#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pui s TYR 9 N 0.00 3.13 -0.09 -1.77 5.04 -1.24 -4.76 117.35 117.66 2pui s TYR 9 Ca 0.00 1.01 -0.04 0.00 -2.44 0.00 0.00 57.07 55.60 2pui s TYR 9 Cb 0.00 -3.75 0.05 0.00 0.35 0.00 0.00 41.96 38.61 2pui s TYR 9 CO 0.00 -2.51 0.19 -1.21 -1.34 0.00 0.00 175.55 170.68 2pui s GLU 10 N 0.19 0.09 0.21 4.97 8.01 -1.26 -5.07 118.70 125.83 2pui s GLU 10 Ca 0.61 0.57 -0.32 0.00 0.01 0.00 0.00 54.97 55.85 2pui s GLU 10 Cb -0.40 -0.18 -0.12 0.00 -4.31 0.00 0.00 34.13 29.12 2pui s GLU 10 CO 0.38 -0.26 1.69 0.99 0.01 0.00 0.00 175.26 178.07 2pui s THR 11 N 2.04 2.11 0.59 3.63 2.01 -1.26 -4.97 115.64 119.78 2pui s THR 11 Ca -0.01 0.08 -0.12 0.00 0.31 0.00 0.00 61.69 61.96 2pui s THR 11 Cb -0.12 -3.05 -0.05 0.00 0.01 0.00 0.00 72.50 69.29 2pui s THR 11 CO -0.07 0.01 1.01 -0.76 -0.69 0.00 0.00 174.62 174.11 2pui s LEU 12 N 1.06 3.33 0.45 4.42 1.43 -1.26 -5.10 118.68 123.01 2pui s LEU 12 Ca 0.73 1.42 0.03 0.00 -1.03 0.00 0.00 54.13 55.28 2pui s LEU 12 Cb -0.49 -4.44 -0.03 0.00 0.03 0.00 0.00 46.19 41.26 2pui s LEU 12 CO 0.33 -0.80 0.04 0.54 0.23 0.00 0.00 176.35 176.69 2pui s ASN 13 N -3.96 3.60 0.42 2.29 2.20 -1.26 -4.98 114.94 113.25 2pui s ASN 13 Ca 0.55 -1.59 0.16 0.00 -0.94 0.00 0.00 52.86 51.04 2pui s ASN 13 Cb -0.11 0.32 1.05 0.00 -2.00 0.00 0.00 41.25 40.51 2pui s ASN 13 CO 0.49 -0.79 1.90 -0.33 -2.94 0.00 0.00 177.10 175.44 2pui h GLU 14 N 1.60 0.41 0.02 3.55 4.39 -1.99 0.44 114.58 123.00 2pui h GLU 14 Ca -0.41 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.26 2pui h GLU 14 Cb 1.29 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 2pui h GLU 14 CO 0.71 0.27 -0.01 1.03 -1.16 0.00 0.00 179.01 179.85 2pui h SER 15 N 0.43 -0.03 0.63 1.42 0.87 -1.96 -2.90 113.55 112.01 2pui h SER 15 Ca 0.40 -0.70 -0.03 0.00 -1.23 0.00 0.00 61.79 60.22 2pui h SER 15 Cb 0.92 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.88 2pui h SER 15 CO -0.13 0.73 -0.16 0.77 -0.53 0.00 0.00 176.83 177.50 2pui h SER 16 N -0.82 0.00 -0.38 6.23 4.64 -1.90 -1.77 113.55 119.55 2pui h SER 16 Ca -0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 2pui h SER 16 Cb 0.73 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.80 2pui h SER 16 CO 0.01 0.16 -0.17 0.00 -0.87 0.00 0.00 176.83 175.95 2pui h ALA 17 N 1.84 0.85 -0.46 5.18 0.00 -0.99 -2.04 119.26 123.66 2pui h ALA 17 Ca -0.00 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.44 2pui h ALA 17 Cb 0.52 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2pui h ALA 17 CO 0.02 0.64 -0.13 0.28 0.00 0.00 0.00 179.25 180.06 2pui h VAL 18 N 0.76 1.27 -0.71 0.00 2.07 -1.19 -2.79 116.25 115.66 2pui h VAL 18 Ca 0.11 -1.26 0.01 0.00 0.82 0.00 0.00 66.70 66.38 2pui h VAL 18 Cb 0.70 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 2pui h VAL 18 CO 0.05 0.43 0.46 0.00 0.02 0.00 0.00 177.57 178.54 2pui h ALA 19 N 0.87 0.90 -0.36 1.67 0.00 -1.26 -2.47 119.26 118.61 2pui h ALA 19 Ca 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2pui h ALA 19 Cb 0.69 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2pui h ALA 19 CO 0.05 0.30 0.20 1.25 0.00 0.00 0.00 179.25 181.05 2pui h LEU 20 N 0.94 0.45 -0.53 0.00 5.85 -1.35 -0.99 115.31 119.67 2pui h LEU 20 Ca 0.26 -0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.97 2pui h LEU 20 Cb -0.09 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.77 2pui h LEU 20 CO -0.07 0.41 0.21 0.00 -0.34 0.00 0.00 178.44 178.65 2pui h ALA 21 N 1.06 0.67 -0.27 1.25 0.00 -1.22 -0.80 119.26 119.95 2pui h ALA 21 Ca 0.13 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2pui h ALA 21 Cb 0.06 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2pui h ALA 21 CO -0.02 -0.18 -0.22 -0.24 0.00 0.00 0.00 179.25 178.59 2pui h VAL 22 N 0.40 1.31 -0.72 0.00 3.04 -1.38 -2.60 116.25 116.30 2pui h VAL 22 Ca 0.26 -1.36 0.13 0.00 -1.01 0.00 0.00 66.70 64.71 2pui h VAL 22 Cb 0.27 1.59 -0.05 0.00 -2.01 0.00 0.00 31.29 31.09 2pui h VAL 22 CO -0.25 0.43 0.48 0.07 -1.01 0.00 0.00 177.57 177.30 2pui h LYS 23 N 0.36 0.43 0.00 4.17 2.10 -0.82 -0.25 116.57 122.56 2pui h LYS 23 Ca 0.05 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 2pui h LYS 23 Cb 0.77 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 2pui h LYS 23 CO 0.06 0.28 -0.02 1.28 -2.00 0.00 0.00 179.45 179.05 2pui n LEU 24 N -4.48 0.36 0.00 7.07 4.77 -0.34 -4.95 117.00 119.44 2pui n LEU 24 Ca 0.13 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.63 2pui n LEU 24 Cb 0.47 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2pui n LEU 24 CO 0.33 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 2pui n GLY 25 N 1.42 0.75 0.00 -0.72 0.00 -0.10 -5.07 105.19 101.46 2pui n GLY 25 Ca 0.06 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2pui n GLY 25 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2pui n LEU 26 N 0.00 0.00 -3.46 0.99 -0.00 -1.00 -5.04 117.00 108.48 2pui n LEU 26 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.88 2pui n LEU 26 Cb 0.22 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.61 2pui n LEU 26 CO 0.00 0.00 0.47 -0.36 -0.00 0.00 0.00 177.39 177.50 2pui s PHE 27 N 4.63 -0.53 0.00 1.47 0.40 -1.26 -4.78 117.98 117.91 2pui s PHE 27 Ca 0.00 0.52 0.00 0.00 -0.60 0.00 0.00 56.93 56.85 2pui s PHE 27 Cb 0.00 0.52 0.00 0.00 0.51 0.00 0.00 43.02 44.05 2pui s PHE 27 CO 0.00 -0.72 0.00 0.25 0.70 0.00 0.00 175.22 175.45 2pui n THR 34 N 0.00 0.00 -3.77 0.64 -2.24 -1.23 -4.37 114.28 103.31 2pui n THR 34 Ca -0.16 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.47 2pui n THR 34 Cb 0.62 0.00 -0.16 0.00 -2.10 0.00 0.00 70.33 68.70 2pui n THR 34 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2pui s GLN 36 N 1.05 1.44 -0.47 0.00 1.11 -0.84 -4.93 119.66 117.02 2pui s GLN 36 Ca -0.09 -0.37 -0.29 0.00 0.01 0.00 0.00 55.36 54.63 2pui s GLN 36 Cb -0.12 -1.24 0.02 0.00 -1.01 0.00 0.00 33.01 30.66 2pui s GLN 36 CO -0.03 0.05 1.24 -1.21 0.01 0.00 0.00 175.29 175.35 2pui s GLU 37 N 0.53 3.64 -0.08 2.91 0.41 -1.26 -1.81 118.70 123.03 2pui s GLU 37 Ca -0.11 0.65 0.14 0.00 -0.41 0.00 0.00 54.97 55.25 2pui s GLU 37 Cb -0.14 -3.96 0.47 0.00 -1.78 0.00 0.00 34.13 28.72 2pui s GLU 37 CO 0.02 -1.49 1.39 0.44 -0.49 0.00 0.00 175.26 175.13 2pui n ILE 38 N 6.92 1.59 0.00 -1.63 -5.35 0.97 -4.94 119.36 116.92 2pui n ILE 38 Ca 0.13 -1.33 0.00 0.00 -0.27 0.00 0.00 62.75 61.29 2pui n ILE 38 Cb 0.49 0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.57 2pui n ILE 38 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2pui n GLY 39 N 0.34 -3.43 0.03 3.28 0.00 -1.23 -4.91 105.19 99.26 2pui n GLY 39 Ca 0.18 -0.79 0.11 0.00 0.00 0.00 0.00 46.02 45.52 2pui n GLY 39 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2pui n ASN 42 N 0.00 0.17 0.00 1.61 3.02 -1.26 -4.94 115.26 113.86 2pui n ASN 42 Ca 0.00 0.06 -0.07 0.00 -0.03 0.00 0.00 54.58 54.54 2pui n ASN 42 Cb 0.00 1.69 -0.13 0.00 -0.61 0.00 0.00 39.78 40.73 2pui n ASN 42 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2pui h LEU 43 N 0.00 0.00 -8.37 3.41 3.38 -1.97 -3.46 115.31 108.30 2pui h LEU 43 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 2pui h LEU 43 Cb 1.00 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 41.42 2pui h LEU 43 CO 0.00 0.95 -0.86 0.20 0.09 0.00 0.00 178.44 178.82 2pui s ASN 44 N -6.17 3.21 0.07 -0.43 0.01 -1.26 -1.17 114.94 109.19 2pui s ASN 44 Ca -0.03 -0.53 -0.19 0.00 -0.71 0.00 0.00 52.86 51.39 2pui s ASN 44 Cb 0.08 -1.44 -0.07 0.00 0.41 0.00 0.00 41.25 40.24 2pui s ASN 44 CO 0.82 0.16 0.56 -0.31 -1.51 0.00 0.00 177.10 176.82 2pui s TYR 45 N 0.37 3.80 -0.20 2.20 4.12 -0.39 -4.77 117.35 122.49 2pui s TYR 45 Ca -0.17 1.26 0.01 0.00 0.02 0.00 0.00 57.07 58.19 2pui s TYR 45 Cb -0.18 -2.49 0.04 0.00 -1.52 0.00 0.00 41.96 37.81 2pui s TYR 45 CO 0.08 0.58 -0.12 0.08 0.02 0.00 0.00 175.55 176.19 2pui s VAL 46 N -1.08 1.73 -0.33 0.71 1.01 -1.26 -1.06 120.40 120.12 2pui s VAL 46 Ca 0.29 -1.01 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 2pui s VAL 46 Cb -0.19 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.43 2pui s VAL 46 CO 0.19 0.23 0.17 -0.36 0.00 0.00 0.00 175.10 175.32 2pui s PHE 47 N 1.37 3.19 -0.18 5.22 0.08 0.47 -0.02 117.98 128.11 2pui s PHE 47 Ca -0.01 -0.64 -0.19 0.00 0.12 0.00 0.00 56.93 56.21 2pui s PHE 47 Cb -0.16 -2.38 -0.03 0.00 -0.57 0.00 0.00 43.02 39.88 2pui s PHE 47 CO -0.09 -0.50 0.55 -1.58 -0.10 0.00 0.00 175.22 173.51 2pui s HIS 48 N 1.60 3.40 -0.14 0.36 5.65 -0.75 -0.71 115.29 124.71 2pui s HIS 48 Ca 0.04 0.86 0.02 0.00 0.25 0.00 0.00 55.06 56.23 2pui s HIS 48 Cb -0.18 -2.69 0.01 0.00 -1.18 0.00 0.00 32.58 28.54 2pui s HIS 48 CO 0.06 -0.07 -0.20 0.42 -0.65 0.00 0.00 174.74 174.30 2pui s ILE 49 N 1.51 1.92 0.03 0.89 1.01 -0.01 -2.00 121.20 124.56 2pui s ILE 49 Ca 0.26 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 60.06 2pui s ILE 49 Cb -0.16 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.57 2pui s ILE 49 CO 0.10 0.52 -0.06 -0.47 0.00 0.00 0.00 174.94 175.03 2pui s TYR 50 N 0.91 2.88 0.00 3.97 6.14 -0.83 -1.10 117.35 129.32 2pui s TYR 50 Ca -0.06 -0.06 0.00 0.00 0.64 0.00 0.00 57.07 57.60 2pui s TYR 50 Cb -0.15 -1.57 0.00 0.00 0.42 0.00 0.00 41.96 40.66 2pui s TYR 50 CO -0.03 0.40 0.00 2.89 0.64 0.00 0.00 175.55 179.45 2pui n ARG 56 N 1.26 0.00 -4.22 4.97 1.85 -1.26 -3.58 116.66 115.68 2pui n ARG 56 Ca -0.14 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.58 2pui n ARG 56 Cb 0.52 -0.21 -0.10 0.00 -1.05 0.00 0.00 32.46 31.63 2pui n ARG 56 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2pui s ALA 57 N -0.23 1.28 -0.03 2.89 0.00 -1.26 -5.04 121.76 119.37 2pui s ALA 57 Ca 0.00 -1.72 -0.29 0.00 0.00 0.00 0.00 51.96 49.94 2pui s ALA 57 Cb 0.00 1.28 0.08 0.00 0.00 0.00 0.00 23.12 24.49 2pui s ALA 57 CO 0.00 -0.55 0.75 -1.17 0.00 0.00 0.00 175.76 174.78 2pui s LEU 58 N -3.19 -0.56 -0.06 0.00 0.20 -0.26 -4.50 118.68 110.32 2pui s LEU 58 Ca 0.38 0.46 0.05 0.00 0.69 0.00 0.00 54.13 55.71 2pui s LEU 58 Cb 0.07 2.37 -0.01 0.00 -0.43 0.00 0.00 46.19 48.20 2pui s LEU 58 CO 0.12 -0.63 -0.23 -0.63 -0.29 0.00 0.00 176.35 174.70 2pui s ILE 59 N -1.83 1.86 -0.25 6.68 -1.09 -0.47 -0.83 121.20 125.28 2pui s ILE 59 Ca -0.06 -0.95 0.01 0.00 -2.23 0.00 0.00 60.65 57.42 2pui s ILE 59 Cb -0.00 -1.58 0.06 0.00 -1.58 0.00 0.00 42.46 39.36 2pui s ILE 59 CO 0.02 0.52 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.58 2pui s ILE 60 N -0.07 1.59 -0.05 2.92 1.01 0.11 -0.87 121.20 125.84 2pui s ILE 60 Ca -0.04 -1.33 -0.10 0.00 0.00 0.00 0.00 60.65 59.18 2pui s ILE 60 Cb -0.13 -1.88 -0.05 0.00 0.01 0.00 0.00 42.46 40.41 2pui s ILE 60 CO 0.03 -0.15 0.28 -0.75 0.00 0.00 0.00 174.94 174.35 2pui s LYS 61 N 1.35 3.67 -0.04 2.79 2.20 -0.31 -0.40 119.74 129.01 2pui s LYS 61 Ca -0.04 0.12 -0.03 0.00 -0.36 0.00 0.00 55.97 55.65 2pui s LYS 61 Cb -0.19 -3.18 0.01 0.00 -1.51 0.00 0.00 37.83 32.96 2pui s LYS 61 CO -0.07 0.72 0.09 -1.14 -0.36 0.00 0.00 175.35 174.59 2pui s GLN 62 N -1.17 0.09 0.28 4.03 0.74 -0.23 -1.17 119.66 122.23 2pui s GLN 62 Ca 0.21 0.16 -0.25 0.00 0.05 0.00 0.00 55.36 55.52 2pui s GLN 62 Cb -0.14 -0.00 -0.09 0.00 1.10 0.00 0.00 33.01 33.88 2pui s GLN 62 CO 0.10 -0.04 0.89 0.00 -0.55 0.00 0.00 175.29 175.68 2pui s ALA 63 N 0.27 3.29 -0.08 1.58 0.00 -0.77 -1.26 121.76 124.79 2pui s ALA 63 Ca -0.02 0.46 0.01 0.00 0.00 0.00 0.00 51.96 52.41 2pui s ALA 63 Cb -0.03 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 19.97 2pui s ALA 63 CO -0.01 0.22 -0.11 0.08 0.00 0.00 0.00 175.76 175.94 2pui s VAL 64 N -1.49 3.32 0.45 0.00 1.01 -0.32 -4.92 120.40 118.45 2pui s VAL 64 Ca 0.46 -0.61 -0.24 0.00 0.00 0.00 0.00 61.98 61.59 2pui s VAL 64 Cb -0.20 -2.35 -0.09 0.00 0.00 0.00 0.00 36.38 33.74 2pui s VAL 64 CO 0.25 0.57 1.23 -2.65 0.00 0.00 0.00 175.10 174.50 2pui n PRO 65 N 2.70 1.77 -3.72 2.72 -0.02 -1.26 -4.79 135.00 132.41 2pui n PRO 65 Ca -0.18 0.64 -0.37 0.00 -2.02 0.00 0.00 63.50 61.57 2pui n PRO 65 Cb 0.53 -2.35 -0.11 0.00 -0.02 0.00 0.00 33.50 31.55 2pui n PRO 65 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2pui s PRO 75 N -2.29 3.91 -0.26 0.52 0.02 -1.26 -5.02 135.00 130.62 2pui s PRO 75 Ca 0.63 -0.35 -0.10 0.00 0.02 0.00 0.00 61.00 61.20 2pui s PRO 75 Cb -0.50 -3.47 0.11 0.00 0.02 0.00 0.00 34.50 30.66 2pui s PRO 75 CO 0.56 -0.05 0.59 -1.17 -0.33 0.00 0.00 177.00 176.60 2pui s LEU 76 N 1.31 -0.92 0.22 -5.54 0.20 -1.26 -5.14 118.68 107.55 2pui s LEU 76 Ca 0.06 1.38 -0.28 0.00 0.69 0.00 0.00 54.13 55.98 2pui s LEU 76 Cb -0.15 2.03 -0.16 0.00 -0.43 0.00 0.00 46.19 47.48 2pui s LEU 76 CO 0.06 -0.22 0.63 1.07 -0.29 0.00 0.00 176.35 177.59 2pui n THR 77 N 5.14 1.99 1.58 3.68 5.66 -1.26 -4.86 114.28 126.21 2pui n THR 77 Ca -0.14 -0.50 0.15 0.00 -3.05 0.00 0.00 64.05 60.52 2pui n THR 77 Cb 0.51 -0.22 0.81 0.00 -1.55 0.00 0.00 70.33 69.89 2pui n THR 77 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 