#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d91 s THR 2 N 0.00 0.24 -0.38 -5.08 -1.32 -1.26 -5.02 115.64 102.81 3d91 s THR 2 Ca 0.00 -0.10 -0.01 0.00 -1.21 0.00 0.00 61.69 60.37 3d91 s THR 2 Cb 0.00 -0.22 0.28 0.00 -1.51 0.00 0.00 72.50 71.05 3d91 s THR 2 CO 0.00 0.08 1.97 0.18 -2.21 0.00 0.00 174.62 174.64 3d91 n LEU 3 N 3.16 6.57 0.00 9.08 7.99 -1.26 -4.89 117.00 137.65 3d91 n LEU 3 Ca -0.15 -3.43 0.00 0.00 -0.01 0.00 0.00 56.01 52.42 3d91 n LEU 3 Cb 0.58 -1.00 0.00 0.00 -0.11 0.00 0.00 43.42 42.89 3d91 n LEU 3 CO 0.25 1.23 0.00 0.61 -1.51 0.00 0.00 177.39 177.97 3d91 n GLY 4 N -0.00 1.54 0.49 -0.72 0.00 -1.26 -4.87 105.19 100.37 3d91 n GLY 4 Ca 0.37 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.46 3d91 n GLY 4 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3d91 n ASN 5 N 0.00 2.53 -4.85 1.61 5.15 -1.26 -4.46 115.26 113.98 3d91 n ASN 5 Ca 0.00 -3.34 -0.38 0.00 -0.60 0.00 0.00 54.58 50.26 3d91 n ASN 5 Cb 0.00 -0.50 -0.06 0.00 -0.53 0.00 0.00 39.78 38.69 3d91 n ASN 5 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3d91 s THR 6 N -3.00 5.18 0.26 -0.44 2.01 -1.26 -4.88 115.64 113.52 3d91 s THR 6 Ca 0.37 0.64 0.04 0.00 0.31 0.00 0.00 61.69 63.05 3d91 s THR 6 Cb 0.33 -3.61 -0.06 0.00 0.01 0.00 0.00 72.50 69.17 3d91 s THR 6 CO 0.02 0.59 0.01 0.42 -0.69 0.00 0.00 174.62 174.97 3d91 s THR 7 N -1.02 1.12 0.01 -0.82 -4.23 -1.26 -0.57 115.64 108.86 3d91 s THR 7 Ca 0.21 -2.03 0.04 0.00 -1.18 0.00 0.00 61.69 58.73 3d91 s THR 7 Cb -0.15 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.17 3d91 s THR 7 CO 0.10 -0.21 -0.14 -0.55 -0.54 0.00 0.00 174.62 173.28 3d91 s SER 8 N -3.37 1.64 -0.01 3.99 0.15 -0.30 -4.99 113.70 110.80 3d91 s SER 8 Ca 0.31 -0.33 0.06 0.00 0.70 0.00 0.00 55.95 56.70 3d91 s SER 8 Cb 0.06 -0.15 -0.02 0.00 -1.71 0.00 0.00 66.02 64.21 3d91 s SER 8 CO 0.11 0.12 -0.21 -0.94 1.20 0.00 0.00 173.24 173.52 3d91 s SER 9 N -0.64 2.41 -0.21 5.45 1.04 -1.26 0.10 113.70 120.59 3d91 s SER 9 Ca 0.04 -0.38 0.02 0.00 0.48 0.00 0.00 55.95 56.10 3d91 s SER 9 Cb -0.06 -0.26 0.04 0.00 0.10 0.00 0.00 66.02 65.83 3d91 s SER 9 CO 0.00 0.24 -0.16 -0.69 0.98 0.00 0.00 173.24 173.62 3d91 s VAL 10 N -0.51 2.06 0.10 5.02 1.01 0.18 -4.49 120.40 123.76 3d91 s VAL 10 Ca 0.08 -1.21 -0.31 0.00 0.00 0.00 0.00 61.98 60.54 3d91 s VAL 10 Cb -0.08 -2.00 -0.07 0.00 0.00 0.00 0.00 36.38 34.23 3d91 s VAL 10 CO -0.01 0.28 1.32 -0.63 0.00 0.00 0.00 175.10 176.07 3d91 s ILE 11 N 1.23 3.56 0.20 2.22 -1.09 -1.26 -1.11 121.20 124.94 3d91 s ILE 11 Ca -0.01 1.12 0.05 0.00 -2.23 0.00 0.00 60.65 59.58 3d91 s ILE 11 Cb -0.16 -3.72 -0.04 0.00 -1.58 0.00 0.00 42.46 36.97 3d91 s ILE 11 CO -0.09 0.09 0.19 -0.76 -1.23 0.00 0.00 174.94 173.14 3d91 s LEU 12 N 1.06 3.91 -0.16 2.97 1.43 0.85 -4.34 118.68 124.40 3d91 s LEU 12 Ca 0.62 -0.12 -0.06 0.00 -1.03 0.00 0.00 54.13 53.54 3d91 s LEU 12 Cb -0.34 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.36 3d91 s LEU 12 CO 0.30 0.02 0.02 -0.89 0.23 0.00 0.00 176.35 176.03 3d91 s THR 13 N -1.90 4.39 -0.55 5.49 2.01 0.15 -1.85 115.64 123.38 3d91 s THR 13 Ca 0.32 -0.18 -0.19 0.00 0.31 0.00 0.00 61.69 61.96 3d91 s THR 13 Cb -0.09 -2.95 0.09 0.00 0.01 0.00 0.00 72.50 69.56 3d91 s THR 13 CO 0.25 0.49 0.65 0.21 -0.69 0.00 0.00 174.62 175.52 3d91 s ASN 14 N 0.27 6.19 -0.58 3.53 3.84 -1.26 -1.46 114.94 125.47 3d91 s ASN 14 Ca 0.01 -1.28 -0.24 0.00 0.21 0.00 0.00 52.86 51.56 3d91 s ASN 14 Cb -0.13 -2.28 0.05 0.00 -0.55 0.00 0.00 41.25 38.33 3d91 s ASN 14 CO 0.01 -1.00 0.95 -0.47 -2.79 0.00 0.00 177.10 173.81 3d91 s TYR 15 N 2.53 2.75 -1.78 0.43 5.04 0.67 -4.57 117.35 122.43 3d91 s TYR 15 Ca 0.12 -0.17 -0.21 0.00 -2.44 0.00 0.00 57.07 54.37 3d91 s TYR 15 Cb -0.23 -4.13 0.20 0.00 0.35 0.00 0.00 41.96 38.15 3d91 s TYR 15 CO 0.08 -1.45 0.68 -1.33 -1.34 0.00 0.00 175.55 172.19 3d91 n MET 16 N 7.56 -1.85 -1.22 4.97 2.81 -1.26 -1.99 117.12 126.14 3d91 n MET 16 Ca 0.00 0.24 -0.08 0.00 -1.81 0.00 0.00 57.70 56.06 3d91 n MET 16 Cb 0.47 -4.89 -0.03 0.00 -0.71 0.00 0.00 33.22 28.05 3d91 n MET 16 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3d91 n ASP 17 N -2.53 -4.62 0.00 7.83 9.92 -1.26 -4.69 116.55 121.20 3d91 n ASP 17 Ca 0.10 0.19 0.00 0.00 -0.53 0.00 0.00 54.79 54.55 3d91 n ASP 17 Cb 0.47 -2.80 0.00 0.00 -0.64 0.00 0.00 41.12 38.15 3d91 n ASP 17 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 3d91 n THR 18 N -2.54 0.00 -4.61 -3.53 -2.24 -0.84 -4.91 114.28 95.61 3d91 n THR 18 Ca -0.08 -0.05 -0.23 0.00 -2.27 0.00 0.00 64.05 61.42 3d91 n THR 18 Cb 0.37 0.40 -0.16 0.00 -2.10 0.00 0.00 70.33 68.84 3d91 n THR 18 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3d91 s GLN 19 N -0.59 1.39 -0.13 -0.78 -0.21 -0.94 -4.61 119.66 113.79 3d91 s GLN 19 Ca 0.00 -0.45 -0.03 0.00 0.02 0.00 0.00 55.36 54.90 3d91 s GLN 19 Cb 0.00 -1.24 0.05 0.00 1.00 0.00 0.00 33.01 32.82 3d91 s GLN 19 CO 0.00 0.16 0.05 0.71 -2.12 0.00 0.00 175.29 174.10 3d91 s TYR 20 N 0.17 0.46 0.04 0.91 2.02 -1.25 -0.23 117.35 119.47 3d91 s TYR 20 Ca -0.04 -0.30 -0.00 0.00 -0.37 0.00 0.00 57.07 56.35 3d91 s TYR 20 Cb -0.11 -0.75 -0.03 0.00 -0.40 0.00 0.00 41.96 40.67 3d91 s TYR 20 CO 0.01 -0.44 -0.04 1.52 -1.57 0.00 0.00 175.55 175.04 3d91 s TYR 21 N 2.05 0.48 0.32 2.71 1.13 -0.54 -4.42 117.35 119.08 3d91 s TYR 21 Ca 0.02 -0.85 0.04 0.00 -1.41 0.00 0.00 57.07 54.88 3d91 s TYR 21 Cb -0.15 -0.34 -0.02 0.00 -1.10 0.00 0.00 41.96 40.36 3d91 s TYR 21 CO -0.07 -0.28 0.15 0.41 -2.51 0.00 0.00 175.55 173.25 3d91 n GLY 22 N 0.65 3.31 3.44 5.49 0.00 -0.01 0.30 105.19 118.38 3d91 n GLY 22 Ca -0.18 -2.02 -0.29 0.00 0.00 0.00 0.00 46.02 43.54 3d91 n GLY 22 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3d91 s GLU 23 N -3.23 1.61 0.37 1.61 -1.05 -1.26 0.12 118.70 116.86 3d91 s GLU 23 Ca 0.21 -1.28 0.08 0.00 -0.15 0.00 0.00 54.97 53.83 3d91 s GLU 23 Cb 0.01 -2.00 -0.07 0.00 -0.44 0.00 0.00 34.13 31.63 3d91 s GLU 23 CO 0.15 0.46 -0.03 0.96 0.95 0.00 0.00 175.26 177.75 3d91 s ILE 24 N -1.17 2.02 0.23 1.83 -4.36 -0.91 -4.81 121.20 114.03 3d91 s ILE 24 Ca 0.17 -2.09 0.06 0.00 -0.26 0.00 0.00 60.65 58.53 3d91 s ILE 24 Cb -0.10 -2.81 -0.04 0.00 1.25 0.00 0.00 42.46 40.77 3d91 s ILE 24 CO 0.09 -0.10 0.22 -0.83 0.24 0.00 0.00 174.94 174.55 3d91 s GLY 25 N -3.64 1.45 -0.14 6.27 0.00 -1.08 -2.27 107.32 107.90 3d91 s GLY 25 Ca 0.34 -1.33 -0.04 0.00 0.00 0.00 0.00 44.72 43.68 3d91 s GLY 25 CO 0.17 -1.36 0.24 -0.42 0.00 0.00 0.00 173.10 171.73 3d91 s ILE 26 N -2.02 -0.38 0.00 0.90 1.01 -0.91 -2.67 121.20 117.13 3d91 s ILE 26 Ca 0.33 0.20 0.00 0.00 0.00 0.00 0.00 60.65 61.18 3d91 s ILE 26 Cb -0.09 -0.48 0.00 0.00 0.01 0.00 0.00 42.46 41.90 3d91 s ILE 26 CO 0.26 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.85 3d91 n GLY 27 N 5.34 -0.78 3.12 6.18 0.00 -0.85 -1.51 105.19 116.69 3d91 n GLY 27 Ca -0.06 -1.70 -0.33 0.00 0.00 0.00 0.00 46.02 43.93 3d91 n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d91 s THR 28 N -1.38 2.13 0.94 2.61 2.01 -1.26 -1.09 115.64 119.59 3d91 s THR 28 Ca 0.00 -1.04 -0.15 0.00 0.31 0.00 0.00 61.69 60.82 3d91 s THR 28 Cb 0.00 -1.96 0.17 0.00 0.01 0.00 0.00 72.50 70.72 3d91 s THR 28 CO 0.00 0.44 1.23 -2.16 -0.69 0.00 0.00 174.62 173.44 3d91 s PRO 29 N 1.27 0.88 0.11 4.92 0.04 -1.25 -1.60 135.00 139.36 3d91 s PRO 29 Ca 0.03 -0.11 -0.31 0.00 0.04 0.00 0.00 61.00 60.65 3d91 s PRO 29 Cb -0.14 -1.85 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 3d91 s PRO 29 CO -0.11 -2.30 1.52 -2.14 0.04 0.00 0.00 177.00 174.01 3d91 s PRO 30 N -5.64 4.25 -0.27 0.56 0.02 -0.25 -4.87 135.00 128.79 3d91 s PRO 30 Ca 0.69 2.23 -0.07 0.00 0.02 0.00 0.00 61.00 63.86 3d91 s PRO 30 Cb -0.08 -3.34 -0.02 0.00 0.02 0.00 0.00 34.50 31.08 3d91 s PRO 30 CO 0.52 -0.59 0.08 -0.65 -0.33 0.00 0.00 177.00 176.03 3d91 s GLN 31 N 1.66 3.47 0.14 5.54 -0.21 -0.57 -4.80 119.66 124.89 3d91 s GLN 31 Ca 0.69 -0.60 -0.17 0.00 0.02 0.00 0.00 55.36 55.29 3d91 s GLN 31 Cb -0.39 -3.35 -0.07 0.00 1.00 0.00 0.00 33.01 30.20 3d91 s GLN 31 CO 0.31 -0.28 0.60 0.95 -2.12 0.00 0.00 175.29 174.75 3d91 s THR 32 N 1.58 4.75 -0.04 -0.19 -4.23 -1.26 -2.14 115.64 114.12 3d91 s THR 32 Ca 0.05 1.05 -0.04 0.00 -1.18 0.00 0.00 61.69 61.57 3d91 s THR 32 Cb -0.16 -3.81 0.01 0.00 1.34 0.00 0.00 72.50 69.88 3d91 s THR 32 CO 0.03 0.33 0.11 -0.36 -0.54 0.00 0.00 174.62 174.19 3d91 s PHE 33 N -1.38 -0.12 0.24 3.99 0.08 -0.96 -4.98 117.98 114.84 3d91 s PHE 33 Ca 0.36 0.29 -0.30 0.00 0.12 0.00 0.00 56.93 57.41 3d91 s PHE 33 Cb -0.17 0.04 -0.09 0.00 -0.57 0.00 0.00 43.02 42.23 3d91 s PHE 33 CO 0.20 -0.06 0.95 0.15 -0.10 0.00 0.00 175.22 176.35 3d91 s LYS 34 N 0.03 4.84 -0.09 0.44 1.02 -1.26 -2.13 119.74 122.60 3d91 s LYS 34 Ca -0.00 1.50 -0.06 0.00 0.02 0.00 0.00 55.97 57.43 3d91 s LYS 34 Cb -0.01 -3.28 0.04 0.00 -0.52 0.00 0.00 37.83 34.06 3d91 s LYS 34 CO 0.00 0.50 0.22 0.14 -0.92 0.00 0.00 175.35 175.29 3d91 s VAL 35 N -1.13 -0.03 0.19 3.17 -7.23 0.32 -0.59 120.40 115.10 3d91 s VAL 35 Ca 0.41 0.10 -0.30 0.00 -1.81 0.00 0.00 61.98 60.39 3d91 s VAL 35 Cb -0.26 -0.34 -0.08 0.00 0.56 0.00 0.00 36.38 36.27 3d91 s VAL 35 CO 0.32 0.04 1.00 -0.69 -0.31 0.00 0.00 175.10 175.46 3d91 s VAL 36 N 0.85 4.12 -0.41 1.32 1.01 -0.93 -0.83 120.40 125.53 3d91 s VAL 36 Ca -0.06 1.92 -0.15 0.00 0.00 0.00 0.00 61.98 63.69 3d91 s VAL 36 Cb -0.07 -4.23 0.02 0.00 0.00 0.00 0.00 36.38 32.10 3d91 s VAL 36 CO -0.05 0.38 0.30 -0.36 0.00 0.00 0.00 175.10 175.36 3d91 s PHE 37 N -0.57 3.24 -0.24 5.22 0.40 -1.26 -0.94 117.98 123.84 3d91 s PHE 37 Ca 0.45 -0.58 -0.04 0.00 -0.60 0.00 0.00 56.93 56.16 3d91 s PHE 37 Cb -0.26 -2.59 -0.00 0.00 0.51 0.00 0.00 43.02 40.67 3d91 s PHE 37 CO 0.33 -0.59 -0.02 0.34 0.70 0.00 0.00 175.22 175.98 3d91 s ASP 38 N 1.68 4.47 0.06 1.36 2.15 -0.20 -4.19 116.67 122.01 3d91 s ASP 38 Ca 0.05 -0.47 0.20 0.00 0.43 0.00 0.00 52.55 52.75 3d91 s ASP 38 Cb -0.19 -1.76 0.81 0.00 -0.30 0.00 0.00 42.92 41.48 3d91 s ASP 38 CO 0.10 -0.06 1.62 0.35 -0.17 0.00 0.00 175.17 177.01 3d91 n THR 39 N 4.80 0.76 0.20 1.71 -2.24 -1.26 0.12 114.28 118.37 3d91 n THR 39 Ca -0.17 0.17 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 3d91 n THR 39 Cb 0.50 -0.92 0.34 0.00 -2.10 0.00 0.00 70.33 68.15 3d91 n THR 39 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3d91 h GLY 40 N 3.03 0.00 -0.68 3.38 0.00 -1.92 -3.37 103.07 103.50 3d91 h GLY 40 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 47.33 46.92 3d91 h GLY 40 CO 0.00 0.00 -0.34 -1.14 0.00 0.00 0.00 176.54 175.06 3d91 n SER 41 N -3.33 1.30 0.00 0.19 3.41 -1.22 -4.94 113.62 109.04 3d91 n SER 41 Ca 0.01 -2.57 0.00 0.00 -0.26 0.00 0.00 58.87 56.05 3d91 n SER 41 Cb 0.51 0.71 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 3d91 n SER 41 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3d91 n SER 42 N -1.63 0.22 -4.82 4.04 7.64 -1.26 0.10 113.62 117.91 3d91 n SER 42 Ca -0.05 -1.02 -0.32 0.00 1.01 0.00 0.00 58.87 58.48 3d91 n SER 42 Cb 0.44 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.58 3d91 n SER 42 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3d91 s ASN 43 N -0.02 5.84 0.21 6.43 -0.87 -1.26 -4.34 114.94 120.92 3d91 s ASN 43 Ca 0.00 0.15 -0.04 0.00 -1.57 0.00 0.00 52.86 51.40 3d91 s ASN 43 Cb 0.00 -1.69 -0.05 0.00 -0.02 0.00 0.00 41.25 39.48 3d91 s ASN 43 CO 0.00 0.23 0.45 -0.69 -2.57 0.00 0.00 177.10 174.52 3d91 s VAL 44 N -1.31 5.11 -0.18 1.60 1.01 -1.26 -1.39 120.40 123.99 3d91 s VAL 44 Ca 0.27 -0.02 -0.27 0.00 0.00 0.00 0.00 61.98 61.96 3d91 s VAL 44 Cb -0.12 -3.68 0.08 0.00 0.00 0.00 0.00 36.38 32.65 3d91 s VAL 44 CO 0.19 -0.12 0.74 -1.66 0.00 0.00 0.00 175.10 174.25 3d91 s TRP 45 N -1.84 -0.70 0.28 5.22 1.48 -0.75 -2.35 118.94 120.28 3d91 s TRP 45 Ca 0.42 1.51 0.05 0.00 -1.06 0.00 0.00 56.10 57.01 3d91 s TRP 45 Cb -0.11 0.34 -0.06 0.00 -1.16 0.00 0.00 33.47 32.48 3d91 s TRP 45 CO 0.27 -0.45 -0.01 0.14 -4.06 0.00 0.00 176.95 172.83 3d91 s VAL 46 N -0.29 1.38 0.34 -0.66 -7.23 -0.84 -2.27 120.40 110.83 3d91 s VAL 46 Ca -0.04 -2.07 -0.28 0.00 -1.81 0.00 0.00 61.98 57.78 3d91 s VAL 46 Cb -0.03 -2.52 -0.10 0.00 0.56 0.00 0.00 36.38 34.29 3d91 s VAL 46 CO 0.04 -0.23 1.34 -2.84 -0.31 0.00 0.00 175.10 173.10 3d91 s PRO 47 N -3.80 4.29 0.22 4.82 0.02 -1.26 -0.10 135.00 139.18 3d91 s PRO 47 Ca 0.31 2.28 -0.29 0.00 0.02 0.00 0.00 61.00 63.32 3d91 s PRO 47 Cb 0.06 -3.03 -0.09 0.00 0.02 0.00 0.00 34.50 31.46 3d91 s PRO 47 CO 0.12 -0.27 0.90 0.45 -0.33 0.00 0.00 177.00 177.87 3d91 s SER 48 N -0.44 7.58 0.57 2.53 0.15 0.13 -0.92 113.70 123.31 3d91 s SER 48 Ca 0.50 1.87 0.33 0.00 0.70 0.00 0.00 55.95 59.35 3d91 s SER 48 Cb -0.41 -2.58 1.70 0.00 -1.71 0.00 0.00 66.02 63.02 3d91 s SER 48 CO 0.55 0.17 2.14 0.77 1.20 0.00 0.00 173.24 178.07 3d91 h SER 49 N 4.20 0.00 0.00 5.45 4.64 -1.54 0.90 113.55 127.21 3d91 h SER 49 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3d91 h SER 49 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3d91 h SER 49 CO 0.68 0.06 0.00 0.29 -0.87 0.00 0.00 176.83 176.99 3d91 n LYS 50 N -3.41 0.95 -2.73 4.77 4.01 -1.26 -4.81 118.16 115.68 3d91 n LYS 50 Ca -0.02 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.36 3d91 n LYS 50 Cb 0.20 -1.24 -0.03 0.00 -0.51 0.00 0.00 35.03 33.45 3d91 n LYS 50 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3d91 n SER 52 N 5.66 -1.03 0.28 0.00 2.88 -1.26 -4.89 113.62 115.26 3d91 n SER 52 Ca 0.09 1.01 0.19 0.00 -1.33 0.00 0.00 58.87 58.82 3d91 n SER 52 Cb 0.48 -1.04 0.86 0.00 -0.75 0.00 0.00 64.21 63.76 3d91 n SER 52 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 3d91 h ARG 53 N 0.97 0.00 0.00 -1.46 0.11 -1.96 -3.06 114.38 108.98 3d91 h ARG 53 Ca -0.35 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.73 3d91 h ARG 53 Cb 1.41 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.49 3d91 h ARG 53 CO 0.54 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.89 3d91 n LEU 54 N -2.98 0.61 -4.66 0.08 4.77 -1.26 -4.54 117.00 109.02 3d91 n LEU 54 Ca -0.01 0.62 -0.39 0.00 -0.03 0.00 0.00 56.01 56.20 3d91 n LEU 54 Cb 0.20 -0.50 -0.07 0.00 -2.33 0.00 0.00 43.42 40.72 3d91 n LEU 54 CO 0.23 -0.41 0.23 -0.31 -1.33 0.00 0.00 177.39 175.80 3d91 s TYR 55 N -3.22 3.37 -0.46 -1.77 2.02 -1.16 -4.98 117.35 111.15 3d91 s TYR 55 Ca 0.07 0.76 0.23 0.00 -0.37 0.00 0.00 57.07 57.75 3d91 s TYR 55 Cb 0.10 -2.66 0.36 0.00 -0.40 0.00 0.00 41.96 39.36 3d91 s TYR 55 CO 0.44 -0.10 1.56 1.79 -1.57 0.00 0.00 175.55 177.67 3d91 h THR 56 N 5.12 0.00 -0.17 -0.71 1.35 -1.85 -3.21 112.91 113.44 3d91 h THR 56 Ca -0.34 -0.93 -0.18 0.00 -0.55 0.00 0.00 66.41 64.42 3d91 h THR 56 Cb 1.15 1.87 -0.00 0.00 -1.73 0.00 0.00 68.15 69.44 3d91 h THR 56 CO 0.74 0.00 -0.62 0.00 -0.25 0.00 0.00 175.52 175.38 3d91 h ALA 57 N 2.07 0.58 0.00 6.62 0.00 -1.85 -3.13 119.26 123.56 3d91 h ALA 57 Ca 0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 3d91 h ALA 57 Cb 0.96 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 3d91 h ALA 57 CO 0.00 0.70 -0.13 0.00 0.00 0.00 0.00 179.25 179.83 3d91 h VAL 59 N 0.00 1.28 -0.44 0.00 2.07 -1.58 -3.31 116.25 114.28 3d91 h VAL 59 Ca -0.00 -1.57 -0.07 0.00 0.82 0.00 0.00 66.70 65.88 3d91 h VAL 59 Cb 0.55 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.72 3d91 h VAL 59 CO 0.02 0.52 0.05 -1.22 0.02 0.00 0.00 177.57 176.95 3d91 n TYR 60 N -4.04 1.53 -4.29 1.57 4.02 -1.17 -4.94 117.16 109.83 3d91 n TYR 60 Ca -0.02 -0.99 -0.17 0.00 -0.01 0.00 0.00 57.90 56.71 3d91 n TYR 60 Cb 0.54 -0.46 -0.10 0.00 -0.02 0.00 0.00 39.34 39.30 3d91 n TYR 60 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 3d91 s HIS 61 N -2.90 1.50 0.45 -0.72 3.76 -1.19 -5.09 115.29 111.09 3d91 s HIS 61 Ca 0.48 -0.62 -0.24 0.00 -0.15 0.00 0.00 55.06 54.53 3d91 s HIS 61 Cb 0.39 -0.74 -0.07 0.00 1.11 0.00 0.00 32.58 33.27 3d91 s HIS 61 CO 0.10 0.22 1.24 0.21 -0.85 0.00 0.00 174.74 175.66 3d91 s LYS 62 N -3.39 3.73 -0.05 1.40 2.36 -1.26 -4.95 119.74 117.58 3d91 s LYS 62 Ca 0.17 1.98 0.04 0.00 -2.55 0.00 0.00 55.97 55.61 3d91 s LYS 62 Cb -0.01 -2.51 -0.00 0.00 -1.05 0.00 0.00 37.83 34.26 3d91 s LYS 62 CO 0.04 -0.64 -0.16 -0.51 1.55 0.00 0.00 175.35 175.63 3d91 s LEU 63 N -2.89 1.89 -0.28 5.43 1.43 -1.26 -4.39 118.68 118.61 3d91 s LEU 63 Ca 0.62 -0.35 -0.19 0.00 -1.03 0.00 0.00 54.13 53.19 3d91 s LEU 63 Cb -0.34 -0.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 3d91 s LEU 63 CO 0.42 0.14 0.58 0.12 0.23 0.00 0.00 176.35 177.83 3d91 s PHE 64 N 0.12 3.25 -0.44 0.29 5.36 -0.10 -4.75 117.98 121.70 3d91 s PHE 64 Ca -0.05 0.64 -0.09 0.00 -0.96 0.00 0.00 56.93 56.47 3d91 s PHE 64 Cb -0.12 -2.84 0.10 0.00 -0.34 0.00 0.00 43.02 39.82 3d91 s PHE 64 CO 0.02 -0.37 0.29 0.34 -1.46 0.00 0.00 175.22 174.05 3d91 s ASP 65 N 1.57 5.64 0.66 6.13 -1.08 -1.26 -1.42 116.67 126.90 3d91 s ASP 65 Ca 0.23 -1.71 0.22 0.00 -0.52 0.00 0.00 52.55 50.78 3d91 s ASP 65 Cb -0.15 -1.99 1.20 0.00 -1.46 0.00 0.00 42.92 40.51 3d91 s ASP 65 CO 0.10 -0.61 1.67 0.00 0.52 0.00 0.00 175.17 176.86 3d91 h ALA 66 N 8.41 1.63 0.00 3.66 0.00 -1.95 -2.08 119.26 128.92 3d91 h ALA 66 Ca -0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3d91 h ALA 66 Cb 1.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3d91 h ALA 66 CO 0.80 -0.58 -0.67 -1.13 0.00 0.00 0.00 179.25 177.67 3d91 n SER 67 N -2.88 0.64 -0.83 0.00 3.41 -1.26 -3.19 113.62 109.52 3d91 n SER 67 Ca 0.00 -0.43 0.09 0.00 -0.26 0.00 0.00 58.87 58.27 3d91 n SER 67 Cb 0.59 0.48 0.26 0.00 -0.26 0.00 0.00 64.21 65.29 3d91 n SER 67 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3d91 n ASP 68 N -1.55 2.43 -4.11 4.04 9.92 -0.78 -4.79 116.55 121.71 3d91 n ASP 68 Ca 0.05 -1.91 -0.35 0.00 -0.53 0.00 0.00 54.79 52.04 3d91 n ASP 68 Cb 0.34 -0.25 -0.12 0.00 -0.64 0.00 0.00 41.12 40.45 3d91 n ASP 68 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 3d91 s SER 69 N -1.24 5.13 0.13 -2.24 0.15 -1.19 -3.80 113.70 110.63 3d91 s SER 69 Ca 0.33 -1.95 0.22 0.00 0.70 0.00 0.00 55.95 55.25 3d91 s SER 69 Cb 0.18 -1.78 0.88 0.00 -1.71 0.00 0.00 66.02 63.58 3d91 s SER 69 CO 0.25 -0.48 1.68 -1.54 1.20 0.00 0.00 173.24 174.34 3d91 n SER 70 N 4.54 0.39 0.06 5.45 3.41 -0.63 -2.92 113.62 123.92 3d91 n SER 70 Ca -0.03 0.58 0.11 0.00 -0.26 0.00 0.00 58.87 59.27 3d91 n SER 70 Cb 0.42 -0.67 -0.06 0.00 -0.26 0.00 0.00 64.21 63.64 3d91 n SER 70 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3d91 n SER 71 N -1.91 0.52 -4.58 4.04 3.41 -1.26 -4.99 113.62 108.85 3d91 n SER 71 Ca 0.04 0.17 -0.41 0.00 -0.26 0.00 0.00 58.87 58.41 3d91 n SER 71 Cb 0.26 1.05 0.02 0.00 -0.26 0.00 0.00 64.21 65.27 3d91 n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d91 n TYR 72 N -2.48 0.83 -4.06 7.33 4.19 -1.15 -4.77 117.16 117.05 3d91 n TYR 72 Ca -0.01 0.55 -0.18 0.00 3.31 0.00 0.00 57.90 61.57 3d91 n TYR 72 Cb 0.55 -2.18 -0.16 0.00 0.49 0.00 0.00 39.34 38.05 3d91 n TYR 72 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 3d91 s LYS 73 N -2.02 0.51 0.55 2.98 1.02 -0.07 -5.01 119.74 117.71 3d91 s LYS 73 Ca 0.65 -0.04 -0.19 0.00 0.02 0.00 0.00 55.97 56.40 3d91 s LYS 73 Cb -0.55 -0.58 -0.05 0.00 -0.52 0.00 0.00 37.83 36.13 3d91 s LYS 73 CO 0.56 -0.06 1.13 -1.58 -0.92 0.00 0.00 175.35 174.47 3d91 s HIS 74 N 0.72 2.67 0.00 3.18 5.65 -1.26 -1.88 115.29 124.38 3d91 s HIS 74 Ca -0.08 1.54 0.00 0.00 0.25 0.00 0.00 55.06 56.77 3d91 s HIS 74 Cb -0.11 -3.28 0.00 0.00 -1.18 0.00 0.00 32.58 28.01 3d91 s HIS 74 CO -0.01 -1.58 0.00 -1.71 -0.65 0.00 0.00 174.74 170.80 3d91 n ASN 75 N -1.40 0.00 0.00 9.88 2.85 -1.22 -4.81 115.26 120.57 3d91 n ASN 75 Ca 0.11 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.58 3d91 n ASN 75 Cb 0.51 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.53 3d91 n ASN 75 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3d91 n GLY 76 N 1.26 0.91 3.71 8.20 0.00 0.32 -4.97 105.19 114.63 3d91 n GLY 76 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3d91 n GLY 76 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3d91 n THR 77 N -1.65 0.06 -3.27 2.61 -1.04 -1.26 -4.50 114.28 105.22 3d91 n THR 77 Ca 0.00 -0.01 -0.38 0.00 -2.04 0.00 0.00 64.05 61.62 3d91 n THR 77 Cb 0.00 -2.00 -0.06 0.00 -1.82 0.00 0.00 70.33 66.45 3d91 n THR 77 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3d91 s GLU 78 N 1.42 4.33 0.11 -2.82 2.02 -1.26 -1.69 118.70 120.80 3d91 s GLU 78 Ca 0.76 0.56 -0.09 0.00 0.02 0.00 0.00 54.97 56.22 3d91 s GLU 78 Cb -0.50 -3.41 -0.00 0.00 0.10 0.00 0.00 34.13 30.32 3d91 s GLU 78 CO 0.33 0.21 0.23 -0.48 0.02 0.00 0.00 175.26 175.57 3d91 s LEU 79 N 0.42 1.24 -0.09 1.80 2.34 -1.03 -5.03 118.68 118.34 3d91 s LEU 79 Ca 0.28 -0.68 -0.03 0.00 0.06 0.00 0.00 54.13 53.76 3d91 s LEU 79 Cb -0.16 1.13 0.05 0.00 -0.56 0.00 0.00 46.19 46.65 3d91 s LEU 79 CO 0.13 -0.78 0.17 -0.89 -1.06 0.00 0.00 176.35 173.92 3d91 s THR 80 N -3.88 -0.26 -0.25 5.48 2.01 -1.26 -2.16 115.64 115.32 3d91 s THR 80 Ca 0.08 0.34 -0.09 0.00 0.31 0.00 0.00 61.69 62.33 3d91 s THR 80 Cb 0.04 -0.30 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 3d91 s THR 80 CO -0.09 0.14 0.12 -0.76 -0.69 0.00 0.00 174.62 173.35 3d91 s LEU 81 N 2.23 3.75 -0.32 4.42 2.01 0.23 -4.95 118.68 126.05 3d91 s LEU 81 Ca 0.02 -0.08 -0.09 0.00 0.01 0.00 0.00 54.13 53.99 3d91 s LEU 81 Cb -0.12 -2.02 0.00 0.00 0.01 0.00 0.00 46.19 44.07 3d91 s LEU 81 CO -0.06 -0.01 0.15 -0.13 1.01 0.00 0.00 176.35 177.31 3d91 s ARG 82 N 1.50 3.17 0.22 1.70 0.52 -1.26 0.69 118.95 125.50 3d91 s ARG 82 Ca 0.06 -0.83 0.06 0.00 -0.52 0.00 0.00 55.73 54.51 3d91 s ARG 82 Cb -0.15 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.72 3d91 s ARG 82 CO 0.06 -0.48 0.22 0.71 0.02 0.00 0.00 175.30 175.83 3d91 s TYR 83 N 1.58 3.20 0.26 -0.53 2.02 -0.47 -4.98 117.35 118.43 3d91 s TYR 83 Ca 0.04 -0.06 -0.09 0.00 -0.37 0.00 0.00 57.07 56.59 3d91 s TYR 83 Cb -0.18 -1.47 0.41 0.00 -0.40 0.00 0.00 41.96 40.32 3d91 s TYR 83 CO 0.06 0.51 1.58 0.77 -1.57 0.00 0.00 175.55 176.89 3d91 h SER 84 N 1.69 -0.80 -3.28 2.29 0.02 -1.98 -3.13 113.55 108.36 3d91 h SER 84 Ca -0.49 0.27 -0.73 0.00 -0.84 0.00 0.00 61.79 60.00 3d91 h SER 84 Cb 1.23 0.54 -0.28 0.00 0.14 0.00 0.00 62.40 64.03 3d91 h SER 84 CO 0.62 -0.29 -0.37 0.42 -1.14 0.00 0.00 176.83 176.07 3d91 s THR 85 N -6.24 4.40 0.00 -2.27 -4.23 -1.26 -4.97 115.64 101.07 3d91 s THR 85 Ca -0.15 -1.68 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 3d91 s THR 85 Cb 0.25 -3.86 0.00 0.00 1.34 0.00 0.00 72.50 70.23 3d91 s THR 85 CO 0.77 -0.76 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 3d91 n GLY 86 N 4.97 -0.57 3.59 3.99 0.00 -1.18 -4.81 105.19 111.18 3d91 n GLY 86 Ca -0.09 -1.18 -0.36 0.00 0.00 0.00 0.00 46.02 44.39 3d91 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d91 