#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 2.44 0.49 0.00 1.01 -1.26 -5.11 120.40 117.97 3inj s VAL 8 Ca 0.00 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 60.93 3inj s VAL 8 Cb 0.00 -2.04 -0.08 0.00 0.00 0.00 0.00 36.38 34.26 3inj s VAL 8 CO 0.00 0.51 1.17 -0.81 0.00 0.00 0.00 175.10 175.97 3inj n PRO 9 N 4.48 1.52 -1.98 2.72 -0.04 -1.26 -4.89 135.00 135.55 3inj n PRO 9 Ca -0.20 0.55 -0.41 0.00 -0.04 0.00 0.00 63.50 63.40 3inj n PRO 9 Cb 0.51 -2.31 -0.02 0.00 -0.04 0.00 0.00 33.50 31.64 3inj n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3inj s ALA 10 N -1.31 3.62 0.37 0.55 0.00 -1.26 -4.98 121.76 118.77 3inj s ALA 10 Ca 0.67 1.37 -0.19 0.00 0.00 0.00 0.00 51.96 53.81 3inj s ALA 10 Cb -0.48 -3.56 -0.10 0.00 0.00 0.00 0.00 23.12 18.98 3inj s ALA 10 CO 0.53 -0.78 0.87 -1.25 0.00 0.00 0.00 175.76 175.13 3inj s PRO 11 N -0.67 4.18 -0.48 0.00 0.04 -1.26 -5.02 135.00 131.79 3inj s PRO 11 Ca 0.58 0.97 -0.28 0.00 0.04 0.00 0.00 61.00 62.31 3inj s PRO 11 Cb -0.43 -2.35 0.03 0.00 0.04 0.00 0.00 34.50 31.79 3inj s PRO 11 CO 0.46 0.08 1.09 1.21 0.04 0.00 0.00 177.00 179.89 3inj s ASN 12 N -2.14 6.59 0.03 6.66 3.84 -1.26 -4.93 114.94 123.74 3inj s ASN 12 Ca 0.57 0.36 0.16 0.00 0.21 0.00 0.00 52.86 54.17 3inj s ASN 12 Cb -0.11 -2.53 0.69 0.00 -0.55 0.00 0.00 41.25 38.76 3inj s ASN 12 CO 0.16 -1.22 1.52 0.00 -2.79 0.00 0.00 177.10 174.76 3inj n GLN 13 N 7.73 0.02 -3.26 0.43 6.02 -1.26 -3.55 117.38 123.51 3inj n GLN 13 Ca 0.11 0.26 -0.25 0.00 -0.01 0.00 0.00 57.00 57.10 3inj n GLN 13 Cb 0.49 -1.54 -0.08 0.00 1.02 0.00 0.00 30.24 30.13 3inj n GLN 13 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3inj n GLN 14 N -1.59 0.79 -2.05 -1.09 6.02 -1.26 -5.00 117.38 113.20 3inj n GLN 14 Ca 0.04 -3.36 -0.37 0.00 -0.01 0.00 0.00 57.00 53.30 3inj n GLN 14 Cb 0.19 -1.41 0.02 0.00 1.02 0.00 0.00 30.24 30.06 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 -1.06 3.25 0.51 -1.09 0.04 -1.23 -4.98 135.00 130.43 3inj s PRO 15 Ca 0.35 1.88 -0.21 0.00 0.04 0.00 0.00 61.00 63.06 3inj s PRO 15 Cb 0.14 -2.13 -0.07 0.00 0.04 0.00 0.00 34.50 32.49 3inj s PRO 15 CO -0.12 -1.00 1.13 -2.00 0.04 0.00 0.00 177.00 175.05 3inj s GLU 16 N -3.07 3.54 -0.23 4.56 2.12 -1.26 -5.03 118.70 119.33 3inj s GLU 16 Ca 0.72 1.65 -0.09 0.00 0.36 0.00 0.00 54.97 57.62 3inj s GLU 16 Cb -0.31 -2.16 -0.04 0.00 0.26 0.00 0.00 34.13 31.87 3inj s GLU 16 CO 0.36 -0.70 0.10 0.08 -0.54 0.00 0.00 175.26 174.56 3inj s VAL 17 N -1.70 4.85 -0.02 3.70 1.01 -1.26 -4.98 120.40 122.00 3inj s VAL 17 Ca 0.69 0.00 0.16 0.00 0.00 0.00 0.00 61.98 62.84 3inj s VAL 17 Cb -0.25 -3.25 -0.25 0.00 0.00 0.00 0.00 36.38 32.63 3inj s VAL 17 CO 0.29 0.37 0.35 0.49 0.00 0.00 0.00 175.10 176.60 3inj n PHE 18 N 4.33 0.00 -3.82 5.22 3.01 -1.26 -4.96 117.46 119.98 3inj n PHE 18 Ca -0.16 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.08 3inj n PHE 18 Cb 0.52 -0.38 -0.17 0.00 -0.01 0.00 0.00 39.48 39.44 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 4.97 0.07 -2.81 0.00 6.94 -1.26 -4.70 115.26 118.47 3inj n ASN 20 Ca -0.10 -1.73 -0.09 0.00 -0.02 0.00 0.00 54.58 52.64 3inj n ASN 20 Cb 0.50 -0.11 -0.01 0.00 -2.36 0.00 0.00 39.78 37.80 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 0.09 1.49 -2.95 -3.83 6.02 -1.26 -0.64 117.38 116.30 3inj n GLN 21 Ca -0.02 -1.07 -0.40 0.00 -0.01 0.00 0.00 57.00 55.50 3inj n GLN 21 Cb 0.73 0.22 -0.06 0.00 1.02 0.00 0.00 30.24 32.15 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 -1.26 4.34 -0.34 5.09 1.01 0.10 -4.72 121.20 125.43 3inj s ILE 22 Ca 0.03 1.76 -0.03 0.00 0.00 0.00 0.00 60.65 62.41 3inj s ILE 22 Cb -0.00 -4.17 0.06 0.00 0.01 0.00 0.00 42.46 38.36 3inj s ILE 22 CO 0.02 0.51 0.08 0.12 0.00 0.00 0.00 174.94 175.67 3inj s PHE 23 N -1.10 3.35 -0.00 3.97 5.36 0.16 -0.53 117.98 129.19 3inj s PHE 23 Ca 0.37 -1.92 0.01 0.00 -0.96 0.00 0.00 56.93 54.43 3inj s PHE 23 Cb -0.23 -2.44 -0.00 0.00 -0.34 0.00 0.00 43.02 40.00 3inj s PHE 23 CO 0.27 -0.83 -0.04 0.42 -1.46 0.00 0.00 175.22 173.57 3inj s ILE 24 N 1.25 0.33 -1.67 3.12 1.01 -0.63 -0.65 121.20 123.97 3inj s ILE 24 Ca -0.01 -0.19 -0.14 0.00 0.00 0.00 0.00 60.65 60.31 3inj s ILE 24 Cb -0.20 -0.29 0.13 0.00 0.01 0.00 0.00 42.46 42.10 3inj s ILE 24 CO -0.01 0.09 0.58 0.59 0.00 0.00 0.00 174.94 176.19 3inj n ASN 25 N 2.95 -1.93 -2.02 3.58 3.02 -1.26 -0.87 115.26 118.73 3inj n ASN 25 Ca -0.13 -1.09 -0.19 0.00 -0.03 0.00 0.00 54.58 53.14 3inj n ASN 25 Cb 0.58 -2.44 -0.03 0.00 -0.61 0.00 0.00 39.78 37.29 3inj n ASN 25 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3inj n ASN 26 N -2.71 -5.49 -4.10 6.41 5.03 -1.26 -4.66 115.26 108.48 3inj n ASN 26 Ca -0.04 0.10 -0.11 0.00 0.87 0.00 0.00 54.58 55.41 3inj n ASN 26 Cb 0.55 -4.57 -0.11 0.00 -1.02 0.00 0.00 39.78 34.63 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 -4.64 0.64 -0.23 3.52 2.02 -0.05 -5.02 118.70 114.95 3inj s GLU 27 Ca 0.00 -1.05 -0.12 0.00 0.02 0.00 0.00 54.97 53.82 3inj s GLU 27 Cb 0.00 -0.13 -0.05 0.00 0.10 0.00 0.00 34.13 34.05 3inj s GLU 27 CO 0.00 -0.01 0.23 -1.58 0.02 0.00 0.00 175.26 173.91 3inj s TRP 28 N -2.71 3.33 0.05 1.61 0.52 -1.26 -1.60 118.94 118.87 3inj s TRP 28 Ca 0.01 0.33 0.08 0.00 0.02 0.00 0.00 56.10 56.54 3inj s TRP 28 Cb -0.01 -2.35 -0.03 0.00 -1.15 0.00 0.00 33.47 29.94 3inj s TRP 28 CO -0.04 0.03 -0.22 -1.01 0.02 0.00 0.00 176.95 175.74 3inj s HIS 29 N 1.17 1.90 0.71 -1.98 3.76 0.32 -4.94 115.29 116.23 3inj s HIS 29 Ca 0.11 -0.38 -0.11 0.00 -0.15 0.00 0.00 55.06 54.52 3inj s HIS 29 Cb -0.14 -1.13 0.02 0.00 1.11 0.00 0.00 32.58 32.44 3inj s HIS 29 CO 0.06 0.10 1.08 -0.51 -0.85 0.00 0.00 174.74 174.62 3inj s ASP 30 N -1.22 5.31 0.53 1.40 -0.00 -1.26 -0.72 116.67 120.70 3inj s ASP 30 Ca 0.08 1.32 -0.22 0.00 -0.00 0.00 0.00 52.55 53.72 3inj s ASP 30 Cb -0.09 -2.16 -0.06 0.00 -0.00 0.00 0.00 42.92 40.62 3inj s ASP 30 CO 0.02 -1.45 1.37 0.00 -0.00 0.00 0.00 175.17 175.11 3inj n ALA 31 N -3.10 1.65 -0.30 5.23 0.00 -1.26 -4.86 120.51 117.87 3inj n ALA 31 Ca 0.07 0.15 0.19 0.00 0.00 0.00 0.00 53.44 53.85 3inj n ALA 31 Cb 0.56 -2.36 0.46 0.00 0.00 0.00 0.00 19.45 18.11 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 1.58 0.63 0.00 0.00 2.07 -1.95 0.24 116.25 118.82 3inj h VAL 32 Ca -0.51 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 66.84 3inj h VAL 32 Cb 1.30 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 3inj h VAL 32 CO 0.58 0.09 -0.02 -1.54 0.02 0.00 0.00 177.57 176.70 3inj n SER 33 N -4.61 0.13 0.00 0.57 3.41 -1.26 -4.90 113.62 106.95 3inj n SER 33 Ca 0.22 0.48 0.00 0.00 -0.26 0.00 0.00 58.87 59.32 3inj n SER 33 Cb 0.73 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 3inj n SER 33 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3inj n ARG 34 N -1.60 -0.39 -2.31 4.33 5.12 0.84 -4.99 116.66 117.65 3inj n ARG 34 Ca 0.07 0.10 -0.35 0.00 -1.93 0.00 0.00 57.85 55.73 3inj n ARG 34 Cb 0.35 -3.52 -0.01 0.00 -1.16 0.00 0.00 32.46 28.13 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 -0.58 3.54 0.09 5.56 1.02 -1.26 -4.85 119.74 123.26 3inj s LYS 35 Ca 0.00 1.61 0.01 0.00 0.02 0.00 0.00 55.97 57.61 3inj s LYS 35 Cb 0.00 -2.13 -0.04 0.00 -0.52 0.00 0.00 37.83 35.14 3inj s LYS 35 CO 0.00 -0.69 -0.06 0.95 -0.92 0.00 0.00 175.35 174.62 3inj s THR 36 N -1.75 0.63 0.03 2.17 -4.23 -1.26 -1.13 115.64 110.11 3inj s THR 36 Ca 0.69 -1.87 0.05 0.00 -1.18 0.00 0.00 61.69 59.38 3inj s THR 36 Cb -0.24 -1.60 -0.02 0.00 1.34 0.00 0.00 72.50 71.98 3inj s THR 36 CO 0.27 -0.86 -0.14 0.72 -0.54 0.00 0.00 174.62 174.07 3inj s PHE 37 N -3.52 1.26 0.22 3.99 -0.12 -0.15 -4.83 117.98 114.82 3inj s PHE 37 Ca 0.10 -0.34 -0.30 0.00 -0.05 0.00 0.00 56.93 56.34 3inj s PHE 37 Cb 0.05 -0.75 -0.08 0.00 -0.63 0.00 0.00 43.02 41.60 3inj s PHE 37 CO -0.05 0.03 0.97 -1.25 -0.05 0.00 0.00 175.22 174.87 3inj s PRO 38 N -1.04 4.79 -0.02 1.99 0.04 -1.26 -0.39 135.00 139.11 3inj s PRO 38 Ca 0.02 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.59 3inj s PRO 38 Cb -0.08 -3.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.14 3inj s PRO 38 CO 0.01 0.41 0.02 -0.08 0.04 0.00 0.00 177.00 177.40 3inj s THR 39 N -0.92 4.30 0.06 1.26 -1.32 -0.75 -4.95 115.64 113.32 3inj s THR 39 Ca 0.43 -0.48 0.05 0.00 -1.21 0.00 0.00 61.69 60.47 3inj s THR 39 Cb -0.26 -2.90 -0.04 0.00 -1.51 0.00 0.00 72.50 67.79 3inj s THR 39 CO 0.33 0.42 -0.06 -0.69 -2.21 0.00 0.00 174.62 172.41 3inj s VAL 40 N -1.06 3.62 -0.48 5.08 1.01 -1.26 -0.59 120.40 126.73 3inj s VAL 40 Ca 0.19 -1.01 -0.24 0.00 0.00 0.00 0.00 61.98 60.91 3inj s VAL 40 Cb -0.12 -2.66 0.03 0.00 0.00 0.00 0.00 36.38 33.64 3inj s VAL 40 CO 0.09 0.22 0.87 0.21 0.00 0.00 0.00 175.10 176.49 3inj s ASN 41 N -1.92 6.43 0.00 3.32 3.04 -0.48 -4.77 114.94 120.55 3inj s ASN 41 Ca 0.21 -0.09 0.14 0.00 0.04 0.00 0.00 52.86 53.15 3inj s ASN 41 Cb -0.11 -2.42 0.60 0.00 -1.54 0.00 0.00 41.25 37.78 3inj s ASN 41 CO 0.12 -1.03 1.42 -0.81 -3.04 0.00 0.00 177.10 173.77 3inj n PRO 42 N 7.03 0.03 0.11 0.43 -0.05 -1.26 0.65 135.00 141.94 3inj n PRO 42 Ca 0.03 0.25 -0.18 0.00 -0.05 0.00 0.00 63.50 63.55 3inj n PRO 42 Cb 0.48 -1.50 -0.15 0.00 -0.05 0.00 0.00 33.50 32.29 3inj n PRO 42 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 175.50 176.22 3inj h SER 43 N 0.00 0.54 0.00 3.54 0.02 -1.88 -2.03 113.55 113.74 3inj h SER 43 Ca 0.00 -0.59 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 3inj h SER 43 Cb 0.22 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.58 3inj h SER 43 CO 0.00 1.46 -1.42 0.35 -1.14 0.00 0.00 176.83 176.08 3inj n THR 44 N -3.58 0.00 -1.12 -2.27 -2.24 -0.74 -3.01 114.28 101.32 3inj n THR 44 Ca -0.11 -0.23 -0.04 0.00 -2.27 0.00 0.00 64.05 61.40 3inj n THR 44 Cb 1.05 0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 69.56 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 1.92 0.70 3.56 3.38 0.00 0.21 -3.91 105.19 111.05 3inj n GLY 45 Ca -0.02 -0.61 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.01 2.05 0.20 1.61 0.41 -1.24 -4.85 118.70 114.88 3inj s GLU 46 Ca 0.00 -1.06 -0.31 0.00 -0.41 0.00 0.00 54.97 53.19 3inj s GLU 46 Cb 0.00 -2.26 -0.10 0.00 -1.78 0.00 0.00 34.13 29.98 3inj s GLU 46 CO 0.00 0.50 1.57 0.08 -0.49 0.00 0.00 175.26 176.92 3inj s VAL 47 N -1.22 2.49 -0.14 2.63 1.01 -1.26 -1.38 120.40 122.53 3inj s VAL 47 Ca 0.21 0.37 -0.27 0.00 0.00 0.00 0.00 61.98 62.28 3inj s VAL 47 Cb -0.11 -3.24 -0.25 0.00 0.00 0.00 0.00 36.38 32.78 3inj s VAL 47 CO 0.13 0.04 0.70 0.40 0.00 0.00 0.00 175.10 176.37 3inj h ILE 48 N 3.83 1.66 -2.19 2.22 2.04 -1.17 -3.46 117.51 120.44 3inj h ILE 48 Ca -0.44 -2.34 0.23 0.00 1.00 0.00 0.00 64.86 63.31 3inj h ILE 48 Cb 1.21 3.22 -0.04 0.00 -0.74 0.00 0.00 36.82 40.47 3inj h ILE 48 CO 0.88 0.58 0.66 0.00 0.00 0.00 0.00 178.15 180.27 3inj s GLN 50 N -2.03 3.02 0.02 0.00 -1.52 -1.26 -1.81 119.66 116.08 3inj s GLN 50 Ca 0.23 -0.79 0.04 0.00 -1.95 0.00 0.00 55.36 52.89 3inj s GLN 50 Cb -0.01 -2.73 -0.02 0.00 -0.22 0.00 0.00 33.01 30.03 3inj s GLN 50 CO 0.02 0.50 -0.12 0.08 -0.25 0.00 0.00 175.29 175.52 3inj s VAL 51 N -1.71 0.93 0.11 1.09 1.01 0.47 -4.87 120.40 117.42 3inj s VAL 51 Ca 0.32 -0.73 -0.36 0.00 0.00 0.00 0.00 61.98 61.20 3inj s VAL 51 Cb -0.10 -0.82 -0.16 0.00 0.00 0.00 0.00 36.38 35.29 3inj s VAL 51 CO 0.24 0.09 1.38 0.00 0.00 0.00 0.00 175.10 176.81 3inj n ALA 52 N 2.32 -0.43 -3.36 5.51 0.00 0.18 -0.98 120.51 123.75 3inj n ALA 52 Ca -0.16 0.50 -0.46 0.00 0.00 0.00 0.00 53.44 53.31 3inj n ALA 52 Cb 0.55 -2.14 -0.02 0.00 0.00 0.00 0.00 19.45 17.84 3inj n ALA 52 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3inj s GLU 53 N 0.52 3.56 0.47 0.00 2.12 -0.28 -4.39 118.70 120.70 3inj s GLU 53 Ca 0.82 -2.51 -0.22 0.00 0.36 0.00 0.00 54.97 53.42 3inj s GLU 53 Cb -0.89 -4.38 -0.07 0.00 0.26 0.00 0.00 34.13 29.05 3inj s GLU 53 CO 0.45 -1.28 1.15 0.20 -0.54 0.00 0.00 175.26 175.24 3inj s GLY 54 N 2.00 2.74 0.00 -1.50 0.00 0.39 -4.75 107.32 106.20 3inj s GLY 54 Ca 0.18 0.89 0.00 0.00 0.00 0.00 0.00 44.72 45.79 3inj s GLY 54 CO -0.09 1.32 0.00 1.34 0.00 0.00 0.00 173.10 175.67 3inj n ASP 55 N -0.62 0.11 -0.26 1.64 -0.08 -1.26 -4.22 116.55 111.86 3inj n ASP 55 Ca 0.08 -0.63 0.07 0.00 -1.51 0.00 0.00 54.79 52.80 3inj n ASP 55 Cb 0.49 0.00 0.19 0.00 2.34 0.00 0.00 41.12 44.14 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 0.21 -0.01 -0.67 3.64 -1.93 0.18 116.57 117.99 3inj h LYS 56 Ca 0.00 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 3inj h LYS 56 Cb 0.00 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 3inj h LYS 56 CO 0.00 0.14 -0.38 0.93 -2.27 0.00 0.00 179.45 177.87 3inj h GLU 57 N 0.21 0.03 0.03 1.90 5.08 -1.97 -0.22 114.58 119.64 3inj h GLU 57 Ca 0.44 -0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 58.58 3inj h GLU 57 Cb 0.78 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.05 3inj h GLU 57 CO -0.58 0.40 -0.83 -0.44 -1.00 0.00 0.00 179.01 176.57 3inj h ASP 58 N 0.02 0.67 -0.50 1.42 3.32 -1.41 -2.51 116.42 117.43 3inj h ASP 58 Ca -0.00 -0.79 0.06 0.00 0.02 0.00 0.00 57.03 56.32 3inj h ASP 58 Cb 0.68 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.97 3inj h ASP 58 CO 0.05 1.37 0.21 0.58 -1.72 0.00 0.00 179.24 179.73 3inj h VAL 59 N 0.04 0.87 -0.57 -1.35 2.07 -1.04 -1.47 116.25 114.80 3inj h VAL 59 Ca -0.11 -0.14 0.05 0.00 0.82 0.00 0.00 66.70 67.32 3inj h VAL 59 Cb 1.53 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 3inj h VAL 59 CO 0.16 0.07 0.30 0.44 0.02 0.00 0.00 177.57 178.56 3inj h ASP 60 N 0.40 0.44 -0.89 0.57 5.19 -1.00 0.19 116.42 121.32 3inj h ASP 60 Ca 0.24 0.03 0.01 0.00 -0.62 0.00 0.00 57.03 56.69 3inj h ASP 60 Cb 0.22 -0.05 -0.05 0.00 0.18 0.00 0.00 39.33 39.63 3inj h ASP 60 CO -0.22 0.29 0.59 0.11 -3.12 0.00 0.00 179.24 176.90 3inj h LYS 61 N 0.57 1.16 -0.36 3.56 1.57 -1.15 -1.76 116.57 120.17 3inj h LYS 61 Ca 0.25 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.88 3inj h LYS 61 Cb 0.15 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 3inj h LYS 61 CO -0.17 0.77 -0.09 0.00 -0.57 0.00 0.00 179.45 179.40 3inj h ALA 62 N 1.34 0.49 -0.84 3.86 0.00 -0.11 -1.74 119.26 122.25 3inj h ALA 62 Ca 0.33 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3inj h ALA 62 Cb -0.11 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 3inj h ALA 62 CO -0.08 0.34 0.41 0.28 0.00 0.00 0.00 179.25 180.20 3inj h VAL 63 N 0.48 1.25 -0.64 0.00 2.07 -0.54 -0.04 116.25 118.83 3inj h VAL 63 Ca 0.09 -0.70 -0.08 0.00 0.82 0.00 0.00 66.70 66.83 3inj h VAL 63 Cb 0.59 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 3inj h VAL 63 CO 0.04 0.30 0.10 0.11 0.02 0.00 0.00 177.57 178.14 3inj h LYS 64 N 1.19 1.05 -0.50 1.57 1.57 -1.12 0.20 116.57 120.53 3inj h LYS 64 Ca 0.29 -0.27 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 3inj h LYS 64 Cb 0.10 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 3inj h LYS 64 CO -0.04 0.97 0.01 0.00 -0.57 0.00 0.00 179.45 179.82 3inj h ALA 65 N 1.11 0.67 0.03 3.86 0.00 -0.77 -0.87 119.26 123.29 3inj h ALA 65 Ca 0.20 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3inj h ALA 65 Cb 0.43 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3inj h ALA 65 CO 0.01 0.48 -0.01 0.00 0.00 0.00 0.00 179.25 179.72 3inj h ALA 66 N 0.94 -0.04 -0.99 0.00 0.00 -0.72 -1.09 119.26 117.35 3inj h ALA 66 Ca 0.14 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.12 3inj h ALA 66 Cb 0.51 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 3inj h ALA 66 CO 0.02 -0.46 0.61 -0.09 0.00 0.00 0.00 179.25 179.33 3inj h ARG 67 N -0.16 0.87 -0.37 0.00 9.65 -0.52 -1.71 114.38 122.14 3inj h ARG 67 Ca -0.00 -0.05 -0.12 0.00 -1.10 0.00 0.00 59.98 58.71 3inj h ARG 67 Cb 0.15 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 28.52 3inj h ARG 67 CO 0.01 0.58 -0.23 0.00 2.80 0.00 0.00 179.97 183.13 3inj h ALA 68 N 1.57 0.53 0.00 2.80 0.00 -0.82 -2.50 119.26 120.83 3inj h ALA 68 Ca 0.51 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3inj h ALA 68 Cb 0.61 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3inj h ALA 68 CO -0.30 0.50 -0.06 0.00 0.00 0.00 0.00 179.25 179.39 3inj h ALA 69 N 0.78 1.11 -0.01 0.00 0.00 -0.75 -2.86 119.26 117.53 3inj h ALA 69 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3inj h ALA 69 Cb 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3inj h ALA 69 CO 0.06 0.07 -0.19 0.34 0.00 0.00 0.00 179.25 179.53 3inj n PHE 70 N -3.32 0.00 -1.85 0.00 7.35 -0.68 -4.39 117.46 114.57 3inj n PHE 70 Ca -0.01 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.27 3inj n PHE 70 Cb 0.22 -0.13 -0.01 0.00 0.35 0.00 0.00 39.48 39.91 3inj n PHE 70 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 3inj s GLN 71 N -2.45 4.16 0.20 -4.13 -1.52 -1.08 -4.87 119.66 109.96 3inj s GLN 71 Ca 0.27 2.51 -0.32 0.00 -1.95 0.00 0.00 55.36 55.87 3inj s GLN 71 Cb 0.20 -3.02 -0.15 0.00 -0.22 0.00 0.00 33.01 29.82 3inj s GLN 71 CO 0.49 -0.53 1.29 -0.11 -0.25 0.00 0.00 175.29 176.19 3inj n LEU 72 N 1.40 2.28 0.00 2.90 7.94 -1.26 -0.73 117.00 129.52 3inj n LEU 72 Ca 0.04 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.08 3inj n LEU 72 Cb 0.39 -1.32 0.00 0.00 0.53 0.00 0.00 43.42 43.02 3inj n LEU 72 CO 0.63 -0.90 0.00 0.61 -1.11 0.00 0.00 177.39 176.62 3inj n GLY 73 N 2.16 1.48 3.74 -3.96 0.00 -1.26 -5.04 105.19 102.30 3inj n GLY 73 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.02 4.01 0.38 1.61 1.04 0.09 -4.76 113.70 113.04 3inj s SER 74 Ca 0.00 1.83 0.09 0.00 0.48 0.00 0.00 55.95 58.35 3inj s SER 74 Cb 0.00 -2.47 0.85 0.00 0.10 0.00 0.00 66.02 64.50 3inj s SER 74 CO 0.00 -2.35 1.92 -0.65 0.98 0.00 0.00 173.24 173.13 3inj h PRO 75 N -1.35 0.63 -0.06 4.02 0.11 -1.88 -0.46 132.00 133.00 3inj h PRO 75 Ca -0.45 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.44 3inj h PRO 75 Cb 1.25 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3inj h PRO 75 CO 0.50 0.41 -0.74 2.35 -0.21 0.00 0.00 178.00 180.31 3inj h TRP 76 N 0.65 0.49 -0.01 0.65 -0.00 -1.92 -1.86 115.95 113.94 3inj h TRP 76 Ca 0.38 -0.22 -0.19 0.00 -0.00 0.00 0.00 58.89 58.85 3inj h TRP 76 Cb 0.57 -0.07 -0.01 0.00 -0.00 0.00 0.00 29.16 29.65 3inj h TRP 76 CO -0.00 0.97 -0.84 0.00 -0.00 0.00 0.00 178.44 178.57 3inj h ARG 77 N 0.24 0.23 0.00 2.65 2.47 -1.63 -3.30 114.38 115.05 3inj h ARG 77 Ca -0.03 -0.24 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 3inj h ARG 77 Cb 1.32 0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.70 3inj h ARG 77 CO 0.12 0.95 -0.63 0.00 0.56 0.00 0.00 179.97 180.97 3inj h ARG 78 N 0.14 0.00 -6.70 0.04 3.08 -1.11 -3.47 114.38 106.36 3inj h ARG 78 Ca -0.04 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.45 3inj h ARG 78 Cb 1.45 0.00 0.08 0.00 0.08 0.00 0.00 29.97 31.59 3inj h ARG 78 CO 0.13 0.00 0.78 -0.12 -1.07 0.00 0.00 179.97 179.69 3inj n MET 79 N -2.78 2.43 -1.62 0.04 1.56 -0.70 -4.90 117.12 111.15 3inj n MET 79 Ca 0.02 0.86 -0.47 0.00 -0.27 0.00 0.00 57.70 57.84 3inj n MET 79 Cb 0.53 -2.60 -0.03 0.00 2.15 0.00 0.00 33.22 33.27 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 2.24 1.99 -0.28 6.12 8.00 -1.26 -4.86 116.55 128.50 3inj n ASP 80 Ca 0.10 1.14 0.09 0.00 0.71 0.00 0.00 54.79 56.84 3inj n ASP 80 Cb 0.34 -1.32 0.24 0.00 -0.02 0.00 0.00 41.12 40.37 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 3.69 1.21 -0.13 2.24 0.00 -1.90 0.27 119.26 124.63 3inj h ALA 81 Ca -0.44 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3inj h ALA 81 Cb 1.31 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 3inj h ALA 81 CO 0.72 -0.29 0.09 0.66 0.00 0.00 0.00 179.25 180.43 3inj h SER 82 N 0.39 0.15 0.72 0.00 4.64 -1.89 -2.24 113.55 115.32 3inj h SER 82 Ca 0.48 -0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.62 3inj h SER 82 Cb 0.84 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.88 3inj h SER 82 CO -0.49 0.11 -0.83 -0.74 -0.87 0.00 0.00 176.83 174.01 3inj h HIS 83 N 0.18 0.11 -0.72 4.77 6.17 -1.30 -2.36 115.15 122.00 3inj h HIS 83 Ca 0.05 -0.06 0.09 0.00 0.71 0.00 0.00 60.37 61.16 3inj h HIS 83 Cb -0.01 -0.01 -0.05 0.00 2.52 0.00 0.00 27.41 29.86 3inj h HIS 83 CO -0.00 0.86 0.47 0.00 0.71 0.00 0.00 177.93 179.98 3inj h ARG 84 N 0.04 0.61 -0.25 5.26 3.08 -1.06 -0.46 114.38 121.61 3inj h ARG 84 Ca -0.02 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 3inj h ARG 84 Cb 1.45 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.35 3inj h ARG 84 CO 0.11 0.40 -0.06 0.78 -1.07 0.00 0.00 179.97 180.14 3inj h GLY 85 N 0.63 0.52 0.52 0.04 0.00 -1.32 -1.74 103.07 101.71 3inj h GLY 85 Ca 0.33 -0.43 0.11 0.00 0.00 0.00 0.00 47.33 47.34 3inj h GLY 85 CO -0.11 0.39 0.63 3.21 0.00 0.00 0.00 176.54 180.66 3inj h ARG 86 N 0.22 0.99 -0.22 4.80 2.47 -0.85 -0.71 114.38 121.08 3inj h ARG 86 Ca 0.06 -0.06 -0.08 0.00 -1.26 0.00 0.00 59.98 58.64 3inj h ARG 86 Cb 0.52 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.62 3inj h ARG 86 CO 0.02 0.65 -0.19 -0.07 0.56 0.00 0.00 179.97 180.95 3inj h LEU 87 N 1.02 0.55 -0.99 3.04 3.38 -0.89 -0.54 115.31 120.88 3inj h LEU 87 Ca 0.48 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3inj h LEU 87 Cb 0.44 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 3inj h LEU 87 CO -0.25 0.89 0.61 -0.07 0.09 0.00 0.00 178.44 179.72 3inj h LEU 88 N 0.21 1.14 -1.07 1.67 3.38 -1.06 -0.46 115.31 119.12 3inj h LEU 88 Ca 0.04 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3inj h LEU 88 Cb 0.72 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3inj h LEU 88 CO 0.05 0.86 0.13 0.78 0.09 0.00 0.00 178.44 180.34 3inj h ASN 89 N 1.33 0.74 -0.28 -0.43 2.35 -1.00 -2.17 115.58 116.12 3inj h ASN 89 Ca 0.35 -0.13 -0.11 0.00 -0.55 0.00 0.00 56.30 55.86 3inj h ASN 89 Cb -0.10 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.07 3inj h ASN 89 CO -0.07 0.73 -0.27 -0.09 -1.65 0.00 0.00 177.43 176.07 3inj h ARG 90 N 0.77 0.67 -0.54 0.81 9.65 -0.40 -2.30 114.38 123.04 3inj h ARG 90 Ca 0.17 -0.36 0.08 0.00 -1.10 0.00 0.00 59.98 58.78 3inj h ARG 90 Cb 0.28 0.01 -0.07 0.00 -1.39 0.00 0.00 29.97 28.80 3inj h ARG 90 CO -0.00 0.96 0.17 1.25 2.80 0.00 0.00 179.97 185.16 3inj h LEU 91 N 0.41 0.15 -0.46 3.80 5.85 -0.97 -1.46 115.31 122.61 3inj h LEU 91 Ca 0.04 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.88 3inj h LEU 91 Cb 0.84 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.91 3inj h LEU 91 CO 0.07 0.10 0.24 0.00 -0.34 0.00 0.00 178.44 178.51 3inj h ALA 92 N 1.38 0.59 -0.75 1.25 0.00 -1.32 -0.82 119.26 119.59 3inj h ALA 92 Ca 0.27 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.27 3inj h ALA 92 Cb 0.33 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 3inj h ALA 92 CO -0.29 -0.11 0.42 -0.44 0.00 0.00 0.00 179.25 178.83 3inj h ASP 93 N 0.47 0.63 -0.35 0.00 3.32 -0.79 -0.34 116.42 119.36 3inj h ASP 93 Ca 0.20 0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.19 3inj h ASP 93 Cb 0.10 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 3inj h ASP 93 CO -0.13 0.39 -0.14 -0.07 -1.72 0.00 0.00 179.24 177.57 3inj h LEU 94 N 0.76 0.72 -0.93 1.55 3.38 -0.89 0.60 115.31 120.49 3inj h LEU 94 Ca 0.34 -0.39 0.02 0.00 0.09 0.00 0.00 57.88 57.94 3inj h LEU 94 Cb 0.25 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 3inj h LEU 94 CO -0.21 0.95 0.61 0.40 0.09 0.00 0.00 178.44 180.29 3inj h ILE 95 N 0.48 1.20 -0.50 1.22 2.04 -0.84 -1.26 117.51 119.85 3inj h ILE 95 Ca 0.08 -0.42 -0.09 0.00 1.00 0.00 0.00 64.86 65.43 3inj h ILE 95 Cb 0.66 -0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 3inj h ILE 95 CO 0.04 0.22 -0.03 -0.08 0.00 0.00 0.00 178.15 178.30 3inj h GLU 96 N 1.23 0.91 -1.00 2.37 4.81 -0.87 -1.37 114.58 120.66 3inj h GLU 96 Ca 0.35 -0.31 0.12 0.00 -0.13 0.00 0.00 59.36 59.39 3inj h GLU 96 Cb -0.08 -0.07 -0.08 0.00 0.63 0.00 0.00 28.75 29.14 3inj h GLU 96 CO -0.09 0.96 0.63 -0.09 -0.73 0.00 0.00 179.01 179.69 3inj h ARG 97 N 0.78 0.96 -0.70 1.92 2.43 -0.21 -2.25 114.38 117.32 3inj h ARG 97 Ca 0.14 -0.06 -0.29 0.00 -0.81 0.00 0.00 59.98 58.96 3inj h ARG 97 Cb 0.57 -0.22 -0.17 0.00 -0.42 0.00 0.00 29.97 29.73 3inj h ARG 97 CO 0.03 0.64 0.30 -0.25 -1.51 0.00 0.00 179.97 179.18 3inj n ASP 98 N -4.61 3.84 0.03 -3.80 8.00 -0.54 -4.72 116.55 114.75 3inj n ASP 98 Ca 0.19 -3.47 -0.11 0.00 0.71 0.00 0.00 54.79 52.11 3inj n ASP 98 Cb 0.35 -0.74 -0.05 0.00 -0.02 0.00 0.00 41.12 40.67 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 1.64 -0.13 -0.61 -1.24 2.43 -0.62 -1.36 114.38 114.49 3inj h ARG 99 Ca 0.36 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.57 3inj h ARG 99 Cb 2.29 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 31.83 3inj h ARG 99 CO 0.74 -0.09 0.36 1.15 -1.51 0.00 0.00 179.97 180.62 3inj h THR 100 N -0.14 1.04 0.20 0.20 2.02 -1.84 0.48 112.91 114.88 3inj h THR 100 Ca 0.05 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.98 3inj h THR 100 Cb 0.20 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 3inj h THR 100 CO -0.12 0.13 -0.10 0.22 0.37 0.00 0.00 175.52 176.02 3inj h TYR 101 N 0.70 -0.25 -0.99 3.16 3.20 -1.89 -1.60 116.97 119.29 3inj h TYR 101 Ca 0.25 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.14 3inj h TYR 101 Cb 0.06 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.36 3inj h TYR 101 CO -0.06 -0.01 0.65 -0.07 -1.64 0.00 0.00 178.16 177.03 3inj h LEU 102 N -0.47 1.11 -0.56 2.82 3.38 -1.00 0.21 115.31 120.79 3inj h LEU 102 Ca -0.03 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 3inj h LEU 102 Cb 0.36 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 3inj h LEU 102 CO 0.05 0.77 0.26 0.00 0.09 0.00 0.00 178.44 179.61 3inj h ALA 103 N 1.39 0.72 -0.39 1.53 0.00 -0.88 0.11 119.26 121.74 3inj h ALA 103 Ca 0.39 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 3inj h ALA 103 Cb -0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3inj h ALA 103 CO -0.11 0.29 -0.13 0.00 0.00 0.00 0.00 179.25 179.30 3inj h ALA 104 N 1.10 0.54 -0.56 0.00 0.00 -0.61 -2.54 119.26 117.20 3inj h ALA 104 Ca 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3inj h ALA 104 Cb 0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3inj h ALA 104 CO -0.02 0.44 0.30 1.25 0.00 0.00 0.00 179.25 181.22 3inj h LEU 105 N 0.59 0.70 -0.49 0.00 5.85 -0.46 -1.54 115.31 119.97 3inj h LEU 105 Ca 0.09 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.77 3inj h LEU 105 Cb 0.67 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 3inj h LEU 105 CO 0.05 0.60 0.21 -0.08 -0.34 0.00 0.00 178.44 178.88 3inj h GLU 106 N 0.75 0.40 -0.49 1.25 4.57 -0.71 -2.09 114.58 118.27 3inj h GLU 106 Ca 0.20 -0.02 -0.10 0.00 -1.18 0.00 0.00 59.36 58.25 3inj h GLU 106 Cb 0.06 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.54 3inj h GLU 106 CO -0.03 0.27 -0.09 1.15 -1.18 0.00 0.00 179.01 179.13 3inj h THR 107 N 0.42 1.26 -0.51 0.32 2.02 -1.19 -0.29 112.91 114.95 3inj h THR 107 Ca 0.22 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.20 3inj h THR 107 Cb 0.19 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 3inj h THR 107 CO -0.19 0.41 0.27 0.25 0.37 0.00 0.00 175.52 176.63 3inj h LEU 108 N 0.80 0.64 0.01 2.58 5.85 -0.88 -0.43 115.31 123.89 3inj h LEU 108 Ca 0.13 -0.10 -0.25 0.00 0.84 0.00 0.00 57.88 58.51 3inj h LEU 108 Cb 0.60 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 3inj h LEU 108 CO 0.04 0.56 -1.28 -0.78 -0.34 0.00 0.00 178.44 176.65 3inj h ASP 109 N 0.67 0.04 0.00 1.25 1.82 -1.31 -3.38 116.42 115.51 3inj h ASP 109 Ca 0.18 -0.05 -0.33 0.00 -0.39 0.00 0.00 57.03 56.44 3inj h ASP 109 Cb 0.07 -0.01 -0.06 0.00 0.68 0.00 0.00 39.33 40.01 3inj h ASP 109 CO -0.03 1.04 -2.23 -3.20 -1.61 0.00 0.00 179.24 173.21 3inj n ASN 110 N -3.26 2.24 0.00 2.28 2.85 -0.13 -4.59 115.26 114.65 3inj n ASN 110 Ca -0.07 -0.06 0.00 0.00 -0.11 0.00 0.00 54.58 54.34 3inj n ASN 110 Cb 0.99 -0.38 0.00 0.00 1.24 0.00 0.00 39.78 41.62 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 2.35 0.80 3.78 8.20 0.00 -0.17 -4.41 105.19 115.74 3inj n GLY 111 Ca -0.39 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.49 3.25 0.35 1.61 -2.85 -1.26 -3.70 119.74 116.64 3inj s LYS 112 Ca 0.00 1.47 -0.28 0.00 -1.00 0.00 0.00 55.97 56.16 3inj s LYS 112 Cb 0.00 -2.00 -0.12 0.00 -2.06 0.00 0.00 37.83 33.65 3inj s LYS 112 CO 0.00 -0.91 1.35 -2.30 0.10 0.00 0.00 175.35 173.59 3inj n PRO 113 N -1.67 2.28 -0.16 1.78 -0.02 -1.26 -4.56 135.00 131.39 3inj n PRO 113 Ca 0.11 0.80 -0.01 0.00 -2.02 0.00 0.00 63.50 62.38 3inj n PRO 113 Cb 0.52 -2.42 0.23 0.00 -0.02 0.00 0.00 33.50 31.81 3inj n PRO 113 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 3inj h TYR 114 N 2.69 0.87 -0.52 6.00 3.20 -1.20 -0.58 116.97 127.43 3inj h TYR 114 Ca -0.47 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.36 3inj h TYR 114 Cb 1.27 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 39.24 3inj h TYR 114 CO 0.51 0.63 0.26 0.28 -1.64 0.00 0.00 178.16 178.20 3inj h VAL 115 N 0.88 1.17 -0.03 1.81 2.07 -1.90 0.05 116.25 120.30 3inj h VAL 115 Ca 0.22 -0.48 -0.26 0.00 0.82 0.00 0.00 66.70 67.01 3inj h VAL 115 Cb 0.07 0.50 0.02 0.00 -1.52 0.00 0.00 31.29 30.36 3inj h VAL 115 CO -0.03 0.20 -0.98 0.40 0.02 0.00 0.00 177.57 177.18 3inj h ILE 116 N 0.73 1.28 -0.81 4.57 1.08 -1.71 -1.04 117.51 121.61 3inj h ILE 116 Ca 0.18 -2.20 0.03 0.00 -0.39 0.00 0.00 64.86 62.48 3inj h ILE 116 Cb 0.07 2.30 -0.05 0.00 -3.07 0.00 0.00 36.82 36.07 3inj h ILE 116 CO -0.03 0.68 0.53 0.28 -0.69 0.00 0.00 178.15 178.92 3inj h SER 117 N 0.42 0.88 0.04 1.72 0.02 -0.71 0.28 113.55 116.20 3inj h SER 117 Ca -0.11 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3inj h SER 117 Cb 1.63 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.97 3inj h SER 117 CO 0.19 0.61 -0.02 0.22 -1.14 0.00 0.00 176.83 176.70 3inj h TYR 118 N 1.04 -0.04 0.01 3.45 3.20 -0.97 -1.61 116.97 122.04 3inj h TYR 118 Ca 0.32 -0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.92 3inj h TYR 118 Cb -0.02 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 3inj h TYR 118 CO -0.02 0.59 -1.47 -0.07 -1.64 0.00 0.00 178.16 175.55 3inj h LEU 119 N -0.74 0.04 0.00 2.82 3.38 -1.18 -3.35 115.31 116.28 3inj h LEU 119 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3inj h LEU 119 Cb 0.65 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3inj h LEU 119 CO 0.01 1.05 0.00 0.52 0.09 0.00 0.00 178.44 180.11 3inj n VAL 120 N -3.19 0.00 0.09 1.22 0.31 0.04 -4.34 118.33 112.47 3inj n VAL 120 Ca -0.12 0.36 -0.15 0.00 -0.01 0.00 0.00 64.34 64.43 3inj n VAL 120 Cb 1.01 -1.33 -0.08 0.00 -0.91 0.00 0.00 33.84 32.53 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 -1.39 -0.52 4.52 3.45 -1.42 -0.29 116.42 120.76 3inj h ASP 121 Ca 0.00 0.16 0.02 0.00 0.43 0.00 0.00 57.03 57.64 3inj h ASP 121 Cb 0.00 0.53 -0.03 0.00 -0.56 0.00 0.00 39.33 39.26 3inj h ASP 121 CO 0.00 -0.50 0.31 -0.07 -1.57 0.00 0.00 179.24 177.41 3inj h LEU 122 N -0.66 0.50 -0.73 1.55 -0.00 -1.45 -0.51 115.31 114.02 3inj h LEU 122 Ca 0.02 0.00 0.04 0.00 -0.00 0.00 0.00 57.88 57.95 3inj h LEU 122 Cb 0.70 -0.10 -0.05 0.00 -0.00 0.00 0.00 40.66 41.21 3inj h LEU 122 CO -0.30 0.35 0.45 -0.78 -0.00 0.00 0.00 178.44 178.16 3inj h ASP 123 N 0.61 0.71 0.10 -0.43 3.58 -1.59 -1.45 116.42 117.95 3inj h ASP 123 Ca 0.21 0.01 -0.10 0.00 0.42 0.00 0.00 57.03 57.57 3inj h ASP 123 Cb 0.02 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 3inj h ASP 123 CO -0.09 0.48 -0.32 0.24 -2.88 0.00 0.00 179.24 176.66 3inj h MET 124 N 0.85 0.34 -0.13 0.28 2.86 -0.42 -0.93 114.93 117.77 3inj h MET 124 Ca 0.30 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 3inj h MET 124 Cb 0.07 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 3inj h MET 124 CO -0.13 0.63 0.05 0.28 1.06 0.00 0.00 176.91 178.80 3inj h VAL 125 N 0.29 1.16 -0.83 -2.22 2.07 -0.51 0.77 116.25 116.99 3inj h VAL 125 Ca 0.04 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 3inj h VAL 125 Cb 0.72 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.69 3inj h VAL 125 CO 0.05 0.15 0.44 -0.07 0.02 0.00 0.00 177.57 178.16 3inj h LEU 126 N 0.05 1.06 -0.32 2.57 3.38 -1.08 -1.51 115.31 119.46 3inj h LEU 126 Ca 0.04 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 3inj h LEU 126 Cb 0.19 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3inj h LEU 126 CO -0.00 0.87 -0.24 0.11 0.09 0.00 0.00 178.44 179.27 3inj h LYS 127 N 1.17 0.72 -0.10 1.13 1.57 -0.99 -1.31 116.57 118.77 3inj h LYS 127 Ca 0.29 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3inj h LYS 127 Cb 0.06 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 3inj h LYS 127 CO -0.04 0.97 0.06 0.00 -0.57 0.00 0.00 179.45 179.86 3inj h LEU 129 N 0.12 0.58 -0.96 0.00 3.38 -1.24 -1.74 115.31 115.45 3inj h LEU 129 Ca 0.03 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 3inj h LEU 129 Cb -0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3inj h LEU 129 CO -0.01 0.62 -0.38 0.03 0.09 0.00 0.00 178.44 178.80 3inj h ARG 130 N 0.50 0.28 0.60 1.13 3.08 -1.20 -0.55 114.38 118.22 