#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1me9 s LYS 3 N 0.00 3.36 0.36 0.00 2.36 -1.26 -5.12 119.74 119.45 1me9 s LYS 3 Ca 0.00 -0.51 0.09 0.00 -2.55 0.00 0.00 55.97 53.00 1me9 s LYS 3 Cb 0.00 -2.82 -0.06 0.00 -1.05 0.00 0.00 37.83 33.90 1me9 s LYS 3 CO 0.00 0.41 -0.01 0.71 1.55 0.00 0.00 175.35 178.01 1me9 s TYR 4 N -0.09 2.50 0.17 4.03 2.02 -1.26 -5.15 117.35 119.57 1me9 s TYR 4 Ca 0.02 -0.50 0.09 0.00 -0.37 0.00 0.00 57.07 56.31 1me9 s TYR 4 Cb -0.13 -1.53 -0.04 0.00 -0.40 0.00 0.00 41.96 39.86 1me9 s TYR 4 CO 0.03 0.48 -0.13 0.71 -1.57 0.00 0.00 175.55 175.07 1me9 s TYR 5 N -2.58 2.56 0.26 2.71 1.51 -1.26 -5.04 117.35 115.51 1me9 s TYR 5 Ca 0.35 -0.25 0.10 0.00 -1.01 0.00 0.00 57.07 56.26 1me9 s TYR 5 Cb 0.02 -1.27 0.31 0.00 -0.11 0.00 0.00 41.96 40.91 1me9 s TYR 5 CO 0.19 0.49 1.58 -0.91 -1.11 0.00 0.00 175.55 175.79 1me9 h ASN 6 N 3.09 0.00 -4.21 2.29 -0.26 -2.08 -3.45 115.58 110.96 1me9 h ASN 6 Ca -0.47 -0.00 -0.54 0.00 -0.56 0.00 0.00 56.30 54.73 1me9 h ASN 6 Cb 1.20 -0.00 -0.22 0.00 -1.06 0.00 0.00 38.32 38.24 1me9 h ASN 6 CO 0.52 0.65 -0.82 -1.61 -1.06 0.00 0.00 177.43 175.11 1me9 s GLU 7 N -3.54 1.09 0.65 0.81 0.41 -1.26 -5.14 118.70 111.72 1me9 s GLU 7 Ca -0.01 -1.14 -0.11 0.00 -0.41 0.00 0.00 54.97 53.30 1me9 s GLU 7 Cb 0.12 -1.31 -0.02 0.00 -1.78 0.00 0.00 34.13 31.15 1me9 s GLU 7 CO 0.77 0.30 1.04 -1.25 -0.49 0.00 0.00 175.26 175.64 1me9 s PRO 8 N -1.91 3.26 0.52 0.39 0.04 -1.26 -5.03 135.00 131.01 1me9 s PRO 8 Ca 0.06 0.88 -0.14 0.00 0.04 0.00 0.00 61.00 61.83 1me9 s PRO 8 Cb -0.10 -2.03 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1me9 s PRO 8 CO 0.04 -0.84 0.95 0.00 0.04 0.00 0.00 177.00 177.19 1me9 s HIS 10 N -2.70 1.51 0.45 0.00 3.76 -1.26 -4.74 115.29 112.30 1me9 s HIS 10 Ca 0.56 -0.50 0.06 0.00 -0.15 0.00 0.00 55.06 55.03 1me9 s HIS 10 Cb -0.10 -0.80 0.01 0.00 1.11 0.00 0.00 32.58 32.81 1me9 s HIS 10 CO 0.37 0.17 0.62 0.95 -0.85 0.00 0.00 174.74 176.00 1me9 s THR 11 N -1.82 2.97 0.41 1.30 -4.23 -1.26 -2.20 115.64 110.80 1me9 s THR 11 Ca 0.08 -0.91 0.09 0.00 -1.18 0.00 0.00 61.69 59.77 1me9 s THR 11 Cb -0.07 -3.02 0.30 0.00 1.34 0.00 0.00 72.50 71.05 1me9 s THR 11 CO 0.04 -0.01 2.01 -0.26 -0.54 0.00 0.00 174.62 175.86 1me9 h PHE 12 N 0.51 0.53 0.00 3.99 0.04 -1.93 -1.98 116.94 118.10 1me9 h PHE 12 Ca -0.41 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.38 1me9 h PHE 12 Cb 1.28 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 39.26 1me9 h PHE 12 CO 0.39 0.29 0.00 -0.91 -0.60 0.00 0.00 178.31 177.49 1me9 h ASN 13 N 0.54 0.00 -0.34 2.17 2.35 -1.94 -2.22 115.58 116.13 1me9 h ASN 13 Ca 0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 1me9 h ASN 13 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1me9 h ASN 13 CO -0.06 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 175.10 1me9 n GLU 14 N -2.59 1.79 -4.29 0.81 1.02 -0.74 -4.90 120.64 111.74 1me9 n GLU 14 Ca -0.01 -1.24 -0.19 0.00 -0.02 0.00 0.00 57.16 55.70 1me9 n GLU 14 Cb 0.10 -1.27 -0.11 0.00 -0.02 0.00 0.00 31.44 30.14 1me9 n GLU 14 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1me9 s TYR 15 N -1.54 1.57 0.03 -0.32 2.02 -0.84 -0.85 117.35 117.42 1me9 s TYR 15 Ca 0.23 -0.55 -0.05 0.00 -0.37 0.00 0.00 57.07 56.34 1me9 s TYR 15 Cb 0.12 -0.79 -0.01 0.00 -0.40 0.00 0.00 41.96 40.88 1me9 s TYR 15 CO 0.16 0.23 0.08 -0.51 -1.57 0.00 0.00 175.55 173.94 1me9 s LEU 16 N -2.73 1.87 -0.15 -1.29 1.43 -0.31 -4.94 118.68 112.57 1me9 s LEU 16 Ca 0.14 -0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 52.61 1me9 s LEU 16 Cb -0.04 0.52 -0.05 0.00 0.03 0.00 0.00 46.19 46.66 1me9 s LEU 16 CO 0.05 -0.47 0.22 -0.76 0.23 0.00 0.00 176.35 175.61 1me9 s LEU 17 N -2.00 4.29 -0.23 1.79 1.43 -1.26 -1.50 118.68 121.21 1me9 s LEU 17 Ca -0.07 0.46 -0.14 0.00 -1.03 0.00 0.00 54.13 53.35 1me9 s LEU 17 Cb -0.03 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.92 1me9 s LEU 17 CO -0.04 0.22 0.30 -0.63 0.23 0.00 0.00 176.35 176.44 1me9 s ILE 18 N -0.09 5.26 0.58 -0.59 1.01 -0.22 -4.99 121.20 122.16 1me9 s ILE 18 Ca 0.14 0.48 -0.19 0.00 0.00 0.00 0.00 60.65 61.08 1me9 s ILE 18 Cb -0.12 -3.63 -0.05 0.00 0.01 0.00 0.00 42.46 38.66 1me9 s ILE 18 CO 0.03 0.27 0.94 -2.65 0.00 0.00 0.00 174.94 173.53 1me9 n PRO 19 N 4.56 0.92 -1.14 2.79 -0.02 -1.26 -4.29 135.00 136.55 1me9 n PRO 19 Ca -0.11 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1me9 n PRO 19 Cb 0.51 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1me9 n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1me9 n GLY 20 N 1.31 5.20 3.67 -1.23 0.00 -0.39 -4.96 105.19 108.79 1me9 n GLY 20 Ca 0.13 -2.13 -0.43 0.00 0.00 0.00 0.00 46.02 43.59 1me9 n GLY 20 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1me9 s LEU 21 N 0.00 4.22 -0.27 0.99 2.96 -1.26 -4.57 118.68 120.76 1me9 s LEU 21 Ca 0.00 1.78 -0.13 0.00 -0.22 0.00 0.00 54.13 55.56 1me9 s LEU 21 Cb 0.00 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 1me9 s LEU 21 CO 0.00 -0.72 0.27 -0.44 -1.32 0.00 0.00 176.35 174.14 1me9 s SER 22 N 1.91 6.15 0.41 3.68 0.01 -1.26 -3.76 113.70 120.84 1me9 s SER 22 Ca 0.56 0.16 -0.02 0.00 1.31 0.00 0.00 55.95 57.96 1me9 s SER 22 Cb -0.24 -2.16 -0.03 0.00 0.21 0.00 0.00 66.02 63.80 1me9 s SER 22 CO 0.18 -0.09 0.65 0.42 0.41 0.00 0.00 173.24 174.81 1me9 s THR 23 N 1.75 4.88 0.55 1.44 -4.23 -1.26 -4.99 115.64 113.78 1me9 s THR 23 Ca 0.11 -0.24 0.24 0.00 -1.18 0.00 0.00 61.69 60.62 1me9 s THR 23 Cb -0.15 -3.81 0.35 0.00 1.34 0.00 0.00 72.50 70.22 1me9 s THR 23 CO 0.10 -0.63 2.08 -0.37 -0.54 0.00 0.00 174.62 175.26 1me9 h VAL 24 N 0.52 0.71 -0.00 2.29 -1.51 -2.01 -1.90 116.25 114.35 1me9 h VAL 24 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1me9 h VAL 24 Cb 1.22 0.85 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 1me9 h VAL 24 CO 0.61 0.00 -0.02 -0.90 -1.23 0.00 0.00 177.57 176.02 1me9 n ASP 25 N -4.22 0.03 -4.43 4.19 3.85 -1.26 -4.69 116.55 110.01 1me9 n ASP 25 Ca 0.03 0.39 -0.43 0.00 -0.71 0.00 0.00 54.79 54.07 1me9 n ASP 25 Cb 0.36 -0.44 -0.04 0.00 -1.35 0.00 0.00 41.12 39.65 1me9 n ASP 25 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1me9 s ILE 27 N 3.65 1.19 0.29 0.00 -4.36 -1.26 -4.89 121.20 115.81 1me9 s ILE 27 Ca 0.21 -1.21 -0.05 0.00 -0.26 0.00 0.00 60.65 59.34 1me9 s ILE 27 Cb -0.18 -1.11 0.44 0.00 1.25 0.00 0.00 42.46 42.87 1me9 s ILE 27 CO 0.08 -0.11 1.55 -2.65 0.24 0.00 0.00 174.94 174.05 1me9 n PRO 28 N 1.51 -0.09 0.27 0.37 -0.02 -1.26 -0.61 135.00 135.18 1me9 n PRO 28 Ca -0.20 1.53 0.19 0.00 -2.02 0.00 0.00 63.50 63.00 1me9 n PRO 28 Cb 0.54 -2.33 0.96 0.00 -0.02 0.00 0.00 33.50 32.65 1me9 n PRO 28 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1me9 h SER 29 N 0.00 0.00 -0.01 2.55 4.64 -1.97 -1.46 113.55 117.30 1me9 h SER 29 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1me9 h SER 29 Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1me9 h SER 29 CO -0.99 0.00 -0.19 0.59 -0.87 0.00 0.00 176.83 175.36 1me9 n ASN 30 N -2.81 2.49 -4.72 4.97 3.02 0.22 -4.93 115.26 113.51 1me9 n ASN 30 Ca -0.02 -1.75 -0.42 0.00 -0.03 0.00 0.00 54.58 52.36 1me9 n ASN 30 Cb 0.09 0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.42 1me9 n ASN 30 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1me9 s VAL 31 N -2.20 4.25 -0.30 2.41 1.01 -0.55 -4.96 120.40 120.07 1me9 s VAL 31 Ca 0.25 1.65 -0.11 0.00 0.00 0.00 0.00 61.98 63.77 1me9 s VAL 31 Cb 0.19 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1me9 s VAL 31 CO 0.41 0.15 0.19 0.21 0.00 0.00 0.00 175.10 176.06 1me9 s ASN 32 N 0.89 5.88 -0.16 3.32 3.84 0.35 -4.97 114.94 124.10 1me9 s ASN 32 Ca 0.56 -0.20 0.16 0.00 0.21 0.00 0.00 52.86 53.59 1me9 s ASN 32 Cb -0.27 -2.09 0.73 0.00 -0.55 0.00 0.00 41.25 39.07 1me9 s ASN 32 CO 0.30 -0.11 1.65 0.18 -2.79 0.00 0.00 177.10 176.32 1me9 n LEU 33 N 5.05 5.01 -4.74 3.21 4.77 -1.26 -3.80 117.00 125.24 1me9 n LEU 33 Ca -0.14 -2.67 -0.37 0.00 -0.03 0.00 0.00 56.01 52.81 1me9 n LEU 33 Cb 0.51 -0.61 0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1me9 n LEU 33 CO 0.34 0.73 0.89 -0.55 -1.33 0.00 0.00 177.39 177.47 1me9 s SER 34 N -0.97 4.99 -0.12 -1.43 0.15 -1.20 -3.54 113.70 111.59 1me9 s SER 34 Ca 0.51 2.53 -0.29 0.00 0.70 0.00 0.00 55.95 59.40 1me9 s SER 34 Cb 0.36 -2.61 0.07 0.00 -1.71 0.00 0.00 66.02 62.13 1me9 s SER 34 CO 0.20 -1.74 0.70 0.28 1.20 0.00 0.00 173.24 173.88 1me9 s THR 35 N -1.47 0.00 0.28 6.45 -1.32 -0.68 -4.70 115.64 114.20 1me9 s THR 35 Ca 0.78 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.97 1me9 s THR 35 Cb -0.35 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.55 1me9 s THR 35 CO 0.38 0.00 1.12 -2.16 -2.21 0.00 0.00 174.62 171.75 1me9 s PRO 36 N -0.74 4.61 -0.23 7.08 0.04 -1.26 -0.12 135.00 144.38 1me9 s PRO 36 Ca -0.08 1.84 0.08 0.00 0.04 0.00 0.00 61.00 62.88 1me9 s PRO 36 Cb -0.01 -3.18 -0.19 0.00 0.04 0.00 0.00 34.50 31.15 1me9 s PRO 36 CO 0.07 0.16 -0.11 -0.11 0.04 0.00 0.00 177.00 177.05 1me9 n LEU 37 N 1.26 1.82 -4.31 -3.56 7.94 -0.28 -4.80 117.00 115.08 1me9 n LEU 37 Ca -0.01 -0.08 -0.20 0.00 -1.11 0.00 0.00 56.01 54.61 1me9 n LEU 37 Cb 0.45 -0.34 -0.11 0.00 0.53 0.00 0.00 43.42 43.94 1me9 n LEU 37 CO 0.55 0.75 -0.47 0.68 -1.11 0.00 0.00 177.39 177.78 1me9 s VAL 38 N -2.48 1.66 0.68 1.96 -7.23 -1.26 -4.53 120.40 109.21 1me9 s VAL 38 Ca -0.24 -1.90 -0.17 0.00 -1.81 0.00 0.00 61.98 57.86 1me9 s VAL 38 Cb 0.07 -1.78 0.01 0.00 0.56 0.00 0.00 36.38 35.24 1me9 s VAL 38 CO 0.66 -0.39 1.26 -1.59 -0.31 0.00 0.00 175.10 174.73 1me9 s LYS 39 N -2.89 2.36 0.25 4.82 -2.85 0.42 -4.62 119.74 117.24 1me9 s LYS 39 Ca 0.15 1.96 -0.12 0.00 -1.00 0.00 0.00 55.97 56.95 1me9 s LYS 39 Cb -0.05 -1.84 -0.00 0.00 -2.06 0.00 0.00 37.83 33.88 1me9 s LYS 39 CO 0.06 -1.72 0.48 -0.59 0.10 0.00 0.00 175.35 173.68 1me9 s PHE 40 N -1.62 0.40 0.39 1.78 -0.71 -1.06 -4.77 117.98 112.40 1me9 s PHE 40 Ca 0.80 -0.76 -0.00 0.00 -1.04 0.00 0.00 56.93 55.92 1me9 s PHE 40 Cb -0.34 0.18 -0.03 0.00 -1.21 0.00 0.00 43.02 41.62 1me9 s PHE 40 CO 0.42 -1.00 0.62 -0.65 -1.34 0.00 0.00 175.22 173.26 1me9 s GLN 41 N -3.95 3.39 0.24 1.99 -1.52 -1.26 -0.95 119.66 117.59 1me9 s GLN 41 Ca 0.23 -0.29 -0.31 0.00 -1.95 0.00 0.00 55.36 53.04 1me9 s GLN 41 Cb -0.01 -2.59 -0.14 0.00 -0.22 0.00 0.00 33.01 30.05 1me9 s GLN 41 CO 0.10 -0.01 1.32 1.17 -0.25 0.00 0.00 175.29 177.61 1me9 n LYS 42 N -1.93 1.80 0.00 2.91 4.81 0.90 -1.34 118.16 125.30 1me9 n LYS 42 Ca -0.02 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 1me9 n LYS 42 Cb 0.56 -2.23 0.00 0.00 0.02 0.00 0.00 35.03 33.38 1me9 n LYS 42 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1me9 n GLY 43 N 1.95 2.56 4.03 3.14 0.00 -1.26 -5.03 105.19 110.58 1me9 n GLY 43 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 1me9 n GLY 43 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1me9 s GLN 44 N -0.51 2.04 0.16 1.61 -0.21 -0.45 -5.13 119.66 117.17 1me9 s GLN 44 Ca 0.00 -1.55 0.10 0.00 0.02 0.00 0.00 55.36 53.93 1me9 s GLN 44 Cb 0.00 -2.54 -0.04 0.00 1.00 0.00 0.00 33.01 31.43 1me9 s GLN 44 CO 0.00 -1.11 -0.22 -0.65 -2.12 0.00 0.00 175.29 171.19 1me9 s GLN 45 N -4.85 1.35 0.37 2.91 -1.52 -1.26 -4.88 119.66 111.79 1me9 s GLN 45 Ca 0.64 -1.40 -0.26 0.00 -1.95 0.00 0.00 55.36 52.39 1me9 s GLN 45 Cb -0.05 -1.60 -0.09 0.00 -0.22 0.00 0.00 33.01 31.05 1me9 s GLN 45 CO 0.41 0.35 1.17 0.45 -0.25 0.00 0.00 175.29 177.43 1me9 s SER 46 N -2.46 6.67 0.57 5.90 0.15 -1.26 -4.89 113.70 118.38 1me9 s SER 46 Ca 0.16 2.37 0.33 0.00 0.70 0.00 0.00 55.95 59.50 1me9 s SER 46 Cb -0.08 -2.62 1.70 0.00 -1.71 0.00 0.00 66.02 63.31 1me9 s SER 46 CO 0.07 -0.57 2.14 -0.33 1.20 0.00 0.00 173.24 175.75 1me9 h GLU 47 N 2.90 0.00 -3.97 5.44 5.08 -1.86 -3.39 114.58 118.78 1me9 h GLU 47 Ca -0.48 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.39 1me9 h GLU 47 Cb 1.23 