#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mei s LYS 3 N 0.00 3.53 0.44 0.00 2.20 -1.26 -5.11 119.74 119.54 1mei s LYS 3 Ca 0.00 -0.45 0.06 0.00 -0.36 0.00 0.00 55.97 55.22 1mei s LYS 3 Cb 0.00 -2.94 -0.05 0.00 -1.51 0.00 0.00 37.83 33.34 1mei s LYS 3 CO 0.00 0.38 0.12 0.71 -0.36 0.00 0.00 175.35 176.20 1mei s TYR 4 N 0.01 2.37 0.18 4.03 2.02 -1.26 -5.16 117.35 119.54 1mei s TYR 4 Ca 0.02 -0.69 0.10 0.00 -0.37 0.00 0.00 57.07 56.13 1mei s TYR 4 Cb -0.13 -1.85 -0.04 0.00 -0.40 0.00 0.00 41.96 39.54 1mei s TYR 4 CO 0.02 0.20 -0.22 0.71 -1.57 0.00 0.00 175.55 174.70 1mei s TYR 5 N -2.69 2.10 0.07 2.71 1.51 -1.26 -5.04 117.35 114.75 1mei s TYR 5 Ca 0.33 -0.40 0.19 0.00 -1.01 0.00 0.00 57.07 56.17 1mei s TYR 5 Cb 0.05 -1.05 0.55 0.00 -0.11 0.00 0.00 41.96 41.40 1mei s TYR 5 CO 0.18 0.43 1.67 -0.91 -1.11 0.00 0.00 175.55 175.80 1mei h ASN 6 N 3.26 0.00 -4.48 2.29 -0.26 -2.08 -3.45 115.58 110.86 1mei h ASN 6 Ca -0.45 0.00 -0.40 0.00 -0.56 0.00 0.00 56.30 54.89 1mei h ASN 6 Cb 1.21 0.00 -0.21 0.00 -1.06 0.00 0.00 38.32 38.25 1mei h ASN 6 CO 0.49 0.39 -0.77 -1.61 -1.06 0.00 0.00 177.43 174.86 1mei s GLU 7 N -3.43 0.81 0.67 0.81 0.41 -1.26 -5.14 118.70 111.57 1mei s GLU 7 Ca 0.01 -0.96 -0.11 0.00 -0.41 0.00 0.00 54.97 53.50 1mei s GLU 7 Cb 0.10 -0.79 -0.01 0.00 -1.78 0.00 0.00 34.13 31.65 1mei s GLU 7 CO 0.69 0.17 1.05 -1.25 -0.49 0.00 0.00 175.26 175.44 1mei s PRO 8 N -1.80 3.11 0.53 0.39 0.04 -1.26 -5.03 135.00 130.97 1mei s PRO 8 Ca -0.02 0.93 -0.10 0.00 0.04 0.00 0.00 61.00 61.85 1mei s PRO 8 Cb -0.10 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 1mei s PRO 8 CO 0.02 -0.96 0.91 0.00 0.04 0.00 0.00 177.00 177.01 1mei s HIS 10 N -2.83 1.28 0.42 0.00 3.76 -1.26 -4.78 115.29 111.89 1mei s HIS 10 Ca 0.53 -0.62 0.08 0.00 -0.15 0.00 0.00 55.06 54.90 1mei s HIS 10 Cb -0.11 -0.67 0.01 0.00 1.11 0.00 0.00 32.58 32.92 1mei s HIS 10 CO 0.44 0.10 0.54 0.95 -0.85 0.00 0.00 174.74 175.91 1mei s THR 11 N -2.45 2.92 0.52 1.30 -4.23 -1.26 -2.45 115.64 109.99 1mei s THR 11 Ca 0.10 -1.07 0.17 0.00 -1.18 0.00 0.00 61.69 59.71 1mei s THR 11 Cb -0.03 -2.98 0.28 0.00 1.34 0.00 0.00 72.50 71.10 1mei s THR 11 CO 0.02 0.00 2.15 -0.26 -0.54 0.00 0.00 174.62 175.99 1mei h PHE 12 N 0.71 0.00 0.00 3.99 0.04 -1.93 -2.20 116.94 117.55 1mei h PHE 12 Ca -0.40 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.37 1mei h PHE 12 Cb 1.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.43 1mei h PHE 12 CO 0.42 0.00 0.00 0.09 -0.60 0.00 0.00 178.31 178.22 1mei n ASN 13 N -4.51 0.27 -0.91 2.17 3.02 -1.26 -2.23 115.26 111.81 1mei n ASN 13 Ca -0.02 0.59 0.09 0.00 -0.03 0.00 0.00 54.58 55.21 1mei n ASN 13 Cb 0.11 -0.64 0.26 0.00 -0.61 0.00 0.00 39.78 38.90 1mei n ASN 13 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1mei n GLU 14 N -1.83 2.16 -4.32 3.52 1.02 -0.83 -4.94 120.64 115.42 1mei n GLU 14 Ca 0.01 -1.78 -0.22 0.00 -0.02 0.00 0.00 57.16 55.16 1mei n GLU 14 Cb 0.11 -1.42 -0.11 0.00 -0.02 0.00 0.00 31.44 30.00 1mei n GLU 14 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1mei s TYR 15 N -1.44 1.79 0.04 -0.32 2.02 -0.95 0.27 117.35 118.75 1mei s TYR 15 Ca 0.35 -0.47 -0.01 0.00 -0.37 0.00 0.00 57.07 56.57 1mei s TYR 15 Cb 0.19 -0.90 -0.03 0.00 -0.40 0.00 0.00 41.96 40.81 1mei s TYR 15 CO 0.26 0.31 -0.02 -0.51 -1.57 0.00 0.00 175.55 174.01 1mei s LEU 16 N -2.57 2.31 -0.15 -1.29 1.43 -0.46 -4.94 118.68 113.00 1mei s LEU 16 Ca 0.14 -0.73 -0.09 0.00 -1.03 0.00 0.00 54.13 52.43 1mei s LEU 16 Cb -0.06 0.20 -0.05 0.00 0.03 0.00 0.00 46.19 46.31 1mei s LEU 16 CO 0.06 -0.46 0.16 -0.76 0.23 0.00 0.00 176.35 175.59 1mei s LEU 17 N -2.18 4.31 -0.24 1.79 1.43 -1.26 -1.27 118.68 121.26 1mei s LEU 17 Ca -0.05 0.41 -0.10 0.00 -1.03 0.00 0.00 54.13 53.36 1mei s LEU 17 Cb -0.01 -2.13 -0.05 0.00 0.03 0.00 0.00 46.19 44.03 1mei s LEU 17 CO -0.05 0.29 0.16 -0.63 0.23 0.00 0.00 176.35 176.35 1mei s ILE 18 N -0.39 5.33 0.64 -0.59 1.01 0.03 -4.98 121.20 122.26 1mei s ILE 18 Ca 0.13 0.17 -0.17 0.00 0.00 0.00 0.00 60.65 60.78 1mei s ILE 18 Cb -0.12 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1mei s ILE 18 CO 0.02 0.33 0.91 -2.65 0.00 0.00 0.00 174.94 173.55 1mei n PRO 19 N 4.39 0.73 -1.78 2.79 -0.02 -1.26 -4.26 135.00 135.58 1mei n PRO 19 Ca -0.15 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1mei n PRO 19 Cb 0.52 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1mei n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mei n GLY 20 N 1.31 4.04 3.66 -1.23 0.00 0.10 -4.96 105.19 108.11 1mei n GLY 20 Ca 0.13 -2.19 -0.43 0.00 0.00 0.00 0.00 46.02 43.54 1mei n GLY 20 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mei s LEU 21 N 0.00 4.23 -0.30 0.99 2.96 -1.26 -4.59 118.68 120.71 1mei s LEU 21 Ca 0.00 1.86 -0.14 0.00 -0.22 0.00 0.00 54.13 55.63 1mei s LEU 21 Cb 0.00 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.12 1mei s LEU 21 CO 0.00 -0.79 0.34 -0.44 -1.32 0.00 0.00 176.35 174.15 1mei s SER 22 N 2.26 6.19 0.52 3.68 0.01 -1.26 -3.88 113.70 121.22 1mei s SER 22 Ca 0.60 0.06 -0.06 0.00 1.31 0.00 0.00 55.95 57.86 1mei s SER 22 Cb -0.25 -2.19 -0.02 0.00 0.21 0.00 0.00 66.02 63.76 1mei s SER 22 CO 0.20 -0.22 0.83 0.42 0.41 0.00 0.00 173.24 174.88 1mei s THR 23 N 2.01 4.47 0.47 1.44 -4.23 -1.26 -4.99 115.64 113.54 1mei s THR 23 Ca 0.13 0.15 0.13 0.00 -1.18 0.00 0.00 61.69 60.91 1mei s THR 23 Cb -0.16 -3.72 0.29 0.00 1.34 0.00 0.00 72.50 70.24 1mei s THR 23 CO 0.11 -0.73 2.08 -0.37 -0.54 0.00 0.00 174.62 175.17 1mei h VAL 24 N 0.07 1.01 0.00 2.29 -1.51 -2.01 -2.19 116.25 113.91 1mei h VAL 24 Ca -0.46 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 64.91 1mei h VAL 24 Cb 1.22 0.71 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 1mei h VAL 24 CO 0.61 0.05 0.00 -0.90 -1.23 0.00 0.00 177.57 176.10 1mei n ASP 25 N -4.49 0.00 -4.37 4.19 3.85 -1.26 -4.65 116.55 109.82 1mei n ASP 25 Ca 0.02 -0.23 -0.45 0.00 -0.71 0.00 0.00 54.79 53.43 1mei n ASP 25 Cb 0.15 -0.24 -0.04 0.00 -1.35 0.00 0.00 41.12 39.64 1mei n ASP 25 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1mei s ILE 27 N 2.56 1.42 0.30 0.00 -4.36 -1.26 -4.89 121.20 114.98 1mei s ILE 27 Ca 0.12 -1.29 0.04 0.00 -0.26 0.00 0.00 60.65 59.25 1mei s ILE 27 Cb -0.24 -1.29 0.35 0.00 1.25 0.00 0.00 42.46 42.53 1mei s ILE 27 CO 0.05 -0.03 1.61 -0.65 0.24 0.00 0.00 174.94 176.17 1mei h PRO 28 N 4.49 0.10 0.00 0.37 0.11 -1.94 0.13 132.00 135.26 1mei h PRO 28 Ca -0.42 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.68 1mei h PRO 28 Cb 1.18 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1mei h PRO 28 CO 0.42 0.07 -0.03 0.66 -0.21 0.00 0.00 178.00 178.91 1mei h SER 29 N 0.10 0.00 -0.10 -2.05 4.64 -1.96 -1.60 113.55 112.58 1mei h SER 29 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 1mei h SER 29 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1mei h SER 29 CO -0.77 0.03 0.00 0.59 -0.87 0.00 0.00 176.83 175.81 1mei n ASN 30 N -3.55 2.45 -4.71 4.97 3.02 0.44 -4.91 115.26 112.97 1mei n ASN 30 Ca -0.03 -1.81 -0.42 0.00 -0.03 0.00 0.00 54.58 52.30 1mei n ASN 30 Cb 0.12 -0.05 -0.03 0.00 -0.61 0.00 0.00 39.78 39.21 1mei n ASN 30 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1mei s VAL 31 N -1.89 4.58 -0.31 2.41 1.01 -0.60 -4.94 120.40 120.66 1mei s VAL 31 Ca 0.33 1.88 -0.12 0.00 0.00 0.00 0.00 61.98 64.07 1mei s VAL 31 Cb 0.20 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1mei s VAL 31 CO 0.31 0.16 0.22 0.21 0.00 0.00 0.00 175.10 176.00 1mei s ASN 32 N 0.93 6.04 -0.21 3.32 3.04 0.16 -4.97 114.94 123.25 1mei s ASN 32 Ca 0.53 -0.18 0.15 0.00 0.04 0.00 0.00 52.86 53.40 1mei s ASN 32 Cb -0.24 -2.13 0.77 0.00 -1.54 0.00 0.00 41.25 38.12 1mei s ASN 32 CO 0.29 -0.13 1.70 0.18 -3.04 0.00 0.00 177.10 176.09 1mei n LEU 33 N 5.09 5.37 -4.76 3.21 4.32 -1.26 -3.75 117.00 125.22 1mei n LEU 33 Ca -0.13 -2.86 -0.34 0.00 -0.02 0.00 0.00 56.01 52.66 1mei n LEU 33 Cb 0.51 -0.65 0.04 0.00 -1.62 0.00 0.00 43.42 41.70 1mei n LEU 33 CO 0.35 0.67 0.78 -0.44 -1.22 0.00 0.00 177.39 177.53 1mei s SER 34 N -0.94 5.15 -0.14 -1.43 0.01 -1.22 -3.55 113.70 111.58 1mei s SER 34 Ca 0.53 2.18 -0.29 0.00 1.31 0.00 0.00 55.95 59.68 1mei s SER 34 Cb 0.39 -2.57 0.08 0.00 0.21 0.00 0.00 66.02 64.13 1mei s SER 34 CO 0.17 -1.61 0.75 0.28 0.41 0.00 0.00 173.24 173.23 1mei s THR 35 N -1.98 0.00 0.26 1.44 -1.32 -0.94 -4.69 115.64 108.41 1mei s THR 35 Ca 0.72 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.90 1mei s THR 35 Cb -0.25 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.65 1mei s THR 35 CO 0.36 0.00 1.22 -2.16 -2.21 0.00 0.00 174.62 171.84 1mei s PRO 36 N -0.61 4.48 -0.22 7.08 0.04 -1.26 -0.71 135.00 143.79 1mei s PRO 36 Ca -0.06 1.99 -0.03 0.00 0.04 0.00 0.00 61.00 62.94 1mei s PRO 36 Cb -0.02 -3.17 -0.19 0.00 0.04 0.00 0.00 34.50 31.17 1mei s PRO 36 CO 0.05 -0.06 -0.08 -0.11 0.04 0.00 0.00 177.00 176.85 1mei n LEU 37 N 1.64 2.72 -4.41 -3.56 7.94 -0.13 -4.80 117.00 116.40 1mei n LEU 37 Ca 0.02 0.03 -0.23 0.00 -1.11 0.00 0.00 56.01 54.72 1mei n LEU 37 Cb 0.43 -0.96 -0.11 0.00 0.53 0.00 0.00 43.42 43.32 1mei n LEU 37 CO 0.57 0.85 -0.48 0.68 -1.11 0.00 0.00 177.39 177.89 1mei s VAL 38 N -2.52 2.20 0.73 1.96 -7.23 -1.26 -4.57 120.40 109.71 1mei s VAL 38 Ca -0.32 -2.20 -0.15 0.00 -1.81 0.00 0.00 61.98 57.49 1mei s VAL 38 Cb 0.09 -2.13 0.04 0.00 0.56 0.00 0.00 36.38 34.93 1mei s VAL 38 CO 0.63 -0.36 1.23 -1.59 -0.31 0.00 0.00 175.10 174.70 1mei s LYS 39 N -3.22 2.13 0.23 4.82 -2.85 0.84 -4.61 119.74 117.08 1mei s LYS 39 Ca 0.24 1.83 -0.14 0.00 -1.00 0.00 0.00 55.97 56.90 1mei s LYS 39 Cb -0.05 -1.82 0.00 0.00 -2.06 0.00 0.00 37.83 33.90 1mei s LYS 39 CO 0.11 -1.86 0.49 -0.59 0.10 0.00 0.00 175.35 173.60 1mei s PHE 40 N -1.87 0.23 0.42 1.78 -0.71 -1.06 -4.75 117.98 112.02 1mei s PHE 40 Ca 0.76 -0.60 -0.01 0.00 -1.04 0.00 0.00 56.93 56.04 1mei s PHE 40 Cb -0.31 0.25 -0.02 0.00 -1.21 0.00 0.00 43.02 41.73 1mei s PHE 40 CO 0.45 -0.98 0.66 -0.65 -1.34 0.00 0.00 175.22 173.35 1mei s GLN 41 N -3.98 3.32 0.38 1.99 -1.52 -1.26 -0.83 119.66 117.76 1mei s GLN 41 Ca 0.19 -0.27 -0.28 0.00 -1.95 0.00 0.00 55.36 53.05 1mei s GLN 41 Cb -0.01 -2.55 -0.11 0.00 -0.22 0.00 0.00 33.01 30.12 1mei s GLN 41 CO 0.06 -0.11 1.39 1.17 -0.25 0.00 0.00 175.29 177.55 1mei n LYS 42 N -2.02 2.37 0.00 2.91 4.81 0.29 -1.92 118.16 124.60 1mei n LYS 42 Ca -0.01 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 1mei n LYS 42 Cb 0.57 -2.51 0.00 0.00 0.02 0.00 0.00 35.03 33.10 1mei n LYS 42 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mei n GLY 43 N 0.61 2.02 3.95 3.14 0.00 -1.26 -5.02 105.19 108.63 1mei n GLY 43 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 1mei n GLY 43 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1mei n GLN 44 N -2.00 0.63 -4.46 1.61 6.02 -0.81 -5.14 117.38 113.23 1mei n GLN 44 Ca 0.00 -3.39 -0.24 0.00 -0.01 0.00 0.00 57.00 53.35 1mei n GLN 44 Cb 0.00 0.11 -0.10 0.00 1.02 0.00 0.00 30.24 31.27 1mei n GLN 44 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1mei s GLN 45 N -4.48 1.66 0.43 -1.09 -1.52 -1.26 -4.88 119.66 108.51 1mei s GLN 45 Ca 0.45 -1.73 -0.24 0.00 -1.95 0.00 0.00 55.36 51.90 1mei s GLN 45 Cb -0.04 -1.79 -0.08 0.00 -0.22 0.00 0.00 33.01 30.88 1mei s GLN 45 CO 0.29 0.34 1.10 0.45 -0.25 0.00 0.00 175.29 177.22 1mei s SER 46 N -3.38 6.49 0.55 5.90 0.15 -1.26 -4.88 113.70 117.27 1mei s SER 46 Ca 0.29 2.17 0.33 0.00 0.70 0.00 0.00 55.95 59.43 1mei s SER 46 Cb -0.05 -2.59 1.49 0.00 -1.71 0.00 0.00 66.02 63.15 1mei s SER 46 CO 0.14 -0.68 2.04 -0.33 1.20 0.00 0.00 173.24 175.61 1mei h GLU 47 N 2.30 0.00 -3.88 5.44 5.08 -1.85 -3.40 114.58 118.27 1mei h GLU 47 Ca -0.49 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.40 1mei h GLU 47 Cb 1.23 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 30.10 1mei h GLU 47 CO 0.61 0.05 -0.78 0.42 -1.00 0.00 0.00 179.01 178.32 