#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lee s GLY 0 N 0.00 -0.34 0.00 -3.96 0.00 -1.26 -4.62 107.32 97.14 1lee s GLY 0 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.05 1lee s GLY 0 CO 0.00 3.92 0.00 1.44 0.00 0.00 0.00 173.10 178.46 1lee n SER 1 N 15.93 0.00 0.00 1.64 7.64 -1.26 -5.00 113.62 132.57 1lee n SER 1 Ca 0.38 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.26 1lee n SER 1 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 1lee n SER 1 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1lee n SER 2 N 7.98 0.00 -0.49 6.43 2.88 -1.26 -4.89 113.62 124.27 1lee n SER 2 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1lee n SER 2 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1lee n SER 2 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1lee n ASN 3 N 5.11 -3.42 -4.41 -3.46 3.02 -1.26 -4.95 115.26 105.90 1lee n ASN 3 Ca 0.00 0.38 -0.44 0.00 -0.03 0.00 0.00 54.58 54.49 1lee n ASN 3 Cb 0.00 -0.76 -0.09 0.00 -0.61 0.00 0.00 39.78 38.32 1lee n ASN 3 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1lee s ASP 4 N -2.29 6.09 -0.21 6.41 2.15 -0.61 -4.94 116.67 123.27 1lee s ASP 4 Ca 0.00 -1.17 -0.10 0.00 0.43 0.00 0.00 52.55 51.70 1lee s ASP 4 Cb 0.00 -2.16 -0.05 0.00 -0.30 0.00 0.00 42.92 40.41 1lee s ASP 4 CO 0.00 -0.56 0.14 0.20 -0.17 0.00 0.00 175.17 174.78 1lee s ASN 5 N 2.21 6.20 -0.22 -0.34 -0.87 -1.26 -1.22 114.94 119.43 1lee s ASN 5 Ca 0.04 0.21 -0.03 0.00 -1.57 0.00 0.00 52.86 51.51 1lee s ASN 5 Cb -0.22 -2.10 0.00 0.00 -0.02 0.00 0.00 41.25 38.91 1lee s ASN 5 CO 0.08 0.15 -0.06 -0.63 -2.57 0.00 0.00 177.10 174.07 1lee s ILE 6 N 0.54 3.20 0.28 0.60 1.01 -0.40 -4.81 121.20 121.62 1lee s ILE 6 Ca 0.08 -0.62 -0.29 0.00 0.00 0.00 0.00 60.65 59.82 1lee s ILE 6 Cb -0.12 -2.48 -0.10 0.00 0.01 0.00 0.00 42.46 39.78 1lee s ILE 6 CO -0.00 0.39 1.17 -0.70 0.00 0.00 0.00 174.94 175.80 1lee s GLU 7 N 1.44 4.54 -0.15 2.79 2.12 -1.26 -0.71 118.70 127.47 1lee s GLU 7 Ca 0.05 1.92 -0.06 0.00 0.36 0.00 0.00 54.97 57.24 1lee s GLU 7 Cb -0.15 -3.17 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 1lee s GLU 7 CO -0.04 0.06 0.04 -0.51 -0.54 0.00 0.00 175.26 174.27 1lee s LEU 8 N -1.34 3.75 -0.28 2.70 1.43 -0.71 -4.47 118.68 119.76 1lee s LEU 8 Ca 0.47 0.10 -0.09 0.00 -1.03 0.00 0.00 54.13 53.58 1lee s LEU 8 Cb -0.34 -1.92 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 1lee s LEU 8 CO 0.43 0.24 0.13 -0.69 0.23 0.00 0.00 176.35 176.69 1lee s VAL 9 N -0.03 4.63 0.50 -1.59 1.01 0.10 -3.27 120.40 121.77 1lee s VAL 9 Ca 0.05 -0.18 -0.19 0.00 0.00 0.00 0.00 61.98 61.66 1lee s VAL 9 Cb -0.12 -3.24 -0.08 0.00 0.00 0.00 0.00 36.38 32.93 1lee s VAL 9 CO 0.01 0.23 1.02 -0.62 0.00 0.00 0.00 175.10 175.74 1lee s ASP 10 N 1.65 6.37 -0.29 3.32 -1.08 -1.26 0.97 116.67 126.34 1lee s ASP 10 Ca 0.06 1.83 -0.03 0.00 -0.52 0.00 0.00 52.55 53.89 1lee s ASP 10 Cb -0.16 -2.55 0.10 0.00 -1.46 0.00 0.00 42.92 38.85 1lee s ASP 10 CO 0.06 -0.76 0.12 0.12 0.52 0.00 0.00 175.17 175.23 1lee s PHE 11 N -2.16 0.67 -1.36 -5.34 2.19 0.30 -4.89 117.98 107.39 1lee s PHE 11 Ca 0.65 -1.08 0.00 0.00 0.33 0.00 0.00 56.93 56.83 1lee s PHE 11 Cb -0.14 -1.10 0.00 0.00 -1.31 0.00 0.00 43.02 40.47 1lee s PHE 11 CO 0.23 -0.83 0.00 1.04 1.83 0.00 0.00 175.22 177.49 1lee n GLN 12 N 5.15 -1.35 -1.06 10.12 1.13 -1.26 -0.81 117.38 129.30 1lee n GLN 12 Ca -0.05 0.76 -0.02 0.00 -1.94 0.00 0.00 57.00 55.75 1lee n GLN 12 Cb 0.42 -5.03 -0.01 0.00 0.11 0.00 0.00 30.24 25.74 1lee n GLN 12 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1lee n ASN 13 N -0.58 -4.35 -0.13 1.08 5.03 -1.26 -4.85 115.26 110.20 1lee n ASN 13 Ca -0.13 0.05 -0.25 0.00 0.87 0.00 0.00 54.58 55.12 1lee n ASN 13 Cb 0.44 -2.03 -0.08 0.00 -1.02 0.00 0.00 39.78 37.09 1lee n ASN 13 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1lee n ILE 14 N -2.57 1.52 -4.26 2.41 5.41 0.01 -4.99 119.36 116.89 1lee n ILE 14 Ca -0.02 -0.25 -0.14 0.00 1.00 0.00 0.00 62.75 63.33 1lee n ILE 14 Cb 0.25 -1.99 -0.10 0.00 -0.71 0.00 0.00 39.64 37.09 1lee n ILE 14 CO 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 176.55 176.51 1lee s MET 15 N -2.59 1.24 0.06 0.38 -1.94 -0.52 -4.76 119.30 111.17 1lee s MET 15 Ca -0.36 -1.64 -0.08 0.00 -1.71 0.00 0.00 55.69 51.90 1lee s MET 15 Cb 0.12 -0.15 -0.00 0.00 2.01 0.00 0.00 34.83 36.81 1lee s MET 15 CO 0.48 -0.25 0.16 -0.59 -0.01 0.00 0.00 175.02 174.81 1lee s PHE 16 N -3.80 0.15 0.15 -0.03 -0.12 -1.26 0.11 117.98 113.18 1lee s PHE 16 Ca 0.32 -0.49 0.00 0.00 -0.05 0.00 0.00 56.93 56.71 1lee s PHE 16 Cb 0.07 -0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.33 1lee s PHE 16 CO 0.09 -0.46 0.03 0.71 -0.05 0.00 0.00 175.22 175.55 1lee s TYR 17 N -3.17 0.99 0.05 3.49 1.51 0.27 -4.74 117.35 115.75 1lee s TYR 17 Ca -0.00 -1.15 -0.04 0.00 -1.01 0.00 0.00 57.07 54.87 1lee s TYR 17 Cb 0.02 -0.57 -0.02 0.00 -0.11 0.00 0.00 41.96 41.28 1lee s TYR 17 CO -0.07 -0.40 0.04 0.20 -1.11 0.00 0.00 175.55 174.22 1lee s GLY 18 N -3.10 0.29 -0.00 0.71 0.00 -0.84 0.03 107.32 104.41 1lee s GLY 18 Ca 0.24 -0.83 0.02 0.00 0.00 0.00 0.00 44.72 44.14 1lee s GLY 18 CO 0.02 -0.96 -0.01 0.99 0.00 0.00 0.00 173.10 173.15 1lee s ASP 19 N -2.48 5.07 0.17 1.64 1.11 -1.26 -0.35 116.67 120.57 1lee s ASP 19 Ca 0.00 -0.02 -0.06 0.00 0.18 0.00 0.00 52.55 52.65 1lee s ASP 19 Cb 0.02 -1.31 -0.02 0.00 1.07 0.00 0.00 42.92 42.68 1lee s ASP 19 CO -0.07 0.28 0.22 0.00 1.18 0.00 0.00 175.17 176.78 1lee s ALA 20 N -1.08 0.42 0.08 5.23 0.00 -1.02 -4.57 121.76 120.83 1lee s ALA 20 Ca 0.19 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 51.00 1lee s ALA 20 Cb -0.11 0.99 -0.03 0.00 0.00 0.00 0.00 23.12 23.96 1lee s ALA 20 CO 0.10 -0.62 -0.12 -1.21 0.00 0.00 0.00 175.76 173.91 1lee s GLU 21 N -4.03 0.82 0.04 0.00 8.01 -0.64 -2.11 118.70 120.78 1lee s GLU 21 Ca 0.24 -1.03 0.05 0.00 0.01 0.00 0.00 54.97 54.23 1lee s GLU 21 Cb 0.05 -0.69 -0.02 0.00 -4.31 0.00 0.00 34.13 29.15 1lee s GLU 21 CO 0.04 0.14 -0.15 0.08 0.01 0.00 0.00 175.26 175.37 1lee s VAL 22 N -1.76 1.19 0.00 2.63 1.01 -0.58 -0.46 120.40 122.42 1lee s VAL 22 Ca 0.01 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.99 1lee s VAL 22 Cb -0.07 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.25 1lee s VAL 22 CO 0.02 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.78 1lee n GLY 23 N 1.95 0.02 0.10 4.51 0.00 0.17 -1.00 105.19 110.94 1lee n GLY 23 Ca -0.18 -1.61 0.09 0.00 0.00 0.00 0.00 46.02 44.33 1lee n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1lee n ASP 24 N -0.76 0.42 -0.99 1.61 3.85 -1.26 0.14 116.55 119.56 1lee n ASP 24 Ca 0.00 0.63 0.11 0.00 -0.71 0.00 0.00 54.79 54.82 1lee n ASP 24 Cb 0.00 -0.71 0.27 0.00 -1.35 0.00 0.00 41.12 39.32 1lee n ASP 24 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 1lee n ASN 25 N -2.00 2.94 -3.84 -1.12 6.94 -1.26 -4.98 115.26 111.94 1lee n ASN 25 Ca 0.01 -1.93 -0.36 0.00 -0.02 0.00 0.00 54.58 52.28 1lee n ASN 25 Cb 0.14 -0.26 0.03 0.00 -2.36 0.00 0.00 39.78 37.34 1lee n ASN 25 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1lee n GLN 26 N 1.14 -1.07 -2.07 -3.83 6.02 0.12 -4.89 117.38 112.80 1lee n GLN 26 Ca 0.19 0.33 -0.42 0.00 -0.01 0.00 0.00 57.00 57.08 1lee n GLN 26 Cb 0.51 -3.65 -0.03 0.00 1.02 0.00 0.00 30.24 28.09 1lee n GLN 26 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1lee s GLN 27 N -6.50 4.28 0.14 -1.09 -0.21 -0.17 -4.67 119.66 111.44 1lee s GLN 27 Ca 0.44 2.21 -0.28 0.00 0.02 0.00 0.00 55.36 57.74 1lee s GLN 27 Cb -0.19 -3.19 -0.07 0.00 1.00 0.00 0.00 33.01 30.56 1lee s GLN 27 CO 0.90 -0.48 0.88 -1.25 -2.12 0.00 0.00 175.29 173.22 1lee s PRO 28 N 0.81 4.67 -0.00 2.91 0.04 -1.26 -1.53 135.00 140.64 1lee s PRO 28 Ca 0.65 1.32 -0.11 0.00 0.04 0.00 0.00 61.00 62.90 1lee s PRO 28 Cb -0.40 -3.33 0.01 0.00 0.04 0.00 0.00 34.50 30.83 1lee s PRO 28 CO 0.33 0.38 0.22 -0.06 0.04 0.00 0.00 177.00 177.91 1lee s PHE 29 N -0.55 -0.06 -0.16 0.56 0.08 -0.90 -4.81 117.98 112.15 1lee s PHE 29 Ca 0.41 0.04 -0.05 0.00 0.12 0.00 0.00 56.93 57.45 1lee s PHE 29 Cb -0.23 0.02 -0.04 0.00 -0.57 0.00 0.00 43.02 42.20 1lee s PHE 29 CO 0.28 -0.35 0.02 0.99 -0.10 0.00 0.00 175.22 176.07 1lee s THR 30 N -1.45 4.43 0.19 0.64 2.01 -1.26 -2.43 115.64 117.77 1lee s THR 30 Ca -0.14 -0.17 0.08 0.00 0.31 0.00 0.00 61.69 61.78 1lee s THR 30 Cb -0.06 -2.96 -0.04 0.00 0.01 0.00 0.00 72.50 69.45 1lee s THR 30 CO 0.02 0.50 -0.16 -0.36 -0.69 0.00 0.00 174.62 173.93 1lee s PHE 31 N 0.12 1.77 -0.25 4.92 0.08 0.52 0.12 117.98 125.26 1lee s PHE 31 Ca 0.03 -0.52 -0.19 0.00 0.12 0.00 0.00 56.93 56.37 1lee s PHE 31 Cb -0.13 -0.84 -0.03 0.00 -0.57 0.00 0.00 43.02 41.46 1lee s PHE 31 CO 0.01 0.37 0.55 0.42 -0.10 0.00 0.00 175.22 176.47 1lee s ILE 32 N -2.61 5.05 -0.43 0.64 -1.09 -0.68 -1.98 121.20 120.10 1lee s ILE 32 Ca 0.20 0.96 -0.22 0.00 -2.23 0.00 0.00 60.65 59.36 1lee s ILE 32 Cb -0.03 -3.86 0.02 0.00 -1.58 0.00 0.00 42.46 37.01 1lee s ILE 32 CO 0.07 0.08 0.75 -0.76 -1.23 0.00 0.00 174.94 173.85 1lee s LEU 33 N 2.29 4.28 -0.35 2.97 1.43 -1.26 -1.04 118.68 127.00 1lee s LEU 33 Ca 0.23 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1lee s LEU 33 Cb -0.16 -2.92 0.09 0.00 0.03 0.00 0.00 46.19 43.24 1lee s LEU 33 CO 0.09 -0.84 0.08 -0.62 0.23 0.00 0.00 176.35 175.28 1lee s ASP 34 N 2.05 4.94 0.00 2.29 3.68 0.89 -4.24 116.67 126.27 1lee s ASP 34 Ca 0.28 -1.82 0.13 0.00 2.13 0.00 0.00 52.55 53.27 1lee s ASP 34 Cb -0.13 -1.71 0.65 0.00 -1.45 0.00 0.00 42.92 40.28 1lee s ASP 34 CO 0.21 -0.39 1.31 0.35 0.13 0.00 0.00 175.17 176.77 1lee n THR 35 N 4.48 0.62 -0.74 1.71 -2.24 -1.26 -1.13 114.28 115.71 1lee n THR 35 Ca -0.04 0.15 0.08 0.00 -2.27 0.00 0.00 64.05 61.98 1lee n THR 35 Cb 0.42 -0.95 0.36 0.00 -2.10 0.00 0.00 70.33 68.06 1lee n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lee n GLY 36 N -0.21 2.97 3.54 3.38 0.00 -1.26 -4.09 105.19 109.52 1lee n GLY 36 Ca 0.06 -0.88 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 1lee n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lee s SER 37 N -0.97 0.18 -0.06 1.61 1.04 -1.12 -5.01 113.70 109.36 1lee s SER 37 Ca 0.51 -1.12 0.21 0.00 0.48 0.00 0.00 55.95 56.03 1lee s SER 37 Cb 0.35 0.60 0.41 0.00 0.10 0.00 0.00 66.02 67.48 1lee s SER 37 CO 0.20 -1.18 1.18 0.00 0.98 0.00 0.00 173.24 174.42 1lee n ALA 38 N -0.42 2.71 -2.54 5.32 0.00 -1.26 -1.40 120.51 122.91 1lee n ALA 38 Ca -0.01 -2.57 -0.11 0.00 0.00 0.00 0.00 53.44 50.75 1lee n ALA 38 Cb 0.62 -0.62 -0.11 0.00 0.00 0.00 0.00 19.45 19.35 1lee n ALA 38 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1lee s ASN 39 N -2.32 0.78 -0.09 0.00 -0.87 -1.26 -4.48 114.94 106.69 1lee s ASN 39 Ca 0.34 -0.75 -0.00 0.00 -1.57 0.00 0.00 52.86 50.87 1lee s ASN 39 Cb 0.37 0.09 -0.03 0.00 -0.02 0.00 0.00 41.25 41.66 1lee s ASN 39 CO -0.13 -0.36 -0.06 -0.22 -2.57 0.00 0.00 177.10 173.75 1lee s LEU 40 N -2.23 3.16 -0.01 0.60 0.20 -1.26 -1.32 118.68 117.83 1lee s LEU 40 Ca -0.02 -0.07 -0.05 0.00 0.69 0.00 0.00 54.13 54.69 1lee s LEU 40 Cb -0.02 -1.71 -0.00 0.00 -0.43 0.00 0.00 46.19 44.03 1lee s LEU 40 CO -0.03 0.30 0.09 -1.66 -0.29 0.00 0.00 176.35 174.76 1lee s TRP 41 N -0.43 0.05 0.01 5.38 1.48 -0.71 -0.54 