#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x10 n LYS 27 N 0.00 0.74 -4.13 0.00 4.76 -1.26 -4.86 118.16 113.41 2x10 n LYS 27 Ca 0.00 0.26 -0.18 0.00 -2.87 0.00 0.00 58.31 55.52 2x10 n LYS 27 Cb 0.00 -1.49 -0.16 0.00 -1.84 0.00 0.00 35.03 31.54 2x10 n LYS 27 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2x10 s GLU 28 N -1.18 0.64 -0.25 1.97 2.02 -1.26 -2.42 118.70 118.22 2x10 s GLU 28 Ca 0.63 -0.09 -0.10 0.00 0.02 0.00 0.00 54.97 55.43 2x10 s GLU 28 Cb -0.82 -0.67 -0.05 0.00 0.10 0.00 0.00 34.13 32.68 2x10 s GLU 28 CO 0.58 -0.04 0.16 0.08 0.02 0.00 0.00 175.26 176.05 2x10 s VAL 29 N 0.70 5.31 -0.06 2.63 1.01 -0.48 -4.95 120.40 124.55 2x10 s VAL 29 Ca -0.09 0.16 -0.18 0.00 0.00 0.00 0.00 61.98 61.88 2x10 s VAL 29 Cb -0.12 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 2x10 s VAL 29 CO -0.00 0.33 0.48 -0.69 0.00 0.00 0.00 175.10 175.22 2x10 s VAL 30 N 1.19 5.08 -0.11 2.92 1.01 -1.26 -1.45 120.40 127.78 2x10 s VAL 30 Ca 0.07 0.98 0.15 0.00 0.00 0.00 0.00 61.98 63.18 2x10 s VAL 30 Cb -0.14 -3.81 -0.22 0.00 0.00 0.00 0.00 36.38 32.21 2x10 s VAL 30 CO 0.06 0.42 0.17 0.18 0.00 0.00 0.00 175.10 175.92 2x10 n LEU 31 N 2.97 0.00 -3.66 3.92 4.77 0.66 -4.98 117.00 120.69 2x10 n LEU 31 Ca -0.09 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.82 2x10 n LEU 31 Cb 0.52 0.25 -0.08 0.00 -2.33 0.00 0.00 43.42 41.78 2x10 n LEU 31 CO 0.42 0.25 0.18 -0.22 -1.33 0.00 0.00 177.39 176.69 2x10 s LEU 32 N -4.81 -0.73 -0.31 2.23 2.96 -1.15 -4.82 118.68 112.06 2x10 s LEU 32 Ca -0.07 1.26 -0.00 0.00 -0.22 0.00 0.00 54.13 55.09 2x10 s LEU 32 Cb 0.07 1.87 0.10 0.00 0.50 0.00 0.00 46.19 48.73 2x10 s LEU 32 CO 0.67 -0.22 0.09 -0.62 -1.32 0.00 0.00 176.35 174.94 2x10 s ASP 33 N 2.14 4.07 0.20 3.68 2.15 -1.26 -1.93 116.67 125.72 2x10 s ASP 33 Ca -0.07 -1.65 -0.11 0.00 0.43 0.00 0.00 52.55 51.14 2x10 s ASP 33 Cb -0.09 -0.93 0.15 0.00 -0.30 0.00 0.00 42.92 41.75 2x10 s ASP 33 CO -0.16 -0.41 1.84 0.15 -0.17 0.00 0.00 175.17 176.42 2x10 h PHE 34 N 8.05 0.76 -0.23 -5.34 3.57 -1.83 -3.14 116.94 118.78 2x10 h PHE 34 Ca -0.13 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.45 2x10 h PHE 34 Cb 1.02 -0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.45 2x10 h PHE 34 CO 0.37 0.45 -0.13 0.00 -2.23 0.00 0.00 178.31 176.77 2x10 h ALA 35 N 1.27 0.06 -0.63 2.41 0.00 -1.80 -2.35 119.26 118.22 2x10 h ALA 35 Ca 0.25 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.26 2x10 h ALA 35 Cb -0.01 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2x10 h ALA 35 CO -0.09 -0.54 0.41 0.00 0.00 0.00 0.00 179.25 179.03 2x10 h ALA 36 N 1.08 0.80 -1.96 0.00 0.00 -1.96 -3.47 119.26 113.74 2x10 h ALA 36 Ca 0.13 -0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.14 2x10 h ALA 36 Cb 0.30 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 2x10 h ALA 36 CO -0.30 0.24 -0.39 0.00 0.00 0.00 0.00 179.25 178.79 2x10 n ALA 37 N -2.27 -2.60 0.00 0.00 0.00 -0.89 -5.17 120.51 109.58 2x10 n ALA 37 Ca 0.05 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2x10 n ALA 37 Cb 0.02 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.58 2x10 n ALA 37 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2x10 n LEU 41 N -3.04 0.00 -4.24 0.00 -0.00 -1.26 -5.14 117.00 103.31 2x10 n LEU 41 Ca -0.02 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.57 2x10 n LEU 41 Cb 0.51 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.85 2x10 n LEU 41 CO 0.01 0.00 -0.01 -0.83 -0.00 0.00 0.00 177.39 176.56 2x10 s GLY 42 N 0.00 2.03 0.93 1.47 0.00 -1.26 -5.09 107.32 105.41 2x10 s GLY 42 Ca 0.00 -2.45 -0.13 0.00 0.00 0.00 0.00 44.72 42.14 2x10 s GLY 42 CO 0.00 1.09 1.15 -0.98 0.00 0.00 0.00 173.10 174.36 2x10 s TRP 43 N 1.42 2.31 -0.13 1.90 0.51 -1.26 -5.00 118.94 118.70 2x10 s TRP 43 Ca 0.05 0.78 -0.28 0.00 -2.12 0.00 0.00 56.10 54.53 2x10 s TRP 43 Cb -0.26 -3.45 -0.01 0.00 -0.81 0.00 0.00 33.47 28.93 2x10 s TRP 43 CO 0.01 -2.48 0.93 -1.17 -0.51 0.00 0.00 176.95 173.73 2x10 s LEU 44 N -6.07 4.22 0.05 2.99 0.20 -1.05 -4.93 118.68 114.09 2x10 s LEU 44 Ca 0.65 1.39 0.00 0.00 0.69 0.00 0.00 54.13 56.86 2x10 s LEU 44 Cb -0.13 -3.42 -0.04 0.00 -0.43 0.00 0.00 46.19 42.17 2x10 s LEU 44 CO 0.53 -0.42 0.17 0.42 -0.29 0.00 0.00 176.35 176.77 2x10 s THR 45 N 2.01 5.17 -0.23 3.68 -4.23 -1.26 -1.49 115.64 119.29 2x10 s THR 45 Ca 0.44 -0.45 -0.08 0.00 -1.18 0.00 0.00 61.69 60.42 2x10 s THR 45 Cb -0.18 -3.50 0.10 0.00 1.34 0.00 0.00 72.50 70.27 2x10 s THR 45 CO 0.16 0.17 0.49 -2.28 -0.54 0.00 0.00 174.62 172.62 2x10 s HIS 46 N -1.45 -0.97 0.60 3.99 5.04 -0.59 -3.88 115.29 118.04 2x10 s HIS 46 Ca 0.32 1.77 -0.14 0.00 -1.54 0.00 0.00 55.06 55.47 2x10 s HIS 46 Cb -0.13 0.46 -0.04 0.00 0.04 0.00 0.00 32.58 32.92 2x10 s HIS 46 CO 0.25 -0.54 1.04 -2.14 -2.34 0.00 0.00 174.74 171.01 2x10 s PRO 47 N 2.69 3.43 0.34 2.88 0.02 -1.26 -0.91 135.00 142.18 2x10 s PRO 47 Ca -0.03 1.03 -0.28 0.00 0.02 0.00 0.00 61.00 61.75 2x10 s PRO 47 Cb -0.12 -2.05 -0.09 0.00 0.02 0.00 0.00 34.50 32.25 2x10 s PRO 47 CO -0.15 -0.71 1.22 0.71 -0.33 0.00 0.00 177.00 177.74 2x10 s TYR 48 N -2.71 3.16 0.00 6.54 2.02 -1.25 -4.21 117.35 120.90 2x10 s TYR 48 Ca 0.60 1.52 0.00 0.00 -0.37 0.00 0.00 57.07 58.83 2x10 s TYR 48 Cb -0.13 -3.50 0.00 0.00 -0.40 0.00 0.00 41.96 37.92 2x10 s TYR 48 CO 0.41 -1.41 0.00 0.41 -1.57 0.00 0.00 175.55 173.40 2x10 n GLY 49 N 0.84 0.86 3.57 0.71 0.00 -1.26 -4.99 105.19 104.93 2x10 n GLY 49 Ca 0.01 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 44.98 2x10 n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x10 s LYS 50 N 0.00 -0.06 1.78 1.61 0.00 -1.26 -4.79 119.74 117.03 2x10 s LYS 50 Ca 0.00 1.14 0.00 0.00 0.00 0.00 0.00 55.97 57.11 2x10 s LYS 50 Cb 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 37.83 36.20 2x10 s LYS 50 CO 0.00 -3.23 0.00 0.41 0.00 0.00 0.00 175.35 172.53 2x10 n GLY 51 N 0.49 0.06 3.63 0.59 0.00 -1.26 -4.56 105.19 104.13 2x10 n GLY 51 Ca 0.07 -1.39 -0.39 0.00 0.00 0.00 0.00 46.02 44.31 2x10 n GLY 51 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2x10 n TRP 52 N 2.03 1.14 -3.65 1.61 7.02 -1.26 -4.59 117.44 119.74 2x10 n TRP 52 Ca 0.00 0.48 -0.06 0.00 -1.02 0.00 0.00 57.50 56.90 2x10 n TRP 52 Cb 0.00 -2.20 -0.07 0.00 -2.42 0.00 0.00 31.31 26.62 2x10 n TRP 52 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 2x10 s ASP 53 N -0.99 -0.90 0.98 -0.99 2.15 -0.19 -4.84 116.67 111.89 2x10 s ASP 53 Ca 0.70 1.42 -0.11 0.00 0.43 0.00 0.00 52.55 54.99 2x10 s ASP 53 Cb -0.47 1.59 0.18 0.00 -0.30 0.00 0.00 42.92 43.93 2x10 s ASP 53 CO 0.52 -0.23 1.10 -0.22 -0.17 0.00 0.00 175.17 176.17 2x10 s LEU 54 N 2.08 2.14 -0.26 -1.34 2.96 -1.26 -1.63 118.68 121.36 2x10 s LEU 54 Ca -0.08 1.86 -0.26 0.00 -0.22 0.00 0.00 54.13 55.42 2x10 s LEU 54 Cb -0.08 -4.11 0.15 0.00 0.50 0.00 0.00 46.19 42.65 2x10 s LEU 54 CO -0.18 -3.32 1.18 -1.10 -1.32 0.00 0.00 176.35 171.61 2x10 s GLN 56 N -4.65 0.34 0.02 1.98 -0.21 -1.26 -4.93 119.66 110.96 2x10 s GLN 56 Ca 0.66 0.29 0.00 0.00 0.02 0.00 0.00 55.36 56.34 2x10 s GLN 56 Cb -0.22 0.16 -0.00 0.00 1.00 0.00 0.00 33.01 33.95 2x10 s GLN 56 CO 0.60 -0.06 0.01 0.09 -2.12 0.00 0.00 175.29 173.80 2x10 n ASN 57 N 1.56 1.08 -4.23 5.90 3.02 -0.96 -5.00 115.26 116.63 2x10 n ASN 57 Ca -0.10 -1.11 -0.15 0.00 -0.03 0.00 0.00 54.58 53.19 2x10 n ASN 57 Cb 0.57 0.05 -0.11 0.00 -0.61 0.00 0.00 39.78 39.68 2x10 n ASN 57 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2x10 s ILE 58 N -1.55 1.17 0.00 2.41 -1.09 -1.26 -3.43 121.20 117.45 2x10 s ILE 58 Ca 0.01 -1.86 0.00 0.00 -2.23 0.00 0.00 60.65 56.57 2x10 s ILE 58 Cb 0.00 -1.63 0.00 0.00 -1.58 0.00 0.00 42.46 39.25 2x10 s ILE 58 CO 0.01 -0.60 0.00 -3.20 -1.23 0.00 0.00 174.94 169.92 2x10 n ASN 60 N 0.20 0.00 -3.38 3.58 5.15 -1.26 -5.05 115.26 114.50 2x10 n ASN 60 Ca -0.13 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.56 2x10 n ASN 60 Cb 0.59 0.00 0.03 0.00 -0.53 0.00 0.00 39.78 39.86 2x10 n ASN 60 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2x10 n ASP 61 N 0.43 -6.05 -4.61 1.20 5.68 -1.26 -5.20 116.55 106.74 2x10 n ASP 61 Ca 0.00 -0.11 -0.32 0.00 -0.50 0.00 0.00 54.79 53.85 2x10 n ASP 61 Cb 0.00 -2.64 -0.10 0.00 -1.14 0.00 0.00 41.12 37.24 2x10 n ASP 61 CO 0.00 0.00 0.00 -2.84 -1.33 0.00 0.00 177.20 173.03 2x10 s PRO 63 N -2.85 2.58 -0.12 0.11 0.02 -1.26 -5.33 135.00 128.15 2x10 s PRO 63 Ca 0.29 -0.71 -0.02 0.00 0.02 0.00 0.00 61.00 60.58 2x10 s PRO 63 Cb -0.04 -2.52 0.04 0.00 0.02 0.00 0.00 34.50 31.99 2x10 s PRO 63 CO 0.85 0.60 -0.00 0.42 -0.33 0.00 0.00 177.00 178.55 2x10 s ILE 64 N -1.01 0.55 0.63 2.83 1.01 -1.22 -5.02 121.20 118.97 2x10 s ILE 64 Ca 0.17 -0.20 0.05 0.00 0.00 0.00 0.00 60.65 60.67 2x10 s ILE 64 Cb -0.11 -0.81 0.10 0.00 0.01 0.00 0.00 42.46 41.65 2x10 s ILE 64 CO 0.08 0.11 0.87 -0.31 0.00 0.00 0.00 174.94 175.69 2x10 s TYR 65 N 1.88 1.61 -0.18 3.97 2.02 -1.26 -2.28 117.35 123.11 2x10 s TYR 65 Ca 0.03 -0.48 0.01 0.00 -0.37 0.00 0.00 57.07 56.25 2x10 s TYR 65 Cb -0.14 -2.59 0.03 0.00 -0.40 0.00 0.00 41.96 38.86 2x10 s TYR 65 CO -0.07 -1.36 -0.14 0.71 -1.57 0.00 0.00 175.55 173.13 2x10 s TYR 67 N -2.87 2.49 0.29 2.71 2.02 -0.93 -4.76 117.35 116.31 2x10 s TYR 67 Ca 0.63 -1.54 0.11 0.00 -0.37 0.00 0.00 57.07 55.91 2x10 s TYR 67 Cb -0.06 -1.72 -0.05 0.00 -0.40 0.00 0.00 41.96 39.73 2x10 s TYR 67 CO 0.41 -0.75 -0.17 -1.12 -1.57 0.00 0.00 175.55 172.36 2x10 s SER 68 N 1.38 3.67 -0.26 2.29 0.01 -0.65 -1.34 113.70 118.80 2x10 s SER 68 Ca 0.02 -1.04 -0.15 0.00 1.31 0.00 0.00 55.95 56.09 2x10 s SER 68 Cb -0.15 -0.34 0.08 0.00 0.21 0.00 0.00 66.02 65.82 2x10 s SER 68 CO -0.10 -0.01 0.63 0.54 0.41 0.00 0.00 173.24 174.71 2x10 s VAL 69 N -2.52 -0.03 -0.42 3.43 0.11 -1.00 -1.03 120.40 118.95 2x10 s VAL 69 Ca 0.31 0.02 0.10 0.00 -2.93 0.00 0.00 61.98 59.47 2x10 s VAL 69 Cb -0.04 -0.92 0.33 0.00 -1.53 0.00 0.00 36.38 34.22 2x10 s VAL 69 CO 0.16 0.01 0.73 0.00 -3.33 0.00 0.00 175.10 172.66 2x10 n ASN 71 N 0.41 6.45 -1.02 0.00 4.13 -1.24 -4.95 115.26 119.04 2x10 n ASN 71 Ca 0.26 -3.60 -0.00 0.00 1.68 0.00 0.00 54.58 52.91 2x10 n ASN 71 Cb 0.58 -1.07 0.00 0.00 -1.54 0.00 0.00 39.78 37.75 2x10 n ASN 71 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 2x10 n VAL 72 N 0.34 1.03 -0.55 2.41 0.24 -1.26 -4.58 118.33 115.96 2x10 n VAL 72 Ca 0.38 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.66 2x10 n VAL 72 Cb 0.31 -1.01 0.00 0.00 -1.47 0.00 0.00 33.84 31.67 2x10 n VAL 72 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2x10 n SER 74 N 0.52 0.00 -0.07 -1.34 7.64 -1.26 -4.19 113.62 114.92 2x10 n SER 74 Ca 0.00 0.37 -0.13 0.00 1.01 0.00 0.00 58.87 60.12 2x10 n SER 74 Cb 0.50 -0.55 -0.08 0.00 -1.01 0.00 0.00 64.21 63.07 2x10 n SER 74 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2x10 h GLY 75 N 1.08 -0.88 -6.30 0.23 0.00 -1.91 -3.41 103.07 91.88 2x10 h GLY 75 Ca 0.00 0.63 -0.67 0.00 0.00 0.00 0.00 47.33 47.30 2x10 h GLY 75 CO 0.00 -0.18 -0.81 0.99 0.00 0.00 0.00 176.54 176.54 2x10 s ASP 76 N -4.96 3.53 -0.11 0.19 1.01 -1.26 -4.90 116.67 110.17 2x10 s ASP 76 Ca -0.15 -0.56 0.04 0.00 0.71 0.00 0.00 52.55 52.59 2x10 s ASP 76 Cb 0.09 -1.57 0.00 0.00 1.01 0.00 0.00 42.92 42.45 2x10 s ASP 76 CO 0.63 -0.01 -0.23 -1.10 0.21 0.00 0.00 175.17 174.67 2x10 s GLN 77 N 1.34 3.06 -0.40 8.23 -1.52 -1.24 -5.03 119.66 124.11 2x10 s GLN 77 Ca 0.05 -0.87 0.09 0.00 -1.95 0.00 0.00 55.36 52.68 2x10 s GLN 77 Cb -0.13 -2.34 0.28 0.00 -0.22 0.00 0.00 33.01 30.60 2x10 s GLN 77 CO -0.09 0.15 0.64 -3.47 -0.25 0.00 0.00 175.29 172.27 2x10 n ASP 78 N 3.61 -0.04 -4.65 5.90 2.03 -1.21 -3.90 116.55 118.28 2x10 n ASP 78 Ca -0.19 -2.89 -0.38 0.00 0.52 0.00 0.00 54.79 51.85 2x10 n ASP 78 Cb 0.53 -0.28 -0.09 0.00 -0.72 0.00 0.00 41.12 40.56 2x10 n ASP 78 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2x10 s ASN 79 N -1.60 6.27 -0.10 1.67 0.02 -0.31 -4.68 114.94 116.21 2x10 s ASN 79 Ca 0.36 0.31 -0.01 0.00 -1.02 0.00 0.00 52.86 52.49 2x10 s ASN 79 Cb 0.23 -2.17 -0.03 0.00 0.02 0.00 0.00 41.25 39.30 2x10 s ASN 79 CO -0.11 -0.03 -0.06 0.26 0.02 0.00 0.00 177.10 177.17 2x10 s TRP 80 N 1.33 2.96 -0.16 2.20 0.52 -0.09 0.13 118.94 125.83 2x10 s TRP 80 Ca 0.13 -0.15 0.00 0.00 0.02 0.00 0.00 56.10 56.11 2x10 s TRP 80 Cb -0.14 -1.81 0.03 0.00 -1.15 0.00 0.00 33.47 30.40 2x10 s TRP 80 CO 0.07 0.16 -0.12 -1.17 0.02 0.00 0.00 176.95 175.91 2x10 s LEU 81 N -0.30 1.84 -0.11 2.99 2.96 0.17 -1.54 118.68 124.69 2x10 s LEU 81 Ca 0.04 -0.61 -0.01 0.00 -0.22 0.00 0.00 54.13 53.33 2x10 s LEU 81 Cb -0.13 -1.16 -0.03 0.00 0.50 0.00 0.00 46.19 45.38 2x10 s LEU 81 CO 0.02 -0.10 -0.07 -0.60 -1.32 0.00 0.00 176.35 174.29 2x10 s ARG 82 N 1.48 3.15 0.42 1.98 3.52 -0.56 -0.16 118.95 128.79 2x10 s ARG 82 Ca 0.03 -0.56 -0.22 0.00 -0.13 0.00 0.00 55.73 54.85 2x10 s ARG 82 Cb -0.14 -2.70 -0.10 0.00 -1.56 0.00 0.00 34.95 30.44 2x10 s ARG 82 CO -0.10 0.46 0.97 0.95 -0.81 0.00 0.00 175.30 176.77 2x10 s THR 83 N -0.24 4.24 1.10 4.11 -4.23 0.25 -2.54 115.64 118.33 2x10 s THR 83 Ca 0.03 1.48 -0.14 0.00 -1.18 0.00 0.00 61.69 61.88 2x10 s THR 83 Cb -0.13 -3.64 0.19 0.00 1.34 0.00 0.00 72.50 70.26 2x10 s THR 83 CO 0.03 -0.22 0.66 0.59 -0.54 0.00 0.00 174.62 175.13 2x10 n ASN 84 N -0.47 -1.70 -4.67 3.99 3.02 -1.26 -4.43 115.26 109.74 2x10 n ASN 84 Ca 0.06 -0.02 -0.42 0.00 -0.03 0.00 0.00 54.58 54.18 2x10 n ASN 84 Cb 0.53 -1.19 -0.03 0.00 -0.61 0.00 0.00 39.78 38.48 2x10 n ASN 84 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2x10 s TRP 85 N -2.38 1.78 -0.17 3.10 -0.00 -1.26 -4.70 118.94 115.30 2x10 s TRP 85 Ca 0.63 -0.08 -0.09 0.00 -0.00 0.00 0.00 56.10 56.57 2x10 s TRP 85 Cb -0.21 -4.08 -0.05 0.00 -0.00 0.00 0.00 33.47 29.13 2x10 s TRP 85 CO 0.65 -4.66 0.12 0.08 -0.00 0.00 0.00 176.95 173.14 2x10 s VAL 86 N 3.85 5.30 0.20 5.86 1.01 -0.27 -4.95 120.40 131.41 2x10 s VAL 86 Ca 0.80 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.63 2x10 s VAL 86 Cb -0.39 -3.38 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 2x10 s VAL 86 CO 0.36 0.50 1.09 -0.31 0.00 0.00 0.00 175.10 176.73 2x10 s TYR 87 N -0.04 3.61 -0.05 5.22 2.02 -1.26 -0.71 117.35 126.13 2x10 s TYR 87 Ca 0.09 1.63 0.12 0.00 -0.37 0.00 0.00 57.07 58.54 2x10 s TYR 87 Cb -0.11 -3.26 -0.05 0.00 -0.40 0.00 0.00 41.96 38.13 2x10 s TYR 87 CO 0.00 -0.55 1.38 -0.09 -1.57 0.00 0.00 175.55 174.72 2x10 h ARG 88 N 4.86 0.00 0.00 -0.62 2.43 -1.17 -3.47 114.38 116.41 2x10 h ARG 88 Ca -0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2x10 h ARG 88 Cb 1.