#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 0.66 0.61 0.00 1.01 -1.26 -5.02 120.40 116.40 3inj s VAL 8 Ca 0.00 -0.32 -0.19 0.00 0.00 0.00 0.00 61.98 61.47 3inj s VAL 8 Cb 0.00 -0.93 -0.03 0.00 0.00 0.00 0.00 36.38 35.42 3inj s VAL 8 CO 0.00 0.08 1.20 -2.65 0.00 0.00 0.00 175.10 173.73 3inj n PRO 9 N 5.03 1.17 -1.77 2.72 -0.02 -1.26 -4.91 135.00 135.96 3inj n PRO 9 Ca -0.09 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.42 3inj n PRO 9 Cb 0.48 -2.42 -0.02 0.00 -0.02 0.00 0.00 33.50 31.53 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 -1.40 3.78 0.29 3.55 0.00 -1.26 -4.97 121.76 121.74 3inj s ALA 10 Ca 0.78 1.58 -0.14 0.00 0.00 0.00 0.00 51.96 54.18 3inj s ALA 10 Cb -0.40 -3.66 -0.08 0.00 0.00 0.00 0.00 23.12 18.98 3inj s ALA 10 CO 0.44 -0.98 0.68 -1.25 0.00 0.00 0.00 175.76 174.66 3inj s PRO 11 N -0.25 3.95 -0.50 0.00 0.05 -1.26 -5.04 135.00 131.95 3inj s PRO 11 Ca 0.65 0.56 -0.26 0.00 0.05 0.00 0.00 61.00 62.00 3inj s PRO 11 Cb -0.48 -2.51 0.03 0.00 0.05 0.00 0.00 34.50 31.59 3inj s PRO 11 CO 0.46 0.21 1.02 1.21 0.05 0.00 0.00 177.00 179.94 3inj s ASN 12 N -2.28 6.49 0.27 6.66 3.84 -1.26 -4.93 114.94 123.72 3inj s ASN 12 Ca 0.52 0.09 0.25 0.00 0.21 0.00 0.00 52.86 53.93 3inj s ASN 12 Cb -0.11 -2.48 0.96 0.00 -0.55 0.00 0.00 41.25 39.07 3inj s ASN 12 CO 0.19 -1.20 1.74 1.56 -2.79 0.00 0.00 177.10 176.60 3inj h GLN 13 N 9.23 0.00 -2.06 0.43 4.20 -1.96 -3.21 115.11 121.74 3inj h GLN 13 Ca -0.24 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 57.94 3inj h GLN 13 Cb 1.07 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.45 3inj h GLN 13 CO 1.09 0.00 -1.03 1.04 -0.67 0.00 0.00 178.83 179.26 3inj n GLN 14 N -2.31 1.39 -1.98 1.46 6.02 -1.26 -4.98 117.38 115.72 3inj n GLN 14 Ca 0.03 -3.69 -0.38 0.00 -0.01 0.00 0.00 57.00 52.95 3inj n GLN 14 Cb 0.28 -1.70 0.02 0.00 1.02 0.00 0.00 30.24 29.86 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 -2.24 3.41 0.44 -1.09 0.04 -1.21 -4.97 135.00 129.37 3inj s PRO 15 Ca 0.40 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 63.26 3inj s PRO 15 Cb 0.27 -2.33 -0.08 0.00 0.04 0.00 0.00 34.50 32.40 3inj s PRO 15 CO -0.09 -0.92 1.14 -2.00 0.04 0.00 0.00 177.00 175.17 3inj s GLU 16 N -2.80 3.88 -0.22 4.56 2.12 -1.26 -5.02 118.70 119.95 3inj s GLU 16 Ca 0.68 1.72 -0.08 0.00 0.36 0.00 0.00 54.97 57.65 3inj s GLU 16 Cb -0.36 -2.46 -0.04 0.00 0.26 0.00 0.00 34.13 31.53 3inj s GLU 16 CO 0.43 -0.44 0.10 0.08 -0.54 0.00 0.00 175.26 174.88 3inj s VAL 17 N -1.56 4.84 -0.03 3.70 1.01 -1.26 -4.97 120.40 122.14 3inj s VAL 17 Ca 0.62 -0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.68 3inj s VAL 17 Cb -0.27 -3.23 -0.12 0.00 0.00 0.00 0.00 36.38 32.75 3inj s VAL 17 CO 0.34 0.39 0.15 0.49 0.00 0.00 0.00 175.10 176.46 3inj n PHE 18 N 4.16 0.00 -4.03 5.22 3.01 -1.26 -4.95 117.46 119.61 3inj n PHE 18 Ca -0.16 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.01 3inj n PHE 18 Cb 0.52 -0.24 -0.17 0.00 -0.01 0.00 0.00 39.48 39.58 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 4.77 0.57 -1.02 0.00 6.94 -1.26 -4.66 115.26 120.60 3inj n ASN 20 Ca -0.16 -2.03 0.00 0.00 -0.02 0.00 0.00 54.58 52.37 3inj n ASN 20 Cb 0.50 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.77 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 -0.05 0.48 -3.22 -3.83 6.02 -1.26 -2.11 117.38 113.40 3inj n GLN 21 Ca -0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.58 3inj n GLN 21 Cb 0.96 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 32.16 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 -1.60 5.13 -0.38 5.09 1.01 -0.58 -4.73 121.20 125.13 3inj s ILE 22 Ca 0.00 1.10 -0.14 0.00 0.00 0.00 0.00 60.65 61.61 3inj s ILE 22 Cb 0.00 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.59 3inj s ILE 22 CO 0.00 0.27 0.28 0.12 0.00 0.00 0.00 174.94 175.61 3inj s PHE 23 N 0.90 3.24 -0.06 3.97 5.36 -0.00 -0.26 117.98 131.12 3inj s PHE 23 Ca 0.29 -0.43 -0.02 0.00 -0.96 0.00 0.00 56.93 55.80 3inj s PHE 23 Cb -0.16 -2.54 0.04 0.00 -0.34 0.00 0.00 43.02 40.02 3inj s PHE 23 CO 0.12 -0.49 0.12 0.42 -1.46 0.00 0.00 175.22 173.93 3inj s ILE 24 N 1.70 -0.12 -1.37 3.12 1.01 -0.41 -0.13 121.20 124.99 3inj s ILE 24 Ca 0.05 0.26 -0.09 0.00 0.00 0.00 0.00 60.65 60.88 3inj s ILE 24 Cb -0.18 -0.22 0.02 0.00 0.01 0.00 0.00 42.46 42.08 3inj s ILE 24 CO 0.10 0.11 1.16 0.59 0.00 0.00 0.00 174.94 176.90 3inj n ASN 25 N 4.64 -6.01 -2.30 3.58 3.02 -1.26 -2.13 115.26 114.80 3inj n ASN 25 Ca -0.18 -0.57 -0.20 0.00 -0.03 0.00 0.00 54.58 53.60 3inj n ASN 25 Cb 0.51 -4.93 -0.02 0.00 -0.61 0.00 0.00 39.78 34.73 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 -3.01 -5.72 -4.11 6.41 5.03 -1.26 -4.62 115.26 107.97 3inj n ASN 26 Ca -0.00 0.06 -0.11 0.00 0.87 0.00 0.00 54.58 55.40 3inj n ASN 26 Cb 0.56 -4.80 -0.10 0.00 -1.02 0.00 0.00 39.78 34.41 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 -4.88 0.68 -0.19 3.52 2.02 -0.90 -5.03 118.70 113.90 3inj s GLU 27 Ca 0.00 -1.09 -0.09 0.00 0.02 0.00 0.00 54.97 53.80 3inj s GLU 27 Cb 0.00 -0.16 -0.05 0.00 0.10 0.00 0.00 34.13 34.03 3inj s GLU 27 CO 0.00 -0.01 0.12 -1.58 0.02 0.00 0.00 175.26 173.81 3inj s TRP 28 N -2.83 3.40 0.10 1.61 0.52 -1.26 -1.29 118.94 119.19 3inj s TRP 28 Ca 0.03 0.31 0.08 0.00 0.02 0.00 0.00 56.10 56.54 3inj s TRP 28 Cb -0.00 -2.13 -0.03 0.00 -1.15 0.00 0.00 33.47 30.16 3inj s TRP 28 CO -0.04 0.31 -0.21 -1.01 0.02 0.00 0.00 176.95 176.03 3inj s HIS 29 N 0.23 1.76 0.61 -1.98 3.76 0.64 -4.94 115.29 115.37 3inj s HIS 29 Ca 0.08 -0.42 -0.14 0.00 -0.15 0.00 0.00 55.06 54.44 3inj s HIS 29 Cb -0.11 -0.97 -0.03 0.00 1.11 0.00 0.00 32.58 32.58 3inj s HIS 29 CO -0.01 0.19 1.04 -0.51 -0.85 0.00 0.00 174.74 174.60 3inj s ASP 30 N -1.85 5.88 0.66 1.40 -0.00 -1.26 -1.53 116.67 119.98 3inj s ASP 30 Ca 0.06 1.65 -0.17 0.00 -0.00 0.00 0.00 52.55 54.08 3inj s ASP 30 Cb -0.10 -2.51 -0.01 0.00 -0.00 0.00 0.00 42.92 40.31 3inj s ASP 30 CO 0.04 -1.10 1.19 0.00 -0.00 0.00 0.00 175.17 175.30 3inj n ALA 31 N -2.40 0.74 0.31 5.23 0.00 -1.26 -4.86 120.51 118.26 3inj n ALA 31 Ca 0.08 -0.05 0.20 0.00 0.00 0.00 0.00 53.44 53.67 3inj n ALA 31 Cb 0.53 -2.26 0.95 0.00 0.00 0.00 0.00 19.45 18.67 3inj n ALA 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3inj h VAL 32 N 0.32 0.01 0.00 0.00 2.07 -1.95 0.21 116.25 116.90 3inj h VAL 32 Ca -0.50 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 66.75 3inj h VAL 32 Cb 1.34 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.38 3inj h VAL 32 CO 0.51 0.00 -0.62 0.77 0.02 0.00 0.00 177.57 178.26 3inj h SER 33 N 0.00 0.00 0.00 0.57 4.64 -1.91 -3.47 113.55 113.38 3inj h SER 33 Ca -0.00 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 3inj h SER 33 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3inj h SER 33 CO 0.00 0.08 0.00 0.54 -0.87 0.00 0.00 176.83 176.58 3inj n ARG 34 N -2.26 -0.45 -2.45 4.77 5.12 0.72 -5.00 116.66 117.11 3inj n ARG 34 Ca 0.03 0.11 -0.36 0.00 -1.93 0.00 0.00 57.85 55.70 3inj n ARG 34 Cb 0.46 -3.66 -0.03 0.00 -1.16 0.00 0.00 32.46 28.08 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 -0.68 4.00 0.16 5.56 1.02 -1.26 -4.87 119.74 123.68 3inj s LYS 35 Ca 0.00 1.59 0.03 0.00 0.02 0.00 0.00 55.97 57.61 3inj s LYS 35 Cb 0.00 -2.46 -0.05 0.00 -0.52 0.00 0.00 37.83 34.80 3inj s LYS 35 CO 0.00 -0.30 -0.04 0.95 -0.92 0.00 0.00 175.35 175.04 3inj s THR 36 N -1.64 0.89 0.10 2.17 -4.23 -1.26 -1.30 115.64 110.36 3inj s THR 36 Ca 0.60 -2.01 0.05 0.00 -1.18 0.00 0.00 61.69 59.16 3inj s THR 36 Cb -0.24 -2.00 -0.03 0.00 1.34 0.00 0.00 72.50 71.57 3inj s THR 36 CO 0.29 -0.61 -0.14 0.72 -0.54 0.00 0.00 174.62 174.35 3inj s PHE 37 N -3.51 1.28 0.23 3.99 -0.12 -0.06 -4.82 117.98 114.98 3inj s PHE 37 Ca 0.20 -0.53 -0.30 0.00 -0.05 0.00 0.00 56.93 56.26 3inj s PHE 37 Cb 0.05 -0.69 -0.09 0.00 -0.63 0.00 0.00 43.02 41.65 3inj s PHE 37 CO 0.02 0.09 0.97 -1.25 -0.05 0.00 0.00 175.22 175.00 3inj s PRO 38 N -2.29 4.81 -0.11 1.99 0.04 -1.26 -0.00 135.00 138.18 3inj s PRO 38 Ca 0.04 1.53 -0.02 0.00 0.04 0.00 0.00 61.00 62.59 3inj s PRO 38 Cb -0.07 -3.27 -0.03 0.00 0.04 0.00 0.00 34.50 31.17 3inj s PRO 38 CO 0.02 0.45 -0.02 -0.08 0.04 0.00 0.00 177.00 177.41 3inj s THR 39 N -1.07 4.08 0.09 1.26 -1.32 -0.58 -4.91 115.64 113.19 3inj s THR 39 Ca 0.42 -0.32 0.05 0.00 -1.21 0.00 0.00 61.69 60.64 3inj s THR 39 Cb -0.27 -2.74 -0.04 0.00 -1.51 0.00 0.00 72.50 67.94 3inj s THR 39 CO 0.33 0.56 -0.01 -0.69 -2.21 0.00 0.00 174.62 172.60 3inj s VAL 40 N -0.37 3.96 -0.32 5.08 1.01 -1.26 0.66 120.40 129.16 3inj s VAL 40 Ca 0.07 -1.03 -0.27 0.00 0.00 0.00 0.00 61.98 60.74 3inj s VAL 40 Cb -0.12 -2.89 0.01 0.00 0.00 0.00 0.00 36.38 33.38 3inj s VAL 40 CO 0.02 0.11 1.00 0.21 0.00 0.00 0.00 175.10 176.44 3inj s ASN 41 N -2.33 6.85 0.62 3.32 3.04 0.12 -4.75 114.94 121.81 3inj s ASN 41 Ca 0.26 0.92 0.40 0.00 0.04 0.00 0.00 52.86 54.47 3inj s ASN 41 Cb -0.12 -2.51 2.07 0.00 -1.54 0.00 0.00 41.25 39.16 3inj s ASN 41 CO 0.18 -0.82 2.25 -0.65 -3.04 0.00 0.00 177.10 175.02 3inj h PRO 42 N 8.13 0.00 0.00 0.43 0.11 -1.81 0.30 132.00 139.17 3inj h PRO 42 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3inj h PRO 42 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3inj h PRO 42 CO 1.00 0.01 -0.12 0.77 -0.21 0.00 0.00 178.00 179.45 3inj h SER 43 N 0.00 0.00 0.00 -2.05 0.02 -1.89 -2.49 113.55 107.13 3inj h SER 43 Ca -0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3inj h SER 43 Cb 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 3inj h SER 43 CO 0.00 0.00 -0.54 0.35 -1.14 0.00 0.00 176.83 175.51 3inj n THR 44 N -2.81 0.00 -0.84 -2.27 -2.24 -1.02 -3.83 114.28 101.28 3inj n THR 44 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 3inj n THR 44 Cb 0.50 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 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 1.54 0.67 3.91 3.38 0.00 0.10 -4.08 105.19 110.72 3inj n GLY 45 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3inj n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3inj s GLU 46 N -0.16 3.50 0.29 1.61 2.02 -1.23 -4.82 118.70 119.92 3inj s GLU 46 Ca 0.00 -0.31 -0.30 0.00 0.02 0.00 0.00 54.97 54.38 3inj s GLU 46 Cb 0.00 -3.00 -0.11 0.00 0.10 0.00 0.00 34.13 31.12 3inj s GLU 46 CO 0.00 0.58 1.60 0.08 0.02 0.00 0.00 175.26 177.53 3inj s VAL 47 N -1.52 2.06 -0.16 2.63 1.01 -1.26 0.14 120.40 123.29 3inj s VAL 47 Ca 0.35 0.05 -0.16 0.00 0.00 0.00 0.00 61.98 62.22 3inj s VAL 47 Cb -0.13 -3.03 -0.23 0.00 0.00 0.00 0.00 36.38 32.99 3inj s VAL 47 CO 0.25 0.01 0.33 0.40 0.00 0.00 0.00 175.10 176.10 3inj h ILE 48 N 3.38 0.87 -1.96 2.22 2.04 -0.07 -3.44 117.51 120.55 3inj h ILE 48 Ca -0.47 -2.27 0.28 0.00 1.00 0.00 0.00 64.86 63.40 3inj h ILE 48 Cb 1.22 2.42 -0.08 0.00 -0.74 0.00 0.00 36.82 39.64 3inj h ILE 48 CO 0.79 0.56 0.76 0.00 0.00 0.00 0.00 178.15 180.27 3inj s GLN 50 N -2.37 3.72 0.01 0.00 -1.52 -1.26 -1.53 119.66 116.72 3inj s GLN 50 Ca 0.20 0.14 0.05 0.00 -1.95 0.00 0.00 55.36 53.80 3inj s GLN 50 Cb 0.01 -2.68 -0.02 0.00 -0.22 0.00 0.00 33.01 30.10 3inj s GLN 50 CO -0.00 0.32 -0.15 0.08 -0.25 0.00 0.00 175.29 175.28 3inj s VAL 51 N -1.86 1.17 0.03 1.09 1.01 1.00 -4.88 120.40 117.96 3inj s VAL 51 Ca 0.45 -0.81 -0.36 0.00 0.00 0.00 0.00 61.98 61.26 3inj s VAL 51 Cb -0.11 -1.01 -0.15 0.00 0.00 0.00 0.00 36.38 35.10 3inj s VAL 51 CO 0.24 0.19 1.53 0.00 0.00 0.00 0.00 175.10 177.06 3inj n ALA 52 N 2.34 -0.03 -3.06 5.51 0.00 -0.90 -0.89 120.51 123.48 3inj n ALA 52 Ca -0.16 0.45 -0.45 0.00 0.00 0.00 0.00 53.44 53.29 3inj n ALA 52 Cb 0.55 -2.22 -0.03 0.00 0.00 0.00 0.00 19.45 17.75 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 1.48 3.43 0.30 0.00 2.12 -0.42 -4.36 118.70 121.24 3inj s GLU 53 Ca 0.86 -1.75 -0.29 0.00 0.36 0.00 0.00 54.97 54.15 3inj s GLU 53 Cb -0.87 -4.59 -0.10 0.00 0.26 0.00 0.00 34.13 28.83 3inj s GLU 53 CO 0.48 -1.61 1.20 0.20 -0.54 0.00 0.00 175.26 175.00 3inj s GLY 54 N 3.29 3.00 0.00 -1.50 0.00 0.14 -4.81 107.32 107.44 3inj s GLY 54 Ca 0.23 1.07 0.00 0.00 0.00 0.00 0.00 44.72 46.02 3inj s GLY 54 CO -0.04 1.72 0.00 1.34 0.00 0.00 0.00 173.10 176.12 3inj n ASP 55 N 1.13 1.15 -0.24 1.64 -0.08 -1.26 -3.85 116.55 115.05 3inj n ASP 55 Ca -0.00 -0.81 0.03 0.00 -1.51 0.00 0.00 54.79 52.50 3inj n ASP 55 Cb 0.43 0.00 0.15 0.00 2.34 0.00 0.00 41.12 44.04 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 0.45 -0.19 -0.67 3.64 -1.91 -0.18 116.57 117.72 3inj h LYS 56 Ca 0.00 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 3inj h LYS 56 Cb 0.00 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 3inj h LYS 56 CO 0.00 0.30 -0.11 0.93 -2.27 0.00 0.00 179.45 178.30 3inj h GLU 57 N 0.47 0.29 -0.00 1.90 5.08 -1.97 -0.67 114.58 119.67 3inj h GLU 57 Ca 0.36 -0.07 -0.21 0.00 -1.00 0.00 0.00 59.36 58.45 3inj h GLU 57 Cb 0.49 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 3inj h GLU 57 CO -0.34 0.42 -0.90 -0.44 -1.00 0.00 0.00 179.01 176.75 3inj h ASP 58 N 0.28 0.38 -0.26 1.42 3.32 -1.60 -2.68 116.42 117.29 3inj h ASP 58 Ca 0.06 -0.31 -0.13 0.00 0.02 0.00 0.00 57.03 56.67 3inj h ASP 58 Cb 0.38 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 3inj h ASP 58 CO 0.02 1.10 -0.29 0.58 -1.72 0.00 0.00 179.24 178.93 3inj h VAL 59 N 0.17 1.28 -0.25 -1.35 2.07 -0.69 -2.33 116.25 115.15 3inj h VAL 59 Ca -0.06 -1.43 0.02 0.00 0.82 0.00 0.00 66.70 66.06 3inj h VAL 59 Cb 1.53 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 3inj h VAL 59 CO 0.15 0.47 0.10 0.44 0.02 0.00 0.00 177.57 178.75 3inj h ASP 60 N 0.65 0.14 -0.50 0.57 3.32 -1.08 0.75 116.42 120.27 3inj h ASP 60 Ca 0.08 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.18 3inj h ASP 60 Cb 0.81 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.32 3inj h ASP 60 CO 0.07 0.11 0.27 0.11 -1.72 0.00 0.00 179.24 178.08 3inj h LYS 61 N 0.23 0.52 -0.80 3.56 1.57 -1.42 -0.98 116.57 119.24 3inj h LYS 61 Ca 0.10 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3inj h LYS 61 Cb 0.05 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 3inj h LYS 61 CO -0.09 0.34 0.51 0.00 -0.57 0.00 0.00 179.45 179.64 3inj h ALA 62 N 1.25 1.02 -0.16 3.86 0.00 -0.84 -1.80 119.26 122.59 3inj h ALA 62 Ca 0.21 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.86 3inj h ALA 62 Cb 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3inj h ALA 62 CO -0.13 0.45 -0.68 0.28 0.00 0.00 0.00 179.25 179.17 3inj h VAL 63 N 1.09 1.31 -0.61 0.00 2.07 -0.54 -1.54 116.25 118.04 3inj h VAL 63 Ca 0.29 -1.95 -0.04 0.00 0.82 0.00 0.00 66.70 65.83 3inj h VAL 63 Cb -0.09 1.