#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3inj s VAL 8 N 0.00 5.16 0.51 0.00 1.01 -1.26 -5.05 120.40 120.78 3inj s VAL 8 Ca 0.00 -0.62 -0.21 0.00 0.00 0.00 0.00 61.98 61.14 3inj s VAL 8 Cb 0.00 -4.04 -0.08 0.00 0.00 0.00 0.00 36.38 32.26 3inj s VAL 8 CO 0.00 -0.44 0.93 -2.65 0.00 0.00 0.00 175.10 172.93 3inj n PRO 9 N 5.40 1.06 -2.01 2.72 -0.02 -1.26 -4.90 135.00 136.00 3inj n PRO 9 Ca -0.10 0.39 -0.41 0.00 -2.02 0.00 0.00 63.50 61.36 3inj n PRO 9 Cb 0.46 -2.05 -0.02 0.00 -0.02 0.00 0.00 33.50 31.87 3inj n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3inj s ALA 10 N -1.43 3.65 0.35 3.55 0.00 -1.26 -4.98 121.76 121.64 3inj s ALA 10 Ca 0.69 1.32 -0.07 0.00 0.00 0.00 0.00 51.96 53.90 3inj s ALA 10 Cb -0.48 -3.57 -0.06 0.00 0.00 0.00 0.00 23.12 19.01 3inj s ALA 10 CO 0.53 -0.74 0.66 -1.25 0.00 0.00 0.00 175.76 174.95 3inj s PRO 11 N -0.07 3.69 -0.43 0.00 0.05 -1.26 -5.03 135.00 131.95 3inj s PRO 11 Ca 0.61 0.21 -0.27 0.00 0.05 0.00 0.00 61.00 61.61 3inj s PRO 11 Cb -0.42 -2.52 0.02 0.00 0.05 0.00 0.00 34.50 31.63 3inj s PRO 11 CO 0.41 0.09 1.01 1.21 0.05 0.00 0.00 177.00 179.77 3inj s ASN 12 N -3.20 6.63 0.00 6.66 3.84 -1.26 -4.91 114.94 122.69 3inj s ASN 12 Ca 0.47 0.43 0.25 0.00 0.21 0.00 0.00 52.86 54.22 3inj s ASN 12 Cb -0.10 -2.50 1.35 0.00 -0.55 0.00 0.00 41.25 39.45 3inj s ASN 12 CO 0.31 -1.06 1.84 0.00 -2.79 0.00 0.00 177.10 175.40 3inj n GLN 13 N 7.28 0.53 -3.13 0.43 6.02 -1.26 -3.53 117.38 123.73 3inj n GLN 13 Ca 0.09 0.03 -0.22 0.00 -0.01 0.00 0.00 57.00 56.89 3inj n GLN 13 Cb 0.48 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.19 3inj n GLN 13 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3inj n GLN 14 N -1.17 0.72 -2.09 -1.09 6.02 -1.26 -5.02 117.38 113.49 3inj n GLN 14 Ca 0.15 -3.01 -0.36 0.00 -0.01 0.00 0.00 57.00 53.77 3inj n GLN 14 Cb 0.15 -1.25 0.02 0.00 1.02 0.00 0.00 30.24 30.18 3inj n GLN 14 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3inj s PRO 15 N -0.91 3.18 0.49 -1.09 0.04 -1.23 -5.02 135.00 130.46 3inj s PRO 15 Ca 0.35 1.79 -0.14 0.00 0.04 0.00 0.00 61.00 63.04 3inj s PRO 15 Cb 0.18 -2.03 -0.07 0.00 0.04 0.00 0.00 34.50 32.62 3inj s PRO 15 CO -0.13 -1.03 0.92 -2.00 0.04 0.00 0.00 177.00 174.80 3inj s GLU 16 N -3.21 3.85 -0.20 4.56 2.12 -1.26 -5.03 118.70 119.53 3inj s GLU 16 Ca 0.74 0.77 -0.06 0.00 0.36 0.00 0.00 54.97 56.79 3inj s GLU 16 Cb -0.29 -2.21 -0.03 0.00 0.26 0.00 0.00 34.13 31.86 3inj s GLU 16 CO 0.33 -0.23 0.02 0.08 -0.54 0.00 0.00 175.26 174.91 3inj s VAL 17 N -2.61 4.15 -0.07 3.70 1.01 -1.26 -4.99 120.40 120.33 3inj s VAL 17 Ca 0.56 -0.25 0.13 0.00 0.00 0.00 0.00 61.98 62.42 3inj s VAL 17 Cb -0.10 -2.87 -0.20 0.00 0.00 0.00 0.00 36.38 33.21 3inj s VAL 17 CO 0.34 0.43 0.20 0.49 0.00 0.00 0.00 175.10 176.55 3inj n PHE 18 N 4.11 0.00 -4.15 5.22 3.01 -1.26 -4.96 117.46 119.43 3inj n PHE 18 Ca -0.17 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.01 3inj n PHE 18 Cb 0.52 -0.47 -0.17 0.00 -0.01 0.00 0.00 39.48 39.35 3inj n PHE 18 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3inj n ASN 20 N 4.58 0.27 -1.66 0.00 6.94 -1.26 -4.70 115.26 119.43 3inj n ASN 20 Ca -0.17 -1.98 0.00 0.00 -0.02 0.00 0.00 54.58 52.42 3inj n ASN 20 Cb 0.51 -0.09 0.00 0.00 -2.36 0.00 0.00 39.78 37.83 3inj n ASN 20 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3inj n GLN 21 N 0.30 1.40 -3.12 -3.83 6.02 -1.26 -1.25 117.38 115.63 3inj n GLN 21 Ca -0.06 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.54 3inj n GLN 21 Cb 0.97 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 32.17 3inj n GLN 21 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3inj s ILE 22 N -1.29 5.05 -0.42 5.09 1.01 0.19 -4.74 121.20 126.08 3inj s ILE 22 Ca 0.00 1.32 -0.12 0.00 0.00 0.00 0.00 60.65 61.85 3inj s ILE 22 Cb 0.00 -3.98 0.06 0.00 0.01 0.00 0.00 42.46 38.55 3inj s ILE 22 CO 0.00 0.30 0.29 0.12 0.00 0.00 0.00 174.94 175.65 3inj s PHE 23 N 0.58 3.28 -0.03 3.97 5.36 -0.47 0.54 117.98 131.22 3inj s PHE 23 Ca 0.34 -1.15 0.01 0.00 -0.96 0.00 0.00 56.93 55.17 3inj s PHE 23 Cb -0.17 -2.87 0.02 0.00 -0.34 0.00 0.00 43.02 39.65 3inj s PHE 23 CO 0.16 -0.77 -0.04 0.42 -1.46 0.00 0.00 175.22 173.53 3inj s ILE 24 N 1.54 0.46 -1.46 3.12 1.01 -0.37 -0.55 121.20 124.95 3inj s ILE 24 Ca 0.03 -0.13 -0.11 0.00 0.00 0.00 0.00 60.65 60.44 3inj s ILE 24 Cb -0.22 -0.47 0.05 0.00 0.01 0.00 0.00 42.46 41.83 3inj s ILE 24 CO 0.05 0.19 0.96 0.59 0.00 0.00 0.00 174.94 176.73 3inj n ASN 25 N 3.74 -5.42 -2.48 3.58 3.02 -1.26 -1.38 115.26 115.06 3inj n ASN 25 Ca -0.22 -0.61 -0.21 0.00 -0.03 0.00 0.00 54.58 53.51 3inj n ASN 25 Cb 0.53 -4.32 -0.00 0.00 -0.61 0.00 0.00 39.78 35.37 3inj n ASN 25 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3inj n ASN 26 N -2.81 -5.83 -4.04 6.41 5.03 -1.26 -4.63 115.26 108.12 3inj n ASN 26 Ca 0.01 -0.04 -0.10 0.00 0.87 0.00 0.00 54.58 55.33 3inj n ASN 26 Cb 0.55 -4.84 -0.11 0.00 -1.02 0.00 0.00 39.78 34.36 3inj n ASN 26 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 3inj s GLU 27 N -5.13 0.48 -0.14 3.52 0.41 -0.48 -5.03 118.70 112.34 3inj s GLU 27 Ca 0.04 -0.87 -0.14 0.00 -0.41 0.00 0.00 54.97 53.59 3inj s GLU 27 Cb -0.02 0.02 -0.05 0.00 -1.78 0.00 0.00 34.13 32.30 3inj s GLU 27 CO 0.04 -0.04 0.32 -1.58 -0.49 0.00 0.00 175.26 173.51 3inj s TRP 28 N -2.27 3.49 0.03 1.61 0.52 -1.26 -1.23 118.94 119.82 3inj s TRP 28 Ca -0.06 0.65 0.07 0.00 0.02 0.00 0.00 56.10 56.78 3inj s TRP 28 Cb -0.04 -2.35 -0.02 0.00 -1.15 0.00 0.00 33.47 29.91 3inj s TRP 28 CO -0.03 0.27 -0.21 -1.01 0.02 0.00 0.00 176.95 175.98 3inj s HIS 29 N 0.35 1.87 0.89 -1.98 3.76 0.19 -4.92 115.29 115.45 3inj s HIS 29 Ca 0.18 -0.37 -0.11 0.00 -0.15 0.00 0.00 55.06 54.60 3inj s HIS 29 Cb -0.13 -1.14 0.12 0.00 1.11 0.00 0.00 32.58 32.54 3inj s HIS 29 CO 0.05 0.06 1.09 -0.51 -0.85 0.00 0.00 174.74 174.59 3inj s ASP 30 N -1.00 3.55 0.70 1.40 -0.00 -1.26 -0.64 116.67 119.41 3inj s ASP 30 Ca 0.08 1.50 -0.16 0.00 -0.00 0.00 0.00 52.55 53.97 3inj s ASP 30 Cb -0.09 -2.19 0.02 0.00 -0.00 0.00 0.00 42.92 40.67 3inj s ASP 30 CO 0.01 -2.59 1.23 0.00 -0.00 0.00 0.00 175.17 173.81 3inj s ALA 31 N -2.94 2.21 0.42 5.23 0.00 -1.26 -4.81 121.76 120.61 3inj s ALA 31 Ca 0.63 0.97 0.09 0.00 0.00 0.00 0.00 51.96 53.65 3inj s ALA 31 Cb -0.18 -3.49 0.91 0.00 0.00 0.00 0.00 23.12 20.37 3inj s ALA 31 CO 0.57 -1.76 2.05 0.28 0.00 0.00 0.00 175.76 176.90 3inj h VAL 32 N -0.01 1.10 0.00 0.00 2.07 -1.95 -1.80 116.25 115.66 3inj h VAL 32 Ca -0.49 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 66.79 3inj h VAL 32 Cb 1.30 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3inj h VAL 32 CO 0.51 0.11 -0.09 -1.54 0.02 0.00 0.00 177.57 176.57 3inj n SER 33 N -4.46 0.70 0.00 0.57 3.41 -1.26 -4.92 113.62 107.67 3inj n SER 33 Ca 0.01 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.12 3inj n SER 33 Cb 0.10 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 3inj n SER 33 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3inj n ARG 34 N -2.14 -0.68 -2.70 4.33 5.12 -0.68 -4.99 116.66 114.92 3inj n ARG 34 Ca 0.05 0.17 -0.35 0.00 -1.93 0.00 0.00 57.85 55.80 3inj n ARG 34 Cb 0.42 -3.77 -0.06 0.00 -1.16 0.00 0.00 32.46 27.89 3inj n ARG 34 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3inj s LYS 35 N -0.79 4.18 0.15 5.56 1.02 -1.26 -4.88 119.74 123.72 3inj s LYS 35 Ca 0.00 1.29 0.02 0.00 0.02 0.00 0.00 55.97 57.29 3inj s LYS 35 Cb 0.00 -2.33 -0.04 0.00 -0.52 0.00 0.00 37.83 34.93 3inj s LYS 35 CO 0.00 -0.09 -0.02 0.95 -0.92 0.00 0.00 175.35 175.26 3inj s THR 36 N -1.94 0.71 0.04 2.17 -4.23 -1.26 -1.17 115.64 109.96 3inj s THR 36 Ca 0.60 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 59.18 3inj s THR 36 Cb -0.15 -1.99 -0.02 0.00 1.34 0.00 0.00 72.50 71.68 3inj s THR 36 CO 0.19 -0.59 -0.11 0.72 -0.54 0.00 0.00 174.62 174.29 3inj s PHE 37 N -3.63 0.92 0.25 3.99 -0.12 0.94 -4.81 117.98 115.52 3inj s PHE 37 Ca 0.20 -0.41 -0.30 0.00 -0.05 0.00 0.00 56.93 56.37 3inj s PHE 37 Cb 0.06 -0.54 -0.09 0.00 -0.63 0.00 0.00 43.02 41.82 3inj s PHE 37 CO 0.01 -0.01 0.97 -1.25 -0.05 0.00 0.00 175.22 174.89 3inj s PRO 38 N -1.37 4.81 -0.04 1.99 0.04 -1.26 -0.21 135.00 138.96 3inj s PRO 38 Ca -0.04 1.54 -0.01 0.00 0.04 0.00 0.00 61.00 62.54 3inj s PRO 38 Cb -0.09 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 31.17 3inj s PRO 38 CO 0.01 0.45 0.02 -0.08 0.04 0.00 0.00 177.00 177.44 3inj s THR 39 N -1.19 4.35 0.00 1.26 -1.32 -0.82 -4.93 115.64 112.99 3inj s THR 39 Ca 0.42 -0.39 0.05 0.00 -1.21 0.00 0.00 61.69 60.56 3inj s THR 39 Cb -0.27 -2.90 -0.03 0.00 -1.51 0.00 0.00 72.50 67.80 3inj s THR 39 CO 0.33 0.48 -0.15 -0.69 -2.21 0.00 0.00 174.62 172.39 3inj s VAL 40 N -1.01 3.04 -0.44 5.08 1.01 -1.26 -0.70 120.40 126.13 3inj s VAL 40 Ca 0.17 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.92 3inj s VAL 40 Cb -0.12 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 34.03 3inj s VAL 40 CO 0.07 0.44 1.18 0.21 0.00 0.00 0.00 175.10 177.00 3inj s ASN 41 N -1.17 6.63 0.63 3.32 3.04 -0.40 -4.79 114.94 122.19 3inj s ASN 41 Ca 0.14 0.64 0.41 0.00 0.04 0.00 0.00 52.86 54.09 3inj s ASN 41 Cb -0.11 -2.55 2.12 0.00 -1.54 0.00 0.00 41.25 39.18 3inj s ASN 41 CO 0.04 -1.22 2.27 1.55 -3.04 0.00 0.00 177.10 176.70 3inj h PRO 42 N 9.30 0.00 0.00 0.43 0.13 -1.80 0.37 132.00 140.42 3inj h PRO 42 Ca -0.23 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.86 3inj h PRO 42 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 3inj h PRO 42 CO 1.10 0.01 -0.18 0.77 -0.23 0.00 0.00 178.00 179.48 3inj h SER 43 N 0.00 0.00 0.00 1.44 0.02 -1.89 -1.90 113.55 111.22 3inj h SER 43 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3inj h SER 43 Cb 0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.67 3inj h SER 43 CO 0.00 0.18 -0.25 0.35 -1.14 0.00 0.00 176.83 175.97 3inj n THR 44 N -3.20 0.00 -1.17 -2.27 -2.24 -0.97 -3.99 114.28 100.44 3inj n THR 44 Ca 0.02 -0.16 -0.06 0.00 -2.27 0.00 0.00 64.05 61.58 3inj n THR 44 Cb 0.52 0.69 -0.03 0.00 -2.10 0.00 0.00 70.33 69.41 3inj n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3inj n GLY 45 N 0.94 0.79 3.90 3.38 0.00 0.12 -4.37 105.19 109.96 3inj n GLY 45 Ca 0.00 -0.35 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 3inj n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3inj s GLU 46 N -2.07 3.49 0.15 1.61 2.56 -1.22 -4.87 118.70 118.36 3inj s GLU 46 Ca 0.00 -0.25 -0.31 0.00 0.00 0.00 0.00 54.97 54.41 3inj s GLU 46 Cb 0.00 -3.06 -0.08 0.00 2.00 0.00 0.00 34.13 32.99 3inj s GLU 46 CO 0.00 0.64 1.33 0.08 -0.56 0.00 0.00 175.26 176.75 3inj s VAL 47 N -1.38 3.33 -0.14 3.70 1.01 -1.26 -1.28 120.40 124.37 3inj s VAL 47 Ca 0.30 1.02 -0.18 0.00 0.00 0.00 0.00 61.98 63.12 3inj s VAL 47 Cb -0.13 -3.65 -0.25 0.00 0.00 0.00 0.00 36.38 32.36 3inj s VAL 47 CO 0.20 0.11 0.46 0.40 0.00 0.00 0.00 175.10 176.28 3inj h ILE 48 N 4.03 1.06 -1.96 2.22 2.04 -1.25 -3.46 117.51 120.18 3inj h ILE 48 Ca -0.43 -2.32 0.33 0.00 1.00 0.00 0.00 64.86 63.44 3inj h ILE 48 Cb 1.21 2.63 -0.08 0.00 -0.74 0.00 0.00 36.82 39.84 3inj h ILE 48 CO 0.81 0.59 0.87 0.00 0.00 0.00 0.00 178.15 180.42 3inj s GLN 50 N -2.13 3.93 0.00 0.00 -1.52 -1.26 -1.94 119.66 116.75 3inj s GLN 50 Ca 0.25 0.51 0.04 0.00 -1.95 0.00 0.00 55.36 54.21 3inj s GLN 50 Cb 0.01 -2.55 -0.01 0.00 -0.22 0.00 0.00 33.01 30.23 3inj s GLN 50 CO -0.01 0.24 -0.13 0.08 -0.25 0.00 0.00 175.29 175.22 3inj s VAL 51 N -1.88 1.01 0.28 1.09 1.01 0.71 -4.83 120.40 117.79 3inj s VAL 51 Ca 0.50 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 3inj s VAL 51 Cb -0.11 -0.86 -0.12 0.00 0.00 0.00 0.00 36.38 35.29 3inj s VAL 51 CO 0.19 0.22 1.62 0.00 0.00 0.00 0.00 175.10 177.13 3inj n ALA 52 N 2.59 2.60 -3.15 5.51 0.00 -0.38 -0.04 120.51 127.63 3inj n ALA 52 Ca -0.15 0.38 -0.45 0.00 0.00 0.00 0.00 53.44 53.22 3inj n ALA 52 Cb 0.55 -2.47 -0.03 0.00 0.00 0.00 0.00 19.45 17.50 3inj n ALA 52 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3inj s GLU 53 N -0.23 3.38 0.25 0.00 2.12 -0.32 -4.51 118.70 119.40 3inj s GLU 53 Ca 0.66 -1.87 -0.30 0.00 0.36 0.00 0.00 54.97 53.82 3inj s GLU 53 Cb -0.50 -4.49 -0.09 0.00 0.26 0.00 0.00 34.13 29.30 3inj s GLU 53 CO 0.46 -1.50 1.26 0.20 -0.54 0.00 0.00 175.26 175.14 3inj s GLY 54 N 3.11 2.74 0.00 -1.50 0.00 0.37 -4.79 107.32 107.25 3inj s GLY 54 Ca 0.19 1.09 0.00 0.00 0.00 0.00 0.00 44.72 46.00 3inj s GLY 54 CO -0.03 1.90 0.00 1.34 0.00 0.00 0.00 173.10 176.30 3inj n ASP 55 N 1.85 1.04 -0.15 1.64 -0.08 -1.26 -4.11 116.55 115.48 3inj n ASP 55 Ca 0.03 -0.80 -0.03 0.00 -1.51 0.00 0.00 54.79 52.48 3inj n ASP 55 Cb 0.43 0.00 0.03 0.00 2.34 0.00 0.00 41.12 43.92 3inj n ASP 55 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 3inj h LYS 56 N 0.00 -0.03 -0.27 -0.67 3.64 -1.91 -0.57 116.57 116.75 3inj h LYS 56 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 3inj h LYS 56 Cb 0.00 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3inj h LYS 56 CO 0.00 -0.02 0.07 0.93 -2.27 0.00 0.00 179.45 178.16 3inj h GLU 57 N -0.03 0.38 -0.14 1.90 5.08 -1.97 0.26 114.58 120.06 3inj h GLU 57 Ca 0.23 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.35 3inj h GLU 57 Cb 0.38 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 3inj h GLU 57 CO -0.51 0.35 -0.68 -0.44 -1.00 0.00 0.00 179.01 176.73 3inj h ASP 58 N 0.38 0.68 -0.50 1.42 3.32 -1.69 -1.77 116.42 118.27 3inj h ASP 58 Ca 0.09 -0.42 -0.06 0.00 0.02 0.00 0.00 57.03 56.67 3inj h ASP 58 Cb 0.14 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 3inj h ASP 58 CO -0.01 1.17 0.09 0.58 -1.72 0.00 0.00 179.24 179.36 3inj h VAL 59 N 0.42 1.24 -0.67 -1.35 2.07 -0.07 -1.20 116.25 116.69 3inj h VAL 59 Ca -0.02 -0.91 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 3inj h VAL 59 Cb 1.26 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 3inj h VAL 59 CO 0.13 0.33 0.33 0.44 0.02 0.00 0.00 177.57 178.82 3inj h ASP 60 N 0.83 0.87 -0.45 0.57 3.32 -0.33 0.13 116.42 121.37 3inj h ASP 60 Ca 0.17 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 3inj h ASP 60 Cb 0.36 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 3inj h ASP 60 CO 0.01 0.75 0.25 0.11 -1.72 0.00 0.00 179.24 178.63 3inj h LYS 61 N 0.92 0.62 -0.32 3.56 1.57 -1.08 -1.96 116.57 119.89 3inj h LYS 61 Ca 0.23 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3inj h LYS 61 Cb 0.11 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 3inj h LYS 61 CO -0.03 0.49 0.16 0.00 -0.57 0.00 0.00 179.45 179.50 3inj h ALA 62 N 1.10 0.41 -0.48 3.86 0.00 -0.69 -1.64 119.26 121.82 3inj h ALA 62 Ca 0.16 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3inj h ALA 62 Cb 0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3inj h ALA 62 CO -0.03 -0.04 0.10 0.28 0.00 0.00 0.00 179.25 179.56 3inj h VAL 63 N 0.38 1.24 -0.62 0.00 2.07 -0.71 0.05 116.25 118.66 3inj h VAL 63 Ca 0.11 -0.87 0.06 0.00 0.82 0.00 0.00 66.70 66.82 3inj h VAL 63 Cb 0.10 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 3inj h VAL 63 CO -0.01 0.31 0.33 0.11 0.02 0.00 0.00 177.57 178.32 3inj h LYS 64 N 0.65 0.59 -0.53 1.57 1.57 -1.24 0.71 116.57 119.89 3inj h LYS 64 Ca 0.15 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3inj h LYS 64 Cb 0.35 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 3inj h LYS 64 CO 0.00 0.39 0.17 0.00 -0.57 0.00 0.00 179.45 179.45 3inj h ALA 65 N 1.34 0.69 -0.63 3.86 0.00 -0.90 -1.53 119.26 122.08 3inj h ALA 65 Ca 0.28 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3inj h ALA 65 Cb 0.19 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3inj h ALA 65 CO -0.19 0.35 0.41 0.00 0.00 0.00 0.00 179.25 179.82 3inj h ALA 66 N 1.03 0.80 0.26 0.00 0.00 -0.54 -2.11 119.26 118.70 3inj h ALA 66 Ca 0.17 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3inj h ALA 66 Cb 0.27 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3inj h ALA 66 CO -0.01 0.25 -0.17 -0.09 0.00 0.00 0.00 179.25 179.24 3inj h ARG 67 N 0.86 -0.40 -0.85 0.00 9.65 -0.63 -2.37 114.38 120.64 3inj h ARG 67 Ca 0.23 0.03 0.15 0.00 -1.10 0.00 0.00 59.98 59.28 3inj h ARG 67 Cb -0.07 0.09 -0.09 0.00 -1.39 0.00 0.00 29.97 28.50 3inj h ARG 67 CO -0.05 -0.27 0.44 0.00 2.80 0.00 0.00 179.97 182.90 3inj h ALA 68 N 0.31 1.29 0.00 2.80 0.00 -1.18 -0.72 119.26 121.76 3inj h ALA 68 Ca -0.02 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3inj h ALA 68 Cb 0.35 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3inj h ALA 68 CO 0.02 -0.08 -0.08 0.00 0.00 0.00 0.00 179.25 179.11 3inj h ALA 69 N 1.56 1.07 -0.02 0.00 0.00 -1.08 -2.78 119.26 118.01 3inj h ALA 69 Ca 0.47 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3inj h ALA 69 Cb 0.66 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3inj h ALA 69 CO -0.36 0.09 -0.18 0.34 0.00 0.00 0.00 179.25 179.14 3inj n PHE 70 N -3.29 0.00 -1.72 0.00 7.35 -0.31 -4.44 117.46 115.06 3inj n PHE 70 Ca -0.01 