3inj h ARG 130 Ca 0.13 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 3inj h ARG 130 Cb 0.24 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.29 3inj h ARG 130 CO -0.01 0.62 -0.29 -0.92 -1.07 0.00 0.00 179.97 178.31 3inj h TYR 131 N 0.24 -0.74 0.00 3.04 3.20 -0.89 -3.10 116.97 118.72 3inj h TYR 131 Ca 0.03 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 3inj h TYR 131 Cb 0.78 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 3inj h TYR 131 CO 0.02 -0.45 -0.31 1.88 -1.64 0.00 0.00 178.16 177.66 3inj h TYR 132 N -0.83 0.00 -0.84 -3.82 -1.99 -1.20 -1.75 116.97 106.54 3inj h TYR 132 Ca -0.08 0.00 0.19 0.00 2.00 0.00 0.00 58.73 60.84 3inj h TYR 132 Cb 0.62 0.00 -0.12 0.00 2.00 0.00 0.00 36.73 39.24 3inj h TYR 132 CO -0.03 0.31 0.31 0.00 -0.00 0.00 0.00 178.16 178.75 3inj h ALA 133 N 1.69 1.24 0.00 3.88 0.00 -1.03 -0.93 119.26 124.11 3inj h ALA 133 Ca -0.00 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3inj h ALA 133 Cb 0.55 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3inj h ALA 133 CO 0.04 -0.32 -0.20 0.78 0.00 0.00 0.00 179.25 179.55 3inj h GLY 134 N 0.37 0.00 2.00 0.00 0.00 -1.25 -2.98 103.07 101.21 3inj h GLY 134 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.83 3inj h GLY 134 CO -0.51 0.00 0.00 1.49 0.00 0.00 0.00 176.54 177.52 3inj h TRP 135 N 0.00 0.00 -0.91 5.60 -0.00 -1.18 -3.38 115.95 116.07 3inj h TRP 135 Ca -0.00 0.00 0.13 0.00 -0.00 0.00 0.00 58.89 59.02 3inj h TRP 135 Cb 0.47 0.00 -0.09 0.00 -0.00 0.00 0.00 29.16 29.54 3inj h TRP 135 CO 0.00 0.00 0.53 0.00 -0.00 0.00 0.00 178.44 178.97 3inj h ALA 136 N 2.31 1.37 -0.40 1.49 0.00 -1.47 -1.75 119.26 120.81 3inj h ALA 136 Ca 0.00 0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.74 3inj h ALA 136 Cb 0.69 -0.12 -0.13 0.00 0.00 0.00 0.00 17.79 18.23 3inj h ALA 136 CO 0.00 0.07 -0.08 -0.40 0.00 0.00 0.00 179.25 178.85 3inj n ASP 137 N -4.74 2.70 0.00 0.00 3.85 -1.26 -4.61 116.55 112.49 3inj n ASP 137 Ca 0.17 -3.80 0.00 0.00 -0.71 0.00 0.00 54.79 50.46 3inj n ASP 137 Cb 0.38 -0.64 0.00 0.00 -1.35 0.00 0.00 41.12 39.51 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 -1.11 0.12 -2.52 0.11 5.02 -0.66 -4.92 118.16 114.20 3inj n LYS 138 Ca 0.35 -0.13 -0.43 0.00 -2.02 0.00 0.00 58.31 56.09 3inj n LYS 138 Cb 1.04 -0.57 0.00 0.00 -0.02 0.00 0.00 35.03 35.49 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 -0.05 3.30 -1.74 2.13 9.36 -1.22 -5.00 117.16 123.93 3inj n TYR 139 Ca 0.00 -2.90 -0.38 0.00 3.32 0.00 0.00 57.90 57.95 3inj n TYR 139 Cb 0.14 -1.93 0.06 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 0.32 2.16 0.00 2.98 3.76 -1.26 -4.85 115.29 118.40 3inj s HIS 140 Ca 0.39 1.42 0.00 0.00 -0.15 0.00 0.00 55.06 56.72 3inj s HIS 140 Cb 0.07 -3.77 0.00 0.00 1.11 0.00 0.00 32.58 29.98 3inj s HIS 140 CO 0.01 -2.98 0.00 0.41 -0.85 0.00 0.00 174.74 171.33 3inj n GLY 141 N 0.82 -0.12 3.35 -2.22 0.00 -1.26 -4.91 105.19 100.86 3inj n GLY 141 Ca 0.13 -1.81 -0.26 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.23 1.31 -0.16 1.61 1.02 -1.21 -4.93 119.74 115.14 3inj s LYS 142 Ca 0.00 -1.33 -0.07 0.00 0.02 0.00 0.00 55.97 54.59 3inj s LYS 142 Cb 0.00 -1.64 -0.04 0.00 -0.52 0.00 0.00 37.83 35.63 3inj s LYS 142 CO 0.00 0.37 0.08 0.95 -0.92 0.00 0.00 175.35 175.84 3inj s THR 143 N -1.34 5.00 -0.12 2.17 -4.23 -1.26 -0.51 115.64 115.34 3inj s THR 143 Ca 0.13 0.03 0.03 0.00 -1.18 0.00 0.00 61.69 60.70 3inj s THR 143 Cb -0.09 -3.23 0.01 0.00 1.34 0.00 0.00 72.50 70.53 3inj s THR 143 CO 0.06 0.50 -0.20 -0.63 -0.54 0.00 0.00 174.62 173.81 3inj s ILE 144 N -0.02 1.89 -0.94 2.99 1.01 0.18 -5.00 121.20 121.31 3inj s ILE 144 Ca 0.07 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 59.78 3inj s ILE 144 Cb -0.12 -1.68 -0.05 0.00 0.01 0.00 0.00 42.46 40.62 3inj s ILE 144 CO 0.01 0.52 2.14 -2.65 0.00 0.00 0.00 174.94 174.96 3inj n PRO 145 N 4.00 2.15 -2.21 2.79 -0.02 -1.26 -4.15 135.00 136.30 3inj n PRO 145 Ca -0.20 -1.48 -0.34 0.00 -2.02 0.00 0.00 63.50 59.46 3inj n PRO 145 Cb 0.52 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 3inj n PRO 145 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3inj s ILE 146 N 3.36 3.45 0.57 4.25 -1.16 -1.26 -4.99 121.20 125.42 3inj s ILE 146 Ca 0.41 0.82 -0.21 0.00 -0.51 0.00 0.00 60.65 61.16 3inj s ILE 146 Cb 0.10 -3.31 -0.04 0.00 0.61 0.00 0.00 42.46 39.82 3inj s ILE 146 CO -0.03 -0.27 1.36 -1.81 -2.81 0.00 0.00 174.94 171.37 3inj s ASP 147 N -2.14 5.05 0.00 4.50 1.01 -1.26 -4.79 116.67 119.05 3inj s ASP 147 Ca 0.69 2.76 0.00 0.00 0.71 0.00 0.00 52.55 56.71 3inj s ASP 147 Cb -0.20 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.10 3inj s ASP 147 CO 0.29 -1.72 0.00 0.61 0.21 0.00 0.00 175.17 174.57 3inj n GLY 148 N 0.78 -3.57 2.84 0.21 0.00 -1.26 -4.59 105.19 99.61 3inj n GLY 148 Ca 0.12 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.14 5.06 -4.05 1.61 8.00 -1.26 -4.72 116.55 121.04 3inj n ASP 149 Ca 0.00 -3.10 -0.12 0.00 0.71 0.00 0.00 54.79 52.28 3inj n ASP 149 Cb 0.00 -1.49 -0.11 0.00 -0.02 0.00 0.00 41.12 39.50 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 0.51 0.60 -0.26 1.24 0.40 -1.26 -2.00 117.98 117.20 3inj s PHE 150 Ca 0.40 -0.53 -0.08 0.00 -0.60 0.00 0.00 56.93 56.12 3inj s PHE 150 Cb 0.10 -0.36 -0.03 0.00 0.51 0.00 0.00 43.02 43.24 3inj s PHE 150 CO -0.00 -0.11 0.10 0.12 0.70 0.00 0.00 175.22 176.02 3inj s PHE 151 N -1.54 3.12 -0.05 0.36 5.36 0.21 -4.81 117.98 120.63 3inj s PHE 151 Ca -0.10 -0.41 0.05 0.00 -0.96 0.00 0.00 56.93 55.51 3inj s PHE 151 Cb -0.09 -2.27 -0.01 0.00 -0.34 0.00 0.00 43.02 40.31 3inj s PHE 151 CO -0.00 -0.36 -0.19 0.45 -1.46 0.00 0.00 175.22 173.65 3inj s SER 152 N 1.63 2.40 0.15 6.13 0.15 -1.26 0.36 113.70 123.25 3inj s SER 152 Ca 0.06 -0.40 -0.11 0.00 0.70 0.00 0.00 55.95 56.20 3inj s SER 152 Cb -0.16 -0.66 0.00 0.00 -1.71 0.00 0.00 66.02 63.50 3inj s SER 152 CO 0.05 0.18 0.32 -0.72 1.20 0.00 0.00 173.24 174.26 3inj s TYR 153 N -0.02 0.19 -0.07 3.44 -0.85 -0.11 -0.64 117.35 119.29 3inj s TYR 153 Ca -0.04 -0.56 0.04 0.00 -0.52 0.00 0.00 57.07 56.00 3inj s TYR 153 Cb -0.12 0.05 -0.02 0.00 0.38 0.00 0.00 41.96 42.26 3inj s TYR 153 CO 0.03 -0.71 -0.20 0.95 -1.52 0.00 0.00 175.55 174.10 3inj s THR 154 N -3.91 2.53 -0.11 -3.49 -4.23 0.33 -0.35 115.64 106.41 3inj s THR 154 Ca 0.12 -0.89 -0.13 0.00 -1.18 0.00 0.00 61.69 59.60 3inj s THR 154 Cb 0.03 -1.97 -0.05 0.00 1.34 0.00 0.00 72.50 71.85 3inj s THR 154 CO -0.04 0.57 0.30 -0.13 -0.54 0.00 0.00 174.62 174.77 3inj s ARG 155 N -0.23 4.03 -0.67 3.99 0.52 0.71 -3.30 118.95 124.00 3inj s ARG 155 Ca -0.01 0.14 -0.18 0.00 -0.52 0.00 0.00 55.73 55.17 3inj s ARG 155 Cb -0.13 -3.33 0.13 0.00 0.52 0.00 0.00 34.95 32.14 3inj s ARG 155 CO 0.03 0.45 0.74 -1.01 0.02 0.00 0.00 175.30 175.53 3inj s HIS 156 N -0.18 3.18 0.31 -0.53 3.76 -1.26 -1.51 115.29 119.05 3inj s HIS 156 Ca 0.18 -1.24 0.03 0.00 -0.15 0.00 0.00 55.06 53.88 3inj s HIS 156 Cb -0.14 -3.98 -0.03 0.00 1.11 0.00 0.00 32.58 29.54 3inj s HIS 156 CO 0.06 -1.23 0.47 -1.21 -0.85 0.00 0.00 174.74 171.99 3inj s GLU 157 N 2.10 3.43 0.43 1.40 2.02 -0.22 -4.89 118.70 122.96 3inj s GLU 157 Ca 0.14 -0.56 -0.25 0.00 0.02 0.00 0.00 54.97 54.32 3inj s GLU 157 Cb -0.20 -2.76 -0.08 0.00 0.10 0.00 0.00 34.13 31.19 3inj s GLU 157 CO 0.01 0.24 1.28 -2.14 0.02 0.00 0.00 175.26 174.68 3inj s PRO 158 N -4.18 3.85 0.33 0.39 0.02 -1.26 0.51 135.00 134.66 3inj s PRO 158 Ca 0.38 2.09 0.02 0.00 0.02 0.00 0.00 61.00 63.51 3inj s PRO 158 Cb -0.09 -2.65 0.58 0.00 0.02 0.00 0.00 34.50 32.36 3inj s PRO 158 CO 0.33 -0.57 1.92 -0.24 -0.33 0.00 0.00 177.00 178.11 3inj h VAL 159 N 2.26 1.19 0.00 3.83 3.04 -1.74 -3.39 116.25 121.44 3inj h VAL 159 Ca -0.50 -0.59 0.00 0.00 -1.01 0.00 0.00 66.70 64.60 3inj h VAL 159 Cb 1.25 0.62 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 3inj h VAL 159 CO 0.62 0.23 0.00 0.61 -1.01 0.00 0.00 177.57 178.02 3inj n GLY 160 N -1.09 0.38 3.61 3.17 0.00 -1.26 -4.89 105.19 105.11 3inj n GLY 160 Ca 0.04 -1.06 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 3inj n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3inj s VAL 161 N 0.00 4.59 -0.23 1.61 1.01 -1.26 -1.83 120.40 124.29 3inj s VAL 161 Ca 0.00 1.24 -0.06 0.00 0.00 0.00 0.00 61.98 63.16 3inj s VAL 161 Cb 0.00 -4.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 3inj s VAL 161 CO 0.00 -0.52 0.02 0.00 0.00 0.00 0.00 175.10 174.60 3inj s GLY 163 N 1.48 2.13 -0.16 0.00 0.00 0.62 -1.00 107.32 110.39 3inj s GLY 163 Ca 0.06 -0.28 0.01 0.00 0.00 0.00 0.00 44.72 44.50 3inj s GLY 163 CO 0.01 1.17 -0.17 1.20 0.00 0.00 0.00 173.10 175.31 3inj s GLN 164 N 1.60 2.64 -0.26 2.90 -0.21 -0.50 -0.75 119.66 125.08 3inj s GLN 164 Ca 0.27 -0.69 -0.04 0.00 0.02 0.00 0.00 55.36 54.92 3inj s GLN 164 Cb -0.16 -2.33 0.01 0.00 1.00 0.00 0.00 33.01 31.53 3inj s GLN 164 CO 0.11 -0.22 -0.00 0.42 -2.12 0.00 0.00 175.29 173.47 3inj s ILE 165 N 1.39 3.43 0.17 1.08 1.01 -0.18 -0.17 121.20 127.94 3inj s ILE 165 Ca 0.05 -0.73 0.11 0.00 0.00 0.00 0.00 60.65 60.08 3inj s ILE 165 Cb -0.13 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 3inj s ILE 165 CO -0.12 0.23 -0.24 0.27 0.00 0.00 0.00 174.94 175.08 3inj s ILE 166 N 1.44 2.26 0.54 2.92 -4.36 -0.87 -1.78 121.20 121.35 3inj s ILE 166 Ca 0.03 -1.95 -0.01 0.00 -0.26 0.00 0.00 60.65 58.46 3inj s ILE 166 Cb -0.16 -2.05 0.11 0.00 1.25 0.00 0.00 42.46 41.61 3inj s ILE 166 CO -0.02 -0.09 0.74 -0.81 0.24 0.00 0.00 174.94 175.00 3inj n PRO 167 N 0.43 0.01 -0.00 0.37 -0.05 -1.25 -3.27 135.00 131.24 3inj n PRO 167 Ca -0.14 -1.91 0.09 0.00 -0.05 0.00 0.00 63.50 61.49 3inj n PRO 167 Cb 0.55 -0.52 -0.12 0.00 -0.05 0.00 0.00 33.50 33.37 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 -2.51 0.00 -0.07 0.54 4.27 -1.26 -4.31 117.44 114.10 3inj n TRP 168 Ca 0.12 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.61 3inj n TRP 168 Cb 0.42 -0.08 0.01 0.00 -1.36 0.00 0.00 31.31 30.31 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 0.86 -2.35 -0.67 -1.07 -1.96 -3.34 115.58 107.04 3inj h ASN 169 Ca 0.00 -0.42 -0.59 0.00 0.07 0.00 0.00 56.30 55.37 3inj h ASN 169 Cb 0.54 -0.24 -0.40 0.00 -2.07 0.00 0.00 38.32 36.15 3inj h ASN 169 CO 0.00 1.18 -0.87 0.49 0.07 0.00 0.00 177.43 178.30 3inj n PHE 170 N -4.03 0.90 0.23 4.14 3.01 -1.26 -5.02 117.46 115.42 3inj n PHE 170 Ca -0.03 -3.74 -0.15 0.00 1.01 0.00 0.00 57.45 54.55 3inj n PHE 170 Cb 0.57 -0.25 -0.07 0.00 -0.01 0.00 0.00 39.48 39.71 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 4.80 -0.64 -0.43 -1.08 0.11 -1.75 0.76 132.00 133.78 3inj h PRO 171 Ca 0.17 0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.24 3inj h PRO 171 Cb 0.82 0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 3inj h PRO 171 CO 0.55 -0.42 -0.07 -0.07 -0.21 0.00 0.00 178.00 177.78 3inj h LEU 172 N -0.66 0.80 -0.35 2.35 3.38 -1.94 -2.59 115.31 116.30 3inj h LEU 172 Ca -0.03 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 3inj h LEU 172 Cb 0.58 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3inj h LEU 172 CO -0.01 0.96 0.07 0.25 0.09 0.00 0.00 178.44 179.79 3inj h LEU 173 N 0.63 0.54 -1.15 1.67 5.85 -1.83 -2.01 115.31 119.01 3inj h LEU 173 Ca 0.11 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.53 3inj h LEU 173 Cb 0.59 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 3inj h LEU 173 CO 0.04 0.65 0.02 0.24 -0.34 0.00 0.00 178.44 179.05 3inj h MET 174 N 0.41 0.61 -0.51 1.25 2.86 -0.87 -0.46 114.93 118.23 3inj h MET 174 Ca 0.11 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3inj h MET 174 Cb 0.34 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 3inj h MET 174 CO 0.00 0.62 0.33 0.37 1.06 0.00 0.00 176.91 179.29 3inj h GLN 175 N 0.59 0.68 -0.44 1.72 4.15 -1.26 -2.69 115.11 117.86 3inj h GLN 175 Ca 0.13 -0.05 -0.13 0.00 0.77 0.00 0.00 58.65 59.37 3inj h GLN 175 Cb 0.34 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 3inj h GLN 175 CO 0.01 0.46 -0.23 0.00 -1.93 0.00 0.00 178.83 177.14 3inj h ALA 176 N 1.17 0.62 -0.09 3.38 0.00 -0.72 0.07 119.26 123.70 3inj h ALA 176 Ca 0.18 -0.39 0.03 0.00 0.00 0.00 0.00 54.91 54.73 3inj h ALA 176 Cb -0.06 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3inj h ALA 176 CO -0.04 0.62 0.07 -1.49 0.00 0.00 0.00 179.25 178.41 3inj h TRP 177 N 0.77 0.00 0.09 0.00 4.06 -1.04 -0.74 115.95 119.09 3inj h TRP 177 Ca 0.10 0.00 -0.32 0.00 2.06 0.00 0.00 58.89 60.73 3inj h TRP 177 Cb 0.80 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.94 3inj h TRP 177 CO 0.06 0.00 -1.71 0.87 -3.56 0.00 0.00 178.44 174.09 3inj h LYS 178 N 0.00 0.18 -0.26 0.49 1.79 -1.17 -3.39 116.57 114.21 3inj h LYS 178 Ca 0.04 -0.31 -0.12 0.00 -2.18 0.00 0.00 60.65 58.08 3inj h LYS 178 Cb 0.18 0.12 -0.00 0.00 -1.58 0.00 0.00 32.23 30.95 3inj h LYS 178 CO -0.00 1.15 -0.31 -0.07 -1.08 0.00 0.00 179.45 179.14 3inj h LEU 179 N -0.30 0.72 -0.22 2.94 3.38 -0.85 -3.09 115.31 117.89 3inj h LEU 179 Ca -0.39 -0.49 0.03 0.00 0.09 0.00 0.00 57.88 57.12 3inj h LEU 179 Cb 1.78 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 42.26 3inj h LEU 179 CO -0.01 1.06 -0.51 1.23 0.09 0.00 0.00 178.44 180.30 3inj h GLY 180 N 0.39 -1.11 1.19 0.83 0.00 -1.35 0.04 103.07 103.05 3inj h GLY 180 Ca 0.04 0.70 -0.14 0.00 0.00 0.00 0.00 47.33 47.92 3inj h GLY 180 CO 0.07 -0.20 -0.31 -2.55 0.00 0.00 0.00 176.54 173.55 3inj h PRO 181 N -0.48 0.91 -0.04 4.80 0.11 -1.76 -1.41 132.00 134.13 3inj h PRO 181 Ca 0.04 -0.43 -0.00 0.00 0.11 0.00 0.00 66.00 65.72 3inj h PRO 181 Cb 0.61 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.71 3inj h PRO 181 CO -0.46 1.09 0.01 0.00 -0.21 0.00 0.00 178.00 178.43 3inj h ALA 182 N 0.87 0.05 -0.01 -0.75 0.00 -1.42 -2.72 119.26 115.28 3inj h ALA 182 Ca 0.08 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 3inj h ALA 182 Cb 0.89 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3inj h ALA 182 CO 0.08 -0.36 -0.76 -0.07 0.00 0.00 0.00 179.25 178.14 3inj h LEU 183 N -0.11 0.14 -1.43 0.00 3.38 -1.00 -2.14 115.31 114.15 3inj h LEU 183 Ca 0.01 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3inj h LEU 183 Cb 0.17 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3inj h LEU 183 CO -0.00 0.85 0.38 0.00 0.09 0.00 0.00 178.44 179.76 3inj h ALA 184 N 1.15 1.58 -0.34 1.53 0.00 -1.18 -2.41 119.26 119.60 3inj h ALA 184 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3inj h ALA 184 Cb 1.34 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3inj h ALA 184 CO 0.11 0.38 0.00 0.25 0.00 0.00 0.00 179.25 179.99 3inj n THR 185 N -4.45 0.44 -0.87 0.00 -2.24 -1.03 -4.41 114.28 101.72 3inj n THR 185 Ca 0.06 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 3inj n THR 185 Cb 0.05 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 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 1.30 0.48 3.90 3.38 0.00 -0.91 -4.13 105.19 109.22 3inj n GLY 186 Ca 0.17 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.73 2.66 0.09 1.61 0.01 -0.82 -4.82 114.94 110.95 3inj s ASN 187 Ca 0.00 0.21 0.06 0.00 -0.71 0.00 0.00 52.86 52.42 3inj s ASN 187 Cb 0.00 -0.19 -0.03 0.00 0.41 0.00 0.00 41.25 41.44 3inj s ASN 187 CO 0.00 -3.01 -0.15 0.68 -1.51 0.00 0.00 177.10 173.11 3inj s VAL 188 N -3.86 1.24 -0.03 1.60 -7.23 -0.76 -4.68 120.40 106.68 3inj s VAL 188 Ca 0.76 -1.49 0.04 0.00 -1.81 0.00 0.00 61.98 59.48 3inj s VAL 188 Cb -0.03 -1.29 -0.00 0.00 0.56 0.00 0.00 36.38 35.62 3inj s VAL 188 CO 0.54 -0.29 -0.16 -0.69 -0.31 0.00 0.00 175.10 174.19 3inj s VAL 189 N -1.61 1.30 -0.28 1.32 1.01 0.77 -0.44 120.40 122.47 3inj s VAL 189 Ca 0.03 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.38 3inj s VAL 189 Cb -0.08 -1.11 0.07 0.00 0.00 0.00 0.00 36.38 35.26 3inj s VAL 189 CO 0.03 0.38 -0.05 -0.69 0.00 0.00 0.00 175.10 174.76 3inj s VAL 190 N -0.04 2.10 -0.14 2.92 1.01 -0.17 -0.62 120.40 125.46 3inj s VAL 190 Ca -0.01 -1.81 -0.03 0.00 0.00 0.00 0.00 61.98 60.13 3inj s VAL 190 Cb -0.10 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 3inj s VAL 190 CO 0.01 -0.23 -0.03 -0.32 0.00 0.00 0.00 175.10 174.53 3inj s MET 191 N 1.08 3.50 -0.35 2.72 1.75 0.70 -1.41 119.30 127.29 3inj s MET 191 Ca -0.02 -0.49 -0.09 0.00 -1.25 0.00 0.00 55.69 53.84 3inj s MET 191 Cb -0.19 -2.89 0.03 0.00 2.84 0.00 0.00 34.83 34.61 3inj s MET 191 CO -0.07 0.36 0.16 0.21 -0.65 0.00 0.00 175.02 175.03 3inj s LYS 192 N 0.04 2.83 0.51 4.11 2.36 0.76 -0.98 119.74 129.38 3inj s LYS 192 Ca 0.01 -1.06 -0.02 0.00 -2.55 0.00 0.00 