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 3inj h VAL 63 CO -0.06 0.61 0.23 0.11 0.02 0.00 0.00 177.57 178.48 3inj h LYS 64 N 0.46 0.89 -0.31 1.57 1.57 -1.00 0.16 116.57 119.91 3inj h LYS 64 Ca -0.02 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 3inj h LYS 64 Cb 1.28 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 3inj h LYS 64 CO 0.13 0.74 -0.05 0.00 -0.57 0.00 0.00 179.45 179.70 3inj h ALA 65 N 1.38 0.43 -0.57 3.86 0.00 -1.14 -2.18 119.26 121.04 3inj h ALA 65 Ca 0.20 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3inj h ALA 65 Cb 0.19 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3inj h ALA 65 CO -0.02 0.24 0.11 0.00 0.00 0.00 0.00 179.25 179.58 3inj h ALA 66 N 0.81 0.75 -0.47 0.00 0.00 -0.92 -2.05 119.26 117.39 3inj h ALA 66 Ca 0.08 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.78 3inj h ALA 66 Cb 0.53 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 3inj h ALA 66 CO 0.03 0.49 0.26 -0.09 0.00 0.00 0.00 179.25 179.93 3inj h ARG 67 N 0.83 0.49 -0.84 0.00 9.65 -0.93 -2.12 114.38 121.46 3inj h ARG 67 Ca 0.17 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 59.02 3inj h ARG 67 Cb 0.39 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.82 3inj h ARG 67 CO 0.01 0.33 0.50 0.00 2.80 0.00 0.00 179.97 183.60 3inj h ALA 68 N 1.23 1.30 0.00 2.80 0.00 -1.14 -1.74 119.26 121.71 3inj h ALA 68 Ca 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3inj h ALA 68 Cb 0.06 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 3inj h ALA 68 CO -0.11 0.60 -0.03 0.00 0.00 0.00 0.00 179.25 179.70 3inj h ALA 69 N 1.39 1.02 -0.01 0.00 0.00 -0.92 -2.84 119.26 117.90 3inj h ALA 69 Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3inj h ALA 69 Cb -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3inj h ALA 69 CO -0.06 0.04 -0.34 0.34 0.00 0.00 0.00 179.25 179.23 3inj n PHE 70 N -3.16 0.00 -1.70 0.00 7.35 -0.69 -4.38 117.46 114.87 3inj n PHE 70 Ca -0.00 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.25 3inj n PHE 70 Cb 0.27 -0.03 -0.02 0.00 0.35 0.00 0.00 39.48 40.05 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 -0.05 2.34 -1.55 -4.13 1.13 -0.99 -4.89 117.38 109.25 3inj n GLN 71 Ca 0.11 0.83 -0.49 0.00 -1.94 0.00 0.00 57.00 55.52 3inj n GLN 71 Cb 0.44 -2.56 -0.04 0.00 0.11 0.00 0.00 30.24 28.20 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 2.32 1.02 0.00 1.08 7.94 -1.26 -1.16 117.00 126.94 3inj n LEU 72 Ca 0.11 1.15 0.00 0.00 -1.11 0.00 0.00 56.01 56.16 3inj n LEU 72 Cb 0.34 -1.16 0.00 0.00 0.53 0.00 0.00 43.42 43.12 3inj n LEU 72 CO 0.63 -1.63 0.00 0.61 -1.11 0.00 0.00 177.39 175.89 3inj n GLY 73 N 1.82 2.02 3.72 -3.96 0.00 -1.26 -5.03 105.19 102.49 3inj n GLY 73 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.45 3.64 0.27 1.61 1.04 -0.31 -4.76 113.70 111.74 3inj s SER 74 Ca 0.00 1.75 -0.01 0.00 0.48 0.00 0.00 55.95 58.18 3inj s SER 74 Cb 0.00 -2.39 0.47 0.00 0.10 0.00 0.00 66.02 64.20 3inj s SER 74 CO 0.00 -2.57 1.86 -0.65 0.98 0.00 0.00 173.24 172.86 3inj h PRO 75 N -1.50 1.06 -0.22 4.02 0.11 -1.88 -0.61 132.00 132.97 3inj h PRO 75 Ca -0.47 -0.06 -0.14 0.00 0.11 0.00 0.00 66.00 65.44 3inj h PRO 75 Cb 1.26 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3inj h PRO 75 CO 0.51 0.70 -0.45 2.35 -0.21 0.00 0.00 178.00 180.90 3inj h TRP 76 N 1.09 0.68 -0.06 0.65 -0.00 -1.92 -1.91 115.95 114.48 3inj h TRP 76 Ca 0.46 -0.21 -0.19 0.00 -0.00 0.00 0.00 58.89 58.95 3inj h TRP 76 Cb 0.31 -0.14 -0.00 0.00 -0.00 0.00 0.00 29.16 29.33 3inj h TRP 76 CO -0.00 0.91 -0.78 0.00 -0.00 0.00 0.00 178.44 178.57 3inj h ARG 77 N 0.46 0.41 0.00 2.65 2.47 -1.61 -3.33 114.38 115.43 3inj h ARG 77 Ca 0.03 -0.36 -0.13 0.00 -1.26 0.00 0.00 59.98 58.27 3inj h ARG 77 Cb 0.96 0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 29.35 3inj h ARG 77 CO 0.09 1.00 -0.87 0.00 0.56 0.00 0.00 179.97 180.75 3inj h ARG 78 N 0.27 0.00 -6.62 0.04 3.08 -1.05 -3.47 114.38 106.63 3inj h ARG 78 Ca -0.04 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.43 3inj h ARG 78 Cb 1.37 0.00 0.09 0.00 0.08 0.00 0.00 29.97 31.51 3inj h ARG 78 CO 0.13 0.41 0.54 -0.12 -1.07 0.00 0.00 179.97 179.87 3inj n MET 79 N -3.08 1.99 -1.71 0.04 1.56 -0.73 -4.90 117.12 110.30 3inj n MET 79 Ca -0.02 0.71 -0.39 0.00 -0.27 0.00 0.00 57.70 57.72 3inj n MET 79 Cb 0.77 -2.32 0.03 0.00 2.15 0.00 0.00 33.22 33.85 3inj n MET 79 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 3inj n ASP 80 N 1.72 2.39 -0.27 6.12 8.00 -1.26 -4.85 116.55 128.40 3inj n ASP 80 Ca 0.10 1.01 0.04 0.00 0.71 0.00 0.00 54.79 56.65 3inj n ASP 80 Cb 0.33 -1.52 0.18 0.00 -0.02 0.00 0.00 41.12 40.08 3inj n ASP 80 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3inj h ALA 81 N 1.58 1.11 0.00 2.24 0.00 -1.90 -0.56 119.26 121.73 3inj h ALA 81 Ca -0.49 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 3inj h ALA 81 Cb 1.31 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 3inj h ALA 81 CO 0.57 -0.07 -0.05 0.66 0.00 0.00 0.00 179.25 180.36 3inj h SER 82 N 0.60 0.00 0.39 0.00 4.64 -1.90 -2.31 113.55 114.97 3inj h SER 82 Ca 0.40 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.45 3inj h SER 82 Cb 0.50 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.60 3inj h SER 82 CO -0.32 0.05 -1.18 -0.74 -0.87 0.00 0.00 176.83 173.77 3inj h HIS 83 N 0.00 0.71 -0.95 4.77 6.17 -1.45 -1.47 115.15 122.92 3inj h HIS 83 Ca -0.00 -0.46 0.13 0.00 0.71 0.00 0.00 60.37 60.75 3inj h HIS 83 Cb 0.12 -0.05 -0.09 0.00 2.52 0.00 0.00 27.41 29.91 3inj h HIS 83 CO 0.00 1.32 0.58 0.00 0.71 0.00 0.00 177.93 180.54 3inj h ARG 84 N 0.18 0.86 -0.79 5.26 3.08 -1.10 0.31 114.38 122.19 3inj h ARG 84 Ca -0.14 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 3inj h ARG 84 Cb 1.86 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 31.68 3inj h ARG 84 CO 0.21 0.57 0.42 0.78 -1.07 0.00 0.00 179.97 180.88 3inj h GLY 85 N 0.89 1.18 1.02 0.04 0.00 -1.22 -1.70 103.07 103.28 3inj h GLY 85 Ca 0.48 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 3inj h GLY 85 CO -0.29 0.52 0.34 3.21 0.00 0.00 0.00 176.54 180.33 3inj h ARG 86 N 1.09 1.08 -0.71 4.80 2.47 -0.08 -2.28 114.38 120.76 3inj h ARG 86 Ca 0.28 -0.17 -0.07 0.00 -1.26 0.00 0.00 59.98 58.76 3inj h ARG 86 Cb 0.05 -0.19 -0.03 0.00 -1.65 0.00 0.00 29.97 28.15 3inj h ARG 86 CO -0.04 0.85 0.17 -0.07 0.56 0.00 0.00 179.97 181.44 3inj h LEU 87 N 1.05 1.07 -0.58 3.04 3.38 -0.62 -1.36 115.31 121.28 3inj h LEU 87 Ca 0.25 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 3inj h LEU 87 Cb 0.14 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3inj h LEU 87 CO -0.03 1.02 0.12 -0.07 0.09 0.00 0.00 178.44 179.57 3inj h LEU 88 N 1.07 0.91 -1.08 1.67 3.38 -1.13 -0.68 115.31 119.44 3inj h LEU 88 Ca 0.22 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3inj h LEU 88 Cb 0.37 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3inj h LEU 88 CO 0.00 0.92 0.20 0.78 0.09 0.00 0.00 178.44 180.43 3inj h ASN 89 N 0.86 0.78 -0.34 -0.43 2.35 -1.20 -1.35 115.58 116.25 3inj h ASN 89 Ca 0.18 -0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 55.78 3inj h ASN 89 Cb 0.39 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 3inj h ASN 89 CO 0.01 0.73 0.08 -0.09 -1.65 0.00 0.00 177.43 176.50 3inj h ARG 90 N 0.83 0.55 -0.33 0.81 9.65 -0.95 -0.99 114.38 123.95 3inj h ARG 90 Ca 0.19 -0.14 0.03 0.00 -1.10 0.00 0.00 59.98 58.97 3inj h ARG 90 Cb 0.21 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.69 3inj h ARG 90 CO -0.01 0.61 0.14 1.25 2.80 0.00 0.00 179.97 184.76 3inj h LEU 91 N 0.40 0.19 -0.49 3.80 5.85 -0.86 -0.19 115.31 124.00 3inj h LEU 91 Ca 0.11 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.90 3inj h LEU 91 Cb 0.31 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 3inj h LEU 91 CO 0.00 0.14 0.22 0.00 -0.34 0.00 0.00 178.44 178.47 3inj h ALA 92 N 1.19 0.62 -0.88 1.25 0.00 -1.15 0.04 119.26 120.33 3inj h ALA 92 Ca 0.14 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.16 3inj h ALA 92 Cb 0.09 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 3inj h ALA 92 CO -0.12 -0.14 0.54 -0.44 0.00 0.00 0.00 179.25 179.09 3inj h ASP 93 N 0.44 0.84 -0.24 0.00 3.32 -0.56 0.17 116.42 120.39 3inj h ASP 93 Ca 0.22 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 3inj h ASP 93 Cb 0.17 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 3inj h ASP 93 CO -0.18 0.52 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.75 3inj h LEU 94 N 0.97 0.45 -0.76 1.55 3.38 -0.26 -1.03 115.31 119.61 3inj h LEU 94 Ca 0.39 -0.35 0.07 0.00 0.09 0.00 0.00 57.88 58.08 3inj h LEU 94 Cb 0.22 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 3inj h LEU 94 CO -0.19 0.69 0.44 0.40 0.09 0.00 0.00 178.44 179.87 3inj h ILE 95 N 0.20 0.98 -0.66 1.22 2.04 -0.68 -1.73 117.51 118.88 3inj h ILE 95 Ca 0.06 -0.27 -0.07 0.00 1.00 0.00 0.00 64.86 65.58 3inj h ILE 95 Cb 0.48 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 3inj h ILE 95 CO 0.02 0.15 0.13 -0.08 0.00 0.00 0.00 178.15 178.37 3inj h GLU 96 N 0.80 1.06 -0.85 2.37 4.81 -0.83 -1.43 114.58 120.51 3inj h GLU 96 Ca 0.34 -0.26 0.11 0.00 -0.13 0.00 0.00 59.36 59.41 3inj h GLU 96 Cb 0.21 -0.14 -0.08 0.00 0.63 0.00 0.00 28.75 29.37 3inj h GLU 96 CO -0.19 0.96 0.48 -0.09 -0.73 0.00 0.00 179.01 179.44 3inj h ARG 97 N 1.00 0.76 -0.86 1.92 2.43 -0.50 -2.16 114.38 116.98 3inj h ARG 97 Ca 0.21 -0.05 -0.34 0.00 -0.81 0.00 0.00 59.98 58.99 3inj h ARG 97 Cb 0.39 -0.17 -0.20 0.00 -0.42 0.00 0.00 29.97 29.57 3inj h ARG 97 CO 0.01 0.50 0.43 -0.25 -1.51 0.00 0.00 179.97 179.15 3inj n ASP 98 N -4.75 4.43 0.09 -3.80 8.00 -0.72 -4.71 116.55 115.10 3inj n ASP 98 Ca 0.15 -3.36 -0.12 0.00 0.71 0.00 0.00 54.79 52.16 3inj n ASP 98 Cb 0.32 -0.78 -0.07 0.00 -0.02 0.00 0.00 41.12 40.57 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 2.03 -0.19 -0.91 -1.24 2.43 -0.58 0.13 114.38 116.05 3inj h ARG 99 Ca 0.41 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.62 3inj h ARG 99 Cb 2.55 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 32.10 3inj h ARG 99 CO 0.89 -0.13 0.60 1.15 -1.51 0.00 0.00 179.97 180.97 3inj h THR 100 N -0.20 1.19 -0.04 0.20 2.02 -1.84 0.11 112.91 114.36 3inj h THR 100 Ca 0.00 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 3inj h THR 100 Cb 0.19 -0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.49 3inj h THR 100 CO -0.02 0.22 -0.01 0.22 0.37 0.00 0.00 175.52 176.30 3inj h TYR 101 N 1.19 0.08 -0.79 3.16 3.20 -1.81 -2.77 116.97 119.24 3inj h TYR 101 Ca 0.35 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.19 3inj h TYR 101 Cb -0.07 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 3inj h TYR 101 CO -0.01 0.41 0.43 -0.07 -1.64 0.00 0.00 178.16 177.28 3inj h LEU 102 N -0.27 0.98 -0.39 2.82 3.38 -0.54 -1.43 115.31 119.86 3inj h LEU 102 Ca 0.01 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.90 3inj h LEU 102 Cb 0.38 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3inj h LEU 102 CO 0.00 0.79 0.25 0.00 0.09 0.00 0.00 178.44 179.57 3inj h ALA 103 N 1.36 0.49 -0.21 1.53 0.00 -0.77 -0.55 119.26 121.11 3inj h ALA 103 Ca 0.28 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 3inj h ALA 103 Cb 0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3inj h ALA 103 CO -0.04 -0.07 -0.54 0.00 0.00 0.00 0.00 179.25 178.59 3inj h ALA 104 N 1.16 0.65 -0.28 0.00 0.00 -1.21 -2.20 119.26 117.37 3inj h ALA 104 Ca 0.15 -0.51 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 3inj h ALA 104 Cb -0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3inj h ALA 104 CO -0.05 0.69 -0.33 1.25 0.00 0.00 0.00 179.25 180.81 3inj h LEU 105 N 0.49 0.63 -0.19 0.00 5.85 -1.16 -1.12 115.31 119.81 3inj h LEU 105 Ca 0.01 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.49 3inj h LEU 105 Cb 1.09 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 3inj h LEU 105 CO 0.11 0.91 0.10 -0.08 -0.34 0.00 0.00 178.44 179.14 3inj h GLU 106 N 0.52 0.21 -0.54 1.25 4.57 -0.91 -2.25 114.58 117.42 3inj h GLU 106 Ca 0.06 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.19 3inj h GLU 106 Cb 0.82 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.33 3inj h GLU 106 CO 0.07 0.14 0.17 1.15 -1.18 0.00 0.00 179.01 179.36 3inj h THR 107 N 0.22 1.21 -0.58 0.32 2.02 -1.18 -0.54 112.91 114.38 3inj h THR 107 Ca 0.07 -0.72 -0.09 0.00 0.77 0.00 0.00 66.41 66.44 3inj h THR 107 Cb 0.00 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 3inj h THR 107 CO -0.04 0.28 0.01 0.25 0.37 0.00 0.00 175.52 176.39 3inj h LEU 108 N 0.79 0.99 0.00 2.58 5.85 -0.89 0.11 115.31 124.73 3inj h LEU 108 Ca 0.18 -0.30 -0.22 0.00 0.84 0.00 0.00 57.88 58.38 3inj h LEU 108 Cb 0.23 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 3inj h LEU 108 CO -0.01 1.05 -1.45 -0.78 -0.34 0.00 0.00 178.44 176.91 3inj h ASP 109 N 0.90 0.00 0.00 1.25 3.58 -1.29 -3.37 116.42 117.49 3inj h ASP 109 Ca 0.17 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.40 3inj h ASP 109 Cb 0.53 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.54 3inj h ASP 109 CO 0.03 0.78 -1.81 -3.20 -2.88 0.00 0.00 179.24 172.16 3inj n ASN 110 N -3.01 2.57 0.00 2.28 2.85 -0.22 -4.59 115.26 115.14 3inj n ASN 110 Ca -0.11 -0.04 0.00 0.00 -0.11 0.00 0.00 54.58 54.31 3inj n ASN 110 Cb 0.93 0.21 0.00 0.00 1.24 0.00 0.00 39.78 42.16 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 2.58 0.89 3.77 8.20 0.00 0.37 -4.48 105.19 116.51 3inj n GLY 111 Ca -0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.75 2.74 0.30 1.61 -2.85 -1.26 -3.79 119.74 115.74 3inj s LYS 112 Ca 0.00 1.44 -0.30 0.00 -1.00 0.00 0.00 55.97 56.11 3inj s LYS 112 Cb 0.00 -1.94 -0.11 0.00 -2.06 0.00 0.00 37.83 33.72 3inj s LYS 112 CO 0.00 -1.31 1.58 -2.14 0.10 0.00 0.00 175.35 173.58 3inj s PRO 113 N -4.05 4.12 0.35 1.78 0.02 -1.26 -4.51 135.00 131.45 3inj s PRO 113 Ca 0.68 2.58 0.08 0.00 0.02 0.00 0.00 61.00 64.36 3inj s PRO 113 Cb -0.21 -3.02 0.80 0.00 0.02 0.00 0.00 34.50 32.08 3inj s PRO 113 CO 0.41 -0.62 1.87 -0.92 -0.33 0.00 0.00 177.00 177.42 3inj h TYR 114 N 4.61 0.83 -0.77 6.54 3.20 -1.36 -0.79 116.97 129.23 3inj h TYR 114 Ca -0.47 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.43 3inj h TYR 114 Cb 1.22 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 39.19 3inj h TYR 114 CO 0.58 0.32 0.51 0.28 -1.64 0.00 0.00 178.16 178.21 3inj h VAL 115 N 0.72 1.19 -0.01 1.81 2.07 -1.90 -0.29 116.25 119.83 3inj h VAL 115 Ca 0.44 -0.36 -0.22 0.00 0.82 0.00 0.00 66.70 67.38 3inj h VAL 115 Cb 0.67 0.06 0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3inj h VAL 115 CO -0.20 0.19 -0.85 0.40 0.02 0.00 0.00 177.57 177.13 3inj h ILE 116 N 1.03 1.34 -0.89 4.57 1.08 -1.56 -0.74 117.51 122.34 3inj h ILE 116 Ca 0.29 -2.16 0.10 0.00 -0.39 0.00 0.00 64.86 62.70 3inj h ILE 116 Cb -0.10 2.44 -0.08 0.00 -3.07 0.00 0.00 36.82 36.01 3inj h ILE 116 CO -0.06 0.65 0.53 0.28 -0.69 0.00 0.00 178.15 178.86 3inj h SER 117 N 0.21 0.76 0.08 1.72 0.02 -0.88 0.84 113.55 116.30 3inj h SER 117 Ca -0.10 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 3inj h SER 117 Cb 1.53 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.97 3inj h SER 117 CO 0.17 0.42 -0.04 0.22 -1.14 0.00 0.00 176.83 176.46 3inj h TYR 118 N 0.87 -0.10 0.00 3.45 3.20 -1.03 -1.15 116.97 122.20 3inj h TYR 118 Ca 0.43 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 62.17 3inj h TYR 118 Cb 0.41 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 3inj h TYR 118 CO -0.04 0.39 -0.63 -0.07 -1.64 0.00 0.00 178.16 176.17 3inj h LEU 119 N -0.94 0.00 0.00 2.82 3.38 -1.11 -3.31 115.31 116.16 3inj h LEU 119 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3inj h LEU 119 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3inj h LEU 119 CO 0.02 0.63 0.00 0.52 0.09 0.00 0.00 178.44 179.70 3inj n VAL 120 N -3.29 0.00 -0.12 1.22 0.31 0.23 -4.36 118.33 112.31 3inj n VAL 120 Ca 0.01 0.26 -0.07 0.00 -0.01 0.00 0.00 64.34 64.54 3inj n VAL 120 Cb 0.77 -1.23 -0.00 0.00 -0.91 0.00 0.00 33.84 32.47 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 -0.93 0.07 4.52 3.45 -1.42 0.11 116.42 122.21 3inj h ASP 121 Ca 0.00 0.18 -0.13 0.00 0.43 0.00 0.00 57.03 57.51 3inj h ASP 121 Cb 0.00 0.46 -0.01 0.00 -0.56 0.00 0.00 39.33 39.22 3inj h ASP 121 CO 0.00 -0.29 -0.45 -0.07 -1.57 0.00 0.00 179.24 176.86 3inj h LEU 122 N -0.21 0.49 -0.55 1.55 4.07 -1.34 -0.11 115.31 119.22 3inj h LEU 122 Ca 0.19 -0.23 0.00 0.00 0.08 0.00 0.00 57.88 57.92 3inj h LEU 122 Cb 0.51 -0.14 -0.03 0.00 1.08 0.00 0.00 40.66 42.08 3inj h LEU 122 CO -0.53 0.87 0.36 -0.78 -1.08 0.00 0.00 178.44 177.28 3inj h ASP 123 N 0.37 0.64 0.20 -0.43 3.58 -1.50 -1.97 116.42 117.30 3inj h ASP 123 Ca 0.03 -0.03 -0.13 0.00 0.42 0.00 0.00 57.03 57.32 3inj h ASP 123 Cb 0.93 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.81 3inj h ASP 123 CO 0.08 0.47 -0.50 0.24 -2.88 0.00 0.00 179.24 176.65 3inj h MET 124 N 0.74 0.35 -0.06 0.28 2.86 -0.43 -1.03 114.93 117.65 3inj h MET 124 Ca 0.20 -0.20 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3inj h MET 124 Cb -0.07 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 3inj h MET 124 CO -0.04 0.77 0.03 0.28 1.06 0.00 0.00 176.91 179.01 3inj h VAL 125 N 0.28 1.10 -0.25 -2.22 2.07 -0.86 -1.08 116.25 115.29 3inj h VAL 125 Ca 0.01 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.24 3inj h VAL 125 Cb 0.98 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 3inj h VAL 125 CO 0.08 0.09 0.13 -0.07 0.02 0.00 0.00 177.57 177.82 3inj h LEU 126 N -0.03 0.21 -1.09 2.57 3.38 -1.23 -1.75 115.31 117.36 3inj h LEU 126 Ca 0.02 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3inj h LEU 126 Cb 0.12 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3inj h LEU 126 CO -0.00 0.15 0.11 0.11 0.09 0.00 0.00 178.44 178.91 3inj h LYS 127 N 0.28 0.76 0.23 1.13 1.57 -1.13 -1.79 116.57 117.62 3inj h LYS 127 Ca 0.10 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3inj h LYS 127 Cb 0.01 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3inj h LYS 127 CO -0.06 0.69 -0.11 0.00 -0.57 0.00 0.00 179.45 179.40 3inj h LEU 129 N -0.55 0.51 -0.88 0.00 3.38 -1.21 -1.53 115.31 115.03 3inj h LEU 129 Ca -0.03 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 3inj h LEU 129 Cb 0.41 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3inj h LEU 129 CO 0.05 0.35 -0.40 