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.26 3inj n PHE 70 Cb 0.28 -0.02 -0.01 0.00 0.35 0.00 0.00 39.48 40.07 3inj n PHE 70 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 3inj n GLN 71 N 0.30 2.39 -1.59 -4.13 1.13 -1.00 -4.89 117.38 109.59 3inj n GLN 71 Ca 0.13 0.84 -0.50 0.00 -1.94 0.00 0.00 57.00 55.54 3inj n GLN 71 Cb 0.46 -2.54 -0.05 0.00 0.11 0.00 0.00 30.24 28.22 3inj n GLN 71 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 3inj n LEU 72 N 1.59 1.69 0.00 1.08 7.94 -1.26 -1.22 117.00 126.81 3inj n LEU 72 Ca 0.07 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 56.10 3inj n LEU 72 Cb 0.35 -1.21 0.00 0.00 0.53 0.00 0.00 43.42 43.09 3inj n LEU 72 CO 0.63 -1.10 0.00 0.61 -1.11 0.00 0.00 177.39 176.42 3inj n GLY 73 N 2.36 1.03 3.77 -3.96 0.00 -1.26 -5.05 105.19 102.08 3inj n GLY 73 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3inj n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3inj s SER 74 N -2.82 4.64 0.30 1.61 1.04 -0.36 -4.77 113.70 113.34 3inj s SER 74 Ca 0.00 1.81 0.04 0.00 0.48 0.00 0.00 55.95 58.27 3inj s SER 74 Cb 0.00 -2.52 0.64 0.00 0.10 0.00 0.00 66.02 64.24 3inj s SER 74 CO 0.00 -1.95 1.83 -0.65 0.98 0.00 0.00 173.24 173.46 3inj h PRO 75 N -1.02 0.87 -0.33 4.02 0.11 -1.89 -0.56 132.00 133.19 3inj h PRO 75 Ca -0.44 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 65.45 3inj h PRO 75 Cb 1.23 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 3inj h PRO 75 CO 0.52 0.57 -0.46 2.35 -0.21 0.00 0.00 178.00 180.78 3inj h TRP 76 N 0.89 1.08 -0.41 0.65 2.91 -1.92 -0.87 115.95 118.29 3inj h TRP 76 Ca 0.50 -0.35 -0.14 0.00 1.13 0.00 0.00 58.89 60.03 3inj h TRP 76 Cb 0.61 -0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 29.04 3inj h TRP 76 CO -0.00 1.17 -0.31 0.00 -1.03 0.00 0.00 178.44 178.27 3inj h ARG 77 N 0.70 0.93 0.00 2.65 2.47 -1.63 -3.24 114.38 116.26 3inj h ARG 77 Ca 0.04 -0.45 -0.01 0.00 -1.26 0.00 0.00 59.98 58.29 3inj h ARG 77 Cb 1.05 -0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.37 3inj h ARG 77 CO 0.11 1.11 -0.07 0.00 0.56 0.00 0.00 179.97 181.67 3inj h ARG 78 N 0.75 0.00 -6.77 0.04 3.08 -1.09 -3.47 114.38 106.92 3inj h ARG 78 Ca 0.08 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.57 3inj h ARG 78 Cb 0.90 0.00 0.10 0.00 0.08 0.00 0.00 29.97 31.05 3inj h ARG 78 CO 0.08 0.05 0.65 -0.12 -1.07 0.00 0.00 179.97 179.56 3inj n MET 79 N -3.10 2.33 -1.77 0.04 1.56 -0.34 -4.91 117.12 110.93 3inj n MET 79 Ca 0.04 0.82 -0.40 0.00 -0.27 0.00 0.00 57.70 57.89 3inj n MET 79 Cb 0.55 -2.48 0.01 0.00 2.15 0.00 0.00 33.22 33.45 3inj n MET 79 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 3inj s ASP 80 N -0.04 6.02 0.26 6.12 1.01 -1.26 -4.87 116.67 123.91 3inj s ASP 80 Ca 0.58 3.00 -0.02 0.00 0.71 0.00 0.00 52.55 56.83 3inj s ASP 80 Cb -0.55 -2.66 0.46 0.00 1.01 0.00 0.00 42.92 41.18 3inj s ASP 80 CO 0.58 -1.09 1.83 0.00 0.21 0.00 0.00 175.17 176.70 3inj h ALA 81 N 2.56 1.34 0.00 5.23 0.00 -1.91 0.58 119.26 127.06 3inj h ALA 81 Ca -0.51 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 3inj h ALA 81 Cb 1.26 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 3inj h ALA 81 CO 0.62 0.19 -0.13 0.66 0.00 0.00 0.00 179.25 180.60 3inj h SER 82 N 0.92 0.00 0.21 0.00 4.64 -1.89 -1.75 113.55 115.67 3inj h SER 82 Ca 0.44 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.58 3inj h SER 82 Cb 0.39 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3inj h SER 82 CO -0.25 0.13 -0.70 -0.74 -0.87 0.00 0.00 176.83 174.40 3inj h HIS 83 N 0.00 0.59 -0.75 4.77 6.17 -1.25 -1.30 115.15 123.38 3inj h HIS 83 Ca -0.00 -0.25 0.07 0.00 0.71 0.00 0.00 60.37 60.90 3inj h HIS 83 Cb 0.25 -0.09 -0.05 0.00 2.52 0.00 0.00 27.41 30.04 3inj h HIS 83 CO 0.00 1.00 0.49 0.00 0.71 0.00 0.00 177.93 180.14 3inj h ARG 84 N 0.31 0.76 -0.45 5.26 3.08 -0.81 -0.05 114.38 122.49 3inj h ARG 84 Ca -0.03 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 3inj h ARG 84 Cb 1.27 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 3inj h ARG 84 CO 0.12 0.50 0.11 0.78 -1.07 0.00 0.00 179.97 180.41 3inj h GLY 85 N 0.79 0.77 0.93 0.04 0.00 -1.00 -2.11 103.07 102.49 3inj h GLY 85 Ca 0.33 -0.49 0.02 0.00 0.00 0.00 0.00 47.33 47.19 3inj h GLY 85 CO -0.11 0.45 0.41 3.21 0.00 0.00 0.00 176.54 180.50 3inj h ARG 86 N 0.59 0.79 -0.68 4.80 2.47 -0.16 -1.91 114.38 120.28 3inj h ARG 86 Ca 0.14 -0.05 -0.05 0.00 -1.26 0.00 0.00 59.98 58.76 3inj h ARG 86 Cb 0.33 -0.18 -0.03 0.00 -1.65 0.00 0.00 29.97 28.44 3inj h ARG 86 CO 0.00 0.52 0.21 -0.07 0.56 0.00 0.00 179.97 181.19 3inj h LEU 87 N 0.82 0.97 -0.57 3.04 3.38 -0.83 -0.67 115.31 121.44 3inj h LEU 87 Ca 0.25 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 3inj h LEU 87 Cb -0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 3inj h LEU 87 CO -0.08 0.91 -0.18 -0.07 0.09 0.00 0.00 178.44 179.11 3inj h LEU 88 N 1.00 0.97 -1.12 1.67 3.38 -1.18 -0.77 115.31 119.27 3inj h LEU 88 Ca 0.22 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 3inj h LEU 88 Cb 0.29 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3inj h LEU 88 CO -0.01 1.12 0.07 0.78 0.09 0.00 0.00 178.44 180.50 3inj h ASN 89 N 0.84 0.65 -0.38 -0.43 2.35 -1.07 -1.35 115.58 116.18 3inj h ASN 89 Ca 0.12 -0.12 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 3inj h ASN 89 Cb 0.74 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 3inj h ASN 89 CO 0.06 0.67 -0.01 -0.09 -1.65 0.00 0.00 177.43 176.41 3inj h ARG 90 N 0.67 0.69 -0.55 0.81 9.65 -0.87 -0.18 114.38 124.59 3inj h ARG 90 Ca 0.15 -0.23 0.01 0.00 -1.10 0.00 0.00 59.98 58.81 3inj h ARG 90 Cb 0.31 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.80 3inj h ARG 90 CO 0.00 0.79 0.35 1.25 2.80 0.00 0.00 179.97 185.17 3inj h LEU 91 N 0.51 0.60 -0.62 3.80 5.85 -0.90 -0.36 115.31 124.18 3inj h LEU 91 Ca 0.11 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 3inj h LEU 91 Cb 0.49 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 3inj h LEU 91 CO 0.02 0.43 0.31 0.00 -0.34 0.00 0.00 178.44 178.85 3inj h ALA 92 N 1.22 0.79 -0.93 1.25 0.00 -1.08 -1.26 119.26 119.25 3inj h ALA 92 Ca 0.21 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3inj h ALA 92 Cb -0.05 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.44 3inj h ALA 92 CO -0.06 0.34 0.60 -0.44 0.00 0.00 0.00 179.25 179.69 3inj h ASP 93 N 0.84 0.99 -0.42 0.00 3.32 -0.52 -0.41 116.42 120.22 3inj h ASP 93 Ca 0.21 -0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.15 3inj h ASP 93 Cb 0.10 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 3inj h ASP 93 CO -0.03 0.66 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.89 3inj h LEU 94 N 1.14 0.89 -0.40 1.55 3.38 -0.72 -2.00 115.31 119.15 3inj h LEU 94 Ca 0.38 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3inj h LEU 94 Cb 0.06 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3inj h LEU 94 CO -0.14 1.09 0.21 0.40 0.09 0.00 0.00 178.44 180.10 3inj h ILE 95 N 0.69 1.16 -0.89 1.22 2.04 -0.94 -1.64 117.51 119.14 3inj h ILE 95 Ca 0.09 -0.43 0.07 0.00 1.00 0.00 0.00 64.86 65.60 3inj h ILE 95 Cb 0.75 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 37.47 3inj h ILE 95 CO 0.06 0.17 0.55 -0.08 0.00 0.00 0.00 178.15 178.85 3inj h GLU 96 N 0.52 0.97 -0.74 2.37 4.81 -1.05 0.41 114.58 121.87 3inj h GLU 96 Ca 0.14 -0.06 0.07 0.00 -0.13 0.00 0.00 59.36 59.38 3inj h GLU 96 Cb 0.08 -0.22 -0.06 0.00 0.63 0.00 0.00 28.75 29.18 3inj h GLU 96 CO -0.02 0.64 0.43 -0.09 -0.73 0.00 0.00 179.01 179.24 3inj h ARG 97 N 1.00 0.75 -0.72 1.92 2.43 -0.92 -2.51 114.38 116.33 3inj h ARG 97 Ca 0.39 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.39 3inj h ARG 97 Cb 0.20 -0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 29.50 3inj h ARG 97 CO -0.18 0.49 0.16 -0.25 -1.51 0.00 0.00 179.97 178.68 3inj n ASP 98 N -4.74 4.91 0.03 -3.80 8.00 -0.59 -4.67 116.55 115.69 3inj n ASP 98 Ca 0.10 -3.02 -0.11 0.00 0.71 0.00 0.00 54.79 52.48 3inj n ASP 98 Cb 0.19 -0.71 -0.05 0.00 -0.02 0.00 0.00 41.12 40.53 3inj n ASP 98 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 3inj h ARG 99 N 2.94 -0.09 -0.97 -1.24 2.43 -0.49 0.12 114.38 117.08 3inj h ARG 99 Ca 0.15 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 3inj h ARG 99 Cb 2.09 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 31.61 3inj h ARG 99 CO 0.60 -0.06 0.63 1.15 -1.51 0.00 0.00 179.97 180.79 3inj h THR 100 N -0.09 1.25 0.05 0.20 2.02 -1.83 0.12 112.91 114.63 3inj h THR 100 Ca 0.04 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 66.74 3inj h THR 100 Cb 0.14 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.38 3inj h THR 100 CO -0.09 0.25 -0.02 0.22 0.37 0.00 0.00 175.52 176.24 3inj h TYR 101 N 1.32 -0.06 -0.67 3.16 3.20 -1.79 -2.73 116.97 119.40 3inj h TYR 101 Ca 0.36 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.22 3inj h TYR 101 Cb -0.13 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.12 3inj h TYR 101 CO -0.00 0.26 0.39 -0.07 -1.64 0.00 0.00 178.16 177.11 3inj h LEU 102 N -0.39 0.82 -1.19 2.82 3.38 -0.78 -0.87 115.31 119.10 3inj h LEU 102 Ca -0.01 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 3inj h LEU 102 Cb 0.35 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 3inj h LEU 102 CO 0.01 0.65 0.48 0.00 0.09 0.00 0.00 178.44 179.67 3inj h ALA 103 N 1.20 1.40 -0.13 1.53 0.00 -1.00 0.25 119.26 122.51 3inj h ALA 103 Ca 0.24 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 3inj h ALA 103 Cb -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.48 3inj h ALA 103 CO -0.04 0.53 -0.47 0.00 0.00 0.00 0.00 179.25 179.27 3inj h ALA 104 N 1.48 0.24 -0.43 0.00 0.00 -1.13 -2.22 119.26 117.19 3inj h ALA 104 Ca 0.28 -0.49 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 3inj h ALA 104 Cb -0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3inj h ALA 104 CO -0.06 0.39 0.03 1.25 0.00 0.00 0.00 179.25 180.86 3inj h LEU 105 N 0.18 0.64 0.17 0.00 5.85 -0.92 0.11 115.31 121.33 3inj h LEU 105 Ca -0.02 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.57 3inj h LEU 105 Cb 1.10 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 3inj h LEU 105 CO 0.10 0.69 -0.16 -0.08 -0.34 0.00 0.00 178.44 178.65 3inj h GLU 106 N 0.64 -0.34 -0.57 1.25 4.57 -0.43 -1.89 114.58 117.82 3inj h GLU 106 Ca 0.14 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.40 3inj h GLU 106 Cb 0.36 0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.97 3inj h GLU 106 CO 0.01 -0.23 0.28 1.15 -1.18 0.00 0.00 179.01 179.04 3inj h THR 107 N -0.35 0.91 -0.69 0.32 2.02 -1.12 -0.55 112.91 113.45 3inj h THR 107 Ca 0.00 -0.18 0.04 0.00 0.77 0.00 0.00 66.41 67.05 3inj h THR 107 Cb 0.33 0.34 -0.05 0.00 -1.74 0.00 0.00 68.15 67.04 3inj h THR 107 CO -0.04 0.09 0.41 0.25 0.37 0.00 0.00 175.52 176.61 3inj h LEU 108 N 0.52 0.65 0.00 2.58 5.85 -0.60 0.06 115.31 124.37 3inj h LEU 108 Ca 0.26 0.01 -0.25 0.00 0.84 0.00 0.00 57.88 58.75 3inj h LEU 108 Cb 0.21 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 3inj h LEU 108 CO -0.20 0.44 -1.54 -0.78 -0.34 0.00 0.00 178.44 176.01 3inj h ASP 109 N 0.79 0.00 0.00 1.25 3.58 -1.06 -3.39 116.42 117.59 3inj h ASP 109 Ca 0.29 0.00 -0.28 0.00 0.42 0.00 0.00 57.03 57.46 3inj h ASP 109 Cb 0.10 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.10 3inj h ASP 109 CO -0.14 0.88 -2.07 -3.20 -2.88 0.00 0.00 179.24 171.83 3inj n ASN 110 N -3.04 1.99 0.00 2.28 2.85 -0.24 -4.55 115.26 114.55 3inj n ASN 110 Ca -0.13 -0.06 0.00 0.00 -0.11 0.00 0.00 54.58 54.28 3inj n ASN 110 Cb 0.98 0.19 0.00 0.00 1.24 0.00 0.00 39.78 42.20 3inj n ASN 110 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3inj n GLY 111 N 2.36 2.14 3.76 8.20 0.00 -0.00 -4.49 105.19 117.17 3inj n GLY 111 Ca -0.30 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 3inj n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3inj s LYS 112 N -0.55 3.04 0.31 1.61 -2.85 -1.26 -3.90 119.74 116.14 3inj s LYS 112 Ca 0.00 1.81 -0.29 0.00 -1.00 0.00 0.00 55.97 56.49 3inj s LYS 112 Cb 0.00 -1.95 -0.13 0.00 -2.06 0.00 0.00 37.83 33.69 3inj s LYS 112 CO 0.00 -1.15 1.31 -2.30 0.10 0.00 0.00 175.35 173.31 3inj n PRO 113 N -1.52 2.04 -0.26 1.78 -0.02 -1.26 -4.45 135.00 131.31 3inj n PRO 113 Ca 0.13 0.72 -0.05 0.00 -2.02 0.00 0.00 63.50 62.28 3inj n PRO 113 Cb 0.50 -2.31 0.06 0.00 -0.02 0.00 0.00 33.50 31.72 3inj n PRO 113 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 3inj h TYR 114 N 3.03 0.92 -0.97 6.00 3.20 -1.49 0.34 116.97 128.01 3inj h TYR 114 Ca -0.45 0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.52 3inj h TYR 114 Cb 1.28 -0.31 -0.07 0.00 1.54 0.00 0.00 36.73 39.18 3inj h TYR 114 CO 0.52 0.61 0.62 0.28 -1.64 0.00 0.00 178.16 178.55 3inj h VAL 115 N 0.97 0.99 -0.13 1.81 2.07 -1.90 -0.41 116.25 119.64 3inj h VAL 115 Ca 0.26 -0.35 -0.09 0.00 0.82 0.00 0.00 66.70 67.34 3inj h VAL 115 Cb -0.06 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.59 3inj h VAL 115 CO -0.05 0.19 -0.27 0.40 0.02 0.00 0.00 177.57 177.85 3inj h ILE 116 N 1.02 1.37 -0.95 4.57 1.08 -1.72 -0.82 117.51 122.06 3inj h ILE 116 Ca 0.45 -1.54 0.21 0.00 -0.39 0.00 0.00 64.86 63.58 3inj h ILE 116 Cb 0.35 2.04 -0.12 0.00 -3.07 0.00 0.00 36.82 36.03 3inj h ILE 116 CO -0.20 0.46 0.52 0.28 -0.69 0.00 0.00 178.15 178.51 3inj h SER 117 N 0.01 0.59 0.00 1.72 0.02 -0.26 0.11 113.55 115.74 3inj h SER 117 Ca 0.00 0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 61.01 3inj h SER 117 Cb 0.87 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 3inj h SER 117 CO 0.06 0.14 -0.37 0.22 -1.14 0.00 0.00 176.83 175.74 3inj h TYR 118 N 0.58 0.00 0.00 3.45 3.20 -1.03 -0.98 116.97 122.20 3inj h TYR 118 Ca 0.58 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.37 3inj h TYR 118 Cb 1.01 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 3inj h TYR 118 CO -0.05 1.13 -0.58 -0.07 -1.64 0.00 0.00 178.16 176.95 3inj h LEU 119 N -1.00 0.00 0.00 2.82 3.38 -1.10 -3.32 115.31 116.08 3inj h LEU 119 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3inj h LEU 119 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3inj h LEU 119 CO -0.06 0.35 0.00 0.52 0.09 0.00 0.00 178.44 179.34 3inj n VAL 120 N -3.09 0.00 0.04 1.22 0.31 0.33 -4.43 118.33 112.71 3inj n VAL 120 Ca 0.00 0.30 -0.10 0.00 -0.01 0.00 0.00 64.34 64.53 3inj n VAL 120 Cb 0.69 -1.29 -0.04 0.00 -0.91 0.00 0.00 33.84 32.29 3inj n VAL 120 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3inj h ASP 121 N 0.00 -0.54 -0.30 4.52 3.32 -1.37 -0.18 116.42 121.86 3inj h ASP 121 Ca 0.00 0.08 -0.13 0.00 0.02 0.00 0.00 57.03 57.00 3inj h ASP 121 Cb 0.00 0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3inj h ASP 121 CO 0.00 -0.24 -0.29 -0.07 -1.72 0.00 0.00 179.24 176.92 3inj h LEU 122 N -0.27 0.84 -0.71 1.55 -0.00 -1.33 0.01 115.31 115.40 3inj h LEU 122 Ca 0.07 -0.34 0.00 0.00 -0.00 0.00 0.00 57.88 57.61 3inj h LEU 122 Cb 0.37 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.76 3inj h LEU 122 CO -0.20 1.08 0.45 -0.78 -0.00 0.00 0.00 178.44 178.98 3inj h ASP 123 N 0.69 0.83 0.34 -0.43 3.58 -1.62 -1.27 116.42 118.54 3inj h ASP 123 Ca 0.08 -0.04 -0.15 0.00 0.42 0.00 0.00 57.03 57.34 3inj h ASP 123 Cb 0.83 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.66 3inj h ASP 123 CO 0.07 0.63 -0.61 0.24 -2.88 0.00 0.00 179.24 176.69 3inj h MET 124 N 0.96 0.27 -0.08 0.28 2.86 -0.77 -0.95 114.93 117.51 3inj h MET 124 Ca 0.26 -0.19 -0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3inj h MET 124 Cb -0.07 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 3inj h MET 124 CO -0.05 0.80 0.04 0.28 1.06 0.00 0.00 176.91 179.03 3inj h VAL 125 N 0.20 1.11 -0.33 -2.22 2.07 -0.72 -1.08 116.25 115.27 3inj h VAL 125 Ca -0.01 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.21 3inj h VAL 125 Cb 1.12 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 3inj h VAL 125 CO 0.10 0.09 0.21 -0.07 0.02 0.00 0.00 177.57 177.92 3inj h LEU 126 N 0.01 0.38 -1.40 2.57 3.38 -1.13 -1.93 115.31 117.19 3inj h LEU 126 Ca 0.03 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3inj h LEU 126 Cb 0.11 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3inj h LEU 126 CO -0.00 0.29 0.20 0.11 0.09 0.00 0.00 178.44 179.13 3inj h LYS 127 N 0.44 0.61 0.24 1.13 1.57 -1.04 -1.54 116.57 117.96 3inj h LYS 127 Ca 0.12 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3inj h LYS 127 Cb -0.03 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.16 3inj h LYS 127 CO -0.02 0.48 -0.11 0.00 -0.57 0.00 0.00 179.45 179.22 3inj h LEU 129 N -0.67 0.81 -0.63 0.00 3.38 -1.25 -1.93 115.31 115.02 3inj h LEU 129 Ca -0.03 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 3inj h LEU 129 Cb 0.47 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3inj h LEU 129 CO 0.05 0.59 -0.09 0.03 0.09 0.00 0.00 178.44 179.11 3inj h ARG 130 N 0.96 0.98 0.07 1.13 3.08 -1.32 -1.39 114.38 117.89 3inj h ARG 