55.97 52.35 3inj s LYS 192 Cb -0.13 -3.60 0.00 0.00 -1.05 0.00 0.00 37.83 33.05 3inj s LYS 192 CO 0.02 -0.64 0.77 0.14 1.55 0.00 0.00 175.35 177.19 3inj s VAL 193 N 1.51 3.84 0.23 4.02 -7.23 -1.25 -2.04 120.40 119.48 3inj s VAL 193 Ca 0.01 -0.29 -0.30 0.00 -1.81 0.00 0.00 61.98 59.60 3inj s VAL 193 Cb -0.19 -3.46 -0.09 0.00 0.56 0.00 0.00 36.38 33.20 3inj s VAL 193 CO 0.05 -0.39 1.04 0.00 -0.31 0.00 0.00 175.10 175.49 3inj s ALA 194 N -2.74 3.37 0.30 1.32 0.00 -1.20 -4.39 121.76 118.42 3inj s ALA 194 Ca 0.51 0.77 0.30 0.00 0.00 0.00 0.00 51.96 53.54 3inj s ALA 194 Cb -0.10 -3.29 1.43 0.00 0.00 0.00 0.00 23.12 21.16 3inj s ALA 194 CO 0.41 -0.04 2.03 1.05 0.00 0.00 0.00 175.76 179.21 3inj h GLU 195 N 4.31 0.00 0.00 0.00 9.09 -1.93 -1.49 114.58 124.57 3inj h GLU 195 Ca -0.45 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 58.85 3inj h GLU 195 Cb 1.21 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.29 3inj h GLU 195 CO 0.69 0.10 -0.49 1.96 0.05 0.00 0.00 179.01 181.32 3inj h GLN 196 N 0.00 0.00 -1.47 1.06 7.50 -1.93 -3.40 115.11 116.87 3inj h GLN 196 Ca -0.00 0.00 -0.43 0.00 0.50 0.00 0.00 58.65 58.72 3inj h GLN 196 Cb 0.43 0.00 -0.33 0.00 0.05 0.00 0.00 27.48 27.63 3inj h GLN 196 CO 0.01 0.49 -0.98 0.25 -1.50 0.00 0.00 178.83 177.10 3inj n THR 197 N -3.59 -0.25 0.10 -0.54 -2.24 -0.62 -4.69 114.28 102.46 3inj n THR 197 Ca -0.00 -3.64 0.04 0.00 -2.27 0.00 0.00 64.05 58.18 3inj n THR 197 Cb 0.58 -0.18 -0.00 0.00 -2.10 0.00 0.00 70.33 68.62 3inj n THR 197 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3inj h PRO 198 N 3.31 0.00 -0.30 -0.78 0.14 -1.62 -3.40 132.00 129.35 3inj h PRO 198 Ca 0.04 0.00 -0.05 0.00 0.14 0.00 0.00 66.00 66.13 3inj h PRO 198 Cb 0.98 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.11 3inj h PRO 198 CO 0.41 0.30 0.01 -0.07 0.14 0.00 0.00 178.00 178.79 3inj h LEU 199 N 0.00 0.51 -0.71 1.56 3.38 -1.91 -2.85 115.31 115.29 3inj h LEU 199 Ca -0.06 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.52 3inj h LEU 199 Cb 1.36 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 3inj h LEU 199 CO 0.04 0.69 0.03 0.71 0.09 0.00 0.00 178.44 180.00 3inj h THR 200 N 0.33 1.26 -0.85 0.22 1.35 -1.90 -2.08 112.91 111.24 3inj h THR 200 Ca 0.09 -1.09 0.02 0.00 -0.55 0.00 0.00 66.41 64.87 3inj h THR 200 Cb 0.42 0.77 -0.05 0.00 -1.73 0.00 0.00 68.15 67.56 3inj h THR 200 CO 0.01 0.40 0.56 0.00 -0.25 0.00 0.00 175.52 176.24 3inj h ALA 201 N 1.08 1.10 -0.50 6.62 0.00 -1.82 -1.52 119.26 124.22 3inj h ALA 201 Ca 0.18 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3inj h ALA 201 Cb 0.51 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3inj h ALA 201 CO 0.02 0.44 -0.01 -0.07 0.00 0.00 0.00 179.25 179.64 3inj h LEU 202 N 1.12 0.86 -0.97 0.00 3.38 -1.23 -1.25 115.31 117.22 3inj h LEU 202 Ca 0.33 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 3inj h LEU 202 Cb -0.07 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 3inj h LEU 202 CO -0.09 0.96 0.18 0.22 0.09 0.00 0.00 178.44 179.80 3inj h TYR 203 N 0.74 0.95 -0.59 1.13 3.20 -1.05 -2.14 116.97 119.21 3inj h TYR 203 Ca 0.14 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 3inj h TYR 203 Cb 0.52 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 3inj h TYR 203 CO 0.04 0.77 0.22 0.28 -1.64 0.00 0.00 178.16 177.83 3inj h VAL 204 N 0.90 1.22 -0.77 1.81 2.07 -0.86 -0.58 116.25 120.02 3inj h VAL 204 Ca 0.20 -0.69 0.17 0.00 0.82 0.00 0.00 66.70 67.20 3inj h VAL 204 Cb 0.27 0.52 -0.11 0.00 -1.52 0.00 0.00 31.29 30.45 3inj h VAL 204 CO -0.01 0.27 0.23 0.00 0.02 0.00 0.00 177.57 178.08 3inj h ALA 205 N 1.39 1.06 -0.92 1.67 0.00 -0.57 0.26 119.26 122.16 3inj h ALA 205 Ca 0.20 0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.32 3inj h ALA 205 Cb 0.19 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 3inj h ALA 205 CO -0.02 -0.33 0.60 -0.97 0.00 0.00 0.00 179.25 178.53 3inj h ASN 206 N 0.31 0.97 0.42 0.00 -1.24 -0.88 -1.59 115.58 113.57 3inj h ASN 206 Ca 0.45 -0.00 -0.16 0.00 0.71 0.00 0.00 56.30 57.29 3inj h ASN 206 Cb 0.78 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 39.60 3inj h ASN 206 CO -0.51 0.65 -0.67 -0.07 -1.29 0.00 0.00 177.43 175.54 3inj h LEU 207 N 1.11 0.26 -0.70 0.34 3.38 -0.55 -1.20 115.31 117.95 3inj h LEU 207 Ca 0.37 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 58.21 3inj h LEU 207 Cb 0.08 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 3inj h LEU 207 CO -0.12 0.85 0.45 0.40 0.09 0.00 0.00 178.44 180.10 3inj h ILE 208 N 0.15 1.13 -0.09 1.22 2.04 0.31 0.25 117.51 122.53 3inj h ILE 208 Ca -0.01 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.54 3inj h ILE 208 Cb 1.20 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3inj h ILE 208 CO 0.10 0.16 0.04 0.50 0.00 0.00 0.00 178.15 178.95 3inj h LYS 209 N 0.89 0.13 -0.52 2.37 3.64 -1.17 -2.89 116.57 119.02 3inj h LYS 209 Ca 0.27 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.65 3inj h LYS 209 Cb -0.03 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 3inj h LYS 209 CO -0.09 0.22 0.34 1.49 -2.27 0.00 0.00 179.45 179.15 3inj h GLU 210 N -0.00 0.61 0.00 1.90 4.81 -0.75 -1.74 114.58 119.40 3inj h GLU 210 Ca 0.03 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 3inj h GLU 210 Cb 0.14 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 3inj h GLU 210 CO -0.00 0.41 -0.19 0.00 -0.73 0.00 0.00 179.01 178.50 3inj h ALA 211 N 1.69 1.11 0.00 2.92 0.00 -0.36 -3.47 119.26 121.16 3inj h ALA 211 Ca 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3inj h ALA 211 Cb 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3inj h ALA 211 CO -0.05 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.84 3inj n GLY 212 N -0.18 1.21 3.75 0.00 0.00 -0.66 -4.91 105.19 104.41 3inj n GLY 212 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 2.93 0.73 1.61 0.40 -1.14 -4.96 117.98 115.55 3inj s PHE 213 Ca 0.00 0.97 -0.16 0.00 -0.60 0.00 0.00 56.93 57.14 3inj s PHE 213 Cb 0.00 -3.90 0.03 0.00 0.51 0.00 0.00 43.02 39.66 3inj s PHE 213 CO 0.00 -2.93 1.19 -2.30 0.70 0.00 0.00 175.22 171.88 3inj n PRO 214 N 2.19 0.61 -1.84 0.24 -0.02 -1.26 -4.81 135.00 130.11 3inj n PRO 214 Ca 0.07 0.27 -0.41 0.00 -2.02 0.00 0.00 63.50 61.41 3inj n PRO 214 Cb 0.39 -2.43 -0.01 0.00 -0.02 0.00 0.00 33.50 31.44 3inj n PRO 214 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3inj s PRO 215 N -3.66 4.14 0.00 0.52 0.02 -1.26 -2.70 135.00 132.06 3inj s PRO 215 Ca 0.77 2.53 0.00 0.00 0.02 0.00 0.00 61.00 64.32 3inj s PRO 215 Cb -0.34 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.18 3inj s PRO 215 CO 0.47 -0.53 0.00 0.41 -0.33 0.00 0.00 177.00 177.02 3inj n GLY 216 N 1.16 1.78 0.26 0.52 0.00 -1.26 -4.66 105.19 102.99 3inj n GLY 216 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.33 1.61 2.07 -1.81 -3.29 116.25 112.78 3inj h VAL 217 Ca 0.00 -1.45 -0.51 0.00 0.82 0.00 0.00 66.70 65.56 3inj h VAL 217 Cb 0.00 1.33 -0.35 0.00 -1.52 0.00 0.00 31.29 30.75 3inj h VAL 217 CO 0.00 0.48 -0.81 -0.69 0.02 0.00 0.00 177.57 176.57 3inj s VAL 218 N -4.47 1.04 -0.03 2.57 1.01 -1.26 -0.16 120.40 119.09 3inj s VAL 218 Ca -0.09 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.54 3inj s VAL 218 Cb 0.12 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.51 3inj s VAL 218 CO 0.85 0.35 -0.11 0.20 0.00 0.00 0.00 175.10 176.38 3inj s ASN 219 N 1.08 1.48 -0.10 3.32 0.01 0.21 -4.67 114.94 116.27 3inj s ASN 219 Ca -0.07 -0.23 0.02 0.00 -0.71 0.00 0.00 52.86 51.86 3inj s ASN 219 Cb -0.14 -0.41 0.01 0.00 0.41 0.00 0.00 41.25 41.12 3inj s ASN 219 CO -0.01 0.09 -0.15 -0.63 -1.51 0.00 0.00 177.10 174.89 3inj s ILE 220 N 0.18 1.45 -0.34 0.60 1.01 0.18 -0.21 121.20 124.07 3inj s ILE 220 Ca -0.04 -0.62 0.04 0.00 0.00 0.00 0.00 60.65 60.03 3inj s ILE 220 Cb -0.10 -1.33 0.10 0.00 0.01 0.00 0.00 42.46 41.14 3inj s ILE 220 CO 0.01 0.43 0.04 -0.69 0.00 0.00 0.00 174.94 174.73 3inj s VAL 221 N 0.97 2.33 0.39 2.92 1.01 -0.15 -0.66 120.40 127.21 3inj s VAL 221 Ca -0.07 -2.26 -0.25 0.00 0.00 0.00 0.00 61.98 59.40 3inj s VAL 221 Cb -0.15 -2.68 -0.09 0.00 0.00 0.00 0.00 36.38 33.47 3inj s VAL 221 CO -0.01 -0.54 1.14 -2.16 0.00 0.00 0.00 175.10 173.53 3inj s PRO 222 N 0.93 4.11 0.00 2.72 0.04 -1.26 -3.79 135.00 137.75 3inj s PRO 222 Ca 0.09 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.91 3inj s PRO 222 Cb -0.19 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.66 3inj s PRO 222 CO -0.07 -0.26 0.00 0.41 0.04 0.00 0.00 177.00 177.12 3inj n GLY 223 N 0.62 -0.90 4.00 0.56 0.00 -1.26 -0.46 105.19 107.74 3inj n GLY 223 Ca 0.04 -0.98 -0.19 0.00 0.00 0.00 0.00 46.02 44.89 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 2.22 -0.04 1.61 0.40 -1.26 -4.05 117.98 113.85 3inj s PHE 224 Ca 0.00 -0.55 -0.14 0.00 -0.60 0.00 0.00 56.93 55.64 3inj s PHE 224 Cb 0.00 -2.27 -0.08 0.00 0.51 0.00 0.00 43.02 41.18 3inj s PHE 224 CO 0.00 -0.67 0.57 0.78 0.70 0.00 0.00 175.22 176.60 3inj h GLY 225 N 0.51 -0.50 1.43 4.36 0.00 -1.96 -2.14 103.07 104.77 3inj h GLY 225 Ca -0.36 0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.15 3inj h GLY 225 CO 0.45 -0.18 0.00 -1.05 0.00 0.00 0.00 176.54 175.76 3inj n PRO 226 N -5.09 0.14 0.00 4.80 -0.02 -1.26 -0.83 135.00 132.74 3inj n PRO 226 Ca -0.06 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 3inj n PRO 226 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 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 -1.21 0.00 -0.15 3.45 -2.24 -1.24 -4.49 114.28 108.40 3inj n THR 227 Ca 0.04 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.74 3inj n THR 227 Cb 0.05 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 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 -0.57 0.58 0.43 6.98 0.00 -1.55 -0.58 119.26 124.55 3inj h ALA 228 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3inj h ALA 228 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3inj h ALA 228 CO 0.00 0.18 -0.20 0.78 0.00 0.00 0.00 179.25 180.00 3inj h GLY 229 N 0.58 -0.60 1.00 0.00 0.00 -0.96 -2.06 103.07 101.04 3inj h GLY 229 Ca 0.15 0.22 0.05 0.00 0.00 0.00 0.00 47.33 47.75 3inj h GLY 229 CO -0.01 -0.22 0.55 0.00 0.00 0.00 0.00 176.54 176.86 3inj h ALA 230 N -0.10 1.51 -0.69 3.60 0.00 -1.00 -1.66 119.26 120.92 3inj h ALA 230 Ca -0.06 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.86 3inj h ALA 230 Cb 0.48 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 3inj h ALA 230 CO 0.10 0.39 0.42 0.00 0.00 0.00 0.00 179.25 180.15 3inj h ALA 231 N 1.52 0.91 -0.31 0.00 0.00 -0.84 -0.07 119.26 120.47 3inj h ALA 231 Ca 0.34 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 3inj h ALA 231 Cb 0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3inj h ALA 231 CO -0.11 0.16 -0.02 0.82 0.00 0.00 0.00 179.25 180.10 3inj h ILE 232 N 0.80 1.26 -0.39 0.00 2.04 -0.81 -2.62 117.51 117.80 3inj h ILE 232 Ca 0.29 -1.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 3inj h ILE 232 Cb 0.07 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 3inj h ILE 232 CO -0.13 0.32 0.04 0.00 0.00 0.00 0.00 178.15 178.38 3inj h ALA 233 N 0.83 1.35 -0.05 1.87 0.00 -0.82 -2.78 119.26 119.65 3inj h ALA 233 Ca 0.09 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3inj h ALA 233 Cb 0.47 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3inj h ALA 233 CO 0.02 0.45 0.00 0.43 0.00 0.00 0.00 179.25 180.15 3inj n SER 234 N -4.29 2.25 -4.73 0.00 7.64 -0.08 -3.94 113.62 110.46 3inj n SER 234 Ca 0.02 -1.75 -0.41 0.00 1.01 0.00 0.00 58.87 57.74 3inj n SER 234 Cb 0.23 -0.02 -0.03 0.00 -1.01 0.00 0.00 64.21 63.38 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 -1.96 3.21 -0.48 1.43 5.04 -0.99 -4.79 115.29 116.75 3inj s HIS 235 Ca 0.34 1.13 0.26 0.00 -1.54 0.00 0.00 55.06 55.24 3inj s HIS 235 Cb 0.20 -3.66 0.94 0.00 0.04 0.00 0.00 32.58 30.10 3inj s HIS 235 CO 0.31 -2.14 1.76 0.93 -2.34 0.00 0.00 174.74 173.27 3inj h GLU 236 N 5.57 0.00 -0.16 2.88 4.39 -1.91 -3.08 114.58 122.28 3inj h GLU 236 Ca -0.44 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.26 3inj h GLU 236 Cb 1.21 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 3inj h GLU 236 CO 0.79 0.00 0.00 -3.47 -1.16 0.00 0.00 179.01 175.17 3inj n ASP 237 N -2.41 2.59 -4.64 1.42 2.03 -1.26 -4.86 116.55 109.41 3inj n ASP 237 Ca 0.03 -2.23 -0.40 0.00 0.52 0.00 0.00 54.79 52.72 3inj n ASP 237 Cb 0.32 -0.19 -0.07 0.00 -0.72 0.00 0.00 41.12 40.46 3inj n ASP 237 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3inj s VAL 238 N -1.40 5.07 0.09 5.18 1.01 -1.16 -4.80 120.40 124.39 3inj s VAL 238 Ca 0.17 0.98 -0.01 0.00 0.00 0.00 0.00 61.98 63.12 3inj s VAL 238 Cb 0.11 -3.86 -0.26 0.00 0.00 0.00 0.00 36.38 32.38 3inj s VAL 238 CO 0.07 0.13 1.19 0.44 0.00 0.00 0.00 175.10 176.93 3inj h ASP 239 N 7.67 0.28 -3.87 3.32 3.32 -1.53 -3.43 116.42 122.19 3inj h ASP 239 Ca -0.31 -0.30 -0.15 0.00 0.02 0.00 0.00 57.03 56.29 3inj h ASP 239 Cb 1.15 -0.09 -0.25 0.00 0.22 0.00 0.00 39.33 40.35 3inj h ASP 239 CO 0.74 1.23 -0.36 -0.75 -1.72 0.00 0.00 179.24 178.38 3inj s LYS 240 N -2.69 0.36 -0.08 3.56 2.36 -1.06 -1.55 119.74 120.64 3inj s LYS 240 Ca -0.02 0.40 0.03 0.00 -2.55 0.00 0.00 55.97 53.83 3inj s LYS 240 Cb 0.08 0.17 0.01 0.00 -1.05 0.00 0.00 37.83 37.04 3inj s LYS 240 CO 0.86 -0.04 -0.17 0.54 1.55 0.00 0.00 175.35 178.09 3inj s VAL 241 N 0.12 1.48 -0.13 4.02 0.11 0.27 -0.28 120.40 125.99 3inj s VAL 241 Ca -0.00 -0.68 0.01 0.00 -2.93 0.00 0.00 61.98 58.38 3inj s VAL 241 Cb -0.02 -1.32 -0.00 0.00 -1.53 0.00 0.00 36.38 33.51 3inj s VAL 241 CO 0.00 0.43 -0.18 0.00 -3.33 0.00 0.00 175.10 172.03 3inj s ALA 242 N 0.55 2.41 -0.05 1.54 0.00 0.07 -1.83 121.76 124.44 3inj s ALA 242 Ca -0.16 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 50.82 3inj s ALA 242 Cb -0.17 -1.09 0.01 0.00 0.00 0.00 0.00 23.12 21.88 3inj s ALA 242 CO 0.06 0.11 -0.12 0.12 0.00 0.00 0.00 175.76 175.92 3inj s PHE 243 N 0.60 1.36 -0.16 0.00 5.36 -0.86 -1.01 117.98 123.28 3inj s PHE 243 Ca -0.10 -0.45 0.02 0.00 -0.96 0.00 0.00 56.93 55.43 3inj s PHE 243 Cb -0.16 -0.99 0.01 0.00 -0.34 0.00 0.00 43.02 41.55 3inj s PHE 243 CO 0.03 -0.22 -0.21 0.99 -1.46 0.00 0.00 175.22 174.35 3inj s THR 244 N 0.49 2.07 -1.15 0.12 2.01 -0.73 -0.94 115.64 117.51 3inj s THR 244 Ca -0.11 -0.96 0.00 0.00 0.31 0.00 0.00 61.69 60.94 3inj s THR 244 Cb -0.14 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.53 3inj s THR 244 CO 0.03 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.11 3inj n GLY 245 N 4.33 -0.84 3.76 4.40 0.00 -0.68 -3.78 105.19 112.37 3inj n GLY 245 Ca -0.20 -0.79 -0.37 0.00 0.00 0.00 0.00 46.02 44.66 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 5.51 0.34 1.61 1.04 -1.26 -3.79 113.70 113.15 3inj s SER 246 Ca 0.00 2.46 0.08 0.00 0.48 0.00 0.00 55.95 58.97 3inj s SER 246 Cb 0.00 -2.61 0.79 0.00 0.10 0.00 0.00 66.02 64.31 3inj s SER 246 CO 0.00 -1.38 1.84 0.74 0.98 0.00 0.00 173.24 175.41 3inj h THR 247 N 1.33 0.79 -0.82 2.02 2.02 -1.90 -1.44 112.91 114.91 3inj h THR 247 Ca -0.50 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 66.44 3inj h THR 247 Cb 1.28 0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 3inj h THR 247 CO 0.57 0.13 0.54 -0.33 0.37 0.00 0.00 175.52 176.80 3inj h GLU 248 N 0.72 1.07 0.00 6.66 4.39 -1.95 -2.40 114.58 123.07 3inj h GLU 248 Ca 0.50 -0.06 -0.15 0.00 0.34 0.00 0.00 59.36 59.98 3inj h GLU 248 Cb 0.80 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 3inj h GLU 248 CO -0.26 0.71 -0.73 0.82 -1.16 0.00 0.00 179.01 178.39 3inj h ILE 249 N 1.10 1.35 -0.97 3.13 1.08 -1.72 -3.06 117.51 118.42 3inj h ILE 249 Ca 0.30 -2.67 0.11 0.00 -0.39 0.00 0.00 64.86 62.21 3inj h ILE 249 Cb -0.12 2.51 -0.08 0.00 -3.07 0.00 0.00 36.82 36.07 3inj h ILE 249 CO -0.07 0.72 0.62 1.23 -0.69 0.00 0.00 178.15 179.96 3inj h GLY 250 N 2.82 1.51 0.94 5.37 0.00 -0.82 -1.06 103.07 111.84 3inj h GLY 250 Ca -0.01 -0.41 0.01 0.00 0.00 0.00 0.00 47.33 46.92 3inj h GLY 250 CO 0.10 0.20 0.12 3.21 0.00 0.00 0.00 176.54 180.17 3inj h ARG 251 N 0.99 0.25 -0.77 4.80 3.08 -1.34 -1.71 114.38 119.69 3inj h ARG 251 Ca 0.46 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.51 3inj h ARG 251 Cb 0.42 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 3inj h ARG 251 CO -0.22 0.17 0.50 0.28 -1.07 0.00 0.00 179.97 179.63 3inj h VAL 252 N 0.26 1.18 -0.67 2.04 2.07 -1.43 -1.63 116.25 118.07 3inj h VAL 252 Ca 0.09 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.28 3inj h VAL 252 Cb 0.00 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 29.80 3inj h VAL 252 CO -0.04 0.19 0.42 0.40 0.02 0.00 0.00 177.57 178.55 3inj h ILE 253 N 1.02 1.09 -0.21 4.57 1.08 -0.88 -0.29 117.51 123.89 3inj h ILE 253 Ca 0.29 -0.28 -0.06 0.00 -0.39 0.00 0.00 64.86 64.42 3inj h ILE 253 Cb -0.09 0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 33.85 3inj h ILE 253 CO -0.07 0.15 -0.10 -0.61 -0.69 0.00 0.00 178.15 176.82 3inj h GLN 254 N 0.82 0.44 -0.94 2.37 4.15 -0.99 -1.74 115.11 119.22 3inj h GLN 254 Ca 0.27 -0.19 0.03 0.00 0.77 0.00 0.00 58.65 59.53 3inj h GLN 254 Cb 0.01 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.64 3inj h GLN 254 CO -0.10 0.73 0.61 0.28 -1.93 0.00 0.00 178.83 178.42 3inj h VAL 255 N 0.14 1.17 -0.81 2.39 2.07 -1.20 -1.58 116.25 118.43 3inj h VAL 255 Ca 0.05 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 3inj h VAL 255 Cb 0.60 -0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.20 3inj h VAL 255 CO 0.03 0.22 0.40 0.00 0.02 0.00 0.00 177.57 178.24 3inj h ALA 256 N 1.38 1.05 -0.27 1.67 0.00 -0.91 -0.78 119.26 121.40 3inj h ALA 256 Ca 0.37 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 3inj h ALA 256 Cb -0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 3inj h ALA 256 CO -0.11 0.60 -0.19 0.00 0.00 0.00 0.00 179.25 179.55 3inj h ALA 257 N 1.21 1.17 0.06 0.00 0.00 -0.79 -2.29 119.26 118.61 3inj h ALA 257 Ca 0.28 -0.31 -0.25 0.00 0.00 0.00 0.00 54.91 54.64 3inj h ALA 257 Cb 0.10 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.77 3inj h ALA 257 CO -0.04 0.53 -1.07 0.78 0.00 0.00 0.00 179.25 179.45 3inj h GLY 258 N 0.97 0.43 2.00 0.00 0.00 -0.97 -1.19 103.07 104.32 3inj h GLY 258 Ca 0.07 -0.87 -0.11 0.00 0.00 0.00 0.00 47.33 46.43 3inj h GLY 258 CO 0.04 0.76 -0.51 1.76 0.00 0.00 0.00 176.54 178.60 3inj h SER 259 N 0.18 0.00 0.00 0.19 0.02 -1.06 -3.41 113.55 109.47 3inj h SER 259 Ca -0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 3inj h SER 259 Cb 1.