0.03 0.09 0.00 0.00 178.44 178.56 3inj h ARG 130 N 0.63 0.33 -0.07 1.13 3.08 -1.34 -0.24 114.38 117.89 3inj h ARG 130 Ca 0.24 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 3inj h ARG 130 Cb 0.08 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 3inj h ARG 130 CO -0.13 0.68 0.02 -0.92 -1.07 0.00 0.00 179.97 178.55 3inj h TYR 131 N 0.28 0.12 0.00 3.04 3.20 -0.93 -3.09 116.97 119.59 3inj h TYR 131 Ca 0.03 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.78 3inj h TYR 131 Cb 0.83 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 3inj h TYR 131 CO 0.02 0.30 -0.48 1.88 -1.64 0.00 0.00 178.16 178.24 3inj h TYR 132 N -0.09 0.00 -0.74 -3.82 -1.99 -1.08 -1.94 116.97 107.31 3inj h TYR 132 Ca 0.02 0.00 0.11 0.00 2.00 0.00 0.00 58.73 60.86 3inj h TYR 132 Cb 0.24 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.92 3inj h TYR 132 CO 0.00 0.48 0.48 0.00 -0.00 0.00 0.00 178.16 179.12 3inj h ALA 133 N 1.52 1.89 0.00 3.88 0.00 -1.02 -1.71 119.26 123.82 3inj h ALA 133 Ca -0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3inj h ALA 133 Cb 0.94 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3inj h ALA 133 CO 0.06 -0.05 -0.32 0.78 0.00 0.00 0.00 179.25 179.72 3inj h GLY 134 N 0.59 0.00 1.84 0.00 0.00 -1.27 -3.06 103.07 101.17 3inj h GLY 134 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 3inj h GLY 134 CO -0.12 0.00 -0.15 1.49 0.00 0.00 0.00 176.54 177.76 3inj h TRP 135 N 0.00 0.00 -0.94 5.60 4.06 -1.30 -3.40 115.95 119.98 3inj h TRP 135 Ca -0.00 0.00 0.26 0.00 2.06 0.00 0.00 58.89 61.21 3inj h TRP 135 Cb 0.70 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 28.72 3inj h TRP 135 CO 0.00 0.00 0.41 0.00 -3.56 0.00 0.00 178.44 175.29 3inj h ALA 136 N 2.22 1.59 -0.41 1.49 0.00 -1.45 -1.88 119.26 120.82 3inj h ALA 136 Ca 0.00 0.19 -0.29 0.00 0.00 0.00 0.00 54.91 54.81 3inj h ALA 136 Cb 0.89 0.21 -0.21 0.00 0.00 0.00 0.00 17.79 18.67 3inj h ALA 136 CO 0.00 -0.47 -0.53 -0.40 0.00 0.00 0.00 179.25 177.85 3inj n ASP 137 N -5.11 3.46 0.00 0.00 3.85 -1.26 -4.63 116.55 112.86 3inj n ASP 137 Ca 0.26 -3.82 0.00 0.00 -0.71 0.00 0.00 54.79 50.52 3inj n ASP 137 Cb 0.79 -0.48 0.00 0.00 -1.35 0.00 0.00 41.12 40.08 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 -0.93 -0.03 -2.56 0.11 5.02 -0.71 -4.95 118.16 114.11 3inj n LYS 138 Ca 0.34 -0.17 -0.43 0.00 -2.02 0.00 0.00 58.31 56.03 3inj n LYS 138 Cb 0.86 -0.56 0.00 0.00 -0.02 0.00 0.00 35.03 35.31 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 -0.01 3.59 -2.10 2.13 9.36 -1.23 -4.99 117.16 123.90 3inj n TYR 139 Ca 0.00 -2.97 -0.38 0.00 3.32 0.00 0.00 57.90 57.87 3inj n TYR 139 Cb 0.26 -2.00 0.00 0.00 -0.63 0.00 0.00 39.34 36.97 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 0.66 2.72 0.00 2.98 3.76 -1.26 -4.81 115.29 119.34 3inj s HIS 140 Ca 0.40 1.47 0.00 0.00 -0.15 0.00 0.00 55.06 56.79 3inj s HIS 140 Cb 0.05 -3.54 0.00 0.00 1.11 0.00 0.00 32.58 30.21 3inj s HIS 140 CO 0.01 -1.95 0.00 0.41 -0.85 0.00 0.00 174.74 172.35 3inj n GLY 141 N 0.56 -1.17 3.26 -2.22 0.00 -1.26 -4.91 105.19 99.45 3inj n GLY 141 Ca 0.07 -1.62 -0.19 0.00 0.00 0.00 0.00 46.02 44.28 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 -1.78 1.08 -0.12 1.61 1.02 -1.18 -4.95 119.74 115.41 3inj s LYS 142 Ca 0.00 -1.26 -0.02 0.00 0.02 0.00 0.00 55.97 54.71 3inj s LYS 142 Cb 0.00 -1.01 -0.03 0.00 -0.52 0.00 0.00 37.83 36.27 3inj s LYS 142 CO 0.00 0.20 -0.06 0.95 -0.92 0.00 0.00 175.35 175.52 3inj s THR 143 N -2.05 3.70 -0.12 2.17 -4.23 -1.26 -0.75 115.64 113.09 3inj s THR 143 Ca 0.10 -0.45 0.02 0.00 -1.18 0.00 0.00 61.69 60.18 3inj s THR 143 Cb -0.05 -2.57 0.01 0.00 1.34 0.00 0.00 72.50 71.23 3inj s THR 143 CO 0.04 0.53 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.86 3inj s ILE 144 N -0.04 1.64 -0.61 2.99 1.01 0.01 -5.00 121.20 121.20 3inj s ILE 144 Ca 0.00 -0.72 -0.06 0.00 0.00 0.00 0.00 60.65 59.88 3inj s ILE 144 Cb -0.13 -1.49 -0.12 0.00 0.01 0.00 0.00 42.46 40.73 3inj s ILE 144 CO 0.03 0.47 2.48 -0.81 0.00 0.00 0.00 174.94 177.11 3inj n PRO 145 N 4.25 2.01 -1.56 2.79 -0.05 -1.26 -4.11 135.00 137.07 3inj n PRO 145 Ca -0.19 -1.22 -0.36 0.00 -0.05 0.00 0.00 63.50 61.68 3inj n PRO 145 Cb 0.51 -2.23 0.08 0.00 -0.05 0.00 0.00 33.50 31.81 3inj n PRO 145 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 175.50 176.96 3inj n ILE 146 N 3.41 3.91 -1.81 0.52 3.06 -1.26 -4.95 119.36 122.24 3inj n ILE 146 Ca 0.43 -0.44 -0.39 0.00 -2.50 0.00 0.00 62.75 59.85 3inj n ILE 146 Cb 0.37 -1.28 0.03 0.00 0.54 0.00 0.00 39.64 39.30 3inj n ILE 146 CO 0.00 0.00 0.00 -1.81 -2.50 0.00 0.00 176.55 172.24 3inj s ASP 147 N -1.48 5.45 0.00 9.51 1.11 -1.26 -4.81 116.67 125.18 3inj s ASP 147 Ca 0.78 2.78 0.00 0.00 0.18 0.00 0.00 52.55 56.29 3inj s ASP 147 Cb -0.37 -2.64 0.00 0.00 1.07 0.00 0.00 42.92 40.98 3inj s ASP 147 CO 0.45 -1.45 0.00 0.61 1.18 0.00 0.00 175.17 175.96 3inj n GLY 148 N 0.68 -3.16 2.67 0.21 0.00 -1.26 -4.57 105.19 99.76 3inj n GLY 148 Ca 0.09 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 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 -0.30 5.35 -4.10 1.61 8.00 -1.26 -4.71 116.55 121.14 3inj n ASP 149 Ca 0.00 -2.89 -0.12 0.00 0.71 0.00 0.00 54.79 52.49 3inj n ASP 149 Cb 0.00 -1.57 -0.11 0.00 -0.02 0.00 0.00 41.12 39.42 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 1.94 0.72 -0.23 1.24 0.40 -1.26 -1.93 117.98 118.86 3inj s PHE 150 Ca 0.49 -0.68 -0.07 0.00 -0.60 0.00 0.00 56.93 56.08 3inj s PHE 150 Cb 0.14 -0.43 -0.03 0.00 0.51 0.00 0.00 43.02 43.21 3inj s PHE 150 CO -0.06 -0.13 0.05 0.12 0.70 0.00 0.00 175.22 175.90 3inj s PHE 151 N -2.34 3.07 -0.05 0.36 5.36 0.94 -4.83 117.98 120.50 3inj s PHE 151 Ca -0.01 -0.45 0.04 0.00 -0.96 0.00 0.00 56.93 55.55 3inj s PHE 151 Cb -0.03 -2.19 -0.00 0.00 -0.34 0.00 0.00 43.02 40.46 3inj s PHE 151 CO -0.02 -0.32 -0.16 0.45 -1.46 0.00 0.00 175.22 173.70 3inj s SER 152 N 1.41 2.09 0.18 6.13 0.15 -1.26 0.06 113.70 122.46 3inj s SER 152 Ca 0.05 -0.34 -0.11 0.00 0.70 0.00 0.00 55.95 56.25 3inj s SER 152 Cb -0.15 -0.65 0.00 0.00 -1.71 0.00 0.00 66.02 63.52 3inj s SER 152 CO 0.03 0.13 0.35 -0.72 1.20 0.00 0.00 173.24 174.23 3inj s TYR 153 N 0.15 0.27 -0.02 3.44 -0.85 -0.34 -0.81 117.35 119.18 3inj s TYR 153 Ca -0.06 -0.63 0.08 0.00 -0.52 0.00 0.00 57.07 55.94 3inj s TYR 153 Cb -0.12 0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.27 3inj s TYR 153 CO 0.03 -0.78 -0.26 0.95 -1.52 0.00 0.00 175.55 173.96 3inj s THR 154 N -3.95 2.03 -0.17 -3.49 -4.23 0.07 -0.21 115.64 105.69 3inj s THR 154 Ca 0.15 -1.10 -0.10 0.00 -1.18 0.00 0.00 61.69 59.47 3inj s THR 154 Cb 0.02 -1.68 -0.05 0.00 1.34 0.00 0.00 72.50 72.13 3inj s THR 154 CO -0.00 0.57 0.16 -0.13 -0.54 0.00 0.00 174.62 174.68 3inj s ARG 155 N -0.59 4.01 -0.66 3.99 0.52 0.72 -3.09 118.95 123.85 3inj s ARG 155 Ca 0.09 -0.14 -0.17 0.00 -0.52 0.00 0.00 55.73 54.99 3inj s ARG 155 Cb -0.10 -3.36 0.13 0.00 0.52 0.00 0.00 34.95 32.14 3inj s ARG 155 CO -0.01 0.42 0.73 -1.01 0.02 0.00 0.00 175.30 175.45 3inj s HIS 156 N 0.00 3.20 0.45 -0.53 3.76 -1.26 -1.07 115.29 119.83 3inj s HIS 156 Ca 0.11 -1.26 0.04 0.00 -0.15 0.00 0.00 55.06 53.80 3inj s HIS 156 Cb -0.12 -3.97 0.01 0.00 1.11 0.00 0.00 32.58 29.61 3inj s HIS 156 CO 0.01 -1.21 0.63 -1.21 -0.85 0.00 0.00 174.74 172.10 3inj s GLU 157 N 2.03 2.86 0.59 1.40 2.02 -0.26 -4.91 118.70 122.43 3inj s GLU 157 Ca 0.13 -0.89 -0.15 0.00 0.02 0.00 0.00 54.97 54.08 3inj s GLU 157 Cb -0.20 -2.65 -0.04 0.00 0.10 0.00 0.00 34.13 31.34 3inj s GLU 157 CO 0.01 -0.33 1.05 -2.14 0.02 0.00 0.00 175.26 173.88 3inj s PRO 158 N -4.48 3.34 0.34 0.39 0.02 -1.26 -0.73 135.00 132.63 3inj s PRO 158 Ca 0.52 1.17 0.17 0.00 0.02 0.00 0.00 61.00 62.87 3inj s PRO 158 Cb -0.10 -2.04 0.57 0.00 0.02 0.00 0.00 34.50 32.95 3inj s PRO 158 CO 0.35 -0.79 1.69 -0.24 -0.33 0.00 0.00 177.00 177.68 3inj h VAL 159 N 0.39 1.02 0.00 3.83 3.04 -1.79 -3.38 116.25 119.36 3inj h VAL 159 Ca -0.47 -1.70 0.00 0.00 -1.01 0.00 0.00 66.70 63.52 3inj h VAL 159 Cb 1.22 2.01 0.00 0.00 -2.01 0.00 0.00 31.29 32.50 3inj h VAL 159 CO 0.58 0.43 0.00 0.61 -1.01 0.00 0.00 177.57 178.18 3inj n GLY 160 N 0.29 0.14 3.63 3.17 0.00 -1.26 -4.86 105.19 106.29 3inj n GLY 160 Ca -0.00 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.09 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 -0.08 4.57 -0.22 1.61 1.01 -1.26 -2.41 120.40 123.61 3inj s VAL 161 Ca 0.00 1.56 -0.06 0.00 0.00 0.00 0.00 61.98 63.48 3inj s VAL 161 Cb 0.00 -4.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 3inj s VAL 161 CO 0.00 -0.45 0.02 0.00 0.00 0.00 0.00 175.10 174.67 3inj s GLY 163 N 1.19 2.77 -0.15 0.00 0.00 0.22 -1.38 107.32 109.96 3inj s GLY 163 Ca 0.03 0.28 -0.02 0.00 0.00 0.00 0.00 44.72 45.01 3inj s GLY 163 CO 0.02 1.17 0.01 1.20 0.00 0.00 0.00 173.10 175.50 3inj s GLN 164 N 0.23 0.79 -0.28 2.90 -0.21 -0.29 -0.55 119.66 122.25 3inj s GLN 164 Ca 0.40 -0.25 -0.06 0.00 0.02 0.00 0.00 55.36 55.47 3inj s GLN 164 Cb -0.20 -1.69 0.01 0.00 1.00 0.00 0.00 33.01 32.13 3inj s GLN 164 CO 0.22 -0.48 0.05 0.42 -2.12 0.00 0.00 175.29 173.38 3inj s ILE 165 N 1.86 3.75 0.20 1.08 1.01 -0.27 -0.60 121.20 128.24 3inj s ILE 165 Ca 0.02 -0.75 0.08 0.00 0.00 0.00 0.00 60.65 59.99 3inj s ILE 165 Cb -0.15 -2.93 -0.04 0.00 0.01 0.00 0.00 42.46 39.35 3inj s ILE 165 CO -0.07 0.11 0.04 0.27 0.00 0.00 0.00 174.94 175.29 3inj s ILE 166 N 1.47 3.84 0.51 2.92 -4.36 -0.88 -2.04 121.20 122.66 3inj s ILE 166 Ca 0.02 -1.49 -0.05 0.00 -0.26 0.00 0.00 60.65 58.87 3inj s ILE 166 Cb -0.17 -2.98 0.11 0.00 1.25 0.00 0.00 42.46 40.67 3inj s ILE 166 CO 0.01 -0.20 0.69 -0.81 0.24 0.00 0.00 174.94 174.87 3inj n PRO 167 N -0.46 -0.28 -0.00 0.37 -0.05 -1.25 -3.53 135.00 129.80 3inj n PRO 167 Ca -0.09 -1.44 0.10 0.00 -0.05 0.00 0.00 63.50 62.03 3inj n PRO 167 Cb 0.56 -0.60 -0.12 0.00 -0.05 0.00 0.00 33.50 33.30 3inj n PRO 167 CO 0.00 0.00 0.00 -2.67 -0.05 0.00 0.00 175.50 172.78 3inj n TRP 168 N -2.67 0.01 -0.13 0.54 4.27 -1.26 -4.44 117.44 113.76 3inj n TRP 168 Ca 0.10 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.58 3inj n TRP 168 Cb 0.35 -0.10 -0.02 0.00 -1.36 0.00 0.00 31.31 30.18 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 0.00 1.02 -2.34 -0.67 -1.07 -1.96 -3.33 115.58 107.22 3inj h ASN 169 Ca 0.00 -0.44 -0.59 0.00 0.07 0.00 0.00 56.30 55.34 3inj h ASN 169 Cb 0.59 -0.28 -0.40 0.00 -2.07 0.00 0.00 38.32 36.16 3inj h ASN 169 CO 0.00 1.25 -0.83 0.49 0.07 0.00 0.00 177.43 178.41 3inj n PHE 170 N -4.07 1.34 0.02 4.14 3.01 -1.26 -5.03 117.46 115.61 3inj n PHE 170 Ca -0.02 -3.82 -0.10 0.00 1.01 0.00 0.00 57.45 54.52 3inj n PHE 170 Cb 0.52 -0.33 -0.04 0.00 -0.01 0.00 0.00 39.48 39.63 3inj n PHE 170 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 3inj h PRO 171 N 4.67 -0.36 -0.15 -1.08 0.11 -1.78 0.66 132.00 134.06 3inj h PRO 171 Ca 0.17 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.17 3inj h PRO 171 Cb 0.80 0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.99 3inj h PRO 171 CO 0.60 -0.24 -0.40 -0.07 -0.21 0.00 0.00 178.00 177.68 3inj h LEU 172 N -0.37 0.62 -0.82 2.35 3.38 -1.94 -2.88 115.31 115.65 3inj h LEU 172 Ca 0.09 -0.58 -0.06 0.00 0.09 0.00 0.00 57.88 57.42 3inj h LEU 172 Cb 0.51 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 3inj h LEU 172 CO -0.31 1.09 0.17 0.25 0.09 0.00 0.00 178.44 179.73 3inj h LEU 173 N 0.18 1.00 -1.06 1.67 5.85 -1.79 -1.76 115.31 119.38 3inj h LEU 173 Ca -0.01 -0.20 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 3inj h LEU 173 Cb 1.01 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 3inj h LEU 173 CO 0.09 0.95 -0.30 0.24 -0.34 0.00 0.00 178.44 179.08 3inj h MET 174 N 1.01 0.29 -0.59 1.25 2.86 -0.94 -0.64 114.93 118.16 3inj h MET 174 Ca 0.21 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 3inj h MET 174 Cb 0.34 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.96 3inj h MET 174 CO -0.00 0.57 0.24 0.37 1.06 0.00 0.00 176.91 179.15 3inj h GLN 175 N 0.26 0.88 -0.44 1.72 4.15 -1.19 -2.84 115.11 117.63 3inj h GLN 175 Ca 0.04 -0.16 -0.09 0.00 0.77 0.00 0.00 58.65 59.21 3inj h GLN 175 Cb 0.66 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 3inj h GLN 175 CO 0.05 0.75 -0.08 0.00 -1.93 0.00 0.00 178.83 177.62 3inj h ALA 176 N 1.09 0.61 -0.02 3.38 0.00 -0.68 -0.25 119.26 123.39 3inj h ALA 176 Ca 0.20 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.80 3inj h ALA 176 Cb 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3inj h ALA 176 CO -0.02 0.47 0.01 -1.49 0.00 0.00 0.00 179.25 178.23 3inj h TRP 177 N 0.67 0.00 0.02 0.00 4.06 -1.11 -0.27 115.95 119.32 3inj h TRP 177 Ca 0.12 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 60.88 3inj h TRP 177 Cb 0.61 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.74 3inj h TRP 177 CO 0.05 0.00 -0.99 0.87 -3.56 0.00 0.00 178.44 174.81 3inj h LYS 178 N 0.00 0.04 -0.27 0.49 1.79 -1.26 -3.40 116.57 113.95 3inj h LYS 178 Ca 0.01 -0.06 -0.14 0.00 -2.18 0.00 0.00 60.65 58.28 3inj h LYS 178 Cb 0.04 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 3inj h LYS 178 CO -0.00 1.03 -0.40 -0.07 -1.08 0.00 0.00 179.45 178.93 3inj h LEU 179 N -0.89 0.69 -0.06 2.94 3.38 -0.94 -3.07 115.31 117.37 3inj h LEU 179 Ca -0.26 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.42 3inj h LEU 179 Cb 1.31 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 3inj h LEU 179 CO -0.12 1.00 -0.23 1.23 0.09 0.00 0.00 178.44 180.41 3inj h GLY 180 N 1.00 -1.37 0.91 0.83 0.00 -1.26 -0.43 103.07 102.74 3inj h GLY 180 Ca 0.05 0.68 -0.04 0.00 0.00 0.00 0.00 47.33 48.02 3inj h GLY 180 CO 0.08 -0.43 0.06 -2.55 0.00 0.00 0.00 176.54 173.71 3inj h PRO 181 N -0.25 0.55 -0.31 4.80 0.11 -1.78 -1.63 132.00 133.49 3inj h PRO 181 Ca 0.01 -0.14 0.01 0.00 0.11 0.00 0.00 66.00 65.99 3inj h PRO 181 Cb 0.29 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.32 3inj h PRO 181 CO -0.19 0.63 0.20 0.00 -0.21 0.00 0.00 178.00 178.42 3inj h ALA 182 N 0.90 0.39 -0.19 -0.75 0.00 -1.46 -2.37 119.26 115.78 3inj h ALA 182 Ca 0.10 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.80 3inj h ALA 182 Cb 0.34 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3inj h ALA 182 CO 0.00 -0.16 -0.68 -0.07 0.00 0.00 0.00 179.25 178.35 3inj h LEU 183 N 0.40 0.85 -1.20 0.00 3.38 -1.11 -0.54 115.31 117.10 3inj h LEU 183 Ca 0.12 -0.51 0.12 0.00 0.09 0.00 0.00 57.88 57.70 3inj h LEU 183 Cb -0.03 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.40 3inj h LEU 183 CO -0.04 1.30 0.59 0.00 0.09 0.00 0.00 178.44 180.38 3inj h ALA 184 N 0.70 1.70 -0.30 1.53 0.00 -1.15 -1.46 119.26 120.29 3inj h ALA 184 Ca -0.02 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3inj h ALA 184 Cb 1.28 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3inj h ALA 184 CO 0.14 0.07 0.00 0.25 0.00 0.00 0.00 179.25 179.71 3inj n THR 185 N -4.57 0.38 -0.53 0.00 -2.24 -0.91 -4.35 114.28 102.07 3inj n THR 185 Ca 0.17 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3inj n THR 185 Cb 0.40 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 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 1.33 0.68 3.91 3.38 0.00 -0.55 -4.05 105.19 109.89 3inj n GLY 186 Ca 0.18 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.48 5.01 0.20 1.61 0.01 -0.25 -4.82 114.94 114.23 3inj s ASN 187 Ca 0.00 0.73 0.10 0.00 -0.71 0.00 0.00 52.86 52.98 3inj s ASN 187 Cb 0.00 -1.43 -0.04 0.00 0.41 0.00 0.00 41.25 40.19 3inj s ASN 187 CO 0.00 -1.53 -0.13 0.68 -1.51 0.00 0.00 177.10 174.61 3inj s VAL 188 N -3.31 2.94 -0.03 1.60 -7.23 -1.01 -4.57 120.40 108.78 3inj s VAL 188 Ca 0.59 -1.84 0.03 0.00 -1.81 0.00 0.00 61.98 58.95 3inj s VAL 188 Cb -0.11 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.37 3inj s VAL 188 CO 0.47 -0.16 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.29 3inj s VAL 189 N -1.82 1.04 -0.28 1.32 1.01 0.16 -1.12 120.40 120.71 3inj s VAL 189 Ca 0.25 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.72 3inj s VAL 189 Cb -0.08 -0.91 0.05 0.00 0.00 0.00 0.00 36.38 35.44 3inj s VAL 189 CO 0.14 0.31 -0.04 -0.69 0.00 0.00 0.00 175.10 174.83 3inj s VAL 190 N 0.14 2.73 -0.10 2.92 1.01 -0.48 -0.71 120.40 125.92 3inj s VAL 190 Ca -0.04 -1.42 -0.02 0.00 0.00 0.00 0.00 61.98 60.50 3inj s VAL 190 Cb -0.10 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 3inj s VAL 190 CO 0.01 -0.05 -0.03 -0.32 0.00 0.00 0.00 175.10 174.71 3inj s MET 191 N 1.22 3.14 -0.19 2.72 1.75 -0.02 -1.13 119.30 