130 Ca 0.26 -0.35 0.01 0.00 0.07 0.00 0.00 59.98 59.98 3inj h ARG 130 Cb -0.11 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 3inj h ARG 130 CO -0.06 1.02 -0.16 -0.92 -1.07 0.00 0.00 179.97 178.79 3inj h TYR 131 N 0.88 -0.41 0.00 3.04 3.20 -0.93 -3.00 116.97 119.76 3inj h TYR 131 Ca 0.14 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.91 3inj h TYR 131 Cb 0.64 0.17 -0.02 0.00 1.54 0.00 0.00 36.73 39.06 3inj h TYR 131 CO 0.04 -0.23 -0.52 1.88 -1.64 0.00 0.00 178.16 177.68 3inj h TYR 132 N -0.30 0.00 -0.86 -3.82 -1.99 -1.29 -2.04 116.97 106.68 3inj h TYR 132 Ca 0.03 0.00 0.11 0.00 2.00 0.00 0.00 58.73 60.87 3inj h TYR 132 Cb 0.32 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 38.99 3inj h TYR 132 CO -0.17 0.52 0.56 0.00 -0.00 0.00 0.00 178.16 179.06 3inj h ALA 133 N 1.48 1.75 0.00 3.88 0.00 -1.19 0.42 119.26 125.60 3inj h ALA 133 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3inj h ALA 133 Cb 0.98 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 3inj h ALA 133 CO 0.07 0.06 -0.11 0.78 0.00 0.00 0.00 179.25 180.05 3inj h GLY 134 N 0.76 0.00 1.58 0.00 0.00 -1.23 -2.93 103.07 101.26 3inj h GLY 134 Ca 0.41 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.67 3inj h GLY 134 CO -0.17 0.00 -0.67 1.49 0.00 0.00 0.00 176.54 177.18 3inj h TRP 135 N 0.00 0.00 -0.92 5.60 -0.00 -0.90 -3.40 115.95 116.32 3inj h TRP 135 Ca -0.00 0.00 0.27 0.00 -0.00 0.00 0.00 58.89 59.16 3inj h TRP 135 Cb 0.30 0.00 -0.15 0.00 -0.00 0.00 0.00 29.16 29.31 3inj h TRP 135 CO 0.00 0.30 0.31 0.00 -0.00 0.00 0.00 178.44 179.05 3inj h ALA 136 N 1.70 1.47 -0.37 1.49 0.00 -1.29 -0.92 119.26 121.35 3inj h ALA 136 Ca -0.04 0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 3inj h ALA 136 Cb 1.26 0.30 -0.08 0.00 0.00 0.00 0.00 17.79 19.27 3inj h ALA 136 CO 0.03 -0.52 0.02 -0.40 0.00 0.00 0.00 179.25 178.37 3inj n ASP 137 N -5.21 3.20 0.00 0.00 3.85 -1.26 -4.61 116.55 112.52 3inj n ASP 137 Ca 0.25 -3.45 0.00 0.00 -0.71 0.00 0.00 54.79 50.88 3inj n ASP 137 Cb 0.79 -0.62 0.00 0.00 -1.35 0.00 0.00 41.12 39.94 3inj n ASP 137 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3inj n LYS 138 N -0.86 0.14 -2.60 0.11 5.02 -0.35 -4.92 118.16 114.70 3inj n LYS 138 Ca 0.31 -0.49 -0.43 0.00 -2.02 0.00 0.00 58.31 55.67 3inj n LYS 138 Cb 1.04 -0.75 0.01 0.00 -0.02 0.00 0.00 35.03 35.30 3inj n LYS 138 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3inj n TYR 139 N -0.08 2.89 -2.01 2.13 9.36 -1.23 -5.01 117.16 123.21 3inj n TYR 139 Ca 0.00 -2.78 -0.38 0.00 3.32 0.00 0.00 57.90 58.06 3inj n TYR 139 Cb 0.20 -1.74 0.01 0.00 -0.63 0.00 0.00 39.34 37.19 3inj n TYR 139 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 3inj s HIS 140 N -0.59 2.59 0.00 2.98 3.76 -1.26 -4.82 115.29 117.94 3inj s HIS 140 Ca 0.37 1.44 0.00 0.00 -0.15 0.00 0.00 55.06 56.72 3inj s HIS 140 Cb 0.07 -3.62 0.00 0.00 1.11 0.00 0.00 32.58 30.14 3inj s HIS 140 CO 0.03 -2.24 0.00 0.41 -0.85 0.00 0.00 174.74 172.10 3inj n GLY 141 N 0.60 -1.09 3.29 -2.22 0.00 -1.26 -4.92 105.19 99.58 3inj n GLY 141 Ca 0.08 -1.64 -0.23 0.00 0.00 0.00 0.00 46.02 44.24 3inj n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3inj s LYS 142 N -1.86 1.13 -0.14 1.61 1.02 -1.22 -4.94 119.74 115.35 3inj s LYS 142 Ca 0.00 -1.21 -0.05 0.00 0.02 0.00 0.00 55.97 54.73 3inj s LYS 142 Cb 0.00 -1.30 -0.04 0.00 -0.52 0.00 0.00 37.83 35.98 3inj s LYS 142 CO 0.00 0.29 0.05 0.95 -0.92 0.00 0.00 175.35 175.72 3inj s THR 143 N -1.46 4.70 -0.13 2.17 -4.23 -1.26 -0.51 115.64 114.91 3inj s THR 143 Ca 0.08 -0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 3inj s THR 143 Cb -0.09 -3.06 0.02 0.00 1.34 0.00 0.00 72.50 70.72 3inj s THR 143 CO 0.05 0.54 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.91 3inj s ILE 144 N -0.28 1.41 -0.92 2.99 1.01 0.53 -4.99 121.20 120.94 3inj s ILE 144 Ca 0.08 -0.54 -0.08 0.00 0.00 0.00 0.00 60.65 60.11 3inj s ILE 144 Cb -0.12 -1.34 -0.06 0.00 0.01 0.00 0.00 42.46 40.95 3inj s ILE 144 CO 0.02 0.43 2.11 -0.81 0.00 0.00 0.00 174.94 176.68 3inj n PRO 145 N 4.74 2.06 -1.59 2.79 -0.04 -1.26 -4.07 135.00 137.63 3inj n PRO 145 Ca -0.16 -1.54 -0.34 0.00 -0.04 0.00 0.00 63.50 61.42 3inj n PRO 145 Cb 0.50 -2.53 0.07 0.00 -0.04 0.00 0.00 33.50 31.50 3inj n PRO 145 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3inj s ILE 146 N 3.59 2.72 0.61 0.52 2.07 -1.26 -4.99 121.20 124.46 3inj s ILE 146 Ca 0.43 0.35 -0.19 0.00 -1.41 0.00 0.00 60.65 59.82 3inj s ILE 146 Cb 0.11 -2.89 -0.03 0.00 0.13 0.00 0.00 42.46 39.78 3inj s ILE 146 CO -0.01 -0.19 1.28 -1.81 -1.91 0.00 0.00 174.94 172.29 3inj s ASP 147 N -2.26 4.93 0.00 4.50 1.11 -1.26 -4.82 116.67 118.88 3inj s ASP 147 Ca 0.71 2.58 0.00 0.00 0.18 0.00 0.00 52.55 56.02 3inj s ASP 147 Cb -0.25 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.12 3inj s ASP 147 CO 0.43 -1.78 0.00 0.61 1.18 0.00 0.00 175.17 175.61 3inj n GLY 148 N 0.75 -2.78 2.94 0.21 0.00 -1.26 -4.55 105.19 100.50 3inj n GLY 148 Ca 0.14 -1.71 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 3inj n GLY 148 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3inj n ASP 149 N -0.42 4.77 -4.03 1.61 8.00 -1.26 -4.72 116.55 120.50 3inj n ASP 149 Ca 0.00 -3.01 -0.08 0.00 0.71 0.00 0.00 54.79 52.41 3inj n ASP 149 Cb 0.00 -1.55 -0.10 0.00 -0.02 0.00 0.00 41.12 39.44 3inj n ASP 149 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3inj s PHE 150 N 1.51 0.38 -0.21 1.24 0.40 -1.26 -1.47 117.98 118.56 3inj s PHE 150 Ca 0.43 -0.79 -0.05 0.00 -0.60 0.00 0.00 56.93 55.92 3inj s PHE 150 Cb 0.09 -0.28 -0.02 0.00 0.51 0.00 0.00 43.02 43.32 3inj s PHE 150 CO -0.02 -0.29 -0.01 0.12 0.70 0.00 0.00 175.22 175.72 3inj s PHE 151 N -2.72 3.01 -0.06 0.36 5.36 0.86 -4.80 117.98 119.99 3inj s PHE 151 Ca -0.04 -0.64 0.04 0.00 -0.96 0.00 0.00 56.93 55.32 3inj s PHE 151 Cb -0.01 -2.11 0.00 0.00 -0.34 0.00 0.00 43.02 40.57 3inj s PHE 151 CO -0.06 -0.38 -0.17 0.45 -1.46 0.00 0.00 175.22 173.61 3inj s SER 152 N 1.25 2.22 0.15 6.13 0.15 -1.26 0.32 113.70 122.67 3inj s SER 152 Ca 0.03 -0.37 -0.08 0.00 0.70 0.00 0.00 55.95 56.23 3inj s SER 152 Cb -0.15 -0.76 -0.01 0.00 -1.71 0.00 0.00 66.02 63.39 3inj s SER 152 CO 0.00 0.13 0.24 -0.72 1.20 0.00 0.00 173.24 174.10 3inj s TYR 153 N 0.21 0.43 -0.01 3.44 -0.85 -0.47 -0.35 117.35 119.74 3inj s TYR 153 Ca -0.08 -0.80 0.05 0.00 -0.52 0.00 0.00 57.07 55.71 3inj s TYR 153 Cb -0.13 -0.11 -0.03 0.00 0.38 0.00 0.00 41.96 42.07 3inj s TYR 153 CO 0.03 -0.67 -0.14 0.95 -1.52 0.00 0.00 175.55 174.20 3inj s THR 154 N -3.97 3.09 -0.16 -3.49 -4.23 0.33 -0.20 115.64 107.01 3inj s THR 154 Ca 0.17 -0.87 -0.08 0.00 -1.18 0.00 0.00 61.69 59.73 3inj s THR 154 Cb 0.04 -2.26 -0.04 0.00 1.34 0.00 0.00 72.50 71.58 3inj s THR 154 CO -0.01 0.48 0.10 -0.13 -0.54 0.00 0.00 174.62 174.51 3inj s ARG 155 N -1.07 3.80 -0.65 3.99 0.52 0.70 -3.37 118.95 122.87 3inj s ARG 155 Ca 0.13 -0.26 -0.18 0.00 -0.52 0.00 0.00 55.73 54.90 3inj s ARG 155 Cb -0.11 -3.23 0.12 0.00 0.52 0.00 0.00 34.95 32.26 3inj s ARG 155 CO 0.03 0.46 0.75 -1.01 0.02 0.00 0.00 175.30 175.55 3inj s HIS 156 N -0.13 3.09 0.42 -0.53 3.76 -1.26 -1.32 115.29 119.33 3inj s HIS 156 Ca 0.09 -1.12 0.03 0.00 -0.15 0.00 0.00 55.06 53.90 3inj s HIS 156 Cb -0.12 -4.02 -0.00 0.00 1.11 0.00 0.00 32.58 29.55 3inj s HIS 156 CO 0.01 -1.28 0.61 -1.21 -0.85 0.00 0.00 174.74 172.02 3inj s GLU 157 N 2.40 3.05 0.62 1.40 2.02 0.17 -4.88 118.70 123.48 3inj s GLU 157 Ca 0.14 -0.69 -0.16 0.00 0.02 0.00 0.00 54.97 54.28 3inj s GLU 157 Cb -0.21 -2.64 -0.02 0.00 0.10 0.00 0.00 34.13 31.36 3inj s GLU 157 CO 0.03 -0.18 1.11 -2.14 0.02 0.00 0.00 175.26 174.10 3inj s PRO 158 N -4.44 3.01 0.27 0.39 0.02 -1.26 0.15 135.00 133.15 3inj s PRO 158 Ca 0.48 1.45 0.12 0.00 0.02 0.00 0.00 61.00 63.07 3inj s PRO 158 Cb -0.10 -1.97 0.30 0.00 0.02 0.00 0.00 34.50 32.75 3inj s PRO 158 CO 0.36 -1.09 1.56 -0.24 -0.33 0.00 0.00 177.00 177.26 3inj h VAL 159 N 0.44 1.31 0.00 3.83 3.04 -1.75 -3.37 116.25 119.75 3inj h VAL 159 Ca -0.48 -2.23 0.00 0.00 -1.01 0.00 0.00 66.70 62.98 3inj h VAL 159 Cb 1.25 2.25 0.00 0.00 -2.01 0.00 0.00 31.29 32.78 3inj h VAL 159 CO 0.55 0.61 0.00 0.61 -1.01 0.00 0.00 177.57 178.33 3inj n GLY 160 N 0.54 0.23 3.60 3.17 0.00 -1.26 -4.86 105.19 106.61 3inj n GLY 160 Ca -0.00 -1.32 -0.43 0.00 0.00 0.00 0.00 46.02 44.26 3inj n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3inj s VAL 161 N 0.00 4.22 -0.26 1.61 1.01 -1.26 -2.06 120.40 123.66 3inj s VAL 161 Ca 0.00 1.24 -0.09 0.00 0.00 0.00 0.00 61.98 63.13 3inj s VAL 161 Cb 0.00 -4.60 -0.04 0.00 0.00 0.00 0.00 36.38 31.74 3inj s VAL 161 CO 0.00 -0.99 0.13 0.00 0.00 0.00 0.00 175.10 174.24 3inj s GLY 163 N 1.68 1.97 -0.16 0.00 0.00 0.10 -1.15 107.32 109.76 3inj s GLY 163 Ca 0.07 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.49 3inj s GLY 163 CO 0.07 1.38 -0.13 1.20 0.00 0.00 0.00 173.10 175.62 3inj s GLN 164 N 2.12 2.22 -0.24 2.90 -0.21 -0.46 -0.37 119.66 125.61 3inj s GLN 164 Ca 0.29 -0.62 -0.04 0.00 0.02 0.00 0.00 55.36 55.01 3inj s GLN 164 Cb -0.16 -2.17 0.00 0.00 1.00 0.00 0.00 33.01 31.68 3inj s GLN 164 CO 0.10 -0.28 -0.02 0.42 -2.12 0.00 0.00 175.29 173.39 3inj s ILE 165 N 1.47 3.41 0.18 1.08 1.01 -0.27 -0.47 121.20 127.60 3inj s ILE 165 Ca 0.04 -0.64 0.09 0.00 0.00 0.00 0.00 60.65 60.14 3inj s ILE 165 Cb -0.14 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 3inj s ILE 165 CO -0.10 0.30 -0.12 0.27 0.00 0.00 0.00 174.94 175.29 3inj s ILE 166 N 1.45 3.04 0.51 2.92 -4.36 -0.71 -2.27 121.20 121.78 3inj s ILE 166 Ca 0.04 -1.70 -0.02 0.00 -0.26 0.00 0.00 60.65 58.71 3inj s ILE 166 Cb -0.15 -2.49 0.10 0.00 1.25 0.00 0.00 42.46 41.17 3inj s ILE 166 CO -0.02 -0.10 0.70 -0.81 0.24 0.00 0.00 174.94 174.95 3inj n PRO 167 N 0.13 -0.02 0.00 0.37 -0.04 -1.25 -3.14 135.00 131.05 3inj n PRO 167 Ca -0.11 -1.75 0.11 0.00 -0.04 0.00 0.00 63.50 61.70 3inj n PRO 167 Cb 0.55 -0.51 -0.04 0.00 -0.04 0.00 0.00 33.50 33.46 3inj n PRO 167 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3inj n TRP 168 N -2.49 0.00 0.06 0.54 4.27 -1.26 -4.36 117.44 114.20 3inj n TRP 168 Ca 0.11 0.00 -0.17 0.00 -3.89 0.00 0.00 57.50 53.55 3inj n TRP 168 Cb 0.39 -0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.26 3inj n TRP 168 CO 0.00 0.00 0.00 -2.95 -2.29 0.00 0.00 177.69 172.45 3inj h ASN 169 N 1.72 0.71 -2.76 -0.67 -1.07 -1.96 -3.35 115.58 108.18 3inj h ASN 169 Ca 0.00 -0.58 -0.60 0.00 0.07 0.00 0.00 56.30 55.18 3inj h ASN 169 Cb 0.68 -0.22 -0.40 0.00 -2.07 0.00 0.00 38.32 36.32 3inj h ASN 169 CO 0.00 1.39 -0.80 -0.36 0.07 0.00 0.00 177.43 177.73 3inj s PHE 170 N -3.23 2.11 0.12 4.14 0.40 -1.26 -5.03 117.98 115.22 3inj s PHE 170 Ca -0.08 -2.70 -0.16 0.00 -0.60 0.00 0.00 56.93 53.39 3inj s PHE 170 Cb 0.08 -1.69 -0.03 0.00 0.51 0.00 0.00 43.02 41.89 3inj s PHE 170 CO 0.90 -0.72 1.59 -1.35 0.70 0.00 0.00 175.22 176.34 3inj h PRO 171 N 5.69 0.60 0.02 0.24 0.11 -1.76 0.21 132.00 137.11 3inj h PRO 171 Ca 0.19 -0.16 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 3inj h PRO 171 Cb 0.85 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.90 3inj h PRO 171 CO 0.51 0.67 -0.01 -0.07 -0.21 0.00 0.00 178.00 178.89 3inj h LEU 172 N 0.44 -0.03 -0.92 2.35 3.38 -1.93 -2.92 115.31 115.68 3inj h LEU 172 Ca 0.11 -0.52 0.01 0.00 0.09 0.00 0.00 57.88 57.57 3inj h LEU 172 Cb 0.36 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 3inj h LEU 172 CO 0.01 0.52 0.61 0.25 0.09 0.00 0.00 178.44 179.91 3inj h LEU 173 N -0.58 1.05 -1.13 1.67 5.85 -1.83 -1.14 115.31 119.20 3inj h LEU 173 Ca -0.00 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 3inj h LEU 173 Cb 0.54 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 3inj h LEU 173 CO 0.01 0.75 0.00 0.24 -0.34 0.00 0.00 178.44 179.10 3inj h MET 174 N 1.23 0.61 -0.42 1.25 2.86 -1.04 0.89 114.93 120.32 3inj h MET 174 Ca 0.34 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.82 3inj h MET 174 Cb -0.12 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.43 3inj h MET 174 CO -0.08 0.63 0.20 0.37 1.06 0.00 0.00 176.91 179.09 3inj h GLN 175 N 0.58 0.61 -0.61 1.72 4.15 -1.09 -2.42 115.11 118.05 3inj h GLN 175 Ca 0.12 -0.09 -0.04 0.00 0.77 0.00 0.00 58.65 59.41 3inj h GLN 175 Cb 0.36 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.92 3inj h GLN 175 CO 0.01 0.53 0.22 0.00 -1.93 0.00 0.00 178.83 177.67 3inj h ALA 176 N 1.04 0.80 -0.59 3.38 0.00 -0.65 -0.03 119.26 123.21 3inj h ALA 176 Ca 0.14 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.95 3inj h ALA 176 Cb 0.13 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3inj h ALA 176 CO -0.02 0.44 0.40 -1.49 0.00 0.00 0.00 179.25 178.57 3inj h TRP 177 N 0.86 0.49 0.07 0.00 4.06 -0.67 -1.35 115.95 119.41 3inj h TRP 177 Ca 0.20 0.01 -0.23 0.00 2.06 0.00 0.00 58.89 60.93 3inj h TRP 177 Cb 0.24 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.23 3inj h TRP 177 CO 0.01 0.25 -1.20 0.87 -3.56 0.00 0.00 178.44 174.81 3inj h LYS 178 N 0.47 0.16 -0.34 0.49 1.79 -1.08 -3.40 116.57 114.65 3inj h LYS 178 Ca 0.27 -0.27 -0.12 0.00 -2.18 0.00 0.00 60.65 58.34 3inj h LYS 178 Cb 0.43 0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.17 3inj h LYS 178 CO -0.08 1.13 -0.28 -0.07 -1.08 0.00 0.00 179.45 179.07 3inj h LEU 179 N -0.54 0.74 0.24 2.94 3.38 -0.91 -3.05 115.31 118.11 3inj h LEU 179 Ca -0.28 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.40 3inj h LEU 179 Cb 1.57 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 3inj h LEU 179 CO -0.01 0.99 -0.40 1.23 0.09 0.00 0.00 178.44 180.33 3inj h GLY 180 N 0.97 -1.16 1.04 0.83 0.00 -1.46 -0.42 103.07 102.88 3inj h GLY 180 Ca 0.08 0.58 -0.09 0.00 0.00 0.00 0.00 47.33 47.89 3inj h GLY 180 CO 0.07 -0.33 -0.05 -2.55 0.00 0.00 0.00 176.54 173.68 3inj h PRO 181 N -0.68 0.95 -0.50 4.80 0.11 -1.77 -1.20 132.00 133.70 3inj h PRO 181 Ca -0.03 -0.32 -0.04 0.00 0.11 0.00 0.00 66.00 65.72 3inj h PRO 181 Cb 0.63 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.65 3inj h PRO 181 CO -0.14 0.99 0.18 0.00 -0.21 0.00 0.00 178.00 178.81 3inj h ALA 182 N 0.93 0.66 0.04 -0.75 0.00 -1.47 -2.58 119.26 116.09 3inj h ALA 182 Ca 0.14 -0.17 -0.25 0.00 0.00 0.00 0.00 54.91 54.63 3inj h ALA 182 Cb 0.59 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.20 3inj h ALA 182 CO 0.04 0.30 -1.01 -0.07 0.00 0.00 0.00 179.25 178.50 3inj h LEU 183 N 0.68 0.82 -1.56 0.00 3.38 -1.10 0.70 115.31 118.22 3inj h LEU 183 Ca 0.17 -0.78 0.21 0.00 0.09 0.00 0.00 57.88 57.57 3inj h LEU 183 Cb 0.24 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 3inj h LEU 183 CO -0.01 1.50 0.60 0.00 0.09 0.00 0.00 178.44 180.61 3inj h ALA 184 N 0.34 2.27 -0.53 1.53 0.00 -1.15 -1.05 119.26 120.66 3inj h ALA 184 Ca -0.14 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3inj h ALA 184 Cb 1.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.46 3inj h ALA 184 CO 0.20 -0.55 0.00 0.25 0.00 0.00 0.00 179.25 179.15 3inj n THR 185 N -4.49 0.75 -0.49 0.00 -2.24 -0.98 -4.22 114.28 102.61 3inj n THR 185 Ca 0.19 -0.87 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 3inj n THR 185 Cb 0.72 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 3inj n THR 185 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3inj n GLY 186 N 1.47 0.70 3.91 3.38 0.00 -0.40 -4.12 105.19 110.14 3inj n GLY 186 Ca 0.21 -0.45 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 3inj n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3inj s ASN 187 N -2.41 5.20 0.19 1.61 0.01 0.22 -4.82 114.94 114.94 3inj s ASN 187 Ca 0.00 0.74 0.08 0.00 -0.71 0.00 0.00 52.86 52.96 3inj s ASN 187 Cb 0.00 -1.53 -0.04 0.00 0.41 0.00 0.00 41.25 40.09 3inj s ASN 187 CO 0.00 -1.38 0.01 0.68 -1.51 0.00 0.00 177.10 174.90 3inj s VAL 188 N -3.22 3.70 -0.06 1.60 -7.23 -0.87 -4.59 120.40 109.73 3inj s VAL 188 Ca 0.58 -1.50 0.02 0.00 -1.81 0.00 0.00 61.98 59.27 3inj s VAL 188 Cb -0.11 -2.89 0.01 0.00 0.56 0.00 0.00 36.38 33.96 3inj s VAL 188 CO 0.47 -0.16 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.28 3inj s VAL 189 N -1.84 1.15 -0.32 1.32 1.01 0.98 -0.66 120.40 122.04 3inj s VAL 189 Ca 0.28 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.77 3inj s VAL 189 Cb -0.09 -1.05 0.08 0.00 0.00 0.00 0.00 36.38 35.32 3inj s VAL 189 CO 0.19 0.36 0.02 -0.69 0.00 0.00 0.00 175.10 174.97 3inj s VAL 190 N 0.57 2.65 -0.10 2.92 1.01 -0.30 -0.28 120.40 126.88 3inj s VAL 190 Ca -0.13 -1.80 -0.01 0.00 0.00 0.00 0.00 61.98 60.04 3inj s VAL 190 Cb -0.15 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 3inj s VAL 190 CO 0.04 -0.31 -0.05 -0.32 0.00 0.00 0.00 175.10 174.46 3inj s MET 191 N 1.11 3.06 -0.22 2.72 1.75 0.67 -1.36 119.30 127.02 3inj s MET 191 Ca 0.00 -0.51 -0.05 0.00 -1.25 0.00 0.00 55.69 53.88 3inj s MET 191 Cb -0.20 -2.72 -0.02 0.00 2.84 0.00 0.00 34.83 34.73 3inj s MET 191 CO -0.04 0.55 -0.01 0.21 -0.65 0.00 0.00 175.02 175.08 3inj s LYS 192 N -0.50 3.48 0.23 4.11 2.36 0.38 -0.37 119.74 129.42 3inj s LYS 192 Ca 0.08 -0.58 0.01 0.00 -2.55 0.00 0.00 55.97 52.93 3inj s LYS 192 Cb -0.12 -3.08 -0.04 0.00 -1.05 0.00 0.00 37.83 33.55 3inj s LYS 192 CO 0.02 -0.15 0.41 0.14 1.55 0.00 0.00 175.35 177.32 3inj s VAL 193 N 1.39 5.21 0.26 4.02 -7.23 -1.26 -1.75 120.40 121.05 3inj s VAL 193 Ca 0.05 -0.53 -0.30 0.00 -1.81 0.00 0.00 61.98 59.39 3inj s VAL 193 Cb -0.14 -3.78 -0.10 0.00 0.56 0.00 0.00 36.38 32.92 3inj s VAL 193 CO -0.01 -0.27 1.38 0.00 -0.31 0.00 0.00 175.10 175.90 3inj s ALA 194 N -1.96 3.58 0.59 1.32 0.00 -1.19 -4.25 121.76 119.85 3inj s ALA 194 Ca 0.38 1.27 0.41 0.00 0.00 0.00 0.00 51.96 54.02 3inj s ALA 194 Cb -0.10 -3.52 2.22 0.00 0.00 0.00 0.00 23.12 21.71 3inj s ALA 194 CO 0.30 -0.68 2.31 1.05 0.00 0.00 0.00 175.76 178.74 3inj h GLU 195 N 4.70 0.00 0.00 0.00 4.11 -1.93 -0.60 114.58 120.86 3inj h GLU 195 Ca -0.46 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 58.88 3inj h GLU 195 Cb 1.