s THR 87 N -0.39 4.95 0.07 2.61 2.01 -1.26 -1.36 115.64 122.27 3d91 s THR 87 Ca 0.00 0.04 0.05 0.00 0.31 0.00 0.00 61.69 62.09 3d91 s THR 87 Cb 0.00 -3.30 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 3d91 s THR 87 CO 0.00 0.36 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.55 3d91 s VAL 88 N 1.15 3.74 0.07 3.82 1.01 0.22 -4.79 120.40 125.62 3d91 s VAL 88 Ca 0.06 -1.01 -0.06 0.00 0.00 0.00 0.00 61.98 60.98 3d91 s VAL 88 Cb -0.14 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 3d91 s VAL 88 CO 0.04 0.19 0.10 -0.94 0.00 0.00 0.00 175.10 174.50 3d91 s SER 89 N -2.03 0.27 0.00 3.32 1.04 -1.15 0.75 113.70 115.89 3d91 s SER 89 Ca 0.22 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.85 3d91 s SER 89 Cb -0.11 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.29 3d91 s SER 89 CO 0.14 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.29 3d91 n GLY 90 N 0.00 0.86 3.58 7.32 0.00 -0.92 -1.89 105.19 114.14 3d91 n GLY 90 Ca -0.14 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.03 3d91 n GLY 90 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3d91 s PHE 91 N -1.98 1.92 0.07 1.61 -0.12 -0.28 -2.47 117.98 116.73 3d91 s PHE 91 Ca 0.00 -1.06 0.04 0.00 -0.05 0.00 0.00 56.93 55.86 3d91 s PHE 91 Cb 0.00 -1.37 -0.04 0.00 -0.63 0.00 0.00 43.02 40.98 3d91 s PHE 91 CO 0.00 -0.01 -0.02 -0.51 -0.05 0.00 0.00 175.22 174.63 3d91 s LEU 92 N -3.67 3.39 -0.02 -1.99 1.43 -0.68 -0.05 118.68 117.09 3d91 s LEU 92 Ca 0.23 -0.17 -0.24 0.00 -1.03 0.00 0.00 54.13 52.92 3d91 s LEU 92 Cb 0.04 -2.09 0.05 0.00 0.03 0.00 0.00 46.19 44.23 3d91 s LEU 92 CO 0.12 0.20 0.52 -0.44 0.23 0.00 0.00 176.35 176.98 3d91 s SER 93 N -2.09 -0.45 -0.05 2.29 0.01 -0.69 -0.52 113.70 112.22 3d91 s SER 93 Ca 0.23 0.40 0.06 0.00 1.31 0.00 0.00 55.95 57.95 3d91 s SER 93 Cb -0.12 0.45 -0.02 0.00 0.21 0.00 0.00 66.02 66.54 3d91 s SER 93 CO 0.15 -0.56 -0.21 -1.58 0.41 0.00 0.00 173.24 171.45 3d91 s GLN 94 N -1.42 2.43 0.00 12.44 0.74 -0.79 0.15 119.66 133.22 3d91 s GLN 94 Ca -0.11 -0.83 0.00 0.00 0.05 0.00 0.00 55.36 54.46 3d91 s GLN 94 Cb -0.02 -2.22 0.00 0.00 1.10 0.00 0.00 33.01 31.87 3d91 s GLN 94 CO 0.06 0.51 0.00 -3.47 -0.55 0.00 0.00 175.29 171.84 3d91 n ASP 95 N 2.61 0.00 -4.19 6.67 -0.08 -0.42 -0.89 116.55 120.25 3d91 n ASP 95 Ca -0.17 -0.13 -0.34 0.00 -1.51 0.00 0.00 54.79 52.64 3d91 n ASP 95 Cb 0.52 0.00 -0.15 0.00 2.34 0.00 0.00 41.12 43.83 3d91 n ASP 95 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 3d91 s ILE 96 N -2.97 2.56 -0.20 5.18 1.01 -1.26 0.35 121.20 125.87 3d91 s ILE 96 Ca 0.00 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 59.74 3d91 s ILE 96 Cb 0.00 -2.15 -0.04 0.00 0.01 0.00 0.00 42.46 40.28 3d91 s ILE 96 CO 0.00 0.44 0.05 -0.63 0.00 0.00 0.00 174.94 174.80 3d91 s ILE 97 N 1.35 4.55 0.20 2.92 1.01 -0.30 -2.00 121.20 128.92 3d91 s ILE 97 Ca 0.04 -0.11 -0.12 0.00 0.00 0.00 0.00 60.65 60.46 3d91 s ILE 97 Cb -0.14 -3.06 -0.07 0.00 0.01 0.00 0.00 42.46 39.19 3d91 s ILE 97 CO -0.09 0.43 0.56 0.42 0.00 0.00 0.00 174.94 176.27 3d91 s THR 98 N 0.68 4.88 -0.29 2.92 -4.23 -1.09 -1.63 115.64 116.89 3d91 s THR 98 Ca 0.03 0.66 -0.11 0.00 -1.18 0.00 0.00 61.69 61.08 3d91 s THR 98 Cb -0.13 -3.67 0.12 0.00 1.34 0.00 0.00 72.50 70.15 3d91 s THR 98 CO 0.02 0.06 0.64 -0.69 -0.54 0.00 0.00 174.62 174.11 3d91 s VAL 99 N -1.67 -0.77 0.00 2.29 1.01 -0.56 -2.64 120.40 118.06 3d91 s VAL 99 Ca 0.43 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.43 3d91 s VAL 99 Cb -0.13 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.28 3d91 s VAL 99 CO 0.20 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.91 3d91 n GLY 100 N 5.21 0.93 0.00 4.51 0.00 -1.26 0.11 105.19 114.68 3d91 n GLY 100 Ca -0.14 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.37 3d91 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d91 n GLY 101 N 0.00 0.19 3.72 -0.02 0.00 -1.26 -4.95 105.19 102.87 3d91 n GLY 101 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3d91 n GLY 101 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d91 s ILE 102 N 0.00 4.41 -0.12 -0.61 1.01 0.29 -4.96 121.20 121.21 3d91 s ILE 102 Ca 0.00 1.90 -0.06 0.00 0.00 0.00 0.00 60.65 62.50 3d91 s ILE 102 Cb 0.00 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.22 3d91 s ILE 102 CO 0.00 0.25 0.08 -0.89 0.00 0.00 0.00 174.94 174.37 3d91 s THR 103 N 0.33 4.97 -0.15 2.92 2.01 -1.26 -1.49 115.64 122.98 3d91 s THR 103 Ca 0.50 0.01 -0.04 0.00 0.31 0.00 0.00 61.69 62.47 3d91 s THR 103 Cb -0.25 -3.16 0.07 0.00 0.01 0.00 0.00 72.50 69.17 3d91 s THR 103 CO 0.30 0.58 0.25 0.54 -0.69 0.00 0.00 174.62 175.60 3d91 s VAL 104 N -0.65 -0.39 0.00 3.82 0.11 -0.65 -4.95 120.40 117.69 3d91 s VAL 104 Ca 0.12 0.19 -0.30 0.00 -2.93 0.00 0.00 61.98 59.06 3d91 s VAL 104 Cb -0.12 -0.50 -0.07 0.00 -1.53 0.00 0.00 36.38 34.16 3d91 s VAL 104 CO 0.02 0.04 1.81 -0.89 -3.33 0.00 0.00 175.10 172.75 3d91 s THR 105 N 2.40 3.25 0.01 5.04 2.01 -1.26 -1.15 115.64 125.93 3d91 s THR 105 Ca 0.03 0.35 0.02 0.00 0.31 0.00 0.00 61.69 62.40 3d91 s THR 105 Cb -0.13 -3.23 -0.01 0.00 0.01 0.00 0.00 72.50 69.14 3d91 s THR 105 CO -0.09 -0.03 -0.06 -1.58 -0.69 0.00 0.00 174.62 172.16 3d91 s GLN 106 N 4.11 0.49 0.05 4.92 2.00 0.15 -4.95 119.66 126.43 3d91 s GLN 106 Ca 0.81 -0.35 -0.21 0.00 -2.00 0.00 0.00 55.36 53.61 3d91 s GLN 106 Cb -0.38 -0.43 -0.06 0.00 0.80 0.00 0.00 33.01 32.93 3d91 s GLN 106 CO 0.36 0.11 0.62 -1.64 -0.50 0.00 0.00 175.29 174.23 3d91 s MET 107 N -0.49 4.31 -0.02 1.67 -1.94 -1.26 -1.31 119.30 120.27 3d91 s MET 107 Ca -0.01 0.81 -0.17 0.00 -1.71 0.00 0.00 55.69 54.61 3d91 s MET 107 Cb -0.04 -3.29 0.03 0.00 2.01 0.00 0.00 34.83 33.54 3d91 s MET 107 CO -0.00 0.49 0.37 -0.59 -0.01 0.00 0.00 175.02 175.28 3d91 s PHE 108 N -0.65 -0.25 -0.01 -0.03 -0.71 0.12 -4.63 117.98 111.82 3d91 s PHE 108 Ca 0.31 0.39 -0.30 0.00 -1.04 0.00 0.00 56.93 56.30 3d91 s PHE 108 Cb -0.19 0.14 -0.06 0.00 -1.21 0.00 0.00 43.02 41.70 3d91 s PHE 108 CO 0.19 -0.42 1.55 0.20 -1.34 0.00 0.00 175.22 175.40 3d91 s GLY 109 N -1.31 1.65 -0.33 1.99 0.00 -0.99 -1.70 107.32 106.64 3d91 s GLY 109 Ca -0.13 0.97 -0.28 0.00 0.00 0.00 0.00 44.72 45.28 3d91 s GLY 109 CO 0.05 2.80 1.05 -0.54 0.00 0.00 0.00 173.10 176.46 3d91 s GLU 110 N 3.08 4.04 -0.18 2.90 2.02 0.93 -1.99 118.70 129.50 3d91 s GLU 110 Ca 0.69 1.00 -0.17 0.00 0.02 0.00 0.00 54.97 56.51 3d91 s GLU 110 Cb -0.34 -3.74 -0.04 0.00 0.10 0.00 0.00 34.13 30.11 3d91 s GLU 110 CO 0.29 -0.90 0.45 0.08 0.02 0.00 0.00 175.26 175.19 3d91 s VAL 111 N 3.61 5.17 -0.21 2.63 1.01 0.86 -1.13 120.40 132.35 3d91 s VAL 111 Ca 0.44 0.82 0.11 0.00 0.00 0.00 0.00 61.98 63.36 3d91 s VAL 111 Cb -0.12 -3.78 -0.16 0.00 0.00 0.00 0.00 36.38 32.33 3d91 s VAL 111 CO 0.16 0.25 0.34 0.35 0.00 0.00 0.00 175.10 176.19 3d91 n THR 112 N 4.24 0.00 -3.52 3.92 -2.24 -0.86 0.21 114.28 116.03 3d91 n THR 112 Ca -0.07 -0.25 -0.27 0.00 -2.27 0.00 0.00 64.05 61.19 3d91 n THR 112 Cb 0.51 0.54 -0.14 0.00 -2.10 0.00 0.00 70.33 69.13 3d91 n THR 112 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3d91 s GLU 113 N -2.50 0.20 -0.20 -0.78 -1.05 -0.79 -4.03 118.70 109.54 3d91 s GLU 113 Ca -0.01 -0.44 0.01 0.00 -0.15 0.00 0.00 54.97 54.38 3d91 s GLU 113 Cb 0.08 -1.13 0.04 0.00 -0.44 0.00 0.00 34.13 32.68 3d91 s GLU 113 CO 0.47 -0.99 -0.10 0.00 0.95 0.00 0.00 175.26 175.59 3d91 s MET 114 N 2.14 1.97 0.97 -4.83 0.23 -1.26 -2.94 119.30 115.58 3d91 s MET 114 Ca 0.09 -0.86 -0.13 0.00 -1.03 0.00 0.00 55.69 53.76 3d91 s MET 114 Cb -0.16 -2.43 0.07 0.00 -1.53 0.00 0.00 34.83 30.78 3d91 s MET 114 CO -0.34 -0.45 0.52 -0.35 -2.03 0.00 0.00 175.02 172.36 3d91 n PRO 115 N 4.68 -0.50 0.07 3.16 -0.04 -1.26 -4.40 135.00 136.71 3d91 n PRO 115 Ca -0.14 -0.10 -0.06 0.00 -0.04 0.00 0.00 63.50 63.16 3d91 n PRO 115 Cb 0.46 -1.94 0.11 0.00 -0.04 0.00 0.00 33.50 32.09 3d91 n PRO 115 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d91 h ALA 116 N -1.70 0.82 -2.64 0.55 0.00 -1.96 -3.27 119.26 111.05 3d91 h ALA 116 Ca -0.45 -0.54 -0.62 0.00 0.00 0.00 0.00 54.91 53.31 3d91 h ALA 116 Cb 1.29 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.86 3d91 h ALA 116 CO 0.36 0.72 -0.08 -0.51 0.00 0.00 0.00 179.25 179.74 3d91 s LEU 117 N -8.01 4.06 0.00 0.00 2.01 -1.26 0.11 118.68 115.59 3d91 s LEU 117 Ca -0.05 0.47 0.24 0.00 0.01 0.00 0.00 54.13 54.80 3d91 s LEU 117 Cb 0.12 -2.60 0.24 0.00 0.01 0.00 0.00 46.19 43.97 3d91 s LEU 117 CO 0.81 -0.25 1.26 -0.81 1.01 0.00 0.00 176.35 178.37 3d91 n PRO 118 N 5.40 1.40 0.03 1.29 -0.04 -1.26 -4.82 135.00 137.00 3d91 n PRO 118 Ca -0.05 -1.09 0.13 0.00 -0.04 0.00 0.00 63.50 62.45 3d91 n PRO 118 Cb 0.50 -1.48 0.49 0.00 -0.04 0.00 0.00 33.50 32.98 3d91 n PRO 118 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3d91 n PHE 119 N 0.15 0.27 0.04 0.54 3.72 -0.91 -2.36 117.46 118.92 3d91 n PHE 119 Ca 0.11 0.08 0.21 0.00 -0.05 0.00 0.00 57.45 57.80 3d91 n PHE 119 Cb 0.47 -0.59 0.74 0.00 -0.94 0.00 0.00 39.48 39.15 3d91 n PHE 119 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 3d91 h MET 120 N 0.00 0.00 -0.37 -1.08 4.05 -0.47 -2.36 114.93 114.70 3d91 h MET 120 Ca 0.00 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.39 3d91 h MET 120 Cb 0.57 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.36 3d91 h MET 120 CO 0.00 0.00 0.02 1.28 0.23 0.00 0.00 176.91 178.44 3d91 n LEU 121 N -3.91 4.50 -4.87 3.39 4.77 -0.99 -4.97 117.00 114.92 3d91 n LEU 121 Ca 0.09 -3.06 -0.36 0.00 -0.03 0.00 0.00 56.01 52.65 3d91 n LEU 121 Cb 0.65 -0.60 -0.06 0.00 -2.33 0.00 0.00 43.42 41.08 3d91 n LEU 121 CO 0.31 0.70 0.02 0.00 -1.33 0.00 0.00 177.39 177.09 3d91 s ALA 122 N -2.86 3.77 -1.51 -1.18 0.00 -0.89 -4.98 121.76 114.11 3d91 s ALA 122 Ca 0.46 -0.42 0.23 0.00 0.00 0.00 0.00 51.96 52.23 3d91 s ALA 122 Cb 0.37 -2.21 0.21 0.00 0.00 0.00 0.00 23.12 21.49 3d91 s ALA 122 CO 0.10 0.57 1.21 0.39 0.00 0.00 0.00 175.76 178.04 3d91 n GLU 123 N 1.32 0.59 -2.96 0.00 -0.58 -1.26 -4.95 120.64 112.79 3d91 n GLU 123 Ca -0.12 -0.44 -0.20 0.00 -0.42 0.00 0.00 57.16 55.99 3d91 n GLU 123 Cb 0.53 -1.49 0.06 0.00 -0.57 0.00 0.00 31.44 29.96 3d91 n GLU 123 CO 0.00 0.00 0.00 -0.59 -0.48 0.00 0.00 177.13 176.06 3d91 s PHE 124 N -2.72 1.70 -0.26 -0.32 -0.71 -1.26 -4.95 117.98 109.46 3d91 s PHE 124 Ca 0.16 -0.59 -0.10 0.00 -1.04 0.00 0.00 56.93 55.36 3d91 s PHE 124 Cb 0.18 -2.35 -0.15 0.00 -1.21 0.00 0.00 43.02 39.49 3d91 s PHE 124 CO 0.66 -1.10 -0.25 -0.25 -1.34 0.00 0.00 175.22 172.95 3d91 n ASP 125 N -2.26 1.96 -0.22 1.98 8.00 0.24 -4.94 116.55 121.32 3d91 n ASP 125 Ca 0.14 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.84 3d91 n ASP 125 Cb 0.61 -0.71 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 3d91 n ASP 125 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d91 n GLY 126 N 1.59 3.76 2.98 0.44 0.00 -0.66 -4.48 105.19 108.83 3d91 n GLY 126 Ca -0.50 -1.11 -0.20 0.00 0.00 0.00 0.00 46.02 44.21 3d91 n GLY 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d91 s VAL 127 N -2.20 0.73 -0.43 1.61 1.01 -0.96 -2.19 120.40 117.97 3d91 s VAL 127 Ca 0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.62 3d91 s VAL 127 Cb 0.00 -0.67 0.11 0.00 0.00 0.00 0.00 36.38 35.83 3d91 s VAL 127 CO 0.00 0.24 0.24 -0.69 0.00 0.00 0.00 175.10 174.89 3d91 s VAL 128 N 0.31 3.54 