1mei s ILE 48 N -3.82 0.60 -0.12 3.13 1.01 -1.26 -5.09 121.20 115.65 1mei s ILE 48 Ca -0.01 -0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.65 1mei s ILE 48 Cb 0.10 -0.71 0.01 0.00 0.01 0.00 0.00 42.46 41.88 1mei s ILE 48 CO 0.54 0.30 -0.20 0.20 0.00 0.00 0.00 174.94 175.78 1mei s ASN 49 N 1.88 2.84 0.58 3.58 0.01 -1.26 -0.96 114.94 121.61 1mei s ASN 49 Ca 0.05 -0.53 -0.16 0.00 -0.71 0.00 0.00 52.86 51.51 1mei s ASN 49 Cb -0.12 -1.30 -0.04 0.00 0.41 0.00 0.00 41.25 40.19 1mei s ASN 49 CO -0.06 0.07 1.05 -0.76 -1.51 0.00 0.00 177.10 175.89 1mei s LEU 50 N 0.78 3.52 0.11 0.60 1.43 0.11 -4.86 118.68 120.37 1mei s LEU 50 Ca -0.09 1.78 0.16 0.00 -1.03 0.00 0.00 54.13 54.94 1mei s LEU 50 Cb -0.16 -4.53 -0.10 0.00 0.03 0.00 0.00 46.19 41.43 1mei s LEU 50 CO 0.00 -1.07 0.97 0.11 0.23 0.00 0.00 176.35 176.60 1mei h LYS 51 N 0.52 0.00 -4.28 1.70 6.56 -1.07 -2.49 116.57 117.51 1mei h LYS 51 Ca -0.47 0.00 -0.30 0.00 -1.06 0.00 0.00 60.65 58.82 1mei h LYS 51 Cb 1.21 0.00 -0.27 0.00 -0.57 0.00 0.00 32.23 32.60 1mei h LYS 51 CO 0.58 0.38 -0.75 0.96 -2.06 0.00 0.00 179.45 178.57 1mei s ILE 52 N -2.90 0.38 0.00 1.86 -4.36 -1.09 -3.40 121.20 111.68 1mei s ILE 52 Ca -0.01 -0.36 0.00 0.00 -0.26 0.00 0.00 60.65 60.02 1mei s ILE 52 Cb 0.08 -0.35 0.00 0.00 1.25 0.00 0.00 42.46 43.44 1mei s ILE 52 CO 0.80 0.01 1.12 -0.81 0.24 0.00 0.00 174.94 176.30 1mei n PRO 53 N 2.68 0.76 -5.26 0.37 -0.04 -1.23 -4.41 135.00 127.88 1mei n PRO 53 Ca -0.15 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.00 1mei n PRO 53 Cb 0.58 -1.12 -0.16 0.00 -0.04 0.00 0.00 33.50 32.75 1mei n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1mei s LEU 54 N 0.00 2.09 0.01 1.53 1.43 -1.26 -0.45 118.68 122.02 1mei s LEU 54 Ca 0.00 -0.51 0.03 0.00 -1.03 0.00 0.00 54.13 52.62 1mei s LEU 54 Cb 0.00 -1.38 -0.01 0.00 0.03 0.00 0.00 46.19 44.83 1mei s LEU 54 CO 0.00 0.24 -0.09 0.68 0.23 0.00 0.00 176.35 177.42 1mei s VAL 55 N -0.16 0.69 0.18 -1.59 -7.23 -0.07 -3.18 120.40 109.04 1mei s VAL 55 Ca -0.04 -0.57 -0.20 0.00 -1.81 0.00 0.00 61.98 59.36 1mei s VAL 55 Cb -0.14 -0.62 -0.08 0.00 0.56 0.00 0.00 36.38 36.11 1mei s VAL 55 CO 0.04 0.05 0.69 -0.94 -0.31 0.00 0.00 175.10 174.63 1mei s SER 56 N -0.58 7.10 0.69 4.85 1.04 -1.04 -1.49 113.70 124.27 1mei s SER 56 Ca 0.01 1.40 -0.17 0.00 0.48 0.00 0.00 55.95 57.67 1mei s SER 56 Cb -0.05 -2.41 0.01 0.00 0.10 0.00 0.00 66.02 63.66 1mei s SER 56 CO 0.00 0.11 1.18 0.00 0.98 0.00 0.00 173.24 175.51 1mei n ALA 57 N 1.05 0.54 -1.60 5.32 0.00 0.30 -3.45 120.51 122.68 1mei n ALA 57 Ca -0.05 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 52.88 1mei n ALA 57 Cb 0.51 -2.25 -0.01 0.00 0.00 0.00 0.00 19.45 17.70 1mei n ALA 57 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1mei n ILE 58 N -2.29 3.73 -4.23 0.00 5.41 -1.26 -3.79 119.36 116.93 1mei n ILE 58 Ca 0.15 -2.88 -0.17 0.00 1.00 0.00 0.00 62.75 60.85 1mei n ILE 58 Cb 0.49 -2.61 -0.13 0.00 -0.71 0.00 0.00 39.64 36.67 1mei n ILE 58 CO 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 176.55 176.51 1mei s MET 59 N 2.87 0.70 0.40 0.38 -1.94 -1.26 -4.73 119.30 115.72 1mei s MET 59 Ca 0.54 -0.61 0.09 0.00 -1.71 0.00 0.00 55.69 54.00 1mei s MET 59 Cb 0.15 -0.63 0.88 0.00 2.01 0.00 0.00 34.83 37.24 1mei s MET 59 CO -0.08 0.15 2.00 1.96 -0.01 0.00 0.00 175.02 179.04 1mei h GLN 60 N 5.09 0.55 -0.42 2.03 4.20 -1.89 -1.59 115.11 123.08 1mei h GLN 60 Ca -0.35 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.33 1mei h GLN 60 Cb 1.19 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.84 1mei h GLN 60 CO 0.45 0.36 0.00 -1.13 -0.67 0.00 0.00 178.83 177.84 1mei n SER 61 N -4.47 2.22 0.07 1.46 3.41 -1.26 -4.62 113.62 110.42 1mei n SER 61 Ca 0.08 -2.01 0.00 0.00 -0.26 0.00 0.00 58.87 56.68 1mei n SER 61 Cb 0.22 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1mei n SER 61 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1mei n VAL 62 N 0.69 0.46 -3.15 -3.33 0.31 -0.65 -4.49 118.33 108.17 1mei n VAL 62 Ca 0.14 0.15 -0.45 0.00 -0.01 0.00 0.00 64.34 64.17 1mei n VAL 62 Cb 0.35 -0.92 -0.01 0.00 -0.91 0.00 0.00 33.84 32.36 1mei n VAL 62 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1mei s SER 63 N -5.23 6.94 0.00 4.52 0.01 -0.87 -4.32 113.70 114.75 1mei s SER 63 Ca 0.00 -2.83 0.00 0.00 1.31 0.00 0.00 55.95 54.43 1mei s SER 63 Cb 0.00 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1mei s SER 63 CO 0.00 -0.66 0.00 0.61 0.41 0.00 0.00 173.24 173.60 1mei n GLY 64 N 4.05 2.97 0.09 3.44 0.00 -1.26 -3.26 105.19 111.23 1mei n GLY 64 Ca 0.24 -2.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.01 1mei n GLY 64 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1mei h GLU 65 N 0.00 -0.14 -0.76 1.61 5.08 -1.92 -2.19 114.58 116.27 1mei h GLU 65 Ca 0.00 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1mei h GLU 65 Cb 0.00 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1mei h GLU 65 CO 0.00 -0.08 0.38 0.87 -1.00 0.00 0.00 179.01 179.18 1mei h LYS 66 N -0.16 1.08 -0.23 2.33 1.57 -1.97 -2.15 116.57 117.04 1mei h LYS 66 Ca -0.01 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1mei h LYS 66 Cb 0.12 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1mei h LYS 66 CO 0.02 0.82 0.09 1.98 -0.57 0.00 0.00 179.45 181.79 1mei h MET 67 N 1.08 0.35 -0.94 3.15 4.05 -1.44 -0.54 114.93 120.63 1mei h MET 67 Ca 0.27 -0.07 0.05 0.00 -0.28 0.00 0.00 59.70 59.67 1mei h MET 67 Cb 0.08 -0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 30.77 1mei h MET 67 CO -0.04 0.41 0.60 0.00 0.23 0.00 0.00 176.91 178.11 1mei h ALA 68 N 0.92 1.27 -0.06 0.39 0.00 -1.08 0.77 119.26 121.46 1mei h ALA 68 Ca 0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1mei h ALA 68 Cb 0.20 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1mei h ALA 68 CO -0.01 0.42 -0.11 0.82 0.00 0.00 0.00 179.25 180.38 1mei h ILE 69 N 1.13 1.41 -0.96 0.00 2.04 -1.25 -1.56 117.51 118.32 1mei h ILE 69 Ca 0.39 -1.38 0.02 0.00 1.00 0.00 0.00 64.86 64.89 1mei h ILE 69 Cb 0.09 2.17 -0.05 0.00 -0.74 0.00 0.00 36.82 38.29 1mei h ILE 69 CO -0.15 0.38 0.63 0.00 0.00 0.00 0.00 178.15 179.02 1mei h ALA 70 N 0.50 1.23 -0.01 1.87 0.00 -0.77 -1.29 119.26 120.79 1mei h ALA 70 Ca 0.00 -0.06 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 1mei h ALA 70 Cb 0.67 -0.37 0.02 0.00 0.00 0.00 0.00 17.79 18.10 1mei h ALA 70 CO 0.02 0.58 -0.88 1.25 0.00 0.00 0.00 179.25 180.22 1mei h LEU 71 N 1.27 0.79 -1.25 0.00 5.85 -0.90 -3.20 115.31 117.88 1mei h LEU 71 Ca 0.36 -0.74 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1mei h LEU 71 Cb -0.10 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.65 1mei h LEU 71 CO -0.09 1.42 0.46 0.00 -0.34 0.00 0.00 178.44 179.89 1mei h ALA 72 N 0.39 1.45 0.00 1.25 0.00 -1.12 -1.02 119.26 120.20 1mei h ALA 72 Ca -0.11 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1mei h ALA 72 Cb 1.55 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1mei h ALA 72 CO 0.17 0.50 -0.02 0.00 0.00 0.00 0.00 179.25 179.90 1mei h ARG 73 N 0.99 0.00 -0.01 0.00 3.08 -1.23 0.31 114.38 117.52 1mei h ARG 73 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1mei h ARG 73 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1mei h ARG 73 CO -0.05 0.02 -0.35 0.39 -1.07 0.00 0.00 179.97 178.91 1mei n GLU 74 N -4.31 0.98 0.00 0.04 -0.58 -0.50 -2.95 120.64 113.33 1mei n GLU 74 Ca -0.03 -0.69 0.00 0.00 -0.42 0.00 0.00 57.16 56.02 1mei n GLU 74 Cb 0.11 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.49 1mei n GLU 74 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1mei n GLY 75 N 1.37 0.81 0.00 0.62 0.00 -0.46 -4.62 105.19 102.91 1mei n GLY 75 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1mei n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mei n GLY 76 N -0.86 2.06 3.05 -0.02 0.00 -0.56 -0.50 105.19 108.36 1mei n GLY 76 Ca 0.00 -2.13 -0.11 0.00 0.00 0.00 0.00 46.02 43.79 1mei n GLY 76 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1mei s ILE 77 N 0.96 0.08 0.07 -0.61 2.07 -1.19 -3.32 121.20 119.26 1mei s ILE 77 Ca 0.00 -0.67 0.05 0.00 -1.41 0.00 0.00 60.65 58.62 1mei s ILE 77 Cb 0.00 -0.34 -0.04 0.00 0.13 0.00 0.00 42.46 42.21 1mei s ILE 77 CO 0.00 -0.37 -0.05 -0.44 -1.91 0.00 0.00 174.94 172.17 1mei s SER 78 N -1.22 4.69 -0.51 4.50 0.01 -1.26 -2.51 113.70 117.39 1mei s SER 78 Ca -0.13 -0.25 -0.05 0.00 1.31 0.00 0.00 55.95 56.83 1mei s SER 78 Cb -0.07 -1.03 0.13 0.00 0.21 0.00 0.00 66.02 65.26 1mei s SER 78 CO 0.01 0.20 0.35 -0.36 0.41 0.00 0.00 173.24 173.84 1mei s PHE 79 N -1.19 3.50 -0.06 2.43 0.40 -1.22 0.67 117.98 122.51 1mei s PHE 79 Ca 0.22 -2.31 -0.38 0.00 -0.60 0.00 0.00 56.93 53.86 1mei s PHE 79 Cb -0.11 -3.34 -0.16 0.00 0.51 0.00 0.00 43.02 39.92 1mei s PHE 79 CO 0.14 -0.94 1.52 -0.89 0.70 0.00 0.00 175.22 175.75 1mei n ILE 80 N 4.35 0.14 -1.71 0.64 2.08 0.11 -4.17 119.36 120.79 1mei n ILE 80 Ca -0.00 -0.02 -0.42 0.00 0.56 0.00 0.00 62.75 62.86 1mei n ILE 80 Cb 0.40 -1.03 -0.01 0.00 -0.75 0.00 0.00 39.64 38.25 1mei n ILE 80 CO 0.00 0.00 0.00 2.22 0.56 0.00 0.00 176.55 179.33 1mei n PHE 81 N 3.80 2.46 1.19 1.39 -1.74 -1.20 -1.32 117.46 122.04 1mei n PHE 81 Ca 0.22 0.49 0.13 0.00 -0.56 0.00 0.00 57.45 57.72 1mei n PHE 81 Cb 0.17 -2.46 0.28 0.00 1.52 0.00 0.00 39.48 38.99 1mei n PHE 81 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1mei n GLY 82 N 1.05 0.60 2.34 4.97 0.00 -1.25 -4.56 105.19 108.33 1mei n GLY 82 Ca 0.05 -0.59 -0.37 0.00 0.00 0.00 0.00 46.02 45.12 1mei n GLY 82 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mei n SER 83 N 0.86 8.28 -3.45 1.61 3.41 -1.26 -4.76 113.62 118.31 1mei n SER 83 Ca 0.16 -2.73 -0.07 0.00 -0.26 0.00 0.00 58.87 55.98 1mei n SER 83 Cb 0.50 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 62.96 1mei n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mei s GLN 84 N 1.12 1.82 0.61 4.33 -2.07 -1.26 -4.93 119.66 119.28 1mei s GLN 84 Ca 0.65 -1.09 -0.19 0.00 -1.82 0.00 0.00 55.36 52.91 1mei s GLN 84 Cb 0.20 0.56 -0.02 0.00 -1.09 0.00 0.00 33.01 32.66 1mei s GLN 84 CO -0.07 -0.84 1.32 -1.54 -1.32 0.00 0.00 175.29 172.84 1mei s SER 85 N -3.03 4.82 0.27 12.60 1.04 -1.26 -4.81 113.70 123.33 1mei s SER 85 Ca 0.14 2.69 -0.02 0.00 0.48 0.00 0.00 55.95 59.24 1mei s SER 85 Cb -0.05 -2.63 0.44 0.00 0.10 0.00 0.00 66.02 63.89 1mei s SER 85 CO 0.08 -1.87 1.87 0.40 0.98 0.00 0.00 173.24 174.71 1mei h ILE 86 N 0.86 1.06 -0.01 -1.02 2.04 -1.99 -1.43 117.51 117.02 1mei h ILE 86 Ca -0.51 -0.39 -0.13 0.00 1.00 0.00 0.00 64.86 64.83 1mei h ILE 86 Cb 1.33 -0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 1mei h ILE 86 CO 0.55 0.21 -0.60 1.05 0.00 0.00 0.00 178.15 179.35 1mei h GLU 87 N 1.15 0.03 -0.17 2.37 9.09 -1.99 -1.92 114.58 123.14 1mei h GLU 87 Ca 0.45 -0.02 -0.15 0.00 0.05 0.00 0.00 59.36 59.68 1mei h GLU 87 Cb 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.34 1mei h GLU 87 CO -0.19 0.62 -0.49 0.77 0.05 0.00 0.00 179.01 179.77 1mei h SER 88 N 0.02 0.73 -0.43 3.06 0.02 -1.70 -2.26 113.55 113.00 1mei h SER 88 Ca -0.01 -0.58 -0.05 0.00 -0.84 0.00 0.00 61.79 60.31 1mei h SER 88 Cb 1.07 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.38 1mei h SER 88 CO 0.08 1.18 0.07 -0.61 -1.14 0.00 0.00 176.83 176.41 1mei h GLN 89 N 0.31 0.70 -0.92 3.45 4.15 -1.26 -2.62 115.11 118.92 1mei h GLN 89 Ca -0.01 -0.19 -0.00 0.00 0.77 0.00 0.00 58.65 59.22 1mei h GLN 89 Cb 1.10 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.67 1mei h GLN 89 CO 0.10 0.74 0.57 0.00 -1.93 0.00 0.00 178.83 178.31 1mei h ALA 90 N 0.94 1.17 -0.44 3.38 0.00 -1.37 -1.73 119.26 121.20 1mei h ALA 90 Ca 0.13 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1mei h ALA 90 Cb 0.37 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1mei h ALA 90 CO 0.01 0.61 0.26 0.00 0.00 0.00 0.00 179.25 180.12 1mei h ALA 91 N 1.31 0.56 -0.46 0.00 0.00 -1.19 0.13 119.26 119.60 1mei