#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jcn s GLY 11 N 0.00 2.00 0.52 3.41 0.00 -1.26 -4.77 107.32 107.21 1jcn s GLY 11 Ca 0.00 -1.80 -0.17 0.00 0.00 0.00 0.00 44.72 42.75 1jcn s GLY 11 CO 0.00 -1.65 1.00 -0.47 0.00 0.00 0.00 173.10 171.98 1jcn s TYR 12 N -2.41 3.34 -0.06 1.90 5.04 -1.26 -5.03 117.35 118.86 1jcn s TYR 12 Ca 0.45 1.50 -0.06 0.00 -2.44 0.00 0.00 57.07 56.52 1jcn s TYR 12 Cb -0.04 -2.85 -0.02 0.00 0.35 0.00 0.00 41.96 39.40 1jcn s TYR 12 CO 0.27 -0.49 -0.13 0.28 -1.34 0.00 0.00 175.55 174.15 1jcn n VAL 13 N -1.53 0.58 0.00 3.14 0.31 -1.26 -5.04 118.33 114.54 1jcn n VAL 13 Ca 0.07 0.34 0.00 0.00 -0.01 0.00 0.00 64.34 64.74 1jcn n VAL 13 Cb 0.54 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.68 1jcn n VAL 13 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1jcn n PRO 14 N -3.24 2.87 -3.27 5.55 -0.02 -1.26 -4.96 135.00 130.67 1jcn n PRO 14 Ca -0.05 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.00 1jcn n PRO 14 Cb 0.19 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.59 1jcn n PRO 14 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1jcn s GLU 15 N 0.00 3.11 0.00 -0.52 2.56 -1.26 -5.04 118.70 117.55 1jcn s GLU 15 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.97 54.19 1jcn s GLU 15 Cb 0.00 -4.00 0.00 0.00 2.00 0.00 0.00 34.13 32.13 1jcn s GLU 15 CO 0.00 -0.94 0.00 -3.47 -0.56 0.00 0.00 175.26 170.29 1jcn n ASP 16 N 5.74 0.00 0.00 -1.70 4.64 -1.26 -5.11 116.55 118.87 1jcn n ASP 16 Ca -0.07 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.34 1jcn n ASP 16 Cb 0.47 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.55 1jcn n ASP 16 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1jcn n GLY 17 N 3.65 1.83 3.39 0.27 0.00 -1.26 -5.11 105.19 107.95 1jcn n GLY 17 Ca 0.00 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 1jcn n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jcn s LEU 18 N 0.00 2.32 0.73 0.99 1.02 0.23 -4.87 118.68 119.10 1jcn s LEU 18 Ca 0.00 -0.61 -0.12 0.00 0.02 0.00 0.00 54.13 53.42 1jcn s LEU 18 Cb 0.00 -1.32 0.03 0.00 0.02 0.00 0.00 46.19 44.92 1jcn s LEU 18 CO 0.00 0.23 1.12 0.42 0.02 0.00 0.00 176.35 178.14 1jcn s THR 19 N -0.93 3.09 0.24 5.49 -4.23 -1.26 0.87 115.64 118.91 1jcn s THR 19 Ca 0.13 0.35 -0.05 0.00 -1.18 0.00 0.00 61.69 60.94 1jcn s THR 19 Cb -0.10 -3.35 0.15 0.00 1.34 0.00 0.00 72.50 70.54 1jcn s THR 19 CO 0.04 -0.46 1.79 0.00 -0.54 0.00 0.00 174.62 175.45 1jcn h ALA 20 N -0.76 1.10 0.00 3.99 0.00 -1.82 -0.78 119.26 120.98 1jcn h ALA 20 Ca -0.45 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1jcn h ALA 20 Cb 1.27 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1jcn h ALA 20 CO 0.64 0.63 0.00 0.00 0.00 0.00 0.00 179.25 180.52 1jcn n GLN 21 N -4.27 0.20 -0.09 0.00 10.64 -1.26 -1.24 117.38 121.36 1jcn n GLN 21 Ca 0.06 0.42 -0.15 0.00 -1.83 0.00 0.00 57.00 55.51 1jcn n GLN 21 Cb 0.21 -1.87 -0.08 0.00 -0.86 0.00 0.00 30.24 27.63 1jcn n GLN 21 CO 0.00 0.00 0.00 1.96 -1.83 0.00 0.00 177.06 177.19 1jcn h GLN 22 N 0.00 0.00 -0.26 2.61 4.20 -1.74 -3.33 115.11 116.58 1jcn h GLN 22 Ca 0.00 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.77 1jcn h GLN 22 Cb 0.37 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.09 1jcn h GLN 22 CO 0.00 0.67 -0.11 1.25 -0.67 0.00 0.00 178.83 179.97 1jcn h LEU 23 N -1.00 -0.38 -1.38 1.46 5.85 -1.02 -1.69 115.31 117.15 1jcn h LEU 23 Ca -0.18 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1jcn h LEU 23 Cb 0.95 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.20 1jcn h LEU 23 CO -0.11 -0.14 0.00 0.49 -0.34 0.00 0.00 178.44 178.34 1jcn n PHE 24 N -5.28 0.34 -0.39 1.25 