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 3inj h GLU 195 CO 0.75 0.01 -0.39 1.96 0.07 0.00 0.00 179.01 181.40 3inj h GLN 196 N 0.00 0.00 -1.23 1.06 7.50 -1.95 -3.40 115.11 117.08 3inj h GLN 196 Ca -0.00 0.00 -0.39 0.00 0.50 0.00 0.00 58.65 58.76 3inj h GLN 196 Cb 0.06 0.00 -0.31 0.00 0.05 0.00 0.00 27.48 27.28 3inj h GLN 196 CO 0.00 0.39 -0.92 0.25 -1.50 0.00 0.00 178.83 177.05 3inj n THR 197 N -3.28 -0.06 0.15 -0.54 -2.24 -0.27 -4.68 114.28 103.37 3inj n THR 197 Ca 0.02 -3.41 0.10 0.00 -2.27 0.00 0.00 64.05 58.49 3inj n THR 197 Cb 0.63 0.40 0.07 0.00 -2.10 0.00 0.00 70.33 69.34 3inj n THR 197 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3inj h PRO 198 N 2.98 0.00 0.07 -0.78 0.13 -1.69 -3.41 132.00 129.30 3inj h PRO 198 Ca 0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3inj h PRO 198 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3inj h PRO 198 CO 0.36 0.08 -0.03 -0.07 -0.23 0.00 0.00 178.00 178.11 3inj h LEU 199 N 0.00 -0.08 -1.24 1.56 3.38 -1.90 -2.85 115.31 114.19 3inj h LEU 199 Ca -0.01 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 3inj h LEU 199 Cb 1.09 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 3inj h LEU 199 CO 0.01 0.07 -0.18 0.71 0.09 0.00 0.00 178.44 179.15 3inj h THR 200 N -0.23 1.22 -0.25 0.22 1.35 -1.89 -2.44 112.91 110.88 3inj h THR 200 Ca -0.01 -0.98 -0.12 0.00 -0.55 0.00 0.00 66.41 64.75 3inj h THR 200 Cb 0.20 1.27 -0.01 0.00 -1.73 0.00 0.00 68.15 67.88 3inj h THR 200 CO 0.02 0.30 -0.35 0.00 -0.25 0.00 0.00 175.52 175.24 3inj h ALA 201 N 1.54 0.92 -0.49 6.62 0.00 -1.82 -2.45 119.26 123.57 3inj h ALA 201 Ca 0.05 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 54.44 3inj h ALA 201 Cb 0.48 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3inj h ALA 201 CO 0.03 0.62 -0.11 -0.07 0.00 0.00 0.00 179.25 179.73 3inj h LEU 202 N 0.47 0.95 -0.99 0.00 3.38 -1.22 -2.02 115.31 115.87 3inj h LEU 202 Ca 0.05 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 3inj h LEU 202 Cb 0.84 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 3inj h LEU 202 CO 0.07 1.09 0.55 0.22 0.09 0.00 0.00 178.44 180.45 3inj h TYR 203 N 0.80 1.21 0.00 1.13 3.20 -1.36 -1.78 116.97 120.17 3inj h TYR 203 Ca 0.13 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 3inj h TYR 203 Cb 0.66 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 3inj h TYR 203 CO 0.05 0.80 -0.26 0.28 -1.64 0.00 0.00 178.16 177.39 3inj h VAL 204 N 1.26 1.17 -0.58 1.81 2.07 -1.25 -0.03 116.25 120.69 3inj h VAL 204 Ca 0.33 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 3inj h VAL 204 Cb -0.05 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 3inj h VAL 204 CO -0.06 0.26 0.34 0.00 0.02 0.00 0.00 177.57 178.12 3inj h ALA 205 N 1.74 1.50 -0.32 1.67 0.00 -0.58 0.33 119.26 123.60 3inj h ALA 205 Ca -0.00 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 3inj h ALA 205 Cb 0.47 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3inj h ALA 205 CO 0.03 0.43 -0.15 -0.97 0.00 0.00 0.00 179.25 178.59 3inj h ASN 206 N 0.80 0.56 0.48 0.00 -1.24 -0.65 -1.77 115.58 113.77 3inj h ASN 206 Ca 0.21 -0.16 -0.16 0.00 0.71 0.00 0.00 56.30 56.89 3inj h ASN 206 Cb -0.01 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 38.87 3inj h ASN 206 CO -0.04 0.74 -0.71 -0.07 -1.29 0.00 0.00 177.43 176.06 3inj h LEU 207 N 0.52 0.23 -0.20 0.34 3.38 -0.51 -2.02 115.31 117.05 3inj h LEU 207 Ca 0.09 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3inj h LEU 207 Cb 0.57 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3inj h LEU 207 CO 0.04 0.86 0.13 0.40 0.09 0.00 0.00 178.44 179.96 3inj h ILE 208 N 0.13 1.07 0.07 1.22 2.04 -0.10 0.33 117.51 122.28 3inj h ILE 208 Ca -0.02 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.71 3inj h ILE 208 Cb 1.26 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 38.10 3inj h ILE 208 CO 0.11 0.07 -0.37 0.50 0.00 0.00 0.00 178.15 178.46 3inj h LYS 209 N 0.26 -0.55 -0.69 2.37 3.64 -1.30 -2.64 116.57 117.66 3inj h LYS 209 Ca 0.07 0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.58 3inj h LYS 209 Cb 0.00 0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 3inj h LYS 209 CO -0.01 -0.36 0.46 1.49 -2.27 0.00 0.00 179.45 178.75 3inj h GLU 210 N -0.57 0.56 0.00 1.90 4.81 -1.05 -1.59 114.58 118.64 3inj h GLU 210 Ca 0.04 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3inj h GLU 210 Cb 0.62 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 3inj h GLU 210 CO -0.25 0.37 -0.06 0.00 -0.73 0.00 0.00 179.01 178.34 3inj h ALA 211 N 1.65 1.02 0.00 2.92 0.00 0.02 -3.47 119.26 121.39 3inj h ALA 211 Ca 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3inj h ALA 211 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3inj h ALA 211 CO -0.11 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.63 3inj n GLY 212 N 0.05 1.13 3.74 0.00 0.00 -0.60 -4.88 105.19 104.62 3inj n GLY 212 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3inj n GLY 212 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3inj s PHE 213 N -2.00 3.21 0.53 1.61 0.40 -1.12 -4.96 117.98 115.65 3inj s PHE 213 Ca 0.00 1.19 -0.22 0.00 -0.60 0.00 0.00 56.93 57.30 3inj s PHE 213 Cb 0.00 -3.64 -0.06 0.00 0.51 0.00 0.00 43.02 39.83 3inj s PHE 213 CO 0.00 -2.02 1.35 -2.30 0.70 0.00 0.00 175.22 172.94 3inj n PRO 214 N 2.50 1.74 -1.72 0.24 -0.02 -1.26 -4.77 135.00 131.72 3inj n PRO 214 Ca 0.06 0.64 -0.42 0.00 -2.02 0.00 0.00 63.50 61.75 3inj n PRO 214 Cb 0.42 -2.55 -0.01 0.00 -0.02 0.00 0.00 33.50 31.34 3inj n PRO 214 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3inj n PRO 215 N -0.84 2.31 0.00 0.52 -0.02 -1.26 -2.19 135.00 133.52 3inj n PRO 215 Ca 0.10 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3inj n PRO 215 Cb 0.44 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 3inj n PRO 215 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3inj n GLY 216 N 1.08 1.43 0.26 -1.23 0.00 -1.26 -4.74 105.19 100.73 3inj n GLY 216 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 3inj n GLY 216 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3inj h VAL 217 N 0.00 1.27 -3.18 1.61 2.07 -1.75 -3.33 116.25 112.95 3inj h VAL 217 Ca 0.00 -1.47 -0.56 0.00 0.82 0.00 0.00 66.70 65.50 3inj h VAL 217 Cb 0.00 1.31 -0.37 0.00 -1.52 0.00 0.00 31.29 30.71 3inj h VAL 217 CO 0.00 0.49 -0.81 -0.69 0.02 0.00 0.00 177.57 176.58 3inj s VAL 218 N -4.51 1.25 -0.06 2.57 1.01 -1.26 -0.02 120.40 119.38 3inj s VAL 218 Ca -0.11 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.46 3inj s VAL 218 Cb 0.11 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 35.24 3inj s VAL 218 CO 0.87 0.37 -0.24 0.20 0.00 0.00 0.00 175.10 176.30 3inj s ASN 219 N 1.61 3.17 -0.11 3.32 0.01 0.62 -4.66 114.94 118.90 3inj s ASN 219 Ca 0.04 -0.48 0.03 0.00 -0.71 0.00 0.00 52.86 51.74 3inj s ASN 219 Cb -0.13 -0.86 0.01 0.00 0.41 0.00 0.00 41.25 40.68 3inj s ASN 219 CO -0.09 0.25 -0.20 -0.63 -1.51 0.00 0.00 177.10 174.92 3inj s ILE 220 N -0.19 1.85 -0.43 0.60 1.01 0.29 -0.24 121.20 124.10 3inj s ILE 220 Ca -0.03 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.78 3inj s ILE 220 Cb -0.14 -1.64 0.12 0.00 0.01 0.00 0.00 42.46 40.81 3inj s ILE 220 CO 0.03 0.51 0.17 -0.69 0.00 0.00 0.00 174.94 174.96 3inj s VAL 221 N 0.71 2.58 0.59 2.92 1.01 0.50 -1.36 120.40 127.34 3inj s VAL 221 Ca -0.11 -2.73 -0.19 0.00 0.00 0.00 0.00 61.98 58.95 3inj s VAL 221 Cb -0.16 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 3inj s VAL 221 CO 0.02 -0.70 1.22 -2.84 0.00 0.00 0.00 175.10 172.80 3inj s PRO 222 N 0.41 2.96 0.00 2.72 0.02 -1.26 -3.98 135.00 135.87 3inj s PRO 222 Ca 0.13 1.87 0.00 0.00 0.02 0.00 0.00 61.00 63.02 3inj s PRO 222 Cb -0.22 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.35 3inj s PRO 222 CO -0.04 -1.23 0.00 0.41 -0.33 0.00 0.00 177.00 175.81 3inj n GLY 223 N 0.56 1.12 3.86 0.52 0.00 -1.26 -0.48 105.19 109.51 3inj n GLY 223 Ca 0.14 -1.32 -0.30 0.00 0.00 0.00 0.00 46.02 44.53 3inj n GLY 223 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3inj s PHE 224 N -1.91 3.28 0.01 1.61 2.99 -1.26 -4.31 117.98 118.38 3inj s PHE 224 Ca 0.00 1.16 -0.25 0.00 0.00 0.00 0.00 56.93 57.84 3inj s PHE 224 Cb 0.00 -2.98 -0.16 0.00 0.00 0.00 0.00 43.02 39.88 3inj s PHE 224 CO 0.00 -1.19 1.21 0.78 -0.00 0.00 0.00 175.22 176.02 3inj h GLY 225 N -0.67 -0.50 1.33 4.36 0.00 -1.95 -1.23 103.07 104.41 3inj h GLY 225 Ca -0.45 0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.09 3inj h GLY 225 CO 0.62 -0.18 0.31 -2.55 0.00 0.00 0.00 176.54 174.73 3inj h PRO 226 N -0.82 0.00 0.00 4.80 0.11 -1.95 -0.81 132.00 133.33 3inj h PRO 226 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.06 3inj h PRO 226 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 3inj h PRO 226 CO 0.08 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.12 3inj n THR 227 N -3.14 0.00 0.40 -1.15 -2.24 -1.19 -4.45 114.28 102.51 3inj n THR 227 Ca -0.00 0.21 -0.17 0.00 -2.27 0.00 0.00 64.05 61.82 3inj n THR 227 Cb 0.39 -1.17 -0.09 0.00 -2.10 0.00 0.00 70.33 67.36 3inj n THR 227 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3inj h ALA 228 N -1.59 -1.01 -0.87 6.98 0.00 -1.33 -2.10 119.26 119.33 3inj h ALA 228 Ca 0.00 -0.23 0.14 0.00 0.00 0.00 0.00 54.91 54.81 3inj h ALA 228 Cb 0.00 0.39 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 3inj h ALA 228 CO 0.00 -1.00 0.56 0.78 0.00 0.00 0.00 179.25 179.59 3inj h GLY 229 N -1.15 1.16 1.13 0.00 0.00 -1.34 -1.45 103.07 101.42 3inj h GLY 229 Ca -0.10 -0.30 -0.20 0.00 0.00 0.00 0.00 47.33 46.73 3inj h GLY 229 CO 0.17 0.10 -0.67 0.00 0.00 0.00 0.00 176.54 176.14 3inj h ALA 230 N 1.60 0.34 -0.50 3.60 0.00 -1.16 -2.16 119.26 120.98 3inj h ALA 230 Ca 0.43 -0.56 0.05 0.00 0.00 0.00 0.00 54.91 54.83 3inj h ALA 230 Cb 0.68 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 3inj h ALA 230 CO -0.19 0.64 0.24 0.00 0.00 0.00 0.00 179.25 179.93 3inj h ALA 231 N 0.58 0.64 0.27 0.00 0.00 -0.58 -1.68 119.26 118.48 3inj h ALA 231 Ca -0.03 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3inj h ALA 231 Cb 1.30 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 3inj h ALA 231 CO 0.14 -0.13 -0.24 0.82 0.00 0.00 0.00 179.25 179.84 3inj h ILE 232 N 0.46 0.48 0.00 0.00 2.04 -1.26 -0.99 117.51 118.25 3inj h ILE 232 Ca 0.23 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.08 3inj h ILE 232 Cb 0.17 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 3inj h ILE 232 CO -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 177.95 3inj h ALA 233 N 0.12 1.94 -0.28 1.87 0.00 -1.07 -2.56 119.26 119.28 3inj h ALA 233 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3inj h ALA 233 Cb 0.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3inj h ALA 233 CO -0.04 0.03 0.00 -1.13 0.00 0.00 0.00 179.25 178.11 3inj n SER 234 N -4.48 2.80 -4.77 0.00 3.41 -0.66 -3.78 113.62 106.14 3inj n SER 234 Ca -0.03 -1.85 -0.41 0.00 -0.26 0.00 0.00 58.87 56.33 3inj n SER 234 Cb 0.11 -0.18 -0.01 0.00 -0.26 0.00 0.00 64.21 63.86 3inj n SER 234 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3inj s HIS 235 N -1.07 2.93 -1.16 7.33 5.04 -0.38 -4.79 115.29 123.20 3inj s HIS 235 Ca 0.25 1.37 0.29 0.00 -1.54 0.00 0.00 55.06 55.43 3inj s HIS 235 Cb 0.14 -3.74 1.30 0.00 0.04 0.00 0.00 32.58 30.33 3inj s HIS 235 CO 0.19 -2.08 1.94 -1.91 -2.34 0.00 0.00 174.74 170.54 3inj n GLU 236 N 0.63 0.15 -0.04 2.88 4.07 -1.26 -3.25 120.64 123.83 3inj n GLU 236 Ca 0.01 0.01 0.02 0.00 -0.06 0.00 0.00 57.16 57.14 3inj n GLU 236 Cb 0.42 -1.50 0.03 0.00 -0.06 0.00 0.00 31.44 30.33 3inj n GLU 236 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 3inj n ASP 237 N -1.42 1.78 -4.69 4.31 2.03 -1.26 -4.87 116.55 112.43 3inj n ASP 237 Ca 0.09 -2.13 -0.38 0.00 0.52 0.00 0.00 54.79 52.88 3inj n ASP 237 Cb 0.29 -0.10 -0.06 0.00 -0.72 0.00 0.00 41.12 40.53 3inj n ASP 237 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3inj s VAL 238 N -1.27 5.15 -0.20 5.18 1.01 -1.20 -4.78 120.40 124.29 3inj s VAL 238 Ca 0.07 0.93 0.19 0.00 0.00 0.00 0.00 61.98 63.17 3inj s VAL 238 Cb 0.06 -3.82 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 3inj s VAL 238 CO 0.01 0.26 1.06 0.44 0.00 0.00 0.00 175.10 176.86 3inj h ASP 239 N 7.10 0.00 -3.58 3.32 3.32 -1.37 -3.43 116.42 121.78 3inj h ASP 239 Ca -0.37 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.64 3inj h ASP 239 Cb 1.17 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.50 3inj h ASP 239 CO 0.75 0.31 0.02 -0.75 -1.72 0.00 0.00 179.24 177.84 3inj s LYS 240 N -3.11 0.72 -0.06 3.56 2.36 -1.15 -2.26 119.74 119.80 3inj s LYS 240 Ca -0.00 1.02 0.05 0.00 -2.55 0.00 0.00 55.97 54.49 3inj s LYS 240 Cb 0.08 0.26 -0.01 0.00 -1.05 0.00 0.00 37.83 37.12 3inj s LYS 240 CO 0.78 -0.12 -0.22 0.54 1.55 0.00 0.00 175.35 177.88 3inj s VAL 241 N 0.88 1.82 -0.16 4.02 0.11 -0.01 0.02 120.40 127.09 3inj s VAL 241 Ca -0.04 -0.93 0.02 0.00 -2.93 0.00 0.00 61.98 58.09 3inj s VAL 241 Cb -0.05 -1.55 0.02 0.00 -1.53 0.00 0.00 36.38 33.26 3inj s VAL 241 CO -0.07 0.51 -0.21 0.00 -3.33 0.00 0.00 175.10 172.00 3inj s ALA 242 N -0.04 2.27 -0.08 1.54 0.00 0.50 -2.07 121.76 123.87 3inj s ALA 242 Ca -0.05 -1.15 0.03 0.00 0.00 0.00 0.00 51.96 50.79 3inj s ALA 242 Cb -0.13 -1.09 0.01 0.00 0.00 0.00 0.00 23.12 21.91 3inj s ALA 242 CO 0.04 -0.21 -0.16 0.12 0.00 0.00 0.00 175.76 175.55 3inj s PHE 243 N 1.09 1.83 -0.14 0.00 5.36 -0.94 -1.11 117.98 124.06 3inj s PHE 243 Ca -0.00 -0.72 0.01 0.00 -0.96 0.00 0.00 56.93 55.26 3inj s PHE 243 Cb -0.14 -1.29 0.00 0.00 -0.34 0.00 0.00 43.02 41.25 3inj s PHE 243 CO -0.08 -0.34 -0.19 0.99 -1.46 0.00 0.00 175.22 174.15 3inj s THR 244 N 0.59 2.41 -3.56 0.12 2.01 -0.96 -0.94 115.64 115.31 3inj s THR 244 Ca -0.15 -0.87 0.00 0.00 0.31 0.00 0.00 61.69 60.98 3inj s THR 244 Cb -0.16 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.36 3inj s THR 244 CO 0.05 0.53 0.00 0.61 -0.69 0.00 0.00 174.62 175.12 3inj n GLY 245 N 3.94 -0.57 3.77 4.40 0.00 -0.07 -3.87 105.19 112.80 3inj n GLY 245 Ca -0.19 -0.71 -0.39 0.00 0.00 0.00 0.00 46.02 44.73 3inj n GLY 245 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3inj s SER 246 N -4.00 7.09 0.34 1.61 1.04 -1.26 -3.28 113.70 115.24 3inj s SER 246 Ca 0.00 2.14 0.12 0.00 0.48 0.00 0.00 55.95 58.69 3inj s SER 246 Cb 0.00 -2.61 0.94 0.00 0.10 0.00 0.00 66.02 64.45 3inj s SER 246 CO 0.00 -0.26 1.74 0.74 0.98 0.00 0.00 173.24 176.44 3inj h THR 247 N 2.73 0.54 -0.26 2.02 2.02 -1.88 -1.31 112.91 116.77 3inj h THR 247 Ca -0.47 -0.19 0.05 0.00 0.77 0.00 0.00 66.41 66.57 3inj h THR 247 Cb 1.21 -0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 3inj h THR 247 CO 0.65 0.10 -0.01 -0.08 0.37 0.00 0.00 175.52 176.54 3inj h GLU 248 N 0.54 0.06 -0.16 6.66 4.81 -1.94 -2.83 114.58 121.71 3inj h GLU 248 Ca 0.63 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.76 3inj h GLU 248 Cb 1.29 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.65 3inj h GLU 248 CO -0.43 0.04 -0.30 0.82 -0.73 0.00 0.00 179.01 178.42 3inj h ILE 249 N 0.06 1.35 -1.26 2.32 1.08 -1.66 -2.97 117.51 116.44 3inj h ILE 249 Ca 0.12 -1.54 0.46 0.00 -0.39 0.00 0.00 64.86 63.51 3inj h ILE 249 Cb 0.17 1.95 -0.15 0.00 -3.07 0.00 0.00 36.82 35.71 3inj h ILE 249 CO -0.22 0.46 0.77 0.61 -0.69 0.00 0.00 178.15 179.09 3inj n GLY 250 N 0.39 -0.81 0.33 5.37 0.00 -0.67 0.14 105.19 109.94 3inj n GLY 250 Ca -0.06 0.78 -0.06 0.00 0.00 0.00 0.00 46.02 46.67 3inj n GLY 250 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3inj h ARG 251 N 0.00 1.14 -0.59 1.61 3.08 -1.33 -2.24 114.38 116.05 3inj h ARG 251 Ca 0.87 -0.25 -0.09 0.00 0.07 0.00 0.00 59.98 60.59 3inj h ARG 251 Cb 2.65 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 32.52 3inj h ARG 251 CO -0.57 0.97 0.03 0.28 -1.07 0.00 0.00 179.97 179.62 3inj h VAL 252 N 1.09 1.26 0.21 2.04 2.07 0.12 -2.77 116.25 120.27 3inj h VAL 252 Ca 0.24 -1.