0.19 2.92 1.01 -0.12 -1.81 120.40 126.45 3d91 s VAL 128 Ca -0.05 -1.98 -0.32 0.00 0.00 0.00 0.00 61.98 59.64 3d91 s VAL 128 Cb -0.09 -3.40 -0.11 0.00 0.00 0.00 0.00 36.38 32.78 3d91 s VAL 128 CO 0.01 -0.71 1.65 -0.83 0.00 0.00 0.00 175.10 175.22 3d91 s GLY 129 N 2.06 1.39 -0.24 4.51 0.00 -0.48 -1.03 107.32 113.52 3d91 s GLY 129 Ca 0.07 1.50 0.13 0.00 0.00 0.00 0.00 44.72 46.43 3d91 s GLY 129 CO -0.03 2.76 1.55 1.03 0.00 0.00 0.00 173.10 178.41 3d91 n MET 130 N 3.90 3.03 -1.57 2.90 2.81 0.32 -4.53 117.12 123.98 3d91 n MET 130 Ca 0.15 -3.00 -0.07 0.00 -1.81 0.00 0.00 57.70 52.97 3d91 n MET 130 Cb 0.37 -1.96 0.03 0.00 -0.71 0.00 0.00 33.22 30.94 3d91 n MET 130 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d91 n GLY 131 N -0.48 1.56 3.88 3.03 0.00 0.11 -4.75 105.19 108.55 3d91 n GLY 131 Ca 0.29 -2.11 -0.30 0.00 0.00 0.00 0.00 46.02 43.90 3d91 n GLY 131 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d91 s PHE 132 N -0.47 3.39 0.43 1.61 0.40 -1.25 -4.71 117.98 117.37 3d91 s PHE 132 Ca 0.22 1.10 0.10 0.00 -0.60 0.00 0.00 56.93 57.75 3d91 s PHE 132 Cb -0.02 -2.99 0.94 0.00 0.51 0.00 0.00 43.02 41.46 3d91 s PHE 132 CO 0.14 -1.08 2.03 0.97 0.70 0.00 0.00 175.22 177.99 3d91 h ILE 133 N -0.58 1.10 -0.24 0.64 2.10 -1.95 -1.89 117.51 116.70 3d91 h ILE 133 Ca -0.45 -0.35 0.07 0.00 1.08 0.00 0.00 64.86 65.22 3d91 h ILE 133 Cb 1.24 0.87 -0.01 0.00 -1.09 0.00 0.00 36.82 37.83 3d91 h ILE 133 CO 0.63 0.12 0.49 -0.33 -1.08 0.00 0.00 178.15 177.98 3d91 h GLU 134 N 0.30 0.00 -0.00 2.19 3.07 -1.93 -2.52 114.58 115.69 3d91 h GLU 134 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 3d91 h GLU 134 Cb 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 3d91 h GLU 134 CO -0.01 0.00 -0.40 1.04 -1.40 0.00 0.00 179.01 178.24 3d91 n GLN 135 N -3.23 3.71 -2.07 2.33 1.13 -0.72 -4.98 117.38 113.55 3d91 n GLN 135 Ca 0.04 -0.08 -0.42 0.00 -1.94 0.00 0.00 57.00 54.59 3d91 n GLN 135 Cb 0.60 -0.95 -0.03 0.00 0.11 0.00 0.00 30.24 29.97 3d91 n GLN 135 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3d91 s ALA 136 N -1.79 3.66 -0.08 -1.58 0.00 -0.95 -4.48 121.76 116.54 3d91 s ALA 136 Ca 0.04 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 52.88 3d91 s ALA 136 Cb 0.07 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.58 3d91 s ALA 136 CO 0.36 -0.77 1.13 0.42 0.00 0.00 0.00 175.76 176.91 3d91 s ILE 137 N 1.49 4.44 -1.51 0.00 1.01 -1.26 -2.16 121.20 123.21 3d91 s ILE 137 Ca 0.67 1.74 0.00 0.00 0.00 0.00 0.00 60.65 63.07 3d91 s ILE 137 Cb -0.39 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 37.96 3d91 s ILE 137 CO 0.30 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.85 3d91 n GLY 138 N 3.27 0.72 1.81 6.18 0.00 -1.26 -3.62 105.19 112.30 3d91 n GLY 138 Ca 0.10 -0.26 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 3d91 n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d91 n ARG 139 N -2.52 -1.28 -1.64 1.61 1.74 -0.92 -4.88 116.66 108.77 3d91 n ARG 139 Ca -0.17 0.60 -0.50 0.00 -0.77 0.00 0.00 57.85 57.00 3d91 n ARG 139 Cb 0.57 -4.81 -0.05 0.00 -1.02 0.00 0.00 32.46 27.15 3d91 n ARG 139 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3d91 n VAL 140 N -1.75 0.09 -1.82 1.55 0.31 -1.24 -4.83 118.33 110.64 3d91 n VAL 140 Ca -0.10 -0.02 -0.42 0.00 -0.01 0.00 0.00 64.34 63.79 3d91 n VAL 140 Cb 0.35 -1.21 -0.03 0.00 -0.91 0.00 0.00 33.84 32.04 3d91 n VAL 140 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3d91 s THR 141 N 1.32 3.09 0.28 2.52 2.01 -1.26 -4.84 115.64 118.76 3d91 s THR 141 Ca 0.85 0.31 -0.30 0.00 0.31 0.00 0.00 61.69 62.86 3d91 s THR 141 Cb -0.85 -3.20 -0.11 0.00 0.01 0.00 0.00 72.50 68.36 3d91 s THR 141 CO 0.46 -0.02 1.48 -2.84 -0.69 0.00 0.00 174.62 173.02 3d91 s PRO 142 N 3.66 4.21 0.35 4.92 0.02 -1.26 -4.71 135.00 142.19 3d91 s PRO 142 Ca 0.80 2.41 0.08 0.00 0.02 0.00 0.00 61.00 64.31 3d91 s PRO 142 Cb -0.40 -3.07 0.79 0.00 0.02 0.00 0.00 34.50 31.84 3d91 s PRO 142 CO 0.36 -0.48 1.89 0.97 -0.33 0.00 0.00 177.00 179.40 3d91 h ILE 143 N 3.40 0.88 -0.15 2.83 2.10 -1.81 -1.45 117.51 123.31 3d91 h ILE 143 Ca -0.47 -0.25 -0.11 0.00 1.08 0.00 0.00 64.86 65.11 3d91 h ILE 143 Cb 1.22 0.10 0.00 0.00 -1.09 0.00 0.00 36.82 37.05 3d91 h ILE 143 CO 0.76 0.13 -0.34 0.15 -1.08 0.00 0.00 178.15 177.77 3d91 h PHE 144 N 0.72 0.63 -1.00 2.19 3.57 -1.92 -0.27 116.94 120.87 3d91 h PHE 144 Ca 0.42 -0.24 0.14 0.00 3.53 0.00 0.00 57.97 61.82 3d91 h PHE 144 Cb 0.61 -0.12 -0.09 0.00 2.79 0.00 0.00 35.95 39.14 3d91 h PHE 144 CO -0.00 0.96 0.62 -0.44 -2.23 0.00 0.00 178.31 177.23 3d91 h ASP 145 N 0.12 0.87 -0.82 0.41 5.19 -1.82 0.23 116.42 120.60 3d91 h ASP 145 Ca 0.00 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.43 3d91 h ASP 145 Cb 0.94 -0.11 -0.04 0.00 0.18 0.00 0.00 39.33 40.30 3d91 h ASP 145 CO 0.07 0.42 0.37 0.78 -3.12 0.00 0.00 179.24 177.77 3d91 h ASN 146 N 0.91 1.10 -0.11 6.45 2.35 -0.96 -3.18 115.58 122.13 3d91 h ASN 146 Ca 0.51 -0.15 -0.22 0.00 -0.55 0.00 0.00 56.30 55.90 3d91 h ASN 146 Cb 0.62 -0.28 0.01 0.00 0.05 0.00 0.00 38.32 38.71 3d91 h ASN 146 CO -0.29 0.94 -0.76 0.40 -1.65 0.00 0.00 177.43 176.08 3d91 h ILE 147 N 1.18 1.29 -0.92 2.81 2.04 0.11 -2.00 117.51 122.01 3d91 h ILE 147 Ca 0.28 -1.97 0.26 0.00 1.00 0.00 0.00 64.86 64.43 3d91 h ILE 147 Cb 0.16 1.96 -0.16 0.00 -0.74 0.00 0.00 36.82 38.04 3d91 h ILE 147 CO -0.03 0.62 0.17 0.40 0.00 0.00 0.00 178.15 179.32 3d91 h ILE 148 N 0.52 0.18 0.00 -0.67 2.04 -0.78 -1.83 117.51 116.98 3d91 h ILE 148 Ca -0.05 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3d91 h ILE 148 Cb 1.38 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 3d91 h ILE 148 CO 0.15 0.02 0.00 -1.20 0.00 0.00 0.00 178.15 177.12 3d91 n SER 149 N -5.33 0.00 -0.63 1.72 7.64 -0.75 -0.52 113.62 115.75 3d91 n SER 149 Ca 0.23 0.42 0.04 0.00 1.01 0.00 0.00 58.87 60.57 3d91 n SER 149 Cb 0.75 -0.47 0.13 0.00 -1.01 0.00 0.00 64.21 63.62 3d91 n SER 149 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3d91 n GLN 150 N -1.47 1.83 -2.26 1.43 6.02 -0.69 -4.89 117.38 117.35 3d91 n GLN 150 Ca 0.06 -1.06 -0.04 0.00 -0.01 0.00 0.00 57.00 55.95 3d91 n GLN 150 Cb 0.24 -1.34 -0.00 0.00 1.02 0.00 0.00 30.24 30.16 3d91 n GLN 150 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3d91 n GLY 151 N 0.81 -0.36 0.13 1.08 0.00 0.33 -4.81 105.19 102.37 3d91 n GLY 151 Ca 0.10 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 3d91 n GLY 151 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3d91 h VAL 152 N 0.00 1.05 -3.93 1.61 -1.51 -1.75 -3.47 116.25 108.24 3d91 h VAL 152 Ca -0.10 -2.64 -0.48 0.00 -1.23 0.00 0.00 66.70 62.25 3d91 h VAL 152 Cb 0.95 2.77 -0.00 0.00 -2.13 0.00 0.00 31.29 32.88 3d91 h VAL 152 CO 0.12 0.83 0.24 -0.76 -1.23 0.00 0.00 177.57 176.77 3d91 s LEU 153 N -7.17 3.84 0.35 4.19 1.43 -1.26 -4.42 118.68 115.64 3d91 s LEU 153 Ca -0.12 1.41 0.03 0.00 -1.03 0.00 0.00 54.13 54.41 3d91 s LEU 153 Cb 0.06 -4.28 0.65 0.00 0.03 0.00 0.00 46.19 42.64 3d91 s LEU 153 CO 0.86 -0.41 1.98 0.50 0.23 0.00 0.00 176.35 179.52 3d91 h LYS 154 N 1.49 0.83 -2.87 1.70 3.64 -0.99 -3.45 116.57 116.93 3d91 h LYS 154 Ca -0.48 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 58.77 3d91 h LYS 154 Cb 1.18 -0.19 -0.18 0.00 -0.41 0.00 0.00 32.23 32.63 3d91 h LYS 154 CO 0.63 0.55 -0.12 -1.21 -2.27 0.00 0.00 179.45 177.03 3d91 s GLU 155 N -5.74 0.85 -1.39 1.90 2.02 -1.10 -4.99 118.70 110.26 3d91 s GLU 155 Ca -0.10 -0.20 -0.11 0.00 0.02 0.00 0.00 54.97 54.58 3d91 s GLU 155 Cb 0.18 0.38 0.08 0.00 0.10 0.00 0.00 34.13 34.88 3d91 s GLU 155 CO 0.77 -0.27 2.18 -0.25 0.02 0.00 0.00 175.26 177.71 3d91 n ASP 156 N 0.84 5.27 -3.86 -0.19 9.92 -1.26 -3.96 116.55 123.32 3d91 n ASP 156 Ca -0.20 -2.95 -0.11 0.00 -0.53 0.00 0.00 54.79 51.01 3d91 n ASP 156 Cb 0.58 -1.55 -0.09 0.00 -0.64 0.00 0.00 41.12 39.42 3d91 n ASP 156 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 3d91 s VAL 157 N 1.55 0.10 0.04 2.53 -7.23 -1.26 -0.02 120.40 116.11 3d91 s VAL 157 Ca 0.47 -0.83 0.01 0.00 -1.81 0.00 0.00 61.98 59.82 3d91 s VAL 157 Cb 0.13 -0.75 -0.03 0.00 0.56 0.00 0.00 36.38 36.30 3d91 s VAL 157 CO -0.05 -0.46 -0.05 0.72 -0.31 0.00 0.00 175.10 174.96 3d91 s PHE 158 N -2.12 0.52 0.16 2.82 -0.12 -0.92 0.49 117.98 118.82 3d91 s PHE 158 Ca -0.09 -0.69 0.06 0.00 -0.05 0.00 0.00 56.93 56.16 3d91 s PHE 158 Cb -0.03 -0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 41.97 3d91 s PHE 158 CO -0.02 -0.19 -0.12 -1.12 -0.05 0.00 0.00 175.22 173.72 3d91 s SER 159 N -2.03 2.06 -0.09 1.98 0.01 0.12 -0.42 113.70 115.33 3d91 s SER 159 Ca -0.05 -1.01 0.03 0.00 1.31 0.00 0.00 55.95 56.23 3d91 s SER 159 Cb -0.04 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.14 3d91 s SER 159 CO -0.03 -0.27 -0.18 -0.36 0.41 0.00 0.00 173.24 172.81 3d91 s PHE 160 N -3.15 2.08 -0.09 2.43 0.40 0.41 -1.93 117.98 118.13 3d91 s PHE 160 Ca 0.18 -0.87 0.03 0.00 -0.60 0.00 0.00 56.93 55.67 3d91 s PHE 160 Cb 0.01 -1.44 0.01 0.00 0.51 0.00 0.00 43.02 42.11 3d91 s PHE 160 CO 0.03 -0.40 -0.17 -0.47 0.70 0.00 0.00 175.22 174.91 3d91 s TYR 161 N 0.61 1.99 -0.19 0.36 5.04 0.83 -3.00 117.35 122.99 3d91 s TYR 161 Ca -0.14 -0.84 0.01 0.00 -2.44 0.00 0.00 57.07 53.66 3d91 s TYR 161 Cb -0.16 -1.40 0.02 0.00 0.35 0.00 0.00 41.96 40.77 3d91 s TYR 161 CO 0.04 -0.39 -0.18 0.71 -1.34 0.00 0.00 175.55 174.39 3d91 s TYR 162 N 0.66 2.83 0.54 4.97 1.51 -1.26 -1.37 117.35 125.22 3d91 s TYR 162 Ca -0.13 -1.62 -0.04 0.00 -1.01 0.00 0.00 57.07 54.27 3d91 s TYR 162 Cb -0.16 -1.94 0.00 0.00 -0.11 0.00 0.00 41.96 39.75 3d91 s TYR 162 CO 0.04 -0.79 0.81 1.21 -1.11 0.00 0.00 175.55 175.71 3d91 s ASN 163 N 1.30 5.69 0.10 2.29 3.84 -0.84 -4.31 114.94 123.01 3d91 s ASN 163 Ca 0.04 0.55 -0.27 0.00 0.21 0.00 0.00 52.86 53.40 3d91 s ASN 163 Cb -0.14 -1.65 -0.06 0.00 -0.55 0.00 0.00 41.25 38.86 3d91 s ASN 163 CO -0.12 -0.92 0.83 -0.13 -2.79 0.00 0.00 177.10 173.97 3d91 s ARG 164 N -4.82 4.58 -0.65 0.43 0.52 -1.26 -4.94 118.95 112.81 3d91 s ARG 164 Ca 0.52 1.20 -0.32 0.00 -0.52 0.00 0.00 55.73 56.61 3d91 s ARG 164 Cb -0.10 -3.34 -0.15 0.00 0.52 0.00 0.00 34.95 31.88 3d91 s ARG 164 CO 0.42 0.35 2.44 -3.47 0.02 0.00 0.00 175.30 175.06 3d91 n ASP 165 N 2.43 1.33 0.00 0.23 2.03 -1.26 -5.05 116.55 116.25 3d91 n ASP 165 Ca -0.02 0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.41 3d91 n ASP 165 Cb 0.49 -1.18 0.00 0.00 -0.72 0.00 0.00 41.12 39.72 3d91 n ASP 165 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 3d91 n SER 166 N 11.40 0.00 0.00 1.67 2.88 -1.26 -5.06 113.62 123.25 3d91 n SER 166 Ca 0.51 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.05 3d91 n SER 166 Cb 0.21 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 3d91 n SER 166 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3d91 n SER 171 N 0.00 0.00 -4.54 -3.46 3.41 -1.26 -5.09 113.62 102.68 3d91 n SER 171 Ca 0.00 0.00 -0.49 0.00 -0.26 0.00 0.00 58.87 58.12 3d91 n SER 171 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 3d91 n SER 171 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3d91 n LEU 172 N -0.57 2.65 0.16 1.04 7.94 -1.26 -4.87 117.00 122.09 3d91 n LEU 172 Ca 0.00 0.52 0.01 0.00 -1.11 0.00 0.00 56.01 55.44 3d91 n LEU 172 Cb 0.00 -1.34 0.27 0.00 0.53 0.00 0.00 43.42 42.88 3d91 n LEU 172 CO 0.00 -0.56 0.60 1.23 -1.11 0.00 0.00 177.39 177.55 