118.94 124.17 1lee s TRP 41 Ca 0.06 -0.10 0.00 0.00 -1.06 0.00 0.00 56.10 55.01 1lee s TRP 41 Cb -0.12 -0.06 -0.01 0.00 -1.16 0.00 0.00 33.47 32.13 1lee s TRP 41 CO 0.02 -0.20 -0.02 0.14 -4.06 0.00 0.00 176.95 172.83 1lee s VAL 42 N -0.99 0.15 0.20 -0.66 -7.23 -0.29 -3.24 120.40 108.33 1lee s VAL 42 Ca -0.11 -0.35 -0.30 0.00 -1.81 0.00 0.00 61.98 59.41 1lee s VAL 42 Cb -0.06 -0.18 -0.08 0.00 0.56 0.00 0.00 36.38 36.61 1lee s VAL 42 CO 0.01 -0.13 1.22 -2.16 -0.31 0.00 0.00 175.10 173.72 1lee s PRO 43 N -0.51 4.48 0.57 4.82 0.04 -1.26 -1.37 135.00 141.77 1lee s PRO 43 Ca -0.04 1.93 -0.08 0.00 0.04 0.00 0.00 61.00 62.84 1lee s PRO 43 Cb -0.04 -3.22 -0.02 0.00 0.04 0.00 0.00 34.50 31.26 1lee s PRO 43 CO -0.00 -0.10 0.92 0.45 0.04 0.00 0.00 177.00 178.31 1lee s SER 44 N 0.05 6.04 0.53 6.66 0.15 -0.16 -0.95 113.70 126.01 1lee s SER 44 Ca 0.53 1.07 0.24 0.00 0.70 0.00 0.00 55.95 58.48 1lee s SER 44 Cb -0.34 -2.18 1.47 0.00 -1.71 0.00 0.00 66.02 63.26 1lee s SER 44 CO 0.38 -0.85 2.13 1.62 1.20 0.00 0.00 173.24 177.73 1lee h VAL 45 N -0.12 0.73 -0.11 4.45 3.04 -1.31 -1.55 116.25 121.39 1lee h VAL 45 Ca -0.45 -0.29 0.00 0.00 -1.01 0.00 0.00 66.70 64.95 1lee h VAL 45 Cb 1.21 1.17 0.00 0.00 -2.01 0.00 0.00 31.29 31.66 1lee h VAL 45 CO 0.62 0.07 0.00 0.29 -1.01 0.00 0.00 177.57 177.54 1lee n LYS 46 N -3.99 1.50 -3.53 4.17 5.02 -1.26 -4.77 118.16 115.30 1lee n LYS 46 Ca -0.03 -0.49 -0.40 0.00 -2.02 0.00 0.00 58.31 55.37 1lee n LYS 46 Cb 0.16 -1.40 -0.11 0.00 -0.02 0.00 0.00 35.03 33.67 1lee n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1lee n THR 48 N 5.10 0.00 -0.58 0.00 -2.24 -1.26 -4.83 114.28 110.48 1lee n THR 48 Ca -0.13 -0.08 -0.30 0.00 -2.27 0.00 0.00 64.05 61.27 1lee n THR 48 Cb 0.50 1.04 0.21 0.00 -2.10 0.00 0.00 70.33 69.98 1lee n THR 48 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1lee n THR 49 N -1.02 0.00 -0.05 4.28 -2.24 -1.26 -4.89 114.28 109.10 1lee n THR 49 Ca 0.06 -0.29 -0.05 0.00 -2.27 0.00 0.00 64.05 61.50 1lee n THR 49 Cb 0.37 -0.90 0.16 0.00 -2.10 0.00 0.00 70.33 67.87 1lee n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1lee h ALA 50 N -2.30 1.04 -0.62 6.98 0.00 -1.96 -3.13 119.26 119.26 1lee h ALA 50 Ca -0.54 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.02 1lee h ALA 50 Cb 1.32 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 1lee h ALA 50 CO 0.44 0.58 0.32 0.78 0.00 0.00 0.00 179.25 181.37 1lee h GLY 51 N 0.98 0.93 2.00 0.00 0.00 -1.91 -2.65 103.07 102.42 1lee h GLY 51 Ca 0.09 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1lee h GLY 51 CO 0.04 0.41 0.00 0.00 0.00 0.00 0.00 176.54 176.99 1lee h LEU 53 N 0.00 0.00 -1.81 0.00 3.38 -1.51 -2.99 115.31 112.39 1lee h LEU 53 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1lee h LEU 53 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1lee h LEU 53 CO 0.00 0.11 -0.05 0.35 0.09 0.00 0.00 178.44 178.95 1lee n THR 54 N -4.16 0.00 -3.50 0.22 -2.24 -1.25 -5.02 114.28 98.33 1lee n THR 54 Ca -0.03 -0.48 -0.22 0.00 -2.27 0.00 0.00 64.05 61.05 1lee n THR 54 Cb 0.19 1.46 -0.01 0.00 -2.10 0.00 0.00 70.33 69.87 1lee n THR 54 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1lee s LYS 55 N -1.98 3.38 0.07 -0.78 -0.14 -1.13 -5.07 119.74 114.08 1lee s LYS 55 Ca 0.26 -0.55 -0.29 0.00 -1.36 0.00 0.00 55.97 54.03 1lee s LYS 55 Cb 0.19 -2.73 -0.05 0.00 -1.68 0.00 0.00 37.83 33.56 1lee s LYS 55 CO 0.32 0.16 0.93 -1.01 -0.76 0.00 0.00 175.35 174.98 1lee s HIS 56 N -2.24 3.75 0.07 3.18 3.76 -1.26 -5.04 115.29 117.52 1lee s HIS 56 Ca 0.40 1.71 0.09 0.00 -0.15 0.00 0.00 55.06 57.10 1lee s HIS 56 Cb -0.09 -3.03 -0.03 0.00 1.11 0.00 0.00 32.58 30.53 1lee s HIS 56 CO 0.34 0.16 -0.21 -0.51 -0.85 0.00 0.00 174.74 173.66 1lee s LEU 57 N 0.28 2.51 -0.14 0.89 1.43 -1.26 -4.59 118.68 117.80 1lee s LEU 57 Ca 0.47 -0.54 -0.19 0.00 -1.03 0.00 0.00 54.13 52.84 1lee s LEU 57 Cb -0.22 -1.44 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 1lee s LEU 57 CO 0.28 0.23 0.54 -0.47 0.23 0.00 0.00 176.35 177.16 1lee s TYR 58 N -0.98 3.48 -0.33 0.29 6.14 -0.13 -4.72 117.35 121.10 1lee s TYR 58 Ca 0.15 0.93 0.04 0.00 0.64 0.00 0.00 57.07 58.82 1lee s TYR 58 Cb -0.10 -2.65 0.09 0.00 0.42 0.00 0.00 41.96 39.72 1lee s TYR 58 CO 0.06 0.05 0.03 0.34 0.64 0.00 0.00 175.55 176.67 1lee s ASP 59 N 0.84 4.73 0.00 4.32 -1.08 -1.26 -0.90 116.67 123.32 1lee s ASP 59 Ca 0.28 -2.04 0.12 0.00 -0.52 0.00 0.00 52.55 50.39 1lee s ASP 59 Cb -0.16 -1.62 0.51 0.00 -1.46 0.00 0.00 42.92 40.19 1lee s ASP 59 CO 0.11 -0.35 1.38 -1.54 0.52 0.00 0.00 175.17 175.29 1lee n SER 60 N 4.29 0.00 -0.00 -0.34 3.41 -1.26 -2.27 113.62 117.44 1lee n SER 60 Ca 0.01 0.50 0.15 0.00 -0.26 0.00 0.00 58.87 59.26 1lee n SER 60 Cb 0.42 -0.50 0.71 0.00 -0.26 0.00 0.00 64.21 64.58 1lee n SER 60 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1lee n SER 61 N -1.50 0.02 -1.37 4.04 3.41 -1.26 -3.06 113.62 113.90 1lee n SER 61 Ca 0.03 0.02 0.08 0.00 -0.26 0.00 0.00 58.87 58.74 1lee n SER 61 Cb 0.14 -0.33 0.33 0.00 -0.26 0.00 0.00 64.21 64.09 1lee n SER 61 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1lee n LYS 62 N -1.34 3.87 -3.76 4.33 4.76 -0.96 -4.89 118.16 120.16 1lee n LYS 62 Ca 0.12 -2.98 -0.24 0.00 -2.87 0.00 0.00 58.31 52.34 1lee n LYS 62 Cb 0.27 -2.03 -0.17 0.00 -1.84 0.00 0.00 35.03 31.25 1lee n LYS 62 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1lee s SER 63 N -1.36 1.90 0.37 4.39 0.15 -1.17 -4.56 113.70 113.42 1lee s SER 63 Ca 0.48 -0.26 0.16 0.00 0.70 0.00 0.00 55.95 57.03 1lee s SER 63 Cb 0.37 -0.48 0.74 0.00 -1.71 0.00 0.00 66.02 64.94 1lee s SER 63 CO 0.13 -0.22 1.79 0.03 1.20 0.00 0.00 173.24 176.17 1lee h ARG 64 N 8.31 0.00 0.00 5.44 3.08 -1.90 -2.86 114.38 126.45 1lee h ARG 64 Ca -0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1lee h ARG 64 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.17 1lee h ARG 64 CO 0.28 0.38 0.00 0.25 -1.07 0.00 0.00 179.97 179.81 1lee n THR 65 N -3.80 0.20 -1.79 2.04 -2.24 -1.26 -4.86 114.28 102.56 1lee n THR 65 Ca -0.01 0.05 -0.41 0.00 -2.27 0.00 0.00 64.05 61.41 1lee n THR 65 Cb 0.45 -0.65 -0.01 0.00 -2.10 0.00 0.00 70.33 68.03 1lee n THR 65 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1lee s TYR 66 N -2.53 2.66 -0.09 4.78 5.04 -1.08 -4.40 117.35 121.73 1lee s TYR 66 Ca 0.24 1.00 -0.01 0.00 -2.44 0.00 0.00 57.07 55.86 1lee s TYR 66 Cb 0.16 -4.04 0.03 0.00 0.35 0.00 0.00 41.96 38.46 1lee s TYR 66 CO 0.37 -3.24 -0.00 -2.00 -1.34 0.00 0.00 175.55 169.33 1lee s GLU 67 N -1.41 0.74 0.39 4.97 2.12 0.22 -4.96 118.70 120.77 1lee s GLU 67 Ca 0.57 -0.01 -0.27 0.00 0.36 0.00 0.00 54.97 55.62 1lee s GLU 67 Cb -0.47 -1.20 -0.10 0.00 0.26 0.00 0.00 34.13 32.61 1lee s GLU 67 CO 0.57 -0.34 1.49 0.21 -0.54 0.00 0.00 175.26 176.64 1lee s LYS 68 N 1.92 4.01 0.00 4.30 2.20 -1.26 -1.24 119.74 129.67 1lee s LYS 68 Ca 0.04 2.56 0.00 0.00 -0.36 0.00 0.00 55.97 58.22 1lee s LYS 68 Cb -0.13 -2.90 0.00 0.00 -1.51 0.00 0.00 37.83 33.29 1lee s LYS 68 CO -0.06 -0.61 0.00 -3.47 -0.36 0.00 0.00 175.35 170.85 1lee n ASP 69 N 0.31 0.00 0.00 1.43 4.64 -1.24 -4.84 116.55 116.86 1lee n ASP 69 Ca 0.02 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.43 1lee n ASP 69 Cb 0.40 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.48 1lee n ASP 69 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1lee n GLY 70 N 2.66 2.00 3.68 0.27 0.00 0.11 -4.96 105.19 108.95 1lee n GLY 70 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1lee n GLY 70 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1lee n THR 71 N -2.00 0.54 -2.24 2.61 -1.04 -1.26 -4.55 114.28 106.34 1lee n THR 71 Ca 0.00 -0.10 -0.41 0.00 -2.04 0.00 0.00 64.05 61.50 1lee n THR 71 Cb 0.00 -2.11 -0.03 0.00 -1.82 0.00 0.00 70.33 66.37 1lee n THR 71 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1lee s LYS 72 N 3.54 4.41 -0.00 -2.82 1.02 -1.26 0.22 119.74 124.85 1lee s LYS 72 Ca 0.87 2.04 0.03 0.00 0.02 0.00 0.00 55.97 58.92 1lee s LYS 72 Cb -0.52 -3.18 -0.01 0.00 -0.52 0.00 0.00 37.83 33.59 1lee s LYS 72 CO 0.42 -0.20 -0.09 0.08 -0.92 0.00 0.00 175.35 174.64 1lee s VAL 73 N -0.12 0.70 -0.18 3.17 1.01 -0.61 -4.88 120.40 119.49 1lee s VAL 73 Ca 0.55 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1lee s VAL 73 Cb -0.36 -0.60 0.02 0.00 0.00 0.00 0.00 36.38 35.44 1lee s VAL 73 CO 0.40 0.16 -0.17 -0.70 0.00 0.00 0.00 175.10 174.78 1lee s GLU 74 N -0.32 2.69 -0.45 2.72 2.12 -1.26 -0.68 118.70 123.51 1lee s GLU 74 Ca 0.03 -0.80 -0.14 0.00 0.36 0.00 0.00 54.97 54.42 1lee s GLU 74 Cb -0.04 -2.46 0.07 0.00 0.26 0.00 0.00 34.13 31.96 1lee s GLU 74 CO -0.00 -0.26 0.35 1.41 -0.54 0.00 0.00 175.26 176.22 1lee s MET 75 N 1.34 2.90 -0.56 4.30 -2.45 0.22 -4.98 119.30 120.06 1lee s MET 75 Ca 0.04 -1.33 -0.14 0.00 -1.25 0.00 0.00 55.69 53.00 1lee s MET 75 Cb -0.14 -4.03 0.14 0.00 1.25 0.00 0.00 34.83 32.05 1lee s MET 75 CO -0.12 -0.97 0.50 -0.80 1.05 0.00 0.00 175.02 174.68 1lee s ASN 76 N 2.38 6.16 0.65 1.11 0.02 -1.26 -1.66 114.94 122.33 1lee s ASN 76 Ca 0.04 -1.92 -0.03 0.00 -1.02 0.00 0.00 52.86 49.92 1lee s ASN 76 Cb -0.23 -2.17 0.06 0.00 0.02 0.00 0.00 41.25 38.92 1lee s ASN 76 CO 0.06 -0.79 0.92 -0.31 0.02 0.00 0.00 177.10 177.00 1lee s TYR 77 N 1.38 2.79 0.27 2.20 1.51 -0.22 -4.97 117.35 120.31 1lee s TYR 77 Ca 0.05 0.21 0.16 0.00 -1.01 0.00 0.00 57.07 56.49 1lee s TYR 77 Cb -0.27 -3.02 0.72 0.00 -0.11 0.00 0.00 41.96 39.27 1lee s TYR 77 CO 0.01 -1.23 1.77 -0.39 -1.11 0.00 0.00 175.55 174.60 1lee h VAL 78 N -0.34 1.06 0.00 0.71 -1.51 -2.01 -2.97 116.25 111.19 1lee h VAL 78 Ca -0.43 -1.46 0.00 0.00 -1.23 0.00 0.00 66.70 63.59 1lee h VAL 78 Cb 1.30 1.84 0.00 0.00 -2.13 0.00 0.00 31.29 32.30 1lee h VAL 78 CO 0.55 0.38 0.00 -1.20 -1.23 0.00 0.00 177.57 176.08 1lee n SER 79 N -3.76 0.70 0.00 4.19 7.64 -1.26 -5.03 113.62 116.10 1lee n SER 79 Ca -0.01 0.62 0.00 0.00 1.01 0.00 0.00 58.87 60.49 1lee n SER 79 Cb 0.47 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 62.88 1lee n SER 79 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lee n GLY 80 N 0.58 -0.12 2.96 0.23 0.00 -1.12 -4.92 105.19 102.80 1lee n GLY 80 Ca 0.04 -1.65 -0.21 0.00 0.00 0.00 0.00 46.02 44.20 1lee n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lee s THR 81 N -2.17 0.79 0.13 2.61 2.01 0.16 -1.05 115.64 118.12 1lee s THR 81 Ca 0.00 -0.30 0.10 0.00 0.31 0.00 0.00 61.69 61.80 1lee s THR 81 Cb 0.00 -0.74 -0.04 0.00 0.01 0.00 0.00 72.50 71.73 1lee s THR 81 CO 0.00 0.27 -0.24 0.68 -0.69 0.00 0.00 174.62 174.64 1lee s VAL 82 N 0.61 2.05 0.04 3.82 -7.23 -0.66 -2.37 120.40 116.66 1lee s VAL 82 Ca -0.10 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 1lee s VAL 82 Cb -0.13 -1.86 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 1lee s VAL 82 CO 0.01 -0.04 -0.04 -0.55 -0.31 0.00 0.00 175.10 174.17 1lee s SER 83 N -2.18 0.55 0.00 4.85 0.15 0.26 0.71 113.70 118.04 1lee s SER 83 Ca 0.13 -0.75 0.00 0.00 0.70 0.00 0.00 55.95 56.03 1lee s SER 83 Cb -0.09 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.34 1lee s SER 83 CO 0.06 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 174.70 1lee n GLY 84 N 0.85 -0.54 3.35 9.45 0.00 0.15 -0.81 105.19 117.64 