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 3inj h VAL 252 Cb 0.31 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3inj h VAL 252 CO -0.01 0.39 -0.10 0.40 0.02 0.00 0.00 177.57 178.28 3inj h ILE 253 N 0.93 0.80 -0.73 4.57 1.08 -1.03 -1.05 117.51 122.08 3inj h ILE 253 Ca 0.17 -0.03 -0.04 0.00 -0.39 0.00 0.00 64.86 64.58 3inj h ILE 253 Cb 0.49 0.82 -0.03 0.00 -3.07 0.00 0.00 36.82 35.03 3inj h ILE 253 CO 0.02 0.01 0.31 -0.61 -0.69 0.00 0.00 178.15 177.19 3inj h GLN 254 N -0.29 1.07 -0.62 2.37 4.15 -1.37 -0.49 115.11 119.92 3inj h GLN 254 Ca -0.03 -0.18 -0.06 0.00 0.77 0.00 0.00 58.65 59.15 3inj h GLN 254 Cb 0.22 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 3inj h GLN 254 CO 0.05 0.86 0.14 0.28 -1.93 0.00 0.00 178.83 178.23 3inj h VAL 255 N 1.05 1.25 -0.42 2.39 2.07 -1.40 -2.40 116.25 118.80 3inj h VAL 255 Ca 0.25 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 3inj h VAL 255 Cb 0.18 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 3inj h VAL 255 CO -0.02 0.35 0.21 0.00 0.02 0.00 0.00 177.57 178.13 3inj h ALA 256 N 1.04 0.53 0.33 1.67 0.00 -0.52 -1.09 119.26 121.23 3inj h ALA 256 Ca 0.19 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3inj h ALA 256 Cb 0.37 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3inj h ALA 256 CO 0.00 0.08 -0.51 0.00 0.00 0.00 0.00 179.25 178.82 3inj h ALA 257 N 1.06 -1.06 -0.51 0.00 0.00 -0.97 -1.89 119.26 115.89 3inj h ALA 257 Ca 0.14 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.94 3inj h ALA 257 Cb 0.09 0.80 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 3inj h ALA 257 CO -0.02 -1.15 0.34 0.78 0.00 0.00 0.00 179.25 179.20 3inj h GLY 258 N -0.89 0.62 2.00 0.00 0.00 -1.38 -1.82 103.07 101.61 3inj h GLY 258 Ca -0.03 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3inj h GLY 258 CO -0.16 0.18 0.00 1.76 0.00 0.00 0.00 176.54 178.32 3inj h SER 259 N 0.54 0.00 0.00 0.19 0.02 -0.69 -3.41 113.55 110.20 3inj h SER 259 Ca 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3inj h SER 259 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3inj h SER 259 CO -0.05 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.10 3inj n SER 260 N -3.04 0.00 -1.02 3.07 3.41 -0.75 -4.97 113.62 110.32 3inj n SER 260 Ca 0.01 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.70 3inj n SER 260 Cb 0.33 0.00 0.26 0.00 -0.26 0.00 0.00 64.21 64.54 3inj n SER 260 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3inj n ASN 261 N 0.00 3.87 -2.94 4.04 6.94 -1.18 -4.95 115.26 121.05 3inj n ASN 261 Ca 0.00 -2.56 -0.22 0.00 -0.02 0.00 0.00 54.58 51.78 3inj n ASN 261 Cb 0.00 -0.46 0.02 0.00 -2.36 0.00 0.00 39.78 36.98 3inj n ASN 261 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3inj n LEU 262 N 0.25 -2.40 -4.63 -4.53 4.77 -0.79 -4.94 117.00 104.73 3inj n LEU 262 Ca 0.20 -0.24 -0.40 0.00 -0.03 0.00 0.00 56.01 55.54 3inj n LEU 262 Cb 0.76 -2.86 0.03 0.00 -2.33 0.00 0.00 43.42 39.02 3inj n LEU 262 CO 0.16 0.14 0.62 2.29 -1.33 0.00 0.00 177.39 179.26 3inj n LYS 263 N -3.80 1.25 -2.23 3.23 2.85 -1.26 -4.95 118.16 113.24 3inj n LYS 263 Ca -0.13 0.46 -0.39 0.00 -1.05 0.00 0.00 58.31 57.20 3inj n LYS 263 Cb 0.62 -2.16 -0.02 0.00 -0.65 0.00 0.00 35.03 32.82 3inj n LYS 263 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 3inj s ARG 264 N -2.39 4.21 -0.05 -1.58 3.00 -0.96 -4.83 118.95 116.36 3inj s ARG 264 Ca 0.68 1.99 0.03 0.00 0.00 0.00 0.00 55.73 58.43 3inj s ARG 264 Cb -0.48 -2.88 0.01 0.00 0.00 0.00 0.00 34.95 31.60 3inj s ARG 264 CO 0.53 -0.23 -0.13 0.08 0.00 0.00 0.00 175.30 175.55 3inj s VAL 265 N -1.27 1.13 0.11 3.52 1.01 -1.26 -0.83 120.40 122.80 3inj s VAL 265 Ca 0.53 -0.51 0.09 0.00 0.00 0.00 0.00 61.98 62.09 3inj s VAL 265 Cb -0.35 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 3inj s VAL 265 CO 0.45 0.35 -0.22 0.42 0.00 0.00 0.00 175.10 176.09 3inj s THR 266 N 0.42 1.80 -0.02 3.92 -4.23 -0.88 -4.95 115.64 111.69 3inj s THR 266 Ca -0.10 -1.59 0.01 0.00 -1.18 0.00 0.00 61.69 58.84 3inj s THR 266 Cb -0.13 -1.63 0.01 0.00 1.34 0.00 0.00 72.50 72.09 3inj s THR 266 CO 0.03 -0.05 -0.03 -0.76 -0.54 0.00 0.00 174.62 173.27 3inj s LEU 267 N -1.96 1.57 -0.34 4.79 1.43 -0.90 -2.22 118.68 121.04 3inj s LEU 267 Ca 0.08 -0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 3inj s LEU 267 Cb -0.10 -0.26 0.09 0.00 0.03 0.00 0.00 46.19 45.96 3inj s LEU 267 CO 0.05 -0.03 0.06 -1.61 0.23 0.00 0.00 176.35 175.05 3inj s GLU 268 N 0.51 1.83 0.00 1.70 0.41 -0.12 -1.58 118.70 121.45 3inj s GLU 268 Ca -0.05 -1.72 0.00 0.00 -0.41 0.00 0.00 54.97 52.78 3inj s GLU 268 Cb -0.09 -3.27 0.00 0.00 -1.78 0.00 0.00 34.13 29.00 3inj s GLU 268 CO -0.01 -0.89 0.00 1.28 -0.49 0.00 0.00 175.26 175.15 3inj n LEU 269 N 4.41 0.00 0.00 1.80 4.77 0.12 -0.89 117.00 127.20 3inj n LEU 269 Ca -0.02 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.69 3inj n LEU 269 Cb 0.42 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.74 3inj n LEU 269 CO 0.25 0.00 0.55 0.61 -1.33 0.00 0.00 177.39 177.47 3inj n GLY 270 N 5.00 -2.75 3.60 -0.72 0.00 -1.20 -4.81 105.19 104.31 3inj n GLY 270 Ca 0.00 -1.49 -0.10 0.00 0.00 0.00 0.00 46.02 44.43 3inj n GLY 270 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3inj s GLY 271 N -4.29 -0.37 -0.42 -0.02 0.00 -1.20 -4.38 107.32 96.64 3inj s GLY 271 Ca 0.65 0.12 0.09 0.00 0.00 0.00 0.00 44.72 45.58 3inj s GLY 271 CO 0.50 0.03 0.92 1.17 0.00 0.00 0.00 173.10 175.72 3inj n LYS 272 N -0.41 0.98 -2.15 2.90 3.00 -1.26 -4.47 118.16 116.76 3inj n LYS 272 Ca -0.11 -2.62 -0.41 0.00 -0.00 0.00 0.00 58.31 55.16 3inj n LYS 272 Cb 0.62 -1.36 -0.03 0.00 0.00 0.00 0.00 35.03 34.27 3inj n LYS 272 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 3inj s SER 273 N -1.81 6.82 0.11 3.14 0.01 -1.20 -4.59 113.70 116.17 3inj s SER 273 Ca 0.31 2.48 -0.28 0.00 1.31 0.00 0.00 55.95 59.77 3inj s SER 273 Cb 0.31 -2.61 -0.06 0.00 0.21 0.00 0.00 66.02 63.87 3inj s SER 273 CO -0.07 -0.59 0.88 -2.16 0.41 0.00 0.00 173.24 171.71 3inj s PRO 274 N -0.13 4.65 -0.29 12.44 0.04 -1.26 -1.95 135.00 148.49 3inj s PRO 274 Ca 0.58 1.31 0.02 0.00 0.04 0.00 0.00 61.00 62.95 3inj s PRO 274 Cb -0.38 -3.35 0.07 0.00 0.04 0.00 0.00 34.50 30.88 3inj s PRO 274 CO 0.39 0.31 -0.04 1.21 0.04 0.00 0.00 177.00 178.92 3inj s ASN 275 N -0.30 4.67 -0.33 6.66 3.04 0.38 -0.94 114.94 128.12 3inj s ASN 275 Ca 0.42 -1.54 -0.10 0.00 0.04 0.00 0.00 52.86 51.69 3inj s ASN 275 Cb -0.23 -1.62 0.01 0.00 -1.54 0.00 0.00 41.25 37.87 3inj s ASN 275 CO 0.28 -0.26 0.17 -0.63 -3.04 0.00 0.00 177.10 173.61 3inj s ILE 276 N 1.11 4.57 -0.50 -5.21 1.01 0.37 -0.97 121.20 121.58 3inj s ILE 276 Ca -0.04 -0.58 -0.16 0.00 0.00 0.00 0.00 60.65 59.88 3inj s ILE 276 Cb -0.20 -3.41 0.09 0.00 0.01 0.00 0.00 42.46 38.95 3inj s ILE 276 CO -0.04 -0.03 0.46 -0.63 0.00 0.00 0.00 174.94 174.69 3inj s ILE 277 N 1.59 5.18 0.68 2.92 -1.09 0.63 -0.68 121.20 130.44 3inj s ILE 277 Ca 0.04 -1.12 -0.13 0.00 -2.23 0.00 0.00 60.65 57.21 3inj s ILE 277 Cb -0.18 -4.21 0.01 0.00 -1.58 0.00 0.00 42.46 36.50 3inj s ILE 277 CO 0.06 -0.70 1.08 -0.04 -1.23 0.00 0.00 174.94 174.11 3inj s MET 278 N 1.76 2.84 0.41 2.79 -1.94 -0.38 -2.17 119.30 122.62 3inj s MET 278 Ca 0.05 1.14 0.29 0.00 -1.71 0.00 0.00 55.69 55.46 3inj s MET 278 Cb -0.25 -1.97 1.35 0.00 2.01 0.00 0.00 34.83 35.97 3inj s MET 278 CO 0.06 -1.19 1.87 0.66 -0.01 0.00 0.00 175.02 176.42 3inj h SER 279 N -0.41 0.00 -0.66 3.03 4.64 -1.90 -1.47 113.55 116.77 3inj h SER 279 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3inj h SER 279 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3inj h SER 279 CO 0.55 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.61 3inj n ASP 280 N -2.59 3.74 -4.75 4.97 5.75 -1.26 -4.95 116.55 117.46 3inj n ASP 280 Ca 0.00 -2.00 -0.34 0.00 -0.01 0.00 0.00 54.79 52.45 3inj n ASP 280 Cb 0.18 -0.44 0.06 0.00 -1.03 0.00 0.00 41.12 39.89 3inj n ASP 280 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3inj s ALA 281 N -1.12 2.38 -0.25 2.12 0.00 -0.56 -3.84 121.76 120.50 3inj s ALA 281 Ca 0.46 0.71 -0.29 0.00 0.00 0.00 0.00 51.96 52.84 3inj s ALA 281 Cb 0.24 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.96 3inj s ALA 281 CO 0.32 -1.42 1.65 0.34 0.00 0.00 0.00 175.76 176.66 3inj s ASP 282 N -2.26 6.28 0.08 0.00 2.15 -1.26 -4.92 116.67 116.74 3inj s ASP 282 Ca 0.71 1.54 -0.32 0.00 0.43 0.00 0.00 52.55 54.91 3inj s ASP 282 Cb -0.24 -2.53 -0.16 0.00 -0.30 0.00 0.00 42.92 39.68 3inj s ASP 282 CO 0.41 -1.35 1.62 -0.03 -0.17 0.00 0.00 175.17 175.65 3inj h MET 283 N 11.15 -0.78 -0.46 4.34 1.85 -1.96 0.25 114.93 129.31 3inj h MET 283 Ca -0.34 0.05 0.01 0.00 -0.61 0.00 0.00 59.70 58.82 3inj h MET 283 Cb 1.16 0.18 -0.03 0.00 0.43 0.00 0.00 31.60 33.34 3inj h MET 283 CO 1.01 -0.52 0.29 -0.44 -0.40 0.00 0.00 176.91 176.84 3inj h ASP 284 N -0.81 0.48 -0.04 1.39 3.32 -1.99 1.00 116.42 119.76 3inj h ASP 284 Ca -0.06 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3inj h ASP 284 Cb 0.67 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 3inj h ASP 284 CO 0.05 0.34 0.02 -0.25 -1.72 0.00 0.00 179.24 177.69 3inj h TRP 285 N 0.58 0.05 -0.76 4.55 2.91 -1.94 -0.76 115.95 120.58 3inj h TRP 285 Ca 0.18 -0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.25 3inj h TRP 285 Cb -0.02 -0.02 -0.05 0.00 -0.51 0.00 0.00 29.16 28.56 3inj h TRP 285 CO -0.06 0.07 0.47 0.00 -1.03 0.00 0.00 178.44 177.89 3inj h ALA 286 N 0.97 1.03 -0.08 2.65 0.00 -0.18 0.89 119.26 124.53 3inj h ALA 286 Ca 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3inj h ALA 286 Cb 0.04 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3inj h ALA 286 CO -0.00 0.21 0.04 0.28 0.00 0.00 0.00 179.25 179.78 3inj h VAL 287 N 0.88 1.13 -0.26 0.00 2.07 -0.51 0.11 116.25 119.66 3inj h VAL 287 Ca 0.33 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 3inj h VAL 287 Cb 0.12 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3inj h VAL 287 CO -0.15 0.11 0.04 -0.08 0.02 0.00 0.00 177.57 177.51 3inj h GLU 288 N -0.00 0.44 -0.83 1.57 4.57 -0.77 -2.05 114.58 117.51 3inj h GLU 288 Ca 0.03 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 3inj h GLU 288 Cb 0.14 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.64 3inj h GLU 288 CO -0.00 0.56 0.47 1.96 -1.18 0.00 0.00 179.01 180.82 3inj h GLN 289 N 0.25 1.14 -0.28 1.92 1.08 -0.80 -1.21 115.11 117.21 3inj h GLN 289 Ca 0.08 -0.12 -0.08 0.00 -1.45 0.00 0.00 58.65 57.08 3inj h GLN 289 Cb 0.33 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 3inj h GLN 289 CO 0.00 0.82 -0.17 0.00 -0.95 0.00 0.00 178.83 178.53 3inj h ALA 290 N 1.37 1.19 -0.13 3.87 0.00 -0.77 0.48 119.26 125.27 3inj h ALA 290 Ca 0.29 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3inj h ALA 290 Cb -0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3inj h ALA 290 CO -0.05 0.52 -0.04 1.25 0.00 0.00 0.00 179.25 180.93 3inj h HIS 291 N 0.45 0.30 -0.16 0.00 -0.00 -0.98 -2.80 115.15 111.95 3inj h HIS 291 Ca 0.08 -0.07 0.02 0.00 -0.00 0.00 0.00 60.37 60.41 3inj h HIS 291 Cb 0.55 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.87 3inj h HIS 291 CO 0.02 0.56 0.01 0.35 -0.00 0.00 0.00 177.93 178.87 3inj h PHE 292 N -0.06 0.02 -0.88 5.26 -0.00 -0.89 0.75 116.94 121.14 3inj h PHE 292 Ca 0.03 0.01 0.20 0.00 -0.00 0.00 0.00 57.97 58.21 3inj h PHE 292 Cb 0.47 0.02 -0.06 0.00 -0.00 0.00 0.00 35.95 36.38 3inj h PHE 292 CO 0.06 -0.01 0.59 0.00 -0.00 0.00 0.00 178.31 178.95 3inj h ALA 293 N 1.13 2.24 0.00 2.41 0.00 0.02 -1.93 119.26 123.12 3inj h ALA 293 Ca 0.07 0.01 -0.40 0.00 0.00 0.00 0.00 54.91 54.60 3inj h ALA 293 Cb 0.08 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 3inj h ALA 293 CO -0.12 -0.51 -2.19 -0.11 0.00 0.00 0.00 179.25 176.32 3inj n LEU 294 N -4.49 1.97 0.18 0.00 -0.00 -1.07 -1.14 117.00 112.45 3inj n LEU 294 Ca 0.19 0.35 0.12 0.00 -0.00 0.00 0.00 56.01 56.67 3inj n LEU 294 Cb 0.69 -0.87 0.21 0.00 -0.00 0.00 0.00 43.42 43.46 3inj n LEU 294 CO 0.31 0.51 0.75 -0.26 -0.00 0.00 0.00 177.39 178.71 3inj h PHE 295 N -0.96 0.00 -2.60 1.96 -1.00 -0.81 -3.34 116.94 110.19 3inj h PHE 295 Ca -0.60 0.00 -0.60 0.00 2.81 0.00 0.00 57.97 59.58 3inj h PHE 295 Cb 1.55 0.00 0.12 0.00 3.61 0.00 0.00 35.95 41.22 3inj h PHE 295 CO -0.03 0.00 0.09 0.34 -1.61 0.00 0.00 178.31 177.10 3inj n PHE 296 N -2.84 1.10 -3.77 -0.55 -0.00 -0.73 -1.95 117.46 108.71 3inj n PHE 296 Ca 0.04 0.66 -0.24 0.00 -0.00 0.00 0.00 57.45 57.91 3inj n PHE 296 Cb 0.51 -2.22 0.03 0.00 -0.00 0.00 0.00 39.48 37.79 3inj n PHE 296 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 3inj n ASN 297 N 1.06 -2.48 -2.12 -2.13 5.15 -1.26 -1.12 115.26 112.36 3inj n ASN 297 Ca 0.10 -0.80 -0.17 0.00 -0.60 0.00 0.00 54.58 53.11 3inj n ASN 297 Cb 0.34 -4.01 -0.03 0.00 -0.53 0.00 0.00 39.78 35.55 3inj n ASN 297 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3inj n GLN 298 N -4.43 -1.76 -0.95 1.20 3.00 -0.98 -0.06 117.38 113.41 3inj n GLN 298 Ca -0.18 0.86 0.00 0.00 -0.01 0.00 0.00 57.00 57.68 3inj n GLN 298 Cb 0.63 -5.39 0.00 0.00 0.00 0.00 0.00 30.24 25.47 3inj n GLN 298 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3inj n GLY 299 N -0.72 0.35 2.78 1.08 0.00 -0.28 -3.29 105.19 105.12 3inj n GLY 299 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 3inj n GLY 299 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3inj n GLN 300 N -1.45 3.99 -3.86 1.61 6.02 0.92 -3.31 117.38 121.30 3inj n GLN 300 Ca 0.00 -3.65 -0.21 0.00 -0.01 0.00 0.00 57.00 53.13 3inj n GLN 300 Cb 0.16 -2.80 -0.17 0.00 1.02 0.00 0.00 30.24 28.45 3inj n GLN 300 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3inj n ALA 304 N 0.13 -0.63 -2.21 0.00 0.00 -0.29 -4.74 120.51 112.77 3inj n ALA 304 Ca 0.23 0.44 -0.41 0.00 0.00 0.00 0.00 53.44 53.70 3inj n ALA 304 Cb 0.93 -2.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.35 3inj n ALA 304 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3inj n GLY 305 N 1.77 2.76 1.06 0.00 0.00 -0.30 -3.28 105.19 107.20 3inj n GLY 305 Ca 0.13 -1.36 0.12 0.00 0.00 0.00 0.00 46.02 44.91 3inj n GLY 305 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3inj n SER 306 N 8.74 3.17 -3.82 1.61 3.41 -0.82 -4.37 113.62 121.54 3inj n SER 306 Ca 0.49 -1.96 -0.30 0.00 -0.26 0.00 0.00 58.87 56.84 3inj n SER 306 Cb 0.44 -0.21 -0.15 0.00 -0.26 0.00 0.00 64.21 64.03 3inj n SER 306 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3inj s ARG 307 N -1.58 0.97 -0.56 4.33 0.52 -1.00 -4.21 118.95 117.42 3inj s ARG 307 Ca 0.37 -1.25 -0.19 0.00 -0.52 0.00 0.00 55.73 54.14 3inj s ARG 307 Cb 0.22 -2.34 0.09 0.00 0.52 0.00 0.00 34.95 33.44 3inj s ARG 307 CO 0.31 -0.94 0.65 0.99 0.02 0.00 0.00 175.30 176.33 3inj s THR 308 N 1.43 4.89 -0.14 0.02 2.01 -0.47 -0.47 115.64 122.90 3inj s THR 308 Ca 0.09 -0.89 -0.23 0.00 0.31 0.00 0.00 61.69 60.96 3inj s THR 308 Cb -0.18 -4.40 -0.03 0.00 0.01 0.00 0.00 72.50 67.91 3inj s THR 308 CO -0.19 -0.98 0.72 -0.36 -0.69 0.00 0.00 174.62 173.12 3inj s PHE 309 N 2.53 3.46 -0.12 4.92 0.40 -0.14 -0.55 117.98 128.48 3inj s PHE 309 Ca 0.11 1.15 0.01 0.00 -0.60 0.00 0.00 56.93 57.61 3inj s PHE 309 Cb -0.23 -2.87 0.02 0.00 0.51 0.00 0.00 43.02 40.44 3inj s PHE 309 CO 0.08 -0.10 -0.14 0.08 0.70 0.00 0.00 175.22 175.83 3inj s VAL 310 N 1.58 1.47 0.32 -0.44 1.01 0.33 -0.27 120.40 124.40 3inj s VAL 310 Ca 0.35 -0.60 -0.29 0.00 0.00 0.00 0.00 61.98 61.44 3inj s VAL 310 Cb -0.17 -1.36 -0.12 0.00 0.00 0.00 0.00 36.38 34.74 3inj s VAL 310 CO 0.14 0.44 1.47 1.67 0.00 0.00 0.00 175.10 178.82 3inj n GLN 311 N 4.40 2.49 -0.33 2.72 7.27 -0.92 -2.51 117.38 130.50 3inj n GLN 311 Ca -0.18 0.88 0.15 0.00 0.07 0.00 0.00 57.00 57.92 3inj n GLN 311 Cb 0.51 -2.59 0.38 0.00 2.41 0.00 0.00 30.24 30.95 3inj n GLN 311 CO 0.00 0.00 0.00 1.05 0.07 0.00 0.00 177.06 178.18 3inj h GLU 312 N 3.65 0.63 0.00 3.69 4.11 -1.00 -1.57 114.58 124.09 3inj h GLU 312 Ca -0.48 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 58.90 3inj h GLU 312 Cb 1.25 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 3inj h GLU 312 CO 0.70 0.42 -0.05 -0.44 0.07 0.00 0.00 179.01 179.71 3inj h ASP 313 N 0.65 0.00 -0.18 3.06 5.19 -1.89 -2.60 116.42 120.64 3inj h ASP 313 Ca 0.56 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.97 3inj h ASP 313 Cb 1.03 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.54 3inj h ASP 313 CO -0.33 0.05 0.00 2.30 -3.12 0.00 0.00 179.24 178.14 3inj n ILE 314 N -4.44 0.54 0.05 0.35 -5.35 -0.65 -4.77 119.36 105.09 3inj n ILE 314 Ca -0.03 -0.77 -0.11 0.00 -0.27 0.00 0.00 62.75 61.57 3inj n ILE 314 Cb 0.13 0.83 -0.05 0.00 -1.74 0.00 0.00 39.64 38.82 3inj n ILE 314 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 3inj h TYR 315 N 1.99 -0.39 -0.33 4.28 5.03 -0.98 -1.59 116.97 124.98 3inj h TYR 315 Ca 0.00 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.30 3inj h TYR 315 Cb 0.59 0.17 -0.01 