126.78 3inj s MET 191 Ca -0.06 -0.48 -0.02 0.00 -1.25 0.00 0.00 55.69 53.88 3inj s MET 191 Cb -0.19 -2.78 -0.01 0.00 2.84 0.00 0.00 34.83 34.69 3inj s MET 191 CO -0.03 0.55 -0.08 0.21 -0.65 0.00 0.00 175.02 175.02 3inj s LYS 192 N -0.47 3.35 0.15 4.11 2.36 0.23 -0.53 119.74 128.94 3inj s LYS 192 Ca 0.08 -0.66 0.04 0.00 -2.55 0.00 0.00 55.97 52.88 3inj s LYS 192 Cb -0.12 -2.87 -0.04 0.00 -1.05 0.00 0.00 37.83 33.75 3inj s LYS 192 CO 0.02 -0.09 0.20 0.14 1.55 0.00 0.00 175.35 177.17 3inj s VAL 193 N 1.17 4.86 0.26 4.02 -7.23 -1.25 -2.07 120.40 120.16 3inj s VAL 193 Ca 0.02 -0.89 -0.31 0.00 -1.81 0.00 0.00 61.98 58.99 3inj s VAL 193 Cb -0.14 -3.48 -0.11 0.00 0.56 0.00 0.00 36.38 33.20 3inj s VAL 193 CO -0.02 -0.09 1.60 0.00 -0.31 0.00 0.00 175.10 176.28 3inj s ALA 194 N -1.73 3.77 0.55 1.32 0.00 -1.23 -4.25 121.76 120.20 3inj s ALA 194 Ca 0.32 1.53 0.23 0.00 0.00 0.00 0.00 51.96 54.04 3inj s ALA 194 Cb -0.11 -3.64 1.53 0.00 0.00 0.00 0.00 23.12 20.90 3inj s ALA 194 CO 0.26 -0.92 2.19 1.05 0.00 0.00 0.00 175.76 178.33 3inj h GLU 195 N 5.45 0.00 0.00 0.00 4.11 -1.94 -1.32 114.58 120.88 3inj h GLU 195 Ca -0.46 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 58.93 3inj h GLU 195 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 3inj h GLU 195 CO 0.84 0.00 -0.19 1.96 0.07 0.00 0.00 179.01 181.69 3inj h GLN 196 N 0.00 0.00 -1.10 1.06 7.50 -1.93 -3.39 115.11 117.25 3inj h GLN 196 Ca 0.01 0.00 -0.37 0.00 0.50 0.00 0.00 58.65 58.79 3inj h GLN 196 Cb 0.05 0.00 -0.29 0.00 0.05 0.00 0.00 27.48 27.29 3inj h GLN 196 CO -0.00 0.19 -0.88 0.25 -1.50 0.00 0.00 178.83 176.89 3inj n THR 197 N -3.32 -0.03 0.13 -0.54 -2.24 -0.53 -4.70 114.28 103.06 3inj n THR 197 Ca 0.00 -3.20 0.02 0.00 -2.27 0.00 0.00 64.05 58.61 3inj n THR 197 Cb 0.43 0.52 0.04 0.00 -2.10 0.00 0.00 70.33 69.21 3inj n THR 197 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3inj h PRO 198 N 2.96 0.00 0.29 -0.78 0.11 -1.67 -3.42 132.00 129.49 3inj h PRO 198 Ca -0.00 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 3inj h PRO 198 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3inj h PRO 198 CO 0.34 0.55 -0.14 -0.07 -0.21 0.00 0.00 178.00 178.47 3inj h LEU 199 N 0.00 -0.32 -1.11 2.35 3.38 -1.89 -2.54 115.31 115.18 3inj h LEU 199 Ca -0.01 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3inj h LEU 199 Cb 1.38 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 42.18 3inj h LEU 199 CO 0.07 -0.07 0.44 0.71 0.09 0.00 0.00 178.44 179.68 3inj h THR 200 N -0.58 1.22 -0.23 0.22 1.35 -1.88 -0.91 112.91 112.09 3inj h THR 200 Ca -0.04 -0.52 -0.07 0.00 -0.55 0.00 0.00 66.41 65.22 3inj h THR 200 Cb 0.42 0.17 -0.01 0.00 -1.73 0.00 0.00 68.15 67.00 3inj h THR 200 CO 0.06 0.24 -0.18 0.00 -0.25 0.00 0.00 175.52 175.39 3inj h ALA 201 N 1.42 1.26 -0.01 6.62 0.00 -1.80 -1.26 119.26 125.49 3inj h ALA 201 Ca 0.27 -0.29 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 3inj h ALA 201 Cb -0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3inj h ALA 201 CO -0.05 0.48 -0.85 -0.07 0.00 0.00 0.00 179.25 178.77 3inj h LEU 202 N 0.36 0.28 -0.67 0.00 3.38 -0.90 -2.74 115.31 115.03 3inj h LEU 202 Ca 0.06 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.72 3inj h LEU 202 Cb 0.54 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 3inj h LEU 202 CO 0.04 1.00 -0.03 0.22 0.09 0.00 0.00 178.44 179.76 3inj h TYR 203 N 0.13 1.10 0.00 1.13 3.20 -0.84 -2.58 116.97 119.11 3inj h TYR 203 Ca -0.04 -0.19 -0.02 0.00 3.14 0.00 0.00 58.73 61.62 3inj h TYR 203 Cb 1.46 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 39.44 3inj h TYR 203 CO 0.03 0.99 -0.08 0.28 -1.64 0.00 0.00 178.16 177.74 3inj h VAL 204 N 0.92 0.63 -0.66 1.81 2.07 -1.12 -1.60 116.25 118.29 3inj h VAL 204 Ca 0.16 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 3inj h VAL 204 Cb 0.57 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 3inj h VAL 204 CO 0.03 0.08 0.20 0.00 0.02 0.00 0.00 177.57 177.90 3inj h ALA 205 N 1.92 0.86 -0.69 1.67 0.00 -1.15 0.05 119.26 121.92 3inj h ALA 205 Ca -0.00 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.82 3inj h ALA 205 Cb 0.20 -0.25 -0.09 0.00 0.00 0.00 0.00 17.79 17.65 3inj h ALA 205 CO 0.01 0.54 0.25 -0.91 0.00 0.00 0.00 179.25 179.14 3inj h ASN 206 N 0.95 0.22 -0.03 0.00 4.21 -1.24 -1.52 115.58 118.17 3inj h ASN 206 Ca 0.21 0.10 -0.11 0.00 1.21 0.00 0.00 56.30 57.71 3inj h ASN 206 Cb 0.30 0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 37.58 3inj h ASN 206 CO -0.01 0.10 -0.34 -0.07 -1.29 0.00 0.00 177.43 175.82 3inj h LEU 207 N 0.40 0.52 0.10 1.61 3.38 -1.20 -1.06 115.31 119.07 3inj h LEU 207 Ca 0.37 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.14 3inj h LEU 207 Cb 0.53 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 3inj h LEU 207 CO -0.38 0.83 -0.11 0.40 0.09 0.00 0.00 178.44 179.27 3inj h ILE 208 N 0.43 0.74 -0.52 1.22 2.04 -0.36 0.18 117.51 121.24 3inj h ILE 208 Ca 0.05 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.98 3inj h ILE 208 Cb 0.80 0.74 -0.06 0.00 -0.74 0.00 0.00 36.82 37.56 3inj h ILE 208 CO 0.06 0.00 0.17 0.50 0.00 0.00 0.00 178.15 178.89 3inj h LYS 209 N -0.24 0.33 0.00 2.37 3.64 -1.16 -2.16 116.57 119.35 3inj h LYS 209 Ca 0.01 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 3inj h LYS 209 Cb 0.24 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 3inj h LYS 209 CO -0.04 0.22 -0.07 1.49 -2.27 0.00 0.00 179.45 178.78 3inj h GLU 210 N 0.34 0.00 0.00 1.90 4.81 -0.58 -2.17 114.58 118.88 3inj h GLU 210 Ca 0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 3inj h GLU 210 Cb 0.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.67 3inj h GLU 210 CO -0.27 0.07 -0.11 0.00 -0.73 0.00 0.00 179.01 177.97 3inj h ALA 211 N 1.93 0.93 0.00 2.92 0.00 -0.01 -3.48 119.26 121.55 3inj h ALA 211 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3inj h ALA 211 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3inj h ALA 211 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3inj n GLY 212 N 1.27 1.04 3.71 0.00 0.00 -0.82 -4.88 105.19 105.52 3inj n GLY 212 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 3.13 0.55 1.61 0.40 -1.17 -4.95 117.98 115.54 3inj s PHE 213 Ca 0.00 0.85 -0.19 0.00 -0.60 0.00 0.00 56.93 56.99 3inj s PHE 213 Cb 0.00 -3.73 -0.08 0.00 0.51 0.00 0.00 43.02 39.72 3inj s PHE 213 CO 0.00 -2.62 0.78 -2.30 0.70 0.00 0.00 175.22 171.77 3inj n PRO 214 N 4.21 0.80 -1.90 0.24 -0.02 -1.26 -4.74 135.00 132.33 3inj n PRO 214 Ca 0.12 0.30 -0.40 0.00 -2.02 0.00 0.00 63.50 61.51 3inj n PRO 214 Cb 0.42 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 3inj n PRO 214 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3inj s PRO 215 N -2.31 3.97 0.00 0.52 0.04 -1.26 -2.46 135.00 133.50 3inj s PRO 215 Ca 0.70 2.38 0.00 0.00 0.04 0.00 0.00 61.00 64.12 3inj s PRO 215 Cb -0.46 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.25 3inj s PRO 215 CO 0.52 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.40 3inj n GLY 216 N 0.59 1.27 0.22 0.56 0.00 -1.26 -4.71 105.19 101.86 3inj n GLY 216 Ca 0.03 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 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 1.28 -3.26 1.61 2.07 -1.80 -3.31 116.25 112.84 3inj h VAL 217 Ca 0.00 -1.99 -0.55 0.00 0.82 0.00 0.00 66.70 64.98 3inj h VAL 217 Cb 0.00 1.99 -0.37 0.00 -1.52 0.00 0.00 31.29 31.39 3inj h VAL 217 CO 0.00 0.63 -0.80 -0.69 0.02 0.00 0.00 177.57 176.73 3inj s VAL 218 N -3.74 1.16 -0.05 2.57 1.01 -1.26 0.37 120.40 120.46 3inj s VAL 218 Ca -0.10 -0.54 0.06 0.00 0.00 0.00 0.00 61.98 61.41 3inj s VAL 218 Cb 0.09 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 35.20 3inj s VAL 218 CO 0.90 0.25 -0.24 0.20 0.00 0.00 0.00 175.10 176.21 3inj s ASN 219 N 1.63 3.20 -0.12 3.32 0.01 0.12 -4.68 114.94 118.42 3inj s ASN 219 Ca 0.02 -0.46 0.02 0.00 -0.71 0.00 0.00 52.86 51.74 3inj s ASN 219 Cb -0.14 -0.75 0.01 0.00 0.41 0.00 0.00 41.25 40.78 3inj s ASN 219 CO -0.08 0.27 -0.19 -0.63 -1.51 0.00 0.00 177.10 174.96 3inj s ILE 220 N -0.31 1.77 -0.33 0.60 1.01 0.81 -0.84 121.20 123.91 3inj s ILE 220 Ca 0.01 -0.81 0.04 0.00 0.00 0.00 0.00 60.65 59.89 3inj s ILE 220 Cb -0.13 -1.58 0.09 0.00 0.01 0.00 0.00 42.46 40.86 3inj s ILE 220 CO 0.02 0.49 0.03 -0.69 0.00 0.00 0.00 174.94 174.80 3inj s VAL 221 N 0.83 2.19 0.40 2.92 1.01 0.30 -0.82 120.40 127.23 3inj s VAL 221 Ca -0.09 -2.20 -0.24 0.00 0.00 0.00 0.00 61.98 59.46 3inj s VAL 221 Cb -0.16 -2.58 -0.09 0.00 0.00 0.00 0.00 36.38 33.56 3inj s VAL 221 CO -0.00 -0.52 1.07 -2.16 0.00 0.00 0.00 175.10 173.49 3inj s PRO 222 N 0.97 4.12 0.00 2.72 0.04 -1.26 -3.86 135.00 137.72 3inj s PRO 222 Ca 0.08 1.57 0.00 0.00 0.04 0.00 0.00 61.00 62.69 3inj s PRO 222 Cb -0.19 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.80 3inj s PRO 222 CO -0.08 -0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.17 3inj n GLY 223 N 0.39 -0.51 4.02 0.56 0.00 -1.26 0.24 105.19 108.62 3inj n GLY 223 Ca 0.05 -0.95 -0.19 0.00 0.00 0.00 0.00 46.02 44.93 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 -3.00 2.16 -0.05 1.61 0.40 -1.26 -4.05 117.98 113.80 3inj s PHE 224 Ca 0.00 -0.51 -0.09 0.00 -0.60 0.00 0.00 56.93 55.73 3inj s PHE 224 Cb 0.00 -2.35 -0.05 0.00 0.51 0.00 0.00 43.02 41.13 3inj s PHE 224 CO 0.00 -0.81 0.41 0.78 0.70 0.00 0.00 175.22 176.29 3inj h GLY 225 N 0.36 -0.33 1.40 4.36 0.00 -1.96 -2.35 103.07 104.56 3inj h GLY 225 Ca -0.36 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3inj h GLY 225 CO 0.43 -0.12 0.00 -1.05 0.00 0.00 0.00 176.54 175.80 3inj n PRO 226 N -4.51 0.07 0.00 4.80 -0.02 -1.26 -1.28 135.00 132.80 3inj n PRO 226 Ca -0.04 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 3inj n PRO 226 Cb 0.12 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 3inj n PRO 226 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3inj n THR 227 N -1.20 0.00 0.07 3.45 -2.24 -1.23 -4.59 114.28 108.53 3inj n THR 227 Ca 0.02 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.68 3inj n THR 227 Cb 0.02 -0.34 -0.06 0.00 -2.10 0.00 0.00 70.33 67.86 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 -0.50 -0.13 -0.86 6.98 0.00 -1.58 -1.78 119.26 121.37 3inj h ALA 228 Ca 0.00 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.95 3inj h ALA 228 Cb 0.00 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 3inj h ALA 228 CO 0.00 -0.60 0.55 0.78 0.00 0.00 0.00 179.25 179.98 3inj h GLY 229 N -0.18 1.27 1.05 0.00 0.00 -1.24 -1.79 103.07 102.20 3inj h GLY 229 Ca 0.02 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.83 3inj h GLY 229 CO -0.06 0.33 -0.10 0.00 0.00 0.00 0.00 176.54 176.71 3inj h ALA 230 N 1.38 0.68 -0.52 3.60 0.00 -1.13 -2.44 119.26 120.83 3inj h ALA 230 Ca 0.36 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3inj h ALA 230 Cb 0.06 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3inj h ALA 230 CO -0.14 0.57 0.33 0.00 0.00 0.00 0.00 179.25 180.02 3inj h ALA 231 N 0.90 1.61 0.24 0.00 0.00 -0.51 0.65 119.26 122.14 3inj h ALA 231 Ca 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3inj h ALA 231 Cb 0.65 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3inj h ALA 231 CO 0.05 0.36 -0.12 0.82 0.00 0.00 0.00 179.25 180.36 3inj h ILE 232 N 0.70 0.80 -0.07 0.00 2.04 -1.20 -1.31 117.51 118.47 3inj h ILE 232 Ca 0.19 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 65.32 3inj h ILE 232 Cb -0.06 1.19 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 3inj h ILE 232 CO -0.04 0.15 0.05 0.00 0.00 0.00 0.00 178.15 178.31 3inj h ALA 233 N -0.13 2.00 -0.03 1.87 0.00 -1.12 -2.40 119.26 119.45 3inj h ALA 233 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3inj h ALA 233 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3inj h ALA 233 CO 0.05 -0.01 -0.10 0.43 0.00 0.00 0.00 179.25 179.62 3inj n SER 234 N -4.52 2.73 -4.75 0.00 7.64 0.19 -3.73 113.62 111.17 3inj n SER 234 Ca -0.02 -1.87 -0.41 0.00 1.01 0.00 0.00 58.87 57.58 3inj n SER 234 Cb 0.12 0.09 -0.03 0.00 -1.01 0.00 0.00 64.21 63.39 3inj n SER 234 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3inj s HIS 235 N -2.10 3.20 -0.69 1.43 5.04 -0.50 -4.80 115.29 116.87 3inj s HIS 235 Ca 0.27 1.36 0.26 0.00 -1.54 0.00 0.00 55.06 55.41 3inj s HIS 235 Cb 0.20 -3.60 0.87 0.00 0.04 0.00 0.00 32.58 30.08 3inj s HIS 235 CO 0.36 -1.72 1.77 0.39 -2.34 0.00 0.00 174.74 173.20 3inj n GLU 236 N 1.62 0.23 -0.08 2.88 -0.58 -1.26 -3.33 120.64 120.11 3inj n GLU 236 Ca 0.02 0.25 0.03 0.00 -0.42 0.00 0.00 57.16 57.05 3inj n GLU 236 Cb 0.42 -1.81 0.08 0.00 -0.57 0.00 0.00 31.44 29.57 3inj n GLU 236 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 3inj n ASP 237 N -2.22 2.35 -4.67 1.62 2.03 -1.26 -4.86 116.55 109.54 3inj n ASP 237 Ca 0.05 -1.87 -0.38 0.00 0.52 0.00 0.00 54.79 53.10 3inj n ASP 237 Cb 0.38 -0.11 -0.07 0.00 -0.72 0.00 0.00 41.12 40.60 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 -0.92 5.17 -0.25 5.18 1.01 -1.21 -4.78 120.40 124.61 3inj s VAL 238 Ca 0.12 0.78 0.20 0.00 0.00 0.00 0.00 61.98 63.09 3inj s VAL 238 Cb 0.07 -3.76 0.07 0.00 0.00 0.00 0.00 36.38 32.76 3inj s VAL 238 CO 0.09 0.23 1.22 0.44 0.00 0.00 0.00 175.10 177.08 3inj h ASP 239 N 7.38 0.00 -3.38 3.32 3.32 -1.18 -3.43 116.42 122.45 3inj h ASP 239 Ca -0.35 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.69 3inj h ASP 239 Cb 1.16 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.50 3inj h ASP 239 CO 0.72 0.21 0.04 -0.75 -1.72 0.00 0.00 179.24 177.74 3inj s LYS 240 N -3.16 0.74 -0.07 3.56 2.36 -1.13 -1.91 119.74 120.12 3inj s LYS 240 Ca 0.02 1.12 0.04 0.00 -2.55 0.00 0.00 55.97 54.59 3inj s LYS 240 Cb 0.08 0.23 -0.02 0.00 -1.05 0.00 0.00 37.83 37.07 3inj s LYS 240 CO 0.75 -0.13 -0.18 0.08 1.55 0.00 0.00 175.35 177.42 3inj s VAL 241 N 1.15 2.67 -0.17 4.02 1.01 -0.02 0.68 120.40 129.75 3inj s VAL 241 Ca -0.06 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.08 3inj s VAL 241 Cb -0.05 -2.04 0.01 0.00 0.00 0.00 0.00 36.38 34.30 3inj s VAL 241 CO -0.12 0.57 -0.18 0.00 0.00 0.00 0.00 175.10 175.37 3inj s ALA 242 N -0.24 2.41 -0.12 5.51 0.00 0.29 -1.98 121.76 127.62 3inj s ALA 242 Ca 0.00 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.83 3inj s ALA 242 Cb -0.13 -1.20 0.02 0.00 0.00 0.00 0.00 23.12 21.81 3inj s ALA 242 CO 0.03 -0.19 -0.14 0.12 0.00 0.00 0.00 175.76 175.58 3inj s PHE 243 N 1.06 1.96 -0.11 0.00 5.36 -0.85 -1.11 117.98 124.29 3inj s PHE 243 Ca -0.01 -1.00 -0.01 0.00 -0.96 0.00 0.00 56.93 54.95 3inj s PHE 243 Cb -0.14 -1.45 -0.03 0.00 -0.34 0.00 0.00 43.02 41.06 3inj s PHE 243 CO -0.06 -0.55 -0.05 0.99 -1.46 0.00 0.00 175.22 174.10 3inj s THR 244 N 1.26 3.81 -4.01 0.12 2.01 -0.87 -0.48 115.64 117.48 3inj s THR 244 Ca -0.01 -0.41 0.00 0.00 0.31 0.00 0.00 61.69 61.58 3inj s THR 244 Cb -0.14 -2.62 0.00 0.00 0.01 0.00 0.00 72.50 69.76 3inj s THR 244 CO -0.06 0.55 0.00 0.61 -0.69 0.00 0.00 174.62 175.03 3inj n GLY 245 N 2.85 -0.54 3.86 4.40 0.00 0.33 -3.96 105.19 112.13 3inj n GLY 245 Ca -0.18 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.75 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 6.30 0.22 1.61 1.04 -1.26 -3.55 113.70 114.06 3inj s SER 246 Ca 0.00 1.46 -0.08 0.00 0.48 0.00 0.00 55.95 57.80 3inj s SER 246 Cb 0.00 -2.48 0.18 0.00 0.10 0.00 0.00 66.02 63.82 3inj s SER 246 CO 0.00 -0.82 1.85 0.74 0.98 0.00 0.00 173.24 175.99 3inj h THR 247 N -0.07 1.24 -0.31 2.02 2.02 -1.89 -0.82 112.91 115.11 3inj h THR 247 Ca -0.45 -0.56 0.06 0.00 0.77 0.00 0.00 66.41 66.23 3inj h THR 247 Cb 1.19 0.10 -0.05 0.00 -1.74 0.00 0.00 68.15 67.64 3inj h THR 247 CO 0.62 0.26 -0.02 -0.08 0.37 0.00 0.00 175.52 176.66 3inj h GLU 248 N 1.16 0.06 0.00 6.66 4.81 -1.95 -1.93 114.58 123.39 3inj h GLU 248 Ca 0.30 -0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.39 3inj h GLU 248 Cb -0.00 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 3inj h GLU 248 CO -0.05 0.04 -0.64 0.82 -0.73 0.00 0.00 179.01 178.45 3inj h ILE 249 N 0.06 1.25 -0.82 2.32 1.08 -1.94 -3.07 117.51 116.40 3inj h ILE 249 Ca 0.15 -2.37 0.18 0.00 -0.39 0.00 0.00 64.86 62.43 3inj h ILE 249 Cb 0.21 2.36 -0.05 0.00 -3.07 0.00 0.00 36.82 36.27 3inj h ILE 249 CO -0.28 0.63 0.55 1.23 -0.69 0.00 0.00 178.15 179.59 3inj h GLY 250 N 2.60 0.67 1.63 5.37 0.00 -0.37 -1.67 103.07 111.30 3inj h GLY 250 Ca -0.01 -0.15 -0.26 0.00 0.00 0.00 0.00 47.33 46.90 3inj h GLY 250 CO 0.08 0.02 -1.18 3.21 0.00 0.00 0.00 176.54 178.67 3inj h ARG 