h ALA 91 Ca 0.33 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1mei h ALA 91 Cb -0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1mei h ALA 91 CO -0.06 -0.07 0.28 0.52 0.00 0.00 0.00 179.25 179.92 1mei h MET 92 N 0.52 0.63 -0.38 0.00 2.07 -1.07 0.15 114.93 116.84 1mei h MET 92 Ca 0.18 -0.06 0.00 0.00 -2.07 0.00 0.00 59.70 57.75 1mei h MET 92 Cb 0.02 -0.13 -0.02 0.00 -1.87 0.00 0.00 31.60 29.60 1mei h MET 92 CO -0.09 0.46 0.24 0.28 1.07 0.00 0.00 176.91 178.87 1mei h VAL 93 N 0.62 1.11 -0.81 -2.22 2.07 -0.89 -1.83 116.25 114.31 1mei h VAL 93 Ca 0.17 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.41 1mei h VAL 93 Cb -0.01 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 1mei h VAL 93 CO -0.03 0.11 0.33 -0.74 0.02 0.00 0.00 177.57 177.26 1mei h HIS 94 N 0.50 1.21 -0.46 1.57 6.17 -0.40 -1.70 115.15 122.05 1mei h HIS 94 Ca 0.14 -0.09 -0.03 0.00 0.71 0.00 0.00 60.37 61.10 1mei h HIS 94 Cb -0.03 -0.37 -0.02 0.00 2.52 0.00 0.00 27.41 29.52 1mei h HIS 94 CO -0.04 0.91 0.16 0.00 0.71 0.00 0.00 177.93 179.66 1mei h ALA 95 N 1.18 1.42 -0.09 5.26 0.00 -0.32 -1.24 119.26 125.47 1mei h ALA 95 Ca 0.27 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1mei h ALA 95 Cb 0.20 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1mei h ALA 95 CO -0.02 0.44 -0.31 0.28 0.00 0.00 0.00 179.25 179.63 1mei h VAL 96 N 0.66 1.41 0.00 0.00 2.07 -0.92 -2.60 116.25 116.86 1mei h VAL 96 Ca 0.16 -1.67 -0.04 0.00 0.82 0.00 0.00 66.70 65.96 1mei h VAL 96 Cb 0.18 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 1mei h VAL 96 CO -0.01 0.49 -0.19 0.11 0.02 0.00 0.00 177.57 177.98 1mei h LYS 97 N -0.10 0.00 -0.35 1.57 1.79 -1.12 -2.99 116.57 115.37 1mei h LYS 97 Ca -0.01 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.27 1mei h LYS 97 Cb 0.94 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 31.48 1mei h LYS 97 CO 0.07 0.19 -0.11 0.09 -1.08 0.00 0.00 179.45 178.61 1mei n ASN 98 N -3.89 2.47 0.09 0.86 5.03 -0.49 -4.67 115.26 114.67 1mei n ASN 98 Ca -0.02 -3.81 -0.04 0.00 0.87 0.00 0.00 54.58 51.58 1mei n ASN 98 Cb 0.29 -0.63 0.15 0.00 -1.02 0.00 0.00 39.78 38.57 1mei n ASN 98 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 1mei h PHE 99 N 1.03 0.29 -0.16 3.10 3.57 -1.30 -3.08 116.94 120.38 1mei h PHE 99 Ca 0.22 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1mei h PHE 99 Cb 1.62 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 40.31 1mei h PHE 99 CO 1.04 0.72 0.00 1.63 -2.23 0.00 0.00 178.31 179.48 1mei n LYS 100 N -3.92 1.47 -0.01 1.11 5.02 -1.26 -5.12 118.16 115.45 1mei n LYS 100 Ca -0.02 -0.72 0.00 0.00 -2.02 0.00 0.00 58.31 55.55 1mei n LYS 100 Cb 0.57 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.33 1mei n LYS 100 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1mei n ALA 101 N 0.01 1.54 0.00 7.82 0.00 -1.17 -5.19 120.51 123.52 1mei n ALA 101 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1mei n ALA 101 Cb 0.20 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.15 1mei n ALA 101 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1mei n HIS 222 N 1.50 0.00 -1.45 0.00 -0.00 -1.26 -5.17 115.22 108.84 1mei n HIS 222 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.59 1mei n HIS 222 Cb 0.01 0.00 0.17 0.00 -0.00 0.00 0.00 29.99 30.17 1mei n HIS 222 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1mei n ASN 223 N 0.00 3.36 -4.77 0.41 4.13 -1.26 -5.02 115.26 112.11 1mei n ASN 223 Ca 0.00 -3.76 -0.40 0.00 1.68 0.00 0.00 54.58 52.10 1mei n ASN 223 Cb 0.00 -0.69 0.01 0.00 -1.54 0.00 0.00 39.78 37.56 1mei n ASN 223 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 1mei s GLU 224 N -3.34 3.85 -0.41 3.52 -1.05 -1.15 -1.76 118.70 118.35 1mei s GLU 224 Ca 0.50 2.35 -0.16 0.00 -0.15 0.00 0.00 54.97 57.51 1mei s GLU 224 Cb 0.43 -2.74 0.02 0.00 -0.44 0.00 0.00 34.13 31.40 1mei s GLU 224 CO 0.02 -0.66 0.39 -1.17 0.95 0.00 0.00 175.26 174.79 1mei s LEU 225 N -2.52 4.90 0.22 1.83 2.96 0.95 -4.80 118.68 122.22 1mei s LEU 225 Ca 0.58 -0.70 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 1mei s LEU 225 Cb -0.42 -2.31 -0.05 0.00 0.50 0.00 0.00 46.19 43.91 1mei s LEU 225 CO 0.55 -0.52 0.07 0.68 -1.32 0.00 0.00 176.35 175.81 1mei s VAL 226 N 1.99 0.51 0.74 1.68 -7.23 -1.26 -1.22 120.40 115.61 1mei s VAL 226 Ca 0.10 -1.99 0.01 0.00 -1.81 0.00 0.00 61.98 58.28 1mei s VAL 226 Cb -0.18 -2.44 0.15 0.00 0.56 0.00 0.00 36.38 34.47 1mei s VAL 226 CO 0.12 -0.16 1.02 1.51 -0.31 0.00 0.00 175.10 177.28 1mei s ASP 227 N -3.24 4.23 0.08 4.85 1.47 -0.04 -4.84 116.67 119.18 1mei s ASP 227 Ca 0.33 -0.55 0.05 0.00 1.18 0.00 0.00 52.55 53.56 1mei s ASP 227 Cb 0.07 0.27 0.27 0.00 -0.34 0.00 0.00 42.92 43.19 1mei s ASP 227 CO 0.10 -1.96 1.12 -1.54 0.68 0.00 0.00 175.17 173.56 1mei n SER 228 N -2.86 0.13 -1.27 2.11 3.41 -1.26 -0.28 113.62 113.60 1mei n SER 228 Ca 0.17 0.53 0.10 0.00 -0.26 0.00 0.00 58.87 59.41 1mei n SER 228 Cb 0.61 -0.54 0.30 0.00 -0.26 0.00 0.00 64.21 64.32 1mei n SER 228 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mei n GLN 229 N -1.65 2.96 -1.11 4.33 6.02 -1.26 -4.94 117.38 121.74 1mei n GLN 229 Ca -0.00 -2.61 -0.04 0.00 -0.01 0.00 0.00 57.00 54.34 1mei n GLN 229 Cb 0.05 -1.59 -0.02 0.00 1.02 0.00 0.00 30.24 29.71 1mei n GLN 229 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1mei n LYS 230 N 1.31 -0.97 -3.29 -1.09 4.76 0.62 -5.00 118.16 114.49 1mei n LYS 230 Ca 0.22 0.48 -0.38 0.00 -2.87 0.00 0.00 58.31 55.76 1mei n LYS 230 Cb 0.65 -4.34 -0.06 0.00 -1.84 0.00 0.00 35.03 29.44 1mei n LYS 230 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1mei s ARG 231 N -1.71 4.16 0.34 1.97 0.52 -1.26 -4.77 118.95 118.21 1mei s ARG 231 Ca 0.00 0.70 -0.28 0.00 -0.52 0.00 0.00 55.73 55.63 1mei s ARG 231 Cb 0.00 -3.20 -0.12 0.00 0.52 0.00 0.00 34.95 32.14 1mei s ARG 231 CO 0.00 0.62 1.31 0.66 0.02 0.00 0.00 175.30 177.91 1mei n TYR 232 N 1.62 2.33 -2.79 -0.53 4.01 -1.26 -0.86 117.16 119.68 1mei n TYR 232 Ca -0.10 0.54 -0.33 0.00 -0.16 0.00 0.00 57.90 57.85 1mei n TYR 232 Cb 0.51 -2.43 -0.07 0.00 -0.31 0.00 0.00 39.34 37.05 1mei n TYR 232 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1mei s LEU 233 N -1.04 3.92 -0.08 7.72 1.02 -0.35 -4.56 118.68 125.31 1mei s LEU 233 Ca 0.56 1.70 -0.18 0.00 0.02 0.00 0.00 54.13 56.23 1mei s LEU 233 Cb -0.56 -4.54 0.04 0.00 0.02 0.00 0.00 46.19 41.14 1mei s LEU 233 CO 0.62 -0.39 0.42 0.54 0.02 0.00 0.00 176.35 177.56 1mei s VAL 234 N -2.18 0.03 0.42 -1.59 0.11 -1.26 -4.69 120.40 111.23 1mei s VAL 234 Ca 0.62 -0.21 0.07 0.00 -2.93 0.00 0.00 61.98 59.53 1mei s VAL 234 Cb -0.09 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 34.03 1mei s VAL 234 CO 0.14 -0.12 0.23 -0.83 -3.33 0.00 0.00 175.10 171.19 1mei s GLY 235 N -0.70 2.31 -0.13 6.54 0.00 0.21 -1.52 107.32 114.03 1mei s GLY 235 Ca -0.08 -2.02 -0.08 0.00 0.00 0.00 0.00 44.72 42.54 1mei s GLY 235 CO 0.04 -1.87 0.31 0.00 0.00 0.00 0.00 173.10 171.58 1mei s ALA 236 N -2.58 -0.77 0.31 3.20 0.00 -0.62 -0.71 121.76 120.59 1mei s ALA 236 Ca 0.42 1.13 -0.21 0.00 0.00 0.00 0.00 51.96 53.30 1mei s ALA 236 Cb 0.02 -0.69 -0.09 0.00 0.00 0.00 0.00 23.12 22.36 1mei s ALA 236 CO 0.23 -0.20 0.84 0.20 0.00 0.00 0.00 175.76 176.83 1mei s GLY 237 N 1.01 2.57 0.17 0.00 0.00 -0.43 -1.87 107.32 108.77 1mei s GLY 237 Ca -0.07 0.30 0.02 0.00 0.00 0.00 0.00 44.72 44.97 1mei s GLY 237 CO -0.07 0.64 -0.00 -0.26 0.00 0.00 0.00 173.10 173.40 1mei s ILE 238 N -1.77 0.72 0.40 0.90 -4.36 -0.21 -3.95 121.20 112.94 1mei s ILE 238 Ca 0.51 -1.99 0.07 0.00 -0.26 0.00 0.00 60.65 58.99 1mei s ILE 238 Cb -0.14 -2.12 -0.08 0.00 1.25 0.00 0.00 42.46 41.37 1mei s ILE 238 CO 0.20 -0.48 0.02 0.54 0.24 0.00 0.00 174.94 175.45 1mei s ASN 239 N -3.18 3.92 0.00 4.36 2.20 -1.26 -1.33 114.94 119.64 1mei s ASN 239 Ca 0.24 -1.33 0.05 0.00 -0.94 0.00 0.00 52.86 50.87 1mei s ASN 239 Cb 0.06 -0.40 0.17 0.00 -2.00 0.00 0.00 41.25 39.08 1mei s ASN 239 CO 0.04 -0.44 1.13 0.35 -2.94 0.00 0.00 177.10 175.24 1mei n THR 240 N -0.98 0.13 -0.04 0.54 -2.24 -1.26 -3.99 114.28 106.45 1mei n THR 240 Ca -0.05 -0.14 -0.05 0.00 -2.27 0.00 0.00 64.05 61.54 1mei n THR 240 Cb 0.67 0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 68.93 1mei n THR 240 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1mei n ARG 241 N -0.22 0.31 -1.18 -0.78 1.74 -1.26 -4.78 116.66 110.49 1mei n ARG 241 Ca 0.04 0.12 -0.19 0.00 -0.77 0.00 0.00 57.85 57.06 1mei n ARG 241 Cb 0.09 -1.02 0.22 0.00 -1.02 0.00 0.00 32.46 30.72 1mei n ARG 241 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1mei n ASP 242 N -3.97 4.06 0.25 0.55 5.68 -1.26 -4.65 116.55 117.21 1mei n ASP 242 Ca -0.08 -3.51 0.10 0.00 -0.50 0.00 0.00 54.79 50.80 1mei n ASP 242 Cb 0.30 -0.82 0.65 0.00 -1.14 0.00 0.00 41.12 40.12 1mei n ASP 242 CO 0.00 0.00 0.00 2.19 -1.33 0.00 0.00 177.20 178.06 1mei h PHE 243 N 1.47 0.00 0.00 2.11 -5.15 -1.87 -0.15 116.94 113.35 1mei h PHE 243 Ca 0.54 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 58.27 1mei h PHE 243 Cb 2.73 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 38.90 1mei h PHE 243 CO 1.52 0.12 -0.18 0.00 -2.00 0.00 0.00 178.31 177.77 1mei h ARG 244 N 0.00 0.00 0.00 6.09 3.08 -1.93 -0.78 114.38 120.84 1mei h ARG 244 Ca -0.00 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.68 1mei h ARG 244 Cb 0.27 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.25 1mei h ARG 244 CO 0.02 0.18 -2.39 0.39 -1.07 0.00 0.00 179.97 177.10 1mei n GLU 245 N -4.06 0.71 -0.04 0.04 4.71 -0.97 -4.51 120.64 116.52 1mei n GLU 245 Ca -0.02 0.08 -0.15 0.00 -0.01 0.00 0.00 57.16 57.05 1mei n GLU 245 Cb 0.26 -1.50 -0.08 0.00 -1.01 0.00 0.00 31.44 29.10 1mei n GLU 245 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 1mei h ARG 246 N 0.00 0.44 0.42 3.49 2.43 -0.97 -3.24 114.38 116.95 1mei h ARG 246 Ca -0.55 -0.33 -0.01 0.00 -0.81 0.00 0.00 59.98 58.28 1mei h ARG 246 Cb 2.01 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 31.60 1mei h ARG 246 CO -0.04 0.96 -0.44 0.28 -1.51 0.00 0.00 179.97 179.22 1mei h VAL 247 N 0.02 0.12 -0.85 0.20 2.07 -1.37 -0.89 116.25 115.54 1mei h VAL 247 Ca -0.02 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.69 1mei h VAL 247 Cb 1.00 0.12 -0.11 0.00 -1.52 0.00 0.00 31.29 30.78 1mei h VAL 247 CO 0.08 0.00 0.37 -0.65 0.02 0.00 0.00 177.57 177.39 1mei h PRO 248 N -0.88 0.43 -0.77 1.57 0.11 -1.77 0.24 132.00 130.94 1mei h PRO 248 Ca -0.04 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.00 1mei h PRO 248 Cb 0.78 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.76 1mei h PRO 248 CO -0.08 0.28 0.30 0.00 -0.21 0.00 0.00 178.00 178.29 1mei h ALA 249 N 1.65 1.00 -0.34 -0.75 0.00 -1.51 0.71 119.26 120.02 1mei h ALA 249 Ca 0.51 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 1mei h ALA 249 Cb 0.89 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1mei h ALA 249 CO -0.48 0.63 -0.12 -0.07 0.00 0.00 0.00 179.25 179.22 1mei h LEU 250 N 1.12 0.70 0.10 0.00 4.07 0.63 -0.43 115.31 121.50 1mei h LEU 250 Ca 0.25 -0.38 -0.00 0.00 0.08 0.00 0.00 57.88 57.83 1mei h LEU 250 Cb 0.23 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.78 1mei h LEU 250 CO -0.02 0.92 -0.05 0.58 -1.08 0.00 0.00 178.44 178.80 1mei h VAL 251 N 0.47 0.99 -0.85 1.22 2.07 -0.46 -1.44 116.25 118.25 1mei h VAL 251 Ca 0.08 -0.32 0.10 0.00 0.82 0.00 0.00 66.70 67.38 1mei h VAL 251 Cb 0.64 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 31.55 1mei h VAL 251 CO 0.04 0.08 0.55 -0.33 0.02 0.00 0.00 177.57 177.93 1mei h GLU 252 N -0.28 0.78 0.00 1.57 3.07 -0.82 0.12 114.58 119.01 1mei h GLU 252 Ca -0.01 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1mei h GLU 252 Cb 0.23 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1mei h GLU 252 CO 0.02 0.52 0.00 0.00 -1.40 0.00 0.00 179.01 178.15 1mei h ALA 253 N 1.58 1.00 0.00 3.43 0.00 -0.72 -3.47 119.26 121.08 1mei h