0.00 1.55 0.00 0.00 36.73 39.03 3inj h TYR 315 CO 0.12 -0.22 0.13 -0.44 -1.32 0.00 0.00 178.16 176.43 3inj h ASP 316 N -0.25 0.46 -0.44 -2.11 3.32 -1.86 0.05 116.42 115.60 3inj h ASP 316 Ca 0.05 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 3inj h ASP 316 Cb 0.32 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 3inj h ASP 316 CO -0.15 0.51 0.21 -0.08 -1.72 0.00 0.00 179.24 178.01 3inj h GLU 317 N 0.39 0.63 -0.36 3.56 4.81 -1.89 -0.71 114.58 121.02 3inj h GLU 317 Ca 0.11 -0.10 0.02 0.00 -0.13 0.00 0.00 59.36 59.26 3inj h GLU 317 Cb 0.19 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 3inj h GLU 317 CO -0.01 0.55 0.21 0.35 -0.73 0.00 0.00 179.01 179.38 3inj h PHE 318 N 0.57 0.39 -0.82 0.92 3.57 -1.06 -0.39 116.94 120.11 3inj h PHE 318 Ca 0.15 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 3inj h PHE 318 Cb 0.13 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.71 3inj h PHE 318 CO -0.01 0.23 0.39 0.28 -2.23 0.00 0.00 178.31 176.96 3inj h VAL 319 N 0.42 1.26 -0.09 1.41 2.07 -0.77 0.18 116.25 120.73 3inj h VAL 319 Ca 0.14 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 3inj h VAL 319 Cb 0.01 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 29.99 3inj h VAL 319 CO -0.07 0.31 0.05 -0.08 0.02 0.00 0.00 177.57 177.80 3inj h GLU 320 N 1.17 0.13 -0.40 1.57 4.81 -0.67 0.41 114.58 121.60 3inj h GLU 320 Ca 0.28 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 3inj h GLU 320 Cb 0.13 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 3inj h GLU 320 CO -0.03 0.18 0.01 0.00 -0.73 0.00 0.00 179.01 178.44 3inj h ARG 321 N 0.04 0.63 -0.44 1.92 3.08 -0.90 -1.85 114.38 116.85 3inj h ARG 321 Ca 0.03 -0.14 -0.08 0.00 0.07 0.00 0.00 59.98 59.85 3inj h ARG 321 Cb 0.10 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3inj h ARG 321 CO -0.00 0.64 -0.05 0.77 -1.07 0.00 0.00 179.97 180.26 3inj h SER 322 N 0.60 0.81 -0.57 7.04 0.02 -0.32 -1.75 113.55 119.38 3inj h SER 322 Ca 0.13 -0.34 -0.10 0.00 -0.84 0.00 0.00 61.79 60.63 3inj h SER 322 Cb 0.36 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 3inj h SER 322 CO 0.01 0.95 -0.05 0.58 -1.14 0.00 0.00 176.83 177.19 3inj h VAL 323 N 0.65 1.27 -0.21 2.27 2.07 -0.79 -2.18 116.25 119.31 3inj h VAL 323 Ca 0.12 -1.20 0.03 0.00 0.82 0.00 0.00 66.70 66.46 3inj h VAL 323 Cb 0.57 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 3inj h VAL 323 CO 0.03 0.43 0.05 0.00 0.02 0.00 0.00 177.57 178.11 3inj h ALA 324 N 0.98 0.22 -0.79 1.67 0.00 -1.22 -0.41 119.26 119.72 3inj h ALA 324 Ca 0.16 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3inj h ALA 324 Cb 0.61 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 3inj h ALA 324 CO 0.04 -0.38 0.33 -0.09 0.00 0.00 0.00 179.25 179.15 3inj h ARG 325 N 0.14 1.17 -0.22 0.00 9.65 -1.23 -1.80 114.38 122.09 3inj h ARG 325 Ca 0.10 -0.20 -0.16 0.00 -1.10 0.00 0.00 59.98 58.61 3inj h ARG 325 Cb 0.08 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 28.47 3inj h ARG 325 CO -0.12 0.94 -0.52 0.00 2.80 0.00 0.00 179.97 183.07 3inj h ALA 326 N 1.17 0.68 -0.04 2.80 0.00 -1.20 -2.44 119.26 120.24 3inj h ALA 326 Ca 0.26 -0.50 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 3inj h ALA 326 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3inj h ALA 326 CO -0.02 0.68 -0.25 0.87 0.00 0.00 0.00 179.25 180.53 3inj h LYS 327 N 0.48 0.06 0.00 0.00 1.57 -0.82 -2.84 116.57 115.02 3inj h LYS 327 Ca 0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3inj h LYS 327 Cb 1.07 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.37 3inj h LYS 327 CO 0.10 0.30 -0.36 -1.13 -0.57 0.00 0.00 179.45 177.80 3inj n SER 328 N -4.22 0.46 -4.62 0.86 3.41 -0.70 -4.87 113.62 103.93 3inj n SER 328 Ca -0.02 0.12 -0.43 0.00 -0.26 0.00 0.00 58.87 58.28 3inj n SER 328 Cb 0.31 -0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 64.17 3inj n SER 328 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3inj s ARG 329 N -3.05 3.62 -0.18 4.33 3.52 -0.94 -4.93 118.95 121.31 3inj s ARG 329 Ca 0.10 1.96 -0.29 0.00 -0.13 0.00 0.00 55.73 57.37 3inj s ARG 329 Cb 0.16 -4.18 -0.01 0.00 -1.56 0.00 0.00 34.95 29.36 3inj s ARG 329 CO 0.65 -1.53 1.20 0.08 -0.81 0.00 0.00 175.30 174.90 3inj s VAL 330 N 6.17 4.39 -0.14 7.11 1.01 -1.26 -4.91 120.40 132.77 3inj s VAL 330 Ca 0.85 1.68 -0.02 0.00 0.00 0.00 0.00 61.98 64.48 3inj s VAL 330 Cb -0.31 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 31.96 3inj s VAL 330 CO 0.34 -0.15 -0.06 -0.69 0.00 0.00 0.00 175.10 174.55 3inj s VAL 331 N 3.41 3.74 -2.30 2.92 1.01 -1.26 -0.62 120.40 127.30 3inj s VAL 331 Ca 0.52 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.08 3inj s VAL 331 Cb -0.20 -2.61 0.00 0.00 0.00 0.00 0.00 36.38 33.57 3inj s VAL 331 CO 0.12 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.35 3inj n GLY 332 N 3.30 -0.59 3.67 4.51 0.00 -1.04 -4.99 105.19 110.06 3inj n GLY 332 Ca -0.18 -0.67 -0.50 0.00 0.00 0.00 0.00 46.02 44.67 3inj n GLY 332 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3inj n ASN 333 N 0.00 2.95 0.23 1.61 2.85 -1.26 -4.43 115.26 117.20 3inj n ASN 333 Ca 0.00 1.04 0.16 0.00 -0.11 0.00 0.00 54.58 55.67 3inj n ASN 333 Cb 0.00 -1.32 0.78 0.00 1.24 0.00 0.00 39.78 40.48 3inj n ASN 333 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3inj h PRO 334 N 7.50 0.00 0.00 1.20 0.13 -1.89 -2.58 132.00 136.36 3inj h PRO 334 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 3inj h PRO 334 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 3inj h PRO 334 CO 0.92 0.00 -0.75 0.74 -0.23 0.00 0.00 178.00 178.67 3inj h PHE 335 N 0.00 0.00 -3.09 1.56 -1.00 -1.90 -0.93 116.94 111.59 3inj h PHE 335 Ca 0.00 0.00 -0.54 0.00 2.81 0.00 0.00 57.97 60.24 3inj h PHE 335 Cb 0.17 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.72 3inj h PHE 335 CO 0.00 0.07 0.67 0.34 -1.61 0.00 0.00 178.31 177.78 3inj s ASP 336 N -5.67 7.01 0.36 2.17 -1.08 -0.97 -4.91 116.67 113.58 3inj s ASP 336 Ca 0.01 1.98 0.27 0.00 -0.52 0.00 0.00 52.55 54.29 3inj s ASP 336 Cb 0.08 -2.57 1.22 0.00 -1.46 0.00 0.00 42.92 40.19 3inj s ASP 336 CO 0.76 -0.57 1.81 0.77 0.52 0.00 0.00 175.17 178.46 3inj h SER 337 N 7.23 0.00 1.39 -0.34 4.64 -1.87 -1.76 113.55 122.84 3inj h SER 337 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3inj h SER 337 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3inj h SER 337 CO 0.86 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 177.11 3inj n LYS 338 N -2.47 0.22 -2.33 4.77 5.02 -1.26 -4.86 118.16 117.25 3inj n LYS 338 Ca 0.01 0.19 -0.43 0.00 -2.02 0.00 0.00 58.31 56.05 3inj n LYS 338 Cb 0.18 -1.76 -0.02 0.00 -0.02 0.00 0.00 35.03 33.41 3inj n LYS 338 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3inj s THR 339 N -3.09 4.11 -0.13 -0.18 2.01 -0.66 -4.69 115.64 113.02 3inj s THR 339 Ca 0.11 1.33 0.18 0.00 0.31 0.00 0.00 61.69 63.62 3inj s THR 339 Cb 0.13 -3.90 -0.18 0.00 0.01 0.00 0.00 72.50 68.56 3inj s THR 339 CO 0.58 -0.16 0.63 -0.62 -0.69 0.00 0.00 174.62 174.36 3inj n GLU 340 N 6.83 0.64 -3.78 4.92 1.02 0.21 -4.86 120.64 125.61 3inj n GLU 340 Ca 0.15 0.11 -0.24 0.00 -0.02 0.00 0.00 57.16 57.16 3inj n GLU 340 Cb 0.45 -1.71 -0.17 0.00 -0.02 0.00 0.00 31.44 29.98 3inj n GLU 340 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 3inj s GLN 341 N -2.94 0.73 0.00 3.49 0.74 -0.53 -4.85 119.66 116.30 3inj s GLN 341 Ca -0.05 -0.04 0.00 0.00 0.05 0.00 0.00 55.36 55.33 3inj s GLN 341 Cb 0.09 -1.26 0.00 0.00 1.10 0.00 0.00 33.01 32.94 3inj s GLN 341 CO 0.83 -0.36 0.00 0.41 -0.55 0.00 0.00 175.29 175.62 3inj n GLY 342 N 5.10 -0.11 3.90 2.59 0.00 -1.26 -2.50 105.19 112.92 3inj n GLY 342 Ca -0.08 -1.75 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 3inj n GLY 342 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3inj s PRO 343 N -0.12 2.23 0.83 1.61 0.05 -1.25 -4.78 135.00 133.57 3inj s PRO 343 Ca 0.00 0.15 -0.12 0.00 0.05 0.00 0.00 61.00 61.08 3inj s PRO 343 Cb 0.00 -2.00 0.09 0.00 0.05 0.00 0.00 34.50 32.64 3inj s PRO 343 CO 0.00 -1.39 1.11 -0.65 0.05 0.00 0.00 177.00 176.12 3inj s GLN 344 N -5.47 1.81 0.25 4.56 -1.52 0.15 -4.74 119.66 114.70 3inj s GLN 344 Ca 0.61 0.52 0.05 0.00 -1.95 0.00 0.00 55.36 54.58 3inj s GLN 344 Cb -0.11 -1.90 0.29 0.00 -0.22 0.00 0.00 33.01 31.08 3inj s GLN 344 CO 0.49 -1.78 1.59 -0.24 -0.25 0.00 0.00 175.29 175.10 3inj h VAL 345 N -1.20 1.36 -2.81 1.09 3.04 -1.88 -3.42 116.25 112.43 3inj h VAL 345 Ca -0.48 -1.86 -0.04 0.00 -1.01 0.00 0.00 66.70 63.32 3inj h VAL 345 Cb 1.29 1.91 0.00 0.00 -2.01 0.00 0.00 31.29 32.48 3inj h VAL 345 CO 0.60 0.55 0.19 -0.90 -1.01 0.00 0.00 177.57 177.00 3inj n ASP 346 N -3.91 -1.71 -0.02 3.17 5.68 -1.26 -4.62 116.55 113.88 3inj n ASP 346 Ca -0.02 -2.23 -0.14 0.00 -0.50 0.00 0.00 54.79 51.90 3inj n ASP 346 Cb 0.58 2.86 -0.03 0.00 -1.14 0.00 0.00 41.12 43.39 3inj n ASP 346 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3inj h GLU 347 N 0.00 0.71 -0.14 0.11 4.81 -1.98 -1.41 114.58 116.67 3inj h GLU 347 Ca -0.25 -0.53 0.04 0.00 -0.13 0.00 0.00 59.36 58.49 3inj h GLU 347 Cb 0.94 0.09 -0.07 0.00 0.63 0.00 0.00 28.75 30.35 3inj h GLU 347 CO 0.32 1.15 -0.41 1.15 -0.73 0.00 0.00 179.01 180.49 3inj h THR 348 N 0.51 0.16 -0.51 0.32 2.02 -1.99 -0.10 112.91 113.31 3inj h THR 348 Ca -0.03 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.16 3inj h THR 348 Cb 1.29 0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 3inj h THR 348 CO 0.14 0.00 0.33 1.56 0.37 0.00 0.00 175.52 177.92 3inj h GLN 349 N -0.47 0.66 -0.35 6.66 1.08 -1.96 -1.00 115.11 119.72 3inj h GLN 349 Ca 0.08 -0.04 0.05 0.00 -1.45 0.00 0.00 58.65 57.29 3inj h GLN 349 Cb 0.62 -0.15 -0.08 0.00 -0.05 0.00 0.00 27.48 27.82 3inj h GLN 349 CO -0.40 0.44 -0.51 0.35 -0.95 0.00 0.00 178.83 177.76 3inj h PHE 350 N 0.68 -1.52 -0.30 2.96 3.57 -0.74 -0.73 116.94 120.86 3inj h PHE 350 Ca 0.19 0.07 -0.12 0.00 3.53 0.00 0.00 57.97 61.65 3inj h PHE 350 Cb -0.06 0.71 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 3inj h PHE 350 CO -0.04 -0.49 -0.31 0.87 -2.23 0.00 0.00 178.31 176.11 3inj h LYS 351 N -0.42 0.64 -0.72 1.11 1.79 -0.84 -2.40 116.57 115.74 3inj h LYS 351 Ca 0.09 -0.28 -0.04 0.00 -2.18 0.00 0.00 60.65 58.23 3inj h LYS 351 Cb 0.61 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.21 3inj h LYS 351 CO -0.55 0.87 0.28 -0.22 -1.08 0.00 0.00 179.45 178.74 3inj h LYS 352 N 0.54 1.07 -0.21 3.15 3.64 -0.83 0.13 116.57 124.06 3inj h LYS 352 Ca 0.06 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.19 3inj h LYS 352 Cb 0.80 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.44 3inj h LYS 352 CO 0.07 0.87 -0.14 0.82 -2.27 0.00 0.00 179.45 178.80 3inj h ILE 353 N 1.04 1.31 -0.76 2.00 2.04 -1.02 -1.91 117.51 120.21 3inj h ILE 353 Ca 0.24 -1.24 0.07 0.00 1.00 0.00 0.00 64.86 64.93 3inj h ILE 353 Cb 0.21 1.66 -0.06 0.00 -0.74 0.00 0.00 36.82 37.89 3inj h ILE 353 CO -0.02 0.38 0.44 -0.07 0.00 0.00 0.00 178.15 178.88 3inj h LEU 354 N 0.17 0.66 -0.83 1.44 3.38 -1.04 -0.67 115.31 118.41 3inj h LEU 354 Ca 0.04 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 3inj h LEU 354 Cb 0.65 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 3inj h LEU 354 CO 0.04 0.41 0.38 1.23 0.09 0.00 0.00 178.44 180.59 3inj h GLY 355 N 0.79 1.31 1.39 0.83 0.00 -0.93 -1.78 103.07 104.68 3inj h GLY 355 Ca 0.35 -0.67 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 3inj h GLY 355 CO -0.20 0.63 0.24 -0.97 0.00 0.00 0.00 176.54 176.24 3inj h TYR 356 N 1.20 0.79 -0.43 5.60 0.99 -0.42 -1.10 116.97 123.60 3inj h TYR 356 Ca 0.28 -0.03 -0.11 0.00 2.00 0.00 0.00 58.73 60.87 3inj h TYR 356 Cb 0.15 -0.25 -0.01 0.00 1.00 0.00 0.00 36.73 37.62 3inj h TYR 356 CO 0.02 0.60 -0.16 0.82 -0.00 0.00 0.00 178.16 179.44 3inj h ILE 357 N 0.78 1.28 -0.53 -2.88 2.04 -0.75 -1.50 117.51 115.96 3inj h ILE 357 Ca 0.19 -1.29 -0.04 0.00 1.00 0.00 0.00 64.86 64.72 3inj h ILE 357 Cb 0.13 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 3inj h ILE 357 CO -0.02 0.44 0.16 0.78 0.00 0.00 0.00 178.15 179.50 3inj h ASN 358 N 0.69 0.72 -0.37 1.72 2.35 -1.02 -2.13 115.58 117.55 3inj h ASN 358 Ca 0.10 -0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 3inj h ASN 358 Cb 0.71 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 3inj h ASN 358 CO 0.05 0.69 0.09 0.74 -1.65 0.00 0.00 177.43 177.35 3inj h THR 359 N 0.77 1.22 -0.91 2.81 2.02 -1.01 -1.61 112.91 116.20 3inj h THR 359 Ca 0.18 -0.76 0.02 0.00 0.77 0.00 0.00 66.41 66.62 3inj h THR 359 Cb 0.23 1.03 -0.05 0.00 -1.74 0.00 0.00 68.15 67.62 3inj h THR 359 CO -0.01 0.26 0.60 1.23 0.37 0.00 0.00 175.52 177.97 3inj h GLY 360 N 0.44 1.31 0.81 2.16 0.00 -0.95 -0.82 103.07 106.03 3inj h GLY 360 Ca 0.11 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 46.96 3inj h GLY 360 CO 0.00 0.42 -0.21 0.50 0.00 0.00 0.00 176.54 177.25 3inj h LYS 361 N 1.19 -0.56 -0.37 4.80 1.57 -1.30 -0.57 116.57 121.34 3inj h LYS 361 Ca 0.35 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 3inj h LYS 361 Cb -0.06 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 3inj h LYS 361 CO -0.10 -0.27 0.24 0.37 -0.57 0.00 0.00 179.45 179.11 3inj h GLN 362 N -0.78 0.49 -0.15 3.15 5.75 -1.10 -1.49 115.11 120.97 3inj h GLN 362 Ca -0.06 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 3inj h GLN 362 Cb 0.54 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.98 3inj h GLN 362 CO 0.10 0.33 0.00 -0.85 -2.65 0.00 0.00 178.83 175.75 3inj n GLU 363 N -4.48 1.48 -0.22 1.69 0.28 -0.33 -4.92 120.64 114.14 3inj n GLU 363 Ca 0.02 -0.73 0.00 0.00 -0.16 0.00 0.00 57.16 56.30 3inj n GLU 363 Cb 0.07 -1.28 0.00 0.00 1.43 0.00 0.00 31.44 31.65 3inj n GLU 363 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3inj n GLY 364 N 0.94 0.88 3.78 -1.84 0.00 -0.56 -5.02 105.19 103.36 3inj n GLY 364 Ca 0.12 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 3inj n GLY 364 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3inj s ALA 365 N -2.00 2.89 -0.57 4.61 0.00 -0.23 -4.98 121.76 121.47 3inj s ALA 365 Ca 0.00 0.82 -0.24 0.00 0.00 0.00 0.00 51.96 52.54 3inj s ALA 365 Cb 0.00 -3.34 0.04 0.00 0.00 0.00 0.00 23.12 19.82 3inj s ALA 365 CO 0.00 -0.57 0.96 0.21 0.00 0.00 0.00 175.76 176.35 3inj s LYS 366 N -2.93 3.30 -0.41 0.00 2.20 -0.74 -4.59 119.74 116.58 3inj s LYS 366 Ca 0.66 -0.33 -0.29 0.00 -0.36 0.00 0.00 55.97 55.65 3inj s LYS 366 Cb -0.24 -4.08 0.01 0.00 -1.51 0.00 0.00 37.83 32.01 3inj s LYS 366 CO 0.29 -1.55 1.39 -1.17 -0.36 0.00 0.00 175.35 173.95 3inj s LEU 367 N 4.03 3.61 -0.14 5.43 2.96 -1.26 -0.70 118.68 132.61 3inj s LEU 367 Ca 0.30 0.85 0.08 0.00 -0.22 0.00 0.00 54.13 55.13 3inj s LEU 367 Cb -0.13 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.79 3inj s LEU 367 CO 0.18 -1.40 0.27 0.18 -1.32 0.00 0.00 176.35 174.27 3inj n LEU 368 N 8.69 1.43 -3.88 -0.68 4.77 -0.20 -5.00 117.00 122.13 3inj n LEU 368 Ca 0.16 0.16 -0.08 0.00 -0.03 0.00 0.00 56.01 56.21 3inj n LEU 368 Cb 0.48 -0.24 -0.04 0.00 -2.33 0.00 0.00 43.42 41.30 3inj n LEU 368 CO 0.70 0.63 0.32 0.00 -1.33 0.00 0.00 177.39 177.70 3inj n GLY 370 N -0.40 1.55 0.00 0.00 0.00 -1.23 -2.99 105.19 102.11 3inj n GLY 370 Ca -0.05 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.41 3inj n GLY 370 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3inj n GLY 371 N 0.00 1.20 0.00 -0.02 0.00 -1.26 -4.98 105.19 100.13 3inj n GLY 371 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3inj n GLY 371 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3inj n GLY 372 N 0.00 2.42 3.77 -0.02 0.00 -1.26 -4.87 105.19 105.23 3inj n GLY 372 Ca 0.00 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.64 3inj n GLY 372 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3inj s ILE 373 N -2.93 2.40 -1.06 -0.61 1.01 -1.26 -1.11 121.20 117.65 3inj s ILE 373 Ca 0.00 0.40 0.16 0.00 0.00 0.00 0.00 60.65 61.21 3inj s ILE 373 Cb 0.00 -3.26 -0.10 0.00 0.01 0.00 0.00 42.46 39.11 3inj s ILE 373 CO 0.00 0.09 0.75 0.00 0.00 0.00 0.00 174.94 175.78 3inj n ALA 374 N 0.59 3.71 -3.50 9.38 0.00 -0.37 -4.63 120.51 125.70 3inj n ALA 374 Ca 0.01 -0.49 -0.15 0.00 0.00 0.00 0.00 53.44 52.82 3inj n ALA 374 Cb 0.41 -0.58 -0.05 0.00 0.00 0.00 0.00 19.45 19.24 3inj n ALA 374 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3inj s ALA 375 N -2.27 -1.76 -1.20 0.00 0.00 -1.25 -4.95 121.76 110.33 3inj s ALA 375 Ca 0.09 1.13 0.27 0.00 0.00 0.00 0.00 51.96 53.45 3inj s ALA 375 Cb 0.12 0.15 0.90 0.00 0.00 0.00 0.00 23.12 24.30 3inj s ALA 375 CO 0.55 -0.49 1.68 -0.25 0.00 0.00 0.00 175.76 177.25 3inj n ASP 376 N 0.46 0.38 -4.00 0.00 8.00 -1.26 -4.68 116.55 115.45 3inj n ASP 376 Ca -0.16 -0.15 -0.24 0.00 0.71 0.00 0.00 54.79 54.95 3inj n ASP 376 Cb 0.60 -0.05 -0.17 0.00 -0.02 0.00 0.00 41.12 41.48 3inj n ASP 376 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3inj s ARG 377 N -2.84 1.58 0.00 -1.24 3.52 -1.26 -5.07 118.95 113.64 3inj