251 N 0.35 0.29 -0.98 4.80 3.08 -1.36 -2.86 114.38 117.69 3inj h ARG 251 Ca 0.41 -0.45 0.06 0.00 0.07 0.00 0.00 59.98 60.07 3inj h ARG 251 Cb 1.08 0.16 -0.07 0.00 0.08 0.00 0.00 29.97 31.23 3inj h ARG 251 CO -0.13 1.19 0.64 0.28 -1.07 0.00 0.00 179.97 180.89 3inj h VAL 252 N 0.10 1.09 0.05 2.04 2.07 -1.38 -2.01 116.25 118.20 3inj h VAL 252 Ca -0.12 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 3inj h VAL 252 Cb 1.90 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 3inj h VAL 252 CO 0.20 0.21 -0.03 0.40 0.02 0.00 0.00 177.57 178.37 3inj h ILE 253 N 1.15 1.10 -0.61 4.57 1.08 -1.29 -1.14 117.51 122.39 3inj h ILE 253 Ca 0.42 -0.50 -0.04 0.00 -0.39 0.00 0.00 64.86 64.35 3inj h ILE 253 Cb 0.16 1.43 -0.03 0.00 -3.07 0.00 0.00 36.82 35.31 3inj h ILE 253 CO -0.16 0.13 0.20 -0.61 -0.69 0.00 0.00 178.15 177.02 3inj h GLN 254 N -0.29 0.90 -0.53 2.37 4.15 -1.36 -1.20 115.11 119.15 3inj h GLN 254 Ca -0.01 -0.16 -0.07 0.00 0.77 0.00 0.00 58.65 59.18 3inj h GLN 254 Cb 0.26 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 3inj h GLN 254 CO 0.01 0.77 0.05 0.28 -1.93 0.00 0.00 178.83 178.01 3inj h VAL 255 N 0.88 1.26 -0.27 2.39 2.07 -1.31 -1.89 116.25 119.38 3inj h VAL 255 Ca 0.20 -1.02 -0.07 0.00 0.82 0.00 0.00 66.70 66.63 3inj h VAL 255 Cb 0.23 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3inj h VAL 255 CO -0.01 0.36 -0.15 0.00 0.02 0.00 0.00 177.57 177.80 3inj h ALA 256 N 0.97 1.25 -0.18 1.67 0.00 -0.80 -0.72 119.26 121.46 3inj h ALA 256 Ca 0.16 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3inj h ALA 256 Cb 0.46 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3inj h ALA 256 CO 0.02 0.49 0.03 0.00 0.00 0.00 0.00 179.25 179.79 3inj h ALA 257 N 1.43 0.24 -0.61 0.00 0.00 -1.05 -2.52 119.26 116.74 3inj h ALA 257 Ca 0.08 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3inj h ALA 257 Cb 0.51 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3inj h ALA 257 CO 0.03 -0.10 0.10 0.78 0.00 0.00 0.00 179.25 180.06 3inj h GLY 258 N 0.09 1.07 2.00 0.00 0.00 -1.09 -0.12 103.07 105.02 3inj h GLY 258 Ca 0.05 -0.69 -0.08 0.00 0.00 0.00 0.00 47.33 46.61 3inj h GLY 258 CO 0.00 0.64 -0.39 1.48 0.00 0.00 0.00 176.54 178.27 3inj h SER 259 N 0.94 0.00 0.00 0.19 4.64 -1.15 -3.41 113.55 114.75 3inj h SER 259 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 3inj h SER 259 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3inj h SER 259 CO 0.01 0.39 0.00 -1.54 -0.87 0.00 0.00 176.83 174.82 3inj n SER 260 N -3.42 0.00 -1.03 4.97 3.41 -0.95 -4.94 113.62 111.65 3inj n SER 260 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.69 3inj n SER 260 Cb 0.56 0.00 0.26 0.00 -0.26 0.00 0.00 64.21 64.77 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 3.90 -2.88 4.04 6.94 -1.19 -4.94 115.26 121.12 3inj n ASN 261 Ca 0.00 -2.56 -0.21 0.00 -0.02 0.00 0.00 54.58 51.79 3inj n ASN 261 Cb 0.00 -0.46 0.02 0.00 -2.36 0.00 0.00 39.78 36.97 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 0.26 -2.20 -4.60 -4.53 4.77 -0.08 -4.94 117.00 105.69 3inj n LEU 262 Ca 0.20 -0.20 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 3inj n LEU 262 Cb 0.76 -2.76 0.07 0.00 -2.33 0.00 0.00 43.42 39.16 3inj n LEU 262 CO 0.16 0.09 0.48 2.29 -1.33 0.00 0.00 177.39 179.08 3inj n LYS 263 N -3.65 0.66 -2.22 3.23 2.85 -1.25 -4.95 118.16 112.83 3inj n LYS 263 Ca -0.13 0.27 -0.40 0.00 -1.05 0.00 0.00 58.31 57.00 3inj n LYS 263 Cb 0.62 -2.15 -0.02 0.00 -0.65 0.00 0.00 35.03 32.83 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 -2.99 4.27 -0.05 -1.58 3.00 -0.80 -4.86 118.95 115.93 3inj s ARG 264 Ca 0.74 2.03 0.03 0.00 0.00 0.00 0.00 55.73 58.53 3inj s ARG 264 Cb -0.38 -2.94 0.01 0.00 0.00 0.00 0.00 34.95 31.64 3inj s ARG 264 CO 0.49 -0.19 -0.13 0.08 0.00 0.00 0.00 175.30 175.55 3inj s VAL 265 N -1.24 1.15 0.11 3.52 1.01 -1.26 -0.84 120.40 122.86 3inj s VAL 265 Ca 0.51 -0.51 0.09 0.00 0.00 0.00 0.00 61.98 62.06 3inj s VAL 265 Cb -0.36 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 3inj s VAL 265 CO 0.46 0.35 -0.21 0.42 0.00 0.00 0.00 175.10 176.12 3inj s THR 266 N 0.46 1.78 -0.03 3.92 -4.23 -0.84 -4.95 115.64 111.76 3inj s THR 266 Ca -0.11 -1.62 -0.01 0.00 -1.18 0.00 0.00 61.69 58.77 3inj s THR 266 Cb -0.14 -1.64 0.02 0.00 1.34 0.00 0.00 72.50 72.08 3inj s THR 266 CO 0.03 -0.08 0.06 -0.76 -0.54 0.00 0.00 174.62 173.33 3inj s LEU 267 N -2.03 1.35 -0.31 4.79 1.43 -0.66 -2.01 118.68 121.25 3inj s LEU 267 Ca 0.08 0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.33 3inj s LEU 267 Cb -0.09 0.13 0.09 0.00 0.03 0.00 0.00 46.19 46.34 3inj s LEU 267 CO 0.05 -0.08 0.01 -0.70 0.23 0.00 0.00 176.35 175.86 3inj s GLU 268 N 0.60 1.55 0.00 1.70 2.56 0.36 -1.38 118.70 124.10 3inj s GLU 268 Ca -0.05 -1.57 0.00 0.00 0.00 0.00 0.00 54.97 53.36 3inj s GLU 268 Cb -0.07 -2.92 0.00 0.00 2.00 0.00 0.00 34.13 33.14 3inj s GLU 268 CO -0.02 -0.83 0.00 1.28 -0.56 0.00 0.00 175.26 175.13 3inj n LEU 269 N 4.41 0.00 0.00 2.70 4.77 -0.48 -0.51 117.00 127.89 3inj n LEU 269 Ca -0.02 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.75 3inj n LEU 269 Cb 0.42 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.65 3inj n LEU 269 CO 0.20 0.00 0.61 0.61 -1.33 0.00 0.00 177.39 177.47 3inj n GLY 270 N 5.00 -1.10 3.67 -0.72 0.00 -1.23 -4.81 105.19 106.00 3inj n GLY 270 Ca 0.00 -1.74 -0.09 0.00 0.00 0.00 0.00 46.02 44.18 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 -5.00 0.50 -0.43 -0.02 0.00 -1.17 -4.40 107.32 96.79 3inj s GLY 271 Ca 0.54 -0.81 0.08 0.00 0.00 0.00 0.00 44.72 44.52 3inj s GLY 271 CO 0.37 -0.51 0.90 1.17 0.00 0.00 0.00 173.10 175.04 3inj n LYS 272 N -0.45 0.93 -2.30 2.90 3.00 -1.26 -4.37 118.16 116.60 3inj n LYS 272 Ca -0.03 -2.42 -0.41 0.00 -0.00 0.00 0.00 58.31 55.45 3inj n LYS 272 Cb 0.61 -1.31 -0.03 0.00 0.00 0.00 0.00 35.03 34.29 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 -1.65 7.02 -0.05 3.14 0.01 -1.20 -4.63 113.70 116.34 3inj s SER 273 Ca 0.30 2.40 -0.24 0.00 1.31 0.00 0.00 55.95 59.73 3inj s SER 273 Cb 0.28 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.85 3inj s SER 273 CO -0.10 -0.38 0.71 -2.16 0.41 0.00 0.00 173.24 171.72 3inj s PRO 274 N -1.00 4.44 -0.36 12.44 0.04 -1.26 -1.85 135.00 147.46 3inj s PRO 274 Ca 0.50 0.91 -0.05 0.00 0.04 0.00 0.00 61.00 62.40 3inj s PRO 274 Cb -0.35 -3.44 0.06 0.00 0.04 0.00 0.00 34.50 30.81 3inj s PRO 274 CO 0.43 0.08 0.14 1.21 0.04 0.00 0.00 177.00 178.90 3inj s ASN 275 N 0.72 5.29 -0.31 6.66 3.04 0.35 -1.11 114.94 129.57 3inj s ASN 275 Ca 0.38 -1.42 -0.13 0.00 0.04 0.00 0.00 52.86 51.73 3inj s ASN 275 Cb -0.18 -1.85 -0.03 0.00 -1.54 0.00 0.00 41.25 37.65 3inj s ASN 275 CO 0.19 -0.40 0.28 -0.63 -3.04 0.00 0.00 177.10 173.50 3inj s ILE 276 N 1.33 5.24 -0.34 -5.21 1.01 0.46 -1.16 121.20 122.52 3inj s ILE 276 Ca 0.00 0.12 -0.07 0.00 0.00 0.00 0.00 60.65 60.71 3inj s ILE 276 Cb -0.21 -3.68 0.03 0.00 0.01 0.00 0.00 42.46 38.62 3inj s ILE 276 CO 0.00 0.09 0.12 -0.63 0.00 0.00 0.00 174.94 174.52 3inj s ILE 277 N 1.87 3.94 0.54 2.92 -1.09 0.24 -0.18 121.20 129.44 3inj s ILE 277 Ca 0.09 -1.03 -0.09 0.00 -2.23 0.00 0.00 60.65 57.39 3inj s ILE 277 Cb -0.16 -3.20 -0.04 0.00 -1.58 0.00 0.00 42.46 37.47 3inj s ILE 277 CO 0.11 -0.15 0.91 -0.04 -1.23 0.00 0.00 174.94 174.53 3inj s MET 278 N 1.44 3.63 0.44 2.79 -1.94 -0.65 -1.97 119.30 123.04 3inj s MET 278 Ca -0.01 0.54 0.30 0.00 -1.71 0.00 0.00 55.69 54.81 3inj s MET 278 Cb -0.19 -2.23 1.58 0.00 2.01 0.00 0.00 34.83 36.00 3inj s MET 278 CO 0.03 -0.35 1.91 0.66 -0.01 0.00 0.00 175.02 177.26 3inj h SER 279 N 0.15 0.00 -0.46 3.03 4.64 -1.90 -1.50 113.55 117.52 3inj h SER 279 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3inj h SER 279 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3inj h SER 279 CO 0.62 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.68 3inj n ASP 280 N -2.56 4.44 -4.78 4.97 5.75 -1.26 -4.93 116.55 118.17 3inj n ASP 280 Ca -0.02 -2.70 -0.33 0.00 -0.01 0.00 0.00 54.79 51.74 3inj n ASP 280 Cb 0.08 -0.54 0.04 0.00 -1.03 0.00 0.00 41.12 39.67 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 -2.29 2.52 -0.32 2.12 0.00 -0.57 -3.42 121.76 119.82 3inj s ALA 281 Ca 0.45 0.45 -0.29 0.00 0.00 0.00 0.00 51.96 52.57 3inj s ALA 281 Cb 0.33 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 3inj s ALA 281 CO 0.16 -1.22 1.47 0.34 0.00 0.00 0.00 175.76 176.51 3inj s ASP 282 N -2.80 6.41 0.11 0.00 2.15 -1.26 -4.92 116.67 116.35 3inj s ASP 282 Ca 0.65 1.21 -0.25 0.00 0.43 0.00 0.00 52.55 54.58 3inj s ASP 282 Cb -0.19 -2.54 -0.09 0.00 -0.30 0.00 0.00 42.92 39.80 3inj s ASP 282 CO 0.43 -1.30 1.67 -0.03 -0.17 0.00 0.00 175.17 175.77 3inj h MET 283 N 10.49 -0.32 -0.35 4.34 1.85 -1.96 0.31 114.93 129.29 3inj h MET 283 Ca -0.29 0.02 0.04 0.00 -0.61 0.00 0.00 59.70 58.86 3inj h MET 283 Cb 1.12 0.07 -0.04 0.00 0.43 0.00 0.00 31.60 33.19 3inj h MET 283 CO 1.04 -0.21 0.13 -0.44 -0.40 0.00 0.00 176.91 177.03 3inj h ASP 284 N -0.33 0.15 -0.08 1.39 3.32 -2.00 0.43 116.42 119.31 3inj h ASP 284 Ca 0.03 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 3inj h ASP 284 Cb 0.35 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 3inj h ASP 284 CO -0.10 0.12 0.03 -0.25 -1.72 0.00 0.00 179.24 177.32 3inj h TRP 285 N 0.28 0.12 -0.93 4.55 2.91 -1.91 -2.58 115.95 118.39 3inj h TRP 285 Ca 0.15 -0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.23 3inj h TRP 285 Cb 0.12 -0.04 -0.06 0.00 -0.51 0.00 0.00 29.16 28.67 3inj h TRP 285 CO -0.13 0.25 0.59 0.00 -1.03 0.00 0.00 178.44 178.12 3inj h ALA 286 N 0.85 1.28 -0.10 2.65 0.00 -0.04 -0.07 119.26 123.83 3inj h ALA 286 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3inj h ALA 286 Cb 0.19 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3inj h ALA 286 CO -0.00 0.37 0.01 0.28 0.00 0.00 0.00 179.25 179.91 3inj h VAL 287 N 1.08 1.23 -0.17 0.00 2.07 -0.81 -0.40 116.25 119.26 3inj h VAL 287 Ca 0.40 -0.72 -0.17 0.00 0.82 0.00 0.00 66.70 67.03 3inj h VAL 287 Cb 0.16 1.51 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3inj h VAL 287 CO -0.17 0.21 -0.60 -0.33 0.02 0.00 0.00 177.57 176.70 3inj h GLU 288 N -0.07 0.56 -0.50 1.57 4.39 -1.28 -1.12 114.58 118.14 3inj h GLU 288 Ca 0.03 -0.38 -0.09 0.00 0.34 0.00 0.00 59.36 59.27 3inj h GLU 288 Cb 0.31 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 3inj h GLU 288 CO 0.00 0.99 -0.04 1.96 -1.16 0.00 0.00 179.01 180.77 3inj h GLN 289 N 0.42 0.86 -0.32 2.33 1.08 -1.02 -0.01 115.11 118.44 3inj h GLN 289 Ca -0.00 -0.26 -0.13 0.00 -1.45 0.00 0.00 58.65 56.80 3inj h GLN 289 Cb 1.16 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.49 3inj h GLN 289 CO 0.11 0.88 -0.35 0.00 -0.95 0.00 0.00 178.83 178.53 3inj h ALA 290 N 1.16 0.80 0.11 3.87 0.00 -0.93 0.60 119.26 124.87 3inj h ALA 290 Ca 0.14 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3inj h ALA 290 Cb 0.53 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3inj h ALA 290 CO 0.03 0.65 -0.05 1.25 0.00 0.00 0.00 179.25 181.12 3inj h HIS 291 N 0.60 -0.14 -0.10 0.00 -0.00 -1.02 -2.52 115.15 111.97 3inj h HIS 291 Ca 0.06 -0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.47 3inj h HIS 291 Cb 0.87 0.05 -0.04 0.00 -0.00 0.00 0.00 27.41 28.28 3inj h HIS 291 CO 0.04 0.08 -0.16 0.35 -0.00 0.00 0.00 177.93 178.24 3inj h PHE 292 N -0.35 -0.42 -1.02 5.26 3.04 -0.90 0.59 116.94 123.15 3inj h PHE 292 Ca -0.02 0.02 0.27 0.00 3.98 0.00 0.00 57.97 62.22 3inj h PHE 292 Cb 0.28 0.20 -0.07 0.00 2.56 0.00 0.00 35.95 38.92 3inj h PHE 292 CO -0.01 -0.23 0.69 0.00 -2.02 0.00 0.00 178.31 176.73 3inj h ALA 293 N 0.80 2.50 0.02 2.41 0.00 0.33 -2.23 119.26 123.09 3inj h ALA 293 Ca 0.09 0.02 -0.39 0.00 0.00 0.00 0.00 54.91 54.62 3inj h ALA 293 Cb 0.34 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 3inj h ALA 293 CO -0.23 -0.84 -2.26 -0.11 0.00 0.00 0.00 179.25 175.81 3inj n LEU 294 N -4.46 2.44 0.06 0.00 0.00 -0.96 -1.66 117.00 112.42 3inj n LEU 294 Ca 0.23 0.15 0.12 0.00 0.00 0.00 0.00 56.01 56.51 3inj n LEU 294 Cb 0.93 -0.92 0.24 0.00 0.00 0.00 0.00 43.42 43.66 3inj n LEU 294 CO 0.31 0.72 0.47 0.49 0.00 0.00 0.00 177.39 179.38 3inj n PHE 295 N -3.78 0.51 -1.60 1.96 3.01 0.16 -4.00 117.46 113.73 3inj n PHE 295 Ca -0.45 0.15 -0.44 0.00 1.01 0.00 0.00 57.45 57.72 3inj n PHE 295 Cb 0.93 -0.64 -0.02 0.00 -0.01 0.00 0.00 39.48 39.74 3inj n PHE 295 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3inj n PHE 296 N -2.03 1.38 -3.48 1.38 -0.00 -0.86 -2.23 117.46 111.63 3inj n PHE 296 Ca 0.04 0.69 -0.25 0.00 -0.00 0.00 0.00 57.45 57.93 3inj n PHE 296 Cb 0.42 -2.27 0.05 0.00 -0.00 0.00 0.00 39.48 37.68 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 1.22 -5.88 -2.62 -2.13 5.15 -1.26 -1.30 115.26 108.44 3inj n ASN 297 Ca 0.09 -0.50 -0.22 0.00 -0.60 0.00 0.00 54.58 53.36 3inj n ASN 297 Cb 0.32 -4.68 0.01 0.00 -0.53 0.00 0.00 39.78 34.90 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 -4.60 -2.84 -0.88 1.20 3.00 -0.95 -1.15 117.38 111.17 3inj n GLN 298 Ca -0.02 0.98 0.00 0.00 -0.01 0.00 0.00 57.00 57.95 3inj n GLN 298 Cb 0.57 -5.72 0.00 0.00 0.00 0.00 0.00 30.24 25.09 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 -1.20 0.37 2.47 1.08 0.00 -0.42 -3.57 105.19 103.92 3inj n GLY 299 Ca -0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.49 4.33 -4.41 1.61 6.02 -0.30 -3.53 117.38 119.60 3inj n GLN 300 Ca 0.00 -3.19 -0.25 0.00 -0.01 0.00 0.00 57.00 53.55 3inj n GLN 300 Cb 0.13 -2.70 -0.17 0.00 1.02 0.00 0.00 30.24 28.53 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 0.42 -0.43 -2.28 0.00 0.00 -0.62 -4.77 120.51 112.84 3inj n ALA 304 Ca 0.25 0.43 -0.38 0.00 0.00 0.00 0.00 53.44 53.74 3inj n ALA 304 Cb 1.02 -2.04 -0.02 0.00 0.00 0.00 0.00 19.45 18.40 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 1.76 2.20 1.10 0.00 0.00 -0.67 -3.24 105.19 106.34 3inj n GLY 305 Ca 0.13 -1.21 0.12 0.00 0.00 0.00 0.00 46.02 45.06 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 10.19 3.29 -3.80 1.61 3.41 -0.77 -4.42 113.62 123.11 3inj n SER 306 Ca 0.48 -1.97 -0.30 0.00 -0.26 0.00 0.00 58.87 56.82 3inj n SER 306 Cb 0.45 -0.26 -0.15 0.00 -0.26 0.00 0.00 64.21 64.00 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 -1.48 0.90 -0.62 4.33 0.52 -0.99 -4.02 118.95 117.58 3inj s ARG 307 Ca 0.39 -1.24 -0.18 0.00 -0.52 0.00 0.00 55.73 54.18 3inj s ARG 307 Cb 0.22 -2.27 0.12 0.00 0.52 0.00 0.00 34.95 33.54 3inj s ARG 307 CO 0.31 -0.96 0.70 0.99 0.02 0.00 0.00 175.30 176.36 3inj s THR 308 N 1.46 4.93 -0.15 0.02 2.01 0.39 -0.50 115.64 123.79 3inj s THR 308 Ca 0.10 -1.20 -0.25 0.00 0.31 0.00 0.00 61.69 60.64 3inj s THR 308 Cb -0.18 -4.48 -0.02 0.00 0.01 0.00 0.00 72.50 67.83 3inj s THR 308 CO -0.21 -1.11 0.81 -0.36 -0.69 0.00 0.00 174.62 173.07 3inj s PHE 309 N 2.35 3.45 -0.08 4.92 0.40 -0.31 -0.75 117.98 127.97 3inj s PHE 309 Ca 0.12 1.26 0.03 0.00 -0.60 0.00 0.00 56.93 57.74 3inj s PHE 309 Cb -0.23 -2.98 0.01 0.00 0.51 0.00 0.00 43.02 40.33 3inj s PHE 309 CO 0.04 -0.18 -0.17 0.08 0.70 0.00 0.00 175.22 175.69 3inj s VAL 310 N 1.88 1.51 0.43 -0.44 1.01 0.05 -0.59 120.40 124.25 3inj s VAL 310 Ca 0.38 -0.71 -0.26 0.00 0.00 0.00 0.00 61.98 61.40 3inj s VAL 310 Cb -0.17 -1.34 -0.08 0.00 0.00 0.00 0.00 36.38 34.79 3inj s VAL 310 CO 0.14 0.44 1.35 -1.58 0.00 0.00 0.00 175.10 175.45 3inj s GLN 311 N 0.48 3.84 0.28 2.72 0.74 -0.83 -1.95 119.66 124.94 3inj s GLN 311 Ca -0.15 2.26 0.00 0.00 0.05 0.00 0.00 55.36 57.51 3inj s GLN 311 Cb -0.16 -2.71 0.51 0.00 1.10 0.00 0.00 33.01 31.75 3inj s GLN 311 CO 0.06 -0.63 1.85 1.05 -0.55 0.00 0.00 175.29 177.06 3inj h GLU 312 N 2.51 1.00 -0.75 1.67 4.11 -1.10 -2.13 114.58 119.89 3inj h GLU 312 Ca -0.50 -0.06 0.17 0.00 0.07 0.00 0.00 59.36 59.04 3inj h GLU 312 Cb 1.25 -0.23 -0.05 0.00 0.50 0.00 0.00 28.75 30.23 3inj h GLU 312 CO 0.62 0.66 0.51 -0.44 0.07 0.00 0.00 179.01 180.43 3inj h ASP 313 N 1.03 0.29 -0.16 3.06 3.32 -1.90 -2.35 116.42 119.71 3inj h ASP 313 Ca 0.48 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.55 3inj h ASP 313 Cb 0.40 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3inj h ASP 313 CO -0.24 0.14 0.00 2.30 -1.72 0.00 0.00 179.24 179.72 3inj n ILE 314 N -4.45 0.58 0.09 0.35 -5.35 -0.86 -4.76 119.36 104.96 3inj n ILE 314 Ca 0.15 -0.79 -0.12 0.00 -0.27 0.00 0.00 62.75 61.71 3inj n ILE 314 Cb 0.60 0.78 -0.05 0.00 -1.74 0.00 0.00 39.64 39.23 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 1.55 -0.55 0.08 4.28 5.03 -0.84 -1.45 116.97 125.07 3inj h TYR 315 Ca 0.00 0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.35 3inj h TYR 315 Cb 0.54 0.23 -0.04 0.00 1.55 0.00 0.00 36.73 39.01 3inj h TYR 315 CO 0.10 -0.30 -0.32 -0.44 -1.32 0.00 0.00 178.16 175.88 3inj h ASP 316 N -0.37 -0.95 -0.97 -2.11 3.32 -1.86 0.02 116.42 113.50 3inj h ASP 316 Ca 0.04 0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.25 3inj h ASP 316 Cb 0.41 0.37 -0.06 0.00 0.22 0.00 0.00 39.33 40.27 3inj h ASP 316 CO -0.14 -0.40 0.63 -0.08 -1.72 0.00 0.00 179.24 177.52 3inj h GLU 317 N -0.52 1.16 -0.40 3.56 4.81 -1.89 -1.55 114.58 119.74 3inj h GLU 317 Ca 0.04 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 3inj h GLU 317 Cb 0.57 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 3inj h GLU 317 CO -0.22 0.77 0.14 0.35 -0.73 0.00 0.00 179.01 179.31 3inj h PHE 318 N 1.19 0.64 -0.34 0.92 3.57 -0.68 -1.76 116.94 120.49 3inj h PHE 318 Ca 0.40 -0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.75 3inj h PHE 318 Cb 0.06 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 3inj h PHE 318 CO -0.01 0.58 -0.18 0.28 -2.23 0.00 0.00 178.31 176.76 3inj h VAL 319 N 0.51 1.26 -0.22 1.41 2.07 -0.42 -0.83 116.25 120.02 3inj h VAL 319 Ca 0.13 -1.19 -0.07 0.00 0.82 0.00 0.00 66.70 66.39 3inj h VAL 319 Cb 0.23 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3inj h VAL 319 CO -0.01 0.39 -0.13 -0.08 0.02 0.00 0.00 177.57 177.77 3inj h GLU 320 N 0.55 0.47 -0.19 1.57 4.81 -1.17 -1.79 114.58 118.84 3inj h GLU 320 Ca 0.09 -0.22 -0.06 0.00 -0.13 0.00 0.00 59.36 59.04 3inj h GLU 320 Cb 0.61 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 3inj h GLU 320 CO 0.04 0.76 -0.16 0.00 -0.73 0.00 0.00 179.01 178.92 3inj h ARG 321 N 0.17 0.31 0.02 1.92 3.08 -1.22 -2.24 114.38 116.41 3inj h ARG 321 Ca 0.05 -0.08 -0.22 0.00 0.07 0.00 0.00 59.98 59.79 3inj h ARG 321 Cb 0.64 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 3inj h ARG 321 CO 0.04 0.47 -0.95 0.77 -1.07 0.00 0.00 179.97 179.23 3inj h SER 322 N 0.29 0.40 0.40 7.04 0.02 -1.00 -2.36 113.55 118.34 3inj h SER 322 Ca 0.05 -0.34 -0.21 0.00 -0.84 0.00 0.00 61.79 60.46 3inj h SER 322 Cb 0.47 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.88 3inj h SER 322 CO 0.03 1.15 -0.87 0.58 -1.14 0.00 0.00 176.83 176.58 3inj h VAL 323 N 0.16 1.43 -0.92 2.27 2.07 -1.29 -1.48 116.25 118.48 3inj h VAL 323 Ca -0.07 -2.43 -0.01 0.00 0.82 0.00 0.00 66.70 65.01 3inj h VAL 323 Cb 1.59 2.36 -0.04 0.00 -1.52 0.00 0.00 31.29 33.68 3inj h VAL 323 CO 0.16 0.72 0.54 0.00 0.02 0.00 0.00 177.57 179.01 3inj h ALA 324 N 0.86 1.22 -0.00 1.67 0.00 -1.38 -1.48 119.26 120.15 3inj h ALA 324 Ca -0.06 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.53 3inj h ALA 324 Cb 1.49 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3inj h ALA 324 CO 0.14 0.66 -0.92 -0.09 0.00 0.00 0.00 179.25 179.05 3inj h ARG 325 N 1.28 0.37 -0.08 0.00 9.65 -1.33 -2.74 114.38 121.53 3inj h ARG 325 Ca 0.33 -0.39 -0.15 0.00 -1.10 0.00 0.00 59.98 58.67 3inj h ARG 325 Cb -0.04 0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 3inj h ARG 325 CO -0.06 1.07 -0.60 0.00 2.80 0.00 0.00 179.97 183.18 3inj h ALA 326 N 0.79 0.83 0.00 2.80 0.00 -1.09 -2.63 119.26 119.97 3inj h ALA 326 Ca -0.07 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.23 3inj h ALA 326 Cb 1.55 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 3inj h ALA 326 CO 0.16 0.72 -0.32 0.87 0.00 0.00 0.00 179.25 180.68 3inj h LYS 327 N 0.21 0.00 0.00 0.00 1.57 -1.31 -3.18 116.57 113.86 3inj h LYS 327 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3inj h LYS 327 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.42 3inj h LYS 327 CO 0.10 0.32 -0.29 -1.13 -0.57 0.00 0.00 179.45 177.88 3inj n SER 328 N -3.35 0.45 -4.66 0.86 3.41 -1.03 -4.87 113.62 104.42 3inj n SER 328 Ca 0.01 0.21 -0.42 0.00 -0.26 0.00 0.00 58.87 58.40 3inj n SER 328 Cb 0.54 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.28 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 -3.06 4.19 -0.18 4.33 3.52 -1.01 -4.95 118.95 121.79 3inj s ARG 329 Ca 0.11 2.06 -0.29 0.00 -0.13 0.00 0.00 55.73 57.48 3inj s ARG 329 Cb 0.16 -3.94 -0.00 0.00 -1.56 0.00 0.00 34.95 29.61 3inj s ARG 329 CO 0.63 -0.82 1.01 0.08 -0.81 0.00 0.00 175.30 175.39 3inj s VAL 330 N 3.94 4.74 -0.26 7.11 1.01 -1.26 -4.93 120.40 130.74 3inj s VAL 330 Ca 0.69 2.00 -0.05 0.00 0.00 0.00 0.00 61.98 64.62 3inj s VAL 330 Cb -0.31 -4.30 0.01 0.00 0.00 0.00 0.00 36.38 31.79 3inj s VAL 330 CO 0.26 -0.10 0.01 -0.69 0.00 0.00 0.00 175.10 174.59 3inj s VAL 331 N 2.68 3.58 0.00 2.92 1.01 -1.26 -1.10 120.40 128.23 3inj s VAL 331 Ca 0.45 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.74 3inj s VAL 331 Cb -0.16 -2.77 0.00 0.00 0.00 0.00 0.00 36.38 33.44 3inj s VAL 331 CO 0.11 0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.03 3inj n GLY 332 N 4.80 1.71 3.68 4.51 0.00 -0.93 -4.99 105.19 113.97 3inj n GLY 332 Ca -0.16 -0.63 -0.53 0.00 0.00 0.00 0.00 46.02 44.71 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 2.65 0.19 1.61 2.85 -1.26 -4.39 115.26 116.91 3inj n ASN 333 Ca 0.00 1.05 0.14 0.00 -0.11 0.00 0.00 54.58 55.66 3inj n ASN 333 Cb 0.00 -1.24 0.62 0.00 1.24 0.00 0.00 39.78 40.39 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 7.26 0.00 0.00 1.20 0.13 -1.88 -1.66 132.00 137.05 3inj h PRO 334 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3inj h PRO 334 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3inj h PRO 334 CO 0.92 0.00 -0.17 1.19 -0.23 0.00 0.00 178.00 179.71 3inj n PHE 335 N -2.55 0.35 -2.79 1.56 3.01 -1.26 -0.91 117.46 114.87 3inj n PHE 335 Ca 0.01 0.10 -0.41 0.00 1.01 0.00 0.00 57.45 58.16 3inj n PHE 335 Cb 0.22 -0.61 -0.04 0.00 -0.01 0.00 0.00 39.48 39.04 3inj n PHE 335 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3inj s ASP 336 N -3.62 7.34 0.36 4.37 -1.08 -0.62 -4.92 116.67 118.50 3inj s ASP 336 Ca 0.11 1.62 0.27 0.00 -0.52 0.00 0.00 52.55 54.03 3inj s ASP 336 Cb 0.16 -2.54 1.18 0.00 -1.46 0.00 0.00 42.92 40.26 3inj s ASP 336 CO 0.60 -0.16 1.81 0.77 0.52 0.00 0.00 175.17 178.72 3inj h SER 337 N 6.32 0.00 1.55 -0.34 4.64 -1.87 -2.18 113.55 121.67 3inj h SER 337 Ca -0.42 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.82 3inj h SER 337 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 3inj h SER 337 CO 0.74 0.00 -0.46 0.11 -0.87 0.00 0.00 176.83 176.35 3inj h LYS 338 N 0.00 0.00 -6.52 4.77 1.57 -1.92 -3.47 116.57 111.01 3inj h LYS 338 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 3inj h LYS 338 Cb 0.34 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.68 3inj h LYS 338 CO 0.00 0.33 0.91 0.99 -0.57 0.00 0.00 179.45 181.11 3inj s THR 339 N -3.04 2.95 -0.12 -0.16 2.01 -0.82 -4.78 115.64 111.68 3inj s THR 339 Ca 0.04 0.56 0.20 0.00 0.31 0.00 0.00 61.69 62.79 3inj s THR 339 Cb 0.07 -3.36 -0.27 0.00 0.01 0.00 0.00 72.50 68.96 3inj s THR 339 CO 0.73 0.02 0.37 -0.62 -0.69 0.00 0.00 174.62 174.44 3inj n GLU 340 N 4.78 0.67 -3.78 4.92 1.02 -0.26 -4.92 120.64 123.07 3inj n GLU 340 Ca 0.14 -0.05 -0.23 0.00 -0.02 0.00 0.00 57.16 57.00 3inj n GLU 340 Cb 0.40 -1.57 -0.17 0.00 -0.02 0.00 0.00 31.44 30.08 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 -3.01 0.69 0.00 3.49 0.74 -0.51 -4.86 119.66 116.21 3inj s GLN 341 Ca -0.08 0.07 0.00 0.00 0.05 0.00 0.00 55.36 55.40 3inj s GLN 341 Cb 0.10 -1.04 0.00 0.00 1.10 0.00 0.00 33.01 33.17 3inj s GLN 341 CO 0.86 -0.30 0.00 0.41 -0.55 0.00 0.00 175.29 175.71 3inj n GLY 342 N 5.13 -0.31 3.92 2.59 0.00 -1.26 -2.20 105.19 113.05 3inj n GLY 342 Ca -0.08 -1.74 -0.27 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.93 2.48 0.82 1.61 0.04 -1.25 -4.76 135.00 133.01 3inj s PRO 343 Ca 0.00 -0.04 -0.11 0.00 0.04 0.00 0.00 61.00 60.88 3inj s PRO 343 Cb 0.00 -2.16 0.08 0.00 0.04 0.00 0.00 34.50 32.47 3inj s PRO 343 CO 0.00 -1.09 1.09 -0.65 0.04 0.00 0.00 177.00 176.39 3inj s GLN 344 N -5.22 1.91 0.33 4.56 -1.52 0.64 -4.72 119.66 115.64 3inj s GLN 344 Ca 0.58 0.81 0.06 0.00 -1.95 0.00 0.00 55.36 54.86 3inj s GLN 344 Cb -0.11 -1.88 0.57 0.00 -0.22 0.00 0.00 33.01 31.37 3inj s GLN 344 CO 0.46 -1.79 1.80 -0.24 -0.25 0.00 0.00 175.29 175.28 3inj h VAL 345 N -1.22 1.24 -2.58 1.09 3.04 -1.89 -3.43 116.25 112.50 3inj h VAL 345 Ca -0.47 -1.11 -0.03 0.00 -1.01 0.00 0.00 66.70 64.08 3inj h VAL 345 Cb 1.26 1.34 0.00 0.00 -2.01 0.00 0.00 31.29 31.89 3inj h VAL 345 CO 0.56 0.35 0.13 -0.90 -1.01 0.00 0.00 177.57 176.70 3inj n ASP 346 N -4.17 -1.18 -0.13 3.17 5.68 -1.26 -4.57 116.55 114.09 3inj n ASP 346 Ca -0.01 -1.87 -0.12 0.00 -0.50 0.00 0.00 54.79 52.30 3inj n ASP 346 Cb 0.36 1.98 -0.02 0.00 -1.14 0.00 0.00 41.12 42.30 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 0.86 -0.53 0.11 4.81 -1.98 -1.60 114.58 116.25 3inj h GLU 347 Ca -0.18 -0.40 0.07 0.00 -0.13 0.00 0.00 59.36 58.73 3inj h GLU 347 Cb 0.66 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.97 3inj h GLU 347 CO 0.22 1.04 0.22 1.15 -0.73 0.00 0.00 179.01 180.91 3inj h THR 348 N 0.66 0.86 -0.47 0.32 2.02 -1.99 0.17 112.91 114.48 3inj h THR 348 Ca 0.08 -0.14 -0.09 0.00 0.77 0.00 0.00 66.41 67.03 3inj h THR 348 Cb 0.81 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 3inj h THR 348 CO 0.07 0.08 -0.08 1.56 0.37 0.00 0.00 175.52 177.52 3inj h GLN 349 N 0.42 0.83 0.57 6.66 1.08 -1.96 -1.63 115.11 121.08 3inj h GLN 349 Ca 0.25 -0.26 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 3inj h GLN 349 Cb 0.25 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.60 3inj h GLN 349 CO -0.23 0.88 -0.32 0.35 -0.95 0.00 0.00 178.83 178.56 3inj h PHE 350 N 0.75 -0.84 -0.11 2.96 3.57 -0.22 -1.11 116.94 121.94 3inj h PHE 350 Ca 0.13 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.65 3inj h PHE 350 Cb 0.56 0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 3inj h PHE 350 CO 0.03 -0.50 -0.08 0.87 -2.23 0.00 0.00 178.31 176.40 3inj h LYS 351 N -0.83 -0.08 -0.50 1.11 1.57 -0.73 -2.51 116.57 114.60 3inj h LYS 351 Ca -0.07 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.77 3inj h LYS 351 Cb 0.66 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.94 3inj h LYS 351 CO 0.09 -0.05 0.20 -0.22 -0.57 0.00 0.00 179.45 178.90 3inj h LYS 352 N -0.09 0.39 -0.59 3.15 3.64 -1.10 0.13 116.57 122.10 3inj h LYS 352 Ca 0.07 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.33 3inj h LYS 352 Cb 0.18 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 3inj h LYS 352 CO -0.16 0.26 -0.02 0.82 -2.27 0.00 0.00 179.45 178.08 3inj h ILE 353 N 0.40 1.26 -0.80 2.00 2.04 -1.15 -1.44 117.51 119.83 3inj h ILE 353 Ca 0.23 -1.16 -0.00 0.00 1.00 0.00 0.00 64.86 64.93 3inj h ILE 353 Cb 0.21 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 3inj h ILE 353 CO -0.21 0.42 0.50 -0.07 0.00 0.00 0.00 178.15 178.79 3inj h LEU 354 N 0.95 0.95 -0.68 1.44 3.38 -0.92 -1.64 115.31 118.79 3inj h LEU 354 Ca 0.17 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.14 3inj h LEU 354 Cb 0.57 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 3inj h LEU 354 CO 0.03 0.72 0.39 1.23 0.09 0.00 0.00 178.44 180.90 3inj h GLY 355 N 1.09 1.00 1.35 0.83 0.00 -0.26 -1.78 103.07 105.31 3inj h GLY 355 Ca 0.29 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.28 3inj h GLY 355 CO -0.06 0.19 0.08 -0.97 0.00 0.00 0.00 176.54 175.78 3inj h TYR 356 N 0.74 0.84 -0.33 5.60 -1.99 -0.64 -0.86 116.97 120.32 3inj h TYR 356 Ca 0.30 -0.09 -0.04 0.00 2.00 0.00 0.00 58.73 60.90 3inj h TYR 356 Cb 0.15 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 38.62 3inj h TYR 356 CO -0.07 0.73 0.05 0.82 -0.00 0.00 0.00 178.16 179.70 3inj h ILE 357 N 0.77 1.24 0.13 -2.88 2.04 -0.90 -2.34 117.51 115.57 3inj h ILE 357 Ca 0.16 -0.83 0.02 0.00 1.00 0.00 0.00 64.86 65.21 3inj h ILE 357 Cb 0.35 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 3inj h ILE 357 CO 0.01 0.28 -0.36 0.78 0.00 0.00 0.00 178.15 178.85 3inj h ASN 358 N 0.39 -1.05 -0.05 1.72 -0.26 -0.99 -1.55 115.58 113.79 3inj h ASN 358 Ca 0.10 0.12 0.02 0.00 -0.56 0.00 0.00 56.30 55.97 3inj h ASN 358 Cb 0.35 0.39 -0.00 0.00 -1.06 0.00 0.00 38.32 38.01 3inj h ASN 358 CO 0.01 -0.45 0.44 0.74 -1.06 0.00 0.00 177.43 177.11 3inj h THR 359 N -0.60 0.04 0.00 2.81 2.02 -1.01 -0.25 112.91 115.91 3inj h THR 359 Ca 0.03 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.90 3inj h THR 359 Cb 0.62 0.58 -0.05 0.00 -1.74 0.00 0.00 68.15 67.55 3inj h THR 359 CO -0.21 0.00 -1.92 0.61 0.37 0.00 0.00 175.52 174.37 3inj n GLY 360 N -1.29 -1.01 0.00 2.16 0.00 -0.65 -3.67 105.19 100.74 3inj n GLY 360 Ca -0.01 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 45.98 3inj n GLY 360 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3inj n LYS 361 N -2.93 0.12 -0.00 1.61 5.02 -0.16 -3.02 118.16 118.80 3inj n LYS 361 Ca -0.22 0.08 -0.20 0.00 -2.02 0.00 0.00 58.31 55.95 3inj n LYS 361 Cb 1.07 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 34.44 3inj n LYS 361 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 3inj h GLN 362 N 0.00 0.21 -0.81 1.97 5.75 -1.51 -3.38 115.11 117.34 3inj h GLN 362 Ca 0.00 -0.35 0.00 0.00 -0.15 0.00 0.00 58.65 58.15 3inj h GLN 362 Cb 0.35 0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.03 3inj h GLN 362 CO 0.00 1.17 0.00 0.39 -2.65 0.00 0.00 178.83 177.74 3inj n GLU 363 N -4.12 2.03 -1.04 1.69 1.02 -1.19 -4.84 120.64 114.19 3inj n GLU 363 Ca -0.21 -0.87 -0.02 0.00 -0.02 0.00 0.00 57.16 56.05 3inj n GLU 363 Cb 0.81 -1.66 -0.01 0.00 -0.02 0.00 0.00 31.44 30.56 3inj n GLU 363 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3inj n GLY 364 N 0.24 0.51 3.74 0.62 0.00 -1.25 -5.02 105.19 104.04 3inj n GLY 364 Ca 0.08 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 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 -2.05 3.33 -0.66 4.61 0.00 -1.17 -4.98 121.76 120.84 3inj s ALA 365 Ca 0.00 0.69 -0.27 0.00 0.00 0.00 0.00 51.96 52.38 3inj s ALA 365 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.84 3inj s ALA 365 CO 0.00 -0.01 1.60 0.15 0.00 0.00 0.00 175.76 177.50 3inj s LYS 366 N -0.65 2.90 -0.25 0.00 1.02 -0.98 -4.63 119.74 117.13 3inj s LYS 366 Ca 0.45 0.25 -0.29 0.00 0.02 0.00 0.00 55.97 56.40 3inj s LYS 366 Cb -0.27 -4.29 -0.06 0.00 -0.52 0.00 0.00 37.83 32.70 3inj s LYS 366 CO 0.33 -2.45 2.24 -0.11 -0.92 0.00 0.00 175.35 174.44 3inj n LEU 367 N 11.18 3.08 0.03 3.17 7.94 -1.26 -1.64 117.00 139.50 3inj n LEU 367 Ca 0.13 0.16 0.11 0.00 -1.11 0.00 0.00 56.01 55.29 3inj n LEU 367 Cb 0.51 -1.53 -0.11 0.00 0.53 0.00 0.00 43.42 42.82 3inj n LEU 367 CO 0.71 -0.77 -0.47 0.18 -1.11 0.00 0.00 177.39 175.93 3inj n LEU 368 N 11.92 0.32 -3.74 -1.96 4.77 0.19 -4.99 117.00 123.51 3inj n LEU 368 Ca 0.32 0.12 -0.03 0.00 -0.03 0.00 0.00 56.01 56.39 3inj n LEU 368 Cb 0.44 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 3inj n LEU 368 CO 0.67 -0.07 0.77 0.00 -1.33 0.00 0.00 177.39 177.43 3inj n GLY 370 N -0.48 2.78 0.00 0.00 0.00 -1.22 -3.08 105.19 103.20 3inj n GLY 370 Ca -0.06 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 1.54 3.32 -0.02 0.00 -1.26 -4.98 105.19 103.80 3inj n GLY 371 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3inj n GLY 371 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3inj s GLY 372 N -2.33 2.28 0.63 -0.02 0.00 -1.26 -4.87 107.32 101.76 3inj s GLY 372 Ca 0.00 -1.85 -0.18 0.00 0.00 0.00 0.00 44.72 42.69 3inj s GLY 372 CO 0.00 -1.54 1.25 -0.42 0.00 0.00 0.00 173.10 172.39 3inj s ILE 373 N -3.48 2.30 -0.12 0.90 1.01 -1.26 -0.99 121.20 119.55 3inj s ILE 373 Ca 0.37 0.19 0.01 0.00 0.00 0.00 0.00 60.65 61.22 3inj s ILE 373 Cb 0.03 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.44 3inj s ILE 373 CO 0.23 -0.04 0.34 0.00 0.00 0.00 0.00 174.94 175.47 3inj n ALA 374 N -1.80 2.36 -3.42 9.38 0.00 -0.94 -4.66 120.51 121.43 3inj n ALA 374 Ca 0.15 -0.31 -0.16 0.00 0.00 0.00 0.00 53.44 53.12 3inj n ALA 374 Cb 0.49 -0.05 -0.06 0.00 0.00 0.00 0.00 19.45 19.83 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 -0.53 -1.51 -2.16 0.00 0.00 -1.26 -4.99 121.76 111.31 3inj s ALA 375 Ca 0.01 0.96 0.17 0.00 0.00 0.00 0.00 51.96 53.10 3inj s ALA 375 Cb 0.01 0.14 0.57 0.00 0.00 0.00 0.00 23.12 23.84 3inj s ALA 375 CO 0.03 -0.40 1.43 -0.40 0.00 0.00 0.00 175.76 176.41 3inj n ASP 376 N 0.79 1.76 -3.65 0.00 3.85 -1.26 -4.73 116.55 113.32 3inj n ASP 376 Ca -0.19 -1.83 -0.16 0.00 -0.71 0.00 0.00 54.79 51.90 3inj n ASP 376 Cb 0.58 -0.16 -0.14 0.00 -1.35 