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 30.10 1me9 h GLU 47 CO 0.63 0.06 -0.79 0.42 -1.00 0.00 0.00 179.01 178.34 1me9 s ILE 48 N -4.13 0.71 -0.12 3.13 1.01 -1.26 -5.09 121.20 115.45 1me9 s ILE 48 Ca -0.03 -0.10 0.02 0.00 0.00 0.00 0.00 60.65 60.55 1me9 s ILE 48 Cb 0.12 -0.80 0.01 0.00 0.01 0.00 0.00 42.46 41.80 1me9 s ILE 48 CO 0.53 0.31 -0.19 0.20 0.00 0.00 0.00 174.94 175.80 1me9 s ASN 49 N 1.84 2.75 0.54 3.58 0.01 -1.26 -1.13 114.94 121.27 1me9 s ASN 49 Ca 0.05 -0.51 -0.17 0.00 -0.71 0.00 0.00 52.86 51.52 1me9 s ASN 49 Cb -0.12 -1.25 -0.06 0.00 0.41 0.00 0.00 41.25 40.22 1me9 s ASN 49 CO -0.07 0.05 1.04 -0.76 -1.51 0.00 0.00 177.10 175.85 1me9 s LEU 50 N 0.86 3.63 0.07 0.60 1.43 0.83 -4.83 118.68 121.27 1me9 s LEU 50 Ca -0.08 1.81 0.11 0.00 -1.03 0.00 0.00 54.13 54.94 1me9 s LEU 50 Cb -0.15 -4.54 -0.19 0.00 0.03 0.00 0.00 46.19 41.34 1me9 s LEU 50 CO -0.01 -0.94 1.02 0.11 0.23 0.00 0.00 176.35 176.76 1me9 h LYS 51 N 0.89 0.00 -4.78 1.70 6.56 -1.19 -1.80 116.57 117.94 1me9 h LYS 51 Ca -0.48 0.00 -0.37 0.00 -1.06 0.00 0.00 60.65 58.74 1me9 h LYS 51 Cb 1.21 0.00 -0.26 0.00 -0.57 0.00 0.00 32.23 32.62 1me9 h LYS 51 CO 0.59 0.71 -0.77 0.96 -2.06 0.00 0.00 179.45 178.87 1me9 s ILE 52 N -2.71 0.73 0.00 1.86 -4.36 -1.12 -3.27 121.20 112.34 1me9 s ILE 52 Ca -0.01 -0.69 0.00 0.00 -0.26 0.00 0.00 60.65 59.69 1me9 s ILE 52 Cb 0.09 -0.67 0.00 0.00 1.25 0.00 0.00 42.46 43.13 1me9 s ILE 52 CO 0.81 -0.00 1.26 -0.81 0.24 0.00 0.00 174.94 176.45 1me9 n PRO 53 N 2.29 0.83 -5.23 0.37 -0.04 -1.23 -4.40 135.00 127.58 1me9 n PRO 53 Ca -0.17 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.98 1me9 n PRO 53 Cb 0.56 -1.09 -0.16 0.00 -0.04 0.00 0.00 33.50 32.77 1me9 n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1me9 s LEU 54 N 0.00 2.14 0.00 1.53 1.43 -1.26 -0.62 118.68 121.89 1me9 s LEU 54 Ca 0.00 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 1me9 s LEU 54 Cb 0.00 -1.39 -0.01 0.00 0.03 0.00 0.00 46.19 44.82 1me9 s LEU 54 CO 0.00 0.27 -0.08 0.68 0.23 0.00 0.00 176.35 177.45 1me9 s VAL 55 N -0.29 0.62 0.25 -1.59 -7.23 0.03 -3.08 120.40 109.11 1me9 s VAL 55 Ca 0.00 -0.46 -0.21 0.00 -1.81 0.00 0.00 61.98 59.50 1me9 s VAL 55 Cb -0.13 -0.55 -0.09 0.00 0.56 0.00 0.00 36.38 36.18 1me9 s VAL 55 CO 0.02 0.09 0.78 -0.94 -0.31 0.00 0.00 175.10 174.74 1me9 s SER 56 N -0.41 7.13 0.72 4.85 1.04 -1.00 -1.34 113.70 124.69 1me9 s SER 56 Ca 0.01 1.52 -0.16 0.00 0.48 0.00 0.00 55.95 57.81 1me9 s SER 56 Cb -0.04 -2.46 0.03 0.00 0.10 0.00 0.00 66.02 63.65 1me9 s SER 56 CO -0.00 0.01 1.24 0.00 0.98 0.00 0.00 173.24 175.47 1me9 s ALA 57 N -1.54 2.13 -1.43 5.32 0.00 -0.06 -3.44 121.76 122.74 1me9 s ALA 57 Ca 0.45 1.00 -0.13 0.00 0.00 0.00 0.00 51.96 53.27 1me9 s ALA 57 Cb -0.17 -3.51 0.06 0.00 0.00 0.00 0.00 23.12 19.50 1me9 s ALA 57 CO 0.22 -1.89 2.17 -0.89 0.00 0.00 0.00 175.76 175.36 1me9 n ILE 58 N -2.57 3.60 -4.27 0.00 5.41 -1.26 -3.87 119.36 116.40 1me9 n ILE 58 Ca 0.14 -3.24 -0.17 0.00 1.00 0.00 0.00 62.75 60.48 1me9 n ILE 58 Cb 0.49 -2.57 -0.14 0.00 -0.71 0.00 0.00 39.64 36.71 1me9 n ILE 58 CO 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 176.55 176.51 1me9 s MET 59 N 2.77 0.61 0.40 0.38 -1.94 -1.26 -4.77 119.30 115.49 1me9 s MET 59 Ca 0.46 -0.33 0.10 0.00 -1.71 0.00 0.00 55.69 54.21 1me9 s MET 59 Cb 0.13 -0.58 0.89 0.00 2.01 0.00 0.00 34.83 37.29 1me9 s MET 59 CO -0.07 0.16 1.97 1.96 -0.01 0.00 0.00 175.02 179.03 1me9 h GLN 60 N 5.80 0.55 -0.50 2.03 4.20 -1.90 -1.01 115.11 124.29 1me9 h GLN 60 Ca -0.30 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.37 1me9 h GLN 60 Cb 1.19 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.84 1me9 h GLN 60 CO 0.49 0.37 0.00 -1.13 -0.67 0.00 0.00 178.83 177.88 1me9 n SER 61 N -4.48 2.28 0.13 1.46 3.41 -1.26 -4.57 113.62 110.58 1me9 n SER 61 Ca 0.10 -2.15 0.00 0.00 -0.26 0.00 0.00 58.87 56.56 1me9 n SER 61 Cb 0.29 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1me9 n SER 61 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1me9 n VAL 62 N 0.42 0.24 -3.22 -3.33 0.31 -0.46 -4.57 118.33 107.71 1me9 n VAL 62 Ca 0.12 0.08 -0.45 0.00 -0.01 0.00 0.00 64.34 64.08 1me9 n VAL 62 Cb 0.42 -0.71 -0.01 0.00 -0.91 0.00 0.00 33.84 32.64 1me9 n VAL 62 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1me9 s SER 63 N -5.19 7.14 0.09 4.52 0.01 -0.74 -4.34 113.70 115.18 1me9 s SER 63 Ca 0.00 -3.22 0.01 0.00 1.31 0.00 0.00 55.95 54.05 1me9 s SER 63 Cb 0.00 -2.27 0.01 0.00 0.21 0.00 0.00 66.02 63.98 1me9 s SER 63 CO 0.00 -0.49 0.09 0.61 0.41 0.00 0.00 173.24 173.87 1me9 n GLY 64 N 3.40 2.42 0.28 3.44 0.00 -1.26 -3.27 105.19 110.19 1me9 n GLY 64 Ca 0.25 -2.16 -0.05 0.00 0.00 0.00 0.00 46.02 44.06 1me9 n GLY 64 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1me9 h GLU 65 N 0.00 0.92 -0.53 1.61 9.09 -1.93 -2.10 114.58 121.64 1me9 h GLU 65 Ca -0.05 -0.06 -0.05 0.00 0.05 0.00 0.00 59.36 59.26 1me9 h GLU 65 Cb 0.19 -0.21 -0.02 0.00 -1.65 0.00 0.00 28.75 27.06 1me9 h GLU 65 CO 0.07 0.61 0.13 0.87 0.05 0.00 0.00 179.01 180.74 1me9 h LYS 66 N 0.94 0.85 0.03 1.06 1.79 -1.96 -2.27 116.57 117.01 1me9 h LYS 66 Ca 0.26 -0.21 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1me9 h LYS 66 Cb -0.10 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.43 1me9 h LYS 66 CO -0.06 0.81 -0.03 1.98 -1.08 0.00 0.00 179.45 181.07 1me9 h MET 67 N 0.75 -0.06 -0.99 3.15 4.05 -1.45 -1.02 114.93 119.36 1me9 h MET 67 Ca 0.17 0.00 0.13 0.00 -0.28 0.00 0.00 59.70 59.72 1me9 h MET 67 Cb 0.34 0.01 -0.08 0.00 -0.80 0.00 0.00 31.60 31.07 1me9 h MET 67 CO 0.00 -0.04 0.62 0.00 0.23 0.00 0.00 176.91 177.73 1me9 h ALA 68 N 0.91 1.57 -0.03 0.39 0.00 -1.23 0.87 119.26 121.74 1me9 h ALA 68 Ca 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1me9 h ALA 68 Cb 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1me9 h ALA 68 CO -0.01 0.17 -0.10 0.82 0.00 0.00 0.00 179.25 180.13 1me9 h ILE 69 N 0.94 1.47 -0.99 0.00 2.04 -1.12 -1.89 117.51 117.97 1me9 h ILE 69 Ca 0.50 -1.53 0.01 0.00 1.00 0.00 0.00 64.86 64.84 1me9 h ILE 69 Cb 0.55 2.41 -0.05 0.00 -0.74 0.00 0.00 36.82 38.99 1me9 h ILE 69 CO -0.27 0.41 0.65 0.00 0.00 0.00 0.00 178.15 178.95 1me9 h ALA 70 N 0.40 1.25 -0.09 1.87 0.00 -0.72 -1.58 119.26 120.40 1me9 h ALA 70 Ca -0.00 -0.07 -0.23 0.00 0.00 0.00 0.00 54.91 54.60 1me9 h ALA 70 Cb 0.73 -0.40 0.01 0.00 0.00 0.00 0.00 17.79 18.13 1me9 h ALA 70 CO 0.02 0.64 -0.86 1.25 0.00 0.00 0.00 179.25 180.30 1me9 h LEU 71 N 1.33 0.91 -1.48 0.00 5.85 -0.90 -3.14 115.31 117.89 1me9 h LEU 71 Ca 0.36 -0.68 -0.04 0.00 0.84 0.00 0.00 57.88 58.37 1me9 h LEU 71 Cb -0.15 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.60 1me9 h LEU 71 CO -0.08 1.45 -0.04 0.00 -0.34 0.00 0.00 178.44 179.43 1me9 h ALA 72 N 0.48 1.58 -0.01 1.25 0.00 -1.17 -1.38 119.26 120.00 1me9 h ALA 72 Ca -0.08 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1me9 h ALA 72 Cb 1.50 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1me9 h ALA 72 CO 0.17 0.31 -0.20 0.00 0.00 0.00 0.00 179.25 179.53 1me9 h ARG 73 N 0.28 0.02 -0.01 0.00 3.08 -1.24 0.34 114.38 116.86 1me9 h ARG 73 Ca 0.06 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1me9 h ARG 73 Cb 0.26 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1me9 h ARG 73 CO 0.01 0.22 -0.31 0.39 -1.07 0.00 0.00 179.97 179.21 1me9 n GLU 74 N -4.29 0.90 0.00 0.04 -0.58 -0.69 -3.02 120.64 113.00 1me9 n GLU 74 Ca -0.02 -0.59 0.00 0.00 -0.42 0.00 0.00 57.16 56.13 1me9 n GLU 74 Cb 0.27 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 1me9 n GLU 74 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1me9 n GLY 75 N 1.36 0.84 0.00 0.62 0.00 -0.57 -4.61 105.19 102.84 1me9 n GLY 75 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1me9 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1me9 n GLY 76 N -0.86 1.58 3.07 -0.02 0.00 -0.61 -0.69 105.19 107.67 1me9 n GLY 76 Ca 0.00 -2.07 -0.11 0.00 0.00 0.00 0.00 46.02 43.84 1me9 n GLY 76 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1me9 s ILE 77 N 0.87 0.08 0.10 -0.61 2.07 -1.18 -3.42 121.20 119.12 1me9 s ILE 77 Ca 0.00 -0.65 0.05 0.00 -1.41 0.00 0.00 60.65 58.64 1me9 s ILE 77 Cb 0.00 -0.37 -0.04 0.00 0.13 0.00 0.00 42.46 42.18 1me9 s ILE 77 CO 0.00 -0.36 -0.00 -0.44 -1.91 0.00 0.00 174.94 172.23 1me9 s SER 78 N -1.23 4.96 -0.58 4.50 0.01 -1.26 -2.38 113.70 117.71 1me9 s SER 78 Ca -0.13 -0.22 -0.03 0.00 1.31 0.00 0.00 55.95 56.88 1me9 s SER 78 Cb -0.07 -1.15 0.15 0.00 0.21 0.00 0.00 66.02 65.16 1me9 s SER 78 CO 0.01 0.16 0.39 -0.36 0.41 0.00 0.00 173.24 173.85 1me9 s PHE 79 N -1.37 3.43 -0.12 2.43 0.40 -1.22 0.29 117.98 121.83 1me9 s PHE 79 Ca 0.26 -2.67 -0.40 0.00 -0.60 0.00 0.00 56.93 53.52 1me9 s PHE 79 Cb -0.11 -3.20 -0.18 0.00 0.51 0.00 0.00 43.02 40.05 1me9 s PHE 79 CO 0.18 -0.86 1.43 -0.89 0.70 0.00 0.00 175.22 175.78 1me9 n ILE 80 N 3.67 0.09 -1.72 0.64 2.08 0.17 -4.17 119.36 120.13 1me9 n ILE 80 Ca 0.06 -0.02 -0.41 0.00 0.56 0.00 0.00 62.75 62.94 1me9 n ILE 80 Cb 0.38 -0.72 0.01 0.00 -0.75 0.00 0.00 39.64 38.57 1me9 n ILE 80 CO 0.00 0.00 0.00 2.22 0.56 0.00 0.00 176.55 179.33 1me9 n PHE 81 N 3.31 2.31 1.10 1.39 -1.74 -1.20 -1.35 117.46 121.28 1me9 n PHE 81 Ca 0.23 0.49 0.12 0.00 -0.56 0.00 0.00 57.45 57.73 1me9 n PHE 81 Cb 0.12 -2.41 0.18 0.00 1.52 0.00 0.00 39.48 38.89 1me9 n PHE 81 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1me9 n GLY 82 N 0.74 0.76 2.38 4.97 0.00 -1.26 -4.60 105.19 108.18 1me9 n GLY 82 Ca 0.06 -0.64 -0.39 0.00 0.00 0.00 0.00 46.02 45.04 1me9 n GLY 82 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1me9 n SER 83 N 1.05 8.40 -3.42 1.61 3.41 -1.26 -4.76 113.62 118.65 1me9 n SER 83 Ca 0.15 -2.77 -0.06 0.00 -0.26 0.00 0.00 58.87 55.93 1me9 n SER 83 Cb 0.55 -1.50 0.01 0.00 -0.26 0.00 0.00 64.21 63.01 1me9 n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1me9 s GLN 84 N 1.07 1.66 0.62 4.33 -2.07 -1.26 -4.98 119.66 119.03 1me9 s GLN 84 Ca 0.64 -1.01 -0.18 0.00 -1.82 0.00 0.00 55.36 52.99 1me9 s GLN 84 Cb 0.18 0.50 -0.02 0.00 -1.09 0.00 0.00 33.01 32.58 1me9 s GLN 84 CO -0.07 -0.77 1.25 -1.54 -1.32 0.00 0.00 175.29 172.84 1me9 s SER 85 N -3.10 4.87 0.26 12.60 1.04 -1.26 -4.79 113.70 123.31 1me9 s SER 85 Ca 0.16 2.50 -0.03 0.00 0.48 0.00 0.00 55.95 59.05 1me9 s SER 85 Cb -0.04 -2.61 0.40 0.00 0.10 0.00 0.00 66.02 63.87 1me9 s SER 85 CO 0.07 -1.82 1.86 0.40 0.98 0.00 0.00 173.24 174.73 1me9 h ILE 86 N 0.67 1.04 -0.57 -1.02 2.04 -1.99 -0.30 117.51 117.37 1me9 h ILE 86 Ca -0.51 -0.36 -0.09 0.00 1.00 0.00 0.00 64.86 64.91 1me9 h ILE 86 Cb 1.32 -0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 1me9 h ILE 86 CO 0.54 0.19 0.02 -0.33 0.00 0.00 0.00 178.15 178.57 1me9 h GLU 87 N 1.05 1.00 -0.38 2.37 3.07 -1.99 -1.66 114.58 118.04 1me9 h GLU 87 Ca 0.42 -0.31 -0.07 0.00 -0.50 0.00 0.00 59.36 58.90 1me9 h GLU 87 Cb 0.22 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 1me9 h GLU 87 CO -0.19 0.99 -0.02 1.03 -1.40 0.00 0.00 179.01 179.42 1me9 h SER 88 N 0.89 0.68 -0.25 1.42 0.87 -1.67 -1.90 113.55 113.59 1me9 h SER 88 Ca 0.17 -0.32 -0.05 0.00 -1.23 0.00 0.00 61.79 60.35 1me9 h SER 88 Cb 0.52 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1me9 h SER 88 CO 0.03 0.84 -0.06 -0.61 -0.53 0.00 0.00 176.83 176.49 1me9 h GLN 89 N 0.50 0.48 -0.51 2.24 4.15 -1.05 -2.92 115.11 117.99 1me9 h GLN 89 Ca 0.11 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.35 1me9 h GLN 89 Cb 0.50 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.14 1me9 h GLN 89 CO 0.02 0.70 0.33 0.00 -1.93 0.00 0.00 178.83 177.95 1me9 h ALA 90 N 0.76 1.61 -0.64 3.38 0.00 -1.28 -1.74 119.26 121.35 1me9 h ALA 90 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1me9 h ALA 90 Cb 0.52 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1me9 h ALA 90 CO 0.02 0.35 0.28 0.00 0.00 0.00 0.00 179.25 179.90 1me9 h ALA 91 N 1.66 0.82 -0.76 0.00 