#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yz1 n PHE 0 N 0.00 -1.30 -3.79 4.31 3.01 -1.26 -5.04 117.46 113.40 1yz1 n PHE 0 Ca 0.00 0.19 -0.14 0.00 1.01 0.00 0.00 57.45 58.51 1yz1 n PHE 0 Cb 0.00 -1.72 -0.15 0.00 -0.01 0.00 0.00 39.48 37.61 1yz1 n PHE 0 CO 0.00 0.00 0.00 1.41 1.01 0.00 0.00 176.76 179.18 1yz1 s MET 1 N -3.67 0.05 -0.13 -1.08 1.75 -1.26 -4.98 119.30 109.97 1yz1 s MET 1 Ca 0.58 0.23 -0.03 0.00 -1.25 0.00 0.00 55.69 55.21 1yz1 s MET 1 Cb -0.18 -0.13 -0.03 0.00 2.84 0.00 0.00 34.83 37.32 1yz1 s MET 1 CO 0.66 -0.12 -0.01 0.42 -0.65 0.00 0.00 175.02 175.32 1yz1 s ILE 2 N 0.79 4.13 -0.15 10.11 1.01 -1.26 -2.19 121.20 133.63 1yz1 s ILE 2 Ca -0.06 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.24 1yz1 s ILE 2 Cb -0.09 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.56 1yz1 s ILE 2 CO -0.03 0.53 0.03 -0.63 0.00 0.00 0.00 174.94 174.84 1yz1 s ILE 3 N -0.08 4.50 -0.25 2.92 1.01 0.22 -0.66 121.20 128.87 1yz1 s ILE 3 Ca 0.03 -0.15 -0.08 0.00 0.00 0.00 0.00 60.65 60.45 1yz1 s ILE 3 Cb -0.13 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 1yz1 s ILE 3 CO 0.02 0.51 0.10 -0.31 0.00 0.00 0.00 174.94 175.25 1yz1 s TYR 4 N 0.05 3.12 0.02 3.97 1.51 0.46 -0.50 117.35 125.98 1yz1 s TYR 4 Ca 0.04 -0.27 0.04 0.00 -1.01 0.00 0.00 57.07 55.86 1yz1 s TYR 4 Cb -0.13 -2.26 -0.03 0.00 -0.11 0.00 0.00 41.96 39.43 1yz1 s TYR 4 CO 0.01 -0.28 -0.08 0.50 -1.11 0.00 0.00 175.55 174.59 1yz1 s ARG 5 N 1.57 2.46 -0.18 -0.62 3.52 -0.34 -0.45 118.95 124.92 1yz1 s ARG 5 Ca 0.06 -0.78 -0.29 0.00 -0.13 0.00 0.00 55.73 54.59 1yz1 s ARG 5 Cb -0.15 -2.45 -0.04 0.00 -1.56 0.00 0.00 34.95 30.75 1yz1 s ARG 5 CO 0.05 0.59 1.79 0.34 -0.81 0.00 0.00 175.30 177.25 1yz1 s ASP 6 N -1.50 6.20 0.52 -2.12 -1.08 0.75 -1.04 116.67 118.40 1yz1 s ASP 6 Ca 0.17 1.82 0.20 0.00 -0.52 0.00 0.00 52.55 54.22 1yz1 s ASP 6 Cb -0.11 -2.53 1.30 0.00 -1.46 0.00 0.00 42.92 40.12 1yz1 s ASP 6 CO 0.08 -1.37 2.08 0.25 0.52 0.00 0.00 175.17 176.72 1yz1 h LEU 7 N 12.22 0.03 0.01 -1.34 5.85 -1.15 0.58 115.31 131.51 1yz1 h LEU 7 Ca -0.37 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.14 1yz1 h LEU 7 Cb 1.18 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 1yz1 h LEU 7 CO 0.99 0.02 -1.09 0.40 -0.34 0.00 0.00 178.44 178.41 1yz1 h ILE 8 N 0.03 1.05 0.00 4.05 1.08 -1.90 -3.41 117.51 118.42 1yz1 h ILE 8 Ca 0.12 -2.23 0.00 0.00 -0.39 0.00 0.00 64.86 62.37 1yz1 h ILE 8 Cb 0.44 2.45 0.00 0.00 -3.07 0.00 0.00 36.82 36.64 1yz1 h ILE 8 CO -0.01 0.40 -0.97 -1.54 -0.69 0.00 0.00 178.15 175.35 1yz1 n SER 9 N -4.39 0.62 0.00 1.72 3.41 -1.18 -4.96 113.62 108.83 1yz1 n SER 9 Ca -0.28 -0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 1yz1 n SER 9 Cb 0.68 0.70 0.00 0.00 -0.26 0.00 0.00 64.21 65.33 1yz1 n SER 9 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1yz1 n HIS 10 N -1.99 0.00 -2.30 7.33 8.25 0.20 -4.99 115.22 121.72 1yz1 n HIS 10 Ca 0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.12 1yz1 n HIS 10 Cb 0.44 -0.60 -0.01 0.00 1.12 0.00 0.00 29.99 30.94 1yz1 n HIS 10 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1yz1 s ASP 11 N -2.32 6.10 0.01 0.41 1.01 -1.25 -4.65 116.67 115.98 1yz1 s ASP 11 Ca 0.00 2.23 -0.30 0.00 0.71 0.00 0.00 52.55 55.18 1yz1 s ASP 11 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 1yz1 s ASP 11 CO 0.00 -0.96 1.08 -0.70 0.21 0.00 0.00 175.17 174.81 1yz1 s GLU 12 N -2.88 4.48 -0.25 8.23 2.12 -1.26 -0.18 118.70 128.97 1yz1 s GLU 12 Ca 0.66 1.57 -0.04 0.00 0.36 0.00 0.00 54.97 57.52 1yz1 s GLU 12 Cb -0.26 -3.43 -0.14 0.00 0.26 0.00 0.00 34.13 30.56 1yz1 s GLU 12 CO 0.31 -0.19 -0.27 -1.33 -0.54 0.00 0.00 175.26 173.25 1yz1 n MET 13 N 4.12 0.59 -3.89 4.30 2.81 0.40 -4.72 117.12 120.72 1yz1 n MET 13 Ca 0.08 0.18 -0.03 0.00 -1.81 0.00 0.00 57.70 56.12 1yz1 n MET 13 Cb 0.49 -1.47 0.02 0.00 -0.71 0.00 0.00 33.22 31.55 1yz1 n MET 13 CO 0.00 0.00 0.00 -0.59 1.51 0.00 0.00 175.97 176.89 1yz1 s PHE 14 N -2.49 0.08 0.26 2.03 -0.71 -1.15 -4.82 117.98 111.18 1yz1 s PHE 14 Ca -0.35 -0.48 0.01 0.00 -1.04 0.00 0.00 56.93 55.08 1yz1 s PHE 14 Cb 0.11 0.70 -0.04 0.00 -1.21 0.00 0.00 43.02 42.58 1yz1 s PHE 14 CO 0.52 -0.92 0.13 -1.54 -1.34 0.00 0.00 175.22 172.07 1yz1 s SER 15 N -3.44 0.98 -0.14 1.98 1.04 -1.26 -0.41 113.70 112.45 1yz1 s SER 15 Ca 0.23 -1.45 -0.00 0.00 0.48 0.00 0.00 55.95 55.20 1yz1 s SER 15 Cb -0.03 0.31 0.13 0.00 0.10 0.00 0.00 66.02 66.53 1yz1 s SER 15 CO 0.05 -0.82 1.75 -0.90 0.98 0.00 0.00 173.24 174.30 1yz1 n ASP 16 N -0.58 5.03 -0.88 7.02 5.75 0.17 -3.89 116.55 129.16 1yz1 n ASP 16 Ca 0.01 -2.63 0.09 0.00 -0.01 0.00 0.00 54.79 52.26 1yz1 n ASP 16 Cb 0.66 -0.93 0.25 0.00 -1.03 0.00 0.00 41.12 40.07 1yz1 n ASP 16 CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 1yz1 n ILE 17 N 0.65 0.55 -4.55 2.12 -5.35 -1.26 -4.88 119.36 106.65 1yz1 n ILE 17 Ca 0.15 -0.61 -0.25 0.00 -0.27 0.00 0.00 62.75 61.76 1yz1 n ILE 17 Cb 0.62 0.44 -0.11 0.00 -1.74 0.00 0.00 39.64 38.85 1yz1 n ILE 17 