#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yz1 h PHE 0 N 0.00 0.16 -2.45 4.31 3.57 -2.02 -3.46 116.94 117.05 1yz1 h PHE 0 Ca 0.00 -0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.38 1yz1 h PHE 0 Cb 0.00 -0.04 -0.24 0.00 2.79 0.00 0.00 35.95 38.47 1yz1 h PHE 0 CO 0.00 0.52 -0.14 1.41 -2.23 0.00 0.00 178.31 177.86 1yz1 s MET 1 N -4.53 0.56 -0.04 1.11 0.00 -1.26 -5.03 119.30 110.11 1yz1 s MET 1 Ca -0.15 0.83 0.06 0.00 0.00 0.00 0.00 55.69 56.43 1yz1 s MET 1 Cb 0.04 0.17 -0.01 0.00 0.00 0.00 0.00 34.83 35.02 1yz1 s MET 1 CO 0.70 -0.11 -0.22 0.96 0.00 0.00 0.00 175.02 176.35 1yz1 s ILE 2 N 0.86 1.78 -0.18 10.11 -4.36 -1.26 -1.48 121.20 126.67 1yz1 s ILE 2 Ca -0.05 -0.94 -0.08 0.00 -0.26 0.00 0.00 60.65 59.33 1yz1 s ILE 2 Cb -0.05 -1.50 -0.04 0.00 1.25 0.00 0.00 42.46 42.12 1yz1 s ILE 2 CO -0.07 0.50 0.08 -0.63 0.24 0.00 0.00 174.94 175.07 1yz1 s ILE 3 N -0.28 5.00 -0.24 8.37 1.01 0.20 -1.69 121.20 133.58 1yz1 s ILE 3 Ca 0.02 0.04 -0.13 0.00 0.00 0.00 0.00 60.65 60.58 1yz1 s ILE 3 Cb -0.11 -3.26 -0.04 0.00 0.01 0.00 0.00 42.46 39.06 1yz1 s ILE 3 CO 0.01 0.47 0.28 -0.31 0.00 0.00 0.00 174.94 175.39 1yz1 s TYR 4 N 0.27 3.31 0.06 3.97 1.51 0.29 -0.80 117.35 125.95 1yz1 s TYR 4 Ca 0.05 0.37 0.07 0.00 -1.01 0.00 0.00 57.07 56.55 1yz1 s TYR 4 Cb -0.12 -2.42 -0.04 0.00 -0.11 0.00 0.00 41.96 39.28 1yz1 s TYR 4 CO -0.00 -0.04 -0.13 0.50 -1.11 0.00 0.00 175.55 174.76 1yz1 s ARG 5 N 1.41 2.15 -0.13 -0.62 3.52 0.01 -0.82 118.95 124.47 1yz1 s ARG 5 Ca 0.12 -0.96 -0.29 0.00 -0.13 0.00 0.00 55.73 54.47 1yz1 s ARG 5 Cb -0.15 -2.28 -0.04 0.00 -1.56 0.00 0.00 34.95 30.93 1yz1 s ARG 5 CO 0.07 0.54 1.57 0.34 -0.81 0.00 0.00 175.30 177.00 1yz1 s ASP 6 N -1.74 6.63 0.56 -2.12 -1.08 0.10 -1.17 116.67 117.86 1yz1 s ASP 6 Ca 0.17 1.93 0.24 0.00 -0.52 0.00 0.00 52.55 54.38 1yz1 s ASP 6 Cb -0.11 -2.53 1.61 0.00 -1.46 0.00 0.00 42.92 40.43 1yz1 s ASP 6 CO 0.09 -1.00 2.21 0.25 0.52 0.00 0.00 175.17 177.24 1yz1 h LEU 7 N 10.61 0.00 0.00 -1.34 5.85 -1.40 0.61 115.31 129.64 1yz1 h LEU 7 Ca -0.35 0.00 -0.38 0.00 0.84 0.00 0.00 57.88 57.99 1yz1 h LEU 7 Cb 1.15 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.13 1yz1 h LEU 7 CO 0.97 0.00 -2.11 -0.38 -0.34 0.00 0.00 178.44 176.58 1yz1 n ILE 8 N -4.11 1.54 0.40 4.05 -0.00 -1.26 -4.61 119.36 115.37 1yz1 n ILE 8 Ca -0.03 -0.29 0.12 0.00 -0.00 0.00 0.00 62.75 62.55 1yz1 n ILE 8 Cb 0.09 -1.91 0.13 0.00 -0.00 0.00 0.00 39.64 37.95 1yz1 n ILE 8 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.55 177.32 1yz1 h SER 9 N -0.92 0.00 -0.19 4.38 4.64 -1.87 -3.48 113.55 116.11 1yz1 h SER 9 Ca -0.58 -0.12 -0.08 0.00 -0.47 0.00 0.00 61.79 60.54 1yz1 h SER 9 Cb 1.54 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.60 1yz1 h SER 9 CO -0.33 0.06 -0.07 1.41 -0.87 0.00 0.00 176.83 177.03 1yz1 n HIS 10 N -2.37 0.00 -3.03 4.77 8.25 0.20 -4.96 115.22 118.08 1yz1 n HIS 10 Ca 0.02 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.14 1yz1 n HIS 10 Cb 0.48 -1.18 -0.06 0.00 1.12 0.00 0.00 29.99 30.35 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 -2.47 6.99 -0.01 0.41 1.01 -1.26 -4.72 116.67 116.62 1yz1 s ASP 11 Ca 0.00 1.47 -0.30 0.00 0.71 0.00 0.00 52.55 54.42 1yz1 s ASP 11 Cb 0.00 -2.44 -0.05 0.00 1.01 0.00 0.00 42.92 41.44 1yz1 s ASP 11 CO 0.00 -0.11 1.26 -0.70 0.21 0.00 0.00 175.17 175.83 1yz1 s GLU 12 N -2.48 4.35 -0.23 8.23 2.12 -1.26 0.03 118.70 129.45 1yz1 s GLU 12 Ca 0.50 1.79 0.03 0.00 0.36 0.00 0.00 54.97 57.64 1yz1 s GLU 12 Cb -0.14 -3.50 -0.19 0.00 0.26 0.00 0.00 34.13 30.56 1yz1 s GLU 12 CO 0.19 -0.43 -0.11 -1.33 -0.54 0.00 0.00 175.26 173.04 1yz1 n MET 13 N 4.89 0.67 -3.88 4.30 2.81 0.00 -4.73 117.12 121.19 1yz1 n MET 13 Ca 0.11 0.15 0.01 0.00 -1.81 0.00 0.00 57.70 56.16 1yz1 n MET 13 Cb 0.45 -1.55 0.01 0.00 -0.71 0.00 0.00 33.22 31.42 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 -2.52 0.01 0.31 2.03 -0.71 -1.19 -4.83 117.98 111.08 1yz1 s PHE 14 Ca -0.31 -0.19 0.03 0.00 -1.04 0.00 0.00 56.93 55.42 1yz1 s PHE 14 Cb 0.08 0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 42.44 1yz1 s PHE 14 CO 0.65 -0.42 0.12 -1.54 -1.34 0.00 0.00 175.22 172.69 1yz1 s SER 15 N -3.51 1.74 -0.16 1.98 1.04 -1.26 -0.55 113.70 112.98 1yz1 s SER 15 Ca 0.24 -1.49 -0.01 0.00 0.48 0.00 0.00 55.95 55.17 1yz1 s SER 15 Cb 0.00 0.27 0.09 0.00 0.10 0.00 0.00 66.02 66.48 1yz1 s SER 15 CO -0.00 -0.80 2.07 -0.90 0.98 0.00 0.00 173.24 174.58 1yz1 n ASP 16 N -0.81 5.89 -1.27 7.02 5.68 -0.68 -3.98 116.55 128.40 1yz1 n ASP 16 Ca -0.01 -2.73 0.11 0.00 -0.50 0.00 0.00 54.79 51.66 1yz1 n ASP 16 Cb 0.66 -1.11 0.30 0.00 -1.14 0.00 0.00 41.12 39.83 1yz1 n ASP 16 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 1yz1 n ILE 17 N 0.99 0.96 -4.47 2.12 -5.35 -1.26 -4.89 119.36 107.45 1yz1 n ILE 17 Ca 0.16 -0.92 -0.23 0.00 -0.27 0.00 0.00 62.75 61.49 1yz1 n ILE 17 Cb 0.55 0.43 -0.11 0.00 -1.74 0.00 0.00 39.64 38.77 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 -1.15 2.08 -0.13 4.28 2.02 -1.26 -5.10 117.35 118.10 1yz1 s TYR 18 Ca 0.45 -0.74 -0.29 0.00 -0.37 0.00 0.00 57.07 56.12 1yz1 s TYR 18 Cb 0.24 -1.28 -0.02 0.00 -0.40 0.00 0.00 41.96 40.51 1yz1 s TYR 18 CO 0.30 0.27 1.16 0.21 -1.57 0.00 0.00 175.55 175.92 1yz1 s LYS 19 N -3.75 4.31 -0.04 -0.62 2.20 -1.25 -4.92 119.74 115.66 1yz1 s LYS 19 Ca 0.32 1.57 0.06 0.00 -0.36 0.00 0.00 55.97 57.56 1yz1 s LYS 19 Cb 0.06 -3.64 -0.01 0.00 -1.51 0.00 0.00 37.83 32.73 1yz1 s LYS 19 CO 0.14 -0.55 -0.22 0.42 -0.36 0.00 0.00 175.35 174.79 1yz1 s ILE 20 N 2.79 1.78 0.01 5.43 1.01 -1.26 -0.93 121.20 130.03 1yz1 s ILE 20 Ca 0.52 -0.93 -0.06 0.00 0.00 0.00 0.00 60.65 60.18 1yz1 s ILE 20 Cb -0.21 -1.50 -0.00 0.00 0.01 0.00 0.00 42.46 40.76 1yz1 s ILE 20 CO 0.16 0.50 0.11 0.00 0.00 0.00 0.00 174.94 175.71 1yz1 s ARG 21 N -0.23 0.48 -0.19 2.79 1.70 -0.40 -4.98 118.95 118.12 1yz1 s ARG 21 Ca 0.01 -0.48 -0.21 0.00 -0.47 0.00 0.00 55.73 54.58 1yz1 s ARG 21 Cb -0.11 0.19 -0.03 0.00 -0.57 0.00 0.00 34.95 34.44 1yz1 s ARG 21 CO 0.02 -0.11 0.63 -1.21 -1.08 0.00 0.00 175.30 173.55 1yz1 s GLU 22 N -1.58 4.23 0.33 3.89 2.02 -1.26 -0.03 118.70 126.30 1yz1 s GLU 22 Ca -0.14 0.63 0.10 0.00 0.02 0.00 0.00 54.97 55.58 1yz1 s GLU 22 Cb -0.07 -3.56 -0.06 0.00 0.10 0.00 0.00 34.13 30.53 1yz1 s GLU 22 CO 0.00 -0.21 -0.10 0.96 0.02 0.00 0.00 175.26 175.93 1yz1 s ILE 23 N 1.80 2.21 -1.06 -1.63 -0.00 -0.84 -4.76 121.20 116.92 1yz1 s ILE 23 Ca 0.29 -2.22 -0.04 0.00 -0.00 0.00 0.00 60.65 58.68 1yz1 s ILE 23 Cb -0.16 -2.59 -0.05 0.00 -0.00 0.00 0.00 42.46 39.67 1yz1 s ILE 23 CO 0.11 -0.23 0.91 0.00 -0.00 0.00 0.00 174.94 175.72 1yz1 n ALA 24 N -0.75 -2.25 -2.69 2.27 0.00 -1.26 -2.06 120.51 113.75 1yz1 n ALA 24 Ca -0.05 0.07 -0.16 0.00 0.00 0.00 0.00 53.44 53.30 1yz1 n ALA 24 Cb 0.63 -4.53 -0.00 0.00 0.00 0.00 0.00 19.45 15.55 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 -3.12 -4.19 0.00 0.00 8.00 -1.26 -0.53 116.55 115.44 1yz1 n ASP 25 Ca -0.14 0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.37 1yz1 n ASP 25 Cb 0.63 -3.51 0.00 0.00 -0.02 0.00 0.00 41.12 38.22 1yz1 n ASP 25 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yz1 n GLY 26 N -0.97 0.48 0.10 0.44 0.00 -1.18 -4.93 105.19 99.13 1yz1 n GLY 26 Ca -0.12 -0.53 -0.15 0.00 0.00 0.00 0.00 46.02 45.23 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 0.33 -8.92 0.99 7.12 -0.72 -3.45 115.31 110.65 1yz1 h LEU 27 Ca 0.00 -0.40 -0.40 0.00 0.13 0.00 0.00 57.88 57.21 1yz1 h LEU 27 Cb 0.00 -0.11 -0.14 0.00 -0.53 0.00 0.00 40.66 39.88 1yz1 h LEU 27 CO 0.00 1.32 -0.66 0.00 -0.13 0.00 0.00 178.44 178.97 1yz1 s LEU 29 N -3.32 2.27 -0.24 0.00 1.43 -0.36 -1.99 118.68 116.46 1yz1 s LEU 29 Ca 0.28 -0.53 -0.10 0.00 -1.03 0.00 0.00 54.13 52.75 1yz1 s LEU 29 Cb 0.05 -1.49 -0.05 0.00 0.03 0.00 0.00 46.19 44.73 1yz1 s LEU 29 CO 0.09 0.10 0.14 -0.70 0.23 0.00 0.00 176.35 176.21 1yz1 s GLU 30 N 0.70 3.97 -0.24 1.70 2.12 0.95 -1.43 118.70 126.47 1yz1 s GLU 30 Ca -0.09 -0.32 -0.02 0.00 0.36 0.00 0.00 54.97 54.90 1yz1 s GLU 30 Cb -0.16 -3.50 0.02 0.00 0.26 0.00 0.00 34.13 30.75 1yz1 s GLU 30 CO 0.01 -0.01 -0.06 0.08 -0.54 0.00 0.00 175.26 174.75 1yz1 s VAL 31 N 1.22 3.01 -0.07 3.70 1.01 0.87 -1.28 120.40 128.86 1yz1 s VAL 31 Ca 0.07 -0.87 -0.25 0.00 0.00 0.00 0.00 61.98 60.93 1yz1 s VAL 31 Cb -0.14 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 1yz1 s VAL 31 CO 0.05 0.27 0.76 -0.70 0.00 0.00 0.00 175.10 175.48 1yz1 s GLU 32 N 1.37 4.44 0.00 2.72 2.12 -0.11 0.28 118.70 129.52 1yz1 s GLU 32 Ca 0.02 0.97 0.00 0.00 0.36 0.00 0.00 54.97 56.32 1yz1 s GLU 32 Cb -0.16 -3.46 0.00 0.00 0.26 0.00 0.00 34.13 30.77 1yz1 s GLU 32 CO -0.04 0.01 0.00 0.41 -0.54 0.00 0.00 175.26 175.09 1yz1 n GLY 33 N 3.11 4.50 3.16 -1.50 0.00 0.83 -3.95 105.19 111.35 1yz1 n GLY 33 Ca 0.00 -2.13 -0.13 0.00 0.00 0.00 0.00 46.02 43.76 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 -0.76 0.39 0.34 1.61 1.02 -1.26 -4.28 119.74 116.80 1yz1 s LYS 34 Ca 0.00 0.19 -0.26 0.00 0.02 0.00 0.00 55.97 55.92 1yz1 s LYS 34 Cb 0.00 0.18 -0.09 0.00 -0.52 0.00 0.00 37.83 37.40 1yz1 s LYS 34 CO 0.00 -0.07 1.05 -1.64 -0.92 0.00 0.00 175.35 173.77 1yz1 s MET 35 N -0.28 4.41 0.06 1.68 -1.94 -1.26 -0.64 119.30 121.34 1yz1 s MET 35 Ca -0.04 1.60 0.02 0.00 -1.71 0.00 0.00 55.69 55.56 1yz1 s MET 35 Cb -0.03 -2.84 -0.03 0.00 2.01 0.00 0.00 34.83 33.94 1yz1 s MET 35 CO 0.01 0.06 -0.08 0.14 -0.01 0.00 0.00 175.02 175.14 1yz1 s VAL 36 N -1.45 0.63 -0.31 -6.03 -7.23 0.33 -4.88 120.40 101.46 1yz1 s VAL 36 Ca 0.51 -1.32 -0.29 0.00 -1.81 0.00 0.00 61.98 59.07 1yz1 s VAL 36 Cb -0.25 -0.93 -0.02 0.00 0.56 0.00 0.00 36.38 35.74 1yz1 s VAL 36 CO 0.32 -0.50 1.68 -0.55 -0.31 0.00 0.00 175.10 175.75 1yz1 s SER 37 N -1.98 6.11 -0.01 4.85 0.15 -1.26 -0.35 