0.00 -1.19 -0.16 119.26 119.64 1me9 h ALA 91 Ca 0.19 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1me9 h ALA 91 Cb -0.06 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1me9 h ALA 91 CO -0.04 0.42 0.29 0.52 0.00 0.00 0.00 179.25 180.44 1me9 h MET 92 N 0.89 1.14 -0.27 0.00 2.07 -1.16 0.22 114.93 117.81 1me9 h MET 92 Ca 0.21 -0.21 -0.02 0.00 -2.07 0.00 0.00 59.70 57.61 1me9 h MET 92 Cb 0.17 -0.18 -0.01 0.00 -1.87 0.00 0.00 31.60 29.71 1me9 h MET 92 CO -0.02 0.93 0.08 0.28 1.07 0.00 0.00 176.91 179.25 1me9 h VAL 93 N 1.11 1.20 -0.39 -2.22 2.07 -0.98 -1.98 116.25 115.05 1me9 h VAL 93 Ca 0.25 -0.64 0.03 0.00 0.82 0.00 0.00 66.70 67.15 1me9 h VAL 93 Cb 0.23 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 1me9 h VAL 93 CO -0.02 0.21 0.20 -0.74 0.02 0.00 0.00 177.57 177.25 1me9 h HIS 94 N 0.27 0.38 -0.64 1.57 6.17 -0.69 -1.12 115.15 121.09 1me9 h HIS 94 Ca 0.09 0.02 0.05 0.00 0.71 0.00 0.00 60.37 61.23 1me9 h HIS 94 Cb 0.25 -0.11 -0.05 0.00 2.52 0.00 0.00 27.41 30.01 1me9 h HIS 94 CO 0.01 0.21 0.37 0.00 0.71 0.00 0.00 177.93 179.22 1me9 h ALA 95 N 1.19 0.85 -0.33 5.26 0.00 -0.78 -0.60 119.26 124.85 1me9 h ALA 95 Ca 0.16 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1me9 h ALA 95 Cb 0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1me9 h ALA 95 CO -0.10 0.06 -0.00 0.28 0.00 0.00 0.00 179.25 179.49 1me9 h VAL 96 N 0.69 1.26 0.00 0.00 2.07 -0.98 -2.37 116.25 116.92 1me9 h VAL 96 Ca 0.28 -0.96 -0.05 0.00 0.82 0.00 0.00 66.70 66.79 1me9 h VAL 96 Cb 0.13 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1me9 h VAL 96 CO -0.16 0.32 -0.23 0.11 0.02 0.00 0.00 177.57 177.63 1me9 h LYS 97 N 0.40 0.00 -0.56 1.57 1.79 -0.82 -3.12 116.57 115.82 1me9 h LYS 97 Ca 0.09 0.00 -0.40 0.00 -2.18 0.00 0.00 60.65 58.17 1me9 h LYS 97 Cb 0.45 0.00 -0.29 0.00 -1.58 0.00 0.00 32.23 30.81 1me9 h LYS 97 CO 0.02 0.23 -0.53 0.09 -1.08 0.00 0.00 179.45 178.18 1me9 n ASN 98 N -4.03 4.16 0.10 0.86 3.02 -0.27 -4.67 115.26 114.43 1me9 n ASN 98 Ca -0.02 -3.79 -0.06 0.00 -0.03 0.00 0.00 54.58 50.68 1me9 n ASN 98 Cb 0.30 -0.47 0.04 0.00 -0.61 0.00 0.00 39.78 39.04 1me9 n ASN 98 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1me9 h PHE 99 N 1.77 0.15 -0.18 3.10 3.57 -1.36 -3.19 116.94 120.79 1me9 h PHE 99 Ca 0.29 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.71 1me9 h PHE 99 Cb 1.38 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.10 1me9 h PHE 99 CO 0.90 0.85 0.00 1.63 -2.23 0.00 0.00 178.31 179.47 1me9 n LYS 100 N -3.66 1.56 -0.08 1.11 5.02 -1.26 -5.12 118.16 115.72 1me9 n LYS 100 Ca -0.02 -0.85 0.00 0.00 -2.02 0.00 0.00 58.31 55.42 1me9 n LYS 100 Cb 0.76 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.47 1me9 n LYS 100 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1me9 n ALA 101 N 0.12 2.19 0.12 7.82 0.00 -1.21 -5.19 120.51 124.36 1me9 n ALA 101 Ca 0.12 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.33 1me9 n ALA 101 Cb 0.24 -1.18 -0.15 0.00 0.00 0.00 0.00 19.45 18.35 1me9 n ALA 101 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1me9 h HIS 222 N 1.61 0.86 -0.45 0.00 3.86 -2.01 -3.53 115.15 115.50 1me9 h HIS 222 Ca 0.00 -0.63 -0.06 0.00 -1.16 0.00 0.00 60.37 58.52 1me9 h HIS 222 Cb 0.46 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.86 1me9 h HIS 222 CO 0.13 1.57 0.05 0.09 0.86 0.00 0.00 177.93 180.63 1me9 n ASN 223 N -3.66 4.45 -4.77 2.45 5.03 -1.26 -5.01 115.26 112.49 1me9 n ASN 223 Ca -0.19 -3.10 -0.40 0.00 0.87 0.00 0.00 54.58 51.76 1me9 n ASN 223 Cb 1.09 -0.63 -0.01 0.00 -1.02 0.00 0.00 39.78 39.21 1me9 n ASN 223 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.26 173.60 1me9 s GLU 224 N -2.89 4.15 -0.39 3.52 -1.05 -1.17 -1.52 118.70 119.36 1me9 s GLU 224 Ca 0.48 2.25 -0.16 0.00 -0.15 0.00 0.00 54.97 57.40 1me9 s GLU 224 Cb 0.39 -2.92 0.01 0.00 -0.44 0.00 0.00 34.13 31.16 1me9 s GLU 224 CO 0.11 -0.38 0.36 -1.17 0.95 0.00 0.00 175.26 175.13 1me9 s LEU 225 N -2.11 4.79 0.24 1.83 2.96 0.11 -4.81 118.68 121.69 1me9 s LEU 225 Ca 0.53 -0.60 0.00 0.00 -0.22 0.00 0.00 54.13 53.84 1me9 s LEU 225 Cb -0.40 -2.28 -0.05 0.00 0.50 0.00 0.00 46.19 43.96 1me9 s LEU 225 CO 0.53 -0.44 0.12 0.68 -1.32 0.00 0.00 176.35 175.92 1me9 s VAL 226 N 1.93 0.29 0.47 1.68 -7.23 -1.26 -1.59 120.40 114.69 1me9 s VAL 226 Ca 0.09 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.27 1me9 s VAL 226 Cb -0.18 -2.57 0.09 0.00 0.56 0.00 0.00 36.38 34.29 1me9 s VAL 226 CO 0.12 0.00 0.65 -0.90 -0.31 0.00 0.00 175.10 174.65 1me9 n ASP 227 N -0.43 0.98 0.27 4.85 5.68 0.11 -4.84 116.55 123.17 1me9 n ASP 227 Ca 0.01 -1.80 0.18 0.00 -0.50 0.00 0.00 54.79 52.68 1me9 n ASP 227 Cb 0.66 -0.41 0.94 0.00 -1.14 0.00 0.00 41.12 41.17 1me9 n ASP 227 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1me9 h SER 228 N -0.33 0.00 -0.58 -1.12 4.64 -2.02 0.23 113.55 114.38 1me9 h SER 228 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1me9 h SER 228 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1me9 h SER 228 CO 0.24 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.20 1me9 n GLN 229 N -2.74 2.50 -1.28 4.77 6.02 -1.26 -4.93 117.38 120.46 1me9 n GLN 229 Ca -0.02 -2.31 -0.10 0.00 -0.01 0.00 0.00 57.00 54.56 1me9 n GLN 229 Cb 0.09 -1.51 -0.04 0.00 1.02 0.00 0.00 30.24 29.80 1me9 n GLN 229 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1me9 n LYS 230 N 1.41 -0.85 -3.34 -1.09 4.76 0.82 -5.01 118.16 114.87 1me9 n LYS 230 Ca 0.21 0.81 -0.36 0.00 -2.87 0.00 0.00 58.31 56.10 1me9 n LYS 230 Cb 0.56 -4.77 -0.06 0.00 -1.84 0.00 0.00 35.03 28.93 1me9 n LYS 230 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1me9 s ARG 231 N -2.68 4.04 0.44 1.97 0.52 -1.26 -4.75 118.95 117.23 1me9 s ARG 231 Ca 0.00 0.55 -0.25 0.00 -0.52 0.00 0.00 55.73 55.51 1me9 s ARG 231 Cb 0.00 -3.02 -0.09 0.00 0.52 0.00 0.00 34.95 32.36 1me9 s ARG 231 CO 0.00 0.53 1.31 0.66 0.02 0.00 0.00 175.30 177.82 1me9 n TYR 232 N 1.08 2.27 -2.94 -0.53 4.01 -1.26 -0.71 117.16 119.08 1me9 n TYR 232 Ca -0.07 0.48 -0.34 0.00 -0.16 0.00 0.00 57.90 57.81 1me9 n TYR 232 Cb 0.52 -2.40 -0.07 0.00 -0.31 0.00 0.00 39.34 37.09 1me9 n TYR 232 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1me9 s LEU 233 N -2.04 4.11 -0.05 7.72 1.02 -0.62 -4.58 118.68 124.23 1me9 s LEU 233 Ca 0.62 1.57 -0.15 0.00 0.02 0.00 0.00 54.13 56.18 1me9 s LEU 233 Cb -0.49 -4.18 0.03 0.00 0.02 0.00 0.00 46.19 41.58 1me9 s LEU 233 CO 0.57 -0.21 0.35 0.54 0.02 0.00 0.00 176.35 177.63 1me9 s VAL 234 N -1.93 0.04 0.38 -1.59 0.11 -1.26 -4.67 120.40 111.48 1me9 s VAL 234 Ca 0.55 -0.31 0.08 0.00 -2.93 0.00 0.00 61.98 59.37 1me9 s VAL 234 Cb -0.12 -0.61 -0.06 0.00 -1.53 0.00 0.00 36.38 34.06 1me9 s VAL 234 CO 0.17 -0.17 0.07 -0.83 -3.33 0.00 0.00 175.10 171.01 1me9 s GLY 235 N -0.88 2.24 -0.08 6.54 0.00 0.15 -1.73 107.32 113.55 1me9 s GLY 235 Ca -0.10 -2.08 -0.05 0.00 0.00 0.00 0.00 44.72 42.49 1me9 s GLY 235 CO 0.04 -1.95 0.20 0.00 0.00 0.00 0.00 173.10 171.39 1me9 s ALA 236 N -2.58 -0.44 0.39 3.20 0.00 -0.43 -0.66 121.76 121.24 1me9 s ALA 236 Ca 0.37 0.76 -0.22 0.00 0.00 0.00 0.00 51.96 52.87 1me9 s ALA 236 Cb 0.03 -0.48 -0.11 0.00 0.00 0.00 0.00 23.12 22.57 1me9 s ALA 236 CO 0.20 -0.15 0.93 0.20 0.00 0.00 0.00 175.76 176.94 1me9 s GLY 237 N 0.89 2.50 0.16 0.00 0.00 -0.45 -1.79 107.32 108.62 1me9 s GLY 237 Ca -0.06 0.41 0.01 0.00 0.00 0.00 0.00 44.72 45.08 1me9 s GLY 237 CO -0.05 0.73 0.02 -0.26 0.00 0.00 0.00 173.10 173.54 1me9 s ILE 238 N -2.01 0.52 0.39 0.90 -4.36 -0.32 -4.05 121.20 112.27 1me9 s ILE 238 Ca 0.58 -1.96 0.08 0.00 -0.26 0.00 0.00 60.65 59.09 1me9 s ILE 238 Cb -0.12 -2.09 -0.07 0.00 1.25 0.00 0.00 42.46 41.43 1me9 s ILE 238 CO 0.16 -0.48 -0.00 0.54 0.24 0.00 0.00 174.94 175.40 1me9 s ASN 239 N -3.14 3.92 0.00 4.36 2.20 -1.26 -0.85 114.94 120.17 1me9 s ASN 239 Ca 0.24 -1.26 0.07 0.00 -0.94 0.00 0.00 52.86 50.97 1me9 s ASN 239 Cb 0.06 -0.40 0.41 0.00 -2.00 0.00 0.00 41.25 39.32 1me9 s ASN 239 CO 0.03 -0.37 1.27 0.35 -2.94 0.00 0.00 177.10 175.44 1me9 n THR 240 N -0.94 0.03 -0.03 0.54 -2.24 -1.26 -3.98 114.28 106.40 1me9 n THR 240 Ca -0.05 -0.03 -0.03 0.00 -2.27 0.00 0.00 64.05 61.67 1me9 n THR 240 Cb 0.65 -0.08 -0.01 0.00 -2.10 0.00 0.00 70.33 68.80 1me9 n THR 240 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1me9 n ARG 241 N -0.52 0.18 -1.06 -0.78 0.63 -1.26 -4.77 116.66 109.07 1me9 n ARG 241 Ca 0.06 0.07 -0.20 0.00 -0.92 0.00 0.00 57.85 56.86 1me9 n ARG 241 Cb 0.05 -0.75 0.17 0.00 0.45 0.00 0.00 32.46 32.37 1me9 n ARG 241 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 1me9 n ASP 242 N -3.25 3.73 0.23 6.15 5.68 -1.26 -4.63 116.55 123.19 1me9 n ASP 242 Ca -0.05 -3.38 0.06 0.00 -0.50 0.00 0.00 54.79 50.92 1me9 n ASP 242 Cb 0.17 -0.79 0.52 0.00 -1.14 0.00 0.00 41.12 39.88 1me9 n ASP 242 CO 0.00 0.00 0.00 2.19 -1.33 0.00 0.00 177.20 178.06 1me9 h PHE 243 N 1.00 0.00 0.00 2.11 -5.15 -1.86 -0.20 116.94 112.83 1me9 h PHE 243 Ca 0.54 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 58.29 1me9 h PHE 243 Cb 2.61 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 38.78 1me9 h PHE 243 CO 1.38 0.20 -0.06 0.00 -2.00 0.00 0.00 178.31 177.83 1me9 h ARG 244 N 0.00 0.00 0.00 6.09 3.08 -1.93 0.57 114.38 122.18 1me9 h ARG 244 Ca -0.00 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.74 1me9 h ARG 244 Cb 0.36 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.36 1me9 h ARG 244 CO 0.03 0.06 -2.15 0.39 -1.07 0.00 0.00 179.97 177.22 1me9 n GLU 245 N -4.11 1.18 -0.02 0.04 4.71 -1.02 -4.52 120.64 116.90 1me9 n GLU 245 Ca -0.03 0.01 -0.16 0.00 -0.01 0.00 0.00 57.16 56.97 1me9 n GLU 245 Cb 0.15 -1.43 -0.09 0.00 -1.01 0.00 0.00 31.44 29.06 1me9 n GLU 245 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 1me9 h ARG 246 N 0.00 0.46 0.38 3.49 2.43 -0.82 -3.24 114.38 117.09 1me9 h ARG 246 Ca -0.46 -0.40 -0.01 0.00 -0.81 0.00 0.00 59.98 58.30 1me9 h ARG 246 Cb 1.99 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 31.62 1me9 h ARG 246 CO 0.01 1.04 -0.23 0.28 -1.51 0.00 0.00 179.97 179.56 1me9 h VAL 247 N 0.02 0.52 -0.99 0.20 2.07 -1.13 -1.17 116.25 115.77 1me9 h VAL 247 Ca -0.04 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.62 1me9 h VAL 247 Cb 1.16 0.52 -0.09 0.00 -1.52 0.00 0.00 31.29 31.36 1me9 h VAL 247 CO 0.10 0.00 0.62 -0.65 0.02 0.00 0.00 177.57 177.66 1me9 h PRO 248 N -0.59 0.86 -0.56 1.57 0.11 -1.77 0.21 132.00 131.84 1me9 h PRO 248 Ca -0.04 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.92 1me9 h PRO 248 Cb 0.48 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.38 1me9 h PRO 248 CO 0.05 0.57 -0.03 0.00 -0.21 0.00 0.00 178.00 178.37 1me9 h ALA 249 N 1.58 0.88 -0.32 -0.75 0.00 -1.53 -0.33 119.26 118.79 1me9 h ALA 249 Ca 0.52 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.97 1me9 h ALA 249 Cb 0.65 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1me9 h ALA 249 CO -0.29 0.65 -0.34 -0.07 0.00 0.00 0.00 179.25 179.20 1me9 h LEU 250 N 0.91 0.85 0.21 0.00 4.07 0.18 -1.42 115.31 120.11 1me9 h LEU 250 Ca 0.16 -0.48 -0.01 0.00 0.08 0.00 0.00 57.88 57.63 1me9 h LEU 250 Cb 0.57 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.07 1me9 h LEU 250 CO 0.03 1.15 -0.10 0.58 -1.08 0.00 0.00 178.44 179.03 1me9 h VAL 251 N 0.56 0.84 -0.93 1.22 2.07 -0.55 -1.44 116.25 118.02 1me9 h VAL 251 Ca 0.05 -0.23 0.11 0.00 0.82 0.00 0.00 66.70 67.45 1me9 h VAL 251 Cb 0.93 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 31.60 1me9 h VAL 251 CO 0.08 0.05 0.59 -0.33 0.02 0.00 0.00 177.57 177.99 1me9 h GLU 252 N -0.39 0.88 0.00 1.57 3.07 -1.06 0.10 114.58 118.74 1me9 h GLU 252 Ca -0.03 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.78 1me9 h GLU 252 Cb 0.30 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1me9 h GLU 252 CO 0.05 0.58 0.00 0.00 -1.40 0.00 0.00 179.01 178.24 1me9 n ALA 253 N -2.39 1.60 0.00 3.43 0.00 -0.54 -4.87 120.51 117.73 1me9 n ALA 253 Ca 0.16 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1me9 n ALA 253 Cb 0.34 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1me9 n ALA 253 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1me9 n GLY 254 N -0.13 1.08 3.72 0.00 0.00 0.35 -3.85 105.19 106.36 1me9 n GLY 254 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1me9 n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1me9 n ALA 255 N -1.81 2.72 0.05 4.61 0.00 -0.58 -4.88 120.51 120.63 1me9 n ALA 255 Ca 0.00 0.40 -0.04 0.00 0.00 0.00 0.00 53.44 53.80 1me9 n ALA 255 Cb 0.00 -2.50 -0.09 0.00 0.00 0.00 0.00 19.45 16.86 1me9 n ALA 255 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1me9 h ASP 256 N 6.23 0.00 -4.95 0.00 3.32 -1.68 -3.45 116.42 115.88 1me9 h ASP 256 Ca -0.44 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.53 1me9 h ASP 256 Cb 1.21 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.56 1me9 h ASP 256 CO 0.91 0.81 -0.00 0.54 -1.72 0.00 0.00 179.24 179.79 1me9 s VAL 257 N -2.78 0.02 0.32 -1.35 0.11 -1.21 -4.59 120.40 110.93 1me9 s VAL 257 Ca -0.00 -0.19 0.10 0.00 -2.93 0.00 0.00 61.98 58.96 1me9 s VAL 257 Cb 0.09 -0.84 -0.06 0.00 -1.53 0.00 0.00 36.38 34.04 1me9 s VAL 257 CO 0.80 -0.10 -0.10 -0.76 -3.33 0.00 0.00 175.10 171.61 1me9 s LEU 258 N -1.19 2.76 -0.22 2.54 1.43 0.08 -1.32 118.68 122.76 1me9 s LEU 258 Ca -0.12 -1.10 -0.09 0.00 -1.03 0.00 0.00 54.13 51.80 1me9 s LEU 258 Cb -0.02 -1.12 0.09 0.00 0.03 0.00 0.00 46.19 45.17 1me9 s LEU 258 CO 0.07 -0.14 0.48 0.00 0.23 0.00 0.00 176.35 176.99 1me9 s ILE 260 N 2.36 3.18 -0.44 0.00 1.01 -0.24 -1.17 121.20 125.89 1me9 s ILE 260 Ca -0.05 0.80 -0.15 0.00 0.00 0.00 0.00 60.65 61.25 1me9 s ILE 260 Cb -0.11 -3.51 0.05 0.00 0.01 0.00 0.00 42.46 38.90 1me9 s ILE 260 CO -0.14 0.05 0.34 -0.62 0.00 0.00 0.00 174.94 174.56 1me9 s ASP 261 N 1.37 6.07 -0.02 3.58 2.15 -0.03 -4.32 116.67 125.47 1me9 s ASP 261 Ca 0.67 -1.17 -0.27 0.00 0.43 0.00 0.00 52.55 52.20 1me9 s ASP 261 Cb -0.38 -2.15 0.06 0.00 -0.30 0.00 0.00 42.92 40.15 1me9 s ASP 261 CO 0.30 -0.55 0.61 -0.55 -0.17 0.00 0.00 175.17 174.80 1me9 s SER 262 N 2.18 -0.57 0.18 -0.34 0.15 -1.24 -4.85 113.70 109.21 1me9 s SER 262 Ca 0.04 0.53 0.11 0.00 0.70 0.00 0.00 55.95 57.33 1me9 s SER 262 Cb -0.22 0.51 -0.09 0.00 -1.71 0.00 0.00 66.02 64.50 1me9 s SER 262 CO 0.07 -0.62 1.30 0.77 1.20 0.00 0.00 173.24 175.97 1me9 h SER 263 N 3.03 0.00 -3.91 5.45 4.64 -1.90 -1.41 113.55 119.45 1me9 h SER 263 Ca -0.28 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.41 1me9 h SER 263 Cb 1.16 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.85 1me9 h SER 263 CO 0.39 0.78 -0.69 -0.62 -0.87 0.00 0.00 176.83 175.82 1me9 s ASP 264 N -6.54 4.09 0.00 4.97 2.15 -1.26 -4.21 116.67 115.87 1me9 s ASP 264 Ca 0.02 -2.70 0.29 0.00 0.43 0.00 0.00 52.55 50.59 1me9 s ASP 264 Cb 0.09 -1.36 1.38 0.00 -0.30 0.00 0.00 42.92 42.72 1me9 s ASP 264 CO 0.79 -0.27 1.98 0.61 -0.17 0.00 0.00 175.17 178.11 1me9 n GLY 265 N 3.50 -1.36 2.79 2.66 0.00 0.16 -4.34 105.19 108.59 1me9 n GLY 265 Ca 0.06 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1me9 n GLY 265 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1me9 n PHE 266 N -1.38 3.11 -4.03 1.61 -0.00 -1.26 -4.71 117.46 110.80 1me9 n PHE 266 Ca 0.11 -2.72 -0.13 0.00 -0.00 0.00 0.00 57.45 54.71 1me9 n PHE 266 Cb 0.28 -2.36 -0.13 0.00 -0.00 0.00 0.00 39.48 37.27 1me9 n PHE 266 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1me9 s SER 267 N 3.55 0.42 0.52 -2.13 0.15 -1.26 -5.01 113.70 109.94 1me9 s SER 267 Ca 0.50 -0.20 0.24 0.00 0.70 0.00 0.00 55.95 57.19 1me9 s SER 267 Cb 0.14 -0.01 1.40 0.00 -1.71 0.00 0.00 66.02 65.85 1me9 s SER 267 CO -0.04 -0.05 2.08 -0.08 1.20 0.00 0.00 173.24 176.35 1me9 h GLU 268 N 5.61 0.00 -0.60 5.44 4.81 -1.97 -1.67 114.58 126.20 1me9 h GLU 268 Ca -0.29 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.92 1me9 h GLU 268 Cb 1.20 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.55 1me9 h GLU 268 CO 0.48 0.11 0.27 -1.49 -0.73 0.00 0.00 179.01 177.65 1me9 h TRP 269 N 0.00 0.84 -0.09 0.92 4.06 -1.95 -0.78 115.95 118.96 1me9 h TRP 269 Ca -0.00 -0.03 -0.18 0.00 2.06 0.00 0.00 58.89 60.73 1me9 h TRP 269 Cb 0.27 -0.27 -0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1me9 h TRP 269 CO 0.00 0.63 -0.72 1.96 -3.56 0.00 0.00 178.44 176.75 1me9 h GLN 270 N 0.85 0.44 -0.67 0.49 4.20 -1.60 -1.55 115.11 117.26 1me9 h GLN 270 Ca 0.21 -0.35 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 1me9 h GLN 270 Cb 0.11 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 1me9 h GLN 270 CO -0.03 0.99 0.34 -0.22 -0.67 0.00 0.00 178.83 179.24 1me9 h LYS 271 N 0.30 0.95 -0.32 1.46 3.64 -1.25 -1.08 116.57 120.28 1me9 h LYS 271 Ca -0.03 -0.13 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 1me9 h LYS 271 Cb 1.30 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1me9 h LYS 271 CO 0.13 0.74 0.11 0.82 -2.27 0.00 0.00 179.45 178.98 1me9 h ILE 272 N 0.93 1.20 -0.24 2.00 2.04 -1.04 -0.81 117.51 121.59 1me9 h ILE 272 Ca 0.23 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1me9 h ILE 272 Cb 0.09 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1me9 h ILE 272 CO -0.03 0.22 0.12 0.74 0.00 0.00 0.00 178.15 179.20 1me9 h THR 273 N 0.37 1.13 -0.47 -0.27 2.02 -1.04 -1.38 112.91 113.27 1me9 h THR 273 Ca 0.11 -0.36 -0.07 0.00 0.77 0.00 0.00 66.41 66.86 1me9 h THR 273 Cb 0.23 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 1me9 h THR 273 CO -0.00 0.13 0.01 0.40 0.37 0.00 0.00 175.52 176.43 1me9 h ILE 274 N 0.27 1.24 -0.69 3.11 2.04 -1.15 -2.46 117.51 119.86 1me9 h ILE 274 Ca 0.08 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 64.96 1me9 h ILE 274 Cb 0.09 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1me9 h ILE 274 CO -0.01 0.34 0.33 1.23 0.00 0.00 0.00 178.15 180.04 1me9 h GLY 275 N 0.96 1.07 1.28 5.37 0.00 -0.83 -1.44 103.07 109.49 1me9 h GLY 275 Ca 0.14 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 1me9 h GLY 275 CO 0.02 0.51 0.15 -0.25 0.00 0.00 0.00 176.54 176.97 1me9 h TRP 276 N 0.97 0.92 -0.43 5.60 7.01 -0.95 -1.61 115.95 127.46 1me9 h TRP 276 Ca 0.24 -0.09 -0.12 0.00 2.11 0.00 0.00 58.89 61.04 1me9 h TRP 276 Cb 0.12 -0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 26.90 1me9 h TRP 276 CO 0.01 0.76 -0.20 0.82 -2.79 0.00 0.00 178.44 177.04 1me9 h ILE 277 N 0.86 1.27 -0.31 2.65 2.04 -1.00 -2.39 117.51 120.63 1me9 h ILE 277 Ca 0.19 -1.33 -0.12 0.00 1.00 0.00 0.00 64.86 64.61 1me9 h ILE 277 Cb 0.29 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 1me9 h ILE 277 CO -0.00 0.45 -0.26 0.03 0.00 0.00 0.00 178.15 178.36 1me9 h ARG 278 N 0.74 0.73 -0.23 2.37 2.47 -0.91 0.13 114.38 119.68 1me9 h ARG 278 Ca 0.10 -0.37 -0.06 0.00 -1.26 0.00 0.00 59.98 58.40 1me9 h ARG 278 Cb 0.73 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.04 1me9 h ARG 278 CO 0.06 0.99 -0.12 1.49 0.56 0.00 0.00 179.97 182.94 1me9 h GLU 279 N 0.49 0.38 0.03 0.04 4.57 -1.27 0.94 114.58 119.76 1me9 h GLU 279 Ca 0.06 -0.10 -0.31 0.00 -1.18 0.00 0.00 59.36 57.83 1me9 h GLU 279 Cb 0.83 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 29.33 1me9 h GLU 279 CO 0.07 0.50 -1.77 1.17 -1.18 0.00 0.00 179.01 177.81 1me9 n LYS 280 N -4.24 0.66 0.00 1.92 0.00 -0.90 -4.60 118.16 111.00 1me9 n LYS 280 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 58.31 58.61 1me9 n LYS 280 Cb 0.29 -1.78 0.00 0.00 0.00 0.00 0.00 35.03 33.54 1me9 n LYS 280 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1me9 n TYR 281 N -3.15 0.00 -5.00 5.64 4.01 0.46 -5.09 117.16 114.03 1me9 n TYR 281 Ca -0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1me9 n TYR 281 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 1me9 n TYR 281 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1me9 n GLY 282 N 0.06 1.97 1.22 2.72 0.00 0.32 -1.96 105.19 109.52 1me9 n GLY 282 Ca 0.00 -0.49 0.04 0.00 0.00 0.00 0.00 46.02 45.57 1me9 n GLY 282 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1me9 n ASP 283 N -1.12 3.45 0.10 1.61 8.00 -1.26 -4.12 116.55 123.21 1me9 n ASP 283 Ca 0.00 -2.47 -0.01 0.00 0.71 0.00 0.00 54.79 53.02 1me9 n ASP 283 Cb 0.00 -0.59 -0.03 0.00 -0.02 0.00 0.00 41.12 40.48 1me9 n ASP 283 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1me9 h LYS 284 N 2.10 0.00 -5.18 -1.24 3.64 -1.78 -3.43 116.57 110.68 1me9 h LYS 284 Ca 0.00 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.74 1me9 h LYS 284 Cb 1.26 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 32.84 1me9 h LYS 284 CO 0.25 0.65 -0.68 0.08 -2.27 0.00 0.00 179.45 177.48 1me9 s VAL 285 N -2.87 3.82 -0.03 2.00 1.01 -1.26 -5.10 120.40 117.98 1me9 s VAL 285 Ca 0.02 -0.37 -0.16 0.00 0.00 0.00 0.00 61.98 61.48 1me9 s VAL 285 Cb 0.08 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.71 1me9 s VAL 285 CO 0.78 0.46 0.43 -0.54 0.00 0.00 0.00 175.10 176.23 1me9 s LYS 286 N 0.79 4.07 -0.07 2.72 -0.14 -1.26 -4.98 119.74 120.86 1me9 s LYS 286 Ca -0.01 0.44 -0.03 0.00 -1.36 0.00 0.00 55.97 55.01 1me9 s LYS 286 Cb -0.14 -3.29 0.04 0.00 -1.68 0.00 0.00 37.83 32.76 1me9 s LYS 286 CO 0.02 0.53 0.14 0.54 -0.76 0.00 0.00 175.35 175.82 1me9 s VAL 287 N -0.58 -0.23 0.43 3.17 0.11 -1.26 -0.75 120.40 121.30 1me9 s VAL 287 Ca 0.24 0.36 -0.08 0.00 -2.93 0.00 0.00 61.98 59.58 1me9 s VAL 287 Cb -0.16 -0.26 -0.05 0.00 -1.53 0.00 0.00 36.38 34.37 1me9 s VAL 287 CO 0.13 0.15 0.76 -0.83 -3.33 0.00 0.00 175.10 171.98 1me9 s GLY 288 N 2.23 1.76 0.22 6.54 0.00 0.73 -0.93 107.32 117.87 1me9 s GLY 288 Ca 0.03 -0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.41 1me9 s GLY 288 CO -0.05 -0.17 0.08 0.00 0.00 0.00 0.00 173.10 172.96 1me9 s ALA 289 N -2.50 1.50 0.00 3.20 0.00 -0.32 -1.08 121.76 122.56 1me9 s ALA 289 Ca 0.49 -1.76 0.00 0.00 0.00 0.00 0.00 51.96 50.70 1me9 s ALA 289 Cb -0.10 0.98 0.00 0.00 0.00 0.00 0.00 23.12 24.00 1me9 s ALA 289 CO 0.37 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 176.09 1me9 n GLY 290 N -0.36 1.00 3.90 0.00 0.00 -1.26 -0.58 105.19 107.89 1me9 n GLY 290 Ca -0.01 -1.92 -0.30 0.00 0.00 0.00 0.00 46.02 43.79 1me9 n GLY 290 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1me9 s ASN 291 N -2.93 6.50 0.24 1.61 -0.87 -0.53 -3.72 114.94 115.23 1me9 s ASN 291 Ca 0.00 0.75 0.01 0.00 -1.57 0.00 0.00 52.86 52.06 1me9 s ASN 291 Cb 0.00 -2.16 -0.05 0.00 -0.02 0.00 0.00 41.25 39.02 1me9 s ASN 291 CO 0.00 -0.14 0.07 0.27 -2.57 0.00 0.00 177.10 174.74 1me9 s ILE 292 N -1.97 0.60 0.00 0.60 -5.25 -0.73 0.36 121.20 114.81 1me9 s ILE 292 Ca 0.44 -2.00 0.00 0.00 -0.99 0.00 0.00 60.65 58.11 1me9 s ILE 292 Cb -0.11 -2.51 0.00 0.00 2.95 0.00 0.00 42.46 42.79 1me9 s ILE 292 CO 0.27 -0.12 0.27 1.33 -1.79 0.00 0.00 174.94 174.90 1me9 n VAL 293 N -0.41 0.07 -4.16 8.37 0.24 -1.26 -2.15 118.33 119.03 1me9 n VAL 293 Ca -0.02 -0.18 -0.14 0.00 -2.04 0.00 0.00 64.34 61.97 1me9 n VAL 293 Cb 0.65 1.50 -0.08 0.00 -1.47 0.00 0.00 33.84 34.45 1me9 n VAL 293 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1me9 s ASP 294 N -0.07 0.62 0.30 -1.34 -4.77 -1.26 -4.50 116.67 105.66 1me9 s ASP 294 Ca 0.00 -1.42 0.01 0.00 -3.30 0.00 0.00 52.55 47.84 1me9 s ASP 294 Cb 0.00 0.51 0.54 0.00 -1.09 0.00 0.00 42.92 42.89 1me9 s ASP 294 CO 0.00 -1.04 1.91 1.23 0.70 0.00 0.00 175.17 177.98 1me9 h GLY 295 N 2.34 1.30 0.96 2.12 0.00 -1.90 -1.76 103.07 106.14 1me9 h GLY 295 Ca -0.30 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 46.60 1me9 h GLY 295 CO 0.43 0.29 0.22 0.83 0.00 0.00 0.00 176.54 178.31 1me9 h GLU 296 N 1.01 0.65 -0.64 4.80 5.08 -1.96 0.51 114.58 124.02 1me9 h GLU 296 Ca 0.39 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.58 1me9 h GLU 296 Cb 0.21 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1me9 h GLU 296 CO -0.14 0.55 0.11 0.78 -1.00 0.00 0.00 179.01 179.31 1me9 h GLY 