3d91 h GLY 173 N 11.98 0.00 -3.25 -3.96 0.00 -1.95 -3.42 103.07 102.47 3d91 h GLY 173 Ca -0.36 0.00 0.34 0.00 0.00 0.00 0.00 47.33 47.31 3d91 h GLY 173 CO 0.99 0.00 0.91 -0.32 0.00 0.00 0.00 176.54 178.12 3d91 s GLY 174 N -4.39 -0.38 -0.21 4.60 0.00 -0.77 -1.98 107.32 104.19 3d91 s GLY 174 Ca -0.02 1.18 -0.17 0.00 0.00 0.00 0.00 44.72 45.71 3d91 s GLY 174 CO 0.74 0.31 0.54 1.62 0.00 0.00 0.00 173.10 176.30 3d91 s GLN 175 N -2.21 0.60 -0.04 2.90 0.74 -0.47 -0.10 119.66 121.07 3d91 s GLN 175 Ca 0.13 0.81 0.06 0.00 0.05 0.00 0.00 55.36 56.41 3d91 s GLN 175 Cb 0.04 0.24 -0.01 0.00 1.10 0.00 0.00 33.01 34.37 3d91 s GLN 175 CO -0.05 -0.10 -0.22 -1.50 -0.55 0.00 0.00 175.29 172.88 3d91 s ILE 176 N 0.61 1.76 -0.20 -2.34 2.07 -0.27 -0.12 121.20 122.72 3d91 s ILE 176 Ca -0.03 -0.92 -0.05 0.00 -1.41 0.00 0.00 60.65 58.25 3d91 s ILE 176 Cb -0.05 -1.49 -0.03 0.00 0.13 0.00 0.00 42.46 41.03 3d91 s ILE 176 CO -0.04 0.50 -0.00 -0.69 -1.91 0.00 0.00 174.94 172.80 3d91 s VAL 177 N -0.18 3.98 -0.25 4.00 1.01 -0.81 0.47 120.40 128.62 3d91 s VAL 177 Ca -0.01 -0.31 -0.10 0.00 0.00 0.00 0.00 61.98 61.57 3d91 s VAL 177 Cb -0.12 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 3d91 s VAL 177 CO 0.02 0.43 0.14 -0.76 0.00 0.00 0.00 175.10 174.93 3d91 s LEU 178 N 0.93 3.92 0.00 3.92 1.43 0.28 0.15 118.68 129.32 3d91 s LEU 178 Ca 0.01 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 3d91 s LEU 178 Cb -0.14 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 44.02 3d91 s LEU 178 CO 0.02 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.24 3d91 n GLY 179 N 4.53 0.56 0.00 -3.19 0.00 0.18 -1.15 105.19 106.12 3d91 n GLY 179 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3d91 n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d91 n GLY 180 N -1.27 -0.74 3.36 -0.02 0.00 -1.20 -2.70 105.19 102.61 3d91 n GLY 180 Ca 0.00 -0.38 -0.21 0.00 0.00 0.00 0.00 46.02 45.43 3d91 n GLY 180 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d91 s SER 181 N -4.00 2.03 -0.23 1.61 1.04 -1.26 -3.43 113.70 109.46 3d91 s SER 181 Ca 0.00 -1.74 0.02 0.00 0.48 0.00 0.00 55.95 54.72 3d91 s SER 181 Cb 0.00 0.56 0.05 0.00 0.10 0.00 0.00 66.02 66.72 3d91 s SER 181 CO 0.00 -1.03 -0.13 -0.62 0.98 0.00 0.00 173.24 172.44 3d91 s ASP 182 N -3.45 3.99 0.48 7.02 -1.08 -1.26 -4.99 116.67 117.39 3d91 s ASP 182 Ca 0.35 -1.15 0.25 0.00 -0.52 0.00 0.00 52.55 51.48 3d91 s ASP 182 Cb 0.02 -1.49 1.24 0.00 -1.46 0.00 0.00 42.92 41.23 3d91 s ASP 182 CO 0.23 -0.14 1.99 1.55 0.52 0.00 0.00 175.17 179.32 3d91 h PRO 183 N 7.84 0.00 0.00 4.34 0.13 -2.01 -2.29 132.00 140.01 3d91 h PRO 183 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3d91 h PRO 183 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3d91 h PRO 183 CO 0.51 0.18 0.00 0.00 -0.23 0.00 0.00 178.00 178.45 3d91 n GLN 184 N -3.66 0.07 0.00 0.86 10.64 -1.26 -3.30 117.38 120.72 3d91 n GLN 184 Ca -0.01 0.28 0.00 0.00 -1.83 0.00 0.00 57.00 55.43 3d91 n GLN 184 Cb 0.30 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.18 3d91 n GLN 184 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 3d91 n HIS 185 N -1.38 0.00 -4.11 2.61 8.25 -0.86 -4.87 115.22 114.86 3d91 n HIS 185 Ca 0.03 -0.14 -0.09 0.00 -0.26 0.00 0.00 57.72 57.26 3d91 n HIS 185 Cb 0.08 -0.01 -0.09 0.00 1.12 0.00 0.00 29.99 31.08 3d91 n HIS 185 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 3d91 s TYR 186 N -0.28 0.74 0.14 4.41 1.13 -1.21 0.68 117.35 122.96 3d91 s TYR 186 Ca 0.00 -1.13 0.09 0.00 -1.41 0.00 0.00 57.07 54.62 3d91 s TYR 186 Cb 0.00 -0.39 -0.04 0.00 -1.10 0.00 0.00 41.96 40.43 3d91 s TYR 186 CO 0.00 -0.55 -0.21 -1.83 -2.51 0.00 0.00 175.55 170.45 3d91 s GLU 187 N -4.02 1.26 2.84 -3.49 -1.05 -0.09 -4.67 118.70 109.46 3d91 s GLU 187 Ca 0.21 -1.32 0.00 0.00 -0.15 0.00 0.00 54.97 53.72 3d91 s GLU 187 Cb 0.07 -1.48 0.00 0.00 -0.44 0.00 0.00 34.13 32.27 3d91 s GLU 187 CO 0.00 0.33 0.00 0.41 0.95 0.00 0.00 175.26 176.95 3d91 n GLY 188 N 0.68 -0.42 3.57 -3.83 0.00 -1.26 -3.65 105.19 100.28 3d91 n GLY 188 Ca -0.16 -1.08 -0.24 0.00 0.00 0.00 0.00 46.02 44.54 3d91 n GLY 188 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3d91 s ASN 189 N -4.00 4.18 0.58 1.61 0.01 -1.26 -5.02 114.94 111.04 3d91 s ASN 189 Ca 0.00 -0.76 -0.18 0.00 -0.71 0.00 0.00 52.86 51.21 3d91 s ASN 189 Cb 0.00 -0.64 -0.04 0.00 0.41 0.00 0.00 41.25 40.98 3d91 s ASN 189 CO 0.00 0.03 1.13 -0.36 -1.51 0.00 0.00 177.10 176.39 3d91 s PHE 190 N -2.27 2.65 -0.04 2.20 0.08 -1.26 -4.70 117.98 114.64 3d91 s PHE 190 Ca 0.30 1.54 0.03 0.00 0.12 0.00 0.00 56.93 58.92 3d91 s PHE 190 Cb -0.06 -3.26 0.01 0.00 -0.57 0.00 0.00 43.02 39.13 3d91 s PHE 190 CO 0.17 -1.62 -0.11 -1.01 -0.10 0.00 0.00 175.22 172.56 3d91 s HIS 191 N -1.92 1.17 0.14 0.36 3.76 -1.07 -4.97 115.29 112.76 3d91 s HIS 191 Ca 0.71 -0.33 0.08 0.00 -0.15 0.00 0.00 55.06 55.37 3d91 s HIS 191 Cb -0.23 -0.84 -0.04 0.00 1.11 0.00 0.00 32.58 32.58 3d91 s HIS 191 CO 0.31 -0.15 -0.13 0.71 -0.85 0.00 0.00 174.74 174.63 3d91 s TYR 192 N 0.31 2.62 -0.02 1.40 2.02 -1.26 -1.39 117.35 121.03 3d91 s TYR 192 Ca -0.06 -0.22 0.05 0.00 -0.37 0.00 0.00 57.07 56.47 3d91 s TYR 192 Cb -0.11 -1.34 -0.01 0.00 -0.40 0.00 0.00 41.96 40.10 3d91 s TYR 192 CO 0.01 0.45 -0.17 0.42 -1.57 0.00 0.00 175.55 174.69 3d91 s ILE 193 N -1.39 1.36 0.33 2.71 1.09 0.27 -4.89 121.20 120.69 3d91 s ILE 193 Ca 0.22 -0.72 -0.27 0.00 -1.10 0.00 0.00 60.65 58.78 3d91 s ILE 193 Cb -0.10 -1.14 -0.09 0.00 -1.06 0.00 0.00 42.46 40.07 3d91 s ILE 193 CO 0.13 0.39 1.05 0.20 -0.10 0.00 0.00 174.94 176.60 3d91 s ASN 194 N -0.27 7.08 0.62 3.58 0.02 -1.26 -1.06 114.94 123.65 3d91 s ASN 194 Ca 0.04 2.09 -0.18 0.00 -1.02 0.00 0.00 52.86 53.79 3d91 s ASN 194 Cb -0.08 -2.60 -0.05 0.00 0.02 0.00 0.00 41.25 38.54 3d91 s ASN 194 CO 0.00 -0.26 0.86 0.18 0.02 0.00 0.00 177.10 177.89 3d91 n LEU 195 N 0.59 3.03 0.06 0.60 4.77 0.08 -4.61 117.00 121.52 3d91 n LEU 195 Ca 0.02 0.76 -0.11 0.00 -0.03 0.00 0.00 56.01 56.65 3d91 n LEU 195 Cb 0.48 -1.34 -0.08 0.00 -2.33 0.00 0.00 43.42 40.15 3d91 n LEU 195 CO 0.49 -2.18 0.42 0.40 -1.33 0.00 0.00 177.39 175.19 3d91 h ILE 196 N 0.30 0.86 -4.34 -0.08 2.04 -1.30 -3.46 117.51 111.53 3d91 h ILE 196 Ca -0.48 -1.09 -0.22 0.00 1.00 0.00 0.00 64.86 64.08 3d91 h ILE 196 Cb 1.37 1.43 -0.15 0.00 -0.74 0.00 0.00 36.82 38.73 3d91 h ILE 196 CO 0.49 0.22 -0.64 -1.59 0.00 0.00 0.00 178.15 176.63 3d91 s LYS 197 N -3.56 1.02 0.63 2.37 -2.85 -1.26 -5.11 119.74 110.98 3d91 s LYS 197 Ca -0.13 -1.50 -0.16 0.00 -1.00 0.00 0.00 55.97 53.18 3d91 s LYS 197 Cb 0.01 0.16 -0.02 0.00 -2.06 0.00 0.00 37.83 35.92 3d91 s LYS 197 CO 0.49 -0.27 1.10 -0.08 0.10 0.00 0.00 175.35 176.70 3d91 s THR 198 N -4.01 3.33 0.00 3.79 -1.32 -1.26 -3.92 115.64 112.25 3d91 s THR 198 Ca 0.28 0.65 0.00 0.00 -1.21 0.00 0.00 61.69 61.41 3d91 s THR 198 Cb 0.07 -3.18 0.00 0.00 -1.51 0.00 0.00 72.50 67.88 3d91 s THR 198 CO 0.05 -0.35 0.00 0.61 -2.21 0.00 0.00 174.62 172.72 3d91 n GLY 199 N -0.49 2.96 3.06 6.08 0.00 -1.26 -5.06 105.19 110.47 3d91 n GLY 199 Ca 0.10 -1.02 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 3d91 n GLY 199 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d91 s VAL 200 N -0.33 0.04 -1.61 1.61 0.11 -1.25 -3.95 120.40 115.02 3d91 s VAL 200 Ca 0.00 -0.33 -0.10 0.00 -2.93 0.00 0.00 61.98 58.62 3d91 s VAL 200 Cb 0.00 -0.30 -0.07 0.00 -1.53 0.00 0.00 36.38 34.48 3d91 s VAL 200 CO 0.00 -0.18 2.87 0.79 -3.33 0.00 0.00 175.10 175.25 3d91 n TRP 201 N 2.30 2.55 -4.61 1.54 7.02 -1.26 -4.78 117.44 120.21 3d91 n TRP 201 Ca -0.17 -3.08 -0.22 0.00 -1.02 0.00 0.00 57.50 53.01 3d91 n TRP 201 Cb 0.57 -2.50 -0.15 0.00 -2.42 0.00 0.00 31.31 26.82 3d91 n TRP 201 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 3d91 s GLN 202 N 2.24 1.11 0.25 -0.99 0.74 -1.26 -1.37 119.66 120.37 3d91 s GLN 202 Ca 0.67 -0.52 0.02 0.00 0.05 0.00 0.00 55.36 55.58 3d91 s GLN 202 Cb 0.18 -1.07 -0.05 0.00 1.10 0.00 0.00 33.01 33.16 3d91 s GLN 202 CO -0.06 0.29 0.07 0.96 -0.55 0.00 0.00 175.29 176.00 3d91 s ILE 203 N -0.37 0.64 0.19 -2.34 -4.36 0.43 -0.86 121.20 114.53 3d91 s ILE 203 Ca 0.05 -2.00 -0.16 0.00 -0.26 0.00 0.00 60.65 58.28 3d91 s ILE 203 Cb -0.06 -2.56 -0.08 0.00 1.25 0.00 0.00 42.46 41.02 3d91 s ILE 203 CO -0.00 -0.09 0.63 -1.58 0.24 0.00 0.00 174.94 174.14 3d91 s GLN 204 N -4.00 4.07 -0.27 0.37 2.00 -1.26 0.87 119.66 121.44 3d91 s GLN 204 Ca 0.35 0.63 0.00 0.00 -2.00 0.00 0.00 55.36 54.34 3d91 s GLN 204 Cb 0.07 -2.86 0.08 0.00 0.80 0.00 0.00 33.01 31.11 3d91 s GLN 204 CO 0.12 0.41 0.03 1.41 -0.50 0.00 0.00 175.29 176.77 3d91 s MET 205 N -2.09 1.11 0.00 1.67 -2.45 0.88 -4.66 119.30 113.77 3d91 s MET 205 Ca 0.41 -1.08 0.00 0.00 -1.25 0.00 0.00 55.69 53.78 3d91 s MET 205 Cb -0.15 -2.39 0.00 0.00 1.25 0.00 0.00 34.83 33.54 3d91 s MET 205 CO 0.20 -0.81 1.18 1.63 1.05 0.00 0.00 175.02 178.28 3d91 n LYS 206 N 4.73 0.98 0.00 4.11 5.02 -1.05 -1.75 118.16 130.20 3d91 n LYS 206 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 3d91 n LYS 206 Cb 0.43 -1.01 0.00 0.00 -0.02 0.00 0.00 35.03 34.43 3d91 n LYS 206 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d91 n GLY 207 N 0.72 4.13 3.58 0.72 0.00 -1.01 -4.74 105.19 108.59 3d91 n GLY 207 Ca 0.00 -1.54 -0.32 0.00 0.00 0.00 0.00 46.02 44.16 3d91 n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d91 s VAL 208 N -2.18 3.59 -0.14 1.61 1.01 -0.70 -1.88 120.40 121.71 3d91 s VAL 208 Ca 0.00 -0.75 -0.00 0.00 0.00 0.00 0.00 61.98 61.23 3d91 s VAL 208 Cb 0.00 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 3d91 s VAL 208 CO 0.00 0.43 -0.14 -0.44 0.00 0.00 0.00 175.10 174.95 3d91 s SER 209 N -1.31 3.83 -0.11 3.32 0.01 0.71 -0.70 113.70 119.45 3d91 s SER 209 Ca 0.16 -0.40 -0.02 0.00 1.31 0.00 0.00 55.95 56.99 3d91 s SER 209 Cb -0.11 -1.59 -0.03 0.00 0.21 0.00 0.00 66.02 64.50 3d91 s SER 209 CO 0.06 0.12 -0.02 -0.69 0.41 0.00 0.00 173.24 173.12 3d91 s VAL 210 N 0.62 4.06 0.00 3.43 1.01 -1.25 -0.42 120.40 127.85 3d91 s VAL 210 Ca -0.08 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.58 3d91 s VAL 210 Cb -0.16 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.49 3d91 s VAL 210 CO 0.03 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.29 3d91 n GLY 211 N 2.76 2.97 0.09 4.51 0.00 -0.83 -3.55 105.19 111.14 3d91 n GLY 211 Ca -0.18 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.44 3d91 n GLY 211 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3d91 n SER 212 N 1.49 0.75 -4.59 1.61 2.88 -1.26 -4.80 113.62 109.70 3d91 n SER 212 Ca 0.00 0.26 -0.42 0.00 -1.33 0.00 0.00 58.87 57.38 3d91 n SER 212 Cb 0.00 0.18 -0.05 0.00 -0.75 0.00 0.00 64.21 63.58 3d91 n SER 212 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3d91 s SER 213 N -6.00 6.55 -0.03 -3.46 1.04 -1.23 -5.02 113.70 105.56 3d91 s SER 213 Ca -0.09 0.40 -0.30 0.00 0.48 0.00 0.00 55.95 56.44 3d91 s SER 213 Cb 0.07 -2.38 -0.15 0.00 0.10 0.00 0.00 66.02 63.66 3d91 s SER 213 CO 0.81 -0.65 0.83 0.41 0.98 0.00 0.00 173.24 175.62 3d91 n THR 214 N 5.65 0.00 0.00 2.02 -1.04 -1.26 -3.81 114.28 115.84 3d91 n THR 214 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3d91 n THR 214 Cb 0.48 -0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.96 3d91 n THR 214 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3d91 n LEU 215 N 1.27 0.00 -4.52 -4.42 -0.00 0.12 -4.89 117.00 104.56 3d91 n LEU 215 Ca 0.16 0.00 -0.25 0.00 -0.00 0.00 0.00 56.01 55.92 3d91 n LEU 215 Cb 0.05 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.38 3d91 n LEU 215 CO 0.47 0.00 -0.25 -0.76 -0.00 0.00 0.00 177.39 176.86 3d91 s LEU 216 N -2.46 2.20 -1.49 -1.96 1.02 -1.04 -4.90 118.68 110.04 3d91 s LEU 216 Ca 0.00 -1.50 -0.01 0.00 0.02 0.00 0.00 54.13 52.64 3d91 s LEU 216 Cb 0.00 -0.39 0.01 0.00 0.02 0.00 0.00 46.19 45.83 3d91 s LEU 216 CO 0.00 -0.72 0.20 0.00 0.02 0.00 0.00 176.35 175.85 3d91 h GLU 218 N -1.79 0.00 -0.41 0.00 5.08 -1.90 -2.56 114.58 112.99 3d91 h GLU 218 Ca -0.65 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.71 3d91 h GLU 218 Cb 1.