1lee n GLY 84 Ca -0.19 0.28 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 1lee n GLY 84 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1lee s PHE 85 N 0.00 -0.31 0.36 1.61 -0.71 0.56 -1.58 117.98 117.91 1lee s PHE 85 Ca 0.00 0.04 -0.26 0.00 -1.04 0.00 0.00 56.93 55.67 1lee s PHE 85 Cb 0.00 0.35 -0.09 0.00 -1.21 0.00 0.00 43.02 42.07 1lee s PHE 85 CO 0.00 -0.74 1.07 -0.06 -1.34 0.00 0.00 175.22 174.15 1lee s PHE 86 N -3.72 3.37 0.09 3.49 2.99 0.13 -1.17 117.98 123.17 1lee s PHE 86 Ca 0.02 1.67 -0.03 0.00 0.00 0.00 0.00 56.93 58.59 1lee s PHE 86 Cb 0.01 -3.18 -0.03 0.00 0.00 0.00 0.00 43.02 39.82 1lee s PHE 86 CO -0.12 -0.60 0.06 -1.12 -0.00 0.00 0.00 175.22 173.44 1lee s SER 87 N -1.33 0.33 -0.04 1.36 0.01 -0.65 0.07 113.70 113.45 1lee s SER 87 Ca 0.53 -1.01 0.02 0.00 1.31 0.00 0.00 55.95 56.80 1lee s SER 87 Cb -0.25 0.27 0.01 0.00 0.21 0.00 0.00 66.02 66.26 1lee s SER 87 CO 0.32 -0.69 -0.07 -0.75 0.41 0.00 0.00 173.24 172.46 1lee s LYS 88 N -3.96 1.04 0.17 12.44 2.20 -0.38 -1.41 119.74 129.84 1lee s LYS 88 Ca 0.13 -0.23 -0.23 0.00 -0.36 0.00 0.00 55.97 55.28 1lee s LYS 88 Cb 0.07 -0.96 0.07 0.00 -1.51 0.00 0.00 37.83 35.51 1lee s LYS 88 CO -0.05 0.00 1.01 0.34 -0.36 0.00 0.00 175.35 176.29 1lee s ASP 89 N 0.62 -0.07 0.21 1.43 3.68 -0.73 0.72 116.67 122.53 1lee s ASP 89 Ca -0.10 -0.56 -0.30 0.00 2.13 0.00 0.00 52.55 53.73 1lee s ASP 89 Cb -0.13 0.49 -0.08 0.00 -1.45 0.00 0.00 42.92 41.75 1lee s ASP 89 CO 0.01 -0.95 1.19 -0.22 0.13 0.00 0.00 175.17 175.34 1lee s LEU 90 N -3.19 4.46 -0.09 -1.34 2.96 -1.26 -0.72 118.68 119.50 1lee s LEU 90 Ca 0.17 2.27 0.02 0.00 -0.22 0.00 0.00 54.13 56.38 1lee s LEU 90 Cb -0.02 -3.61 0.01 0.00 0.50 0.00 0.00 46.19 43.07 1lee s LEU 90 CO 0.04 -0.35 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.86 1lee s VAL 91 N -0.28 1.54 -0.27 1.68 1.01 -0.58 0.45 120.40 123.94 1lee s VAL 91 Ca 0.51 -0.69 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 1lee s VAL 91 Cb -0.33 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.66 1lee s VAL 91 CO 0.38 0.45 0.08 -0.89 0.00 0.00 0.00 175.10 175.12 1lee s THR 92 N 0.74 4.18 -0.25 3.92 2.01 0.39 -2.13 115.64 124.51 1lee s THR 92 Ca -0.12 -0.40 0.00 0.00 0.31 0.00 0.00 61.69 61.49 1lee s THR 92 Cb -0.16 -3.04 0.04 0.00 0.01 0.00 0.00 72.50 69.35 1lee s THR 92 CO 0.02 0.22 -0.09 0.68 -0.69 0.00 0.00 174.62 174.76 1lee s VAL 93 N 1.57 2.54 0.00 3.82 -7.23 0.55 -1.62 120.40 120.02 1lee s VAL 93 Ca 0.05 -1.24 0.00 0.00 -1.81 0.00 0.00 61.98 58.98 1lee s VAL 93 Cb -0.16 -2.34 0.00 0.00 0.56 0.00 0.00 36.38 34.44 1lee s VAL 93 CO 0.03 0.15 0.00 0.61 -0.31 0.00 0.00 175.10 175.58 1lee n GLY 94 N 4.58 3.46 1.25 2.32 0.00 -1.26 -2.20 105.19 113.34 1lee n GLY 94 Ca -0.16 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 45.85 1lee n GLY 94 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1lee n ASN 95 N 7.64 4.55 -4.43 1.61 0.23 -1.26 -4.95 115.26 118.64 1lee n ASN 95 Ca 0.00 -2.98 -0.30 0.00 -0.53 0.00 0.00 54.58 50.77 1lee n ASN 95 Cb 0.00 -0.59 -0.13 0.00 -2.08 0.00 0.00 39.78 36.98 1lee n ASN 95 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1lee s LEU 96 N -2.80 2.49 0.09 -4.53 1.43 -0.93 -5.14 118.68 109.30 1lee s LEU 96 Ca 0.47 -0.61 0.05 0.00 -1.03 0.00 0.00 54.13 53.01 1lee s LEU 96 Cb 0.37 -1.40 -0.03 0.00 0.03 0.00 0.00 46.19 45.16 1lee s LEU 96 CO 0.11 0.20 -0.13 -0.44 0.23 0.00 0.00 176.35 176.33 1lee s SER 97 N -1.89 1.68 -0.05 2.29 0.01 -1.26 -0.33 113.70 114.16 1lee s SER 97 Ca 0.15 -0.73 -0.30 0.00 1.31 0.00 0.00 55.95 56.38 1lee s SER 97 Cb -0.10 -0.04 0.08 0.00 0.21 0.00 0.00 66.02 66.18 1lee s SER 97 CO 0.07 -0.16 0.75 -1.48 0.41 0.00 0.00 173.24 172.83 1lee s LEU 98 N -2.17 -0.57 0.40 2.44 2.34 -0.90 -4.98 118.68 115.24 1lee s LEU 98 Ca 0.03 0.53 -0.25 0.00 0.06 0.00 0.00 54.13 54.50 1lee s LEU 98 Cb -0.06 2.37 -0.08 0.00 -0.56 0.00 0.00 46.19 47.86 1lee s LEU 98 CO 0.02 -0.60 1.13 -2.84 -1.06 0.00 0.00 176.35 173.00 1lee s PRO 99 N -1.59 4.08 -0.10 1.48 0.02 -1.26 -1.53 135.00 136.10 1lee s PRO 99 Ca -0.07 1.73 -0.20 0.00 0.02 0.00 0.00 61.00 62.48 1lee s PRO 99 Cb -0.00 -2.63 0.05 0.00 0.02 0.00 0.00 34.50 31.94 1lee s PRO 99 CO 0.04 -0.27 0.49 -0.47 -0.33 0.00 0.00 177.00 176.47 1lee s TYR 100 N -1.49 -0.47 -0.30 6.54 5.04 0.11 -4.88 117.35 121.89 1lee s TYR 100 Ca 0.57 0.98 -0.18 0.00 -2.44 0.00 0.00 57.07 56.00 1lee s TYR 100 Cb -0.28 0.22 -0.02 0.00 0.35 0.00 0.00 41.96 42.23 1lee s TYR 100 CO 0.35 -0.39 0.50 0.21 -1.34 0.00 0.00 175.55 174.88 1lee s LYS 101 N -0.59 3.88 0.34 4.97 2.20 -1.26 -1.77 119.74 127.51 1lee s LYS 101 Ca -0.07 0.10 0.03 0.00 -0.36 0.00 0.00 55.97 55.67 1lee s LYS 101 Cb -0.03 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.53 1lee s LYS 101 CO 0.04 -0.47 0.11 -0.59 -0.36 0.00 0.00 175.35 174.08 1lee s PHE 102 N 2.34 1.76 -0.22 4.03 -0.71 -0.50 -4.71 117.98 119.97 1lee s PHE 102 Ca 0.20 -1.20 -0.08 0.00 -1.04 0.00 0.00 56.93 54.81 1lee s PHE 102 Cb -0.15 -1.09 -0.04 0.00 -1.21 0.00 0.00 43.02 40.52 1lee s PHE 102 CO 0.11 -0.27 0.08 0.42 -1.34 0.00 0.00 175.22 174.22 1lee s ILE 103 N -3.39 4.73 -0.39 -4.49 1.09 0.30 -1.64 121.20 117.40 1lee s ILE 103 Ca 0.32 -0.04 -0.17 0.00 -1.10 0.00 0.00 60.65 59.65 1lee s ILE 103 Cb 0.05 -3.17 0.01 0.00 -1.06 0.00 0.00 42.46 38.29 1lee s ILE 103 CO 0.15 0.39 0.46 -0.70 -0.10 0.00 0.00 174.94 175.15 1lee s GLU 104 N 0.93 3.36 -0.19 2.79 2.12 -0.31 -1.14 118.70 126.25 1lee s GLU 104 Ca 0.04 -0.48 -0.16 0.00 0.36 0.00 0.00 54.97 54.73 1lee s GLU 104 Cb -0.14 -3.89 -0.04 0.00 0.26 0.00 0.00 34.13 30.33 1lee s GLU 104 CO 0.03 -0.74 0.43 0.08 -0.54 0.00 0.00 175.26 174.51 1lee s VAL 105 N 2.26 5.18 -0.19 3.70 1.01 -0.47 -0.32 120.40 131.57 1lee s VAL 105 Ca 0.15 0.77 0.10 0.00 0.00 0.00 0.00 61.98 63.00 1lee s VAL 105 Cb -0.16 -3.76 -0.14 0.00 0.00 0.00 0.00 36.38 32.32 1lee s VAL 105 CO 0.14 0.25 0.31 2.30 0.00 0.00 0.00 175.10 178.09 1lee n ILE 106 N 4.29 0.00 -3.78 2.22 -5.35 0.01 -0.99 119.36 115.77 1lee n ILE 106 Ca -0.08 -0.25 -0.25 0.00 -0.27 0.00 0.00 62.75 61.91 1lee n ILE 106 Cb 0.51 0.55 -0.17 0.00 -1.74 0.00 0.00 39.64 38.79 1lee n ILE 106 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1lee s ASP 107 N -2.72 2.06 -0.11 7.28 3.68 -0.82 -4.05 116.67 122.00 1lee s ASP 107 Ca -0.01 -0.33 0.14 0.00 2.13 0.00 0.00 52.55 54.48 1lee s ASP 107 Cb 0.07 -0.55 0.36 0.00 -1.45 0.00 0.00 42.92 41.35 1lee s ASP 107 CO 0.43 -0.21 1.27 0.35 0.13 0.00 0.00 175.17 177.13 1lee n THR 108 N 5.08 1.77 0.11 1.71 -2.24 -1.26 -0.57 114.28 118.88 1lee n THR 108 Ca -0.08 -1.69 0.03 0.00 -2.27 0.00 0.00 64.05 60.03 1lee n THR 108 Cb 0.49 -0.01 0.41 0.00 -2.10 0.00 0.00 70.33 69.13 1lee n THR 108 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1lee h ASN 109 N 1.16 0.25 0.00 3.42 2.35 -1.95 -0.47 115.58 120.34 1lee h ASN 109 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1lee h ASN 109 Cb 1.07 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.38 1lee h ASN 109 CO 0.09 0.36 0.00 0.61 -1.65 0.00 0.00 177.43 176.84 1lee n GLY 110 N -1.00 -0.78 0.01 2.83 0.00 -1.22 -2.78 105.19 102.24 1lee n GLY 110 Ca -0.00 -0.10 0.01 0.00 0.00 0.00 0.00 46.02 45.92 1lee n GLY 110 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1lee n PHE 111 N -0.83 0.00 -4.11 1.61 7.35 -0.20 0.38 117.46 121.66 1lee n PHE 111 Ca 0.12 -0.39 -0.28 0.00 -0.76 0.00 0.00 57.45 56.15 1lee n PHE 111 Cb 0.06 -0.04 -0.07 0.00 0.35 0.00 0.00 39.48 39.78 1lee n PHE 111 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1lee s GLU 112 N -0.82 2.72 0.00 -4.13 2.02 -1.11 0.45 118.70 117.82 1lee s GLU 112 Ca 0.02 -0.88 0.16 0.00 0.02 0.00 0.00 54.97 54.29 1lee s GLU 112 Cb 0.02 -2.58 0.97 0.00 0.10 0.00 0.00 34.13 32.63 1lee s GLU 112 CO 0.00 0.50 1.39 -0.35 0.02 0.00 0.00 175.26 176.82 1lee n PRO 113 N 0.03 0.58 0.24 0.39 -0.04 -1.26 -4.94 135.00 130.00 1lee n PRO 113 Ca -0.09 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.21 1lee n PRO 113 Cb 0.54 -1.44 -0.08 0.00 -0.04 0.00 0.00 33.50 32.48 1lee n PRO 113 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1lee h THR 114 N 0.00 0.23 -0.83 0.52 2.02 -1.87 -2.02 112.91 110.95 1lee h THR 114 Ca 0.00 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.27 1lee h THR 114 Cb 0.00 0.23 -0.06 0.00 -1.74 0.00 0.00 68.15 66.58 1lee h THR 114 CO 0.00 0.00 0.54 0.22 0.37 0.00 0.00 175.52 176.65 1lee h TYR 115 N -0.80 0.86 -0.57 3.16 -0.00 -0.36 -0.99 116.97 118.28 1lee h TYR 115 Ca -0.03 0.02 -0.04 0.00 -0.00 0.00 0.00 58.73 58.68 1lee h TYR 115 Cb 0.71 -0.28 -0.03 0.00 -0.00 0.00 0.00 36.73 37.13 1lee h TYR 115 CO -0.20 0.41 0.20 1.15 -0.00 0.00 0.00 178.16 179.72 1lee h THR 116 N 0.81 1.21 -0.99 1.81 2.02 -1.73 -2.11 112.91 113.94 1lee h THR 116 Ca 0.38 -0.69 -0.67 0.00 0.77 0.00 0.00 66.41 66.20 1lee h THR 116 Cb 0.39 0.56 -0.30 0.00 -1.74 0.00 0.00 68.15 67.06 1lee h THR 116 CO -0.15 0.27 0.79 0.00 0.37 0.00 0.00 175.52 176.80 1lee n ALA 117 N -2.46 6.26 -2.53 6.16 0.00 -0.39 -4.94 120.51 122.61 1lee n ALA 117 Ca 0.05 -3.47 -0.24 0.00 0.00 0.00 0.00 53.44 49.78 1lee n ALA 117 Cb 0.18 -1.70 -0.15 0.00 0.00 0.00 0.00 19.45 17.78 1lee n ALA 117 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1lee s SER 118 N -1.90 1.95 0.00 0.00 0.01 -0.79 -4.99 113.70 107.98 1lee s SER 118 Ca 0.64 -0.35 0.25 0.00 1.31 0.00 0.00 55.95 57.80 1lee s SER 118 Cb 0.50 -0.20 0.41 0.00 0.21 0.00 0.00 66.02 66.95 1lee s SER 118 CO -0.00 0.17 1.35 0.35 0.41 0.00 0.00 173.24 175.51 1lee n THR 119 N 2.45 0.00 -2.81 1.44 -2.24 -1.26 -4.93 114.28 106.92 1lee n THR 119 Ca -0.15 -0.10 -0.31 0.00 -2.27 0.00 0.00 64.05 61.21 1lee n THR 119 Cb 0.54 0.60 -0.04 0.00 -2.10 0.00 0.00 70.33 69.33 1lee n THR 119 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1lee s PHE 120 N -2.70 3.44 -0.17 4.78 -0.71 -1.26 -4.87 117.98 116.49 1lee s PHE 120 Ca 0.17 1.19 -0.08 0.00 -1.04 0.00 0.00 56.93 57.17 1lee s PHE 120 Cb 0.18 -2.55 -0.22 0.00 -1.21 0.00 0.00 43.02 39.22 1lee s PHE 120 CO 0.63 -0.12 0.18 -0.25 -1.34 0.00 0.00 175.22 174.31 1lee n ASP 121 N -1.16 2.05 -0.79 1.98 8.00 0.32 -4.97 116.55 121.98 1lee n ASP 121 Ca 0.04 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.72 1lee n ASP 121 Cb 0.54 -0.79 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 1lee n ASP 121 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lee n GLY 122 N 1.92 2.88 3.17 0.44 0.00 -0.78 -4.35 105.19 108.47 1lee n GLY 122 Ca -0.36 -1.17 -0.28 0.00 0.00 0.00 0.00 46.02 44.21 1lee n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lee s ILE 123 N -2.61 1.62 -0.34 -0.61 1.01 -1.20 -1.68 121.20 117.39 1lee s ILE 123 Ca 0.00 -0.82 -0.00 0.00 0.00 0.00 0.00 60.65 59.83 1lee s ILE 123 Cb 0.00 -1.38 0.08 0.00 0.01 0.00 0.00 42.46 41.17 1lee s ILE 123 CO 0.00 0.46 0.07 -0.22 0.00 0.00 0.00 174.94 175.25 1lee s LEU 124 N -0.02 4.51 0.34 2.97 0.20 -0.21 -1.73 118.68 124.73 1lee s LEU 124 Ca -0.04 -1.76 -0.28 0.00 0.69 0.00 0.00 54.13 52.75 1lee s LEU 124 Cb -0.12 -1.71 -0.09 0.00 -0.43 0.00 0.00 46.19 43.83 1lee s LEU 124 CO 0.03 -0.38 1.17 -0.83 -0.29 0.00 0.00 176.35 176.05 1lee s GLY 125 N 1.34 2.97 -0.07 7.98 0.00 -0.44 -0.08 107.32 119.02 1lee s GLY 125 Ca 0.03 1.00 0.14 0.00 0.00 0.00 0.00 44.72 45.89 1lee s GLY 125 CO -0.04 1.58 1.13 1.04 0.00 0.00 0.00 173.10 176.81 1lee n LEU 126 N 0.67 1.38 0.00 0.66 4.77 -0.28 -4.60 117.00 119.60 1lee n LEU 126 Ca 0.01 -2.37 0.00 0.00 -0.03 0.00 0.00 56.01 53.62 1lee n LEU 126 Cb 0.45 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1lee n LEU 126 CO 0.54 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.89 1lee n GLY 127 N -0.38 1.06 3.90 -0.72 0.00 -0.50 -4.72 105.19 103.84 1lee n GLY 127 Ca 0.09 -1.86 -0.28 0.00 0.00 0.00 0.00 46.02 43.97 1lee n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1lee s TRP 128 N 1.40 3.55 0.24 1.61 0.52 -0.21 -4.78 118.94 121.27 1lee s TRP 128 Ca 0.00 0.87 -0.06 0.00 0.02 0.00 0.00 56.10 56.93 1lee s TRP 128 Cb 0.00 -2.34 0.43 0.00 -1.15 0.00 0.00 33.47 30.42 1lee s TRP 128 CO 0.00 -0.25 1.68 -0.22 0.02 0.00 0.00 176.95 178.19 1lee h LYS 129 N 0.43 0.25 0.00 4.98 3.64 -1.86 0.05 116.57 124.06 1lee h LYS 129 Ca -0.47 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1lee h LYS 129 Cb 1.20 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1lee h LYS 129 CO 0.62 0.16 0.00 -0.25 -2.27 0.00 0.00 179.45 177.71 1lee n ASP 130 N -5.17 0.54 -0.04 4.20 10.43 -1.26 -1.53 116.55 123.71 1lee n ASP 130 Ca 0.13 0.68 0.14 0.00 2.57 0.00 0.00 54.79 58.31 1lee n ASP 130 Cb 0.44 -0.77 0.62 0.00 1.84 0.00 0.00 41.12 43.24 1lee n ASP 130 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 1lee n LEU 131 N -2.14 0.24 -4.93 0.64 7.94 0.00 -4.92 117.00 113.83 1lee n LEU 131 Ca 0.01 0.19 -0.26 0.00 -1.11 0.00 0.00 56.01 54.85 1lee n LEU 131 Cb 0.14 -0.29 -0.02 0.00 0.53 0.00 0.00 43.42 43.79 1lee n LEU 131 CO 0.14 0.05 0.22 -0.94 -1.11 0.00 0.00 177.39 175.75 1lee s SER 132 N -2.68 6.33 -0.06 1.96 1.04 -0.58 -4.22 113.70 115.48 1lee s SER 132 Ca 0.23 0.59 -0.22 0.00 0.48 0.00 0.00 55.95 57.04 1lee s SER 132 Cb 0.20 -2.09 -0.04 0.00 0.10 0.00 0.00 66.02 64.18 1lee s SER 132 CO 0.51 -0.31 0.65 -0.63 0.98 0.00 0.00 173.24 174.44 1lee s ILE 133 N -2.32 5.05 0.00 -1.02 1.01 -1.26 -3.93 121.20 118.72 1lee s ILE 133 Ca 0.42 1.33 0.00 0.00 0.00 0.00 0.00 60.65 62.40 1lee s ILE 133 Cb -0.10 -3.99 0.00 0.00 0.01 0.00 0.00 42.46 38.38 1lee s ILE 133 CO 0.36 0.29 0.00 0.61 0.00 0.00 0.00 174.94 176.20 1lee n GLY 134 N 3.03 0.06 3.26 6.18 0.00 -1.26 -4.27 105.19 112.19 1lee n GLY 134 Ca -0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 1lee n GLY 134 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1lee n SER 135 N 0.00 -5.77 -4.69 1.61 2.88 -1.25 -4.95 113.62 101.44 1lee n SER 135 Ca 0.00 -0.44 -0.42 0.00 -1.33 0.00 0.00 58.87 56.67 1lee n SER 135 Cb 0.00 -4.40 -0.03 0.00 -0.75 0.00 0.00 64.21 59.03 1lee n SER 135 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1lee s VAL 136 N -3.26 4.58 0.28 2.46 1.01 -1.26 -5.01 120.40 119.20 1lee s VAL 136 Ca 0.48 1.86 -0.29 0.00 0.00 0.00 0.00 61.98 64.03 1lee s VAL 136 Cb -0.21 -4.20 -0.10 0.00 0.00 0.00 0.00 36.38 31.87 1lee s VAL 136 CO 0.60 0.03 1.31 -1.81 0.00 0.00 0.00 175.10 175.23 1lee s ASP 137 N 1.20 6.84 0.58 3.32 -0.00 -1.26 -4.49 116.67 122.86 1lee s ASP 137 Ca 0.52 2.56 -0.18 0.00 -0.00 0.00 0.00 52.55 55.45 1lee s ASP 137 Cb -0.21 -2.63 -0.08 0.00 -0.00 0.00 0.00 42.92 39.99 1lee s ASP 137 CO 0.21 -0.52 0.56 -2.65 -0.00 0.00 0.00 175.17 172.77 1lee n PRO 138 N 1.61 0.53 -0.01 8.23 -0.02 -1.26 -4.82 135.00 139.26 1lee n PRO 138 Ca 0.03 0.21 -0.11 0.00 -2.02 0.00 0.00 63.50 61.61 1lee n PRO 138 Cb 0.42 -1.74 -0.05 0.00 -0.02 0.00 0.00 33.50 32.11 1lee n PRO 138 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1lee h ILE 139 N 0.23 1.01 -0.40 4.25 2.04 -1.92 -2.46 117.51 120.27 1lee h ILE 139 Ca -0.46 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 1lee h ILE 139 Cb 1.40 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.33 1lee h ILE 139 CO 0.47 0.02 0.08 0.58 0.00 0.00 0.00 178.15 179.30 1lee h VAL 140 N 0.13 1.19 -0.47 1.67 2.07 -1.97 -1.38 116.25 117.49 1lee h VAL 140 Ca 0.04 -0.68 -0.10 0.00 0.82 0.00 0.00 66.70 66.79 1lee h VAL 140 Cb -0.00 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1lee h VAL 140 CO -0.02 0.24 -0.10 0.58 0.02 0.00 0.00 177.57 178.29 1lee h VAL 141 N 0.58 1.26 0.38 2.57 2.07 -1.87 -2.41 116.25 118.82 1lee h VAL 141 Ca 0.13 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 1lee h VAL 141 Cb 0.25 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1lee h VAL 141 CO -0.00 0.41 -0.18 -0.33 0.02 0.00 0.00 177.57 177.49 1lee h GLU 142 N 0.77 -0.49 -0.94 1.57 4.39 -0.99 -1.00 114.58 117.89 1lee h GLU 142 Ca 0.13 0.03 0.14 0.00 0.34 0.00 0.00 59.36 60.01 1lee h GLU 142 Cb 0.61 0.11 -0.09 0.00 -0.10 0.00 0.00 28.75 29.27 1lee h GLU 142 CO 0.04 -0.21 0.55 -0.07 -1.16 0.00 0.00 179.01 178.16 1lee h LEU 143 N -0.72 0.74 -0.51 1.33 3.38 -1.24 0.71 115.31 119.00 1lee h LEU 143 Ca -0.05 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1lee h LEU 143 Cb 0.50 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1lee h LEU 143 CO 0.08 0.34 -0.02 0.50 0.09 0.00 0.00 178.44 179.44 1lee h LYS 144 N 0.80 0.92 -0.45 1.13 3.11 -1.18 0.20 116.57 121.10 1lee h LYS 144 Ca 0.50 -0.30 0.00 0.00 -2.81 0.00 0.00 60.65 58.04 1lee h LYS 144 Cb 0.63 -0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 31.76 1lee h LYS 144 CO -0.32 0.95 0.29 -0.91 -2.81 0.00 0.00 179.45 176.65 1lee h ASN 145 N 0.79 0.52 -0.50 4.20 2.35 0.24 -2.13 115.58 121.05 1lee h ASN 145 Ca 0.14 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1lee h ASN 145 Cb 0.55 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1lee h ASN 145 CO 0.03 0.38 0.00 0.00 -1.65 0.00 0.00 177.43 176.19 1lee n GLN 146 N -4.46 3.03 -2.11 0.81 6.02 0.09 -4.90 117.38 115.86 1lee n GLN 146 Ca 0.04 -2.17 -0.20 0.00 -0.01 0.00 0.00 57.00 54.66 1lee n GLN 146 Cb 0.06 -1.72 -0.04 0.00 1.02 0.00 0.00 30.24 29.56 1lee n GLN 146 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1lee n ASN 147 N 0.84 -5.46 0.15 1.08 3.02 -0.67 -4.83 115.26 109.39 1lee n ASN 147 Ca 0.20 0.18 0.10 0.00 -0.03 0.00 0.00 54.58 55.03 1lee n ASN 147 Cb 0.69 -4.66 0.06 0.00 -0.61 0.00 0.00 39.78 35.27 1lee n ASN 147 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1lee h LYS 148 N 0.00 0.00 -5.50 3.52 1.57 -1.25 -3.46 116.57 111.45 1lee h LYS 148 Ca -0.44 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 57.89 1lee h LYS 148 Cb 1.32 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.49 1lee h LYS 148 CO 0.56 0.07 -0.71 0.96 -0.57 0.00 0.00 179.45 179.76 1lee s ILE 149 N -3.23 1.65 -0.01 1.86 -4.36 -1.24 -5.00 121.20 110.88 1lee s ILE 149 Ca 0.03 -2.18 -0.25 0.00 -0.26 0.00 0.00 60.65 58.00 1lee s ILE 149 Cb 0.08 -2.15 -0.17 0.00 1.25 0.00 0.00 42.46 41.46 1lee s ILE 149 CO 0.74 -0.52 1.21 -0.08 0.24 0.00 0.00 174.94 176.53 1lee h GLU 150 N 2.50 -0.22 -5.62 0.37 4.57 -1.90 -3.43 114.58 110.85 1lee h GLU 150 Ca -0.38 0.01 -0.47 0.00 -1.18 0.00 0.00 59.36 57.34 1lee h GLU 150 Cb 1.22 0.05 -0.22 0.00 -0.16 0.00 0.00 28.75 29.64 1lee h GLU 150 CO 0.63 0.15 -0.80 -0.80 -1.18 0.00 0.00 179.01 177.02 1lee s ASN 151 N -5.34 1.97 -1.44 1.04 0.01 -0.94 -5.05 114.94 105.19 1lee s ASN 151 Ca -0.14 -0.60 -0.13 0.00 -0.71 0.00 0.00 52.86 51.27 1lee s ASN 151 Cb 0.02 -0.10 0.06 0.00 0.41 0.00 0.00 41.25 41.64 1lee s ASN 151 CO 0.58 -0.00 2.18 0.00 -1.51 0.00 0.00 177.10 178.35 1lee n ALA 152 N 1.38 5.53 -2.86 0.60 0.00 -1.26 -4.18 120.51 119.72 1lee n ALA 152 Ca -0.20 -3.94 -0.10 0.00 0.00 0.00 0.00 53.44 49.20 1lee n ALA 152 Cb 0.54 -3.46 -0.07 0.00 0.00 0.00 0.00 19.45 16.45 1lee n ALA 152 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1lee s LEU 153 N 1.88 1.05 0.09 0.00 0.05 -1.26 -0.22 118.68 120.27 1lee s LEU 153 Ca 0.46 -0.36 0.00 0.00 0.05 0.00 0.00 54.13 54.28 1lee s LEU 153 Cb 0.13 1.26 -0.04 0.00 -2.05 0.00 0.00 46.19 45.49 1lee s LEU 153 CO -0.08 -0.66 -0.03 0.72 -0.55 0.00 0.00 176.35 175.75 1lee s PHE 154 N -3.05 0.76 0.09 3.48 -0.71 0.03 -1.11 117.98 117.46 1lee s PHE 154 Ca -0.01 -1.03 0.02 0.00 -1.04 0.00 0.00 56.93 54.86 1lee s PHE 154 Cb 0.01 -0.47 -0.04 0.00 -1.21 0.00 0.00 43.02 41.31 1lee s PHE 154 CO -0.06 -0.30 -0.07 0.95 -1.34 0.00 0.00 175.22 174.40 1lee s THR 155 N -3.81 0.65 -0.14 -4.49 -4.23 0.49 -0.05 115.64 104.07 1lee s THR 155 Ca 0.12 -1.75 0.01 0.00 -1.18 0.00 0.00 61.69 58.89 1lee s THR 155 Cb 0.07 -1.46 0.02 0.00 1.34 0.00 0.00 72.50 72.47 1lee s THR 155 CO -0.05 -0.77 -0.16 -0.36 -0.54 0.00 0.00 174.62 172.74 1lee s PHE 156 N -3.16 2.18 -0.50 3.99 0.40 -0.72 -1.14 117.98 119.02 1lee s PHE 156 Ca 0.07 -1.16 -0.02 0.00 -0.60 0.00 0.00 56.93 55.23 1lee s PHE 156 Cb 0.02 -1.58 0.13 0.00 0.51 0.00 0.00 43.02 42.11 1lee s PHE 156 CO -0.04 -0.61 0.29 -0.47 0.70 0.00 0.00 175.22 175.10 1lee s TYR 157 N 1.24 3.49 0.39 0.36 5.04 0.35 -3.01 117.35 125.21 1lee s TYR 157 Ca -0.00 -2.67 -0.26 0.00 -2.44 0.00 0.00 57.07 51.70 1lee s TYR 157 Cb -0.14 -3.15 -0.09 0.00 0.35 0.00 0.00 41.96 38.94 1lee s TYR 157 CO -0.07 -0.89 1.17 -0.51 -1.34 0.00 0.00 175.55 173.91 1lee s LEU 158 N 0.48 4.23 0.63 6.97 1.43 -1.26 0.03 118.68 131.19 1lee s LEU 158 Ca 0.13 2.36 -0.17 0.00 -1.03 0.00 0.00 54.13 55.42 1lee s LEU 158 Cb -0.22 -3.98 -0.01 0.00 0.03 0.00 0.00 46.19 42.01 1lee s LEU 158 CO -0.04 -0.64 1.18 -2.16 0.23 0.00 0.00 176.35 174.92 1lee s PRO 159 N -2.22 2.78 -0.22 1.29 0.04 -1.26 -4.49 135.00 130.91 1lee s PRO 159 Ca 0.56 1.70 0.01 0.00 0.04 0.00 0.00 61.00 63.31 1lee s PRO 159 Cb -0.31 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.36 1lee s PRO 159 CO 0.39 -1.33 -0.10 0.08 0.04 0.00 0.00 177.00 176.09 1lee s VAL 160 N -1.86 1.80 0.07 -0.36 1.01 -0.38 -4.91 120.40 115.78 1lee s VAL 160 Ca 0.74 -1.24 -0.32 0.00 0.00 0.00 0.00 61.98 61.15 1lee s VAL 160 Cb -0.27 -1.92 -0.17 0.00 0.00 0.00 0.00 36.38 34.02 1lee s VAL 160 CO 0.37 0.07 0.78 1.57 0.00 0.00 0.00 175.10 177.90 1lee n HIS 161 N 4.60 0.18 0.00 5.22 -0.00 -1.26 -0.63 115.22 123.33 1lee n HIS 161 Ca -0.14 0.94 0.00 0.00 0.46 0.00 0.00 57.72 58.98 1lee n HIS 161 Cb 0.45 -1.88 0.00 0.00 -0.12 0.00 0.00 29.99 28.44 1lee n HIS 161 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 1lee n ASP 162 N 1.56 0.00 0.00 0.26 2.03 -1.26 -4.70 116.55 114.44 1lee n ASP 162 Ca 0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.49 1lee n ASP 162 Cb 0.14 -0.23 0.00 0.00 -0.72 0.00 0.00 41.12 40.30 1lee n ASP 162 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1lee n LYS 163 N -1.23 0.00 -4.00 -0.67 4.81 0.20 -5.10 118.16 112.18 1lee n LYS 163 Ca 0.00 0.15 -0.10 0.00 -0.87 0.00 0.00 58.31 57.49 1lee n LYS 163 Cb 0.00 -0.57 -0.04 0.00 0.02 0.00 0.00 35.03 34.44 1lee n LYS 163 CO 0.00 0.00 0.00 -3.38 1.17 0.00 0.00 177.40 175.19 1lee s HIS 164 N -0.69 0.47 0.89 5.64 -3.43 -0.62 -5.00 115.29 112.55 1lee s HIS 164 Ca 0.00 -0.84 -0.12 0.00 -0.80 0.00 0.00 55.06 53.30 1lee s HIS 164 Cb 0.00 0.21 0.17 0.00 -1.43 0.00 0.00 32.58 31.53 1lee s HIS 164 CO 0.00 -1.08 1.23 0.95 -2.00 0.00 0.00 174.74 173.83 1lee s THR 165 N -3.66 2.04 0.49 -5.38 -4.23 -1.26 -1.25 115.64 102.39 1lee s THR 165 Ca 0.23 -0.15 0.02 0.00 -1.18 0.00 0.00 