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1yz1 s TYR 18 N -1.45 2.32 -0.20 4.28 2.02 -1.25 -5.09 117.35 117.98 1yz1 s TYR 18 Ca 0.34 -0.68 -0.29 0.00 -0.37 0.00 0.00 57.07 56.06 1yz1 s TYR 18 Cb 0.18 -1.51 -0.01 0.00 -0.40 0.00 0.00 41.96 40.23 1yz1 s TYR 18 CO 0.25 0.38 1.20 0.21 -1.57 0.00 0.00 175.55 176.02 1yz1 s LYS 19 N -3.72 4.22 -0.11 -0.62 2.20 -1.26 -4.94 119.74 115.52 1yz1 s LYS 19 Ca 0.34 1.54 0.02 0.00 -0.36 0.00 0.00 55.97 57.51 1yz1 s LYS 19 Cb 0.07 -3.73 -0.01 0.00 -1.51 0.00 0.00 37.83 32.65 1yz1 s LYS 19 CO 0.16 -0.71 -0.17 0.42 -0.36 0.00 0.00 175.35 174.70 1yz1 s ILE 20 N 3.46 2.75 -0.00 5.43 1.01 -1.26 -1.69 121.20 130.90 1yz1 s ILE 20 Ca 0.51 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 60.43 1yz1 s ILE 20 Cb -0.19 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.15 1yz1 s ILE 20 CO 0.12 0.54 -0.16 -0.13 0.00 0.00 0.00 174.94 175.32 1yz1 s ARG 21 N 0.17 1.24 -0.14 2.79 1.81 -0.34 -4.97 118.95 119.51 1yz1 s ARG 21 Ca -0.09 -0.62 -0.22 0.00 -1.72 0.00 0.00 55.73 53.08 1yz1 s ARG 21 Cb -0.16 -1.22 -0.03 0.00 -0.45 0.00 0.00 34.95 33.10 1yz1 s ARG 21 CO 0.06 0.33 0.67 -2.00 -0.68 0.00 0.00 175.30 173.67 1yz1 s GLU 22 N -0.53 4.31 0.42 3.54 2.12 -1.26 -0.03 118.70 127.28 1yz1 s GLU 22 Ca 0.06 0.75 0.04 0.00 0.36 0.00 0.00 54.97 56.17 1yz1 s GLU 22 Cb -0.06 -3.52 -0.02 0.00 0.26 0.00 0.00 34.13 30.78 1yz1 s GLU 22 CO -0.00 -0.11 0.11 0.96 -0.54 0.00 0.00 175.26 175.68 1yz1 s ILE 23 N 1.44 0.68 -1.29 -3.70 -4.36 -0.19 -4.77 121.20 109.01 1yz1 s ILE 23 Ca 0.33 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.71 1yz1 s ILE 23 Cb -0.16 -2.34 -0.00 0.00 1.25 0.00 0.00 42.46 41.21 1yz1 s ILE 23 CO 0.13 0.00 0.71 0.00 0.24 0.00 0.00 174.94 176.02 1yz1 n ALA 24 N -0.95 -2.04 -4.03 2.27 0.00 -1.26 -2.21 120.51 112.28 1yz1 n ALA 24 Ca -0.07 -0.16 -0.33 0.00 0.00 0.00 0.00 53.44 52.88 1yz1 n ALA 24 Cb 0.65 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 18.02 1yz1 n ALA 24 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1yz1 n ASP 25 N -3.05 -4.21 0.00 0.00 9.92 -1.26 -1.41 116.55 116.54 1yz1 n ASP 25 Ca -0.29 -0.87 0.00 0.00 -0.53 0.00 0.00 54.79 53.10 1yz1 n ASP 25 Cb 0.68 -3.39 0.00 0.00 -0.64 0.00 0.00 41.12 37.77 1yz1 n ASP 25 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1yz1 n GLY 26 N -1.55 0.91 0.09 0.44 0.00 -0.97 -4.95 105.19 99.16 1yz1 n GLY 26 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 1yz1 n GLY 26 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1yz1 h LEU 27 N 0.00 0.19 -8.86 0.99 5.85 -1.02 -3.45 115.31 109.02 1yz1 h LEU 27 Ca 0.00 -0.19 -0.41 0.00 0.84 0.00 0.00 57.88 58.13 1yz1 h LEU 27 Cb 0.00 -0.06 -0.14 0.00 0.37 0.00 0.00 40.66 40.83 1yz1 h LEU 27 CO 0.00 1.10 -0.71 0.00 -0.34 0.00 0.00 178.44 178.49 1yz1 s LEU 29 N -3.29 2.45 -0.25 0.00 1.43 0.06 -1.02 118.68 118.05 1yz1 s LEU 29 Ca 0.23 -0.47 -0.08 0.00 -1.03 0.00 0.00 54.13 52.78 1yz1 s LEU 29 Cb 0.02 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 1yz1 s LEU 29 CO 0.06 0.10 0.10 -0.70 0.23 0.00 0.00 176.35 176.14 1yz1 s GLU 30 N 0.72 3.73 -0.25 1.70 2.12 0.96 -1.40 118.70 126.29 1yz1 s GLU 30 Ca -0.07 -0.44 -0.05 0.00 0.36 0.00 0.00 54.97 54.77 1yz1 s GLU 30 Cb -0.16 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 30.84 1yz1 s GLU 30 CO 0.01 -0.18 0.01 0.08 -0.54 0.00 0.00 175.26 174.65 1yz1 s VAL 31 N 1.61 3.67 -0.04 3.70 1.01 0.51 -1.20 120.40 129.66 1yz1 s VAL 31 Ca 0.06 -0.52 -0.19 0.00 0.00 0.00 0.00 61.98 61.34 1yz1 s VAL 31 Cb -0.15 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 1yz1 s VAL 31 CO 0.05 0.30 0.55 -0.70 0.00 0.00 0.00 175.10 175.30 1yz1 s GLU 32 N 1.50 4.29 0.00 2.72 2.12 -0.68 -0.16 118.70 128.49 1yz1 s GLU 32 Ca 0.05 0.62 0.00 0.00 0.36 0.00 0.00 54.97 56.00 1yz1 s GLU 32 Cb -0.15 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 30.87 1yz1 s GLU 32 CO -0.01 0.32 0.00 0.41 -0.54 0.00 0.00 175.26 175.44 1yz1 n GLY 33 N 2.67 7.36 3.22 -1.50 0.00 0.05 -4.05 105.19 112.95 1yz1 n GLY 33 Ca -0.07 -1.96 -0.13 0.00 0.00 0.00 0.00 46.02 43.85 1yz1 n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yz1 s LYS 34 N 1.13 0.63 0.13 1.61 1.02 -1.26 -4.32 119.74 118.68 1yz1 s LYS 34 Ca 0.00 -0.18 -0.30 0.00 0.02 0.00 0.00 55.97 55.51 1yz1 s LYS 34 Cb 0.00 0.28 -0.06 0.00 -0.52 0.00 0.00 37.83 37.53 1yz1 s LYS 34 CO 0.00 -0.17 1.02 -1.64 -0.92 0.00 0.00 175.35 173.64 1yz1 s MET 35 N -1.26 4.65 -0.15 1.68 -1.94 -1.26 -1.06 119.30 119.96 1yz1 s MET 35 Ca -0.13 1.55 -0.01 0.00 -1.71 0.00 0.00 55.69 55.39 1yz1 s MET 35 Cb -0.05 -3.34 0.04 0.00 2.01 0.00 0.00 34.83 33.48 1yz1 s MET 35 CO 0.04 0.14 -0.03 0.08 -0.01 0.00 0.00 175.02 175.24 1yz1 s VAL 36 N -0.00 0.89 -1.12 -6.03 1.01 0.20 -4.89 120.40 110.46 1yz1 s VAL 36 Ca 0.48 -0.49 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 1yz1 s VAL 36 Cb -0.26 -1.12 0.28 0.00 0.00 0.00 0.00 36.38 35.29 1yz1 s VAL 36 CO 0.31 0.10 1.61 -1.54 0.00 0.00 0.00 175.10 175.58 1yz1 n SER 37 N 4.95 6.32 -3.11 3.32 3.41 -1.26 -1.25 113.62 125.99 1yz1 n SER 37 Ca -0.11 -3.38 -0.20 0.00 -0.26 0.00 0.00 58.87 54.92 1yz1 n SER 37 Cb 0.48 -1.30 -0.03 0.00 -0.26 0.00 0.00 64.21 63.10 1yz1 n SER 37 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1yz1 n ARG 38 N 1.65 1.61 -1.66 4.33 5.12 -1.26 -4.66 116.66 121.79 1yz1 n ARG 38 Ca 0.31 -3.79 -0.01 0.00 -1.93 0.00 0.00 57.85 52.43 1yz1 n ARG 38 Cb 0.33 -1.85 -0.01 0.00 -1.16 0.00 0.00 32.46 29.77 1yz1 n ARG 38 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 1yz1 n ILE 67 N 0.13 -4.36 -2.13 0.55 2.08 -1.26 -5.12 119.36 109.25 1yz1 n ILE 67 Ca 0.26 0.39 -0.36 0.00 0.56 0.00 0.00 62.75 63.61 1yz1 n ILE 67 Cb 0.59 -3.97 0.02 0.00 -0.75 0.00 0.00 39.64 35.53 1yz1 n ILE 67 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 1yz1 s THR 68 N -0.10 2.86 0.00 1.39 2.01 -1.26 -4.86 115.64 115.68 1yz1 s THR 68 Ca -0.04 0.55 0.00 0.00 0.31 0.00 0.00 61.69 62.51 1yz1 s THR 68 Cb 0.00 -3.23 0.00 0.00 0.01 0.00 0.00 72.50 69.28 1yz1 s THR 68 CO 0.11 -0.10 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 1yz1 n GLY 69 N 0.38 1.68 3.72 4.40 0.00 -0.38 -4.90 105.19 110.09 1yz1 n GLY 69 Ca 0.12 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 1yz1 n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yz1 s VAL 70 N -2.00 4.59 0.21 1.61 1.01 -1.26 0.62 120.40 125.18 1yz1 s VAL 70 Ca 0.00 1.98 -0.09 0.00 0.00 0.00 0.00 61.98 63.87 1yz1 s VAL 70 Cb 0.00 -4.27 0.15 0.00 0.00 0.00 0.00 36.38 32.27 1yz1 s VAL 70 CO 0.00 0.22 1.81 -2.24 0.00 0.00 0.00 175.10 174.89 1yz1 h ASP 71 N 6.24 0.56 -0.44 3.32 2.03 -1.44 -1.62 116.42 125.08 1yz1 h ASP 71 Ca -0.42 0.03 0.05 0.00 -0.73 0.00 0.00 57.03 55.97 1yz1 h ASP 71 Cb 1.22 -0.08 -0.05 0.00 -0.83 0.00 0.00 39.33 39.59 1yz1 h ASP 71 CO 0.74 0.36 0.16 0.40 -1.03 0.00 0.00 179.24 179.87 1yz1 h ILE 72 N 0.70 0.87 -0.18 4.15 2.04 -1.93 0.13 117.51 123.29 1yz1 h ILE 72 Ca 0.31 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 66.05 1yz1 h ILE 72 Cb 0.21 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1yz1 h ILE 72 CO -0.19 0.06 0.08 0.58 0.00 0.00 0.00 178.15 178.68 1yz1 h VAL 73 N 0.33 1.14 -0.46 1.67 2.07 -1.81 -2.48 116.25 116.71 1yz1 h VAL 73 Ca 0.20 -0.42 -0.12 0.00 0.82 0.00 0.00 66.70 67.18 1yz1 h VAL 73 Cb 0.19 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1yz1 h VAL 73 CO -0.20 0.14 -0.17 0.24 0.02 0.00 0.00 177.57 177.59 1yz1 h MET 74 N 0.15 0.93 -0.26 1.57 2.86 -1.12 -1.19 114.93 117.87 1yz1 h MET 74 Ca 0.06 -0.39 -0.05 0.00 -2.06 0.00 0.00 59.70 57.26 1yz1 h MET 74 Cb 0.14 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 1yz1 h MET 74 CO -0.01 1.05 -0.07 -0.91 1.06 0.00 0.00 176.91 178.03 1yz1 h ASN 75 N 0.78 0.39 -0.24 1.22 2.35 -0.68 -3.10 115.58 116.29 1yz1 h ASN 75 Ca 0.11 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1yz1 h ASN 75 Cb 0.74 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.01 1yz1 h ASN 75 CO 0.06 0.50 0.00 1.41 -1.65 0.00 0.00 177.43 177.75 1yz1 n HIS 76 N -4.27 0.57 -3.90 1.19 8.25 -0.94 -4.99 115.22 111.13 1yz1 n HIS 76 Ca 0.00 -0.71 -0.29 0.00 -0.26 0.00 0.00 57.72 56.47 1yz1 n HIS 76 Cb 0.26 -0.16 0.02 0.00 1.12 0.00 0.00 29.99 31.23 1yz1 n HIS 76 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1yz1 n HIS 77 N -0.21 -2.15 -2.44 4.41 8.25 -0.59 -4.58 115.22 117.91 1yz1 n HIS 77 Ca 0.15 0.88 -0.36 0.00 -0.26 0.00 0.00 57.72 58.13 1yz1 n HIS 77 Cb 0.63 -3.97 -0.03 0.00 1.12 0.00 0.00 29.99 27.74 1yz1 n HIS 77 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1yz1 s LEU 78 N -7.15 3.97 -0.16 2.41 1.43 -0.55 -3.60 118.68 115.03 1yz1 s LEU 78 Ca 0.50 2.09 -0.02 0.00 -1.03 0.00 0.00 54.13 55.67 1yz1 s LEU 78 Cb -0.26 -4.36 -0.02 0.00 0.03 0.00 0.00 46.19 41.59 1yz1 s LEU 78 CO 0.84 -0.77 -0.09 -1.10 0.23 0.00 0.00 176.35 175.46 1yz1 s GLN 79 N -2.86 3.44 0.32 1.70 -1.52 0.29 -4.84 119.66 116.19 1yz1 s GLN 79 Ca 0.64 -0.64 -0.28 0.00 -1.95 0.00 0.00 55.36 53.13 1yz1 s GLN 79 Cb -0.22 -2.79 -0.09 0.00 -0.22 0.00 0.00 33.01 29.69 1yz1 s GLN 79 CO 0.27 0.11 1.13 -2.00 -0.25 0.00 0.00 175.29 174.54 1yz1 s GLU 80 N 0.66 4.46 0.31 2.91 2.12 -1.26 -0.82 118.70 127.08 1yz1 s GLU 80 Ca -0.05 1.82 0.05 0.00 0.36 0.00 0.00 54.97 57.15 1yz1 s GLU 80 Cb -0.15 -3.02 -0.02 0.00 0.26 0.00 0.00 34.13 31.20 1yz1 s GLU 80 CO 0.02 0.05 0.16 -2.37 -0.54 0.00 0.00 175.26 172.59 1yz1 n THR 81 N 0.83 0.00 -4.04 -1.70 5.66 0.52 -4.92 114.28 110.63 1yz1 n THR 81 Ca 0.01 -1.96 -0.08 0.00 -3.05 0.00 0.00 64.05 58.97 1yz1 n THR 81 Cb 0.45 0.82 -0.10 0.00 -1.55 0.00 0.00 70.33 69.95 1yz1 n THR 81 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1yz1 s SER 82 N -2.99 0.40 -0.00 1.09 1.04 -1.26 -4.17 113.70 107.81 1yz1 s SER 82 Ca 0.23 -0.87 -0.08 0.00 0.48 0.00 0.00 55.95 55.71 1yz1 s SER 82 Cb 0.01 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1yz1 s SER 82 CO 0.16 -0.57 0.15 -0.36 0.98 0.00 0.00 173.24 173.61 1yz1 s PHE 83 N -3.51 0.01 0.44 5.02 0.40 -1.26 -5.06 117.98 114.02 1yz1 s PHE 83 Ca 0.03 -0.08 -0.07 0.00 -0.60 0.00 0.00 56.93 56.21 1yz1 s PHE 83 Cb 0.05 -0.03 -0.05 0.00 0.51 0.00 0.00 43.02 43.50 1yz1 s PHE 83 CO -0.09 -0.29 0.76 0.95 0.70 0.00 0.00 175.22 177.26 1yz1 s THR 84 N -1.32 4.87 0.22 0.64 -4.23 -1.26 -4.91 115.64 109.64 1yz1 s THR 84 Ca -0.14 0.35 -0.09 0.00 -1.18 0.00 0.00 61.69 60.63 1yz1 s THR 84 Cb -0.07 -3.80 0.18 0.00 1.34 0.00 0.00 72.50 70.14 1yz1 s THR 84 CO 0.02 -0.68 1.85 0.50 -0.54 0.00 0.00 174.62 175.76 1yz1 h LYS 85 N 0.73 1.13 -0.45 3.99 3.64 -2.00 -0.52 116.57 123.09 1yz1 h LYS 85 Ca -0.47 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 58.72 1yz1 h LYS 85 Cb 1.20 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1yz1 h LYS 85 CO 0.63 0.82 0.01 0.93 -2.27 0.00 0.00 179.45 179.57 1yz1 h GLU 86 N 1.13 0.73 -0.34 1.90 4.39 -1.99 0.44 114.58 120.84 1yz1 h GLU 86 Ca 0.29 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.70 1yz1 h GLU 86 Cb 0.00 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 1yz1 h GLU 86 CO -0.05 0.74 -0.23 0.00 -1.16 0.00 0.00 179.01 178.31 1yz1 h ALA 87 N 1.33 0.48 -0.65 3.43 0.00 -1.80 -2.77 119.26 119.27 1yz1 h ALA 87 Ca 0.14 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 1yz1 h ALA 87 Cb 0.40 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1yz1 h ALA 87 CO 0.01 0.45 0.16 -0.92 0.00 0.00 0.00 179.25 178.96 1yz1 h TYR 88 N 0.52 1.10 -0.59 0.00 3.20 -0.72 -1.80 116.97 118.67 1yz1 h TYR 88 Ca 0.07 -0.13 0.05 0.00 3.14 0.00 0.00 58.73 61.85 1yz1 h TYR 88 Cb 0.78 -0.31 -0.05 0.00 1.54 0.00 0.00 36.73 38.70 1yz1 h TYR 88 CO 0.06 0.91 0.33 -0.22 -1.64 0.00 0.00 178.16 177.60 1yz1 h LYS 89 N 0.97 0.61 -0.43 1.82 3.64 -0.86 0.10 116.57 122.41 1yz1 h LYS 89 Ca 0.20 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1yz1 h LYS 89 Cb 0.36 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1yz1 h LYS 89 CO 0.00 0.40 0.04 -0.22 -2.27 0.00 0.00 179.45 177.40 1yz1 h LYS 90 N 0.63 0.74 0.15 1.90 3.64 -1.26 -2.99 116.57 119.39 1yz1 h LYS 90 Ca 0.26 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1yz1 h LYS 90 Cb 0.13 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1yz1 h LYS 90 CO -0.15 0.79 -0.07 -0.92 -2.27 0.00 0.00 179.45 176.82 1yz1 h TYR 91 N 0.58 -0.19 -0.02 1.91 3.20 -0.54 -2.88 116.97 119.03 1yz1 h TYR 91 Ca 0.13 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.90 1yz1 h TYR 91 Cb 0.43 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1yz1 h TYR 91 CO 0.03 -0.09 -0.41 -0.84 -1.64 0.00 0.00 178.16 175.22 1yz1 h ILE 92 N -0.24 1.30 -0.27 1.81 -0.00 -1.05 0.18 117.51 119.23 1yz1 h ILE 92 Ca -0.02 -1.41 -0.03 0.00 -0.00 0.00 0.00 64.86 63.39 1yz1 h ILE 92 Cb 0.19 1.74 -0.01 0.00 -0.00 0.00 0.00 36.82 38.74 1yz1 h ILE 92 CO 0.03 0.41 0.04 0.11 -0.00 0.00 0.00 178.15 178.74 1yz1 h LYS 93 N 0.03 0.45 -0.53 0.16 1.57 -1.54 0.17 116.57 116.88 1yz1 h LYS 93 Ca -0.00 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.55 1yz1 h LYS 93 Cb 0.73 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 1yz1 h LYS 93 CO 0.05 0.57 -0.08 -0.44 -0.57 0.00 0.00 179.45 178.98 1yz1 h ASP 94 N 0.25 0.96 -0.26 0.86 3.32 -1.27 -1.48 116.42 118.80 1yz1 h ASP 94 Ca 0.08 -0.30 -0.03 0.00 0.02 0.00 0.00 57.03 56.80 1yz1 h ASP 94 Cb 0.35 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1yz1 h ASP 94 CO 0.01 1.07 0.06 0.22 -1.72 0.00 0.00 179.24 178.87 1yz1 h TYR 95 N 0.87 0.44 -0.46 4.55 3.20 -0.47 -1.42 116.97 123.68 1yz1 h TYR 95 Ca 0.14 -0.05 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 1yz1 h TYR 95 Cb 0.63 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 1yz1 h TYR 95 CO 0.04 0.51 0.04 1.98 -1.64 0.00 0.00 178.16 179.09 1yz1 h MET 96 N 0.24 0.74 -0.19 1.82 4.05 -0.58 -1.64 114.93 119.36 1yz1 h MET 96 Ca 0.08 -0.17 -0.06 0.00 -0.28 0.00 0.00 59.70 59.26 1yz1 h MET 96 Cb 0.30 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.98 1yz1 h MET 96 CO 0.00 0.73 -0.16 0.87 0.23 0.00 0.00 176.91 178.58 1yz1 h LYS 97 N 0.70 0.32 -0.15 0.39 1.79 -1.07 0.08 116.57 118.64 1yz1 h LYS 97 Ca 0.14 -0.09 -0.14 0.00 -2.18 0.00 0.00 60.65 58.39 1yz1 h LYS 97 Cb 0.38 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.98 1yz1 h LYS 97 CO 0.01 0.48 -0.51 0.66 -1.08 0.00 0.00 179.45 179.01 1yz1 h SER 98 N 0.30 0.45 0.09 0.86 4.64 -0.38 -1.80 113.55 117.71 1yz1 h SER 98 Ca 0.06 -0.23 -0.15 0.00 -0.47 0.00 0.00 61.79 61.00 1yz1 h SER 98 Cb 0.46 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 1yz1 h SER 98 CO 0.03 0.88 -0.52 0.40 -0.87 0.00 0.00 176.83 176.75 1yz1 h ILE 99 N 0.32 1.33 -0.93 0.95 1.08 -0.65 -2.72 117.51 116.88 1yz1 h ILE 99 Ca 0.01 -1.77 0.00 0.00 -0.39 0.00 0.00 64.86 62.72 1yz1 h ILE 99 Cb 1.01 1.77 -0.05 0.00 -3.07 0.00 0.00 36.82 36.48 1yz1 h ILE 99 CO 0.09 0.54 0.60 0.50 -0.69 0.00 0.00 178.15 179.19 1yz1 h LYS 100 N 0.37 1.24 -0.95 2.37 3.64 -0.65 -1.37 116.57 121.22 1yz1 h LYS 100 Ca 0.01 -0.09 0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1yz1 h LYS 100 Cb 1.04 -0.27 -0.05 0.00 -0.41 0.00 0.00 