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2x10 h ARG 88 CO 0.71 0.70 0.00 0.41 -1.51 0.00 0.00 179.97 180.29 2x10 n GLY 89 N 1.28 3.94 0.50 2.80 0.00 -1.26 -1.25 105.19 111.19 2x10 n GLY 89 Ca 0.01 0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.13 2x10 n GLY 89 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2x10 n GLU 90 N 14.00 2.58 -1.68 1.61 -0.58 -1.26 -5.02 120.64 130.28 2x10 n GLU 90 Ca 0.00 -1.84 -0.43 0.00 -0.42 0.00 0.00 57.16 54.47 2x10 n GLU 90 Cb 0.00 -1.21 -0.01 0.00 -0.57 0.00 0.00 31.44 29.64 2x10 n GLU 90 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2x10 n ALA 91 N 0.34 1.19 -0.11 0.62 0.00 -0.38 -4.93 120.51 117.23 2x10 n ALA 91 Ca 0.09 0.38 -0.23 0.00 0.00 0.00 0.00 53.44 53.68 2x10 n ALA 91 Cb 0.37 -2.26 -0.08 0.00 0.00 0.00 0.00 19.45 17.49 2x10 n ALA 91 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2x10 n GLU 92 N 1.17 0.48 -4.07 0.00 2.13 -1.26 -4.67 120.64 114.42 2x10 n GLU 92 Ca 0.08 0.21 -0.27 0.00 0.66 0.00 0.00 57.16 57.83 2x10 n GLU 92 Cb 0.34 -1.32 -0.17 0.00 0.27 0.00 0.00 31.44 30.57 2x10 n GLU 92 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2x10 s ARG 93 N -2.46 1.79 0.11 5.31 3.52 -1.26 -0.77 118.95 125.19 2x10 s ARG 93 Ca -0.31 -0.37 -0.08 0.00 -0.13 0.00 0.00 55.73 54.83 2x10 s ARG 93 Cb 0.11 -1.71 -0.06 0.00 -1.56 0.00 0.00 34.95 31.74 2x10 s ARG 93 CO 0.40 -0.20 0.40 0.96 -0.81 0.00 0.00 175.30 176.05 2x10 s ILE 94 N 1.46 5.11 -0.16 4.11 -4.36 -0.93 -4.56 121.20 121.86 2x10 s ILE 94 Ca 0.01 0.32 -0.03 0.00 -0.26 0.00 0.00 60.65 60.69 2x10 s ILE 94 Cb -0.13 -3.63 -0.02 0.00 1.25 0.00 0.00 42.46 39.92 2x10 s ILE 94 CO -0.07 0.19 -0.05 -0.36 0.24 0.00 0.00 174.94 174.89 2x10 s PHE 95 N -1.51 2.99 -0.29 1.37 0.08 0.14 -2.28 117.98 118.48 2x10 s PHE 95 Ca 0.36 -0.41 -0.06 0.00 0.12 0.00 0.00 56.93 56.95 2x10 s PHE 95 Cb -0.13 -1.96 0.02 0.00 -0.57 0.00 0.00 43.02 40.37 2x10 s PHE 95 CO 0.20 -0.12 0.06 0.42 -0.10 0.00 0.00 175.22 175.68 2x10 s ILE 96 N 0.50 3.71 -0.19 0.64 1.01 0.52 -1.68 121.20 125.71 2x10 s ILE 96 Ca -0.04 -0.85 -0.03 0.00 0.00 0.00 0.00 60.65 59.73 2x10 s ILE 96 Cb -0.14 -2.95 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 2x10 s ILE 96 CO 0.03 0.05 -0.05 -0.70 0.00 0.00 0.00 174.94 174.27 2x10 s GLU 97 N 1.44 3.48 0.00 2.79 2.12 0.12 -0.84 118.70 127.82 2x10 s GLU 97 Ca 0.01 -0.59 0.08 0.00 0.36 0.00 0.00 54.97 54.83 2x10 s GLU 97 Cb -0.18 -2.94 -0.02 0.00 0.26 0.00 0.00 34.13 31.26 2x10 s GLU 97 CO 0.01 0.00 -0.25 -0.51 -0.54 0.00 0.00 175.26 173.98 2x10 s LEU 98 N 0.96 2.09 -0.14 2.70 1.43 0.16 -0.66 118.68 125.23 2x10 s LEU 98 Ca -0.00 -0.48 -0.00 0.00 -1.03 0.00 0.00 54.13 52.61 2x10 s LEU 98 Cb -0.15 -1.24 0.03 0.00 0.03 0.00 0.00 46.19 44.86 2x10 s LEU 98 CO 0.01 0.28 -0.07 -0.54 0.23 0.00 0.00 176.35 176.26 2x10 s LYS 99 N -0.78 1.51 0.21 1.70 1.02 -0.73 -0.61 119.74 122.06 2x10 s LYS 99 Ca 0.10 -0.38 -0.07 0.00 0.02 0.00 0.00 55.97 55.64 2x10 s LYS 99 Cb -0.09 -1.79 -0.02 0.00 -0.52 0.00 0.00 37.83 35.40 2x10 s LYS 99 CO -0.00 -0.34 0.28 -0.59 -0.92 0.00 0.00 175.35 173.78 2x10 s PHE 100 N 1.67 0.73 0.20 3.18 -0.12 0.02 -1.07 117.98 122.59 2x10 s PHE 100 Ca 0.03 -1.03 0.09 0.00 -0.05 0.00 0.00 56.93 55.96 2x10 s PHE 100 Cb -0.14 -0.20 -0.04 0.00 -0.63 0.00 0.00 43.02 42.01 2x10 s PHE 100 CO -0.08 -0.78 -0.17 0.95 -0.05 0.00 0.00 175.22 175.08 2x10 s THR 101 N -4.07 1.91 -0.08 -4.49 -4.23 -0.33 0.92 115.64 105.26 2x10 s THR 101 Ca 0.29 -2.11 -0.03 0.00 -1.18 0.00 0.00 61.69 58.65 2x10 s THR 101 Cb 0.04 -2.00 0.04 0.00 1.34 0.00 0.00 72.50 71.92 2x10 s THR 101 CO 0.09 -0.43 0.17 -0.69 -0.54 0.00 0.00 174.62 173.21 2x10 s VAL 102 N -2.48 -0.16 0.43 2.29 1.01 -1.26 -1.68 120.40 118.56 2x10 s VAL 102 Ca 0.21 0.25 -0.16 0.00 0.00 0.00 0.00 61.98 62.28 2x10 s VAL 102 Cb -0.04 -0.29 -0.08 0.00 0.00 0.00 0.00 36.38 35.97 2x10 s VAL 102 CO 0.08 0.10 0.87 -0.13 0.00 0.00 0.00 175.10 176.03 2x10 s ARG 103 N 1.71 3.98 -0.07 2.72 1.81 -1.03 -0.79 118.95 127.28 2x10 s ARG 103 Ca -0.04 0.81 -0.30 0.00 -1.72 0.00 0.00 55.73 54.49 2x10 s ARG 103 Cb -0.12 -2.27 -0.03 0.00 -0.45 0.00 0.00 34.95 32.08 2x10 s ARG 103 CO -0.06 -0.07 1.16 0.34 -0.68 0.00 0.00 175.30 175.99 2x10 s ASP 104 N -2.72 7.09 0.00 0.23 2.15 -0.19 -4.77 116.67 118.47 2x10 s ASP 104 Ca 0.57 1.75 0.03 0.00 0.43 0.00 0.00 52.55 55.33 2x10 s ASP 104 Cb -0.10 -2.56 0.16 0.00 -0.30 0.00 0.00 42.92 40.12 2x10 s ASP 104 CO 0.24 -0.55 0.97 0.00 -0.17 0.00 0.00 175.17 175.66 2x10 n ASN 106 N -1.34 1.94 -0.00 0.00 3.02 -1.26 -4.07 115.26 113.54 2x10 n ASN 106 Ca 0.01 -1.66 0.10 0.00 -0.03 0.00 0.00 54.58 53.00 2x10 n ASN 106 Cb 0.03 -0.02 -0.11 0.00 -0.61 0.00 0.00 39.78 39.07 2x10 n ASN 106 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2x10 n SER 107 N 0.51 0.96 -4.79 6.41 3.41 -0.54 -4.95 113.62 114.64 2x10 n SER 107 Ca 0.18 -0.98 -0.38 0.00 -0.26 0.00 0.00 58.87 57.42 2x10 n SER 107 Cb 0.42 1.00 -0.06 0.00 -0.26 0.00 0.00 64.21 65.31 2x10 n SER 107 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2x10 s PHE 108 N -2.92 3.70 0.15 7.33 0.08 -1.26 -4.99 117.98 120.09 2x10 s PHE 108 Ca 0.08 1.12 -0.25 0.00 0.12 0.00 0.00 56.93 58.00 2x10 s PHE 108 Cb 0.15 -2.48 0.02 0.00 -0.57 0.00 0.00 43.02 40.14 2x10 s PHE 108 CO 0.83 0.47 1.59 -1.35 -0.10 0.00 0.00 175.22 176.67 2x10 h PRO 109 N 5.24 -0.30 0.26 0.24 0.11 -1.94 -1.13 132.00 134.48 2x10 h PRO 109 Ca -0.47 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 2x10 h PRO 109 Cb 1.21 0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2x10 h PRO 109 CO 0.67 -0.20 -0.20 0.78 -0.21 0.00 0.00 178.00 178.83 2x10 h GLY 110 N -0.32 -0.81 -6.27 -0.55 0.00 -1.97 -3.44 103.07 89.70 2x10 h GLY 110 Ca 0.14 0.35 -0.45 0.00 0.00 0.00 0.00 47.33 47.38 2x10 h GLY 110 CO -0.50 -0.28 -0.65 0.61 0.00 0.00 0.00 176.54 175.73 2x10 n GLY 111 N -1.24 -0.37 3.94 4.60 0.00 -0.43 -4.89 105.19 106.81 2x10 n GLY 111 Ca -0.05 0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2x10 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x10 s ALA 112 N -2.74 2.27 -1.27 4.61 0.00 -1.26 -4.85 121.76 118.51 2x10 s ALA 112 Ca 0.60 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 51.21 2x10 s ALA 112 Cb -0.35 -2.68 0.00 0.00 0.00 0.00 0.00 23.12 20.09 2x10 s ALA 112 CO 0.73 -2.52 0.86 -1.13 0.00 0.00 0.00 175.76 173.71 2x10 n SER 113 N -3.79 0.00 0.00 0.00 3.41 -1.26 -2.07 113.62 109.91 2x10 n SER 113 Ca 0.17 0.36 0.14 0.00 -0.26 0.00 0.00 58.87 59.28 2x10 n SER 113 Cb 0.59 -0.36 0.81 0.00 -0.26 0.00 0.00 64.21 64.99 2x10 n SER 113 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2x10 n SER 114 N -1.36 0.00 -4.59 4.04 3.41 -1.26 -4.75 113.62 109.10 2x10 n SER 114 Ca 0.00 -0.84 -0.36 0.00 -0.26 0.00 0.00 58.87 57.41 2x10 n SER 114 Cb 0.00 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 2x10 n SER 114 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x10 s LYS 116 N 1.14 2.33 -0.17 0.00 -0.14 0.04 -4.95 119.74 118.00 2x10 s LYS 116 Ca 0.06 -1.68 0.23 0.00 -1.36 0.00 0.00 55.97 53.21 2x10 s LYS 116 Cb -0.14 -2.55 0.48 0.00 -1.68 0.00 0.00 37.83 33.94 2x10 s LYS 116 CO 0.04 -0.77 1.14 0.39 -0.76 0.00 0.00 175.35 175.40 2x10 n GLU 117 N -2.12 1.20 -3.81 1.68 1.02 -1.26 -4.46 120.64 112.89 2x10 n GLU 117 Ca 0.12 -2.99 -0.10 0.00 -0.02 0.00 0.00 57.16 54.17 2x10 n GLU 117 Cb 0.62 -1.06 -0.05 0.00 -0.02 0.00 0.00 31.44 30.93 2x10 n GLU 117 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2x10 s THR 118 N -2.45 0.04 0.18 2.62 -4.23 -1.26 -4.23 115.64 106.31 2x10 s THR 118 Ca 0.31 -0.99 -0.02 0.00 -1.18 0.00 0.00 61.69 59.81 2x10 s THR 118 Cb 0.35 -1.64 -0.04 0.00 1.34 0.00 0.00 72.50 72.51 2x10 s THR 118 CO -0.08 -0.20 0.14 0.72 -0.54 0.00 0.00 174.62 174.66 2x10 s PHE 119 N -3.90 0.97 -0.01 3.99 -0.12 -1.10 -4.60 117.98 113.22 2x10 s PHE 119 Ca 0.11 -1.25 0.04 0.00 -0.05 0.00 0.00 56.93 55.78 2x10 s PHE 119 Cb 0.01 -0.45 -0.03 0.00 -0.63 0.00 0.00 43.02 41.91 2x10 s PHE 119 CO -0.02 -0.64 -0.09 -0.80 -0.05 0.00 0.00 175.22 173.61 2x10 s ASN 120 N -3.11 4.42 -0.16 1.98 -0.87 -0.50 -0.35 114.94 116.35 2x10 s ASN 120 Ca 0.32 -0.18 -0.03 0.00 -1.57 0.00 0.00 52.86 51.40 2x10 s ASN 120 Cb 0.06 -0.99 -0.02 0.00 -0.02 0.00 0.00 41.25 40.29 2x10 s ASN 120 CO 0.08 0.30 -0.05 -0.22 -2.57 0.00 0.00 177.10 174.63 2x10 s LEU 121 N -1.25 3.08 0.42 0.60 2.96 -0.71 -0.28 118.68 123.51 2x10 s LEU 121 Ca 0.15 -0.22 0.04 0.00 -0.22 0.00 0.00 54.13 53.89 2x10 s LEU 121 Cb -0.11 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 2x10 s LEU 121 CO 0.05 0.13 0.04 -0.31 -1.32 0.00 0.00 176.35 174.95 2x10 s TYR 122 N 0.57 2.06 0.20 5.38 1.51 0.92 0.57 117.35 128.56 2x10 s TYR 122 Ca -0.04 -0.94 -0.18 0.00 -1.01 0.00 0.00 57.07 54.90 2x10 s TYR 122 Cb -0.15 -1.50 0.03 0.00 -0.11 0.00 0.00 41.96 40.23 2x10 s TYR 122 CO 0.03 0.14 0.55 1.52 -1.11 0.00 0.00 175.55 176.68 2x10 s TYR 123 N -2.99 -0.14 -0.19 2.71 -0.85 -0.66 -1.81 117.35 113.42 2x10 s TYR 123 Ca 0.24 -0.20 -0.22 0.00 -0.52 0.00 0.00 57.07 56.37 2x10 s TYR 123 Cb 0.06 0.44 0.06 0.00 0.38 0.00 0.00 41.96 42.89 2x10 s TYR 123 CO 0.12 -0.95 0.59 0.00 -1.52 0.00 0.00 175.55 173.79 2x10 s ALA 124 N -3.87 -1.48 0.23 9.51 0.00 -0.93 -0.64 121.76 124.58 2x10 s ALA 124 Ca 0.09 1.56 0.03 0.00 0.00 0.00 0.00 51.96 53.64 2x10 s ALA 124 Cb -0.02 -0.80 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 2x10 s ALA 124 CO -0.02 -0.29 0.38 -1.21 0.00 0.00 0.00 175.76 174.62 2x10 s GLU 125 N 0.03 3.46 0.06 0.00 2.02 -1.26 -0.53 118.70 122.49 2x10 s GLU 125 Ca -0.02 -0.57 -0.27 0.00 0.02 0.00 0.00 54.97 54.13 2x10 s GLU 125 Cb -0.04 -2.86 0.09 0.00 0.10 0.00 0.00 34.13 31.42 2x10 s GLU 125 CO 0.02 0.39 0.90 -1.54 0.02 0.00 0.00 175.26 175.05 2x10 s SER 126 N -3.67 -0.31 0.00 -0.19 1.04 0.08 -4.96 113.70 105.69 2x10 s SER 126 Ca 0.36 -0.15 0.20 0.00 0.48 0.00 0.00 55.95 56.83 2x10 s SER 126 Cb -0.10 0.44 -0.17 0.00 0.10 0.00 0.00 66.02 66.29 2x10 s SER 126 CO 0.30 -0.75 0.87 0.47 0.98 0.00 0.00 173.24 175.11 2x10 n ASP 127 N -0.34 1.14 -4.18 7.02 8.00 -1.26 -1.86 116.55 125.07 2x10 n ASP 127 Ca -0.08 -1.07 -0.11 0.00 0.71 0.00 0.00 54.79 54.24 2x10 n ASP 127 Cb 0.62 0.88 -0.10 0.00 -0.02 0.00 0.00 41.12 42.50 2x10 n ASP 127 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2x10 s LEU 128 N -2.79 1.92 -0.41 0.64 2.34 -1.26 -4.80 118.68 114.32 2x10 s LEU 128 Ca 0.09 -1.19 -0.27 0.00 0.06 0.00 0.00 54.13 52.83 2x10 s LEU 128 Cb 0.15 0.16 0.02 0.00 -0.56 0.00 0.00 46.19 45.96 2x10 s LEU 128 CO 0.74 -0.67 0.98 -0.62 -1.06 0.00 0.00 176.35 175.72 2x10 s ASP 129 N -3.09 6.65 0.45 1.48 -1.08 -1.26 -4.89 116.67 114.93 2x10 s ASP 129 Ca 0.24 0.49 0.31 0.00 -0.52 0.00 0.00 52.55 53.07 2x10 s ASP 129 Cb 0.07 -2.49 1.44 0.00 -1.46 0.00 0.00 42.92 40.49 2x10 s ASP 129 CO 0.02 -0.99 1.93 1.88 0.52 0.00 0.00 175.17 178.54 2x10 h TYR 130 N 8.73 0.00 0.00 -5.34 0.05 -2.00 -3.48 116.97 114.94 2x10 h TYR 130 Ca -0.23 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.55 2x10 h TYR 130 Cb 1.07 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.81 2x10 h TYR 130 CO 0.87 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 178.39 2x10 n GLY 131 N -0.44 3.98 0.00 3.88 0.00 -1.26 -1.57 105.19 109.78 2x10 n GLY 131 Ca -0.00 0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.19 2x10 n GLY 131 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2x10 n THR 132 N 0.00 0.00 -1.04 2.61 -2.24 -1.26 -4.45 114.28 107.89 2x10 n THR 132 Ca 0.00 -0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.47 2x10 n THR 132 Cb 0.00 -0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 67.76 2x10 n THR 132 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2x10 n ASN 133 N -1.45 6.10 -4.73 3.42 2.85 -0.61 -4.90 115.26 115.95 2x10 n ASN 133 Ca 0.08 -2.47 -0.41 0.00 -0.11 0.00 0.00 54.58 51.67 2x10 n ASN 133 Cb 0.32 -1.31 -0.04 0.00 1.24 0.00 0.00 39.78 40.00 2x10 n ASN 133 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 2x10 s PHE 134 N 3.06 3.58 -0.27 1.20 5.36 -1.26 -4.91 117.98 124.73 2x10 s PHE 134 Ca 0.52 1.54 -0.03 0.00 -0.96 0.00 0.00 56.93 58.01 2x10 s PHE 134 Cb 0.14 -3.28 0.11 0.00 -0.34 0.00 0.00 43.02 39.64 2x10 s PHE 134 CO -0.04 -0.65 0.18 -1.14 -1.46 0.00 0.00 175.22 172.11 2x10 s GLN 135 N 0.28 0.21 0.32 10.12 0.74 -1.26 -5.04 119.66 125.04 2x10 s GLN 135 Ca 0.52 -0.32 0.11 0.00 0.05 0.00 0.00 55.36 55.72 2x10 s GLN 135 Cb -0.28 -1.09 0.96 0.00 1.10 0.00 0.00 33.01 33.70 2x10 s GLN 135 CO 0.32 -0.96 1.68 -0.22 -0.55 0.00 0.00 175.29 175.56 2x10 h LYS 136 N 8.36 0.37 0.00 1.67 3.64 -1.98 -0.46 116.57 128.18 2x10 h LYS 136 Ca -0.17 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.18 2x10 h LYS 136 Cb 1.05 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.79 2x10 h LYS 136 CO 0.38 0.25 -0.02 0.07 -2.27 0.00 0.00 179.45 177.86 2x10 h ARG 137 N 0.38 0.00 -0.00 1.90 0.11 -2.03 -1.39 114.38 113.35 2x10 h ARG 137 Ca 0.67 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.75 2x10 h ARG 137 Cb 1.44 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.52 2x10 h ARG 137 CO -0.57 0.02 -0.04 1.28 0.10 0.00 0.00 179.97 180.75 2x10 n LEU 138 N -3.27 0.19 -4.90 0.08 4.77 -0.18 -4.86 117.00 108.82 2x10 n LEU 138 Ca -0.02 0.15 -0.33 0.00 -0.03 0.00 0.00 56.01 55.78 2x10 n LEU 138 Cb 0.15 -0.22 -0.05 0.00 -2.33 0.00 0.00 43.42 40.97 2x10 n LEU 138 CO 0.24 0.04 -0.11 -0.36 -1.33 0.00 0.00 177.39 175.87 2x10 s PHE 139 N -2.48 3.54 -0.18 -1.77 0.08 -0.52 -4.75 117.98 111.90 2x10 s PHE 139 Ca 0.30 0.42 -0.04 0.00 0.12 0.00 0.00 56.93 57.73 2x10 s PHE 139 Cb 0.20 -1.88 -0.02 0.00 -0.57 0.00 0.00 43.02 40.75 2x10 s PHE 139 CO 0.46 0.61 -0.03 0.99 -0.10 0.00 0.00 175.22 177.15 2x10 s THR 140 N -1.38 3.80 0.14 0.64 2.01 0.18 -4.91 115.64 116.12 2x10 s THR 140 Ca 0.30 -0.38 -0.31 0.00 0.31 0.00 0.00 61.69 61.62 2x10 s THR 140 Cb -0.13 -2.69 -0.08 0.00 0.01 0.00 0.00 72.50 69.61 2x10 s THR 140 CO 0.20 0.46 1.34 -0.75 -0.69 0.00 0.00 174.62 175.18 2x10 s LYS 141 N 0.72 4.36 -0.17 4.92 2.20 -1.26 -1.65 119.74 128.86 2x10 s LYS 141 Ca -0.01 2.03 -0.01 0.00 -0.36 0.00 0.00 55.97 57.62 2x10 s LYS 141 Cb -0.14 -3.24 -0.22 0.00 -1.51 0.00 0.00 37.83 32.71 2x10 s LYS 141 CO 0.02 -0.35 0.14 -0.89 -0.36 0.00 0.00 175.35 173.91 2x10 n ILE 142 N 3.49 1.64 0.00 5.43 5.41 0.19 -4.95 119.36 130.57 2x10 n ILE 142 Ca 0.09 -0.64 0.00 0.00 1.00 0.00 0.00 62.75 63.20 2x10 n ILE 142 Cb 0.43 -1.49 0.00 0.00 -0.71 0.00 0.00 39.64 37.87 2x10 n ILE 142 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2x10 n ASP 143 N -3.32 0.00 -4.84 4.38 2.03 -1.19 -5.03 116.55 108.58 2x10 n ASP 143 Ca -0.36 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.61 2x10 n ASP 143 Cb 1.03 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 41.37 2x10 n ASP 143 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2x10 s THR 144 N -2.00 4.67 -0.23 5.18 -4.23 -1.26 -1.74 115.64 116.02 2x10 s THR 144 Ca 0.00 1.00 -0.03 0.00 -1.18 0.00 0.00 61.69 61.48 2x10 s THR 144 Cb 0.00 -3.67 0.00 0.00 1.34 0.00 0.00 72.50 70.17 2x10 s THR 144 CO 0.00 -0.09 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.32 2x10 s ILE 145 N -1.87 3.26 -0.04 2.99 -1.09 0.53 -4.95 121.20 120.04 2x10 s ILE 145 Ca 0.51 -0.63 0.03 0.00 -2.23 0.00 0.00 60.65 58.34 2x10 s ILE 145 Cb -0.12 -2.53 -0.03 0.00 -1.58 0.00 0.00 42.46 38.21 2x10 s ILE 145 CO 0.18 0.36 -0.11 0.00 -1.23 0.00 0.00 174.94 174.14 2x10 s ALA 146 N 1.44 2.81 0.28 9.38 0.00 -1.26 -2.70 121.76 131.72 2x10 s ALA 146 Ca 0.05 -0.98 -0.30 0.00 0.00 0.00 0.00 51.96 50.73 2x10 s ALA 146 Cb -0.15 -1.05 -0.10 0.00 0.00 0.00 0.00 23.12 21.82 2x10 s ALA 146 CO -0.04 0.57 1.43 -2.14 0.00 0.00 0.00 175.76 175.59 2x10 s PRO 147 N -0.96 4.26 0.07 0.00 0.02 -1.26 -4.91 135.00 132.22 2x10 s PRO 147 Ca 0.13 2.33 0.09 0.00 0.02 0.00 0.00 61.00 63.57 2x10 s PRO 147 Cb -0.11 -3.08 -0.21 0.00 0.02 0.00 0.00 34.50 31.12 2x10 s PRO 147 CO 0.03 -0.40 1.07 -0.44 -0.33 0.00 0.00 177.00 176.93 2x10 h ASP 148 N 4.53 0.00 -3.23 2.53 3.32 -1.93 -3.44 116.42 118.20 2x10 h ASP 148 Ca -0.47 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.08 2x10 h ASP 148 Cb 1.22 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.37 2x10 h ASP 148 CO 0.74 0.98 -0.76 -0.70 -1.72 0.00 0.00 179.24 177.79 2x10 s GLU 149 N -2.68 0.55 -0.05 3.56 2.56 -1.26 -5.07 118.70 116.30 2x10 s GLU 149 Ca -0.01 -0.29 -0.16 0.00 0.00 0.00 0.00 54.97 54.52 2x10 s GLU 149 Cb 0.09 -1.90 -0.05 0.00 2.00 0.00 0.00 34.13 34.28 2x10 s GLU 149 CO 0.82 -0.60 0.41 -1.50 -0.56 0.00 0.00 175.26 173.84 2x10 s ILE 150 N 1.92 5.11 0.40 -3.70 2.07 -1.26 -4.50 121.20 121.24 2x10 s ILE 150 Ca 0.00 0.84 0.08 0.00 -1.41 0.00 0.00 60.65 60.16 2x10 s ILE 150 Cb -0.16 -3.73 -0.04 0.00 0.13 0.00 0.00 42.46 38.66 2x10 s ILE 150 CO -0.08 0.48 0.25 0.42 -1.91 0.00 0.00 174.94 174.10 2x10 s THR 151 N -0.39 2.56 -0.54 4.00 -4.23 0.03 -4.93 115.64 112.14 2x10 s THR 151 Ca 0.23 -1.56 0.04 0.00 -1.18 0.00 0.00 61.69 59.22 2x10 s THR 151 Cb -0.16 -3.00 0.16 0.00 1.34 0.00 0.00 72.50 