#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q8o s SER 3 N 0.00 1.24 -0.12 -2.24 1.04 -1.26 -1.50 113.70 110.85 1q8o s SER 3 Ca 0.00 -0.42 -0.14 0.00 0.48 0.00 0.00 55.95 55.87 1q8o s SER 3 Cb 0.00 -0.06 0.03 0.00 0.10 0.00 0.00 66.02 66.10 1q8o s SER 3 CO 0.00 -0.04 0.37 -0.22 0.98 0.00 0.00 173.24 174.33 1q8o s LEU 4 N -1.11 0.59 -0.09 2.42 2.96 -0.65 -5.01 118.68 117.79 1q8o s LEU 4 Ca -0.02 0.66 -0.22 0.00 -0.22 0.00 0.00 54.13 54.33 1q8o s LEU 4 Cb -0.07 1.30 0.05 0.00 0.50 0.00 0.00 46.19 47.96 1q8o s LEU 4 CO 0.01 -0.18 0.52 -0.94 -1.32 0.00 0.00 176.35 174.43 1q8o s SER 5 N -0.05 -0.48 0.01 3.68 1.04 -1.26 -1.24 113.70 115.40 1q8o s SER 5 Ca -0.02 0.66 -0.15 0.00 0.48 0.00 0.00 55.95 56.92 1q8o s SER 5 Cb -0.03 0.67 0.02 0.00 0.10 0.00 0.00 66.02 66.78 1q8o s SER 5 CO 0.01 -0.41 0.31 0.72 0.98 0.00 0.00 173.24 174.85 1q8o s PHE 6 N -0.71 -0.16 -0.02 5.02 -0.12 -0.34 -4.99 117.98 116.65 1q8o s PHE 6 Ca -0.08 0.17 0.00 0.00 -0.05 0.00 0.00 56.93 56.98 1q8o s PHE 6 Cb -0.03 0.10 0.03 0.00 -0.63 0.00 0.00 43.02 42.49 1q8o s PHE 6 CO 0.05 -0.43 0.01 0.20 -0.05 0.00 0.00 175.22 175.00 1q8o s GLY 7 N -1.58 0.15 -0.59 1.99 0.00 -1.26 -0.51 107.32 105.52 1q8o s GLY 7 Ca -0.11 0.22 0.01 0.00 0.00 0.00 0.00 44.72 44.84 1q8o s GLY 7 CO 0.02 0.58 0.37 -1.36 0.00 0.00 0.00 173.10 172.70 1q8o s PHE 8 N 0.93 3.31 0.33 1.90 0.40 0.26 -4.93 117.98 120.18 1q8o s PHE 8 Ca -0.08 -2.97 0.02 0.00 -0.60 0.00 0.00 56.93 53.30 1q8o s PHE 8 Cb -0.12 -3.00 0.61 0.00 0.51 0.00 0.00 43.02 41.01 1q8o s PHE 8 CO -0.02 -0.78 1.97 -1.35 0.70 0.00 0.00 175.22 175.74 1q8o h PRO 9 N 6.68 0.89 0.00 0.24 0.11 -1.90 -1.09 132.00 136.94 1q8o h PRO 9 Ca -0.04 -0.05 -0.23 0.00 0.11 0.00 0.00 66.00 65.79 1q8o h PRO 9 Cb 0.91 -0.20 -0.06 0.00 0.11 0.00 0.00 31.00 31.76 1q8o h PRO 9 CO 0.70 0.59 -0.19 0.25 -0.21 0.00 0.00 178.00 179.14 1q8o n THR 10 N -4.45 0.00 -3.70 -1.15 -2.24 -1.26 -4.45 114.28 97.03 1q8o n THR 10 Ca 0.10 -1.29 -0.28 0.00 -2.27 0.00 0.00 64.05 60.31 1q8o n THR 10 Cb 0.12 0.70 -0.11 0.00 -2.10 0.00 0.00 70.33 68.94 1q8o n THR 10 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1q8o s PHE 11 N -3.25 2.51 0.84 4.78 0.08 -0.10 -4.93 117.98 117.92 1q8o s PHE 11 Ca 0.21 -2.87 -0.12 0.00 0.12 0.00 0.00 56.93 54.26 1q8o s PHE 11 Cb 0.00 -1.99 0.10 0.00 -0.57 0.00 0.00 43.02 40.57 1q8o s PHE 11 CO 0.15 -0.68 1.19 -2.14 -0.10 0.00 0.00 175.22 173.65 1q8o s PRO 12 N -0.69 1.41 0.20 0.24 0.02 -1.26 -3.39 135.00 131.54 1q8o s PRO 12 Ca 0.27 1.71 0.22 0.00 0.02 0.00 0.00 61.00 63.22 1q8o s PRO 12 Cb -0.04 -1.75 0.91 0.00 0.02 0.00 0.00 34.50 33.63 1q8o s PRO 12 CO -0.15 -2.37 1.68 -1.13 -0.33 0.00 0.00 177.00 174.69 1q8o n SER 13 N -3.60 0.55 -3.82 2.53 3.41 -1.26 -4.11 113.62 107.31 1q8o n SER 13 Ca 0.13 0.62 -0.42 0.00 -0.26 0.00 0.00 58.87 58.94 1q8o n SER 13 Cb 0.51 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 1q8o n SER 13 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1q8o n ASP 14 N -2.09 5.60 -4.84 4.04 4.64 -1.26 -4.99 116.55 117.65 1q8o n ASP 14 Ca 0.03 -3.14 -0.37 0.00 -1.38 0.00 0.00 54.79 49.93 1q8o n ASP 14 Cb 0.24 -1.44 -0.06 0.00 -1.04 0.00 0.00 41.12 38.82 1q8o n ASP 14 CO 0.00 0.00 0.00 -1.10 -0.82 0.00 0.00 177.20 175.28 1q8o s GLN 15 N -0.09 3.97 0.00 -0.67 -1.52 -1.26 -4.98 119.66 115.11 1q8o s GLN 15 Ca 0.41 0.47 0.00 0.00 -1.95 0.00 0.00 55.36 54.29 1q8o s GLN 15 Cb 0.11 -3.08 0.00 0.00 -0.22 0.00 0.00 33.01 29.81 1q8o s GLN 15 CO -0.00 0.58 0.00 1.63 -0.25 0.00 0.00 175.29 177.25 1q8o n LYS 16 N 1.28 3.22 -0.70 2.91 4.76 -1.26 -4.79 118.16 123.57 1q8o n LYS 16 Ca -0.09 0.00 0.03 0.00 -2.87 0.00 0.00 58.31 55.38 1q8o n LYS 16 Cb 0.52 -0.96 0.29 0.00 -1.84 0.00 0.00 35.03 33.03 1q8o n LYS 16 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1q8o n ASN 17 N -1.81 4.23 -4.36 4.39 3.02 -1.26 -4.95 115.26 114.52 1q8o n ASN 17 Ca 0.00 -3.15 -0.33 0.00 -0.03 0.00 0.00 54.58 51.07 1q8o n ASN 17 Cb 0.39 -0.63 -0.14 0.00 -0.61 0.00 0.00 39.78 38.79 1q8o n ASN 17 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1q8o s LEU 18 N -2.92 2.67 -0.33 3.41 1.43 -1.26 -0.28 118.68 121.40 1q8o s LEU 18 Ca 0.48 -0.34 -0.17 0.00 -1.03 0.00 0.00 54.13 53.07 1q8o s LEU 18 Cb 0.39 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 45.00 1q8o s LEU 18 CO 0.10 0.17 0.47 -0.63 0.23 0.00 0.00 176.35 176.70 1q8o s ILE 19 N 0.29 5.06 -0.19 -0.59 1.01 0.11 -4.92 121.20 121.98 1q8o s ILE 19 Ca -0.10 0.39 -0.11 0.00 0.00 0.00 0.00 60.65 60.82 1q8o s ILE 19 Cb -0.16 -3.89 -0.05 0.00 0.01 0.00 0.00 42.46 38.37 1q8o s ILE 19 CO 0.06 -0.12 0.18 -0.36 0.00 0.00 0.00 174.94 174.71 1q8o s PHE 20 N 2.29 3.43 0.07 3.97 0.08 -1.26 -1.10 117.98 125.45 1q8o s PHE 20 Ca 0.17 0.42 0.07 0.00 0.12 0.00 0.00 56.93 57.71 1q8o s PHE 20 Cb -0.16 -2.22 -0.03 0.00 -0.57 0.00 0.00 43.02 40.05 1q8o s PHE 20 CO 0.12 0.27 -0.18 -0.65 -0.10 0.00 0.00 175.22 174.69 1q8o s GLN 21 N 0.39 1.07 6.14 0.44 -0.21 0.27 -4.99 119.66 122.76 1q8o s GLN 21 Ca 0.11 -0.99 0.00 0.00 0.02 0.00 0.00 55.36 54.50 1q8o s GLN 21 Cb -0.12 -1.19 0.00 0.00 1.00 0.00 0.00 33.01 32.70 1q8o s GLN 21 CO -0.00 0.29 0.00 0.41 -2.12 0.00 0.00 175.29 173.86 1q8o n GLY 22 N 1.45 1.91 1.06 3.09 0.00 -1.26 -1.56 105.19 109.87 1q8o n GLY 22 Ca -0.19 -0.50 0.10 0.00 0.00 0.00 0.00 46.02 45.43 1q8o n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1q8o n ASP 23 N 4.33 3.10 -4.77 1.61 8.00 0.69 -4.94 116.55 124.57 1q8o n ASP 23 Ca 0.00 -1.98 -0.41 0.00 0.71 0.00 0.00 54.79 53.11 1q8o n ASP 23 Cb 0.00 -0.36 -0.02 0.00 -0.02 0.00 0.00 41.12 40.72 1q8o n ASP 23 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1q8o s ALA 24 N -1.27 3.53 0.08 2.24 0.00 -1.15 -4.37 121.76 120.80 1q8o s ALA 24 Ca 0.39 1.32 -0.26 0.00 0.00 0.00 0.00 51.96 53.41 1q8o s ALA 24 Cb 0.21 -3.51 0.08 0.00 0.00 0.00 0.00 23.12 19.90 1q8o s ALA 24 CO 0.27 -0.72 0.79 1.14 0.00 0.00 0.00 175.76 177.24 1q8o s GLN 25 N -1.62 1.05 0.05 0.00 -2.07 -0.80 -4.74 119.66 111.53 1q8o s GLN 25 Ca 0.51 -0.42 -0.23 0.00 -1.82 0.00 0.00 55.36 53.40 1q8o s GLN 25 Cb -0.41 0.46 -0.06 0.00 -1.09 0.00 0.00 33.01 31.91 1q8o s GLN 25 CO 0.53 -0.46 0.69 0.42 -1.32 0.00 0.00 175.29 175.15 1q8o s ILE 26 N -3.38 4.72 -0.20 3.63 -1.09 -1.26 -0.45 121.20 123.17 1q8o s ILE 26 Ca 0.05 1.48 -0.09 0.00 -2.23 0.00 0.00 60.65 59.86 1q8o s ILE 26 Cb -0.01 -4.04 0.08 0.00 -1.58 0.00 0.00 42.46 36.91 1q8o s ILE 26 CO -0.09 0.43 0.46 -0.54 -1.23 0.00 0.00 174.94 173.97 1q8o s LYS 27 N -0.41 0.40 -1.25 2.79 1.02 0.45 -4.91 119.74 117.83 1q8o s LYS 27 Ca 0.35 1.01 -0.00 0.00 0.02 0.00 0.00 55.97 57.34 1q8o s LYS 27 Cb -0.20 0.24 -0.00 0.00 -0.52 0.00 0.00 37.83 37.35 1q8o s LYS 27 CO 0.21 -0.21 0.85 0.09 -0.92 0.00 0.00 175.35 175.38 1q8o n ASN 28 N 4.93 -1.67 -2.35 2.83 3.02 -1.26 -2.01 115.26 118.75 1q8o n ASN 28 Ca -0.15 -0.72 -0.15 0.00 -0.03 0.00 0.00 54.58 53.54 1q8o n ASN 28 Cb 0.52 -4.61 -0.01 0.00 -0.61 0.00 0.00 39.78 35.07 1q8o n ASN 28 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1q8o n ASN 29 N -3.09 -4.38 -4.02 6.41 4.13 -1.25 -4.95 115.26 108.11 1q8o n ASN 29 Ca -0.29 0.16 -0.08 0.00 1.68 0.00 0.00 54.58 56.05 1q8o n ASN 29 Cb 0.67 -3.72 -0.09 0.00 -1.54 0.00 0.00 39.78 35.10 1q8o n ASN 29 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1q8o s ALA 30 N -2.69 0.29 -0.32 5.41 0.00 -0.85 -0.92 121.76 122.69 1q8o s ALA 30 Ca 0.00 -1.04 -0.15 0.00 0.00 0.00 0.00 51.96 50.78 1q8o s ALA 30 Cb 0.00 0.36 -0.02 0.00 0.00 0.00 0.00 23.12 23.46 1q8o s ALA 30 CO 0.00 -0.42 0.34 0.08 0.00 0.00 0.00 175.76 175.76 1q8o s VAL 31 N -3.91 5.19 -0.64 0.00 1.01 -0.13 -0.41 120.40 121.51 1q8o s VAL 31 Ca 0.07 0.20 -0.20 0.00 0.00 0.00 0.00 61.98 62.05 1q8o s VAL 31 Cb 0.07 -3.76 0.10 0.00 0.00 0.00 0.00 36.38 32.80 1q8o s VAL 31 CO -0.10 0.01 0.79 -1.10 0.00 0.00 0.00 175.10 174.71 1q8o s GLN 32 N 2.00 3.11 0.20 2.72 -1.52 0.40 -1.01 119.66 125.56 1q8o s GLN 32 Ca 0.12 -1.28 -0.08 0.00 -1.95 0.00 0.00 55.36 52.16 1q8o s GLN 32 Cb -0.16 -4.31 0.12 0.00 -0.22 0.00 0.00 33.01 28.44 1q8o s GLN 32 CO 0.11 -1.61 1.71 -0.07 -0.25 0.00 0.00 175.29 175.18 1q8o h LEU 33 N 10.23 1.08 -9.73 2.90 3.38 -1.70 -2.14 115.31 119.33 