0.00 0.00 41.12 40.04 3inj n ASP 376 CO 0.00 0.00 0.00 -0.60 -1.01 0.00 0.00 177.20 175.59 3inj s ARG 377 N -1.68 0.10 0.00 0.11 3.52 -1.26 -5.10 118.95 114.63 3inj s ARG 377 Ca 0.29 0.60 0.00 0.00 -0.13 0.00 0.00 55.73 56.49 3inj s ARG 377 Cb 0.15 -0.27 0.00 0.00 -1.56 0.00 0.00 34.95 33.27 3inj s ARG 377 CO 0.22 -0.33 0.00 0.41 -0.81 0.00 0.00 175.30 174.79 3inj n GLY 378 N 5.34 -0.49 2.44 8.12 0.00 -1.25 -4.70 105.19 114.65 3inj n GLY 378 Ca -0.05 -1.68 -0.33 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.37 2.01 -3.04 1.61 0.53 -0.94 -4.81 117.16 112.15 3inj n TYR 379 Ca 0.00 -2.41 -0.40 0.00 -1.02 0.00 0.00 57.90 54.08 3inj n TYR 379 Cb 0.00 -1.69 -0.05 0.00 -1.03 0.00 0.00 39.34 36.57 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 -0.99 3.72 -0.02 -0.72 0.40 -1.26 -0.26 117.98 118.85 3inj s PHE 380 Ca 0.58 1.40 0.04 0.00 -0.60 0.00 0.00 56.93 58.35 3inj s PHE 380 Cb 0.27 -2.76 -0.01 0.00 0.51 0.00 0.00 43.02 41.03 3inj s PHE 380 CO -0.14 0.30 -0.16 0.42 0.70 0.00 0.00 175.22 176.35 3inj s ILE 381 N -0.11 1.27 0.23 0.64 1.01 -1.26 -2.20 121.20 120.77 3inj s ILE 381 Ca 0.36 -0.66 -0.30 0.00 0.00 0.00 0.00 60.65 60.05 3inj s ILE 381 Cb -0.20 -1.07 -0.09 0.00 0.01 0.00 0.00 42.46 41.10 3inj s ILE 381 CO 0.21 0.36 1.35 -1.10 0.00 0.00 0.00 174.94 175.77 3inj s GLN 382 N -0.19 4.35 -0.24 2.79 -0.21 -0.17 -4.80 119.66 121.20 3inj s GLN 382 Ca 0.02 2.15 -0.34 0.00 0.02 0.00 0.00 55.36 57.21 3inj s GLN 382 Cb -0.08 -3.15 -0.11 0.00 1.00 0.00 0.00 33.01 30.67 3inj s GLN 382 CO 0.00 -0.29 2.07 -2.30 -2.12 0.00 0.00 175.29 172.65 3inj n PRO 383 N 2.31 1.58 -4.66 2.91 -0.02 -1.26 -4.30 135.00 131.56 3inj n PRO 383 Ca 0.06 0.50 -0.34 0.00 -2.02 0.00 0.00 63.50 61.70 3inj n PRO 383 Cb 0.42 -2.63 -0.12 0.00 -0.02 0.00 0.00 33.50 31.15 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 6.20 3.56 -0.06 3.45 2.01 -0.12 -3.38 115.64 127.29 3inj s THR 384 Ca 1.02 -0.52 0.04 0.00 0.31 0.00 0.00 61.69 62.53 3inj s THR 384 Cb -0.73 -2.46 0.00 0.00 0.01 0.00 0.00 72.50 69.32 3inj s THR 384 CO 0.49 0.58 -0.17 -0.69 -0.69 0.00 0.00 174.62 174.14 3inj s VAL 385 N -0.55 1.45 -0.16 3.82 1.01 -1.18 -0.48 120.40 124.31 3inj s VAL 385 Ca 0.08 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 3inj s VAL 385 Cb -0.12 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.98 3inj s VAL 385 CO 0.02 0.42 -0.08 -0.36 0.00 0.00 0.00 175.10 175.10 3inj s PHE 386 N 0.28 2.91 0.35 5.22 0.40 0.97 -0.64 117.98 127.48 3inj s PHE 386 Ca -0.10 -0.65 0.08 0.00 -0.60 0.00 0.00 56.93 55.65 3inj s PHE 386 Cb -0.14 -1.95 -0.03 0.00 0.51 0.00 0.00 43.02 41.41 3inj s PHE 386 CO 0.04 -0.27 0.29 0.20 0.70 0.00 0.00 175.22 176.17 3inj s GLY 387 N 0.70 1.84 -1.52 4.36 0.00 -0.65 -0.97 107.32 111.08 3inj s GLY 387 Ca -0.04 -1.70 -0.13 0.00 0.00 0.00 0.00 44.72 42.85 3inj s GLY 387 CO 0.02 -1.61 0.91 1.22 0.00 0.00 0.00 173.10 173.64 3inj n ASP 388 N -1.38 -4.73 -4.76 1.64 8.00 -1.03 -2.33 116.55 111.96 3inj n ASP 388 Ca -0.01 -0.73 -0.39 0.00 0.71 0.00 0.00 54.79 54.37 3inj n ASP 388 Cb 0.60 -3.79 -0.04 0.00 -0.02 0.00 0.00 41.12 37.87 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 -3.25 3.58 0.08 2.53 1.01 -1.00 -4.74 120.40 118.62 3inj s VAL 389 Ca 0.63 1.47 0.07 0.00 0.00 0.00 0.00 61.98 64.16 3inj s VAL 389 Cb -0.32 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 3inj s VAL 389 CO 0.78 0.26 -0.13 -1.10 0.00 0.00 0.00 175.10 174.91 3inj s GLN 390 N -1.75 2.07 0.56 2.72 -1.52 -1.26 -4.50 119.66 115.99 3inj s GLN 390 Ca 0.48 -1.03 0.26 0.00 -1.95 0.00 0.00 55.36 53.13 3inj s GLN 390 Cb -0.29 -2.25 1.53 0.00 -0.22 0.00 0.00 33.01 31.78 3inj s GLN 390 CO 0.37 0.52 2.07 -0.44 -0.25 0.00 0.00 175.29 177.55 3inj h ASP 391 N 3.92 0.00 1.36 5.90 3.32 -1.97 -1.15 116.42 127.80 3inj h ASP 391 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 3inj h ASP 391 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 3inj h ASP 391 CO 0.50 0.00 -0.01 0.61 -1.72 0.00 0.00 179.24 178.61 3inj n GLY 392 N -1.49 -1.66 3.77 2.75 0.00 -1.26 -4.60 105.19 102.70 3inj n GLY 392 Ca 0.04 -0.05 -0.40 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 -3.08 4.22 0.29 1.61 -1.94 -0.44 -4.93 119.30 115.03 3inj s MET 393 Ca 0.11 2.03 0.03 0.00 -1.71 0.00 0.00 55.69 56.15 3inj s MET 393 Cb 0.14 -2.90 0.64 0.00 2.01 0.00 0.00 34.83 34.72 3inj s MET 393 CO 0.59 -0.24 1.78 1.15 -0.01 0.00 0.00 175.02 178.28 3inj h THR 394 N 2.70 0.73 0.00 2.05 2.02 -1.89 0.78 112.91 119.29 3inj h THR 394 Ca -0.49 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.44 3inj h THR 394 Cb 1.23 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 3inj h THR 394 CO 0.64 0.13 0.00 2.30 0.37 0.00 0.00 175.52 178.96 3inj n ILE 395 N -4.79 0.79 1.19 3.11 -5.35 -1.26 -1.16 119.36 111.89 3inj n ILE 395 Ca 0.21 0.15 0.12 0.00 -0.27 0.00 0.00 62.75 62.96 3inj n ILE 395 Cb 0.50 -1.05 0.27 0.00 -1.74 0.00 0.00 39.64 37.62 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 -1.75 3.12 -0.02 -1.28 0.00 0.24 -4.56 120.51 116.26 3inj n ALA 396 Ca 0.03 -0.49 -0.04 0.00 0.00 0.00 0.00 53.44 52.94 3inj n ALA 396 Cb 0.26 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.26 0.11 -3.72 0.00 5.02 -0.82 -4.96 118.16 113.52 3inj n LYS 397 Ca 0.12 0.03 -0.35 0.00 -2.02 0.00 0.00 58.31 56.10 3inj n LYS 397 Cb 0.40 -0.93 -0.05 0.00 -0.02 0.00 0.00 35.03 34.42 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 -2.09 3.63 -0.13 1.97 2.02 -0.31 -4.90 118.70 118.88 3inj s GLU 398 Ca -0.06 -0.00 -0.29 0.00 0.02 0.00 0.00 54.97 54.64 3inj s GLU 398 Cb 0.02 -3.08 -0.04 0.00 0.10 0.00 0.00 34.13 31.13 3inj s GLU 398 CO 0.09 0.64 1.65 -2.00 0.02 0.00 0.00 175.26 175.66 3inj s GLU 399 N -1.70 3.98 -0.07 1.61 2.12 -1.26 -4.81 118.70 118.58 3inj s GLU 399 Ca 0.27 1.95 -0.16 0.00 0.36 0.00 0.00 54.97 57.40 3inj s GLU 399 Cb -0.13 -4.01 -0.29 0.00 0.26 0.00 0.00 34.13 29.95 3inj s GLU 399 CO 0.16 -1.07 0.67 0.82 -0.54 0.00 0.00 175.26 175.29 3inj h ILE 400 N 5.87 1.11 -2.68 -3.70 2.04 -1.93 -3.49 117.51 114.73 3inj h ILE 400 Ca -0.37 -2.47 -0.28 0.00 1.00 0.00 0.00 64.86 62.74 3inj h ILE 400 Cb 1.17 2.83 0.02 0.00 -0.74 0.00 0.00 36.82 40.10 3inj h ILE 400 CO 0.97 0.75 -0.40 0.33 0.00 0.00 0.00 178.15 179.81 3inj n PHE 401 N -3.86 -1.04 -4.12 1.37 7.35 -1.26 -4.72 117.46 111.18 3inj n PHE 401 Ca -0.22 0.19 -0.14 0.00 -0.76 0.00 0.00 57.45 56.51 3inj n PHE 401 Cb 0.95 -3.26 -0.06 0.00 0.35 0.00 0.00 39.48 37.46 3inj n PHE 401 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 3inj s GLY 402 N -2.59 1.47 -1.25 7.13 0.00 -1.23 -4.18 107.32 106.66 3inj s GLY 402 Ca 0.11 -1.53 -0.10 0.00 0.00 0.00 0.00 44.72 43.20 3inj s GLY 402 CO 0.14 -1.06 2.45 -1.55 0.00 0.00 0.00 173.10 173.08 3inj n PRO 403 N -0.51 2.77 -3.87 2.90 -0.05 -1.23 -4.51 135.00 130.50 3inj n PRO 403 Ca 0.02 -1.93 -0.29 0.00 -0.05 0.00 0.00 63.50 61.24 3inj n PRO 403 Cb 0.62 -2.74 -0.16 0.00 -0.05 0.00 0.00 33.50 31.17 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 3.05 1.20 -0.18 0.52 1.01 -1.26 -0.95 120.40 123.79 3inj s VAL 404 Ca 0.54 -1.03 -0.13 0.00 0.00 0.00 0.00 61.98 61.36 3inj s VAL 404 Cb 0.14 -1.56 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 3inj s VAL 404 CO -0.04 -0.16 0.24 -0.32 0.00 0.00 0.00 175.10 174.82 3inj s MET 405 N 1.54 4.22 -0.26 2.72 1.75 0.36 -4.98 119.30 124.65 3inj s MET 405 Ca -0.04 -0.02 -0.08 0.00 -1.25 0.00 0.00 55.69 54.31 3inj s MET 405 Cb -0.18 -3.44 -0.02 0.00 2.84 0.00 0.00 34.83 34.02 3inj s MET 405 CO -0.07 0.22 0.09 -0.65 -0.65 0.00 0.00 175.02 173.96 3inj s GLN 406 N 0.54 3.58 -0.29 4.11 1.11 -1.26 -0.02 119.66 127.44 3inj s GLN 406 Ca 0.13 -0.53 -0.04 0.00 0.01 0.00 0.00 55.36 54.93 3inj s GLN 406 Cb -0.12 -3.38 0.02 0.00 -1.01 0.00 0.00 33.01 28.52 3inj s GLN 406 CO 0.02 -0.24 0.03 0.42 0.01 0.00 0.00 175.29 175.53 3inj s ILE 407 N 1.61 3.48 0.17 1.08 1.01 -0.14 -0.47 121.20 127.94 3inj s ILE 407 Ca 0.06 -0.95 0.08 0.00 0.00 0.00 0.00 60.65 59.84 3inj s ILE 407 Cb -0.16 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 3inj s ILE 407 CO 0.04 0.05 -0.04 -0.76 0.00 0.00 0.00 174.94 174.24 3inj s LEU 408 N 1.40 3.19 0.07 2.97 1.02 0.07 -2.38 118.68 125.02 3inj s LEU 408 Ca 0.00 -0.46 0.05 0.00 0.02 0.00 0.00 54.13 53.75 3inj s LEU 408 Cb -0.18 -1.86 -0.04 0.00 0.02 0.00 0.00 46.19 44.14 3inj s LEU 408 CO -0.00 0.10 -0.06 -0.75 0.02 0.00 0.00 176.35 175.65 3inj s LYS 409 N -2.88 2.37 0.12 1.70 2.20 -1.26 -0.77 119.74 121.21 3inj s LYS 409 Ca 0.26 -0.88 -0.11 0.00 -0.36 0.00 0.00 55.97 54.89 3inj s LYS 409 Cb -0.09 -2.43 0.01 0.00 -1.51 0.00 0.00 37.83 33.81 3inj s LYS 409 CO 0.17 0.55 0.27 -0.59 -0.36 0.00 0.00 175.35 175.39 3inj s PHE 410 N -1.17 0.11 -0.14 4.03 -0.12 -0.82 -4.87 117.98 115.00 3inj s PHE 410 Ca 0.21 -0.50 -0.11 0.00 -0.05 0.00 0.00 56.93 56.48 3inj s PHE 410 Cb -0.11 0.03 -0.06 0.00 -0.63 0.00 0.00 43.02 42.25 3inj s PHE 410 CO 0.13 -0.63 -0.25 1.17 -0.05 0.00 0.00 175.22 175.59 3inj n LYS 411 N -0.14 0.39 -4.16 1.99 4.81 -1.26 -0.51 118.16 119.27 3inj n LYS 411 Ca -0.13 0.16 -0.23 0.00 -0.87 0.00 0.00 58.31 57.23 3inj n LYS 411 Cb 0.63 -1.17 -0.07 0.00 0.02 0.00 0.00 35.03 34.44 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 -2.51 3.00 0.20 3.15 -4.23 -1.26 -4.76 115.64 109.24 3inj s THR 412 Ca -0.23 -1.76 -0.02 0.00 -1.18 0.00 0.00 61.69 58.50 3inj s THR 412 Cb 0.06 -2.94 -0.04 0.00 1.34 0.00 0.00 72.50 70.93 3inj s THR 412 CO 0.32 -0.20 1.54 -0.29 -0.54 0.00 0.00 174.62 175.44 3inj h ILE 413 N 1.62 1.32 -0.55 2.99 2.10 -2.00 -2.58 117.51 120.41 3inj h ILE 413 Ca -0.44 -1.73 -0.07 0.00 1.08 0.00 0.00 64.86 63.70 3inj h ILE 413 Cb 1.25 1.71 -0.02 0.00 -1.09 0.00 0.00 36.82 38.67 3inj h ILE 413 CO 0.64 0.54 0.05 -0.33 -1.08 0.00 0.00 178.15 177.97 3inj h GLU 414 N 0.42 0.94 0.18 2.19 3.07 -2.00 -2.30 114.58 117.09 3inj h GLU 414 Ca 0.02 -0.27 0.01 0.00 -0.50 0.00 0.00 59.36 58.62 3inj h GLU 414 Cb 1.03 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 28.81 3inj h GLU 414 CO 0.09 0.92 -0.31 1.49 -1.40 0.00 0.00 179.01 179.81 3inj h GLU 415 N 0.82 -0.55 -0.24 2.33 4.81 -1.95 -2.74 114.58 117.06 3inj h GLU 415 Ca 0.16 0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.34 3inj h GLU 415 Cb 0.46 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 3inj h GLU 415 CO 0.02 -0.37 -0.25 -0.24 -0.73 0.00 0.00 179.01 177.44 3inj h VAL 416 N -0.57 1.26 -0.04 0.32 3.04 -1.38 -1.18 116.25 117.71 3inj h VAL 416 Ca 0.02 -1.26 0.03 0.00 -1.01 0.00 0.00 66.70 64.48 3inj h VAL 416 Cb 0.57 1.36 -0.04 0.00 -2.01 0.00 0.00 31.29 31.17 3inj h VAL 416 CO -0.14 0.40 -0.20 0.58 -1.01 0.00 0.00 177.57 177.20 3inj h VAL 417 N 0.40 0.53 -0.53 1.51 2.07 -1.34 0.34 116.25 119.22 3inj h VAL 417 Ca 0.06 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.51 3inj h VAL 417 Cb 0.66 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3inj h VAL 417 CO 0.05 0.00 0.04 1.23 0.02 0.00 0.00 177.57 178.91 3inj h GLY 418 N -0.30 0.94 1.12 2.17 0.00 -1.13 -0.00 103.07 105.87 3inj h GLY 418 Ca 0.07 -0.62 -0.21 0.00 0.00 0.00 0.00 47.33 46.57 3inj h GLY 418 CO -0.21 0.57 -0.72 3.21 0.00 0.00 0.00 176.54 179.39 3inj h ARG 419 N 0.82 0.75 -0.45 4.80 3.08 -1.01 -0.75 114.38 121.62 3inj h ARG 419 Ca 0.16 -0.61 -0.01 0.00 0.07 0.00 0.00 59.98 59.60 3inj h ARG 419 Cb 0.43 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.59 3inj h ARG 419 CO 0.02 1.22 0.26 0.00 -1.07 0.00 0.00 179.97 180.39 3inj h ALA 420 N 0.54 0.58 0.00 0.04 0.00 -0.18 -2.79 119.26 117.44 3inj h ALA 420 Ca -0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3inj h ALA 420 Cb 1.35 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 3inj h ALA 420 CO 0.15 0.09 -0.02 -0.91 0.00 0.00 0.00 179.25 178.56 3inj h ASN 421 N 0.60 0.00 -0.68 0.00 2.35 -0.95 -3.40 115.58 113.49 3inj h ASN 421 Ca 0.16 0.00 -0.50 0.00 -0.55 0.00 0.00 56.30 55.41 3inj h ASN 421 Cb 0.03 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.34 3inj h ASN 421 CO -0.03 0.02 1.61 0.21 -1.65 0.00 0.00 177.43 177.59 3inj s ASN 422 N -5.90 5.92 -0.23 5.81 2.47 -0.29 -4.78 114.94 117.95 3inj s ASN 422 Ca 0.03 -2.00 -0.27 0.00 0.42 0.00 0.00 52.86 51.04 3inj s ASN 422 Cb 0.08 -2.58 0.12 0.00 -1.45 0.00 0.00 41.25 37.42 3inj s ASN 422 CO 0.59 -2.13 1.02 -0.55 -3.72 0.00 0.00 177.10 172.31 3inj s SER 423 N 5.43 -0.41 0.00 -4.21 0.15 -1.26 -4.98 113.70 108.41 3inj s SER 423 Ca 0.61 0.66 0.30 0.00 0.70 0.00 0.00 55.95 58.22 3inj s SER 423 Cb 0.01 0.62 1.47 0.00 -1.71 0.00 0.00 66.02 66.41 3inj s SER 423 CO 0.10 -0.24 2.02 0.35 1.20 0.00 0.00 173.24 176.67 3inj n THR 424 N 1.55 0.00 -3.58 6.45 -2.24 -1.26 -4.81 114.28 110.39 3inj n THR 424 Ca -0.12 -0.01 -0.27 0.00 -2.27 0.00 0.00 64.05 61.39 3inj n THR 424 Cb 0.57 -0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 68.35 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 -2.55 3.48 -0.30 4.78 4.12 -1.26 -1.12 117.35 124.51 3inj s TYR 425 Ca 0.29 0.38 0.10 0.00 0.02 0.00 0.00 57.07 57.86 3inj s TYR 425 Cb 0.20 -1.89 0.33 0.00 -1.52 0.00 0.00 41.96 39.08 3inj s TYR 425 CO 0.46 0.30 1.34 0.41 0.02 0.00 0.00 175.55 178.08 3inj n GLY 426 N -0.96 1.34 0.11 0.71 0.00 -1.23 -4.88 105.19 100.28 3inj n GLY 426 Ca -0.04 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 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 1.05 -0.12 -8.46 0.99 5.85 -1.82 0.07 115.31 112.87 3inj h LEU 427 Ca -0.36 -0.45 -0.20 0.00 0.84 0.00 0.00 57.88 57.72 3inj h LEU 427 Cb 1.25 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 42.21 3inj h LEU 427 CO -0.14 0.45 -0.29 0.00 -0.34 0.00 0.00 178.44 178.13 3inj s ALA 428 N -3.71 0.56 0.12 1.25 0.00 -1.26 -2.35 121.76 116.36 3inj s ALA 428 Ca -0.14 -1.36 -0.25 0.00 0.00 0.00 0.00 51.96 50.21 3inj s ALA 428 Cb 0.00 1.20 0.08 0.00 0.00 0.00 0.00 23.12 24.40 3inj s ALA 428 CO 0.54 -0.76 0.71 0.00 0.00 0.00 0.00 175.76 176.25 3inj s ALA 429 N -3.70 -1.64 0.04 0.00 0.00 0.35 -4.07 121.76 112.74 3inj s ALA 429 Ca 0.30 0.58 -0.00 0.00 0.00 0.00 0.00 51.96 52.84 3inj s ALA 429 Cb 0.01 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.84 3inj s ALA 429 CO 0.14 -0.77 -0.03 0.00 0.00 0.00 0.00 175.76 175.10 3inj s ALA 430 N -3.56 0.37 -0.04 0.00 0.00 -0.27 -1.02 121.76 117.24 3inj s ALA 430 Ca 0.03 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.06 3inj s ALA 430 Cb -0.01 0.21 0.03 0.00 0.00 0.00 0.00 23.12 23.34 3inj s ALA 430 CO -0.10 -0.26 -0.01 0.08 0.00 0.00 0.00 175.76 175.47 3inj s VAL 431 N -2.77 0.31 -0.22 0.00 1.01 -0.15 -0.41 120.40 118.17 3inj s VAL 431 Ca -0.03 0.