113.70 121.21 1yz1 s SER 37 Ca -0.04 1.32 -0.00 0.00 0.70 0.00 0.00 55.95 57.93 1yz1 s SER 37 Cb -0.06 -2.53 -0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1yz1 s SER 37 CO -0.01 -1.53 -0.00 -0.09 1.20 0.00 0.00 173.24 172.80 1yz1 h ARG 38 N 11.90 0.00 -6.19 5.44 9.65 -2.03 -3.46 114.38 129.69 1yz1 h ARG 38 Ca -0.33 0.00 -0.53 0.00 -1.10 0.00 0.00 59.98 58.02 1yz1 h ARG 38 Cb 1.15 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.66 1yz1 h ARG 38 CO 1.03 0.00 -0.58 0.95 2.80 0.00 0.00 179.97 184.17 1yz1 s THR 68 N -1.07 3.78 0.27 0.20 -4.23 -1.26 -5.26 115.64 108.07 1yz1 s THR 68 Ca -0.00 -1.68 -0.10 0.00 -1.18 0.00 0.00 61.69 58.73 1yz1 s THR 68 Cb 0.00 -3.08 -0.00 0.00 1.34 0.00 0.00 72.50 70.76 1yz1 s THR 68 CO 0.01 -0.34 0.47 -0.83 -0.54 0.00 0.00 174.62 173.38 1yz1 s GLY 69 N -3.77 0.80 0.05 3.99 0.00 0.52 -4.95 107.32 103.98 1yz1 s GLY 69 Ca 0.33 -1.07 -0.27 0.00 0.00 0.00 0.00 44.72 43.70 1yz1 s GLY 69 CO 0.22 -0.75 0.86 0.14 0.00 0.00 0.00 173.10 173.57 1yz1 s VAL 70 N -3.73 4.69 0.00 1.40 1.01 -1.26 -0.51 120.40 121.99 1yz1 s VAL 70 Ca 0.25 1.84 0.00 0.00 0.00 0.00 0.00 61.98 64.07 1yz1 s VAL 70 Cb -0.00 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.16 1yz1 s VAL 70 CO 0.12 0.31 0.72 -0.67 0.00 0.00 0.00 175.10 175.58 1yz1 n ASP 71 N 3.02 0.00 -0.19 3.32 2.03 0.19 -1.54 116.55 123.39 1yz1 n ASP 71 Ca 0.01 0.72 -0.01 0.00 0.52 0.00 0.00 54.79 56.02 1yz1 n ASP 71 Cb 0.50 -0.32 0.06 0.00 -0.72 0.00 0.00 41.12 40.64 1yz1 n ASP 71 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1yz1 h ILE 72 N 0.00 0.46 -0.05 5.18 2.04 -1.94 -1.51 117.51 121.68 1yz1 h ILE 72 Ca 0.00 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 65.87 1yz1 h ILE 72 Cb 0.00 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 1yz1 h ILE 72 CO 0.00 0.00 -0.07 0.58 0.00 0.00 0.00 178.15 178.67 1yz1 h VAL 73 N 0.03 0.81 -0.43 1.67 2.07 -1.79 -2.01 116.25 116.60 1yz1 h VAL 73 Ca 0.28 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.67 1yz1 h VAL 73 Cb 0.43 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1yz1 h VAL 73 CO -0.56 0.00 -0.24 0.24 0.02 0.00 0.00 177.57 177.03 1yz1 h MET 74 N -0.09 0.92 -0.45 1.57 2.86 -1.02 -1.22 114.93 117.49 1yz1 h MET 74 Ca 0.05 -0.42 -0.04 0.00 -2.06 0.00 0.00 59.70 57.23 1yz1 h MET 74 Cb 0.16 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 1yz1 h MET 74 CO -0.11 1.07 0.10 -0.91 1.06 0.00 0.00 176.91 178.12 1yz1 h ASN 75 N 0.75 0.64 -0.40 1.22 2.35 -1.17 -3.12 115.58 115.85 1yz1 h ASN 75 Ca 0.09 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1yz1 h ASN 75 Cb 0.82 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1yz1 h ASN 75 CO 0.07 0.64 0.00 1.41 -1.65 0.00 0.00 177.43 177.90 1yz1 n HIS 76 N -4.30 0.84 -3.88 1.19 8.25 -0.77 -4.98 115.22 111.58 1yz1 n HIS 76 Ca 0.03 -0.64 -0.29 0.00 -0.26 0.00 0.00 57.72 56.56 1yz1 n HIS 76 Cb 0.21 -0.16 0.03 0.00 1.12 0.00 0.00 29.99 31.20 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 0.37 -2.35 -2.30 4.41 8.25 -0.72 -4.58 115.22 118.30 1yz1 n HIS 77 Ca 0.18 0.92 -0.35 0.00 -0.26 0.00 0.00 57.72 58.21 1yz1 n HIS 77 Cb 0.67 -4.10 -0.01 0.00 1.12 0.00 0.00 29.99 27.68 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 -7.27 3.74 -0.14 2.41 1.43 -0.54 -3.47 118.68 114.84 1yz1 s LEU 78 Ca 0.64 2.08 0.01 0.00 -1.03 0.00 0.00 54.13 55.83 1yz1 s LEU 78 Cb -0.32 -4.57 -0.00 0.00 0.03 0.00 0.00 46.19 41.33 1yz1 s LEU 78 CO 0.82 -1.12 -0.17 -1.10 0.23 0.00 0.00 176.35 175.01 1yz1 s GLN 79 N -3.35 3.20 0.33 1.70 -1.52 0.28 -4.86 119.66 115.44 1yz1 s GLN 79 Ca 0.71 -0.77 -0.28 0.00 -1.95 0.00 0.00 55.36 53.07 1yz1 s GLN 79 Cb -0.21 -2.56 -0.09 0.00 -0.22 0.00 0.00 33.01 29.93 1yz1 s GLN 79 CO 0.26 0.07 1.15 -2.00 -0.25 0.00 0.00 175.29 174.52 1yz1 s GLU 80 N 0.67 4.39 0.37 2.91 2.12 -1.26 -0.78 118.70 127.12 1yz1 s GLU 80 Ca -0.08 1.86 0.06 0.00 0.36 0.00 0.00 54.97 57.17 1yz1 s GLU 80 Cb -0.16 -2.97 -0.02 0.00 0.26 0.00 0.00 34.13 31.23 1yz1 s GLU 80 CO 0.02 -0.03 0.23 -0.08 -0.54 0.00 0.00 175.26 174.86 1yz1 s THR 81 N -1.27 0.20 0.04 -1.70 -1.32 0.28 -4.89 115.64 106.98 1yz1 s THR 81 Ca 0.50 -2.00 -0.06 0.00 -1.21 0.00 0.00 61.69 58.91 1yz1 s THR 81 Cb -0.32 -2.41 -0.01 0.00 -1.51 0.00 0.00 72.50 68.25 1yz1 s THR 81 CO 0.41 0.00 0.12 -0.94 -2.21 0.00 0.00 174.62 172.00 1yz1 s SER 82 N -3.49 0.16 0.03 8.08 1.04 -1.26 -3.93 113.70 114.33 1yz1 s SER 82 Ca 0.33 -0.53 -0.00 0.00 0.48 0.00 0.00 55.95 56.22 1yz1 s SER 82 Cb 0.02 0.25 -0.03 0.00 0.10 0.00 0.00 66.02 66.36 1yz1 s SER 82 CO 0.23 -0.54 -0.03 -0.36 0.98 0.00 0.00 173.24 173.52 1yz1 s PHE 83 N -2.78 0.39 0.47 5.02 0.40 -1.26 -5.05 117.98 115.17 1yz1 s PHE 83 Ca -0.03 -0.75 -0.03 0.00 -0.60 0.00 0.00 56.93 55.51 1yz1 s PHE 83 Cb -0.00 -0.28 -0.02 0.00 0.51 0.00 0.00 43.02 43.22 1yz1 s PHE 83 CO -0.05 -0.26 0.74 -0.08 0.70 0.00 0.00 175.22 