ALA 253 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1mei h ALA 253 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1mei h ALA 253 CO -0.16 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.50 1mei n GLY 254 N 0.22 1.11 3.72 0.00 0.00 0.41 -3.97 105.19 106.67 1mei n GLY 254 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1mei n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mei n ALA 255 N -1.72 2.64 0.09 4.61 0.00 -0.60 -4.88 120.51 120.65 1mei n ALA 255 Ca 0.00 0.40 -0.03 0.00 0.00 0.00 0.00 53.44 53.81 1mei n ALA 255 Cb 0.00 -2.49 -0.05 0.00 0.00 0.00 0.00 19.45 16.91 1mei n ALA 255 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1mei h ASP 256 N 6.14 0.00 -4.94 0.00 3.32 -1.62 -3.45 116.42 115.87 1mei h ASP 256 Ca -0.44 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.53 1mei h ASP 256 Cb 1.21 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.57 1mei h ASP 256 CO 0.91 0.79 0.02 0.54 -1.72 0.00 0.00 179.24 179.78 1mei s VAL 257 N -2.85 0.02 0.38 -1.35 0.11 -1.22 -4.57 120.40 110.91 1mei s VAL 257 Ca 0.02 -0.16 0.08 0.00 -2.93 0.00 0.00 61.98 58.99 1mei s VAL 257 Cb 0.09 -0.86 -0.06 0.00 -1.53 0.00 0.00 36.38 34.02 1mei s VAL 257 CO 0.79 -0.09 0.02 -0.76 -3.33 0.00 0.00 175.10 171.74 1mei s LEU 258 N -1.15 2.93 -0.25 2.54 1.43 0.55 -1.59 118.68 123.14 1mei s LEU 258 Ca -0.11 -1.17 -0.11 0.00 -1.03 0.00 0.00 54.13 51.71 1mei s LEU 258 Cb -0.02 -1.16 0.10 0.00 0.03 0.00 0.00 46.19 45.14 1mei s LEU 258 CO 0.08 -0.36 0.57 0.00 0.23 0.00 0.00 176.35 176.87 1mei s ILE 260 N 2.26 4.06 -0.42 0.00 1.01 0.28 -1.05 121.20 127.34 1mei s ILE 260 Ca -0.07 1.33 -0.17 0.00 0.00 0.00 0.00 60.65 61.74 1mei s ILE 260 Cb -0.10 -3.86 0.02 0.00 0.01 0.00 0.00 42.46 38.54 1mei s ILE 260 CO -0.17 -0.08 0.45 -0.62 0.00 0.00 0.00 174.94 174.53 1mei s ASP 261 N 2.09 6.20 -0.03 3.58 2.15 -0.44 -3.97 116.67 126.25 1mei s ASP 261 Ca 0.60 -0.63 -0.24 0.00 0.43 0.00 0.00 52.55 52.70 1mei s ASP 261 Cb -0.26 -2.23 0.05 0.00 -0.30 0.00 0.00 42.92 40.18 1mei s ASP 261 CO 0.21 -0.59 0.53 -0.55 -0.17 0.00 0.00 175.17 174.59 1mei s SER 262 N 1.82 -0.47 0.45 -0.34 0.15 -1.22 -4.84 113.70 109.25 1mei s SER 262 Ca 0.13 0.45 0.25 0.00 0.70 0.00 0.00 55.95 57.49 1mei s SER 262 Cb -0.17 0.45 0.74 0.00 -1.71 0.00 0.00 66.02 65.33 1mei s SER 262 CO 0.14 -0.54 1.75 0.77 1.20 0.00 0.00 173.24 176.56 1mei h SER 263 N 3.35 0.00 -2.42 5.45 4.64 -1.91 -1.63 113.55 121.03 1mei h SER 263 Ca -0.28 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.56 1mei h SER 263 Cb 1.16 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.88 1mei h SER 263 CO 0.39 0.12 -0.76 -0.62 -0.87 0.00 0.00 176.83 175.09 1mei s ASP 264 N -6.08 2.51 0.00 4.97 2.15 -1.26 -4.60 116.67 114.35 1mei s ASP 264 Ca 0.03 -1.62 0.30 0.00 0.43 0.00 0.00 52.55 51.69 1mei s ASP 264 Cb 0.08 -0.03 1.53 0.00 -0.30 0.00 0.00 42.92 44.19 1mei s ASP 264 CO 0.63 -0.34 2.04 0.61 -0.17 0.00 0.00 175.17 177.94 1mei n GLY 265 N 4.57 -1.23 2.60 2.66 0.00 0.58 -4.24 105.19 110.13 1mei n GLY 265 Ca 0.05 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1mei n GLY 265 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1mei n PHE 266 N -1.26 3.02 -4.12 1.61 -0.00 -1.26 -4.75 117.46 110.71 1mei n PHE 266 Ca 0.15 -2.94 -0.15 0.00 -0.00 0.00 0.00 57.45 54.51 1mei n PHE 266 Cb 0.22 -2.48 -0.13 0.00 -0.00 0.00 0.00 39.48 37.09 1mei n PHE 266 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1mei s SER 267 N 2.93 0.73 0.53 -2.13 0.15 -1.26 -5.01 113.70 109.63 1mei s SER 267 Ca 0.55 -0.29 0.24 0.00 0.70 0.00 0.00 55.95 57.15 1mei s SER 267 Cb 0.15 -0.02 1.47 0.00 -1.71 0.00 0.00 66.02 65.91 1mei s SER 267 CO -0.07 -0.05 2.13 -0.08 1.20 0.00 0.00 173.24 176.37 1mei h GLU 268 N 5.36 0.00 -0.49 5.44 4.81 -1.96 -1.76 114.58 125.98 1mei h GLU 268 Ca -0.31 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.89 1mei h GLU 268 Cb 1.20 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1mei h GLU 268 CO 0.46 0.08 0.18 -1.49 -0.73 0.00 0.00 179.01 177.51 1mei h TRP 269 N 0.00 0.70 -0.20 0.92 4.06 -1.95 -0.62 115.95 118.87 1mei h TRP 269 Ca -0.00 -0.03 -0.16 0.00 2.06 0.00 0.00 58.89 60.75 1mei h TRP 269 Cb 0.17 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 1mei h TRP 269 CO 0.00 0.56 -0.54 1.96 -3.56 0.00 0.00 178.44 176.86 1mei h GLN 270 N 0.69 0.58 -0.40 0.49 4.20 -1.62 -0.93 115.11 118.12 1mei h GLN 270 Ca 0.17 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 1mei h GLN 270 Cb 0.16 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 1mei h GLN 270 CO -0.01 0.97 0.20 -0.22 -0.67 0.00 0.00 178.83 179.10 1mei h LYS 271 N 0.45 0.58 -0.39 1.46 3.64 -1.30 -0.65 116.57 120.36 1mei h LYS 271 Ca 0.01 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1mei h LYS 271 Cb 1.09 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 1mei h LYS 271 CO 0.10 0.50 0.20 0.82 -2.27 0.00 0.00 179.45 178.81 1mei h ILE 272 N 0.51 1.16 -0.17 2.00 2.04 -1.00 -0.39 117.51 121.66 1mei h ILE 272 Ca 0.14 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 1mei h ILE 272 Cb 0.11 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1mei h ILE 272 CO -0.02 0.16 0.10 0.74 0.00 0.00 0.00 178.15 179.14 1mei h THR 273 N 0.50 1.08 -0.69 -0.27 2.02 -0.93 -1.35 112.91 113.27 1mei h THR 273 Ca 0.14 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 67.06 1mei h THR 273 Cb 0.08 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1mei h THR 273 CO -0.02 0.08 0.24 0.40 0.37 0.00 0.00 175.52 176.59 1mei h ILE 274 N 0.20 1.25 -0.96 3.11 2.04 -1.03 -2.51 117.51 119.61 1mei h ILE 274 Ca 0.06 -0.84 0.01 0.00 1.00 0.00 0.00 64.86 65.10 1mei h ILE 274 Cb 0.03 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 36.56 1mei h ILE 274 CO -0.01 0.33 0.64 1.23 0.00 0.00 0.00 178.15 180.33 1mei h GLY 275 N 1.00 1.36 1.07 5.37 0.00 -0.80 -0.90 103.07 110.17 1mei h GLY 275 Ca 0.23 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 1mei h GLY 275 CO -0.01 0.48 0.13 -0.25 0.00 0.00 0.00 176.54 176.88 1mei h TRP 276 N 1.29 1.19 -0.60 5.60 7.01 -1.02 -1.61 115.95 127.81 1mei h TRP 276 Ca 0.36 -0.16 -0.07 0.00 2.11 0.00 0.00 58.89 61.13 1mei h TRP 276 Cb -0.12 -0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 26.59 1mei h TRP 276 CO -0.00 0.99 0.10 0.82 -2.79 0.00 0.00 178.44 177.55 1mei h ILE 277 N 1.05 1.26 -0.06 2.65 2.04 -0.97 -2.44 117.51 121.04 1mei h ILE 277 Ca 0.21 -0.99 -0.10 0.00 1.00 0.00 0.00 64.86 64.98 1mei h ILE 277 Cb 0.43 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1mei h ILE 277 CO 0.01 0.37 -0.40 0.03 0.00 0.00 0.00 178.15 178.15 1mei h ARG 278 N 0.90 0.13 0.00 2.37 2.47 -0.96 0.66 114.38 119.95 1mei h ARG 278 Ca 0.18 -0.06 -0.12 0.00 -1.26 0.00 0.00 59.98 58.73 1mei h ARG 278 Cb 0.42 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.72 1mei h ARG 278 CO 0.01 0.51 -0.58 1.49 0.56 0.00 0.00 179.97 181.96 1mei h GLU 279 N 0.11 0.00 0.00 0.04 4.81 -1.06 0.32 114.58 118.80 1mei h GLU 279 Ca 0.01 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.09 1mei h GLU 279 Cb 0.76 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 1mei h GLU 279 CO 0.06 0.58 -2.08 1.17 -0.73 0.00 0.00 179.01 178.00 1mei n LYS 280 N -3.56 0.74 0.00 1.92 4.81 -0.94 -4.67 118.16 116.46 1mei n LYS 280 Ca -0.00 -0.11 0.00 0.00 -0.87 0.00 0.00 58.31 57.33 1mei n LYS 280 Cb 0.65 -1.48 0.00 0.00 0.02 0.00 0.00 35.03 34.21 1mei n LYS 280 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1mei n TYR 281 N -2.41 0.00 -4.95 5.64 4.01 0.21 -5.10 117.16 114.56 1mei n TYR 281 Ca -0.15 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 1mei n TYR 281 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.81 1mei n TYR 281 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1mei n GLY 282 N 0.20 2.11 1.20 2.72 0.00 0.10 -2.19 105.19 109.34 1mei n GLY 282 Ca 0.00 -0.49 0.05 0.00 0.00 0.00 0.00 46.02 45.58 1mei n GLY 282 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mei n ASP 283 N -0.43 3.46 0.13 1.61 8.00 -1.26 -4.16 116.55 123.90 1mei n ASP 283 Ca 0.00 -2.41 0.04 0.00 0.71 0.00 0.00 54.79 53.13 1mei n ASP 283 Cb 0.00 -0.53 0.03 0.00 -0.02 0.00 0.00 41.12 40.60 1mei n ASP 283 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1mei h LYS 284 N 2.46 0.00 -5.04 -1.24 1.79 -1.84 -3.43 116.57 109.28 1mei h LYS 284 Ca 0.00 0.00 -0.65 0.00 -2.18 0.00 0.00 60.65 57.82 1mei h LYS 284 Cb 1.18 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 31.60 1mei h LYS 284 CO 0.22 0.37 -0.65 0.08 -1.08 0.00 0.00 179.45 178.39 1mei s VAL 285 N -3.01 4.08 -0.05 0.50 1.01 -1.26 -5.08 120.40 116.59 1mei s VAL 285 Ca 0.03 -0.26 -0.19 0.00 0.00 0.00 0.00 61.98 61.56 1mei s VAL 285 Cb 0.07 -2.88 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 1mei s VAL 285 CO 0.75 0.39 0.53 -0.54 0.00 0.00 0.00 175.10 176.23 1mei s LYS 286 N 1.31 4.28 -0.03 2.72 -0.14 -1.26 -4.98 119.74 121.63 1mei s LYS 286 Ca 0.04 0.60 -0.01 0.00 -1.36 0.00 0.00 55.97 55.24 1mei s LYS 286 Cb -0.15 -3.37 0.03 0.00 -1.68 0.00 0.00 37.83 32.67 1mei s LYS 286 CO 0.02 0.32 0.05 0.54 -0.76 0.00 0.00 175.35 175.52 1mei s VAL 287 N 0.04 -0.08 0.38 3.17 0.11 -1.26 -0.33 120.40 122.43 1mei s VAL 287 Ca 0.29 0.36 -0.04 0.00 -2.93 0.00 0.00 61.98 59.65 1mei s VAL 287 Cb -0.17 -0.14 -0.04 0.00 -1.53 0.00 0.00 36.38 34.50 1mei s VAL 287 CO 0.14 0.16 0.65 -0.83 -3.33 0.00 0.00 175.10 171.89 1mei s GLY 288 N 1.83 1.62 0.17 6.54 0.00 0.67 -0.72 107.32 117.44 1mei s GLY 288 Ca 0.01 -0.59 0.01 0.00 0.00 0.00 0.00 44.72 44.15 1mei s GLY 288 CO -0.03 -0.47 0.02 0.00 0.00 0.00 0.00 173.10 172.62 1mei s ALA 289 N -2.38 1.29 0.00 3.20 0.00 -0.31 -0.56 121.76 123.01 1mei s ALA 289 Ca 0.45 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.82 1mei s ALA 289 Cb -0.10 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.66 1mei s ALA 289 CO 0.36 -0.36 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1mei n GLY 290 N -0.23 -0.06 3.90 0.00 0.00 -1.25 -0.15 105.19 107.40 1mei n GLY 290 Ca -0.06 -1.68 -0.30 0.00 0.00 0.00 0.00 46.02 43.98 1mei n GLY 290 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mei s ASN 291 N -2.74 6.47 0.26 1.61 -0.87 -0.61 -3.45 114.94 115.62 1mei s ASN 291 Ca 0.00 0.59 0.02 0.00 -1.57 0.00 0.00 52.86 51.91 1mei s ASN 291 Cb 0.00 -2.09 -0.05 0.00 -0.02 0.00 0.00 41.25 39.08 1mei s ASN 291 CO 0.00 -0.02 0.06 0.27 -2.57 0.00 0.00 177.10 174.85 1mei s ILE 292 N -1.79 0.76 0.00 0.60 -5.25 -0.75 -0.31 121.20 114.46 1mei s ILE 292 Ca 0.41 -2.00 0.00 0.00 -0.99 0.00 0.00 60.65 58.07 1mei s ILE 292 Cb -0.12 -2.57 0.00 0.00 2.95 0.00 0.00 42.46 42.72 1mei s ILE 292 CO 0.26 -0.10 0.38 1.33 -1.79 0.00 0.00 174.94 175.02 1mei n VAL 293 N -0.48 0.11 -4.12 8.37 0.24 -1.26 -1.72 118.33 119.47 1mei n VAL 293 Ca -0.02 -0.16 -0.12 0.00 -2.04 0.00 0.00 64.34 62.01 1mei n VAL 293 Cb 0.66 1.30 -0.07 0.00 -1.47 0.00 0.00 33.84 34.25 1mei n VAL 293 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1mei s ASP 294 N -0.11 0.28 0.30 -1.34 -4.77 -1.26 -4.44 116.67 105.33 1mei s ASP 294 Ca 0.00 -1.27 0.01 0.00 -3.30 0.00 0.00 52.55 47.99 1mei s ASP 294 Cb 0.00 0.50 0.53 0.00 -1.09 0.00 0.00 42.92 42.86 1mei s ASP 294 CO 0.00 -1.02 1.91 1.23 0.70 0.00 0.00 175.17 177.99 1mei h GLY 295 N 2.39 1.31 0.91 2.12 0.00 -1.90 -1.97 103.07 105.93 1mei h GLY 295 Ca -0.31 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 46.59 1mei h GLY 295 CO 0.44 0.31 0.11 0.83 0.00 0.00 0.00 176.54 178.23 1mei h GLU 296 N 1.03 0.40 -0.74 4.80 5.08 -1.97 -0.20 114.58 122.99 1mei h GLU 296 Ca 0.38 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.63 1mei h GLU 296 Cb 0.18 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1mei h GLU 296 CO -0.14 0.42 0.29 0.78 -1.00 0.00 0.00 179.01 179.36 1mei h GLY 297 N 0.29 1.19 0.95 -3.84 0.00 -1.92 -0.98 103.07 98.77 1mei h GLY 297 Ca 0.09 -0.66 -0.00 0.00 0.00 