61.69 60.61 1lee s THR 165 Cb -0.01 -2.89 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 1lee s THR 165 CO 0.12 0.00 0.03 -0.83 -0.54 0.00 0.00 174.62 173.40 1lee s GLY 166 N -4.82 2.93 -0.28 3.99 0.00 -1.20 -4.34 107.32 103.60 1lee s GLY 166 Ca 0.71 -0.58 -0.17 0.00 0.00 0.00 0.00 44.72 44.68 1lee s GLY 166 CO 0.50 -2.11 0.71 -1.36 0.00 0.00 0.00 173.10 170.84 1lee s PHE 167 N -2.95 -1.00 -0.34 1.90 0.08 0.10 -1.74 117.98 114.03 1lee s PHE 167 Ca 0.10 2.05 -0.16 0.00 0.12 0.00 0.00 56.93 59.04 1lee s PHE 167 Cb 0.02 0.58 -0.01 0.00 -0.57 0.00 0.00 43.02 43.04 1lee s PHE 167 CO 0.06 -0.50 0.39 -1.17 -0.10 0.00 0.00 175.22 173.90 1lee s LEU 168 N 1.48 4.38 -0.27 -0.37 2.96 0.11 -0.50 118.68 126.47 1lee s LEU 168 Ca -0.09 -0.14 -0.08 0.00 -0.22 0.00 0.00 54.13 53.60 1lee s LEU 168 Cb -0.05 -2.38 -0.01 0.00 0.50 0.00 0.00 46.19 44.24 1lee s LEU 168 CO -0.17 -0.34 0.09 -0.89 -1.32 0.00 0.00 176.35 173.71 1lee s THR 169 N 2.08 4.29 -0.13 3.68 2.01 -0.30 -1.27 115.64 126.00 1lee s THR 169 Ca 0.13 -0.35 -0.12 0.00 0.31 0.00 0.00 61.69 61.66 1lee s THR 169 Cb -0.16 -3.09 -0.05 0.00 0.01 0.00 0.00 72.50 69.21 1lee s THR 169 CO 0.12 0.22 0.24 -0.63 -0.69 0.00 0.00 174.62 173.88 1lee s ILE 170 N 1.59 5.33 0.00 1.82 1.01 -0.36 -0.38 121.20 130.21 1lee s ILE 170 Ca 0.05 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.15 1lee s ILE 170 Cb -0.16 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.75 1lee s ILE 170 CO 0.04 0.49 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1lee n GLY 171 N 2.79 2.63 3.78 6.18 0.00 -0.27 -1.58 105.19 118.72 1lee n GLY 171 Ca -0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 1lee n GLY 171 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1lee s GLY 172 N -2.60 -0.16 -0.24 -0.02 0.00 -1.26 -2.21 107.32 100.83 1lee s GLY 172 Ca 0.00 0.09 -0.09 0.00 0.00 0.00 0.00 44.72 44.73 1lee s GLY 172 CO 0.00 1.02 0.11 -0.42 0.00 0.00 0.00 173.10 173.81 1lee s ILE 173 N -2.71 4.84 -0.21 0.90 1.01 -1.26 -4.75 121.20 119.02 1lee s ILE 173 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 60.65 60.76 1lee s ILE 173 Cb -0.00 -3.25 -0.03 0.00 0.01 0.00 0.00 42.46 39.19 1lee s ILE 173 CO 0.02 0.35 0.03 -1.61 0.00 0.00 0.00 174.94 173.73 1lee s GLU 174 N 1.21 3.67 0.57 2.79 2.02 -1.26 -4.96 118.70 122.73 1lee s GLU 174 Ca 0.06 -0.49 0.31 0.00 0.02 0.00 0.00 54.97 54.87 1lee s GLU 174 Cb -0.14 -3.17 1.70 0.00 0.10 0.00 0.00 34.13 32.61 1lee s GLU 174 CO 0.05 -0.02 2.17 0.93 0.02 0.00 0.00 175.26 178.40 1lee h GLU 175 N 7.63 0.00 -0.30 1.61 5.08 -1.98 -2.85 114.58 123.78 1lee h GLU 175 Ca -0.37 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.08 1lee h GLU 175 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 1lee h GLU 175 CO 0.61 0.06 0.35 0.07 -1.00 0.00 0.00 179.01 179.09 1lee h ARG 176 N 0.00 0.00 0.00 2.33 0.11 -2.03 -2.71 114.38 112.08 1lee h ARG 176 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1lee h ARG 176 Cb 0.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.27 1lee h ARG 176 CO 0.01 0.00 -0.78 0.74 0.10 0.00 0.00 179.97 180.04 1lee h PHE 177 N 0.00 0.00 -3.81 4.08 0.05 -1.91 -3.45 116.94 111.90 1lee h PHE 177 Ca 0.14 0.00 -0.23 0.00 3.82 0.00 0.00 57.97 61.70 1lee h PHE 177 Cb 0.83 0.00 -0.15 0.00 2.00 0.00 0.00 35.95 38.63 1lee h PHE 177 CO 0.00 0.00 -0.70 1.52 -0.18 0.00 0.00 178.31 178.95 1lee s TYR 178 N -3.30 0.89 0.18 -0.55 -0.85 -1.02 -0.32 117.35 112.38 1lee s TYR 178 Ca 0.02 -0.87 0.08 0.00 -0.52 0.00 0.00 57.07 55.78 1lee s TYR 178 Cb 0.10 -0.51 -0.04 0.00 0.38 0.00 0.00 41.96 41.88 1lee s TYR 178 CO 0.76 -0.13 -0.16 -1.83 -1.52 0.00 0.00 175.55 172.67 1lee s GLU 179 N -3.62 1.26 1.86 -3.49 -1.05 0.13 -4.74 118.70 109.05 1lee s GLU 179 Ca 0.10 -1.47 0.00 0.00 -0.15 0.00 0.00 54.97 53.45 1lee s GLU 179 Cb 0.04 -1.17 0.00 0.00 -0.44 0.00 0.00 34.13 32.56 1lee s GLU 179 CO -0.04 0.22 0.00 0.41 0.95 0.00 0.00 175.26 176.79 1lee n GLY 180 N 0.01 -1.09 3.83 -3.83 0.00 -1.26 -3.54 105.19 99.32 1lee n GLY 180 Ca -0.11 -1.17 -0.31 0.00 0.00 0.00 0.00 46.02 44.42 1lee n GLY 180 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lee s PRO 181 N 0.00 3.33 -0.29 1.61 0.04 -1.26 -4.91 135.00 133.53 1lee s PRO 181 Ca 0.00 0.94 -0.05 0.00 0.04 0.00 0.00 61.00 61.93 1lee s PRO 181 Cb 0.00 -2.04 0.02 0.00 0.04 0.00 0.00 34.50 32.52 1lee s PRO 181 CO 0.00 -0.78 0.03 -1.17 0.04 0.00 0.00 177.00 175.12 1lee s LEU 182 N -5.05 3.70 -0.14 -3.56 2.96 -1.26 -4.33 118.68 110.99 1lee s LEU 182 Ca 0.58 -0.85 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1lee s LEU 182 Cb -0.13 -1.80 -0.03 0.00 0.50 0.00 0.00 46.19 44.73 1lee s LEU 182 CO 0.48 -0.19 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.42 1lee s THR 183 N 1.41 4.14 -0.06 3.68 2.01 -0.57 -4.86 115.64 121.40 1lee s THR 183 Ca 0.01 -0.28 -0.12 0.00 0.31 0.00 0.00 61.69 61.61 1lee s THR 183 Cb -0.17 -2.80 -0.05 0.00 0.01 0.00 0.00 72.50 69.48 1lee s THR 183 CO 0.00 0.52 0.30 -0.31 -0.69 0.00 0.00 174.62 174.43 1lee s TYR 184 N 0.03 3.65 -0.10 4.92 1.51 -1.26 -0.65 117.35 125.45 1lee s TYR 184 Ca 0.02 0.77 0.02 0.00 -1.01 0.00 0.00 57.07 56.87 1lee s TYR 184 Cb -0.13 -2.17 0.01 0.00 -0.11 0.00 0.00 41.96 39.56 1lee s TYR 184 CO 0.02 0.63 -0.16 -1.21 -1.11 0.00 0.00 175.55 173.72 1lee s GLU 185 N -0.86 2.21 0.14 -0.62 0.41 0.73 -4.92 118.70 115.80 1lee s GLU 185 Ca 0.20 -0.57 -0.31 0.00 -0.41 0.00 0.00 54.97 53.87 1lee s GLU 185 Cb -0.15 -1.83 -0.09 0.00 -1.78 0.00 0.00 34.13 30.29 1lee s GLU 185 CO 0.09 -0.00 1.42 0.15 -0.49 0.00 0.00 175.26 176.42 1lee s LYS 186 N 0.80 4.30 0.39 1.61 3.01 -1.26 -0.00 119.74 128.59 1lee s LYS 186 Ca -0.11 2.14 -0.27 0.00 -1.01 0.00 0.00 55.97 56.73 1lee s LYS 186 Cb -0.16 -3.22 -0.11 0.00 -1.01 0.00 0.00 37.83 33.34 1lee s LYS 186 CO 0.01 -0.45 1.29 1.28 0.51 0.00 0.00 175.35 177.99 1lee n LEU 187 N 3.72 3.88 0.08 3.17 4.77 0.11 -4.51 117.00 128.21 1lee n LEU 187 Ca 0.11 1.15 0.12 0.00 -0.03 0.00 0.00 56.01 57.36 1lee n LEU 187 Cb 0.41 -1.50 0.16 0.00 -2.33 0.00 0.00 43.42 40.17 1lee n LEU 187 CO 0.59 -0.54 0.36 -0.55 -1.33 0.00 0.00 177.39 175.92 1lee h ASN 188 N 2.31 0.00 -4.97 -1.43 -0.00 -1.21 -3.48 115.58 106.81 1lee h ASN 188 Ca -0.47 -0.15 -0.08 0.00 -0.00 0.00 0.00 56.30 55.59 1lee h ASN 188 Cb 1.29 0.00 -0.19 0.00 -0.00 0.00 0.00 38.32 39.41 1lee h ASN 188 CO 0.61 0.08 0.02 -1.00 -0.00 0.00 0.00 177.43 177.14 1lee s HIS 189 N -3.20 -0.49 -1.26 4.14 3.76 -1.26 -5.07 115.29 111.92 1lee s HIS 189 Ca 0.06 0.84 -0.09 0.00 -0.15 0.00 0.00 55.06 55.71 1lee s HIS 189 Cb 0.12 0.30 0.18 0.00 1.11 0.00 0.00 32.58 34.29 1lee s HIS 189 CO 0.72 -0.53 1.79 -0.25 -0.85 0.00 0.00 174.74 175.62 1lee n ASP 190 N 1.08 5.21 0.00 1.40 8.00 -1.26 -4.50 116.55 126.48 1lee n ASP 190 Ca -0.20 -3.12 0.00 0.00 0.71 0.00 0.00 54.79 52.18 1lee n ASP 190 Cb 0.57 -1.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.19 1lee n ASP 190 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1lee n LEU 191 N 3.87 0.00 -4.94 0.64 4.77 -1.26 -4.54 117.00 115.54 1lee n LEU 191 Ca 0.38 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 56.11 1lee n LEU 191 Cb 0.37 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.54 1lee n LEU 191 CO 0.78 0.00 0.61 -0.31 -1.33 0.00 0.00 177.39 177.14 1lee s TYR 192 N 0.00 2.63 -1.20 -1.77 1.51 -1.26 -1.05 117.35 116.21 1lee s TYR 192 Ca 0.00 0.30 -0.13 0.00 -1.01 0.00 0.00 57.07 56.23 1lee s TYR 192 Cb 0.00 -3.21 0.19 0.00 -0.11 0.00 0.00 41.96 38.83 1lee s TYR 192 CO 0.00 -1.50 1.44 0.91 -1.11 0.00 0.00 175.55 175.29 1lee n TRP 193 N -2.93 4.80 -4.78 2.71 7.02 -1.26 -4.80 117.44 118.20 1lee n TRP 193 Ca 0.09 -3.37 -0.33 0.00 -1.02 0.00 0.00 57.50 52.87 1lee n TRP 193 Cb 0.60 -2.09 -0.14 0.00 -2.42 0.00 0.00 31.31 27.26 1lee n TRP 193 CO 0.00 0.00 0.00 1.14 -2.02 0.00 0.00 177.69 176.81 1lee s GLN 194 N 1.02 3.08 0.19 -0.99 -2.07 -1.26 -1.14 119.66 118.49 1lee s GLN 194 Ca 0.41 -0.67 0.04 0.00 -1.82 0.00 0.00 55.36 53.32 1lee s GLN 194 Cb -0.03 -2.56 -0.05 0.00 -1.09 0.00 0.00 33.01 29.28 1lee s GLN 194 CO -0.01 0.38 -0.05 0.96 -1.32 0.00 0.00 175.29 175.25 1lee s ILE 195 N -0.07 1.11 -0.32 3.63 -4.36 -0.51 -0.64 121.20 120.04 1lee s ILE 195 Ca -0.02 -2.05 -0.14 0.00 -0.26 0.00 0.00 60.65 58.18 1lee s ILE 195 Cb -0.14 -2.10 -0.02 0.00 1.25 0.00 0.00 42.46 41.45 1lee s ILE 195 CO 0.04 -0.53 0.30 -0.89 0.24 0.00 0.00 174.94 174.09 1lee s THR 196 N -3.37 5.23 0.04 8.37 2.01 -1.26 -0.79 115.64 125.87 1lee s THR 196 Ca 0.23 0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.29 1lee s THR 196 Cb 0.04 -3.73 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 1lee s THR 196 CO 0.05 0.01 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.13 1lee s LEU 197 N 1.88 2.19 0.03 4.42 1.43 -0.71 -4.80 118.68 123.13 1lee s LEU 197 Ca 0.09 -0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 52.43 1lee s LEU 197 Cb -0.17 -0.38 -0.04 0.00 0.03 0.00 0.00 46.19 45.64 1lee s LEU 197 CO 0.11 -0.07 0.98 -1.81 0.23 0.00 0.00 176.35 175.79 1lee s ASP 198 N -1.23 7.39 -0.18 2.29 1.01 0.02 -0.14 116.67 125.83 1lee s ASP 198 Ca -0.03 1.70 -0.09 0.00 0.71 0.00 0.00 52.55 54.84 1lee s ASP 198 Cb -0.08 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.23 1lee s ASP 198 CO 0.01 -0.22 0.12 0.00 0.21 0.00 0.00 175.17 175.29 1lee s ALA 199 N 0.78 3.70 -0.01 5.23 0.00 0.10 -1.69 121.76 129.88 1lee s ALA 199 Ca 0.51 -0.68 0.00 0.00 0.00 0.00 0.00 51.96 51.79 1lee s ALA 199 Cb -0.22 -2.09 0.01 0.00 0.00 0.00 0.00 23.12 20.82 1lee s ALA 199 CO 0.28 0.27 0.00 -1.58 0.00 0.00 0.00 175.76 174.74 1lee s HIS 200 N 0.03 0.12 -0.21 0.00 5.04 0.77 -0.39 115.29 120.65 1lee s HIS 200 Ca 0.09 0.02 -0.04 0.00 -1.54 0.00 0.00 55.06 53.60 1lee s HIS 200 Cb -0.11 -0.16 0.09 0.00 0.04 0.00 0.00 32.58 32.43 1lee s HIS 200 CO -0.00 -0.04 0.18 0.08 -2.34 0.00 0.00 174.74 172.61 1lee s VAL 201 N 0.42 -0.23 0.00 0.89 1.01 -0.79 -0.65 120.40 121.05 1lee s VAL 201 Ca -0.04 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.69 1lee s VAL 201 Cb -0.06 -0.72 0.00 0.00 0.00 0.00 0.00 36.38 35.60 1lee s VAL 201 CO -0.01 -0.33 0.00 0.61 0.00 0.00 0.00 175.10 175.37 1lee n GLY 202 N 5.30 1.75 0.00 4.51 0.00 -1.26 -2.25 105.19 113.24 1lee n GLY 202 Ca -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1lee n GLY 202 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1lee n ASN 203 N 8.69 0.75 -4.79 1.61 4.13 -1.26 -5.00 115.26 119.39 1lee n ASN 203 Ca 0.00 -1.17 -0.39 0.00 1.68 0.00 0.00 54.58 54.70 1lee n ASN 203 Cb 0.00 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.18 1lee n ASN 203 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1lee s ILE 204 N -0.17 4.49 0.01 2.41 1.01 -0.95 -5.05 121.20 122.93 1lee s ILE 204 Ca 0.00 1.53 0.00 0.00 0.00 0.00 0.00 60.65 62.18 1lee s ILE 204 Cb 0.00 -4.04 -0.01 0.00 0.01 0.00 0.00 42.46 38.42 1lee s ILE 204 CO 0.00 0.50 -0.01 -0.94 0.00 0.00 0.00 174.94 174.49 1lee s SER 205 N -1.20 0.11 -0.25 3.58 1.04 -1.26 -1.88 113.70 113.84 1lee s SER 205 Ca 0.35 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.65 1lee s SER 205 Cb -0.21 0.02 0.07 0.00 0.10 0.00 0.00 66.02 65.99 1lee s SER 205 CO 