176.26 1yz1 s THR 84 N -2.47 4.61 0.24 0.64 -1.32 -1.26 -4.89 115.64 111.18 1yz1 s THR 84 Ca -0.06 -0.08 -0.06 0.00 -1.21 0.00 0.00 61.69 60.28 1yz1 s THR 84 Cb -0.03 -3.74 0.20 0.00 -1.51 0.00 0.00 72.50 67.43 1yz1 s THR 84 CO -0.05 -0.65 1.85 0.50 -2.21 0.00 0.00 174.62 174.07 1yz1 h LYS 85 N 0.30 1.22 -0.30 7.08 3.64 -2.00 -0.67 116.57 125.83 1yz1 h LYS 85 Ca -0.47 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 58.75 1yz1 h LYS 85 Cb 1.22 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 1yz1 h LYS 85 CO 0.61 0.91 0.18 0.93 -2.27 0.00 0.00 179.45 179.80 1yz1 h GLU 86 N 1.22 0.41 -0.62 1.90 5.08 -1.99 -1.14 114.58 119.44 1yz1 h GLU 86 Ca 0.30 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.53 1yz1 h GLU 86 Cb 0.06 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1yz1 h GLU 86 CO -0.05 0.32 0.03 0.00 -1.00 0.00 0.00 179.01 178.31 1yz1 h ALA 87 N 1.06 0.88 -0.61 3.43 0.00 -1.85 -1.96 119.26 120.22 1yz1 h ALA 87 Ca 0.11 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1yz1 h ALA 87 Cb 0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1yz1 h ALA 87 CO -0.02 0.66 0.16 -0.92 0.00 0.00 0.00 179.25 179.14 1yz1 h TYR 88 N 0.98 1.01 -0.21 0.00 3.20 -0.97 0.89 116.97 121.87 1yz1 h TYR 88 Ca 0.18 -0.11 0.04 0.00 3.14 0.00 0.00 58.73 61.98 1yz1 h TYR 88 Cb 0.53 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.47 1yz1 h TYR 88 CO 0.04 0.84 -0.04 -0.22 -1.64 0.00 0.00 178.16 177.14 1yz1 h LYS 89 N 0.88 0.02 -0.37 1.82 3.64 -0.96 0.32 116.57 121.91 1yz1 h LYS 89 Ca 0.19 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.53 1yz1 h LYS 89 Cb 0.33 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1yz1 h LYS 89 CO -0.00 0.01 0.07 -0.22 -2.27 0.00 0.00 179.45 177.04 1yz1 h LYS 90 N 0.02 0.61 -0.07 1.90 3.64 -1.14 -2.60 116.57 118.92 1yz1 h LYS 90 Ca 0.10 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1yz1 h LYS 90 Cb 0.15 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1yz1 h LYS 90 CO -0.20 0.66 0.04 -0.92 -2.27 0.00 0.00 179.45 176.75 1yz1 h TYR 91 N 0.45 0.08 -0.26 1.91 3.20 -0.26 -2.69 116.97 119.41 1yz1 h TYR 91 Ca 0.11 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.89 1yz1 h TYR 91 Cb 0.33 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 1yz1 h TYR 91 CO 0.02 0.05 -0.24 0.97 -1.64 0.00 0.00 178.16 177.32 1yz1 h ILE 92 N 0.09 1.26 -0.24 1.81 6.09 -0.39 0.31 117.51 126.44 1yz1 h ILE 92 Ca 0.03 -1.24 -0.01 0.00 -1.37 0.00 0.00 64.86 62.26 1yz1 h ILE 92 Cb -0.01 1.33 -0.01 0.00 0.47 0.00 0.00 36.82 38.60 1yz1 h ILE 92 CO -0.01 0.40 0.11 0.11 -3.07 0.00 0.00 178.15 175.69 1yz1 h LYS 93 N 0.43 0.36 -0.48 2.19 1.57 -1.38 -0.07 116.57 119.19 1yz1 h LYS 93 Ca 0.07 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 1yz1 h LYS 93 Cb 0.65 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 1yz1 h LYS 93 CO 0.05 0.37 0.04 -0.44 -0.57 0.00 0.00 179.45 178.89 1yz1 h ASP 94 N 0.26 0.80 0.61 0.86 3.32 -1.25 -2.39 116.42 118.63 1yz1 h ASP 94 Ca 0.08 -0.29 -0.03 0.00 0.02 0.00 0.00 57.03 56.82 1yz1 h ASP 94 Cb 0.14 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.48 1yz1 h ASP 94 CO -0.01 0.89 -0.29 0.22 -1.72 0.00 0.00 179.24 178.33 1yz1 h TYR 95 N 0.69 -0.76 -0.21 4.55 3.20 -0.77 0.06 116.97 123.73 1yz1 h TYR 95 Ca 0.14 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.05 1yz1 h TYR 95 Cb 0.46 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 1yz1 h TYR 95 CO 0.03 -0.47 0.17 0.52 -1.64 0.00 0.00 178.16 176.78 1yz1 h MET 96 N -0.83 0.00 0.00 1.82 2.86 -1.01 0.33 114.93 118.09 1yz1 h MET 96 Ca -0.08 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 1yz1 h MET 96 Cb 0.63 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 1yz1 h MET 96 CO 0.14 0.00 -0.25 0.87 1.06 0.00 0.00 176.91 178.73 1yz1 h LYS 97 N 0.00 0.00 -0.15 1.72 1.57 -1.05 -1.55 116.57 117.12 1yz1 h LYS 97 Ca 0.10 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.72 1yz1 h LYS 97 Cb 0.44 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 1yz1 h LYS 97 CO -0.00 0.17 -0.57 0.77 -0.57 0.00 0.00 179.45 179.25 1yz1 h SER 98 N 0.00 0.53 -0.31 0.86 0.02 0.16 -2.25 113.55 112.56 1yz1 h SER 98 Ca -0.01 -0.29 -0.16 0.00 -0.84 0.00 0.00 61.79 60.50 1yz1 h SER 98 Cb 1.14 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.52 1yz1 h SER 98 CO 0.02 0.98 -0.42 0.40 -1.14 0.00 0.00 176.83 176.68 1yz1 h ILE 99 N 0.36 1.29 -0.67 3.27 1.08 -1.11 -2.56 117.51 119.16 1yz1 h ILE 99 Ca 0.00 -1.60 0.08 0.00 -0.39 0.00 0.00 64.86 62.95 1yz1 h ILE 99 Cb 1.10 1.57 -0.07 0.00 -3.07 0.00 0.00 36.82 36.36 1yz1 h ILE 99 CO 0.10 0.52 0.34 0.50 -0.69 0.00 0.00 178.15 178.92 1yz1 h LYS 100 N 0.60 0.57 -0.40 2.37 3.64 -1.16 0.16 116.57 122.35 1yz1 h LYS 100 Ca 0.03 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1yz1 h LYS 100 Cb 1.02 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.67 