0.00 0.00 47.33 46.77 1mei h GLY 297 CO -0.01 0.62 -0.00 -2.75 0.00 0.00 0.00 176.54 174.40 1mei h PHE 298 N 1.07 -0.00 -0.64 5.60 3.57 -1.17 -2.52 116.94 122.84 1mei h PHE 298 Ca 0.25 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.81 1mei h PHE 298 Cb 0.22 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 38.91 1mei h PHE 298 CO 0.02 0.05 0.34 -0.09 -2.23 0.00 0.00 178.31 176.40 1mei h ARG 299 N -0.05 0.61 -0.58 1.11 9.65 -0.81 0.40 114.38 124.70 1mei h ARG 299 Ca -0.00 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.83 1mei h ARG 299 Cb 0.05 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.47 1mei h ARG 299 CO 0.00 0.40 0.32 -0.92 2.80 0.00 0.00 179.97 182.57 1mei h TYR 300 N 0.63 0.80 0.00 2.20 3.20 -1.05 -1.33 116.97 121.42 1mei h TYR 300 Ca 0.29 -0.02 -0.13 0.00 3.14 0.00 0.00 58.73 62.02 1mei h TYR 300 Cb 0.21 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 1mei h TYR 300 CO -0.09 0.58 -0.60 -0.07 -1.64 0.00 0.00 178.16 176.34 1mei h LEU 301 N 0.79 0.00 0.10 2.82 3.38 -0.99 -2.34 115.31 119.07 1mei h LEU 301 Ca 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1mei h LEU 301 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1mei h LEU 301 CO -0.03 0.60 -0.05 0.00 0.09 0.00 0.00 178.44 179.04 1mei h ALA 302 N 1.40 -0.14 0.00 1.53 0.00 -0.62 -2.22 119.26 119.22 1mei h ALA 302 Ca -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1mei h ALA 302 Cb 1.16 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1mei h ALA 302 CO 0.08 -0.38 -0.04 -0.44 0.00 0.00 0.00 179.25 178.46 1mei h ASP 303 N -0.52 0.00 1.11 0.00 3.32 -1.27 -0.00 116.42 119.05 1mei h ASP 303 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1mei h ASP 303 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1mei h ASP 303 CO 0.02 0.04 0.00 0.00 -1.72 0.00 0.00 179.24 177.58 1mei h ALA 304 N 1.96 1.00 0.00 3.45 0.00 -1.14 -3.47 119.26 121.06 1mei h ALA 304 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mei h ALA 304 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1mei h ALA 304 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1mei n GLY 305 N 0.28 1.01 3.64 0.00 0.00 -0.01 -4.55 105.19 105.56 1mei n GLY 305 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1mei n GLY 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mei n ALA 306 N -1.10 0.57 0.24 4.61 0.00 -0.87 -4.90 120.51 119.06 1mei n ALA 306 Ca 0.00 0.29 0.12 0.00 0.00 0.00 0.00 53.44 53.85 1mei n ALA 306 Cb 0.00 -2.14 0.11 0.00 0.00 0.00 0.00 19.45 17.42 1mei n ALA 306 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1mei h ASP 307 N 1.93 0.00 -4.59 0.00 3.32 -1.28 -3.46 116.42 112.34 1mei h ASP 307 Ca -0.45 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.57 1mei h ASP 307 Cb 1.32 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.66 1mei h ASP 307 CO 0.59 0.01 0.31 0.72 -1.72 0.00 0.00 179.24 179.15 1mei s PHE 308 N -3.27 -0.57 -0.10 4.55 -0.12 -1.26 -0.11 117.98 117.10 1mei s PHE 308 Ca 0.04 1.03 0.03 0.00 -0.05 0.00 0.00 56.93 57.98 1mei s PHE 308 Cb 0.08 0.41 -0.00 0.00 -0.63 0.00 0.00 43.02 42.88 1mei s PHE 308 CO 0.72 -0.50 -0.23 0.42 -0.05 0.00 0.00 175.22 175.59 1mei s ILE 309 N -1.01 2.20 -0.13 -4.49 1.01 -0.86 -1.16 121.20 116.76 1mei s ILE 309 Ca -0.07 -0.97 -0.18 0.00 0.00 0.00 0.00 60.65 59.43 1mei s ILE 309 Cb -0.01 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.57 1mei s ILE 309 CO 0.06 0.56 0.47 -0.75 0.00 0.00 0.00 174.94 175.27 1mei s LYS 310 N 0.33 4.32 -0.15 2.79 2.20 0.79 -0.97 119.74 129.03 1mei s LYS 310 Ca -0.17 0.42 -0.06 0.00 -0.36 0.00 0.00 55.97 55.79 1mei s LYS 310 Cb -0.18 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 32.66 1mei s LYS 310 CO 0.08 0.13 0.05 0.42 -0.36 0.00 0.00 175.35 175.67 1mei s ILE 311 N 0.73 4.71 0.00 5.43 1.01 0.23 -1.82 121.20 131.49 1mei s ILE 311 Ca 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.83 1mei s ILE 311 Cb -0.15 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.24 1mei s ILE 311 CO 0.10 0.51 0.00 0.61 0.00 0.00 0.00 174.94 176.16 1mei n GLY 312 N 3.07 3.50 2.74 6.18 0.00 -0.70 -0.29 105.19 119.69 1mei n GLY 312 Ca -0.17 -0.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.95 1mei n GLY 312 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mei s ILE 313 N 0.00 -0.24 0.00 -0.61 1.01 -1.26 -4.68 121.20 115.42 1mei s ILE 313 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.69 1mei s ILE 313 Cb 0.00 -0.52 0.00 0.00 0.01 0.00 0.00 42.46 41.95 1mei s ILE 313 CO 0.00 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.45 1mei n GLY 314 N 5.31 2.67 0.35 6.18 0.00 -1.26 -2.90 105.19 115.53 1mei n GLY 314 Ca -0.05 -0.16 0.02 0.00 0.00 0.00 0.00 46.02 45.82 1mei n GLY 314 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1mei h GLY 315 N 0.00 1.02 -2.87 -0.02 0.00 -1.89 -3.43 103.07 95.87 1mei h GLY 315 Ca 0.00 -0.36 -0.48 0.00 0.00 0.00 0.00 47.33 46.49 1mei h GLY 315 CO 0.00 0.34 -1.28 0.61 0.00 0.00 0.00 176.54 176.20 1mei n GLY 316 N -1.43 -3.33 0.15 4.60 0.00 -1.26 -3.20 105.19 100.72 1mei n GLY 316 Ca 0.09 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 1mei n GLY 316 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1mei h SER 317 N -0.45 0.47 -0.24 1.61 4.64 -1.94 -3.00 113.55 114.64 1mei h SER 317 Ca -0.35 -0.55 -0.14 0.00 -0.47 0.00 0.00 61.79 60.28 1mei h SER 317 Cb 1.14 -0.14 -0.07 0.00 -0.31 0.00 0.00 62.40 63.02 1mei h SER 317 CO 0.26 0.93 0.17 2.30 -0.87 0.00 0.00 176.83 179.63 1mei n ILE 318 N -4.43 1.83 -4.18 0.95 -6.64 -1.26 -4.82 119.36 100.81 1mei n ILE 318 Ca -0.07 -0.68 -0.34 0.00 -1.77 0.00 0.00 62.75 59.90 1mei n ILE 318 Cb 0.45 -1.07 -0.14 0.00 -1.44 0.00 0.00 39.64 37.43 1mei n ILE 318 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1mei n ILE 320 N 4.42 3.21 -0.21 0.00 2.08 -1.26 -4.92 119.36 122.68 1mei n ILE 320 Ca -0.19 -5.25 -0.02 0.00 0.56 0.00 0.00 62.75 57.85 1mei n ILE 320 Cb 0.51 -1.35 -0.00 0.00 -0.75 0.00 0.00 39.64 38.05 1mei n ILE 320 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 1mei n THR 321 N -0.35 -0.31 0.04 1.39 -1.04 -1.26 -0.69 114.28 112.07 1mei n THR 321 Ca 0.38 1.28 -0.10 0.00 -2.04 0.00 0.00 64.05 63.57 1mei n THR 321 Cb 0.46 -1.65 -0.06 0.00 -1.82 0.00 0.00 70.33 67.26 1mei n THR 321 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1mei h ARG 322 N 0.00 -0.41 -2.79 -2.82 -0.00 -1.93 -2.30 114.38 104.13 1mei h ARG 322 Ca 0.15 0.03 -0.30 0.00 -0.50 0.00 0.00 59.98 59.36 1mei h ARG 322 Cb 0.29 0.09 -0.01 0.00 0.00 0.00 0.00 29.97 30.34 1mei h ARG 322 CO -0.53 -0.28 1.44 -1.91 0.00 0.00 0.00 179.97 178.70 1mei n GLU 323 N -4.31 2.03 0.00 0.04 4.07 0.13 -4.29 120.64 118.32 1mei n GLU 323 Ca -0.05 -1.21 0.00 0.00 -0.06 0.00 0.00 57.16 55.85 1mei n GLU 323 Cb 0.25 -2.21 0.00 0.00 -0.06 0.00 0.00 31.44 29.42 1mei n GLU 323 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 1mei n GLN 324 N 3.31 0.00 -0.00 5.31 -0.06 -0.88 -4.91 117.38 120.15 1mei n GLN 324 Ca 0.43 0.00 0.05 0.00 -2.00 0.00 0.00 57.00 55.48 1mei n GLN 324 Cb 0.41 0.00 -0.08 0.00 -4.06 0.00 0.00 30.24 26.51 1mei n GLN 324 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1mei n LYS 325 N 0.00 0.32 -1.66 3.69 5.02 -1.22 -5.01 118.16 119.29 1mei n LYS 325 Ca 0.00 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1mei n LYS 325 Cb 0.00 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1mei n LYS 325 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mei n GLY 326 N 1.92 0.40 3.61 0.72 0.00 -1.14 -5.05 105.19 105.64 1mei n GLY 326 Ca -0.02 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.75 1mei n GLY 326 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1mei s ILE 327 N -2.00 3.65 -5.00 -0.61 -4.36 -1.26 -5.04 121.20 106.58 1mei s ILE 327 Ca 0.00 -0.95 0.00 0.00 -0.26 0.00 0.00 60.65 59.44 1mei s ILE 327 Cb 0.00 -2.65 0.00 0.00 1.25 0.00 0.00 42.46 41.06 1mei s ILE 327 CO 0.00 0.26 0.00 0.61 0.24 0.00 0.00 174.94 176.05 1mei n GLY 328 N 1.13 -0.38 3.62 6.27 0.00 -1.26 -4.62 105.19 109.94 1mei n GLY 328 Ca -0.14 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.21 1mei n GLY 328 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1mei s ARG 329 N -1.88 0.46 0.21 1.61 3.52 -1.14 -5.04 118.95 116.67 1mei s ARG 329 Ca 0.00 0.34 -0.32 0.00 -0.13 0.00 0.00 55.73 55.62 1mei s ARG 329 Cb 0.00 0.22 -0.14 0.00 -1.56 0.00 0.00 34.95 33.46 1mei s ARG 329 CO 0.00 -0.10 1.30 0.41 -0.81 0.00 0.00 175.30 176.10 1mei n GLY 330 N 1.52 0.44 0.34 8.12 0.00 -1.26 -4.66 105.19 109.69 1mei n GLY 330 Ca -0.11 0.52 0.04 0.00 0.00 0.00 0.00 46.02 46.47 1mei n GLY 330 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1mei h GLN 331 N 3.85 0.96 0.03 1.61 5.75 -1.92 -1.18 115.11 124.21 1mei h GLN 331 Ca -0.44 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.00 1mei h GLN 331 Cb 1.31 -0.22 0.00 0.00 1.07 0.00 0.00 27.48 29.64 1mei h GLN 331 CO 0.73 0.63 -0.02 0.00 -2.65 0.00 0.00 178.83 177.53 1mei h ALA 332 N 1.47 -0.04 -0.97 3.38 0.00 -1.75 -0.73 119.26 120.62 1mei h ALA 332 Ca 0.43 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.29 1mei h ALA 332 Cb 0.31 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1mei h ALA 332 CO -0.22 -0.47 0.64 1.15 0.00 0.00 0.00 179.25 180.35 1mei h THR 333 N -0.15 1.23 -0.14 0.00 2.02 -1.34 -0.65 112.91 113.87 1mei h THR 333 Ca -0.00 -0.44 -0.00 0.00 0.77 0.00 0.00 66.41 66.73 1mei h THR 333 Cb 0.14 -0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.37 1mei h THR 333 CO 0.01 0.24 0.08 0.00 0.37 0.00 0.00 175.52 176.21 1mei h ALA 334 N 1.36 0.18 -0.14 6.16 0.00 -0.94 -1.45 119.26 124.44 1mei h ALA 334 Ca 0.36 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1mei h ALA 334 Cb -0.12 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1mei h ALA 334 CO -0.09 -0.28 0.05 0.28 0.00 0.00 0.00 179.25 179.22 1mei h VAL 335 N 0.13 1.16 -0.85 0.00 2.07 -0.79 -1.00 116.25 116.97 1mei h VAL 335 Ca 0.05 -0.47 0.05 0.00 0.82 0.00 0.00 66.70 67.15 1mei h VAL 335 Cb 0.07 1.21 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 1mei h VAL 335 CO -0.01 0.14 0.54 0.40 0.02 0.00 0.00 177.57 178.66 1mei h ILE 336 N 0.07 1.08 -0.18 4.57 2.04 -1.07 0.11 117.51 124.13 1mei h ILE 336 Ca 0.05 -0.35 -0.10 0.00 1.00 0.00 0.00 64.86 65.47 1mei h ILE 336 Cb 0.18 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.24 1mei h ILE 336 CO -0.00 0.18 -0.26 -0.78 0.00 0.00 0.00 178.15 177.29 1mei h ASP 337 N 1.01 0.54 -0.61 1.72 3.58 -1.14 -2.66 116.42 118.86 1mei h ASP 337 Ca 0.36 -0.52 -0.09 0.00 0.42 0.00 0.00 57.03 57.20 1mei h ASP 337 Cb 0.11 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1mei h ASP 337 CO -0.15 0.95 0.01 0.58 -2.88 0.00 0.00 179.24 177.76 1mei h VAL 338 N 0.14 1.27 -0.87 2.25 2.07 -0.92 -2.53 116.25 117.65 1mei h VAL 338 Ca 0.02 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.38 1mei h VAL 338 Cb 0.84 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 1mei h VAL 338 CO 0.06 0.42 0.48 0.58 0.02 0.00 0.00 177.57 179.13 1mei h VAL 339 N 0.98 1.25 -0.54 2.57 2.07 -0.80 0.15 116.25 121.93 1mei h VAL 339 Ca 0.18 -0.61 -0.10 0.00 0.82 0.00 0.00 66.70 66.98 1mei h VAL 339 Cb 0.55 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1mei h VAL 339 CO 0.03 0.28 -0.07 0.00 0.02 0.00 0.00 177.57 177.82 1mei h ALA 340 N 1.32 0.85 -0.42 1.67 0.00 -1.31 -0.72 119.26 120.64 1mei h ALA 340 Ca 0.31 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1mei h ALA 340 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1mei h ALA 340 CO -0.05 0.66 -0.18 1.49 0.00 0.00 0.00 179.25 181.16 1mei h GLU 341 N 0.89 0.87 -0.87 0.00 4.57 -1.00 -1.23 114.58 117.81 1mei h GLU 341 Ca 0.15 -0.37 -0.01 0.00 -1.18 0.00 0.00 59.36 57.95 1mei h GLU 341 Cb 0.62 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.14 1mei h GLU 341 CO 0.04 1.02 0.51 -0.09 -1.18 0.00 0.00 179.01 