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.28 3inj h SER 259 CO 0.18 0.51 0.00 -1.54 -1.14 0.00 0.00 176.83 174.84 3inj n SER 260 N -3.66 0.00 -1.26 3.07 3.41 -0.87 -4.94 113.62 109.36 3inj n SER 260 Ca -0.01 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.68 3inj n SER 260 Cb 0.57 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.83 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 4.55 -3.44 4.04 6.94 -1.24 -4.94 115.26 121.17 3inj n ASN 261 Ca 0.00 -2.96 -0.25 0.00 -0.02 0.00 0.00 54.58 51.35 3inj n ASN 261 Cb 0.00 -0.59 0.04 0.00 -2.36 0.00 0.00 39.78 36.87 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 -0.06 -2.75 -4.69 -4.53 4.77 -0.45 -4.94 117.00 104.34 3inj n LEU 262 Ca 0.24 -0.49 -0.37 0.00 -0.03 0.00 0.00 56.01 55.36 3inj n LEU 262 Cb 1.00 -2.81 0.08 0.00 -2.33 0.00 0.00 43.42 39.36 3inj n LEU 262 CO 0.22 0.41 0.79 2.29 -1.33 0.00 0.00 177.39 179.77 3inj n LYS 263 N -4.46 0.91 -2.10 3.23 2.85 -1.24 -4.97 118.16 112.37 3inj n LYS 263 Ca -0.03 0.37 -0.38 0.00 -1.05 0.00 0.00 58.31 57.22 3inj n LYS 263 Cb 0.57 -2.43 0.01 0.00 -0.65 0.00 0.00 35.03 32.53 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 -3.35 3.61 -0.03 -1.58 3.00 -0.59 -4.85 118.95 115.16 3inj s ARG 264 Ca 0.80 1.94 0.02 0.00 0.00 0.00 0.00 55.73 58.49 3inj s ARG 264 Cb -0.37 -2.41 0.01 0.00 0.00 0.00 0.00 34.95 32.18 3inj s ARG 264 CO 0.43 -0.72 -0.06 0.08 0.00 0.00 0.00 175.30 175.04 3inj s VAL 265 N -1.44 0.55 0.11 3.52 1.01 -1.26 -0.56 120.40 122.31 3inj s VAL 265 Ca 0.65 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.52 3inj s VAL 265 Cb -0.33 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 3inj s VAL 265 CO 0.40 0.20 -0.20 0.42 0.00 0.00 0.00 175.10 175.92 3inj s THR 266 N 0.51 1.67 -0.02 3.92 -4.23 -0.76 -4.93 115.64 111.80 3inj s THR 266 Ca -0.07 -1.57 0.01 0.00 -1.18 0.00 0.00 61.69 58.89 3inj s THR 266 Cb -0.10 -1.55 0.01 0.00 1.34 0.00 0.00 72.50 72.20 3inj s THR 266 CO 0.00 -0.10 -0.03 -0.76 -0.54 0.00 0.00 174.62 173.19 3inj s LEU 267 N -1.98 1.57 -0.34 4.79 1.43 -0.99 -2.03 118.68 121.14 3inj s LEU 267 Ca 0.07 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.12 3inj s LEU 267 Cb -0.09 -0.27 0.09 0.00 0.03 0.00 0.00 46.19 45.95 3inj s LEU 267 CO 0.04 -0.02 0.05 -1.61 0.23 0.00 0.00 176.35 175.04 3inj s GLU 268 N 0.51 1.77 0.00 1.70 0.41 -0.12 -1.36 118.70 121.61 3inj s GLU 268 Ca -0.05 -1.74 0.00 0.00 -0.41 0.00 0.00 54.97 52.77 3inj s GLU 268 Cb -0.09 -3.22 0.00 0.00 -1.78 0.00 0.00 34.13 29.04 3inj s GLU 268 CO -0.01 -0.88 0.00 1.28 -0.49 0.00 0.00 175.26 175.16 3inj n LEU 269 N 4.37 0.00 0.00 1.80 4.77 0.14 -1.69 117.00 126.38 3inj n LEU 269 Ca -0.01 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.82 3inj n LEU 269 Cb 0.42 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.61 3inj n LEU 269 CO 0.24 0.00 0.43 0.61 -1.33 0.00 0.00 177.39 177.34 3inj n GLY 270 N 5.00 -1.30 3.71 -0.72 0.00 -1.25 -4.86 105.19 105.77 3inj n GLY 270 Ca 0.00 -1.69 -0.07 0.00 0.00 0.00 0.00 46.02 44.26 3inj n GLY 270 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3inj s GLY 271 N -4.41 -0.27 -0.41 -0.02 0.00 -1.19 -4.30 107.32 96.71 3inj s GLY 271 Ca 0.37 0.10 0.11 0.00 0.00 0.00 0.00 44.72 45.30 3inj s GLY 271 CO 0.26 0.03 0.77 1.17 0.00 0.00 0.00 173.10 175.32 3inj n LYS 272 N -0.42 1.38 -1.91 2.90 3.00 -1.26 -4.43 118.16 117.41 3inj n LYS 272 Ca -0.08 -3.65 -0.42 0.00 -0.00 0.00 0.00 58.31 54.17 3inj n LYS 272 Cb 0.61 -1.80 -0.03 0.00 0.00 0.00 0.00 35.03 33.81 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 -2.60 6.56 0.02 3.14 0.01 -1.22 -4.55 113.70 115.06 3inj s SER 273 Ca 0.42 2.64 -0.26 0.00 1.31 0.00 0.00 55.95 60.05 3inj s SER 273 Cb 0.33 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.93 3inj s SER 273 CO -0.09 -0.85 0.83 -2.16 0.41 0.00 0.00 173.24 171.38 3inj s PRO 274 N 1.27 4.53 -0.34 12.44 0.05 -1.25 -2.15 135.00 149.53 3inj s PRO 274 Ca 0.71 1.16 -0.05 0.00 0.05 0.00 0.00 61.00 62.87 3inj s PRO 274 Cb -0.44 -3.41 0.05 0.00 0.05 0.00 0.00 34.50 30.76 3inj s PRO 274 CO 0.31 0.15 0.10 1.21 0.05 0.00 0.00 177.00 178.82 3inj s ASN 275 N 0.38 5.21 -0.28 6.66 3.04 0.13 -1.53 114.94 128.54 3inj s ASN 275 Ca 0.43 -1.32 -0.10 0.00 0.04 0.00 0.00 52.86 51.90 3inj s ASN 275 Cb -0.20 -1.83 -0.04 0.00 -1.54 0.00 0.00 41.25 37.64 3inj s ASN 275 CO 0.24 -0.35 0.16 -0.63 -3.04 0.00 0.00 177.10 173.48 3inj s ILE 276 N 1.33 4.97 -0.33 -5.21 1.01 0.16 0.23 121.20 123.36 3inj s ILE 276 Ca -0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 60.65 60.58 3inj s ILE 276 Cb -0.20 -3.39 0.04 0.00 0.01 0.00 0.00 42.46 38.92 3inj s ILE 276 CO 0.01 0.24 0.09 -0.63 0.00 0.00 0.00 174.94 174.65 3inj s ILE 277 N 1.70 3.74 0.43 2.92 -1.09 0.17 -0.42 121.20 128.66 3inj s ILE 277 Ca 0.07 -1.11 -0.19 0.00 -2.23 0.00 0.00 60.65 57.19 3inj s ILE 277 Cb -0.16 -3.10 -0.10 0.00 -1.58 0.00 0.00 42.46 37.52 3inj s ILE 277 CO 0.09 -0.15 0.92 -0.04 -1.23 0.00 0.00 174.94 174.52 3inj s MET 278 N 1.40 4.12 0.07 2.79 -1.94 -0.15 -1.95 119.30 123.63 3inj s MET 278 Ca -0.02 0.99 0.05 0.00 -1.71 0.00 0.00 55.69 55.00 3inj s MET 278 Cb -0.19 -2.22 0.25 0.00 2.01 0.00 0.00 34.83 34.68 3inj s MET 278 CO 0.02 -0.05 1.12 -1.13 -0.01 0.00 0.00 175.02 174.98 3inj n SER 279 N -0.81 0.12 -1.37 3.03 3.41 -1.26 -1.05 113.62 115.69 3inj n SER 279 Ca 0.06 0.53 0.08 0.00 -0.26 0.00 0.00 58.87 59.28 3inj n SER 279 Cb 0.54 -0.55 0.33 0.00 -0.26 0.00 0.00 64.21 64.27 3inj n SER 279 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3inj n ASP 280 N -1.64 4.71 -4.83 4.04 5.75 -1.26 -4.95 116.55 118.35 3inj n ASP 280 Ca -0.00 -2.86 -0.32 0.00 -0.01 0.00 0.00 54.79 51.60 3inj n ASP 280 Cb 0.03 -0.59 -0.06 0.00 -1.03 0.00 0.00 41.12 39.48 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 -2.58 3.11 -0.24 2.12 0.00 -0.21 -3.30 121.76 120.66 3inj s ALA 281 Ca 0.47 0.24 -0.28 0.00 0.00 0.00 0.00 51.96 52.40 3inj s ALA 281 Cb 0.36 -3.05 -0.05 0.00 0.00 0.00 0.00 23.12 20.38 3inj s ALA 281 CO 0.14 0.05 2.23 0.34 0.00 0.00 0.00 175.76 178.52 3inj s ASP 282 N -2.51 5.39 0.10 0.00 -1.08 -1.26 -4.89 116.67 112.42 3inj s ASP 282 Ca 0.59 1.83 -0.22 0.00 -0.52 0.00 0.00 52.55 54.24 3inj s ASP 282 Cb -0.10 -2.51 -0.11 0.00 -1.46 0.00 0.00 42.92 38.75 3inj s ASP 282 CO 0.20 -2.02 1.74 -0.03 0.52 0.00 0.00 175.17 175.58 3inj h MET 283 N 15.36 0.07 -0.74 4.34 1.85 -1.96 0.95 114.93 134.81 3inj h MET 283 Ca -0.40 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.69 3inj h MET 283 Cb 1.24 -0.02 -0.04 0.00 0.43 0.00 0.00 31.60 33.22 3inj h MET 283 CO 0.97 0.04 0.48 -0.44 -0.40 0.00 0.00 176.91 177.56 3inj h ASP 284 N 0.07 0.86 -0.21 1.39 3.32 -2.00 -0.84 116.42 119.01 3inj h ASP 284 Ca 0.04 -0.04 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 3inj h ASP 284 Cb 0.02 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 3inj h ASP 284 CO -0.04 0.64 -0.34 -0.25 -1.72 0.00 0.00 179.24 177.53 3inj h TRP 285 N 1.00 0.74 -0.87 4.55 2.91 -1.92 -2.59 115.95 119.78 3inj h TRP 285 Ca 0.27 -0.26 -0.00 0.00 1.13 0.00 0.00 58.89 60.03 3inj h TRP 285 Cb -0.09 -0.14 -0.04 0.00 -0.51 0.00 0.00 29.16 28.37 3inj h TRP 285 CO -0.02 0.99 0.54 0.00 -1.03 0.00 0.00 178.44 178.93 3inj h ALA 286 N 0.62 1.11 -0.35 2.65 0.00 -0.58 -0.54 119.26 122.16 3inj h ALA 286 Ca 0.02 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 3inj h ALA 286 Cb 0.93 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3inj h ALA 286 CO 0.08 0.55 -0.24 0.28 0.00 0.00 0.00 179.25 179.92 3inj h VAL 287 N 1.19 1.27 -0.18 0.00 2.07 -1.14 -0.29 116.25 119.17 3inj h VAL 287 Ca 0.31 -1.34 -0.14 0.00 0.82 0.00 0.00 66.70 66.36 3inj h VAL 287 Cb -0.07 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 3inj h VAL 287 CO -0.06 0.44 -0.42 -0.08 0.02 0.00 0.00 177.57 177.47 3inj h GLU 288 N 0.62 0.60 -0.15 1.57 4.57 -1.14 -2.52 114.58 118.13 3inj h GLU 288 Ca 0.08 -0.41 -0.09 0.00 -1.18 0.00 0.00 59.36 57.77 3inj h GLU 288 Cb 0.74 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.37 3inj h GLU 288 CO 0.06 1.03 -0.31 1.96 -1.18 0.00 0.00 179.01 180.56 3inj h GLN 289 N 0.26 0.28 -0.21 1.92 1.08 -1.07 -1.04 115.11 116.34 3inj h GLN 289 Ca -0.00 -0.11 -0.14 0.00 -1.45 0.00 0.00 58.65 56.95 3inj h GLN 289 Cb 1.03 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.44 3inj h GLN 289 CO 0.09 0.57 -0.45 0.00 -0.95 0.00 0.00 178.83 178.10 3inj h ALA 290 N 1.43 0.83 -0.06 3.87 0.00 -1.03 0.10 119.26 124.40 3inj h ALA 290 Ca 0.03 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3inj h ALA 290 Cb 0.68 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 3inj h ALA 290 CO 0.05 0.65 -0.04 1.25 0.00 0.00 0.00 179.25 181.17 3inj h HIS 291 N 0.42 0.16 -0.41 0.00 -0.00 -1.13 -2.92 115.15 111.27 3inj h HIS 291 Ca 0.03 -0.04 0.06 0.00 -0.00 0.00 0.00 60.37 60.41 3inj h HIS 291 Cb 0.95 -0.04 -0.05 0.00 -0.00 0.00 0.00 27.41 28.27 3inj h HIS 291 CO 0.04 0.53 0.12 0.35 -0.00 0.00 0.00 177.93 178.97 3inj h PHE 292 N -0.25 0.21 -0.97 5.26 3.04 -1.11 -0.14 116.94 122.97 3inj h PHE 292 Ca 0.01 0.02 0.10 0.00 3.98 0.00 0.00 57.97 62.09 3inj h PHE 292 Cb 0.49 -0.03 -0.07 0.00 2.56 0.00 0.00 35.95 38.89 3inj h PHE 292 CO 0.07 0.06 0.62 0.00 -2.02 0.00 0.00 178.31 177.04 3inj h ALA 293 N 1.29 1.54 0.07 2.41 0.00 -0.78 -1.50 119.26 122.29 3inj h ALA 293 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.80 3inj h ALA 293 Cb 0.21 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3inj h ALA 293 CO -0.22 0.25 -1.70 -0.11 0.00 0.00 0.00 179.25 177.46 3inj n LEU 294 N -4.56 2.31 0.06 0.00 -0.00 -1.09 -1.41 117.00 112.30 3inj n LEU 294 Ca 0.17 0.30 0.12 0.00 -0.00 0.00 0.00 56.01 56.60 3inj n LEU 294 Cb 0.31 -1.05 0.14 0.00 -0.00 0.00 0.00 43.42 42.81 3inj n LEU 294 CO 0.30 0.61 0.28 -0.26 -0.00 0.00 0.00 177.39 178.31 3inj h PHE 295 N -0.39 0.00 -2.44 1.96 -1.00 -0.96 -3.36 116.94 110.75 3inj h PHE 295 Ca -0.40 0.00 -0.61 0.00 2.81 0.00 0.00 57.97 59.77 3inj h PHE 295 Cb 1.73 0.00 0.11 0.00 3.61 0.00 0.00 35.95 41.40 3inj h PHE 295 CO 0.08 0.00 0.06 0.34 -1.61 0.00 0.00 178.31 177.18 3inj n PHE 296 N -2.16 1.04 -3.83 -0.55 -0.00 -0.57 -2.09 117.46 109.29 3inj n PHE 296 Ca 0.03 0.70 -0.25 0.00 -0.00 0.00 0.00 57.45 57.93 3inj n PHE 296 Cb 0.45 -2.21 0.02 0.00 -0.00 0.00 0.00 39.48 37.74 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 1.19 -1.92 -2.08 -2.13 5.15 -1.26 -1.13 115.26 113.08 3inj n ASN 297 Ca 0.10 -0.86 -0.17 0.00 -0.60 0.00 0.00 54.58 53.05 3inj n ASN 297 Cb 0.33 -3.74 -0.03 0.00 -0.53 0.00 0.00 39.78 35.80 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 -4.40 -1.72 -0.99 1.20 3.00 -0.89 -0.35 117.38 113.23 3inj n GLN 298 Ca -0.21 0.91 0.00 0.00 -0.01 0.00 0.00 57.00 57.69 3inj n GLN 298 Cb 0.64 -5.43 0.00 0.00 0.00 0.00 0.00 30.24 25.44 3inj n GLN 298 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3inj n GLY 299 N -0.71 0.78 2.71 1.08 0.00 -0.29 -3.17 105.19 105.60 3inj n GLY 299 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 3inj n GLY 299 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3inj n GLN 300 N -2.38 4.37 -4.20 1.61 6.02 0.52 -3.41 117.38 119.92 3inj n GLN 300 Ca 0.00 -3.83 -0.20 0.00 -0.01 0.00 0.00 57.00 52.97 3inj n GLN 300 Cb 0.00 -2.69 -0.16 0.00 1.02 0.00 0.00 30.24 28.41 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 0.47 -0.59 -1.61 0.00 0.00 -0.81 -4.77 120.51 113.19 3inj n ALA 304 Ca 0.26 0.41 -0.42 0.00 0.00 0.00 0.00 53.44 53.69 3inj n ALA 304 Cb 1.10 -1.98 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 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 1.43 4.08 0.39 0.00 0.00 -0.50 -3.40 105.19 107.18 3inj n GLY 305 Ca 0.11 -1.53 0.14 0.00 0.00 0.00 0.00 46.02 44.74 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 6.29 1.20 -3.87 1.61 3.41 -0.92 -4.36 113.62 116.98 3inj n SER 306 Ca 0.52 -1.42 -0.30 0.00 -0.26 0.00 0.00 58.87 57.41 3inj n SER 306 Cb 0.39 -0.01 -0.15 0.00 -0.26 0.00 0.00 64.21 64.18 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 -1.99 1.10 -0.53 4.33 0.52 -0.99 -3.84 118.95 117.55 3inj s ARG 307 Ca 0.39 -1.50 -0.19 0.00 -0.52 0.00 0.00 55.73 53.92 3inj s ARG 307 Cb 0.21 -2.59 0.07 0.00 0.52 0.00 0.00 34.95 33.16 3inj s ARG 307 CO 0.33 -0.97 0.65 0.99 0.02 0.00 0.00 175.30 176.33 3inj s THR 308 N 1.23 4.85 -0.18 0.02 2.01 0.25 0.19 115.64 124.01 3inj s THR 308 Ca 0.11 -0.65 -0.20 0.00 0.31 0.00 0.00 61.69 61.26 3inj s THR 308 Cb -0.18 -4.36 -0.03 0.00 0.01 0.00 0.00 72.50 67.94 3inj s THR 308 CO -0.16 -0.91 0.59 -0.36 -0.69 0.00 0.00 174.62 173.09 3inj s PHE 309 N 2.66 3.41 -0.11 4.92 0.40 0.14 -0.90 117.98 128.50 3inj s PHE 309 Ca 0.14 0.92 -0.00 0.00 -0.60 0.00 0.00 56.93 57.38 3inj s PHE 309 Cb -0.21 -2.74 0.02 0.00 0.51 0.00 0.00 43.02 40.60 3inj s PHE 309 CO 0.10 -0.10 -0.08 0.08 0.70 0.00 0.00 175.22 175.93 3inj s VAL 310 N 1.60 1.01 0.36 -0.44 1.01 -0.52 0.46 120.40 123.88 3inj s VAL 310 Ca 0.28 -0.29 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 3inj s VAL 310 Cb -0.16 -1.02 -0.12 0.00 0.00 0.00 0.00 36.38 35.09 3inj s VAL 310 CO 0.11 0.36 1.43 1.67 0.00 0.00 0.00 175.10 178.67 3inj n GLN 311 N 4.83 2.50 -0.00 2.72 7.27 -0.82 -2.84 117.38 131.03 3inj n GLN 311 Ca -0.13 0.88 0.13 0.00 0.07 0.00 0.00 57.00 57.94 3inj n GLN 311 Cb 0.50 -2.57 0.56 0.00 2.41 0.00 0.00 30.24 31.14 3inj n GLN 311 CO 0.00 0.00 0.00 1.05 0.07 0.00 0.00 177.06 178.18 3inj h GLU 312 N 2.94 0.26 0.00 3.69 4.11 -1.32 -1.35 114.58 122.90 3inj h GLU 312 Ca -0.49 -0.02 -0.02 0.00 0.07 0.00 0.00 59.36 58.91 3inj h GLU 312 Cb 1.25 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 3inj h GLU 312 CO 0.64 0.17 -0.07 -0.44 0.07 0.00 0.00 179.01 179.38 3inj h ASP 313 N 0.27 0.00 -0.06 3.06 3.32 -1.89 -2.94 116.42 118.17 3inj h ASP 313 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3inj h ASP 313 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 3inj h ASP 313 CO -0.04 0.07 0.00 2.30 -1.72 0.00 0.00 179.24 179.85 3inj n ILE 314 N -4.07 0.33 0.16 0.35 -5.35 -0.55 -4.78 119.36 105.45 3inj n ILE 314 Ca -0.03 -0.66 -0.14 0.00 -0.27 0.00 0.00 62.75 61.65 3inj n ILE 314 Cb 0.16 0.92 -0.07 0.00 -1.74 0.00 0.00 39.64 38.91 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 1.11 -0.53 -0.80 4.28 5.03 -1.27 -0.64 116.97 124.15 3inj h TYR 315 Ca 0.00 0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.32 3inj h TYR 315 Cb 0.37 0.20 -0.04 0.00 1.55 0.00 0.00 36.73 38.81 