297 N 0.59 1.14 0.95 -3.84 0.00 -1.87 -1.36 103.07 98.68 1me9 h GLY 297 Ca 0.16 -0.76 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 1me9 h GLY 297 CO -0.02 0.70 -0.15 -2.75 0.00 0.00 0.00 176.54 174.33 1me9 h PHE 298 N 0.98 -0.38 -0.77 5.60 3.57 -1.09 -2.70 116.94 122.16 1me9 h PHE 298 Ca 0.20 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.79 1me9 h PHE 298 Cb 0.43 0.12 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 1me9 h PHE 298 CO 0.03 -0.20 0.39 -0.09 -2.23 0.00 0.00 178.31 176.22 1me9 h ARG 299 N -0.46 0.62 -0.26 1.11 9.65 -0.79 0.18 114.38 124.43 1me9 h ARG 299 Ca -0.04 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.79 1me9 h ARG 299 Cb 0.35 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 1me9 h ARG 299 CO 0.07 0.41 0.12 -0.92 2.80 0.00 0.00 179.97 182.45 1me9 h TYR 300 N 0.64 0.37 0.00 2.20 3.20 -1.16 -1.00 116.97 121.22 1me9 h TYR 300 Ca 0.39 -0.02 -0.10 0.00 3.14 0.00 0.00 58.73 62.14 1me9 h TYR 300 Cb 0.43 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 1me9 h TYR 300 CO -0.10 0.36 -0.48 -0.07 -1.64 0.00 0.00 178.16 176.23 1me9 h LEU 301 N 0.28 0.00 0.23 2.82 3.38 -1.09 -2.07 115.31 118.87 1me9 h LEU 301 Ca 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1me9 h LEU 301 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1me9 h LEU 301 CO -0.01 0.48 -0.11 0.00 0.09 0.00 0.00 178.44 178.89 1me9 h ALA 302 N 1.52 -0.31 0.00 1.53 0.00 -0.34 -1.93 119.26 119.74 1me9 h ALA 302 Ca -0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1me9 h ALA 302 Cb 0.98 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1me9 h ALA 302 CO 0.06 -0.53 -0.08 -0.44 0.00 0.00 0.00 179.25 178.27 1me9 h ASP 303 N -0.60 0.00 0.96 0.00 3.32 -1.17 -0.16 116.42 118.77 1me9 h ASP 303 Ca -0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1me9 h ASP 303 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1me9 h ASP 303 CO 0.05 0.08 0.00 0.00 -1.72 0.00 0.00 179.24 177.65 1me9 n ALA 304 N -2.45 1.90 0.00 3.45 0.00 -0.78 -4.92 120.51 117.71 1me9 n ALA 304 Ca -0.03 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1me9 n ALA 304 Cb 0.16 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1me9 n ALA 304 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1me9 n GLY 305 N 0.50 0.98 3.66 0.00 0.00 -0.07 -4.57 105.19 105.69 1me9 n GLY 305 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1me9 n GLY 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1me9 n ALA 306 N -1.56 0.81 0.14 4.61 0.00 -0.76 -4.91 120.51 118.84 1me9 n ALA 306 Ca 0.00 0.22 0.10 0.00 0.00 0.00 0.00 53.44 53.76 1me9 n ALA 306 Cb 0.00 -2.19 0.05 0.00 0.00 0.00 0.00 19.45 17.31 1me9 n ALA 306 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1me9 h ASP 307 N 1.72 0.00 -4.97 0.00 3.32 -1.39 -3.46 116.42 111.64 1me9 h ASP 307 Ca -0.47 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.54 1me9 h ASP 307 Cb 1.32 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.69 1me9 h ASP 307 CO 0.58 0.11 0.21 0.72 -1.72 0.00 0.00 179.24 179.14 1me9 s PHE 308 N -3.23 -0.63 -0.09 4.55 -0.12 -1.26 -0.44 117.98 116.77 1me9 s PHE 308 Ca 0.02 0.98 0.03 0.00 -0.05 0.00 0.00 56.93 57.91 1me9 s PHE 308 Cb 0.08 0.44 0.00 0.00 -0.63 0.00 0.00 43.02 42.91 1me9 s PHE 308 CO 0.75 -0.64 -0.20 0.42 -0.05 0.00 0.00 175.22 175.50 1me9 s ILE 309 N -1.62 1.75 -0.02 -4.49 1.01 -0.82 -1.17 121.20 115.83 1me9 s ILE 309 Ca -0.09 -0.84 -0.18 0.00 0.00 0.00 0.00 60.65 59.54 1me9 s ILE 309 Cb -0.00 -1.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.89 1me9 s ILE 309 CO 0.06 0.49 0.52 -0.54 0.00 0.00 0.00 174.94 175.46 1me9 s LYS 310 N 0.43 4.22 -0.15 2.79 1.02 0.26 -0.88 119.74 127.43 1me9 s LYS 310 Ca -0.17 0.58 -0.03 0.00 0.02 0.00 0.00 55.97 56.37 1me9 s LYS 310 Cb -0.17 -3.33 -0.03 0.00 -0.52 0.00 0.00 37.83 33.79 1me9 s LYS 310 CO 0.07 0.42 -0.04 0.42 -0.92 0.00 0.00 175.35 175.30 1me9 s ILE 311 N -0.29 3.85 0.00 2.17 1.01 0.21 -1.77 121.20 126.38 1me9 s ILE 311 Ca 0.28 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.55 1me9 s ILE 311 Cb -0.17 -2.68 0.00 0.00 0.01 0.00 0.00 42.46 39.62 1me9 s ILE 311 CO 0.15 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.20 1me9 n GLY 312 N 3.42 3.43 2.74 6.18 0.00 -0.91 -0.48 105.19 119.57 1me9 n GLY 312 Ca -0.17 -0.54 -0.19 0.00 0.00 0.00 0.00 46.02 45.11 1me9 n GLY 312 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1me9 s ILE 313 N 0.00 -0.19 0.00 -0.61 1.01 -1.26 -4.71 121.20 115.43 1me9 s ILE 313 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.90 1me9 s ILE 313 Cb 0.00 -0.33 0.00 0.00 0.01 0.00 0.00 42.46 42.14 1me9 s ILE 313 CO 0.00 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.60 1me9 n GLY 314 N 5.31 1.01 0.03 6.18 0.00 -1.26 -2.42 105.19 114.04 1me9 n GLY 314 Ca -0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.09 1me9 n GLY 314 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1me9 n GLY 315 N -2.00 -1.24 3.60 -0.02 0.00 -1.26 -4.68 105.19 99.59 1me9 n GLY 315 Ca 0.00 -0.38 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 1me9 n GLY 315 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1me9 n GLY 316 N 1.39 -0.59 0.19 -0.02 0.00 -1.26 -2.49 105.19 102.41 1me9 n GLY 316 Ca 0.03 -0.39 0.04 0.00 0.00 0.00 0.00 46.02 45.69 1me9 n GLY 316 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1me9 h SER 317 N -0.46 0.00 -3.53 1.61 4.64 -1.95 -3.45 113.55 110.42 1me9 h SER 317 Ca -0.47 0.00 -0.79 0.00 -0.47 0.00 0.00 61.79 60.06 1me9 h SER 317 Cb 1.33 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 63.15 1me9 h SER 317 CO 0.45 0.35 0.40 0.27 -0.87 0.00 0.00 176.83 177.44 1me9 s ILE 318 N -4.14 5.78 0.00 0.95 -0.00 -1.26 -5.14 121.20 117.39 1me9 s ILE 318 Ca -0.03 -3.01 0.00 0.00 -0.00 0.00 0.00 60.65 57.62 1me9 s ILE 318 Cb 0.14 -4.59 0.00 0.00 -0.00 0.00 0.00 42.46 38.01 1me9 s ILE 318 CO 0.71 -1.17 0.00 -0.38 -0.00 0.00 0.00 174.94 174.10 1me9 n ILE 320 N 3.33 0.00 -0.23 8.37 2.08 -1.26 -4.47 119.36 127.17 1me9 n ILE 320 Ca 0.21 0.00 -0.01 0.00 0.56 0.00 0.00 62.75 63.52 1me9 n ILE 320 Cb 0.42 0.00 0.02 0.00 -0.75 0.00 0.00 39.64 39.34 1me9 n ILE 320 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 1me9 n THR 321 N 0.00 -0.31 -0.84 1.39 -1.04 -1.26 -0.78 114.28 111.43 1me9 n THR 321 Ca 0.00 1.39 -0.12 0.00 -2.04 0.00 0.00 64.05 63.29 1me9 n THR 321 Cb 0.00 -1.84 -0.13 0.00 -1.82 0.00 0.00 70.33 66.54 1me9 n THR 321 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1me9 n ARG 322 N -4.87 1.75 0.00 -2.82 1.74 -1.26 -0.44 116.66 110.76 1me9 n ARG 322 Ca 0.06 -0.90 0.00 0.00 -0.77 0.00 0.00 57.85 56.24 1me9 n ARG 322 Cb 0.24 -1.97 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 1me9 n ARG 322 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1me9 n GLU 323 N 2.68 0.00 0.00 5.56 2.13 0.04 -5.02 120.64 126.03 1me9 n GLU 323 Ca 0.38 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.20 1me9 n GLU 323 Cb 0.72 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.43 1me9 n GLU 323 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1me9 n GLN 324 N 0.00 0.00 0.00 5.31 1.13 0.42 -5.01 117.38 119.23 1me9 n GLN 324 Ca 0.00 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 55.07 1me9 n GLN 324 Cb 0.02 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.37 1me9 n GLN 324 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1me9 n LYS 325 N 0.00 1.09 -2.99 -1.09 5.02 -1.19 -5.03 118.16 113.98 1me9 n LYS 325 Ca 0.00 -0.49 -0.14 0.00 -2.02 0.00 0.00 58.31 55.65 1me9 n LYS 325 Cb 0.00 -0.94 0.04 0.00 -0.02 0.00 0.00 35.03 34.11 1me9 n LYS 325 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1me9 n GLY 326 N 0.38 0.00 3.50 0.72 0.00 -0.95 -5.04 105.19 103.81 1me9 n GLY 326 Ca 0.01 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 1me9 n GLY 326 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1me9 s ILE 327 N -3.09 3.01 -5.00 -0.61 -4.36 -1.26 -5.02 121.20 104.87 1me9 s ILE 327 Ca 0.29 -1.25 0.00 0.00 -0.26 0.00 0.00 60.65 59.42 1me9 s ILE 327 Cb -0.13 -2.33 0.00 0.00 1.25 0.00 0.00 42.46 41.25 1me9 s ILE 327 CO 0.36 0.23 0.00 0.61 0.24 0.00 0.00 174.94 176.37 1me9 n GLY 328 N 1.16 0.14 3.61 6.27 0.00 -1.26 -4.44 105.19 110.68 1me9 n GLY 328 Ca -0.15 -1.72 -0.10 0.00 0.00 0.00 0.00 46.02 44.05 1me9 n GLY 328 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1me9 s ARG 329 N -1.81 0.56 0.13 1.61 3.52 -1.01 -5.03 118.95 116.92 1me9 s ARG 329 Ca 0.00 0.46 -0.35 0.00 -0.13 0.00 0.00 55.73 55.71 1me9 s ARG 329 Cb 0.00 0.27 -0.16 0.00 -1.56 0.00 0.00 34.95 33.50 1me9 s ARG 329 CO 0.00 -0.11 1.33 0.41 -0.81 0.00 0.00 175.30 176.12 1me9 n GLY 330 N 1.72 0.47 0.29 8.12 0.00 -1.26 -4.67 105.19 109.86 1me9 n GLY 330 Ca -0.12 0.63 0.05 0.00 0.00 0.00 0.00 46.02 46.58 1me9 n GLY 330 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1me9 h GLN 331 N 4.40 0.59 0.30 1.61 5.75 -1.92 -1.77 115.11 124.07 1me9 h GLN 331 Ca -0.46 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.00 1me9 h GLN 331 Cb 1.32 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 29.73 1me9 h GLN 331 CO 0.77 0.39 -0.19 0.00 -2.65 0.00 0.00 178.83 177.15 1me9 h ALA 332 N 1.51 -0.45 -0.96 3.38 0.00 -1.72 -1.02 119.26 120.00 1me9 h ALA 332 Ca 0.42 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.29 1me9 h ALA 332 Cb 0.55 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.51 1me9 h ALA 332 CO -0.33 -0.77 0.63 1.15 0.00 0.00 0.00 179.25 179.93 1me9 h THR 333 N -0.47 1.15 0.02 0.00 2.02 -1.33 -1.19 112.91 113.12 1me9 h THR 333 Ca -0.03 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.75 1me9 h THR 333 Cb 0.39 -0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 1me9 h THR 333 CO 0.03 0.22 -0.03 0.00 0.37 0.00 0.00 175.52 176.10 1me9 h ALA 334 N 1.45 -0.05 0.09 6.16 0.00 -0.95 -0.87 119.26 125.08 1me9 h ALA 334 Ca 0.39 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 1me9 h ALA 334 Cb 0.05 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1me9 h ALA 334 CO -0.13 -0.54 -0.04 0.28 0.00 0.00 0.00 179.25 178.82 1me9 h VAL 335 N -0.07 0.97 -0.70 0.00 2.07 -0.76 -0.88 116.25 116.88 1me9 h VAL 335 Ca 0.01 -0.20 0.09 0.00 0.82 0.00 0.00 66.70 67.42 1me9 h VAL 335 Cb 0.08 1.10 -0.07 0.00 -1.52 0.00 0.00 31.29 30.88 1me9 h VAL 335 CO -0.02 0.05 0.36 0.40 0.02 0.00 0.00 177.57 178.38 1me9 h ILE 336 N -0.20 0.88 -0.24 4.57 2.04 -1.15 0.17 117.51 123.57 1me9 h ILE 336 Ca -0.01 -0.21 -0.08 0.00 1.00 0.00 0.00 64.86 65.56 1me9 h ILE 336 Cb 0.17 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 1me9 h ILE 336 CO 0.02 0.11 -0.14 -0.78 0.00 0.00 0.00 178.15 177.36 1me9 h ASP 337 N 0.63 0.55 -0.47 1.72 -0.00 -1.02 -2.36 116.42 115.48 1me9 h ASP 337 Ca 0.34 -0.43 -0.06 0.00 -0.00 0.00 0.00 57.03 56.88 1me9 h ASP 337 Cb 0.33 -0.15 -0.02 0.00 -0.00 0.00 0.00 39.33 39.49 1me9 h ASP 337 CO -0.25 0.86 0.04 0.58 -0.00 0.00 0.00 179.24 180.47 1me9 h VAL 338 N 0.25 1.25 -0.96 2.25 2.07 -0.79 -2.45 116.25 117.87 1me9 h VAL 338 Ca 0.05 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.61 1me9 h VAL 338 Cb 0.66 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.36 1me9 h VAL 338 CO 0.04 0.34 0.64 0.58 0.02 0.00 0.00 177.57 179.19 1me9 h VAL 339 N 0.65 1.24 -0.69 2.57 2.07 -0.67 0.13 116.25 121.55 1me9 h VAL 339 Ca 0.14 -0.44 -0.07 0.00 0.82 0.00 0.00 66.70 67.15 1me9 h VAL 339 Cb 0.44 -0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 1me9 h VAL 339 CO 0.02 0.24 0.16 0.00 0.02 0.00 0.00 177.57 178.00 1me9 h ALA 340 N 1.41 0.91 -0.39 1.67 0.00 -1.21 -1.15 119.26 120.50 1me9 h ALA 340 Ca 0.36 -0.25 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 1me9 h ALA 340 Cb -0.13 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1me9 h ALA 340 CO -0.08 0.64 -0.33 1.49 0.00 0.00 0.00 179.25 180.97 1me9 h GLU 341 N 1.04 0.89 -0.81 0.00 