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.64 3d91 h GLU 218 CO 0.68 0.25 0.00 -0.25 -1.00 0.00 0.00 179.01 178.69 3d91 n ASP 219 N -2.96 2.25 0.00 1.42 8.00 -1.26 -4.87 116.55 119.13 3d91 n ASP 219 Ca -0.02 -1.98 0.00 0.00 0.71 0.00 0.00 54.79 53.50 3d91 n ASP 219 Cb 0.71 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 3d91 n ASP 219 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d91 n GLY 220 N 1.18 -3.71 0.00 0.44 0.00 -1.00 -5.05 105.19 97.05 3d91 n GLY 220 Ca 0.14 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3d91 n GLY 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d91 s LEU 222 N 0.00 3.10 -0.20 0.00 1.43 -1.26 -0.08 118.68 121.67 3d91 s LEU 222 Ca 0.00 -0.20 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 3d91 s LEU 222 Cb 0.00 -1.80 0.06 0.00 0.03 0.00 0.00 46.19 44.48 3d91 s LEU 222 CO 0.00 0.27 0.03 0.00 0.23 0.00 0.00 176.35 176.88 3d91 s ALA 223 N -1.02 1.11 -0.04 4.21 0.00 0.25 -2.05 121.76 124.23 3d91 s ALA 223 Ca 0.18 -0.80 -0.30 0.00 0.00 0.00 0.00 51.96 51.04 3d91 s ALA 223 Cb -0.11 -1.22 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 3d91 s ALA 223 CO 0.08 -1.20 1.11 -1.17 0.00 0.00 0.00 175.76 174.58 3d91 s LEU 224 N 1.81 4.30 -0.71 0.00 2.96 -0.77 -0.43 118.68 125.84 3d91 s LEU 224 Ca -0.01 1.75 -0.18 0.00 -0.22 0.00 0.00 54.13 55.47 3d91 s LEU 224 Cb -0.17 -3.56 0.13 0.00 0.50 0.00 0.00 46.19 43.09 3d91 s LEU 224 CO -0.09 -0.46 0.81 -0.69 -1.32 0.00 0.00 176.35 174.60 3d91 s VAL 225 N 1.72 4.95 -0.43 1.68 1.01 -0.47 0.64 120.40 129.50 3d91 s VAL 225 Ca 0.54 -1.40 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 3d91 s VAL 225 Cb -0.23 -4.55 0.07 0.00 0.00 0.00 0.00 36.38 31.66 3d91 s VAL 225 CO 0.23 -1.20 0.30 -0.62 0.00 0.00 0.00 175.10 173.81 3d91 s ASP 226 N 3.34 5.83 0.00 3.32 2.15 -1.10 -4.73 116.67 125.49 3d91 s ASP 226 Ca 0.18 -1.38 0.25 0.00 0.43 0.00 0.00 52.55 52.03 3d91 s ASP 226 Cb -0.17 -2.06 1.19 0.00 -0.30 0.00 0.00 42.92 41.58 3d91 s ASP 226 CO -0.00 -0.56 1.82 0.35 -0.17 0.00 0.00 175.17 176.61 3d91 n THR 227 N 5.03 0.24 0.89 1.71 -2.24 -1.26 -2.96 114.28 115.69 3d91 n THR 227 Ca -0.11 0.06 0.10 0.00 -2.27 0.00 0.00 64.05 61.83 3d91 n THR 227 Cb 0.44 -0.65 0.00 0.00 -2.10 0.00 0.00 70.33 68.02 3d91 n THR 227 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d91 n GLY 228 N 0.88 0.07 3.49 3.38 0.00 -1.26 -4.78 105.19 106.97 3d91 n GLY 228 Ca 0.10 -0.58 -0.34 0.00 0.00 0.00 0.00 46.02 45.20 3d91 n GLY 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d91 s ALA 229 N -2.21 3.07 0.31 4.61 0.00 -1.16 -4.99 121.76 121.39 3d91 s ALA 229 Ca 0.17 -0.89 0.13 0.00 0.00 0.00 0.00 51.96 51.37 3d91 s ALA 229 Cb 0.16 -1.72 0.60 0.00 0.00 0.00 0.00 23.12 22.16 3d91 s ALA 229 CO 0.49 0.03 1.74 0.77 0.00 0.00 0.00 175.76 178.78 3d91 h SER 230 N 7.10 0.00 -0.72 0.00 0.02 -1.88 0.35 113.55 118.42 3d91 h SER 230 Ca -0.34 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 59.98 3d91 h SER 230 Cb 1.18 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.62 3d91 h SER 230 CO 0.63 0.46 -0.46 -0.31 -1.14 0.00 0.00 176.83 176.01 3d91 s TYR 231 N -3.88 1.97 0.00 3.45 2.02 -1.26 -3.10 117.35 116.55 3d91 s TYR 231 Ca -0.02 -0.84 -0.22 0.00 -0.37 0.00 0.00 57.07 55.63 3d91 s TYR 231 Cb 0.13 -1.77 -0.05 0.00 -0.40 0.00 0.00 41.96 39.87 3d91 s TYR 231 CO 0.73 0.04 0.63 0.42 -1.57 0.00 0.00 175.55 175.80 3d91 s ILE 232 N -2.79 4.88 0.13 2.71 1.01 -1.18 -2.07 121.20 123.90 3d91 s ILE 232 Ca 0.22 1.33 0.10 0.00 0.00 0.00 0.00 60.65 62.29 3d91 s ILE 232 Cb 0.02 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 3d91 s ILE 232 CO 0.12 0.40 -0.24 -0.94 0.00 0.00 0.00 174.94 174.29 3d91 s SER 233 N -0.10 2.98 0.11 3.58 1.04 -0.80 -1.35 113.70 119.16 3d91 s SER 233 Ca 0.33 -0.75 0.02 0.00 0.48 0.00 0.00 55.95 56.03 3d91 s SER 233 Cb -0.19 -0.19 -0.01 0.00 0.10 0.00 0.00 66.02 65.74 3d91 s SER 233 CO 0.18 0.11 0.09 0.61 0.98 0.00 0.00 173.24 175.21 3d91 n GLY 234 N 0.85 3.68 3.76 7.32 0.00 -1.17 -1.13 105.19 118.50 3d91 n GLY 234 Ca -0.18 -1.75 -0.39 0.00 0.00 0.00 0.00 46.02 43.70 3d91 n GLY 234 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d91 s SER 235 N -1.75 5.83 0.26 1.61 1.04 -1.25 -1.50 113.70 117.93 3d91 s SER 235 Ca 0.13 2.83 -0.07 0.00 0.48 0.00 0.00 55.95 59.31 3d91 s SER 235 Cb 0.01 -2.65 0.46 0.00 0.10 0.00 0.00 66.02 63.94 3d91 s SER 235 CO 0.09 -1.20 1.61 0.74 0.98 0.00 0.00 173.24 175.45 3d91 h THR 236 N 2.13 0.21 -0.21 2.02 2.02 -1.93 0.34 112.91 117.50 3d91 h THR 236 Ca -0.51 -0.01 0.04 0.00 0.77 0.00 0.00 66.41 66.70 3d91 h THR 236 Cb 1.27 0.16 -0.07 0.00 -1.74 0.00 0.00 68.15 67.77 3d91 h THR 236 CO 0.60 0.01 -0.53 -1.28 0.37 0.00 0.00 175.52 174.69 3d91 h SER 237 N 0.04 -1.72 -0.42 4.18 0.87 -1.98 0.41 113.55 114.93 3d91 h SER 237 Ca 0.44 0.21 0.04 0.00 -1.23 0.00 0.00 61.79 61.25 3d91 h SER 237 Cb 0.76 0.68 -0.04 0.00 -0.44 0.00 0.00 62.40 63.37 3d91 h SER 237 CO -0.79 -0.46 0.20 0.28 -0.53 0.00 0.00 176.83 175.53 3d91 h SER 238 N -0.52 0.28 -0.21 6.23 0.02 -1.34 0.72 113.55 118.73 3d91 h SER 238 Ca 0.05 0.03 -0.13 0.00 -0.84 0.00 0.00 61.79 60.90 3d91 h SER 238 Cb 0.65 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 3d91 h SER 238 CO -0.48 0.21 -0.31 0.40 -1.14 0.00 0.00 176.83 175.51 3d91 h ILE 239 N 0.41 1.28 0.09 3.27 1.08 -0.07 0.19 117.51 123.75 3d91 h ILE 239 Ca 0.18 -1.44 0.02 0.00 -0.39 0.00 0.00 64.86 63.23 3d91 h ILE 239 Cb 0.10 1.35 -0.05 0.00 -3.07 0.00 0.00 36.82 35.15 3d91 h ILE 239 CO -0.14 0.47 -0.52 -0.33 -0.69 0.00 0.00 178.15 176.95 3d91 h GLU 240 N 0.61 -0.70 -0.11 2.37 5.08 0.19 -1.65 114.58 120.37 3d91 h GLU 240 Ca 0.07 0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3d91 h GLU 240 Cb 0.82 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 3d91 h GLU 240 CO 0.07 -0.47 -0.17 0.87 -1.00 0.00 0.00 179.01 178.31 3d91 h LYS 241 N -0.73 -0.13 -0.85 2.33 1.79 0.24 -2.90 116.57 116.33 3d91 h LYS 241 Ca 0.00 0.01 0.13 0.00 -2.18 0.00 0.00 60.65 58.61 3d91 h LYS 241 Cb 0.75 0.03 -0.06 0.00 -1.58 0.00 0.00 32.23 31.36 3d91 h LYS 241 CO -0.30 -0.09 0.55 1.25 -1.08 0.00 0.00 179.45 179.78 3d91 h LEU 242 N -0.13 0.62 -0.01 2.94 5.85 -0.56 -2.76 115.31 121.26 3d91 h LEU 242 Ca 0.02 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 3d91 h LEU 242 Cb 0.19 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3d91 h LEU 242 CO -0.17 0.33 -0.11 0.24 -0.34 0.00 0.00 178.44 178.39 3d91 h MET 243 N 0.67 0.10 -0.53 1.25 2.86 -1.27 -2.77 114.93 115.23 3d91 h MET 243 Ca 0.41 -0.09 0.06 0.00 -2.06 0.00 0.00 59.70 58.03 3d91 h MET 243 Cb 0.66 0.02 -0.07 0.00 0.06 0.00 0.00 31.60 32.27 3d91 h MET 243 CO -0.18 0.79 -0.27 -1.91 1.06 0.00 0.00 176.91 176.40 3d91 n GLU 244 N -4.64 -0.19 0.07 1.72 0.00 -1.05 0.19 120.64 116.75 3d91 n GLU 244 Ca -0.09 0.81 0.11 0.00 0.00 0.00 0.00 57.16 57.99 3d91 n GLU 244 Cb 0.41 -1.20 0.44 0.00 0.00 0.00 0.00 31.44 31.09 3d91 n GLU 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3d91 n ALA 245 N -3.65 1.83 0.02 4.31 0.00 -1.16 -2.85 120.51 119.01 3d91 n ALA 245 Ca 0.03 0.01 -0.14 0.00 0.00 0.00 0.00 53.44 53.34 3d91 n ALA 245 Cb 0.17 -1.36 -0.14 0.00 0.00 0.00 0.00 19.45 18.12 3d91 n ALA 245 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3d91 h LEU 246 N 0.00 0.21 0.00 0.00 3.38 0.24 -3.48 115.31 115.65 3d91 h LEU 246 Ca 0.00 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3d91 h LEU 246 Cb 0.40 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3d91 h LEU 246 CO 0.00 1.33 0.00 0.61 0.09 0.00 0.00 178.44 180.47 3d91 n GLY 247 N 1.67 1.97 3.71 0.83 0.00 -0.70 -4.81 105.19 107.87 3d91 n GLY 247 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 3d91 n GLY 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d91 s ALA 248 N -1.92 1.91 0.26 4.61 0.00 -1.24 -4.89 121.76 120.49 3d91 s ALA 248 Ca 0.00 0.81 0.02 0.00 0.00 0.00 0.00 51.96 52.79 3d91 s ALA 248 Cb 0.00 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 3d91 s ALA 248 CO 0.00 -2.18 0.07 0.36 0.00 0.00 0.00 175.76 174.02 3d91 n LYS 249 N -3.20 0.81 -3.83 0.00 2.85 0.16 -4.64 118.16 110.31 3d91 n LYS 249 Ca 0.13 -2.10 -0.33 0.00 -1.05 0.00 0.00 58.31 54.96 3d91 n LYS 249 Cb 0.51 1.04 -0.05 0.00 -0.65 0.00 0.00 35.03 35.88 3d91 n LYS 249 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3d91 s LYS 250 N -2.96 3.51 0.00 -1.58 1.02 -1.26 0.21 119.74 118.67 3d91 s LYS 250 Ca 0.10 -0.24 0.00 0.00 0.02 0.00 0.00 55.97 55.85 3d91 s LYS 250 Cb 0.01 -3.04 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 3d91 s LYS 250 CO 0.07 0.62 0.00 0.54 -0.92 0.00 0.00 175.35 175.66 3d91 n ARG 251 N 0.72 2.77 0.00 1.68 1.74 -0.13 -4.82 116.66 118.63 3d91 n ARG 251 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 3d91 n ARG 251 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 3d91 n ARG 251 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3d91 n LEU 252 N 0.00 0.00 -1.03 0.55 4.77 -1.26 -4.00 117.00 116.03 3d91 n LEU 252 Ca 0.00 0.66 0.12 0.00 -0.03 0.00 0.00 56.01 56.75 3d91 n LEU 252 Cb 0.00 -0.16 0.15 0.00 -2.33 0.00 0.00 43.42 41.09 3d91 n LEU 252 CO 0.00 -0.16 0.66 0.49 -1.33 0.00 0.00 177.39 177.05 3d91 n PHE 253 N -1.17 0.24 -4.13 -1.77 3.72 -1.26 -4.96 117.46 108.12 3d91 n PHE 253 Ca 0.00 -0.12 -0.11 0.00 -0.05 0.00 0.00 57.45 57.17 3d91 n PHE 253 Cb 0.00 -0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.45 3d91 n PHE 253 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 3d91 s ASP 254 N -1.72 0.17 0.12 4.37 1.47 -1.26 -4.88 116.67 114.94 3d91 s ASP 254 Ca 0.32 -1.21 0.05 0.00 1.18 0.00 0.00 52.55 52.90 3d91 s ASP 254 Cb 0.21 0.38 -0.04 0.00 -0.34 0.00 0.00 42.92 43.13 3d91 s ASP 254 CO 0.30 -0.83 0.02 -0.31 0.68 0.00 0.00 175.17 175.03 3d91 s TYR 255 N -4.08 2.98 -0.03 2.11 2.02 -1.26 -0.95 117.35 118.13 3d91 s TYR 255 Ca 0.29 -0.05 -0.02 0.00 -0.37 0.00 0.00 57.07 56.92 3d91 s TYR 255 Cb 0.06 -1.49 0.02 0.00 -0.40 0.00 0.00 41.96 40.14 3d91 s TYR 255 CO 0.06 0.49 0.07 0.14 -1.57 0.00 0.00 175.55 174.75 3d91 s VAL 256 N -1.48 -0.02 0.43 0.71 -7.23 0.55 -2.97 120.40 110.38 3d91 s VAL 256 Ca 0.27 0.09 0.08 0.00 -1.81 0.00 0.00 61.98 60.60 3d91 s VAL 256 Cb -0.11 -0.12 -0.01 0.00 0.56 0.00 0.00 36.38 36.70 3d91 s VAL 256 CO 0.19 0.04 0.42 0.68 -0.31 0.00 0.00 175.10 176.12 3d91 s VAL 257 N 0.51 2.66 -0.14 1.32 -7.23 -0.83 0.41 120.40 117.10 3d91 s VAL 257 Ca -0.04 -1.29 -0.26 0.00 -1.81 0.00 0.00 61.98 58.58 3d91 s VAL 257 Cb -0.06 -2.95 -0.02 0.00 0.56 0.00 0.00 36.38 33.92 3d91 s VAL 257 CO -0.02 0.00 0.86 -0.54 -0.31 0.00 0.00 