175.07 174.32 2pui n ILE 78 N 0.06 0.00 0.33 1.09 -5.35 -1.26 -3.57 119.36 110.66 2pui n ILE 78 Ca 0.16 0.00 0.22 0.00 -0.27 0.00 0.00 62.75 62.86 2pui n ILE 78 Cb 0.26 -0.50 1.12 0.00 -1.74 0.00 0.00 39.64 38.78 2pui n ILE 78 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 2pui h ASP 79 N 0.00 0.00 -0.43 7.28 3.58 -1.91 -2.33 116.42 122.61 2pui h ASP 79 Ca 0.00 0.00 0.12 0.00 0.42 0.00 0.00 57.03 57.57 2pui h ASP 79 Cb 0.21 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 2pui h ASP 79 CO 0.00 0.00 0.33 0.08 -2.88 0.00 0.00 179.24 176.77 2pui h ARG 80 N 0.00 0.00 -0.10 0.28 0.11 -1.91 -1.88 114.38 110.88 2pui h ARG 80 Ca 0.00 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.94 2pui h ARG 80 Cb 0.09 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.16 2pui h ARG 80 CO 0.00 0.00 -0.55 0.00 0.10 0.00 0.00 179.97 179.52 2pui h ALA 81 N 1.74 0.88 -0.24 0.08 0.00 -1.72 -0.18 119.26 119.82 2pui h ALA 81 Ca 0.20 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2pui h ALA 81 Cb 0.86 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2pui h ALA 81 CO -0.00 0.69 0.08 -0.09 0.00 0.00 0.00 179.25 179.93 2pui h ARG 82 N 0.23 0.37 -0.47 0.00 2.43 -1.53 -2.24 114.38 113.17 2pui h ARG 82 Ca 0.00 -0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2pui h ARG 82 Cb 1.03 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.50 2pui h ARG 82 CO 0.09 0.44 0.30 0.82 -1.51 0.00 0.00 179.97 180.11 2pui h ILE 83 N 0.23 1.11 -0.13 1.20 2.04 -1.25 -1.53 117.51 119.18 2pui h ILE 83 Ca 0.08 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 2pui h ILE 83 Cb 0.22 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 2pui h ILE 83 CO -0.00 0.11 0.08 -0.08 0.00 0.00 0.00 178.15 178.26 2pui h GLU 84 N 0.62 0.18 -0.11 2.37 4.81 -1.02 0.17 114.58 121.59 2pui h GLU 84 Ca 0.17 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2pui h GLU 84 Cb -0.06 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 2pui h GLU 84 CO -0.05 0.16 0.03 1.03 -0.73 0.00 0.00 179.01 179.46 2pui h SER 85 N 0.14 0.17 -0.62 1.04 0.87 -1.39 -0.74 113.55 113.02 2pui h SER 85 Ca 0.05 -0.21 0.05 0.00 -1.23 0.00 0.00 61.79 60.45 2pui h SER 85 Cb 0.03 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 61.90 2pui h SER 85 CO -0.01 0.33 0.34 0.28 -0.53 0.00 0.00 176.83 177.24 2pui h SER 86 N -0.01 0.50 -0.48 6.23 0.02 -1.21 -1.82 113.55 116.78 2pui h SER 86 Ca 0.04 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 2pui h SER 86 Cb 0.23 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 2pui h SER 86 CO -0.00 0.33 0.22 0.00 -1.14 0.00 0.00 176.83 176.24 2pui h ALA 87 N 1.33 0.62 -0.91 3.77 0.00 -0.44 -1.69 119.26 121.94 2pui h ALA 87 Ca 0.28 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2pui h ALA 87 Cb 0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2pui h ALA 87 CO -0.18 0.20 0.51 -0.07 0.00 0.00 0.00 179.25 179.71 2pui h LEU 88 N 0.64 1.13 -0.27 0.00 3.38 -0.92 -0.70 115.31 118.56 2pui h LEU 88 Ca 0.16 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2pui h LEU 88 Cb 0.14 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2pui h LEU 88 CO -0.02 0.90 -0.04 0.40 0.09 0.00 0.00 178.44 179.77 2pui h ILE 89 N 1.27 1.27 -0.10 1.22 2.04 -1.21 -0.92 117.51 121.09 2pui h ILE 89 Ca 0.32 -1.02 0.02 0.00 1.00 0.00 0.00 64.86 65.18 2pui h ILE 89 Cb 0.01 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 2pui h ILE 89 CO -0.05 0.32 -0.01 0.03 0.00 0.00 0.00 178.15 178.44 2pui h ARG 90 N 0.27 0.02 -0.99 2.37 3.08 -1.04 -2.66 114.38 115.44 2pui h ARG 90 Ca 0.07 -0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.19 2pui h ARG 90 Cb 0.49 -0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.47 2pui h ARG 90 CO 0.02 0.01 0.64 1.96 -1.07 0.00 0.00 179.97 181.54 2pui h GLN 91 N 0.02 1.13 0.00 0.04 4.20 -1.12 -1.68 115.11 117.71 2pui h GLN 91 Ca 0.05 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 2pui h GLN 91 Cb 0.06 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 27.59 2pui h GLN 91 CO -0.09 0.75 -0.02 0.78 -0.67 0.00 0.00 178.83 179.58 2pui h GLY 92 N 1.16 0.00 2.00 3.46 0.00 -0.87 -0.02 103.07 108.81 2pui h GLY 92 Ca 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.70 2pui h GLY 92 CO -0.17 0.00 -0.26 1.05 0.00 0.00 0.00 176.54 177.16 2pui h GLU 93 N 0.00 0.00 0.00 4.80 9.09 -0.97 -3.07 114.58 124.44 2pui h GLU 93 Ca -0.00 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.31 2pui h GLU 93 Cb 0.06 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.15 2pui h GLU 93 CO 0.00 0.26 -1.37 0.72 0.05 0.00 0.00 179.01 178.68 2pui n HIS 94 N -3.87 0.00 -3.06 2.06 8.25 -0.98 -4.84 115.22 112.78 2pui n HIS 94 Ca -0.02 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.22 2pui n HIS 94 Cb 0.35 -0.25 -0.04 0.00 1.12 0.00 0.00 29.99 31.17 2pui n HIS 94 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2pui n VAL 95 N -2.52 1.57 0.30 1.59 0.24 -0.06 -4.94 118.33 114.51 2pui n VAL 95 Ca -0.11 -5.12 0.20 0.00 -2.04 0.00 0.00 64.34 57.27 2pui n VAL 95 Cb 0.64 -0.87 1.04 0.00 -1.47 0.00 0.00 33.84 33.17 2pui n VAL 95 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2pui h PRO 96 N 2.99 0.00 -0.00 7.34 0.13 -1.70 0.74 132.00 141.50 2pui h PRO 96 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2pui h PRO 96 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2pui h PRO 96 CO 0.67 0.00 -0.19 -2.39 -0.23 0.00 0.00 178.00 175.86 2pui n HIS 97 N -2.90 0.00 -0.09 1.56 1.44 -1.26 -3.94 115.22 110.03 2pui n HIS 97 Ca -0.02 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.72 2pui n HIS 97 Cb 0.09 -0.37 0.09 0.00 0.12 0.00 0.00 29.99 29.92 2pui n HIS 97 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2pui n LEU 98 N -1.42 2.51 -3.87 2.39 4.77 0.25 -4.79 117.00 116.84 2pui n LEU 98 Ca 0.08 -1.98 -0.11 0.00 -0.03 0.00 0.00 56.01 53.97 2pui n LEU 98 Cb 0.33 -0.13 -0.10 0.00 -2.33 0.00 0.00 43.42 41.19 2pui n LEU 98 CO 0.29 0.63 -0.17 0.68 -1.33 0.00 0.00 177.39 177.49 2pui s VAL 99 N -0.99 0.09 0.47 4.08 -7.23 -1.22 -0.42 120.40 115.18 2pui s VAL 99 Ca 0.13 -0.73 -0.24 0.00 -1.81 0.00 0.00 61.98 59.34 2pui s VAL 99 Cb 0.07 -0.49 -0.07 0.00 0.56 0.00 0.00 36.38 36.44 2pui s VAL 99 CO 0.09 -0.40 1.28 -2.16 -0.31 0.00 0.00 175.10 173.60 2pui s PRO 100 N -1.54 3.62 0.32 4.82 0.04 -1.26 -4.89 135.00 136.11 2pui s PRO 100 Ca -0.14 2.08 -0.29 0.00 0.04 0.00 0.00 61.00 62.69 2pui s PRO 100 Cb -0.07 -2.48 -0.10 0.00 0.04 0.00 0.00 34.50 31.89 2pui s PRO 100 CO 0.01 -0.75 1.30 -0.98 0.04 0.00 0.00 177.00 176.61 2pui s ARG 101 N -2.61 4.38 -0.27 4.56 3.03 -1.26 -4.82 118.95 121.96 2pui s ARG 101 Ca 0.64 2.18 -0.07 0.00 2.03 0.00 0.00 55.73 60.51 2pui s ARG 101 Cb -0.36 -3.08 -0.01 0.00 -1.03 0.00 0.00 34.95 30.46 2pui s ARG 101 CO 0.44 -0.17 0.07 0.08 -1.13 0.00 0.00 175.30 174.60 2pui s VAL 102 N -1.07 4.16 -0.17 4.99 1.01 -1.26 -0.19 120.40 127.87 2pui s VAL 102 Ca 0.49 -0.37 0.18 0.00 0.00 0.00 0.00 61.98 62.28 2pui s VAL 102 Cb -0.39 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 2pui s VAL 102 CO 0.51 0.25 1.01 -0.26 0.00 0.00 0.00 175.10 176.62 2pui h PHE 103 N 8.24 0.00 -1.61 5.22 -1.00 -0.68 -3.48 116.94 123.62 2pui h PHE 103 Ca -0.36 0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.48 2pui h PHE 103 Cb 1.16 0.00 -0.24 0.00 3.61 0.00 0.00 35.95 40.47 2pui h PHE 103 CO 0.64 0.41 0.47 -0.47 -1.61 0.00 0.00 178.31 177.76 2pui s TYR 104 N -3.04 -0.45 0.04 -0.55 6.14 -1.13 -5.03 117.35 113.33 2pui s TYR 104 Ca -0.01 0.95 -0.07 0.00 0.64 0.00 0.00 57.07 58.58 2pui s TYR 104 Cb 0.09 0.40 -0.01 0.00 0.42 0.00 0.00 41.96 42.86 2pui s TYR 104 CO 0.79 -0.30 0.12 -1.54 0.64 0.00 0.00 175.55 175.26 2pui s SER 105 N -0.42 0.14 -0.10 4.32 1.04 -1.26 -0.07 113.70 117.34 2pui s SER 105 Ca 0.00 -0.49 -0.05 0.00 0.48 0.00 0.00 55.95 55.89 2pui s SER 105 Cb -0.03 0.25 0.05 0.00 0.10 0.00 0.00 66.02 66.39 2pui s SER 105 CO -0.02 -0.53 0.23 -0.62 0.98 0.00 0.00 173.24 173.28 2pui s ASP 106 N -2.13 -0.03 -0.04 7.02 3.68 -0.56 -5.01 116.67 119.59 2pui s ASP 106 Ca -0.05 0.49 -0.26 0.00 2.13 0.00 0.00 52.55 54.86 2pui s ASP 106 Cb -0.01 0.42 -0.21 0.00 -1.45 0.00 0.00 42.92 41.67 2pui s ASP 106 CO -0.05 -0.19 1.17 0.74 0.13 0.00 0.00 175.17 176.98 2pui h THR 107 N 6.03 1.47 -0.79 1.71 2.02 -1.95 -0.54 112.91 120.87 2pui h THR 107 Ca -0.33 -1.40 -0.03 0.00 0.77 0.00 0.00 66.41 65.42 2pui h THR 107 Cb 1.14 2.41 -0.04 0.00 -1.74 0.00 0.00 68.15 69.92 2pui h THR 107 CO 0.31 0.37 0.39 -0.33 0.37 0.00 0.00 175.52 176.63 2pui h GLU 108 N -0.57 1.12 0.00 6.66 3.07 -1.97 -1.40 114.58 121.49 2pui h GLU 108 Ca -0.00 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 2pui h GLU 108 Cb 0.60 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 2pui h GLU 108 CO 0.00 0.85 0.00 -1.33 -1.40 0.00 0.00 179.01 177.13 2pui n MET 109 N -4.32 0.19 -3.57 2.33 2.81 -1.25 -3.65 117.12 109.66 2pui n MET 109 Ca 0.08 0.17 -0.19 0.00 -1.81 0.00 0.00 57.70 55.95 2pui n MET 109 Cb 0.13 -1.73 0.06 0.00 -0.71 0.00 0.00 33.22 30.97 2pui n MET 109 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2pui n ALA 110 N -1.71 -2.02 -2.74 3.04 0.00 -0.53 -4.70 120.51 111.85 2pui n ALA 110 Ca 0.06 -0.12 -0.30 0.00 0.00 0.00 0.00 53.44 53.08 2pui n ALA 110 Cb 0.39 -2.20 -0.16 0.00 0.00 0.00 0.00 19.45 17.48 2pui n ALA 110 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2pui s VAL 111 N -3.52 1.89 -0.15 0.00 1.01 -0.29 -1.84 120.40 117.50 2pui s VAL 111 Ca 0.01 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.01 2pui s VAL 111 Cb -0.00 -1.60 0.02 0.00 0.00 0.00 0.00 36.38 34.80 2pui s VAL 111 CO 0.77 0.53 -0.16 -0.89 0.00 0.00 0.00 175.10 175.35 2pui s THR 112 N -0.15 1.70 -0.28 3.92 2.01 -0.32 -1.50 115.64 121.02 2pui s THR 112 Ca -0.02 -0.72 -0.10 0.00 0.31 0.00 0.00 61.69 61.16 2pui s THR 112 Cb -0.13 -1.57 -0.03 0.00 0.01 0.00 0.00 72.50 70.78 2pui s THR 112 CO 0.03 0.48 0.15 -0.69 -0.69 0.00 0.00 174.62 173.90 2pui s VAL 113 N 1.35 4.85 0.18 3.82 1.01 0.89 -1.17 120.40 131.34 2pui s VAL 113 Ca 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 2pui s VAL 113 Cb -0.13 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2pui s VAL 113 CO -0.10 0.23 0.10 0.00 0.00 0.00 0.00 175.10 175.33 2pui s MET 114 N 1.68 1.13 0.28 2.72 0.23 -0.05 0.11 119.30 125.40 2pui s MET 114 Ca 0.06 -1.58 -0.30 0.00 -1.03 0.00 0.00 55.69 52.84 2pui s MET 114 Cb -0.16 0.18 -0.12 0.00 -1.53 0.00 0.00 34.83 33.20 2pui s MET 114 CO 0.08 -0.33 1.53 -1.91 -2.03 0.00 0.00 175.02 172.36 2pui n GLU 115 N -0.24 2.49 -2.61 3.16 2.13 0.73 -1.37 120.64 124.95 2pui n GLU 115 Ca -0.01 0.89 -0.42 0.00 0.66 0.00 0.00 57.16 58.28 2pui n GLU 115 Cb 0.65 -2.63 -0.03 0.00 0.27 0.00 0.00 31.44 29.70 2pui n GLU 115 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2pui s ASP 116 N 0.42 7.24 -0.17 4.31 3.68 -1.26 -4.67 116.67 126.22 2pui s ASP 116 Ca 0.65 1.74 0.14 0.00 2.13 0.00 0.00 52.55 57.21 2pui s ASP 116 Cb -0.54 -2.57 0.40 0.00 -1.45 0.00 0.00 42.92 38.76 2pui s ASP 116 CO 0.49 -0.38 1.20 0.18 0.13 0.00 0.00 175.17 176.79 2pui n LEU 117 N 4.24 2.36 0.00 -1.34 4.77 -1.26 -4.80 117.00 120.98 2pui n LEU 117 Ca 0.08 -3.48 0.12 0.00 -0.03 0.00 0.00 56.01 52.69 2pui n LEU 117 Cb 0.49 -0.43 0.66 0.00 -2.33 0.00 0.00 43.42 41.81 2pui n LEU 117 CO 0.53 1.18 0.89 -1.54 -1.33 0.00 0.00 177.39 177.13 2pui n SER 118 N -0.87 0.00 -0.18 -1.43 3.41 -1.26 -1.71 113.62 111.57 2pui n SER 118 Ca 0.16 -0.46 0.15 0.00 -0.26 0.00 0.00 58.87 58.46 2pui n SER 118 Cb 0.76 -0.12 0.77 0.00 -0.26 0.00 0.00 64.21 65.37 2pui n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pui n HIS 119 N -1.12 0.00 -4.29 7.33 1.44 -1.26 -4.85 115.22 112.48 2pui n HIS 119 Ca 0.15 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.61 2pui n HIS 119 Cb 0.12 -0.01 -0.08 0.00 0.12 0.00 0.00 29.99 30.14 2pui n HIS 119 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2pui s LEU 120 N -2.03 3.03 -0.02 2.39 1.43 -0.69 -4.98 118.68 117.81 2pui s LEU 120 Ca 0.43 -1.03 0.06 0.00 -1.03 0.00 0.00 54.13 52.56 2pui s LEU 120 Cb 0.22 -1.37 -0.03 0.00 0.03 0.00 0.00 46.19 45.04 2pui s LEU 120 CO 0.36 -0.34 -0.19 -0.75 0.23 0.00 0.00 176.35 175.66 2pui s LYS 121 N -3.78 2.28 0.22 1.70 2.20 -0.39 -4.85 119.74 117.12 2pui s LYS 121 Ca 0.37 -0.84 -0.32 0.00 -0.36 0.00 0.00 55.97 54.82 2pui s LYS 121 Cb 0.02 -2.23 -0.13 0.00 -1.51 0.00 0.00 37.83 33.98 2pui s LYS 121 CO 0.20 0.58 1.54 -0.89 -0.36 0.00 0.00 175.35 176.42 2pui n ILE 122 N 2.17 0.53 -0.28 5.43 2.08 -1.26 0.41 119.36 128.44 2pui n ILE 122 Ca -0.17 -0.13 -0.06 0.00 0.56 0.00 0.00 62.75 62.95 2pui n ILE 122 Cb 0.52 -1.64 0.06 0.00 -0.75 0.00 0.00 39.64 37.82 2pui n ILE 122 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2pui h ALA 123 N 5.19 1.00 -0.17 -1.39 0.00 -0.67 -1.81 119.26 121.42 2pui h ALA 123 Ca -0.45 