1q8o h LEU 33 Ca -0.25 -0.24 -0.62 0.00 0.09 0.00 0.00 57.88 56.87 1q8o h LEU 33 Cb 1.08 -0.29 -0.07 0.00 0.09 0.00 0.00 40.66 41.47 1q8o h LEU 33 CO 1.11 1.04 -0.57 0.42 0.09 0.00 0.00 178.44 180.53 1q8o s THR 34 N -5.29 4.70 0.45 0.22 -4.23 -1.26 -2.96 115.64 107.27 1q8o s THR 34 Ca -0.12 -0.77 -0.25 0.00 -1.18 0.00 0.00 61.69 59.37 1q8o s THR 34 Cb 0.15 -3.31 -0.08 0.00 1.34 0.00 0.00 72.50 70.60 1q8o s THR 34 CO 0.85 0.07 1.39 -0.75 -0.54 0.00 0.00 174.62 175.64 1q8o s LYS 35 N -2.60 3.72 0.09 3.99 2.20 -1.26 -4.79 119.74 121.08 1q8o s LYS 35 Ca 0.31 2.33 0.04 0.00 -0.36 0.00 0.00 55.97 58.29 1q8o s LYS 35 Cb -0.12 -2.65 -0.03 0.00 -1.51 0.00 0.00 37.83 33.52 1q8o s LYS 35 CO 0.24 -0.76 -0.10 0.95 -0.36 0.00 0.00 175.35 175.31 1q8o s THR 36 N -1.23 0.89 0.11 3.43 -4.23 -1.26 -2.65 115.64 110.70 1q8o s THR 36 Ca 0.61 -1.53 -0.02 0.00 -1.18 0.00 0.00 61.69 59.57 1q8o s THR 36 Cb -0.42 -1.23 0.03 0.00 1.34 0.00 0.00 72.50 72.22 1q8o s THR 36 CO 0.54 -0.51 0.15 -0.90 -0.54 0.00 0.00 174.62 173.36 1q8o n ASP 37 N 0.75 0.03 -0.12 3.99 5.68 -0.11 -4.86 116.55 121.91 1q8o n ASP 37 Ca -0.17 -1.07 -0.05 0.00 -0.50 0.00 0.00 54.79 53.00 1q8o n ASP 37 Cb 0.57 -0.11 0.03 0.00 -1.14 0.00 0.00 41.12 40.46 1q8o n ASP 37 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1q8o h SER 38 N -0.19 -0.14 -0.06 -1.12 0.02 -2.02 -1.37 113.55 108.67 1q8o h SER 38 Ca -0.05 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1q8o h SER 38 Cb 0.14 0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1q8o h SER 38 CO 0.04 -0.03 0.00 -0.46 -1.14 0.00 0.00 176.83 175.23 1q8o n ASN 39 N -5.18 0.41 0.00 3.07 6.94 -1.26 -4.89 115.26 114.36 1q8o n ASN 39 Ca 0.03 -2.01 0.00 0.00 -0.02 0.00 0.00 54.58 52.58 1q8o n ASN 39 Cb 0.20 -0.07 0.00 0.00 -2.36 0.00 0.00 39.78 37.55 1q8o n ASN 39 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1q8o n GLY 40 N 0.57 0.53 3.82 4.83 0.00 -0.52 -5.06 105.19 109.38 1q8o n GLY 40 Ca 0.02 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 1q8o n GLY 40 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1q8o s ASN 41 N -2.32 6.98 0.45 1.61 0.02 -1.26 -4.73 114.94 115.69 1q8o s ASN 41 Ca 0.00 1.28 -0.25 0.00 -1.02 0.00 0.00 52.86 52.87 1q8o s ASN 41 Cb 0.00 -2.36 -0.08 0.00 0.02 0.00 0.00 41.25 38.83 1q8o s ASN 41 CO 0.00 0.10 1.30 -2.16 0.02 0.00 0.00 177.10 176.37 1q8o s PRO 42 N -1.80 3.74 0.33 -0.60 0.04 -1.26 -0.93 135.00 134.52 1q8o s PRO 42 Ca 0.39 2.14 0.10 0.00 0.04 0.00 0.00 61.00 63.66 1q8o s PRO 42 Cb -0.17 -2.59 -0.06 0.00 0.04 0.00 0.00 34.50 31.72 1q8o s PRO 42 CO 0.20 -0.67 -0.06 0.14 0.04 0.00 0.00 177.00 176.65 1q8o s VAL 43 N -1.31 2.48 0.71 -0.36 -7.23 -1.08 -4.83 120.40 108.77 1q8o s VAL 43 Ca 0.61 -2.12 -0.10 0.00 -1.81 0.00 0.00 61.98 58.56 1q8o s VAL 43 Cb -0.38 -2.68 0.04 0.00 0.56 0.00 0.00 36.38 33.93 1q8o s VAL 43 CO 0.47 -0.23 1.07 0.00 -0.31 0.00 0.00 175.10 176.10 1q8o s ALA 44 N -2.55 2.95 -0.75 1.32 0.00 -1.26 -4.57 121.76 116.89 1q8o s ALA 44 Ca 0.33 -0.61 -0.04 0.00 0.00 0.00 0.00 51.96 51.64 1q8o s ALA 44 Cb 0.00 -2.85 0.01 0.00 0.00 0.00 0.00 23.12 20.28 1q8o s ALA 44 CO 0.18 -1.26 0.64 0.43 0.00 0.00 0.00 175.76 175.74 1q8o n SER 45 N -3.00 -6.01 -3.73 0.00 7.64 0.43 -4.98 113.62 103.97 1q8o n SER 45 Ca 0.07 -0.54 -0.12 0.00 1.01 0.00 0.00 58.87 59.29 1q8o n SER 45 Cb 0.59 -3.04 -0.11 0.00 -1.01 0.00 0.00 64.21 60.64 1q8o n SER 45 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1q8o s THR 46 N -2.86 -0.01 0.06 0.44 -1.32 -0.51 -4.99 115.64 106.44 1q8o s THR 46 Ca 0.04 0.05 0.06 0.00 -1.21 0.00 0.00 61.69 60.63 1q8o s THR 46 Cb -0.01 -0.51 -0.03 0.00 -1.51 0.00 0.00 72.50 70.44 1q8o s THR 46 CO 0.84 0.02 -0.16 -0.69 -2.21 0.00 0.00 174.62 172.42 1q8o s VAL 47 N 0.75 1.29 -0.09 5.08 1.01 -1.26 -0.43 120.40 126.74 1q8o s VAL 47 Ca -0.05 -1.18 -0.29 0.00 0.00 0.00 0.00 61.98 60.46 1q8o s VAL 47 Cb -0.06 -1.18 0.07 0.00 0.00 0.00 0.00 36.38 35.22 1q8o s VAL 47 CO -0.05 -0.03 0.67 -0.83 0.00 0.00 0.00 175.10 174.86 1q8o s GLY 48 N -1.40 -0.55 0.07 4.51 0.00 -0.57 -0.22 107.32 109.16 1q8o s GLY 48 Ca 0.02 1.42 -0.16 0.00 0.00 0.00 0.00 44.72 46.00 1q8o s GLY 48 CO 0.02 1.08 0.38 0.50 0.00 0.00 0.00 173.10 175.08 1q8o s ARG 49 N -0.85 0.95 0.06 2.90 0.52 -0.60 -1.25 118.95 120.67 1q8o s ARG 49 Ca -0.09 -0.53 0.03 0.00 -0.52 0.00 0.00 55.73 54.63 1q8o s ARG 49 Cb -0.01 0.42 -0.03 0.00 0.52 0.00 0.00 34.95 35.85 1q8o s ARG 49 CO 0.08 -0.34 -0.10 0.96 0.02 0.00 0.00 175.30 175.92 1q8o s ILE 50 N -2.99 0.79 -0.01 1.52 -4.36 -0.60 -0.57 121.20 114.98 1q8o s ILE 50 Ca -0.02 -1.25 -0.02 0.00 -0.26 0.00 0.00 60.65 59.10 1q8o s ILE 50 Cb 0.00 -0.89 0.00 0.00 1.25 0.00 0.00 42.46 42.82 1q8o s ILE 50 CO -0.06 -0.36 0.04 -0.76 0.24 0.00 0.00 174.94 174.04 1q8o s LEU 51 N -1.78 1.84 0.25 0.37 1.43 -0.26 -1.21 118.68 119.32 1q8o s LEU 51 Ca -0.05 0.05 -0.30 0.00 -1.03 0.00 0.00 54.13 52.80 1q8o s LEU 51 Cb -0.09 0.17 -0.09 0.00 0.03 0.00 0.00 46.19 46.22 1q8o s LEU 51 CO 0.01 -0.05 1.10 0.12 0.23 0.00 0.00 176.35 177.76 1q8o s PHE 52 N -0.12 3.59 0.17 0.29 5.36 -0.73 0.07 117.98 126.62 1q8o s PHE 52 Ca -0.01 1.67 -0.13 0.00 -0.96 0.00 0.00 56.93 57.50 1q8o s PHE 52 Cb -0.01 -3.28 0.06 0.00 -0.34 0.00 0.00 43.02 39.46 1q8o s PHE 52 CO 0.00 -0.56 1.74 0.66 -1.46 0.00 0.00 175.22 175.61 1q8o h SER 53 N 4.24 0.75 -2.96 6.13 4.64 -1.00 -3.43 113.55 121.91 1q8o h SER 53 Ca -0.46 -0.14 -0.53 0.00 -0.47 0.00 0.00 61.79 60.19 1q8o h SER 53 Cb 1.21 -0.19 0.02 0.00 -0.31 0.00 0.00 62.40 63.13 1q8o h SER 53 CO 0.69 0.68 0.76 0.00 -0.87 0.00 0.00 176.83 178.09 1q8o s ALA 54 N -5.67 3.60 0.31 5.18 0.00 -1.26 -4.97 121.76 118.95 1q8o s ALA 54 Ca -0.13 1.10 -0.28 0.00 0.00 0.00 0.00 51.96 52.64 1q8o s ALA 54 Cb 0.12 -3.56 -0.09 0.00 0.00 0.00 0.00 23.12 19.59 1q8o s ALA 54 CO 0.78 -0.69 1.12 -0.65 0.00 0.00 0.00 175.76 176.33 1q8o s GLN 55 N 1.38 4.48 -0.16 0.00 -0.21 -1.26 -4.83 119.66 119.06 1q8o s GLN 55 Ca 0.65 1.82 -0.10 0.00 0.02 0.00 0.00 55.36 57.75 1q8o s GLN 55 Cb -0.36 -3.04 -0.05 0.00 1.00 0.00 0.00 33.01 30.56 1q8o s GLN 55 CO 0.30 0.06 0.17 0.08 -2.12 0.00 0.00 175.29 173.78 1q8o s VAL 56 N -1.25 5.41 -0.88 1.09 1.01 0.11 -4.89 120.40 121.00 1q8o s VAL 56 Ca 0.48 0.28 -0.20 0.00 0.00 0.00 0.00 61.98 62.54 1q8o s VAL 56 Cb -0.32 -3.48 0.11 0.00 0.00 0.00 0.00 36.38 32.69 1q8o s VAL 56 CO 0.41 0.50 1.13 -2.28 0.00 0.00 0.00 175.10 174.85 1q8o s HIS 57 N -0.15 2.93 0.20 5.22 2.46 -1.26 -0.89 115.29 123.80 1q8o s HIS 57 Ca 0.12 -1.11 -0.04 0.00 0.47 0.00 0.00 55.06 54.50 1q8o s HIS 57 Cb -0.12 -4.34 0.15 0.00 -0.13 0.00 0.00 32.58 28.14 1q8o s HIS 57 CO 0.02 -1.59 1.57 1.25 -2.47 0.00 0.00 174.74 173.52 1q8o h LEU 58 N 10.95 0.74 -7.00 8.88 5.85 -1.09 -3.42 115.31 130.22 1q8o h LEU 58 Ca 0.05 -0.32 -0.03 0.00 0.84 0.00 0.00 57.88 58.42 1q8o h LEU 58 Cb 1.03 -0.21 -0.14 0.00 0.37 0.00 0.00 40.66 41.72 1q8o h LEU 58 CO 1.17 1.03 0.20 -1.66 -0.34 0.00 0.00 178.44 178.84 1q8o s TRP 59 N -4.36 -0.58 -0.23 1.25 1.48 -1.14 -0.05 118.94 115.31 1q8o s TRP 59 Ca -0.09 0.59 -0.01 0.00 -1.06 0.00 0.00 56.10 55.53 1q8o s TRP 59 Cb 0.12 0.51 0.07 0.00 -1.16 0.00 0.00 33.47 33.01 1q8o s TRP 59 CO 0.84 -0.77 0.01 -2.00 -4.06 0.00 0.00 176.95 170.97 1q8o s GLU 60 N -2.93 1.02 0.25 3.25 2.12 0.46 -4.54 118.70 118.33 1q8o s GLU 60 Ca -0.03 -0.74 -0.04 0.00 0.36 0.00 0.00 54.97 54.52 1q8o s GLU 60 Cb -0.01 -2.28 0.39 0.00 0.26 0.00 0.00 34.13 32.49 1q8o s GLU 60 CO -0.06 -0.68 1.84 -0.22 -0.54 0.00 0.00 175.26 175.60 1q8o h LYS 61 N 8.11 0.90 -0.57 4.30 3.64 -1.96 -1.28 116.57 129.71 1q8o h LYS 61 Ca -0.16 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.14 1q8o h LYS 61 Cb 1.09 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.68 1q8o h LYS 61 CO 0.39 0.59 0.26 0.66 -2.27 0.00 0.00 179.45 179.07 1q8o h SER 62 N 0.92 0.76 -0.23 4.20 4.64 -1.96 -2.98 113.55 118.91 1q8o h SER 62 Ca 0.40 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1q8o h SER 62 Cb 0.28 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1q8o h SER 62 CO -0.21 0.70 0.00 -1.54 -0.87 0.00 0.00 176.83 174.90 1q8o n SER 63 N -4.53 2.60 -2.94 4.97 3.41 -1.13 -4.94 113.62 111.06 1q8o n SER 63 Ca 0.03 -1.86 -0.22 0.00 -0.26 0.00 0.00 58.87 56.57 1q8o n SER 63 Cb 0.14 -0.14 0.02 0.00 -0.26 0.00 0.00 64.21 63.96 1q8o n SER 63 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1q8o n SER 64 N 0.95 -5.51 -4.74 4.04 2.88 -0.53 -4.97 113.62 105.75 1q8o n SER 64 Ca 0.17 -0.23 -0.31 0.00 -1.33 0.00 0.00 58.87 57.17 1q8o n SER 64 Cb 0.49 -4.50 -0.07 0.00 -0.75 0.00 0.00 64.21 59.38 1q8o n SER 64 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1q8o s ARG 65 N -5.61 2.85 -0.02 -1.46 0.52 -0.91 -4.65 118.95 109.66 1q8o s ARG 65 Ca 0.25 -0.65 0.04 0.00 -0.52 0.00 0.00 55.73 54.85 1q8o s ARG 65 Cb -0.12 -2.72 -0.01 0.00 0.52 0.00 0.00 34.95 32.63 1q8o s ARG 65 CO 0.31 0.59 -0.12 0.08 0.02 0.00 0.00 175.30 176.18 1q8o s VAL 66 N -1.27 1.02 0.36 3.52 1.01 -0.82 -0.40 120.40 123.81 1q8o s VAL 66 Ca 0.25 -0.52 -0.26 0.00 0.00 0.00 0.00 61.98 61.45 1q8o s VAL 66 Cb -0.12 -0.87 -0.09 0.00 0.00 0.00 0.00 36.38 35.30 1q8o s VAL 66 CO 0.17 0.30 1.03 0.00 0.00 0.00 0.00 175.10 176.60 1q8o s ALA 67 N -0.11 3.18 -0.24 5.51 0.00 0.92 -1.62 121.76 129.40 1q8o s ALA 67 Ca 0.01 0.69 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 1q8o s ALA 67 Cb -0.07 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.74 1q8o s ALA 67 CO 0.00 -0.10 0.17 1.21 0.00 0.00 0.00 175.76 177.04 1q8o s ASN 68 N -1.45 6.12 0.13 0.00 3.84 0.39 -4.41 114.94 119.56 1q8o s ASN 68 Ca 0.53 0.12 0.05 0.00 0.21 0.00 0.00 52.86 53.77 1q8o s ASN 68 Cb -0.23 -2.11 -0.04 0.00 -0.55 0.00 0.00 41.25 38.32 1q8o s ASN 68 CO 0.29 0.05 -0.12 0.72 -2.79 0.00 0.00 177.10 175.25 1q8o s PHE 69 N 1.13 1.33 -0.03 0.43 -0.12 -1.01 -1.10 117.98 118.61 1q8o s PHE 69 Ca 0.08 -0.63 -0.00 0.00 -0.05 0.00 0.00 56.93 56.32 1q8o s PHE 69 Cb -0.14 -0.68 0.03 0.00 -0.63 0.00 0.00 43.02 41.60 1q8o s PHE 69 CO 0.05 0.12 0.04 -1.14 -0.05 0.00 0.00 175.22 174.24 1q8o s GLN 70 N -3.10 -0.04 -0.18 1.99 0.74 0.11 -0.69 119.66 118.50 1q8o s GLN 70 Ca 0.12 0.23 0.01 0.00 0.05 0.00 0.00 55.36 55.76 1q8o s GLN 70 Cb -0.02 -0.27 0.04 0.00 1.10 0.00 0.00 33.01 33.85 1q8o s GLN 70 CO 0.02 -0.19 -0.11 0.45 -0.55 0.00 0.00 175.29 174.91 1q8o s SER 71 N 1.22 3.14 -0.10 6.67 0.15 0.16 -1.90 113.70 123.03 1q8o s SER 71 Ca -0.07 -0.75 0.02 0.00 0.70 0.00 0.00 55.95 55.84 1q8o s SER 71 Cb -0.13 -1.20 -0.02 0.00 -1.71 0.00 0.00 66.02 62.96 1q8o s SER 71 CO -0.03 -0.12 -0.14 -1.58 1.20 0.00 0.00 173.24 172.57 1q8o s GLN 72 N 1.44 3.04 0.21 5.44 0.74 -0.56 -0.28 119.66 129.68 1q8o s GLN 72 Ca 0.01 -0.71 -0.23 0.00 0.05 0.00 0.00 55.36 54.48 1q8o s GLN 72 Cb -0.15 -2.51 0.05 0.00 1.10 0.00 0.00 33.01 31.49 1q8o s GLN 72 CO -0.09 0.36 0.75 -0.59 -0.55 0.00 0.00 175.29 175.17 1q8o s PHE 73 N -0.04 -0.27 0.01 1.67 -0.12 -0.54 -0.24 117.98 118.47 1q8o s PHE 73 Ca -0.04 -0.08 -0.00 0.00 -0.05 0.00 0.00 56.93 56.76 1q8o s PHE 73 Cb -0.14 0.65 -0.01 0.00 -0.63 0.00 0.00 43.02 42.88 1q8o s PHE 73 CO 0.04 -1.02 -0.01 -1.54 -0.05 0.00 0.00 175.22 172.64 1q8o s SER 74 N -2.85 0.16 0.17 1.98 1.04 -0.91 -0.29 113.70 113.00 1q8o s SER 74 Ca 0.08 -0.33 -0.09 0.00 0.48 0.00 0.00 55.95 56.10 1q8o s SER 74 Cb -0.04 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.15 1q8o s SER 74 CO 0.00 -0.21 0.29 0.72 0.98 0.00 0.00 173.24 175.02 1q8o s PHE 75 N -1.01 0.44 0.02 5.02 -0.71 -0.96 -0.91 117.98 119.87 1q8o s PHE 75 Ca -0.11 -0.79 -0.00 0.00 -1.04 0.00 0.00 56.93 54.98 1q8o s PHE 75 Cb -0.07 -0.07 -0.02 0.00 -1.21 0.00 0.00 43.02 41.66 1q8o s PHE 75 CO -0.01 -0.74 -0.02 -1.54 -1.34 0.00 0.00 175.22 171.58 1q8o s SER 76 N -2.98 0.21 -0.08 1.98 1.04 -0.58 0.05 113.70 113.34 1q8o s SER 76 Ca 0.19 -0.45 0.05 0.00 0.48 0.00 0.00 55.95 56.22 1q8o s SER 76 Cb 0.03 0.10 -0.00 0.00 0.10 0.00 0.00 66.02 66.25 1q8o s SER 76 CO 0.01 -0.28 -0.23 -0.76 0.98 0.00 0.00 173.24 172.96 1q8o s LEU 77 N -1.36 2.04 -0.01 2.42 1.43 -1.26 -1.56 118.68 120.38 1q8o s LEU 77 Ca -0.15 -0.51 0.03 0.00 -1.03 0.00 0.00 54.13 52.47 1q8o s LEU 77 Cb -0.09 -1.33 -0.00 0.00 0.03 0.00 0.00 46.19 44.79 1q8o s LEU 77 CO -0.01 0.18 -0.10 -0.54 0.23 0.00 0.00 176.35 176.12 1q8o s LYS 78 N 0.15 0.89 -0.28 1.70 -0.14 -1.18 0.10 119.74 120.99 1q8o s LYS 78 Ca -0.12 -0.35 -0.20 0.00 -1.36 0.00 0.00 55.97 53.93 1q8o s LYS 78 Cb -0.16 -0.85 0.08 0.00 -1.68 0.00 0.00 37.83 35.22 1q8o s LYS 78 CO 0.06 0.19 0.71 0.45 -0.76 0.00 0.00 175.35 176.00 1q8o s SER 79 N -0.10 -0.86 0.38 2.83 0.15 -1.26 -0.15 113.70 114.69 1q8o s SER 79 Ca 0.02 1.49 0.06 0.00 0.70 0.00 0.00 55.95 58.21 1q8o s SER 79 Cb -0.06 1.43 0.76 0.00 -1.71 0.00 0.00 66.02 66.44 1q8o s SER 79 CO -0.00 -0.24 1.98 -0.65 1.20 0.00 0.00 173.24 175.52 1q8o h PRO 80 N 6.06 0.50 0.00 5.44 0.11 -1.96 -3.41 132.00 138.75 1q8o h PRO 80 Ca -0.30 -0.07 -0.28 0.00 0.11 0.00 0.00 66.00 65.47 1q8o h PRO 80 Cb 1.20 -0.10 0.11 0.00 0.11 0.00 0.00 31.00 32.33 1q8o h PRO 80 CO 0.11 0.43 0.27 1.28 -0.21 0.00 0.00 178.00 179.88 1q8o n LEU 81 N -4.38 0.00 -0.18 2.35 4.77 -1.26 -5.00 117.00 113.30 1q8o n LEU 81 Ca 0.02 -0.96 0.02 0.00 -0.03 0.00 0.00 56.01 55.07 1q8o n LEU 81 Cb 0.15 -0.66 0.03 0.00 -2.33 0.00 0.00 43.42 40.61 1q8o n LEU 81 CO 0.37 -1.12 0.37 -1.54 -1.33 0.00 0.00 177.39 174.14 1q8o n SER 82 N -3.56 0.93 -2.04 -1.43 3.41 -1.26 -4.62 113.62 105.05 1q8o n SER 82 Ca 0.11 -2.00 -0.23 0.00 -0.26 0.00 0.00 58.87 56.50 1q8o n SER 82 Cb 0.38 -0.16 0.02 0.00 -0.26 0.00 0.00 64.21 64.19 1q8o n SER 82 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1q8o n ASN 83 N -0.43 4.75 -4.68 4.04 5.03 -1.26 -5.07 115.26 117.64 1q8o n ASN 83 Ca 0.04 -3.68 -0.43 0.00 0.87 0.00 0.00 54.58 51.38 1q8o n ASN 83 Cb 0.55 -0.35 -0.01 0.00 -1.02 0.00 0.00 39.78 38.95 1q8o n ASN 83 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1q8o n GLY 84 N -0.71 0.50 3.17 7.41 0.00 -1.26 -4.50 105.19 109.81 1q8o n GLY 84 Ca 0.42 0.34 -0.10 0.00 0.00 0.00 0.00 46.02 46.67 1q8o n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q8o s ALA 85 N -0.99 0.97 -0.18 4.61 0.00 -1.22 -4.26 121.76 120.69 1q8o s ALA 85 Ca 0.57 -1.42 0.07 0.00 0.00 0.00 0.00 51.96 51.19 1q8o s ALA 85 Cb -0.59 0.45 -0.10 0.00 0.00 0.00 0.00 23.12 22.88 1q8o s ALA 85 CO 0.61 -0.34 0.24 -0.25 0.00 0.00 0.00 175.76 176.01 1q8o n ASP 86 N -0.08 1.79 0.00 0.00 8.00 0.11 -2.97 116.55 123.40 1q8o n ASP 86 Ca -0.09 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.06 1q8o n ASP 86 Cb 0.62 1.17 0.00 0.00 -0.02 0.00 0.00 41.12 42.89 1q8o n ASP 86 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1q8o n GLY 87 N 1.61 2.41 3.26 0.44 0.00 -1.24 -2.56 105.19 109.11 1q8o n GLY 87 Ca 0.00 -1.88 -0.23 0.00 0.00 0.00 0.00 46.02 43.92 1q8o n GLY 87 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1q8o s ILE 88 N -1.68 1.56 -0.04 -0.61 2.07 -0.91 -3.21 121.20 118.39 1q8o s ILE 88 Ca 0.00 -1.47 -0.03 0.00 -1.41 0.00 0.00 60.65 57.74 1q8o s ILE 88 Cb 0.00 -1.43 0.01 0.00 0.13 0.00 0.00 42.46 41.17 1q8o s ILE 88 CO 0.00 -0.09 0.09 0.00 -1.91 0.00 0.00 174.94 173.02 1q8o s ALA 89 N -1.18 -0.19 -0.06 1.50 0.00 0.82 -0.35 121.76 122.29 1q8o s ALA 89 Ca 0.04 0.30 -0.19 0.00 0.00 0.00 0.00 51.96 52.12 1q8o s ALA 89 Cb -0.10 -0.19 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 1q8o s ALA 89 CO 0.04 -0.06 0.52 0.12 0.00 0.00 0.00 175.76 176.38 1q8o s PHE 90 N 0.28 3.60 0.11 0.00 5.36 -0.08 -0.70 117.98 126.54 1q8o s PHE 90 Ca -0.02 1.03 -0.02 0.00 -0.96 0.00 0.00 56.93 56.96 1q8o s PHE 90 Cb -0.03 -2.56 -0.04 0.00 -0.34 0.00 0.00 43.02 40.05 1q8o s PHE 90 CO -0.01 0.28 0.05 -0.59 -1.46 0.00 0.00 175.22 173.48 1q8o s PHE 91 N 0.18 0.72 -0.08 10.12 -0.71 -0.29 0.09 117.98 128.01 1q8o s PHE 91 Ca 0.28 -1.15 0.01 0.00 -1.04 0.00 0.00 56.93 55.03 1q8o s PHE 91 Cb -0.16 -0.42 0.02 0.00 -1.21 0.00 0.00 43.02 41.25 1q8o s PHE 91 CO 0.13 -0.49 -0.07 0.42 -1.34 0.00 0.00 175.22 173.87 1q8o s ILE 92 N -4.00 0.86 0.27 -4.49 1.01 0.16 -1.62 121.20 113.40 1q8o s ILE 92 Ca 0.18 -0.25 -0.06 0.00 0.00 0.00 0.00 60.65 60.52 1q8o s ILE 92 Cb 0.07 -0.87 -0.01 0.00 0.01 0.00 0.00 42.46 41.67 1q8o s ILE 92 CO -0.02 0.32 0.39 0.00 0.00 0.00 0.00 174.94 175.63 1q8o s ALA 93 N 1.24 0.51 0.71 9.38 0.00 -0.67 -2.11 121.76 130.82 1q8o s ALA 93 Ca -0.05 -1.33 -0.16 0.00 0.00 0.00 0.00 