0.24 -0.07 -0.02 -0.22 0.98 0.00 0.00 173.24 174.15 1lee s LEU 206 N -0.38 2.54 0.21 2.42 0.20 0.48 -4.99 118.68 119.16 1lee s LEU 206 Ca -0.04 -1.27 -0.30 0.00 0.69 0.00 0.00 54.13 53.22 1lee s LEU 206 Cb -0.03 -1.11 -0.08 0.00 -0.43 0.00 0.00 46.19 44.54 1lee s LEU 206 CO -0.00 -0.28 1.12 -1.61 -0.29 0.00 0.00 176.35 175.29 1lee s GLU 207 N 1.44 4.58 -1.24 1.98 2.02 -1.26 0.02 118.70 126.24 1lee s GLU 207 Ca -0.02 1.77 -0.14 0.00 0.02 0.00 0.00 54.97 56.60 1lee s GLU 207 Cb -0.18 -3.25 -0.00 0.00 0.10 0.00 0.00 34.13 30.80 1lee s GLU 207 CO -0.09 0.08 0.66 1.63 0.02 0.00 0.00 175.26 177.56 1lee n LYS 208 N 2.08 -1.96 -2.63 1.61 5.02 -1.24 -4.90 118.16 116.14 1lee n LYS 208 Ca 0.02 0.42 -0.37 0.00 -2.02 0.00 0.00 58.31 56.35 1lee n LYS 208 Cb 0.45 -4.18 -0.05 0.00 -0.02 0.00 0.00 35.03 31.23 1lee n LYS 208 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1lee s ALA 209 N -3.64 3.20 -0.07 7.82 0.00 0.80 -4.77 121.76 125.11 1lee s ALA 209 Ca 0.31 0.66 -0.29 0.00 0.00 0.00 0.00 51.96 52.64 1lee s ALA 209 Cb -0.12 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 1lee s ALA 209 CO 0.88 -0.04 0.96 1.21 0.00 0.00 0.00 175.76 178.77 1lee s ASN 210 N -1.45 7.25 -0.22 0.00 2.47 -0.91 -1.74 114.94 120.34 1lee s ASN 210 Ca 0.52 1.53 0.02 0.00 0.42 0.00 0.00 52.86 55.35 1lee s ASN 210 Cb -0.23 -2.54 0.04 0.00 -1.45 0.00 0.00 41.25 37.07 1lee s ASN 210 CO 0.29 -0.35 -0.15 0.00 -3.72 0.00 0.00 177.10 173.17 1lee s ILE 212 N 1.20 5.14 -0.66 0.00 1.01 -0.23 -1.42 121.20 126.24 1lee s ILE 212 Ca -0.03 0.49 -0.24 0.00 0.00 0.00 0.00 60.65 60.87 1lee s ILE 212 Cb -0.17 -3.76 0.06 0.00 0.01 0.00 0.00 42.46 38.59 1lee s ILE 212 CO -0.08 0.06 1.03 -0.69 0.00 0.00 0.00 174.94 175.26 1lee s VAL 213 N 2.13 4.19 -0.26 2.92 1.01 -0.29 0.53 120.40 130.63 1lee s VAL 213 Ca 0.16 -0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.10 1lee s VAL 213 Cb -0.16 -4.71 0.06 0.00 0.00 0.00 0.00 36.38 31.57 1lee s VAL 213 CO 0.11 -1.49 -0.08 -0.62 0.00 0.00 0.00 175.10 173.01 1lee s ASP 214 N 3.54 4.32 0.58 3.32 3.68 -0.82 -4.68 116.67 126.61 1lee s ASP 214 Ca 0.27 -1.40 0.35 0.00 2.13 0.00 0.00 52.55 53.90 1lee s ASP 214 Cb -0.14 -1.46 1.71 0.00 -1.45 0.00 0.00 42.92 41.58 1lee s ASP 214 CO 0.13 -0.22 2.13 0.77 0.13 0.00 0.00 175.17 178.11 1lee h SER 215 N 7.81 0.00 0.26 -0.34 4.64 -1.85 -2.95 113.55 121.12 1lee h SER 215 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1lee h SER 215 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1lee h SER 215 CO 0.45 0.04 -0.09 0.61 -0.87 0.00 0.00 176.83 176.98 1lee n GLY 216 N -0.51 -0.81 3.53 -0.77 0.00 -1.26 -4.62 105.19 100.74 1lee n GLY 216 Ca -0.01 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1lee n GLY 216 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lee s THR 217 N -2.35 4.44 -2.32 2.61 2.01 -1.11 -5.02 115.64 113.90 1lee s THR 217 Ca 0.32 -0.14 0.26 0.00 0.31 0.00 0.00 61.69 62.44 1lee s THR 217 Cb 0.20 -3.03 0.58 0.00 0.01 0.00 0.00 72.50 70.26 1lee s THR 217 CO 0.45 0.41 1.76 -1.54 -0.69 0.00 0.00 174.62 175.00 1lee n SER 218 N 4.20 1.20 -4.23 3.53 3.41 -1.26 0.43 113.62 120.90 1lee n SER 218 Ca -0.16 -1.48 -0.21 0.00 -0.26 0.00 0.00 58.87 56.76 1lee n SER 218 Cb 0.52 -0.03 -0.09 0.00 -0.26 0.00 0.00 64.21 64.34 1lee n SER 218 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lee s ALA 219 N -1.94 2.32 -0.19 7.33 0.00 -1.26 -4.30 121.76 123.72 1lee s ALA 219 Ca 0.37 -1.71 -0.15 0.00 0.00 0.00 0.00 51.96 50.47 1lee s ALA 219 Cb 0.19 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 24.14 1lee s ALA 219 CO 0.31 -0.39 0.36 0.42 0.00 0.00 0.00 175.76 176.46 1lee s ILE 220 N -3.43 5.24 -0.04 0.00 -1.09 -0.36 -3.21 121.20 118.31 1lee s ILE 220 Ca 0.33 0.64 -0.03 0.00 -2.23 0.00 0.00 60.65 59.36 1lee s ILE 220 Cb 0.06 -3.69 -0.04 0.00 -1.58 0.00 0.00 42.46 37.21 1lee s ILE 220 CO 0.15 0.30 0.13 0.42 -1.23 0.00 0.00 174.94 174.71 1lee s THR 221 N 1.03 5.17 0.05 2.92 -4.23 -0.89 -1.73 115.64 117.96 1lee s THR 221 Ca 0.18 -0.16 0.05 0.00 -1.18 0.00 0.00 61.69 60.59 1lee s THR 221 Cb -0.14 -3.35 -0.03 0.00 1.34 0.00 0.00 72.50 70.33 1lee s THR 221 CO 0.07 0.42 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.72 1lee s VAL 222 N -1.19 1.22 0.65 2.29 1.01 -0.39 -2.24 120.40 121.75 1lee s VAL 222 Ca 0.22 -1.15 -0.16 0.00 0.00 0.00 0.00 61.98 60.89 1lee s VAL 222 Cb -0.12 -1.12 -0.00 0.00 0.00 0.00 0.00 36.38 35.13 1lee s VAL 222 CO 0.13 -0.04 1.16 -2.84 0.00 0.00 0.00 175.10 173.51 1lee s PRO 223 N -1.37 2.72 0.17 2.72 0.02 -1.24 0.13 135.00 138.15 1lee s PRO 223 Ca 0.02 1.62 -0.08 0.00 0.02 0.00 0.00 61.00 62.58 1lee s PRO 223 Cb -0.09 -1.92 0.03 0.00 0.02 0.00 0.00 34.50 32.55 1lee s PRO 223 CO 0.02 -1.35 1.52 1.79 -0.33 0.00 0.00 177.00 178.64 1lee h THR 224 N 0.29 1.28 -0.23 0.99 1.35 -1.89 -1.77 112.91 112.93 1lee h THR 224 Ca -0.48 -1.54 -0.04 0.00 -0.55 0.00 0.00 66.41 63.81 1lee h THR 224 Cb 1.27 1.38 -0.01 0.00 -1.73 0.00 0.00 68.15 69.06 1lee h THR 224 CO 0.53 0.51 -0.02 -2.24 -0.25 0.00 0.00 175.52 174.06 1lee h ASP 225 N 0.70 0.31 -0.15 5.36 -0.00 -1.97 0.75 116.42 121.41 1lee h ASP 225 Ca 0.06 -0.05 -0.05 0.00 -0.00 0.00 0.00 57.03 57.00 1lee h ASP 225 Cb 0.93 -0.08 -0.00 0.00 -0.00 0.00 0.00 39.33 40.18 1lee h ASP 225 CO 0.09 0.38 -0.10 0.15 -0.00 0.00 0.00 179.24 179.76 1lee h PHE 226 N 0.33 0.40 -0.31 4.15 3.04 -1.93 -1.10 116.94 121.51 1lee h PHE 226 Ca 0.07 -0.11 -0.03 0.00 3.98 0.00 0.00 57.97 61.89 1lee h PHE 226 Cb 0.25 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 38.66 1lee h PHE 226 CO 0.01 0.68 0.08 1.25 -2.02 0.00 0.00 178.31 178.31 1lee h LEU 227 N -0.01 0.46 -0.34 0.59 5.85 -0.77 -1.90 115.31 119.19 1lee h LEU 227 Ca 0.03 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.60 1lee h LEU 227 Cb 0.60 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.43 1lee h LEU 227 CO 0.03 0.57 -0.13 -1.13 -0.34 0.00 0.00 178.44 177.43 1lee h ASN 228 N 0.33 -0.46 -1.01 1.25 -1.24 0.74 -1.48 115.58 113.72 1lee h ASN 228 Ca 0.10 0.12 0.02 0.00 0.71 0.00 0.00 56.30 57.25 1lee h ASN 228 Cb 0.28 0.27 -0.05 0.00 0.73 0.00 0.00 38.32 39.54 1lee h ASN 228 CO 0.00 -0.17 0.67 0.11 -1.29 0.00 0.00 177.43 176.75 1lee h LYS 229 N -0.07 1.30 0.00 6.67 1.57 -1.13 -2.96 116.57 121.96 1lee h LYS 229 Ca 0.17 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1lee h LYS 229 Cb 0.33 -0.29 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1lee h LYS 229 CO -0.39 0.86 -0.18 0.00 -0.57 0.00 0.00 179.45 179.17 1lee h MET 230 N 1.34 0.00 0.00 3.15 -0.00 -0.48 -3.10 114.93 115.83 1lee h MET 230 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.08 1lee h MET 230 Cb -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.49 1lee h MET 230 CO -0.09 0.18 -0.04 1.28 -0.00 0.00 0.00 176.91 178.23 1lee n LEU 231 N -3.22 0.50 -4.59 -0.10 4.77 -0.64 -4.52 117.00 109.20 1lee n LEU 231 Ca 0.02 0.52 -0.48 0.00 -0.03 0.00 0.00 56.01 56.03 1lee n LEU 231 Cb 0.50 -0.38 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1lee n LEU 231 CO 0.34 -0.10 1.68 0.00 -1.33 0.00 0.00 177.39 177.98 1lee n GLN 232 N -1.95 1.76 0.00 3.23 6.02 -1.18 -1.73 117.38 123.53 1lee n GLN 232 Ca 0.06 0.57 0.00 0.00 -0.01 0.00 0.00 57.00 57.62 1lee n GLN 232 Cb 0.39 -2.73 0.00 0.00 1.02 0.00 0.00 30.24 28.92 1lee n GLN 232 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1lee n ASN 233 N 8.94 0.00 -4.74 1.08 3.02 -1.26 -4.95 115.26 117.35 1lee n ASN 233 Ca 0.30 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.48 1lee n ASN 233 Cb 0.31 -0.85 0.05 0.00 -0.61 0.00 0.00 39.78 38.68 1lee n ASN 233 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1lee s LEU 234 N 0.00 3.73 -1.42 3.41 1.43 -0.71 -4.80 118.68 120.31 1lee s LEU 234 Ca 0.00 2.72 -0.07 0.00 -1.03 0.00 0.00 54.13 55.75 1lee s LEU 234 Cb 0.00 -4.42 0.05 0.00 0.03 0.00 0.00 46.19 41.85 1lee s LEU 234 CO 0.00 -1.78 2.57 0.47 0.23 0.00 0.00 176.35 177.84 1lee n ASP 235 N -1.42 8.27 -4.22 2.29 10.43 -1.26 -4.85 116.55 125.79 1lee n ASP 235 Ca 0.13 -2.96 -0.34 0.00 2.57 0.00 0.00 54.79 54.20 1lee n ASP 235 Cb 0.46 -1.43 -0.15 0.00 1.84 0.00 0.00 41.12 41.84 1lee n ASP 235 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1lee s VAL 236 N -0.06 2.64 -0.16 2.53 1.01 -1.26 -4.60 120.40 120.50 1lee s VAL 236 Ca 0.59 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.75 1lee s VAL 236 Cb 0.18 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1lee s VAL 236 CO -0.08 0.50 0.07 -0.63 0.00 0.00 0.00 175.10 174.95 1lee s ILE 237 N 1.22 4.87 -0.14 2.22 -1.09 -0.46 -4.92 121.20 122.89 1lee s ILE 237 Ca 0.02 -0.01 -0.17 0.00 -2.23 0.00 0.00 60.65 58.27 1lee s ILE 237 Cb -0.14 -3.17 -0.04 0.00 -1.58 0.00 0.00 42.46 37.53 1lee s ILE 237 CO -0.06 0.51 0.42 -0.75 -1.23 0.00 0.00 174.94 173.82 1lee s LYS 238 N -0.04 4.30 -0.30 2.79 2.47 -1.26 -0.61 119.74 127.09 1lee s LYS 238 Ca 0.07 0.32 -0.25 0.00 -1.56 0.00 0.00 55.97 54.55 1lee s LYS 238 Cb -0.12 -3.45 0.01 0.00 -1.46 0.00 0.00 37.83 32.81 1lee s LYS 238 CO 0.01 0.15 0.88 0.08 0.16 0.00 0.00 175.35 176.63 1lee s VAL 239 N 0.69 4.71 0.72 4.02 1.01 0.15 -5.00 120.40 126.71 1lee s VAL 239 Ca 0.22 1.40 -0.16 0.00 0.00 0.00 0.00 61.98 63.44 1lee s VAL 239 Cb -0.14 -4.23 -0.00 0.00 0.00 0.00 0.00 36.38 32.01 1lee s VAL 239 CO 0.08 -0.30 0.87 -2.65 0.00 0.00 0.00 175.10 173.11 1lee n PRO 240 N 6.37 0.45 0.00 2.72 -0.02 -1.26 -3.51 135.00 139.75 1lee n PRO 240 Ca 0.06 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1lee n PRO 240 Cb 0.48 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1lee n PRO 240 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1lee n PHE 241 N -2.51 0.00 -3.13 6.00 -0.00 -1.26 -4.90 117.46 111.66 1lee n PHE 241 Ca 0.12 0.00 -0.39 0.00 -0.00 0.00 0.00 57.45 57.18 1lee n PHE 241 Cb 0.50 0.00 -0.06 0.00 -0.00 0.00 0.00 39.48 39.92 1lee n PHE 241 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1lee s LEU 242 N 0.00 4.53 0.00 -2.13 1.43 -1.23 -5.00 118.68 116.28 1lee s LEU 242 Ca 0.00 1.40 0.03 0.00 -1.03 0.00 0.00 54.13 54.53 1lee s LEU 242 Cb 0.00 -3.07 0.16 0.00 0.03 0.00 0.00 46.19 43.31 1lee s LEU 242 CO 0.00 0.20 0.50 -0.81 0.23 0.00 0.00 176.35 176.47 1lee n PRO 243 N 1.93 0.30 -2.80 1.29 -0.04 -1.26 -4.45 135.00 129.97 1lee n PRO 243 Ca -0.07 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.98 1lee n PRO 243 Cb 0.50 -1.14 -0.04 0.00 -0.04 0.00 0.00 33.50 32.78 1lee n PRO 243 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1lee s PHE 244 N -2.00 3.77 -0.18 0.54 0.40 -1.26 -4.80 117.98 114.45 1lee s PHE 244 Ca 0.04 1.70 0.00 0.00 -0.60 0.00 0.00 56.93 58.07 1lee s PHE 244 Cb 0.02 -3.00 0.01 0.00 0.51 0.00 0.00 43.02 40.57 1lee s PHE 244 CO 0.03 0.20 -0.18 0.71 0.70 0.00 0.00 175.22 176.68 1lee s TYR 245 N 0.10 2.79 0.20 0.36 1.51 -1.26 -0.67 117.35 120.38 1lee s TYR 245 Ca 0.45 -1.52 0.11 0.00 -1.01 0.00 0.00 57.07 55.10 1lee s TYR 245 Cb -0.22 -1.93 -0.04 0.00 -0.11 0.00 0.00 41.96 39.65 1lee s TYR 245 CO 0.28 -0.75 -0.18 0.14 -1.11 0.00 0.00 175.55 173.93 1lee s VAL 246 N 1.26 2.69 0.17 0.71 -7.23 0.22 -0.19 120.40 118.04 1lee s VAL 246 Ca 0.04 -1.95 -0.22 0.00 -1.81 0.00 0.00 61.98 