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 54.30 2pui h ALA 123 Cb 1.25 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 2pui h ALA 123 CO 0.83 0.65 -0.16 -0.09 0.00 0.00 0.00 179.25 180.49 2pui h ARG 124 N 1.13 -0.17 0.03 0.00 2.43 -1.48 0.22 114.38 116.53 2pui h ARG 124 Ca 0.25 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.44 2pui h ARG 124 Cb 0.25 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2pui h ARG 124 CO -0.02 -0.12 -0.07 -0.22 -1.51 0.00 0.00 179.97 178.04 2pui h LYS 125 N -0.18 -0.13 -0.26 0.20 3.64 -1.79 -1.96 116.57 116.09 2pui h LYS 125 Ca 0.11 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.54 2pui h LYS 125 Cb 0.34 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.15 2pui h LYS 125 CO -0.27 -0.09 -0.01 0.78 -2.27 0.00 0.00 179.45 177.59 2pui h GLY 126 N -0.14 0.24 1.29 5.01 0.00 -1.08 -1.90 103.07 106.50 2pui h GLY 126 Ca 0.02 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2pui h GLY 126 CO -0.05 -0.06 0.45 1.41 0.00 0.00 0.00 176.54 178.29 2pui h LEU 127 N 0.07 0.83 -0.63 3.11 3.38 -0.39 -1.54 115.31 120.13 2pui h LEU 127 Ca 0.12 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 2pui h LEU 127 Cb 0.16 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2pui h LEU 127 CO -0.21 0.62 -0.37 0.40 0.09 0.00 0.00 178.44 178.97 2pui h ILE 128 N 0.97 1.29 0.00 1.22 2.04 -1.10 -2.32 117.51 119.61 2pui h ILE 128 Ca 0.26 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.59 2pui h ILE 128 Cb -0.07 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2pui h ILE 128 CO -0.05 0.49 0.00 -0.62 0.00 0.00 0.00 178.15 177.97 2pui n GLU 129 N -4.05 0.31 -0.11 2.37 1.02 -0.74 -4.88 120.64 114.57 2pui n GLU 129 Ca -0.01 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2pui n GLU 129 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 2pui n GLU 129 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pui n GLY 130 N 0.23 0.71 3.76 0.62 0.00 -0.87 -5.07 105.19 104.57 2pui n GLY 130 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 2pui n GLY 130 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pui s GLU 131 N -0.89 3.72 -0.00 1.61 0.41 -0.65 -4.96 118.70 117.93 2pui s GLU 131 Ca 0.00 2.23 0.10 0.00 -0.41 0.00 0.00 54.97 56.89 2pui s GLU 131 Cb 0.00 -2.62 -0.11 0.00 -1.78 0.00 0.00 34.13 29.62 2pui s GLU 131 CO 0.00 -0.72 0.42 0.09 -0.49 0.00 0.00 175.26 174.56 2pui n ASN 132 N -0.21 0.57 -2.90 -0.19 3.02 -1.26 -4.17 115.26 110.12 2pui n ASN 132 Ca 0.05 -0.71 -0.27 0.00 -0.03 0.00 0.00 54.58 53.62 2pui n ASN 132 Cb 0.43 1.02 0.03 0.00 -0.61 0.00 0.00 39.78 40.65 2pui n ASN 132 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2pui n TYR 133 N -1.27 -1.83 0.06 3.10 0.53 -1.26 -4.82 117.16 111.68 2pui n TYR 133 Ca 0.02 0.77 0.17 0.00 -1.02 0.00 0.00 57.90 57.84 2pui n TYR 133 Cb 0.16 -1.27 0.67 0.00 -1.03 0.00 0.00 39.34 37.87 2pui n TYR 133 CO 0.00 0.00 0.00 -1.35 -1.02 0.00 0.00 176.86 174.49 2pui h PRO 134 N 1.78 0.01 -0.11 -0.72 0.11 -1.89 -1.67 132.00 129.51 2pui h PRO 134 Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2pui h PRO 134 Cb 1.06 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2pui h PRO 134 CO 0.16 0.01 0.00 0.72 -0.21 0.00 0.00 178.00 178.68 2pui n HIS 135 N -4.42 0.12 -0.29 0.65 8.25 -1.26 -4.55 115.22 113.72 2pui n HIS 135 Ca 0.07 -0.07 0.07 0.00 -0.26 0.00 0.00 57.72 57.53 2pui n HIS 135 Cb 0.48 -0.00 0.22 0.00 1.12 0.00 0.00 29.99 31.81 2pui n HIS 135 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2pui h LEU 136 N 3.90 0.46 -0.01 2.41 5.85 -1.63 -0.50 115.31 125.80 2pui h LEU 136 Ca 0.00 0.10 -0.27 0.00 0.84 0.00 0.00 57.88 58.55 2pui h LEU 136 Cb 0.85 0.03 0.02 0.00 0.37 0.00 0.00 40.66 41.93 2pui h LEU 136 CO 0.00 0.18 -1.08 0.77 -0.34 0.00 0.00 178.44 177.97 2pui h SER 137 N 0.57 0.78 -0.32 1.25 4.64 -1.80 -0.95 113.55 117.72 2pui h SER 137 Ca 0.46 -0.66 -0.02 0.00 -0.47 0.00 0.00 61.79 61.10 2pui h SER 137 Cb 0.67 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 2pui h SER 137 CO -0.38 1.46 0.12 1.56 -0.87 0.00 0.00 176.83 178.72 2pui h GLN 138 N 0.30 0.48 0.09 4.77 7.50 -1.77 0.17 115.11 126.66 2pui h GLN 138 Ca -0.13 -0.09 -0.00 0.00 0.50 0.00 0.00 58.65 58.92 2pui h GLN 138 Cb 1.74 -0.08 0.00 0.00 0.05 0.00 0.00 27.48 29.20 2pui h GLN 138 CO 0.20 0.50 -0.04 0.45 -1.50 0.00 0.00 178.83 178.44 2pui h HIS 139 N 0.37 -0.12 -0.61 2.96 -0.00 -1.05 -1.72 115.15 114.98 2pui h HIS 139 Ca 0.11 -0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.38 2pui h HIS 139 Cb 0.20 0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 27.62 2pui h HIS 139 CO -0.00 0.01 -0.00 0.82 -0.00 0.00 0.00 177.93 178.76 2pui h ILE 140 N -0.22 1.27 -0.90 2.45 1.08 -1.21 -0.37 117.51 119.61 2pui h ILE 140 Ca -0.01 -1.16 0.13 0.00 -0.39 0.00 0.00 64.86 63.43 2pui h ILE 140 Cb 0.18 0.79 -0.07 0.00 -3.07 0.00 0.00 36.82 34.65 2pui h ILE 140 CO 0.02 0.42 0.58 1.23 -0.69 0.00 0.00 178.15 179.71 2pui h GLY 141 N 0.99 1.28 0.72 5.37 0.00 -0.87 0.30 103.07 110.86 2pui h GLY 141 Ca 0.17 -0.33 -0.12 0.00 0.00 0.00 0.00 47.33 47.05 2pui h GLY 141 CO 0.03 0.13 -0.42 -2.09 0.00 0.00 0.00 176.54 174.19 2pui h GLU 142 N 0.78 0.37 -0.30 4.80 4.81 -0.92 -1.40 114.58 122.73 2pui h GLU 142 Ca 0.44 -0.34 0.07 0.00 -0.13 0.00 0.00 59.36 59.40 2pui h GLU 142 Cb 0.60 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.98 2pui h GLU 142 CO -0.20 0.99 -0.23 0.35 -0.73 0.00 0.00 179.01 179.19 2pui h PHE 143 N -0.13 -0.60 0.46 0.92 3.57 -0.50 -1.79 116.94 118.87 2pui h PHE 143 Ca -0.04 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2pui h PHE 143 Cb 1.10 0.31 0.00 0.00 2.79 0.00 0.00 35.95 40.16 2pui h PHE 143 CO 0.14 -0.31 -0.22 -0.07 -2.23 0.00 0.00 178.31 175.62 2pui h LEU 144 N -0.21 -0.53 -0.48 0.59 3.38 -0.44 -1.13 115.31 116.50 2pui h LEU 144 Ca 0.16 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.20 2pui h LEU 144 Cb 0.45 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.28 2pui h LEU 144 CO -0.42 -0.37 0.15 1.23 0.09 0.00 0.00 178.44 179.13 2pui h GLY 145 N -0.64 0.62 0.19 0.83 0.00 -1.12 -0.34 103.07 102.61 2pui h GLY 145 Ca -0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 2pui h GLY 145 CO 0.10 -0.01 -0.02 0.50 0.00 0.00 0.00 176.54 177.11 2pui h LYS 146 N 0.32 -0.06 -0.67 4.80 1.57 -1.33 -1.95 116.57 119.23 2pui h LYS 146 Ca 0.23 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 59.11 2pui h LYS 146 Cb 0.26 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.51 2pui h LYS 146 CO -0.25 0.56 0.32 1.79 -0.57 0.00 0.00 179.45 181.29 2pui h THR 147 N -0.88 0.84 0.01 -0.16 1.35 -1.19 -0.91 112.91 111.96 2pui h THR 147 Ca -0.01 -0.19 -0.22 0.00 -0.55 0.00 0.00 66.41 65.44 2pui h THR 147 Cb 0.65 0.24 -0.00 0.00 -1.73 0.00 0.00 68.15 67.31 2pui h THR 147 CO 0.01 0.10 -0.94 -0.07 -0.25 0.00 0.00 175.52 174.38 2pui h LEU 148 N 0.55 0.47 -0.35 3.87 3.38 -1.14 -3.15 115.31 118.93 2pui h LEU 148 Ca 0.33 -0.38 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 2pui h LEU 148 Cb 0.35 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2pui h LEU 148 CO -0.27 1.18 -0.01 0.15 0.09 0.00 0.00 178.44 179.58 2pui h PHE 149 N 0.20 0.69 -0.00 1.13 3.57 -1.09 -3.37 116.94 118.07 2pui h PHE 149 Ca -0.07 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.30 2pui h PHE 149 Cb 1.57 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 40.14 2pui h PHE 149 CO 0.05 0.74 -0.14 0.66 -2.23 0.00 0.00 178.31 177.40 2pui n TYR 150 N -4.49 0.00 -0.60 0.41 4.01 -0.37 -2.29 117.16 113.82 2pui n TYR 150 Ca -0.02 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.80 2pui n TYR 150 Cb 0.28 -0.31 0.23 0.00 -0.31 0.00 0.00 39.34 39.24 2pui n TYR 150 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2pui n SER 151 N -1.27 3.63 -5.00 7.72 7.64 -1.23 -4.65 113.62 120.46 2pui n SER 151 Ca 0.10 -2.52 -0.18 0.00 1.01 0.00 0.00 58.87 57.28 2pui n SER 151 Cb 0.30 -0.42 0.03 0.00 -1.01 0.00 0.00 64.21 63.11 2pui n SER 151 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2pui s SER 152 N -1.39 5.42 0.59 6.43 1.04 -0.97 -3.99 113.70 120.83 2pui s SER 152 Ca 0.36 -0.52 0.37 0.00 0.48 0.00 0.00 55.95 56.64 2pui s SER 152 Cb 0.25 -0.37 1.76 0.00 0.10 0.00 0.00 66.02 67.76 2pui s SER 152 CO 0.14 -1.00 2.13 0.44 0.98 0.00 0.00 173.24 175.93 2pui h ASP 153 N 0.42 0.00 -0.17 7.02 3.32 -1.80 0.11 116.42 125.33 2pui h ASP 153 Ca -0.37 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.56 2pui h ASP 153 Cb 1.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.82 2pui h ASP 153 CO 0.44 0.01 -0.28 1.88 -1.72 0.00 0.00 179.24 179.57 2pui h TYR 154 N 0.00 0.74 0.00 4.55 0.05 -1.91 -3.31 116.97 117.09 2pui h TYR 154 Ca -0.00 -0.18 -0.31 0.00 0.05 0.00 0.00 58.73 58.29 2pui h TYR 154 Cb 0.32 -0.17 -0.06 0.00 1.01 0.00 0.00 36.73 37.83 2pui h TYR 154 CO 0.00 0.86 -2.17 0.00 -1.05 0.00 0.00 178.16 175.80 2pui n ALA 155 N -2.50 1.65 -2.50 3.88 0.00 -0.94 -0.15 120.51 119.95 2pui n ALA 155 Ca -0.01 -1.11 -0.30 0.00 0.00 0.00 0.00 53.44 52.02 2pui n ALA 155 Cb 0.45 -0.40 -0.11 0.00 0.00 0.00 0.00 19.45 19.39 2pui n ALA 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2pui s LEU 156 N -5.53 2.74 0.25 0.00 1.43 0.35 -4.71 118.68 113.21 2pui s LEU 156 Ca -0.08 -0.49 -0.31 0.00 -1.03 0.00 0.00 54.13 52.21 2pui s LEU 156 Cb 0.07 -1.59 -0.13 0.00 0.03 0.00 0.00 46.19 44.58 2pui s LEU 156 CO 0.84 0.20 1.50 -0.62 0.23 0.00 0.00 176.35 178.50 2pui n GLU 157 N 0.99 2.30 -0.07 1.70 1.02 -1.26 -4.55 120.64 120.77 2pui n GLU 157 Ca -0.15 0.82 0.04 0.00 -0.02 0.00 0.00 57.16 57.85 2pui n GLU 157 Cb 0.52 -2.54 0.38 0.00 -0.02 0.00 0.00 31.44 29.79 2pui n GLU 157 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2pui h PRO 158 N 4.73 0.65 -0.92 3.49 0.11 -1.94 -0.91 132.00 137.20 2pui h PRO 158 Ca -0.45 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.64 2pui h PRO 158 Cb 1.25 -0.15 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 2pui h PRO 158 CO 0.79 0.43 0.60 0.87 -0.21 0.00 0.00 178.00 180.49 2pui h LYS 159 N 0.67 1.15 0.29 1.05 1.57 -2.00 -0.39 116.57 118.91 2pui h LYS 159 Ca 0.20 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2pui h LYS 159 Cb 0.01 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.06 2pui h LYS 159 CO -0.05 0.76 -0.14 0.28 -0.57 0.00 0.00 179.45 179.74 2pui h VAL 160 N 1.19 0.74 -0.99 0.50 2.07 -1.64 -3.19 116.25 114.94 2pui h VAL 160 Ca 0.36 -0.52 0.17 0.00 0.82 0.00 0.00 66.70 67.53 2pui h VAL 160 Cb -0.04 1.02 -0.10 0.00 -1.52 0.00 0.00 31.29 30.65 2pui h VAL 160 CO -0.11 0.11 0.62 0.50 0.02 0.00 0.00 177.57 178.71 2pui h LYS 161 N -0.67 0.76 0.00 1.57 3.11 -1.10 -0.56 116.57 119.67 2pui h LYS 161 Ca -0.04 -0.05 -0.03 0.00 -2.81 0.00 0.00 60.65 57.73 2pui h LYS 161 Cb 0.47 -0.17 -0.00 0.00 -1.00 0.00 0.00 32.23 31.52 2pui h LYS 161 CO 0.06 0.50 -0.14 0.87 -2.81 0.00 0.00 179.45 177.93 2pui h LYS 162 N 0.78 0.00 -0.06 1.90 1.57 -1.07 -0.61 116.57 119.08 2pui h LYS 162 Ca 0.54 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 59.14 2pui h LYS 162 Cb 0.82 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.14 2pui h LYS 162 CO -0.32 0.14 -0.69 1.96 -0.57 0.00 0.00 179.45 179.97 2pui h GLN 163 N 0.00 0.57 -0.56 3.15 1.08 -1.10 -3.06 115.11 115.19 2pui h GLN 163 Ca -0.00 -0.54 -0.04 0.00 -1.45 0.00 0.00 58.65 56.62 2pui h GLN 163 Cb 0.43 0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.97 2pui h GLN 163 CO 0.02 1.16 0.18 -0.07 -0.95 0.00 0.00 178.83 179.17 2pui h LEU 164 N 0.17 0.77 -0.27 1.46 3.38 -1.06 -1.36 115.31 118.41 2pui h LEU 164 Ca -0.07 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 57.84 2pui h LEU 164 Cb 1.36 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.85 2pui h LEU 164 CO 0.14 0.73 -0.12 0.58 0.09 0.00 0.00 178.44 179.86 2pui h VAL 165 N 0.82 0.63 0.14 1.22 2.07 -1.17 0.47 116.25 120.43 2pui h VAL 165 Ca 0.19 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.72 2pui h VAL 165 Cb 0.23 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 2pui h VAL 165 CO -0.01 0.00 -0.25 0.11 0.02 0.00 0.00 177.57 177.44 2pui h LYS 166 N -0.07 -0.45 -0.99 1.57 1.57 -1.29 -2.15 116.57 114.76 2pui h LYS 166 Ca 0.14 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 59.04 2pui h LYS 166 Cb 0.28 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.62 2pui h LYS 166 CO -0.32 -0.30 0.63 0.37 -0.57 0.00 0.00 179.45 179.26 2pui h GLN 167 N -0.46 1.04 -0.59 3.15 4.15 -0.96 -2.71 115.11 118.73 2pui h GLN 167 Ca 0.02 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2pui h GLN 167 Cb 0.48 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.93 2pui h GLN 167 CO -0.13 0.69 0.00 1.19 -1.93 0.00 0.00 178.83 178.65 2pui n PHE 168 N -4.57 0.79 -1.67 3.99 3.72 0.13 -4.94 117.46 114.91 2pui n PHE 168 Ca 0.17 -0.40 -0.42 0.00 -0.05 0.00 0.00 57.45 56.75 2pui n PHE 168 Cb 0.26 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.77 