70.84 2x10 s THR 151 CO 0.11 -0.03 0.39 0.68 -0.54 0.00 0.00 174.62 175.23 2x10 s VAL 152 N -2.52 1.60 -1.32 2.29 -7.23 -1.26 -1.02 120.40 110.93 2x10 s VAL 152 Ca 0.43 -3.32 -0.06 0.00 -1.81 0.00 0.00 61.98 57.22 2x10 s VAL 152 Cb 0.00 -2.08 0.01 0.00 0.56 0.00 0.00 36.38 34.88 2x10 s VAL 152 CO 0.25 -1.08 1.08 -1.54 -0.31 0.00 0.00 175.10 173.50 2x10 n SER 153 N 2.60 -4.57 -3.84 4.85 3.41 -1.26 -5.05 113.62 109.77 2x10 n SER 153 Ca 0.22 -0.61 -0.14 0.00 -0.26 0.00 0.00 58.87 58.09 2x10 n SER 153 Cb 0.40 -4.89 -0.15 0.00 -0.26 0.00 0.00 64.21 59.31 2x10 n SER 153 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 2x10 s LEU 163 N -6.98 1.61 -0.02 1.04 2.34 -1.26 -5.13 118.68 110.27 2x10 s LEU 163 Ca 0.38 0.01 -0.29 0.00 0.06 0.00 0.00 54.13 54.29 2x10 s LEU 163 Cb -0.17 -0.05 -0.03 0.00 -0.56 0.00 0.00 46.19 45.38 2x10 s LEU 163 CO 0.75 -0.05 0.94 0.20 -1.06 0.00 0.00 176.35 177.13 2x10 s ASN 164 N 0.45 7.30 -0.11 1.48 0.01 0.26 -4.82 114.94 119.51 2x10 s ASN 164 Ca -0.04 1.57 -0.01 0.00 -0.71 0.00 0.00 52.86 53.67 2x10 s ASN 164 Cb -0.06 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 39.03 2x10 s ASN 164 CO -0.01 -0.27 -0.04 -0.69 -1.51 0.00 0.00 177.10 174.58 2x10 s VAL 165 N 1.12 3.90 -0.08 1.60 1.01 -1.26 -0.80 120.40 125.89 2x10 s VAL 165 Ca 0.49 -0.39 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 2x10 s VAL 165 Cb -0.20 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.55 2x10 s VAL 165 CO 0.25 0.56 0.22 -1.61 0.00 0.00 0.00 175.10 174.53 2x10 s GLU 166 N -0.37 0.29 0.03 2.72 0.41 0.22 -4.91 118.70 117.09 2x10 s GLU 166 Ca 0.06 0.27 0.05 0.00 -0.41 0.00 0.00 54.97 54.94 2x10 s GLU 166 Cb -0.12 0.14 -0.02 0.00 -1.78 0.00 0.00 34.13 32.34 2x10 s GLU 166 CO 0.02 -0.04 -0.16 -2.00 -0.49 0.00 0.00 175.26 172.60 2x10 s GLU 167 N 0.01 1.05 0.31 1.61 2.12 -1.26 0.40 118.70 122.95 2x10 s GLU 167 Ca -0.01 -0.77 0.06 0.00 0.36 0.00 0.00 54.97 54.61 2x10 s GLU 167 Cb -0.02 -1.08 -0.02 0.00 0.26 0.00 0.00 34.13 33.27 2x10 s GLU 167 CO 0.00 0.27 0.30 0.54 -0.54 0.00 0.00 175.26 175.84 2x10 n ARG 168 N 1.97 0.43 -3.51 4.30 5.12 -0.02 -4.97 116.66 119.98 2x10 n ARG 168 Ca -0.17 -3.04 -0.16 0.00 -1.93 0.00 0.00 57.85 52.54 2x10 n ARG 168 Cb 0.54 2.56 -0.05 0.00 -1.16 0.00 0.00 32.46 34.35 2x10 n ARG 168 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2x10 s SER 169 N -3.16 -0.62 -0.02 0.55 1.04 -1.26 -0.36 113.70 109.88 2x10 s SER 169 Ca 0.36 0.59 -0.01 0.00 0.48 0.00 0.00 55.95 57.37 2x10 s SER 169 Cb 0.01 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.67 2x10 s SER 169 CO 0.25 -0.63 0.04 0.54 0.98 0.00 0.00 173.24 174.42 2x10 s VAL 170 N -1.53 -0.01 0.13 5.02 0.11 -0.97 -5.01 120.40 118.15 2x10 s VAL 170 Ca -0.08 0.04 -0.26 0.00 -2.93 0.00 0.00 61.98 58.75 2x10 s VAL 170 Cb -0.00 -0.07 0.07 0.00 -1.53 0.00 0.00 36.38 34.85 2x10 s VAL 170 CO 0.06 0.02 0.99 -0.83 -3.33 0.00 0.00 175.10 172.01 2x10 s GLY 171 N 0.22 -0.26 0.21 6.54 0.00 -1.26 -2.19 107.32 110.58 2x10 s GLY 171 Ca -0.02 0.23 -0.16 0.00 0.00 0.00 0.00 44.72 44.77 2x10 s GLY 171 CO -0.01 0.03 0.66 -4.14 0.00 0.00 0.00 173.10 169.64 2x10 s PRO 172 N -3.19 4.09 0.14 2.90 0.02 -1.26 -5.03 135.00 132.68 2x10 s PRO 172 Ca 0.12 0.67 -0.07 0.00 0.02 0.00 0.00 61.00 61.74 2x10 s PRO 172 Cb -0.01 -2.82 -0.06 0.00 0.02 0.00 0.00 34.50 31.64 2x10 s PRO 172 CO 0.01 0.38 0.42 -0.51 -0.33 0.00 0.00 177.00 176.97 2x10 s LEU 173 N -2.17 4.27 -0.13 -5.54 1.43 0.05 -5.02 118.68 111.57 2x10 s LEU 173 Ca 0.43 0.71 0.12 0.00 -1.03 0.00 0.00 54.13 54.36 2x10 s LEU 173 Cb -0.15 -3.30 0.27 0.00 0.03 0.00 0.00 46.19 43.04 2x10 s LEU 173 CO 0.20 0.06 1.20 0.35 0.23 0.00 0.00 176.35 178.39 2x10 n THR 174 N 0.27 0.17 -4.31 5.49 -2.24 -1.26 -4.77 114.28 107.62 2x10 n THR 174 Ca -0.03 -0.87 -0.16 0.00 -2.27 0.00 0.00 64.05 60.71 2x10 n THR 174 Cb 0.52 0.85 -0.10 0.00 -2.10 0.00 0.00 70.33 69.49 2x10 n THR 174 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2x10 s ARG 175 N -0.48 1.38 0.19 -0.78 1.81 -1.26 -5.06 118.95 114.75 2x10 s ARG 175 Ca 0.13 -1.74 -0.12 0.00 -1.72 0.00 0.00 55.73 52.27 2x10 s ARG 175 Cb 0.25 -0.27 0.21 0.00 -0.45 0.00 0.00 34.95 34.68 2x10 s ARG 175 CO -0.07 -0.27 1.72 0.87 -0.68 0.00 0.00 175.30 176.87 2x10 h LYS 176 N 2.41 0.27 -3.53 3.54 1.57 -1.86 -3.41 116.57 115.55 2x10 h LYS 176 Ca -0.38 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.35 2x10 h LYS 176 Cb 1.24 -0.06 -0.08 0.00 0.08 0.00 0.00 32.23 33.41 2x10 h LYS 176 CO 0.61 0.18 -0.05 0.20 -0.57 0.00 0.00 179.45 179.82 2x10 s GLY 177 N -3.05 0.43 0.07 3.86 0.00 -0.77 -0.72 107.32 107.13 2x10 s GLY 177 Ca -0.13 -0.78 -0.00 0.00 0.00 0.00 0.00 44.72 43.81 2x10 s GLY 177 CO 0.73 -0.53 -0.04 -0.11 0.00 0.00 0.00 173.10 173.15 2x10 s PHE 178 N -3.98 0.65 0.18 1.90 -0.12 0.11 -0.74 117.98 115.97 2x10 s PHE 178 Ca 0.20 -1.00 0.08 0.00 -0.05 0.00 0.00 56.93 56.16 2x10 s PHE 178 Cb -0.02 -0.43 -0.04 0.00 -0.63 0.00 0.00 43.02 41.90 2x10 s PHE 178 CO 0.09 -0.29 -0.05 0.71 -0.05 0.00 0.00 175.22 175.63 2x10 s TYR 179 N -3.76 2.75 0.04 3.49 2.02 0.32 -1.11 117.35 121.10 2x10 s TYR 179 Ca 0.08 -0.17 0.04 0.00 -0.37 0.00 0.00 57.07 56.65 2x10 s TYR 179 Cb 0.07 -1.34 -0.04 0.00 -0.40 0.00 0.00 41.96 40.25 2x10 s TYR 179 CO -0.08 0.51 -0.06 -0.51 -1.57 0.00 0.00 175.55 173.84 2x10 s LEU 180 N -2.88 3.19 -0.02 -1.29 1.43 -1.26 -2.19 118.68 115.67 2x10 s LEU 180 Ca 0.26 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 2x10 s LEU 180 Cb -0.09 -1.89 0.01 0.00 0.03 0.00 0.00 46.19 44.25 2x10 s LEU 180 CO 0.17 0.24 -0.05 0.00 0.23 0.00 0.00 176.35 176.94 2x10 s ALA 181 N -1.10 0.53 -0.16 4.21 0.00 -0.75 -0.58 121.76 123.91 2x10 s ALA 181 Ca 0.20 -0.15 -0.01 0.00 0.00 0.00 0.00 51.96 52.00 2x10 s ALA 181 Cb -0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.76 2x10 s ALA 181 CO 0.11 0.06 -0.12 -0.06 0.00 0.00 0.00 175.76 175.76 2x10 s PHE 182 N 0.30 2.84 -0.16 0.00 0.08 0.77 -0.05 117.98 121.76 2x10 s PHE 182 Ca -0.03 -0.82 -0.05 0.00 0.12 0.00 0.00 56.93 56.15 2x10 s PHE 182 Cb -0.07 -1.91 -0.03 0.00 -0.57 0.00 0.00 43.02 40.43 2x10 s PHE 182 CO -0.00 -0.36 0.00 -1.14 -0.10 0.00 0.00 175.22 173.63 2x10 s GLN 183 N 0.72 3.74 -0.11 0.44 0.74 0.62 -0.66 119.66 125.14 2x10 s GLN 183 Ca -0.05 -0.44 -0.06 0.00 0.05 0.00 0.00 55.36 54.86 2x10 s GLN 183 Cb -0.15 -3.02 -0.04 0.00 1.10 0.00 0.00 33.01 30.90 2x10 s GLN 183 CO 0.02 0.29 0.11 0.34 -0.55 0.00 0.00 175.29 175.50 2x10 s ASP 184 N 0.26 6.13 0.00 6.67 2.15 0.35 -1.41 116.67 130.81 2x10 s ASP 184 Ca -0.00 0.39 0.00 0.00 0.43 0.00 0.00 52.55 53.37 2x10 s ASP 184 Cb -0.13 -1.93 0.00 0.00 -0.30 0.00 0.00 42.92 40.56 2x10 s ASP 184 CO 0.02 0.40 0.37 2.30 -0.17 0.00 0.00 175.17 178.09 2x10 n ILE 185 N 1.99 0.00 0.00 4.11 -5.35 -1.25 -1.16 119.36 117.69 2x10 n ILE 185 Ca -0.19 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 61.79 2x10 n ILE 185 Cb 0.55 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.46 2x10 n ILE 185 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2x10 n GLY 186 N 0.24 0.36 3.52 3.28 0.00 -1.26 -3.61 105.19 107.73 2x10 n GLY 186 Ca 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 2x10 n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x10 s ALA 187 N 0.00 2.92 -0.74 4.61 0.00 -1.26 -0.78 121.76 126.50 2x10 s ALA 187 Ca 0.00 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 50.64 2x10 s ALA 187 Cb 0.00 0.69 0.19 0.00 0.00 0.00 0.00 23.12 24.00 2x10 s ALA 187 CO 0.00 -0.31 0.59 0.00 0.00 0.00 0.00 175.76 176.04 2x10 s VAL 189 N -0.60 3.38 -0.24 0.00 1.01 -0.81 -2.48 120.40 120.67 2x10 s VAL 189 Ca 0.21 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.46 2x10 s VAL 189 Cb -0.14 -2.41 0.06 0.00 0.00 0.00 0.00 36.38 33.89 2x10 s VAL 189 CO -0.07 0.49 -0.10 0.00 0.00 0.00 0.00 175.10 175.41 2x10 s ALA 190 N -0.87 2.35 -0.51 5.51 0.00 -0.67 -2.38 121.76 125.18 2x10 s ALA 190 Ca 0.14 -1.58 -0.19 0.00 0.00 0.00 0.00 51.96 50.34 2x10 s ALA 190 Cb -0.11 -1.50 0.06 0.00 0.00 0.00 0.00 23.12 21.58 2x10 s ALA 190 CO 0.04 -1.11 0.61 -1.17 0.00 0.00 0.00 175.76 174.12 2x10 s LEU 191 N 1.21 5.08 -0.09 0.00 0.20 -0.45 -1.18 118.68 123.45 2x10 s LEU 191 Ca -0.07 -1.00 -0.01 0.00 0.69 0.00 0.00 54.13 53.74 2x10 s LEU 191 Cb -0.19 -2.41 -0.25 0.00 -0.43 0.00 0.00 46.19 42.91 2x10 s LEU 191 CO -0.06 -0.88 0.46 0.18 -0.29 0.00 0.00 176.35 175.76 2x10 n LEU 192 N 6.08 2.10 -3.85 -0.68 4.32 -0.23 -2.18 117.00 122.54 2x10 n LEU 192 Ca -0.07 0.28 -0.12 0.00 -0.02 0.00 0.00 56.01 56.08 2x10 n LEU 192 Cb 0.45 -0.73 -0.11 0.00 -1.62 0.00 0.00 43.42 41.41 2x10 n LEU 192 CO 0.54 0.71 -0.21 -0.55 -1.22 0.00 0.00 177.39 176.66 2x10 s SER 193 N -6.75 -0.05 -0.01 -1.43 0.15 -0.92 -4.56 113.70 100.12 2x10 s SER 193 Ca -0.17 0.03 0.00 0.00 0.70 0.00 0.00 55.95 56.52 2x10 s SER 193 Cb 0.07 0.24 0.01 0.00 -1.71 0.00 0.00 66.02 64.63 2x10 s SER 193 CO 0.79 -0.19 -0.01 0.68 1.20 0.00 0.00 173.24 175.71 2x10 s VAL 194 N -0.60 0.11 -0.05 4.45 -7.23 -1.25 -1.77 120.40 114.05 2x10 s VAL 194 Ca -0.07 0.01 0.01 0.00 -1.81 0.00 0.00 61.98 60.12 2x10 s VAL 194 Cb -0.04 -0.14 0.02 0.00 0.56 0.00 0.00 36.38 36.78 2x10 s VAL 194 CO 0.01 0.07 -0.05 -0.13 -0.31 0.00 0.00 175.10 174.68 2x10 s ARG 195 N 0.34 0.98 -0.14 4.82 0.52 0.17 -2.20 118.95 123.44 2x10 s ARG 195 Ca -0.03 -0.14 0.02 0.00 -0.52 0.00 0.00 55.73 55.06 2x10 s ARG 195 Cb -0.05 -0.97 0.01 0.00 0.52 0.00 0.00 34.95 34.46 2x10 s ARG 195 CO -0.01 -0.09 -0.20 0.54 0.02 0.00 0.00 175.30 175.56 2x10 s VAL 196 N 0.98 1.93 0.16 3.52 0.11 -0.81 0.13 120.40 126.42 2x10 s VAL 196 Ca -0.10 -0.90 -0.07 0.00 -2.93 0.00 0.00 61.98 57.98 2x10 s VAL 196 Cb -0.14 -1.73 -0.02 0.00 -1.53 0.00 0.00 36.38 32.97 2x10 s VAL 196 CO -0.00 0.52 0.24 -0.72 -3.33 0.00 0.00 175.10 171.81 2x10 s TYR 197 N 0.92 0.51 0.13 1.54 -0.85 -0.68 -0.24 117.35 118.68 2x10 s TYR 197 Ca -0.05 -0.87 0.10 0.00 -0.52 0.00 0.00 57.07 55.72 2x10 s TYR 197 Cb -0.15 -0.15 -0.04 0.00 0.38 0.00 0.00 41.96 42.00 2x10 s TYR 197 CO -0.03 -0.68 -0.23 1.52 -1.52 0.00 0.00 175.55 174.61 2x10 s TYR 198 N -3.99 2.03 0.51 -3.49 -0.85 -0.53 0.24 117.35 111.28 2x10 s TYR 198 Ca 0.19 -0.40 -0.06 0.00 -0.52 0.00 0.00 57.07 56.28 2x10 s TYR 198 Cb 0.04 -1.08 -0.03 0.00 0.38 0.00 0.00 41.96 41.26 2x10 s TYR 198 CO 0.01 0.30 0.83 0.15 -1.52 0.00 0.00 175.55 175.32 2x10 s LYS 199 N -2.17 3.52 -0.07 -3.49 1.02 -1.26 -1.39 119.74 115.90 2x10 s LYS 199 Ca 0.12 0.27 -0.06 0.00 0.02 0.00 0.00 55.97 56.32 2x10 s LYS 199 Cb -0.09 -2.33 0.02 0.00 -0.52 0.00 0.00 37.83 34.91 2x10 s LYS 199 CO 0.06 -0.28 0.19 0.21 -0.92 0.00 0.00 175.35 174.60 2x10 s LYS 200 N -4.82 0.22 0.02 1.68 2.20 -1.01 -2.64 119.74 115.38 2x10 s LYS 200 Ca 0.49 0.27 -0.24 0.00 -0.36 0.00 0.00 55.97 56.13 2x10 s LYS 200 Cb -0.10 0.09 -0.05 0.00 -1.51 0.00 0.00 37.83 36.26 2x10 s LYS 200 CO 0.46 -0.03 0.73 0.00 -0.36 0.00 0.00 175.35 176.15 2x10 s PRO 202 N 0.03 3.26 0.49 0.00 0.02 -1.26 -2.29 135.00 135.25 2x10 s PRO 202 Ca 0.37 1.85 -0.22 0.00 0.02 0.00 0.00 61.00 63.03 2x10 s PRO 202 Cb -0.20 -2.12 -0.07 0.00 0.02 0.00 0.00 34.50 32.13 2x10 s PRO 202 CO 0.22 -0.98 1.17 -1.83 -0.33 0.00 0.00 177.00 175.25 2x10 s GLU 203 N -3.08 3.61 0.25 5.54 -1.05 -1.26 -4.56 118.70 118.14 2x10 s GLU 203 Ca 0.72 1.78 -0.19 0.00 -0.15 0.00 0.00 54.97 57.13 2x10 s GLU 203 Cb -0.31 -2.30 0.02 0.00 -0.44 0.00 0.00 34.13 31.10 2x10 s GLU 203 CO 0.35 -0.68 0.63 -0.48 0.95 0.00 0.00 175.26 176.03 2x10 s LEU 204 N -3.25 -0.12 -0.13 1.83 0.05 -0.74 -4.95 118.68 111.36 2x10 s LEU 204 Ca 0.66 -0.58 0.02 0.00 0.05 0.00 0.00 54.13 54.28 2x10 s LEU 204 Cb -0.29 2.43 -0.00 0.00 -2.05 0.00 0.00 46.19 46.28 2x10 s LEU 204 CO 0.34 -1.22 -0.18 -1.48 -0.55 0.00 0.00 176.35 173.26 2x10 s LEU 205 N -2.91 2.35 -0.12 1.48 2.34 -1.26 -1.23 118.68 119.33 2x10 s LEU 205 Ca 0.12 -0.49 -0.04 0.00 0.06 0.00 0.00 54.13 53.78 2x10 s LEU 205 Cb -0.04 -1.51 0.05 0.00 -0.56 0.00 0.00 46.19 44.13 2x10 s LEU 205 CO 0.03 0.12 0.08 -1.58 -1.06 0.00 0.00 176.35 173.94 2x10 s GLN 206 N 0.61 0.03 -1.08 1.48 2.00 0.85 -4.86 119.66 118.69 2x10 s GLN 206 Ca -0.10 0.08 -0.02 0.00 -2.00 0.00 0.00 55.36 53.31 2x10 s GLN 206 Cb -0.16 -1.37 -0.03 0.00 0.80 0.00 0.00 33.01 32.26 2x10 s GLN 206 CO 0.03 -0.55 0.92 0.41 -0.50 0.00 0.00 175.29 175.60 2x10 n GLY 207 N 5.28 -0.62 3.80 2.59 0.00 -1.26 -2.45 105.19 112.52 2x10 n GLY 207 Ca -0.06 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2x10 n GLY 207 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x10 n LEU 208 N -3.63 0.81 -4.82 0.99 7.99 -1.26 -1.89 117.00 115.19 2x10 n LEU 208 Ca -0.19 0.00 -0.29 0.00 -0.01 0.00 0.00 56.01 55.52 2x10 n LEU 208 Cb 0.64 -1.23 -0.05 0.00 -0.11 0.00 0.00 43.42 42.66 2x10 n LEU 208 CO 0.57 -0.41 -0.22 0.00 -1.51 0.00 0.00 177.39 175.82 2x10 s ALA 209 N -1.56 3.67 -0.14 -1.18 0.00 -1.03 -0.93 121.76 120.60 2x10 s ALA 209 Ca 0.00 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 50.92 2x10 s ALA 209 Cb 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.61 2x10 s ALA 209 CO 0.00 0.66 -0.18 -1.58 0.00 0.00 0.00 175.76 174.66 2x10 s HIS 210 N -1.56 2.73 -0.02 0.00 2.46 0.80 -0.11 115.29 119.60 2x10 s HIS 210 Ca 0.31 -1.10 0.03 0.00 0.47 0.00 0.00 55.06 54.78 2x10 s HIS 210 Cb -0.12 -1.85 -0.03 0.00 -0.13 0.00 0.00 32.58 30.46 2x10 s HIS 210 CO 0.24 -0.49 -0.10 -0.06 -2.47 0.00 0.00 174.74 171.86 2x10 s PHE 211 N 0.73 2.81 0.37 3.88 0.08 -0.36 -1.63 117.98 123.85 2x10 s PHE 211 Ca -0.08 -0.09 0.02 0.00 0.12 0.00 0.00 56.93 56.91 2x10 s PHE 211 Cb -0.16 -1.62 -0.02 0.00 -0.57 0.00 0.00 43.02 40.66 2x10 s PHE 211 CO 0.01 0.30 0.56 -1.25 -0.10 0.00 0.00 175.22 174.74 2x10 s PRO 212 N -1.12 3.24 -0.33 0.24 0.04 -1.26 -1.80 135.00 134.01 2x10 s PRO 212 Ca 0.14 -0.58 -0.41 0.00 0.04 0.00 0.00 61.00 60.19 2x10 s PRO 212 Cb -0.11 -2.68 -0.16 0.00 0.04 0.00 0.00 34.50 31.59 2x10 s PRO 212 CO 0.04 -0.01 1.74 0.39 0.04 0.00 0.00 177.00 179.20 2x10 n GLU 213 N -1.83 0.92 -5.08 4.56 1.02 -1.26 -4.61 120.64 114.35 2x10 n GLU 213 Ca -0.02 0.34 -0.29 0.00 -0.02 0.00 0.00 57.16 57.17 2x10 n GLU 213 Cb 0.57 -1.99 -0.16 0.00 -0.02 0.00 0.00 31.44 29.84 2x10 n GLU 213 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2x10 s THR 214 N 3.62 1.78 0.25 2.62 2.01 -0.97 -4.96 115.64 119.99 2x10 s THR 214 Ca 1.00 -0.92 -0.30 0.00 0.31 0.00 0.00 61.69 61.78 2x10 s THR 214 Cb -1.15 -1.50 -0.10 0.00 0.01 0.00 0.00 72.50 69.76 2x10 s THR 214 CO 0.69 0.50 1.40 -0.63 -0.69 0.00 0.00 174.62 175.88 2x10 s ILE 215 N -0.17 2.77 0.69 1.82 1.01 -1.26 -0.35 121.20 125.70 2x10 s ILE 215 Ca -0.01 0.66 -0.17 0.00 0.00 0.00 0.00 60.65 61.13 2x10 s ILE 215 Cb -0.12 -3.42 0.01 0.00 0.01 0.00 0.00 42.46 38.94 2x10 s ILE 215 CO 0.02 0.11 1.25 0.00 0.00 0.00 0.00 174.94 176.33 2x10 s ALA 216 N -0.16 2.24 0.71 9.38 0.00 -1.08 -4.83 121.76 128.02 2x10 s ALA 216 Ca 0.57 1.06 -0.11 0.00 0.00 0.00 0.00 51.96 53.48 2x10 s ALA 216 Cb -0.41 -3.52 0.01 0.00 0.00 0.00 0.00 23.12 19.21 2x10 s ALA 216 CO 0.44 -1.74 1.09 0.20 0.00 0.00 0.00 175.76 175.75 2x10 s GLY 217 N -1.69 1.63 -0.14 0.00 0.00 -0.85 -4.59 107.32 101.68 2x10 s GLY 217 Ca 0.79 -0.32 -0.16 0.00 0.00 0.00 0.00 44.72 45.03 2x10 s GLY 217 CO 0.42 0.05 0.29 0.23 0.00 0.00 0.00 173.10 174.09 2x10 h SER 218 N -0.66 0.00 -4.16 1.64 0.87 -1.88 -3.35 113.55 106.01 2x10 h SER 218 Ca -0.45 -0.45 -0.57 0.00 -1.23 0.00 0.00 61.79 59.09 2x10 h SER 218 Cb 1.25 0.00 -0.22 0.00 -0.44 0.00 0.00 62.40 62.99 2x10 h SER 218 CO 0.63 0.90 -0.83 -1.81 -0.53 0.00 0.00 176.83 175.19 2x10 s ASP 219 N -6.05 2.60 0.01 6.23 1.11 -1.26 -4.89 116.67 114.42 2x10 s ASP 219 Ca -0.14 -0.69 -0.25 0.00 0.18 0.00 0.00 52.55 51.65 2x10 s ASP 219 Cb 0.00 -0.15 -0.17 0.00 1.07 0.00 0.00 42.92 43.68 2x10 