51.96 50.42 1q8o s ALA 93 Cb -0.14 1.18 0.01 0.00 0.00 0.00 0.00 23.12 24.18 1q8o s ALA 93 CO -0.02 -0.77 1.09 -2.30 0.00 0.00 0.00 175.76 173.76 1q8o n PRO 94 N -0.43 0.64 -0.30 0.00 -0.02 -1.26 -0.94 135.00 132.68 1q8o n PRO 94 Ca 0.00 0.28 0.17 0.00 -2.02 0.00 0.00 63.50 61.93 1q8o n PRO 94 Cb 0.63 -2.34 0.43 0.00 -0.02 0.00 0.00 33.50 32.20 1q8o n PRO 94 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1q8o h PRO 95 N -0.11 0.54 -0.32 0.52 0.11 -1.84 -2.16 132.00 128.74 1q8o h PRO 95 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1q8o h PRO 95 Cb 1.33 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1q8o h PRO 95 CO 0.49 0.36 0.00 -0.40 -0.21 0.00 0.00 178.00 178.24 1q8o n ASP 96 N -4.63 1.70 -4.65 -2.05 3.85 -1.26 -4.87 116.55 104.63 1q8o n ASP 96 Ca 0.22 -2.00 -0.42 0.00 -0.71 0.00 0.00 54.79 51.88 1q8o n ASP 96 Cb 0.67 -0.21 0.00 0.00 -1.35 0.00 0.00 41.12 40.23 1q8o n ASP 96 CO 0.00 0.00 0.00 1.07 -1.01 0.00 0.00 177.20 177.26 1q8o n THR 97 N 0.43 2.34 -4.14 2.12 5.66 -0.81 -5.01 114.28 114.86 1q8o n THR 97 Ca 0.11 -0.50 -0.10 0.00 -3.05 0.00 0.00 64.05 60.50 1q8o n THR 97 Cb 0.27 -1.34 -0.10 0.00 -1.55 0.00 0.00 70.33 67.62 1q8o n THR 97 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1q8o s THR 98 N -1.19 0.06 -0.16 1.09 -4.23 -1.26 -5.08 115.64 104.86 1q8o s THR 98 Ca 0.60 -1.87 -0.29 0.00 -1.18 0.00 0.00 61.69 58.95 1q8o s THR 98 Cb -0.56 -2.17 -0.05 0.00 1.34 0.00 0.00 72.50 71.06 1q8o s THR 98 CO 0.59 -0.29 1.90 -0.63 -0.54 0.00 0.00 174.62 175.65 1q8o s ILE 99 N -4.07 3.30 0.54 2.99 1.01 -1.26 -4.95 121.20 118.76 1q8o s ILE 99 Ca 0.28 0.34 -0.21 0.00 0.00 0.00 0.00 60.65 61.06 1q8o s ILE 99 Cb 0.07 -3.32 -0.05 0.00 0.01 0.00 0.00 42.46 39.17 1q8o s ILE 99 CO 0.05 -0.14 1.28 -2.84 0.00 0.00 0.00 174.94 173.29 1q8o s PRO 100 N 5.21 3.22 0.23 2.79 0.02 -1.26 -4.92 135.00 140.29 1q8o s PRO 100 Ca 0.85 2.04 -0.31 0.00 0.02 0.00 0.00 61.00 63.60 1q8o s PRO 100 Cb -0.32 -2.20 -0.11 0.00 0.02 0.00 0.00 34.50 31.89 1q8o s PRO 100 CO 0.34 -1.07 1.57 0.45 -0.33 0.00 0.00 177.00 177.97 1q8o s SER 101 N -1.20 6.50 -1.20 2.53 0.15 -1.26 -2.47 113.70 116.75 1q8o s SER 101 Ca 0.71 2.78 -0.00 0.00 0.70 0.00 0.00 55.95 60.14 1q8o s SER 101 Cb -0.36 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.34 1q8o s SER 101 CO 0.41 -0.85 0.02 0.61 1.20 0.00 0.00 173.24 174.63 1q8o n GLY 102 N 2.90 -0.21 1.32 9.45 0.00 -1.26 -4.40 105.19 113.00 1q8o n GLY 102 Ca 0.11 -0.29 0.07 0.00 0.00 0.00 0.00 46.02 45.91 1q8o n GLY 102 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1q8o n SER 103 N -0.72 3.88 -3.40 1.61 3.41 -1.03 -4.08 113.62 113.28 1q8o n SER 103 Ca -0.16 -2.38 -0.25 0.00 -0.26 0.00 0.00 58.87 55.82 1q8o n SER 103 Cb 0.63 -0.52 0.21 0.00 -0.26 0.00 0.00 64.21 64.26 1q8o n SER 103 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1q8o n GLY 104 N 0.91 -2.62 7.00 5.00 0.00 -1.26 0.12 105.19 114.33 1q8o n GLY 104 Ca 0.20 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1q8o n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q8o n GLY 105 N -3.53 3.06 0.00 -0.02 0.00 -1.26 -2.27 105.19 101.17 1q8o n GLY 105 Ca 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1q8o n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q8o n GLY 106 N 0.00 -0.48 0.43 -0.02 0.00 -1.26 -1.06 105.19 102.80 1q8o n GLY 106 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1q8o n GLY 106 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1q8o n LEU 107 N -1.48 1.33 -0.89 0.99 4.77 -0.96 -4.93 117.00 115.82 1q8o n LEU 107 Ca 0.00 -0.46 -0.09 0.00 -0.03 0.00 0.00 56.01 55.43 1q8o n LEU 107 Cb 0.01 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 1q8o n LEU 107 CO 0.00 0.23 -0.08 0.18 -1.33 0.00 0.00 177.39 176.39 1q8o n LEU 108 N 0.05 -0.40 -0.17 2.23 4.77 -0.22 -1.40 117.00 121.86 1q8o n LEU 108 Ca 0.19 0.22 -0.02 0.00 -0.03 0.00 0.00 56.01 56.37 1q8o n LEU 108 Cb 0.32 -1.99 -0.01 0.00 -2.33 0.00 0.00 43.42 39.41 1q8o n LEU 108 CO 0.16 -0.71 -0.02 0.61 -1.33 0.00 0.00 177.39 176.10 1q8o n GLY 109 N 0.08 0.54 0.08 -0.72 0.00 0.32 -3.87 105.19 101.63 1q8o n GLY 109 Ca -0.09 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.49 1q8o n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1q8o n LEU 110 N -0.25 1.79 -4.45 0.99 4.77 -0.49 -4.43 117.00 114.92 1q8o n LEU 110 Ca -0.02 -0.06 -0.23 0.00 -0.03 0.00 0.00 56.01 55.67 1q8o n LEU 110 Cb 0.15 -0.25 -0.10 0.00 -2.33 0.00 0.00 43.42 40.89 1q8o n LEU 110 CO 0.03 0.63 -0.44 -0.36 -1.33 0.00 0.00 177.39 175.92 1q8o s PHE 111 N -2.36 2.14 0.11 -1.77 0.40 -1.20 -4.78 117.98 110.53 1q8o s PHE 111 Ca -0.18 -0.45 -0.13 0.00 -0.60 0.00 0.00 56.93 55.57 1q8o s PHE 111 Cb 0.06 -1.03 -0.06 0.00 0.51 0.00 0.00 43.02 42.49 1q8o s PHE 111 CO 0.50 0.57 0.50 0.00 0.70 0.00 0.00 175.22 177.48 1q8o s ALA 112 N -2.68 3.63 0.19 5.36 0.00 -1.26 -3.99 121.76 123.01 1q8o s ALA 112 Ca 0.29 -0.20 -0.15 0.00 0.00 0.00 0.00 51.96 51.90 1q8o s ALA 112 Cb -0.02 -2.44 0.18 0.00 0.00 0.00 0.00 23.12 20.84 1q8o s ALA 112 CO 0.13 0.49 1.65 -1.35 0.00 0.00 0.00 175.76 176.68 1q8o h PRO 113 N 3.74 0.03 0.00 0.00 0.11 -1.77 0.19 132.00 134.29 1q8o h PRO 113 Ca -0.49 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1q8o h PRO 113 Cb 1.20 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1q8o h PRO 113 CO 0.65 0.02 -0.01 0.78 -0.21 0.00 0.00 178.00 179.23 1q8o h GLY 114 N 0.03 0.00 0.00 -0.55 0.00 -1.94 -3.16 103.07 97.45 1q8o h GLY 114 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1q8o h GLY 114 CO -0.51 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 174.73 1q8o n THR 115 N -3.16 0.47 -0.42 4.70 -2.24 -0.88 -4.83 114.28 107.92 1q8o n THR 115 Ca -0.02 -0.59 0.35 0.00 -2.27 0.00 0.00 64.05 61.53 1q8o n THR 115 Cb 0.17 0.86 0.62 0.00 -2.10 0.00 0.00 70.33 69.89 1q8o n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1q8o h ALA 116 N 0.00 2.61 -0.28 6.98 0.00 -0.61 0.16 119.26 128.12 1q8o h ALA 116 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1q8o h ALA 116 Cb 0.48 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1q8o h ALA 116 CO 0.00 -1.24 0.00 1.04 0.00 0.00 0.00 179.25 179.05 1q8o n GLN 117 N -4.75 2.85 -3.19 0.00 6.02 -1.26 -1.10 117.38 115.95 1q8o n GLN 117 Ca 0.36 -2.30 -0.45 0.00 -0.01 0.00 0.00 57.00 54.60 1q8o n GLN 117 Cb 1.36 -1.46 -0.04 0.00 1.02 0.00 0.00 30.24 31.12 1q8o n GLN 117 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1q8o s ASN 118 N -1.39 6.26 0.54 1.08 3.84 0.54 -4.93 114.94 120.89 1q8o s ASN 118 Ca 0.28 -1.70 0.22 0.00 0.21 0.00 0.00 52.86 51.88 1q8o s ASN 118 Cb 0.19 -2.27 1.43 0.00 -0.55 0.00 0.00 41.25 40.05 1q8o s ASN 118 CO 0.12 -0.98 2.11 0.71 -2.79 0.00 0.00 177.10 176.27 1q8o h THR 119 N 5.81 0.79 -0.01 -5.21 1.35 -1.84 -1.55 112.91 112.25 1q8o h THR 119 Ca -0.24 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 1q8o h THR 119 Cb 1.08 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 1q8o h THR 119 CO 1.05 0.00 -0.06 -1.54 -0.25 0.00 0.00 175.52 174.72 1q8o n SER 120 N -4.30 0.74 -0.73 5.36 3.41 -1.26 -3.56 113.62 113.28 1q8o n SER 120 Ca 0.01 -1.01 0.08 0.00 -0.26 0.00 0.00 58.87 57.69 1q8o n SER 120 Cb 0.27 -0.01 0.10 0.00 -0.26 0.00 0.00 64.21 64.30 1q8o n SER 120 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1q8o n ALA 121 N -0.57 2.44 -2.38 7.33 0.00 -0.58 -4.99 120.51 121.75 1q8o n ALA 121 Ca 0.18 -0.73 -0.20 0.00 0.00 0.00 0.00 53.44 52.69 1q8o n ALA 121 Cb 0.27 -0.59 -0.10 0.00 0.00 0.00 0.00 19.45 19.03 1q8o n ALA 121 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1q8o s ASN 122 N -1.34 2.66 -0.37 0.00 0.01 -1.23 -5.08 114.94 109.59 1q8o s ASN 122 Ca 0.22 -1.09 0.02 0.00 -0.71 0.00 0.00 52.86 51.30 1q8o s ASN 122 Cb 0.15 -0.15 0.15 0.00 0.41 0.00 0.00 41.25 41.81 1q8o s ASN 122 CO 0.22 -0.24 0.28 -1.10 -1.51 0.00 0.00 177.10 174.75 1q8o s GLN 123 N -3.68 0.65 -0.28 -0.60 -0.21 -1.26 -4.85 119.66 109.43 1q8o s GLN 123 Ca 0.26 -1.40 -0.24 0.00 0.02 0.00 0.00 55.36 54.00 1q8o s GLN 123 Cb 0.01 -1.18 0.12 0.00 1.00 0.00 0.00 33.01 32.95 1q8o s GLN 123 CO 0.09 -1.25 0.97 0.54 -2.12 0.00 0.00 175.29 173.52 1q8o s VAL 124 N 0.92 0.00 -0.12 1.09 0.11 -1.26 -4.24 