2pui n PHE 168 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2pui n THR 169 N 1.28 0.59 -3.23 4.37 -1.04 -0.82 -4.14 114.28 111.29 2pui n THR 169 Ca 0.20 -0.11 -0.24 0.00 -2.04 0.00 0.00 64.05 61.87 2pui n THR 169 Cb 0.51 -2.23 -0.06 0.00 -1.82 0.00 0.00 70.33 66.73 2pui n THR 169 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2pui n ASN 170 N 6.67 1.88 -0.34 8.00 2.85 -1.26 -5.00 115.26 128.07 2pui n ASN 170 Ca 0.19 -3.09 -0.01 0.00 -0.11 0.00 0.00 54.58 51.55 2pui n ASN 170 Cb 0.39 -0.64 0.11 0.00 1.24 0.00 0.00 39.78 40.89 2pui n ASN 170 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2pui h PRO 171 N 3.75 1.14 -0.08 1.20 0.11 -1.97 -0.16 132.00 135.99 2pui h PRO 171 Ca 0.12 -0.07 -0.20 0.00 0.11 0.00 0.00 66.00 65.96 2pui h PRO 171 Cb 0.78 -0.26 0.01 0.00 0.11 0.00 0.00 31.00 31.65 2pui h PRO 171 CO 0.62 0.75 -0.73 0.93 -0.21 0.00 0.00 178.00 179.37 2pui h GLU 172 N 1.17 0.63 0.08 1.05 5.08 -1.99 -1.42 114.58 119.19 2pui h GLU 172 Ca 0.36 -0.58 -0.25 0.00 -1.00 0.00 0.00 59.36 57.89 2pui h GLU 172 Cb -0.03 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2pui h GLU 172 CO -0.11 1.19 -1.12 -0.07 -1.00 0.00 0.00 179.01 177.90 2pui h LEU 173 N 0.28 0.40 -0.73 1.33 -0.00 -1.91 -2.65 115.31 112.02 2pui h LEU 173 Ca -0.07 -0.39 0.02 0.00 -0.00 0.00 0.00 57.88 57.44 2pui h LEU 173 Cb 1.38 -0.13 -0.04 0.00 -0.00 0.00 0.00 40.66 41.88 2pui h LEU 173 CO 0.15 1.26 0.47 0.00 -0.00 0.00 0.00 178.44 180.32 2pui h ASP 175 N 0.94 0.02 -0.35 0.00 -0.00 -1.08 0.22 116.42 116.17 2pui h ASP 175 Ca 0.28 0.07 0.08 0.00 -0.00 0.00 0.00 57.03 57.45 2pui h ASP 175 Cb -0.05 0.09 -0.08 0.00 -0.00 0.00 0.00 39.33 39.30 2pui h ASP 175 CO -0.08 0.05 -0.15 0.40 -0.00 0.00 0.00 179.24 179.45 2pui h ILE 176 N 0.21 0.52 -0.09 2.25 2.04 -1.41 -1.64 117.51 119.39 2pui h ILE 176 Ca 0.19 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.04 2pui h ILE 176 Cb 0.23 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2pui h ILE 176 CO -0.25 0.00 0.03 0.74 0.00 0.00 0.00 178.15 178.67 2pui h THR 177 N -0.09 1.17 -0.97 -0.27 2.02 -1.22 0.33 112.91 113.88 2pui h THR 177 Ca 0.18 -0.50 0.18 0.00 0.77 0.00 0.00 66.41 67.04 2pui h THR 177 Cb 0.36 1.34 -0.09 0.00 -1.74 0.00 0.00 68.15 68.01 2pui h THR 177 CO -0.41 0.14 0.61 -0.33 0.37 0.00 0.00 175.52 175.91 2pui h GLU 178 N -0.04 0.68 0.00 6.66 5.08 -0.40 -0.41 114.58 126.15 2pui h GLU 178 Ca 0.03 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2pui h GLU 178 Cb 0.20 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2pui h GLU 178 CO -0.00 0.45 -0.04 0.00 -1.00 0.00 0.00 179.01 178.42 2pui h ARG 179 N 0.70 0.00 -0.10 2.33 3.08 -1.12 -3.09 114.38 116.19 2pui h ARG 179 Ca 0.53 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.44 2pui h ARG 179 Cb 0.91 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.96 2pui h ARG 179 CO -0.30 0.46 -0.50 -0.07 -1.07 0.00 0.00 179.97 178.49 2pui h LEU 180 N -1.00 0.61 0.00 3.04 3.38 -0.13 0.54 115.31 121.76 2pui h LEU 180 Ca -0.01 -0.64 -0.26 0.00 0.09 0.00 0.00 57.88 57.06 2pui h LEU 180 Cb 0.47 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 2pui h LEU 180 CO -0.00 1.16 -1.40 -0.37 0.09 0.00 0.00 178.44 177.91 2pui h VAL 181 N 0.11 1.22 0.00 1.22 -1.51 -1.26 -3.41 116.25 112.62 2pui h VAL 181 Ca -0.03 -3.01 0.00 0.00 -1.23 0.00 0.00 66.70 62.43 2pui h VAL 181 Cb 1.14 2.61 0.00 0.00 -2.13 0.00 0.00 31.29 32.91 2pui h VAL 181 CO 0.10 0.71 -1.25 0.49 -1.23 0.00 0.00 177.57 176.39 2pui n PHE 182 N -3.19 0.00 0.07 5.19 3.72 -1.18 -4.73 117.46 117.34 2pui n PHE 182 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 2pui n PHE 182 Cb 1.00 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 39.35 2pui n PHE 182 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2pui n THR 183 N -1.72 0.62 -0.27 4.37 -1.04 -0.87 -4.81 114.28 110.55 2pui n THR 183 Ca -0.00 0.20 -0.05 0.00 -2.04 0.00 0.00 64.05 62.16 2pui n THR 183 Cb 0.33 -1.07 0.06 0.00 -1.82 0.00 0.00 70.33 67.83 2pui n THR 183 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2pui h ASP 184 N 0.00 0.86 -0.30 8.00 3.32 -1.15 -2.42 116.42 124.73 2pui h ASP 184 Ca 0.00 -0.03 0.09 0.00 0.02 0.00 0.00 57.03 57.11 2pui h ASP 184 Cb 0.00 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 2pui h ASP 184 CO 0.00 0.63 0.28 -0.65 -1.72 0.00 0.00 179.24 177.79 2pui h PRO 185 N 1.01 0.00 -0.04 3.56 0.11 -1.81 -2.66 132.00 132.17 2pui h PRO 185 Ca 0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 2pui h PRO 185 Cb -0.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.01 2pui h PRO 185 CO -0.06 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.92 2pui n PHE 186 N -3.97 0.03 -4.28 0.65 3.72 -0.91 -4.87 117.46 107.84 2pui n PHE 186 Ca 0.04 -0.01 -0.16 0.00 -0.05 0.00 0.00 57.45 57.27 2pui n PHE 186 Cb 0.44 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.88 2pui n PHE 186 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2pui s PHE 187 N -1.97 1.44 -1.38 1.38 0.40 -1.00 -4.47 117.98 112.38 2pui s PHE 187 Ca 0.37 -1.35 -0.13 0.00 -0.60 0.00 0.00 56.93 55.22 2pui s PHE 187 Cb 0.21 -0.75 0.09 0.00 0.51 0.00 0.00 43.02 43.08 2pui s PHE 187 CO 0.33 -0.55 2.05 -3.47 0.70 0.00 0.00 175.22 174.28 2pui n ASP 188 N -0.63 4.40 -4.89 1.36 4.64 -1.26 -4.94 116.55 115.23 2pui n ASP 188 Ca 0.02 -2.95 -0.29 0.00 -1.38 0.00 0.00 54.79 50.19 2pui n ASP 188 Cb 0.65 -1.60 -0.04 0.00 -1.04 0.00 0.00 41.12 39.09 2pui n ASP 188 CO 0.00 0.00 0.00 -1.00 -0.82 0.00 0.00 177.20 175.38 2pui s HIS 189 N 2.20 3.42 0.55 -0.67 3.76 -1.26 -5.02 115.29 118.28 2pui s HIS 189 Ca 0.45 0.16 0.27 0.00 -0.15 0.00 0.00 55.06 55.79 2pui s HIS 189 Cb 0.11 -1.69 1.69 0.00 1.11 0.00 0.00 32.58 33.80 2pui s HIS 189 CO -0.04 0.55 2.21 0.38 -0.85 0.00 0.00 174.74 176.99 2pui h ASP 190 N 2.80 0.00 1.43 1.40 -0.00 -1.93 -2.81 116.42 117.30 2pui h ASP 190 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.57 2pui h ASP 190 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.50 2pui h ASP 190 CO 0.71 0.02 0.00 0.71 -0.00 0.00 0.00 179.24 180.68 2pui h THR 191 N 0.00 0.00 -4.22 1.15 1.35 -1.95 -3.46 112.91 105.78 2pui h THR 191 Ca -0.00 -0.53 -0.51 0.00 -0.55 0.00 0.00 66.41 64.82 2pui h THR 191 Cb 0.06 1.49 0.11 0.00 -1.73 0.00 0.00 68.15 68.07 2pui h THR 191 CO 0.00 0.00 0.36 0.20 -0.25 0.00 0.00 175.52 175.84 2pui s ASN 192 N -4.85 5.00 -0.27 5.36 0.01 -1.06 -2.42 114.94 116.70 2pui s ASN 192 Ca 0.08 1.96 -0.00 0.00 -0.71 0.00 0.00 52.86 54.19 2pui s ASN 192 Cb 0.10 -2.54 0.15 0.00 0.41 0.00 0.00 41.25 39.37 2pui s ASN 192 CO 0.57 -1.70 0.40 -0.62 -1.51 0.00 0.00 177.10 174.24 2pui s ASP 193 N -2.76 0.27 0.02 -1.22 3.68 -0.24 -4.78 116.67 111.63 2pui s ASP 193 Ca 0.66 -0.05 -0.11 0.00 2.13 0.00 0.00 52.55 55.18 2pui s ASP 193 Cb -0.20 1.14 0.01 0.00 -1.45 0.00 0.00 42.92 42.43 2pui s ASP 193 CO 0.44 -0.32 0.23 0.72 0.13 0.00 0.00 175.17 176.37 2pui s PHE 194 N 2.55 -0.04 0.49 -5.34 -0.71 -1.26 -4.34 117.98 109.34 2pui s PHE 194 Ca 0.12 -0.06 -0.24 0.00 -1.04 0.00 0.00 56.93 55.71 2pui s PHE 194 Cb -0.14 0.02 -0.07 0.00 -1.21 0.00 0.00 43.02 41.62 2pui s PHE 194 CO -0.23 -0.40 1.41 -1.21 -1.34 0.00 0.00 175.22 173.45 2pui s GLU 195 N -1.96 3.48 0.46 1.99 8.01 -1.26 -4.91 118.70 124.50 2pui s GLU 195 Ca -0.10 2.36 0.12 0.00 0.01 0.00 0.00 54.97 57.37 2pui s GLU 195 Cb -0.04 -2.51 1.04 0.00 -4.31 0.00 0.00 34.13 28.31 2pui s GLU 195 CO -0.00 -0.97 2.06 1.49 0.01 0.00 0.00 175.26 177.85 2pui h GLU 196 N 1.99 0.17 0.00 1.61 4.57 -2.02 -1.53 114.58 119.37 2pui h GLU 196 Ca -0.51 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 57.65 2pui h GLU 196 Cb 1.28 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.84 2pui h GLU 196 CO 0.60 0.18 -0.01 0.93 -1.18 0.00 0.00 179.01 179.53 2pui h GLU 197 N 0.17 0.00 0.00 1.92 3.07 -2.03 -1.65 114.58 116.06 2pui h GLU 197 Ca 0.04 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 2pui h GLU 197 Cb 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.02 2pui h GLU 197 CO 0.00 0.01 -0.38 -0.07 -1.40 0.00 0.00 179.01 177.17 2pui h LEU 198 N 0.00 0.00 -0.88 1.33 3.38 -1.64 -3.40 115.31 114.09 2pui h LEU 198 Ca -0.00 -0.03 0.20 0.00 0.09 0.00 0.00 57.88 58.13 2pui h LEU 198 Cb 0.04 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.62 2pui h LEU 198 CO 0.00 0.02 -0.12 -0.09 0.09 0.00 0.00 178.44 178.34 2pui h ARG 199 N 0.00 0.02 -0.98 1.13 2.43 -1.33 -0.32 114.38 115.34 2pui h ARG 199 Ca 0.00 -0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.27 2pui h ARG 199 Cb 0.92 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.39 2pui h ARG 199 CO 0.00 0.01 0.61 -1.35 -1.51 0.00 0.00 179.97 177.74 2pui h PRO 200 N 0.02 0.99 -0.01 0.20 0.11 -1.80 0.82 132.00 132.34 2pui h PRO 200 Ca 0.46 -0.06 -0.21 0.00 0.11 0.00 0.00 66.00 66.30 2pui h PRO 200 Cb 0.79 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 2pui h PRO 200 CO -0.86 0.66 -0.88 0.74 -0.21 0.00 0.00 178.00 177.44 2pui h PHE 201 N 1.02 0.45 -0.39 0.65 -1.00 -1.41 -2.40 116.94 113.87 2pui h PHE 201 Ca 0.47 -0.24 -0.04 0.00 2.81 0.00 0.00 57.97 60.96 2pui h PHE 201 Cb 0.38 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.87 2pui h PHE 201 CO -0.01 1.05 0.08 0.28 -1.61 0.00 0.00 178.31 178.10 2pui h VAL 202 N 0.18 1.23 -0.01 -0.55 2.07 -0.86 -2.74 116.25 115.56 2pui h VAL 202 Ca -0.06 -0.81 -0.09 0.00 0.82 0.00 0.00 66.70 66.57 2pui h VAL 202 Cb 1.50 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 2pui h VAL 202 CO 0.14 0.28 -0.40 -0.33 0.02 0.00 0.00 177.57 177.28 2pui h GLU 203 N 0.48 0.02 -0.98 1.57 5.08 -0.84 -1.62 114.58 118.30 2pui h GLU 203 Ca 0.12 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2pui h GLU 203 Cb 0.33 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.53 2pui h GLU 203 CO 0.00 0.43 0.65 -0.22 -1.00 0.00 0.00 179.01 178.87 2pui h LYS 204 N 0.02 1.29 -0.07 2.33 3.64 -1.29 -1.81 116.57 120.68 2pui h LYS 204 Ca -0.00 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2pui h LYS 204 Cb 0.73 -0.29 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2pui h LYS 204 CO 0.05 0.85 -0.00 1.25 -2.27 0.00 0.00 179.45 179.33 2pui h LEU 205 N 1.33 0.13 -1.38 5.20 5.85 -1.07 -2.96 115.31 122.39 2pui h LEU 205 Ca 0.36 -0.32 0.12 0.00 0.84 0.00 0.00 57.88 58.88 2pui h LEU 205 Cb -0.14 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 40.80 2pui h LEU 205 CO -0.08 0.41 0.52 -0.50 -0.34 0.00 0.00 178.44 178.45 2pui h TRP 206 N -0.16 0.72 -0.01 1.25 6.55 -1.14 -1.81 115.95 121.36 2pui h TRP 206 Ca 0.02 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.88 2pui h TRP 206 Cb 0.35 -0.23 0.00 0.00 -0.86 0.00 0.00 29.16 28.41 2pui h TRP 206 CO 0.03 0.31 -0.08 0.09 -1.05 0.00 0.00 178.44 177.75 2pui n ASN 207 N -4.51 1.11 -4.47 -3.49 3.02 -0.70 -4.78 115.26 101.44 2pui n ASN 207 Ca 0.14 -1.19 -0.43 0.00 -0.03 0.00 0.00 54.58 53.08 2pui n ASN 207 Cb 0.40 0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.55 2pui n ASN 207 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2pui s ASN 208 N -2.18 6.23 0.15 6.41 3.84 -0.68 -4.92 114.94 123.79 2pui s ASN 208 Ca 0.34 -0.80 -0.10 0.00 0.21 0.00 0.00 52.86 52.51 2pui s ASN 208 Cb 0.21 -2.41 -0.01 0.00 -0.55 0.00 0.00 41.25 38.49 2pui s ASN 208 CO 0.40 -1.31 1.51 0.44 -2.79 0.00 0.00 177.10 175.34 2pui h ASP 209 N 9.42 1.00 0.35 -4.21 5.19 -1.86 -3.04 116.42 123.27 2pui h ASP 209 Ca -0.28 -0.43 -0.19 0.00 -0.62 0.00 0.00 57.03 55.51 2pui h ASP 209 Cb 1.07 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 40.30 2pui h ASP 209 CO 1.13 1.23 -0.77 0.77 -3.12 0.00 0.00 179.24 178.48 2pui h SER 210 N 0.79 0.41 0.01 6.45 4.64 -1.97 -0.20 113.55 123.68 2pui h SER 210 Ca 0.08 -0.29 -0.16 0.00 -0.47 0.00 0.00 61.79 60.96 2pui h SER 210 Cb 0.92 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.88 2pui h SER 210 CO 0.09 1.03 -0.52 1.62 -0.87 0.00 0.00 176.83 178.18 2pui h VAL 211 N 0.22 1.32 -0.12 0.95 3.04 -1.95 -2.91 116.25 116.80 2pui h VAL 211 Ca -0.04 -1.75 -0.15 0.00 -1.01 0.00 0.00 66.70 63.75 2pui h VAL 211 Cb 1.35 1.73 -0.01 0.00 -2.01 0.00 0.00 31.29 32.35 2pui h VAL 211 CO 0.13 0.55 -0.55 0.11 -1.01 0.00 0.00 177.57 176.79 2pui h LYS 212 N 0.44 0.37 -0.89 4.17 1.57 -1.35 0.06 116.57 120.93 2pui h LYS 212 Ca 0.01 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.57 2pui h LYS 212 Cb 1.06 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.35 2pui h LYS 212 CO 0.10 0.83 0.59 0.82 -0.57 0.00 0.00 179.45 181.22 2pui h ILE 213 N 0.29 1.22 -0.37 1.86 2.04 -1.06 -0.90 117.51 120.59 2pui h ILE 213 Ca 0.00 -0.41 -0.15 0.00 1.00 0.00 0.00 64.86 65.30 2pui h ILE 213 Cb 1.06 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 2pui h ILE 213 CO 0.09 0.22 -0.35 -0.33 0.00 0.00 0.00 178.15 177.78 2pui h GLU 214 N 1.20 0.90 -0.18 2.37 4.39 -1.21 -2.21 114.58 119.84 2pui h GLU 214 Ca 0.33 -0.47 -0.03 0.00 0.34 0.00 0.00 59.36 59.53 2pui h GLU 214 Cb -0.13 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 2pui h GLU 214 CO -0.08 1.12 -0.02 0.00 -1.16 0.00 0.00 179.01 178.87 2pui h ALA 215 N 0.76 1.63 -0.44 3.43 0.00 -0.79 -2.11 119.26 121.74 2pui h ALA 215 Ca 0.06 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2pui h ALA 215 Cb 0.94 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2pui h ALA 215 CO 0.09 0.28 -0.00 0.00 0.00 0.00 0.00 179.25 179.62 2pui h ALA 216 N 1.72 0.59 -0.42 0.00 0.00 -0.76 -1.91 119.26 118.49 2pui h ALA 216 Ca 0.06 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2pui h ALA 216 Cb 0.22 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2pui h ALA 216 CO 0.01 0.38 0.11 0.87 0.00 0.00 0.00 179.25 180.62 2pui h LYS 217 N 0.62 0.67 -0.66 0.00 1.57 -0.81 0.23 116.57 118.19 2pui h LYS 217 Ca 0.12 -0.15 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 2pui h LYS 217 Cb 0.49 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 2pui h LYS 217 CO 0.02 0.67 0.09 -0.07 -0.57 0.00 0.00 179.45 179.60 2pui h LEU 218 N 0.54 1.06 -0.03 2.94 3.38 -1.43 0.83 115.31 122.59 2pui h LEU 218 Ca 0.13 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 2pui h LEU 218 Cb 0.30 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2pui h LEU 218 CO -0.00 1.06 0.01 0.50 0.09 0.00 0.00 178.44 180.10 2pui h LYS 219 N 1.03 0.05 -0.90 1.13 3.64 -1.09 -0.18 116.57 120.25 2pui h LYS 219 Ca 0.20 -0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.70 2pui h LYS 219 Cb 0.46 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.18 2pui h LYS 219 CO 0.02 0.21 0.52 -0.22 -2.27 0.00 0.00 179.45 177.71 2pui h LYS 220 N -0.12 0.78 -0.32 1.90 3.11 -0.34 0.64 116.57 122.22 2pui h LYS 220 Ca 0.01 -0.05 -0.02 0.00 -2.81 0.00 0.00 60.65 57.79 2pui h LYS 220 Cb 0.18 -0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 31.22 2pui h LYS 220 CO -0.00 0.52 0.13 1.03 -2.81 0.00 0.00 179.45 178.32 2pui h SER 221 N 0.80 0.45 -0.99 4.20 0.87 -0.51 -1.58 113.55 116.78 2pui h SER 221 Ca 0.46 -0.16 0.14 0.00 -1.23 0.00 0.00 61.79 61.00 2pui h SER 221 Cb 0.53 -0.12 -0.09 0.00 -0.44 0.00 0.00 62.40 62.29 2pui h SER 221 CO -0.30 0.48 0.61 0.15 -0.53 0.00 0.00 176.83 177.25 2pui h PHE 222 N 0.38 1.10 0.00 2.24 3.57 0.16 0.17 116.94 124.57 2pui h PHE 222 Ca 0.11 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.53 2pui h PHE 222 Cb 0.18 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 2pui h PHE 222 CO -0.01 0.37 -0.52 -0.07 -2.23 0.00 0.00 178.31 175.86 2pui h LEU 223 N 0.91 0.00 0.00 0.59 3.38 -0.65 -3.40 115.31 116.14 2pui h LEU 223 Ca 0.52 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.49 2pui h LEU 223 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2pui h LEU 223 CO -0.31 0.52 -0.91 0.35 0.09 0.00 0.00 178.44 178.19 2pui n THR 224 N -3.45 0.00 -2.81 0.22 -2.24 -0.62 -4.97 114.28 100.42 2pui n THR 224 Ca 0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 2pui n THR 224 Cb 0.64 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.64 2pui n THR 224 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2pui s SER 225 N -2.30 6.61 -1.39 3.42 0.01 0.55 -4.90 113.70 115.70 2pui s SER 225 Ca 0.00 -1.90 -0.09 0.00 1.31 0.00 0.00 55.95 55.26 2pui s SER 225 Cb 0.00 -2.46 0.08 0.00 0.21 0.00 0.00 66.02 63.86 2pui s SER 225 CO 0.00 -1.19 2.28 0.00 0.41 0.00 0.00 173.24 174.74 2pui n ALA 226 N 7.28 6.18 0.05 1.44 0.00 -1.26 -1.93 120.51 132.27 2pui n ALA 226 Ca 0.28 -4.02 -0.21 0.00 0.00 0.00 0.00 53.44 49.48 2pui n ALA 226 Cb 0.49 -3.12 -0.15 0.00 0.00 0.00 0.00 19.45 16.68 2pui n ALA 226 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2pui h GLU 227 N 5.37 0.31 -3.24 0.00 5.08 -1.75 -3.45 114.58 116.90 2pui h GLU 227 Ca 0.60 -0.54 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2pui h GLU 227 Cb 0.48 0.20 -0.07 0.00 0.50 0.00 0.00 28.75 29.87 2pui h GLU 227 CO 1.68 1.26 0.10 -0.08 -1.00 0.00 0.00 179.01 180.96 2pui s THR 228 N -2.47 0.00 -0.39 1.13 -1.32 -0.92 -4.05 115.64 107.62 2pui s THR 228 Ca -0.15 -1.12 -0.29 0.00 -1.21 0.00 0.00 61.69 58.92 2pui s THR 228 Cb 0.03 -2.03 0.02 0.00 -1.51 0.00 0.00 72.50 69.00 2pui s THR 228 CO 0.82 -0.01 1.21 -0.22 -2.21 0.00 0.00 174.62 174.21 2pui s LEU 229 N -2.95 3.75 0.31 9.08 2.96 -1.26 -1.07 118.68 129.51 2pui s LEU 229 Ca 0.15 0.84 0.05 0.00 -0.22 0.00 0.00 54.13 54.95 2pui s LEU 229 Cb -0.04 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.09 2pui s LEU 229 CO 0.07 -1.15 0.44 0.27 -1.32 0.00 0.00 176.35 174.66 2pui s ILE 230 N 4.40 4.54 0.02 6.68 -4.36 0.10 -4.72 121.20 127.87 2pui s ILE 230 Ca 0.51 -0.95 -0.21 0.00 -0.26 0.00 0.00 60.65 59.75 2pui s ILE 230 Cb -0.12 -3.60 -0.18 0.00 1.25 0.00 0.00 42.46 39.82 2pui s ILE 230 CO 0.26 -0.24 1.22 -0.74 0.24 0.00 0.00 174.94 175.67 2pui h HIS 231 N 0.96 0.47 0.00 1.37 -0.00 -1.90 -3.14 115.15 112.91 2pui h HIS 231 Ca -0.48 -0.19 0.00 0.00 -0.00 0.00 0.00 60.37 59.70 2pui h HIS 231 Cb 1.25 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 28.58 2pui h HIS 231 CO 0.44 0.91 0.00 0.41 -0.00 0.00 0.00 177.93 179.69 2pui n GLY 232 N 0.60 1.28 2.69 5.26 0.00 -1.26 -2.07 105.19 111.69 2pui n GLY 232 Ca -0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.89 2pui n GLY 232 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2pui n ASP 233 N 0.00 -1.27 -3.74 1.61 2.03 -1.26 -4.84 116.55 109.08 2pui n ASP 233 Ca 0.00 -2.36 -0.42 0.00 0.52 0.00 0.00 54.79 52.53 2pui n ASP 233 Cb 0.00 0.68 0.00 0.00 -0.72 0.00 0.00 41.12 41.08 2pui n ASP 233 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2pui n LEU 234 N -0.91 7.11 -4.99 -2.67 7.94 -1.26 -4.71 117.00 117.51 2pui n LEU 234 Ca -0.07 -4.77 -0.20 0.00 -1.11 0.00 0.00 56.01 49.86 2pui n LEU 234 Cb 0.86 -1.42 0.04 0.00 0.53 0.00 0.00 43.42 43.42 2pui n LEU 234 CO -0.07 1.63 0.34 -1.38 -1.11 0.00 0.00 177.39 176.80 2pui s HIS 235 N -0.34 2.53 0.26 1.96 -3.43 -1.26 -2.95 115.29 112.06 2pui s HIS 235 Ca 0.44 -0.20 0.36 0.00 -0.80 0.00 0.00 55.06 54.86 2pui s HIS 235 Cb 0.12 -2.66 1.79 0.00 -1.43 0.00 0.00 32.58 30.40 2pui s HIS 235 CO -0.02 -0.93 2.09 1.79 -2.00 0.00 0.00 174.74 175.68 2pui h THR 236 N 0.11 0.00 -0.00 -5.38 1.35 -1.90 -0.48 112.91 106.61 2pui h THR 236 Ca -0.40 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 2pui h THR 236 Cb 1.29 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 2pui h THR 236 CO 0.48 0.00 -0.06 0.61 -0.25 0.00 0.00 175.52 176.29 2pui n GLY 237 N -0.63 -1.13 1.91 5.82 0.00 -1.26 -1.37 105.19 108.53 2pui n GLY 237 Ca -0.01 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 45.84 2pui n GLY 237 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2pui n SER 238 N -1.15 5.49 -3.94 1.61 7.64 -0.19 -4.90 113.62 118.18 2pui n SER 238 Ca 0.14 -3.02 -0.19 0.00 1.01 0.00 0.00 58.87 56.81 2pui n SER 238 Cb 0.26 -0.70 -0.16 0.00 -1.01 0.00 0.00 64.21 62.60 2pui n SER 238 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2pui s ILE 239 N -2.84 0.60 -0.14 0.44 1.01 -1.23 -0.56 121.20 118.48 2pui s ILE 239 Ca 0.55 -0.22 -0.08 0.00 0.00 0.00 0.00 60.65 60.89 2pui s ILE 239 Cb 0.42 -0.57 -0.04 0.00 0.01 0.00 0.00 42.46 42.28 2pui s ILE 239 CO 0.15 0.21 0.15 -0.36 0.00 0.00 0.00 174.94 175.09 2pui s PHE 240 N 0.46 3.56 -0.00 3.97 0.08 0.61 -0.50 117.98 126.16 2pui s PHE 240 Ca -0.06 0.50 -0.04 0.00 0.12 0.00 0.00 56.93 57.45 2pui s PHE 240 Cb -0.10 -2.01 -0.00 0.00 -0.57 0.00 0.00 43.02 40.34 2pui s PHE 240 CO 0.00 0.62 0.07 0.00 -0.10 0.00 0.00 175.22 175.81 2pui s ALA 241 N -0.68 -0.14 0.05 5.36 0.00 0.17 -0.95 121.76 125.56 2pui s ALA 241 Ca 0.14 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.93 2pui s ALA 241 Cb -0.12 0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.04 2pui s ALA 241 CO 0.03 -0.14 0.05 -1.13 0.00 0.00 0.00 175.76 174.57 2pui n SER 242 N 1.99 -0.14 -0.30 0.00 3.41 -0.59 -1.26 113.62 116.73 2pui n SER 242 Ca -0.20 -1.31 0.09 0.00 -0.26 0.00 0.00 58.87 57.18 2pui n SER 242 Cb 0.57 0.30 0.25 0.00 -0.26 0.00 0.00 64.21 65.07 2pui n SER 242 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2pui h GLU 243 N 0.00 0.55 0.00 4.33 9.09 -2.00 -3.21 114.58 123.34 2pui h GLU 243 Ca -0.04 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.34 2pui h GLU 243 Cb 0.18 -0.12 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 2pui h GLU 243 CO 0.05 0.36 -0.57 0.72 0.05 0.00 0.00 179.01 179.63 2pui n HIS 244 N -4.92 0.00 -4.41 2.06 8.25 -1.26 -4.38 115.22 110.57 2pui n HIS 244 Ca 0.18 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.43 2pui n HIS 244 Cb 0.50 -0.04 -0.13 0.00 1.12 0.00 0.00 29.99 31.44 2pui n HIS 244 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2pui s GLU 245 N -1.92 1.02 -0.01 -0.41 2.02 -1.21 -5.05 118.70 113.13 2pui s GLU 245 Ca 0.02 -0.79 0.01 0.00 0.02 0.00 0.00 54.97 54.23 2pui s GLU 245 Cb 0.06 -1.05 0.00 0.00 0.10 0.00 0.00 34.13 33.24 2pui s GLU 245 CO 0.34 0.26 -0.02 0.99 0.02 0.00 0.00 175.26 176.85 2pui s THR 246 N -0.84 0.22 -0.03 3.63 2.01 -1.26 -1.54 115.64 117.84 2pui s THR 246 Ca 0.03 -0.09 -0.01 0.00 0.31 0.00 0.00 61.69 61.93 2pui s THR 246 Cb -0.08 -0.21 0.03 0.00 0.01 0.00 0.00 72.50 72.25 2pui s THR 246 CO 0.01 0.08 0.05 -0.54 -0.69 0.00 0.00 174.62 173.53 2pui s LYS 247 N 0.10 -0.02 -0.10 4.92 -0.14 -0.13 -4.42 119.74 119.95 2pui s LYS 247 Ca -0.01 0.23 -0.11 0.00 -1.36 0.00 0.00 55.97 54.72 2pui s LYS 247 Cb -0.03 -0.25 -0.05 0.00 -1.68 0.00 0.00 37.83 35.82 2pui s LYS 247 CO -0.00 -0.18 0.25 0.08 -0.76 0.00 0.00 175.35 174.74 2pui s VAL 248 N 1.16 5.32 0.30 3.17 1.01 0.44 -0.28 120.40 131.52 2pui s VAL 248 Ca -0.08 0.46 0.02 0.00 0.00 0.00 0.00 61.98 62.38 2pui s VAL 248 Cb -0.13 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.66 2pui s VAL 248 CO -0.03 0.54 0.11 0.27 0.00 0.00 0.00 175.10 175.98 2pui s ILE 249 N -0.56 0.61 -1.18 2.22 -4.36 0.27 -4.28 121.20 113.91 2pui s ILE 249 Ca 0.17 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.56 2pui s ILE 249 Cb -0.13 -2.60 -0.00 0.00 1.25 0.00 0.00 42.46 40.98 2pui s ILE 249 CO 0.06 0.00 0.99 -0.67 0.24 0.00 0.00 174.94 175.56 2pui n ASP 250 N -0.72 -2.05 -1.64 4.36 2.03 -1.26 -4.75 116.55 112.51 2pui n ASP 250 Ca -0.01 -0.61 -0.05 0.00 0.52 0.00 0.00 54.79 54.64 2pui n ASP 250 Cb 0.66 -5.07 -0.01 0.00 -0.72 0.00 0.00 41.12 35.98 2pui n ASP 250 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2pui n PRO 251 N -4.08 1.27 -0.21 -0.67 -0.04 -1.26 -4.48 135.00 125.52 2pui n PRO 251 Ca -0.29 -0.42 0.15 0.00 -0.04 0.00 0.00 63.50 62.90 2pui n PRO 251 Cb 0.67 -1.24 0.46 0.00 -0.04 0.00 0.00 33.50 33.35 2pui n PRO 251 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2pui h GLU 252 N 1.34 0.50 -0.17 0.54 5.08 -1.87 -2.58 114.58 117.41 2pui h GLU 252 Ca 0.08 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2pui h GLU 252 Cb 1.03 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2pui h GLU 252 CO 0.17 0.33 0.00 1.19 -1.00 0.00 0.00 179.01 179.70 2pui n PHE 253 N -4.51 0.22 -1.77 4.33 3.01 -1.24 -4.59 117.46 112.91 2pui n PHE 253 Ca 0.16 -0.11 -0.41 0.00 1.01 0.00 0.00 57.45 58.10 2pui n PHE 253 Cb 0.53 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 40.00 2pui n PHE 253 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2pui n ALA 254 N 0.13 2.44 -3.78 4.37 0.00 -0.88 -4.43 120.51 118.37 2pui n ALA 254 Ca 0.14 0.35 -0.02 0.00 0.00 0.00 0.00 53.44 53.91 2pui n ALA 254 Cb 0.25 -2.43 -0.00 0.00 0.00 0.00 0.00 19.45 17.27 2pui n ALA 254 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2pui s PHE 255 N -0.80 -0.04 -0.55 0.00 -0.12 -1.19 -4.62 117.98 110.66 2pui s PHE 255 Ca 0.56 -0.24 -0.28 0.00 -0.05 0.00 0.00 56.93 56.92 2pui s PHE 255 Cb -0.48 0.63 0.03 0.00 -0.63 0.00 0.00 43.02 42.57 2pui s PHE 255 CO 0.60 -0.69 1.17 0.71 -0.05 0.00 0.00 175.22 176.95 2pui s TYR 256 N -2.67 2.66 0.00 3.49 2.02 -1.26 -0.72 117.35 120.87 2pui s TYR 256 Ca 0.17 0.47 0.00 0.00 -0.37 0.00 0.00 57.07 57.34 2pui s TYR 256 Cb -0.00 -4.48 0.00 0.00 -0.40 0.00 0.00 41.96 37.08 2pui s TYR 256 CO 0.02 -1.50 0.00 0.41 -1.57 0.00 0.00 175.55 172.90 2pui n GLY 257 N 5.02 4.07 3.75 0.71 0.00 -0.23 -4.36 105.19 114.14 2pui n GLY 257 Ca 0.09 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 2pui n GLY 257 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2pui s PRO 258 N -1.21 4.43 0.41 1.61 0.05 -0.81 -2.16 135.00 137.31 2pui s PRO 258 Ca 0.00 2.03 0.13 0.00 0.05 0.00 0.00 61.00 63.21 2pui s PRO 258 Cb 0.00 -3.17 0.97 0.00 0.05 0.00 0.00 34.50 32.35 2pui s PRO 258 CO 0.00 -0.16 1.93 0.82 0.05 0.00 0.00 177.00 179.64 2pui h ILE 259 N 3.51 0.85 0.00 0.56 2.04 -1.90 -2.19 117.51 120.38 2pui h ILE 259 Ca -0.46 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.23 2pui h ILE 259 Cb 1.22 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2pui h ILE 259 CO 0.73 0.09 