32.23 32.54 1yz1 h LYS 100 CO 0.09 0.84 0.63 0.78 -2.27 0.00 0.00 179.45 179.52 1yz1 h GLY 101 N 1.27 1.35 1.25 5.01 0.00 -1.04 -0.89 103.07 110.01 1yz1 h GLY 101 Ca 0.34 -0.49 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 1yz1 h GLY 101 CO -0.07 0.47 -0.08 0.50 0.00 0.00 0.00 176.54 177.36 1yz1 h LYS 102 N 1.27 0.89 -0.52 4.80 1.79 -1.09 -2.96 116.57 120.75 1yz1 h LYS 102 Ca 0.36 -0.30 -0.12 0.00 -2.18 0.00 0.00 60.65 58.41 1yz1 h LYS 102 Cb -0.11 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.45 1yz1 h LYS 102 CO -0.09 0.94 -0.15 -0.07 -1.08 0.00 0.00 179.45 179.00 1yz1 h LEU 103 N 0.81 1.03 -1.99 2.94 3.38 -0.75 0.14 115.31 120.86 1yz1 h LEU 103 Ca 0.14 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1yz1 h LEU 103 Cb 0.60 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1yz1 h LEU 103 CO 0.04 1.16 -0.02 -0.33 0.09 0.00 0.00 178.44 179.37 1yz1 h GLU 104 N 0.89 0.00 0.00 1.13 5.08 -1.05 0.67 114.58 121.30 1yz1 h GLU 104 Ca 0.13 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.40 1yz1 h GLU 104 Cb 0.72 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1yz1 h GLU 104 CO 0.06 0.02 -0.54 1.49 -1.00 0.00 0.00 179.01 179.04 1yz1 h GLU 105 N 0.00 0.00 0.00 2.33 4.81 -1.33 -3.39 114.58 117.00 1yz1 h GLU 105 Ca -0.00 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.02 1yz1 h GLU 105 Cb 0.04 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.39 1yz1 h GLU 105 CO 0.00 0.80 -1.87 1.04 -0.73 0.00 0.00 179.01 178.26 1yz1 n GLN 106 N -4.56 0.65 -2.96 1.92 6.02 0.46 -4.73 117.38 114.18 1yz1 n GLN 106 Ca -0.17 0.07 -0.15 0.00 -0.01 0.00 0.00 57.00 56.73 1yz1 n GLN 106 Cb 0.49 -1.65 -0.00 0.00 1.02 0.00 0.00 30.24 30.09 1yz1 n GLN 106 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1yz1 n ARG 107 N -2.72 0.78 -0.23 -1.09 1.74 0.21 -5.01 116.66 110.34 1yz1 n ARG 107 Ca -0.17 -2.49 0.24 0.00 -0.77 0.00 0.00 57.85 54.66 1yz1 n ARG 107 Cb 0.90 -1.35 0.60 0.00 -1.02 0.00 0.00 32.46 31.59 1yz1 n ARG 107 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1yz1 h PRO 108 N 3.85 0.23 0.00 5.56 0.13 -1.22 -0.21 132.00 140.33 1yz1 h PRO 108 Ca -0.04 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1yz1 h PRO 108 Cb 0.97 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1yz1 h PRO 108 CO 0.38 0.15 0.00 1.05 -0.23 0.00 0.00 178.00 179.35 1yz1 h GLU 109 N 0.24 0.00 0.00 0.86 9.09 -1.95 -2.75 114.58 120.07 1yz1 h GLU 109 Ca 0.47 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.88 1yz1 h GLU 109 Cb 1.45 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.55 1yz1 h GLU 109 CO -0.12 0.00 -0.27 -0.09 0.05 0.00 0.00 179.01 178.58 1yz1 h ARG 110 N 0.00 0.00 -0.07 1.06 9.65 -1.36 -3.39 114.38 120.27 1yz1 h ARG 110 Ca 0.00 0.00 0.04 0.00 -1.10 0.00 0.00 59.98 58.92 1yz1 h ARG 110 Cb 0.48 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.01 1yz1 h ARG 110 CO 0.00 0.00 -0.20 0.28 2.80 0.00 0.00 179.97 182.85 1yz1 h VAL 111 N 0.00 0.51 0.61 0.20 2.07 -1.56 -1.37 116.25 116.71 1yz1 h VAL 111 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1yz1 h VAL 111 Cb 0.87 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1yz1 h VAL 111 CO 0.00 0.00 -0.34 0.50 0.02 0.00 0.00 177.57 177.75 1yz1 h LYS 112 N -0.29 -0.85 -0.21 1.57 1.63 -1.80 -0.03 116.57 116.59 1yz1 h LYS 112 Ca 0.08 0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.91 1yz1 h LYS 112 Cb 0.40 0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 32.21 1yz1 h LYS 112 CO -0.24 -0.57 0.00 -1.00 -3.45 0.00 0.00 179.45 174.20 1yz1 h PRO 113 N -0.88 0.31 0.03 1.90 0.13 -1.81 -1.49 132.00 130.18 1yz1 h PRO 113 Ca -0.08 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 65.00 1yz1 h PRO 113 Cb 0.70 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1yz1 h PRO 113 CO 0.11 0.33 -0.01 0.35 -0.23 0.00 0.00 178.00 178.54 1yz1 h PHE 114 N 0.30 -0.04 -0.64 1.56 3.57 -1.00 -1.25 116.94 119.45 1yz1 h PHE 114 Ca 0.07 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 1yz1 h PHE 114 Cb 0.20 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.93 1yz1 h PHE 114 CO 0.00 0.03 0.26 0.52 -2.23 0.00 0.00 178.31 176.90 1yz1 h MET 115 N -0.10 0.95 -0.39 1.11 2.86 -0.47 0.35 114.93 119.25 1yz1 h MET 115 Ca -0.00 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 1yz1 h MET 115 Cb 0.09 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 1yz1 h MET 115 CO 0.01 0.80 0.09 1.15 1.06 0.00 0.00 176.91 180.02 1yz1 h THR 116 N 0.90 1.23 -0.43 2.22 2.02 -1.29 -1.27 112.91 116.28 1yz1 h THR 116 Ca 0.21 -0.78 -0.12 0.00 0.77 0.00 0.00 66.41 66.49 1yz1 h THR 116 Cb 0.20 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1yz1 h THR 116 CO -0.02 0.27 -0.22 1.23 0.37 0.00 0.00 175.52 177.15 1yz1 h GLY 117 N 0.48 0.94 0.99 2.16 0.00 -1.01 -2.71 103.07 103.93 1yz1 h GLY 117 Ca 0.12 -0.82 -0.01 0.00 0.00 0.00 0.00 47.33 46.62 1yz1 h GLY 117 CO 0.00 0.75 0.31 0.00 0.00 0.00 0.00 176.54 177.60 1yz1 h ALA 118 N 0.99 0.68 -0.50 3.60 0.00 -0.13 0.80 119.26 124.69 