175.10 175.09 3d91 s LYS 258 N -4.18 4.35 0.29 4.82 1.02 -1.26 -0.33 119.74 124.44 3d91 s LYS 258 Ca 0.49 1.10 0.03 0.00 0.02 0.00 0.00 55.97 57.61 3d91 s LYS 258 Cb -0.04 -3.55 0.75 0.00 -0.52 0.00 0.00 37.83 34.46 3d91 s LYS 258 CO 0.29 -0.28 1.43 0.00 -0.92 0.00 0.00 175.35 175.87 3d91 h ASN 260 N 0.00 -1.22 -0.09 0.00 7.08 -1.51 -2.61 115.58 117.23 3d91 h ASN 260 Ca 0.57 0.14 -0.02 0.00 -3.08 0.00 0.00 56.30 53.91 3d91 h ASN 260 Cb 1.22 0.46 -0.01 0.00 -2.08 0.00 0.00 38.32 37.92 3d91 h ASN 260 CO -0.85 -0.47 0.03 -1.84 -2.08 0.00 0.00 177.43 172.21 3d91 n GLU 261 N -5.46 1.42 -0.07 4.14 0.28 0.52 -4.09 120.64 117.37 3d91 n GLU 261 Ca -0.07 -0.41 -0.09 0.00 -0.16 0.00 0.00 57.16 56.43 3d91 n GLU 261 Cb 0.37 -1.47 -0.06 0.00 1.43 0.00 0.00 31.44 31.71 3d91 n GLU 261 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 3d91 h GLY 262 N 4.51 0.00 1.14 -1.84 0.00 -1.19 -3.35 103.07 102.33 3d91 h GLY 262 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3d91 h GLY 262 CO 0.09 0.00 0.00 -1.05 0.00 0.00 0.00 176.54 175.58 3d91 n PRO 263 N -4.63 0.17 0.00 4.80 -0.02 -1.26 -1.73 135.00 132.33 3d91 n PRO 263 Ca -0.11 0.05 0.09 0.00 -2.02 0.00 0.00 63.50 61.52 3d91 n PRO 263 Cb 0.33 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.29 3d91 n PRO 263 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3d91 n THR 264 N -1.07 0.00 -1.71 3.45 -2.24 -1.26 -4.92 114.28 106.54 3d91 n THR 264 Ca 0.04 -0.28 -0.36 0.00 -2.27 0.00 0.00 64.05 61.19 3d91 n THR 264 Cb 0.03 1.18 0.07 0.00 -2.10 0.00 0.00 70.33 69.51 3d91 n THR 264 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3d91 s LEU 265 N -2.27 3.51 0.64 3.22 1.43 -0.71 -4.99 118.68 119.51 3d91 s LEU 265 Ca 0.14 2.49 -0.16 0.00 -1.03 0.00 0.00 54.13 55.57 3d91 s LEU 265 Cb 0.14 -4.60 -0.01 0.00 0.03 0.00 0.00 46.19 41.75 3d91 s LEU 265 CO 0.50 -1.99 1.11 -2.16 0.23 0.00 0.00 176.35 174.03 3d91 s PRO 266 N -3.53 2.92 0.33 1.29 0.04 -1.26 -4.42 135.00 130.37 3d91 s PRO 266 Ca 0.79 1.40 -0.29 0.00 0.04 0.00 0.00 61.00 62.95 3d91 s PRO 266 Cb -0.33 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.14 3d91 s PRO 266 CO 0.40 -1.16 1.40 -0.51 0.04 0.00 0.00 177.00 177.18 3d91 s ASP 267 N -2.49 6.58 -0.09 6.66 1.11 -1.26 -4.39 116.67 122.80 3d91 s ASP 267 Ca 0.67 2.83 0.00 0.00 0.18 0.00 0.00 52.55 56.23 3d91 s ASP 267 Cb -0.21 -2.65 -0.03 0.00 1.07 0.00 0.00 42.92 41.11 3d91 s ASP 267 CO 0.39 -0.70 -0.08 -0.63 1.18 0.00 0.00 175.17 175.33 3d91 s ILE 268 N -0.91 3.58 -0.03 0.77 1.01 0.47 -1.96 121.20 124.12 3d91 s ILE 268 Ca 0.52 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.69 3d91 s ILE 268 Cb -0.43 -2.48 0.00 0.00 0.01 0.00 0.00 42.46 39.56 3d91 s ILE 268 CO 0.55 0.57 -0.10 -0.44 0.00 0.00 0.00 174.94 175.51 3d91 s SER 269 N -0.43 1.41 -0.16 3.58 0.01 0.44 0.37 113.70 118.92 3d91 s SER 269 Ca 0.06 -0.22 -0.04 0.00 1.31 0.00 0.00 55.95 57.06 3d91 s SER 269 Cb -0.12 -0.44 -0.03 0.00 0.21 0.00 0.00 66.02 65.64 3d91 s SER 269 CO 0.02 0.07 -0.02 -0.36 0.41 0.00 0.00 173.24 173.36 3d91 s PHE 270 N 0.28 3.07 -0.32 2.43 0.08 0.23 -0.21 117.98 123.54 3d91 s PHE 270 Ca -0.05 -0.21 -0.12 0.00 0.12 0.00 0.00 56.93 56.66 3d91 s PHE 270 Cb -0.10 -1.97 -0.03 0.00 -0.57 0.00 0.00 43.02 40.35 3d91 s PHE 270 CO 0.01 0.02 0.23 -1.58 -0.10 0.00 0.00 175.22 173.80 3d91 s HIS 271 N 0.31 3.23 -0.19 0.36 5.65 -0.79 -1.16 115.29 122.70 3d91 s HIS 271 Ca -0.02 -0.09 -0.05 0.00 0.25 0.00 0.00 55.06 55.15 3d91 s HIS 271 Cb -0.14 -2.45 0.09 0.00 -1.18 0.00 0.00 32.58 28.90 3d91 s HIS 271 CO 0.02 -0.30 0.32 -0.51 -0.65 0.00 0.00 174.74 173.63 3d91 s LEU 272 N 1.75 -0.43 0.00 8.88 1.43 -1.09 -2.54 118.68 126.68 3d91 s LEU 272 Ca 0.07 0.44 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 3d91 s LEU 272 Cb -0.17 0.89 0.00 0.00 0.03 0.00 0.00 46.19 46.94 3d91 s LEU 272 CO 0.11 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.03 3d91 n GLY 273 N 5.36 0.11 0.27 -3.19 0.00 -1.26 -3.62 105.19 102.86 3d91 n GLY 273 Ca -0.06 -0.93 -0.15 0.00 0.00 0.00 0.00 46.02 44.88 3d91 n GLY 273 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3d91 h GLY 274 N 0.00 -0.66 -2.24 -0.02 0.00 -1.97 -3.47 103.07 94.71 3d91 h GLY 274 Ca 0.00 0.24 -0.54 0.00 0.00 0.00 0.00 47.33 47.03 3d91 h GLY 274 CO 0.00 -0.24 -0.62 1.17 0.00 0.00 0.00 176.54 176.85 3d91 n LYS 275 N -5.27 -0.08 -4.66 4.80 4.81 -1.24 -5.04 118.16 111.48 3d91 n LYS 275 Ca -0.11 0.02 -0.33 0.00 -0.87 0.00 0.00 58.31 57.02 3d91 n LYS 275 Cb 0.30 -1.77 -0.13 0.00 0.02 0.00 0.00 35.03 33.45 3d91 n LYS 275 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 3d91 s GLU 276 N -3.21 3.34 -0.23 1.64 0.41 -1.26 -2.66 118.70 116.73 3d91 s GLU 276 Ca 0.58 -0.62 -0.03 0.00 -0.41 0.00 0.00 54.97 54.49 3d91 s GLU 276 Cb -0.25 -2.69 0.00 0.00 -1.78 0.00 0.00 34.13 29.41 3d91 s GLU 276 CO 0.66 0.30 -0.04 0.71 -0.49 0.00 0.00 175.26 176.40 3d91 s TYR 277 N 0.15 3.00 -0.10 1.61 2.02 -0.31 -4.96 117.35 118.76 3d91 s TYR 277 Ca -0.05 -1.13 0.03 0.00 -0.37 0.00 0.00 57.07 55.55 3d91 s TYR 277 Cb -0.14 -2.10 -0.01 0.00 -0.40 0.00 0.00 41.96 39.31 3d91 s TYR 277 CO 0.04 -0.61 -0.21 0.99 -1.57 0.00 0.00 175.55 174.19 3d91 s THR 278 N 1.43 2.31 -0.18 -0.71 2.01 -1.26 0.75 115.64 120.00 3d91 s THR 278 Ca 0.04 -0.94 -0.07 0.00 0.31 0.00 0.00 61.69 61.04 3d91 s THR 278 Cb -0.15 -1.90 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 3d91 s THR 278 CO -0.03 0.55 0.04 -0.76 -0.69 0.00 0.00 174.62 173.73 3d91 s LEU 279 N 0.25 3.70 0.26 4.42 1.43 0.16 -4.97 118.68 123.93 3d91 s LEU 279 Ca -0.15 0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 52.95 3d91 s LEU 279 Cb -0.17 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.08 3d91 s LEU 279 CO 0.07 0.17 0.51 0.42 0.23 0.00 0.00 176.35 177.75 3d91 s THR 280 N 0.38 5.07 0.57 5.49 -4.23 -1.26 -0.40 115.64 121.26 3d91 s THR 280 Ca 0.02 -0.06 0.28 0.00 -1.18 0.00 0.00 61.69 60.75 3d91 s THR 280 Cb -0.13 -3.73 0.40 0.00 1.34 0.00 0.00 72.50 70.38 3d91 s THR 280 CO 0.01 -0.27 1.94 0.77 -0.54 0.00 0.00 174.62 176.52 3d91 h SER 281 N 1.79 0.00 0.42 3.99 4.64 -1.77 2.67 113.55 125.28 3d91 h SER 281 Ca -0.48 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.83 3d91 h SER 281 Cb 1.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3d91 h SER 281 CO 0.67 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 176.58 3d91 h ALA 282 N 1.57 1.13 0.00 5.18 0.00 -1.88 -0.98 119.26 124.27 3d91 h ALA 282 Ca 0.25 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.92 3d91 h ALA 282 Cb 1.17 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 3d91 h ALA 282 CO -0.00 0.06 -1.40 -0.44 0.00 0.00 0.00 179.25 177.47 3d91 h ASP 283 N 0.00 0.00 -0.08 0.00 3.32 0.43 -3.40 116.42 116.69 3d91 h ASP 283 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3d91 h ASP 283 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 3d91 h ASP 283 CO 0.01 0.69 0.00 0.00 -1.72 0.00 0.00 179.24 178.22 3d91 n TYR 284 N -2.97 0.11 -4.83 4.55 0.18 -0.95 -4.94 117.16 108.31 3d91 n TYR 284 Ca -0.10 -0.47 -0.27 0.00 1.88 0.00 0.00 57.90 58.94 3d91 n TYR 284 Cb 0.89 -0.04 -0.17 0.00 -0.38 0.00 0.00 39.34 39.64 3d91 n TYR 284 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 3d91 s VAL 285 N -0.95 1.48 -1.11 -3.48 1.01 -0.39 0.48 120.40 117.45 3d91 s VAL 285 Ca 0.06 -0.69 -0.22 0.00 0.00 0.00 0.00 61.98 61.13 3d91 s VAL 285 Cb 0.03 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 35.11 3d91 s VAL 285 CO 0.04 0.43 1.72 -0.36 0.00 0.00 0.00 175.10 176.93 3d91 s PHE 286 N 0.48 2.35 -1.45 5.22 0.08 0.15 -4.84 117.98 119.96 3d91 s PHE 286 Ca -0.15 -0.53 -0.12 0.00 0.12 0.00 0.00 56.93 56.25 3d91 s PHE 286 Cb -0.16 -4.46 -0.04 0.00 -0.57 0.00 0.00 43.02 37.80 3d91 s PHE 286 CO 0.05 -1.73 2.53 0.94 -0.10 0.00 0.00 175.22 176.91 3d91 n GLN 287 N 8.63 3.09 0.00 0.44 -0.06 -1.26 -4.01 117.38 124.20 3d91 n GLN 287 Ca 0.41 -2.30 0.00 0.00 -2.00 0.00 0.00 57.00 53.12 3d91 n GLN 287 Cb 0.48 -2.99 0.00 0.00 -4.06 0.00 0.00 30.24 23.67 3d91 n GLN 287 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 3d91 n GLU 288 N 4.92 0.91 0.00 3.69 2.13 -1.26 -4.82 120.64 126.22 3d91 n GLU 288 Ca 0.63 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.45 3d91 n GLU 288 Cb 0.30 -1.42 0.00 0.00 0.27 0.00 0.00 31.44 30.59 3d91 n GLU 288 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 3d91 n SER 289 N 0.09 0.00 -0.15 4.31 3.41 -1.26 -5.01 113.62 115.01 3d91 n SER 289 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 3d91 n SER 289 Cb 0.25 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.35 3d91 n SER 289 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3d91 n TYR 290 N -1.31 0.07 -1.53 7.33 0.53 -1.26 -4.70 117.16 116.28 3d91 n TYR 290 Ca 0.00 -1.01 -0.36 0.00 -1.02 0.00 0.00 57.90 55.51 3d91 n TYR 290 Cb 0.00 -0.17 0.08 0.00 -1.03 0.00 0.00 39.34 38.22 3d91 n TYR 290 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 3d91 n SER 291 N -1.36 1.19 0.17 7.72 2.88 -1.26 -3.41 113.62 119.55 3d91 n SER 291 Ca 0.17 0.75 0.08 0.00 -1.33 0.00 0.00 58.87 58.54 3d91 n SER 291 Cb 0.66 -1.47 0.09 0.00 -0.75 0.00 0.00 64.21 62.74 3d91 n SER 291 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3d91 h SER 292 N 0.13 0.00 0.00 -3.46 0.02 -1.96 -2.82 113.55 105.45 3d91 h SER 292 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 3d91 h SER 292 Cb 1.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.88 3d91 h SER 292 CO 0.50 0.18 0.00 0.29 -1.14 0.00 0.00 176.83 176.66 3d91 n LYS 293 N -3.08 0.55 -2.82 3.45 4.01 -1.26 -4.80 118.16 114.22 3d91 n LYS 293 Ca 0.02 -0.29 -0.35 0.00 -0.51 0.00 0.00 58.31 57.17 3d91 n LYS 293 Cb 0.61 -0.77 -0.07 0.00 -0.51 0.00 0.00 35.03 34.30 3d91 n LYS 293 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 3d91 s LYS 294 N -0.16 4.42 -0.13 1.97 -0.14 -1.25 -5.01 119.74 119.44 3d91 s LYS 294 Ca 0.00 1.21 -0.10 0.00 -1.36 0.00 0.00 55.97 55.72 3d91 s LYS 294 Cb 0.00 -2.56 -0.05 0.00 -1.68 0.00 0.00 37.83 33.55 3d91 s LYS 294 CO 0.00 0.16 0.20 -0.51 -0.76 0.00 0.00 175.35 174.45 3d91 s LEU 295 N -2.51 4.33 0.03 3.17 1.43 -1.26 -2.06 118.68 121.81 3d91 s LEU 295 Ca 0.55 0.48 0.08 0.00 -1.03 0.00 0.00 54.13 54.21 3d91 s LEU 295 Cb -0.15 -2.20 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 3d91 s LEU 295 CO 0.19 0.28 -0.22 0.00 0.23 0.00 0.00 176.35 176.84 3d91 s THR 297 N -0.83 5.09 -0.06 0.00 2.01 -1.26 -1.96 115.64 118.64 3d91 s THR 297 Ca 0.13 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.89 3d91 s THR 297 Cb -0.10 -3.23 -0.02 0.00 0.01 0.00 0.00 72.50 69.15 3d91 s THR 297 CO 0.03 0.56 1.06 -0.76 -0.69 0.00 0.00 174.62 174.82 3d91 s LEU 298 N -0.54 4.29 0.00 4.42 1.43 -1.16 0.30 118.68 127.42 3d91 s LEU 298 Ca 0.11 1.66 -0.02 0.00 -1.03 0.00 0.00 54.13 54.85 3d91 s LEU 298 Cb -0.12 -3.