0.00 1.23 0.00 0.00 0.00 178.15 180.20 2pui h GLY 260 N 0.50 0.00 0.72 5.37 0.00 -1.91 -3.37 103.07 104.38 2pui h GLY 260 Ca 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.67 2pui h GLY 260 CO -0.12 0.00 -0.15 -2.75 0.00 0.00 0.00 176.54 173.52 2pui h PHE 261 N 0.00 -0.39 -0.13 5.60 3.04 -1.72 -1.11 116.94 122.22 2pui h PHE 261 Ca 0.00 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 61.92 2pui h PHE 261 Cb 0.32 0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 2pui h PHE 261 CO 0.00 -0.08 -0.02 -0.44 -2.02 0.00 0.00 178.31 175.75 2pui h ASP 262 N -0.71 0.17 -0.02 0.41 3.32 -1.79 -1.74 116.42 116.07 2pui h ASP 262 Ca -0.04 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 2pui h ASP 262 Cb 0.49 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 2pui h ASP 262 CO 0.07 0.22 -0.00 0.58 -1.72 0.00 0.00 179.24 178.39 2pui h VAL 263 N 0.19 1.26 0.04 -1.35 2.07 -1.72 -2.45 116.25 114.28 2pui h VAL 263 Ca 0.05 -0.78 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 2pui h VAL 263 Cb 0.16 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2pui h VAL 263 CO 0.00 0.20 -0.02 1.23 0.02 0.00 0.00 177.57 179.01 2pui h GLY 264 N -0.29 -0.06 0.92 2.17 0.00 -0.95 -1.29 103.07 103.58 2pui h GLY 264 Ca 0.00 0.02 0.03 0.00 0.00 0.00 0.00 47.33 47.38 2pui h GLY 264 CO 0.00 -0.02 0.65 -1.61 0.00 0.00 0.00 176.54 175.56 2pui h GLN 265 N -0.11 1.25 -0.04 4.80 4.15 -1.40 -0.11 115.11 123.65 2pui h GLN 265 Ca -0.01 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 2pui h GLN 265 Cb 0.10 -0.28 -0.00 0.00 0.21 0.00 0.00 27.48 27.51 2pui h GLN 265 CO 0.01 0.83 -0.02 0.35 -1.93 0.00 0.00 178.83 178.07 2pui h PHE 266 N 1.29 0.09 -0.93 3.99 3.04 -1.32 -2.70 116.94 120.40 2pui h PHE 266 Ca 0.38 -0.02 0.09 0.00 3.98 0.00 0.00 57.97 62.41 2pui h PHE 266 Cb -0.06 -0.02 -0.07 0.00 2.56 0.00 0.00 35.95 38.36 2pui h PHE 266 CO -0.00 0.48 0.57 0.82 -2.02 0.00 0.00 178.31 178.16 2pui h ILE 267 N -0.32 0.96 -0.76 1.41 2.04 -1.05 -2.17 117.51 117.62 2pui h ILE 267 Ca 0.01 -0.33 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 2pui h ILE 267 Cb 0.45 -0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 2pui h ILE 267 CO 0.01 0.18 0.28 0.00 0.00 0.00 0.00 178.15 178.61 2pui h ALA 268 N 1.48 1.05 0.00 1.87 0.00 -0.99 -1.17 119.26 121.50 2pui h ALA 268 Ca 0.44 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2pui h ALA 268 Cb 0.35 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2pui h ALA 268 CO -0.23 0.66 -0.14 -0.91 0.00 0.00 0.00 179.25 178.63 2pui h ASN 269 N 1.12 0.00 -0.22 0.00 2.35 -1.07 0.34 115.58 118.10 2pui h ASN 269 Ca 0.25 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.89 2pui h ASN 269 Cb 0.25 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.62 2pui h ASN 269 CO -0.02 0.14 -0.29 -0.07 -1.65 0.00 0.00 177.43 175.55 2pui h LEU 270 N 0.00 0.63 -0.76 1.61 3.38 -0.81 -2.58 115.31 116.78 2pui h LEU 270 Ca -0.00 -0.50 -0.08 0.00 0.09 0.00 0.00 57.88 57.39 2pui h LEU 270 Cb 0.57 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 2pui h LEU 270 CO 0.02 1.01 0.09 -0.26 0.09 0.00 0.00 178.44 179.39 2pui h PHE 271 N 0.27 1.10 -0.69 1.13 0.04 -0.75 -1.31 116.94 116.74 2pui h PHE 271 Ca 0.03 -0.15 0.01 0.00 2.80 0.00 0.00 57.97 60.66 2pui h PHE 271 Cb 0.86 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.67 2pui h PHE 271 CO 0.08 0.93 0.46 -0.07 -0.60 0.00 0.00 178.31 179.11 2pui h LEU 272 N 0.97 0.79 -0.17 1.54 3.38 -0.35 -1.79 115.31 119.68 2pui h LEU 272 Ca 0.19 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.98 2pui h LEU 272 Cb 0.44 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2pui h LEU 272 CO 0.01 0.57 -0.53 -1.13 0.09 0.00 0.00 178.44 177.46 2pui h ASN 273 N 0.93 0.76 -0.78 -0.43 -0.73 -1.20 -3.08 115.58 111.04 2pui h ASN 273 Ca 0.25 -0.59 0.18 0.00 1.87 0.00 0.00 56.30 58.01 2pui h ASN 273 Cb -0.10 -0.22 -0.12 0.00 0.27 0.00 0.00 38.32 38.15 2pui h ASN 273 CO -0.06 1.22 0.19 0.00 -0.37 0.00 0.00 177.43 178.42 2pui h ALA 274 N 0.56 1.05 0.00 1.57 0.00 -0.75 -0.26 119.26 121.43 2pui h ALA 274 Ca -0.02 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2pui h ALA 274 Cb 1.15 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 2pui h ALA 274 CO 0.11 -0.37 -0.11 -0.07 0.00 0.00 0.00 179.25 178.82 2pui h LEU 275 N 0.26 0.00 0.00 0.00 3.38 -1.30 -1.23 115.31 116.41 2pui h LEU 275 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 2pui h LEU 275 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2pui h LEU 275 CO -0.56 0.11 -0.05 -1.54 0.09 0.00 0.00 178.44 176.49 2pui n SER 276 N -3.67 0.13 -4.92 -0.43 3.41 -0.13 -4.86 113.62 103.14 2pui n SER 276 Ca -0.02 0.45 -0.19 0.00 -0.26 0.00 0.00 58.87 58.84 2pui n SER 276 Cb 0.22 -0.46 -0.02 0.00 -0.26 0.00 0.00 64.21 63.69 2pui n SER 276 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2pui s ARG 277 N -3.01 2.64 0.09 4.33 0.52 -0.46 -4.99 118.95 118.07 2pui s ARG 277 Ca 0.13 -1.43 0.09 0.00 -0.52 0.00 0.00 55.73 54.00 2pui s ARG 277 Cb 0.18 -2.51 -0.03 0.00 0.52 0.00 0.00 34.95 33.11 2pui s ARG 277 CO 0.55 -0.22 -0.24 -0.51 0.02 0.00 0.00 175.30 174.90 2pui s ASP 278 N -4.21 2.90 1.20 0.23 -0.00 -1.26 -4.90 116.67 110.63 2pui s ASP 278 Ca 0.51 -0.67 0.00 0.00 -0.00 0.00 0.00 52.55 52.39 2pui s ASP 278 Cb -0.06 -0.20 0.00 0.00 -0.00 0.00 0.00 42.92 42.66 2pui s ASP 278 CO 0.30 0.15 0.00 0.61 -0.00 0.00 0.00 175.17 176.23 2pui n GLY 279 N 1.27 3.14 0.21 0.21 0.00 -1.26 -1.82 105.19 106.93 2pui n GLY 279 Ca -0.18 -0.09 0.15 0.00 0.00 0.00 0.00 46.02 45.90 2pui n GLY 279 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pui h ALA 280 N -0.63 1.00 0.00 4.61 0.00 -2.03 -2.47 119.26 119.74 2pui h ALA 280 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2pui h ALA 280 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2pui h ALA 280 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.00 2pui n ASP 281 N -2.63 0.26 0.14 0.00 10.43 -0.76 -2.47 116.55 121.52 2pui n ASP 281 Ca 0.01 0.56 0.01 0.00 2.57 0.00 0.00 54.79 57.93 2pui n ASP 281 Cb 0.22 -0.61 0.16 0.00 1.84 0.00 0.00 41.12 42.73 2pui n ASP 281 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 2pui h ARG 282 N 0.00 0.00 -0.80 -1.24 3.08 -1.55 -3.38 114.38 110.49 2pui h ARG 282 Ca 0.00 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.14 2pui h ARG 282 Cb 0.33 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.31 2pui h ARG 282 CO 0.00 0.58 0.45 0.93 -1.07 0.00 0.00 179.97 180.86 2pui h GLU 283 N 0.00 0.73 -0.77 0.04 4.39 -1.69 -0.38 114.58 116.89 2pui h GLU 283 Ca -0.01 -0.04 0.14 0.00 0.34 0.00 0.00 59.36 59.79 2pui h GLU 283 Cb 1.19 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 29.62 2pui h GLU 283 CO 0.08 0.48 0.51 -1.35 -1.16 0.00 0.00 179.01 177.57 2pui h PRO 284 N 0.75 0.47 -0.15 2.33 0.11 -1.81 0.18 132.00 133.88 2pui h PRO 284 Ca 0.39 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 66.29 2pui h PRO 284 Cb 0.36 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.38 2pui h PRO 284 CO -0.25 0.31 -0.61 -0.07 -0.21 0.00 0.00 178.00 177.17 2pui h LEU 285 N 0.48 0.79 -0.69 2.35 -0.00 -1.34 -1.21 115.31 115.69 2pui h LEU 285 Ca 0.38 -0.62 -0.03 0.00 -0.00 0.00 0.00 57.88 57.61 2pui h LEU 285 Cb 0.79 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 41.18 2pui h LEU 285 CO -0.13 1.28 0.31 1.88 -0.00 0.00 0.00 178.44 181.78 2pui h TYR 286 N 0.35 1.01 -0.72 1.13 0.99 -1.17 -1.33 116.97 117.23 2pui h TYR 286 Ca -0.04 -0.06 0.04 0.00 2.00 0.00 0.00 58.73 60.68 2pui h TYR 286 Cb 1.25 -0.31 -0.05 0.00 1.00 0.00 0.00 36.73 38.62 2pui h TYR 286 CO 0.10 0.76 0.44 0.93 -0.00 0.00 0.00 178.16 180.39 2pui h GLU 287 N 0.96 0.82 -0.61 4.88 4.39 -0.94 -2.31 114.58 121.77 2pui h GLU 287 Ca 0.23 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 2pui h GLU 287 Cb 0.15 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 2pui h GLU 287 CO -0.03 0.54 0.37 0.45 -1.16 0.00 0.00 179.01 179.18 2pui h HIS 288 N 0.84 0.79 -0.17 4.33 3.86 -0.58 -0.03 115.15 124.19 2pui h HIS 288 Ca 0.30 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.47 2pui h HIS 288 Cb 0.08 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 28.28 2pui h HIS 288 CO -0.05 0.52 -0.06 0.28 0.86 0.00 0.00 177.93 179.48 2pui h VAL 289 N 0.84 1.30 -0.18 2.45 2.07 -0.99 -0.91 116.25 120.83 2pui h VAL 289 Ca 0.22 -1.08 -0.00 0.00 0.82 0.00 0.00 66.70 66.66 2pui h VAL 289 Cb -0.04 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2pui h VAL 289 CO -0.04 0.32 0.10 -1.13 0.02 0.00 0.00 177.57 176.84 2pui h ASN 290 N 0.02 0.22 -0.62 0.57 -1.24 -1.19 -2.78 115.58 110.56 2pui h ASN 290 Ca 0.04 -0.06 -0.06 0.00 0.71 0.00 0.00 56.30 56.93 2pui h ASN 290 Cb 0.52 -0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.49 2pui h ASN 290 CO 0.02 0.22 0.17 -0.61 -1.29 0.00 0.00 177.43 175.94 2pui h GLN 291 N 0.20 0.98 -0.27 6.67 5.75 -1.01 -1.89 115.11 125.54 2pui h GLN 291 Ca 0.06 -0.23 -0.13 0.00 -0.15 0.00 0.00 58.65 58.21 2pui h GLN 291 Cb 0.04 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 2pui h GLN 291 CO -0.01 0.88 -0.37 -0.24 -2.65 0.00 0.00 178.83 176.44 2pui h VAL 292 N 0.90 1.29 -0.23 2.39 3.04 -1.12 0.98 116.25 123.51 2pui h VAL 292 Ca 0.20 -1.52 -0.03 0.00 -1.01 0.00 0.00 66.70 64.33 2pui h VAL 292 Cb 0.33 1.49 -0.01 0.00 -2.01 0.00 0.00 31.29 31.09 2pui h VAL 292 CO -0.00 0.49 0.01 -0.25 -1.01 0.00 0.00 177.57 176.81 2pui h TRP 293 N 0.51 0.42 0.06 3.17 2.91 -1.42 -0.12 115.95 121.48 2pui h TRP 293 Ca 0.05 -0.07 0.01 0.00 1.13 0.00 0.00 58.89 60.01 2pui h TRP 293 Cb 0.88 -0.11 -0.02 0.00 -0.51 0.00 0.00 29.16 29.40 2pui h TRP 293 CO 0.04 0.56 -0.11 1.49 -1.03 0.00 0.00 178.44 179.38 2pui h GLU 294 N 0.17 -0.21 -0.52 2.65 4.81 -1.11 0.45 114.58 120.82 2pui h GLU 294 Ca 0.07 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2pui h GLU 294 Cb 0.38 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 2pui h GLU 294 CO 0.01 -0.14 0.29 1.15 -0.73 0.00 0.00 179.01 179.59 2pui h THR 295 N -0.22 1.17 0.57 0.32 2.02 -0.87 -0.24 112.91 115.66 2pui h THR 295 Ca 0.02 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.75 2pui h THR 295 Cb 0.24 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 2pui h THR 295 CO -0.07 0.18 -0.45 0.15 0.37 0.00 0.00 175.52 175.70 2pui h PHE 296 N 0.69 -1.23 -0.78 3.16 3.57 -0.57 0.29 116.94 122.06 2pui h PHE 296 Ca 0.18 0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.80 2pui h PHE 296 Cb 0.04 0.46 -0.08 0.00 2.79 0.00 0.00 35.95 39.16 2pui h PHE 296 CO -0.02 -0.64 0.39 1.49 -2.23 0.00 0.00 178.31 177.30 2pui h GLU 297 N -1.00 0.60 -0.51 1.11 4.81 -0.02 0.48 114.58 120.06 2pui h GLU 297 Ca -0.07 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.03 2pui h GLU 297 Cb 0.84 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 2pui h GLU 297 CO -0.00 0.40 -0.06 0.93 -0.73 0.00 0.00 179.01 179.54 2pui h GLU 298 N 0.62 0.94 -0.21 1.92 5.08 -0.79 -1.06 114.58 121.08 2pui h GLU 298 Ca 0.40 -0.33 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 2pui h GLU 298 Cb 0.49 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2pui h GLU 298 CO -0.31 0.99 -0.09 1.15 -1.00 0.00 0.00 179.01 179.75 2pui h THR 299 N 0.80 1.30 -0.66 1.13 2.02 -0.48 -0.62 112.91 116.40 2pui h THR 299 Ca 0.14 -1.