s ARG 377 Ca 0.17 -0.37 0.00 0.00 -0.13 0.00 0.00 55.73 55.40 3inj s ARG 377 Cb 0.19 -1.33 0.00 0.00 -1.56 0.00 0.00 34.95 32.24 3inj s ARG 377 CO 0.59 0.01 0.00 0.41 -0.81 0.00 0.00 175.30 175.49 3inj n GLY 378 N 3.87 -1.36 2.53 8.12 0.00 -1.26 -4.70 105.19 112.40 3inj n GLY 378 Ca -0.23 -1.58 -0.36 0.00 0.00 0.00 0.00 46.02 43.85 3inj n GLY 378 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3inj n TYR 379 N -1.25 2.34 -3.48 1.61 0.53 -0.71 -4.83 117.16 111.37 3inj n TYR 379 Ca 0.00 -2.50 -0.38 0.00 -1.02 0.00 0.00 57.90 54.01 3inj n TYR 379 Cb 0.00 -1.58 -0.06 0.00 -1.03 0.00 0.00 39.34 36.67 3inj n TYR 379 CO 0.00 0.00 0.00 -0.06 -1.02 0.00 0.00 176.86 175.78 3inj s PHE 380 N -1.88 3.69 -0.01 -0.72 0.40 -1.26 0.29 117.98 118.49 3inj s PHE 380 Ca 0.54 0.96 0.04 0.00 -0.60 0.00 0.00 56.93 57.86 3inj s PHE 380 Cb 0.26 -2.32 -0.01 0.00 0.51 0.00 0.00 43.02 41.46 3inj s PHE 380 CO -0.16 0.57 -0.11 0.42 0.70 0.00 0.00 175.22 176.64 3inj s ILE 381 N -0.82 0.89 0.27 0.64 1.01 -1.26 -1.23 121.20 120.70 3inj s ILE 381 Ca 0.24 -0.51 -0.29 0.00 0.00 0.00 0.00 60.65 60.08 3inj s ILE 381 Cb -0.16 -0.75 -0.10 0.00 0.01 0.00 0.00 42.46 41.46 3inj s ILE 381 CO 0.13 0.23 1.30 -1.10 0.00 0.00 0.00 174.94 175.49 3inj s GLN 382 N -0.32 4.39 -0.00 2.79 -0.21 -0.27 -4.71 119.66 121.33 3inj s GLN 382 Ca 0.04 2.12 -0.35 0.00 0.02 0.00 0.00 55.36 57.20 3inj s GLN 382 Cb -0.05 -3.13 -0.13 0.00 1.00 0.00 0.00 33.01 30.70 3inj s GLN 382 CO -0.00 -0.18 1.72 -2.30 -2.12 0.00 0.00 175.29 172.40 3inj n PRO 383 N 1.60 1.99 -4.82 2.91 -0.02 -1.26 -4.38 135.00 131.01 3inj n PRO 383 Ca 0.03 0.73 -0.31 0.00 -2.02 0.00 0.00 63.50 61.92 3inj n PRO 383 Cb 0.42 -2.51 -0.17 0.00 -0.02 0.00 0.00 33.50 31.22 3inj n PRO 383 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3inj s THR 384 N 2.59 1.92 -0.12 3.45 2.01 -0.65 -3.54 115.64 121.30 3inj s THR 384 Ca 0.88 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 61.98 3inj s THR 384 Cb -0.74 -1.70 -0.01 0.00 0.01 0.00 0.00 72.50 70.07 3inj s THR 384 CO 0.48 0.53 -0.18 -0.69 -0.69 0.00 0.00 174.62 174.06 3inj s VAL 385 N 0.67 2.55 -0.18 3.82 1.01 -1.16 0.19 120.40 127.30 3inj s VAL 385 Ca -0.11 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 3inj s VAL 385 Cb -0.16 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 3inj s VAL 385 CO 0.02 0.54 -0.07 -0.36 0.00 0.00 0.00 175.10 175.24 3inj s PHE 386 N 0.43 2.93 0.41 5.22 0.40 0.69 -1.03 117.98 127.03 3inj s PHE 386 Ca -0.13 -0.68 0.08 0.00 -0.60 0.00 0.00 56.93 55.60 3inj s PHE 386 Cb -0.17 -1.99 0.00 0.00 0.51 0.00 0.00 43.02 41.37 3inj s PHE 386 CO 0.06 -0.31 0.53 0.20 0.70 0.00 0.00 175.22 176.40 3inj s GLY 387 N 0.86 1.93 -1.52 4.36 0.00 0.12 -0.72 107.32 112.36 3inj s GLY 387 Ca -0.02 -1.67 -0.14 0.00 0.00 0.00 0.00 44.72 42.89 3inj s GLY 387 CO 0.01 -1.50 0.84 1.22 0.00 0.00 0.00 173.10 173.66 3inj n ASP 388 N -1.79 -4.40 -4.77 1.64 8.00 -1.11 -1.78 116.55 112.33 3inj n ASP 388 Ca 0.07 -0.72 -0.38 0.00 0.71 0.00 0.00 54.79 54.46 3inj n ASP 388 Cb 0.59 -3.55 -0.04 0.00 -0.02 0.00 0.00 41.12 38.10 3inj n ASP 388 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3inj s VAL 389 N -3.21 3.64 0.09 2.53 1.01 -0.77 -4.69 120.40 119.00 3inj s VAL 389 Ca 0.62 1.38 0.09 0.00 0.00 0.00 0.00 61.98 64.06 3inj s VAL 389 Cb -0.32 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 3inj s VAL 389 CO 0.76 0.12 -0.19 -1.10 0.00 0.00 0.00 175.10 174.70 3inj s GLN 390 N -2.16 1.84 0.50 2.72 -1.52 -1.26 -4.51 119.66 115.28 3inj s GLN 390 Ca 0.54 -1.13 0.25 0.00 -1.95 0.00 0.00 55.36 53.07 3inj s GLN 390 Cb -0.25 -2.12 1.33 0.00 -0.22 0.00 0.00 33.01 31.75 3inj s GLN 390 CO 0.32 0.50 1.92 -0.44 -0.25 0.00 0.00 175.29 177.33 3inj h ASP 391 N 4.02 0.13 0.73 5.90 3.32 -1.96 -1.17 116.42 127.38 3inj h ASP 391 Ca -0.49 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.57 3inj h ASP 391 Cb 1.16 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3inj h ASP 391 CO 0.46 0.06 -0.13 0.61 -1.72 0.00 0.00 179.24 178.51 3inj n GLY 392 N -1.63 -1.33 3.77 2.75 0.00 -1.26 -4.60 105.19 102.89 3inj n GLY 392 Ca 0.15 -0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 3inj n GLY 392 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3inj s MET 393 N -2.87 3.77 0.24 1.61 -1.94 -0.44 -4.94 119.30 114.73 3inj s MET 393 Ca 0.17 1.77 -0.05 0.00 -1.71 0.00 0.00 55.69 55.87 3inj s MET 393 Cb 0.19 -2.41 0.33 0.00 2.01 0.00 0.00 34.83 34.95 3inj s MET 393 CO 0.55 -0.54 1.85 1.15 -0.01 0.00 0.00 175.02 178.03 3inj h THR 394 N 1.89 1.04 0.00 2.05 2.02 -1.89 -1.26 112.91 116.76 3inj h THR 394 Ca -0.49 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.35 3inj h THR 394 Cb 1.25 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3inj h THR 394 CO 0.60 0.18 0.00 2.30 0.37 0.00 0.00 175.52 178.97 3inj n ILE 395 N -4.62 0.99 1.06 3.11 -5.35 -1.26 -1.47 119.36 111.82 3inj n ILE 395 Ca 0.12 0.25 0.11 0.00 -0.27 0.00 0.00 62.75 62.97 3inj n ILE 395 Cb 0.17 -1.05 0.08 0.00 -1.74 0.00 0.00 39.64 37.10 3inj n ILE 395 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3inj n ALA 396 N -1.56 3.48 -0.02 -1.28 0.00 -0.49 -4.59 120.51 116.06 3inj n ALA 396 Ca 0.03 -0.59 -0.02 0.00 0.00 0.00 0.00 53.44 52.86 3inj n ALA 396 Cb 0.18 -0.87 -0.01 0.00 0.00 0.00 0.00 19.45 18.74 3inj n ALA 396 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3inj n LYS 397 N -0.19 0.08 -3.68 0.00 5.02 -0.68 -4.97 118.16 113.73 3inj n LYS 397 Ca 0.10 0.02 -0.36 0.00 -2.02 0.00 0.00 58.31 56.05 3inj n LYS 397 Cb 0.44 -1.05 -0.06 0.00 -0.02 0.00 0.00 35.03 34.34 3inj n LYS 397 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3inj s GLU 398 N -2.06 3.67 -0.12 1.97 2.02 -0.54 -4.94 118.70 118.71 3inj s GLU 398 Ca -0.04 0.09 -0.29 0.00 0.02 0.00 0.00 54.97 54.74 3inj s GLU 398 Cb 0.01 -3.11 -0.03 0.00 0.10 0.00 0.00 34.13 31.10 3inj s GLU 398 CO 0.07 0.66 1.41 -2.00 0.02 0.00 0.00 175.26 175.42 3inj s GLU 399 N -1.51 4.22 -0.03 1.61 2.12 -1.26 -4.82 118.70 119.03 3inj s GLU 399 Ca 0.26 1.87 0.04 0.00 0.36 0.00 0.00 54.97 57.49 3inj s GLU 399 Cb -0.14 -3.83 -0.25 0.00 0.26 0.00 0.00 34.13 30.17 3inj s GLU 399 CO 0.14 -0.75 0.71 0.82 -0.54 0.00 0.00 175.26 175.64 3inj h ILE 400 N 5.49 0.96 -3.90 -3.70 2.04 -1.93 -3.48 117.51 113.00 3inj h ILE 400 Ca -0.32 -2.72 -0.40 0.00 1.00 0.00 0.00 64.86 62.42 3inj h ILE 400 Cb 1.13 2.57 0.03 0.00 -0.74 0.00 0.00 36.82 39.82 3inj h ILE 400 CO 0.96 0.71 -0.58 0.33 0.00 0.00 0.00 178.15 179.57 3inj n PHE 401 N -3.27 -1.61 -4.15 1.37 7.35 -1.26 -4.70 117.46 111.18 3inj n PHE 401 Ca -0.18 0.34 -0.16 0.00 -0.76 0.00 0.00 57.45 56.69 3inj n PHE 401 Cb 1.04 -4.29 -0.05 0.00 0.35 0.00 0.00 39.48 36.53 3inj n PHE 401 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3inj n GLY 402 N -1.35 2.49 2.39 7.13 0.00 -1.21 -4.13 105.19 110.52 3inj n GLY 402 Ca -0.16 -1.73 -0.40 0.00 0.00 0.00 0.00 46.02 43.73 3inj n GLY 402 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3inj n PRO 403 N -0.59 3.76 -3.99 1.61 -0.05 -1.21 -4.45 135.00 130.08 3inj n PRO 403 Ca 0.04 -2.47 -0.31 0.00 -0.05 0.00 0.00 63.50 60.71 3inj n PRO 403 Cb 0.58 -2.83 -0.16 0.00 -0.05 0.00 0.00 33.50 31.05 3inj n PRO 403 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 175.50 175.53 3inj s VAL 404 N 1.72 1.74 -0.10 0.52 1.01 -1.26 -1.64 120.40 122.39 3inj s VAL 404 Ca 0.64 -1.27 -0.13 0.00 0.00 0.00 0.00 61.98 61.23 3inj s VAL 404 Cb 0.17 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 3inj s VAL 404 CO -0.07 -0.00 0.30 -0.32 0.00 0.00 0.00 175.10 175.01 3inj s MET 405 N 1.31 3.95 -0.19 2.72 1.75 0.13 -5.00 119.30 123.98 3inj s MET 405 Ca -0.05 0.16 -0.02 0.00 -1.25 0.00 0.00 55.69 54.52 3inj s MET 405 Cb -0.18 -3.30 -0.01 0.00 2.84 0.00 0.00 34.83 34.18 3inj s MET 405 CO -0.06 0.52 -0.08 -0.65 -0.65 0.00 0.00 175.02 174.09 3inj s GLN 406 N -0.40 3.35 -0.14 4.11 1.11 -1.26 -0.22 119.66 126.21 3inj s GLN 406 Ca 0.19 -0.65 -0.01 0.00 0.01 0.00 0.00 55.36 54.90 3inj s GLN 406 Cb -0.14 -2.87 -0.01 0.00 -1.01 0.00 0.00 33.01 28.98 3inj s GLN 406 CO 0.07 -0.08 -0.12 0.42 0.01 0.00 0.00 175.29 175.59 3inj s ILE 407 N 1.13 3.07 -0.03 1.08 1.01 0.10 -1.37 121.20 126.20 3inj s ILE 407 Ca 0.01 -0.64 0.05 0.00 0.00 0.00 0.00 60.65 60.07 3inj s ILE 407 Cb -0.14 -2.31 -0.01 0.00 0.01 0.00 0.00 42.46 40.01 3inj s ILE 407 CO -0.02 0.51 -0.17 -0.76 0.00 0.00 0.00 174.94 174.50 3inj s LEU 408 N 0.53 1.97 0.06 2.97 1.02 0.29 -1.84 118.68 123.68 3inj s LEU 408 Ca -0.08 -0.33 -0.12 0.00 0.02 0.00 0.00 54.13 53.62 3inj s LEU 408 Cb -0.16 -0.92 -0.06 0.00 0.02 0.00 0.00 46.19 45.08 3inj s LEU 408 CO 0.04 0.18 0.43 -0.75 0.02 0.00 0.00 176.35 176.27 3inj s LYS 409 N -0.18 3.86 0.13 1.70 2.20 -1.26 -0.52 119.74 125.68 3inj s LYS 409 Ca 0.01 0.32 -0.08 0.00 -0.36 0.00 0.00 55.97 55.87 3inj s LYS 409 Cb -0.09 -3.07 -0.01 0.00 -1.51 0.00 0.00 37.83 33.15 3inj s LYS 409 CO 0.01 0.59 0.22 -0.59 -0.36 0.00 0.00 175.35 175.22 3inj s PHE 410 N -1.29 0.39 -0.14 4.03 -0.12 -1.04 -4.87 117.98 114.93 3inj s PHE 410 Ca 0.30 -0.78 -0.05 0.00 -0.05 0.00 0.00 56.93 56.36 3inj s PHE 410 Cb -0.15 -0.12 -0.07 0.00 -0.63 0.00 0.00 43.02 42.05 3inj s PHE 410 CO 0.17 -0.63 -0.17 1.17 -0.05 0.00 0.00 175.22 175.71 3inj n LYS 411 N -0.14 0.31 -4.39 1.99 4.81 -1.26 -0.36 118.16 119.11 3inj n LYS 411 Ca -0.10 0.12 -0.25 0.00 -0.87 0.00 0.00 58.31 57.22 3inj n LYS 411 Cb 0.63 -1.07 -0.09 0.00 0.02 0.00 0.00 35.03 34.52 3inj n LYS 411 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3inj s THR 412 N -2.26 2.64 0.18 3.15 -4.23 -1.26 -4.76 115.64 109.10 3inj s THR 412 Ca -0.19 -2.08 -0.05 0.00 -1.18 0.00 0.00 61.69 58.18 3inj s THR 412 Cb 0.07 -2.69 -0.05 0.00 1.34 0.00 0.00 72.50 71.16 3inj s THR 412 CO 0.26 -0.26 1.49 -0.29 -0.54 0.00 0.00 174.62 175.29 3inj h ILE 413 N 1.94 1.30 -0.74 2.99 2.10 -1.99 -2.21 117.51 120.90 3inj h ILE 413 Ca -0.42 -1.74 -0.01 0.00 1.08 0.00 0.00 64.86 63.77 3inj h ILE 413 Cb 1.25 1.68 -0.04 0.00 -1.09 0.00 0.00 36.82 38.63 3inj h ILE 413 CO 0.65 0.55 0.43 -0.33 -1.08 0.00 0.00 178.15 178.37 3inj h GLU 414 N 0.51 1.02 0.24 2.19 3.07 -2.00 -2.39 114.58 117.22 3inj h GLU 414 Ca 0.02 -0.10 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 3inj h GLU 414 Cb 1.07 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.78 3inj h GLU 414 CO 0.10 0.74 -0.11 1.49 -1.40 0.00 0.00 179.01 179.83 3inj h GLU 415 N 1.01 -0.31 -0.51 2.33 4.81 -1.92 -2.64 114.58 117.35 3inj h GLU 415 Ca 0.26 0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.43 3inj h GLU 415 Cb -0.00 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 3inj h GLU 415 CO -0.05 -0.20 -0.03 -0.24 -0.73 0.00 0.00 179.01 177.76 3inj h VAL 416 N -0.32 1.26 -0.41 0.32 3.04 -1.34 -0.47 116.25 118.32 3inj h VAL 416 Ca -0.03 -1.10 -0.01 0.00 -1.01 0.00 0.00 66.70 64.54 3inj h VAL 416 Cb 0.25 0.89 -0.02 0.00 -2.01 0.00 0.00 31.29 30.40 3inj h VAL 416 CO 0.05 0.39 0.22 1.62 -1.01 0.00 0.00 177.57 178.84 3inj h VAL 417 N 0.82 1.16 -0.65 1.51 3.04 -1.41 0.27 116.25 120.99 3inj h VAL 417 Ca 0.15 -0.43 -0.08 0.00 -1.01 0.00 0.00 66.70 65.32 3inj h VAL 417 Cb 0.53 0.69 -0.03 0.00 -2.01 0.00 0.00 31.29 30.48 3inj h VAL 417 CO 0.03 0.17 0.09 1.23 -1.01 0.00 0.00 177.57 178.07 3inj h GLY 418 N 0.53 1.18 1.23 3.17 0.00 -1.08 -1.19 103.07 106.91 3inj h GLY 418 Ca 0.14 -0.80 -0.17 0.00 0.00 0.00 0.00 47.33 46.50 3inj h GLY 418 CO -0.02 0.74 -0.47 3.21 0.00 0.00 0.00 176.54 180.00 3inj h ARG 419 N 1.01 0.83 -0.48 4.80 3.08 -0.86 -1.77 114.38 120.98 3inj h ARG 419 Ca 0.20 -0.48 -0.02 0.00 0.07 0.00 0.00 59.98 59.75 3inj h ARG 419 Cb 0.47 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 3inj h ARG 419 CO 0.02 1.11 0.21 0.00 -1.07 0.00 0.00 179.97 180.24 3inj h ALA 420 N 0.81 0.63 0.00 0.04 0.00 -0.34 -2.86 119.26 117.53 3inj h ALA 420 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3inj h ALA 420 Cb 1.05 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3inj h ALA 420 CO 0.10 0.22 0.00 0.09 0.00 0.00 0.00 179.25 179.66 3inj n ASN 421 N -4.59 0.19 -3.98 0.00 3.02 -0.46 -4.30 115.26 105.15 3inj n ASN 421 Ca 0.02 0.52 -0.43 0.00 -0.03 0.00 0.00 54.58 54.66 3inj n ASN 421 Cb 0.14 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 38.74 3inj n ASN 421 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3inj n ASN 422 N -1.68 4.63 -3.68 6.41 5.15 -0.67 -4.84 115.26 120.57 3inj n ASN 422 Ca 0.06 -2.97 -0.15 0.00 -0.60 0.00 0.00 54.58 50.92 3inj n ASN 422 Cb 0.33 -1.59 -0.08 0.00 -0.53 0.00 0.00 39.78 37.90 3inj n ASN 422 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3inj s SER 423 N 2.40 -0.39 0.00 1.20 0.15 -1.26 -5.00 113.70 110.79 3inj s SER 423 Ca 0.45 0.45 0.29 0.00 0.70 0.00 0.00 55.95 57.83 3inj s SER 423 Cb 0.09 0.51 1.17 0.00 -1.71 0.00 0.00 66.02 66.08 3inj s SER 423 CO -0.02 -0.44 1.85 0.35 1.20 0.00 0.00 173.24 176.18 3inj n THR 424 N 1.47 0.00 -3.33 6.45 -2.24 -1.26 -4.84 114.28 110.52 3inj n THR 424 Ca -0.19 -0.01 -0.23 0.00 -2.27 0.00 0.00 64.05 61.34 3inj n THR 424 Cb 0.56 -0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.50 3inj n THR 424 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3inj s TYR 425 N -2.81 3.40 -0.22 4.78 4.12 -1.26 -1.79 117.35 123.57 3inj s TYR 425 Ca 0.19 0.25 0.08 0.00 0.02 0.00 0.00 57.07 57.61 3inj s TYR 425 Cb 0.19 -1.98 0.25 0.00 -1.52 0.00 0.00 41.96 38.90 3inj s TYR 425 CO 0.53 0.02 1.15 0.41 0.02 0.00 0.00 175.55 177.68 3inj n GLY 426 N -1.82 0.82 0.14 0.71 0.00 -1.23 -4.86 105.19 98.95 3inj n GLY 426 Ca -0.03 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 3inj n GLY 426 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3inj h LEU 427 N 0.71 -0.20 -8.61 0.99 5.85 -1.82 -0.97 115.31 111.27 3inj h LEU 427 Ca -0.29 -0.28 -0.28 0.00 0.84 0.00 0.00 57.88 57.87 3inj h LEU 427 Cb 1.19 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 42.15 3inj h LEU 427 CO -0.12 0.36 -0.42 0.00 -0.34 0.00 0.00 178.44 177.92 3inj s ALA 428 N -3.46 1.06 0.07 1.25 0.00 -1.26 -2.38 121.76 117.05 3inj s ALA 428 Ca -0.10 -1.64 -0.26 0.00 0.00 0.00 0.00 51.96 49.95 3inj s ALA 428 Cb 0.00 1.32 0.09 0.00 0.00 0.00 0.00 23.12 24.53 3inj s ALA 428 CO 0.38 -0.69 0.74 0.00 0.00 0.00 0.00 175.76 176.19 3inj s ALA 429 N -3.72 -1.71 0.02 0.00 0.00 0.35 -4.03 121.76 112.67 3inj s ALA 429 Ca 0.35 0.78 -0.03 0.00 0.00 0.00 0.00 51.96 53.06 3inj s ALA 429 Cb 0.03 0.61 -0.01 0.00 0.00 0.00 0.00 23.12 23.75 3inj s ALA 429 CO 0.17 -0.71 0.05 0.00 0.00 0.00 0.00 175.76 175.27 3inj s ALA 430 N -3.32 -0.03 -0.05 0.00 0.00 -0.11 -0.58 121.76 117.66 3inj s ALA 430 Ca 0.02 -0.48 -0.00 0.00 0.00 0.00 0.00 51.96 51.50 3inj s ALA 430 Cb -0.01 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.30 3inj s ALA 430 CO -0.10 -0.22 -0.00 0.08 0.00 0.00 0.00 175.76 175.52 3inj s VAL 431 N -1.83 0.31 -0.25 0.00 1.01 0.13 -0.48 120.40 119.29 3inj s VAL 431 Ca -0.12 0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.92 3inj s VAL 431 Cb -0.06 -0.44 0.01 0.00 0.00 0.00 0.00 36.38 35.89 3inj s VAL 431 CO -0.01 0.22 -0.02 -0.36 0.00 0.00 0.00 175.10 174.92 3inj s PHE 432 N 1.53 3.04 0.04 5.22 0.40 0.15 -0.39 117.98 127.97 3inj s PHE 432 Ca -0.02 -1.16 -0.27 0.00 -0.60 0.00 0.00 56.93 54.88 3inj s PHE 432 Cb -0.13 -2.12 0.09 0.00 0.51 0.00 0.00 43.02 41.37 3inj s PHE 432 CO -0.03 -0.62 0.80 -0.08 0.70 0.00 0.00 175.22 175.99 3inj s THR 433 N 1.43 0.00 -2.04 0.64 -1.32 -1.26 -1.24 115.64 111.85 3inj s THR 433 Ca 0.03 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 60.69 3inj s THR 433 Cb -0.16 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 69.93 3inj s THR 433 CO -0.02 0.00 1.01 0.29 -2.21 0.00 0.00 174.62 173.69 3inj n LYS 434 N -0.28 1.52 -3.54 7.08 5.02 -1.25 -4.85 118.16 121.87 3inj n LYS 434 Ca -0.11 -1.36 -0.37 0.00 -2.02 0.00 0.00 58.31 54.45 3inj n LYS 434 Cb 0.63 -1.33 -0.08 0.00 -0.02 0.00 0.00 35.03 34.23 3inj n LYS 434 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3inj s ASP 435 N -1.62 6.29 0.10 4.39 -1.08 -1.26 -5.00 116.67 118.50 3inj s ASP 435 Ca 0.19 0.33 -0.27 0.00 -0.52 0.00 0.00 52.55 52.28 3inj s ASP 435 Cb 0.14 -2.17 -0.10 0.00 -1.46 0.00 0.00 42.92 39.34 3inj s ASP 435 CO 0.28 0.02 1.65 0.25 0.52 0.00 0.00 175.17 177.89 3inj h LEU 436 N 7.41 -0.64 -0.81 -1.34 5.85 -2.00 -1.67 115.31 122.12 3inj h LEU 436 Ca -0.38 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.36 3inj h LEU 436 Cb 1.16 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.39 3inj h LEU 436 CO 0.70 -0.33 0.27 0.44 -0.34 0.00 0.00 178.44 179.18 3inj h ASP 437 N -0.46 1.07 -0.79 1.25 3.45 -1.99 -1.16 116.42 117.79 3inj h ASP 437 Ca 0.01 -0.18 -0.01 0.00 0.43 0.00 0.00 57.03 57.28 3inj h ASP 437 Cb 0.46 -0.28 -0.04 0.00 -0.56 0.00 0.00 39.33 38.91 3inj h ASP 437 CO -0.09 0.97 0.44 0.11 -1.57 0.00 0.00 179.24 179.10 3inj h LYS 438 