s ASP 219 CO 0.39 0.07 1.29 0.00 1.18 0.00 0.00 175.17 178.09 2x10 h ALA 220 N 4.06 -0.29 0.00 5.23 0.00 -1.99 -3.08 119.26 123.19 2x10 h ALA 220 Ca -0.47 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2x10 h ALA 220 Cb 1.18 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2x10 h ALA 220 CO 0.39 -0.49 0.18 -1.35 0.00 0.00 0.00 179.25 177.99 2x10 h PRO 221 N -0.63 0.00 -2.14 0.00 0.11 -2.04 -2.66 132.00 124.63 2x10 h PRO 221 Ca -0.03 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.50 2x10 h PRO 221 Cb 0.45 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.15 2x10 h PRO 221 CO 0.05 0.00 -0.78 -1.13 -0.21 0.00 0.00 178.00 175.93 2x10 n SER 222 N -2.69 2.76 -4.43 -2.05 3.41 -1.16 -5.06 113.62 104.41 2x10 n SER 222 Ca -0.02 -3.27 -0.39 0.00 -0.26 0.00 0.00 58.87 54.93 2x10 n SER 222 Cb 0.23 -0.64 -0.11 0.00 -0.26 0.00 0.00 64.21 63.43 2x10 n SER 222 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2x10 s LEU 223 N -2.34 4.32 1.03 1.04 2.96 -1.01 -4.50 118.68 120.18 2x10 s LEU 223 Ca 0.40 -0.65 -0.12 0.00 -0.22 0.00 0.00 54.13 53.54 2x10 s LEU 223 Cb 0.20 -2.02 0.21 0.00 0.50 0.00 0.00 46.19 45.07 2x10 s LEU 223 CO -0.06 -0.25 1.08 0.00 -1.32 0.00 0.00 176.35 175.79 2x10 s ALA 224 N 1.60 0.67 -0.07 5.97 0.00 -1.26 -5.02 121.76 123.66 2x10 s ALA 224 Ca 0.04 -0.25 0.03 0.00 0.00 0.00 0.00 51.96 51.78 2x10 s ALA 224 Cb -0.18 -3.16 -0.02 0.00 0.00 0.00 0.00 23.12 19.76 2x10 s ALA 224 CO 0.07 -3.04 -0.16 -0.08 0.00 0.00 0.00 175.76 172.56 2x10 s THR 225 N -2.83 2.91 -0.22 0.00 -1.32 -1.26 -4.39 115.64 108.53 2x10 s THR 225 Ca 0.66 -0.76 -0.05 0.00 -1.21 0.00 0.00 61.69 60.33 2x10 s THR 225 Cb -0.20 -2.15 -0.02 0.00 -1.51 0.00 0.00 72.50 68.62 2x10 s THR 225 CO 0.59 0.57 -0.00 -0.69 -2.21 0.00 0.00 174.62 172.88 2x10 s VAL 226 N -0.33 3.82 0.24 5.08 1.01 -1.26 -5.02 120.40 123.94 2x10 s VAL 226 Ca 0.03 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 2x10 s VAL 226 Cb -0.13 -2.74 -0.09 0.00 0.00 0.00 0.00 36.38 33.42 2x10 s VAL 226 CO 0.02 0.41 0.95 0.00 0.00 0.00 0.00 175.10 176.48 2x10 s ALA 227 N 1.27 3.34 0.17 5.51 0.00 -1.26 -4.26 121.76 126.53 2x10 s ALA 227 Ca 0.04 0.63 0.07 0.00 0.00 0.00 0.00 51.96 52.69 2x10 s ALA 227 Cb -0.15 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 2x10 s ALA 227 CO 0.01 0.18 0.05 0.20 0.00 0.00 0.00 175.76 176.20 2x10 s GLY 228 N -1.11 1.72 0.15 0.00 0.00 -1.02 -4.82 107.32 102.24 2x10 s GLY 228 Ca 0.41 -1.32 0.06 0.00 0.00 0.00 0.00 44.72 43.88 2x10 s GLY 228 CO 0.32 -1.33 0.04 -0.51 0.00 0.00 0.00 173.10 171.62 2x10 s THR 229 N -1.76 4.00 -0.18 0.90 -4.23 -0.65 -4.67 115.64 109.06 2x10 s THR 229 Ca 0.29 -1.22 -0.24 0.00 -1.18 0.00 0.00 61.69 59.33 2x10 s THR 229 Cb -0.09 -3.00 -0.02 0.00 1.34 0.00 0.00 72.50 70.73 2x10 s THR 229 CO 0.20 -0.05 0.79 0.00 -0.54 0.00 0.00 174.62 175.02 2x10 n VAL 231 N 4.74 1.22 -1.56 0.00 0.31 -0.10 -4.75 118.33 118.19 2x10 n VAL 231 Ca 0.03 -0.49 -0.51 0.00 -0.01 0.00 0.00 64.34 63.36 2x10 n VAL 231 Cb 0.49 -0.38 -0.05 0.00 -0.91 0.00 0.00 33.84 32.98 2x10 n VAL 231 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2x10 n ASP 232 N 1.35 1.15 -0.25 4.52 8.00 -1.26 -0.91 116.55 129.16 2x10 n ASP 232 Ca 0.10 1.13 -0.03 0.00 0.71 0.00 0.00 54.79 56.70 2x10 n ASP 232 Cb 0.48 -1.15 -0.01 0.00 -0.02 0.00 0.00 41.12 40.41 2x10 n ASP 232 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2x10 n HIS 233 N 1.84 0.00 -4.34 1.24 8.25 -1.26 -4.42 115.22 116.52 2x10 n HIS 233 Ca 0.17 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.37 2x10 n HIS 233 Cb 0.20 -1.08 -0.10 0.00 1.12 0.00 0.00 29.99 30.13 2x10 n HIS 233 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2x10 s ALA 234 N -1.92 2.81 0.19 -1.41 0.00 -0.08 -0.25 121.76 121.10 2x10 s ALA 234 Ca 0.00 -1.56 -0.14 0.00 0.00 0.00 0.00 51.96 50.26 2x10 s ALA 234 Cb 0.00 -0.58 0.01 0.00 0.00 0.00 0.00 23.12 22.55 2x10 s ALA 234 CO 0.00 0.44 0.43 0.14 0.00 0.00 0.00 175.76 176.77 2x10 s VAL 235 N -1.76 0.04 -0.33 0.00 -7.23 0.12 -4.72 120.40 106.51 2x10 s VAL 235 Ca 0.24 -1.09 -0.12 0.00 -1.81 0.00 0.00 61.98 59.20 2x10 s VAL 235 Cb -0.08 -1.77 -0.02 0.00 0.56 0.00 0.00 36.38 35.07 2x10 s VAL 235 CO 0.14 -0.17 0.22 0.54 -0.31 0.00 0.00 175.10 175.52 2x10 s VAL 236 N -3.93 5.19 0.81 1.32 0.11 -1.26 -0.55 120.40 122.08 2x10 s VAL 236 Ca 0.14 -0.21 -0.11 0.00 -2.93 0.00 0.00 61.98 58.87 2x10 s VAL 236 Cb 0.00 -3.64 0.08 0.00 -1.53 0.00 0.00 36.38 31.29 2x10 s VAL 236 CO 0.00 0.02 1.10 -2.16 -3.33 0.00 0.00 175.10 170.73 2x10 s PRO 237 N 1.71 1.93 -0.32 1.54 0.04 -1.26 -4.88 135.00 133.75 2x10 s PRO 237 Ca 0.06 1.21 -0.27 0.00 0.04 0.00 0.00 61.00 62.04 2x10 s PRO 237 Cb -0.17 -1.86 0.01 0.00 0.04 0.00 0.00 34.50 32.52 2x10 s PRO 237 CO 0.10 -1.89 0.96 -2.14 0.04 0.00 0.00 177.00 174.07 2x10 s PRO 238 N -4.86 3.99 -0.44 0.56 0.02 -1.26 -1.22 135.00 131.79 2x10 s PRO 238 Ca 0.62 0.82 0.05 0.00 0.02 0.00 0.00 61.00 62.52 2x10 s PRO 238 Cb -0.18 -3.75 0.20 0.00 0.02 0.00 0.00 34.50 30.79 2x10 s PRO 238 CO 0.57 -0.84 0.42 0.41 -0.33 0.00 0.00 177.00 177.23 2x10 n GLY 239 N 4.07 2.62 3.93 0.52 0.00 -1.26 -5.17 105.19 109.90 2x10 n GLY 239 Ca 0.08 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.25 2x10 n GLY 239 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2x10 s GLY 240 N -0.55 1.82 0.32 -0.02 0.00 -0.36 -5.03 107.32 103.50 2x10 s GLY 240 Ca 0.33 -1.33 -0.28 0.00 0.00 0.00 0.00 44.72 43.44 2x10 s GLY 240 CO -0.16 -0.49 1.12 -0.54 0.00 0.00 0.00 173.10 173.03 2x10 s GLU 241 N -5.95 4.48 0.26 2.90 0.41 -1.26 -4.90 118.70 114.63 2x10 s GLU 241 Ca 0.77 1.80 -0.20 0.00 -0.41 0.00 0.00 54.97 56.93 2x10 s GLU 241 Cb -0.02 -3.02 -0.09 0.00 -1.78 0.00 0.00 34.13 29.22 2x10 s GLU 241 CO 0.54 0.07 0.76 -1.83 -0.49 0.00 0.00 175.26 174.31 2x10 s GLU 242 N -1.73 4.26 0.02 1.61 4.04 -1.26 -2.91 118.70 122.73 2x10 s GLU 242 Ca 0.48 0.91 -0.36 0.00 0.04 0.00 0.00 54.97 56.04 2x10 s GLU 242 Cb -0.31 -2.79 -0.15 0.00 0.02 0.00 0.00 34.13 30.90 2x10 s GLU 242 CO 0.40 0.33 1.54 -2.30 -1.84 0.00 0.00 175.26 173.39 2x10 n PRO 243 N 0.52 1.53 -4.11 -4.83 -0.02 -1.26 -4.35 135.00 122.48 2x10 n PRO 243 Ca -0.01 0.56 -0.15 0.00 -2.02 0.00 0.00 63.50 61.88 2x10 n PRO 243 Cb 0.51 -2.26 -0.05 0.00 -0.02 0.00 0.00 33.50 31.68 2x10 n PRO 243 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2x10 s ARG 244 N 1.55 1.87 -0.00 -0.52 0.52 0.64 -2.42 118.95 120.59 2x10 s ARG 244 Ca 0.86 -1.78 0.00 0.00 -0.52 0.00 0.00 55.73 54.30 2x10 s ARG 244 Cb -0.87 0.42 0.01 0.00 0.52 0.00 0.00 34.95 35.03 2x10 s ARG 244 CO 0.48 -0.76 0.00 -1.01 0.02 0.00 0.00 175.30 174.03 2x10 s HIS 246 N -3.15 0.04 -0.42 -0.53 0.09 -1.26 -0.67 115.29 109.38 2x10 s HIS 246 Ca 0.32 0.02 -0.17 0.00 -0.00 0.00 0.00 55.06 55.23 2x10 s HIS 246 Cb 0.00 -0.07 0.02 0.00 -0.00 0.00 0.00 32.58 32.53 2x10 s HIS 246 CO 0.21 -0.02 0.42 0.00 -0.00 0.00 0.00 174.74 175.35 2x10 s ALA 248 N 2.08 2.95 0.29 0.00 0.00 0.12 -2.01 121.76 125.18 2x10 s ALA 248 Ca 0.11 -0.37 0.02 0.00 0.00 0.00 0.00 51.96 51.72 2x10 s ALA 248 Cb -0.18 -2.98 0.59 0.00 0.00 0.00 0.00 23.12 20.55 2x10 s ALA 248 CO 0.13 -1.08 1.83 -0.39 0.00 0.00 0.00 175.76 176.25 2x10 h VAL 249 N -0.58 0.89 0.00 0.00 -1.51 -1.87 -0.58 116.25 112.59 2x10 h VAL 249 Ca -0.45 -0.33 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 2x10 h VAL 249 Cb 1.25 -0.15 0.00 0.00 -2.13 0.00 0.00 31.29 30.26 2x10 h VAL 249 CO 0.63 0.17 0.00 -0.90 -1.23 0.00 0.00 177.57 176.25 2x10 n ASP 250 N -4.63 0.00 0.00 4.19 3.85 -1.26 -4.77 116.55 113.93 2x10 n ASP 250 Ca 0.20 -0.90 0.00 0.00 -0.71 0.00 0.00 54.79 53.37 2x10 n ASP 250 Cb 0.39 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.16 2x10 n ASP 250 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2x10 n GLY 251 N 0.41 0.49 3.50 6.12 0.00 -0.22 -4.92 105.19 110.57 2x10 n GLY 251 Ca 0.13 -0.86 -0.31 0.00 0.00 0.00 0.00 46.02 44.98 2x10 n GLY 251 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x10 s GLU 252 N -3.25 2.29 0.11 1.61 0.41 -1.24 -4.30 118.70 114.33 2x10 s GLU 252 Ca 0.00 -0.86 -0.30 0.00 -0.41 0.00 0.00 54.97 53.40 2x10 s GLU 252 Cb 0.00 -2.31 -0.06 0.00 -1.78 0.00 0.00 34.13 29.98 2x10 s GLU 252 CO 0.00 0.57 1.09 -1.58 -0.49 0.00 0.00 175.26 174.85 2x10 s TRP 253 N -0.91 3.60 0.00 1.61 0.52 -1.26 -0.70 118.94 121.79 2x10 s TRP 253 Ca 0.15 1.57 0.00 0.00 0.02 0.00 0.00 56.10 57.84 2x10 s TRP 253 Cb -0.11 -3.26 0.00 0.00 -1.15 0.00 0.00 33.47 28.96 2x10 s TRP 253 CO 0.05 -0.57 0.00 -0.11 0.02 0.00 0.00 176.95 176.34 2x10 n LEU 254 N 3.04 0.00 -4.17 2.99 -0.00 -0.04 -4.94 117.00 113.89 2x10 n LEU 254 Ca 0.05 0.00 -0.39 0.00 -0.00 0.00 0.00 56.01 55.67 2x10 n LEU 254 Cb 0.47 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.80 2x10 n LEU 254 CO 0.54 0.00 -0.07 -0.69 -0.00 0.00 0.00 177.39 177.16 2x10 s VAL 255 N 0.00 3.82 0.09 1.96 1.01 -1.26 -4.91 120.40 121.10 2x10 s VAL 255 Ca 0.00 -1.96 -0.31 0.00 0.00 0.00 0.00 61.98 59.71 2x10 s VAL 255 Cb 0.00 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.75 2x10 s VAL 255 CO 0.00 -0.75 1.55 -2.84 0.00 0.00 0.00 175.10 173.06 2x10 s PRO 256 N 1.19 4.24 -0.02 2.72 0.02 -1.26 -4.18 135.00 137.70 2x10 s PRO 256 Ca 0.07 2.24 0.06 0.00 0.02 0.00 0.00 61.00 63.40 2x10 s PRO 256 Cb -0.24 -3.43 -0.02 0.00 0.02 0.00 0.00 34.50 30.83 2x10 s PRO 256 CO -0.02 -0.63 -0.21 0.42 -0.33 0.00 0.00 177.00 176.22 2x10 s ILE 257 N 1.98 1.69 0.24 2.83 1.01 0.15 -4.99 121.20 124.11 2x10 s ILE 257 Ca 0.70 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 60.44 2x10 s ILE 257 Cb -0.39 -1.40 0.00 0.00 0.01 0.00 0.00 42.46 40.68 2x10 s ILE 257 CO 0.31 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.33 2x10 n GLY 258 N 2.60 -1.72 3.50 6.18 0.00 -1.26 -0.26 105.19 114.22 2x10 n GLY 258 Ca -0.16 -1.26 -0.12 0.00 0.00 0.00 0.00 46.02 44.49 2x10 n GLY 258 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2x10 s GLN 259 N -1.89 0.94 -0.12 1.61 0.74 -1.15 -4.66 119.66 115.14 2x10 s GLN 259 Ca 0.00 -0.15 -0.02 0.00 0.05 0.00 0.00 55.36 55.24 2x10 s GLN 259 Cb 0.00 0.44 -0.03 0.00 1.10 0.00 0.00 33.01 34.52 2x10 s GLN 259 CO 0.00 -0.37 -0.05 0.00 -0.55 0.00 0.00 175.29 174.32 2x10 s LEU 261 N -0.07 3.12 0.11 0.00 1.43 0.28 -4.27 118.68 119.28 2x10 s LEU 261 Ca 0.01 -0.48 -0.31 0.00 -1.03 0.00 0.00 54.13 52.32 2x10 s LEU 261 Cb -0.13 -1.80 -0.09 0.00 0.03 0.00 0.00 46.19 44.20 2x10 s LEU 261 CO 0.03 0.10 1.63 0.00 0.23 0.00 0.00 176.35 178.34 2x10 n GLN 263 N 4.96 0.10 -1.71 0.00 7.27 0.66 -4.06 117.38 124.60 2x10 n GLN 263 Ca 0.15 0.10 -0.42 0.00 0.07 0.00 0.00 57.00 56.90 2x10 n GLN 263 Cb 0.39 -2.26 -0.01 0.00 2.41 0.00 0.00 30.24 30.78 2x10 n GLN 263 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2x10 n ALA 264 N -3.25 1.60 0.00 1.69 0.00 -1.26 -1.51 120.51 117.78 2x10 n ALA 264 Ca 0.12 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2x10 n ALA 264 Cb 0.51 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.65 2x10 n ALA 264 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x10 n GLY 265 N 1.05 1.58 3.43 0.00 0.00 -0.05 -4.89 105.19 106.32 2x10 n GLY 265 Ca 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 2x10 n GLY 265 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x10 s TYR 266 N -2.33 2.18 0.12 1.61 1.51 -0.57 -0.07 117.35 119.80 2x10 s TYR 266 Ca 0.00 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 55.70 2x10 s TYR 266 Cb 0.00 -1.01 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 2x10 s TYR 266 CO 0.00 0.57 -0.06 -1.83 -1.11 0.00 0.00 175.55 173.12 2x10 s GLU 267 N -3.17 0.93 -0.14 -0.62 -1.05 0.55 -4.66 118.70 110.54 2x10 s GLU 267 Ca 0.25 -1.40 -0.25 0.00 -0.15 0.00 0.00 54.97 53.41 2x10 s GLU 267 Cb -0.06 -0.30 -0.02 0.00 -0.44 0.00 0.00 34.13 33.32 2x10 s GLU 267 CO 0.11 -0.02 0.82 0.21 0.95 0.00 0.00 175.26 177.33 2x10 s LYS 268 N -3.83 4.34 -0.16 -4.83 2.20 -1.26 -1.27 119.74 114.92 2x10 s LYS 268 Ca 0.15 1.02 0.00 0.00 -0.36 0.00 0.00 55.97 56.79 2x10 s LYS 268 Cb 0.05 -3.54 0.03 0.00 -1.51 0.00 0.00 37.83 32.85 2x10 s LYS 268 CO -0.02 -0.24 -0.13 0.08 -0.36 0.00 0.00 175.35 174.68 2x10 s VAL 269 N 1.82 1.57 0.00 4.02 1.01 -0.15 -4.94 120.40 123.73 2x10 s VAL 269 Ca 0.39 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.67 2x10 s VAL 269 Cb -0.17 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.69 2x10 s VAL 269 CO 0.15 0.39 0.00 -0.62 0.00 0.00 0.00 175.10 175.02 2x10 n GLU 270 N 4.76 0.00 -0.77 2.72 -0.58 -1.26 -1.15 120.64 124.36 2x10 n GLU 270 Ca -0.16 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.56 2x10 n GLU 270 Cb 0.49 0.00 0.20 0.00 -0.57 0.00 0.00 31.44 31.56 2x10 n GLU 270 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2x10 n ASP 271 N 7.11 2.25 -4.04 1.62 9.92 -1.26 -5.01 116.55 127.14 2x10 n ASP 271 Ca 0.00 -3.84 -0.22 0.00 -0.53 0.00 0.00 54.79 50.20 2x10 n ASP 271 Cb 0.00 -0.59 -0.09 0.00 -0.64 0.00 0.00 41.12 39.80 2x10 n ASP 271 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2x10 s ALA 272 N -3.27 2.35 -0.18 2.24 0.00 -0.30 -4.87 121.76 117.73 2x10 s ALA 272 Ca 0.42 -1.62 0.01 0.00 0.00 0.00 0.00 51.96 50.78 2x10 s ALA 272 Cb 0.39 0.98 0.02 0.00 0.00 0.00 0.00 23.12 24.52 2x10 s ALA 272 CO -0.03 -0.44 -0.18 0.00 0.00 0.00 0.00 175.76 175.11 2x10 s GLN 274 N 1.33 3.41 0.46 0.00 -0.21 -0.40 -4.88 119.66 119.37 2x10 s GLN 274 Ca 0.04 -0.73 -0.21 0.00 0.02 0.00 0.00 55.36 54.48 2x10 s GLN 274 Cb -0.13 -2.85 -0.09 0.00 1.00 0.00 0.00 33.01 30.94 2x10 s GLN 274 CO -0.12 0.35 1.04 0.00 -2.12 0.00 0.00 175.29 174.44 2x10 s ALA 275 N -2.04 2.95 0.33 6.09 0.00 -1.26 -0.33 121.76 127.49 2x10 s ALA 275 Ca 0.36 0.62 -0.29 0.00 0.00 0.00 0.00 51.96 52.65 2x10 s ALA 275 Cb -0.09 -3.25 -0.11 0.00 0.00 0.00 0.00 23.12 19.66 2x10 s ALA 275 CO 0.30 -0.25 1.52 0.00 0.00 0.00 0.00 175.76 177.33 2x10 n SER 277 N 1.30 -0.02 -4.68 0.00 7.64 -1.26 -0.60 113.62 116.00 2x10 n SER 277 Ca 0.05 0.53 -0.42 0.00 1.01 0.00 0.00 58.87 60.04 2x10 n SER 277 Cb 0.37 -1.40 -0.03 0.00 -1.01 0.00 0.00 64.21 62.15 2x10 n SER 277 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2x10 s PRO 278 N -3.81 4.19 0.00 1.43 0.02 -1.26 -1.88 135.00 133.69 2x10 s PRO 278 Ca 0.68 2.33 0.00 0.00 0.02 0.00 0.00 61.00 64.04 2x10 s PRO 278 Cb -0.28 -3.69 0.00 0.00 0.02 0.00 0.00 34.50 30.55 2x10 s PRO 278 CO 0.56 -0.77 0.00 0.41 -0.33 0.00 0.00 177.00 176.87 2x10 n GLY 279 N 4.05 0.77 3.60 0.52 0.00 -0.51 -4.86 105.19 108.76 2x10 n GLY 279 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 2x10 n GLY 279 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2x10 s PHE 280 N -2.00 2.11 0.14 1.61 0.08 -0.79 -1.62 117.98 117.51 2x10 s PHE 280 Ca 0.00 -0.90 -0.21 0.00 0.12 0.00 0.00 56.93 55.94 2x10 s PHE 280 Cb 0.00 -1.52 0.06 0.00 -0.57 0.00 0.00 43.02 40.98 2x10 s PHE 280 CO 0.00 0.18 0.54 -0.59 -0.10 0.00 0.00 175.22 175.24 2x10 s PHE 281 N -2.97 -0.43 -0.28 0.36 -0.12 0.12 -4.28 117.98 110.37 2x10 s PHE 281 Ca 0.26 0.22 0.02 0.00 -0.05 0.00 0.00 56.93 57.38 2x10 s PHE 281 Cb 0.06 0.45 0.16 0.00 -0.63 0.00 0.00 43.02 43.07 2x10 s PHE 281 CO 0.13 -0.79 0.43 0.21 -0.05 0.00 0.00 175.22 175.15 2x10 s LYS 282 N -3.64 0.43 0.05 1.99 2.20 -0.71 -1.62 119.74 118.43 2x10 s LYS 282 Ca 0.01 0.25 -0.17 0.00 -0.36 0.00 0.00 55.97 55.70 2x10 s LYS 282 Cb -0.00 -0.23 -0.19 0.00 -1.51 0.00 0.00 37.83 35.89 2x10 s LYS 282 CO -0.12 -0.98 1.21 0.27 -0.36 0.00 0.00 175.35 175.38 2x10 h PHE 283 N 8.14 0.77 -3.42 4.03 -5.15 -1.85 -0.09 116.94 119.37 2x10 h PHE 283 Ca -0.09 -0.36 -0.66 0.00 -0.20 0.00 0.00 57.97 56.66 2x10 h PHE 283 Cb 1.13 -0.11 -0.16 0.00 0.22 0.00 0.00 35.95 37.03 2x10 h PHE 283 CO 0.25 1.16 -0.76 -1.21 -2.00 0.00 0.00 178.31 175.75 2x10 s GLU 284 N -3.57 1.98 -0.65 6.09 