120.40 116.90 1q8o s VAL 124 Ca 0.21 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.29 1q8o s VAL 124 Cb -0.15 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.71 1q8o s VAL 124 CO -0.04 0.00 -0.20 -0.63 -3.33 0.00 0.00 175.10 170.90 1q8o s ILE 125 N 0.42 1.85 0.04 7.04 1.01 -0.90 -0.26 121.20 130.41 1q8o s ILE 125 Ca 0.01 -0.87 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 1q8o s ILE 125 Cb -0.05 -1.64 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 1q8o s ILE 125 CO -0.07 0.51 -0.03 0.00 0.00 0.00 0.00 174.94 175.36 1q8o s ALA 126 N 0.71 0.34 -0.29 9.38 0.00 0.69 -0.66 121.76 131.93 1q8o s ALA 126 Ca -0.11 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 50.94 1q8o s ALA 126 Cb -0.16 0.22 0.07 0.00 0.00 0.00 0.00 23.12 23.25 1q8o s ALA 126 CO 0.02 -0.28 -0.05 0.08 0.00 0.00 0.00 175.76 175.52 1q8o s VAL 127 N -2.90 2.19 0.14 0.00 1.01 0.11 0.39 120.40 121.34 1q8o s VAL 127 Ca -0.03 -1.88 0.00 0.00 0.00 0.00 0.00 61.98 60.07 1q8o s VAL 127 Cb 0.01 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1q8o s VAL 127 CO -0.06 -0.24 0.30 -1.83 0.00 0.00 0.00 175.10 173.27 1q8o s GLU 128 N 1.04 3.48 -0.46 2.72 -1.05 0.61 -0.91 118.70 124.13 1q8o s GLU 128 Ca -0.02 -0.42 0.03 0.00 -0.15 0.00 0.00 54.97 54.40 1q8o s GLU 128 Cb -0.20 -2.94 0.13 0.00 -0.44 0.00 0.00 34.13 30.69 1q8o s GLU 128 CO -0.06 0.51 0.24 -0.06 0.95 0.00 0.00 175.26 176.84 1q8o s PHE 129 N -1.70 2.34 -0.30 4.83 0.40 0.53 -0.38 117.98 123.69 1q8o s PHE 129 Ca 0.36 -2.64 -0.19 0.00 -0.60 0.00 0.00 56.93 53.86 1q8o s PHE 129 Cb -0.12 -2.17 -0.01 0.00 0.51 0.00 0.00 43.02 41.23 1q8o s PHE 129 CO 0.28 -0.77 0.58 0.34 0.70 0.00 0.00 175.22 176.35 1q8o s ASP 130 N 0.18 6.45 -0.01 1.36 -1.08 -0.24 -2.15 116.67 121.18 1q8o s ASP 130 Ca 0.17 0.37 0.19 0.00 -0.52 0.00 0.00 52.55 52.77 1q8o s ASP 130 Cb -0.25 -2.31 -0.26 0.00 -1.46 0.00 0.00 42.92 38.65 1q8o s ASP 130 CO 0.00 -0.43 0.60 0.35 0.52 0.00 0.00 175.17 176.21 1q8o n THR 131 N 5.34 0.00 -4.45 1.71 -2.24 -1.06 -1.66 114.28 111.92 1q8o n THR 131 Ca -0.02 -0.26 -0.34 0.00 -2.27 0.00 0.00 64.05 61.16 1q8o n THR 131 Cb 0.49 0.50 -0.14 0.00 -2.10 0.00 0.00 70.33 69.07 1q8o n THR 131 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1q8o s PHE 132 N -3.08 2.85 -0.05 4.78 5.36 -1.24 -4.74 117.98 121.87 1q8o s PHE 132 Ca -0.00 -0.82 0.11 0.00 -0.96 0.00 0.00 56.93 55.25 1q8o s PHE 132 Cb 0.13 -1.93 0.20 0.00 -0.34 0.00 0.00 43.02 41.09 1q8o s PHE 132 CO 0.79 -0.37 1.09 2.48 -1.46 0.00 0.00 175.22 177.75 1q8o n TYR 133 N 4.00 0.00 -1.67 10.12 4.11 -1.26 -4.95 117.16 127.51 1q8o n TYR 133 Ca -0.18 -0.46 -0.54 0.00 -0.00 0.00 0.00 57.90 56.72 1q8o n TYR 133 Cb 0.52 -0.11 -0.06 0.00 -0.00 0.00 0.00 39.34 39.68 1q8o n TYR 133 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1q8o n ALA 134 N -0.25 0.32 0.18 -3.48 0.00 -1.26 -4.76 120.51 111.25 1q8o n ALA 134 Ca 0.06 0.30 0.08 0.00 0.00 0.00 0.00 53.44 53.89 1q8o n ALA 134 Cb 0.80 -2.35 0.43 0.00 0.00 0.00 0.00 19.45 18.32 1q8o n ALA 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1q8o n GLN 135 N 6.17 0.11 0.10 0.00 1.13 -1.26 0.10 117.38 123.72 1q8o n GLN 135 Ca 0.27 0.56 -0.23 0.00 -1.94 0.00 0.00 57.00 55.66 1q8o n GLN 135 Cb 0.19 -1.82 -0.15 0.00 0.11 0.00 0.00 30.24 28.57 1q8o n GLN 135 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 1q8o h ASP 136 N 0.00 0.69 0.05 1.08 2.03 -1.97 -3.30 116.42 115.00 1q8o h ASP 136 Ca 0.00 -0.89 -0.38 0.00 -0.73 0.00 0.00 57.03 55.03 1q8o h ASP 136 Cb 0.06 -0.22 -0.05 0.00 -0.83 0.00 0.00 39.33 38.29 1q8o h ASP 136 CO 0.00 1.73 -2.21 -1.54 -1.03 0.00 0.00 179.24 176.19 1q8o n SER 137 N -3.63 2.03 -3.61 4.15 3.41 -1.01 -4.53 113.62 110.43 1q8o n SER 137 Ca -0.21 0.08 -0.38 0.00 -0.26 0.00 0.00 58.87 58.10 1q8o n SER 137 Cb 1.09 -0.67 -0.00 0.00 -0.26 0.00 0.00 64.21 64.37 1q8o n SER 137 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1q8o n ASN 138 N -3.52 6.27 0.34 4.04 5.03 0.11 -4.85 115.26 122.68 1q8o n ASN 138 Ca -0.40 -3.58 0.21 0.00 0.87 0.00 0.00 54.58 51.67 1q8o n ASN 138 Cb 0.98 -1.05 1.13 0.00 -1.02 0.00 0.00 39.78 39.82 1q8o n ASN 138 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1q8o h THR 139 N 2.79 0.00 0.00 3.41 1.35 -1.74 -2.00 112.91 116.72 1q8o h THR 139 Ca 0.34 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.20 1q8o h THR 139 Cb 0.47 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1q8o h THR 139 CO 1.13 0.00 -0.43 4.11 -0.25 0.00 0.00 175.52 180.09 1q8o h TRP 140 N 0.00 0.00 -3.88 4.73 0.09 -1.89 -3.48 115.95 111.52 1q8o h TRP 140 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 58.89 58.51 1q8o h TRP 140 Cb 0.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 29.39 1q8o h TRP 140 CO 0.00 0.00 0.21 -0.51 0.09 0.00 0.00 178.44 178.23 1q8o s ASP 141 N -4.38 6.81 0.85 0.11 1.01 -0.75 -4.75 116.67 115.57 1q8o s ASP 141 Ca 0.07 1.45 -0.11 0.00 0.71 0.00 0.00 52.55 54.67 1q8o s ASP 141 Cb 0.13 -2.44 0.10 0.00 1.01 0.00 0.00 42.92 41.71 1q8o s ASP 141 CO 0.68 -0.30 1.09 -2.16 0.21 0.00 0.00 175.17 174.69 1q8o s PRO 142 N -3.18 1.67 -1.03 8.23 0.04 -1.26 -4.88 135.00 134.59 1q8o s PRO 142 Ca 0.57 0.93 -0.07 0.00 0.04 0.00 0.00 61.00 62.47 1q8o s PRO 142 Cb -0.10 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1q8o s PRO 142 CO 0.17 -1.98 2.86 -1.71 0.04 0.00 0.00 177.00 176.38 1q8o n ASN 143 N -3.72 7.51 -3.62 6.66 5.15 -1.26 -4.82 115.26 121.15 1q8o n ASN 143 Ca 0.08 -2.86 -0.04 0.00 -0.60 0.00 0.00 54.58 51.16 1q8o n ASN 143 Cb 0.55 -1.41 -0.02 0.00 -0.53 0.00 0.00 39.78 38.36 1q8o n ASN 143 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1q8o s TYR 144 N 0.17 -0.09 0.56 1.20 -0.85 -1.26 -5.10 117.35 111.98 1q8o s TYR 144 Ca 0.62 0.08 -0.21 0.00 -0.52 0.00 0.00 57.07 57.04 1q8o s TYR 144 Cb 0.24 0.50 -0.05 0.00 0.38 0.00 0.00 41.96 43.04 1q8o s TYR 144 CO -0.09 -0.13 1.28 -0.35 -1.52 0.00 0.00 175.55 174.74 1q8o n PRO 145 N 0.07 1.47 -3.54 -3.49 -0.04 -1.26 -4.88 135.00 123.33 1q8o n PRO 145 Ca 0.01 0.55 -0.10 0.00 -0.04 0.00 0.00 63.50 63.92 1q8o n PRO 145 Cb 0.58 -2.49 -0.02 0.00 -0.04 0.00 0.00 33.50 31.53 1q8o n PRO 145 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1q8o s HIS 146 N -1.33 -0.42 -0.16 0.54 -3.43 -0.67 -1.47 115.29 108.35 1q8o s HIS 146 Ca 0.74 0.16 -0.06 0.00 -0.80 0.00 0.00 55.06 55.10 1q8o s HIS 146 Cb -0.42 0.59 -0.04 0.00 -1.43 0.00 0.00 32.58 31.29 1q8o s HIS 146 CO 0.48 -0.89 0.03 0.42 -2.00 0.00 0.00 174.74 172.78 1q8o s ILE 147 N -3.68 4.49 0.10 -5.38 1.01 -0.48 -1.08 121.20 116.19 1q8o s ILE 147 Ca 0.04 -0.15 0.05 0.00 0.00 0.00 0.00 60.65 60.59 1q8o s ILE 147 Cb -0.02 -2.99 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 1q8o s ILE 147 CO -0.07 0.50 -0.12 -0.83 0.00 0.00 0.00 174.94 174.41 1q8o s GLY 148 N 0.14 0.95 -0.27 6.18 0.00 0.49 -1.54 107.32 113.27 1q8o s GLY 148 Ca 0.03 -1.21 -0.07 0.00 0.00 0.00 0.00 44.72 43.47 1q8o s GLY 148 CO 0.01 -1.27 0.06 -0.42 0.00 0.00 0.00 173.10 171.49 1q8o s ILE 149 N -2.15 4.02 -0.19 0.90 1.01 -0.27 -0.28 121.20 124.23 1q8o s ILE 149 Ca 0.06 -0.50 -0.06 0.00 0.00 0.00 0.00 60.65 60.15 1q8o s ILE 149 Cb -0.05 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 1q8o s ILE 149 CO 0.02 0.20 0.03 -1.81 0.00 0.00 0.00 174.94 173.38 1q8o s ASP 150 N 1.54 5.19 -0.38 3.58 -0.00 0.16 -1.44 116.67 125.33 1q8o s ASP 150 Ca 0.04 -0.08 0.02 0.00 -0.00 0.00 0.00 52.55 52.53 1q8o s ASP 150 Cb -0.16 -1.89 0.11 0.00 -0.00 0.00 0.00 42.92 40.98 1q8o s ASP 150 CO 0.02 0.11 0.14 -0.69 -0.00 0.00 0.00 175.17 174.76 1q8o s VAL 151 N 0.72 1.57 -1.03 -1.27 1.01 -1.26 -0.22 120.40 119.91 1q8o s VAL 151 Ca 0.02 -2.18 0.00 0.00 0.00 0.00 0.00 61.98 59.82 1q8o s VAL 151 Cb -0.14 -2.14 0.00 0.00 0.00 0.00 0.00 36.38 34.10 1q8o s VAL 151 CO 0.02 -0.73 0.00 0.59 0.00 0.00 0.00 175.10 174.98 1q8o n ASN 152 N 4.14 -5.37 -3.63 3.32 3.02 0.65 -4.92 115.26 112.46 1q8o n ASN 152 Ca 0.03 0.24 -0.16 0.00 -0.03 0.00 0.00 54.58 54.67 1q8o n ASN 152 Cb 0.39 -3.72 -0.07 0.00 -0.61 0.00 0.00 39.78 35.76 1q8o n ASN 152 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1q8o s SER 153 N -2.44 -0.49 0.36 6.41 0.15 -1.26 -3.72 113.70 112.71 1q8o s SER 153 