1yz1 h ALA 118 Ca 0.10 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1yz1 h ALA 118 Cb 0.77 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1yz1 h ALA 118 CO 0.06 0.18 0.31 0.00 0.00 0.00 0.00 179.25 179.80 1yz1 h ALA 119 N 1.14 0.64 -0.46 0.00 0.00 -1.14 0.65 119.26 120.09 1yz1 h ALA 119 Ca 0.19 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 1yz1 h ALA 119 Cb 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1yz1 h ALA 119 CO -0.03 0.02 -0.05 1.49 0.00 0.00 0.00 179.25 180.68 1yz1 h GLU 120 N 0.62 0.85 -0.15 0.00 4.81 -1.14 -2.47 114.58 117.09 1yz1 h GLU 120 Ca 0.20 -0.29 -0.13 0.00 -0.13 0.00 0.00 59.36 59.01 1yz1 h GLU 120 Cb -0.00 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1yz1 h GLU 120 CO -0.08 0.92 -0.45 0.37 -0.73 0.00 0.00 179.01 179.04 1yz1 h GLN 121 N 0.69 0.37 -0.46 1.92 5.75 -0.57 -1.49 115.11 121.33 1yz1 h GLN 121 Ca 0.13 -0.20 -0.05 0.00 -0.15 0.00 0.00 58.65 58.38 1yz1 h GLN 121 Cb 0.57 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.11 1yz1 h GLN 121 CO 0.03 0.76 0.09 0.82 -2.65 0.00 0.00 178.83 177.88 1yz1 h ILE 122 N 0.31 1.24 -0.77 2.39 1.08 -0.81 0.50 117.51 121.44 1yz1 h ILE 122 Ca 0.02 -0.88 0.00 0.00 -0.39 0.00 0.00 64.86 63.62 1yz1 h ILE 122 Cb 0.92 0.92 -0.04 0.00 -3.07 0.00 0.00 36.82 35.55 1yz1 h ILE 122 CO 0.08 0.31 0.50 0.50 -0.69 0.00 0.00 178.15 178.85 1yz1 h LYS 123 N 0.63 1.03 -0.21 2.37 3.64 -1.23 -0.96 116.57 121.84 1yz1 h LYS 123 Ca 0.14 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1yz1 h LYS 123 Cb 0.36 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1yz1 h LYS 123 CO 0.01 0.69 0.08 1.25 -2.27 0.00 0.00 179.45 179.21 1yz1 h HIS 124 N 1.05 0.33 -0.31 1.91 2.76 -0.83 -1.46 115.15 118.60 1yz1 h HIS 124 Ca 0.28 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.41 1yz1 h HIS 124 Cb -0.10 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 28.75 1yz1 h HIS 124 CO -0.02 0.39 0.16 0.82 -1.30 0.00 0.00 177.93 177.99 1yz1 h ILE 125 N 0.18 1.14 -0.93 6.26 1.08 -0.63 -2.17 117.51 122.44 1yz1 h ILE 125 Ca 0.07 -0.38 -0.00 0.00 -0.39 0.00 0.00 64.86 64.15 1yz1 h ILE 125 Cb 0.20 0.83 -0.05 0.00 -3.07 0.00 0.00 36.82 34.73 1yz1 h ILE 125 CO -0.00 0.14 0.58 -0.07 -0.69 0.00 0.00 178.15 178.11 1yz1 h LEU 126 N 0.38 1.11 -1.41 1.44 3.38 -1.14 0.19 115.31 119.26 1yz1 h LEU 126 Ca 0.11 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1yz1 h LEU 126 Cb 0.08 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1yz1 h LEU 126 CO -0.02 0.84 -0.29 0.00 0.09 0.00 0.00 178.44 179.06 1yz1 h ALA 127 N 1.36 1.38 -0.17 1.53 0.00 -0.98 -2.74 119.26 119.63 1yz1 h ALA 127 Ca 0.34 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1yz1 h ALA 127 Cb -0.08 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1yz1 h ALA 127 CO -0.07 0.37 -0.15 0.09 0.00 0.00 0.00 179.25 179.49 1yz1 n ASN 128 N -3.99 2.53 -0.29 0.00 3.02 -0.84 -4.85 115.26 110.83 1yz1 n ASN 128 Ca -0.02 -3.52 0.11 0.00 -0.03 0.00 0.00 54.58 51.12 1yz1 n ASN 128 Cb 0.36 -0.55 0.25 0.00 -0.61 0.00 0.00 39.78 39.23 1yz1 n ASN 128 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1yz1 h PHE 129 N 0.94 0.15 0.00 3.10 3.57 -0.32 -1.33 116.94 123.05 1yz1 h PHE 129 Ca 0.08 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.63 1yz1 h PHE 129 Cb 1.32 0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.13 1yz1 h PHE 129 CO 0.65 -0.26 0.00 1.63 -2.23 0.00 0.00 178.31 178.09 1yz1 n LYS 130 N -5.31 0.10 0.16 1.11 5.02 -1.26 -2.94 118.16 115.04 1yz1 n LYS 130 Ca 0.19 0.22 0.12 0.00 -2.02 0.00 0.00 58.31 56.83 1yz1 n LYS 130 Cb 0.64 -1.50 0.27 0.00 -0.02 0.00 0.00 35.03 34.42 1yz1 n LYS 130 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1yz1 h ASN 131 N 0.00 0.00 -2.66 4.39 2.35 -1.63 -3.47 115.58 114.57 1yz1 h ASN 131 Ca 0.00 -0.01 -0.56 0.00 -0.55 0.00 0.00 56.30 55.18 1yz1 h ASN 131 Cb 0.16 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.49 1yz1 h ASN 131 CO 0.00 0.01 -0.50 -0.31 -1.65 0.00 0.00 177.43 174.98 1yz1 s TYR 132 N -3.16 3.40 0.14 1.19 2.02 -1.15 -4.70 117.35 115.09 1yz1 s TYR 132 Ca 0.08 0.10 0.07 0.00 -0.37 0.00 0.00 57.07 56.95 1yz1 s TYR 132 Cb 0.09 -1.64 -0.04 0.00 -0.40 0.00 0.00 41.96 39.97 1yz1 s TYR 132 CO 0.64 0.53 -0.01 -0.65 -1.57 0.00 0.00 175.55 174.49 1yz1 s GLN 133 N -3.08 2.41 -0.07 -0.62 -0.21 -0.75 -4.94 119.66 112.40 1yz1 s GLN 133 Ca 0.34 -1.03 0.05 0.00 0.02 0.00 0.00 55.36 54.74 1yz1 s GLN 133 Cb -0.11 -2.40 -0.01 0.00 1.00 0.00 0.00 33.01 31.49 1yz1 s GLN 133 CO 0.27 0.48 -0.23 -0.06 -2.12 0.00 0.00 175.29 173.63 1yz1 s PHE 134 N -1.56 2.51 -0.01 0.91 0.08 -1.26 -1.05 117.98 117.59 1yz1 s PHE 134 Ca 0.26 -0.72 0.02 0.00 0.12 0.00 0.00 56.93 56.62 1yz1 s PHE 134 Cb -0.10 -1.64 -0.00 0.00 -0.57 0.00 0.00 43.02 40.71 1yz1 s PHE 134 CO 0.18 -0.21 -0.08 -0.06 -0.10 0.00 0.00 175.22 174.94 1yz1 s PHE 135 N -0.09 0.80 0.34 0.36 0.40 -0.04 -0.36 117.98 119.39 1yz1 s PHE 135 Ca -0.05 -0.17 0.09 0.00 -0.60 0.00 0.00 56.93 56.20 1yz1 s PHE 135 Cb -0.14 -0.55 -0.07 0.00 0.51 0.00 0.00 43.02 42.77 1yz1 s PHE 135 CO 0.04 -0.05 -0.09 0.96 0.70 0.00 0.00 175.22 176.78 1yz1 s ILE 136 N 0.01 2.19 0.95 0.64 -4.36 0.00 -0.09 121.20 120.55 1yz1 s ILE 136 Ca 0.00 -2.19 -0.11 0.00 -0.26 0.00 0.00 60.65 58.09 1yz1 s ILE 136 Cb -0.06 -2.65 0.17 0.00 1.25 0.00 0.00 42.46 41.16 1yz1 s ILE 136 CO -0.00 -0.20 1.11 -0.83 0.24 0.00 0.00 174.94 175.27 1yz1 s GLY 137 N -3.60 1.65 0.29 6.27 0.00 -1.26 -0.55 107.32 110.11 1yz1 s GLY 137 Ca 0.32 0.36 0.03 0.00 0.00 0.00 0.00 44.72 45.44 1yz1 s GLY 137 CO 0.16 0.84 1.73 -2.09 0.00 0.00 0.00 173.10 173.75 1yz1 h GLU 138 N -1.94 0.53 0.00 2.90 4.81 -1.81 -0.14 114.58 118.93 1yz1 h GLU 138 Ca -0.48 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1yz1 h GLU 138 Cb 1.28 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1yz1 h GLU 138 CO 0.45 0.35 0.00 -0.91 -0.73 0.00 0.00 179.01 178.17 1yz1 h ASN 139 N 0.54 0.00 -6.25 1.04 2.35 -1.91 -3.47 115.58 107.89 1yz1 h ASN 139 Ca 0.54 0.00 -0.46 0.00 -0.55 0.00 0.00 56.30 55.83 1yz1 h ASN 139 Cb 0.91 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 1yz1 h ASN 139 CO -0.45 0.00 -0.78 0.23 -1.65 0.00 0.00 177.43 174.78 1yz1 n MET 140 N -2.35 -5.31 -2.43 0.81 2.81 -0.07 -4.92 117.12 105.67 1yz1 n MET 140 Ca 0.01 0.60 -0.43 0.00 -1.81 0.00 0.00 57.70 56.07 1yz1 n MET 140 Cb 0.18 -5.38 -0.02 0.00 -0.71 0.00 0.00 33.22 27.30 1yz1 n MET 140 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1yz1 s ASN 141 N -3.64 6.67 0.50 7.83 3.84 -1.26 -4.90 114.94 123.98 1yz1 s ASN 141 Ca 0.46 1.20 0.26 0.00 0.21 0.00 0.00 52.86 54.99 1yz1 s ASN 141 Cb -0.23 -2.54 1.44 0.00 -0.55 0.00 0.00 41.25 39.37 1yz1 s ASN 141 CO 0.83 -1.08 1.78 1.55 -2.79 0.00 0.00 177.10 177.39 1yz1 h PRO 142 N 9.29 0.00 -0.01 0.43 0.13 -2.00 0.26 132.00 140.10 1yz1 h PRO 142 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1yz1 h PRO 142 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1yz1 h PRO 142 CO 1.03 0.00 -0.32 -0.25 -0.23 0.00 0.00 178.00 178.23 1yz1 n ASP 143 N -2.56 1.59 -4.04 1.44 8.00 -1.26 -4.94 116.55 114.78 1yz1 n ASP 143 Ca -0.02 -1.26 -0.30 0.00 0.71 0.00 0.00 54.79 53.93 1yz1 n ASP 143 Cb 0.23 0.27 0.20 0.00 -0.02 0.00 0.00 41.12 41.80 1yz1 n ASP 143 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1yz1 s GLY 144 N -2.43 1.72 0.49 0.44 0.00 0.90 -4.84 107.32 103.60 1yz1 s GLY 144 Ca 0.23 -1.12 -0.21 0.00 0.00 0.00 0.00 44.72 43.63 1yz1 s GLY 144 CO 0.52 -0.31 1.08 -0.29 0.00 0.00 0.00 173.10 174.09 1yz1 s MET 145 N -5.74 3.70 -0.26 2.90 1.75 -1.26 -5.03 119.30 115.37 1yz1 s MET 145 Ca 0.73 1.48 0.00 0.00 -1.25 0.00 0.00 55.69 56.65 1yz1 s MET 145 Cb -0.06 -2.13 0.04 0.00 2.84 0.00 0.00 34.83 35.52 1yz1 s MET 145 CO 0.54 -0.54 -0.08 0.08 -0.65 0.00 0.00 175.02 174.37 1yz1 s VAL 146 N -1.85 2.59 0.34 10.11 1.01 -1.26 -4.36 120.40 126.97 1yz1 s VAL 146 Ca 0.68 -1.30 -0.21 0.00 0.00 0.00 0.00 61.98 61.15 1yz1 s VAL 146 Cb -0.20 -2.40 -0.10 0.00 0.00 0.00 0.00 36.38 33.68 1yz1 s VAL 146 CO 0.24 0.09 0.87 0.00 0.00 0.00 0.00 175.10 176.29 1yz1 s ALA 147 N 1.23 3.21 -0.11 5.51 0.00 0.88 -4.85 121.76 127.63 1yz1 s ALA 147 Ca -0.04 0.33 -0.03 0.00 0.00 0.00 0.00 51.96 52.22 1yz1 s ALA 147 Cb -0.18 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1yz1 s ALA 147 CO -0.05 0.22 0.01 -0.51 0.00 0.00 0.00 175.76 175.43 1yz1 s LEU 148 N -2.59 3.58 -0.07 0.00 1.02 -0.78 -0.86 118.68 118.98 1yz1 s LEU 148 Ca 0.54 0.10 0.05 0.00 0.02 0.00 0.00 54.13 54.84 1yz1 s LEU 148 Cb -0.13 -1.83 -0.00 0.00 0.02 0.00 0.00 46.19 44.24 1yz1 s LEU 148 CO 0.18 0.33 -0.22 -0.22 0.02 0.00 0.00 176.35 176.44 1yz1 s LEU 149 N -0.56 2.02 0.00 1.79 2.96 -0.22 -0.03 118.68 124.63 1yz1 s LEU 149 Ca 0.10 -0.48 -0.04 0.00 -0.22 0.00 0.00 54.13 53.48 1yz1 s LEU 149 Cb -0.12 -1.27 0.02 0.00 0.50 0.00 0.00 46.19 45.32 1yz1 s LEU 149 CO 0.02 0.18 0.51 -0.67 -1.32 0.00 0.00 176.35 175.08 1yz1 n ASP 150 N 3.23 -1.44 -4.42 3.68 -0.08 -0.90 -1.81 116.55 114.81 1yz1 n ASP 150 Ca -0.18 -2.69 -0.27 0.00 -1.51 0.00 0.00 54.79 50.14 1yz1 n ASP 150 Cb 0.52 2.59 -0.12 0.00 2.34 0.00 0.00 41.12 46.46 1yz1 n ASP 150 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1yz1 s TYR 151 N -3.02 2.29 1.13 -0.67 1.51 -1.26 -1.18 117.35 116.15 1yz1 s TYR 151 Ca 0.24 -0.36 -0.16 0.00 -1.01 0.00 0.00 57.07 55.79 1yz1 s TYR 151 Cb -0.02 -1.14 0.25 0.00 -0.11 0.00 0.00 41.96 40.95 1yz1 s TYR 151 CO 0.17 0.50 1.08 1.03 -1.11 0.00 0.00 175.55 177.22 1yz1 s ARG 152 N -2.68 -0.61 0.66 -0.62 1.81 0.32 -4.83 118.95 113.00 1yz1 s ARG 152 Ca 0.21 0.31 0.44 0.00 -1.72 0.00 0.00 55.73 54.96 1yz1 s ARG 152 Cb -0.08 -1.63 2.37 0.00 -0.45 0.00 0.00 34.95 35.16 1yz1 s ARG 152 CO 0.10 -3.38 2.35 0.93 -0.68 0.00 0.00 175.30 174.61 1yz1 h GLU 153 N -2.36 0.00 0.00 3.54 4.39 -2.01 -0.55 114.58 117.59 1yz1 h GLU 153 Ca -0.52 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.18 1yz1 h GLU 153 Cb 1.