2.02 -1.26 -4.72 118.70 118.59 2x10 s GLU 284 Ca -0.12 -1.17 -0.26 0.00 0.02 0.00 0.00 54.97 53.44 2x10 s GLU 284 Cb 0.06 -2.18 -0.02 0.00 0.10 0.00 0.00 34.13 32.09 2x10 s GLU 284 CO 0.85 0.47 1.79 0.00 0.02 0.00 0.00 175.26 178.39 2x10 s ALA 285 N -1.36 2.22 0.00 5.21 0.00 -1.26 -4.64 121.76 121.92 2x10 s ALA 285 Ca 0.21 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.38 2x10 s ALA 285 Cb -0.10 -4.32 0.00 0.00 0.00 0.00 0.00 23.12 18.70 2x10 s ALA 285 CO 0.13 -3.87 0.00 -1.13 0.00 0.00 0.00 175.76 170.88 2x10 n SER 286 N 12.39 1.84 -0.00 0.00 3.41 -1.26 -4.91 113.62 125.10 2x10 n SER 286 Ca 0.19 -0.34 0.09 0.00 -0.26 0.00 0.00 58.87 58.56 2x10 n SER 286 Cb 0.51 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.34 2x10 n SER 286 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2x10 n GLU 287 N 0.00 0.68 -1.21 4.33 1.02 -1.26 -4.17 120.64 120.02 2x10 n GLU 287 Ca 0.00 -0.08 -0.30 0.00 -0.02 0.00 0.00 57.16 56.75 2x10 n GLU 287 Cb 0.00 -1.43 0.12 0.00 -0.02 0.00 0.00 31.44 30.11 2x10 n GLU 287 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2x10 s SER 288 N -3.46 3.98 0.82 1.62 0.01 -1.26 -4.91 113.70 110.50 2x10 s SER 288 Ca 0.01 1.69 -0.11 0.00 1.31 0.00 0.00 55.95 58.84 2x10 s SER 288 Cb 0.13 -2.37 0.11 0.00 0.21 0.00 0.00 66.02 64.10 2x10 s SER 288 CO 0.79 -2.35 1.17 -2.84 0.41 0.00 0.00 173.24 170.43 2x10 s PRO 289 N -4.90 1.69 0.16 12.44 0.02 -1.26 -4.79 135.00 138.35 2x10 s PRO 289 Ca 0.62 -0.14 -0.31 0.00 0.02 0.00 0.00 61.00 61.19 2x10 s PRO 289 Cb -0.18 -1.99 -0.10 0.00 0.02 0.00 0.00 34.50 32.26 2x10 s PRO 289 CO 0.57 -1.71 1.52 0.00 -0.33 0.00 0.00 177.00 177.05 2x10 s LEU 291 N 1.01 4.23 0.49 0.00 1.02 -0.64 -4.82 118.68 119.97 2x10 s LEU 291 Ca 0.68 0.75 -0.21 0.00 0.02 0.00 0.00 54.13 55.37 2x10 s LEU 291 Cb -0.42 -3.44 -0.08 0.00 0.02 0.00 0.00 46.19 42.27 2x10 s LEU 291 CO 0.32 0.01 1.07 -1.83 0.02 0.00 0.00 176.35 175.94 2x10 s GLU 292 N -2.66 3.74 0.44 1.70 -1.05 -1.26 0.13 118.70 119.75 2x10 s GLU 292 Ca 0.43 1.45 -0.24 0.00 -0.15 0.00 0.00 54.97 56.47 2x10 s GLU 292 Cb -0.12 -2.14 -0.10 0.00 -0.44 0.00 0.00 34.13 31.34 2x10 s GLU 292 CO 0.23 -0.50 1.07 0.00 0.95 0.00 0.00 175.26 177.01 2x10 n PRO 294 N -0.03 -0.93 -2.27 0.00 -0.02 -1.26 -5.01 135.00 125.48 2x10 n PRO 294 Ca 0.09 -0.41 -0.38 0.00 -2.02 0.00 0.00 63.50 60.79 2x10 n PRO 294 Cb 0.40 -0.33 -0.01 0.00 -0.02 0.00 0.00 33.50 33.54 2x10 n PRO 294 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2x10 s GLU 295 N -3.58 3.89 -1.07 -0.52 2.02 -1.26 -3.80 118.70 114.38 2x10 s GLU 295 Ca 0.16 1.80 -0.01 0.00 0.02 0.00 0.00 54.97 56.94 2x10 s GLU 295 Cb -0.01 -2.53 0.00 0.00 0.10 0.00 0.00 34.13 31.69 2x10 s GLU 295 CO 0.12 -0.45 0.11 0.72 0.02 0.00 0.00 175.26 175.78 2x10 n HIS 296 N -0.23 -0.79 -4.38 1.61 8.25 -1.26 -3.31 115.22 115.11 2x10 n HIS 296 Ca 0.06 0.09 -0.25 0.00 -0.26 0.00 0.00 57.72 57.36 2x10 n HIS 296 Cb 0.47 -2.94 -0.12 0.00 1.12 0.00 0.00 29.99 28.52 2x10 n HIS 296 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2x10 s THR 297 N -2.73 2.10 0.12 1.59 -4.23 -1.25 -1.08 115.64 110.16 2x10 s THR 297 Ca 0.05 -1.93 -0.27 0.00 -1.18 0.00 0.00 61.69 58.37 2x10 s THR 297 Cb -0.02 -1.96 -0.07 0.00 1.34 0.00 0.00 72.50 71.79 2x10 s THR 297 CO 0.07 -0.17 0.85 -0.76 -0.54 0.00 0.00 174.62 174.07 2x10 s LEU 298 N -2.56 4.53 -0.24 4.79 1.43 0.16 -4.72 118.68 122.07 2x10 s LEU 298 Ca 0.17 1.66 -0.41 0.00 -1.03 0.00 0.00 54.13 54.53 2x10 s LEU 298 Cb -0.07 -3.40 -0.17 0.00 0.03 0.00 0.00 46.19 42.58 2x10 s LEU 298 CO 0.08 0.06 1.62 -0.81 0.23 0.00 0.00 176.35 177.53 2x10 n PRO 299 N 2.33 0.92 -2.70 1.29 -0.04 -1.26 -4.41 135.00 131.13 2x10 n PRO 299 Ca -0.02 0.34 -0.32 0.00 -0.04 0.00 0.00 63.50 63.45 2x10 n PRO 299 Cb 0.49 -1.98 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 2x10 n PRO 299 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2x10 s SER 300 N 2.78 6.75 0.82 3.54 1.04 -1.26 -4.84 113.70 122.53 2x10 s SER 300 Ca 0.97 1.53 -0.12 0.00 0.48 0.00 0.00 55.95 58.81 2x10 s SER 300 Cb -1.13 -2.48 0.08 0.00 0.10 0.00 0.00 66.02 62.59 2x10 s SER 300 CO 0.65 -0.43 1.13 -2.16 0.98 0.00 0.00 173.24 173.40 2x10 s PRO 301 N -3.58 1.89 0.43 4.02 0.04 -1.26 -1.43 135.00 135.11 2x10 s PRO 301 Ca 0.59 0.36 -0.24 0.00 0.04 0.00 0.00 61.00 61.74 2x10 s PRO 301 Cb -0.10 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 2x10 s PRO 301 CO 0.23 -1.69 1.10 -1.91 0.04 0.00 0.00 177.00 174.77 2x10 n GLU 302 N -3.43 1.53 -3.36 4.56 2.13 -1.26 -3.09 120.64 117.72 2x10 n GLU 302 Ca 0.07 0.55 -0.18 0.00 0.66 0.00 0.00 57.16 58.26 2x10 n GLU 302 Cb 0.59 -2.17 0.08 0.00 0.27 0.00 0.00 31.44 30.20 2x10 n GLU 302 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2x10 n GLY 303 N 1.05 -0.32 3.77 8.31 0.00 0.23 -4.90 105.19 113.33 2x10 n GLY 303 Ca 0.09 0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 2x10 n GLY 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x10 s ALA 304 N -3.30 3.44 -2.01 4.61 0.00 -1.18 -4.70 121.76 118.63 2x10 s ALA 304 Ca 0.24 0.30 0.20 0.00 0.00 0.00 0.00 51.96 52.70 2x10 s ALA 304 Cb -0.10 -2.93 0.03 0.00 0.00 0.00 0.00 23.12 20.12 2x10 s ALA 304 CO 0.65 0.24 1.03 0.25 0.00 0.00 0.00 175.76 177.93 2x10 n THR 305 N 1.94 0.00 -3.63 0.00 -2.24 -1.26 -1.74 114.28 107.36 2x10 n THR 305 Ca -0.05 -0.34 -0.07 0.00 -2.27 0.00 0.00 64.05 61.32 2x10 n THR 305 Cb 0.49 1.28 -0.06 0.00 -2.10 0.00 0.00 70.33 69.94 2x10 n THR 305 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2x10 s SER 306 N -2.12 -0.25 -0.34 3.42 0.15 -1.26 -3.46 113.70 109.84 2x10 s SER 306 Ca 0.18 0.40 -0.11 0.00 0.70 0.00 0.00 55.95 57.12 2x10 s SER 306 Cb 0.16 0.37 0.01 0.00 -1.71 0.00 0.00 66.02 64.85 2x10 s SER 306 CO 0.44 -0.14 0.19 0.00 1.20 0.00 0.00 173.24 174.93 2x10 s GLU 308 N 1.61 3.27 0.02 0.00 2.12 -1.26 -4.71 118.70 119.74 2x10 s GLU 308 Ca 0.04 2.12 -0.17 0.00 0.36 0.00 0.00 54.97 57.31 2x10 s GLU 308 Cb -0.18 -2.28 -0.06 0.00 0.26 0.00 0.00 34.13 31.87 2x10 s GLU 308 CO 0.07 -1.05 0.50 0.00 -0.54 0.00 0.00 175.26 174.24 2x10 s GLU 310 N -0.82 2.94 -0.11 0.00 -1.05 -0.24 -4.79 118.70 114.63 2x10 s GLU 310 Ca 0.27 2.01 -0.37 0.00 -0.15 0.00 0.00 54.97 56.72 2x10 s GLU 310 Cb -0.18 -2.02 -0.15 0.00 -0.44 0.00 0.00 34.13 31.35 2x10 s GLU 310 CO 0.16 -1.28 1.69 -1.91 0.95 0.00 0.00 175.26 174.86 2x10 n GLU 311 N -1.46 1.54 0.00 -4.83 2.13 -1.26 -1.48 120.64 115.28 2x10 n GLU 311 Ca 0.13 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.51 2x10 n GLU 311 Cb 0.48 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.90 2x10 n GLU 311 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2x10 n GLY 312 N 3.85 1.07 3.54 8.31 0.00 -1.26 -5.10 105.19 115.60 2x10 n GLY 312 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 2x10 n GLY 312 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2x10 s PHE 313 N -1.24 2.50 0.19 1.61 0.08 -0.55 -4.84 117.98 115.73 2x10 s PHE 313 Ca 0.00 -0.27 -0.06 0.00 0.12 0.00 0.00 56.93 56.71 2x10 s PHE 313 Cb 0.00 -1.16 -0.02 0.00 -0.57 0.00 0.00 43.02 41.27 2x10 s PHE 313 CO 0.00 0.59 0.25 -0.06 -0.10 0.00 0.00 175.22 175.90 2x10 s PHE 314 N -2.07 0.67 0.05 0.36 0.08 -0.34 -4.66 117.98 112.06 2x10 s PHE 314 Ca 0.27 -0.99 0.08 0.00 0.12 0.00 0.00 56.93 56.40 2x10 s PHE 314 Cb -0.07 -0.20 -0.03 0.00 -0.57 0.00 0.00 43.02 42.15 2x10 s PHE 314 CO 0.15 -0.73 -0.21 1.03 -0.10 0.00 0.00 175.22 175.36 2x10 s ARG 315 N -4.04 1.42 0.48 0.44 0.52 -1.26 -0.21 118.95 116.30 2x10 s ARG 315 Ca 0.25 -0.97 -0.07 0.00 -0.52 0.00 0.00 55.73 54.42 2x10 s ARG 315 Cb 0.04 -1.55 -0.04 0.00 0.52 0.00 0.00 34.95 33.92 2x10 s ARG 315 CO 0.05 0.39 0.81 0.00 0.02 0.00 0.00 175.30 176.58 2x10 s ALA 316 N -0.81 3.35 0.23 2.13 0.00 -1.26 -4.95 121.76 120.44 2x10 s ALA 316 Ca 0.08 -0.38 -0.06 0.00 0.00 0.00 0.00 51.96 51.60 2x10 s ALA 316 Cb -0.09 -2.68 0.34 0.00 0.00 0.00 0.00 23.12 20.69 2x10 s ALA 316 CO 0.02 -0.32 1.82 -1.35 0.00 0.00 0.00 175.76 175.93 2x10 h PRO 317 N 0.38 0.77 -0.24 0.00 0.11 -2.01 0.56 132.00 131.56 2x10 h PRO 317 Ca -0.47 -0.05 0.07 0.00 0.11 0.00 0.00 66.00 65.67 2x10 h PRO 317 Cb 1.20 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2x10 h PRO 317 CO 0.62 0.51 0.19 1.96 -0.21 0.00 0.00 178.00 181.06 2x10 h GLN 318 N 0.79 0.00 -6.50 1.05 4.20 -1.96 -3.43 115.11 109.26 2x10 h GLN 318 Ca 0.37 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.54 2x10 h GLN 318 Cb 0.28 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.08 2x10 h GLN 318 CO -0.22 0.00 0.73 -0.51 -0.67 0.00 0.00 178.83 178.16 2x10 s ASP 319 N -6.51 6.86 0.47 1.46 1.01 0.19 -5.02 116.67 115.13 2x10 s ASP 319 Ca -0.05 2.24 -0.23 0.00 0.71 0.00 0.00 52.55 55.23 2x10 s ASP 319 Cb 0.18 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.46 2x10 s ASP 319 CO 0.67 -0.65 1.18 -2.16 0.21 0.00 0.00 175.17 174.43 2x10 s PRO 320 N 1.40 3.70 0.00 8.23 0.04 -1.26 -4.82 135.00 142.29 2x10 s PRO 320 Ca 0.64 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.49 2x10 s PRO 320 Cb -0.35 -2.39 0.00 0.00 0.04 0.00 0.00 34.50 31.80 2x10 s PRO 320 CO 0.29 -0.61 0.51 0.00 0.04 0.00 0.00 177.00 177.23 2x10 n ALA 321 N -0.54 2.03 -0.48 8.56 0.00 -1.26 -4.86 120.51 123.97 2x10 n ALA 321 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.36 2x10 n ALA 321 Cb 0.48 -1.00 0.11 0.00 0.00 0.00 0.00 19.45 19.04 2x10 n ALA 321 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2x10 n SER 322 N -0.30 3.82 -4.61 0.00 3.41 -1.26 -4.78 113.62 109.89 2x10 n SER 322 Ca 0.00 -3.05 -0.31 0.00 -0.26 0.00 0.00 58.87 55.25 2x10 n SER 322 Cb 0.04 -0.75 -0.10 0.00 -0.26 0.00 0.00 64.21 63.14 2x10 n SER 322 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2x10 s PRO 324 N -2.13 2.47 0.42 4.33 0.04 -1.26 -4.78 135.00 134.09 2x10 s PRO 324 Ca 0.37 -0.80 -0.26 0.00 0.04 0.00 0.00 61.00 60.35 2x10 s PRO 324 Cb 0.31 -2.47 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 2x10 s PRO 324 CO 0.06 0.57 1.39 0.00 0.04 0.00 0.00 177.00 179.07 2x10 n THR 326 N -0.06 0.00 -4.17 0.00 -2.24 0.71 -4.72 114.28 103.81 2x10 n THR 326 Ca 0.05 -1.48 -0.11 0.00 -2.27 0.00 0.00 64.05 60.23 2x10 n THR 326 Cb 0.40 0.26 -0.10 0.00 -2.10 0.00 0.00 70.33 68.79 2x10 n THR 326 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2x10 s ARG 327 N -3.16 0.82 0.73 -0.78 0.52 0.51 -1.20 118.95 116.39 2x10 s ARG 327 Ca 0.02 -1.28 -0.15 0.00 -0.52 0.00 0.00 55.73 53.80 2x10 s ARG 327 Cb -0.00 -0.27 0.04 0.00 0.52 0.00 0.00 34.95 35.24 2x10 s ARG 327 CO 0.01 0.00 1.20 -2.14 0.02 0.00 0.00 175.30 174.39 2x10 s PRO 328 N -3.54 2.14 0.76 3.54 0.02 -1.26 -4.19 135.00 132.47 2x10 s PRO 328 Ca 0.10 1.71 -0.12 0.00 0.02 0.00 0.00 61.00 62.71 2x10 s PRO 328 Cb 0.03 -1.84 0.05 0.00 0.02 0.00 0.00 34.50 32.76 2x10 s PRO 328 CO -0.04 -1.83 1.14 -2.14 -0.33 0.00 0.00 177.00 173.81 2x10 s PRO 329 N -3.97 2.37 0.45 5.54 0.02 -1.26 -4.29 135.00 133.86 2x10 s PRO 329 Ca 0.73 0.27 -0.05 0.00 0.02 0.00 0.00 61.00 61.97 2x10 s PRO 329 Cb -0.28 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.22 2x10 s PRO 329 CO 0.46 -1.34 0.75 -1.54 -0.33 0.00 0.00 177.00 175.00 2x10 s SER 330 N -4.48 6.31 0.84 2.53 1.04 -0.64 -4.83 113.70 114.48 2x10 s SER 330 Ca 0.60 0.90 -0.13 0.00 0.48 0.00 0.00 55.95 57.80 2x10 s SER 330 Cb -0.11 -2.23 0.05 0.00 0.10 0.00 0.00 66.02 63.82 2x10 s SER 330 CO 0.50 -0.51 0.79 0.00 0.98 0.00 0.00 173.24 175.00 2x10 n ALA 331 N -2.01 -1.27 -1.40 5.32 0.00 -1.26 -4.41 120.51 115.48 2x10 n ALA 331 Ca 0.00 -0.42 -0.41 0.00 0.00 0.00 0.00 53.44 52.62 2x10 n ALA 331 Cb 0.55 -2.01 0.01 0.00 0.00 0.00 0.00 19.45 18.00 2x10 n ALA 331 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2x10 n PRO 332 N -2.27 0.39 0.10 0.00 -0.02 -1.26 -4.22 135.00 127.71 2x10 n PRO 332 Ca 0.10 0.14 -0.13 0.00 -2.02 0.00 0.00 63.50 61.60 2x10 n PRO 332 Cb 0.51 -1.39 -0.08 0.00 -0.02 0.00 0.00 33.50 32.53 2x10 n PRO 332 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2x10 h HIS 333 N 0.52 -0.16 -3.86 6.00 2.76 -1.25 -3.45 115.15 115.71 2x10 h HIS 333 Ca -0.41 -0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 57.66 2x10 h HIS 333 Cb 1.41 0.05 -0.13 0.00 1.55 0.00 0.00 27.41 30.29 2x10 h HIS 333 CO 0.32 -0.04 -0.36 0.71 -1.30 0.00 0.00 177.93 177.27 2x10 s TYR 334 N -5.86 0.27 -0.04 5.26 2.02 -1.26 -5.01 117.35 112.73 2x10 s TYR 334 Ca -0.14 -0.67 -0.02 0.00 -0.37 0.00 0.00 57.07 55.87 2x10 s TYR 334 Cb 0.05 -0.07 0.03 0.00 -0.40 0.00 0.00 41.96 41.57 2x10 s TYR 334 CO 0.65 -0.61 0.08 -1.17 -1.57 0.00 0.00 175.55 172.93 2x10 s LEU 335 N -2.91 0.69 0.22 -1.29 0.20 -1.26 -2.98 118.68 111.35 2x10 s LEU 335 Ca 0.10 0.15 0.11 0.00 0.69 0.00 0.00 54.13 55.19 2x10 s LEU 335 Cb 0.04 0.08 -0.05 0.00 -0.43 0.00 0.00 46.19 45.84 2x10 s LEU 335 CO -0.06 -0.17 -0.23 0.42 -0.29 0.00 0.00 176.35 176.02 2x10 s THR 336 N 1.42 2.37 -0.47 3.68 -4.23 -0.02 -4.96 115.64 113.43 2x10 s THR 336 Ca -0.05 -2.14 0.06 0.00 -1.18 0.00 0.00 61.69 58.38 2x10 s THR 336 Cb -0.12 -2.17 0.21 0.00 1.34 0.00 0.00 72.50 71.76 2x10 s THR 336 CO -0.04 -0.21 0.66 0.00 -0.54 0.00 0.00 174.62 174.49 2x10 n ALA 337 N 0.00 -0.04 -2.63 3.99 0.00 -1.23 -1.87 120.51 118.73 2x10 n ALA 337 Ca -0.10 -1.97 -0.41 0.00 0.00 0.00 0.00 53.44 50.96 2x10 n ALA 337 Cb 0.57 -1.18 -0.05 0.00 0.00 0.00 0.00 19.45 18.79 2x10 n ALA 337 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2x10 s VAL 338 N 0.30 4.87 0.00 0.00 0.11 -1.14 -4.70 120.40 119.84 2x10 s VAL 338 Ca 0.32 1.41 0.00 0.00 -2.93 0.00 0.00 61.98 60.78 2x10 s VAL 338 Cb 0.10 -4.07 0.00 0.00 -1.53 0.00 0.00 36.38 30.88 2x10 s VAL 338 CO -0.15 -0.07 0.00 0.61 -3.33 0.00 0.00 175.10 172.16 2x10 n GLY 339 N 3.91 1.99 0.00 6.54 0.00 -1.26 -1.31 105.19 115.06 2x10 n GLY 339 Ca 0.04 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.97 2x10 n GLY 339 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x10 n GLY 341 N 5.00 0.00 0.04 -0.02 0.00 -1.26 -4.90 105.19 104.06 2x10 n GLY 341 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2x10 n GLY 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x10 n ALA 342 N 0.00 4.60 -2.00 4.61 0.00 -1.26 -4.88 120.51 121.58 2x10 n ALA 342 Ca 0.00 -0.59 -0.22 0.00 0.00 0.00 0.00 53.44 52.63 2x10 n ALA 342 Cb 0.00 -0.79 0.08 0.00 0.00 0.00 0.00 19.45 18.74 2x10 n ALA 342 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2x10 s LYS 343 N -2.95 2.06 0.03 0.00 1.02 -1.26 -3.10 119.74 115.54 2x10 s LYS 343 Ca 0.09 -1.16 -0.23 0.00 0.02 0.00 0.00 55.97 54.68 2x10 s LYS 343 Cb 0.16 -2.46 0.05 0.00 -0.52 0.00 0.00 37.83 35.07 2x10 s LYS 343 CO 0.84 -1.10 0.54 0.54 -0.92 0.00 0.00 175.35 175.24 2x10 s VAL 344 N -2.91 0.03 -0.33 3.17 0.11 -0.64 -4.38 120.40 115.43 2x10 s VAL 344 Ca 0.63 -0.21 0.04 0.00 -2.93 0.00 0.00 61.98 59.51 2x10 s VAL 344 Cb -0.07 -0.96 0.10 0.00 -1.53 0.00 0.00 36.38 33.92 2x10 s VAL 344 CO 0.41 -0.12 0.04 -1.61 -3.33 0.00 0.00 175.10 170.50 2x10 s GLU 345 N -2.26 1.53 -0.82 1.54 0.41 -0.43 -3.14 118.70 115.53 2x10 s GLU 345 Ca -0.06 -1.84 -0.22 0.00 -0.41 0.00 0.00 54.97 52.44 2x10 s GLU 345 Cb -0.01 -3.19 0.09 0.00 -1.78 0.00 0.00 34.13 29.24 2x10 s GLU 345 CO -0.00 -0.91 1.12 -0.51 -0.49 0.00 0.00 175.26 174.46 2x10 s LEU 346 N 0.91 4.38 -0.03 1.80 1.02 -0.83 -2.87 118.68 123.06 2x10 s LEU 346 Ca 0.10 -1.38 -0.08 0.00 0.02 0.00 0.00 54.13 52.79 2x10 s LEU 346 Cb -0.19 -2.45 -0.05 0.00 0.02 0.00 0.00 46.19 43.53 2x10 s LEU 346 CO -0.08 -1.35 0.24 -0.13 0.02 0.00 0.00 176.35 175.05 2x10 s ARG 347 N 3.86 3.58 0.27 1.70 3.00 -0.78 -2.21 118.95 128.36 2x10 s ARG 347 Ca 0.30 -0.03 -0.13 0.00 0.00 0.00 0.00 55.73 55.87 2x10 s ARG 347 Cb -0.09 -3.14 0.00 0.00 0.00 0.00 0.00 34.95 31.72 2x10 s ARG 347 CO 0.01 0.70 0.53 1.67 0.00 0.00 0.00 175.30 178.21 2x10 s TRP 