Ca 0.00 0.59 0.27 0.00 0.70 0.00 0.00 55.95 57.50 1q8o s SER 153 Cb 0.00 0.58 0.92 0.00 -1.71 0.00 0.00 66.02 65.81 1q8o s SER 153 CO 0.00 -0.48 1.78 -0.29 1.20 0.00 0.00 173.24 175.46 1q8o h ILE 154 N 3.53 0.00 -2.96 6.45 6.09 -1.48 -3.39 117.51 125.75 1q8o h ILE 154 Ca -0.28 -0.51 -0.62 0.00 -1.37 0.00 0.00 64.86 62.08 1q8o h ILE 154 Cb 1.16 1.43 -0.13 0.00 0.47 0.00 0.00 36.82 39.74 1q8o h ILE 154 CO 0.35 0.00 0.53 -0.60 -3.07 0.00 0.00 178.15 175.36 1q8o s ARG 155 N -3.34 3.22 0.28 2.19 3.52 -1.26 -4.91 118.95 118.65 1q8o s ARG 155 Ca 0.05 -0.54 -0.29 0.00 -0.13 0.00 0.00 55.73 54.83 1q8o s ARG 155 Cb 0.09 -4.13 -0.14 0.00 -1.56 0.00 0.00 34.95 29.21 1q8o s ARG 155 CO 0.53 -1.62 1.10 0.43 -0.81 0.00 0.00 175.30 174.93 1q8o n SER 156 N 7.52 1.64 0.21 -2.12 7.64 -1.26 -4.81 113.62 122.44 1q8o n SER 156 Ca -0.01 1.18 0.13 0.00 1.01 0.00 0.00 58.87 61.18 1q8o n SER 156 Cb 0.47 -1.32 0.30 0.00 -1.01 0.00 0.00 64.21 62.65 1q8o n SER 156 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 1q8o h VAL 157 N 2.22 0.00 -2.37 0.44 -1.51 -1.59 -3.45 116.25 110.00 1q8o h VAL 157 Ca -0.41 -0.81 -0.08 0.00 -1.23 0.00 0.00 66.70 64.17 1q8o h VAL 157 Cb 1.33 1.80 -0.22 0.00 -2.13 0.00 0.00 31.29 32.06 1q8o h VAL 157 CO 0.63 0.00 -0.05 -0.75 -1.23 0.00 0.00 177.57 176.17 1q8o s LYS 158 N -3.27 0.66 0.13 5.19 2.47 -1.24 -5.03 119.74 118.65 1q8o s LYS 158 Ca 0.07 0.79 -0.04 0.00 -1.56 0.00 0.00 55.97 55.22 1q8o s LYS 158 Cb 0.07 0.32 -0.03 0.00 -1.46 0.00 0.00 37.83 36.74 1q8o s LYS 158 CO 0.63 -0.08 0.13 0.95 0.16 0.00 0.00 175.35 177.14 1q8o s THR 159 N 0.30 0.11 -0.03 3.43 -4.23 -1.26 -1.12 115.64 112.83 1q8o s THR 159 Ca -0.00 -1.68 -0.03 0.00 -1.18 0.00 0.00 61.69 58.80 1q8o s THR 159 Cb -0.04 -1.88 0.01 0.00 1.34 0.00 0.00 72.50 71.93 1q8o s THR 159 CO 0.01 -0.48 0.08 0.54 -0.54 0.00 0.00 174.62 174.23 1q8o s VAL 160 N -4.00 -0.00 0.31 2.29 0.11 -0.59 -4.97 120.40 113.56 1q8o s VAL 160 Ca 0.19 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.95 1q8o s VAL 160 Cb 0.06 -0.12 -0.12 0.00 -1.53 0.00 0.00 36.38 34.68 1q8o s VAL 160 CO -0.01 0.00 1.55 1.17 -3.33 0.00 0.00 175.10 174.49 1q8o n LYS 161 N 3.05 2.66 -4.19 1.54 4.81 -1.26 -1.38 118.16 123.39 1q8o n LYS 161 Ca -0.12 0.94 -0.17 0.00 -0.87 0.00 0.00 58.31 58.09 1q8o n LYS 161 Cb 0.59 -2.70 -0.11 0.00 0.02 0.00 0.00 35.03 32.83 1q8o n LYS 161 CO 0.00 0.00 0.00 -0.46 1.17 0.00 0.00 177.40 178.11 1q8o s TRP 162 N -0.33 1.20 -0.20 5.64 -0.00 -0.54 -4.76 118.94 119.94 1q8o s TRP 162 Ca 0.61 -0.54 -0.04 0.00 -0.00 0.00 0.00 56.10 56.13 1q8o s TRP 162 Cb -0.50 -0.66 -0.02 0.00 -0.00 0.00 0.00 33.47 32.30 1q8o s TRP 162 CO 0.53 0.06 -0.03 -0.51 -0.00 0.00 0.00 176.95 177.00 1q8o s ASP 163 N -2.11 4.56 -0.18 5.86 1.01 -1.26 -4.32 116.67 120.22 1q8o s ASP 163 Ca 0.03 -0.29 -0.25 0.00 0.71 0.00 0.00 52.55 52.74 1q8o s ASP 163 Cb -0.07 -1.77 -0.01 0.00 1.01 0.00 0.00 42.92 42.08 1q8o s ASP 163 CO 0.02 0.04 0.84 -0.60 0.21 0.00 0.00 175.17 175.68 1q8o s ARG 164 N 1.15 4.28 -0.30 8.23 3.52 -1.26 -5.02 118.95 129.55 1q8o s ARG 164 Ca 0.02 1.02 0.02 0.00 -0.13 0.00 0.00 55.73 56.66 1q8o s ARG 164 Cb -0.15 -3.59 0.07 0.00 -1.56 0.00 0.00 34.95 29.73 1q8o s ARG 164 CO 0.00 -0.37 -0.03 1.03 -0.81 0.00 0.00 175.30 175.12 1q8o s ARG 165 N 2.29 2.13 0.06 5.12 0.52 -1.26 -5.08 118.95 122.74 1q8o s ARG 165 Ca 0.38 -1.46 -0.34 0.00 -0.52 0.00 0.00 55.73 53.79 1q8o s ARG 165 Cb -0.16 -3.08 -0.14 0.00 0.52 0.00 0.00 34.95 32.10 1q8o s ARG 165 CO 0.11 -0.69 1.65 -3.47 0.02 0.00 0.00 175.30 172.93 1q8o n ASP 166 N 4.46 3.03 0.00 0.23 2.03 -1.26 -1.88 116.55 123.16 1q8o n ASP 166 Ca -0.10 1.05 0.00 0.00 0.52 0.00 0.00 54.79 56.27 1q8o n ASP 166 Cb 0.42 -1.37 0.00 0.00 -0.72 0.00 0.00 41.12 39.45 1q8o n ASP 166 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1q8o n GLY 167 N 3.65 1.37 3.76 0.27 0.00 0.28 -4.98 105.19 109.54 1q8o n GLY 167 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 1q8o n GLY 167 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q8o s GLN 168 N -0.13 3.86 0.21 1.61 -0.21 -0.79 -4.88 119.66 119.34 1q8o s GLN 168 Ca 0.00 -0.22 -0.30 0.00 0.02 0.00 0.00 55.36 54.86 1q8o s GLN 168 Cb 0.00 -3.28 -0.09 0.00 1.00 0.00 0.00 33.01 30.64 1q8o s GLN 168 CO 0.00 0.47 1.23 -1.12 -2.12 0.00 0.00 175.29 173.75 1q8o s SER 169 N -0.14 7.02 -0.19 5.90 0.01 -1.26 -4.40 113.70 120.64 1q8o s SER 169 Ca 0.10 2.33 -0.05 0.00 1.31 0.00 0.00 55.95 59.63 1q8o s SER 169 Cb -0.12 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 1q8o s SER 169 CO 0.00 -0.41 0.00 -0.22 0.41 0.00 0.00 173.24 173.03 1q8o s LEU 170 N -0.45 3.34 -0.22 2.44 2.96 0.11 -4.33 118.68 122.53 1q8o s LEU 170 Ca 0.53 -0.14 -0.17 0.00 -0.22 0.00 0.00 54.13 54.12 1q8o s LEU 170 Cb -0.34 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.48 1q8o s LEU 170 CO 0.39 0.10 0.47 0.20 -1.32 0.00 0.00 176.35 176.19 1q8o s ASN 171 N 0.77 6.47 -0.04 3.68 0.01 -0.20 -2.25 114.94 123.38 1q8o s ASN 171 Ca 0.00 0.56 0.06 0.00 -0.71 0.00 0.00 52.86 52.77 1q8o s ASN 171 Cb -0.14 -2.27 -0.01 0.00 0.41 0.00 0.00 41.25 39.24 1q8o s ASN 171 CO 0.02 -0.18 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.52 1q8o s VAL 172 N 1.76 1.79 -0.15 1.60 1.01 0.60 -0.55 120.40 126.47 1q8o s VAL 172 Ca 0.21 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.25 1q8o s VAL 172 Cb -0.15 -1.50 0.02 0.00 0.00 0.00 0.00 36.38 34.75 1q8o s VAL 172 CO 0.09 0.50 -0.14 -0.22 0.00 0.00 0.00 175.10 175.34 1q8o s LEU 173 N -0.28 1.65 -0.18 3.92 2.96 0.52 -1.46 118.68 125.83 1q8o s LEU 173 Ca 0.02 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 53.46 1q8o s LEU 173 Cb -0.11 -1.16 0.01 0.00 0.50 0.00 0.00 46.19 45.43 1q8o s LEU 173 CO 0.01 -0.06 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.12 1q8o s VAL 174 N 1.50 2.30 0.02 1.68 1.01 0.62 -0.90 120.40 126.63 1q8o s VAL 174 Ca 0.05 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1q8o s VAL 174 Cb -0.13 -1.97 -0.02 0.00 0.00 0.00 0.00 36.38 34.26 1q8o s VAL 174 CO -0.11 0.52 -0.15 0.42 0.00 0.00 0.00 175.10 175.78 1q8o s THR 175 N 1.19 1.22 -0.15 3.92 -4.23 -0.03 0.37 115.64 117.92 1q8o s THR 175 Ca 0.02 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.62 1q8o s THR 175 Cb -0.14 -1.07 0.02 0.00 1.34 0.00 0.00 72.50 72.66 1q8o s THR 175 CO -0.09 0.14 -0.15 0.12 -0.54 0.00 0.00 174.62 174.11 1q8o s PHE 176 N -0.68 2.20 -0.38 3.99 5.36 0.14 0.14 117.98 128.74 1q8o s PHE 176 Ca 0.04 -1.21 -0.10 0.00 -0.96 0.00 0.00 56.93 54.69 1q8o s PHE 176 Cb -0.07 -1.60 0.04 0.00 -0.34 0.00 0.00 43.02 41.04 1q8o s PHE 176 CO 0.01 -0.65 0.20 1.21 -1.46 0.00 0.00 175.22 174.53 1q8o s ASN 177 N 1.39 5.69 0.57 6.13 3.84 -0.76 -2.41 114.94 129.39 1q8o s ASN 177 Ca 0.03 -1.08 0.33 0.00 0.21 0.00 0.00 52.86 52.36 1q8o s ASN 177 Cb -0.13 -2.00 1.71 0.00 -0.55 0.00 0.00 41.25 40.27 1q8o s ASN 177 CO -0.09 -0.40 2.14 1.55 -2.79 0.00 0.00 177.10 177.51 1q8o h PRO 178 N 8.41 0.00 -0.01 0.43 0.13 -1.87 0.96 132.00 140.05 1q8o h PRO 178 Ca -0.25 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1q8o h PRO 178 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1q8o h PRO 178 CO 0.67 0.06 0.00 1.03 -0.23 0.00 0.00 178.00 179.54 1q8o h SER 179 N 0.00 0.02 0.00 1.44 0.87 -1.93 -3.27 113.55 110.67 1q8o h SER 179 Ca -0.00 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1q8o h SER 179 Cb 0.27 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1q8o h SER 179 CO 0.01 0.21 -1.01 0.35 -0.53 0.00 0.00 176.83 175.85 1q8o n THR 180 N -4.99 0.00 -1.61 2.23 -2.24 -1.11 -4.99 114.28 101.58 1q8o n THR 180 Ca -0.07 -0.10 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 1q8o n THR 180 Cb 0.12 0.88 -0.04 0.00 -2.10 0.00 0.00 70.33 69.19 1q8o n THR 180 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1q8o n ARG 181 N -1.53 -0.95 -3.23 -0.78 1.74 0.33 -4.88 116.66 107.36 1q8o n ARG 181 Ca 0.03 0.88 -0.39 0.00 -0.77 0.00 0.00 57.85 57.60 1q8o n ARG 181 Cb 0.32 -4.99 -0.06 0.00 -1.02 0.00 0.00 32.46 26.72 1q8o n ARG 181 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1q8o s ASN 182 N -2.74 6.76 -0.38 0.55 0.01 -1.14 -0.67 114.94 117.33 1q8o s ASN 182 Ca 0.00 0.90 -0.13 0.00 -0.71 