1yz1 h LYS 100 CO 0.10 0.38 0.19 0.78 -2.27 0.00 0.00 179.45 178.63 1yz1 h GLY 101 N 0.59 0.54 1.43 5.01 0.00 -1.22 0.15 103.07 109.57 1yz1 h GLY 101 Ca 0.32 -0.13 -0.08 0.00 0.00 0.00 0.00 47.33 47.44 1yz1 h GLY 101 CO -0.25 0.08 -0.10 0.50 0.00 0.00 0.00 176.54 176.78 1yz1 h LYS 102 N 0.38 0.68 -0.35 4.80 1.79 -0.90 -2.95 116.57 120.03 1yz1 h LYS 102 Ca 0.17 -0.21 -0.06 0.00 -2.18 0.00 0.00 60.65 58.37 1yz1 h LYS 102 Cb 0.10 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 1yz1 h LYS 102 CO -0.13 0.77 -0.03 -0.07 -1.08 0.00 0.00 179.45 178.91 1yz1 h LEU 103 N 0.63 0.64 -1.17 2.94 4.07 -0.03 -0.92 115.31 121.47 1yz1 h LEU 103 Ca 0.11 -0.33 0.17 0.00 0.08 0.00 0.00 57.88 57.91 1yz1 h LEU 103 Cb 0.54 -0.17 -0.09 0.00 1.08 0.00 0.00 40.66 42.02 1yz1 h LEU 103 CO 0.03 0.82 0.61 -0.33 -1.08 0.00 0.00 178.44 178.49 1yz1 h GLU 104 N 0.45 0.69 0.06 1.13 5.08 -0.56 1.65 114.58 123.08 1yz1 h GLU 104 Ca 0.10 -0.04 -0.28 0.00 -1.00 0.00 0.00 59.36 58.14 1yz1 h GLU 104 Cb 0.51 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1yz1 h GLU 104 CO 0.02 0.46 -1.42 1.05 -1.00 0.00 0.00 179.01 178.12 1yz1 h GLU 105 N 0.71 0.12 0.00 2.33 4.11 -1.44 -3.38 114.58 117.03 1yz1 h GLU 105 Ca 0.52 -0.21 -0.33 0.00 0.07 0.00 0.00 59.36 59.41 1yz1 h GLU 105 Cb 0.86 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.13 1yz1 h GLU 105 CO -0.28 0.95 -2.23 1.04 0.07 0.00 0.00 179.01 178.56 1yz1 n GLN 106 N -3.34 1.05 -2.98 1.06 6.02 -0.36 -4.86 117.38 113.97 1yz1 n GLN 106 Ca -0.12 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.73 1yz1 n GLN 106 Cb 1.02 -1.46 0.01 0.00 1.02 0.00 0.00 30.24 30.83 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 -2.70 0.90 -0.28 -1.09 1.74 0.55 -5.03 116.66 110.74 1yz1 n ARG 107 Ca -0.30 -2.63 0.06 0.00 -0.77 0.00 0.00 57.85 54.21 1yz1 n ARG 107 Cb 1.07 -1.37 0.13 0.00 -1.02 0.00 0.00 32.46 31.27 1yz1 n ARG 107 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1yz1 n PRO 108 N 0.78 -0.07 0.00 5.56 -0.02 -1.01 0.52 135.00 140.77 1yz1 n PRO 108 Ca 0.16 1.22 0.03 0.00 -2.02 0.00 0.00 63.50 62.90 1yz1 n PRO 108 Cb 0.64 -1.85 0.17 0.00 -0.02 0.00 0.00 33.50 32.44 1yz1 n PRO 108 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1yz1 n GLU 109 N -5.26 0.07 0.06 -0.52 -0.58 -1.26 -2.04 120.64 111.10 1yz1 n GLU 109 Ca 0.14 0.27 0.10 0.00 -0.42 0.00 0.00 57.16 57.24 1yz1 n GLU 109 Cb 0.43 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.74 1yz1 n GLU 109 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1yz1 n ARG 110 N -1.35 0.62 0.00 3.49 3.00 0.19 -4.57 116.66 118.04 1yz1 n ARG 110 Ca 0.03 0.04 -0.13 0.00 -0.00 0.00 0.00 57.85 57.79 1yz1 n ARG 110 Cb 0.06 -1.73 -0.07 0.00 0.00 0.00 0.00 32.46 30.73 1yz1 n ARG 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1yz1 h VAL 111 N 0.00 0.12 0.40 5.15 2.07 -1.50 -0.06 116.25 122.42 1yz1 h VAL 111 Ca -0.03 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1yz1 h VAL 111 Cb 1.08 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1yz1 h VAL 111 CO 0.00 0.00 -0.27 0.50 0.02 0.00 0.00 177.57 177.82 1yz1 h LYS 112 N -0.51 -0.63 -0.56 1.57 1.63 -1.80 0.42 116.57 116.68 1yz1 h LYS 112 Ca 0.07 0.04 0.08 0.00 -0.85 0.00 0.00 60.65 59.99 1yz1 h LYS 112 Cb 0.64 0.14 -0.06 0.00 -0.60 0.00 0.00 32.23 32.35 1yz1 h LYS 112 CO -0.40 -0.42 0.22 -1.35 -3.45 0.00 0.00 179.45 174.05 1yz1 h PRO 113 N -0.66 0.41 0.13 1.90 0.11 -1.79 -1.10 132.00 131.00 1yz1 h PRO 113 Ca -0.04 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1yz1 h PRO 113 Cb 0.55 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 1yz1 h PRO 113 CO 0.02 0.27 -0.13 0.35 -0.21 0.00 0.00 178.00 178.30 1yz1 h PHE 114 N 0.42 -0.33 -0.68 0.65 3.57 -0.77 -0.94 116.94 118.86 1yz1 h PHE 114 Ca 0.27 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.72 1yz1 h PHE 114 Cb 0.29 0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 1yz1 h PHE 114 CO -0.15 -0.20 0.20 0.52 -2.23 0.00 0.00 178.31 176.45 1yz1 h MET 115 N -0.29 1.04 -0.40 1.11 2.86 -0.58 0.23 114.93 118.91 1yz1 h MET 115 Ca 0.00 -0.22 -0.08 0.00 -2.06 0.00 0.00 59.70 57.34 1yz1 h MET 115 Cb 0.27 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1yz1 h MET 115 CO -0.03 0.90 -0.08 1.79 1.06 0.00 0.00 176.91 180.55 1yz1 h THR 116 N 1.00 1.27 -0.40 2.22 1.35 -1.14 -1.86 112.91 115.35 1yz1 h THR 116 Ca 0.22 -1.16 -0.07 0.00 -0.55 0.00 0.00 66.41 64.85 1yz1 h THR 116 Cb 0.30 1.21 -0.01 0.00 -1.73 0.00 0.00 68.15 67.92 1yz1 h THR 116 CO -0.01 0.39 -0.02 1.23 -0.25 0.00 0.00 175.52 176.86 1yz1 h GLY 117 N 0.57 0.79 0.98 5.82 0.00 -0.83 -2.92 103.07 107.48 1yz1 h GLY 117 Ca 0.10 -0.60 0.01 0.00 0.00 0.00 0.00 47.33 46.84 1yz1 h GLY 117 CO 0.04 0.55 0.41 0.00 0.00 0.00 0.00 176.54 177.53 1yz1 h ALA 118 N 0.88 0.79 -0.69 3.60 0.00 -0.50 -0.38 119.26 122.96 1yz1 h ALA 118 Ca 0.11 