179.31 1mei h ARG 342 N 0.70 1.20 -0.18 1.92 1.12 -0.48 0.28 114.38 118.93 1mei h ARG 342 Ca 0.10 -0.12 -0.13 0.00 -1.11 0.00 0.00 59.98 58.72 1mei h ARG 342 Cb 0.74 -0.25 -0.01 0.00 -0.01 0.00 0.00 29.97 30.45 1mei h ARG 342 CO 0.06 0.85 -0.44 -0.91 -3.11 0.00 0.00 179.97 176.42 1mei h ASN 343 N 1.21 0.47 -0.35 -3.80 2.35 -0.97 -0.49 115.58 114.00 1mei h ASN 343 Ca 0.31 -0.22 -0.09 0.00 -0.55 0.00 0.00 56.30 55.76 1mei h ASN 343 Cb -0.02 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1mei h ASN 343 CO -0.06 0.85 -0.12 0.50 -1.65 0.00 0.00 177.43 176.96 1mei h LYS 344 N 0.36 0.70 -0.91 0.81 3.64 -0.63 -2.33 116.57 118.21 1mei h LYS 344 Ca 0.03 -0.28 -0.01 0.00 -1.27 0.00 0.00 60.65 59.11 1mei h LYS 344 Cb 0.92 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.67 1mei h LYS 344 CO 0.08 0.87 0.51 -0.92 -2.27 0.00 0.00 179.45 177.72 1mei h TYR 345 N 0.48 1.24 -0.63 1.91 3.20 -0.18 -2.05 116.97 120.95 1mei h TYR 345 Ca 0.08 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 1mei h TYR 345 Cb 0.64 -0.40 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 1mei h TYR 345 CO 0.05 0.85 0.29 0.35 -1.64 0.00 0.00 178.16 178.06 1mei h PHE 346 N 1.27 0.92 -0.35 -3.82 3.57 -0.92 -1.35 116.94 116.25 1mei h PHE 346 Ca 0.32 -0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.70 1mei h PHE 346 Cb 0.01 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.45 1mei h PHE 346 CO 0.01 0.70 -0.07 0.93 -2.23 0.00 0.00 178.31 177.65 1mei h GLU 347 N 0.87 0.58 0.10 1.11 4.39 -1.01 0.56 114.58 121.18 1mei h GLU 347 Ca 0.21 -0.16 -0.28 0.00 0.34 0.00 0.00 59.36 59.47 1mei h GLU 347 Cb 0.14 -0.07 0.02 0.00 -0.10 0.00 0.00 28.75 28.74 1mei h GLU 347 CO -0.03 0.66 -1.19 0.93 -1.16 0.00 0.00 179.01 178.23 1mei h GLU 348 N 0.54 0.54 0.00 2.33 5.08 -1.12 -3.39 114.58 118.56 1mei h GLU 348 Ca 0.11 -0.71 0.00 0.00 -1.00 0.00 0.00 59.36 57.75 1mei h GLU 348 Cb 0.46 0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1mei h GLU 348 CO 0.02 1.31 -0.55 0.25 -1.00 0.00 0.00 179.01 179.04 1mei n THR 349 N -3.75 0.00 -0.99 1.13 -2.24 -0.53 -5.00 114.28 102.91 1mei n THR 349 Ca -0.12 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1mei n THR 349 Cb 0.96 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 70.02 1mei n THR 349 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mei n GLY 350 N 1.41 0.64 3.58 3.38 0.00 0.20 -4.97 105.19 109.42 1mei n GLY 350 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1mei n GLY 350 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mei s ILE 351 N -2.62 5.03 -0.33 -0.61 1.01 -1.25 -0.54 121.20 121.88 1mei s ILE 351 Ca 0.00 0.07 -0.12 0.00 0.00 0.00 0.00 60.65 60.59 1mei s ILE 351 Cb 0.00 -3.36 -0.02 0.00 0.01 0.00 0.00 42.46 39.09 1mei s ILE 351 CO 0.00 0.32 0.23 -0.47 0.00 0.00 0.00 174.94 175.02 1mei s TYR 352 N 1.37 3.22 -0.31 3.97 5.04 -0.01 -3.78 117.35 126.86 1mei s TYR 352 Ca 0.06 -0.18 -0.09 0.00 -2.44 0.00 0.00 57.07 54.42 1mei s TYR 352 Cb -0.15 -2.46 -0.00 0.00 0.35 0.00 0.00 41.96 39.70 1mei s TYR 352 CO 0.06 -0.34 0.14 0.42 -1.34 0.00 0.00 175.55 174.49 1mei s ILE 353 N 1.72 4.47 0.40 3.14 1.01 -1.26 -2.55 121.20 128.14 1mei s ILE 353 Ca 0.06 -0.47 -0.26 0.00 0.00 0.00 0.00 60.65 59.98 1mei s ILE 353 Cb -0.17 -3.28 -0.09 0.00 0.01 0.00 0.00 42.46 38.93 1mei s ILE 353 CO 0.10 0.07 1.34 -2.84 0.00 0.00 0.00 174.94 173.62 1mei s PRO 354 N 1.59 3.98 0.09 2.79 0.02 -1.26 -4.85 135.00 137.36 1mei s PRO 354 Ca 0.04 2.25 0.10 0.00 0.02 0.00 0.00 61.00 63.41 1mei s PRO 354 Cb -0.17 -2.80 -0.04 0.00 0.02 0.00 0.00 34.50 31.51 1mei s PRO 354 CO 0.05 -0.51 -0.25 0.14 -0.33 0.00 0.00 177.00 176.10 1mei s VAL 355 N -1.22 2.36 -0.15 3.83 -7.23 -1.26 -2.02 120.40 114.70 1mei s VAL 355 Ca 0.56 -1.53 -0.00 0.00 -1.81 0.00 0.00 61.98 59.20 1mei s VAL 355 Cb -0.40 -2.00 -0.01 0.00 0.56 0.00 0.00 36.38 34.53 1mei s VAL 355 CO 0.52 0.22 -0.14 0.00 -0.31 0.00 0.00 175.10 175.39 1mei s SER 357 N 0.74 6.45 -0.33 0.00 0.15 -0.55 0.76 113.70 120.91 1mei s SER 357 Ca -0.06 -0.02 -0.09 0.00 0.70 0.00 0.00 55.95 56.49 1mei s SER 357 Cb -0.15 -2.42 0.02 0.00 -1.71 0.00 0.00 66.02 61.75 1mei s SER 357 CO 0.01 -1.01 0.14 -0.62 1.20 0.00 0.00 173.24 172.97 1mei s ASP 358 N 2.25 5.44 0.00 5.45 2.15 0.60 -1.28 116.67 131.27 1mei s ASP 358 Ca 0.33 -0.84 0.00 0.00 0.43 0.00 0.00 52.55 52.47 1mei s ASP 358 Cb -0.11 -1.95 0.00 0.00 -0.30 0.00 0.00 42.92 40.56 1mei s ASP 358 CO 0.24 -0.28 0.00 0.61 -0.17 0.00 0.00 175.17 175.57 1mei n GLY 359 N 4.92 -0.68 1.84 2.66 0.00 -1.04 -4.42 105.19 108.46 1mei n GLY 359 Ca -0.13 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.23 1mei n GLY 359 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mei n GLY 360 N -0.54 0.77 3.55 -0.02 0.00 -1.19 -4.71 105.19 103.05 1mei n GLY 360 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1mei n GLY 360 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mei s ILE 361 N -2.85 4.67 -0.22 -0.61 -1.09 -1.26 -4.77 121.20 115.06 1mei s ILE 361 Ca 0.00 0.52 0.02 0.00 -2.23 0.00 0.00 60.65 58.97 1mei s ILE 361 Cb 0.00 -4.30 -0.15 0.00 -1.58 0.00 0.00 42.46 36.44 1mei s ILE 361 CO 0.00 -0.66 -0.18 0.52 -1.23 0.00 0.00 174.94 173.39 1mei n VAL 362 N 6.07 1.25 -4.41 2.92 0.31 -1.26 -4.92 118.33 118.29 1mei n VAL 362 Ca 0.02 -0.49 -0.21 0.00 -0.01 0.00 0.00 64.34 63.65 1mei n VAL 362 Cb 0.48 -1.24 -0.10 0.00 -0.91 0.00 0.00 33.84 32.07 1mei n VAL 362 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1mei s TYR 363 N -2.44 2.01 0.26 3.52 2.02 -1.26 -5.05 117.35 116.42 1mei s TYR 363 Ca -0.29 -0.47 -0.01 0.00 -0.37 0.00 0.00 57.07 55.93 1mei s TYR 363 Cb 0.07 -0.92 0.50 0.00 -0.40 0.00 0.00 41.96 41.21 1mei s TYR 363 CO 0.51 0.52 1.79 -0.44 -1.57 0.00 0.00 175.55 176.37 1mei h ASP 364 N 2.39 0.67 0.35 2.29 3.32 -1.96 -0.29 116.42 123.19 1mei h ASP 364 Ca -0.39 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.73 1mei h ASP 364 Cb 1.24 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1mei h ASP 364 CO 0.62 0.33 0.00 0.10 -1.72 0.00 0.00 179.24 178.57 1mei h TYR 365 N 0.76 0.00 0.00 4.55 -0.00 -1.96 0.22 116.97 120.54 1mei h TYR 365 Ca 0.45 0.00 -0.08 0.00 0.00 0.00 0.00 58.73 59.11 1mei h TYR 365 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.26 1mei h TYR 365 CO -0.06 0.00 -0.36 0.45 -0.00 0.00 0.00 178.16 178.19 1mei h HIS 366 N 0.00 0.00 0.04 0.10 3.86 -1.43 -1.74 115.15 115.99 1mei h HIS 366 Ca 0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1mei h HIS 366 Cb 0.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.65 1mei h HIS 366 CO 0.00 0.36 -0.02 0.52 0.86 0.00 0.00 177.93 179.65 1mei h MET 367 N 0.00 -0.06 -0.81 2.45 2.86 -1.02 0.27 114.93 118.62 1mei h MET 367 Ca -0.00 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.67 1mei h MET 367 Cb 0.68 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.31 1mei h MET 367 CO 0.05 0.12 0.52 1.15 1.06 0.00 0.00 176.91 179.81 1mei h THR 368 N -0.23 1.12 -0.34 2.22 2.02 -1.53 -1.60 112.91 114.58 1mei h THR 368 Ca -0.01 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 1mei h THR 368 Cb 0.20 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.62 1mei h THR 368 CO 0.01 0.18 0.17 -0.07 0.37 0.00 0.00 175.52 176.19 1mei h LEU 369 N 1.01 0.43 -0.75 2.58 3.38 -1.07 0.83 115.31 121.72 1mei h LEU 369 Ca 0.33 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.21 1mei h LEU 369 Cb 0.01 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1mei h LEU 369 CO -0.11 0.41 0.49 0.00 0.09 0.00 0.00 178.44 179.31 1mei h ALA 370 N 1.03 0.96 -0.15 1.53 0.00 -0.47 -0.34 119.26 121.82 1mei h ALA 370 Ca 0.12 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1mei h ALA 370 Cb 0.09 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1mei h ALA 370 CO -0.02 0.32 -0.10 -0.07 0.00 0.00 0.00 179.25 179.38 1mei h LEU 371 N 0.98 0.35 -1.55 0.00 3.38 -1.11 -2.25 115.31 115.10 1mei h LEU 371 Ca 0.28 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.87 1mei h LEU 371 Cb -0.06 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1mei h LEU 371 CO -0.08 0.72 0.39 0.00 0.09 0.00 0.00 178.44 179.56 1mei h ALA 372 N 0.64 1.84 0.00 1.53 0.00 -0.50 0.36 119.26 123.13 1mei h ALA 372 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1mei h ALA 372 Cb 0.60 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1mei h ALA 372 CO 0.03 0.06 0.00 -1.33 0.00 0.00 0.00 179.25 178.01 1mei n MET 373 N -4.47 0.16 0.00 0.00 2.81 -0.17 -4.43 117.12 111.02 1mei n MET 373 Ca 0.08 0.10 0.00 0.00 -1.81 0.00 0.00 57.70 56.08 1mei n MET 373 Cb 0.24 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.25 1mei n MET 373 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1mei n GLY 374 N 0.65 1.54 3.74 3.03 0.00 0.11 -4.56 105.19 109.70 1mei n GLY 374 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1mei n GLY 374 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mei s ALA 375 N -1.83 3.61 0.05 4.61 0.00 -0.86 -4.83 121.76 122.52 1mei s ALA 375 Ca 0.00 1.27 -0.15 0.00 0.00 0.00 0.00 51.96 53.08 1mei s ALA 375 Cb 0.00 -3.54 -0.27 0.00 0.00 0.00 0.00 23.12 19.31 1mei s ALA 375 CO 0.00 -0.69 1.12 -0.44 0.00 0.00 0.00 175.76 175.75 1mei h ASP 376 N 5.25 0.86 -5.49 0.00 3.32 -1.56 -3.39 116.42 115.40 1mei h ASP 376 Ca -0.45 -0.79 -0.20 0.00 0.02 0.00 0.00 57.03 55.61 1mei h ASP 376 Cb 1.22 -0.27 -0.13 0.00 0.22 0.00 0.00 39.33 40.37 1mei h ASP 376 CO 0.78 1.55 -0.43 0.72 -1.72 0.00 0.00 179.24 180.15 1mei s PHE 377 N -3.10 0.93 -0.03 4.55 -0.71 -1.17 -4.81 117.98 113.64 1mei s PHE 377 Ca -0.10 -1.18 0.05 0.00 -1.04 0.00 0.00 56.93 54.66 1mei s PHE 377 Cb 0.06 -0.30 -0.01 0.00 -1.21 0.00 0.00 43.02 41.56 1mei s PHE 377 CO 0.92 -0.80 -0.19 0.42 -1.34 0.00 0.00 175.22 174.23 1mei s ILE 378 N -4.01 1.54 -0.17 -4.49 1.01 0.40 -1.49 121.20 114.00 1mei s ILE 378 Ca 0.33 -0.80 -0.06 0.00 0.00 0.00 0.00 60.65 60.13 1mei s ILE 378 Cb 0.04 -1.30 -0.03 0.00 0.01 0.00 0.00 42.46 41.17 1mei s ILE 378 CO 0.12 0.44 0.01 -0.32 0.00 0.00 0.00 174.94 175.19 1mei s MET 379 N -0.16 3.81 0.01 2.79 -2.45 -0.41 -0.89 119.30 122.01 1mei s MET 379 Ca 0.00 -0.44 0.05 0.00 -1.25 0.00 0.00 55.69 54.05 1mei s MET 379 Cb -0.10 -3.07 -0.02 0.00 1.25 0.00 0.00 34.83 32.89 1mei s MET 379 CO 0.01 0.24 -0.14 -0.51 1.05 0.00 0.00 175.02 175.67 1mei s LEU 380 N 0.40 2.09 0.00 4.11 1.43 -0.55 -2.49 118.68 123.67 1mei s LEU 380 Ca -0.00 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 1mei s LEU 380 Cb -0.13 -0.70 0.00 0.00 0.03 0.00 0.00 46.19 45.39 1mei s LEU 380 CO 0.02 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.33 1mei n GLY 381 N 2.39 -0.19 0.26 -3.19 0.00 -1.26 -0.54 105.19 102.65 1mei n GLY 381 Ca -0.16 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.89 1mei n GLY 381 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1mei h ARG 382 N 0.00 0.08 -0.57 1.61 2.43 -1.97 -1.22 114.38 114.74 1mei h ARG 382 Ca 0.00 -0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.28 1mei h ARG 382 Cb 0.00 -0.02 -0.11 0.00 -0.42 0.00 0.00 29.97 29.42 1mei h ARG 382 CO 0.00 0.06 -0.15 -0.92 -1.51 0.00 0.00 179.97 177.45 1mei h TYR 383 N 0.09 -0.32 0.00 2.20 3.20 -1.91 -2.29 116.97 117.93 1mei h TYR 383 Ca 0.36 0.05 -0.13 0.00 3.14 0.00 0.00 58.73 62.15 1mei h TYR 383 Cb 0.60 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.08 1mei h TYR 383 CO -0.42 -0.25 -0.64 0.74 -1.64 0.00 0.00 178.16 175.95 1mei h PHE 384 N -0.01 0.00 0.00 -3.82 0.04 -1.63 -3.30 116.94 108.23 1mei h PHE 384 Ca 0.27 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.04 1mei h PHE 384 Cb 0.42 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.57 1mei h PHE 384 CO -0.48 0.64 -0.02 0.00 -0.60 0.00 0.00 178.31 177.85 1mei h ALA 385 N 1.36 1.76 0.00 2.45 0.00 -0.66 -1.98 119.26 122.20 1mei h ALA 385 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1mei h ALA 385 Cb 1.