N 1.11 1.10 -0.11 3.56 1.57 -1.95 0.14 116.57 121.99 3inj h LYS 438 Ca 0.25 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 3inj h LYS 438 Cb 0.26 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 3inj h LYS 438 CO -0.01 0.80 0.02 0.00 -0.57 0.00 0.00 179.45 179.69 3inj h ALA 439 N 1.23 0.15 -0.72 3.86 0.00 -0.75 -1.99 119.26 121.03 3inj h ALA 439 Ca 0.28 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3inj h ALA 439 Cb 0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3inj h ALA 439 CO -0.05 -0.21 0.23 -0.91 0.00 0.00 0.00 179.25 178.32 3inj h ASN 440 N -0.03 1.04 0.18 0.00 2.35 -1.10 -1.38 115.58 116.64 3inj h ASN 440 Ca 0.03 -0.20 0.01 0.00 -0.55 0.00 0.00 56.30 55.59 3inj h ASN 440 Cb 0.27 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 3inj h ASN 440 CO 0.00 0.97 -0.20 0.22 -1.65 0.00 0.00 177.43 176.77 3inj h TYR 441 N 1.06 -0.52 -0.34 1.19 3.20 -0.65 -2.60 116.97 118.32 3inj h TYR 441 Ca 0.23 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.99 3inj h TYR 441 Cb 0.29 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 3inj h TYR 441 CO 0.02 -0.29 -0.24 -0.07 -1.64 0.00 0.00 178.16 175.94 3inj h LEU 442 N -0.42 0.80 -1.51 2.82 3.38 -1.33 -1.85 115.31 117.20 3inj h LEU 442 Ca 0.01 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 3inj h LEU 442 Cb 0.40 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3inj h LEU 442 CO -0.06 1.06 0.04 0.77 0.09 0.00 0.00 178.44 180.34 3inj h SER 443 N 0.53 0.32 -0.01 -0.43 4.64 -1.27 0.59 113.55 117.93 3inj h SER 443 Ca 0.07 -0.04 -0.18 0.00 -0.47 0.00 0.00 61.79 61.17 3inj h SER 443 Cb 0.80 -0.08 0.01 0.00 -0.31 0.00 0.00 62.40 62.82 3inj h SER 443 CO 0.06 0.35 -0.68 -0.61 -0.87 0.00 0.00 176.83 175.09 3inj h GLN 444 N 0.35 0.48 0.00 4.77 4.15 -1.37 -3.36 115.11 120.14 3inj h GLN 444 Ca 0.08 -0.50 -0.14 0.00 0.77 0.00 0.00 58.65 58.86 3inj h GLN 444 Cb 0.17 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.98 3inj h GLN 444 CO -0.00 1.14 -0.68 0.00 -1.93 0.00 0.00 178.83 177.36 3inj h ALA 445 N 0.35 0.56 -2.61 3.38 0.00 -0.90 -3.45 119.26 116.59 3inj h ALA 445 Ca -0.08 -0.62 -0.53 0.00 0.00 0.00 0.00 54.91 53.69 3inj h ALA 445 Cb 1.37 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 19.08 3inj h ALA 445 CO 0.13 0.84 0.68 -0.51 0.00 0.00 0.00 179.25 180.40 3inj s LEU 446 N -6.54 4.39 -1.19 0.00 1.43 0.16 -4.92 118.68 112.01 3inj s LEU 446 Ca 0.03 2.35 -0.07 0.00 -1.03 0.00 0.00 54.13 55.42 3inj s LEU 446 Cb 0.08 -3.60 0.23 0.00 0.03 0.00 0.00 46.19 42.93 3inj s LEU 446 CO 0.77 -0.58 1.75 0.00 0.23 0.00 0.00 176.35 178.52 3inj n GLN 447 N 3.24 4.13 -3.98 1.70 6.02 -1.26 -4.94 117.38 122.28 3inj n GLN 447 Ca 0.08 -4.00 -0.09 0.00 -0.01 0.00 0.00 57.00 52.99 3inj n GLN 447 Cb 0.43 -2.71 -0.11 0.00 1.02 0.00 0.00 30.24 28.86 3inj n GLN 447 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3inj s ALA 448 N -1.25 0.14 0.34 -1.58 0.00 -1.26 -4.57 121.76 113.58 3inj s ALA 448 Ca 0.37 -0.60 0.10 0.00 0.00 0.00 0.00 51.96 51.82 3inj s ALA 448 Cb 0.09 0.15 0.63 0.00 0.00 0.00 0.00 23.12 23.98 3inj s ALA 448 CO 0.04 -0.16 1.79 0.78 0.00 0.00 0.00 175.76 178.21 3inj h GLY 449 N 4.63 0.16 -6.24 0.00 0.00 -0.94 -3.42 103.07 97.26 3inj h GLY 449 Ca -0.32 -0.13 -0.40 0.00 0.00 0.00 0.00 47.33 46.48 3inj h GLY 449 CO 0.41 0.12 -0.77 -1.59 0.00 0.00 0.00 176.54 174.71 3inj s THR 450 N -4.28 0.48 -0.23 4.70 2.01 -1.09 -4.73 115.64 112.50 3inj s THR 450 Ca -0.04 -0.09 0.00 0.00 0.31 0.00 0.00 61.69 61.87 3inj s THR 450 Cb 0.14 -0.52 0.03 0.00 0.01 0.00 0.00 72.50 72.17 3inj s THR 450 CO 0.75 0.21 -0.12 -0.69 -0.69 0.00 0.00 174.62 174.08 3inj s VAL 451 N 0.92 2.43 -0.04 3.82 1.01 -1.26 -0.49 120.40 126.79 3inj s VAL 451 Ca -0.11 -1.18 -0.17 0.00 0.00 0.00 0.00 61.98 60.52 3inj s VAL 451 Cb -0.14 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.95 3inj s VAL 451 CO -0.00 0.23 0.47 0.26 0.00 0.00 0.00 175.10 176.06 3inj s TRP 452 N 1.25 3.64 -0.25 5.22 0.51 0.25 -4.98 118.94 124.58 3inj s TRP 452 Ca -0.01 0.99 -0.01 0.00 -2.12 0.00 0.00 56.10 54.95 3inj s TRP 452 Cb -0.17 -2.45 0.03 0.00 -0.81 0.00 0.00 33.47 30.08 3inj s TRP 452 CO -0.07 0.41 -0.06 0.08 -0.51 0.00 0.00 176.95 176.80 3inj s VAL 453 N -0.28 2.85 -1.52 4.03 1.01 -1.26 -0.70 120.40 124.53 3inj s VAL 453 Ca 0.26 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3inj s VAL 453 Cb -0.16 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.74 3inj s VAL 453 CO 0.13 0.16 0.00 0.59 0.00 0.00 0.00 175.10 175.98 3inj n ASN 454 N 4.65 -4.95 -3.20 3.32 3.02 0.48 -4.97 115.26 113.61 3inj n ASN 454 Ca -0.16 0.10 -0.07 0.00 -0.03 0.00 0.00 54.58 54.42 3inj n ASN 454 Cb 0.46 -4.02 0.01 0.00 -0.61 0.00 0.00 39.78 35.63 3inj n ASN 454 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3inj s TYR 456 N -2.62 -0.43 -1.73 0.00 5.04 -1.26 -4.74 117.35 111.61 3inj s TYR 456 Ca 0.15 0.86 0.00 0.00 -2.44 0.00 0.00 57.07 55.64 3inj s TYR 456 Cb -0.05 0.21 0.00 0.00 0.35 0.00 0.00 41.96 42.47 3inj s TYR 456 CO 0.09 -0.40 0.00 -0.25 -1.34 0.00 0.00 175.55 173.65 3inj n ASP 457 N 1.71 -5.70 -4.56 4.32 8.00 -1.26 -4.92 116.55 114.14 3inj n ASP 457 Ca -0.18 0.01 -0.42 0.00 0.71 0.00 0.00 54.79 54.91 3inj n ASP 457 Cb 0.56 -4.73 -0.03 0.00 -0.02 0.00 0.00 41.12 36.90 3inj n ASP 457 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3inj s VAL 458 N -2.98 4.03 -0.04 2.53 1.01 -1.26 -5.01 120.40 118.68 3inj s VAL 458 Ca 0.00 0.65 -0.01 0.00 0.00 0.00 0.00 61.98 62.62 3inj s VAL 458 Cb 0.00 -4.74 -0.04 0.00 0.00 0.00 0.00 36.38 31.61 3inj s VAL 458 CO 0.00 -1.42 0.05 -0.36 0.00 0.00 0.00 175.10 173.36 3inj s PHE 459 N 4.92 3.23 -0.07 5.22 0.40 -1.26 -5.11 117.98 125.32 3inj s PHE 459 Ca 0.38 0.20 -0.06 0.00 -0.60 0.00 0.00 56.93 56.85 3inj s PHE 459 Cb -0.09 -1.75 0.02 0.00 0.51 0.00 0.00 43.02 41.71 3inj s PHE 459 CO 0.22 0.52 0.17 0.20 0.70 0.00 0.00 175.22 177.03 3inj s GLY 460 N -1.40 -0.13 0.60 4.36 0.00 -1.26 -5.01 107.32 104.47 3inj s GLY 460 Ca 0.19 0.50 0.40 0.00 0.00 0.00 0.00 44.72 45.81 3inj s GLY 460 CO 0.09 0.45 2.22 0.00 0.00 0.00 0.00 173.10 175.86 3inj h ALA 461 N 5.93 1.00 -0.00 3.20 0.00 -1.96 -2.51 119.26 124.92 3inj h ALA 461 Ca -0.26 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.49 3inj h ALA 461 Cb 1.20 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 3inj h ALA 461 CO 0.40 0.00 -0.77 1.96 0.00 0.00 0.00 179.25 180.84 3inj h GLN 462 N 0.00 0.06 -5.40 0.00 7.50 -1.94 0.47 115.11 115.80 3inj h GLN 462 Ca 0.00 -0.06 -0.64 0.00 0.50 0.00 0.00 58.65 58.45 3inj h GLN 462 Cb 0.06 0.02 -0.20 0.00 0.05 0.00 0.00 27.48 27.41 3inj h GLN 462 CO 0.00 0.80 -0.65 -1.12 -1.50 0.00 0.00 178.83 176.36 3inj s SER 463 N -6.84 4.96 0.76 1.46 0.01 -0.95 -3.73 113.70 109.37 3inj s SER 463 Ca -0.01 -0.06 -0.13 0.00 1.31 0.00 0.00 55.95 57.05 3inj s SER 463 Cb 0.11 -1.75 0.06 0.00 0.21 0.00 0.00 66.02 64.65 3inj s SER 463 CO 0.79 0.20 1.16 -2.16 0.41 0.00 0.00 173.24 173.64 3inj s PRO 464 N 0.18 2.06 -0.12 12.44 0.05 -1.26 -4.26 135.00 144.09 3inj s PRO 464 Ca -0.01 1.56 -0.06 0.00 0.05 0.00 0.00 61.00 62.55 3inj s PRO 464 Cb -0.13 -1.84 0.05 0.00 0.05 0.00 0.00 34.50 32.62 3inj s PRO 464 CO 0.02 -1.85 0.27 0.12 0.05 0.00 0.00 177.00 175.61 3inj s PHE 465 N -2.31 -0.39 0.00 0.56 5.36 0.55 -4.94 117.98 116.81 3inj s PHE 465 Ca 0.70 0.89 0.00 0.00 -0.96 0.00 0.00 56.93 57.56 3inj s PHE 465 Cb -0.24 0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.49 3inj s PHE 465 CO 0.48 -0.28 0.00 0.41 -1.46 0.00 0.00 175.22 174.38 3inj n GLY 466 N 4.50 -0.60 3.86 13.12 0.00 -1.26 -0.87 105.19 123.94 3inj n GLY 466 Ca -0.21 -0.96 -0.31 0.00 0.00 0.00 0.00 46.02 44.54 3inj n GLY 466 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3inj s GLY 467 N 0.00 2.12 0.48 -0.02 0.00 -1.26 -3.90 107.32 104.74 3inj s GLY 467 Ca 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 44.72 43.78 3inj s GLY 467 CO 0.00 -0.87 0.76 -0.19 0.00 0.00 0.00 173.10 172.81 3inj s TYR 468 N -1.44 3.50 0.00 1.90 1.51 -0.46 -4.27 117.35 118.09 3inj s TYR 468 Ca 0.32 0.70 0.00 0.00 -1.01 0.00 0.00 57.07 57.07 3inj s TYR 468 Cb -0.13 -2.31 0.00 0.00 -0.11 0.00 0.00 41.96 39.42 3inj s TYR 468 CO 0.25 -0.30 0.00 1.63 -1.11 0.00 0.00 175.55 176.01 3inj n LYS 469 N -2.23 0.00 -0.74 -0.62 5.02 -1.26 -2.08 118.16 116.25 3inj n LYS 469 Ca 0.00 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 3inj n LYS 469 Cb 0.56 0.00 0.38 0.00 -0.02 0.00 0.00 35.03 35.95 3inj n LYS 469 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3inj n MET 470 N 14.00 4.22 0.00 1.97 2.81 -0.74 -3.69 117.12 135.69 3inj n MET 470 Ca 0.00 -3.02 0.14 0.00 -1.81 0.00 0.00 57.70 53.02 3inj n MET 470 Cb 0.00 -2.05 0.62 0.00 -0.71 0.00 0.00 33.22 31.08 3inj n MET 470 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3inj n SER 471 N 0.95 0.87 0.00 7.83 7.64 -0.88 -4.43 113.62 125.61 3inj n SER 471 Ca 0.27 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 59.05 3inj n SER 471 Cb 1.02 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.22 3inj n SER 471 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3inj n GLY 472 N 1.18 0.75 3.22 0.23 0.00 -1.24 -0.70 105.19 108.63 3inj n GLY 472 Ca 0.18 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 3inj n GLY 472 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3inj s SER 473 N -4.00 -0.23 0.00 1.61 1.04 -0.61 -4.44 113.70 107.07 3inj s SER 473 Ca 0.00 0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.70 3inj s SER 473 Cb 0.00 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.55 3inj s SER 473 CO 0.00 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.51 3inj n GLY 474 N 1.88 -0.97 3.08 7.32 0.00 -1.26 -2.13 105.19 113.11 3inj n GLY 474 Ca -0.19 -1.65 -0.17 0.00 0.00 0.00 0.00 46.02 44.01 3inj n GLY 474 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3inj s ARG 475 N -1.86 0.70 0.29 1.61 1.81 -1.26 -4.16 118.95 116.08 3inj s ARG 475 Ca 0.00 -0.66 0.09 0.00 -1.72 0.00 0.00 55.73 53.44 3inj s ARG 475 Cb 0.00 -0.63 -0.04 0.00 -0.45 0.00 0.00 34.95 33.83 3inj s ARG 475 CO 0.00 0.15 0.04 -1.21 -0.68 0.00 0.00 175.30 173.60 3inj s GLU 476 N -1.12 2.31 0.22 3.54 2.02 -0.05 -3.95 118.70 121.68 3inj s GLU 476 Ca -0.02 -1.48 0.00 0.00 0.02 0.00 0.00 54.97 53.49 3inj s GLU 476 Cb -0.08 -2.15 0.00 0.00 0.10 0.00 0.00 34.13 32.00 3inj s GLU 476 CO 0.01 0.27 0.00 1.28 0.02 0.00 0.00 175.26 176.84 3inj n LEU 477 N -0.98 -0.39 0.00 1.80 4.77 -1.26 -0.33 117.00 120.61 3inj n LEU 477 Ca -0.05 0.91 0.06 0.00 -0.03 0.00 0.00 56.01 56.89 3inj n LEU 477 Cb 0.60 -1.77 -0.02 0.00 -2.33 0.00 0.00 43.42 39.91 3inj n LEU 477 CO 0.41 -1.16 -0.08 0.61 -1.33 0.00 0.00 177.39 175.84 3inj n GLY 478 N -3.18 -1.37 0.29 -0.72 0.00 0.16 -1.48 105.19 98.88 3inj n GLY 478 Ca -0.02 -1.10 0.05 0.00 0.00 0.00 0.00 46.02 44.94 3inj n GLY 478 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3inj h GLU 479 N 0.00 0.37 0.00 1.61 4.81 -1.86 -2.84 114.58 116.67 3inj h GLU 479 Ca 0.01 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 3inj h GLU 479 Cb 0.41 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 3inj h GLU 479 CO 0.00 0.28 -0.19 1.88 -0.73 0.00 0.00 179.01 180.26 3inj h TYR 480 N 0.38 0.00 0.00 0.92 -1.99 -1.93 -2.32 116.97 112.04 3inj h TYR 480 Ca 0.10 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.83 3inj h TYR 480 Cb 0.02 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.75 3inj h TYR 480 CO 0.00 0.19 0.00 0.41 -0.00 0.00 0.00 178.16 178.76 3inj n GLY 481 N -0.99 -0.86 0.08 3.88 0.00 -0.55 -1.88 105.19 104.88 3inj n GLY 481 Ca -0.02 0.14 -0.06 0.00 0.00 0.00 0.00 46.02 46.08 3inj n GLY 481 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3inj h LEU 482 N 0.00 0.00 -0.55 0.99 3.38 -1.59 -3.39 115.31 114.14 3inj h LEU 482 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 3inj h LEU 482 Cb 0.06 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 3inj h LEU 482 CO 0.00 0.89 0.17 1.56 0.09 0.00 0.00 178.44 181.15 3inj h GLN 483 N 0.00 0.33 0.00 1.13 4.20 -1.52 -1.35 115.11 117.90 3inj h GLN 483 Ca -0.15 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.54 3inj h GLN 483 Cb 1.81 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.51 3inj h GLN 483 CO 0.09 0.22 0.00 0.00 -0.67 0.00 0.00 178.83 178.47 3inj h ALA 484 N 1.39 1.00 -0.41 3.87 0.00 -1.76 -2.68 119.26 120.67 3inj h ALA 484 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3inj h ALA 484 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3inj h ALA 484 CO -0.30 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.61 3inj n TYR 485 N -2.54 0.54 -5.06 0.00 4.02 -0.52 -4.90 117.16 108.69 3inj n TYR 485 Ca 0.00 -0.38 -0.32 0.00 -0.01 0.00 0.00 57.90 57.19 3inj n TYR 485 Cb 0.17 -0.01 -0.16 0.00 -0.02 0.00 0.00 39.34 39.32 3inj n TYR 485 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3inj s THR 486 N -1.11 2.48 -0.18 -0.72 2.01 -1.01 -2.29 115.64 114.82 3inj s THR 486 Ca 0.32 -0.89 -0.05 0.00 0.31 0.00 0.00 61.69 61.37 3inj s THR 486 Cb 0.18 -1.97 -0.03 0.00 0.01 0.00 0.00 72.50 70.69 3inj s THR 486 CO 0.24 0.56 0.01 -0.70 -0.69 0.00 0.00 174.62 174.04 3inj s GLU 487 N 0.03 3.75 -0.18 4.92 2.56 0.12 -4.74 118.70 125.17 3inj s GLU 487 Ca -0.08 -0.46 -0.16 0.00 0.00 0.00 0.00 54.97 54.27 3inj s GLU 487 Cb -0.15 -3.08 -0.04 0.00 2.00 0.00 0.00 34.13 32.86 3inj s GLU 487 CO 0.05 0.16 0.39 0.08 -0.56 0.00 0.00 175.26 175.38 3inj s VAL 488 N 0.63 5.22 -0.14 3.70 1.01 -1.26 -0.66 120.40 128.89 3inj s VAL 488 Ca 0.00 0.72 0.02 0.00 0.00 0.00 0.00 61.98 62.72 3inj s VAL 488 Cb -0.14 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.52 3inj s VAL 488 CO 0.02 0.29 -0.19 -0.75 0.00 0.00 0.00 175.10 174.47 3inj s LYS 489 N 1.02 3.12 -0.08 2.72 2.20 -0.43 -4.97 119.74 123.33 3inj s LYS 489 Ca 0.20 -0.80 -0.19 0.00 -0.36 0.00 0.00 55.97 54.82 3inj s LYS 489 Cb -0.14 -2.51 -0.05 0.00 -1.51 0.00 0.00 37.83 33.62 3inj s LYS 489 CO 0.08 0.03 0.52 0.99 -0.36 0.00 0.00 175.35 176.60 3inj s THR 490 N 0.75 5.10 -0.17 3.43 2.01 -1.26 -0.22 115.64 125.28 3inj s THR 490 Ca -0.08 1.05 -0.00 0.00 0.31 0.00 0.00 61.69 62.97 3inj s THR 490 Cb -0.16 -3.85 0.00 0.00 0.01 0.00 0.00 72.50 68.50 3inj s THR 490 CO 0.00 0.36 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.47 3inj s VAL 491 N 0.31 2.70 -0.16 3.82 1.01 0.72 -4.99 120.40 123.80 3inj s VAL 491 Ca 0.28 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.52 3inj s VAL 491 Cb -0.16 -2.16 0.02 0.00 0.00 0.00 0.00 36.38 34.08 3inj s VAL 491 CO 0.13 0.50 -0.16 -0.89 0.00 0.00 0.00 175.10 174.68 3inj s THR 492 N 1.01 1.76 -0.14 3.92 2.01 -1.26 -1.36 115.64 121.57 3inj s THR 492 Ca -0.01 -0.76 0.02 0.00 0.31 0.00 0.00 61.69 61.25 3inj s THR 492 Cb -0.15 -1.63 0.01 0.00 0.01 0.00 0.00 72.50 70.74 3inj s THR 492 CO -0.03 0.48 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.47 3inj s VAL 493 N 1.41 2.06 0.12 3.82 1.01 0.15 -4.94 120.40 124.03 3inj s VAL 493 Ca 0.05 -0.98 -0.31 0.00 0.00 0.00 0.00 61.98 60.74 3inj s VAL 493 Cb -0.13 -1.82 -0.10 0.00 0.00 0.00 0.00 36.38 34.33 3inj s VAL 493 CO -0.12 0.55 1.79 -0.75 0.00 0.00 0.00 175.10 176.57 3inj s LYS 494 N 0.84 4.15 0.23 2.72 2.20 -1.26 -0.10 119.74 128.53 3inj s LYS 494 Ca -0.06 2.55 0.11 0.00 -0.36 0.00 0.00 55.97 58.21 3inj s LYS 494 Cb -0.15 -3.54 -0.05 0.00 -1.51 0.00 0.00 37.83 32.58 3inj s LYS 494 CO -0.03 -0.81 -0.18 0.14 -0.36 0.00 0.00 175.35 174.11 3inj s VAL 495 N 2.56 2.64 0.13 4.02 -7.23 -0.54 -4.88 120.40 117.10 3inj s VAL 495 Ca 0.79 -2.12 -0.19 0.00 -1.81 0.00 0.00 61.98 58.65 3inj s VAL 495 Cb -0.45 -2.34 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 3inj s VAL 495 CO 0.35 -0.26 1.73 -0.65 -0.31 0.00 0.00 175.10 175.97 3inj h PRO 496 N 2.65 0.09 -1.80 4.82 0.11 -1.95 -3.43 132.00 132.49 3inj h PRO 496 Ca -0.44 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 3inj h PRO 496 Cb 1.23 -0.02 -0.24 0.00 0.11 0.00 0.00 31.00 32.08 3inj h PRO 496 CO 0.55 0.06 -0.30 -1.14 -0.21 0.00 0.00 178.00 176.96 3inj s GLN 497 N -6.19 0.47 0.09 1.05 0.74 -1.26 -5.03 119.66 109.53 3inj s GLN 497 Ca -0.13 1.04 -0.30 0.00 0.05 0.00 0.00 55.36 56.01 3inj s GLN 497 Cb 0.10 0.37 -0.06 0.00 1.10 0.00 0.00 33.01 34.52 3inj s GLN 497 CO 0.69 -0.43 1.19 0.21 -0.55 0.00 0.00 175.29 176.40 3inj s LYS 498 N 2.75 4.46 0.16 1.67 2.36 -1.26 -5.04 119.74 124.83 3inj s LYS 498 Ca 0.07 1.78 0.06 0.00 -2.55 0.00 0.00 55.97 55.32 3inj s LYS 498 Cb -0.14 -3.33 -0.04 0.00 -1.05 0.00 0.00 37.83 33.27 3inj s LYS 498 CO -0.17 -0.20 -0.13 -0.80 1.55 0.00 0.00 175.35 175.60 3inj s ASN 499 N 0.83 2.14 0.00 1.43 0.01 -1.26 -4.99 114.94 113.09 3inj s ASN 499 Ca 0.57 -0.97 0.06 0.00 -0.71 0.00 0.00 52.86 51.81 3inj s ASN 499 Cb -0.30 -0.07 0.36 0.00 0.41 0.00 0.00 41.25 41.65 3inj s ASN 499 CO 0.31 -0.23 0.83 -1.54 -1.51 0.00 0.00 177.10 174.96