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1yz1 h ALA 118 Cb 0.51 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 1yz1 h ALA 118 CO 0.03 0.21 0.40 0.00 0.00 0.00 0.00 179.25 179.88 1yz1 h ALA 119 N 1.23 0.92 -0.14 0.00 0.00 -1.26 0.19 119.26 120.20 1yz1 h ALA 119 Ca 0.23 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.98 1yz1 h ALA 119 Cb -0.08 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.56 1yz1 h ALA 119 CO -0.06 0.11 -0.58 0.93 0.00 0.00 0.00 179.25 179.65 1yz1 h GLU 120 N 0.75 0.63 -0.63 0.00 5.08 -1.29 -2.51 114.58 116.61 1yz1 h GLU 120 Ca 0.30 -0.50 -0.02 0.00 -1.00 0.00 0.00 59.36 58.13 1yz1 h GLU 120 Cb 0.14 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1yz1 h GLU 120 CO -0.16 1.12 0.29 0.37 -1.00 0.00 0.00 179.01 179.63 1yz1 h GLN 121 N 0.29 0.89 -0.36 2.33 5.75 -0.74 0.07 115.11 123.35 1yz1 h GLN 121 Ca -0.03 -0.12 -0.03 0.00 -0.15 0.00 0.00 58.65 58.31 1yz1 h GLN 121 Cb 1.22 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 29.58 1yz1 h GLN 121 CO 0.12 0.70 0.10 0.82 -2.65 0.00 0.00 178.83 177.92 1yz1 h ILE 122 N 0.89 1.22 -0.89 2.39 2.04 -0.59 0.27 117.51 122.84 1yz1 h ILE 122 Ca 0.22 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.37 1yz1 h ILE 122 Cb 0.11 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 1yz1 h ILE 122 CO -0.03 0.25 0.58 0.11 0.00 0.00 0.00 178.15 179.07 1yz1 h LYS 123 N 0.42 1.15 0.52 2.37 1.79 -0.93 0.03 116.57 121.91 1yz1 h LYS 123 Ca 0.11 -0.07 -0.03 0.00 -2.18 0.00 0.00 60.65 58.49 1yz1 h LYS 123 Cb 0.28 -0.26 0.01 0.00 -1.58 0.00 0.00 32.23 30.68 1yz1 h LYS 123 CO -0.00 0.76 -0.25 1.25 -1.08 0.00 0.00 179.45 180.13 1yz1 h HIS 124 N 1.18 -0.64 -0.45 -1.35 2.76 -0.54 -1.28 115.15 114.83 1yz1 h HIS 124 Ca 0.33 -0.02 0.09 0.00 -2.20 0.00 0.00 60.37 58.57 1yz1 h HIS 124 Cb -0.10 0.21 -0.08 0.00 1.55 0.00 0.00 27.41 28.99 1yz1 h HIS 124 CO -0.01 -0.34 -0.07 0.82 -1.30 0.00 0.00 177.93 177.03 1yz1 h ILE 125 N -0.86 0.59 -1.00 6.26 1.08 -0.28 -1.99 117.51 121.32 1yz1 h ILE 125 Ca -0.07 -0.01 0.01 0.00 -0.39 0.00 0.00 64.86 64.39 1yz1 h ILE 125 Cb 0.60 0.55 -0.05 0.00 -3.07 0.00 0.00 36.82 34.84 1yz1 h ILE 125 CO 0.12 0.01 0.66 -0.07 -0.69 0.00 0.00 178.15 178.17 1yz1 h LEU 126 N 0.04 1.15 -0.23 1.44 3.38 -0.93 0.17 115.31 120.33 1yz1 h LEU 126 Ca 0.22 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1yz1 h LEU 126 Cb 0.33 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1yz1 h LEU 126 CO -0.43 0.84 0.00 0.00 0.09 0.00 0.00 178.44 178.94 1yz1 n ALA 127 N -2.38 1.80 -2.21 1.53 0.00 -0.49 -2.65 120.51 116.12 1yz1 n ALA 127 Ca 0.12 -0.01 0.01 0.00 0.00 0.00 0.00 53.44 53.55 1yz1 n ALA 127 Cb 0.01 -1.34 0.08 0.00 0.00 0.00 0.00 19.45 18.21 1yz1 n ALA 127 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1yz1 n ASN 128 N -1.81 1.80 -0.19 0.00 3.02 -0.69 -4.92 115.26 112.46 1yz1 n ASN 128 Ca 0.04 -2.82 -0.04 0.00 -0.03 0.00 0.00 54.58 51.73 1yz1 n ASN 128 Cb 0.23 -0.41 0.02 0.00 -0.61 0.00 0.00 39.78 39.02 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 1.40 -0.75 0.00 3.10 3.57 -0.47 -1.28 116.94 122.52 1yz1 h PHE 129 Ca -0.07 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1yz1 h PHE 129 Cb 1.47 0.42 0.00 0.00 2.79 0.00 0.00 35.95 40.63 1yz1 h PHE 129 CO 0.50 -0.35 0.00 1.63 -2.23 0.00 0.00 178.31 177.85 1yz1 n LYS 130 N -5.43 0.05 0.24 1.11 4.01 -1.26 -2.39 118.16 114.48 1yz1 n LYS 130 Ca 0.05 0.29 0.14 0.00 -0.51 0.00 0.00 58.31 58.28 1yz1 n LYS 130 Cb 0.35 -1.50 0.36 0.00 -0.51 0.00 0.00 35.03 33.72 1yz1 n LYS 130 CO 0.00 0.00 0.00 -0.91 -1.11 0.00 0.00 177.40 175.38 1yz1 h ASN 131 N 0.00 0.00 -2.50 4.39 -0.26 -1.60 -3.46 115.58 112.15 1yz1 h ASN 131 Ca 0.00 0.00 -0.54 0.00 -0.56 0.00 0.00 56.30 55.20 1yz1 h ASN 131 Cb 0.10 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 37.30 1yz1 h ASN 131 CO 0.00 0.00 -0.54 -0.31 -1.06 0.00 0.00 177.43 175.52 1yz1 s TYR 132 N -3.37 3.17 0.12 1.19 2.02 -1.01 -4.72 117.35 114.76 1yz1 s TYR 132 Ca 0.05 -0.04 0.09 0.00 -0.37 0.00 0.00 57.07 56.79 1yz1 s TYR 132 Cb 0.06 -1.49 -0.04 0.00 -0.40 0.00 0.00 41.96 40.10 1yz1 s TYR 132 CO 0.62 0.52 -0.15 -0.65 -1.57 0.00 0.00 175.55 174.32 1yz1 s GLN 133 N -3.40 1.90 -0.06 -0.62 -0.21 -0.98 -4.95 119.66 111.34 1yz1 s GLN 133 Ca 0.32 -1.16 0.04 0.00 0.02 0.00 0.00 55.36 54.57 1yz1 s GLN 133 Cb -0.09 -2.16 -0.02 0.00 1.00 0.00 0.00 33.01 31.74 1yz1 s GLN 133 CO 0.24 0.48 -0.16 -0.06 -2.12 0.00 0.00 175.29 173.67 1yz1 s PHE 134 N -1.25 2.65 -0.01 0.91 0.40 -1.25 -1.39 117.98 118.04 1yz1 s PHE 134 Ca 0.20 -0.31 0.04 0.00 -0.60 0.00 0.00 56.93 56.25 1yz1 s PHE 134 Cb -0.10 -1.64 -0.01 0.00 0.51 0.00 0.00 43.02 41.77 1yz1 s PHE 134 CO 0.12 0.07 -0.12 -0.06 0.70 0.00 0.00 175.22 175.92 1yz1 s PHE 135 N -0.50 1.10 0.27 0.36 0.40 -0.06 -0.55 117.98 118.99 1yz1 s PHE 135 Ca 0.07 -0.21 0.10 0.00 -0.60 0.00 0.00 56.93 56.28 1yz1 s PHE 