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.97 3inj s VAL 431 Cb -0.00 -0.41 0.01 0.00 0.00 0.00 0.00 36.38 35.97 3inj s VAL 431 CO -0.06 0.19 -0.08 -0.36 0.00 0.00 0.00 175.10 174.80 3inj s PHE 432 N 1.25 2.94 -0.07 5.22 0.40 0.74 -0.20 117.98 128.26 3inj s PHE 432 Ca -0.06 -1.23 -0.30 0.00 -0.60 0.00 0.00 56.93 54.74 3inj s PHE 432 Cb -0.13 -2.06 0.11 0.00 0.51 0.00 0.00 43.02 41.45 3inj s PHE 432 CO -0.02 -0.65 0.95 -0.08 0.70 0.00 0.00 175.22 176.13 3inj s THR 433 N 1.41 0.00 -1.13 0.64 -1.32 -1.26 -1.64 115.64 112.33 3inj s THR 433 Ca 0.04 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.74 3inj s THR 433 Cb -0.14 -1.00 -0.15 0.00 -1.51 0.00 0.00 72.50 69.70 3inj s THR 433 CO -0.06 0.00 1.03 0.29 -2.21 0.00 0.00 174.62 173.68 3inj n LYS 434 N 0.10 0.15 -3.08 7.08 5.02 -1.22 -4.86 118.16 121.35 3inj n LYS 434 Ca -0.08 -0.12 -0.41 0.00 -2.02 0.00 0.00 58.31 55.68 3inj n LYS 434 Cb 0.60 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 34.06 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 -2.93 6.68 0.12 4.39 -1.08 -1.26 -4.98 116.67 117.60 3inj s ASP 435 Ca 0.10 0.83 -0.33 0.00 -0.52 0.00 0.00 52.55 52.63 3inj s ASP 435 Cb 0.17 -2.36 -0.12 0.00 -1.46 0.00 0.00 42.92 39.14 3inj s ASP 435 CO 0.80 -0.34 1.54 0.25 0.52 0.00 0.00 175.17 177.93 3inj h LEU 436 N 8.58 -1.71 -0.62 -1.34 5.85 -1.99 -1.22 115.31 122.85 3inj h LEU 436 Ca -0.29 0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 3inj h LEU 436 Cb 1.13 0.67 -0.03 0.00 0.37 0.00 0.00 40.66 42.80 3inj h LEU 436 CO 0.79 -0.46 0.35 0.44 -0.34 0.00 0.00 178.44 179.21 3inj h ASP 437 N -0.54 0.77 -0.69 1.25 3.45 -1.99 -1.15 116.42 117.53 3inj h ASP 437 Ca 0.04 -0.09 -0.00 0.00 0.43 0.00 0.00 57.03 57.41 3inj h ASP 437 Cb 0.65 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 39.19 3inj h ASP 437 CO -0.45 0.64 0.42 0.11 -1.57 0.00 0.00 179.24 178.39 3inj h LYS 438 N 0.85 0.93 -0.08 3.56 1.57 -1.95 0.29 116.57 121.73 3inj h LYS 438 Ca 0.22 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3inj h LYS 438 Cb 0.03 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 3inj h LYS 438 CO -0.04 0.65 0.05 0.00 -0.57 0.00 0.00 179.45 179.55 3inj h ALA 439 N 1.22 0.10 -0.51 3.86 0.00 -0.85 -1.44 119.26 121.65 3inj h ALA 439 Ca 0.25 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 3inj h ALA 439 Cb -0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3inj h ALA 439 CO -0.05 -0.40 -0.10 -0.91 0.00 0.00 0.00 179.25 177.79 3inj h ASN 440 N 0.10 0.92 -0.18 0.00 2.35 -0.94 -1.34 115.58 116.50 3inj h ASN 440 Ca 0.03 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 3inj h ASN 440 Cb -0.01 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 3inj h ASN 440 CO -0.01 1.03 0.12 0.22 -1.65 0.00 0.00 177.43 177.14 3inj h TYR 441 N 0.83 0.22 -0.15 1.19 3.20 -0.32 -2.70 116.97 119.23 3inj h TYR 441 Ca 0.14 0.01 -0.21 0.00 3.14 0.00 0.00 58.73 61.80 3inj h TYR 441 Cb 0.63 -0.07 0.01 0.00 1.54 0.00 0.00 36.73 38.83 3inj h TYR 441 CO 0.04 0.14 -0.74 -0.07 -1.64 0.00 0.00 178.16 175.88 3inj h LEU 442 N 0.24 0.91 -1.30 2.82 3.38 -1.20 -1.23 115.31 118.93 3inj h LEU 442 Ca 0.07 -0.63 -0.06 0.00 0.09 0.00 0.00 57.88 57.35 3inj h LEU 442 Cb -0.02 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 3inj h LEU 442 CO -0.02 1.39 -0.22 0.77 0.09 0.00 0.00 178.44 180.46 3inj h SER 443 N 0.49 0.20 -0.04 -0.43 4.64 -1.28 0.16 113.55 117.29 3inj h SER 443 Ca -0.05 -0.05 -0.14 0.00 -0.47 0.00 0.00 61.79 61.08 3inj h SER 443 Cb 1.37 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 63.42 3inj h SER 443 CO 0.15 0.43 -0.53 -0.61 -0.87 0.00 0.00 176.83 175.40 3inj h GLN 444 N 0.19 0.44 -0.09 4.77 4.15 -1.45 -3.36 115.11 119.76 3inj h GLN 444 Ca 0.03 -0.41 -0.16 0.00 0.77 0.00 0.00 58.65 58.88 3inj h GLN 444 Cb 0.49 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.28 3inj h GLN 444 CO 0.03 1.06 -0.64 0.00 -1.93 0.00 0.00 178.83 177.35 3inj h ALA 445 N 0.38 0.73 -2.57 3.38 0.00 -0.91 -3.45 119.26 116.84 3inj h ALA 445 Ca -0.05 -0.56 -0.53 0.00 0.00 0.00 0.00 54.91 53.76 3inj h ALA 445 Cb 1.22 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 18.96 3inj h ALA 445 CO 0.11 0.74 0.84 -0.51 0.00 0.00 0.00 179.25 180.43 3inj s LEU 446 N -7.98 4.37 -1.21 0.00 1.43 0.02 -4.92 118.68 110.39 3inj s LEU 446 Ca -0.05 2.50 -0.10 0.00 -1.03 0.00 0.00 54.13 55.45 3inj s LEU 446 Cb 0.11 -3.59 0.21 0.00 0.03 0.00 0.00 46.19 42.95 3inj s LEU 446 CO 0.82 -0.77 1.56 0.00 0.23 0.00 0.00 176.35 178.19 3inj n GLN 447 N 4.15 3.65 -3.93 1.70 6.02 -1.26 -4.94 117.38 122.77 3inj n GLN 447 Ca 0.13 -3.92 -0.10 0.00 -0.01 0.00 0.00 57.00 53.10 3inj n GLN 447 Cb 0.40 -2.85 -0.12 0.00 1.02 0.00 0.00 30.24 28.69 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 0.09 -0.01 0.33 -1.58 0.00 -1.26 -4.56 121.76 114.77 3inj s ALA 448 Ca 0.38 -0.33 0.02 0.00 0.00 0.00 0.00 51.96 52.03 3inj s ALA 448 Cb 0.02 0.09 0.58 0.00 0.00 0.00 0.00 23.12 23.80 3inj s ALA 448 CO 0.01 -0.13 1.95 0.78 0.00 0.00 0.00 175.76 178.37 3inj h GLY 449 N 4.99 0.85 -6.01 0.00 0.00 -0.65 -3.42 103.07 98.84 3inj h GLY 449 Ca -0.30 -0.37 -0.38 0.00 0.00 0.00 0.00 47.33 46.28 3inj h GLY 449 CO 0.43 0.36 -0.77 -1.59 0.00 0.00 0.00 176.54 174.98 3inj s THR 450 N -5.52 0.47 -0.26 4.70 2.01 -0.99 -4.72 115.64 111.33 3inj s THR 450 Ca -0.10 -0.13 -0.00 0.00 0.31 0.00 0.00 61.69 61.77 3inj s THR 450 Cb 0.17 -0.48 0.04 0.00 0.01 0.00 0.00 72.50 72.24 3inj s THR 450 CO 0.77 0.19 -0.07 0.54 -0.69 0.00 0.00 174.62 175.37 3inj s VAL 451 N 0.64 2.66 0.02 3.82 0.11 -1.26 -0.49 120.40 125.90 3inj s VAL 451 Ca -0.08 -1.30 -0.19 0.00 -2.93 0.00 0.00 61.98 57.48 3inj s VAL 451 Cb -0.11 -2.45 -0.06 0.00 -1.53 0.00 0.00 36.38 32.23 3inj s VAL 451 CO -0.00 0.06 0.54 0.26 -3.33 0.00 0.00 175.10 172.63 3inj s TRP 452 N 1.24 3.74 -0.23 1.54 0.51 -0.19 -4.98 118.94 120.56 3inj s TRP 452 Ca -0.04 1.17 -0.01 0.00 -2.12 0.00 0.00 56.10 55.10 3inj s TRP 452 Cb -0.18 -2.49 0.02 0.00 -0.81 0.00 0.00 33.47 30.01 3inj s TRP 452 CO -0.04 0.50 -0.08 0.08 -0.51 0.00 0.00 176.95 176.90 3inj s VAL 453 N -0.73 2.77 -1.54 4.03 1.01 -1.26 -0.98 120.40 123.71 3inj s VAL 453 Ca 0.28 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.29 3inj s VAL 453 Cb -0.18 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.83 3inj s VAL 453 CO 0.17 0.27 0.00 0.59 0.00 0.00 0.00 175.10 176.13 3inj n ASN 454 N 4.67 -5.07 -2.85 3.32 3.02 0.73 -4.95 115.26 114.12 3inj n ASN 454 Ca -0.17 0.06 -0.05 0.00 -0.03 0.00 0.00 54.58 54.39 3inj n ASN 454 Cb 0.48 -4.14 0.02 0.00 -0.61 0.00 0.00 39.78 35.53 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 -0.64 -1.33 0.00 5.04 -1.26 -4.74 117.35 111.79 3inj s TYR 456 Ca 0.18 1.13 -0.06 0.00 -2.44 0.00 0.00 57.07 55.87 3inj s TYR 456 Cb -0.04 0.38 0.04 0.00 0.35 0.00 0.00 41.96 42.70 3inj s TYR 456 CO 0.08 -0.58 0.44 -0.25 -1.34 0.00 0.00 175.55 173.90 3inj n ASP 457 N 1.04 -4.46 -4.50 4.32 8.00 -1.26 -4.91 116.55 114.78 3inj n ASP 457 Ca -0.19 -0.27 -0.43 0.00 0.71 0.00 0.00 54.79 54.62 3inj n ASP 457 Cb 0.57 -3.67 -0.04 0.00 -0.02 0.00 0.00 41.12 37.96 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 -2.96 4.33 -0.01 2.53 1.01 -1.26 -5.03 120.40 119.01 3inj s VAL 458 Ca 0.31 0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.38 3inj s VAL 458 Cb -0.15 -4.61 -0.04 0.00 0.00 0.00 0.00 36.38 31.58 3inj s VAL 458 CO 0.38 -1.26 0.02 -0.36 0.00 0.00 0.00 175.10 173.87 3inj s PHE 459 N 4.09 3.13 -0.01 5.22 0.40 -1.26 -5.10 117.98 124.46 3inj s PHE 459 Ca 0.28 0.12 -0.01 0.00 -0.60 0.00 0.00 56.93 56.73 3inj s PHE 459 Cb -0.14 -1.70 0.00 0.00 0.51 0.00 0.00 43.02 41.70 3inj s PHE 459 CO 0.16 0.48 0.02 0.20 0.70 0.00 0.00 175.22 176.78 3inj s GLY 460 N -1.52 -0.00 0.65 4.36 0.00 -1.26 -5.00 107.32 104.55 3inj s GLY 460 Ca 0.19 0.07 0.37 0.00 0.00 0.00 0.00 44.72 45.35 3inj s GLY 460 CO 0.10 0.10 2.17 0.00 0.00 0.00 0.00 173.10 175.47 3inj h ALA 461 N 6.22 1.26 0.00 3.20 0.00 -1.96 -1.75 119.26 126.23 3inj h ALA 461 Ca -0.26 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 3inj h ALA 461 Cb 1.20 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3inj h ALA 461 CO 0.50 -0.17 -0.62 1.96 0.00 0.00 0.00 179.25 180.93 3inj h GLN 462 N 0.00 0.00 -5.53 0.00 7.50 -1.94 0.35 115.11 115.48 3inj h GLN 462 Ca 0.01 0.00 -0.65 0.00 0.50 0.00 0.00 58.65 58.51 3inj h GLN 462 Cb 0.31 0.00 -0.21 0.00 0.05 0.00 0.00 27.48 27.64 3inj h GLN 462 CO -0.00 0.62 -0.67 -1.12 -1.50 0.00 0.00 178.83 176.15 3inj s SER 463 N -6.53 4.76 0.63 1.46 0.01 -0.66 -3.97 113.70 109.40 3inj s SER 463 Ca 0.03 -0.09 -0.16 0.00 1.31 0.00 0.00 55.95 57.03 3inj s SER 463 Cb 0.09 -1.62 -0.02 0.00 0.21 0.00 0.00 66.02 64.68 3inj s SER 463 CO 0.76 0.23 1.12 -2.16 0.41 0.00 0.00 173.24 173.60 3inj s PRO 464 N 0.01 2.95 -0.03 12.44 0.05 -1.26 -4.27 135.00 144.89 3inj s PRO 464 Ca 0.00 1.48 -0.01 0.00 0.05 0.00 0.00 61.00 62.52 3inj s PRO 464 Cb -0.13 -1.96 0.03 0.00 0.05 0.00 0.00 34.50 32.48 3inj s PRO 464 CO 0.03 -1.15 0.06 0.12 0.05 0.00 0.00 177.00 176.11 3inj s PHE 465 N -2.14 -0.03 0.00 0.56 5.36 0.58 -4.94 117.98 117.38 3inj s PHE 465 Ca 0.69 0.23 0.00 0.00 -0.96 0.00 0.00 56.93 56.89 3inj s PHE 465 Cb -0.22 -0.18 0.00 0.00 -0.34 0.00 0.00 43.02 42.28 3inj s PHE 465 CO 0.37 -0.11 0.00 0.41 -1.46 0.00 0.00 175.22 174.43 3inj n GLY 466 N 4.13 0.72 3.88 13.12 0.00 -1.26 -0.65 105.19 125.13 3inj n GLY 466 Ca -0.27 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.68 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 2.25 0.54 -0.02 0.00 -1.25 -3.80 107.32 105.04 3inj s GLY 467 Ca 0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 44.72 44.39 3inj s GLY 467 CO 0.00 -0.20 0.78 -0.19 0.00 0.00 0.00 173.10 173.49 3inj s TYR 468 N -1.81 2.97 0.00 1.90 1.51 -0.65 -4.42 117.35 116.85 3inj s TYR 468 Ca 0.46 0.13 0.00 0.00 -1.01 0.00 0.00 57.07 56.65 3inj s TYR 468 Cb -0.11 -2.69 0.00 0.00 -0.11 0.00 0.00 41.96 39.05 3inj s TYR 468 CO 0.22 -0.80 0.00 1.63 -1.11 0.00 0.00 175.55 175.49 3inj n LYS 469 N -2.35 0.00 -0.48 -0.62 5.02 -1.26 -1.46 118.16 117.01 3inj n LYS 469 Ca 0.06 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.39 3inj n LYS 469 Cb 0.59 0.00 0.22 0.00 -0.02 0.00 0.00 35.03 35.82 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 3.07 -0.12 1.97 2.81 -0.27 -3.64 117.12 134.94 3inj n MET 470 Ca 0.00 -1.69 0.10 0.00 -1.81 0.00 0.00 57.70 54.30 3inj n MET 470 Cb 0.00 -1.89 0.31 0.00 -0.71 0.00 0.00 33.22 30.93 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 0.35 2.05 0.00 7.83 7.64 -0.54 -4.43 113.62 126.52 3inj n SER 471 Ca 0.15 -1.81 0.00 0.00 1.01 0.00 0.00 58.87 58.22 3inj n SER 471 Cb 0.75 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 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 1.19 0.90 3.02 0.23 0.00 -1.24 -1.38 105.19 107.91 3inj n GLY 472 Ca 0.16 -2.26 -0.10 0.00 0.00 0.00 0.00 46.02 43.81 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 -0.06 0.10 0.00 1.61 1.04 -0.48 -4.37 113.70 111.55 3inj s SER 473 Ca 0.00 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.16 3inj s SER 473 Cb 0.00 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.27 3inj s SER 473 CO 0.00 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.56 3inj n GLY 474 N 1.84 0.06 3.13 7.32 0.00 -1.26 -1.65 105.19 114.63 3inj n GLY 474 Ca -0.21 -1.82 -0.20 0.00 0.00 0.00 0.00 46.02 43.79 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 -1.88 0.90 0.34 1.61 1.81 -1.26 -4.31 118.95 116.17 3inj s ARG 475 Ca 0.00 -0.75 0.08 0.00 -1.72 0.00 0.00 55.73 53.35 3inj s ARG 475 Cb 0.00 -0.90 -0.04 0.00 -0.45 0.00 0.00 34.95 33.56 3inj s ARG 475 CO 0.00 0.22 0.15 -1.21 -0.68 0.00 0.00 175.30 173.78 3inj s GLU 476 N -1.14 2.38 0.46 3.54 2.02 0.18 -3.89 118.70 122.25 3inj s GLU 476 Ca 0.01 -1.55 0.00 0.00 0.02 0.00 0.00 54.97 53.45 3inj s GLU 476 Cb -0.08 -2.18 0.00 0.00 0.10 0.00 0.00 34.13 31.97 3inj s GLU 476 CO 0.01 0.10 0.00 1.28 0.02 0.00 0.00 175.26 176.67 3inj n LEU 477 N -1.17 -0.78 0.00 1.80 4.77 -1.26 -0.30 117.00 120.06 3inj n LEU 477 Ca -0.03 1.81 0.06 0.00 -0.03 0.00 0.00 56.01 57.82 3inj n LEU 477 Cb 0.61 -2.86 -0.01 0.00 -2.33 0.00 0.00 43.42 38.83 3inj n LEU 477 CO 0.43 -1.93 -0.07 0.61 -1.33 0.00 0.00 177.39 175.09 3inj n GLY 478 N -3.88 -1.75 0.34 -0.72 0.00 0.12 -2.15 105.19 97.15 3inj n GLY 478 Ca -0.06 -1.25 0.05 0.00 0.00 0.00 0.00 46.02 44.76 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 0.69 -0.47 1.61 4.81 -1.86 -2.85 114.58 116.51 3inj h GLU 479 Ca 0.01 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 3inj h GLU 479 Cb 0.37 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 3inj h GLU 479 CO 0.00 0.45 0.31 1.88 -0.73 0.00 0.00 179.01 180.93 3inj h TYR 480 N 0.71 0.50 0.00 0.92 -1.99 -1.92 -0.74 116.97 114.45 3inj h TYR 480 Ca 0.25 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.99 3inj h TYR 480 Cb 0.12 -0.17 0.00 0.00 2.00 0.00 0.00 36.73 38.68 3inj h TYR 480 CO -0.00 0.29 0.00 0.41 -0.00 0.00 0.00 178.16 178.86 3inj n GLY 481 N -1.49 -0.88 0.10 3.88 0.00 -0.91 -1.48 105.19 104.41 3inj n GLY 481 Ca 0.05 0.15 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.39 0.99 3.38 -1.29 -3.38 115.31 114.61 3inj h LEU 482 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 3inj h LEU 482 Cb 0.06 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 3inj h LEU 482 CO 0.00 0.75 0.19 1.56 0.09 0.00 0.00 178.44 181.03 3inj h GLN 483 N 0.00 0.37 0.00 1.13 4.20 -1.40 -1.38 115.11 118.03 3inj h GLN 483 Ca -0.01 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3inj h GLN 483 Cb 1.55 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.25 3inj h GLN 483 CO 0.10 0.25 0.00 0.00 -0.67 0.00 0.00 178.83 178.50 3inj n ALA 484 N -2.29 1.56 -0.06 3.87 0.00 -1.26 -2.40 120.51 119.92 3inj n ALA 484 Ca 0.02 0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.57 3inj n ALA 484 Cb 0.10 -1.29 0.18 0.00 0.00 0.00 0.00 19.45 18.44 3inj n ALA 484 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3inj n TYR 485 N -1.88 0.51 -4.86 0.00 4.02 -0.53 -4.93 117.16 109.49 3inj n TYR 485 Ca 0.02 -0.40 -0.33 0.00 -0.01 0.00 0.00 57.90 57.19 3inj n TYR 485 Cb 0.17 -0.01 -0.15 0.00 -0.02 0.00 0.00 39.34 39.33 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 -1.05 2.90 -0.19 -0.72 2.01 -1.01 -2.52 115.64 115.06 3inj s THR 486 Ca 0.29 -0.72 -0.07 0.00 0.31 0.00 0.00 61.69 61.49 3inj s THR 486 Cb 0.16 -2.20 -0.04 0.00 0.01 0.00 0.00 72.50 70.43 3inj s THR 486 CO 0.21 0.54 0.06 -0.70 -0.69 0.00 0.00 174.62 174.03 3inj s GLU 487 N 0.23 3.91 -0.21 4.92 2.56 0.09 -4.77 118.70 125.43 3inj s GLU 487 Ca -0.10 -0.37 -0.13 0.00 0.00 0.00 0.00 54.97 54.37 3inj s GLU 487 Cb -0.16 -3.21 -0.05 0.00 2.00 0.00 0.00 34.13 32.72 3inj s GLU 487 CO 0.06 0.21 0.27 0.08 -0.56 0.00 0.00 175.26 175.31 3inj s VAL 488 N 0.53 5.30 -0.14 3.70 1.01 -1.26 -1.10 120.40 128.43 3inj s VAL 488 Ca 0.03 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.44 3inj s VAL 488 Cb -0.13 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 3inj s VAL 488 CO 0.01 0.32 -0.14 -0.75 0.00 0.00 0.00 175.10 174.54 3inj s LYS 489 N 1.03 3.29 -0.10 2.72 2.20 -0.23 -4.97 119.74 123.68 3inj s LYS 489 Ca 0.13 -0.72 -0.18 0.00 -0.36 0.00 0.00 55.97 54.84 3inj s LYS 489 Cb -0.14 -2.62 -0.04 0.00 -1.51 0.00 0.00 37.83 33.51 3inj s LYS 489 CO 0.05 0.11 0.47 0.99 -0.36 0.00 0.00 175.35 176.61 3inj s THR 490 N 0.59 5.16 -0.19 3.43 2.01 -1.26 -0.20 115.64 125.18 3inj s THR 490 Ca -0.08 0.94 -0.01 0.00 0.31 0.00 0.00 61.69 62.85 3inj s THR 490 Cb -0.16 -3.81 0.01 0.00 0.01 0.00 0.00 72.50 68.55 3inj s THR 490 CO 0.03 0.36 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.49 3inj s VAL 491 N 0.40 2.57 -0.18 3.82 1.01 0.71 -4.99 120.40 123.74 3inj s VAL 491 Ca 0.26 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3inj s VAL 491 Cb -0.15 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.14 3inj s VAL 491 CO 0.11 0.50 -0.17 -0.89 0.00 0.00 0.00 175.10 174.64 3inj s THR 492 N 1.29 1.91 -0.12 3.92 2.01 -1.26 -1.20 115.64 122.19 3inj s THR 492 Ca 0.04 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 61.14 3inj s THR 492 Cb -0.14 -1.78 -0.01 0.00 0.01 0.00 0.00 72.50 70.58 3inj s THR 492 CO -0.08 0.45 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.43 3inj s VAL 493 N 1.33 2.53 0.11 3.82 1.01 0.11 -4.95 120.40 124.37 3inj s VAL 493 Ca 0.04 -0.84 -0.31 0.00 0.00 0.00 0.00 61.98 60.86 3inj s VAL 493 Cb -0.14 -2.03 -0.09 0.00 0.00 0.00 0.00 36.38 34.13 3inj s VAL 493 CO -0.11 0.54 1.58 -0.75 0.00 0.00 0.00 175.10 176.35 3inj s LYS 494 N 0.46 4.22 0.31 2.72 2.20 -1.26 -0.04 119.74 128.35 3inj s LYS 494 Ca -0.13 2.30 0.09 0.00 -0.36 0.00 0.00 55.97 57.87 3inj s LYS 494 Cb -0.17 -3.39 -0.06 0.00 -1.51 0.00 0.00 37.83 32.71 3inj s LYS 494 CO 0.05 -0.65 -0.11 0.14 -0.36 0.00 0.00 175.35 174.43 3inj s VAL 495 N 1.89 2.14 0.12 4.02 -7.23 -0.81 -4.87 120.40 115.66 3inj s VAL 495 Ca 0.71 -2.23 -0.19 0.00 -1.81 0.00 0.00 61.98 58.46 3inj s VAL 495 Cb -0.41 -2.50 -0.05 0.00 0.56 0.00 0.00 36.38 33.98 3inj s VAL 495 CO 0.31 -0.29 1.72 -0.65 -0.31 0.00 0.00 175.10 175.89 3inj h PRO 496 N 2.16 0.37 -0.94 4.82 0.11 -1.96 -3.44 132.00 133.12 3inj h PRO 496 Ca -0.41 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 65.73 3inj h PRO 496 Cb 1.25 -0.07 -0.21 0.00 0.11 0.00 0.00 31.00 32.08 3inj h PRO 496 CO 0.67 0.33 -0.29 -1.14 -0.21 0.00 0.00 178.00 177.35 3inj s GLN 497 N -5.86 0.53 0.25 1.05 0.74 -1.26 -5.03 119.66 110.08 3inj s GLN 497 Ca -0.13 0.73 -0.30 0.00 0.05 0.00 0.00 55.36 55.71 3inj s GLN 497 Cb 0.09 0.38 -0.10 0.00 1.10 0.00 0.00 33.01 34.47 3inj s GLN 497 CO 0.71 -0.79 1.48 0.21 -0.55 0.00 0.00 175.29 176.35 3inj s LYS 498 N 2.85 4.24 0.11 1.67 2.36 -1.26 -5.03 119.74 124.68 3inj s LYS 498 Ca 0.15 2.35 0.04 0.00 -2.55 0.00 0.00 55.97 55.96 3inj s LYS 498 Cb -0.12 -3.10 -0.04 0.00 -1.05 0.00 0.00 37.83 33.52 3inj s LYS 498 CO -0.23 -0.47 -0.10 -0.80 1.55 0.00 0.00 175.35 175.29 3inj s ASN 499 N 0.46 1.56 0.00 1.43 0.01 -1.26 -5.00 114.94 112.14 3inj s ASN 499 Ca 0.61 -0.87 0.14 0.00 -0.71 0.00 0.00 52.86 52.03 3inj s ASN 499 Cb -0.43 0.00 0.82 0.00 0.41 0.00 0.00 41.25 42.05 3inj s ASN 499 CO 0.43 -0.28 1.24 -1.54 -1.51 0.00 0.00 177.10 175.44