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1mei h ALA 385 CO 0.08 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1mei h ARG 386 N 0.00 0.00 -7.20 0.00 3.08 -1.61 -3.43 114.38 105.21 1mei h ARG 386 Ca -0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.58 1mei h ARG 386 Cb 0.05 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.12 1mei h ARG 386 CO 0.00 0.00 0.38 -0.06 -1.07 0.00 0.00 179.97 179.22 1mei s PHE 387 N -3.58 3.46 0.36 3.04 0.08 -0.74 -1.84 117.98 118.76 1mei s PHE 387 Ca 0.02 1.46 0.10 0.00 0.12 0.00 0.00 56.93 58.63 1mei s PHE 387 Cb 0.09 -2.79 0.86 0.00 -0.57 0.00 0.00 43.02 40.61 1mei s PHE 387 CO 0.48 -0.38 1.87 1.49 -0.10 0.00 0.00 175.22 178.58 1mei h GLU 388 N 0.87 0.63 0.00 0.44 4.57 -1.16 -1.71 114.58 118.22 1mei h GLU 388 Ca -0.47 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1mei h GLU 388 Cb 1.18 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1mei h GLU 388 CO 0.61 0.41 0.00 0.39 -1.18 0.00 0.00 179.01 179.25 1mei n GLU 389 N -4.56 0.17 -2.33 1.92 4.71 -1.26 -4.81 120.64 114.48 1mei n GLU 389 Ca 0.17 0.11 -0.36 0.00 -0.01 0.00 0.00 57.16 57.08 1mei n GLU 389 Cb 0.50 -1.50 -0.01 0.00 -1.01 0.00 0.00 31.44 29.42 1mei n GLU 389 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1mei s SER 390 N -2.76 6.05 0.00 1.62 1.04 -0.64 -3.01 113.70 116.00 1mei s SER 390 Ca 0.16 2.17 0.00 0.00 0.48 0.00 0.00 55.95 58.75 1mei s SER 390 Cb 0.14 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.67 1mei s SER 390 CO 0.35 -0.99 0.63 -0.81 0.98 0.00 0.00 173.24 173.39 1mei n PRO 391 N -0.88 0.68 -2.92 4.02 -0.04 -1.26 -4.88 135.00 129.72 1mei n PRO 391 Ca 0.09 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.37 1mei n PRO 391 Cb 0.50 -1.05 0.02 0.00 -0.04 0.00 0.00 33.50 32.93 1mei n PRO 391 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1mei s THR 392 N -1.84 2.83 0.19 0.52 -4.23 -1.26 -5.02 115.64 106.83 1mei s THR 392 Ca 0.00 -0.91 -0.30 0.00 -1.18 0.00 0.00 61.69 59.30 1mei s THR 392 Cb 0.00 -2.92 -0.08 0.00 1.34 0.00 0.00 72.50 70.84 1mei s THR 392 CO 0.00 0.00 1.04 -0.13 -0.54 0.00 0.00 174.62 174.99 1mei s ARG 393 N -4.49 4.67 -0.27 3.99 0.52 -1.26 -4.85 118.95 117.26 1mei s ARG 393 Ca 0.56 1.63 -0.22 0.00 -0.52 0.00 0.00 55.73 57.19 1mei s ARG 393 Cb -0.10 -3.29 -0.01 0.00 0.52 0.00 0.00 34.95 32.07 1mei s ARG 393 CO 0.35 0.19 0.70 0.21 0.02 0.00 0.00 175.30 176.77 1mei s LYS 394 N -0.56 4.07 -0.07 3.54 2.20 -1.26 -2.81 119.74 124.85 1mei s LYS 394 Ca 0.47 0.61 0.05 0.00 -0.36 0.00 0.00 55.97 56.74 1mei s LYS 394 Cb -0.28 -3.67 -0.01 0.00 -1.51 0.00 0.00 37.83 32.36 1mei s LYS 394 CO 0.34 -0.50 -0.24 0.08 -0.36 0.00 0.00 175.35 174.67 1mei s VAL 395 N 2.67 2.01 -0.38 4.02 1.01 0.87 -4.94 120.40 125.66 1mei s VAL 395 Ca 0.29 -1.02 -0.17 0.00 0.00 0.00 0.00 61.98 61.08 1mei s VAL 395 Cb -0.15 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.52 1mei s VAL 395 CO 0.09 0.55 0.44 -0.89 0.00 0.00 0.00 175.10 175.30 1mei s THR 396 N 0.06 5.08 -0.28 3.92 2.01 -1.26 0.86 115.64 126.04 1mei s THR 396 Ca -0.10 -0.05 -0.02 0.00 0.31 0.00 0.00 61.69 61.84 1mei s THR 396 Cb -0.15 -3.96 0.04 0.00 0.01 0.00 0.00 72.50 68.44 1mei s THR 396 CO 0.06 -0.28 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.06 1mei s ILE 397 N 2.19 2.96 -1.19 1.82 1.01 0.11 -4.79 121.20 123.31 1mei s ILE 397 Ca 0.14 -1.27 -0.32 0.00 0.00 0.00 0.00 60.65 59.20 1mei s ILE 397 Cb -0.16 -2.64 0.04 0.00 0.01 0.00 0.00 42.46 39.70 1mei s ILE 397 CO 0.13 -0.02 0.69 -0.46 0.00 0.00 0.00 174.94 175.29 1mei n ASN 398 N 4.64 -4.33 0.00 3.58 6.94 -1.26 -1.03 115.26 123.80 1mei n ASN 398 Ca -0.14 -1.25 0.00 0.00 -0.02 0.00 0.00 54.58 53.17 1mei n ASN 398 Cb 0.44 -1.87 0.00 0.00 -2.36 0.00 0.00 39.78 35.99 1mei n ASN 398 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1mei n GLY 399 N -2.03 2.63 3.40 4.83 0.00 -1.26 -5.00 105.19 107.76 1mei n GLY 399 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1mei n GLY 399 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mei s SER 400 N -3.80 4.48 -0.15 1.61 0.01 -0.20 -5.08 113.70 110.57 1mei s SER 400 Ca 0.00 -0.28 -0.25 0.00 1.31 0.00 0.00 55.95 56.74 1mei s SER 400 Cb 0.00 -1.74 -0.02 0.00 0.21 0.00 0.00 66.02 64.47 1mei s SER 400 CO 0.00 0.08 0.80 -0.69 0.41 0.00 0.00 173.24 173.84 1mei s VAL 401 N 0.90 4.91 0.40 3.43 1.01 -1.26 0.07 120.40 129.85 1mei s VAL 401 Ca -0.01 1.59 0.05 0.00 0.00 0.00 0.00 61.98 63.61 1mei s VAL 401 Cb -0.15 -4.12 -0.06 0.00 0.00 0.00 0.00 36.38 32.06 1mei s VAL 401 CO 0.01 0.07 0.04 -0.04 0.00 0.00 0.00 175.10 175.17 1mei s MET 402 N 1.93 1.89 0.04 2.72 -1.94 0.25 -1.52 119.30 122.66 1mei s MET 402 Ca 0.38 -2.10 0.05 0.00 -1.71 0.00 0.00 55.69 52.31 1mei s MET 402 Cb -0.17 -1.26 -0.02 0.00 2.01 0.00 0.00 34.83 35.39 1mei s MET 402 CO 0.13 -0.19 -0.14 0.15 -0.01 0.00 0.00 175.02 174.97 1mei s LYS 403 N -3.80 0.91 0.47 2.03 1.02 0.97 -0.09 119.74 121.24 1mei s LYS 403 Ca 0.30 -0.76 -0.21 0.00 0.02 0.00 0.00 55.97 55.32 1mei s LYS 403 Cb 0.08 -0.91 -0.08 0.00 -0.52 0.00 0.00 37.83 36.39 1mei s LYS 403 CO 0.15 0.22 1.06 -1.21 -0.92 0.00 0.00 175.35 174.65 1mei s GLU 404 N -1.16 3.85 -0.24 1.68 2.02 -1.12 -0.84 118.70 122.88 1mei s GLU 404 Ca 0.01 1.47 -0.10 0.00 0.02 0.00 0.00 54.97 56.38 1mei s GLU 404 Cb -0.08 -2.24 0.10 0.00 0.10 0.00 0.00 34.13 32.01 1mei s GLU 404 CO 0.01 -0.41 0.53 -0.47 0.02 0.00 0.00 175.26 174.95 1mei s TYR 405 N -1.82 -0.99 0.02 1.61 5.04 -0.16 -4.83 117.35 116.22 1mei s TYR 405 Ca 0.65 1.85 0.00 0.00 -2.44 0.00 0.00 57.07 57.13 1mei s TYR 405 Cb -0.20 0.51 -0.02 0.00 0.35 0.00 0.00 41.96 42.61 1mei s TYR 405 CO 0.24 -0.53 -0.03 1.67 -1.34 0.00 0.00 175.55 175.56 1mei s TRP 406 N 2.39 0.29 0.68 4.97 -2.14 -1.26 -0.07 118.94 123.80 1mei s TRP 406 Ca -0.05 -0.42 -0.11 0.00 2.66 0.00 0.00 56.10 58.18 1mei s TRP 406 Cb -0.10 -0.19 -0.00 0.00 -3.10 0.00 0.00 33.47 30.07 1mei s TRP 406 CO -0.16 -0.14 1.05 0.20 -2.66 0.00 0.00 176.95 175.25 1mei s GLY 407 N -1.19 1.66 0.26 3.67 0.00 -0.55 -4.65 107.32 106.54 1mei s GLY 407 Ca -0.12 0.03 0.24 0.00 0.00 0.00 0.00 44.72 44.88 1mei s GLY 407 CO -0.01 0.33 1.73 1.18 0.00 0.00 0.00 173.10 176.34 1mei n GLU 408 N -3.05 0.21 0.01 2.90 -0.58 -1.26 -2.38 120.64 116.49 1mei n GLU 408 Ca 0.07 0.40 0.12 0.00 -0.42 0.00 0.00 57.16 57.33 1mei n GLU 408 Cb 0.54 -1.88 0.24 0.00 -0.57 0.00 0.00 31.44 29.77 1mei n GLU 408 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1mei n GLY 409 N 0.18 -1.27 3.78 0.62 0.00 -1.26 -4.23 105.19 103.01 1mei n GLY 409 Ca 0.03 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 1mei n GLY 409 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1mei s SER 410 N -3.12 5.11 0.46 1.61 1.04 -1.00 -2.57 113.70 115.23 1mei s SER 410 Ca 0.10 1.94 0.18 0.00 0.48 0.00 0.00 55.95 58.66 1mei s SER 410 Cb 0.17 -2.54 1.10 0.00 0.10 0.00 0.00 66.02 64.85 1mei s SER 410 CO 0.70 -1.63 1.99 0.77 0.98 0.00 0.00 173.24 176.06 1mei h SER 411 N -0.11 0.00 0.04 7.02 4.64 -1.88 -1.91 113.55 121.35 1mei h SER 411 Ca -0.46 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1mei h SER 411 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1mei h SER 411 CO 0.54 0.19 -0.02 -0.09 -0.87 0.00 0.00 176.83 176.59 1mei h ARG 412 N 0.00 0.00 0.00 4.77 2.43 -1.91 -2.69 114.38 116.98 1mei h ARG 412 Ca -0.00 0.00 -0.40 0.00 -0.81 0.00 0.00 59.98 58.77 1mei h ARG 412 Cb 0.38 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.86 1mei h ARG 412 CO 0.03 0.02 -2.48 0.00 -1.51 0.00 0.00 179.97 176.02 1mei n ALA 413 N -2.33 1.40 0.26 2.80 0.00 -0.77 -4.43 120.51 117.45 1mei n ALA 413 Ca -0.03 -1.10 0.10 0.00 0.00 0.00 0.00 53.44 52.41 1mei n ALA 413 Cb 0.10 -0.09 0.70 0.00 0.00 0.00 0.00 19.45 20.16 1mei n ALA 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mei h ARG 414 N -0.11 0.00 -3.21 0.00 3.08 -1.41 -3.28 114.38 109.45 1mei h ARG 414 Ca -0.59 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 58.93 1mei h ARG 414 Cb 1.87 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.95 1mei h ARG 414 CO -0.12 0.04 3.27 -1.71 -1.07 0.00 0.00 179.97 180.38 1mei n ASN 415 N -4.23 6.95 -0.06 7.04 2.85 -1.02 -5.11 115.26 121.69 1mei n ASN 415 Ca -0.03 -2.45 0.01 0.00 -0.11 0.00 0.00 54.58 51.99 1mei n ASN 415 Cb 0.13 -1.34 0.01 0.00 1.24 0.00 0.00 39.78 39.82 1mei n ASN 415 CO 0.00 0.00 0.00 -2.67 -2.11 0.00 0.00 177.26 172.48 1mei n TRP 416 N 3.89 0.02 1.31 1.20 4.27 -1.24 -5.05 117.44 121.83 1mei n TRP 416 Ca 0.63 -0.17 0.05 0.00 -3.89 0.00 0.00 57.50 54.12 1mei n TRP 416 Cb 0.18 -0.02 0.32 0.00 -1.36 0.00 0.00 31.31 30.44 1mei n TRP 416 CO 0.00 0.00 0.00 -1.13 -2.29 0.00 0.00 177.69 174.27 1mei n SER 428 N -0.08 0.00 -0.84 -0.67 3.41 -1.26 -4.87 113.62 109.31 1mei n SER 428 Ca 0.01 -0.97 0.00 0.00 -0.26 0.00 0.00 58.87 57.65 1mei n SER 428 Cb 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 1mei n SER 428 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1mei n PHE 429 N -0.76 0.00 -3.49 7.33 7.35 -1.26 -5.18 117.46 121.45 1mei n PHE 429 Ca 0.08 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.78 1mei n PHE 429 Cb 0.04 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 39.81 1mei n PHE 429 CO 0.00 0.00 0.00 -2.00 -0.76 0.00 0.00 176.76 174.00 1mei s GLU 430 N -1.06 0.18 0.23 -4.13 2.12 -1.26 -4.83 118.70 109.94 1mei s GLU 430 Ca 0.00 0.36 0.26 0.00 0.36 0.00 0.00 54.97 55.95 1mei s GLU 430 Cb 0.00 0.12 0.81 0.00 0.26 0.00 0.00 34.13 35.32 1mei s GLU 430 CO 0.00 -0.05 1.77 0.93 -0.54 0.00 0.00 175.26 177.37 1mei h GLU 431 N 6.29 0.00 0.00 4.30 3.07 -1.87 -3.47 114.58 122.90 1mei h GLU 431 Ca -0.22 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.46 1mei h GLU 431 Cb 1.15 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 29.01 1mei h GLU 431 CO 0.15 0.00 -0.17 0.41 -1.40 0.00 0.00 179.01 178.00 1mei n GLY 432 N 1.20 3.38 3.40 -3.84 0.00 -1.23 -4.62 105.19 103.47 1mei n GLY 432 Ca 0.05 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.17 1mei n GLY 432 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mei s VAL 433 N -2.59 1.58 -0.27 1.61 -7.23 -1.23 -4.45 120.40 107.82 1mei s VAL 433 Ca 0.16 -2.13 0.03 0.00 -1.81 0.00 0.00 61.98 58.23 1mei s VAL 433 Cb 0.01 -2.37 0.07 0.00 0.56 0.00 0.00 36.38 34.64 1mei s VAL 433 CO 0.12 -0.35 -0.08 -0.62 -0.31 0.00 0.00 175.10 173.85 1mei s ASP 434 N -3.40 4.40 0.00 4.85 2.15 -1.26 -1.48 116.67 121.93 1mei s ASP 434 Ca 0.28 -1.47 0.00 0.00 0.43 0.00 0.00 52.55 51.79 1mei s ASP 434 Cb 0.03 -1.50 0.00 0.00 -0.30 0.00 0.00 42.92 41.15 1mei s ASP 434 CO 0.11 -0.22 0.00 -1.54 -0.17 0.00 0.00 175.17 173.34 1mei n SER 435 N 4.44 0.16 -4.25 -0.34 3.41 0.91 -4.99 113.62 112.96 1mei n SER 435 Ca -0.11 -0.03 -0.23 0.00 -0.26 0.00 0.00 58.87 58.23 1mei n SER 435 Cb 0.42 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.24 1mei n SER 435 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1mei s TYR 436 N -0.87 1.69 0.04 7.33 2.02 -1.26 -0.99 117.35 125.31 1mei s TYR 436 Ca 0.00 -0.41 0.06 0.00 -0.37 0.00 0.00 57.07 56.35 1mei s TYR 436 Cb 0.00 -0.95 -0.02 0.00 -0.40 0.00 0.00 41.96 40.59 1mei s TYR 436 CO 0.00 0.15 -0.17 0.14 -1.57 0.00 0.00 175.55 174.09 1mei s VAL 437 N -1.06 1.40 0.21 0.71 -7.23 -0.02 -4.93 120.40 109.48 1mei s VAL 437 Ca 0.05 -1.08 -0.30 0.00 -1.81 0.00 0.00 61.98 58.84 1mei s VAL 437 Cb -0.10 -1.23 -0.09 0.00 0.56 0.00 0.00 36.38 35.52 1mei s VAL 437 CO 0.03 0.13 1.41 -2.16 -0.31 0.00 0.00 175.10 174.20 1mei s PRO 438 N -1.11 4.30 0.20 4.82 0.04 -1.26 -0.02 135.00 141.97 1mei s PRO 438 Ca 0.05 2.21 -0.32 0.00 0.04 0.00 0.00 61.00 62.98 1mei s PRO 438 Cb -0.08 -3.15 -0.11 0.00 0.04 0.00 0.00 34.50 31.19 1mei s PRO 438 CO 0.01 -0.39 1.63 -0.47 0.04 0.00 0.00 177.00 177.83 1mei s TYR 439 N 0.27 2.96 -0.59 0.56 5.04 -0.58 -4.71 117.35 120.30 1mei s TYR 439 Ca 0.60 0.53 0.05 0.00 -2.44 