3inj h TYR 315 CO 0.04 -0.30 0.53 -0.44 -1.32 0.00 0.00 178.16 176.67 3inj h ASP 316 N -0.44 0.91 -0.02 -2.11 3.32 -1.86 -0.36 116.42 115.85 3inj h ASP 316 Ca -0.01 -0.02 -0.23 0.00 0.02 0.00 0.00 57.03 56.79 3inj h ASP 316 Cb 0.41 -0.23 0.02 0.00 0.22 0.00 0.00 39.33 39.75 3inj h ASP 316 CO -0.04 0.65 -0.89 -0.08 -1.72 0.00 0.00 179.24 177.16 3inj h GLU 317 N 1.07 0.64 -0.55 3.56 4.81 -1.87 -2.22 114.58 120.03 3inj h GLU 317 Ca 0.29 -0.66 -0.01 0.00 -0.13 0.00 0.00 59.36 58.86 3inj h GLU 317 Cb -0.11 0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 3inj h GLU 317 CO -0.07 1.26 0.32 0.35 -0.73 0.00 0.00 179.01 180.14 3inj h PHE 318 N 0.28 0.73 -0.17 0.92 3.57 -0.70 -0.66 116.94 120.92 3inj h PHE 318 Ca -0.11 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.38 3inj h PHE 318 Cb 1.56 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 40.05 3inj h PHE 318 CO 0.11 0.52 0.07 0.28 -2.23 0.00 0.00 178.31 177.06 3inj h VAL 319 N 0.73 1.15 -0.50 1.41 2.07 -1.12 0.22 116.25 120.21 3inj h VAL 319 Ca 0.19 -0.45 0.07 0.00 0.82 0.00 0.00 66.70 67.33 3inj h VAL 319 Cb 0.01 1.14 -0.06 0.00 -1.52 0.00 0.00 31.29 30.87 3inj h VAL 319 CO -0.03 0.14 0.18 -0.08 0.02 0.00 0.00 177.57 177.79 3inj h GLU 320 N 0.12 0.34 -0.33 1.57 4.81 -1.20 -0.14 114.58 119.76 3inj h GLU 320 Ca 0.06 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.13 3inj h GLU 320 Cb 0.16 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 3inj h GLU 320 CO -0.01 0.23 -0.35 0.00 -0.73 0.00 0.00 179.01 178.15 3inj h ARG 321 N 0.35 0.74 -0.22 1.92 3.08 -0.87 -2.53 114.38 116.86 3inj h ARG 321 Ca 0.24 -0.36 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 3inj h ARG 321 Cb 0.26 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3inj h ARG 321 CO -0.25 0.97 0.04 0.77 -1.07 0.00 0.00 179.97 180.44 3inj h SER 322 N 0.62 0.35 -0.95 7.04 0.02 -0.16 -1.44 113.55 119.02 3inj h SER 322 Ca 0.06 -0.25 0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3inj h SER 322 Cb 0.88 -0.09 -0.05 0.00 0.14 0.00 0.00 62.40 63.28 3inj h SER 322 CO 0.08 0.51 0.63 0.58 -1.14 0.00 0.00 176.83 177.49 3inj h VAL 323 N 0.17 1.23 -0.60 2.27 2.07 -1.03 -0.78 116.25 119.57 3inj h VAL 323 Ca 0.07 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 3inj h VAL 323 Cb 0.31 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 29.90 3inj h VAL 323 CO 0.00 0.23 0.20 0.00 0.02 0.00 0.00 177.57 178.03 3inj h ALA 324 N 1.36 0.79 -0.67 1.67 0.00 -1.28 -1.80 119.26 119.34 3inj h ALA 324 Ca 0.35 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 3inj h ALA 324 Cb -0.12 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 3inj h ALA 324 CO -0.08 0.44 0.12 -0.09 0.00 0.00 0.00 179.25 179.64 3inj h ARG 325 N 0.85 1.09 -0.63 0.00 9.65 -0.81 -2.86 114.38 121.68 3inj h ARG 325 Ca 0.20 -0.28 -0.08 0.00 -1.10 0.00 0.00 59.98 58.72 3inj h ARG 325 Cb 0.26 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 3inj h ARG 325 CO -0.01 0.99 0.08 0.00 2.80 0.00 0.00 179.97 183.83 3inj h ALA 326 N 1.10 0.83 0.00 2.80 0.00 -0.90 -2.70 119.26 120.39 3inj h ALA 326 Ca 0.20 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 3inj h ALA 326 Cb 0.42 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3inj h ALA 326 CO 0.01 0.61 -0.26 0.87 0.00 0.00 0.00 179.25 180.48 3inj h LYS 327 N 0.96 0.00 -0.00 0.00 1.57 -1.23 -2.88 116.57 114.99 3inj h LYS 327 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3inj h LYS 327 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 3inj h LYS 327 CO 0.02 0.26 -0.49 -1.13 -0.57 0.00 0.00 179.45 177.54 3inj n SER 328 N -3.63 0.92 -4.66 0.86 3.41 -1.09 -4.89 113.62 104.54 3inj n SER 328 Ca -0.01 -0.72 -0.42 0.00 -0.26 0.00 0.00 58.87 57.46 3inj n SER 328 Cb 0.39 0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 64.66 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 -2.78 4.09 -0.40 4.33 3.52 -1.04 -4.92 118.95 121.75 3inj s ARG 329 Ca 0.16 2.58 -0.27 0.00 -0.13 0.00 0.00 55.73 58.07 3inj s ARG 329 Cb 0.18 -4.17 0.02 0.00 -1.56 0.00 0.00 34.95 29.42 3inj s ARG 329 CO 0.65 -1.01 1.02 0.08 -0.81 0.00 0.00 175.30 175.23 3inj s VAL 330 N 4.65 4.44 -0.17 7.11 1.01 -1.26 -4.94 120.40 131.24 3inj s VAL 330 Ca 0.89 1.26 -0.10 0.00 0.00 0.00 0.00 61.98 64.03 3inj s VAL 330 Cb -0.42 -4.45 -0.05 0.00 0.00 0.00 0.00 36.38 31.46 3inj s VAL 330 CO 0.41 -0.71 0.17 -0.69 0.00 0.00 0.00 175.10 174.29 3inj s VAL 331 N 3.85 5.40 -2.66 2.92 1.01 -1.26 -0.48 120.40 129.18 3inj s VAL 331 Ca 0.43 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.69 3inj s VAL 331 Cb -0.10 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.78 3inj s VAL 331 CO 0.23 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.42 3inj n GLY 332 N 3.05 -0.56 3.63 4.51 0.00 -0.85 -4.97 105.19 110.01 3inj n GLY 332 Ca -0.16 -0.77 -0.50 0.00 0.00 0.00 0.00 46.02 44.59 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 2.97 0.19 1.61 2.85 -1.26 -4.44 115.26 117.18 3inj n ASN 333 Ca 0.00 0.81 0.13 0.00 -0.11 0.00 0.00 54.58 55.41 3inj n ASN 333 Cb 0.00 -1.32 0.66 0.00 1.24 0.00 0.00 39.78 40.36 3inj n ASN 333 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3inj h PRO 334 N 10.03 0.00 -0.00 1.20 0.11 -1.89 -1.08 132.00 140.37 3inj h PRO 334 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3inj h PRO 334 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3inj h PRO 334 CO 0.97 0.00 -0.34 1.19 -0.21 0.00 0.00 178.00 179.61 3inj n PHE 335 N -2.43 0.00 -2.97 0.65 3.01 -1.26 -0.61 117.46 113.85 3inj n PHE 335 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 3inj n PHE 335 Cb 0.11 -0.23 -0.05 0.00 -0.01 0.00 0.00 39.48 39.30 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 -2.80 6.67 0.62 4.37 -1.08 -0.41 -4.91 116.67 119.12 3inj s ASP 336 Ca 0.17 0.70 0.28 0.00 -0.52 0.00 0.00 52.55 53.19 3inj s ASP 336 Cb 0.18 -2.40 1.50 0.00 -1.46 0.00 0.00 42.92 40.74 3inj s ASP 336 CO 0.61 -0.57 1.89 0.77 0.52 0.00 0.00 175.17 178.39 3inj h SER 337 N 8.04 0.00 0.94 -0.34 4.64 -1.87 0.25 113.55 125.22 3inj h SER 337 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 3inj h SER 337 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3inj h SER 337 CO 0.86 0.00 0.00 1.17 -0.87 0.00 0.00 176.83 177.99 3inj n LYS 338 N -3.42 0.17 -2.89 4.77 3.00 -1.26 -4.83 118.16 113.71 3inj n LYS 338 Ca 0.05 0.31 -0.41 0.00 -0.00 0.00 0.00 58.31 58.25 3inj n LYS 338 Cb 0.58 -1.78 -0.04 0.00 0.00 0.00 0.00 35.03 33.79 3inj n LYS 338 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 3inj s THR 339 N -3.19 4.93 -0.17 3.15 2.01 0.87 -4.77 115.64 118.47 3inj s THR 339 Ca 0.07 1.70 0.10 0.00 0.31 0.00 0.00 61.69 63.88 3inj s THR 339 Cb 0.11 -4.16 -0.23 0.00 0.01 0.00 0.00 72.50 68.23 3inj s THR 339 CO 0.45 0.14 0.17 -0.62 -0.69 0.00 0.00 174.62 174.07 3inj n GLU 340 N 4.33 0.68 -3.97 4.92 1.02 0.37 -4.89 120.64 123.09 3inj n GLU 340 Ca 0.03 0.13 -0.26 0.00 -0.02 0.00 0.00 57.16 57.04 3inj n GLU 340 Cb 0.50 -1.61 -0.17 0.00 -0.02 0.00 0.00 31.44 30.15 3inj n GLU 340 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 3inj s GLN 341 N -2.53 1.49 0.00 3.49 0.74 -0.23 -4.80 119.66 117.82 3inj s GLN 341 Ca -0.16 -0.25 0.00 0.00 0.05 0.00 0.00 55.36 55.00 3inj s GLN 341 Cb 0.07 -1.53 0.00 0.00 1.10 0.00 0.00 33.01 32.65 3inj s GLN 341 CO 0.77 -0.24 0.00 0.41 -0.55 0.00 0.00 175.29 175.68 3inj n GLY 342 N 4.83 0.65 3.92 2.59 0.00 -1.26 -2.00 105.19 113.92 3inj n GLY 342 Ca -0.13 -1.68 -0.26 0.00 0.00 0.00 0.00 46.02 43.95 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 1.07 3.27 1.03 1.61 0.04 -1.24 -4.76 135.00 136.02 3inj s PRO 343 Ca 0.00 -0.09 -0.12 0.00 0.04 0.00 0.00 61.00 60.83 3inj s PRO 343 Cb 0.00 -2.43 0.21 0.00 0.04 0.00 0.00 34.50 32.32 3inj s PRO 343 CO 0.00 -0.29 1.07 -0.65 0.04 0.00 0.00 177.00 177.17 3inj s GLN 344 N -4.70 0.14 0.27 4.56 -1.52 -0.02 -4.71 119.66 113.68 3inj s GLN 344 Ca 0.48 0.84 0.09 0.00 -1.95 0.00 0.00 55.36 54.82 3inj s GLN 344 Cb -0.10 -1.68 0.35 0.00 -0.22 0.00 0.00 33.01 31.36 3inj s GLN 344 CO 0.42 -3.01 1.61 -0.24 -0.25 0.00 0.00 175.29 173.82 3inj h VAL 345 N -2.11 1.42 -2.89 1.09 3.04 -1.88 -3.43 116.25 111.49 3inj h VAL 345 Ca -0.55 -2.03 0.02 0.00 -1.01 0.00 0.00 66.70 63.13 3inj h VAL 345 Cb 1.31 2.08 -0.00 0.00 -2.01 0.00 0.00 31.29 32.67 3inj h VAL 345 CO 0.52 0.59 0.36 1.51 -1.01 0.00 0.00 177.57 179.54 3inj s ASP 346 N -6.87 0.03 0.29 3.17 1.47 -1.26 -4.53 116.67 108.97 3inj s ASP 346 Ca -0.02 -1.08 0.10 0.00 1.18 0.00 0.00 52.55 52.72 3inj s ASP 346 Cb 0.13 0.77 0.43 0.00 -0.34 0.00 0.00 42.92 43.91 3inj s ASP 346 CO 0.77 -1.55 1.66 -0.08 0.68 0.00 0.00 175.17 176.66 3inj h GLU 347 N 2.00 0.06 -0.48 2.11 4.81 -1.98 -1.84 114.58 119.25 3inj h GLU 347 Ca -0.32 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.84 3inj h GLU 347 Cb 1.24 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 3inj h GLU 347 CO 0.41 0.58 0.18 1.15 -0.73 0.00 0.00 179.01 180.61 3inj h THR 348 N 0.04 1.22 -0.05 0.32 2.02 -2.00 -1.83 112.91 112.63 3inj h THR 348 Ca -0.00 -0.69 -0.02 0.00 0.77 0.00 0.00 66.41 66.47 3inj h THR 348 Cb 0.97 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 68.14 3inj h THR 348 CO 0.07 0.26 -0.03 1.56 0.37 0.00 0.00 175.52 177.75 3inj h GLN 349 N 0.64 0.11 -0.93 6.66 1.08 -1.95 -2.47 115.11 118.25 3inj h GLN 349 Ca 0.16 -0.05 0.18 0.00 -1.45 0.00 0.00 58.65 57.48 3inj h GLN 349 Cb 0.22 -0.00 -0.17 0.00 -0.05 0.00 0.00 27.48 27.48 3inj h GLN 349 CO -0.01 0.53 -0.27 0.35 -0.95 0.00 0.00 178.83 178.48 3inj h PHE 350 N -0.31 -0.65 -0.32 2.96 3.57 -1.30 -0.03 116.94 120.86 3inj h PHE 350 Ca 0.01 0.09 -0.16 0.00 3.53 0.00 0.00 57.97 61.44 3inj h PHE 350 Cb 0.50 0.43 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 3inj h PHE 350 CO 0.08 -0.40 -0.43 0.87 -2.23 0.00 0.00 178.31 176.19 3inj h LYS 351 N -0.01 0.81 -0.60 1.11 1.57 -1.28 -2.46 116.57 115.72 3inj h LYS 351 Ca 0.42 -0.45 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3inj h LYS 351 Cb 0.66 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 3inj h LYS 351 CO -0.95 1.08 0.30 -0.22 -0.57 0.00 0.00 179.45 179.09 3inj h LYS 352 N 0.65 0.85 -0.44 3.15 3.64 -0.77 -0.49 116.57 123.15 3inj h LYS 352 Ca 0.04 -0.12 -0.10 0.00 -1.27 0.00 0.00 60.65 59.21 3inj h LYS 352 Cb 1.01 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.65 3inj h LYS 352 CO 0.10 0.67 -0.14 0.82 -2.27 0.00 0.00 179.45 178.63 3inj h ILE 353 N 0.81 1.26 -0.55 2.00 2.04 -0.97 -1.40 117.51 120.71 3inj h ILE 353 Ca 0.21 -1.23 -0.06 0.00 1.00 0.00 0.00 64.86 64.78 3inj h ILE 353 Cb 0.09 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 3inj h ILE 353 CO -0.03 0.42 0.10 -0.07 0.00 0.00 0.00 178.15 178.57 3inj h LEU 354 N 0.74 0.81 -0.52 1.44 3.38 -1.07 -0.81 115.31 119.27 3inj h LEU 354 Ca 0.12 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 3inj h LEU 354 Cb 0.64 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3inj h LEU 354 CO 0.04 0.82 0.16 1.23 0.09 0.00 0.00 178.44 180.79 3inj h GLY 355 N 0.99 0.88 1.06 0.83 0.00 -0.66 -1.96 103.07 104.20 3inj h GLY 355 Ca 0.17 -0.52 -0.12 0.00 0.00 0.00 0.00 47.33 46.87 3inj h GLY 355 CO 0.01 0.49 -0.17 -0.97 0.00 0.00 0.00 176.54 175.89 3inj h TYR 356 N 0.72 1.04 -0.51 5.60 0.99 -0.99 -0.21 116.97 123.62 3inj h TYR 356 Ca 0.17 -0.24 0.08 0.00 2.00 0.00 0.00 58.73 60.74 3inj h TYR 356 Cb 0.28 -0.25 -0.07 0.00 1.00 0.00 0.00 36.73 37.69 3inj h TYR 356 CO 0.02 1.03 0.13 0.82 -0.00 0.00 0.00 178.16 180.15 3inj h ILE 357 N 0.76 0.75 -0.32 -2.88 2.04 -1.12 0.56 117.51 117.30 3inj h ILE 357 Ca 0.11 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.77 3inj h ILE 357 Cb 0.73 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 3inj h ILE 357 CO 0.06 0.05 -0.23 -1.13 0.00 0.00 0.00 178.15 176.90 3inj h ASN 358 N 0.27 0.61 -0.12 1.72 -0.73 -1.06 -2.71 115.58 113.56 3inj h ASN 358 Ca 0.25 -0.21 0.01 0.00 1.87 0.00 0.00 56.30 58.22 3inj h ASN 358 Cb 0.32 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.74 3inj h ASN 358 CO -0.31 0.83 0.05 0.74 -0.37 0.00 0.00 177.43 178.38 3inj h THR 359 N 0.54 0.99 -0.36 -3.57 2.02 -0.24 -1.04 112.91 111.25 3inj h THR 359 Ca 0.08 -0.04 0.07 0.00 0.77 0.00 0.00 66.41 67.29 3inj h THR 359 Cb 0.68 0.86 -0.07 0.00 -1.74 0.00 0.00 68.15 67.88 3inj h THR 359 CO 0.05 0.02 -0.09 1.23 0.37 0.00 0.00 175.52 177.10 3inj h GLY 360 N 0.12 0.26 1.01 2.16 0.00 -0.66 -1.20 103.07 104.75 3inj h GLY 360 Ca 0.05 0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.51 3inj h GLY 360 CO -0.04 -0.14 0.55 0.50 0.00 0.00 0.00 176.54 177.41 3inj h LYS 361 N -0.00 1.12 -0.63 4.80 1.57 -1.28 -2.11 116.57 120.04 3inj h LYS 361 Ca 0.17 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 3inj h LYS 361 Cb 0.26 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 3inj h LYS 361 CO -0.37 0.75 0.20 1.96 -0.57 0.00 0.00 179.45 181.41 3inj h GLN 362 N 1.15 0.95 -0.52 3.15 1.08 -0.14 -2.91 115.11 117.86 3inj h GLN 362 Ca 0.31 -0.18 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 3inj h GLN 362 Cb -0.12 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.16 3inj h GLN 362 CO -0.07 0.81 0.00 -0.85 -0.95 0.00 0.00 178.83 177.78 3inj n GLU 363 N -4.28 2.32 -0.36 1.46 0.28 -0.56 -4.93 120.64 114.58 3inj n GLU 363 Ca 0.05 -1.78 0.00 0.00 -0.16 0.00 0.00 57.16 55.27 3inj n GLU 363 Cb 0.21 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.62 3inj n GLU 363 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3inj n GLY 364 N 1.15 0.79 3.77 -1.84 0.00 -1.10 -5.02 105.19 102.94 3inj n GLY 364 Ca 0.16 -0.28 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 3inj n GLY 364 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3inj s ALA 365 N -2.00 3.25 -0.52 4.61 0.00 -0.81 -4.99 121.76 121.31 3inj s ALA 365 Ca 0.00 0.62 -0.26 0.00 0.00 0.00 0.00 51.96 52.33 3inj s ALA 365 Cb 0.00 -3.22 0.03 0.00 0.00 0.00 0.00 23.12 19.93 3inj s ALA 365 CO 0.00 0.09 1.00 0.21 0.00 0.00 0.00 175.76 177.05 3inj s LYS 366 N -1.80 3.46 -0.21 0.00 2.20 -0.72 -4.53 119.74 118.15 3inj s LYS 366 Ca 0.48 0.04 -0.29 0.00 -0.36 0.00 0.00 55.97 55.84 3inj s LYS 366 Cb -0.23 -3.99 -0.03 0.00 -1.51 0.00 0.00 37.83 32.08 3inj s LYS 366 CO 0.29 -1.42 1.56 -1.17 -0.36 0.00 0.00 175.35 174.25 3inj s LEU 367 N 4.10 3.96 -0.10 5.43 2.96 -1.26 -0.91 118.68 132.85 3inj s LEU 367 Ca 0.36 1.64 0.20 0.00 -0.22 0.00 0.00 54.13 56.12 3inj s LEU 367 Cb -0.10 -3.53 -0.30 0.00 0.50 0.00 0.00 46.19 42.75 3inj s LEU 367 CO 0.24 -1.17 0.31 0.18 -1.32 0.00 0.00 176.35 174.58 3inj n LEU 368 N 8.10 0.00 -3.53 -0.68 4.77 0.43 -4.98 117.00 121.11 3inj n LEU 368 Ca 0.18 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.07 3inj n LEU 368 Cb 0.45 0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.74 3inj n LEU 368 CO 0.64 0.21 0.59 0.00 -1.33 0.00 0.00 177.39 177.50 3inj n GLY 370 N -0.32 3.01 0.18 0.00 0.00 -1.25 -2.94 105.19 103.85 3inj n GLY 370 Ca -0.11 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 0.75 0.00 -0.02 0.00 -1.26 -5.01 105.19 99.66 3inj n GLY 371 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3inj n GLY 371 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3inj n GLY 372 N -2.04 3.49 3.72 -0.02 0.00 -1.26 -4.93 105.19 104.15 3inj n GLY 372 Ca 0.00 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 3inj n GLY 372 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3inj s ILE 373 N -2.26 4.89 -0.96 -0.61 1.01 -1.26 -0.71 121.20 121.29 3inj s ILE 373 Ca 0.00 1.83 0.23 0.00 0.00 0.00 0.00 60.65 62.71 3inj s ILE 373 Cb 0.00 -4.22 -0.11 0.00 0.01 0.00 0.00 42.46 38.15 3inj s ILE 373 CO 0.00 0.22 1.16 0.00 0.00 0.00 0.00 174.94 176.31 3inj n ALA 374 N 3.69 4.06 -3.82 9.38 0.00 -0.42 -4.77 120.51 128.63 3inj n ALA 374 Ca 0.03 -0.46 -0.07 0.00 0.00 0.00 0.00 53.44 52.93 3inj n ALA 374 Cb 0.51 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.99 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 -3.02 -1.09 -0.23 0.00 0.00 -1.26 -4.99 121.76 111.18 3inj s ALA 375 Ca 0.09 -0.41 -0.18 0.00 0.00 0.00 0.00 51.96 51.46 3inj s ALA 375 Cb 0.17 0.83 -0.17 0.00 0.00 0.00 0.00 23.12 23.94 3inj s ALA 375 CO 0.78 -1.02 0.05 -0.40 0.00 0.00 0.00 175.76 175.17 3inj n ASP 376 N -0.61 1.91 -4.83 0.00 5.75 -1.26 -4.77 116.55 112.73 3inj n ASP 376 Ca -0.05 0.37 -0.33 0.00 -0.01 0.00 0.00 54.79 54.78 3inj n ASP 376 Cb 0.59 -0.90 -0.05 0.00 -1.03 0.00 0.00 41.12 39.73 3inj n ASP 376 