348 N -1.18 0.32 0.06 -0.53 1.48 -0.76 -0.84 118.94 117.49 2x10 s TRP 348 Ca 0.23 -0.71 0.06 0.00 -1.06 0.00 0.00 56.10 54.62 2x10 s TRP 348 Cb -0.13 0.28 -0.03 0.00 -1.16 0.00 0.00 33.47 32.43 2x10 s TRP 348 CO 0.12 -1.08 -0.16 0.95 -4.06 0.00 0.00 176.95 172.72 2x10 s THR 349 N -3.83 1.29 0.68 0.66 -4.23 -1.16 -4.78 115.64 104.27 2x10 s THR 349 Ca 0.21 -1.21 -0.17 0.00 -1.18 0.00 0.00 61.69 59.34 2x10 s THR 349 Cb -0.02 -1.18 -0.06 0.00 1.34 0.00 0.00 72.50 72.59 2x10 s THR 349 CO 0.10 -0.05 0.49 -2.65 -0.54 0.00 0.00 174.62 171.97 2x10 n PRO 350 N 1.57 0.35 -1.15 3.99 -0.02 -1.26 -1.56 135.00 136.93 2x10 n PRO 350 Ca -0.19 0.15 -0.36 0.00 -2.02 0.00 0.00 63.50 61.08 2x10 n PRO 350 Cb 0.54 -1.76 0.06 0.00 -0.02 0.00 0.00 33.50 32.32 2x10 n PRO 350 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2x10 n PRO 351 N -0.44 0.12 0.05 0.52 -0.02 -1.26 -3.20 135.00 130.77 2x10 n PRO 351 Ca 0.10 0.07 0.13 0.00 -2.02 0.00 0.00 63.50 61.78 2x10 n PRO 351 Cb 0.49 -1.57 0.50 0.00 -0.02 0.00 0.00 33.50 32.90 2x10 n PRO 351 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2x10 n GLN 352 N -0.00 0.13 -3.49 -0.52 7.27 -1.26 -4.48 117.38 115.02 2x10 n GLN 352 Ca 0.07 0.13 -0.27 0.00 0.07 0.00 0.00 57.00 57.00 2x10 n GLN 352 Cb 0.51 -1.66 -0.13 0.00 2.41 0.00 0.00 30.24 31.37 2x10 n GLN 352 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2x10 s ASP 353 N -3.75 3.05 0.08 1.69 2.15 -1.26 -4.99 116.67 113.64 2x10 s ASP 353 Ca 0.12 -1.49 0.11 0.00 0.43 0.00 0.00 52.55 51.71 2x10 s ASP 353 Cb 0.15 -0.22 0.50 0.00 -0.30 0.00 0.00 42.92 43.05 2x10 s ASP 353 CO 0.54 -0.39 1.34 -1.54 -0.17 0.00 0.00 175.17 174.95 2x10 n SER 354 N 4.87 0.16 0.00 -0.34 3.41 -1.26 -1.62 113.62 118.84 2x10 n SER 354 Ca 0.00 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 2x10 n SER 354 Cb 0.41 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 2x10 n SER 354 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x10 n GLY 355 N -0.79 0.50 1.24 5.00 0.00 -1.26 -3.33 105.19 106.55 2x10 n GLY 355 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2x10 n GLY 355 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x10 n GLY 356 N -2.09 0.91 3.26 -0.02 0.00 -1.26 -0.37 105.19 105.62 2x10 n GLY 356 Ca 0.00 -0.55 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 2x10 n GLY 356 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x10 s ARG 357 N -3.35 1.30 0.00 1.61 0.52 -1.21 -4.88 118.95 112.95 2x10 s ARG 357 Ca 0.00 -1.69 0.02 0.00 -0.52 0.00 0.00 55.73 53.54 2x10 s ARG 357 Cb 0.00 -0.03 0.00 0.00 0.52 0.00 0.00 34.95 35.44 2x10 s ARG 357 CO 0.00 -0.33 0.36 0.39 0.02 0.00 0.00 175.30 175.74 2x10 n GLU 358 N -0.37 2.24 -1.80 3.54 4.71 -1.26 -4.78 120.64 122.91 2x10 n GLU 358 Ca 0.01 -0.36 -0.37 0.00 -0.01 0.00 0.00 57.16 56.42 2x10 n GLU 358 Cb 0.66 -0.85 0.03 0.00 -1.01 0.00 0.00 31.44 30.27 2x10 n GLU 358 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 2x10 n ASP 359 N -0.37 7.38 -4.68 1.62 3.85 -1.26 -4.97 116.55 118.13 2x10 n ASP 359 Ca 0.01 -3.73 -0.40 0.00 -0.71 0.00 0.00 54.79 49.95 2x10 n ASP 359 Cb 0.04 -1.09 -0.05 0.00 -1.35 0.00 0.00 41.12 38.67 2x10 n ASP 359 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.20 176.46 2x10 s ILE 360 N -4.62 5.02 0.17 2.12 -4.36 -1.26 -3.56 121.20 114.72 2x10 s ILE 360 Ca 0.54 1.28 0.10 0.00 -0.26 0.00 0.00 60.65 62.30 2x10 s ILE 360 Cb 0.43 -3.98 -0.04 0.00 1.25 0.00 0.00 42.46 40.12 2x10 s ILE 360 CO -0.36 0.15 -0.22 0.68 0.24 0.00 0.00 174.94 175.43 2x10 s VAL 361 N 1.60 2.06 -0.02 8.37 -7.23 0.82 -4.86 120.40 121.14 2x10 s VAL 361 Ca 0.32 -1.90 0.05 0.00 -1.81 0.00 0.00 61.98 58.63 2x10 s VAL 361 Cb -0.16 -1.93 -0.03 0.00 0.56 0.00 0.00 36.38 34.82 2x10 s VAL 361 CO 0.12 -0.17 -0.15 -0.31 -0.31 0.00 0.00 175.10 174.28 2x10 s TYR 362 N -1.70 2.67 -0.02 2.82 2.02 -0.19 -1.16 117.35 121.80 2x10 s TYR 362 Ca 0.16 -0.18 0.07 0.00 -0.37 0.00 0.00 57.07 56.75 2x10 s TYR 362 Cb -0.08 -1.58 -0.02 0.00 -0.40 0.00 0.00 41.96 39.89 2x10 s TYR 362 CO 0.08 0.21 -0.23 0.45 -1.57 0.00 0.00 175.55 174.49 2x10 s SER 363 N -0.98 2.74 -0.09 2.29 0.15 -0.23 -1.32 113.70 116.25 2x10 s SER 363 Ca 0.13 -0.42 0.02 0.00 0.70 0.00 0.00 55.95 56.37 2x10 s SER 363 Cb -0.11 -0.35 0.01 0.00 -1.71 0.00 0.00 66.02 63.87 2x10 s SER 363 CO 0.02 0.28 -0.13 0.54 1.20 0.00 0.00 173.24 175.15 2x10 s VAL 364 N -0.51 1.31 0.34 4.45 0.11 -0.99 -1.13 120.40 123.98 2x10 s VAL 364 Ca 0.08 -0.55 0.00 0.00 -2.93 0.00 0.00 61.98 58.59 2x10 s VAL 364 Cb -0.09 -1.21 0.00 0.00 -1.53 0.00 0.00 36.38 33.55 2x10 s VAL 364 CO -0.01 0.40 0.04 0.35 -3.33 0.00 0.00 175.10 172.56 2x10 n THR 365 N 4.10 0.00 -3.72 5.04 -2.24 -0.37 -4.78 114.28 112.31 2x10 n THR 365 Ca -0.20 -1.57 -0.13 0.00 -2.27 0.00 0.00 64.05 59.88 2x10 n THR 365 Cb 0.51 0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 68.89 2x10 n THR 365 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x10 s GLU 367 N 0.17 2.59 -0.14 0.00 2.02 0.94 -1.46 118.70 122.83 2x10 s GLU 367 Ca -0.01 -0.66 -0.04 0.00 0.02 0.00 0.00 54.97 54.28 2x10 s GLU 367 Cb -0.03 -2.50 -0.07 0.00 0.10 0.00 0.00 34.13 31.63 2x10 s GLU 367 CO 0.01 0.63 -0.16 0.94 0.02 0.00 0.00 175.26 176.69 2x10 n GLN 368 N 1.94 0.32 -2.37 1.61 7.27 -1.26 -1.87 117.38 123.02 2x10 n GLN 368 Ca -0.17 0.11 -0.04 0.00 0.07 0.00 0.00 57.00 56.98 2x10 n GLN 368 Cb 0.53 -1.12 -0.01 0.00 2.41 0.00 0.00 30.24 32.05 2x10 n GLN 368 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2x10 n GLY 377 N 2.15 2.97 3.71 0.00 0.00 -1.26 -5.13 105.19 107.62 2x10 n GLY 377 Ca -0.01 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 2x10 n GLY 377 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2x10 n PRO 378 N -1.74 2.23 -2.19 1.61 -0.02 -1.26 -4.52 135.00 129.10 2x10 n PRO 378 Ca 0.00 0.78 -0.37 0.00 -2.02 0.00 0.00 63.50 61.89 2x10 n PRO 378 Cb 0.00 -2.42 -0.00 0.00 -0.02 0.00 0.00 33.50 31.06 2x10 n PRO 378 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x10 n GLU 380 N -0.54 3.76 -0.16 0.00 1.02 -1.26 -4.90 120.64 118.56 2x10 n GLU 380 Ca 0.08 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.33 2x10 n GLU 380 Cb 0.47 0.00 0.25 0.00 -0.02 0.00 0.00 31.44 32.14 2x10 n GLU 380 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2x10 n ALA 381 N -3.00 2.45 0.18 0.62 0.00 -1.26 -4.47 120.51 115.03 2x10 n ALA 381 Ca 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 53.44 52.65 2x10 n ALA 381 Cb 0.00 -0.93 0.60 0.00 0.00 0.00 0.00 19.45 19.13 2x10 n ALA 381 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2x10 h SER 382 N 3.93 0.09 -3.23 0.00 4.64 -1.93 -3.42 113.55 113.64 2x10 h SER 382 Ca 0.00 -0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 2x10 h SER 382 Cb 0.86 -0.02 -0.07 0.00 -0.31 0.00 0.00 62.40 62.86 2x10 h SER 382 CO 0.00 0.06 -0.19 -0.69 -0.87 0.00 0.00 176.83 175.15 2x10 s VAL 383 N -5.15 5.15 -0.22 0.95 1.01 -1.26 -4.76 120.40 116.13 2x10 s VAL 383 Ca -0.06 0.86 -0.10 0.00 0.00 0.00 0.00 61.98 62.68 2x10 s VAL 383 Cb 0.17 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 2x10 s VAL 383 CO 0.69 0.42 0.14 -0.13 0.00 0.00 0.00 175.10 176.21 2x10 s ARG 384 N 0.05 4.10 -0.11 2.72 3.00 -0.78 -4.93 118.95 122.99 2x10 s ARG 384 Ca 0.24 -0.26 -0.13 0.00 0.00 0.00 0.00 55.73 55.58 2x10 s ARG 384 Cb -0.15 -3.45 -0.05 0.00 0.00 0.00 0.00 34.95 31.30 2x10 s ARG 384 CO 0.10 0.18 0.30 0.71 0.00 0.00 0.00 175.30 176.59 2x10 s TYR 385 N 0.71 3.55 0.59 -0.53 2.02 -1.26 -1.30 117.35 121.13 2x10 s TYR 385 Ca 0.07 0.69 0.29 0.00 -0.37 0.00 0.00 57.07 57.76 2x10 s TYR 385 Cb -0.12 -2.27 1.75 0.00 -0.40 0.00 0.00 41.96 40.92 2x10 s TYR 385 CO 0.01 0.42 2.18 0.66 -1.57 0.00 0.00 175.55 177.26 2x10 h SER 386 N 5.90 0.00 -5.22 2.29 4.64 -1.27 -3.43 113.55 116.47 2x10 h SER 386 Ca -0.46 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.75 2x10 h SER 386 Cb 1.19 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.14 2x10 h SER 386 CO 0.69 0.00 -0.51 -1.61 -0.87 0.00 0.00 176.83 174.53 2x10 s GLU 387 N -4.63 0.78 0.12 4.77 0.41 -1.26 -5.00 118.70 113.89 2x10 s GLU 387 Ca -0.05 -1.12 -0.35 0.00 -0.41 0.00 0.00 54.97 53.04 2x10 s GLU 387 Cb 0.15 0.28 -0.16 0.00 -1.78 0.00 0.00 34.13 32.63 2x10 s GLU 387 CO 0.54 -0.21 1.40 -0.35 -0.49 0.00 0.00 175.26 176.15 2x10 n PRO 388 N -0.01 1.47 0.15 0.39 -0.04 -1.26 -4.87 135.00 130.84 2x10 n PRO 388 Ca -0.13 0.53 0.02 0.00 -0.04 0.00 0.00 63.50 63.88 2x10 n PRO 388 Cb 0.62 -2.20 0.17 0.00 -0.04 0.00 0.00 33.50 32.06 2x10 n PRO 388 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 2x10 h PRO 389 N 4.85 0.00 -5.31 0.54 0.11 -1.94 -3.43 132.00 126.81 2x10 h PRO 389 Ca -0.46 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.00 2x10 h PRO 389 Cb 1.31 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 32.17 2x10 h PRO 389 CO 0.80 0.51 -0.73 -1.01 -0.21 0.00 0.00 178.00 177.36 2x10 s HIS 390 N -3.31 2.88 0.00 0.65 3.76 -1.26 -2.36 115.29 115.65 2x10 s HIS 390 Ca 0.01 -0.53 0.00 0.00 -0.15 0.00 0.00 55.06 54.39 2x10 s HIS 390 Cb 0.10 -1.88 0.00 0.00 1.11 0.00 0.00 32.58 31.91 2x10 s HIS 390 CO 0.73 -0.15 0.00 0.41 -0.85 0.00 0.00 174.74 174.87 2x10 n GLY 391 N 3.52 0.60 3.91 -2.22 0.00 -1.21 -5.04 105.19 104.75 2x10 n GLY 391 Ca -0.18 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 2x10 n GLY 391 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x10 s LEU 392 N -2.15 4.21 0.00 0.99 1.43 -0.44 -4.89 118.68 117.83 2x10 s LEU 392 Ca 0.00 0.52 0.00 0.00 -1.03 0.00 0.00 54.13 53.62 2x10 s LEU 392 Cb 0.00 -3.28 0.00 0.00 0.03 0.00 0.00 46.19 42.94 2x10 s LEU 392 CO 0.00 -0.04 0.00 0.35 0.23 0.00 0.00 176.35 176.89 2x10 n THR 393 N -0.45 0.00 -2.03 5.49 -2.24 -1.26 -1.02 114.28 112.77 2x10 n THR 393 Ca -0.03 -0.22 -0.28 0.00 -2.27 0.00 0.00 64.05 61.24 2x10 n THR 393 Cb 0.53 0.72 0.19 0.00 -2.10 0.00 0.00 70.33 69.67 2x10 n THR 393 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2x10 n ARG 394 N -1.26 -1.12 -1.92 -0.78 1.74 -1.26 -4.98 116.66 107.08 2x10 n ARG 394 Ca 0.00 -2.16 -0.05 0.00 -0.77 0.00 0.00 57.85 54.86 2x10 n ARG 394 Cb 0.00 -1.26 0.06 0.00 -1.02 0.00 0.00 32.46 30.24 2x10 n ARG 394 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2x10 n THR 395 N -3.69 1.56 -3.64 0.55 -2.24 -1.26 -4.83 114.28 100.72 2x10 n THR 395 Ca 0.17 -2.98 -0.08 0.00 -2.27 0.00 0.00 64.05 58.89 2x10 n THR 395 Cb 0.58 0.25 -0.07 0.00 -2.10 0.00 0.00 70.33 68.99 2x10 n THR 395 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2x10 s SER 396 N -3.28 -0.46 -0.00 3.42 1.04 -1.26 -1.83 113.70 111.33 2x10 s SER 396 Ca 0.37 0.87 -0.07 0.00 0.48 0.00 0.00 55.95 57.60 2x10 s SER 396 Cb 0.37 0.92 0.00 0.00 0.10 0.00 0.00 66.02 67.41 2x10 s SER 396 CO -0.05 -0.15 0.13 -0.69 0.98 0.00 0.00 173.24 173.46 2x10 s VAL 397 N 0.36 0.08 -0.27 5.02 1.01 -0.94 -5.00 120.40 120.66 2x10 s VAL 397 Ca 0.02 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 2x10 s VAL 397 Cb -0.05 -0.40 0.03 0.00 0.00 0.00 0.00 36.38 35.96 2x10 s VAL 397 CO -0.07 -0.36 -0.02 -0.89 0.00 0.00 0.00 175.10 173.75 2x10 s THR 398 N -1.28 3.04 0.07 3.92 2.01 -1.26 -1.96 115.64 120.17 2x10 s THR 398 Ca -0.14 -1.13 0.00 0.00 0.31 0.00 0.00 61.69 60.73 2x10 s THR 398 Cb -0.07 -2.63 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 2x10 s THR 398 CO 0.01 0.06 0.21 0.68 -0.69 0.00 0.00 174.62 174.89 2x10 s VAL 399 N 1.32 5.34 0.24 3.82 -7.23 -1.19 -0.65 120.40 122.05 2x10 s VAL 399 Ca -0.02 -0.43 -0.03 0.00 -1.81 0.00 0.00 61.98 59.69 2x10 s VAL 399 Cb -0.18 -3.61 -0.02 0.00 0.56 0.00 0.00 36.38 33.12 2x10 s VAL 399 CO -0.02 0.12 0.28 -0.94 -0.31 0.00 0.00 175.10 174.23 2x10 s SER 400 N -2.55 0.36 -0.41 4.85 1.04 -0.42 -1.62 113.70 114.94 2x10 s SER 400 Ca 0.35 -1.33 -0.00 0.00 0.48 0.00 0.00 55.95 55.44 2x10 s SER 400 Cb -0.13 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.47 2x10 s SER 400 CO 0.28 -1.00 0.34 -0.67 0.98 0.00 0.00 173.24 173.17 2x10 n ASP 401 N -0.58 -2.35 -4.37 7.02 -0.08 -1.18 -1.87 116.55 113.13 2x10 n ASP 401 Ca 0.02 -0.22 -0.43 0.00 -1.51 0.00 0.00 54.79 52.64 2x10 n ASP 401 Cb 0.64 -2.12 -0.09 0.00 2.34 0.00 0.00 41.12 41.89 2x10 n ASP 401 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2x10 s LEU 402 N -3.59 5.34 -0.07 -2.67 1.02 -1.21 -4.48 118.68 113.03 2x10 s LEU 402 Ca 0.03 -1.26 -0.32 0.00 0.02 0.00 0.00 54.13 52.60 2x10 s LEU 402 Cb -0.00 -2.12 -0.10 0.00 0.02 0.00 0.00 46.19 43.98 2x10 s LEU 402 CO 0.26 -0.56 1.96 -0.62 0.02 0.00 0.00 176.35 177.40 2x10 n GLU 403 N 5.11 2.36 -0.72 1.70 4.71 -1.26 -4.87 120.64 127.67 2x10 n GLU 403 Ca -0.12 0.85 -0.32 0.00 -0.01 0.00 0.00 57.16 57.56 2x10 n GLU 403 Cb 0.44 -2.81 0.15 0.00 -1.01 0.00 0.00 31.44 28.21 2x10 n GLU 403 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 2x10 n PRO 404 N 7.21 -0.89 -2.26 3.49 -0.02 -1.26 -4.96 135.00 136.31 2x10 n PRO 404 Ca 0.23 -0.22 -0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2x10 n PRO 404 Cb 0.34 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 2x10 n PRO 404 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 2x10 n HIS 405 N -4.03 -1.48 -3.89 6.00 -0.00 -0.96 -4.99 115.22 105.88 2x10 n HIS 405 Ca 0.05 0.57 -0.27 0.00 -0.00 0.00 0.00 57.72 58.07 2x10 n HIS 405 Cb 0.56 -2.78 -0.17 0.00 -0.00 0.00 0.00 29.99 27.60 2x10 n HIS 405 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2x10 s ASN 407 N -2.45 2.35 0.33 0.26 4.22 -1.26 -5.01 114.94 113.39 2x10 s ASN 407 Ca 0.01 -0.41 -0.07 0.00 -2.14 0.00 0.00 52.86 50.25 2x10 s ASN 407 Cb -0.00 -0.83 -0.06 0.00 1.28 0.00 0.00 41.25 41.65 2x10 s ASN 407 CO 0.37 -0.15 0.63 -0.31 -2.04 0.00 0.00 177.10 175.60 2x10 s TYR 408 N 1.71 3.48 -0.15 1.54 2.02 -0.67 -4.78 117.35 120.50 2x10 s TYR 408 Ca 0.04 0.78 0.01 0.00 -0.37 0.00 0.00 57.07 57.52 2x10 s TYR 408 Cb -0.13 -2.22 0.02 0.00 -0.40 0.00 0.00 41.96 39.23 2x10 s TYR 408 CO -0.08 0.07 -0.17 0.95 -1.57 0.00 0.00 175.55 174.74 2x10 s THR 409 N -2.20 1.79 -0.15 -0.71 -4.23 -0.78 -0.86 115.64 108.50 2x10 s THR 409 Ca 0.46 -0.78 -0.06 0.00 -1.18 0.00 0.00 61.69 60.13 2x10 s THR 409 Cb -0.11 -1.63 -0.04 0.00 1.34 0.00 0.00 72.50 72.06 2x10 s THR 409 CO 0.31 0.50 0.07 -0.36 -0.54 0.00 0.00 174.62 174.59 2x10 s PHE 410 N 1.27 3.31 -0.13 3.99 0.08 0.21 -0.04 117.98 126.67 2x10 s PHE 410 Ca 0.02 0.20 -0.01 0.00 0.12 0.00 0.00 56.93 57.25 2x10 s PHE 410 Cb -0.13 -2.00 -0.02 0.00 -0.57 0.00 0.00 43.02 40.29 2x10 s PHE 410 CO -0.09 0.33 -0.09 0.95 -0.10 0.00 0.00 175.22 176.22 2x10 s THR 411 N -0.14 3.44 -0.21 0.64 -4.23 -1.04 -1.04 115.64 113.06 2x10 s THR 411 Ca 0.07 -0.53 0.00 0.00 -1.18 0.00 0.00 61.69 60.05 2x10 s THR 411 Cb -0.12 -2.46 0.02 0.00 1.34 0.00 0.00 72.50 71.28 2x10 s THR 411 CO 0.01 0.52 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.78 2x10 s VAL 412 N 0.21 2.41 0.06 2.29 1.01 0.13 -1.23 120.40 125.27 2x10 s VAL 412 Ca -0.05 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 60.98 2x10 s VAL 412 Cb -0.15 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 2x10 s VAL 412 CO 0.04 0.40 0.08 -1.83 0.00 0.00 0.00 175.10 173.79 2x10 s GLU 413 N 1.30 2.94 -0.13 2.72 -1.05 -0.29 -0.87 118.70 123.33 2x10 s GLU 413 Ca 0.03 -0.63 -0.01 0.00 -0.15 0.00 0.00 54.97 54.21 2x10 s GLU 413 Cb -0.15 -2.77 -0.02 0.00 -0.44 0.00 0.00 34.13 30.76 2x10 s GLU 413 CO -0.09 0.59 -0.12 0.00 0.95 0.00 0.00 175.26 176.59 2x10 s ALA 414 N -1.33 2.68 0.03 -0.84 0.00 -1.01 -1.07 121.76 120.23 2x10 s ALA 414 Ca 0.28 -0.88 -0.03 0.00 0.00 0.00 0.00 51.96 51.33 2x10 s ALA 414 Cb -0.12 -1.26 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 2x10 s ALA 414 CO 0.20 0.26 0.02 -0.98 0.00 0.00 0.00 175.76 175.26 2x10 s ARG 415 N 0.30 0.48 0.17 0.00 1.70 -0.31 -4.62 118.95 116.68 2x10 s ARG 415 Ca -0.09 -0.78 0.00 0.00 -0.47 0.00 0.00 55.73 54.39 2x10 s ARG 415 Cb -0.15 0.18 -0.00 0.00 -0.57 0.00 0.00 34.95 34.40 2x10 s ARG 415 CO 0.05 -0.10 0.00 0.27 -1.08 0.00 0.00 175.30 174.44 2x10 n ASN 416 N 0.98 2.44 0.00 -2.89 0.23 -1.26 -0.12 115.26 114.64 2x10 n ASN 416 Ca -0.20 -1.74 0.00 0.00 -0.53 0.00 0.00 54.58 52.12 2x10 n ASN 416 Cb 0.58 0.12 0.02 0.00 -2.08 0.00 0.00 39.78 38.42 2x10 n ASN 416 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x10 n GLY 417 N 2.96 -0.32 0.00 4.83 0.00 -1.23 -1.61 105.19 109.82 2x10 n GLY 417 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2x10 n GLY 417 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2x10 n VAL 418 N -0.54 0.03 0.04 1.61 3.14 -1.26 -4.65 118.33 116.69 2x10 n VAL 418 Ca 0.01 -0.30 -0.02 0.00 -2.96 0.00 0.00 64.34 61.06 2x10 n VAL 418 Cb 0.00 1.39 0.24 0.00 -1.06 0.00 0.00 33.84 34.41 2x10 n VAL 418 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2x10 h SER 419 N 0.00 0.42 0.07 6.55 0.02 -1.66 -2.61 113.55 116.35 2x10 h SER 419 Ca 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 2x10 h SER 419 Cb 0.23 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2x10 h SER 419 CO 0.00 0.66 0.00 0.61 -1.14 0.00 0.00 176.83 176.96 2x10 n GLY 420 N -0.46 -0.44 0.07 -3.77 0.00 -1.26 -1.79 105.19 97.54 2x10 n GLY 420 Ca -0.00 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.07 2x10 n GLY 420 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x10 n LEU 421 N -1.34 0.49 -4.34 0.99 7.99 -0.98 -4.93 117.00 114.87 2x10 n LEU 421 Ca 0.01 0.20 -0.24 0.00 -0.01 0.00 0.00 56.01 55.97 2x10 n LEU 421 Cb 0.03 0.04 -0.12 0.00 -0.11 0.00 0.00 43.42 43.26 2x10 n LEU 421 CO 0.02 0.01 -0.51 0.54 -1.51 0.00 0.00 177.39 175.94 2x10 s VAL 422 N -3.25 1.94 -0.42 4.08 0.11 -0.74 -5.05 120.40 117.07 2x10 s VAL 422 Ca -0.04 -1.84 0.15 0.00 -2.93 0.00 0.00 61.98 57.32 2x10 s VAL 422 Cb 0.11 -1.85 0.81 0.00 -1.53 0.00 0.00 36.38 33.92 2x10 s VAL 422 CO 0.84 -0.18 1.73 0.35 -3.33 0.00 0.00 175.10 174.51 2x10 n THR 423 N 0.52 2.60 -2.19 5.04 -2.24 -1.26 -4.92 114.28 111.83 2x10 n THR 423 Ca -0.15 -1.37 -0.27 0.00 -2.27 0.00 0.00 64.05 59.99 2x10 n THR 423 Cb 0.56 -0.20 0.12 0.00 -2.10 0.00 0.00 70.33 68.71 2x10 n THR 423 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2x10 s SER 424 N -0.81 4.04 -0.01 3.42 0.15 -1.26 -5.11 113.70 114.11 2x10 s SER 424 Ca 0.54 0.19 0.00 0.00 0.70 0.00 0.00 55.95 57.38 2x10 s SER 424 Cb 0.40 -0.53 0.01 0.00 -1.71 0.00 0.00 66.02 64.20 2x10 s SER 424 CO 0.18 -2.11 0.00 -0.13 1.20 0.00 0.00 173.24 172.38 2x10 s ARG 425 N -5.48 0.11 -0.33 5.44 1.81 -1.26 -5.11 118.95 114.13 2x10 s ARG 425 Ca 0.67 0.04 0.00 0.00 -1.72 0.00 0.00 55.73 54.72 2x10 s ARG 425 Cb -0.07 -0.22 0.11 0.00 -0.45 0.00 0.00 34.95 34.32 2x10 s ARG 425 CO 0.48 -0.05 0.12 0.45 -0.68 0.00 0.00 175.30 175.61 2x10 s SER 426 N 0.46 4.01 0.14 0.23 0.15 -1.26 -5.02 113.70 112.41 2x10 s SER 426 Ca -0.04 -1.83 -0.01 0.00 0.70 0.00 0.00 55.95 54.76 2x10 s SER 426 Cb -0.06 -0.94 -0.04 0.00 -1.71 0.00 0.00 66.02 63.27 2x10 s SER 426 CO -0.01 -0.39 0.08 0.72 1.20 0.00 0.00 173.24 174.84 2x10 s PHE 427 N 1.37 0.86 0.20 3.44 -0.71 -1.26 -2.39 117.98 119.49 2x10 s PHE 427 Ca 0.11 -1.22 0.11 0.00 -1.04 0.00 0.00 56.93 54.89 2x10 s PHE 427 Cb -0.19 -0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 41.12 2x10 s PHE 427 CO -0.20 -0.54 -0.18 1.03 -1.34 0.00 0.00 175.22 173.99 2x10 s ARG 428 N -4.05 1.74 0.10 1.99 1.81 -0.05 -4.83 118.95 115.65 2x10 s ARG 428 Ca 0.25 -1.48 0.07 0.00 -1.72 0.00 0.00 55.73 52.85 2x10 s ARG 428 Cb 0.07 -1.94 -0.03 0.00 -0.45 0.00 0.00 34.95 32.59 2x10 s ARG 428 CO 0.02 0.40 -0.18 0.95 -0.68 0.00 0.00 175.30 175.81 2x10 s THR 429 N -1.82 1.51 -0.23 0.02 -4.23 -1.26 -0.69 115.64 108.93 2x10 s THR 429 Ca 0.24 -1.50 -0.17 0.00 -1.18 0.00 0.00 61.69 59.08 2x10 s THR 429 Cb -0.08 -1.42 0.06 0.00 1.34 0.00 0.00 72.50 72.41 2x10 s THR 429 CO 0.13 -0.14 0.58 0.00 -0.54 0.00 0.00 174.62 174.64 2x10 s ALA 430 N -1.29 -1.49 0.13 3.99 0.00 -0.20 -4.95 121.76 117.94 2x10 s ALA 430 Ca 0.04 1.85 0.09 0.00 0.00 0.00 0.00 51.96 53.95 2x10 s ALA 430 Cb -0.10 -1.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.90 2x10 s ALA 430 CO 0.04 -0.30 -0.23 -1.54 0.00 0.00 0.00 175.76 173.73 2x10 s SER 431 N 0.92 2.86 -0.13 0.00 1.04 -1.26 0.65 113.70 117.78 2x10 s SER 431 Ca -0.05 -0.75 -0.11 0.00 0.48 0.00 0.00 55.95 55.52 2x10 s SER 431 Cb -0.05 -0.17 0.04 0.00 0.10 0.00 0.00 66.02 65.93 2x10 s SER 431 CO -0.08 0.08 0.35 -0.69 0.98 0.00 0.00 173.24 173.88 2x10 s VAL 432 N -1.30 -0.01 -0.12 5.02 1.01 -0.04 -4.98 120.40 119.98 2x10 s VAL 432 Ca 0.11 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.13 2x10 s VAL 432 Cb -0.09 -0.50 0.02 0.00 0.00 0.00 0.00 36.38 35.81 2x10 s VAL 432 CO 0.06 0.01 -0.16 -0.94 0.00 0.00 0.00 175.10 174.06 2x10 s SER 433 N 0.43 2.63 -0.07 3.32 1.04 -1.26 -1.67 113.70 118.12 2x10 s SER 433 Ca -0.02 -0.48 -0.23 0.00 0.48 0.00 0.00 55.95 55.70 2x10 s SER 433 Cb -0.04 -1.18 -0.04 0.00 0.10 0.00 0.00 66.02 64.86 2x10 s SER 433 CO -0.02 0.01 0.69 0.27 0.98 0.00 0.00 173.24 175.17 2x10 s ILE 434 N 1.07 5.05 -1.87 -1.02 -4.36 -1.26 -4.94 121.20 113.87 2x10 s ILE 434 Ca -0.04 1.41 0.25 0.00 -0.26 0.00 0.00 60.65 62.01 2x10 s ILE 434 Cb -0.14 -4.03 0.17 0.00 1.25 0.00 0.00 42.46 39.71 2x10 s ILE 434 CO -0.04 0.25 1.39 0.59 0.24 0.00 0.00 174.94 177.37 2x10 n ASN 435 N 3.81 1.41 -4.56 4.36 4.13 -1.26 -2.25 115.26 120.90 2x10 n ASN 435 Ca -0.02 -1.14 -0.32 0.00 1.68 0.00 0.00 54.58 54.79 2x10 n ASN 435 Cb 0.51 0.26 -0.04 0.00 -1.54 0.00 0.00 39.78 38.97 2x10 n ASN 435 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 2x10 s GLN 436 N -2.48 2.77 -0.28 3.52 2.00 -1.26 -4.80 119.66 119.12 2x10 s GLN 436 Ca 0.22 -0.28 -0.06 0.00 -2.00 0.00 0.00 55.36 53.24 2x10 s GLN 436 Cb 0.19 -4.96 0.15 0.00 0.80 0.00 0.00 33.01 29.18 2x10 s GLN 436 CO 0.54 -3.02 0.59 -0.08 -0.50 0.00 0.00 175.29 172.82 2x10 s THR 437 N 8.84 -0.93 -0.27 -0.34 -1.32 -1.26 -4.73 115.64 115.63 2x10 s THR 437 Ca 0.64 0.01 -0.24 0.00 -1.21 0.00 0.00 61.69 60.89 2x10 s THR 437 Cb -0.07 -0.95 0.08 0.00 -1.51 0.00 0.00 72.50 70.06 2x10 s THR 437 CO 0.02 -0.00 0.79 -0.70 -2.21 0.00 0.00 174.62 172.52 2x10 s GLU 438 N 2.83 0.75 -0.57 7.08 2.12 -1.26 -4.69 118.70 124.96 2x10 s GLU 438 Ca 0.05 0.92 -0.14 0.00 0.36 0.00 0.00 54.97 56.16 2x10 s GLU 438 Cb -0.13 0.35 -0.14 0.00 0.26 0.00 0.00 34.13 34.47 2x10 s GLU 438 CO -0.19 -0.09 1.45 -2.30 -0.54 0.00 0.00 175.26 173.59 2x10 n PRO 439 N 2.70 0.00 -1.87 4.30 -0.02 -1.26 -4.80 135.00 134.06 2x10 n PRO 439 Ca -0.14 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 60.96 2x10 n PRO 439 Cb 0.55 -0.78 0.03 0.00 -0.02 0.00 0.00 33.50 33.29 2x10 n PRO 439 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2x10 s PRO 440 N 4.82 3.29 -0.48 0.52 0.02 -1.26 -4.93 135.00 136.98 2x10 s PRO 440 Ca 0.77 2.16 -0.20 0.00 0.02 0.00 0.00 61.00 63.75 2x10 s PRO 440 Cb -0.65 -2.31 0.04 0.00 0.02 0.00 0.00 34.50 31.60 2x10 s PRO 440 CO 0.29 -1.05 0.63 0.15 -0.33 0.00 0.00 177.00 176.69 2x10 s LYS 441 N -2.84 3.18 0.09 5.54 1.02 -0.96 -4.39 119.74 121.39 2x10 s LYS 441 Ca 0.69 -0.67 -0.09 0.00 0.02 0.00 0.00 55.97 55.92 2x10 s LYS 441 Cb -0.38 -4.03 -0.06 0.00 -0.52 0.00 0.00 37.83 32.84 2x10 s LYS 441 CO 0.46 -1.12 0.40 0.08 -0.92 0.00 0.00 175.35 174.24 2x10 s VAL 442 N 2.71 5.10 -0.08 3.17 1.01 -1.26 -1.75 120.40 129.29 2x10 s VAL 442 Ca 0.18 0.40 -0.30 0.00 0.00 0.00 0.00 61.98 62.26 2x10 s VAL 442 Cb -0.17 -3.64 0.10 0.00 0.00 0.00 0.00 36.38 32.67 2x10 s VAL 442 CO 0.15 0.25 0.86 0.00 0.00 0.00 0.00 175.10 176.36 2x10 s ARG 443 N -2.03 0.80 0.43 2.72 1.70 -0.41 -5.00 118.95 117.17 2x10 s ARG 443 Ca 0.34 0.07 -0.02 0.00 -0.47 0.00 0.00 55.73 55.66 2x10 s ARG 443 Cb -0.14 0.38 -0.02 0.00 -0.57 0.00 0.00 34.95 34.60 2x10 s ARG 443 CO 0.19 -0.28 0.68 -0.48 -1.08 0.00 0.00 175.30 174.33 2x10 s LEU 444 N -1.45 3.74 0.00 -1.89 0.05 -1.26 -1.33 118.68 116.53 2x10 s LEU 444 Ca -0.03 0.55 0.00 0.00 0.05 0.00 0.00 54.13 54.70 2x10 s LEU 444 Cb -0.00 -3.44 0.00 0.00 -2.05 0.00 0.00 46.19 40.70 2x10 s LEU 444 CO 0.02 -0.56 0.76 -0.62 -0.55 0.00 0.00 176.35 175.40 2x10 n GLU 445 N -2.07 0.00 -3.65 1.48 1.02 0.17 -4.90 120.64 112.69 2x10 n GLU 445 Ca -0.01 -0.74 -0.03 0.00 -0.02 0.00 0.00 57.16 56.36 2x10 n GLU 445 Cb 0.56 -0.47 -0.07 0.00 -0.02 0.00 0.00 31.44 31.45 2x10 n GLU 445 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2x10 s GLY 446 N -0.55 0.36 0.06 0.62 0.00 -1.18 -4.93 107.32 101.69 2x10 s GLY 446 Ca 0.00 3.51 0.03 0.00 0.00 0.00 0.00 44.72 48.26 2x10 s GLY 446 CO 0.00 2.05 -0.09 0.50 0.00 0.00 0.00 173.10 175.56 2x10 s ARG 447 N 0.18 0.66 0.28 2.90 0.52 -1.26 -0.16 118.95 122.07 2x10 s ARG 447 Ca 0.05 -0.93 -0.10 0.00 -0.52 0.00 0.00 55.73 54.23 2x10 s ARG 447 Cb -0.05 -0.39 0.00 0.00 0.52 0.00 0.00 34.95 35.03 2x10 s ARG 447 CO -0.14 0.06 0.49 0.45 0.02 0.00 0.00 175.30 176.18 2x10 s SER 448 N -1.95 0.19 0.60 0.23 0.15 0.56 -4.95 113.70 108.53 2x10 s SER 448 Ca -0.03 -1.11 0.37 0.00 0.70 0.00 0.00 55.95 55.88 2x10 s SER 448 Cb -0.07 0.62 1.87 0.00 -1.71 0.00 0.00 66.02 66.73 2x10 s SER 448 CO -0.00 -1.21 2.19 0.71 1.20 0.00 0.00 173.24 176.12 2x10 h THR 449 N 2.21 0.15 0.00 6.45 1.35 -1.93 -1.73 112.91 119.42 2x10 h THR 449 Ca -0.27 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 2x10 h THR 449 Cb 1.25 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 2x10 h THR 449 CO 0.37 0.03 -0.14 0.35 -0.25 0.00 0.00 175.52 175.88 2x10 n THR 450 N -3.24 0.00 -4.26 6.82 -2.24 -1.26 -2.20 114.28 107.90 2x10 n THR 450 Ca -0.02 -0.10 -0.22 0.00 -2.27 0.00 0.00 64.05 61.44 2x10 n THR 450 Cb 0.18 0.66 -0.12 0.00 -2.10 0.00 0.00 70.33 68.95 2x10 n THR 450 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2x10 s SER 451 N -0.47 2.33 -0.11 3.42 1.04 -1.24 -0.49 113.70 118.18 2x10 s SER 451 Ca 0.00 -0.69 0.01 0.00 0.48 0.00 0.00 55.95 55.75 2x10 s SER 451 Cb 0.00 -0.12 0.02 0.00 0.10 0.00 0.00 66.02 66.02 2x10 s SER 451 CO 0.00 0.01 -0.10 -0.76 0.98 0.00 0.00 173.24 173.37 2x10 s LEU 452 N -1.95 1.42 -0.50 2.42 1.02 -0.92 -0.32 118.68 119.84 2x10 s LEU 452 Ca 0.05 -0.34 -0.20 0.00 0.02 0.00 0.00 54.13 53.66 2x10 s LEU 452 Cb -0.09 -0.91 0.05 0.00 0.02 0.00 0.00 46.19 45.26 2x10 s LEU 452 CO 0.04 -0.06 0.68 -0.44 0.02 0.00 0.00 176.35 176.59 2x10 s SER 453 N 1.35 6.26 0.01 2.29 0.01 0.78 -0.66 113.70 123.73 2x10 s SER 453 Ca -0.01 -0.72 0.04 0.00 1.31 0.00 0.00 55.95 56.57 2x10 s SER 453 Cb -0.14 -2.32 -0.03 0.00 0.21 0.00 0.00 66.02 63.74 2x10 s SER 453 CO -0.05 -0.92 -0.08 -0.69 0.41 0.00 0.00 173.24 171.90 2x10 s VAL 454 N 2.88 3.53 -0.02 3.43 1.01 0.10 -0.66 120.40 130.66 2x10 s VAL 454 Ca 0.19 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 2x10 s VAL 454 Cb -0.17 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.69 2x10 s VAL 454 CO 0.14 0.39 0.21 -0.55 0.00 0.00 0.00 175.10 175.30 2x10 s SER 455 N -1.41 -0.10 0.28 3.32 0.15 -0.44 -0.71 113.70 114.79 2x10 s SER 455 Ca 0.17 0.05 0.05 0.00 0.70 0.00 0.00 55.95 56.91 2x10 s SER 455 Cb -0.11 0.30 -0.06 0.00 -1.71 0.00 0.00 66.02 64.45 2x10 s SER 455 CO 0.07 -0.32 -0.02 -1.66 1.20 0.00 0.00 173.24 172.51 2x10 s TRP 456 N -1.00 1.88 0.05 3.44 -2.14 -0.99 -1.29 118.94 118.90 2x10 s TRP 456 Ca -0.11 -0.80 -0.01 0.00 2.66 0.00 0.00 56.10 57.85 2x10 s TRP 456 Cb -0.05 -1.12 -0.04 0.00 -3.10 0.00 0.00 33.47 29.16 2x10 s TRP 456 CO 0.02 0.16 -0.03 0.45 -2.66 0.00 0.00 176.95 174.88 2x10 s SER 457 N -3.43 0.55 -0.30 -2.66 0.15 -0.72 -4.79 113.70 102.51 2x10 s SER 457 Ca 0.31 -0.97 -0.18 0.00 0.70 0.00 0.00 55.95 55.81 2x10 s SER 457 Cb 0.05 0.18 0.19 0.00 -1.71 0.00 0.00 66.02 64.73 2x10 s SER 457 CO 0.12 -0.56 1.22 -0.51 1.20 0.00 0.00 173.24 174.71 2x10 s ILE 458 N -3.71 0.00 0.17 6.45 -1.16 -1.26 -2.27 121.20 119.41 2x10 s ILE 458 Ca 0.06 0.00 -0.34 0.00 -0.51 0.00 0.00 60.65 59.86 2x10 s ILE 458 Cb 0.06 -1.00 -0.15 0.00 0.61 0.00 0.00 42.46 41.99 2x10 s ILE 458 CO -0.09 0.00 1.44 -2.65 -2.81 0.00 0.00 174.94 170.83 2x10 n PRO 459 N 2.88 1.80 -0.30 3.50 -0.02 -1.26 -4.74 135.00 136.85 2x10 n PRO 459 Ca -0.16 0.65 0.14 0.00 -2.02 0.00 0.00 63.50 62.11 2x10 n PRO 459 Cb 0.57 -2.33 0.32 0.00 -0.02 0.00 0.00 33.50 32.03 2x10 n PRO 459 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2x10 h PRO 460 N 4.93 0.28 -0.03 0.52 0.11 -2.01 0.65 132.00 136.45 2x10 h PRO 460 Ca -0.45 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.65 2x10 h PRO 460 Cb 1.29 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2x10 h PRO 460 CO 0.81 0.19 0.31 -1.00 -0.21 0.00 0.00 178.00 178.10 2x10 h PRO 461 N 0.29 0.00 0.00 1.05 0.13 -2.02 0.44 132.00 131.89 2x10 h PRO 461 Ca 0.58 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.71 2x10 h PRO 461 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2x10 h PRO 461 CO -0.60 0.00 -0.70 1.04 -0.23 0.00 0.00 178.00 177.51 2x10 n GLN 462 N -2.97 2.35 0.00 0.86 6.02 0.20 -4.38 117.38 119.46 2x10 n GLN 462 Ca -0.01 -0.01 0.06 0.00 -0.01 0.00 0.00 57.00 57.03 2x10 n GLN 462 Cb 0.37 -1.16 0.33 0.00 1.02 0.00 0.00 30.24 30.80 2x10 n GLN 462 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2x10 n GLN 463 N -1.36 0.25 0.09 -1.09 6.02 0.14 -3.12 117.38 118.33 2x10 n GLN 463 Ca 0.02 0.11 -0.05 0.00 -0.01 0.00 0.00 57.00 57.07 2x10 n GLN 463 Cb 0.22 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.95 2x10 n GLN 463 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2x10 h SER 464 N 0.00 -0.28 0.13 1.08 0.87 -1.77 -3.38 113.55 110.21 2x10 h SER 464 Ca 0.00 -0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.57 2x10 h SER 464 Cb 0.07 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 2x10 h SER 464 CO 0.00 0.18 -0.25 0.03 -0.53 0.00 0.00 176.83 176.26 2x10 h ARG 465 N -1.08 -0.45 -5.25 2.24 -0.00 -1.86 -3.43 114.38 104.55 2x10 h ARG 465 Ca -0.03 0.03 -0.63 0.00 -0.50 0.00 0.00 59.98 58.84 2x10 h ARG 465 Cb 0.27 0.10 -0.05 0.00 0.00 0.00 0.00 29.97 30.29 2x10 h ARG 465 CO 0.06 -0.30 1.33 1.33 0.00 0.00 0.00 179.97 182.39 2x10 n VAL 466 N -5.37 0.00 0.23 2.04 0.24 -1.25 -4.82 118.33 109.40 2x10 n VAL 466 Ca -0.07 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.12 2x10 n VAL 466 Cb 0.28 -0.46 -0.05 0.00 -1.47 0.00 0.00 33.84 32.14 2x10 n VAL 466 CO 0.00 0.00 0.00 -0.25 -2.14 0.00 0.00 176.83 174.44 2x10 h TRP 467 N 9.10 -0.59 -3.59 6.34 7.01 -1.30 -3.48 115.95 129.44 2x10 h TRP 467 Ca -0.08 -0.01 -0.11 0.00 2.11 0.00 0.00 58.89 60.79 2x10 h TRP 467 Cb 1.28 0.20 -0.17 0.00 -2.10 0.00 0.00 29.16 28.36 2x10 h TRP 467 CO 0.93 -0.33 -0.41 0.15 -2.79 0.00 0.00 178.44 175.99 2x10 s LYS 468 N -3.84 0.68 -0.39 2.65 1.02 -1.24 -4.89 119.74 113.73 2x10 s LYS 468 Ca -0.11 -0.64 -0.14 0.00 0.02 0.00 0.00 55.97 55.10 2x10 s LYS 468 Cb 0.01 0.28 0.01 0.00 -0.52 0.00 0.00 37.83 37.61 2x10 s LYS 468 CO 0.33 -0.19 0.27 0.71 -0.92 0.00 0.00 175.35 175.56 2x10 s TYR 469 N -2.57 3.24 -0.15 3.18 2.02 0.08 -1.84 117.35 121.31 2x10 s TYR 469 Ca -0.05 -0.55 -0.22 0.00 -0.37 0.00 0.00 57.07 55.87 2x10 s TYR 469 Cb -0.01 -2.55 -0.03 0.00 -0.40 0.00 0.00 41.96 38.98 2x10 s TYR 469 CO -0.04 -0.55 0.69 -2.00 -1.57 0.00 0.00 175.55 172.08 2x10 s GLU 470 N 1.67 4.29 -0.17 -0.62 2.12 -0.43 -2.42 118.70 123.14 2x10 s GLU 470 Ca 0.05 0.77 -0.04 0.00 0.36 0.00 0.00 54.97 56.11 2x10 s GLU 470 Cb -0.19 -3.54 -0.02 0.00 0.26 0.00 0.00 34.13 30.64 2x10 s GLU 470 CO 0.10 -0.17 -0.03 0.08 -0.54 0.00 0.00 175.26 174.70 2x10 s VAL 471 N 1.63 3.83 -0.03 3.70 1.01 -0.17 -0.83 120.40 129.55 2x10 s VAL 471 Ca 0.33 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.99 2x10 s VAL 471 Cb -0.16 -2.70 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 2x10 