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.15 2pui h THR 299 Cb 0.61 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 68.59 2pui h THR 299 CO 0.04 0.35 0.34 0.15 0.37 0.00 0.00 175.52 176.77 2pui h PHE 300 N 0.15 0.93 -0.15 3.16 3.04 -0.92 -1.82 116.94 121.33 2pui h PHE 300 Ca 0.05 -0.03 -0.00 0.00 3.98 0.00 0.00 57.97 61.96 2pui h PHE 300 Cb 0.58 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 38.79 2pui h PHE 300 CO 0.06 0.68 0.08 0.77 -2.02 0.00 0.00 178.31 177.89 2pui h SER 301 N 0.91 0.18 -0.62 0.41 0.02 -1.15 -1.03 113.55 112.28 2pui h SER 301 Ca 0.23 -0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.11 2pui h SER 301 Cb 0.08 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 2pui h SER 301 CO -0.03 0.21 0.41 -0.33 -1.14 0.00 0.00 176.83 175.94 2pui h GLU 302 N 0.14 0.80 -0.35 3.45 3.07 -0.98 -0.96 114.58 119.76 2pui h GLU 302 Ca 0.05 -0.05 -0.07 0.00 -0.50 0.00 0.00 59.36 58.80 2pui h GLU 302 Cb 0.07 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 2pui h GLU 302 CO -0.01 0.53 -0.06 0.00 -1.40 0.00 0.00 179.01 178.07 2pui h ALA 303 N 1.23 1.24 0.06 3.43 0.00 -1.28 -1.49 119.26 122.46 2pui h ALA 303 Ca 0.23 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2pui h ALA 303 Cb -0.08 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2pui h ALA 303 CO -0.06 0.50 -0.03 2.35 0.00 0.00 0.00 179.25 182.01 2pui h TRP 304 N 0.53 -0.08 0.06 0.00 2.91 -0.59 -0.13 115.95 118.66 2pui h TRP 304 Ca 0.10 -0.00 0.01 0.00 1.13 0.00 0.00 58.89 60.14 2pui h TRP 304 Cb 0.44 0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 29.10 2pui h TRP 304 CO 0.02 0.17 -0.14 1.96 -1.03 0.00 0.00 178.44 179.42 2pui h GLN 305 N -0.32 -0.25 -0.14 2.65 1.08 -0.95 -2.77 115.11 114.42 2pui h GLN 305 Ca -0.01 0.02 -0.17 0.00 -1.45 0.00 0.00 58.65 57.04 2pui h GLN 305 Cb 0.28 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.76 2pui h GLN 305 CO 0.01 -0.17 -0.63 0.87 -0.95 0.00 0.00 178.83 177.97 2pui h LYS 306 N -0.26 0.52 0.00 1.46 6.56 -1.28 -3.40 116.57 120.17 2pui h LYS 306 Ca 0.03 -0.36 0.00 0.00 -1.06 0.00 0.00 60.65 59.25 2pui h LYS 306 Cb 0.29 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 2pui h LYS 306 CO -0.09 0.98 0.00 -0.25 -2.06 0.00 0.00 179.45 178.03 2pui n ASP 307 N -3.91 0.35 -4.77 0.86 10.43 -0.06 -5.07 116.55 114.37 2pui n ASP 307 Ca -0.04 -1.17 -0.40 0.00 2.57 0.00 0.00 54.79 55.76 2pui n ASP 307 Cb 0.65 0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.59 2pui n ASP 307 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 2pui s SER 308 N -0.17 6.71 0.00 -2.24 0.15 -1.04 -4.63 113.70 112.48 2pui s SER 308 Ca 0.00 2.50 0.24 0.00 0.70 0.00 0.00 55.95 59.39 2pui s SER 308 Cb 0.00 -2.63 0.24 0.00 -1.71 0.00 0.00 66.02 61.91 2pui s SER 308 CO 0.00 -0.56 1.29 0.18 1.20 0.00 0.00 173.24 175.35 2pui n LEU 309 N 0.54 3.09 -4.63 3.45 4.77 0.79 -4.96 117.00 120.05 2pui n LEU 309 Ca 0.02 -1.09 -0.40 0.00 -0.03 0.00 0.00 56.01 54.51 2pui n LEU 309 Cb 0.44 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.41 2pui n LEU 309 CO 0.55 0.55 0.26 -0.62 -1.33 0.00 0.00 177.39 176.79 2pui s ASP 310 N -1.91 6.48 0.51 -1.43 2.15 -1.26 -4.94 116.67 116.27 2pui s ASP 310 Ca 0.30 0.58 0.27 0.00 0.43 0.00 0.00 52.55 54.14 2pui s ASP 310 Cb 0.21 -2.29 1.38 0.00 -0.30 0.00 0.00 42.92 41.92 2pui s ASP 310 CO 0.30 -0.26 1.90 -0.37 -0.17 0.00 0.00 175.17 176.57 2pui h VAL 311 N 5.32 0.61 -0.00 1.11 -1.51 -1.98 -1.40 116.25 118.40 2pui h VAL 311 Ca -0.30 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 2pui h VAL 311 Cb 1.14 0.51 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 2pui h VAL 311 CO 0.73 0.02 -0.00 -1.22 -1.23 0.00 0.00 177.57 175.86 2pui n TYR 312 N -4.34 0.00 -0.29 5.19 4.02 -1.26 -4.48 117.16 116.00 2pui n TYR 312 Ca 0.17 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 58.08 2pui n TYR 312 Cb 0.84 -0.26 0.15 0.00 -0.02 0.00 0.00 39.34 40.05 2pui n TYR 312 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2pui h ALA 313 N 3.47 1.13 -0.03 -0.72 0.00 -1.66 -3.09 119.26 118.37 2pui h ALA 313 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2pui h ALA 313 Cb 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2pui h ALA 313 CO 0.00 0.12 -0.03 0.09 0.00 0.00 0.00 179.25 179.44 2pui n ASN 314 N -4.73 2.57 -4.69 0.00 3.02 -1.26 -4.50 115.26 105.67 2pui n ASN 314 Ca 0.12 -1.84 -0.42 0.00 -0.03 0.00 0.00 54.58 52.41 2pui n ASN 314 Cb 0.24 0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.41 2pui n ASN 314 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2pui s ILE 315 N -2.03 3.12 0.11 2.41 1.01 -1.17 -4.89 121.20 119.75 2pui s ILE 315 Ca 0.30 0.54 -0.33 0.00 0.00 0.00 0.00 60.65 61.16 2pui s ILE 315 Cb 0.20 -3.35 -0.13 0.00 0.01 0.00 0.00 42.46 39.19 2pui s ILE 315 CO 0.33 -0.00 1.69 -0.90 0.00 0.00 0.00 174.94 176.05 2pui n ASP 316 N 5.65 3.41 0.00 3.58 5.75 -1.26 -1.92 116.55 131.76 2pui n ASP 316 Ca 0.16 1.04 0.00 0.00 -0.01 0.00 0.00 54.79 55.98 2pui n ASP 316 Cb 0.41 -1.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.05 2pui n ASP 316 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pui n GLY 317 N 3.79 3.46 0.09 6.12 0.00 -1.26 -4.95 105.19 112.45 2pui n GLY 317 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 2pui n GLY 317 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2pui h TYR 318 N 0.00 -0.11 -0.44 1.61 3.20 -1.72 -0.81 116.97 118.70 2pui h TYR 318 Ca 0.00 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 2pui h TYR 318 Cb 0.00 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.27 2pui h TYR 318 CO 0.00 0.30 0.21 1.25 -1.64 0.00 0.00 178.16 178.28 2pui h LEU 319 N -0.55 0.30 -0.43 2.82 5.85 -1.79 -1.00 115.31 120.52 2pui h LEU 319 Ca -0.01 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.81 2pui h LEU 319 Cb 0.45 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.39 2pui h LEU 319 CO 0.02 0.21 0.01 0.74 -0.34 0.00 0.00 178.44 179.08 2pui h THR 320 N 0.42 0.68 -0.11 1.05 2.02 -1.92 -0.33 112.91 114.73 2pui h THR 320 Ca 0.19 -0.04 -0.09 0.00 0.77 0.00 0.00 66.41 67.24 2pui h THR 320 Cb 0.11 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 2pui h THR 320 CO -0.14 0.02 -0.32 0.44 0.37 0.00 0.00 175.52 175.88 2pui h ASP 321 N 0.12 0.21 -0.07 4.18 3.32 -0.88 -1.99 116.42 121.32 2pui h ASP 321 Ca 0.21 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 2pui h ASP 321 Cb 0.30 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 2pui h ASP 321 CO -0.34 0.53 0.02 0.74 -1.72 0.00 0.00 179.24 178.47 2pui h THR 322 N 0.19 1.15 -0.80 0.35 2.02 -0.35 -2.55 112.91 112.92 2pui h THR 322 Ca 0.02 -0.46 0.02 0.00 0.77 0.00 0.00 66.41 66.76 2pui h THR 322 Cb 0.67 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 68.38 2pui h THR 322 CO 0.05 0.13 0.53 -0.07 0.37 0.00 0.00 175.52 176.53 2pui h LEU 323 N -0.07 0.90 -0.96 2.58 3.38 -0.94 -2.27 115.31 117.94 2pui h LEU 323 Ca 0.02 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 2pui h LEU 323 Cb 0.19 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2pui h LEU 323 CO -0.00 0.64 0.22 0.28 0.09 0.00 0.00 178.44 179.67 2pui h SER 324 N 1.05 0.90 -0.33 -0.43 0.02 -1.23 0.54 113.55 114.07 2pui h SER 324 Ca 0.30 -0.15 -0.15 0.00 -0.84 0.00 0.00 61.79 60.96 2pui h SER 324 Cb -0.07 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.23 2pui h SER 324 CO -0.07 0.83 -0.37 -0.74 -1.14 0.00 0.00 176.83 175.34 2pui h HIS 325 N 0.95 1.01 -0.37 3.45 -0.00 -1.12 -2.17 115.15 116.90 2pui h HIS 325 Ca 0.21 -0.31 0.00 0.00 -0.00 0.00 0.00 60.37 60.28 2pui h HIS 325 Cb 0.24 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 27.43 2pui h HIS 325 CO 0.02 1.11 0.24 0.82 -0.00 0.00 0.00 177.93 180.12 2pui h ILE 326 N 0.62 1.09 -0.12 6.26 2.04 -1.23 -1.74 117.51 124.43 2pui h ILE 326 Ca 0.05 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.77 2pui h ILE 326 Cb 0.96 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 2pui h ILE 326 CO 0.09 0.09 -0.12 0.15 0.00 0.00 0.00 178.15 178.36 2pui h PHE 327 N 0.50 -0.29 -0.03 1.37 3.57 -0.85 0.19 116.94 121.40 2pui h PHE 327 Ca 0.14 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.66 2pui h PHE 327 Cb -0.05 0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 2pui h PHE 327 CO -0.05 -0.18 0.02 1.49 -2.23 0.00 0.00 178.31 177.36 2pui h GLU 328 N -0.14 0.03 -0.27 1.11 4.81 -1.29 -0.90 114.58 117.93 2pui h GLU 328 Ca 0.08 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 2pui h GLU 328 Cb 0.26 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 2pui h GLU 328 CO -0.21 0.04 0.15 0.93 -0.73 0.00 0.00 179.01 179.19 2pui h GLU 329 N 0.02 0.37 -0.63 1.92 5.08 -1.14 -1.99 114.58 118.22 2pui h GLU 329 Ca 0.01 -0.04 0.13 0.00 -1.00 0.00 0.00 59.36 58.45 2pui h GLU 329 Cb 0.01 -0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.09 2pui h GLU 329 CO -0.00 0.33 0.05 0.00 -1.00 0.00 0.00 179.01 178.39 2pui h ALA 330 N 1.02 0.67 -0.49 3.43 0.00 -0.34 0.16 119.26 123.72 2pui h ALA 330 Ca 0.09 0.17 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 2pui h ALA 330 Cb 0.07 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2pui h ALA 330 CO -0.02 -0.37 0.09 0.82 0.00 0.00 0.00 179.25 179.77 2pui h ILE 331 N 0.16 1.25 -0.31 0.00 1.08 -1.02 -0.66 117.51 118.00 2pui h ILE 331 Ca 0.33 -0.91 0.02 0.00 -0.39 0.00 0.00 64.86 63.92 2pui h ILE 331 Cb 0.54 0.90 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 2pui h ILE 331 CO -0.50 0.32 0.14 1.23 -0.69 0.00 0.00 178.15 178.66 2pui h GLY 332 N 0.67 0.41 1.05 5.37 0.00 -0.53 -2.12 103.07 107.93 2pui h GLY 332 Ca 0.15 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 2pui h GLY 332 CO 0.01 0.07 0.29 0.74 0.00 0.00 0.00 176.54 177.65 2pui h PHE 333 N 0.31 1.21 -0.77 5.60 0.04 -0.58 -2.41 116.94 120.33 2pui h PHE 333 Ca 0.13 -0.10 0.09 0.00 2.80 0.00 0.00 57.97 60.89 2pui h PHE 333 Cb 0.06 -0.36 -0.07 0.00 2.20 0.00 0.00 35.95 37.78 2pui h PHE 333 CO -0.11 0.93 0.42 0.00 -0.60 0.00 0.00 178.31 178.95 2pui h ALA 334 N 1.15 1.08 -0.75 2.45 0.00 -0.99 -0.84 119.26 121.36 2pui h ALA 334 Ca 0.26 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 2pui h ALA 334 Cb 0.25 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2pui h ALA 334 CO -0.02 0.05 0.41 0.78 0.00 0.00 0.00 179.25 180.47 2pui h GLY 335 N 0.72 1.13 0.98 0.00 0.00 -0.98 -0.52 103.07 104.40 2pui h GLY 335 Ca 0.37 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 2pui h GLY 335 CO -0.25 0.50 0.26 0.00 0.00 0.00 0.00 176.54 177.05 2pui h GLU 337 N 0.63 0.93 0.02 0.00 4.57 -0.90 -0.37 114.58 119.46 2pui h GLU 337 Ca 0.17 -0.27 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2pui h GLU 337 Cb 0.04 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.53 2pui h GLU 337 CO -0.03 0.92 -0.01 -0.07 -1.18 0.00 0.00 179.01 178.64 2pui h LEU 338 N 0.86 -0.02 0.66 1.64 3.38 -0.98 -2.07 115.31 118.78 2pui h LEU 338 Ca 0.16 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2pui h LEU 338 Cb 0.49 0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.25 2pui h LEU 338 CO 0.02 0.02 -0.32 0.40 0.09 0.00 0.00 178.44 178.65 2pui h ILE 339 N -0.06 0.31 -0.91 1.22 2.04 -1.30 -3.19 117.51 115.63 2pui h ILE 339 Ca -0.00 -0.14 0.23 0.00 1.00 0.00 0.00 64.86 65.95 2pui h ILE 339 Cb 0.05 0.35 -0.13 0.00 -0.74 0.00 0.00 36.82 36.35 2pui h ILE 339 CO 0.00 0.02 0.40 -0.09 0.00 0.00 0.00 178.15 178.48 2pui h ARG 340 N -0.98 0.38 0.00 2.37 1.12 -1.07 -0.55 114.38 115.65 2pui h ARG 340 Ca -0.09 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.76 2pui h ARG 340 Cb 0.71 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.58 2pui h ARG 340 CO 0.15 0.25 0.00 0.00 -3.11 0.00 0.00 179.97 177.26 2pui h ARG 341 N 0.39 0.00 0.06 0.20 2.47 -1.43 -0.05 114.38 116.02 2pui h ARG 341 Ca 0.57 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 59.04 2pui h ARG 341 Cb 1.10 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.40 2pui h ARG 341 CO -0.54 0.00 -1.34 1.15 0.56 0.00 0.00 179.97 179.80 2pui h THR 342 N 0.00 0.98 0.00 2.04 2.02 -1.10 -3.30 112.91 113.55 2pui h THR 342 Ca 0.00 -2.30 0.00 0.00 0.77 0.00 0.00 66.41 64.88 2pui h THR 342 Cb 0.75 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.69 2pui h THR 342 CO 0.00 0.57 0.00 2.30 0.37 0.00 0.00 175.52 178.76 2pui n ILE 343 N -4.11 0.00 -1.67 3.11 -5.35 -0.87 -4.84 119.36 105.63 2pui n ILE 343 Ca -0.28 -0.40 -0.07 0.00 -0.27 0.00 0.00 62.75 61.73 2pui n ILE 343 Cb 0.80 1.15 0.05 0.00 -1.74 0.00 0.00 39.64 39.90 2pui n ILE 343 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2pui n GLY 344 N 0.20 -0.46 0.23 3.28 0.00 -0.03 -1.08 105.19 107.33 2pui n GLY 344 Ca 0.00 -1.80 -0.00 0.00 0.00 0.00 0.00 46.02 44.22 2pui n GLY 344 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2pui h LEU 345 N 0.00 0.22 -8.16 0.99 6.46 -1.71 -3.23 115.31 109.88 2pui h LEU 345 Ca -0.10 0.08 -0.70 0.00 -0.12 0.00 0.00 57.88 57.04 2pui h LEU 345 Cb 0.31 0.06 -0.29 0.00 -0.73 0.00 0.00 40.66 40.02 2pui h LEU 345 CO 0.08 0.13 -0.59 0.00 -0.62 0.00 0.00 178.44 177.44 2pui s ALA 346 N -6.09 3.07 0.74 1.25 0.00 -1.26 -4.90 121.76 114.57 2pui s ALA 346 Ca -0.13 -1.83 -0.02 0.00 0.00 0.00 0.00 51.96 49.98 2pui s ALA 346 Cb 0.17 -2.31 0.13 0.00 0.00 0.00 0.00 23.12 21.11 2pui s ALA 346 CO 0.74 -1.40 1.02 -1.01 0.00 0.00 0.00 175.76 175.11 2pui s HIS 347 N 1.39 1.60 0.03 0.00 3.76 -1.26 -4.38 115.29 116.42 2pui s HIS 347 Ca -0.01 -0.23 0.08 0.00 -0.15 0.00 0.00 55.06 54.75 2pui s HIS 347 Cb -0.20 -3.07 -0.03 0.00 1.11 0.00 0.00 32.58 30.39 2pui s HIS 347 CO 0.02 -1.77 -0.23 0.14 -0.85 0.00 0.00 174.74 172.05 2pui s VAL 348 N -3.19 2.40 0.50 -0.90 -7.23 -1.24 -5.03 120.40 105.71 2pui s VAL 348 Ca 0.67 -1.24 0.28 0.00 -1.81 0.00 0.00 61.98 59.88 2pui s VAL 348 Cb -0.05 -1.95 0.32 0.00 0.56 0.00 0.00 36.38 35.26 2pui s VAL 348 CO 0.45 0.41 2.16 0.00 -0.31 0.00 0.00 175.10 177.81 2pui h ALA 349 N 4.85 1.40 -0.39 1.32 0.00 -1.97 -2.41 119.26 122.07 2pui h ALA 349 Ca -0.46 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.43 2pui h ALA 349 Cb 1.14 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 2pui h ALA 349 CO 0.46 0.08 0.16 -0.44 0.00 0.00 0.00 179.25 179.51 2pui h ASP 350 N 0.00 0.20 0.18 0.00 5.19 -1.94 -2.35 116.42 117.71 2pui h ASP 350 Ca -0.00 0.03 -0.30 0.00 -0.62 0.00 0.00 57.03 56.14 2pui h ASP 350 Cb 0.17 0.00 0.02 0.00 0.18 0.00 0.00 39.33 39.70 2pui h ASP 350 CO 0.01 0.15 -1.43 -0.07 -3.12 0.00 0.00 