58.04 1lee s VAL 246 Cb -0.13 -2.33 0.06 0.00 0.56 0.00 0.00 36.38 34.54 1lee s VAL 246 CO -0.10 -0.16 0.59 0.28 -0.31 0.00 0.00 175.10 175.40 1lee s THR 247 N -1.80 0.01 0.24 5.32 -1.32 0.33 -1.36 115.64 117.05 1lee s THR 247 Ca 0.24 -0.18 -0.30 0.00 -1.21 0.00 0.00 61.69 60.24 1lee s THR 247 Cb -0.08 -1.14 -0.09 0.00 -1.51 0.00 0.00 72.50 69.68 1lee s THR 247 CO 0.13 -0.03 1.30 -0.76 -2.21 0.00 0.00 174.62 173.05 1lee s LEU 248 N -2.78 4.43 0.66 9.08 1.43 -1.26 0.14 118.68 130.37 1lee s LEU 248 Ca 0.03 2.48 0.41 0.00 -1.03 0.00 0.00 54.13 56.01 1lee s LEU 248 Cb -0.01 -3.62 2.21 0.00 0.03 0.00 0.00 46.19 44.79 1lee s LEU 248 CO -0.10 -0.51 2.24 0.00 0.23 0.00 0.00 176.35 178.21 1lee n ASN 250 N -3.00 4.66 -4.60 0.00 6.94 -1.26 -4.95 115.26 113.04 1lee n ASN 250 Ca -0.03 -2.73 -0.43 0.00 -0.02 0.00 0.00 54.58 51.38 1lee n ASN 250 Cb 0.14 -0.57 -0.03 0.00 -2.36 0.00 0.00 39.78 36.96 1lee n ASN 250 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1lee s ASN 251 N -1.19 5.52 0.65 0.53 3.04 -0.64 -4.82 114.94 118.04 1lee s ASN 251 Ca 0.47 1.68 0.43 0.00 0.04 0.00 0.00 52.86 55.48 1lee s ASN 251 Cb 0.34 -2.51 2.28 0.00 -1.54 0.00 0.00 41.25 39.82 1lee s ASN 251 CO 0.16 -1.94 2.31 0.77 -3.04 0.00 0.00 177.10 175.36 1lee h SER 252 N 14.70 0.00 0.95 -4.21 4.64 -1.92 -3.00 113.55 124.70 1lee h SER 252 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1lee h SER 252 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1lee h SER 252 CO 0.99 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 177.24 1lee n LYS 253 N -3.06 0.00 -1.63 4.77 5.02 -1.26 -4.87 118.16 117.13 1lee n LYS 253 Ca -0.02 0.03 -0.44 0.00 -2.02 0.00 0.00 58.31 55.85 1lee n LYS 253 Cb 0.10 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.57 1lee n LYS 253 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1lee n LEU 254 N -1.51 3.60 -4.88 -0.35 4.77 -1.14 -4.95 117.00 112.53 1lee n LEU 254 Ca 0.07 0.63 -0.30 0.00 -0.03 0.00 0.00 56.01 56.38 1lee n LEU 254 Cb 0.32 -1.49 0.02 0.00 -2.33 0.00 0.00 43.42 39.94 1lee n LEU 254 CO 0.26 -0.22 0.67 -2.16 -1.33 0.00 0.00 177.39 174.60 1lee s PRO 255 N 5.20 3.30 -0.21 3.23 0.04 -1.26 -4.82 135.00 140.47 1lee s PRO 255 Ca 0.95 0.50 -0.11 0.00 0.04 0.00 0.00 61.00 62.38 1lee s PRO 255 Cb -0.47 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 31.89 1lee s PRO 255 CO 0.42 -0.67 0.17 0.99 0.04 0.00 0.00 177.00 177.95 1lee s THR 256 N -3.14 5.37 0.36 1.26 2.01 -1.26 -4.45 115.64 115.78 1lee s THR 256 Ca 0.55 0.25 -0.27 0.00 0.31 0.00 0.00 61.69 62.53 1lee s THR 256 Cb -0.11 -3.51 -0.09 0.00 0.01 0.00 0.00 72.50 68.80 1lee s THR 256 CO 0.51 0.39 1.15 -0.36 -0.69 0.00 0.00 174.62 175.62 1lee s PHE 257 N 0.67 3.25 -0.09 4.92 0.08 -0.25 -4.52 117.98 122.03 1lee s PHE 257 Ca 0.09 1.59 -0.01 0.00 0.12 0.00 0.00 56.93 58.73 1lee s PHE 257 Cb -0.12 -3.36 0.03 0.00 -0.57 0.00 0.00 43.02 39.00 1lee s PHE 257 CO 0.01 -1.05 -0.03 -1.21 -0.10 0.00 0.00 175.22 172.84 1lee s GLU 258 N -2.02 0.97 -0.07 0.44 2.02 0.18 -0.94 118.70 119.28 1lee s GLU 258 Ca 0.52 -0.04 0.05 0.00 0.02 0.00 0.00 54.97 55.53 1lee s GLU 258 Cb -0.31 -1.20 -0.01 0.00 0.10 0.00 0.00 34.13 32.71 1lee s GLU 258 CO 0.39 -0.28 -0.24 -0.06 0.02 0.00 0.00 175.26 175.09 1lee s PHE 259 N 1.83 2.49 0.02 1.61 0.08 0.14 -0.16 117.98 123.98 1lee s PHE 259 Ca 0.04 -0.79 0.00 0.00 0.12 0.00 0.00 56.93 56.31 1lee s PHE 259 Cb -0.12 -1.64 -0.02 0.00 -0.57 0.00 0.00 43.02 40.67 1lee s PHE 259 CO -0.06 -0.26 -0.03 0.95 -0.10 0.00 0.00 175.22 175.72 1lee s THR 260 N -0.04 0.14 0.39 0.64 -4.23 -0.68 0.73 115.64 112.59 1lee s THR 260 Ca -0.07 -0.79 0.05 0.00 -1.18 0.00 0.00 61.69 59.69 1lee s THR 260 Cb -0.15 -0.26 -0.02 0.00 1.34 0.00 0.00 72.50 73.41 1lee s THR 260 CO 0.05 -0.41 0.18 -0.94 -0.54 0.00 0.00 174.62 172.96 1lee s SER 261 N -1.25 2.49 0.00 3.99 1.04 -0.70 -0.80 113.70 118.46 1lee s SER 261 Ca -0.13 -1.72 0.22 0.00 0.48 0.00 0.00 55.95 54.81 1lee s SER 261 Cb -0.09 0.55 1.11 0.00 0.10 0.00 0.00 66.02 67.70 1lee s SER 261 CO -0.01 -0.99 1.72 -1.84 0.98 0.00 0.00 173.24 173.11 1lee n GLU 262 N -0.84 0.30 -0.07 4.02 0.28 -1.26 -3.39 120.64 119.68 1lee n GLU 262 Ca -0.02 0.08 -0.14 0.00 -0.16 0.00 0.00 57.16 56.91 1lee n GLU 262 Cb 0.64 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.87 1lee n GLU 262 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1lee n ASN 263 N -1.30 1.22 -3.24 -1.84 3.02 -1.26 -5.06 115.26 106.79 1lee n ASN 263 Ca 0.10 0.10 -0.10 0.00 -0.03 0.00 0.00 54.58 54.66 1lee n ASN 263 Cb 0.18 -0.04 -0.00 0.00 -0.61 0.00 0.00 39.78 39.31 1lee n ASN 263 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1lee s GLY 264 N -5.71 0.51 -0.07 7.41 0.00 -1.22 -5.01 107.32 103.24 1lee s GLY 264 Ca -0.18 -0.83 -0.01 0.00 0.00 0.00 0.00 44.72 43.70 1lee s GLY 264 CO 0.75 -0.43 0.00 1.25 0.00 0.00 0.00 173.10 174.68 1lee s LYS 265 N -2.88 0.61 -0.17 2.90 2.20 -1.26 -1.73 119.74 119.42 1lee s LYS 265 Ca 0.18 0.11 -0.03 0.00 -0.36 0.00 0.00 55.97 55.87 1lee s LYS 265 Cb -0.04 -0.97 -0.02 0.00 -1.51 0.00 0.00 37.83 35.29 1lee s LYS 265 CO 0.12 -0.30 -0.06 0.71 -0.36 0.00 0.00 175.35 175.46 1lee s TYR 266 N 1.96 2.96 0.17 4.03 2.02 0.22 -4.94 117.35 123.78 1lee s TYR 266 Ca 0.05 -0.53 0.11 0.00 -0.37 0.00 0.00 57.07 56.33 1lee s TYR 266 Cb -0.12 -1.97 -0.04 0.00 -0.40 0.00 0.00 41.96 39.42 1lee s TYR 266 CO -0.05 -0.20 -0.24 0.95 -1.57 0.00 0.00 175.55 174.43 1lee s THR 267 N 0.65 2.37 -0.30 -0.71 -4.23 -1.26 0.24 115.64 112.39 1lee s THR 267 Ca -0.03 -1.92 -0.01 0.00 -1.18 0.00 0.00 61.69 58.55 1lee s THR 267 Cb -0.15 -2.11 0.10 0.00 1.34 0.00 0.00 72.50 71.68 1lee s THR 267 CO 0.02 -0.04 0.10 -0.22 -0.54 0.00 0.00 174.62 173.94 1lee s LEU 268 N -2.46 2.03 0.84 4.79 2.96 -0.12 -4.94 118.68 121.77 1lee s LEU 268 Ca 0.19 -1.56 -0.11 0.00 -0.22 0.00 0.00 54.13 52.43 1lee s LEU 268 Cb -0.09 -0.81 0.09 0.00 0.50 0.00 0.00 46.19 45.89 1lee s LEU 268 CO 0.09 -0.41 1.09 -1.61 -1.32 0.00 0.00 176.35 174.19 1lee s GLU 269 N 1.67 1.75 0.25 1.98 8.01 -1.26 -1.10 118.70 130.00 1lee s GLU 269 Ca 0.09 0.82 -0.04 0.00 0.01 0.00 0.00 54.97 55.85 1lee s GLU 269 Cb -0.17 -1.87 0.44 0.00 -4.31 0.00 0.00 34.13 28.23 1lee s GLU 269 CO -0.25 -1.90 1.76 -1.35 0.01 0.00 0.00 175.26 173.53 1lee h PRO 270 N -1.30 0.56 -0.49 0.39 0.11 -1.88 -1.61 132.00 127.78 1lee h PRO 270 Ca -0.48 -0.03 0.14 0.00 0.11 0.00 0.00 66.00 65.74 1lee h PRO 270 Cb 1.27 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1lee h PRO 270 CO 0.56 0.37 0.48 1.05 -0.21 0.00 0.00 178.00 180.25 1lee h GLU 271 N 0.57 0.00 0.00 1.05 4.11 -1.93 -1.18 114.58 117.21 1lee h GLU 271 Ca 0.41 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.66 1lee h GLU 271 Cb 0.54 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1lee h GLU 271 CO -0.34 0.00 -1.19 1.88 0.07 0.00 0.00 179.01 179.43 1lee h TYR 272 N 0.00 0.00 -0.13 2.06 -1.99 -1.65 -3.38 116.97 111.88 1lee h TYR 272 Ca 0.23 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.96 1lee h TYR 272 Cb 1.19 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.92 1lee h TYR 272 CO 0.00 0.68 0.00 2.48 -0.00 0.00 0.00 178.16 181.32 1lee n TYR 273 N -3.05 0.15 -3.41 4.88 4.11 -0.68 -4.82 117.16 114.34 1lee n TYR 273 Ca -0.07 -0.13 -0.40 0.00 -0.00 0.00 0.00 57.90 57.30 1lee n TYR 273 Cb 0.86 -0.01 -0.09 0.00 -0.00 0.00 0.00 39.34 40.10 1lee n TYR 273 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1lee s LEU 274 N -1.11 4.20 0.40 -3.48 1.43 -0.53 0.21 118.68 119.81 1lee s LEU 274 Ca 0.19 0.04 0.08 0.00 -1.03 0.00 0.00 54.13 53.41 1lee s LEU 274 Cb 0.12 -2.37 0.01 0.00 0.03 0.00 0.00 46.19 43.98 1lee s LEU 274 CO 0.18 -0.25 0.55 -1.58 0.23 0.00 0.00 176.35 175.48 1lee s GLN 275 N 2.04 2.89 1.22 1.70 2.00 0.87 -4.85 119.66 125.53 1lee s GLN 275 Ca 0.13 -1.19 0.00 0.00 -2.00 0.00 0.00 55.36 52.30 1lee s GLN 275 Cb -0.16 -2.77 0.00 0.00 0.80 0.00 0.00 33.01 30.88 1lee s GLN 275 CO 0.11 -0.20 0.00 0.72 -0.50 0.00 0.00 175.29 175.42 1lee n HIS 276 N -1.81 0.00 -2.10 1.67 8.25 -1.26 -0.20 115.22 119.76 1lee n HIS 276 Ca 0.06 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.49 1lee n HIS 276 Cb 0.59 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.67 1lee n HIS 276 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1lee n ILE 277 N 0.00 -8.90 -1.87 1.59 2.08 -1.25 -4.81 119.36 106.20 1lee n ILE 277 Ca 0.00 1.69 -0.02 0.00 0.56 0.00 0.00 62.75 64.98 1lee n ILE 277 Cb 0.00 -5.26 0.01 0.00 -0.75 0.00 0.00 39.64 33.64 1lee n ILE 277 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1lee n GLU 278 N 1.02 -0.47 0.00 0.38 -0.58 -1.26 -5.03 120.64 114.70 1lee n GLU 278 Ca -0.23 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 1lee n GLU 278 Cb 0.35 -2.33 0.00 0.00 -0.57 0.00 0.00 31.44 28.89 1lee n GLU 278 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1lee n ASP 279 N -1.58 0.00 -4.46 1.62 2.03 -1.14 -4.95 116.55 108.05 1lee n ASP 279 Ca -0.02 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.86 1lee n ASP 279 Cb 0.52 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.89 1lee n ASP 279 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1lee s VAL 280 N 2.69 4.58 0.00 5.18 0.11 -1.26 -4.74 120.40 126.97 1lee s VAL 280 Ca 0.00 -1.35 0.00 0.00 -2.93 0.00 0.00 61.98 57.70 1lee s VAL 280 Cb 0.00 -4.81 0.00 0.00 -1.53 0.00 0.00 36.38 30.04 1lee s VAL 280 CO 0.00 -1.56 0.00 0.61 -3.33 0.00 0.00 175.10 170.82 1lee n GLY 281 N 5.66 0.69 0.00 6.54 0.00 -1.26 -4.71 105.19 112.11 1lee n GLY 281 Ca 0.22 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 45.10 1lee n GLY 281 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1lee n PRO 282 N 0.00 0.00 -3.74 1.61 -0.02 -1.26 -4.92 135.00 126.67 1lee n PRO 282 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.19 1lee n PRO 282 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.36 1lee n PRO 282 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1lee s GLY 283 N 0.00 2.06 -0.11 -1.23 0.00 -1.26 -2.90 107.32 103.88 1lee s GLY 283 Ca 0.00 -3.03 -0.16 0.00 0.00 0.00 0.00 44.72 41.53 1lee s GLY 283 CO 0.00 1.45 0.41 -2.27 0.00 0.00 0.00 173.10 172.69 1lee s LEU 284 N -0.33 4.30 0.09 0.66 2.96 -1.26 -1.09 118.68 124.00 1lee s LEU 284 Ca 0.23 0.74 0.09 0.00 -0.22 0.00 0.00 54.13 54.97 1lee s LEU 284 Cb -0.13 -2.