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 1yz1 h GLU 153 CO 0.47 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 177.92 1yz1 n ASP 154 N -3.08 0.00 0.00 1.42 5.68 -1.26 -4.87 116.55 114.44 1yz1 n ASP 154 Ca -0.03 0.30 0.00 0.00 -0.50 0.00 0.00 54.79 54.57 1yz1 n ASP 154 Cb 0.09 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 39.65 1yz1 n ASP 154 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1yz1 n GLY 155 N 0.39 0.61 0.00 6.12 0.00 -0.22 -4.76 105.19 107.33 1yz1 n GLY 155 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1yz1 n GLY 155 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1yz1 n VAL 156 N -2.07 0.00 -3.11 1.61 0.24 -1.26 -4.95 118.33 108.79 1yz1 n VAL 156 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 1yz1 n VAL 156 Cb 0.02 0.33 -0.06 0.00 -1.47 0.00 0.00 33.84 32.65 1yz1 n VAL 156 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1yz1 s THR 157 N -1.53 4.81 0.49 3.34 2.01 -1.26 -4.53 115.64 118.97 1yz1 s THR 157 Ca 0.00 -0.19 -0.19 0.00 0.31 0.00 0.00 61.69 61.61 1yz1 s THR 157 Cb 0.00 -4.29 -0.09 0.00 0.01 0.00 0.00 72.50 68.14 1yz1 s THR 157 CO 0.00 -0.76 1.00 -2.16 -0.69 0.00 0.00 174.62 172.01 1yz1 s PRO 158 N 2.84 3.90 0.00 4.92 0.04 -1.26 -0.52 135.00 144.92 1yz1 s PRO 158 Ca 0.19 1.20 -0.08 0.00 0.04 0.00 0.00 61.00 62.35 1yz1 s PRO 158 Cb -0.17 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.26 1yz1 s PRO 158 CO 0.15 -0.32 0.16 1.52 0.04 0.00 0.00 177.00 178.55 1yz1 s TYR 159 N -2.21 0.02 0.03 0.56 -0.85 -0.32 -0.77 117.35 113.82 1yz1 s TYR 159 Ca 0.64 -0.10 0.07 0.00 -0.52 0.00 0.00 57.07 57.15 1yz1 s TYR 159 Cb -0.13 -0.03 -0.02 0.00 0.38 0.00 0.00 41.96 42.16 1yz1 s TYR 159 CO 0.22 -0.31 -0.19 -1.64 -1.52 0.00 0.00 175.55 172.11 1yz1 s MET 160 N -1.44 1.32 -0.14 -3.49 -1.94 0.77 -2.13 119.30 112.25 1yz1 s MET 160 Ca -0.14 -0.87 -0.03 0.00 -1.71 0.00 0.00 55.69 52.95 1yz1 s MET 160 Cb -0.07 -1.39 -0.02 0.00 2.01 0.00 0.00 34.83 35.35 1yz1 s MET 160 CO 0.02 0.36 -0.06 0.42 -0.01 0.00 0.00 175.02 175.74 1yz1 s ILE 161 N -0.75 3.69 0.14 2.53 1.01 0.95 -0.36 121.20 128.40 1yz1 s ILE 161 Ca 0.06 -0.44 0.07 0.00 0.00 0.00 0.00 60.65 60.34 1yz1 s ILE 161 Cb -0.08 -2.59 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 1yz1 s ILE 161 CO 0.01 0.51 -0.15 -0.36 0.00 0.00 0.00 174.94 174.95 1yz1 s PHE 162 N 0.25 1.54 -0.36 3.97 0.40 -0.49 -1.86 117.98 121.44 1yz1 s PHE 162 Ca -0.04 -0.53 -0.21 0.00 -0.60 0.00 0.00 56.93 55.55 1yz1 s PHE 162 Cb -0.14 -0.79 0.00 0.00 0.51 0.00 0.00 43.02 42.60 1yz1 s PHE 162 CO 0.03 0.21 0.65 -0.06 0.70 0.00 0.00 175.22 176.75 1yz1 s PHE 163 N -2.12 3.14 0.22 0.36 0.08 -1.26 -0.76 117.98 117.64 1yz1 s PHE 163 Ca 0.11 0.34 -0.09 0.00 0.12 0.00 0.00 56.93 57.41 1yz1 s PHE 163 Cb -0.05 -3.17 0.34 0.00 -0.57 0.00 0.00 43.02 39.57 1yz1 s PHE 163 CO 0.04 -0.65 1.69 -0.22 -0.10 0.00 0.00 175.22 175.98 1yz1 h LYS 164 N 8.49 0.22 0.00 0.44 3.64 -1.52 -0.13 116.57 127.71 1yz1 h LYS 164 Ca -0.26 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1yz1 h LYS 164 Cb 1.11 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1yz1 h LYS 164 CO 0.84 0.15 0.00 -0.25 -2.27 0.00 0.00 179.45 177.92 1yz1 n ASP 165 N -5.17 0.00 -1.23 4.20 8.00 -1.26 -1.97 116.55 119.12 1yz1 n ASP 165 Ca 0.10 0.14 0.11 0.00 0.71 0.00 0.00 54.79 55.85 1yz1 n ASP 165 Cb 0.37 -0.33 0.29 0.00 -0.02 0.00 0.00 41.12 41.43 1yz1 n ASP 165 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yz1 n GLY 166 N 0.16 2.48 3.46 0.44 0.00 -0.06 -4.94 105.19 106.73 1yz1 n GLY 166 Ca 0.07 -0.73 -0.27 0.00 0.00 0.00 0.00 46.02 45.09 1yz1 n GLY 166 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yz1 s LEU 167 N -1.03 2.58 -0.02 0.99 1.43 -0.83 -0.57 118.68 121.23 1yz1 s LEU 167 Ca 0.44 -0.78 0.06 0.00 -1.03 0.00 0.00 54.13 52.82 1yz1 s LEU 167 Cb 0.23 -1.31 -0.01 0.00 0.03 0.00 0.00 46.19 45.13 1yz1 s LEU 167 CO 0.31 0.12 -0.19 -1.83 0.23 0.00 0.00 176.35 174.99 1yz1 s GLU 168 N -2.66 1.58 -0.06 1.70 -1.05 -0.21 -4.80 118.70 113.20 1yz1 s GLU 168 Ca 0.21 -0.67 -0.13 0.00 -0.15 0.00 0.00 54.97 54.24 1yz1 s GLU 168 Cb -0.08 -1.50 -0.05 0.00 -0.44 0.00 0.00 34.13 32.06 1yz1 s GLU 168 CO 0.11 0.38 0.34 -1.64 0.95 0.00 0.00 175.26 175.40 1yz1 s MET 169 N -0.37 3.89 -0.06 -4.83 -1.94 -1.26 -1.19 119.30 113.54 1yz1 s MET 169 Ca 0.06 0.25 0.04 0.00 -1.71 0.00 0.00 55.69 54.32 1yz1 s MET 169 Cb -0.08 -3.26 0.00 0.00 2.01 0.00 0.00 34.83 33.50 1yz1 s MET 169 CO -0.00 0.61 -0.18 -2.00 -0.01 0.00 0.00 175.02 173.44 1yz1 s GLU 170 N -0.73 2.03 0.03 2.03 2.12 0.35 -4.97 118.70 119.56 1yz1 s GLU 170 Ca 0.21 -0.63 0.03 0.00 0.36 0.00 0.00 54.97 54.93 1yz1 s GLU 170 Cb -0.15 -1.69 -0.02 0.00 0.26 0.00 0.00 34.13 32.53 1yz1 s GLU 170 CO 0.10 0.20 -0.09 -1.59 -0.54 0.00 0.00 175.26 173.34 1yz1 s LYS 171 N 0.21 0.61 0.00 4.30 -2.85 -1.26 0.72 119.74 121.46 1yz1 s LYS 171 Ca -0.09 -0.59 0.00 0.00 -1.00 0.00 0.00 55.97 54.29 1yz1 s LYS 171 Cb -0.14 -0.50 0.00 0.00 -2.06 0.00 0.00 37.83 35.13 1yz1 s LYS 171 CO 0.04 0.12 0.00 0.00 0.10 0.00 0.00 175.35 175.61