pz4 s LEU 64 N 1.13 3.11 -0.17 4.42 1.02 0.47 -0.63 118.68 128.03 1pz4 s LEU 64 Ca -0.03 -0.23 -0.00 0.00 0.02 0.00 0.00 54.13 53.89 1pz4 s LEU 64 Cb -0.14 -1.76 0.00 0.00 0.02 0.00 0.00 46.19 44.31 1pz4 s LEU 64 CO -0.04 0.10 -0.15 -0.89 0.02 0.00 0.00 176.35 175.39 1pz4 s THR 65 N 0.76 2.64 0.12 5.49 2.01 0.32 -0.39 115.64 126.59 1pz4 s THR 65 Ca -0.02 -0.77 -0.25 0.00 0.31 0.00 0.00 61.69 60.97 1pz4 s THR 65 Cb -0.15 -2.12 0.07 0.00 0.01 0.00 0.00 72.50 70.31 1pz4 s THR 65 CO 0.02 0.51 0.75 0.00 -0.69 0.00 0.00 174.62 175.21 1pz4 s MET 66 N 0.96 1.20 0.61 4.92 0.23 -0.76 -1.37 119.30 125.08 1pz4 s MET 66 Ca -0.03 -0.51 -0.17 0.00 -1.03 0.00 0.00 55.69 53.95 1pz4 s MET 66 Cb -0.15 0.51 -0.03 0.00 -1.53 0.00 0.00 34.83 33.63 1pz4 s MET 66 CO -0.02 -0.53 1.14 -1.21 -2.03 0.00 0.00 175.02 172.37 1pz4 s GLU 67 N -3.52 2.99 0.24 3.16 0.41 -1.26 -1.16 118.70 119.56 1pz4 s GLU 67 Ca 0.05 1.59 -0.07 0.00 -0.41 0.00 0.00 54.97 56.13 1pz4 s GLU 67 Cb -0.02 -1.96 0.43 0.00 -1.78 0.00 0.00 34.13 30.81 1pz4 s GLU 67 CO -0.07 -1.13 1.65 0.22 -0.49 0.00 0.00 175.26 175.43 1pz4 h ASP 68 N 0.61 -0.24 -0.12 -0.19 3.58 -1.29 -0.02 116.42 118.75 1pz4 h ASP 68 Ca -0.49 0.18 -0.03 0.00 0.42 0.00 0.00 57.03 57.11 1pz4 h ASP 68 Cb 1.27 0.30 -0.01 0.00 1.72 0.00 0.00 39.33 42.60 1pz4 h ASP 68 CO 0.55 -0.14 0.01 0.44 -2.88 0.00 0.00 179.24 177.22 1pz4 h ASP 69 N 0.14 0.28 -0.11 2.28 3.32 -1.92 -0.97 116.42 119.44 1pz4 h ASP 69 Ca 0.40 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.35 1pz4 h ASP 69 Cb 0.71 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1pz4 h ASP 69 CO -0.61 0.32 -0.20 0.40 -1.72 0.00 0.00 179.24 177.44 1pz4 h ILE 70 N 0.30 1.38 -0.86 0.35 1.08 -1.41 -1.56 117.51 116.80 1pz4 h ILE 70 Ca 0.07 -1.46 0.06 0.00 -0.39 0.00 0.00 64.86 63.14 1pz4 h ILE 70 Cb 0.19 2.07 -0.06 0.00 -3.07 0.00 0.00 36.82 35.95 1pz4 h ILE 70 CO 0.00 0.42 0.53 -0.03 -0.69 0.00 0.00 178.15 178.39 1pz4 h MET 71 N -0.10 0.94 -0.27 2.37 4.05 -0.97 -0.11 114.93 120.83 1pz4 h MET 71 Ca 0.01 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1pz4 h MET 71 Cb 0.78 -0.21 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 1pz4 h MET 71 CO 0.04 0.62 0.17 0.35 0.23 0.00 0.00 176.91 178.32 1pz4 h PHE 72 N 0.96 0.35 -0.70 1.39 3.57 -1.05 -0.20 116.94 121.26 1pz4 h PHE 72 Ca 0.37 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.87 1pz4 h PHE 72 Cb 0.18 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 1pz4 h PHE 72 CO -0.03 0.25 0.41 0.00 -2.23 0.00 0.00 178.31 176.71 1pz4 h ALA 73 N 1.07 0.89 -0.14 2.41 0.00 -0.70 -1.41 119.26 121.39 1pz4 h ALA 73 Ca 0.10 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1pz4 h ALA 73 Cb -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1pz4 h ALA 73 CO -0.02 0.38 -0.44 0.82 0.00 0.00 0.00 179.25 179.98 1pz4 h ILE 74 N 0.96 1.35 0.00 0.00 2.04 -0.89 -0.05 117.51 120.92 1pz4 h ILE 74 Ca 0.25 -1.73 -0.01 0.00 1.00 0.00 0.00 64.86 64.37 1pz4 h ILE 74 Cb -0.01 2.07 -0.00 0.00 -0.74 0.00 0.00 36.82 38.14 1pz4 h ILE 74 CO -0.05 0.52 -0.05 1.23 0.00 0.00 0.00 178.15 179.81 1pz4 h GLY 75 N 0.17 0.00 -1.18 5.37 0.00 -0.88 -1.13 103.07 105.43 1pz4 h GLY 75 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1pz4 h GLY 75 CO 0.09 0.00 -0.04 -1.30 0.00 0.00 0.00 176.54 175.29 1pz4 n THR 76 N -3.45 0.00 -0.92 4.70 -2.24 -0.54 -4.94 114.28 106.88 1pz4 n THR 76 Ca -0.02 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1pz4 n THR 76 Cb 0.17 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.43 1pz4 n THR 76 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pz4 n GLY 77 N 1.28 0.52 0.09 3.38 0.00 -0.43 -4.94 105.19 105.10 1pz4 n GLY 77 Ca 0.16 -0.13 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 1pz4 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pz4 h ALA 78 N 0.00 0.50 -3.18 4.61 0.00 -1.23 -3.45 119.26 116.51 1pz4 h ALA 78 Ca 0.00 -0.84 -0.65 0.00 0.00 0.00 0.00 54.91 53.42 1pz4 h ALA 78 Cb 0.00 -0.05 -0.35 0.00 0.00 0.00 0.00 17.79 17.40 1pz4 h ALA 78 CO 0.00 1.10 -0.86 -1.17 0.00 0.00 0.00 179.25 178.32 1pz4 s LEU 79 N -6.52 1.98 0.32 0.00 2.96 -0.81 -4.99 118.68 111.62 1pz4 s LEU 79 Ca 0.01 -0.56 -0.28 0.00 -0.22 0.00 0.00 54.13 53.07 1pz4 s LEU 79 Cb 0.09 -1.34 -0.10 0.00 0.50 0.00 0.00 46.19 45.34 1pz4 s LEU 79 CO 0.80 0.04 1.20 -2.84 -1.32 0.00 0.00 176.35 174.23 1pz4 s PRO 80 N 1.01 4.43 0.21 0.98 0.02 -1.26 -4.26 135.00 136.13 1pz4 s PRO 80 Ca -0.03 1.99 -0.09 0.00 0.02 0.00 0.00 61.00 62.88 1pz4 s PRO 80 Cb -0.15 -3.06 0.25 0.00 0.02 0.00 0.00 34.50 31.57 1pz4 s PRO 80 CO -0.05 -0.04 1.79 0.00 -0.33 0.00 0.00 177.00 178.38 1pz4 h ALA 81 N 3.45 0.88 -0.20 -1.55 0.00 -1.98 -1.73 119.26 118.13 1pz4 h ALA 81 Ca -0.48 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 1pz4 h ALA 81 Cb 1.22 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1pz4 h ALA 81 CO 0.66 -0.01 -0.04 0.87 0.00 0.00 0.00 179.25 180.73 1pz4 h LYS 82 N 0.62 0.29 -0.37 0.00 1.57 -2.00 -1.26 116.57 115.43 1pz4 h LYS 82 Ca 0.30 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.89 1pz4 h LYS 82 Cb 0.24 