135 Cb -0.12 -0.71 -0.05 0.00 0.51 0.00 0.00 43.02 42.65 1yz1 s PHE 135 CO 0.01 -0.02 -0.16 -1.50 0.70 0.00 0.00 175.22 174.25 1yz1 s ILE 136 N -0.26 2.17 1.00 0.64 2.07 0.04 0.12 121.20 126.98 1yz1 s ILE 136 Ca 0.04 -2.30 -0.11 0.00 -1.41 0.00 0.00 60.65 56.87 1yz1 s ILE 136 Cb -0.05 -2.30 0.20 0.00 0.13 0.00 0.00 42.46 40.44 1yz1 s ILE 136 CO -0.00 -0.41 1.10 -0.83 -1.91 0.00 0.00 174.94 172.89 1yz1 s GLY 137 N -3.47 1.64 0.57 1.50 0.00 -1.26 -0.56 107.32 105.75 1yz1 s GLY 137 Ca 0.28 0.35 0.27 0.00 0.00 0.00 0.00 44.72 45.63 1yz1 s GLY 137 CO 0.13 0.87 2.07 -2.09 0.00 0.00 0.00 173.10 174.09 1yz1 h GLU 138 N -2.15 0.00 0.00 2.90 4.81 -1.80 0.58 114.58 118.91 1yz1 h GLU 138 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1yz1 h GLU 138 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 1yz1 h GLU 138 CO 0.44 0.00 0.00 -0.91 -0.73 0.00 0.00 179.01 177.81 1yz1 h ASN 139 N 0.00 0.00 -6.26 1.04 2.35 -1.90 -3.47 115.58 107.35 1yz1 h ASN 139 Ca 0.11 0.00 -0.47 0.00 -0.55 0.00 0.00 56.30 55.39 1yz1 h ASN 139 Cb 0.58 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.91 1yz1 h ASN 139 CO -0.00 0.00 -0.75 0.23 -1.65 0.00 0.00 177.43 175.26 1yz1 n MET 140 N -3.02 -5.50 -2.40 0.81 2.81 0.20 -4.90 117.12 105.12 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 0.33 -5.49 -0.02 0.00 -0.71 0.00 0.00 33.22 27.32 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 -3.27 6.69 0.47 7.83 3.84 -1.26 -4.90 114.94 124.34 1yz1 s ASN 141 Ca 0.66 1.30 0.25 0.00 0.21 0.00 0.00 52.86 55.28 1yz1 s ASN 141 Cb -0.33 -2.54 1.37 0.00 -0.55 0.00 0.00 41.25 39.20 1yz1 s ASN 141 CO 0.81 -1.04 1.74 1.55 -2.79 0.00 0.00 177.10 177.37 1yz1 h PRO 142 N 9.22 0.00 -0.02 0.43 0.13 -2.00 0.20 132.00 139.95 1yz1 h PRO 142 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 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 1.02 0.00 -0.03 -0.25 -0.23 0.00 0.00 178.00 178.52 1yz1 n ASP 143 N -2.49 2.39 -4.16 1.44 8.00 -1.26 -4.96 116.55 115.51 1yz1 n ASP 143 Ca -0.02 -1.78 -0.30 0.00 0.71 0.00 0.00 54.79 53.41 1yz1 n ASP 143 Cb 0.21 0.02 0.19 0.00 -0.02 0.00 0.00 41.12 41.52 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 -2.03 1.66 0.51 0.44 0.00 0.70 -4.81 107.32 103.78 1yz1 s GLY 144 Ca 0.31 -0.96 -0.21 0.00 0.00 0.00 0.00 44.72 43.86 1yz1 s GLY 144 CO 0.33 -0.20 1.11 -0.29 0.00 0.00 0.00 173.10 174.05 1yz1 s MET 145 N -5.58 3.58 -0.28 2.90 1.75 -1.26 -5.01 119.30 115.40 1yz1 s MET 145 Ca 0.71 1.58 0.00 0.00 -1.25 0.00 0.00 55.69 56.72 1yz1 s MET 145 Cb -0.08 -2.13 0.05 0.00 2.84 0.00 0.00 34.83 35.50 1yz1 s MET 145 CO 0.54 -0.65 -0.05 0.08 -0.65 0.00 0.00 175.02 174.29 1yz1 s VAL 146 N -1.77 2.67 0.36 10.11 1.01 -1.26 -4.32 120.40 127.19 1yz1 s VAL 146 Ca 0.69 -1.44 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 1yz1 s VAL 146 Cb -0.23 -2.52 -0.10 0.00 0.00 0.00 0.00 36.38 33.53 1yz1 s VAL 146 CO 0.27 -0.04 0.98 0.00 0.00 0.00 0.00 175.10 176.31 1yz1 s ALA 147 N 1.20 3.16 -0.16 5.51 0.00 0.12 -4.81 121.76 126.78 1yz1 s ALA 147 Ca -0.06 0.58 -0.07 0.00 0.00 0.00 0.00 51.96 52.41 1yz1 s ALA 147 Cb -0.19 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 1yz1 s ALA 147 CO -0.03 0.03 0.10 -0.51 0.00 0.00 0.00 175.76 175.36 1yz1 s LEU 148 N -2.33 4.11 -0.13 0.00 1.02 -0.76 -0.88 118.68 119.70 1yz1 s LEU 148 Ca 0.54 0.27 -0.01 0.00 0.02 0.00 0.00 54.13 54.94 1yz1 s LEU 148 Cb -0.19 -2.02 -0.02 0.00 0.02 0.00 0.00 46.19 43.97 1yz1 s LEU 148 CO 0.24 0.28 -0.10 -0.22 0.02 0.00 0.00 176.35 176.58 1yz1 s LEU 149 N -0.25 2.93 0.29 1.79 2.96 -0.48 -0.88 118.68 125.03 1yz1 s LEU 149 Ca 0.10 -0.24 -0.04 0.00 -0.22 0.00 0.00 54.13 53.73 1yz1 s LEU 149 Cb -0.12 -1.67 -0.01 0.00 0.50 0.00 0.00 46.19 44.89 1yz1 s LEU 149 CO 0.01 0.18 0.40 -0.62 -1.32 0.00 0.00 176.35 175.00 1yz1 s ASP 150 N 0.26 0.55 0.24 3.68 2.15 -0.86 -2.32 116.67 120.39 1yz1 s ASP 150 Ca -0.07 -1.34 0.11 0.00 0.43 0.00 0.00 52.55 51.69 1yz1 s ASP 150 Cb -0.15 0.58 -0.05 0.00 -0.30 0.00 0.00 42.92 43.00 1yz1 s ASP 150 CO 0.04 -1.15 -0.21 -0.31 -0.17 0.00 0.00 175.17 173.38 1yz1 s TYR 151 N -3.55 2.22 0.89 -5.34 1.51 -1.26 -1.31 117.35 110.51 1yz1 s TYR 151 Ca 0.31 -0.36 -0.15 0.00 -1.01 0.00 0.00 57.07 55.85 1yz1 s TYR 151 Cb 0.01 -1.01 0.21 0.00 -0.11 0.00 0.00 41.96 41.07 1yz1 s TYR 151 CO 0.16 0.61 0.94 0.54 -1.11 0.00 0.00 175.55 176.69 1yz1 n ARG 152 N -0.32 -2.00 -0.02 -0.62 5.12 -0.30 -4.84 116.66 113.67 1yz1 n ARG 152 Ca -0.08 -1.48 -0.09 0.00 -1.93 0.00 0.00 57.85 54.27 1yz1 n ARG 152 Cb 0.59 -1.20 -0.04 0.00 -1.16 0.00 0.00 32.46 30.65 1yz1 n ARG 152 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1yz1 h GLU 153 N 0.00 0.03 0.00 5.56 4.39 -2.01 -0.12 114.58 122.43 1yz1 h GLU 153 Ca -0.33 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.37 1yz1 h GLU 153 Cb 0.97 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 