4.57 -0.91 -1.65 114.58 117.71 1me9 h GLU 341 Ca 0.22 -0.43 -0.04 0.00 -1.18 0.00 0.00 59.36 57.93 1me9 h GLU 341 Cb 0.38 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.93 1me9 h GLU 341 CO 0.00 1.08 0.36 -0.09 -1.18 0.00 0.00 179.01 179.19 1me9 h ARG 342 N 0.74 1.18 -0.18 1.92 1.12 -0.49 0.18 114.38 118.85 1me9 h ARG 342 Ca 0.07 -0.19 -0.15 0.00 -1.11 0.00 0.00 59.98 58.61 1me9 h ARG 342 Cb 0.90 -0.20 -0.01 0.00 -0.01 0.00 0.00 29.97 30.65 1me9 h ARG 342 CO 0.08 0.93 -0.51 -0.91 -3.11 0.00 0.00 179.97 176.45 1me9 h ASN 343 N 1.15 0.56 -0.37 -3.80 2.35 -1.10 -0.07 115.58 114.31 1me9 h ASN 343 Ca 0.27 -0.28 -0.06 0.00 -0.55 0.00 0.00 56.30 55.68 1me9 h ASN 343 Cb 0.16 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1me9 h ASN 343 CO -0.03 0.97 -0.01 0.50 -1.65 0.00 0.00 177.43 177.21 1me9 h LYS 344 N 0.40 0.66 -0.68 0.81 3.64 -0.90 -2.03 116.57 118.47 1me9 h LYS 344 Ca 0.02 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 1me9 h LYS 344 Cb 1.03 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.76 1me9 h LYS 344 CO 0.09 0.77 0.43 -0.92 -2.27 0.00 0.00 179.45 177.55 1me9 h TYR 345 N 0.47 0.88 -0.62 1.91 3.20 -0.43 -1.81 116.97 120.58 1me9 h TYR 345 Ca 0.10 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.00 1me9 h TYR 345 Cb 0.48 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 1me9 h TYR 345 CO 0.04 0.58 0.39 0.35 -1.64 0.00 0.00 178.16 177.88 1me9 h PHE 346 N 0.93 0.72 0.00 -3.82 3.57 -0.79 -0.88 116.94 116.68 1me9 h PHE 346 Ca 0.25 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.70 1me9 h PHE 346 Cb -0.06 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.43 1me9 h PHE 346 CO -0.02 0.42 -0.30 0.93 -2.23 0.00 0.00 178.31 177.11 1me9 h GLU 347 N 0.77 0.00 0.17 1.11 4.39 -0.91 0.58 114.58 120.68 1me9 h GLU 347 Ca 0.25 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.61 1me9 h GLU 347 Cb 0.00 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1me9 h GLU 347 CO -0.09 0.30 -1.64 0.93 -1.16 0.00 0.00 179.01 177.35 1me9 h GLU 348 N 0.00 0.35 0.00 2.33 5.08 -0.84 -3.41 114.58 118.09 1me9 h GLU 348 Ca -0.00 -0.60 0.00 0.00 -1.00 0.00 0.00 59.36 57.75 1me9 h GLU 348 Cb 0.59 0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1me9 h GLU 348 CO 0.04 1.25 -0.69 0.25 -1.00 0.00 0.00 179.01 178.85 1me9 n THR 349 N -3.55 0.00 -0.99 1.13 -2.24 -0.38 -5.00 114.28 103.26 1me9 n THR 349 Ca -0.21 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 1me9 n THR 349 Cb 1.07 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 70.09 1me9 n THR 349 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1me9 n GLY 350 N 1.44 0.65 3.58 3.38 0.00 0.20 -4.97 105.19 109.47 1me9 n GLY 350 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1me9 n GLY 350 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1me9 s ILE 351 N -2.65 5.00 -0.31 -0.61 1.01 -1.25 -0.07 121.20 122.32 1me9 s ILE 351 Ca 0.00 0.06 -0.11 0.00 0.00 0.00 0.00 60.65 60.60 1me9 s ILE 351 Cb 0.00 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 1me9 s ILE 351 CO 0.00 0.33 0.19 -0.47 0.00 0.00 0.00 174.94 175.00 1me9 s TYR 352 N 1.30 3.21 -0.28 3.97 5.04 -0.13 -3.74 117.35 126.72 1me9 s TYR 352 Ca 0.06 -0.18 -0.07 0.00 -2.44 0.00 0.00 57.07 54.44 1me9 s TYR 352 Cb -0.14 -2.40 -0.01 0.00 0.35 0.00 0.00 41.96 39.75 1me9 s TYR 352 CO 0.06 -0.31 0.08 0.42 -1.34 0.00 0.00 175.55 174.46 1me9 s ILE 353 N 1.71 4.15 0.46 3.14 1.01 -1.26 -2.57 121.20 127.83 1me9 s ILE 353 Ca 0.06 -0.46 -0.24 0.00 0.00 0.00 0.00 60.65 60.01 1me9 s ILE 353 Cb -0.17 -3.06 -0.07 0.00 0.01 0.00 0.00 42.46 39.17 1me9 s ILE 353 CO 0.09 0.18 1.32 -2.84 0.00 0.00 0.00 174.94 173.69 1me9 s PRO 354 N 1.56 3.68 0.08 2.79 0.02 -1.26 -4.85 135.00 137.02 1me9 s PRO 354 Ca 0.04 2.16 0.09 0.00 0.02 0.00 0.00 61.00 63.32 1me9 s PRO 354 Cb -0.16 -2.56 -0.03 0.00 0.02 0.00 0.00 34.50 31.76 1me9 s PRO 354 CO 0.03 -0.73 -0.25 0.14 -0.33 0.00 0.00 177.00 175.87 1me9 s VAL 355 N -1.31 2.02 -0.14 3.83 -7.23 -1.26 -1.94 120.40 114.36 1me9 s VAL 355 Ca 0.62 -1.49 0.00 0.00 -1.81 0.00 0.00 61.98 59.30 1me9 s VAL 355 Cb -0.38 -1.76 -0.01 0.00 0.56 0.00 0.00 36.38 34.79 1me9 s VAL 355 CO 0.48 0.18 -0.15 0.00 -0.31 0.00 0.00 175.10 175.30 1me9 s SER 357 N 0.65 6.51 -0.33 0.00 0.15 -0.57 0.67 113.70 120.78 1me9 s SER 357 Ca -0.08 0.20 -0.08 0.00 0.70 0.00 0.00 55.95 56.69 1me9 s SER 357 Cb -0.16 -2.40 0.02 0.00 -1.71 0.00 0.00 66.02 61.77 1me9 s SER 357 CO 0.02 -0.81 0.13 -0.62 1.20 0.00 0.00 173.24 173.16 1me9 s ASP 358 N 1.96 5.41 0.00 5.45 2.15 0.37 -1.06 116.67 130.95 1me9 s ASP 358 Ca 0.31 -0.84 0.00 0.00 0.43 0.00 0.00 52.55 52.46 1me9 s ASP 358 Cb -0.13 -1.94 0.00 0.00 -0.30 0.00 0.00 42.92 40.56 1me9 s ASP 358 CO 0.19 -0.27 0.00 0.61 -0.17 0.00 0.00 175.17 175.53 1me9 n GLY 359 N 4.91 -0.86 1.89 2.66 0.00 -0.97 -4.51 105.19 108.30 1me9 n GLY 359 Ca -0.13 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1me9 n GLY 359 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1me9 n GLY 360 N -0.68 0.83 3.61 -0.02 0.00 -1.04 -4.76 105.19 103.13 1me9 n GLY 360 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1me9 n GLY 360 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1me9 s ILE 361 N -3.25 4.22 -0.19 -0.61 -1.09 -1.26 -4.83 121.20 114.20 1me9 s ILE 361 Ca 0.00 1.29 0.02 0.00 -2.23 0.00 0.00 60.65 59.74 1me9 s ILE 361 Cb 0.00 -4.49 -0.13 0.00 -1.58 0.00 0.00 42.46 36.27 1me9 s ILE 361 CO 0.00 -0.84 -0.15 0.52 -1.23 0.00 0.00 174.94 173.24 1me9 n VAL 362 N 6.64 1.08 -4.41 2.92 0.31 -1.26 -4.85 118.33 118.74 1me9 n VAL 362 Ca 0.13 -0.43 -0.22 0.00 -0.01 0.00 0.00 64.34 63.81 1me9 n VAL 362 Cb 0.48 -1.12 -0.10 0.00 -0.91 0.00 0.00 33.84 32.19 1me9 n VAL 362 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1me9 s TYR 363 N -2.38 2.04 0.31 3.52 2.02 -1.26 -5.04 117.35 116.57 1me9 s TYR 363 Ca -0.24 -0.43 0.02 0.00 -0.37 0.00 0.00 57.07 56.05 1me9 s TYR 363 Cb 0.06 -0.92 0.58 0.00 -0.40 0.00 0.00 41.96 41.28 1me9 s TYR 363 CO 0.45 0.55 1.91 -0.44 -1.57 0.00 0.00 175.55 176.45 1me9 h ASP 364 N 2.50 0.85 0.55 2.29 3.32 -1.96 -1.27 116.42 122.70 1me9 h ASP 364 Ca -0.40 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1me9 h ASP 364 Cb 1.24 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.62 1me9 h ASP 364 CO 0.59 0.54 0.00 0.10 -1.72 0.00 0.00 179.24 178.75 1me9 h TYR 365 N 0.96 0.00 0.00 4.55 -0.00 -1.96 -0.73 116.97 119.79 1me9 h TYR 365 Ca 0.38 0.00 -0.08 0.00 0.00 0.00 0.00 58.73 59.03 1me9 h TYR 365 Cb 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.97 1me9 h TYR 365 CO -0.00 0.00 -0.38 0.45 -0.00 0.00 0.00 178.16 178.23 1me9 h HIS 366 N 0.00 0.00 0.08 0.10 3.86 -1.62 -1.30 115.15 116.27 1me9 h HIS 366 Ca 0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1me9 h HIS 366 Cb 0.27 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1me9 h HIS 366 CO 0.00 0.38 -0.04 0.52 0.86 0.00 0.00 177.93 179.65 1me9 h MET 367 N 0.00 -0.10 -0.82 2.45 2.86 -1.22 0.44 114.93 118.53 1me9 h MET 367 Ca -0.00 0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.67 1me9 h MET 367 Cb 0.72 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.36 1me9 h MET 367 CO 0.05 0.05 0.53 1.15 1.06 0.00 0.00 176.91 179.76 1me9 h THR 368 N -0.24 1.15 0.05 2.22 2.02 -1.53 -1.67 112.91 114.91 1me9 h THR 368 Ca -0.01 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 66.81 1me9 h THR 368 Cb 0.20 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 1me9 h THR 368 CO 0.02 0.19 -0.02 -0.07 0.37 0.00 0.00 175.52 176.01 1me9 h LEU 369 N 1.05 -0.06 -0.46 2.58 3.38 -0.97 0.41 115.31 121.24 1me9 h LEU 369 Ca 0.32 -0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.31 1me9 h LEU 369 Cb -0.03 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 1me9 h LEU 369 CO -0.10 0.01 0.12 0.00 0.09 0.00 0.00 178.44 178.57 1me9 h ALA 370 N 0.82 0.53 -0.33 1.53 0.00 -0.58 0.92 119.26 122.15 1me9 h ALA 370 Ca -0.01 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1me9 h ALA 370 Cb 0.11 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1me9 h ALA 370 CO 0.01 -0.28 0.03 -0.07 0.00 0.00 0.00 179.25 178.94 1me9 h LEU 371 N 0.27 0.55 -1.40 0.00 3.38 -1.22 -2.18 115.31 114.71 1me9 h LEU 371 Ca 0.22 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1me9 h LEU 371 Cb 0.26 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1me9 h LEU 371 CO -0.27 0.70 0.31 0.00 0.09 0.00 0.00 178.44 179.28 1me9 h ALA 372 N 0.87 1.55 0.00 1.53 0.00 -0.22 0.02 119.26 123.00 1me9 h ALA 372 Ca 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1me9 h ALA 372 Cb 0.40 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1me9 h ALA 372 CO 0.01 0.39 0.00 -1.33 0.00 0.00 0.00 179.25 178.32 1me9 n MET 373 N -4.42 0.13 0.00 0.00 2.81 0.25 -4.46 117.12 111.43 1me9 n MET 373 Ca 0.05 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 1me9 n MET 373 Cb 0.08 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 1me9 n MET 373 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1me9 n GLY 374 N 0.50 1.65 3.76 3.03 0.00 -0.01 -4.58 105.19 109.54 1me9 n GLY 374 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1me9 n GLY 374 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1me9 s ALA 375 N -1.75 3.60 0.06 4.61 0.00 -0.83 -4.83 121.76 122.61 1me9 s ALA 375 Ca 0.00 1.41 -0.08 0.00 0.00 0.00 0.00 51.96 53.29 1me9 s ALA 375 Cb 0.00 -3.57 -0.30 0.00 0.00 0.00 0.00 23.12 19.25 1me9 s ALA 375 CO 0.00 -0.84 1.10 -0.44 0.00 0.00 0.00 175.76 175.58 1me9 h ASP 376 N 4.08 0.58 -5.35 0.00 3.32 -1.49 -3.38 116.42 114.18 1me9 h ASP 376 Ca -0.48 -0.61 -0.12 0.00 0.02 0.00 0.00 57.03 55.84 1me9 h ASP 376 Cb 1.23 -0.19 -0.11 0.00 0.22 0.00 0.00 39.33 40.48 1me9 h ASP 376 CO 0.72 1.48 -0.26 0.72 -1.72 0.00 0.00 179.24 180.17 1me9 s PHE 377 N -2.66 0.62 -0.05 4.55 -0.71 -1.16 -4.81 117.98 113.76 1me9 s PHE 377 Ca -0.06 -0.94 0.05 0.00 -1.04 0.00 0.00 56.93 54.94 1me9 s PHE 377 Cb 0.06 -0.04 -0.00 0.00 -1.21 0.00 0.00 43.02 41.83 1me9 s PHE 377 CO 0.91 -0.90 -0.19 0.42 -1.34 0.00 0.00 175.22 174.12 1me9 s ILE 378 N -4.01 1.59 -0.19 -4.49 1.01 0.21 -1.51 121.20 113.80 1me9 s ILE 378 Ca 0.28 -0.80 -0.08 0.00 0.00 0.00 0.00 60.65 60.05 1me9 s ILE 378 Cb 0.02 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 1me9 s ILE 378 CO 0.10 0.45 0.08 -0.32 0.00 0.00 0.00 174.94 175.25 1me9 s MET 379 N 0.01 3.98 0.01 2.79 -2.45 -0.22 -0.79 119.30 122.62 1me9 s MET 379 Ca -0.04 -0.34 0.05 0.00 -1.25 0.00 0.00 55.69 54.11 1me9 s MET 379 Cb -0.12 -3.27 -0.01 0.00 1.25 0.00 0.00 34.83 32.68 1me9 s MET 379 CO 0.03 0.22 -0.14 -0.51 1.05 0.00 0.00 175.02 175.67 1me9 s LEU 380 N 0.52 2.08 -0.00 4.11 1.02 -0.45 -2.30 118.68 123.66 1me9 s LEU 380 Ca 0.04 -0.33 -0.00 0.00 0.02 0.00 0.00 54.13 53.85 1me9 s LEU 380 Cb -0.13 -0.68 -0.00 0.00 0.02 0.00 0.00 46.19 45.41 1me9 s LEU 380 CO 0.01 0.12 -0.00 0.61 0.02 0.00 0.00 176.35 177.10 1me9 n GLY 381 N 2.41 -0.18 0.25 -3.19 0.00 -1.26 -0.88 105.19 102.34 1me9 n GLY 381 Ca -0.16 -0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.88 1me9 n GLY 381 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1me9 h ARG 382 N -0.01 0.32 -0.57 1.61 2.43 -1.97 -0.96 114.38 115.22 1me9 h ARG 382 Ca 0.00 -0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.27 1me9 h ARG 382 Cb 0.01 -0.07 -0.10 0.00 -0.42 0.00 0.00 29.97 29.39 1me9 h ARG 382 CO 0.00 0.21 -0.07 -0.92 -1.51 0.00 0.00 179.97 177.69 1me9 h TYR 383 N 0.33 -0.16 0.00 2.20 3.20 -1.89 -2.12 116.97 118.53 1me9 h TYR 383 Ca 0.35 0.05 -0.10 0.00 3.14 0.00 0.00 58.73 62.17 1me9 h TYR 383 Cb 0.53 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1me9 h TYR 383 CO -0.22 -0.20 -0.51 0.74 -1.64 0.00 0.00 178.16 176.33 1me9 h PHE 384 N 0.06 0.00 -0.07 -3.82 0.04 -1.66 -3.31 116.94 108.17 1me9 h PHE 384 Ca 0.29 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.04 