s VAL 471 CO 0.13 0.47 -0.17 -0.89 0.00 0.00 0.00 175.10 174.64 2x10 s THR 472 N 0.62 1.38 0.08 3.92 2.01 0.21 -2.03 115.64 121.83 2x10 s THR 472 Ca -0.02 -0.71 -0.17 0.00 0.31 0.00 0.00 61.69 61.09 2x10 s THR 472 Cb -0.14 -1.18 0.04 0.00 0.01 0.00 0.00 72.50 71.23 2x10 s THR 472 CO 0.02 0.40 0.41 -0.72 -0.69 0.00 0.00 174.62 174.04 2x10 s TYR 473 N -0.11 -0.25 -0.06 4.92 1.13 -0.47 -0.01 117.35 122.49 2x10 s TYR 473 Ca -0.00 0.09 -0.29 0.00 -1.41 0.00 0.00 57.07 55.46 2x10 s TYR 473 Cb -0.10 0.24 0.11 0.00 -1.10 0.00 0.00 41.96 41.11 2x10 s TYR 473 CO 0.01 -0.63 0.90 -0.98 -2.51 0.00 0.00 175.55 172.34 2x10 s ARG 474 N -3.05 0.77 0.91 -3.49 1.70 -1.03 -1.53 118.95 113.23 2x10 s ARG 474 Ca -0.02 -0.08 -0.10 0.00 -0.47 0.00 0.00 55.73 55.06 2x10 s ARG 474 Cb 0.00 0.36 0.14 0.00 -0.57 0.00 0.00 34.95 34.88 2x10 s ARG 474 CO -0.06 -0.29 1.13 0.15 -1.08 0.00 0.00 175.30 175.14 2x10 s LYS 475 N -2.17 1.10 0.28 3.89 1.02 -1.26 -0.61 119.74 121.98 2x10 s LYS 475 Ca 0.01 1.44 -0.29 0.00 0.02 0.00 0.00 55.97 57.14 2x10 s LYS 475 Cb -0.01 -1.74 -0.10 0.00 -0.52 0.00 0.00 37.83 35.46 2x10 s LYS 475 CO -0.03 -2.54 1.31 0.15 -0.92 0.00 0.00 175.35 173.32 2x10 s LYS 476 N -4.68 4.38 0.00 1.68 -0.14 -0.92 -3.37 119.74 116.69 2x10 s LYS 476 Ca 0.66 2.15 0.00 0.00 -1.36 0.00 0.00 55.97 57.42 2x10 s LYS 476 Cb -0.22 -3.12 0.00 0.00 -1.68 0.00 0.00 37.83 32.81 2x10 s LYS 476 CO 0.58 -0.21 0.00 0.41 -0.76 0.00 0.00 175.35 175.37 2x10 n GLY 477 N 1.50 2.26 3.67 -3.33 0.00 -1.26 -5.00 105.19 103.03 2x10 n GLY 477 Ca 0.03 -0.43 -0.47 0.00 0.00 0.00 0.00 46.02 45.14 2x10 n GLY 477 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2x10 n ASP 478 N 2.29 3.07 -0.05 1.61 9.92 -1.22 -4.86 116.55 127.31 2x10 n ASP 478 Ca 0.00 1.05 0.01 0.00 -0.53 0.00 0.00 54.79 55.32 2x10 n ASP 478 Cb 0.00 -1.38 0.01 0.00 -0.64 0.00 0.00 41.12 39.10 2x10 n ASP 478 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2x10 n SER 479 N 4.36 0.76 -0.40 -2.24 3.41 -1.26 -4.75 113.62 113.50 2x10 n SER 479 Ca 0.19 -1.52 0.04 0.00 -0.26 0.00 0.00 58.87 57.31 2x10 n SER 479 Cb 0.28 -0.04 0.10 0.00 -0.26 0.00 0.00 64.21 64.28 2x10 n SER 479 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2x10 n ASN 480 N -0.24 2.59 -3.69 4.04 4.13 -1.26 -4.96 115.26 115.88 2x10 n ASN 480 Ca 0.01 -2.01 -0.13 0.00 1.68 0.00 0.00 54.58 54.13 2x10 n ASN 480 Cb 0.45 -0.15 -0.13 0.00 -1.54 0.00 0.00 39.78 38.41 2x10 n ASN 480 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2x10 s SER 481 N -1.01 0.06 -0.04 6.41 1.04 -1.26 -5.15 113.70 113.75 2x10 s SER 481 Ca 0.15 0.62 0.05 0.00 0.48 0.00 0.00 55.95 57.24 2x10 s SER 481 Cb 0.08 0.65 -0.01 0.00 0.10 0.00 0.00 66.02 66.84 2x10 s SER 481 CO 0.10 -0.21 -0.19 -0.31 0.98 0.00 0.00 173.24 173.60 2x10 s TYR 482 N 2.00 1.88 -0.24 5.02 2.02 -1.26 -4.80 117.35 121.96 2x10 s TYR 482 Ca -0.03 -0.52 -0.06 0.00 -0.37 0.00 0.00 57.07 56.09 2x10 s TYR 482 Cb -0.11 -1.25 -0.02 0.00 -0.40 0.00 0.00 41.96 40.18 2x10 s TYR 482 CO -0.09 -0.16 0.04 -0.80 -1.57 0.00 0.00 175.55 172.97 2x10 s ASN 483 N -0.08 4.88 -0.05 2.29 0.01 -0.58 -5.00 114.94 116.40 2x10 s ASN 483 Ca -0.02 -0.29 0.00 0.00 -0.71 0.00 0.00 52.86 51.84 2x10 s ASN 483 Cb -0.11 -1.87 0.02 0.00 0.41 0.00 0.00 41.25 39.70 2x10 s ASN 483 CO 0.02 -0.04 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.85 2x10 s VAL 484 N 1.57 0.48 0.02 1.60 1.01 -1.26 -1.37 120.40 122.44 2x10 s VAL 484 Ca 0.06 -0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.00 2x10 s VAL 484 Cb -0.15 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.67 2x10 s VAL 484 CO 0.01 0.23 -0.04 0.00 0.00 0.00 0.00 175.10 175.31 2x10 s ARG 485 N 1.22 0.31 0.23 2.72 1.70 -0.86 -5.00 118.95 119.27 2x10 s ARG 485 Ca -0.06 -0.45 0.09 0.00 -0.47 0.00 0.00 55.73 54.84 2x10 s ARG 485 Cb -0.14 -0.09 -0.04 0.00 -0.57 0.00 0.00 34.95 34.11 2x10 s ARG 485 CO -0.02 0.01 -0.06 1.03 -1.08 0.00 0.00 175.30 175.19 2x10 s ARG 486 N -0.98 2.16 -0.05 3.89 0.52 -1.26 -1.00 118.95 122.23 2x10 s ARG 486 Ca -0.08 -1.37 -0.31 0.00 -0.52 0.00 0.00 55.73 53.45 2x10 s ARG 486 Cb -0.07 -2.14 0.11 0.00 0.52 0.00 0.00 34.95 33.37 2x10 s ARG 486 CO -0.00 0.40 1.04 -0.08 0.02 0.00 0.00 175.30 176.68 2x10 s THR 487 N -2.06 0.00 -2.79 0.02 -1.32 -1.02 -5.00 115.64 103.48 2x10 s THR 487 Ca 0.28 -0.10 0.23 0.00 -1.21 0.00 0.00 61.69 60.90 2x10 s THR 487 Cb -0.07 -1.21 0.17 0.00 -1.51 0.00 0.00 72.50 69.87 2x10 s THR 487 CO 0.18 0.00 1.21 -0.62 -2.21 0.00 0.00 174.62 173.18 2x10 n GLU 488 N -0.24 2.11 -1.87 7.08 1.02 -1.26 -0.74 120.64 126.74 2x10 n GLU 488 Ca -0.05 -1.79 -0.29 0.00 -0.02 0.00 0.00 57.16 55.01 2x10 n GLU 488 Cb 0.61 -1.44 0.10 0.00 -0.02 0.00 0.00 31.44 30.68 2x10 n GLU 488 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2x10 s GLY 489 N -1.95 1.60 -0.19 0.62 0.00 -1.26 -4.93 107.32 101.20 2x10 s GLY 489 Ca 0.26 -0.66 0.16 0.00 0.00 0.00 0.00 44.72 44.48 2x10 s GLY 489 CO 0.31 -0.16 1.46 0.69 0.00 0.00 0.00 173.10 175.40 2x10 n PHE 490 N -3.38 1.07 -3.55 1.90 3.72 -1.26 -4.87 117.46 111.08 2x10 n PHE 490 Ca 0.08 -0.88 -0.17 0.00 -0.05 0.00 0.00 57.45 56.43 2x10 n PHE 490 Cb 0.61 -0.34 -0.06 0.00 -0.94 0.00 0.00 39.48 38.74 2x10 n PHE 490 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2x10 s SER 491 N -1.84 -0.62 -0.09 4.37 0.15 -1.26 -2.34 113.70 112.07 2x10 s SER 491 Ca 0.44 0.74 -0.29 0.00 0.70 0.00 0.00 55.95 57.54 2x10 s SER 491 Cb 0.35 0.61 0.07 0.00 -1.71 0.00 0.00 66.02 65.34 2x10 s SER 491 CO 0.09 -0.55 0.66 0.54 1.20 0.00 0.00 173.24 175.18 2x10 s VAL 492 N -1.03 0.00 -0.13 4.45 0.11 0.11 -5.00 120.40 118.91 2x10 s VAL 492 Ca -0.10 -0.03 -0.00 0.00 -2.93 0.00 0.00 61.98 58.92 2x10 s VAL 492 Cb -0.01 -0.97 -0.01 0.00 -1.53 0.00 0.00 36.38 33.86 2x10 s VAL 492 CO 0.08 -0.02 -0.14 -0.89 -3.33 0.00 0.00 175.10 170.81 2x10 s THR 493 N -0.91 2.98 -0.26 5.04 2.01 -1.26 -0.72 115.64 122.52 2x10 s THR 493 Ca -0.09 -0.68 -0.17 0.00 0.31 0.00 0.00 61.69 61.06 2x10 s THR 493 Cb -0.01 -2.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2x10 s THR 493 CO 0.08 0.52 0.48 -0.76 -0.69 0.00 0.00 174.62 174.25 2x10 s LEU 494 N 0.41 4.05 0.31 4.42 1.43 0.16 -4.94 118.68 124.53 2x10 s LEU 494 Ca -0.10 0.46 0.04 0.00 -1.03 0.00 0.00 54.13 53.49 2x10 s LEU 494 Cb -0.16 -2.60 -0.02 0.00 0.03 0.00 0.00 46.19 43.44 2x10 s LEU 494 CO 0.05 -0.26 0.47 -1.81 0.23 0.00 0.00 176.35 175.03 2x10 s ASP 495 N 1.57 6.15 -0.57 2.29 1.01 -1.26 -2.17 116.67 123.69 2x10 s ASP 495 Ca 0.19 0.08 -0.15 0.00 0.71 0.00 0.00 52.55 53.39 2x10 s ASP 495 Cb -0.16 -1.65 0.02 0.00 1.01 0.00 0.00 42.92 42.14 2x10 s ASP 495 CO 0.09 -0.30 0.64 0.47 0.21 0.00 0.00 175.17 176.28 2x10 n ASP 496 N -1.63 -6.91 -4.20 0.27 8.00 -1.22 -4.93 116.55 105.93 2x10 n ASP 496 Ca -0.04 0.01 -0.12 0.00 0.71 0.00 0.00 54.79 55.35 2x10 n ASP 496 Cb 0.57 -3.97 -0.10 0.00 -0.02 0.00 0.00 41.12 37.60 2x10 n ASP 496 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2x10 s LEU 497 N -3.25 2.39 0.31 0.64 1.43 0.36 -5.02 118.68 115.53 2x10 s LEU 497 Ca 0.19 -1.06 -0.27 0.00 -1.03 0.00 0.00 54.13 51.96 2x10 s LEU 497 Cb -0.04 -0.10 -0.10 0.00 0.03 0.00 0.00 46.19 45.98 2x10 s LEU 497 CO 0.81 -0.48 0.94 0.00 0.23 0.00 0.00 176.35 177.85 2x10 s ALA 498 N -3.59 3.23 0.83 4.21 0.00 -1.26 -4.10 121.76 121.07 2x10 s ALA 498 Ca 0.16 0.54 -0.11 0.00 0.00 0.00 0.00 51.96 52.55 2x10 s ALA 498 Cb 0.05 -3.19 0.09 0.00 0.00 0.00 0.00 23.12 20.08 2x10 s ALA 498 CO -0.01 0.18 1.09 -2.14 0.00 0.00 0.00 175.76 174.88 2x10 s PRO 499 N -1.92 1.78 -1.28 0.00 0.02 -0.93 -4.16 135.00 128.50 2x10 s PRO 499 Ca 0.49 1.03 -0.25 0.00 0.02 0.00 0.00 61.00 62.29 2x10 s PRO 499 Cb -0.20 -1.85 0.03 0.00 0.02 0.00 0.00 34.50 32.50 2x10 s PRO 499 CO 0.25 -1.94 0.56 -0.25 -0.33 0.00 0.00 177.00 175.29 2x10 n ASP 500 N -3.70 -3.12 -3.75 2.53 9.92 -1.23 -4.93 116.55 112.26 2x10 n ASP 500 Ca 0.08 -1.25 -0.13 0.00 -0.53 0.00 0.00 54.79 52.96 2x10 n ASP 500 Cb 0.54 -1.93 -0.14 0.00 -0.64 0.00 0.00 41.12 38.94 2x10 n ASP 500 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2x10 s THR 501 N -3.70 -0.04 -0.11 -3.53 -4.23 -1.26 -4.95 115.64 97.81 2x10 s THR 501 Ca 0.38 0.16 -0.28 0.00 -1.18 0.00 0.00 61.69 60.76 2x10 s THR 501 Cb -0.20 -0.25 -0.01 0.00 1.34 0.00 0.00 72.50 73.38 2x10 s THR 501 CO 0.96 0.07 0.95 0.42 -0.54 0.00 0.00 174.62 176.48 2x10 s THR 502 N 1.07 4.82 0.13 3.99 -4.23 -1.26 -2.55 115.64 117.61 2x10 s THR 502 Ca -0.08 1.92 0.05 0.00 -1.18 0.00 0.00 61.69 62.40 2x10 s THR 502 Cb -0.10 -4.26 -0.04 0.00 1.34 0.00 0.00 72.50 69.44 2x10 s THR 502 CO -0.06 0.03 0.07 -0.31 -0.54 0.00 0.00 174.62 173.81 2x10 s TYR 503 N 1.96 3.07 -0.29 3.99 2.02 0.15 -2.16 117.35 126.09 2x10 s TYR 503 Ca 0.46 -0.02 -0.11 0.00 -0.37 0.00 0.00 57.07 57.02 2x10 s TYR 503 Cb -0.18 -1.51 -0.05 0.00 -0.40 0.00 0.00 41.96 39.82 2x10 s TYR 503 CO 0.17 0.51 0.20 -0.51 -1.57 0.00 0.00 175.55 174.35 2x10 s LEU 504 N -2.77 4.07 -0.15 -1.29 1.43 0.22 -2.37 118.68 117.82 2x10 s LEU 504 Ca 0.29 -0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.33 2x10 s LEU 504 Cb -0.11 -2.12 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 2x10 s LEU 504 CO 0.21 -0.07 -0.10 -0.69 0.23 0.00 0.00 176.35 175.94 2x10 s VAL 505 N 1.76 3.28 -0.17 -1.59 1.01 -0.77 -2.46 120.40 121.46 2x10 s VAL 505 Ca 0.07 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 61.45 2x10 s VAL 505 Cb -0.16 -2.41 0.05 0.00 0.00 0.00 0.00 36.38 33.86 2x10 s VAL 505 CO 0.11 0.50 0.03 -1.58 0.00 0.00 0.00 175.10 174.16 2x10 s GLN 506 N 0.52 0.62 -0.14 2.72 -0.44 0.98 -1.88 119.66 122.05 2x10 s GLN 506 Ca -0.07 -0.31 -0.05 0.00 -2.50 0.00 0.00 55.36 52.44 2x10 s GLN 506 Cb -0.15 -1.89 -0.04 0.00 -1.64 0.00 0.00 33.01 29.29 2x10 s GLN 506 CO 0.04 -0.58 0.04 0.08 0.50 0.00 0.00 175.29 175.37 2x10 s VAL 507 N 1.89 4.62 -0.12 1.34 1.01 -1.26 -0.62 120.40 127.26 2x10 s VAL 507 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 2x10 s VAL 507 Cb -0.16 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.23 2x10 s VAL 507 CO -0.08 0.53 -0.03 -1.58 0.00 0.00 0.00 175.10 173.95 2x10 s GLN 508 N -0.22 1.08 -1.00 2.72 0.74 -0.01 -1.07 119.66 121.90 2x10 s GLN 508 Ca 0.07 -0.20 -0.19 0.00 0.05 0.00 0.00 55.36 55.09 2x10 s GLN 508 Cb -0.12 -1.52 0.12 0.00 1.10 0.00 0.00 33.01 32.58 2x10 s GLN 508 CO 0.02 -0.36 1.27 0.00 -0.55 0.00 0.00 175.29 175.67 2x10 s ALA 509 N 1.80 3.31 0.35 1.58 0.00 -0.83 -1.32 121.76 126.65 2x10 s ALA 509 Ca 0.03 -2.74 -0.28 0.00 0.00 0.00 0.00 51.96 48.97 2x10 s ALA 509 Cb -0.14 -4.19 -0.10 0.00 0.00 0.00 0.00 23.12 18.69 2x10 s ALA 509 CO -0.07 -3.11 1.33 -0.51 0.00 0.00 0.00 175.76 173.40 2x10 s LEU 510 N 3.11 4.39 -0.38 0.00 1.43 -0.76 -2.37 118.68 124.10 2x10 s LEU 510 Ca 0.38 2.74 0.04 0.00 -1.03 0.00 0.00 54.13 56.27 2x10 s LEU 510 Cb -0.03 -3.68 0.16 0.00 0.03 0.00 0.00 46.19 42.68 2x10 s LEU 510 CO -0.07 -0.62 0.45 0.42 0.23 0.00 0.00 176.35 176.76 2x10 s THR 511 N -1.15 -0.52 -0.26 5.49 -4.23 -1.26 -0.91 115.64 112.80 2x10 s THR 511 Ca 0.50 -0.70 -0.13 0.00 -1.18 0.00 0.00 61.69 60.18 2x10 s THR 511 Cb -0.41 -0.50 -0.14 0.00 1.34 0.00 0.00 72.50 72.79 2x10 s THR 511 CO 0.54 -0.42 -0.25 1.67 -0.54 0.00 0.00 174.62 175.62 2x10 n GLN 512 N 4.33 0.60 -4.17 3.99 7.27 -1.26 -4.16 117.38 123.97 2x10 n GLN 512 Ca 0.11 0.29 -0.30 0.00 0.07 0.00 0.00 57.00 57.17 2x10 n GLN 512 Cb 0.48 -1.53 -0.16 0.00 2.41 0.00 0.00 30.24 31.44 2x10 n GLN 512 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 2x10 s GLU 513 N -2.49 2.34 -0.58 3.69 2.56 -1.26 -4.69 118.70 118.26 2x10 s GLU 513 Ca -0.37 -0.58 0.00 0.00 0.00 0.00 0.00 54.97 54.02 2x10 s GLU 513 Cb 0.13 -2.08 0.00 0.00 2.00 0.00 0.00 34.13 34.17 2x10 s GLU 513 CO 0.52 -0.18 0.00 0.41 -0.56 0.00 0.00 175.26 175.45 2x10 n GLY 514 N 4.59 0.62 0.18 -1.50 0.00 -1.26 -4.79 105.19 103.03 2x10 n GLY 514 Ca -0.18 -0.08 0.05 0.00 0.00 0.00 0.00 46.02 45.81 2x10 n GLY 514 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x10 n GLN 515 N -0.75 1.02 -2.40 1.61 -0.00 -1.26 -5.03 117.38 110.58 2x10 n GLN 515 Ca -0.05 -1.83 -0.24 0.00 -0.00 0.00 0.00 57.00 54.87 2x10 n GLN 515 Cb 0.44 -1.07 0.07 0.00 -0.00 0.00 0.00 30.24 29.68 2x10 n GLN 515 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2x10 s GLY 516 N -1.89 1.75 -0.23 2.61 0.00 -1.26 -4.25 107.32 104.06 2x10 s GLY 516 Ca 0.16 -1.22 -0.08 0.00 0.00 0.00 0.00 44.72 43.58 2x10 s GLY 516 CO 0.02 -0.80 0.09 0.00 0.00 0.00 0.00 173.10 172.40 2x10 s ALA 517 N -3.11 3.33 0.77 3.20 0.00 -1.00 -4.85 121.76 120.09 2x10 s ALA 517 Ca 0.61 -0.97 -0.12 0.00 0.00 0.00 0.00 51.96 51.49 2x10 s ALA 517 Cb -0.09 -2.09 0.05 0.00 0.00 0.00 0.00 23.12 20.99 2x10 s ALA 517 CO 0.43 -0.23 1.14 0.20 0.00 0.00 0.00 175.76 177.30 2x10 s GLY 518 N 1.15 1.61 0.43 0.00 0.00 -1.26 -1.97 107.32 107.28 2x10 s GLY 518 Ca 0.05 -0.53 0.07 0.00 0.00 0.00 0.00 44.72 44.31 2x10 s GLY 518 CO 0.04 -0.09 0.20 -0.45 0.00 0.00 0.00 173.10 172.79 2x10 s SER 519 N -4.49 4.44 0.33 1.64 0.15 -0.23 -4.09 113.70 111.45 2x10 s SER 519 Ca 0.60 -1.13 -0.29 0.00 0.70 0.00 0.00 55.95 55.84 2x10 s SER 519 Cb -0.11 -0.32 -0.10 0.00 -1.71 0.00 0.00 66.02 63.77 2x10 s SER 519 CO 0.50 -0.63 1.39 -0.75 1.20 0.00 0.00 173.24 174.96 2x10 s LYS 520 N -3.95 4.26 -0.86 5.44 2.20 -1.26 -4.73 119.74 120.84 2x10 s LYS 520 Ca 0.38 2.35 -0.25 0.00 -0.36 0.00 0.00 55.97 58.09 2x10 s LYS 520 Cb 0.03 -3.04 0.02 0.00 -1.51 0.00 0.00 37.83 33.33 2x10 s LYS 520 CO 0.21 -0.34 1.52 0.08 -0.36 0.00 0.00 175.35 176.46 2x10 s VAL 521 N -0.93 3.71 0.84 4.02 1.01 -1.26 -4.70 120.40 123.09 2x10 s VAL 521 Ca 0.52 -0.20 -0.13 0.00 0.00 0.00 0.00 61.98 62.17 2x10 s VAL 521 Cb -0.42 -4.72 0.10 0.00 0.00 0.00 0.00 36.38 31.34 2x10 s VAL 521 CO 0.55 -1.64 1.20 -1.00 0.00 0.00 0.00 175.10 174.21 2x10 s HIS 522 N 6.51 2.70 -0.25 5.22 0.09 -0.79 -4.83 115.29 123.94 2x10 s HIS 522 Ca 0.49 0.67 -0.04 0.00 -0.00 0.00 0.00 55.06 56.17 2x10 s HIS 522 Cb -0.05 -3.61 0.09 0.00 -0.00 0.00 0.00 32.58 29.01 2x10 s HIS 522 CO 0.03 -1.93 0.11 -1.21 -0.00 0.00 0.00 174.74 171.74 2x10 s GLU 523 N -5.63 0.25 0.29 1.40 2.02 -1.26 -1.85 118.70 113.93 2x10 s GLU 523 Ca 0.64 -0.46 0.09 0.00 0.02 0.00 0.00 54.97 55.27 2x10 s GLU 523 Cb -0.10 -1.51 -0.04 0.00 0.10 0.00 0.00 34.13 32.58 2x10 s GLU 523 CO 0.50 -0.89 0.04 -0.06 0.02 0.00 0.00 175.26 174.87 2x10 s PHE 524 N 2.04 2.70 -0.02 1.61 0.08 -1.00 -4.90 117.98 118.50 2x10 s PHE 524 Ca 0.06 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 56.84 2x10 s PHE 524 Cb -0.16 -1.34 0.02 0.00 -0.57 0.00 0.00 43.02 40.97 2x10 s PHE 524 CO -0.26 0.53 0.02 -1.14 -0.10 0.00 0.00 175.22 174.28 2x10 s GLN 525 N -3.73 0.00 1.44 0.44 0.74 -1.26 0.34 119.66 117.63 2x10 s GLN 525 Ca 0.33 0.14 -0.23 0.00 0.05 0.00 0.00 55.36 55.66 2x10 s GLN 525 Cb -0.05 -0.23 0.37 0.00 1.10 0.00 0.00 33.01 34.20 2x10 s GLN 525 CO 0.21 -0.13 0.86 0.25 -0.55 0.00 0.00 175.29 175.92 2x10 n THR 526 N 3.98 0.00 -4.29 -0.34 -2.24 -1.06 -4.86 114.28 105.47 2x10 n THR 526 Ca -0.25 -0.05 -0.24 0.00 -2.27 0.00 0.00 64.05 61.24 2x10 n THR 526 Cb 0.52 -0.97 -0.08 0.00 -2.10 0.00 0.00 70.33 67.70 2x10 n THR 526 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2x10 s LEU 527 N -7.53 3.09 0.02 3.22 2.01 -0.65 -4.10 118.68 114.75 2x10 s LEU 527 Ca 0.66 -0.81 0.00 0.00 0.01 0.00 0.00 54.13 54.00 2x10 s LEU 527 Cb -0.13 -1.56 -0.04 0.00 0.01 0.00 0.00 46.19 44.47 2x10 s LEU 527 CO 0.56 -0.12 0.10 -0.55 1.01 0.00 0.00 176.35 177.35 2x10 s SER 528 N -3.70 5.73 0.00 2.29 0.15 -1.26 -3.51 113.70 113.39 2x10 s SER 528 Ca 0.33 0.12 0.04 0.00 0.70 0.00 0.00 55.95 57.15 2x10 s SER 528 Cb -0.04 -1.64 0.26 0.00 -1.71 0.00 0.00 66.02 62.90 2x10 s SER 528 CO 0.20 0.24 0.74 -2.65 1.20 0.00 0.00 173.24 172.96