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1pz4 h LYS 82 CO -0.21 0.35 -0.31 1.49 -0.57 0.00 0.00 179.45 180.21 1pz4 h GLU 83 N 0.29 0.87 -0.87 3.15 4.81 -1.81 -0.97 114.58 120.05 1pz4 h GLU 83 Ca 0.07 -0.44 0.06 0.00 -0.13 0.00 0.00 59.36 58.92 1pz4 h GLU 83 Cb 0.26 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.58 1pz4 h GLU 83 CO 0.01 1.08 0.55 0.00 -0.73 0.00 0.00 179.01 179.92 1pz4 h ALA 84 N 0.77 1.19 -0.45 2.92 0.00 -0.85 -0.87 119.26 121.97 1pz4 h ALA 84 Ca 0.07 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1pz4 h ALA 84 Cb 0.89 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1pz4 h ALA 84 CO 0.08 0.31 -0.13 0.52 0.00 0.00 0.00 179.25 180.03 1pz4 h MET 85 N 1.01 0.89 -0.26 0.00 2.86 -1.06 0.18 114.93 118.54 1pz4 h MET 85 Ca 0.38 -0.35 -0.07 0.00 -2.06 0.00 0.00 59.70 57.60 1pz4 h MET 85 Cb 0.15 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 1pz4 h MET 85 CO -0.17 1.00 -0.12 0.00 1.06 0.00 0.00 176.91 178.68 1pz4 h ALA 86 N 0.86 1.31 -0.35 6.32 0.00 -0.62 -2.71 119.26 124.08 1pz4 h ALA 86 Ca 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1pz4 h ALA 86 Cb 0.68 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1pz4 h ALA 86 CO 0.05 0.46 0.00 1.04 0.00 0.00 0.00 179.25 180.80 1pz4 n GLN 87 N -4.22 2.09 -2.98 0.00 6.02 -0.38 -4.91 117.38 113.01 1pz4 n GLN 87 Ca 0.00 -1.37 -0.22 0.00 -0.01 0.00 0.00 57.00 55.40 1pz4 n GLN 87 Cb 0.31 -1.42 0.03 0.00 1.02 0.00 0.00 30.24 30.18 1pz4 n GLN 87 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1pz4 n ASP 88 N 0.51 -6.13 -0.50 1.08 8.00 -1.02 -4.90 116.55 113.59 1pz4 n ASP 88 Ca 0.13 -0.27 0.11 0.00 0.71 0.00 0.00 54.79 55.47 1pz4 n ASP 88 Cb 0.40 -4.96 0.01 0.00 -0.02 0.00 0.00 41.12 36.55 1pz4 n ASP 88 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1pz4 n LYS 89 N -3.96 1.21 -3.78 -1.24 4.76 0.60 -4.92 118.16 110.83 1pz4 n LYS 89 Ca -0.12 -1.00 -0.13 0.00 -2.87 0.00 0.00 58.31 54.19 1pz4 n LYS 89 Cb 0.63 -1.48 -0.13 0.00 -1.84 0.00 0.00 35.03 32.21 1pz4 n LYS 89 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 1pz4 s MET 90 N -2.48 0.21 -0.05 1.97 1.75 -1.20 -4.35 119.30 115.15 1pz4 s MET 90 Ca 0.19 0.36 0.05 0.00 -1.25 0.00 0.00 55.69 55.04 1pz4 s MET 90 Cb 0.18 0.01 -0.02 0.00 2.84 0.00 0.00 34.83 37.84 1pz4 s MET 90 CO 0.57 -0.08 -0.19 -1.21 -0.65 0.00 0.00 175.02 173.46 1pz4 s GLU 91 N 0.56 2.45 -0.06 4.11 2.02 -0.47 -4.58 118.70 122.74 1pz4 s GLU 91 Ca -0.04 -0.79 0.03 0.00 0.02 0.00 0.00 54.97 54.19 1pz4 s GLU 91 Cb -0.05 -2.27 0.01 0.00 0.10 0.00 0.00 34.13 31.92 1pz4 s GLU 91 CO -0.03 0.55 -0.12 0.08 0.02 0.00 0.00 175.26 175.75 1pz4 s VAL 92 N -0.55 1.12 0.27 2.63 1.01 -1.26 -0.52 120.40 123.10 1pz4 s VAL 92 Ca 0.08 -0.49 0.10 0.00 0.00 0.00 0.00 61.98 61.67 1pz4 s VAL 92 Cb -0.11 -1.01 -0.05 0.00 0.00 0.00 0.00 36.38 35.21 1pz4 s VAL 92 CO 0.01 0.35 -0.06 -1.81 0.00 0.00 0.00 175.10 173.58 1pz4 s ASP 93 N 0.50 4.25 0.00 3.32 -0.00 0.19 -4.95 116.67 119.98 1pz4 s ASP 93 Ca -0.11 -0.77 0.00 0.00 -0.00 0.00 0.00 52.55 51.67 1pz4 s ASP 93 Cb -0.14 -0.67 0.00 0.00 -0.00 0.00 0.00 42.92 42.11 1pz4 s ASP 93 CO 0.03 0.01 0.00 0.61 -0.00 0.00 0.00 175.17 175.82 1pz4 n GLY 94 N -0.81 0.85 3.45 0.21 0.00 -1.26 -1.28 105.19 106.33 1pz4 n GLY 94 Ca -0.06 -1.45 -0.44 0.00 0.00 0.00 0.00 46.02 44.07 1pz4 n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pz4 s GLN 95 N 0.00 3.92 0.21 1.61 -0.21 -0.33 -4.89 119.66 119.98 1pz4 s GLN 95 Ca 0.00 -2.36 -0.10 0.00 0.02 0.00 0.00 55.36 52.92 1pz4 s GLN 95 Cb 0.00 -4.96 0.31 0.00 1.00 0.00 0.00 33.01 29.36 1pz4 s GLN 95 CO 0.00 -1.72 1.68 0.28 -2.12 0.00 0.00 175.29 173.41 1pz4 h VAL 96 N 4.97 0.54 -0.25 1.09 2.07 -1.86 -2.30 116.25 120.51 1pz4 h VAL 96 Ca 0.25 -0.06 0.07 0.00 0.82 0.00 0.00 66.70 67.78 1pz4 h VAL 96 Cb 0.93 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1pz4 h VAL 96 CO 1.17 0.03 0.27 -0.33 0.02 0.00 0.00 177.57 178.73 1pz4 h GLU 97 N 0.17 0.00 -0.05 1.57 3.07 -1.99 -1.33 114.58 116.02 1pz4 h GLU 97 Ca 0.33 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.20 1pz4 h GLU 97 Cb 0.53 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1pz4 h GLU 97 CO -0.49 0.00 0.06 -0.07 -1.40 0.00 0.00 179.01 177.12 1pz4 h LEU 98 N 0.00 0.00 -1.14 1.33 3.38 -1.83 -2.19 115.31 114.86 1pz4 h LEU 98 Ca 0.12 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 1pz4 h LEU 98 Cb 0.66 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1pz4 h LEU 98 CO -0.00 0.00 -0.42 0.16 0.09 0.00 0.00 178.44 178.27 1pz4 h ILE 99 N 0.00 1.25 0.00 1.22 3.07 -1.44 -2.71 117.51 118.90 1pz4 h ILE 99 Ca 0.03 -1.47 -0.02 0.00 1.55 0.00 0.00 64.86 64.95 1pz4 h ILE 99 Cb 0.16 1.80 -0.00 0.00 -0.27 0.00 0.00 36.82 38.51 1pz4 h ILE 99 CO -0.00 0.41 -0.08 -0.26 -1.05 0.00 0.00 178.15 177.18 1pz4 h PHE 100 N 0.00 0.00 0.00 0.16 0.05 -1.57 -1.83 116.94 113.75 1pz4 h PHE 100 Ca -0.00 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.78 1pz4 h PHE 100 Cb 0.77 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.72 1pz4 h PHE 100 CO 0.00 0.08 -0.04 -0.07 -0.18 0.00 0.00 178.31 178.09 1pz4 h LEU 101 N 0.00 0.00 0.00 1.54 3.38 -1.60 -2.77 115.31 115.86 1pz4 h LEU 101 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pz4 h LEU 101 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1pz4 h LEU 101 CO 0.01 0.04 -0.32 0.18 0.09 0.00 0.00 178.44 178.44 1pz4 n LEU 102 N -3.31 0.71 -0.20 1.67 4.77 -0.69 -4.39 117.00 115.57 1pz4 n LEU 102 Ca -0.02 0.38 -0.02 0.00 -0.03 0.00 0.00 56.01 56.32 1pz4 n LEU 102 Cb 0.19 -0.26 0.08 0.00 -2.33 0.00 0.00 43.42 41.11 1pz4 n LEU 102 CO 0.26 -0.10 1.05 -0.33 -1.33 0.00 0.00 177.39 176.94 1pz4 h GLU 103 N 0.00 0.57 0.00 3.23 5.08 -1.62 -1.76 114.58 120.08 1pz4 h GLU 103 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1pz4 h GLU 103 Cb 0.72 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1pz4 h GLU 103 CO 0.00 0.38 0.00 -2.30 -1.00 0.00 0.00 179.01 176.09 1pz4 n PRO 104 N -4.84 0.51 -0.00 2.33 -0.02 -1.26 -2.41 135.00 129.30 1pz4 n PRO 104 Ca 0.07 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.62 1pz4 n PRO 104 Cb 0.17 -1.37 -0.09 0.00 -0.02 0.00 0.00 33.50 32.19 1pz4 n PRO 104 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1pz4 n PHE 105 N -0.87 0.00 -0.26 6.00 3.01 -0.66 -4.56 117.46 120.12 1pz4 n PHE 105 Ca 0.09 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.59 1pz4 n PHE 105 Cb 0.04 -0.08 0.18 0.00 -0.01 0.00 0.00 39.48 39.60 1pz4 n PHE 105 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1pz4 h ILE 106 N 0.00 0.73 0.00 4.37 2.04 -1.48 -1.50 117.51 121.66 1pz4 h ILE 106 Ca 0.00 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 1pz4 h ILE 106 Cb 0.41 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1pz4 h ILE 106 CO 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 178.15 178.24 1pz4 h ALA 107 N 1.51 1.01 -0.00 1.87 0.00 -1.80 -2.00 119.26 119.84 1pz4 h ALA 107 Ca 0.40 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1pz4 h ALA 107 Cb 0.55 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1pz4 h ALA 107 CO -0.35 0.00 -0.05 -1.13 0.00 0.00 0.00 179.25 177.71 1pz4 n SER 108 N -3.10 0.08 -4.73 0.00 3.41 -0.57 -4.83 113.62 103.90 1pz4 n SER 108 Ca -0.02 0.17 -0.41 0.00 -0.26 0.00 0.00 58.87 58.35 1pz4 n SER 108 Cb 0.11 -0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 63.68 1pz4 n SER 108 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1pz4 s LEU 109 N -2.84 4.43 0.00 1.04 1.43 -0.76 -4.99 118.68 116.99 1pz4 s LEU 109 Ca 0.19 2.20 0.22 0.00 -1.03 0.00 0.00 54.13 55.71 1pz4 s LEU 109 Cb 0.19 -3.60 0.17 0.00 0.03 0.00 0.00 46.19 42.98 1pz4 s LEU 109 CO 0.52 -0.41 1.18 0.29 0.23 0.00 0.00 176.35 178.16