0.00 0.00 57.07 55.81 1mei s TYR 439 Cb -0.40 -4.03 0.04 0.00 0.35 0.00 0.00 41.96 37.92 1mei s TYR 439 CO 0.39 -3.81 0.67 0.00 -1.34 0.00 0.00 175.55 171.46 1mei n ALA 440 N 3.71 2.47 0.00 3.97 0.00 -0.77 -5.00 120.51 124.90 1mei n ALA 440 Ca 0.14 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1mei n ALA 440 Cb 0.37 -0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.66 1mei n ALA 440 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mei n GLY 441 N 0.25 -0.71 3.78 0.00 0.00 -1.26 -4.87 105.19 102.37 1mei n GLY 441 Ca 0.03 -1.59 -0.36 0.00 0.00 0.00 0.00 46.02 44.09 1mei n GLY 441 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mei s LYS 442 N 0.00 3.88 0.17 1.61 -0.14 -1.26 -0.57 119.74 123.42 1mei s LYS 442 Ca 0.00 1.62 -0.14 0.00 -1.36 0.00 0.00 55.97 56.09 1mei s LYS 442 Cb 0.00 -2.39 0.11 0.00 -1.68 0.00 0.00 37.83 33.88 1mei s LYS 442 CO 0.00 -0.42 1.75 1.25 -0.76 0.00 0.00 175.35 177.18 1mei h LEU 443 N 2.09 0.18 -0.56 3.17 6.46 -1.93 -3.29 115.31 121.42 1mei h LEU 443 Ca -0.49 0.05 0.06 0.00 -0.12 0.00 0.00 57.88 57.38 1mei h LEU 443 Cb 1.23 0.03 -0.09 0.00 -0.73 0.00 0.00 40.66 41.10 1mei h LEU 443 CO 0.61 0.14 -0.54 0.50 -0.62 0.00 0.00 178.44 178.52 1mei h LYS 444 N 0.33 -0.25 -0.81 1.25 3.64 -1.93 -0.50 116.57 118.30 1mei h LYS 444 Ca 0.20 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1mei h LYS 444 Cb 0.18 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 1mei h LYS 444 CO -0.20 -0.17 0.53 -0.44 -2.27 0.00 0.00 179.45 176.90 1mei h ASP 445 N -0.26 0.94 -0.11 4.20 3.32 -1.98 -1.54 116.42 120.99 1mei h ASP 445 Ca 0.09 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 1mei h ASP 445 Cb 0.51 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1mei h ASP 445 CO -0.67 0.69 -0.20 0.78 -1.72 0.00 0.00 179.24 178.12 1mei h ASN 446 N 1.11 0.37 -0.66 6.45 2.35 -1.51 -2.23 115.58 121.45 1mei h ASN 446 Ca 0.30 -0.55 -0.04 0.00 -0.55 0.00 0.00 56.30 55.46 1mei h ASN 446 Cb -0.11 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 1mei h ASN 446 CO -0.06 0.85 0.28 0.58 -1.65 0.00 0.00 177.43 177.43 1mei h VAL 447 N -0.09 1.23 -0.38 2.81 2.07 -0.98 -0.91 116.25 119.99 1mei h VAL 447 Ca 0.01 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1mei h VAL 447 Cb 0.78 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1mei h VAL 447 CO 0.05 0.29 0.10 -0.08 0.02 0.00 0.00 177.57 177.95 1mei h GLU 448 N 0.99 0.60 -0.73 1.57 4.81 -1.28 -0.49 114.58 120.04 1mei h GLU 448 Ca 0.23 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1mei h GLU 448 Cb 0.17 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 1mei h GLU 448 CO -0.02 0.62 0.24 0.00 -0.73 0.00 0.00 179.01 179.12 1mei h ALA 449 N 0.95 0.96 -0.09 2.92 0.00 -1.07 -1.23 119.26 121.69 1mei h ALA 449 Ca 0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1mei h ALA 449 Cb 0.29 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1mei h ALA 449 CO -0.00 0.64 0.02 0.77 0.00 0.00 0.00 179.25 180.68 1mei h SER 450 N 1.08 0.14 1.06 0.00 0.02 -0.95 -2.97 113.55 111.93 1mei h SER 450 Ca 0.24 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 1mei h SER 450 Cb 0.30 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 1mei h SER 450 CO -0.01 0.32 -0.12 -0.07 -1.14 0.00 0.00 176.83 175.81 1mei h LEU 451 N -0.05 0.00 -0.59 5.07 3.38 -1.01 -2.30 115.31 119.81 1mei h LEU 451 Ca 0.03 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 1mei h LEU 451 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1mei h LEU 451 CO -0.00 0.12 -0.44 0.78 0.09 0.00 0.00 178.44 178.99 1mei h ASN 452 N 0.00 0.66 -0.28 -0.43 2.35 -1.14 -0.27 115.58 116.47 1mei h ASN 452 Ca -0.00 -0.31 -0.16 0.00 -0.55 0.00 0.00 56.30 55.28 1mei h ASN 452 Cb 0.68 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 1mei h ASN 452 CO 0.02 1.01 -0.42 0.11 -1.65 0.00 0.00 177.43 176.50 1mei h LYS 453 N 0.49 0.83 -0.22 0.81 1.57 -1.32 -1.24 116.57 117.50 1mei h LYS 453 Ca 0.03 -0.45 -0.01 0.00 -1.87 0.00 0.00 60.65 58.35 1mei h LYS 453 Cb 0.97 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 1mei h LYS 453 CO 0.09 1.09 0.10 0.28 -0.57 0.00 0.00 179.45 180.44 1mei h VAL 454 N 0.68 1.15 -0.81 0.50 2.07 -1.23 -0.95 116.25 117.65 1mei h VAL 454 Ca 0.05 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1mei h VAL 454 Cb 0.99 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 1mei h VAL 454 CO 0.10 0.14 0.53 0.11 0.02 0.00 0.00 177.57 178.47 1mei h LYS 455 N 0.21 1.05 -0.35 1.57 1.57 -0.95 0.25 116.57 119.93 1mei h LYS 455 Ca 0.07 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1mei h LYS 455 Cb 0.13 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1mei h LYS 455 CO -0.01 0.69 0.11 1.03 -0.57 0.00 0.00 179.45 180.70 1mei h SER 456 N 1.08 0.51 -0.72 0.86 0.87 -1.03 -2.06 113.55 113.06 1mei h SER 456 Ca 0.30 -0.21 -0.05 0.00 -1.23 0.00 0.00 61.79 60.61 1mei h SER 456 Cb -0.09 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.70 1mei h SER 456 CO -0.08 0.58 0.25 0.74 -0.53 0.00 0.00 176.83 177.80 1mei h THR 457 N 0.41 1.25 -1.00 2.23 2.02 -0.80 -2.18 112.91 114.85 1mei h THR 457 Ca 0.11 -0.85 0.04 0.00 0.77 0.00 0.00 66.41 66.48 1mei h THR 457 Cb 0.25 0.42 -0.06 0.00 -1.74 0.00 0.00 68.15 67.02 1mei h THR 457 CO -0.00 0.34 0.65 0.24 0.37 0.00 0.00 175.52 177.12 1mei h MET 458 N 1.08 1.21 -0.05 6.66 2.07 -0.66 -0.42 114.93 124.81 1mei h MET 458 Ca 0.24 -0.07 -0.09 0.00 -2.07 0.00 0.00 59.70 57.71 1mei h MET 458 Cb 0.26 -0.27 -0.01 0.00 -1.87 0.00 0.00 31.60 29.71 1mei h MET 458 CO -0.01 0.80 -0.38 0.00 1.07 0.00 0.00 176.91 178.39 1mei h ASN 460 N 0.10 0.00 -0.19 0.00 -0.26 -0.56 -1.68 115.58 112.99 1mei h ASN 460 Ca 0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 1mei h ASN 460 Cb 0.72 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.98 1mei h ASN 460 CO 0.05 0.22 0.00 0.00 -1.06 0.00 0.00 177.43 176.65 1mei n GLY 462 N 1.23 0.18 3.24 0.00 0.00 -0.63 -4.42 105.19 104.78 1mei n GLY 462 Ca 0.17 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 1mei n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mei s ALA 463 N -2.26 2.17 -0.63 4.61 0.00 0.11 -4.93 121.76 120.83 1mei s ALA 463 Ca 0.00 -1.00 0.19 0.00 0.00 0.00 0.00 51.96 51.15 1mei s ALA 463 Cb 0.00 -0.76 -0.24 0.00 0.00 0.00 0.00 23.12 22.12 1mei s ALA 463 CO 0.00 0.33 0.69 1.28 0.00 0.00 0.00 175.76 178.06 1mei n LEU 464 N 3.32 0.62 -4.15 0.00 4.77 -1.26 -3.73 117.00 116.56 1mei n LEU 464 Ca -0.18 -0.34 -0.10 0.00 -0.03 0.00 0.00 56.01 55.35 1mei n LEU 464 Cb 0.53 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.52 1mei n LEU 464 CO 0.27 0.15 -0.29 0.42 -1.33 0.00 0.00 177.39 176.61 1mei s THR 465 N -2.98 0.10 0.12 -5.08 -4.23 -1.26 -0.66 115.64 101.66 1mei s THR 465 Ca 0.03 -1.92 -0.16 0.00 -1.18 0.00 0.00 61.69 58.46 1mei s THR 465 Cb 0.14 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.89 1mei s THR 465 CO 0.79 -0.44 1.64 0.40 -0.54 0.00 0.00 174.62 176.47 1mei h ILE 466 N 2.85 1.22 -0.69 2.99 2.04 -1.84 -1.47 117.51 122.61 1mei h ILE 466 Ca -0.35 -0.72 0.02 0.00 1.00 0.00 0.00 64.86 64.81 1mei h ILE 466 Cb 1.20 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 38.22 1mei h ILE 466 CO 0.59 0.25 0.46 -0.65 0.00 0.00 0.00 178.15 178.79 1mei h PRO 467 N 0.46 0.85 -0.22 2.37 0.11 -1.93 0.04 132.00 133.68 1mei h PRO 467 Ca 0.12 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.07 1mei h PRO 467 Cb 0.27 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.18 1mei h PRO 467 CO -0.00 0.56 -0.34 0.37 -0.21 0.00 0.00 178.00 178.38 1mei h GLN 468 N 0.88 0.47 -0.36 1.05 4.15 -1.90 -1.94 115.11 117.46 1mei h GLN 468 Ca 0.27 -0.21 -0.09 0.00 0.77 0.00 0.00 58.65 59.38 1mei h GLN 468 Cb -0.01 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 1mei h GLN 468 CO -0.07 0.75 -0.14 1.25 -1.93 0.00 0.00 178.83 178.69 1mei h LEU 469 N 0.40 0.74 -1.86 -2.39 5.85 -0.17 0.17 115.31 118.05 1mei h LEU 469 Ca 0.05 -0.39 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 1mei h LEU 469 Cb 0.79 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 1mei h LEU 469 CO 0.06 0.97 -0.13 1.56 -0.34 0.00 0.00 178.44 180.56 1mei h GLN 470 N 0.52 0.00 0.17 1.25 4.20 -0.82 0.48 115.11 120.91 1mei h GLN 470 Ca 0.08 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.44 1mei h GLN 470 Cb 0.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.46 1mei h GLN 470 CO 0.05 0.13 -1.80 1.03 -0.67 0.00 0.00 178.83 177.57 1mei h SER 471 N 0.00 0.56 0.11 1.46 0.87 -1.07 -3.41 113.55 112.07 1mei h SER 471 Ca -0.00 -0.91 0.00 0.00 -1.23 0.00 0.00 61.79 59.65 1mei h SER 471 Cb 0.30 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1mei h SER 471 CO 0.02 1.78 -1.46 0.29 -0.53 0.00 0.00 176.83 176.92 1mei n LYS 472 N -3.56 0.37 -1.68 2.24 5.02 0.02 -5.00 118.16 115.58 1mei n LYS 472 Ca -0.26 -0.09 -0.44 0.00 -2.02 0.00 0.00 58.31 55.50 1mei n LYS 472 Cb 1.07 -1.54 -0.02 0.00 -0.02 0.00 0.00 35.03 34.52 1mei n LYS 472 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1mei n ALA 473 N -1.93 1.12 -3.33 7.82 0.00 0.14 -4.97 120.51 119.37 1mei n ALA 473 Ca -0.00 0.39 -0.37 0.00 0.00 0.00 0.00 53.44 53.46 1mei n ALA 473 Cb 0.47 -2.25 -0.13 0.00 0.00 0.00 0.00 19.45 17.53 1mei n ALA 473 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1mei s LYS 474 N -0.99 2.58 -0.18 0.00 1.02 -1.26 -5.05 119.74 115.86 1mei s LYS 474 Ca 0.63 -1.20 -0.02 0.00 0.02 0.00 0.00 55.97 55.41 1mei s LYS 474 Cb -0.62 -3.39 -0.01 0.00 -0.52 0.00 0.00 37.83 33.29 1mei s LYS 474 CO 0.55 -0.65 -0.10 0.42 -0.92 0.00 0.00 175.35 174.64 1mei s ILE 475 N 1.37 3.04 0.06 2.17 1.01 -1.26 -0.79 121.20 126.80 1mei s ILE 475 Ca -0.03 -0.63 0.07 0.00 0.00 0.00 0.00 60.65 60.07 1mei s ILE 475 Cb -0.20 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 1mei s ILE 475 CO 0.02 0.48 -0.16 0.28 0.00 0.00 0.00 174.94 175.56 1mei s THR 476 N 1.00 2.98 0.42 2.92 -1.32 -0.40 -4.98 115.64 116.26 1mei s THR 476 Ca -0.01 -1.22 -0.16 0.00 -1.21 0.00 0.00 61.69 59.10 1mei s THR 476 Cb -0.15 -2.30 -0.08 0.00 -1.51 0.00 0.00 72.50 68.45 1mei s THR 476 CO -0.01 0.26 0.86 -0.22 -2.21 0.00 0.00 174.62 173.30 1mei s LEU 477 N -1.69 3.86 0.03 9.08 2.96 -1.26 -1.35 118.68 130.30 1mei s LEU 477 Ca 0.17 1.41 0.06 0.00 -0.22 0.00 0.00 54.13 55.54 1mei s LEU 477 Cb -0.11 -4.28 -0.03 0.00 0.50 0.00 0.00 46.19 42.28 1mei s LEU 477 CO 0.08 -0.39 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.87 1mei s VAL 478 N -2.30 2.98 0.67 1.68 1.01 0.14 -4.88 120.40 119.71 1mei s VAL 478 Ca 0.56 -1.07 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1mei s VAL 478 Cb -0.10 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 34.03 1mei s VAL 478 CO 0.24 0.36 1.12 -0.94 0.00 0.00 0.00 175.10 175.88 1mei s SER 479 N -1.39 4.96 0.16 3.32 1.04 -1.26 -4.91 113.70 115.62 1mei s SER 479 Ca 0.15 2.03 -0.17 0.00 0.48 0.00 0.00 55.95 58.44 1mei s SER 479 Cb -0.11 -2.55 0.08 0.00 0.10 0.00 0.00 66.02 63.54 1mei s SER 479 CO 0.05 -1.73 1.68 0.28 0.98 0.00 0.00 173.24 174.51 1mei h SER 480 N -0.07 -0.26 -0.93 7.02 0.02 -2.00 -2.19 113.55 115.14 1mei h SER 480 Ca -0.47 0.10 0.10 0.00 -0.84 0.00 0.00 61.79 60.68 1mei h SER 480 Cb 1.25 0.20 -0.07 0.00 0.14 0.00 0.00 62.40 63.92 1mei h SER 480 CO 0.53 -0.09 0.60 0.58 -1.14 0.00 0.00 176.83 177.31 1mei h VAL 481 N 0.04 0.97 -0.10 2.27 2.07 -2.07 -0.51 116.25 118.92 1mei h VAL 481 Ca 0.18 -0.33 0.03 0.00 0.82 0.00 0.00 66.70 67.40 1mei h VAL 481 Cb 0.26 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 29.97 1mei h VAL 481 CO -0.35 0.17 0.14 0.28 0.02 0.00 0.00 177.57 177.84 1mei h SER 482 N 0.95 0.00 -0.03 0.57 0.02 -1.76 -3.56 113.55 109.74 1mei h SER 482 Ca 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 1mei h SER 482 Cb 0.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1mei h SER 482 CO -0.20 0.00 0.00 -0.38 -1.14 0.00 0.00 176.83 175.11