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3inj s ARG 377 N -2.42 4.06 1.77 0.11 1.81 -1.26 -4.86 118.95 118.15 3inj s ARG 377 Ca -0.32 1.05 0.00 0.00 -1.72 0.00 0.00 55.73 54.75 3inj s ARG 377 Cb 0.09 -2.15 0.00 0.00 -0.45 0.00 0.00 34.95 32.43 3inj s ARG 377 CO 0.57 -0.18 0.00 0.41 -0.68 0.00 0.00 175.30 175.43 3inj n GLY 378 N -1.08 -1.30 2.65 -3.53 0.00 -1.16 -4.59 105.19 96.17 3inj n GLY 378 Ca 0.07 -1.24 -0.24 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.30 2.69 -3.42 1.61 4.02 -0.76 -4.89 117.16 116.10 3inj n TYR 379 Ca 0.00 -3.94 -0.38 0.00 -0.01 0.00 0.00 57.90 53.58 3inj n TYR 379 Cb 0.00 -0.47 -0.06 0.00 -0.02 0.00 0.00 39.34 38.79 3inj n TYR 379 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 3inj s PHE 380 N -3.01 3.56 -0.05 -0.72 0.40 -1.26 -0.84 117.98 116.05 3inj s PHE 380 Ca 0.45 0.84 0.06 0.00 -0.60 0.00 0.00 56.93 57.68 3inj s PHE 380 Cb 0.29 -2.43 -0.01 0.00 0.51 0.00 0.00 43.02 41.38 3inj s PHE 380 CO -0.11 0.31 -0.23 0.42 0.70 0.00 0.00 175.22 176.30 3inj s ILE 381 N 0.15 1.92 0.25 0.64 1.01 -1.26 -1.30 121.20 122.60 3inj s ILE 381 Ca 0.23 -1.00 -0.31 0.00 0.00 0.00 0.00 60.65 59.57 3inj s ILE 381 Cb -0.15 -1.62 -0.11 0.00 0.01 0.00 0.00 42.46 40.59 3inj s ILE 381 CO 0.09 0.54 1.62 -1.10 0.00 0.00 0.00 174.94 176.09 3inj s GLN 382 N -0.19 4.14 0.14 2.79 -0.21 0.11 -4.74 119.66 121.71 3inj s GLN 382 Ca -0.02 2.54 -0.35 0.00 0.02 0.00 0.00 55.36 57.56 3inj s GLN 382 Cb -0.13 -3.06 -0.15 0.00 1.00 0.00 0.00 33.01 30.68 3inj s GLN 382 CO 0.03 -0.65 1.50 -2.30 -2.12 0.00 0.00 175.29 171.75 3inj n PRO 383 N 2.93 1.85 -4.87 2.91 -0.02 -1.26 -4.34 135.00 132.20 3inj n PRO 383 Ca 0.11 0.67 -0.26 0.00 -2.02 0.00 0.00 63.50 62.00 3inj n PRO 383 Cb 0.37 -2.40 -0.16 0.00 -0.02 0.00 0.00 33.50 31.30 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 0.77 1.44 -0.10 3.45 2.01 -0.27 -3.88 115.64 119.07 3inj s THR 384 Ca 0.80 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 62.04 3inj s THR 384 Cb -0.76 -1.22 0.02 0.00 0.01 0.00 0.00 72.50 70.56 3inj s THR 384 CO 0.41 0.41 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.96 3inj s VAL 385 N -0.27 1.09 -0.13 3.82 1.01 -1.15 -0.68 120.40 124.09 3inj s VAL 385 Ca 0.03 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 3inj s VAL 385 Cb -0.09 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 3inj s VAL 385 CO 0.00 0.37 0.07 -0.36 0.00 0.00 0.00 175.10 175.18 3inj s PHE 386 N 1.40 3.33 0.32 5.22 0.40 0.09 -0.43 117.98 128.32 3inj s PHE 386 Ca -0.01 0.27 0.10 0.00 -0.60 0.00 0.00 56.93 56.69 3inj s PHE 386 Cb -0.13 -1.93 -0.06 0.00 0.51 0.00 0.00 43.02 41.41 3inj s PHE 386 CO -0.05 0.46 -0.10 0.20 0.70 0.00 0.00 175.22 176.43 3inj s GLY 387 N -0.55 2.08 -1.35 4.36 0.00 -0.09 -1.21 107.32 110.57 3inj s GLY 387 Ca 0.11 -2.00 -0.04 0.00 0.00 0.00 0.00 44.72 42.79 3inj s GLY 387 CO 0.02 -1.98 0.48 1.22 0.00 0.00 0.00 173.10 172.84 3inj n ASP 388 N -0.78 -5.45 -4.76 1.64 8.00 -0.91 -1.75 116.55 112.54 3inj n ASP 388 Ca -0.05 -0.23 -0.40 0.00 0.71 0.00 0.00 54.79 54.83 3inj n ASP 388 Cb 0.62 -4.31 -0.04 0.00 -0.02 0.00 0.00 41.12 37.37 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 -3.07 3.59 0.16 2.53 1.01 -0.62 -4.71 120.40 119.29 3inj s VAL 389 Ca 0.24 1.55 0.08 0.00 0.00 0.00 0.00 61.98 63.85 3inj s VAL 389 Cb -0.11 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 3inj s VAL 389 CO 0.29 0.33 -0.05 -1.10 0.00 0.00 0.00 175.10 174.57 3inj s GLN 390 N -1.54 2.24 0.35 2.72 -1.52 -1.26 -4.51 119.66 116.13 3inj s GLN 390 Ca 0.46 -1.13 0.04 0.00 -1.95 0.00 0.00 55.36 52.78 3inj s GLN 390 Cb -0.30 -2.29 0.68 0.00 -0.22 0.00 0.00 33.01 30.88 3inj s GLN 390 CO 0.38 0.46 1.96 -0.44 -0.25 0.00 0.00 175.29 177.40 3inj h ASP 391 N 3.01 0.72 0.96 5.90 3.32 -1.96 -2.15 116.42 126.22 3inj h ASP 391 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3inj h ASP 391 Cb 1.19 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.59 3inj h ASP 391 CO 0.56 0.47 0.00 0.61 -1.72 0.00 0.00 179.24 179.16 3inj n GLY 392 N -1.44 -1.40 3.76 2.75 0.00 -1.26 -4.55 105.19 103.06 3inj n GLY 392 Ca 0.11 0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.17 3.30 0.22 1.61 -1.94 -0.81 -4.94 119.30 113.58 3inj s MET 393 Ca 0.08 1.86 -0.05 0.00 -1.71 0.00 0.00 55.69 55.86 3inj s MET 393 Cb 0.11 -2.15 0.19 0.00 2.01 0.00 0.00 34.83 35.00 3inj s MET 393 CO 0.45 -0.95 1.67 1.15 -0.01 0.00 0.00 175.02 177.34 3inj h THR 394 N 1.35 1.26 0.00 2.05 2.02 -1.88 -1.69 112.91 116.01 3inj h THR 394 Ca -0.50 -1.17 0.00 0.00 0.77 0.00 0.00 66.41 65.50 3inj h THR 394 Cb 1.28 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 3inj h THR 394 CO 0.57 0.41 0.00 0.16 0.37 0.00 0.00 175.52 177.03 3inj h ILE 395 N 0.80 0.00 0.00 3.11 3.07 -1.91 -0.65 117.51 121.93 3inj h ILE 395 Ca 0.14 -0.26 0.00 0.00 1.55 0.00 0.00 64.86 66.28 3inj h ILE 395 Cb 0.59 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.18 3inj h ILE 395 CO 0.04 0.00 -0.59 0.00 -1.05 0.00 0.00 178.15 176.55 3inj n ALA 396 N -1.86 3.09 -0.06 0.16 0.00 -0.67 -4.50 120.51 116.67 3inj n ALA 396 Ca 0.01 -0.28 -0.09 0.00 0.00 0.00 0.00 53.44 53.08 3inj n ALA 396 Cb 0.22 -1.16 -0.06 0.00 0.00 0.00 0.00 19.45 18.45 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 -1.92 0.30 -3.88 0.00 5.02 -0.69 -4.98 118.16 112.01 3inj n LYS 397 Ca 0.04 0.08 -0.35 0.00 -2.02 0.00 0.00 58.31 56.06 3inj n LYS 397 Cb 0.41 -1.20 -0.05 0.00 -0.02 0.00 0.00 35.03 34.17 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 -2.24 3.46 -0.01 1.97 2.02 -0.34 -4.83 118.70 118.73 3inj s GLU 398 Ca -0.17 -0.23 -0.30 0.00 0.02 0.00 0.00 54.97 54.30 3inj s GLU 398 Cb 0.05 -3.13 -0.06 0.00 0.10 0.00 0.00 34.13 31.09 3inj s GLU 398 CO 0.27 0.71 1.64 -2.00 0.02 0.00 0.00 175.26 175.90 3inj s GLU 399 N -1.61 4.19 -0.11 1.61 2.12 -1.26 -4.81 118.70 118.83 3inj s GLU 399 Ca 0.23 2.22 0.01 0.00 0.36 0.00 0.00 54.97 57.79 3inj s GLU 399 Cb -0.12 -3.86 -0.24 0.00 0.26 0.00 0.00 34.13 30.16 3inj s GLU 399 CO 0.13 -0.80 0.41 -0.89 -0.54 0.00 0.00 175.26 173.57 3inj n ILE 400 N 5.21 1.69 -3.01 -3.70 5.41 -1.26 -4.99 119.36 118.71 3inj n ILE 400 Ca 0.17 -0.70 -0.20 0.00 1.00 0.00 0.00 62.75 63.01 3inj n ILE 400 Cb 0.42 -1.43 0.04 0.00 -0.71 0.00 0.00 39.64 37.96 3inj n ILE 400 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 3inj n PHE 401 N -3.29 -1.87 -4.17 1.39 7.35 -1.26 -4.71 117.46 110.89 3inj n PHE 401 Ca -0.28 0.53 -0.16 0.00 -0.76 0.00 0.00 57.45 56.78 3inj n PHE 401 Cb 1.05 -4.22 -0.07 0.00 0.35 0.00 0.00 39.48 36.60 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 -2.81 1.72 -1.33 7.13 0.00 -1.22 -4.25 107.32 106.56 3inj s GLY 402 Ca 0.31 -1.70 -0.13 0.00 0.00 0.00 0.00 44.72 43.20 3inj s GLY 402 CO 0.38 -1.21 2.41 -1.55 0.00 0.00 0.00 173.10 173.13 3inj n PRO 403 N -0.52 2.81 -3.89 2.90 -0.04 -1.19 -4.48 135.00 130.59 3inj n PRO 403 Ca 0.03 -2.18 -0.29 0.00 -0.04 0.00 0.00 63.50 61.03 3inj n PRO 403 Cb 0.63 -2.94 -0.16 0.00 -0.04 0.00 0.00 33.50 30.98 3inj n PRO 403 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3inj s VAL 404 N 3.16 1.21 -0.09 0.52 1.01 -1.26 -1.11 120.40 123.84 3inj s VAL 404 Ca 0.55 -0.88 -0.12 0.00 0.00 0.00 0.00 61.98 61.53 3inj s VAL 404 Cb 0.15 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 3inj s VAL 404 CO -0.04 -0.03 0.27 -0.32 0.00 0.00 0.00 175.10 174.99 3inj s MET 405 N 1.56 3.85 -0.18 2.72 1.75 0.14 -4.97 119.30 124.18 3inj s MET 405 Ca -0.02 0.12 -0.02 0.00 -1.25 0.00 0.00 55.69 54.52 3inj s MET 405 Cb -0.17 -3.27 -0.01 0.00 2.84 0.00 0.00 34.83 34.22 3inj s MET 405 CO -0.07 0.58 -0.10 -0.65 -0.65 0.00 0.00 175.02 174.13 3inj s GLN 406 N -0.59 3.33 -0.17 4.11 1.11 -1.25 -0.73 119.66 125.47 3inj s GLN 406 Ca 0.18 -0.68 -0.00 0.00 0.01 0.00 0.00 55.36 54.87 3inj s GLN 406 Cb -0.14 -2.78 0.00 0.00 -1.01 0.00 0.00 33.01 29.08 3inj s GLN 406 CO 0.07 -0.02 -0.15 0.42 0.01 0.00 0.00 175.29 175.62 3inj s ILE 407 N 0.96 2.64 0.07 1.08 1.01 -0.35 -0.58 121.20 126.03 3inj s ILE 407 Ca -0.02 -0.77 0.09 0.00 0.00 0.00 0.00 60.65 59.95 3inj s ILE 407 Cb -0.15 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.17 3inj s ILE 407 CO -0.01 0.51 -0.23 -0.76 0.00 0.00 0.00 174.94 174.45 3inj s LEU 408 N 0.97 2.21 -0.13 2.97 1.02 -0.08 -1.59 118.68 124.06 3inj s LEU 408 Ca -0.02 -0.60 -0.07 0.00 0.02 0.00 0.00 54.13 53.45 3inj s LEU 408 Cb -0.15 -1.07 -0.04 0.00 0.02 0.00 0.00 46.19 44.95 3inj s LEU 408 CO -0.03 0.17 0.11 -0.75 0.02 0.00 0.00 176.35 175.87 3inj s LYS 409 N -1.46 3.56 0.16 1.70 2.20 -1.26 -1.44 119.74 123.20 3inj s LYS 409 Ca 0.09 -0.21 0.02 0.00 -0.36 0.00 0.00 55.97 55.52 3inj s LYS 409 Cb -0.09 -3.18 -0.05 0.00 -1.51 0.00 0.00 37.83 33.00 3inj s LYS 409 CO 0.03 0.64 -0.02 -0.59 -0.36 0.00 0.00 175.35 175.05 3inj s PHE 410 N -0.64 1.20 -0.09 4.03 -0.12 -1.13 -4.92 117.98 116.31 3inj s PHE 410 Ca 0.12 -0.97 -0.10 0.00 -0.05 0.00 0.00 56.93 55.93 3inj s PHE 410 Cb -0.12 -0.68 -0.05 0.00 -0.63 0.00 0.00 43.02 41.55 3inj s PHE 410 CO 0.02 -0.16 -0.20 1.17 -0.05 0.00 0.00 175.22 175.99 3inj n LYS 411 N -0.22 0.32 -4.28 1.99 4.81 -1.26 -0.91 118.16 118.61 3inj n LYS 411 Ca -0.07 0.13 -0.27 0.00 -0.87 0.00 0.00 58.31 57.23 3inj n LYS 411 Cb 0.63 -1.05 -0.09 0.00 0.02 0.00 0.00 35.03 34.54 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 -2.46 3.27 0.43 3.15 -4.23 -1.26 -4.76 115.64 109.78 3inj s THR 412 Ca -0.19 -1.62 0.15 0.00 -1.18 0.00 0.00 61.69 58.86 3inj s THR 412 Cb 0.04 -2.62 0.18 0.00 1.34 0.00 0.00 72.50 71.44 3inj s THR 412 CO 0.26 -0.11 1.97 -0.29 -0.54 0.00 0.00 174.62 175.91 3inj h ILE 413 N 2.71 1.10 -0.13 2.99 2.10 -1.99 -0.58 117.51 123.70 3inj h ILE 413 Ca -0.47 -0.75 -0.23 0.00 1.08 0.00 0.00 64.86 64.49 3inj h ILE 413 Cb 1.20 1.41 0.01 0.00 -1.09 0.00 0.00 36.82 38.36 3inj h ILE 413 CO 0.55 0.21 -0.81 -0.33 -1.08 0.00 0.00 178.15 176.69 3inj h GLU 414 N 0.00 0.77 0.16 2.19 3.07 -2.01 -2.86 114.58 115.90 3inj h GLU 414 Ca -0.00 -0.65 -0.01 0.00 -0.50 0.00 0.00 59.36 58.20 3inj h GLU 414 Cb 0.39 0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 3inj h GLU 414 CO 0.03 1.25 -0.08 1.49 -1.40 0.00 0.00 179.01 180.30 3inj h GLU 415 N 0.51 -0.20 0.00 2.33 4.81 -1.81 -3.15 114.58 117.07 3inj h GLU 415 Ca -0.06 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 3inj h GLU 415 Cb 1.44 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.86 3inj h GLU 415 CO 0.16 -0.11 -0.15 -0.24 -0.73 0.00 0.00 179.01 177.94 3inj h VAL 416 N -0.24 1.07 -0.34 0.32 3.04 -1.15 -1.95 116.25 117.02 3inj h VAL 416 Ca -0.02 -0.51 -0.01 0.00 -1.01 0.00 0.00 66.70 65.14 3inj h VAL 416 Cb 0.18 1.28 -0.02 0.00 -2.01 0.00 0.00 31.29 30.73 3inj h VAL 416 CO 0.04 0.15 0.15 0.58 -1.01 0.00 0.00 177.57 177.47 3inj h VAL 417 N 0.00 1.17 -0.52 1.51 2.07 -1.46 -0.05 116.25 118.97 3inj h VAL 417 Ca -0.00 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 66.96 3inj h VAL 417 Cb 0.27 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 3inj h VAL 417 CO 0.02 0.18 0.06 1.23 0.02 0.00 0.00 177.57 179.08 3inj h GLY 418 N 0.40 0.94 0.95 2.17 0.00 -1.35 -1.65 103.07 104.54 3inj h GLY 418 Ca 0.11 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.69 3inj h GLY 418 CO -0.01 0.60 -0.23 3.21 0.00 0.00 0.00 176.54 180.10 3inj h ARG 419 N 0.75 0.68 -0.75 4.80 3.08 -1.39 -0.71 114.38 120.85 3inj h ARG 419 Ca 0.15 -0.34 0.03 0.00 0.07 0.00 0.00 59.98 59.90 3inj h ARG 419 Cb 0.43 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.44 3inj h ARG 419 CO 0.01 0.94 0.48 0.00 -1.07 0.00 0.00 179.97 180.33 3inj h ALA 420 N 0.73 0.98 0.00 0.04 0.00 -0.97 -2.75 119.26 117.28 3inj h ALA 420 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3inj h ALA 420 Cb 0.79 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3inj h ALA 420 CO 0.06 0.28 0.00 -0.91 0.00 0.00 0.00 179.25 178.68 3inj h ASN 421 N 0.93 0.00 -0.06 0.00 2.35 -1.14 -3.39 115.58 114.27 3inj h ASN 421 Ca 0.30 0.00 -0.69 0.00 -0.55 0.00 0.00 56.30 55.35 3inj h ASN 421 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 3inj h ASN 421 CO -0.11 0.00 2.90 -3.20 -1.65 0.00 0.00 177.43 175.38 3inj n ASN 422 N -2.30 3.68 -3.73 5.81 5.15 -0.29 -4.83 115.26 118.75 3inj n ASN 422 Ca 0.05 -2.81 -0.13 0.00 -0.60 0.00 0.00 54.58 51.09 3inj n ASN 422 Cb 0.43 -1.57 -0.08 0.00 -0.53 0.00 0.00 39.78 38.03 3inj n ASN 422 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3inj s SER 423 N 3.64 -0.23 0.00 1.20 0.15 -1.26 -5.01 113.70 112.18 3inj s SER 423 Ca 0.50 0.10 0.29 0.00 0.70 0.00 0.00 55.95 57.54 3inj s SER 423 Cb 0.13 0.35 1.23 0.00 -1.71 0.00 0.00 66.02 66.02 3inj s SER 423 CO -0.04 -0.50 1.88 0.35 1.20 0.00 0.00 173.24 176.13 3inj n THR 424 N 1.09 0.00 -3.62 6.45 -2.24 -1.26 -4.83 114.28 109.88 3inj n THR 424 Ca -0.21 -0.03 -0.20 0.00 -2.27 0.00 0.00 64.05 61.34 3inj n THR 424 Cb 0.57 -0.24 -0.01 0.00 -2.10 0.00 0.00 70.33 68.55 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 -2.66 3.28 -0.28 4.78 1.51 -1.26 -1.35 117.35 121.37 3inj s TYR 425 Ca 0.24 -0.07 0.06 0.00 -1.01 0.00 0.00 57.07 56.29 3inj s TYR 425 Cb 0.20 -1.85 0.23 0.00 -0.11 0.00 0.00 41.96 40.43 3inj s TYR 425 CO 0.51 0.15 1.16 0.41 -1.11 0.00 0.00 175.55 176.66 3inj n GLY 426 N -1.59 0.53 0.09 0.71 0.00 -1.23 -4.86 105.19 98.84 3inj n GLY 426 Ca -0.04 -0.08 -0.16 0.00 0.00 0.00 0.00 46.02 45.74 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 1.09 0.23 -8.26 0.99 5.85 -1.82 -0.83 115.31 112.56 3inj h LEU 427 Ca -0.35 -0.86 -0.09 0.00 0.84 0.00 0.00 57.88 57.42 3inj h LEU 427 Cb 1.22 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 42.11 3inj h LEU 427 CO -0.13 1.07 -0.07 0.00 -0.34 0.00 0.00 178.44 178.97 3inj s ALA 428 N -2.78 -0.16 0.12 1.25 0.00 -1.26 -2.28 121.76 116.65 3inj s ALA 428 Ca -0.16 -0.95 -0.25 0.00 0.00 0.00 0.00 51.96 50.59 3inj s ALA 428 Cb -0.00 1.03 0.07 0.00 0.00 0.00 0.00 23.12 24.22 3inj s ALA 428 CO 0.75 -0.87 0.83 0.00 0.00 0.00 0.00 175.76 176.47 3inj s ALA 429 N -3.64 -1.64 0.03 0.00 0.00 0.43 -3.94 121.76 113.00 3inj s ALA 429 Ca 0.23 0.46 -0.08 0.00 0.00 0.00 0.00 51.96 52.56 3inj s ALA 429 Cb -0.01 0.64 -0.00 0.00 0.00 0.00 0.00 23.12 23.74 3inj s ALA 429 CO 0.11 -0.86 0.16 0.00 0.00 0.00 0.00 175.76 175.17 3inj s ALA 430 N -3.41 -0.27 -0.06 0.00 0.00 -0.58 -0.79 121.76 116.65 3inj s ALA 430 Ca 0.07 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.69 3inj s ALA 430 Cb -0.02 0.25 0.02 0.00 0.00 0.00 0.00 23.12 23.38 3inj s ALA 430 CO -0.04 -0.33 -0.04 0.08 0.00 0.00 0.00 175.76 175.43 3inj s VAL 431 N -2.44 0.55 -0.24 0.00 1.01 -0.02 -0.66 120.40 118.60 3inj s VAL 431 Ca -0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 3inj s VAL 431 Cb -0.02 -0.60 0.01 0.00 0.00 0.00 0.00 36.38 35.77 3inj s VAL 431 CO -0.03 0.25 -0.04 -0.36 0.00 0.00 0.00 175.10 174.91 3inj s PHE 432 N 1.20 3.01 -0.13 5.22 0.40 0.44 -0.81 117.98 127.32 3inj s PHE 432 Ca -0.06 -1.19 -0.30 0.00 -0.60 0.00 0.00 56.93 54.78 3inj s PHE 432 Cb -0.14 -2.10 0.12 0.00 0.51 0.00 0.00 43.02 41.41 3inj s PHE 432 CO -0.02 -0.63 0.97 -0.08 0.70 0.00 0.00 175.22 176.17 3inj s THR 433 N 1.42 0.00 -0.87 0.64 -1.32 -1.26 -0.98 115.64 113.27 3inj s THR 433 Ca 0.03 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.74 3inj s THR 433 Cb -0.15 -1.00 -0.12 0.00 -1.51 0.00 0.00 72.50 69.71 3inj s THR 433 CO -0.03 0.00 1.09 0.29 -2.21 0.00 0.00 174.62 173.76 3inj n LYS 434 N 0.54 0.10 -2.92 7.08 5.02 -1.21 -4.84 118.16 121.93 3inj n LYS 434 Ca -0.10 -0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 55.78 3inj n LYS 434 Cb 0.59 -1.53 -0.04 0.00 -0.02 0.00 0.00 35.03 34.03 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 -3.30 6.98 0.14 4.39 -1.08 -1.26 -4.97 116.67 117.57 3inj s ASP 435 Ca 0.07 1.19 -0.19 0.00 -0.52 0.00 0.00 52.55 53.11 3inj s ASP 435 Cb 0.16 -2.45 0.00 0.00 -1.46 0.00 0.00 42.92 39.18 3inj s ASP 435 CO 0.80 -0.33 1.71 0.25 0.52 0.00 0.00 175.17 178.12 3inj h LEU 436 N 7.89 -0.16 -0.29 -1.34 5.85 -2.00 -1.82 115.31 123.44 3inj h LEU 436 Ca -0.33 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.41 3inj h LEU 436 Cb 1.15 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 3inj h LEU 436 CO 0.81 -0.05 -0.03 0.44 -0.34 0.00 0.00 178.44 179.27 3inj h ASP 437 N 0.04 0.53 -0.99 1.25 3.45 -1.99 -1.55 116.42 117.16 3inj h ASP 437 Ca 0.12 -0.34 0.07 0.00 0.43 0.00 0.00 57.03 57.32 3inj h ASP 437 Cb 0.17 -0.14 -0.07 0.00 -0.56 0.00 0.00 39.33 38.73 3inj h ASP 437 CO -0.23 0.74 0.64 0.11 -1.57 0.00 0.00 179.24 178.93 3inj h LYS 438 N 0.30 1.10 0.37 3.56 1.57 -1.97 0.89 116.57 122.39 3inj h LYS 438 Ca 0.08 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3inj h LYS 438 Cb 0.49 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.56 3inj h LYS 438 CO 0.02 0.72 -0.18 0.00 -0.57 0.00 0.00 179.45 179.45 3inj h ALA 439 N 1.46 -0.50 -0.33 3.86 0.00 -0.99 -2.07 119.26 120.70 3inj h ALA 439 Ca 0.44 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 3inj h ALA 439 Cb 0.22 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3inj h ALA 439 CO -0.19 -0.73 -0.11 -0.91 0.00 0.00 0.00 179.25 177.30 3inj h ASN 440 N -0.60 0.56 -0.01 0.00 2.35 -1.05 -0.94 115.58 115.89 3inj h ASN 440 Ca -0.05 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.55 3inj h ASN 440 Cb 0.44 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.66 3inj h ASN 440 CO 0.08 0.71 0.01 0.22 -1.65 0.00 0.00 177.43 176.80 3inj h TYR 441 N 0.53 0.02 -0.09 1.19 3.20 -0.80 -2.79 116.97 118.23 3inj h TYR 441 Ca 0.10 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.86 3inj h TYR 441 Cb 0.51 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.78 3inj h TYR 441 CO 0.02 0.08 -0.36 -0.07 -1.64 0.00 0.00 178.16 176.18 3inj h LEU 442 N -0.05 0.47 -1.19 2.82 3.38 -1.24 -2.13 115.31 117.37 3inj h LEU 442 Ca 0.00 -0.64 0.09 0.00 0.09 0.00 0.00 57.88 57.43 3inj h LEU 442 Cb 0.07 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 3inj h LEU 442 CO -0.00 1.03 0.58 0.77 0.09 0.00 0.00 178.44 180.90 3inj h SER 443 N -0.06 0.81 -0.29 -0.43 4.64 -1.25 0.21 113.55 117.18 3inj h SER 443 Ca -0.02 0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 3inj h SER 443 Cb 1.01 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.94 3inj h SER 443 CO 0.08 0.49 -0.41 -0.61 -0.87 0.00 0.00 176.83 175.51 3inj h GLN 444 N 0.90 0.79 0.00 4.77 4.15 -1.49 -3.35 115.11 120.89 3inj h GLN 444 Ca 0.41 -0.46 -0.13 0.00 0.77 0.00 0.00 58.65 59.24 3inj h GLN 444 Cb 0.38 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 3inj h GLN 444 CO -0.17 1.09 -0.63 0.00 -1.93 0.00 0.00 178.83 177.19 3inj h ALA 445 N 0.69 0.62 -2.45 3.38 0.00 -0.57 -3.45 119.26 117.48 3inj h ALA 445 Ca 0.03 -0.55 -0.54 0.00 0.00 0.00 0.00 54.91 53.85 3inj h ALA 445 Cb 1.