1yz1 h GLU 153 CO 0.22 0.02 0.17 -0.40 -1.16 0.00 0.00 179.01 177.86 1yz1 n ASP 154 N -5.15 0.10 -1.42 1.42 5.68 -1.26 -4.76 116.55 111.16 1yz1 n ASP 154 Ca -0.03 0.42 -0.18 0.00 -0.50 0.00 0.00 54.79 54.49 1yz1 n ASP 154 Cb 0.10 -0.41 -0.07 0.00 -1.14 0.00 0.00 41.12 39.59 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 -1.33 1.66 0.00 6.12 0.00 -0.06 -4.80 105.19 106.78 1yz1 n GLY 155 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1yz1 n GLY 155 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1yz1 n VAL 156 N -2.56 0.00 -2.96 1.61 0.31 -1.26 -4.93 118.33 108.54 1yz1 n VAL 156 Ca -0.18 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.73 1yz1 n VAL 156 Cb 0.60 -0.40 -0.05 0.00 -0.91 0.00 0.00 33.84 33.08 1yz1 n VAL 156 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1yz1 s THR 157 N -1.76 4.79 0.45 2.52 -1.32 -1.26 -4.73 115.64 114.33 1yz1 s THR 157 Ca 0.00 1.07 -0.15 0.00 -1.21 0.00 0.00 61.69 61.40 1yz1 s THR 157 Cb 0.00 -4.15 -0.08 0.00 -1.51 0.00 0.00 72.50 66.76 1yz1 s THR 157 CO 0.00 -0.30 0.89 -2.16 -2.21 0.00 0.00 174.62 170.84 1yz1 s PRO 158 N 2.97 3.93 -0.06 7.08 0.04 -1.26 -1.15 135.00 146.55 1yz1 s PRO 158 Ca 0.31 0.79 -0.11 0.00 0.04 0.00 0.00 61.00 62.03 1yz1 s PRO 158 Cb -0.14 -2.25 0.02 0.00 0.04 0.00 0.00 34.50 32.17 1yz1 s PRO 158 CO 0.14 -0.13 0.27 1.52 0.04 0.00 0.00 177.00 178.84 1yz1 s TYR 159 N -2.43 -0.21 0.04 0.56 -0.85 -0.43 -0.12 117.35 113.91 1yz1 s TYR 159 Ca 0.56 0.45 0.09 0.00 -0.52 0.00 0.00 57.07 57.65 1yz1 s TYR 159 Cb -0.10 0.08 -0.03 0.00 0.38 0.00 0.00 41.96 42.29 1yz1 s TYR 159 CO 0.28 -0.26 -0.24 -1.64 -1.52 0.00 0.00 175.55 172.17 1yz1 s MET 160 N -0.64 1.89 -0.16 -3.49 -1.94 0.14 -2.02 119.30 113.08 1yz1 s MET 160 Ca -0.07 -1.07 -0.03 0.00 -1.71 0.00 0.00 55.69 52.80 1yz1 s MET 160 Cb -0.04 -2.04 -0.02 0.00 2.01 0.00 0.00 34.83 34.73 1yz1 s MET 160 CO 0.02 0.52 -0.05 0.42 -0.01 0.00 0.00 175.02 175.93 1yz1 s ILE 161 N -0.84 3.76 0.19 2.53 1.01 -0.06 -0.09 121.20 127.70 1yz1 s ILE 161 Ca 0.12 -0.40 0.09 0.00 0.00 0.00 0.00 60.65 60.47 1yz1 s ILE 161 Cb -0.10 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.68 1yz1 s ILE 161 CO 0.03 0.49 -0.19 -0.36 0.00 0.00 0.00 174.94 174.91 1yz1 s PHE 162 N 0.48 1.93 -0.32 3.97 0.40 -0.51 -1.83 117.98 122.10 1yz1 s PHE 162 Ca -0.04 -0.45 -0.22 0.00 -0.60 0.00 0.00 56.93 55.62 1yz1 s PHE 162 Cb -0.14 -0.94 -0.00 0.00 0.51 0.00 0.00 43.02 42.45 1yz1 s PHE 162 CO 0.03 0.40 0.71 -0.06 0.70 0.00 0.00 175.22 177.00 1yz1 s PHE 163 N -2.16 3.19 0.19 0.36 0.08 -1.26 -1.22 117.98 117.15 1yz1 s PHE 163 Ca 0.19 0.65 -0.12 0.00 0.12 0.00 0.00 56.93 57.77 1yz1 s PHE 163 Cb -0.05 -3.14 0.17 0.00 -0.57 0.00 0.00 43.02 39.42 1yz1 s PHE 163 CO 0.08 -0.55 1.77 -0.22 -0.10 0.00 0.00 175.22 176.20 1yz1 h LYS 164 N 8.21 0.44 0.00 0.44 3.64 -1.60 -1.44 116.57 126.27 1yz1 h LYS 164 Ca -0.25 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1yz1 h LYS 164 Cb 1.11 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1yz1 h LYS 164 CO 0.85 0.29 0.00 -0.25 -2.27 0.00 0.00 179.45 178.07 1yz1 n ASP 165 N -4.93 0.44 -0.98 4.20 8.00 -1.26 -1.97 116.55 120.05 1yz1 n ASP 165 Ca 0.05 0.62 0.09 0.00 0.71 0.00 0.00 54.79 56.26 1yz1 n ASP 165 Cb 0.17 -0.71 0.23 0.00 -0.02 0.00 0.00 41.12 40.79 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 -0.29 1.47 3.35 0.44 0.00 -0.54 -4.91 105.19 104.71 1yz1 n GLY 166 Ca 0.02 -0.57 -0.23 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.01 2.44 -0.04 0.99 1.43 -0.83 -1.03 118.68 120.63 1yz1 s LEU 167 Ca 0.35 -0.86 0.04 0.00 -1.03 0.00 0.00 54.13 52.63 1yz1 s LEU 167 Cb 0.18 -0.90 -0.00 0.00 0.03 0.00 0.00 46.19 45.50 1yz1 s LEU 167 CO 0.24 -0.00 -0.18 -1.83 0.23 0.00 0.00 176.35 174.81 1yz1 s GLU 168 N -2.77 1.83 0.08 1.70 -1.05 -0.32 -4.84 118.70 113.34 1yz1 s GLU 168 Ca 0.17 -0.63 -0.11 0.00 -0.15 0.00 0.00 54.97 54.24 1yz1 s GLU 168 Cb -0.06 -1.59 -0.06 0.00 -0.44 0.00 0.00 34.13 31.97 1yz1 s GLU 168 CO 0.07 0.26 0.43 -1.64 0.95 0.00 0.00 175.26 175.33 1yz1 s MET 169 N 0.01 3.82 -0.06 -4.83 -1.94 -1.26 -0.81 119.30 114.23 1yz1 s MET 169 Ca -0.04 0.27 0.01 0.00 -1.71 0.00 0.00 55.69 54.22 1yz1 s MET 169 Cb -0.12 -3.01 0.02 0.00 2.01 0.00 0.00 34.83 33.73 1yz1 s MET 169 CO 0.02 0.56 -0.08 -1.21 -0.01 0.00 0.00 175.02 174.30 1yz1 s GLU 170 N -1.81 1.26 0.10 2.03 2.02 0.02 -4.96 118.70 117.35 1yz1 s GLU 170 Ca 0.33 -0.24 -0.30 0.00 0.02 0.00 0.00 54.97 54.77 1yz1 s GLU 170 Cb -0.14 -1.16 -0.05 0.00 0.10 0.00 0.00 34.13 32.87 1yz1 s GLU 170 CO 0.18 -0.06 0.97 0.15 0.02 0.00 0.00 175.26 176.51 1yz1 s LYS 171 N 0.92 4.68 0.00 1.61 -0.14 -1.26 -0.63 119.74 124.92 1yz1 s LYS 171 Ca -0.11 1.45 0.00 0.00 -1.36 0.00 0.00 55.97 55.95 1yz1 s LYS 171 Cb -0.15 -3.39 0.00 0.00 -1.68 0.00 0.00 37.83 32.61 1yz1 s LYS 171 CO 0.01 0.17 0.00 0.00 -0.76 0.00 0.00 175.35 174.77