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.45 3d91 s LEU 298 CO 0.02 -0.44 2.01 0.00 0.23 0.00 0.00 176.35 178.16 3d91 n ALA 299 N 4.74 3.97 -3.08 4.21 0.00 0.18 -4.65 120.51 125.87 3d91 n ALA 299 Ca 0.09 -0.59 -0.13 0.00 0.00 0.00 0.00 53.44 52.81 3d91 n ALA 299 Cb 0.48 -1.75 -0.12 0.00 0.00 0.00 0.00 19.45 18.06 3d91 n ALA 299 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3d91 s ILE 300 N 1.04 0.00 0.18 0.00 1.01 -1.26 -3.08 121.20 119.10 3d91 s ILE 300 Ca 0.22 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.78 3d91 s ILE 300 Cb 0.10 -0.29 0.02 0.00 0.01 0.00 0.00 42.46 42.31 3d91 s ILE 300 CO 0.00 -0.02 0.35 0.00 0.00 0.00 0.00 174.94 175.27 3d91 n HIS 301 N 2.90 -1.53 -4.56 3.97 1.44 -0.46 -4.60 115.22 112.39 3d91 n HIS 301 Ca -0.13 -0.92 -0.34 0.00 -2.01 0.00 0.00 57.72 54.32 3d91 n HIS 301 Cb 0.58 0.41 -0.11 0.00 0.12 0.00 0.00 29.99 31.00 3d91 n HIS 301 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3d91 s ALA 302 N -1.62 3.04 -0.11 1.59 0.00 -1.26 -3.03 121.76 120.37 3d91 s ALA 302 Ca 0.09 -0.87 -0.10 0.00 0.00 0.00 0.00 51.96 51.08 3d91 s ALA 302 Cb -0.02 -1.30 0.03 0.00 0.00 0.00 0.00 23.12 21.82 3d91 s ALA 302 CO 0.06 0.54 0.29 1.41 0.00 0.00 0.00 175.76 178.06 3d91 s MET 303 N -0.71 0.35 -0.32 0.00 1.75 -0.56 -4.90 119.30 114.91 3d91 s MET 303 Ca 0.11 0.38 -0.06 0.00 -1.25 0.00 0.00 55.69 54.87 3d91 s MET 303 Cb -0.11 0.17 0.03 0.00 2.84 0.00 0.00 34.83 37.76 3d91 s MET 303 CO 0.02 -0.04 0.09 -0.51 -0.65 0.00 0.00 175.02 173.92 3d91 s ASP 304 N 0.11 5.21 -0.12 1.11 1.01 -1.26 -3.88 116.67 118.84 3d91 s ASP 304 Ca -0.00 -1.04 -0.22 0.00 0.71 0.00 0.00 52.55 52.00 3d91 s ASP 304 Cb -0.02 -1.85 -0.03 0.00 1.01 0.00 0.00 42.92 42.02 3d91 s ASP 304 CO 0.00 -0.28 0.64 -0.63 0.21 0.00 0.00 175.17 175.11 3d91 s ILE 305 N 1.41 5.06 0.62 0.77 1.01 -1.26 -5.04 121.20 123.76 3d91 s ILE 305 Ca -0.01 1.28 -0.15 0.00 0.00 0.00 0.00 60.65 61.77 3d91 s ILE 305 Cb -0.19 -3.97 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 3d91 s ILE 305 CO 0.02 0.21 1.06 -2.16 0.00 0.00 0.00 174.94 174.07 3d91 s PRO 306 N 1.20 3.23 1.14 2.79 0.04 -1.26 -3.71 135.00 138.43 3d91 s PRO 306 Ca 0.32 1.15 -0.15 0.00 0.04 0.00 0.00 61.00 62.37 3d91 s PRO 306 Cb -0.16 -2.02 0.26 0.00 0.04 0.00 0.00 34.50 32.61 3d91 s PRO 306 CO 0.14 -0.88 1.06 -2.14 0.04 0.00 0.00 177.00 175.22 3d91 s PRO 307 N -4.27 -0.71 0.39 0.56 0.02 -1.18 -0.94 135.00 128.86 3d91 s PRO 307 Ca 0.62 0.46 0.11 0.00 0.02 0.00 0.00 61.00 62.21 3d91 s PRO 307 Cb -0.16 -1.61 0.91 0.00 0.02 0.00 0.00 34.50 33.67 3d91 s PRO 307 CO 0.41 -3.48 1.92 -1.00 -0.33 0.00 0.00 177.00 174.52 3d91 h PRO 308 N -2.43 0.55 -0.46 5.54 0.13 -2.05 -3.43 132.00 129.85 3d91 h PRO 308 Ca -0.55 -0.03 -0.11 0.00 -0.87 0.00 0.00 66.00 64.44 3d91 h PRO 308 Cb 1.33 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 3d91 h PRO 308 CO 0.49 0.37 -0.14 1.15 -0.23 0.00 0.00 178.00 179.63 3d91 h THR 309 N 0.57 1.27 -1.89 1.56 2.02 -1.94 -3.45 112.91 111.06 3d91 h THR 309 Ca 0.36 -1.28 -0.46 0.00 0.77 0.00 0.00 66.41 65.80 3d91 h THR 309 Cb 0.63 1.13 0.05 0.00 -1.74 0.00 0.00 68.15 68.23 3d91 h THR 309 CO -0.13 0.44 -0.01 -0.83 0.37 0.00 0.00 175.52 175.35 3d91 s GLY 310 N -3.61 1.79 0.21 2.16 0.00 -0.12 -4.50 107.32 103.25 3d91 s GLY 310 Ca -0.12 -1.70 -0.30 0.00 0.00 0.00 0.00 44.72 42.60 3d91 s GLY 310 CO 0.85 -1.27 1.19 -4.14 0.00 0.00 0.00 173.10 169.72 3d91 s PRO 311 N -4.85 4.51 0.11 2.90 0.02 -1.24 -3.13 135.00 133.31 3d91 s PRO 311 Ca 0.62 1.88 -0.16 0.00 0.02 0.00 0.00 61.00 63.36 3d91 s PRO 311 Cb -0.07 -3.22 0.03 0.00 0.02 0.00 0.00 34.50 31.26 3d91 s PRO 311 CO 0.40 -0.04 0.39 -0.08 -0.33 0.00 0.00 177.00 177.34 3d91 s THR 312 N -0.28 0.07 0.77 0.99 -1.32 -1.26 -4.69 115.64 109.91 3d91 s THR 312 Ca 0.51 -0.60 -0.10 0.00 -1.21 0.00 0.00 61.69 60.30 3d91 s THR 312 Cb -0.33 -1.14 0.07 0.00 -1.51 0.00 0.00 72.50 69.60 3d91 s THR 312 CO 0.38 -0.33 1.12 0.26 -2.21 0.00 0.00 174.62 173.84 3d91 s TRP 313 N -3.57 2.94 -0.12 9.09 0.52 -0.87 -4.34 118.94 122.60 3d91 s TRP 313 Ca 0.02 0.64 -0.06 0.00 0.02 0.00 0.00 56.10 56.71 3d91 s TRP 313 Cb 0.02 -3.39 0.05 0.00 -1.15 0.00 0.00 33.47 29.00 3d91 s TRP 313 CO -0.10 -1.64 0.28 0.00 0.02 0.00 0.00 176.95 175.51 3d91 s ALA 314 N -3.46 -0.66 -0.61 0.98 0.00 -0.28 -1.84 121.76 115.89 3d91 s ALA 314 Ca 0.61 1.07 -0.10 0.00 0.00 0.00 0.00 51.96 53.55 3d91 s ALA 314 Cb -0.11 -0.67 0.16 0.00 0.00 0.00 0.00 23.12 22.50 3d91 s ALA 314 CO 0.47 -0.20 0.50 -0.51 0.00 0.00 0.00 175.76 176.02 3d91 s LEU 315 N 1.18 5.96 0.00 0.00 1.43 0.21 -1.90 118.68 125.55 3d91 s LEU 315 Ca -0.08 -2.32 0.00 0.00 -1.03 0.00 0.00 54.13 50.70 3d91 s LEU 315 Cb -0.09 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 44.07 3d91 s LEU 315 CO -0.08 -0.61 0.00 0.61 0.23 0.00 0.00 176.35 176.49 3d91 n GLY 316 N 4.39 0.50 0.44 -3.19 0.00 -0.88 -2.70 105.19 103.74 3d91 n GLY 316 Ca 0.01 -1.84 0.25 0.00 0.00 0.00 0.00 46.02 44.44 3d91 n GLY 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d91 h ALA 317 N -1.42 2.52 -0.59 4.61 0.00 -0.22 0.17 119.26 124.33 3d91 h ALA 317 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d91 h ALA 317 Cb 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3d91 h ALA 317 CO 0.00 -0.83 0.38 1.15 0.00 0.00 0.00 179.25 179.95 3d91 h THR 318 N 0.22 1.16 0.16 0.00 2.02 -1.81 0.32 112.91 114.98 3d91 h THR 318 Ca 0.49 -0.30 -0.23 0.00 0.77 0.00 0.00 66.41 67.14 3d91 h THR 318 Cb 1.53 0.30 0.02 0.00 -1.74 0.00 0.00 68.15 68.26 3d91 h THR 318 CO -0.12 0.15 -1.02 0.15 0.37 0.00 0.00 175.52 175.05 3d91 h PHE 319 N 0.80 0.63 -0.03 3.16 3.04 -0.98 -3.37 116.94 120.19 3d91 h PHE 319 Ca 0.21 -0.46 -0.16 0.00 3.98 0.00 0.00 57.97 61.54 3d91 h PHE 319 Cb -0.07 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.40 3d91 h PHE 319 CO 0.00 1.39 -0.72 0.82 -2.02 0.00 0.00 178.31 177.78 3d91 h ILE 320 N -0.25 1.44 -0.61 1.41 2.04 -1.00 -2.62 117.51 117.92 3d91 h ILE 320 Ca -0.18 -2.28 0.18 0.00 1.00 0.00 0.00 64.86 63.58 3d91 h ILE 320 Cb 1.77 2.21 -0.02 0.00 -0.74 0.00 0.00 36.82 40.04 3d91 h ILE 320 CO 0.17 0.66 0.60 0.03 0.00 0.00 0.00 178.15 179.62 3d91 h ARG 321 N 0.12 0.00 0.00 2.37 3.08 -0.55 -2.14 114.38 117.27 3d91 h ARG 321 Ca -0.02 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.79 3d91 h ARG 321 Cb 1.27 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.27 3d91 h ARG 321 CO 0.11 0.00 -2.05 1.17 -1.07 0.00 0.00 179.97 178.12 3d91 n LYS 322 N -3.74 1.22 -3.85 0.04 4.81 -1.07 -4.72 118.16 110.84 3d91 n LYS 322 Ca 0.12 -0.03 -0.30 0.00 -0.87 0.00 0.00 58.31 57.22 3d91 n LYS 322 Cb 0.83 -1.41 -0.15 0.00 0.02 0.00 0.00 35.03 34.32 3d91 n LYS 322 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3d91 s PHE 323 N -2.53 2.62 0.03 5.64 0.08 -0.81 -0.17 117.98 122.84 3d91 s PHE 323 Ca -0.08 -2.46 -0.38 0.00 0.12 0.00 0.00 56.93 54.14 3d91 s PHE 323 Cb 0.06 -2.28 -0.18 0.00 -0.57 0.00 0.00 43.02 40.05 3d91 s PHE 323 CO 0.67 -0.87 1.30 0.98 -0.10 0.00 0.00 175.22 177.20 3d91 n TYR 324 N 4.21 1.31 -4.78 0.36 4.19 0.10 -4.50 117.16 118.05 3d91 n TYR 324 Ca 0.03 0.76 -0.32 0.00 3.31 0.00 0.00 57.90 61.68 3d91 n TYR 324 Cb 0.39 -2.27 -0.13 0.00 0.49 0.00 0.00 39.34 37.83 3d91 n TYR 324 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 3d91 s THR 325 N 0.58 3.04 -0.13 2.97 2.01 -1.16 -1.02 115.64 121.93 3d91 s THR 325 Ca 0.87 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 62.03 3d91 s THR 325 Cb -1.06 -2.23 0.02 0.00 0.01 0.00 0.00 72.50 69.24 3d91 s THR 325 CO 0.51 0.50 -0.17 -0.70 -0.69 0.00 0.00 174.62 174.07 3d91 s GLU 326 N -1.01 2.53 -0.44 4.92 2.12 -0.57 -0.44 118.70 125.80 3d91 s GLU 326 Ca 0.13 -0.66 -0.12 0.00 0.36 0.00 0.00 54.97 54.68 3d91 s GLU 326 Cb -0.11 -2.16 0.08 0.00 0.26 0.00 0.00 34.13 32.21 3d91 s GLU 326 CO 0.03 -0.11 0.32 -0.06 -0.54 0.00 0.00 175.26 174.90 3d91 s PHE 327 N 1.10 3.31 -0.56 5.30 0.08 0.44 -2.07 117.98 125.59 3d91 s PHE 327 Ca -0.03 -1.34 -0.16 0.00 0.12 0.00 0.00 56.93 55.52 3d91 s PHE 327 Cb -0.14 -3.09 0.13 0.00 -0.57 0.00 0.00 43.02 39.34 3d91 s PHE 327 CO -0.05 -0.85 0.54 0.34 -0.10 0.00 0.00 175.22 175.10 3d91 s ASP 328 N 2.37 6.20 0.15 1.36 -1.08 -0.65 -2.17 116.67 122.85 3d91 s ASP 328 Ca 0.04 -1.76 -0.05 0.00 -0.52 0.00 0.00 52.55 50.26 3d91 s ASP 328 Cb -0.24 -2.22 -0.02 0.00 -1.46 0.00 0.00 42.92 38.98 3d91 s ASP 328 CO 0.03 -0.89 1.38 0.03 0.52 0.00 0.00 175.17 176.25 3d91 h ARG 329 N 8.91 0.50 -0.55 4.34 2.47 -0.71 -1.58 114.38 127.76 3d91 h ARG 329 Ca -0.29 -0.43 0.00 0.00 -1.26 0.00 0.00 59.98 58.00 3d91 h ARG 329 Cb 1.10 0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 29.48 3d91 h ARG 329 CO 1.04 1.06 0.35 -0.09 0.56 0.00 0.00 179.97 182.89 3d91 h ARG 330 N 0.34 0.74 -0.01 0.04 9.65 -1.92 -3.14 114.38 120.07 3d91 h ARG 330 Ca -0.04 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.78 3d91 h ARG 330 Cb 1.37 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 29.79 3d91 h ARG 330 CO 0.14 0.51 -0.52 0.09 2.80 0.00 0.00 179.97 182.99 3d91 n ASN 331 N -4.68 1.24 -3.64 -3.80 5.03 -1.24 -5.01 115.26 103.17 3d91 n ASN 331 Ca 0.03 -0.99 -0.26 0.00 0.87 0.00 0.00 54.58 54.22 3d91 n ASN 331 Cb 0.04 0.44 0.03 0.00 -1.02 0.00 0.00 39.78 39.26 3d91 n ASN 331 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3d91 n ASN 332 N -0.78 -5.55 -3.62 6.41 3.02 -0.64 -4.87 115.26 109.24 3d91 n ASN 332 Ca 0.08 -0.88 -0.10 0.00 -0.03 0.00 0.00 54.58 53.65 3d91 n ASN 332 Cb 0.38 -3.21 -0.04 0.00 -0.61 0.00 0.00 39.78 36.30 3d91 n ASN 332 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3d91 s ARG 333 N -5.42 1.20 -0.12 3.52 1.70 -0.93 -0.74 118.95 118.16 3d91 s ARG 333 Ca 0.31 -0.71 0.02 0.00 -0.47 0.00 0.00 55.73 54.88 3d91 s ARG 333 Cb -0.12 0.51 0.01 0.00 -0.57 0.00 0.00 34.95 34.78 3d91 s ARG 333 CO 0.86 -0.49 -0.16 0.42 -1.08 0.00 0.00 175.30 174.84 3d91 s ILE 334 N -3.81 1.59 0.05 4.99 1.01 -0.23 -1.64 121.20 123.15 3d91 s ILE 334 Ca 0.04 -0.69 -0.02 0.00 0.00 0.00 0.00 60.65 59.99 3d91 s ILE 334 Cb 0.00 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.99 3d91 s ILE 334 CO -0.10 0.46 0.23 -0.83 0.00 0.00 0.00 174.94 174.70 3d91 s GLY 335 N 1.00 2.20 0.06 6.18 0.00 -0.88 -0.56 107.32 115.32 3d91 s GLY 335 Ca -0.06 -0.77 0.07 0.00 0.00 0.00 0.00 44.72 43.97 3d91 s GLY 335 CO -0.02 -0.71 -0.16 -1.36 0.00 0.00 0.00 173.10 170.85 3d91 s PHE 336 N -1.47 2.60 0.05 1.90 0.08 -0.49 -1.51 117.98 119.15 3d91 s PHE 336 Ca 0.33 -0.23 0.01 0.00 0.12 0.00 0.00 56.93 57.17 3d91 s PHE 336 Cb -0.13 -1.45 -0.03 0.00 -0.57 0.00 0.00 43.02 40.84 3d91 s PHE 336 CO 0.25 0.31 -0.05 0.00 -0.10 0.00 0.00 175.22 175.62 3d91 s ALA 337 N -1.00 0.56 0.06 5.36 0.00 -0.19 -2.59 121.76 123.97 3d91 s ALA 337 Ca 0.16 -1.00 -0.31 0.00 0.00 0.00 0.00 51.96 50.82 3d91 s ALA 337 Cb -0.11 0.16 -0.08 0.00 0.00 0.00 0.00 23.12 23.09 3d91 s ALA 337 CO 0.07 -0.20 1.70 -1.17 0.00 0.00 0.00 175.76 176.16 3d91 s LEU 338 N -2.29 4.37 0.44 0.00 0.20 -1.24 0.01 118.68 120.18 3d91 s LEU 338 Ca -0.01 2.52 -0.24 0.00 0.69 0.00 0.00 54.13 57.09 3d91 s LEU 338 Cb -0.01 -3.56 -0.08 0.00 -0.43 0.00 0.00 46.19 42.11 3d91 s LEU 338 CO -0.04 -0.92 1.19 0.00 -0.29 0.00 0.00 176.35 176.29 3d91 s ALA 339 N 2.89 3.03 -0.05 5.97 0.00 0.76 -0.91 121.76 133.44 3d91 s ALA 339 Ca 0.76 0.99 -0.16 0.00 0.00 0.00 0.00 51.96 53.55 3d91 s ALA 339 Cb -0.40 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.27 3d91 s ALA 339 CO 0.33 -0.67 0.42 1.03 0.00 0.00 0.00 175.76 176.87 3d91 s ARG 340 N -2.57 4.10 0.00 0.00 0.52 0.21 -4.71 118.95 116.51 3d91 s ARG 340 Ca 0.62 0.40 0.00 0.00 -0.52 0.00 0.00 55.73 56.22 3d91 s ARG 340 Cb -0.30 -3.31 0.00 0.00 0.52 0.00 0.00 34.95 31.85 3d91 s ARG 340 CO 0.37 0.47 0.33 0.72 0.02 0.00 0.00 175.30 177.21