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.95 1lee s LEU 284 CO -0.09 0.08 -0.24 0.00 -1.32 0.00 0.00 176.35 174.79 1lee s MET 286 N -1.65 3.69 -0.14 0.00 1.75 0.72 -0.51 119.30 123.15 1lee s MET 286 Ca 0.10 0.03 -0.22 0.00 -1.25 0.00 0.00 55.69 54.34 1lee s MET 286 Cb -0.10 -3.23 -0.03 0.00 2.84 0.00 0.00 34.83 34.31 1lee s MET 286 CO 0.04 0.68 0.69 -0.51 -0.65 0.00 0.00 175.02 175.26 1lee s LEU 287 N -0.83 4.22 -1.18 4.11 1.02 0.73 -0.09 118.68 126.67 1lee s LEU 287 Ca 0.17 1.03 -0.08 0.00 0.02 0.00 0.00 54.13 55.27 1lee s LEU 287 Cb -0.13 -3.02 -0.10 0.00 0.02 0.00 0.00 46.19 42.96 1lee s LEU 287 CO 0.06 -0.23 3.03 -3.20 0.02 0.00 0.00 176.35 176.04 1lee n ASN 288 N 4.55 7.81 -3.94 2.29 2.85 0.13 -4.53 115.26 124.42 1lee n ASN 288 Ca -0.00 -2.65 -0.14 0.00 -0.11 0.00 0.00 54.58 51.67 1lee n ASN 288 Cb 0.50 -1.49 -0.14 0.00 1.24 0.00 0.00 39.78 39.90 1lee n ASN 288 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1lee s ILE 289 N 1.28 0.28 -0.01 -1.44 1.01 -1.26 -1.23 121.20 119.83 1lee s ILE 289 Ca 0.67 -0.28 -0.04 0.00 0.00 0.00 0.00 60.65 60.99 1lee s ILE 289 Cb 0.22 -0.27 -0.00 0.00 0.01 0.00 0.00 42.46 42.42 1lee s ILE 289 CO -0.06 -0.01 0.09 0.27 0.00 0.00 0.00 174.94 175.23 1lee s ILE 290 N -0.29 0.06 -0.02 2.92 -4.36 -0.71 -4.76 121.20 114.05 1lee s ILE 290 Ca -0.01 -0.53 -0.30 0.00 -0.26 0.00 0.00 60.65 59.55 1lee s ILE 290 Cb -0.03 -0.31 -0.03 0.00 1.25 0.00 0.00 42.46 43.35 1lee s ILE 290 CO -0.00 -0.29 1.06 -0.83 0.24 0.00 0.00 174.94 175.12 1lee s GLY 291 N -0.95 2.57 -0.17 6.27 0.00 -1.26 -1.26 107.32 112.52 1lee s GLY 291 Ca -0.10 0.57 -0.09 0.00 0.00 0.00 0.00 44.72 45.09 1lee s GLY 291 CO 0.01 1.88 0.41 -2.27 0.00 0.00 0.00 173.10 173.13 1lee s LEU 292 N 1.43 -0.09 -0.13 0.66 2.96 0.34 -4.85 118.68 119.00 1lee s LEU 292 Ca 0.53 0.89 -0.02 0.00 -0.22 0.00 0.00 54.13 55.31 1lee s LEU 292 Cb -0.22 1.35 -0.03 0.00 0.50 0.00 0.00 46.19 47.79 1lee s LEU 292 CO 0.25 -0.19 -0.05 -1.81 -1.32 0.00 0.00 176.35 173.22 1lee s ASP 293 N 1.40 4.69 0.37 3.68 -0.00 -1.26 -3.64 116.67 121.91 1lee s ASP 293 Ca -0.10 -0.12 0.08 0.00 -0.00 0.00 0.00 52.55 52.41 1lee s ASP 293 Cb -0.08 -1.63 -0.07 0.00 -0.00 0.00 0.00 42.92 41.14 1lee s ASP 293 CO -0.13 0.22 -0.03 -0.36 -0.00 0.00 0.00 175.17 174.87 1lee s PHE 294 N 0.07 2.41 0.32 4.23 0.08 -1.26 -5.04 117.98 118.79 1lee s PHE 294 Ca -0.01 -0.62 0.09 0.00 0.12 0.00 0.00 56.93 56.51 1lee s PHE 294 Cb -0.14 -1.56 0.85 0.00 -0.57 0.00 0.00 43.02 41.60 1lee s PHE 294 CO 0.03 0.47 1.75 -1.35 -0.10 0.00 0.00 175.22 176.02 1lee h PRO 295 N 1.92 0.62 -6.12 0.24 0.11 -2.02 -3.37 132.00 123.38 1lee h PRO 295 Ca -0.43 -0.04 -0.67 0.00 0.11 0.00 0.00 66.00 64.98 1lee h PRO 295 Cb 1.24 -0.14 -0.31 0.00 0.11 0.00 0.00 31.00 31.91 1lee h PRO 295 CO 0.75 0.41 -0.88 0.14 -0.21 0.00 0.00 178.00 178.22 1lee s VAL 296 N -5.78 1.93 -0.44 3.15 -7.23 -1.26 -5.07 120.40 105.70 1lee s VAL 296 Ca -0.11 -1.02 -0.45 0.00 -1.81 0.00 0.00 61.98 58.60 1lee s VAL 296 Cb 0.26 -1.62 -0.18 0.00 0.56 0.00 0.00 36.38 35.39 1lee s VAL 296 CO 0.80 0.54 1.71 -2.65 -0.31 0.00 0.00 175.10 175.20 1lee n PRO 297 N 2.77 0.34 -4.48 4.82 -0.02 -1.26 -4.87 135.00 132.30 1lee n PRO 297 Ca -0.17 0.12 -0.20 0.00 -2.02 0.00 0.00 63.50 61.23 1lee n PRO 297 Cb 0.52 -1.69 -0.15 0.00 -0.02 0.00 0.00 33.50 32.16 1lee n PRO 297 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1lee s THR 298 N 3.60 0.90 -0.11 3.45 2.01 -1.26 -2.13 115.64 122.10 1lee s THR 298 Ca 1.05 -0.53 0.01 0.00 0.31 0.00 0.00 61.69 62.53 1lee s THR 298 Cb -1.37 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 70.36 1lee s THR 298 CO 0.75 0.22 -0.14 -0.36 -0.69 0.00 0.00 174.62 174.40 1lee s PHE 299 N -0.33 2.77 -0.31 4.92 0.08 -0.47 -3.70 117.98 120.94 1lee s PHE 299 Ca 0.04 -0.53 -0.13 0.00 0.12 0.00 0.00 56.93 56.43 1lee s PHE 299 Cb -0.05 -1.78 -0.03 0.00 -0.57 0.00 0.00 43.02 40.59 1lee s PHE 299 CO -0.00 -0.12 0.25 0.42 -0.10 0.00 0.00 175.22 175.67 1lee s ILE 300 N 0.07 5.27 -1.12 0.64 1.01 -0.95 -1.06 121.20 125.05 1lee s ILE 300 Ca -0.05 0.04 -0.16 0.00 0.00 0.00 0.00 60.65 60.48 1lee s ILE 300 Cb -0.15 -3.66 0.14 0.00 0.01 0.00 0.00 42.46 38.81 1lee s ILE 300 CO 0.04 0.09 1.38 -0.76 0.00 0.00 0.00 174.94 175.69 1lee s LEU 301 N 1.81 4.83 0.00 2.97 1.02 0.19 -2.09 118.68 127.40 1lee s LEU 301 Ca 0.08 -2.56 0.00 0.00 0.02 0.00 0.00 54.13 51.67 1lee s LEU 301 Cb -0.17 -2.43 0.00 0.00 0.02 0.00 0.00 46.19 43.61 1lee s LEU 301 CO 0.11 -0.93 0.00 0.61 0.02 0.00 0.00 176.35 176.16 1lee n GLY 302 N 4.83 -0.10 0.32 -3.19 0.00 -1.20 -1.95 105.19 103.91 1lee n GLY 302 Ca 0.34 -1.76 0.17 0.00 0.00 0.00 0.00 46.02 44.77 1lee n GLY 302 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lee n ASP 303 N -1.00 -0.03 -0.11 1.61 10.43 0.17 -0.65 116.55 126.96 1lee n ASP 303 Ca 0.00 1.59 0.08 0.00 2.57 0.00 0.00 54.79 59.03 1lee n ASP 303 Cb 0.00 -0.61 0.42 0.00 1.84 0.00 0.00 41.12 42.77 1lee n ASP 303 CO 0.00 0.00 0.00 -0.65 -1.07 0.00 0.00 177.20 175.48 1lee h PRO 304 N 0.00 0.57 -0.05 -0.24 0.11 -1.83 0.21 132.00 130.77 1lee h PRO 304 Ca 0.61 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.64 1lee h PRO 304 Cb 1.35 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1lee h PRO 304 CO -0.86 0.38 -0.16 0.35 -0.21 0.00 0.00 178.00 177.50 1lee h PHE 305 N 0.58 0.26 0.00 0.65 3.04 -1.19 -3.26 116.94 117.02 1lee h PHE 305 Ca 0.27 -0.11 -0.01 0.00 3.98 0.00 0.00 57.97 62.11 1lee h PHE 305 Cb 0.33 -0.04 -0.00 0.00 2.56 0.00 0.00 35.95 38.79 1lee h PHE 305 CO -0.00 0.79 -0.05 0.52 -2.02 0.00 0.00 178.31 177.55 1lee h MET 306 N -0.35 0.00 -0.18 1.11 2.86 -1.31 0.48 114.93 117.54 1lee h MET 306 Ca -0.01 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.50 1lee h MET 306 Cb 0.80 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 1lee h MET 306 CO 0.03 0.05 -0.45 0.00 1.06 0.00 0.00 176.91 177.60 1lee h ARG 307 N 0.00 0.45 0.16 1.72 3.08 -0.99 -3.25 114.38 115.54 1lee h ARG 307 Ca -0.00 -0.24 -0.26 0.00 0.07 0.00 0.00 59.98 59.55 1lee h ARG 307 Cb 0.38 0.01 0.02 0.00 0.08 0.00 0.00 29.97 30.46 1lee h ARG 307 CO 0.01 0.82 -1.21 -0.22 -1.07 0.00 0.00 179.97 178.29 1lee h LYS 308 N 0.37 0.34 -5.06 0.04 3.64 -1.43 -3.47 116.57 111.01 1lee h LYS 308 Ca 0.02 -0.58 -0.64 0.00 -1.27 0.00 0.00 60.65 58.19 1lee h LYS 308 Cb 0.94 0.22 -0.20 0.00 -0.41 0.00 0.00 32.23 32.78 1lee h LYS 308 CO 0.08 1.28 -0.60 0.71 -2.27 0.00 0.00 179.45 178.65 1lee s TYR 309 N -2.49 3.14 0.37 1.91 1.51 0.08 -1.63 117.35 120.25 1lee s TYR 309 Ca -0.15 -0.22 -0.27 0.00 -1.01 0.00 0.00 57.07 55.42 1lee s TYR 309 Cb 0.03 -2.19 -0.10 0.00 -0.11 0.00 0.00 41.96 39.59 1lee s TYR 309 CO 0.84 -0.18 1.34 0.12 -1.11 0.00 0.00 175.55 176.55 1lee s PHE 310 N 1.21 2.86 0.02 2.71 2.19 0.10 -4.39 117.98 122.68 1lee s PHE 310 Ca 0.05 1.37 0.03 0.00 0.33 0.00 0.00 56.93 58.71 1lee s PHE 310 Cb -0.14 -3.73 -0.01 0.00 -1.31 0.00 0.00 43.02 37.82 1lee s PHE 310 CO 0.04 -2.16 -0.08 0.95 1.83 0.00 0.00 175.22 175.79 1lee s THR 311 N -1.19 0.64 -0.07 0.12 -4.23 -1.16 -1.61 115.64 108.14 1lee s THR 311 Ca 0.53 -0.67 0.05 0.00 -1.18 0.00 0.00 61.69 60.43 1lee s THR 311 Cb -0.40 -0.61 -0.01 0.00 1.34 0.00 0.00 72.50 72.82 1lee s THR 311 CO 0.53 -0.04 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.63 1lee s VAL 312 N -0.67 2.09 -0.28 2.29 1.01 0.11 -1.76 120.40 123.19 1lee s VAL 312 Ca -0.01 -1.04 0.01 0.00 0.00 0.00 0.00 61.98 60.93 1lee s VAL 312 Cb -0.06 -1.77 0.06 0.00 0.00 0.00 0.00 36.38 34.62 1lee s VAL 312 CO 0.00 0.57 -0.05 -0.36 0.00 0.00 0.00 175.10 175.26 1lee s PHE 313 N -0.06 3.31 -0.40 5.22 0.08 0.93 -0.72 117.98 126.35 1lee s PHE 313 Ca -0.07 -2.21 -0.06 0.00 0.12 0.00 0.00 56.93 54.71 1lee s PHE 313 Cb -0.15 -2.10 0.08 0.00 -0.57 0.00 0.00 43.02 40.29 1lee s PHE 313 CO 0.05 -0.86 0.20 0.34 -0.10 0.00 0.00 175.22 174.85 1lee s ASP 314 N 1.16 5.39 0.26 1.36 -1.08 -0.91 -0.79 116.67 122.06 1lee s ASP 314 Ca -0.06 -1.65 0.06 0.00 -0.52 0.00 0.00 52.55 50.39 1lee s ASP 314 Cb -0.20 -1.89 0.34 0.00 -1.46 0.00 0.00 42.92 39.71 1lee s ASP 314 CO -0.04 -0.50 1.62 1.88 0.52 0.00 0.00 175.17 178.66 1lee h TYR 315 N 8.22 0.26 -0.58 -5.34 -1.99 -0.90 -1.53 116.97 115.11 1lee h TYR 315 Ca -0.19 -0.09 -0.06 0.00 2.00 0.00 0.00 58.73 60.39 1lee h TYR 315 Cb 1.07 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 39.72 1lee h TYR 315 CO 0.59 0.70 0.11 -0.44 -0.00 0.00 0.00 178.16 179.13 1lee h ASP 316 N 0.16 0.90 -0.45 3.88 3.45 -1.88 -3.14 116.42 119.35 1lee h ASP 316 Ca 0.00 -0.25 0.00 0.00 0.43 0.00 0.00 57.03 57.21 1lee h ASP 316 Cb 1.00 -0.24 0.00 0.00 -0.56 0.00 0.00 39.33 39.53 1lee h ASP 316 CO 0.08 0.92 0.00 0.59 -1.57 0.00 0.00 179.24 179.26 1lee n ASN 317 N -4.35 3.53 -4.00 6.45 4.13 -1.22 -4.98 115.26 114.83 1lee n ASN 317 Ca 0.03 -1.99 -0.30 0.00 1.68 0.00 0.00 54.58 54.00 1lee n ASN 317 Cb 0.26 -0.29 -0.02 0.00 -1.54 0.00 0.00 39.78 38.18 1lee n ASN 317 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1lee n HIS 318 N 1.49 -1.58 -3.94 3.10 8.25 -0.59 -4.86 115.22 117.09 1lee n HIS 318 Ca 0.20 0.60 -0.10 0.00 -0.26 0.00 0.00 57.72 58.16 1lee n HIS 318 Cb 0.60 -3.39 -0.07 0.00 1.12 0.00 0.00 29.99 28.25 1lee n HIS 318 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1lee s SER 319 N -4.15 0.01 -0.07 0.41 1.04 -1.13 0.05 113.70 109.86 1lee s SER 319 Ca 0.13 -0.83 0.05 0.00 0.48 0.00 0.00 55.95 55.78 1lee s SER 319 Cb -0.06 0.45 -0.00 0.00 0.10 0.00 0.00 66.02 66.51 1lee s SER 319 CO 0.92 -0.91 -0.23 -0.69 0.98 0.00 0.00 173.24 173.31 1lee s VAL 320 N -3.96 1.94 0.02 5.02 1.01 0.99 -2.14 120.40 123.29 1lee s VAL 320 Ca 0.16 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1lee s VAL 320 Cb 0.03 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1lee s VAL 320 CO -0.00 0.54 0.05 -0.83 0.00 0.00 0.00 175.10 174.85 1lee s GLY 321 N 0.11 1.97 -0.02 4.51 0.00 0.11 -0.19 107.32 113.81 1lee s GLY 321 Ca -0.11 -0.95 0.00 0.00 0.00 0.00 0.00 44.72 43.67 1lee s GLY 321 CO 0.06 -0.85 0.00 -0.42 0.00 0.00 0.00 173.10 171.89 1lee s ILE 322 N -1.22 0.13 0.08 0.90 1.01 0.18 0.05 121.20 122.33 1lee s ILE 322 Ca 0.24 0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.85 1lee s ILE 322 Cb -0.12 -0.20 0.01 0.00 0.01 0.00 0.00 42.46 42.15 1lee s ILE 322 CO 0.15 0.11 0.23 0.00 0.00 0.00 0.00 174.94 175.43 1lee s ALA 323 N 0.75 -0.38 -0.02 9.38 0.00 -0.63 -1.52 121.76 129.33 1lee s ALA 323 Ca -0.07 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.16 1lee s ALA 323 Cb -0.10 0.47 -0.06 0.00 0.00 0.00 0.00 23.12 23.42 1lee s ALA 323 CO -0.02 -0.50 1.66 -1.17 0.00 0.00 0.00 175.76 175.74 1lee s LEU 324 N -2.67 4.34 0.29 0.00 1.98 -1.23 0.02 118.68 121.41 1lee s LEU 324 Ca 0.02 2.30 -0.29 0.00 -2.89 0.00 0.00 54.13 53.27 1lee s LEU 324 Cb 0.03 -3.54 -0.10 0.00 0.66 0.00 0.00 46.19 43.24 1lee s LEU 324 CO -0.09 -0.92 1.22 0.00 -1.89 0.00 0.00 176.35 174.67 1lee s ALA 325 N 3.74 3.46 0.12 5.97 0.00 -0.65 -0.69 121.76 133.72 1lee s ALA 325 Ca 0.74 1.09 -0.31 0.00 0.00 0.00 0.00 51.96 53.48 1lee s ALA 325 Cb -0.35 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.27 1lee s ALA 325 CO 0.31 -0.43 1.53 0.15 0.00 0.00 0.00 175.76 177.31 1lee s LYS 326 N -1.44 4.24 0.40 0.00 1.02 0.57 -4.73 119.74 119.79 1lee s LYS 326 Ca 0.48 2.25 0.15 0.00 0.02 0.00 0.00 55.97 58.87 1lee s LYS 326 Cb -0.36 -3.32 1.01 0.00 -0.52 0.00 0.00 37.83 34.64 1lee s LYS 326 CO 0.46 -0.59 1.85 0.87 -0.92 0.00 0.00 175.35 177.02 1lee h LYS 327 N 7.24 0.47 -2.89 1.68 6.56 -1.92 -3.44 116.57 124.28 1lee h LYS 327 Ca -0.42 -0.03 -0.09 0.00 -1.06 0.00 0.00 60.65 59.05 1lee h LYS 327 Cb 1.20 -0.11 -0.18 0.00 -0.57 0.00 0.00 32.23 32.58 1lee h LYS 327 CO 0.90 0.31 -0.12 1.21 -2.06 0.00 0.00 179.45 179.70 1lee s ASN 328 N -5.62 -0.30 0.00 0.86 3.84 -1.26 -4.81 114.94 107.64 1lee s ASN 328 Ca -0.09 0.12 0.27 0.00 0.21 0.00 0.00 52.86 53.37 1lee s ASN 328 Cb 0.23 0.40 0.78 0.00 -0.55 0.00 0.00 41.25 42.11 1lee s ASN 328 CO 0.79 -0.58 1.59 0.18 -2.79 0.00 0.00 177.10 176.28