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3inj h ALA 445 CO 0.09 0.75 0.64 -0.51 0.00 0.00 0.00 179.25 180.22 3inj s LEU 446 N -6.47 4.35 -1.21 0.00 1.43 -0.04 -4.94 118.68 111.80 3inj s LEU 446 Ca 0.03 2.04 -0.14 0.00 -1.03 0.00 0.00 54.13 55.04 3inj s LEU 446 Cb 0.08 -3.57 0.17 0.00 0.03 0.00 0.00 46.19 42.90 3inj s LEU 446 CO 0.76 -0.55 1.43 -1.10 0.23 0.00 0.00 176.35 177.13 3inj s GLN 447 N 1.41 4.09 -0.06 1.70 -0.21 -1.26 -4.93 119.66 120.41 3inj s GLN 447 Ca 0.60 -2.59 -0.15 0.00 0.02 0.00 0.00 55.36 53.23 3inj s GLN 447 Cb -0.30 -5.06 0.03 0.00 1.00 0.00 0.00 33.01 28.68 3inj s GLN 447 CO 0.28 -1.76 0.35 0.00 -2.12 0.00 0.00 175.29 172.04 3inj s ALA 448 N 1.55 -0.89 0.37 6.09 0.00 -1.26 -4.56 121.76 123.06 3inj s ALA 448 Ca 0.43 0.62 0.07 0.00 0.00 0.00 0.00 51.96 53.07 3inj s ALA 448 Cb -0.03 -0.15 0.71 0.00 0.00 0.00 0.00 23.12 23.65 3inj s ALA 448 CO 0.00 -0.24 1.92 0.78 0.00 0.00 0.00 175.76 178.21 3inj h GLY 449 N 4.34 0.45 -6.13 0.00 0.00 -0.84 -3.41 103.07 97.47 3inj h GLY 449 Ca -0.29 -0.25 -0.41 0.00 0.00 0.00 0.00 47.33 46.39 3inj h GLY 449 CO 0.36 0.24 -0.77 -1.59 0.00 0.00 0.00 176.54 174.77 3inj s THR 450 N -4.95 0.55 -0.24 4.70 2.01 -1.05 -4.75 115.64 111.91 3inj s THR 450 Ca -0.07 -0.15 -0.01 0.00 0.31 0.00 0.00 61.69 61.78 3inj s THR 450 Cb 0.16 -0.57 0.03 0.00 0.01 0.00 0.00 72.50 72.13 3inj s THR 450 CO 0.75 0.22 -0.09 -0.69 -0.69 0.00 0.00 174.62 174.12 3inj s VAL 451 N 0.81 2.67 -0.01 3.82 1.01 -1.26 -0.43 120.40 127.01 3inj s VAL 451 Ca -0.11 -1.09 -0.17 0.00 0.00 0.00 0.00 61.98 60.60 3inj s VAL 451 Cb -0.14 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.84 3inj s VAL 451 CO 0.00 0.22 0.48 0.26 0.00 0.00 0.00 175.10 176.06 3inj s TRP 452 N 1.29 3.69 -0.22 5.22 0.51 0.03 -4.97 118.94 124.49 3inj s TRP 452 Ca -0.00 1.05 -0.04 0.00 -2.12 0.00 0.00 56.10 54.99 3inj s TRP 452 Cb -0.17 -2.44 -0.01 0.00 -0.81 0.00 0.00 33.47 30.04 3inj s TRP 452 CO -0.06 0.47 -0.04 0.08 -0.51 0.00 0.00 176.95 176.90 3inj s VAL 453 N -0.54 3.45 -1.70 4.03 1.01 -1.26 -0.84 120.40 124.55 3inj s VAL 453 Ca 0.26 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.78 3inj s VAL 453 Cb -0.17 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.64 3inj s VAL 453 CO 0.14 0.42 0.00 0.59 0.00 0.00 0.00 175.10 176.25 3inj n ASN 454 N 4.75 -4.93 -2.56 3.32 3.02 0.01 -4.94 115.26 113.95 3inj n ASN 454 Ca -0.18 0.25 -0.10 0.00 -0.03 0.00 0.00 54.58 54.52 3inj n ASN 454 Cb 0.51 -4.27 0.00 0.00 -0.61 0.00 0.00 39.78 35.41 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 -3.35 -0.41 -1.51 0.00 5.04 -1.26 -4.72 117.35 111.14 3inj s TYR 456 Ca 0.18 0.52 -0.13 0.00 -2.44 0.00 0.00 57.07 55.20 3inj s TYR 456 Cb -0.03 0.30 0.09 0.00 0.35 0.00 0.00 41.96 42.68 3inj s TYR 456 CO 0.13 -0.59 0.79 -0.25 -1.34 0.00 0.00 175.55 174.30 3inj n ASP 457 N 0.64 -4.30 -4.49 4.32 8.00 -1.26 -4.92 116.55 114.54 3inj n ASP 457 Ca -0.19 -0.70 -0.43 0.00 0.71 0.00 0.00 54.79 54.18 3inj n ASP 457 Cb 0.59 -3.48 -0.06 0.00 -0.02 0.00 0.00 41.12 38.15 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 -3.19 4.80 0.02 2.53 1.01 -1.26 -5.04 120.40 119.27 3inj s VAL 458 Ca 0.60 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.54 3inj s VAL 458 Cb -0.31 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 31.77 3inj s VAL 458 CO 0.74 -0.72 -0.10 -0.36 0.00 0.00 0.00 175.10 174.66 3inj s PHE 459 N 2.87 2.79 -0.05 5.22 0.40 -1.26 -5.10 117.98 122.85 3inj s PHE 459 Ca 0.21 -0.10 -0.04 0.00 -0.60 0.00 0.00 56.93 56.39 3inj s PHE 459 Cb -0.16 -1.56 0.02 0.00 0.51 0.00 0.00 43.02 41.83 3inj s PHE 459 CO 0.17 0.34 0.13 0.20 0.70 0.00 0.00 175.22 176.76 3inj s GLY 460 N -1.47 -0.09 0.63 4.36 0.00 -1.26 -5.00 107.32 104.49 3inj s GLY 460 Ca 0.17 0.40 0.34 0.00 0.00 0.00 0.00 44.72 45.63 3inj s GLY 460 CO 0.07 0.38 2.16 0.00 0.00 0.00 0.00 173.10 175.71 3inj h ALA 461 N 6.08 1.42 0.00 3.20 0.00 -1.95 -1.10 119.26 126.90 3inj h ALA 461 Ca -0.27 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 3inj h ALA 461 Cb 1.19 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3inj h ALA 461 CO 0.43 -0.19 -0.29 1.96 0.00 0.00 0.00 179.25 181.15 3inj h GLN 462 N 0.00 0.00 -5.40 0.00 7.50 -1.94 0.25 115.11 115.52 3inj h GLN 462 Ca 0.03 0.00 -0.65 0.00 0.50 0.00 0.00 58.65 58.53 3inj h GLN 462 Cb 0.35 0.00 -0.24 0.00 0.05 0.00 0.00 27.48 27.64 3inj h GLN 462 CO -0.00 0.29 -0.72 -1.12 -1.50 0.00 0.00 178.83 175.79 3inj s SER 463 N -6.33 4.42 0.74 1.46 0.01 -0.42 -4.03 113.70 109.55 3inj s SER 463 Ca 0.04 -0.21 -0.13 0.00 1.31 0.00 0.00 55.95 56.96 3inj s SER 463 Cb 0.07 -1.64 0.05 0.00 0.21 0.00 0.00 66.02 64.71 3inj s SER 463 CO 0.70 0.19 1.13 -2.16 0.41 0.00 0.00 173.24 173.51 3inj s PRO 464 N 0.24 2.24 -0.09 12.44 0.04 -1.26 -4.32 135.00 144.28 3inj s PRO 464 Ca -0.06 1.43 -0.08 0.00 0.04 0.00 0.00 61.00 62.34 3inj s PRO 464 Cb -0.15 -1.88 0.03 0.00 0.04 0.00 0.00 34.50 32.55 3inj s PRO 464 CO 0.04 -1.69 0.24 0.12 0.04 0.00 0.00 177.00 175.75 3inj s PHE 465 N -2.46 -0.28 0.00 0.56 5.36 0.68 -4.94 117.98 116.90 3inj s PHE 465 Ca 0.67 0.68 0.00 0.00 -0.96 0.00 0.00 56.93 57.32 3inj s PHE 465 Cb -0.22 0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.54 3inj s PHE 465 CO 0.49 -0.15 0.00 0.41 -1.46 0.00 0.00 175.22 174.50 3inj n GLY 466 N 3.25 -0.96 3.87 13.12 0.00 -1.26 -0.78 105.19 122.44 3inj n GLY 466 Ca -0.16 -1.18 -0.27 0.00 0.00 0.00 0.00 46.02 44.41 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 1.80 0.39 -0.02 0.00 -1.26 -3.83 107.32 104.40 3inj s GLY 467 Ca 0.00 -1.07 0.03 0.00 0.00 0.00 0.00 44.72 43.68 3inj s GLY 467 CO 0.00 -1.07 0.56 -0.19 0.00 0.00 0.00 173.10 172.40 3inj s TYR 468 N -1.68 3.20 0.00 1.90 1.51 -0.42 -4.48 117.35 117.38 3inj s TYR 468 Ca 0.33 0.03 0.00 0.00 -1.01 0.00 0.00 57.07 56.42 3inj s TYR 468 Cb -0.11 -2.12 0.00 0.00 -0.11 0.00 0.00 41.96 39.62 3inj s TYR 468 CO 0.26 -0.15 0.00 1.63 -1.11 0.00 0.00 175.55 176.18 3inj n LYS 469 N -1.84 0.00 -0.75 -0.62 5.02 -1.26 -1.94 118.16 116.77 3inj n LYS 469 Ca -0.00 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.33 3inj n LYS 469 Cb 0.58 0.00 0.31 0.00 -0.02 0.00 0.00 35.03 35.90 3inj n LYS 469 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3inj n MET 470 N 14.00 4.00 -0.00 1.97 2.81 -0.46 -3.50 117.12 135.95 3inj n MET 470 Ca 0.00 -2.54 0.14 0.00 -1.81 0.00 0.00 57.70 53.49 3inj n MET 470 Cb 0.00 -2.11 0.54 0.00 -0.71 0.00 0.00 33.22 30.94 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 0.40 1.43 0.00 7.83 7.64 -0.82 -4.47 113.62 125.64 3inj n SER 471 Ca 0.24 -1.48 0.00 0.00 1.01 0.00 0.00 58.87 58.65 3inj n SER 471 Cb 1.05 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.25 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 1.17 0.59 3.20 0.23 0.00 -1.23 -0.69 105.19 108.46 3inj n GLY 472 Ca 0.19 -2.12 -0.09 0.00 0.00 0.00 0.00 46.02 43.99 3inj n GLY 472 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3inj s SER 473 N -4.00 0.09 0.00 1.61 1.04 -0.46 -4.49 113.70 107.49 3inj s SER 473 Ca 0.00 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 55.88 3inj s SER 473 Cb 0.00 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.44 3inj s SER 473 CO 0.00 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.16 3inj n GLY 474 N 0.21 -1.64 3.22 7.32 0.00 -1.26 -2.33 105.19 110.71 3inj n GLY 474 Ca -0.16 -1.55 -0.23 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.18 1.16 0.30 1.61 1.81 -1.26 -4.28 118.95 116.12 3inj s ARG 475 Ca 0.00 -0.92 0.09 0.00 -1.72 0.00 0.00 55.73 53.18 3inj s ARG 475 Cb 0.00 -1.26 -0.05 0.00 -0.45 0.00 0.00 34.95 33.19 3inj s ARG 475 CO 0.00 0.31 0.04 -1.21 -0.68 0.00 0.00 175.30 173.76 3inj s GLU 476 N -1.33 2.26 0.32 3.54 2.02 0.04 -4.01 118.70 121.54 3inj s GLU 476 Ca 0.05 -1.54 0.00 0.00 0.02 0.00 0.00 54.97 53.50 3inj s GLU 476 Cb -0.09 -2.11 0.00 0.00 0.10 0.00 0.00 34.13 32.04 3inj s GLU 476 CO 0.02 0.24 0.00 1.28 0.02 0.00 0.00 175.26 176.82 3inj n LEU 477 N -0.98 -0.53 0.00 1.80 4.77 -1.26 -0.23 117.00 120.57 3inj n LEU 477 Ca -0.05 1.23 0.05 0.00 -0.03 0.00 0.00 56.01 57.20 3inj n LEU 477 Cb 0.60 -1.57 -0.01 0.00 -2.33 0.00 0.00 43.42 40.11 3inj n LEU 477 CO 0.42 -1.10 -0.06 0.61 -1.33 0.00 0.00 177.39 175.93 3inj n GLY 478 N -3.20 -1.65 0.26 -0.72 0.00 0.87 -2.11 105.19 98.63 3inj n GLY 478 Ca -0.05 -1.22 0.04 0.00 0.00 0.00 0.00 46.02 44.80 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 0.22 -0.39 1.61 4.81 -1.87 -2.54 114.58 116.42 3inj h GLU 479 Ca 0.01 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.28 3inj h GLU 479 Cb 0.32 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 3inj h GLU 479 CO 0.00 0.26 0.27 1.88 -0.73 0.00 0.00 179.01 180.69 3inj h TYR 480 N 0.21 0.22 0.00 0.92 -1.99 -1.93 -1.92 116.97 112.48 3inj h TYR 480 Ca 0.05 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.79 3inj h TYR 480 Cb 0.19 -0.07 0.00 0.00 2.00 0.00 0.00 36.73 38.85 3inj h TYR 480 CO 0.00 0.11 0.00 0.41 -0.00 0.00 0.00 178.16 178.69 3inj n GLY 481 N -1.55 -0.90 0.15 3.88 0.00 -0.90 -1.99 105.19 103.88 3inj n GLY 481 Ca 0.05 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.15 0.99 3.38 -1.52 -3.40 115.31 114.61 3inj h LEU 482 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3inj h LEU 482 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3inj h LEU 482 CO 0.00 0.00 0.10 1.56 0.09 0.00 0.00 178.44 180.19 3inj h GLN 483 N 0.00 0.20 0.00 1.13 4.20 -1.54 -2.33 115.11 116.76 3inj h GLN 483 Ca 0.00 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.70 3inj h GLN 483 Cb 1.00 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.73 3inj h GLN 483 CO 0.00 0.14 0.00 0.00 -0.67 0.00 0.00 178.83 178.30 3inj n ALA 484 N -2.14 1.72 -0.41 3.87 0.00 -1.26 -2.27 120.51 120.02 3inj n ALA 484 Ca -0.04 -0.04 0.09 0.00 0.00 0.00 0.00 53.44 53.45 3inj n ALA 484 Cb 0.03 -1.27 0.26 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.59 0.90 -5.24 0.00 4.02 -0.89 -4.88 117.16 109.48 3inj n TYR 485 Ca 0.04 -0.55 -0.30 0.00 -0.01 0.00 0.00 57.90 57.07 3inj n TYR 485 Cb 0.19 -0.09 -0.16 0.00 -0.02 0.00 0.00 39.34 39.26 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 -1.33 1.96 -0.14 -0.72 2.01 -0.96 -2.36 115.64 114.10 3inj s THR 486 Ca 0.40 -1.05 -0.00 0.00 0.31 0.00 0.00 61.69 61.34 3inj s THR 486 Cb 0.23 -1.64 -0.01 0.00 0.01 0.00 0.00 72.50 71.09 3inj s THR 486 CO 0.23 0.55 -0.13 -0.70 -0.69 0.00 0.00 174.62 173.89 3inj s GLU 487 N -0.48 3.36 -0.23 4.92 2.56 0.18 -4.67 118.70 124.33 3inj s GLU 487 Ca 0.07 -0.69 -0.17 0.00 0.00 0.00 0.00 54.97 54.18 3inj s GLU 487 Cb -0.10 -2.67 -0.03 0.00 2.00 0.00 0.00 34.13 33.32 3inj s GLU 487 CO 0.00 0.15 0.44 0.08 -0.56 0.00 0.00 175.26 175.37 3inj s VAL 488 N 0.53 5.14 -0.16 3.70 1.01 -1.26 -1.06 120.40 128.30 3inj s VAL 488 Ca -0.08 0.76 -0.01 0.00 0.00 0.00 0.00 61.98 62.65 3inj s VAL 488 Cb -0.16 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 3inj s VAL 488 CO 0.04 0.17 -0.11 -0.75 0.00 0.00 0.00 175.10 174.45 3inj s LYS 489 N 1.80 3.36 -0.11 2.72 2.20 -0.57 -4.98 119.74 124.15 3inj s LYS 489 Ca 0.19 -0.68 -0.18 0.00 -0.36 0.00 0.00 55.97 54.95 3inj s LYS 489 Cb -0.15 -2.73 -0.04 0.00 -1.51 0.00 0.00 37.83 33.39 3inj s LYS 489 CO 0.09 0.07 0.47 0.99 -0.36 0.00 0.00 175.35 176.60 3inj s THR 490 N 0.73 5.18 -0.19 3.43 2.01 -1.26 -0.21 115.64 125.34 3inj s THR 490 Ca -0.05 0.93 -0.02 0.00 0.31 0.00 0.00 61.69 62.86 3inj s THR 490 Cb -0.15 -3.80 -0.00 0.00 0.01 0.00 0.00 72.50 68.55 3inj s THR 490 CO 0.02 0.34 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.50 3inj s VAL 491 N 0.54 3.01 -0.23 3.82 1.01 0.53 -4.98 120.40 124.09 3inj s VAL 491 Ca 0.25 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.62 3inj s VAL 491 Cb -0.15 -2.33 0.06 0.00 0.00 0.00 0.00 36.38 33.95 3inj s VAL 491 CO 0.10 0.47 -0.08 -0.89 0.00 0.00 0.00 175.10 174.71 3inj s THR 492 N 1.21 1.69 -0.14 3.92 2.01 -1.26 -0.94 115.64 122.13 3inj s THR 492 Ca 0.02 -1.27 -0.03 0.00 0.31 0.00 0.00 61.69 60.72 3inj s THR 492 Cb -0.14 -1.89 -0.03 0.00 0.01 0.00 0.00 72.50 70.45 3inj s THR 492 CO -0.04 -0.03 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.13 3inj s VAL 493 N 1.33 3.84 0.13 3.82 1.01 0.16 -4.94 120.40 125.74 3inj s VAL 493 Ca -0.06 -0.39 -0.31 0.00 0.00 0.00 0.00 61.98 61.23 3inj s VAL 493 Cb -0.19 -2.66 -0.08 0.00 0.00 0.00 0.00 36.38 33.45 3inj s VAL 493 CO -0.06 0.51 1.40 -0.75 0.00 0.00 0.00 175.10 176.20 3inj s LYS 494 N 0.16 4.32 0.18 2.72 2.20 -1.26 -0.62 119.74 127.42 3inj s LYS 494 Ca -0.02 2.10 0.09 0.00 -0.36 0.00 0.00 55.97 57.78 3inj s LYS 494 Cb -0.14 -3.23 -0.04 0.00 -1.51 0.00 0.00 37.83 32.91 3inj s LYS 494 CO 0.03 -0.44 -0.18 0.14 -0.36 0.00 0.00 175.35 174.54 3inj s VAL 495 N 1.00 1.88 0.18 4.02 -7.23 -0.85 -4.87 120.40 114.53 3inj s VAL 495 Ca 0.64 -1.98 -0.12 0.00 -1.81 0.00 0.00 61.98 58.71 3inj s VAL 495 Cb -0.37 -1.90 0.09 0.00 0.56 0.00 0.00 36.38 34.76 3inj s VAL 495 CO 0.31 -0.33 1.80 -0.65 -0.31 0.00 0.00 175.10 175.92 3inj h PRO 496 N 3.14 0.85 -1.07 4.82 0.11 -1.96 -3.43 132.00 134.45 3inj h PRO 496 Ca -0.42 -0.09 0.07 0.00 0.11 0.00 0.00 66.00 65.67 3inj h PRO 496 Cb 1.21 -0.17 -0.22 0.00 0.11 0.00 0.00 31.00 31.93 3inj h PRO 496 CO 0.52 0.63 -0.29 -1.14 -0.21 0.00 0.00 178.00 177.51 3inj s GLN 497 N -5.90 0.55 0.07 1.05 0.74 -1.26 -5.05 119.66 109.87 3inj s GLN 497 Ca -0.13 0.95 -0.31 0.00 0.05 0.00 0.00 55.36 55.93 3inj s GLN 497 Cb 0.13 0.46 -0.06 0.00 1.10 0.00 0.00 33.01 34.64 3inj s GLN 497 CO 0.77 -0.64 1.29 0.21 -0.55 0.00 0.00 175.29 176.38 3inj s LYS 498 N 2.83 4.37 0.08 1.67 2.36 -1.26 -5.04 119.74 124.75 3inj s LYS 498 Ca 0.20 1.90 0.06 0.00 -2.55 0.00 0.00 55.97 55.58 3inj s LYS 498 Cb -0.15 -3.35 -0.03 0.00 -1.05 0.00 0.00 37.83 33.25 3inj s LYS 498 CO -0.21 -0.37 -0.15 -0.80 1.55 0.00 0.00 175.35 175.37 3inj s ASN 499 N 1.20 1.84 0.00 1.43 0.01 -1.26 -5.01 114.94 113.15 3inj s ASN 499 Ca 0.61 -0.65 0.00 0.00 -0.71 0.00 0.00 52.86 52.11 3inj s ASN 499 Cb -0.32 -0.06 0.00 0.00 0.41 0.00 0.00 41.25 41.27 3inj s ASN 499 CO 0.29 -0.07 0.44 -1.54 -1.51 0.00 0.00 177.10 174.71