0.00 0.00 52.86 52.92 1q8o s ASN 182 Cb 0.00 -2.32 0.01 0.00 0.41 0.00 0.00 41.25 39.35 1q8o s ASN 182 CO 0.00 -0.06 0.25 -0.22 -1.51 0.00 0.00 177.10 175.56 1q8o s LEU 183 N 0.82 4.81 -0.10 0.60 2.96 0.68 -1.83 118.68 126.62 1q8o s LEU 183 Ca 0.29 -0.79 -0.03 0.00 -0.22 0.00 0.00 54.13 53.39 1q8o s LEU 183 Cb -0.16 -2.11 -0.03 0.00 0.50 0.00 0.00 46.19 44.39 1q8o s LEU 183 CO 0.12 -0.37 0.02 -1.81 -1.32 0.00 0.00 176.35 172.99 1q8o s ASP 184 N 1.65 5.35 -0.11 3.68 1.01 0.12 -1.46 116.67 126.91 1q8o s ASP 184 Ca 0.05 0.16 0.02 0.00 0.71 0.00 0.00 52.55 53.48 1q8o s ASP 184 Cb -0.19 -1.58 0.02 0.00 1.01 0.00 0.00 42.92 42.18 1q8o s ASP 184 CO 0.09 0.36 -0.15 -0.69 0.21 0.00 0.00 175.17 174.99 1q8o s VAL 185 N -0.76 1.48 -0.11 -1.27 1.01 0.10 -0.85 120.40 119.99 1q8o s VAL 185 Ca 0.12 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1q8o s VAL 185 Cb -0.12 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 34.93 1q8o s VAL 185 CO 0.02 0.44 -0.11 -0.69 0.00 0.00 0.00 175.10 174.76 1q8o s VAL 186 N 1.01 1.26 -0.05 2.92 1.01 -0.08 -1.91 120.40 124.56 1q8o s VAL 186 Ca -0.06 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.49 1q8o s VAL 186 Cb -0.15 -1.21 0.00 0.00 0.00 0.00 0.00 36.38 35.03 1q8o s VAL 186 CO -0.02 0.40 -0.15 0.00 0.00 0.00 0.00 175.10 175.34 1q8o s ALA 187 N 1.39 1.34 -0.02 5.51 0.00 -0.15 -0.35 121.76 129.48 1q8o s ALA 187 Ca 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.37 1q8o s ALA 187 Cb -0.13 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.50 1q8o s ALA 187 CO -0.06 0.21 0.07 0.95 0.00 0.00 0.00 175.76 176.94 1q8o s THR 188 N 0.22 0.02 0.46 0.00 -4.23 0.29 -0.23 115.64 112.18 1q8o s THR 188 Ca -0.06 -0.16 -0.04 0.00 -1.18 0.00 0.00 61.69 60.24 1q8o s THR 188 Cb -0.12 -0.17 -0.03 0.00 1.34 0.00 0.00 72.50 73.52 1q8o s THR 188 CO 0.02 -0.09 0.75 -0.31 -0.54 0.00 0.00 174.62 174.45 1q8o s TYR 189 N -0.25 3.53 0.58 3.99 1.51 -0.42 -1.03 117.35 125.26 1q8o s TYR 189 Ca -0.03 0.71 0.29 0.00 -1.01 0.00 0.00 57.07 57.03 1q8o s TYR 189 Cb -0.02 -2.25 1.47 0.00 -0.11 0.00 0.00 41.96 41.05 1q8o s TYR 189 CO 0.00 -0.24 1.90 0.66 -1.11 0.00 0.00 175.55 176.77 1q8o h SER 190 N 0.30 0.00 -0.02 2.29 4.64 -1.90 0.50 113.55 119.36 1q8o h SER 190 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1q8o h SER 190 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1q8o h SER 190 CO 0.61 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.67 1q8o n ASP 191 N -3.86 0.20 0.00 4.97 5.75 -1.26 -4.88 116.55 117.47 1q8o n ASP 191 Ca 0.10 -1.37 0.00 0.00 -0.01 0.00 0.00 54.79 53.51 1q8o n ASP 191 Cb 0.71 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.79 1q8o n ASP 191 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1q8o n GLY 192 N 0.87 0.64 3.67 6.12 0.00 0.17 -5.03 105.19 111.64 1q8o n GLY 192 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1q8o n GLY 192 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q8o s THR 193 N -2.23 2.82 0.06 2.61 2.01 -1.25 -4.79 115.64 114.88 1q8o s THR 193 Ca 0.00 0.04 0.08 0.00 0.31 0.00 0.00 61.69 62.12 1q8o s THR 193 Cb 0.00 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 1q8o s THR 193 CO 0.00 -0.00 -0.20 -0.60 -0.69 0.00 0.00 174.62 173.13 1q8o s ARG 194 N 3.74 1.94 -0.02 4.92 3.52 -1.26 -1.30 118.95 130.49 1q8o s ARG 194 Ca 0.85 -1.06 0.02 0.00 -0.13 0.00 0.00 55.73 55.41 1q8o s ARG 194 Cb -0.44 -2.12 0.01 0.00 -1.56 0.00 0.00 34.95 30.84 1q8o s ARG 194 CO 0.39 0.52 -0.06 0.71 -0.81 0.00 0.00 175.30 176.06 1q8o s TYR 195 N -0.94 0.69 0.00 5.12 1.51 0.68 -4.99 117.35 119.42 1q8o s TYR 195 Ca 0.15 -0.16 0.03 0.00 -1.01 0.00 0.00 57.07 56.07 1q8o s TYR 195 Cb -0.10 -0.54 -0.01 0.00 -0.11 0.00 0.00 41.96 41.20 1q8o s TYR 195 CO 0.05 -0.10 -0.10 -1.21 -1.11 0.00 0.00 175.55 173.09 1q8o s GLU 196 N 0.38 0.73 -0.22 -0.62 2.02 -1.26 -0.98 118.70 118.75 1q8o s GLU 196 Ca -0.05 -0.42 -0.16 0.00 0.02 0.00 0.00 54.97 54.36 1q8o s GLU 196 Cb -0.09 -0.69 0.06 0.00 0.10 0.00 0.00 34.13 33.51 1q8o s GLU 196 CO 0.00 0.18 0.57 0.54 0.02 0.00 0.00 175.26 176.57 1q8o s VAL 197 N -0.40 -0.01 0.10 2.63 0.11 -0.80 -4.87 120.40 117.15 1q8o s VAL 197 Ca 0.02 0.02 -0.02 0.00 -2.93 0.00 0.00 61.98 59.07 1q8o s VAL 197 Cb -0.05 -0.81 -0.04 0.00 -1.53 0.00 0.00 36.38 33.96 1q8o s VAL 197 CO -0.00 0.01 0.05 -0.94 -3.33 0.00 0.00 175.10 170.89 1q8o s SER 198 N 0.92 0.34 -0.21 3.54 1.04 -1.26 -0.72 113.70 117.35 1q8o s SER 198 Ca -0.05 -1.07 -0.25 0.00 0.48 0.00 0.00 55.95 55.06 1q8o s SER 198 Cb -0.05 0.27 0.07 0.00 0.10 0.00 0.00 66.02 66.41 1q8o s SER 198 CO -0.08 -0.69 0.68 -0.47 0.98 0.00 0.00 173.24 173.65 1q8o s TYR 199 N -3.98 -0.72 -0.20 5.02 6.14 -0.54 -4.97 117.35 118.10 1q8o s TYR 199 Ca 0.16 1.67 -0.21 0.00 0.64 0.00 0.00 57.07 59.34 1q8o s TYR 199 Cb 0.07 0.28 -0.03 0.00 0.42 0.00 0.00 41.96 42.71 1q8o s TYR 199 CO -0.04 -0.41 0.63 -2.00 0.64 0.00 0.00 175.55 174.38 1q8o s GLU 200 N 0.04 4.21 -0.09 4.97 2.12 -1.26 -0.23 118.70 128.46 1q8o s GLU 200 Ca -0.02 0.62 -0.06 0.00 0.36 0.00 0.00 54.97 55.86 1q8o s GLU 200 Cb -0.04 -3.58 0.03 0.00 0.26 0.00 0.00 34.13 30.81 1q8o s GLU 200 CO 0.03 -0.23 0.23 0.54 -0.54 0.00 0.00 175.26 175.28 1q8o s VAL 201 N 1.89 -0.02 -0.67 3.70 0.11 0.15 -4.98 120.40 120.58 1q8o s VAL 201 Ca 0.29 0.08 -0.22 0.00 -2.93 0.00 0.00 61.98 59.20 1q8o s VAL 201 Cb -0.16 -0.34 0.08 0.00 -1.53 0.00 0.00 36.38 34.43 1q8o s VAL 201 CO 0.10 0.03 0.93 -0.62 -3.33 0.00 0.00 175.10 172.22 1q8o s ASP 202 N 0.71 6.21 0.62 3.54 -1.08 -1.26 -4.75 116.67 120.66 1q8o s ASP 202 Ca -0.05 -1.16 0.33 0.00 -0.52 0.00 0.00 52.55 51.16 1q8o s ASP 202 Cb -0.06 -2.40 1.89 0.00 -1.46 0.00 0.00 42.92 40.89 1q8o s ASP 202 CO -0.04 -1.36 2.18 -0.37 0.52 0.00 0.00 175.17 176.11 1q8o h VAL 203 N 5.95 0.31 -0.52 1.11 -1.51 -1.96 -2.25 116.25 117.39 1q8o h VAL 203 Ca -0.25 0.00 -0.05 0.00 -1.23 0.00 0.00 66.70 65.17 1q8o h VAL 203 Cb 1.07 0.90 -0.02 0.00 -2.13 0.00 0.00 31.29 31.10 1q8o h VAL 203 CO 1.16 0.00 0.13 0.03 -1.23 0.00 0.00 177.57 177.66 1q8o h ARG 204 N 0.00 0.79 -0.01 5.19 3.08 -1.90 -0.05 114.38 121.49 1q8o h ARG 204 Ca 0.03 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1q8o h ARG 204 Cb 0.27 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1q8o h ARG 204 CO -0.00 0.71 -0.07 -1.13 -1.07 0.00 0.00 179.97 178.41 1q8o n SER 205 N -4.28 0.62 -0.06 7.04 3.41 -0.85 -4.19 113.62 115.31 1q8o n SER 205 Ca 0.04 -0.87 -0.10 0.00 -0.26 0.00 0.00 58.87 57.68 1q8o n SER 205 Cb 0.22 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.09 1q8o n SER 205 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1q8o n VAL 206 N -0.71 0.66 -4.38 -3.33 0.31 -0.95 -5.06 118.33 104.86 1q8o n VAL 206 Ca 0.17 -0.22 -0.27 0.00 -0.01 0.00 0.00 64.34 64.01 1q8o n VAL 206 Cb 0.26 -1.18 -0.11 0.00 -0.91 0.00 0.00 33.84 31.90 1q8o n VAL 206 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1q8o s LEU 207 N -6.03 2.61 1.03 7.52 1.43 -0.07 -4.60 118.68 120.56 1q8o s LEU 207 Ca -0.16 -0.78 -0.13 0.00 -1.03 0.00 0.00 54.13 52.03 1q8o s LEU 207 Cb 0.05 -1.32 0.20 0.00 0.03 0.00 0.00 46.19 45.15 1q8o s LEU 207 CO 0.25 0.11 1.10 -2.16 0.23 0.00 0.00 176.35 175.88 1q8o s PRO 208 N -2.74 0.17 0.25 1.29 0.04 -1.26 -4.59 135.00 128.15 1q8o s PRO 208 Ca 0.22 0.37 -0.06 0.00 0.04 0.00 0.00 61.00 61.58 1q8o s PRO 208 Cb -0.08 -1.72 0.27 0.00 0.04 0.00 0.00 34.50 33.01 1q8o s PRO 208 CO 0.12 -2.88 1.92 0.93 0.04 0.00 0.00 177.00 177.13 1q8o h GLU 209 N -1.99 1.30 -5.54 4.56 5.08 -1.94 -3.41 114.58 112.63 1q8o h GLU 209 Ca -0.53 -0.08 -0.65 0.00 -1.00 0.00 0.00 59.36 57.10 1q8o h GLU 209 Cb 1.33 -0.29 -0.19 0.00 0.50 0.00 0.00 28.75 30.09 1q8o h GLU 209 CO 0.55 0.86 -0.65 -1.58 -1.00 0.00 0.00 179.01 177.19 1q8o s TRP 210 N -6.11 3.07 0.35 4.33 0.52 -1.26 -0.50 118.94 119.34 1q8o s TRP 210 Ca -0.13 -0.11 0.07 0.00 0.02 0.00 0.00 56.10 55.94 1q8o s TRP 210 Cb 0.18 -1.91 -0.03 0.00 -1.15 0.00 0.00 33.47 30.57 1q8o s TRP 210 CO 0.82 0.14 0.25 0.14 0.02 0.00 0.00 176.95 178.31 1q8o s VAL 211 N -0.04 0.12 0.02 4.03 -7.23 -0.07 -4.26 120.40 112.96 1q8o s VAL 211 Ca 0.02 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.23 1q8o s VAL 211 Cb -0.13 -2.45 -0.02 0.00 0.56 0.00 0.00 36.38 34.34 1q8o s VAL 211 CO 0.02 0.00 -0.13 -0.13 -0.31 0.00 0.00 175.10 174.55 1q8o s ARG 212 N -3.50 0.94 0.13 4.82 0.52 -0.12 0.05 118.95 121.80 1q8o s ARG 212 Ca 0.37 -0.61 0.09 0.00 -0.52 0.00 0.00 55.73 55.05 1q8o s ARG 212 Cb 0.02 -0.93 -0.04 0.00 0.52 0.00 0.00 34.95 34.53 1q8o s ARG 212 CO 0.25 0.24 -0.14 0.14 0.02 0.00 0.00 175.30 175.81 1q8o s VAL 213 N -0.61 3.06 0.00 3.52 -7.23 -1.26 -1.67 120.40 116.21 1q8o s VAL 213 Ca 0.03 -1.50 0.00 0.00 -1.81 0.00 0.00 61.98 58.69 1q8o s VAL 213 Cb -0.06 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.43 1q8o s VAL 213 CO 0.00 0.04 0.00 0.61 -0.31 0.00 0.00 175.10 175.44 1q8o n GLY 214 N 0.55 1.04 3.16 2.32 0.00 -0.64 -1.78 105.19 109.83 1q8o n GLY 214 Ca -0.14 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.15 1q8o n GLY 214 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1q8o s PHE 215 N -2.11 0.95 0.01 1.61 0.40 -0.35 -1.14 117.98 117.36 1q8o s PHE 215 Ca 0.00 -0.71 -0.01 0.00 -0.60 0.00 0.00 56.93 55.61 1q8o s PHE 215 Cb 0.00 -0.53 -0.01 0.00 0.51 0.00 0.00 43.02 42.98 1q8o s PHE 215 CO 0.00 -0.06 0.00 0.45 0.70 0.00 0.00 175.22 176.32 1q8o s SER 216 N -2.48 0.17 0.08 1.36 0.15 0.12 -1.55 113.70 111.54 1q8o s SER 216 Ca 0.05 -0.37 -0.17 0.00 0.70 0.00 0.00 55.95 56.16 1q8o s SER 216 Cb -0.02 0.11 0.03 0.00 -1.71 0.00 0.00 66.02 64.43 1q8o s SER 216 CO -0.01 -0.26 0.40 0.00 1.20 0.00 0.00 173.24 174.57 1q8o s ALA 217 N -1.20 -0.95 0.05 5.45 0.00 -0.38 -0.13 121.76 124.60 1q8o s ALA 217 Ca -0.13 0.13 -0.27 0.00 0.00 0.00 0.00 51.96 51.70 1q8o s ALA 217 Cb -0.08 0.49 0.08 0.00 0.00 0.00 0.00 23.12 23.61 1q8o s ALA 217 CO -0.00 -0.53 0.69 0.00 0.00 0.00 0.00 175.76 175.91 1q8o s ALA 218 N -3.04 -1.71 -0.03 0.00 0.00 -1.20 -1.51 121.76 114.27 1q8o s ALA 218 Ca -0.02 0.90 0.01 0.00 0.00 0.00 0.00 51.96 52.85 1q8o s ALA 218 Cb 0.00 0.44 0.02 0.00 0.00 0.00 0.00 23.12 23.58 1q8o s ALA 218 CO -0.06 -0.60 -0.02 -1.12 0.00 0.00 0.00 175.76 173.96 1q8o s SER 219 N -2.11 0.57 0.00 0.00 0.01 0.42 0.08 113.70 112.69 1q8o s SER 219 Ca -0.03 -0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.17 1q8o s SER 219 Cb -0.01 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 65.95 1q8o s SER 219 CO -0.04 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.15 1q8o n GLY 220 N 3.98 0.56 0.12 3.44 0.00 -1.26 -1.42 105.19 110.62 1q8o n GLY 220 Ca -0.25 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.76 1q8o n GLY 220 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1q8o h GLU 221 N 0.00 0.00 -6.03 1.61 5.08 -1.97 0.12 114.58 113.39 1q8o h GLU 221 Ca 0.00 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.76 1q8o h GLU 221 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1q8o h GLU 221 CO 0.00 0.65 -0.36 -0.65 -1.00 0.00 0.00 179.01 177.65 1q8o s GLN 222 N -3.12 3.60 0.20 2.33 -1.52 -1.26 -4.84 119.66 115.04 1q8o s GLN 222 Ca 0.01 -0.10 -0.03 0.00 -1.95 0.00 0.00 55.36 53.29 1q8o s GLN 222 Cb 0.10 -2.98 -0.03 0.00 -0.22 0.00 0.00 33.01 29.88 1q8o s GLN 222 CO 0.76 0.56 0.17 1.52 -0.25 0.00 0.00 175.29 178.05 1q8o s TYR 223 N -1.48 1.00 0.00 0.91 1.13 -1.25 -4.11 117.35 113.55 1q8o s TYR 223 Ca 0.34 -1.26 0.00 0.00 -1.41 0.00 0.00 57.07 54.74 1q8o s TYR 223 Cb -0.13 -0.44 0.00 0.00 -1.10 0.00 0.00 41.96 40.29 1q8o s TYR 223 CO 0.21 -0.67 0.00 0.00 -2.51 0.00 0.00 175.55 172.58 1q8o n GLN 224 N -0.26 0.00 -2.84 -3.49 10.64 -1.16 -3.45 117.38 116.83 1q8o n GLN 224 Ca 0.00 0.00 -0.36 0.00 -1.83 0.00 0.00 57.00 54.81 1q8o n GLN 224 Cb 0.65 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.97 1q8o n GLN 224 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 1q8o s THR 225 N -2.00 4.30 -0.51 -0.39 -4.23 0.79 -4.85 115.64 108.75 1q8o s THR 225 Ca 0.00 1.69 0.04 0.00 -1.18 0.00 0.00 61.69 62.23 1q8o s THR 225 Cb 0.00 -3.93 0.13 0.00 1.34 0.00 0.00 72.50 70.04 1q8o s THR 225 CO 0.00 0.09 0.25 -1.00 -0.54 0.00 0.00 174.62 173.42 1q8o s HIS 226 N -1.68 3.16 -0.46 3.99 0.09 -1.26 -3.11 115.29 116.02 1q8o s HIS 226 Ca 0.51 -3.14 -0.18 0.00 -0.00 0.00 0.00 55.06 52.25 1q8o s HIS 226 Cb -0.17 -2.79 0.04 0.00 -0.00 0.00 0.00 32.58 29.67 1q8o s HIS 226 CO 0.22 -0.75 0.51 0.99 -0.00 0.00 0.00 174.74 175.71 1q8o s THR 227 N -0.21 5.02 -0.31 1.30 2.01 -0.60 -2.23 115.64 120.62 1q8o s THR 227 Ca 0.17 -0.50 -0.26 0.00 0.31 0.00 0.00 61.69 61.41 1q8o s THR 227 Cb -0.26 -4.16 0.01 0.00 0.01 0.00 0.00 72.50 68.10 1q8o s THR 227 CO -0.00 -0.60 0.90 -0.22 -0.69 0.00 0.00 174.62 174.01 1q8o s LEU 228 N 2.27 4.04 -0.16 4.42 2.96 -0.18 -1.53 118.68 130.50 1q8o s LEU 228 Ca 0.12 0.82 0.03 0.00 -0.22 0.00 0.00 54.13 54.88 1q8o s LEU 228 Cb -0.19 -3.26 -0.23 0.00 0.50 0.00 0.00 46.19 43.01 1q8o s LEU 228 CO 0.12 -0.72 0.20 -0.62 -1.32 0.00 0.00 176.35 174.02 1q8o n GLU 229 N 6.45 0.70 -3.60 1.98 1.02 -0.09 -0.96 120.64 126.14 1q8o n GLU 229 Ca 0.07 0.20 -0.11 0.00 -0.02 0.00 0.00 57.16 57.30 1q8o n GLU 229 Cb 0.48 -1.64 -0.04 0.00 -0.02 0.00 0.00 31.44 30.21 1q8o n GLU 229 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1q8o s SER 230 N -6.51 -0.31 -0.29 1.62 1.04 -1.21 -4.24 113.70 103.81 1q8o s SER 230 Ca -0.21 -0.18 -0.14 0.00 0.48 0.00 0.00 55.95 55.89 1q8o s SER 230 Cb 0.07 0.49 0.12 0.00 0.10 0.00 0.00 66.02 66.80 1q8o s SER 230 CO 0.74 -0.83 0.77 0.86 0.98 0.00 0.00 173.24 175.75 1q8o s TRP 231 N -3.49 -1.01 0.07 5.02 -0.00 -0.41 -2.14 118.94 116.98 1q8o s TRP 231 Ca 0.01 1.89 0.07 0.00 -0.00 0.00 0.00 56.10 58.07 1q8o s TRP 231 Cb 0.01 0.60 -0.03 0.00 -0.00 0.00 0.00 33.47 34.05 1q8o s TRP 231 CO -0.10 -0.50 -0.20 -1.54 -0.00 0.00 0.00 176.95 174.62 1q8o s SER 232 N 2.04 2.34 -0.03 5.86 1.04 0.67 0.89 113.70 126.52 1q8o s SER 232 Ca -0.08 -0.59 -0.07 0.00 0.48 0.00 0.00 55.95 55.70 1q8o s SER 232 Cb -0.07 -0.16 0.01 0.00 0.10 0.00 0.00 66.02 65.91 1q8o s SER 232 CO -0.18 0.09 0.17 0.12 0.98 0.00 0.00 173.24 174.41 1q8o s PHE 233 N -0.98 -0.08 -0.21 5.02 2.19 0.33 -1.50 117.98 122.75 1q8o s PHE 233 Ca 0.06 0.19 -0.15 0.00 0.33 0.00 0.00 56.93 57.35 1q8o s PHE 233 Cb -0.09 0.01 0.06 0.00 -1.31 0.00 0.00 43.02 41.69 1q8o s PHE 233 CO 0.03 -0.20 0.53 -0.08 1.83 0.00 0.00 175.22 177.33 1q8o s THR 234 N -0.66 -0.01 0.01 0.12 -1.32 -0.80 -1.20 115.64 111.78 1q8o s THR 234 Ca -0.07 0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.44 1q8o s THR 234 Cb -0.04 -0.76 -0.01 0.00 -1.51 0.00 0.00 72.50 70.18 1q8o s THR 234 CO 0.01 0.01 -0.01 -0.94 -2.21 0.00 0.00 174.62 171.48 1q8o s SER 235 N 0.94 0.13 -0.03 8.08 1.04 -0.37 -0.71 113.70 122.78 1q8o s SER 235 Ca -0.05 -0.16 -0.01 0.00 0.48 0.00 0.00 55.95 56.21 1q8o s SER 235 Cb -0.06 0.03 0.03 0.00 0.10 0.00 0.00 66.02 66.12 1q8o s SER 235 CO -0.08 -0.09 0.03 -0.89 0.98 0.00 0.00 173.24 173.19 1q8o s THR 236 N -0.46 -0.00 0.09 2.02 2.01 -0.26 -1.64 115.64 117.40 1q8o s THR 236 Ca -0.05 0.24 -0.31 0.00 0.31 0.00 0.00 61.69 61.89 1q8o s THR 236 Cb -0.03 -0.16 -0.07 0.00 0.01 0.00 0.00 72.50 72.24 1q8o s THR 236 CO -0.00 0.13 1.32 -0.76 -0.69 0.00 0.00 174.62 174.62 1q8o s LEU 237 N 1.41 4.37 0.09 4.42 1.43 -0.56 -0.47 118.68 129.38 1q8o s LEU 237 Ca -0.05 2.21 0.05 0.00 -1.03 0.00 0.00 54.13 55.31 1q8o s LEU 237 Cb -0.13 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.48 1q8o s LEU 237 CO -0.03 -0.59 -0.13 -0.76 0.23 0.00 0.00 176.35 175.08 1q8o s LEU 238 N 1.10 2.35 0.17 1.79 1.43 -0.64 -4.92 118.68 119.96 1q8o s LEU 238 Ca 0.62 -0.72 -0.10 0.00 -1.03 0.00 0.00 54.13 52.90 1q8o s LEU 238 Cb -0.34 -0.44 -0.07 0.00 0.03 0.00 0.00 46.19 45.37 1q8o s LEU 238 CO 0.30 -0.16 0.50 -0.31 0.23 0.00 0.00 176.35 176.91 1q8o s TYR 239 N -1.85 3.50 -0.05 0.29 2.02 -1.26 -1.94 117.35 118.06 1q8o s TYR 239 Ca 0.03 0.85 -0.04 0.00 -0.37 0.00 0.00 57.07 57.54 1q8o s TYR 239 Cb -0.07 -2.23 0.02 0.00 -0.40 0.00 0.00 41.96 39.28 1q8o s TYR 239 CO 0.02 0.37 0.12 0.99 -1.57 0.00 0.00 175.55 175.47 1q8o s THR 240 N -1.65 -0.01 0.00 -0.71 2.01 -1.26 -5.00 115.64 109.02 1q8o s THR 240 Ca 0.42 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.45 1q8o s THR 240 Cb -0.13 -0.18 0.00 0.00 0.01 0.00 0.00 72.50 72.21 1q8o s THR 240 CO 0.21 0.01 0.00 0.00 -0.69 0.00 0.00 174.62 174.15