179.24 174.78 2pui h LEU 351 N 0.33 0.61 -0.95 1.55 3.38 -1.77 -3.35 115.31 115.11 2pui h LEU 351 Ca 0.17 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.22 2pui h LEU 351 Cb 0.12 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2pui h LEU 351 CO -0.15 1.66 0.00 0.44 0.09 0.00 0.00 178.44 180.48 2pui h ASP 352 N -0.06 0.00 -0.02 -0.43 3.45 -1.40 -2.92 116.42 115.04 2pui h ASP 352 Ca -0.27 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.19 2pui h ASP 352 Cb 1.96 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.73 2pui h ASP 352 CO 0.18 0.00 -0.03 0.35 -1.57 0.00 0.00 179.24 178.17 2pui n THR 353 N -2.63 0.00 -1.67 0.35 -2.24 -0.89 -4.97 114.28 102.22 2pui n THR 353 Ca 0.02 -0.49 -0.45 0.00 -2.27 0.00 0.00 64.05 60.86 2pui n THR 353 Cb 0.29 1.36 -0.03 0.00 -2.10 0.00 0.00 70.33 69.84 2pui n THR 353 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2pui n ILE 354 N 0.92 0.69 -4.40 2.28 5.41 -1.11 -5.01 119.36 118.14 2pui n ILE 354 Ca 0.10 -0.17 -0.21 0.00 1.00 0.00 0.00 62.75 63.47 2pui n ILE 354 Cb 0.44 -1.51 -0.13 0.00 -0.71 0.00 0.00 39.64 37.72 2pui n ILE 354 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 2pui s VAL 355 N 0.20 1.25 1.03 1.39 -7.23 -1.26 -4.50 120.40 111.28 2pui s VAL 355 Ca 0.71 -1.08 -0.15 0.00 -1.81 0.00 0.00 61.98 59.66 2pui s VAL 355 Cb -0.65 -1.13 0.20 0.00 0.56 0.00 0.00 36.38 35.36 2pui s VAL 355 CO 0.46 0.03 1.13 -2.16 -0.31 0.00 0.00 175.10 174.26 2pui s PRO 356 N -1.21 0.19 0.21 4.82 0.04 -1.26 -4.87 135.00 132.93 2pui s PRO 356 Ca 0.03 0.19 -0.13 0.00 0.04 0.00 0.00 61.00 61.13 2pui s PRO 356 Cb -0.08 -1.74 0.25 0.00 0.04 0.00 0.00 34.50 32.97 2pui s PRO 356 CO 0.02 -2.82 1.63 0.35 0.04 0.00 0.00 177.00 176.22 2pui h PHE 357 N -1.95 -0.29 -0.69 0.56 3.57 -2.00 -1.62 116.94 114.53 2pui h PHE 357 Ca -0.50 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 2pui h PHE 357 Cb 1.31 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 40.25 2pui h PHE 357 CO -0.49 -0.26 0.37 -0.44 -2.23 0.00 0.00 178.31 175.26 2pui h ASP 358 N 0.02 0.85 -0.53 0.41 3.32 -1.97 -0.63 116.42 117.88 2pui h ASP 358 Ca 0.31 -0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.25 2pui h ASP 358 Cb 0.48 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2pui h ASP 358 CO -0.63 0.69 0.19 0.50 -1.72 0.00 0.00 179.24 178.27 2pui h LYS 359 N 0.96 0.81 -0.27 3.56 3.64 -1.77 -2.06 116.57 121.44 2pui h LYS 359 Ca 0.24 -0.16 0.06 0.00 -1.27 0.00 0.00 60.65 59.52 2pui h LYS 359 Cb 0.04 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 31.68 2pui h LYS 359 CO -0.04 0.73 -0.10 -0.09 -2.27 0.00 0.00 179.45 177.68 2pui h ARG 360 N 0.73 -0.04 -0.69 1.90 2.43 -0.36 -0.63 114.38 117.72 2pui h ARG 360 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 2pui h ARG 360 Cb 0.24 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 2pui h ARG 360 CO -0.01 -0.03 0.43 0.82 -1.51 0.00 0.00 179.97 179.67 2pui h ILE 361 N -0.05 1.19 -0.43 1.20 1.08 -1.06 -0.99 117.51 118.45 2pui h ILE 361 Ca 0.14 -0.39 -0.00 0.00 -0.39 0.00 0.00 64.86 64.22 2pui h ILE 361 Cb 0.26 0.21 -0.02 0.00 -3.07 0.00 0.00 36.82 34.19 2pui h ILE 361 CO -0.31 0.19 0.25 1.23 -0.69 0.00 0.00 178.15 178.83 2pui h GLY 362 N 0.94 0.64 1.81 5.37 0.00 -1.04 0.42 103.07 111.21 2pui h GLY 362 Ca 0.25 -0.27 -0.13 0.00 0.00 0.00 0.00 47.33 47.18 2pui h GLY 362 CO -0.05 0.26 -0.53 3.21 0.00 0.00 0.00 176.54 179.44 2pui h ARG 363 N 0.57 0.20 -0.07 4.80 2.47 -0.94 -1.96 114.38 119.46 2pui h ARG 363 Ca 0.16 -0.12 -0.16 0.00 -1.26 0.00 0.00 59.98 58.60 2pui h ARG 363 Cb 0.01 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 2pui h ARG 363 CO -0.03 0.68 -0.65 0.87 0.56 0.00 0.00 179.97 181.40 2pui h LYS 364 N 0.16 0.27 -0.50 0.04 1.57 -0.93 -1.63 116.57 115.54 2pui h LYS 364 Ca 0.00 -0.20 0.01 0.00 -1.87 0.00 0.00 60.65 58.60 2pui h LYS 364 Cb 0.98 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.30 2pui h LYS 364 CO 0.08 0.83 0.32 -0.09 -0.57 0.00 0.00 179.45 180.02 2pui h ARG 365 N 0.19 0.63 -0.75 3.15 2.43 -0.72 -2.48 114.38 116.83 2pui h ARG 365 Ca -0.01 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 2pui h ARG 365 Cb 1.19 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.56 2pui h ARG 365 CO 0.10 0.42 0.27 -0.07 -1.51 0.00 0.00 179.97 179.18 2pui h LEU 366 N 0.65 1.06 -0.48 3.80 3.38 -1.11 -1.46 115.31 121.15 2pui h LEU 366 Ca 0.19 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 58.01 2pui h LEU 366 Cb -0.04 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.40 2pui h LEU 366 CO -0.06 0.96 0.26 0.00 0.09 0.00 0.00 178.44 179.69 2pui h ALA 367 N 1.19 0.61 -0.35 1.53 0.00 -1.20 0.14 119.26 121.16 2pui h ALA 367 Ca 0.25 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.20 2pui h ALA 367 Cb 0.25 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2pui h ALA 367 CO -0.01 -0.07 0.15 -0.07 0.00 0.00 0.00 179.25 179.25 2pui h LEU 368 N 0.52 0.19 -0.20 0.00 3.38 -1.25 -0.80 115.31 117.16 2pui h LEU 368 Ca 0.20 0.03 -0.16 0.00 0.09 0.00 0.00 57.88 58.03 2pui h LEU 368 Cb 0.06 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2pui h LEU 368 CO -0.11 0.15 -0.52 -0.33 0.09 0.00 0.00 178.44 177.72 2pui h GLU 369 N 0.31 0.70 -0.66 1.13 5.08 -0.94 -1.89 114.58 118.31 2pui h GLU 369 Ca 0.16 -0.49 -0.07 0.00 -1.00 0.00 0.00 59.36 57.96 2pui h GLU 369 Cb 0.10 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 2pui h GLU 369 CO -0.14 1.11 0.16 1.79 -1.00 0.00 0.00 179.01 180.93 2pui h THR 370 N 0.40 1.26 -0.57 1.13 1.35 -0.76 -1.48 112.91 114.23 2pui h THR 370 Ca -0.01 -0.95 -0.02 0.00 -0.55 0.00 0.00 66.41 64.88 2pui h THR 370 Cb 1.13 0.61 -0.03 0.00 -1.73 0.00 0.00 68.15 68.13 2pui h THR 370 CO 0.11 0.36 0.30 1.23 -0.25 0.00 0.00 175.52 177.27 2pui h GLY 371 N 0.99 0.87 0.79 5.82 0.00 -1.12 0.88 103.07 111.29 2pui h GLY 371 Ca 0.21 -0.41 0.03 0.00 0.00 0.00 0.00 47.33 47.16 2pui h GLY 371 CO 0.00 0.39 0.17 -0.84 0.00 0.00 0.00 176.54 176.26 2pui h THR 372 N 0.78 0.96 -0.39 4.70 2.02 -1.27 -0.53 112.91 119.18 2pui h THR 372 Ca 0.20 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.26 2pui h THR 372 Cb 0.08 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 2pui h THR 372 CO -0.03 0.06 0.25 0.00 0.37 0.00 0.00 175.52 176.18 2pui h ALA 373 N 1.20 0.49 -0.66 6.16 0.00 -0.82 -1.70 119.26 123.93 2pui h ALA 373 Ca 0.16 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.11 2pui h ALA 373 Cb 0.08 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 2pui h ALA 373 CO -0.12 -0.05 0.34 0.74 0.00 0.00 0.00 179.25 180.16 2pui h PHE 374 N 0.52 0.62 -0.15 0.00 -1.00 -0.57 0.95 116.94 117.31 2pui h PHE 374 Ca 0.14 0.03 -0.03 0.00 2.81 0.00 0.00 57.97 60.92 2pui h PHE 374 Cb -0.05 -0.18 -0.01 0.00 3.61 0.00 0.00 35.95 39.32 2pui h PHE 374 CO -0.05 0.27 -0.01 0.82 -1.61 0.00 0.00 178.31 177.73 2pui h ILE 375 N 0.62 1.26 0.00 -0.55 2.04 -0.81 -2.64 117.51 117.44 2pui h ILE 375 Ca 0.31 -0.88 -0.12 0.00 1.00 0.00 0.00 64.86 65.16 2pui h ILE 375 Cb 0.25 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.87 2pui h ILE 375 CO -0.22 0.26 -0.58 -0.33 0.00 0.00 0.00 178.15 177.28 2pui h GLU 376 N 0.00 0.00 -0.30 2.37 5.08 -1.12 -3.30 114.58 117.31 2pui h GLU 376 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2pui h GLU 376 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2pui h GLU 376 CO 0.01 0.58 0.00 1.63 -1.00 0.00 0.00 179.01 180.23 2pui n LYS 377 N -3.26 2.16 -0.25 2.33 5.02 0.31 -4.72 118.16 119.76 2pui n LYS 377 Ca 0.02 -1.97 0.21 0.00 -2.02 0.00 0.00 58.31 54.55 2pui n LYS 377 Cb 0.76 -1.37 0.53 0.00 -0.02 0.00 0.00 35.03 34.93 2pui n LYS 377 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 2pui h ARG 378 N 3.13 0.36 -0.02 1.97 0.11 -1.55 0.20 114.38 118.58 2pui h ARG 378 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 2pui h ARG 378 Cb 0.78 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 31.78 2pui h ARG 378 CO 0.00 0.24 0.00 -1.13 0.10 0.00 0.00 179.97 179.18 2pui n SER 379 N -4.51 1.48 0.03 0.08 3.41 -1.26 -3.84 113.62 109.00 2pui n SER 379 Ca 0.20 -1.50 0.03 0.00 -0.26 0.00 0.00 58.87 57.34 2pui n SER 379 Cb 0.76 -0.01 -0.09 0.00 -0.26 0.00 0.00 64.21 64.61 2pui n SER 379 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2pui n GLU 380 N 0.16 0.63 -2.12 4.33 1.02 0.69 -4.92 120.64 120.43 2pui n GLU 380 Ca 0.19 0.12 -0.41 0.00 -0.02 0.00 0.00 57.16 57.04 2pui n GLU 380 Cb 0.35 -1.74 -0.02 0.00 -0.02 0.00 0.00 31.44 30.00 2pui n GLU 380 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2pui s PHE 381 N -3.05 3.10 -0.21 -0.32 0.40 -1.19 -4.95 117.98 111.76 2pui s PHE 381 Ca -0.04 1.29 0.09 0.00 -0.60 0.00 0.00 56.93 57.67 2pui s PHE 381 Cb 0.09 -3.69 -0.21 0.00 0.51 0.00 0.00 43.02 39.72 2pui s PHE 381 CO 0.82 -2.02 -0.02 0.36 0.70 0.00 0.00 175.22 175.06 2pui n LYS 382 N 1.54 0.67 -4.13 0.44 0.00 -1.26 -5.01 118.16 110.41 2pui n LYS 382 Ca 0.03 0.10 -0.10 0.00 -0.00 0.00 0.00 58.31 58.33 2pui n LYS 382 Cb 0.42 -1.55 -0.09 0.00 -0.00 0.00 0.00 35.03 33.81 2pui n LYS 382 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2pui s THR 383 N -2.51 0.05 0.42 0.58 -4.23 -1.26 -5.05 115.64 103.64 2pui s THR 383 Ca -0.22 -1.83 0.08 0.00 -1.18 0.00 0.00 61.69 58.53 2pui s THR 383 Cb 0.08 -2.18 0.26 0.00 1.34 0.00 0.00 72.50 72.00 2pui s THR 383 CO 0.72 -0.25 2.06 -0.29 -0.54 0.00 0.00 174.62 176.33 2pui h ILE 384 N 2.69 1.10 -0.79 2.99 6.09 -1.96 -2.38 117.51 125.26 2pui h ILE 384 Ca -0.34 -0.19 0.05 0.00 -1.37 0.00 0.00 64.86 63.00 2pui h ILE 384 Cb 1.22 0.54 -0.05 0.00 0.47 0.00 0.00 36.82 39.00 2pui h ILE 384 CO 0.54 0.10 0.52 0.74 -3.07 0.00 0.00 178.15 176.97 2pui h THR 385 N 0.52 1.09 -0.65 2.19 2.02 -1.96 -1.55 112.91 114.57 2pui h THR 385 Ca 0.14 -0.32 -0.07 0.00 0.77 0.00 0.00 66.41 66.93 2pui h THR 385 Cb -0.05 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 66.42 2pui h THR 385 CO -0.03 0.17 0.12 0.44 0.37 0.00 0.00 175.52 176.59 2pui h ASP 386 N 0.92 1.01 -0.02 4.18 3.32 -1.84 0.69 116.42 124.69 2pui h ASP 386 Ca 0.32 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2pui h ASP 386 Cb 0.12 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 2pui h ASP 386 CO -0.10 0.99 0.00 0.58 -1.72 0.00 0.00 179.24 178.99 2pui h VAL 387 N 1.00 1.21 -0.22 -1.35 2.07 -1.30 -0.74 116.25 116.91 2pui h VAL 387 Ca 0.20 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 2pui h VAL 387 Cb 0.40 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 2pui h VAL 387 CO 0.01 0.16 0.12 0.40 0.02 0.00 0.00 177.57 178.28 2pui h ILE 388 N -0.22 1.11 -0.65 4.57 2.04 -1.23 -1.55 117.51 121.57 2pui h ILE 388 Ca 0.01 -0.30 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 2pui h ILE 388 Cb 0.26 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 2pui h ILE 388 CO 0.00 0.11 0.12 -0.33 0.00 0.00 0.00 178.15 178.05 2pui h GLU 389 N 0.25 1.07 -0.26 2.37 4.39 -0.86 0.85 114.58 122.38 2pui h GLU 389 Ca 0.08 -0.27 0.03 0.00 0.34 0.00 0.00 59.36 59.54 2pui h GLU 389 Cb 0.07 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 2pui h GLU 389 CO -0.01 0.97 0.07 1.25 -1.16 0.00 0.00 179.01 180.13 2pui h LEU 390 N 1.00 0.06 0.28 1.33 5.85 -0.99 -2.03 115.31 120.81 2pui h LEU 390 Ca 0.20 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 2pui h LEU 390 Cb 0.41 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2pui h LEU 390 CO 0.01 0.07 -0.20 0.15 -0.34 0.00 0.00 178.44 178.12 2pui h PHE 391 N 0.18 -0.54 -1.00 1.25 3.04 -0.59 -2.04 116.94 117.24 2pui h PHE 391 Ca 0.12 -0.00 0.18 0.00 3.98 0.00 0.00 57.97 62.25 2pui h PHE 391 Cb 0.10 0.20 -0.10 0.00 2.56 0.00 0.00 35.95 38.71 2pui h PHE 391 CO -0.14 -0.31 0.62 0.87 -2.02 0.00 0.00 178.31 177.32 2pui h LYS 392 N -0.48 0.74 -0.01 1.11 1.57 -0.83 -1.90 116.57 116.76 2pui h LYS 392 Ca -0.02 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2pui h LYS 392 Cb 0.42 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 2pui h LYS 392 CO -0.00 0.49 0.00 1.25 -0.57 0.00 0.00 179.45 180.62 2pui h LEU 393 N 0.76 0.02 -1.50 2.94 5.85 -0.80 -2.55 115.31 120.03 2pui h LEU 393 Ca 0.56 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 59.05 2pui h LEU 393 Cb 0.88 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 2pui h LEU 393 CO -0.35 0.21 -0.03 -0.07 -0.34 0.00 0.00 178.44 177.86 2pui h LEU 394 N -0.18 0.27 -2.13 2.25 4.07 -0.71 -3.04 115.31 115.83 2pui h LEU 394 Ca 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2pui h LEU 394 Cb 0.20 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.87 2pui h LEU 394 CO -0.00 0.34 0.00 1.33 -1.08 0.00 0.00 178.44 179.03 2pui n VAL 395 N -4.35 0.30 0.00 1.22 0.24 -0.78 -5.06 118.33 109.91 2pui n VAL 395 Ca -0.00 -0.65 0.00 0.00 -2.04 0.00 0.00 64.34 61.65 2pui n VAL 395 Cb 0.20 1.18 0.00 0.00 -1.47 0.00 0.00 33.84 33.75 2pui n VAL 395 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98