1me9 h PHE 384 Cb 0.45 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.60 1me9 h PHE 384 CO -0.41 0.46 -0.03 0.00 -0.60 0.00 0.00 178.31 177.74 1me9 h ALA 385 N 1.54 1.83 0.00 2.45 0.00 -0.49 -2.22 119.26 122.36 1me9 h ALA 385 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1me9 h ALA 385 Cb 1.36 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1me9 h ALA 385 CO 0.06 0.14 0.00 0.54 0.00 0.00 0.00 179.25 179.98 1me9 n ARG 386 N -4.44 0.13 -2.91 0.00 1.74 -1.16 -4.68 116.66 105.34 1me9 n ARG 386 Ca -0.02 0.45 -0.31 0.00 -0.77 0.00 0.00 57.85 57.20 1me9 n ARG 386 Cb 0.15 -1.80 -0.04 0.00 -1.02 0.00 0.00 32.46 29.75 1me9 n ARG 386 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1me9 s PHE 387 N -3.29 3.45 0.34 -1.55 0.08 -0.84 -1.21 117.98 114.97 1me9 s PHE 387 Ca 0.03 1.06 0.10 0.00 0.12 0.00 0.00 56.93 58.24 1me9 s PHE 387 Cb 0.08 -2.45 0.85 0.00 -0.57 0.00 0.00 43.02 40.93 1me9 s PHE 387 CO 0.29 -0.07 1.80 1.49 -0.10 0.00 0.00 175.22 178.64 1me9 h GLU 388 N 1.43 0.64 0.00 0.44 4.57 -1.21 -1.43 114.58 119.01 1me9 h GLU 388 Ca -0.47 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 1me9 h GLU 388 Cb 1.19 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1me9 h GLU 388 CO 0.64 0.42 0.00 0.39 -1.18 0.00 0.00 179.01 179.28 1me9 n GLU 389 N -4.68 0.03 -2.21 1.92 4.71 -1.26 -4.79 120.64 114.36 1me9 n GLU 389 Ca 0.22 0.16 -0.41 0.00 -0.01 0.00 0.00 57.16 57.13 1me9 n GLU 389 Cb 0.62 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.52 1me9 n GLU 389 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1me9 s SER 390 N -2.95 6.90 0.00 1.62 1.04 -0.54 -3.11 113.70 116.66 1me9 s SER 390 Ca 0.10 2.58 0.00 0.00 0.48 0.00 0.00 55.95 59.11 1me9 s SER 390 Cb 0.13 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.60 1me9 s SER 390 CO 0.34 -0.44 0.23 -0.81 0.98 0.00 0.00 173.24 173.55 1me9 n PRO 391 N 0.96 0.23 -2.95 4.02 -0.04 -1.26 -4.80 135.00 131.17 1me9 n PRO 391 Ca -0.00 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.28 1me9 n PRO 391 Cb 0.43 -1.00 0.02 0.00 -0.04 0.00 0.00 33.50 32.90 1me9 n PRO 391 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1me9 s THR 392 N -1.98 2.84 0.20 0.52 -4.23 -1.26 -5.02 115.64 106.71 1me9 s THR 392 Ca 0.00 -0.94 -0.28 0.00 -1.18 0.00 0.00 61.69 59.29 1me9 s THR 392 Cb 0.00 -2.90 -0.08 0.00 1.34 0.00 0.00 72.50 70.86 1me9 s THR 392 CO 0.00 0.00 0.86 -0.13 -0.54 0.00 0.00 174.62 174.81 1me9 s ARG 393 N -4.47 4.71 -0.40 3.99 0.52 -1.26 -4.88 118.95 117.16 1me9 s ARG 393 Ca 0.56 1.32 -0.23 0.00 -0.52 0.00 0.00 55.73 56.86 1me9 s ARG 393 Cb -0.09 -3.28 0.02 0.00 0.52 0.00 0.00 34.95 32.12 1me9 s ARG 393 CO 0.35 0.53 0.78 0.21 0.02 0.00 0.00 175.30 177.19 1me9 s LYS 394 N -1.11 3.62 -0.25 3.54 2.20 -1.26 -2.96 119.74 123.51 1me9 s LYS 394 Ca 0.39 0.14 -0.02 0.00 -0.36 0.00 0.00 55.97 56.12 1me9 s LYS 394 Cb -0.24 -3.86 0.02 0.00 -1.51 0.00 0.00 37.83 32.24 1me9 s LYS 394 CO 0.29 -0.96 -0.04 0.08 -0.36 0.00 0.00 175.35 174.36 1me9 s VAL 395 N 3.18 3.04 -0.60 4.02 1.01 0.55 -4.94 120.40 126.65 1me9 s VAL 395 Ca 0.31 -0.94 -0.28 0.00 0.00 0.00 0.00 61.98 61.06 1me9 s VAL 395 Cb -0.13 -2.53 0.03 0.00 0.00 0.00 0.00 36.38 33.75 1me9 s VAL 395 CO 0.19 0.20 1.20 -0.89 0.00 0.00 0.00 175.10 175.81 1me9 s THR 396 N 1.36 3.97 -0.36 3.92 2.01 -1.26 -0.59 115.64 124.68 1me9 s THR 396 Ca 0.01 0.82 -0.07 0.00 0.31 0.00 0.00 61.69 62.76 1me9 s THR 396 Cb -0.16 -4.76 0.05 0.00 0.01 0.00 0.00 72.50 67.64 1me9 s THR 396 CO -0.04 -1.42 0.15 -0.63 -0.69 0.00 0.00 174.62 172.00 1me9 s ILE 397 N 5.07 3.91 -1.24 1.82 1.01 0.75 -4.72 121.20 127.80 1me9 s ILE 397 Ca 0.42 -1.24 -0.07 0.00 0.00 0.00 0.00 60.65 59.76 1me9 s ILE 397 Cb -0.08 -3.28 -0.01 0.00 0.01 0.00 0.00 42.46 39.10 1me9 s ILE 397 CO 0.24 -0.29 0.71 -3.20 0.00 0.00 0.00 174.94 172.40 1me9 n ASN 398 N 4.83 -2.93 0.00 3.58 2.85 -1.26 -2.24 115.26 120.10 1me9 n ASN 398 Ca -0.11 -0.90 0.00 0.00 -0.11 0.00 0.00 54.58 53.46 1me9 n ASN 398 Cb 0.44 -3.83 0.00 0.00 1.24 0.00 0.00 39.78 37.63 1me9 n ASN 398 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1me9 n GLY 399 N -1.63 2.95 3.58 8.20 0.00 -1.26 -5.01 105.19 112.02 1me9 n GLY 399 Ca -0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 1me9 n GLY 399 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1me9 s SER 400 N -0.32 5.30 -0.07 1.61 0.01 -0.95 -5.08 113.70 114.21 1me9 s SER 400 Ca 0.00 -0.01 -0.29 0.00 1.31 0.00 0.00 55.95 56.96 1me9 s SER 400 Cb 0.00 -1.89 -0.02 0.00 0.21 0.00 0.00 66.02 64.32 1me9 s SER 400 CO 0.00 0.17 0.98 -0.69 0.41 0.00 0.00 173.24 174.10 1me9 s VAL 401 N 0.39 4.83 0.37 3.43 1.01 -1.26 -0.18 120.40 128.99 1me9 s VAL 401 Ca 0.00 2.01 0.04 0.00 0.00 0.00 0.00 61.98 64.03 1me9 s VAL 401 Cb -0.13 -4.30 -0.06 0.00 0.00 0.00 0.00 36.38 31.89 1me9 s VAL 401 CO 0.01 0.07 0.05 -0.04 0.00 0.00 0.00 175.10 175.20 1me9 s MET 402 N 1.59 1.81 0.03 2.72 -1.94 0.24 -1.44 119.30 122.31 1me9 s MET 402 Ca 0.49 -2.04 0.04 0.00 -1.71 0.00 0.00 55.69 52.47 1me9 s MET 402 Cb -0.19 -1.04 -0.02 0.00 2.01 0.00 0.00 34.83 35.59 1me9 s MET 402 CO 0.22 -0.22 -0.11 0.15 -0.01 0.00 0.00 175.02 175.04 1me9 s LYS 403 N -3.83 0.74 0.43 2.03 1.02 0.11 -0.33 119.74 119.91 1me9 s LYS 403 Ca 0.31 -0.65 -0.24 0.00 0.02 0.00 0.00 55.97 55.42 1me9 s LYS 403 Cb 0.07 -0.69 -0.08 0.00 -0.52 0.00 0.00 37.83 36.62 1me9 s LYS 403 CO 0.15 0.17 1.13 -1.21 -0.92 0.00 0.00 175.35 174.66 1me9 s GLU 404 N -1.06 3.93 -0.24 1.68 2.02 -1.16 -0.56 118.70 123.31 1me9 s GLU 404 Ca -0.01 1.70 -0.08 0.00 0.02 0.00 0.00 54.97 56.60 1me9 s GLU 404 Cb -0.07 -2.48 0.11 0.00 0.10 0.00 0.00 34.13 31.78 1me9 s GLU 404 CO 0.01 -0.39 0.51 -0.47 0.02 0.00 0.00 175.26 174.93 1me9 s TYR 405 N -1.57 -1.01 0.04 1.61 5.04 0.15 -4.83 117.35 116.78 1me9 s TYR 405 Ca 0.61 1.83 0.01 0.00 -2.44 0.00 0.00 57.07 57.08 1me9 s TYR 405 Cb -0.27 0.49 -0.03 0.00 0.35 0.00 0.00 41.96 42.51 1me9 s TYR 405 CO 0.33 -0.56 -0.06 1.67 -1.34 0.00 0.00 175.55 175.60 1me9 s TRP 406 N 2.72 0.54 0.60 4.97 -2.14 -1.26 0.01 118.94 124.37 1me9 s TRP 406 Ca -0.03 -0.59 -0.10 0.00 2.66 0.00 0.00 56.10 58.04 1me9 s TRP 406 Cb -0.12 -0.34 -0.04 0.00 -3.10 0.00 0.00 33.47 29.88 1me9 s TRP 406 CO -0.15 -0.15 0.99 0.20 -2.66 0.00 0.00 176.95 175.18 1me9 s GLY 407 N -1.76 1.63 0.36 3.67 0.00 -0.91 -4.65 107.32 105.65 1me9 s GLY 407 Ca -0.09 -0.19 0.27 0.00 0.00 0.00 0.00 44.72 44.71 1me9 s GLY 407 CO -0.01 0.07 1.81 0.83 0.00 0.00 0.00 173.10 175.79 1me9 h GLU 408 N -0.24 0.00 0.00 2.90 4.39 -1.93 -2.52 114.58 117.18 1me9 h GLU 408 Ca -0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 1me9 h GLU 408 Cb 1.20 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 1me9 h GLU 408 CO 0.62 0.00 -0.62 0.41 -1.16 0.00 0.00 179.01 178.26 1me9 n GLY 409 N -0.20 -1.30 3.78 -3.84 0.00 -1.26 -3.88 105.19 98.48 1me9 n GLY 409 Ca 0.01 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 1me9 n GLY 409 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1me9 s SER 410 N -3.55 5.54 0.49 1.61 1.04 -0.95 -3.36 113.70 114.51 1me9 s SER 410 Ca 0.08 2.05 0.14 0.00 0.48 0.00 0.00 55.95 58.71 1me9 s SER 410 Cb 0.16 -2.56 1.15 0.00 0.10 0.00 0.00 66.02 64.87 1me9 s SER 410 CO 0.72 -1.34 2.10 0.77 0.98 0.00 0.00 173.24 176.48 1me9 h SER 411 N 0.70 0.07 0.01 7.02 4.64 -1.89 -1.07 113.55 123.02 1me9 h SER 411 Ca -0.48 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1me9 h SER 411 Cb 1.25 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1me9 h SER 411 CO 0.56 0.09 0.00 -1.14 -0.87 0.00 0.00 176.83 175.47 1me9 n ARG 412 N -4.48 0.04 0.00 4.77 0.63 -1.26 -3.60 116.66 112.76 1me9 n ARG 412 Ca -0.02 0.11 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 1me9 n ARG 412 Cb 0.12 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.53 1me9 n ARG 412 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1me9 n ALA 413 N -1.11 1.58 0.17 5.13 0.00 -0.57 -4.91 120.51 120.80 1me9 n ALA 413 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.48 1me9 n ALA 413 Cb 0.01 0.00 0.38 0.00 0.00 0.00 0.00 19.45 19.84 1me9 n ALA 413 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1me9 h ARG 414 N 0.00 0.06 -3.47 0.00 0.11 -1.30 -3.27 114.38 106.50 1me9 h ARG 414 Ca 0.00 -0.02 -0.72 0.00 0.10 0.00 0.00 59.98 59.34 1me9 h ARG 414 Cb 0.00 -0.01 -0.07 0.00 1.11 0.00 0.00 29.97 31.01 1me9 h ARG 414 CO 0.00 0.36 2.89 0.09 0.10 0.00 0.00 179.97 183.41 1me9 n ASN 415 N -4.17 5.77 -1.32 0.08 3.02 -1.24 -5.09 115.26 112.31 1me9 n ASN 415 Ca -0.02 -2.90 0.10 0.00 -0.03 0.00 0.00 54.58 51.73 1me9 n ASN 415 Cb 0.36 -1.55 0.31 0.00 -0.61 0.00 0.00 39.78 38.29 1me9 n ASN 415 CO 0.00 0.00 0.00 1.87 -2.62 0.00 0.00 177.26 176.51 1me9 n TRP 416 N 4.38 1.14 -0.14 3.10 -0.00 -1.24 -5.06 117.44 119.62 1me9 n TRP 416 Ca 0.56 -0.58 0.00 0.00 -0.00 0.00 0.00 57.50 57.48 1me9 n TRP 416 Cb 0.33 -0.14 0.00 0.00 -0.00 0.00 0.00 31.31 31.50 1me9 n TRP 416 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 177.69 179.66 1me9 n PHE 429 N 1.09 0.00 -4.48 5.87 1.16 -1.26 -5.04 117.46 114.80 1me9 n PHE 429 Ca 0.23 0.00 -0.23 0.00 -1.87 0.00 0.00 57.45 55.58 1me9 n PHE 429 Cb 0.74 -0.01 -0.11 0.00 -1.61 0.00 0.00 39.48 38.49 1me9 n PHE 429 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 1me9 s GLU 430 N -0.51 1.68 -0.05 3.97 2.12 -1.26 -5.07 118.70 119.58 1me9 s GLU 430 Ca 0.00 -1.91 0.16 0.00 0.36 0.00 0.00 54.97 53.57 1me9 s GLU 430 Cb 0.00 -1.13 0.29 0.00 0.26 0.00 0.00 34.13 33.55 1me9 s GLU 430 CO 0.00 -0.08 1.13 0.39 -0.54 0.00 0.00 175.26 176.16 1me9 n GLU 431 N -0.71 0.38 -3.92 4.30 1.02 -1.26 -4.98 120.64 115.48 1me9 n GLU 431 Ca -0.04 -1.99 -0.02 0.00 -0.02 0.00 0.00 57.16 55.10 1me9 n GLU 431 Cb 0.66 -0.55 0.02 0.00 -0.02 0.00 0.00 31.44 31.54 1me9 n GLU 431 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1me9 s GLY 432 N -2.01 0.07 0.06 0.62 0.00 -1.21 -3.84 107.32 101.01 1me9 s GLY 432 Ca 0.25 -0.27 0.03 0.00 0.00 0.00 0.00 44.72 44.73 1me9 s GLY 432 CO -0.09 3.33 -0.09 -1.34 0.00 0.00 0.00 173.10 174.91 1me9 s VAL 433 N -2.09 0.72 -0.10 1.40 -7.23 -1.26 -4.73 120.40 107.11 1me9 s VAL 433 Ca 0.24 -1.24 0.04 0.00 -1.81 0.00 0.00 61.98 59.21 1me9 s VAL 433 Cb -0.02 -0.86 -0.00 0.00 0.56 0.00 0.00 36.38 36.06 1me9 s VAL 433 CO 0.04 -0.40 -0.23 -0.62 -0.31 0.00 0.00 175.10 173.58 1me9 s ASP 434 N -1.80 3.17 0.04 4.85 -1.08 -1.26 -2.14 116.67 118.45 1me9 s ASP 434 Ca -0.05 -0.53 -0.01 0.00 -0.52 0.00 0.00 52.55 51.44 1me9 s ASP 434 Cb -0.08 -1.38 0.00 0.00 -1.46 0.00 0.00 42.92 40.00 1me9 s ASP 434 CO 0.00 0.17 0.07 -1.54 0.52 0.00 0.00 175.17 174.39 1me9 n SER 435 N 3.47 -0.19 -4.24 -0.34 3.41 0.10 -5.00 113.62 110.83 1me9 n SER 435 Ca -0.19 -1.20 -0.24 0.00 -0.26 0.00 0.00 58.87 56.98 1me9 n SER 435 Cb 0.53 0.34 -0.13 0.00 -0.26 0.00 0.00 64.21 64.69 1me9 n SER 435 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1me9 s TYR 436 N -6.23 1.71 0.01 7.33 2.02 -1.26 -0.68 117.35 120.25 1me9 s TYR 436 Ca 0.03 -0.39 0.06 0.00 -0.37 0.00 0.00 57.07 56.40 1me9 s TYR 436 Cb -0.00 -0.99 -0.02 0.00 -0.40 0.00 0.00 41.96 40.55 1me9 s TYR 436 CO 0.02 0.12 -0.19 0.14 -1.57 0.00 0.00 175.55 174.07 1me9 s VAL 437 N -0.93 1.48 0.26 0.71 -7.23 0.27 -4.90 120.40 110.06 1me9 s VAL 437 Ca 0.06 -0.97 -0.30 0.00 -1.81 0.00 0.00 61.98 58.96 1me9 s VAL 437 Cb -0.09 -1.27 -0.11 0.00 0.56 0.00 0.00 36.38 35.47 1me9 s VAL 437 CO 0.02 0.28 1.56 -2.16 -0.31 0.00 0.00 175.10 174.50 1me9 s PRO 438 N -0.80 4.17 0.21 4.82 0.04 -1.26 0.05 135.00 142.22 1me9 s PRO 438 Ca 0.07 2.48 -0.31 0.00 0.04 0.00 0.00 61.00 63.28 1me9 s PRO 438 Cb -0.08 -3.07 -0.11 0.00 0.04 0.00 0.00 34.50 31.29 1me9 s PRO 438 CO 0.00 -0.58 1.58 -0.47 0.04 0.00 0.00 177.00 177.57 1me9 s TYR 439 N 0.23 2.98 -0.62 0.56 5.04 -0.52 -4.69 117.35 120.32 1me9 s TYR 439 Ca 0.64 0.68 0.05 0.00 -2.44 0.00 0.00 57.07 56.00 1me9 s TYR 439 Cb -0.46 -3.97 0.05 0.00 0.35 0.00 0.00 41.96 37.94 1me9 s TYR 439 CO 0.43 -3.46 0.71 0.00 -1.34 0.00 0.00 175.55 171.89 1me9 n ALA 440 N 3.39 2.45 0.00 3.97 0.00 -0.35 -5.00 120.51 124.97 1me9 n ALA 440 Ca 0.12 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1me9 n ALA 440 Cb 0.38 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.65 1me9 n ALA 440 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1me9 n GLY 441 N 0.26 -0.86 3.78 0.00 0.00 -1.25 -4.88 105.19 102.23 1me9 n GLY 441 Ca 0.03 -1.54 -0.37 0.00 0.00 0.00 0.00 46.02 44.14 1me9 n GLY 441 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1me9 s LYS 442 N 0.00 4.18 0.16 1.61 -0.14 -1.26 -0.67 119.74 123.63 1me9 s LYS 442 Ca 0.00 1.59 -0.18 0.00 -1.36 0.00 0.00 55.97 56.02 1me9 s LYS 442 Cb 0.00 -2.62 0.09 0.00 -1.68 0.00 0.00 37.83 33.62 1me9 s LYS 442 CO 0.00 -0.14 1.66 1.25 -0.76 0.00 0.00 175.35 177.36 1me9 h LEU 443 N 2.64 -0.44 -0.77 3.17 6.46 -1.93 -3.27 115.31 121.16 1me9 h LEU 443 Ca -0.48 0.12 0.07 0.00 -0.12 0.00 0.00 57.88 57.48 1me9 h LEU 443 Cb 1.22 0.27 -0.10 0.00 -0.73 0.00 0.00 40.66 41.32 1me9 h LEU 443 CO 0.63 -0.16 -0.55 0.50 -0.62 0.00 0.00 178.44 178.24 1me9 h LYS 444 N -0.04 -0.11 -0.58 1.25 3.64 -1.93 -0.81 116.57 117.98 1me9 h LYS 444 Ca 0.19 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1me9 h LYS 444 Cb 0.32 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 1me9 h LYS 444 CO -0.41 -0.07 0.33 -0.44 -2.27 0.00 0.00 179.45 176.58 1me9 h ASP 445 N -0.12 0.70 -0.17 4.20 3.32 -1.98 -1.40 116.42 120.99 1me9 h ASP 445 Ca 0.12 -0.05 -0.19 0.00 0.02 0.00 0.00 57.03 56.94 1me9 h ASP 445 Cb 0.44 -0.18 0.01 0.00 0.22 0.00 0.00 39.33 39.82 1me9 h ASP 445 CO -0.78 0.56 -0.63 0.78 -1.72 0.00 0.00 179.24 177.45 1me9 h ASN 446 N 0.81 0.84 -0.43 6.45 2.35 -1.49 -2.27 115.58 121.84 1me9 h ASN 446 Ca 0.21 -0.61 -0.08 0.00 -0.55 0.00 0.00 56.30 55.26 1me9 h ASN 446 Cb 0.01 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 1me9 h ASN 446 CO -0.04 1.31 -0.05 0.58 -1.65 0.00 0.00 177.43 177.58 1me9 h VAL 447 N 0.43 1.27 -0.47 2.81 2.07 -0.98 -0.59 116.25 120.78 1me9 h VAL 447 Ca -0.03 -1.13 0.02 0.00 0.82 0.00 0.00 66.70 66.37 1me9 h VAL 447 Cb 1.26 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 32.12 1me9 h VAL 447 CO 0.13 0.39 0.29 -0.08 0.02 0.00 0.00 177.57 178.32 1me9 h GLU 448 N 0.64 0.57 -0.22 1.57 4.81 -1.29 0.46 114.58 121.12 1me9 h GLU 448 Ca 0.12 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1me9 h GLU 448 Cb 0.57 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1me9 h GLU 448 CO 0.03 0.38 0.10 0.00 -0.73 0.00 0.00 179.01 178.79 1me9 h ALA 449 N 1.20 0.28 -0.22 2.92 0.00 -1.23 -0.93 119.26 121.29 1me9 h ALA 449 Ca 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1me9 h ALA 449 Cb -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1me9 h ALA 449 CO -0.07 -0.15 0.14 0.77 0.00 0.00 0.00 179.25 179.94 1me9 h SER 450 N 0.22 0.24 0.93 0.00 0.02 -0.78 -2.80 113.55 111.38 1me9 h SER 450 Ca 0.07 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1me9 h SER 450 Cb 0.13 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1me9 h SER 450 CO -0.01 0.17 -0.16 -0.07 -1.14 0.00 0.00 176.83 175.62 1me9 h LEU 451 N 0.29 0.00 -0.62 5.07 3.38 -0.82 -2.34 115.31 120.26 1me9 h LEU 451 Ca 0.08 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 1me9 h LEU 451 Cb -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1me9 h LEU 451 CO -0.02 0.16 -0.34 0.78 0.09 0.00 0.00 178.44 179.12 1me9 h ASN 452 N 0.00 0.75 0.09 -0.43 2.35 -0.91 -0.83 115.58 116.60 1me9 h ASN 452 Ca -0.00 -0.31 -0.17 0.00 -0.55 0.00 0.00 56.30 55.27 1me9 h ASN 452 Cb 0.67 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 1me9 h ASN 452 CO 0.02 1.02 -0.60 0.11 -1.65 0.00 0.00 177.43 176.33 1me9 h LYS 453 N 0.60 0.51 -0.21 0.81 1.57 -1.25 -1.25 116.57 117.35 1me9 h LYS 453 Ca 0.06 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 1me9 h LYS 453 Cb 0.86 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1me9 h LYS 453 CO 0.07 0.96 0.03 0.28 -0.57 0.00 0.00 179.45 180.23 1me9 h VAL 454 N 0.38 1.23 -0.73 0.50 2.07 -1.26 -0.66 116.25 117.77 1me9 h VAL 454 Ca -0.00 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.78 1me9 h VAL 454 Cb 1.15 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 1me9 h VAL 454 CO 0.11 0.23 0.48 0.11 0.02 0.00 0.00 177.57 178.52 1me9 h LYS 455 N 0.14 0.94 -0.35 1.57 1.57 -1.09 0.17 116.57 119.53 1me9 h LYS 455 Ca 0.06 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1me9 h LYS 455 Cb 0.32 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1me9 h LYS 455 CO 0.00 0.62 0.14 1.03 -0.57 0.00 0.00 179.45 180.67 1me9 h SER 456 N 0.97 0.48 -0.64 0.86 0.87 -1.09 -1.70 113.55 113.31 1me9 h SER 456 Ca 0.27 -0.17 -0.06 0.00 -1.23 0.00 0.00 61.79 60.60 1me9 h SER 456 Cb -0.09 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 61.72 1me9 h SER 456 CO -0.07 0.52 0.18 0.74 -0.53 0.00 0.00 176.83 177.67 1me9 h THR 457 N 0.41 1.25 -0.82 2.23 2.02 -0.73 -2.26 112.91 115.01 1me9 h THR 457 Ca 0.11 -0.89 0.04 0.00 0.77 0.00 0.00 66.41 66.44 1me9 h THR 457 Cb 0.19 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 67.09 1me9 h THR 457 CO -0.01 0.34 0.52 0.24 0.37 0.00 0.00 175.52 176.98 1me9 h MET 458 N 0.99 0.96 0.00 6.66 2.07 -0.27 -0.88 114.93 124.46 1me9 h MET 458 Ca 0.21 -0.06 -0.07 0.00 -2.07 0.00 0.00 59.70 57.72 1me9 h MET 458 Cb 0.32 -0.22 -0.01 0.00 -1.87 0.00 0.00 31.60 29.82 1me9 h MET 458 CO -0.00 0.63 -0.32 0.00 1.07 0.00 0.00 176.91 178.29 1me9 h ASN 460 N 0.00 0.12 -0.24 0.00 4.21 -0.63 -2.02 115.58 117.03 1me9 h ASN 460 Ca -0.00 -0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.47 1me9 h ASN 460 Cb 0.58 -0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.74 1me9 h ASN 460 CO 0.04 0.39 0.00 0.00 -1.29 0.00 0.00 177.43 176.58 1me9 n GLY 462 N 1.14 0.06 3.17 0.00 0.00 -0.76 -4.41 105.19 104.40 1me9 n GLY 462 Ca 0.15 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.41 1me9 n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1me9 s ALA 463 N -2.58 1.88 -0.78 4.61 0.00 -0.09 -4.92 121.76 119.87 1me9 s ALA 463 Ca 0.05 -0.82 0.20 0.00 0.00 0.00 0.00 51.96 51.39 1me9 s ALA 463 Cb -0.02 -0.69 -0.24 0.00 0.00 0.00 0.00 23.12 22.16 1me9 s ALA 463 CO 0.06 0.27 0.79 1.28 0.00 0.00 0.00 175.76 178.16 1me9 n LEU 464 N 3.45 0.78 -4.06 0.00 7.99 -1.26 -3.77 117.00 120.12 1me9 n LEU 464 Ca -0.20 -0.40 -0.09 0.00 -0.01 0.00 0.00 56.01 55.31 1me9 n LEU 464 Cb 0.53 0.00 -0.09 0.00 -0.11 0.00 0.00 43.42 43.75 1me9 n LEU 464 CO 0.27 0.19 -0.21 0.42 -1.51 0.00 0.00 177.39 176.55 1me9 s THR 465 N -3.03 0.11 0.15 -5.08 -4.23 -1.26 -0.49 115.64 101.80 1me9 s THR 465 Ca 0.05 -1.67 -0.15 0.00 -1.18 0.00 0.00 61.69 58.73 1me9 s THR 465 Cb 0.15 -1.84 0.02 0.00 1.34 0.00 0.00 72.50 72.17 1me9 s THR 465 CO 0.85 -0.51 1.73 0.40 -0.54 0.00 0.00 174.62 176.55 1me9 h ILE 466 N 2.80 1.18 -0.66 2.99 2.04 -1.84 -0.90 117.51 123.13 1me9 h ILE 466 Ca -0.34 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.01 1me9 h ILE 466 Cb 1.20 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 1me9 h ILE 466 CO 0.57 0.20 0.40 -0.65 0.00 0.00 0.00 178.15 178.67 1me9 h PRO 467 N 0.59 0.88 -0.19 2.37 0.11 -1.93 0.05 132.00 133.88 1me9 h PRO 467 Ca 0.16 -0.07 -0.12 0.00 0.11 0.00 0.00 66.00 66.07 1me9 h PRO 467 Cb 0.11 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 1me9 h PRO 467 CO -0.02 0.62 -0.40 0.37 -0.21 0.00 0.00 178.00 178.35 1me9 h GLN 468 N 0.90 0.45 -0.50 1.05 4.15 -1.87 -2.13 115.11 117.16 1me9 h GLN 468 Ca 0.24 -0.22 -0.12 0.00 0.77 0.00 0.00 58.65 59.31 1me9 h GLN 468 Cb -0.05 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1me9 h GLN 468 CO -0.05 0.78 -0.18 1.25 -1.93 0.00 0.00 178.83 178.70 1me9 h LEU 469 N 0.37 1.01 -1.45 -2.39 5.85 -0.31 -0.31 115.31 118.09 1me9 h LEU 469 Ca 0.03 -0.36 -0.06 0.00 0.84 0.00 0.00 57.88 58.33 1me9 h LEU 469 Cb 0.87 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 1me9 h LEU 469 CO 0.07 1.16 -0.27 1.56 -0.34 0.00 0.00 178.44 180.62 1me9 h GLN 470 N 0.87 0.00 0.18 1.25 4.20 -0.78 0.57 115.11 121.41 1me9 h GLN 470 Ca 0.12 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.52 1me9 h GLN 470 Cb 0.75 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.54 1me9 h GLN 470 CO 0.06 0.27 -1.52 1.03 -0.67 0.00 0.00 178.83 178.00 1me9 h SER 471 N 0.00 0.60 0.29 1.46 0.87 -1.13 -3.40 113.55 112.25 1me9 h SER 471 Ca -0.00 -0.92 0.00 0.00 -1.23 0.00 0.00 61.79 59.64 1me9 h SER 471 Cb 0.56 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1me9 h SER 471 CO 0.03 1.70 -1.08 0.29 -0.53 0.00 0.00 176.83 177.24 1me9 n LYS 472 N -3.75 0.24 -1.69 2.24 5.02 -0.15 -5.00 118.16 115.07 1me9 n LYS 472 Ca -0.22 -0.02 -0.43 0.00 -2.02 0.00 0.00 58.31 55.62 1me9 n LYS 472 Cb 1.02 -1.56 -0.01 0.00 -0.02 0.00 0.00 35.03 34.46 1me9 n LYS 472 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1me9 n ALA 473 N -1.77 1.27 -3.64 7.82 0.00 0.18 -4.97 120.51 119.40 1me9 n ALA 473 Ca 0.02 0.37 -0.35 0.00 0.00 0.00 0.00 53.44 53.48 1me9 n ALA 473 Cb 0.42 -2.25 -0.14 0.00 0.00 0.00 0.00 19.45 17.48 1me9 n ALA 473 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1me9 s LYS 474 N -1.75 2.52 -0.18 0.00 1.02 -1.26 -5.05 119.74 115.04 1me9 s LYS 474 Ca 0.56 -1.20 -0.01 0.00 0.02 0.00 0.00 55.97 55.35 1me9 s LYS 474 Cb -0.58 -3.15 0.00 0.00 -0.52 0.00 0.00 37.83 33.58 1me9 s LYS 474 CO 0.61 -0.57 -0.13 0.42 -0.92 0.00 0.00 175.35 174.76 1me9 s ILE 475 N 1.27 2.73 0.03 2.17 1.01 -1.26 -1.06 121.20 126.10 1me9 s ILE 475 Ca -0.04 -0.73 0.07 0.00 0.00 0.00 0.00 60.65 59.95 1me9 s ILE 475 Cb -0.19 -2.18 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 1me9 s ILE 475 CO -0.02 0.50 -0.18 0.28 0.00 0.00 0.00 174.94 175.52 1me9 s THR 476 N 1.11 2.79 0.33 2.92 -1.32 -0.56 -4.98 115.64 115.92 1me9 s THR 476 Ca 0.00 -1.12 -0.15 0.00 -1.21 0.00 0.00 61.69 59.21 1me9 s THR 476 Cb -0.14 -2.15 -0.09 0.00 -1.51 0.00 0.00 72.50 68.60 1me9 s THR 476 CO -0.04 0.38 0.75 -0.22 -2.21 0.00 0.00 174.62 173.28 1me9 s LEU 477 N -1.31 4.06 0.22 9.08 2.96 -1.26 -1.16 118.68 131.26 1me9 s LEU 477 Ca 0.14 1.30 0.11 0.00 -0.22 0.00 0.00 54.13 55.46 1me9 s LEU 477 Cb -0.10 -4.10 -0.04 0.00 0.50 0.00 0.00 46.19 42.44 1me9 s LEU 477 CO 0.04 -0.21 -0.18 0.68 -1.32 0.00 0.00 176.35 175.36 1me9 s VAL 478 N -2.00 2.66 0.65 1.68 -7.23 -0.03 -4.90 120.40 111.23 1me9 s VAL 478 Ca 0.55 -2.02 -0.15 0.00 -1.81 0.00 0.00 61.98 58.54 1me9 s VAL 478 Cb -0.10 -2.32 -0.01 0.00 0.56 0.00 0.00 36.38 34.51 1me9 s VAL 478 CO 0.17 -0.20 1.11 -0.94 -0.31 0.00 0.00 175.10 174.93 1me9 s SER 479 N -2.98 5.18 0.29 4.85 1.04 -1.26 -4.91 113.70 115.91 1me9 s SER 479 Ca 0.25 2.01 -0.02 0.00 0.48 0.00 0.00 55.95 58.67 1me9 s SER 479 Cb -0.07 -2.55 0.42 0.00 0.10 0.00 0.00 66.02 63.91 1me9 s SER 479 CO 0.13 -1.58 1.89 0.77 0.98 0.00 0.00 173.24 175.43 1me9 h SER 480 N 0.15 0.85 -0.93 7.02 4.64 -1.99 -2.67 113.55 120.63 1me9 h SER 480 Ca -0.47 -0.09 0.01 0.00 -0.47 0.00 0.00 61.79 60.77 1me9 h SER 480 Cb 1.25 -0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 63.07 1me9 h SER 480 CO 0.54 0.73 0.62 0.58 -0.87 0.00 0.00 176.83 178.43 1me9 h VAL 481 N 0.94 1.22 0.00 0.95 2.07 -2.06 -1.82 116.25 117.55 1me9 h VAL 481 Ca 0.23 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1me9 h VAL 481 Cb 0.10 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.74 1me9 h VAL 481 CO -0.03 0.23 0.00 0.77 0.02 0.00 0.00 177.57 178.56 1me9 h SER 482 N 1.25 0.00 -0.01 0.57 4.64 -1.85 -3.56 113.55 114.59 1me9 h SER 482 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 1me9 h SER 482 Cb -0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1me9 h SER 482 CO -0.08 0.00 0.00 -0.38 -0.87 0.00 0.00 176.83 175.50