3.01 -0.37 -2.82 117.46 113.19 1jcn n PHE 24 Ca -0.01 -0.12 0.00 0.00 1.01 0.00 0.00 57.45 58.34 1jcn n PHE 24 Cb 0.20 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.51 1jcn n PHE 24 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1jcn n ALA 25 N 0.09 1.60 -1.00 4.37 0.00 -0.65 -4.96 120.51 119.96 1jcn n ALA 25 Ca 0.05 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1jcn n ALA 25 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1jcn n ALA 25 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1jcn n SER 26 N -0.27 0.00 0.00 0.00 7.64 -1.13 -4.96 113.62 114.90 1jcn n SER 26 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1jcn n SER 26 Cb 0.32 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 1jcn n SER 26 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jcn n ALA 27 N -3.00 0.05 -2.40 -0.43 0.00 -1.26 -5.09 120.51 108.38 1jcn n ALA 27 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 53.44 53.14 1jcn n ALA 27 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 1jcn n ALA 27 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1jcn s ASP 28 N 0.00 2.84 0.18 0.00 1.01 -1.26 -5.11 116.67 114.32 1jcn s ASP 28 Ca 0.00 -0.54 -0.27 0.00 0.71 0.00 0.00 52.55 52.45 1jcn s ASP 28 Cb 0.00 -0.26 -0.08 0.00 1.01 0.00 0.00 42.92 43.59 1jcn s ASP 28 CO 0.00 0.23 0.83 -1.81 0.21 0.00 0.00 175.17 174.63 1jcn s ASP 29 N -1.10 7.46 0.12 0.27 1.11 -1.26 -4.93 116.67 118.33 1jcn s ASP 29 Ca 0.10 1.72 0.03 0.00 0.18 0.00 0.00 52.55 54.58 1jcn s ASP 29 Cb -0.09 -2.53 -0.04 0.00 1.07 0.00 0.00 42.92 41.33 1jcn s ASP 29 CO 0.01 0.17 0.17 -0.76 1.18 0.00 0.00 175.17 175.95 1jcn s LEU 30 N -1.05 4.04 0.31 1.23 1.02 -1.26 -4.87 118.68 118.10 1jcn s LEU 30 Ca 0.38 0.05 0.08 0.00 0.02 0.00 0.00 54.13 54.65 1jcn s LEU 30 Cb -0.24 -2.65 -0.03 0.00 0.02 0.00 0.00 46.19 43.29 1jcn s LEU 30 CO 0.28 0.11 0.23 0.28 0.02 0.00 0.00 176.35 177.27 1jcn s THR 31 N -1.61 3.74 0.48 5.49 -1.32 -1.26 -1.51 115.64 119.66 1jcn s THR 31 Ca 0.32 -1.45 0.13 0.00 -1.21 0.00 0.00 61.69 59.48 1jcn s THR 31 Cb -0.11 -3.21 0.27 0.00 -1.51 0.00 0.00 72.50 67.95 1jcn s THR 31 CO 0.25 -0.24 2.11 1.88 -2.21 0.00 0.00 174.62 176.41 1jcn h TYR 32 N 1.39 0.18 -0.00 9.09 0.05 -1.95 -1.81 116.97 123.91 1jcn h TYR 32 Ca -0.46 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.33 1jcn h TYR 32 Cb 1.25 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 38.93 1jcn h TYR 32 CO 0.56 0.11 -0.05 0.09 -1.05 0.00 0.00 178.16 177.82 1jcn n ASN 33 N -4.51 0.37 -0.05 3.88 3.02 -1.26 -3.93 115.26 112.78 1jcn n ASN 33 Ca -0.00 -0.73 0.14 0.00 -0.03 0.00 0.00 54.58 53.96 1jcn n ASN 33 Cb 0.10 -0.08 0.60 0.00 -0.61 0.00 0.00 39.78 39.79 1jcn n ASN 33 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1jcn n ASP 34 N -0.89 0.26 -3.64 6.41 8.00 -0.68 -4.90 116.55 121.11 1jcn n ASP 34 Ca 0.18 -0.19 -0.11 0.00 0.71 0.00 0.00 54.79 55.38 1jcn n ASP 34 Cb 0.23 -0.18 -0.04 0.00 -0.02 0.00 0.00 41.12 41.11 1jcn n ASP 34 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1jcn s PHE 35 N -2.69 0.55 0.11 1.24 -0.12 -1.25 -0.87 117.98 114.96 1jcn s PHE 35 Ca 0.23 -0.91 0.04 0.00 -0.05 0.00 0.00 56.93 56.24 1jcn s PHE 35 Cb 0.20 0.18 -0.04 0.00 -0.63 0.00 0.00 43.02 42.73 1jcn s PHE 35 CO 0.51 -1.10 -0.10 -0.51 -0.05 0.00 0.00 175.22 173.97 1jcn s LEU 36 N -3.09 2.45 -0.16 -1.99 1.43 -0.50 -4.94 118.68 111.88 1jcn s LEU 36 Ca 0.24 -0.89 -0.07 0.00 -1.03 0.00 0.00 54.13 52.38 1jcn s LEU 36 Cb -0.01 -0.29 -0.04 0.00 0.03 0.00 0.00 46.19 45.88 1jcn s LEU 36 CO 0.13 -0.30 0.10 -0.63 0.23 0.00 0.00 176.35 175.87 1jcn s ILE 37 N -2.80 5.13 0.07 -0.59 1.01 -1.26 -1.50 121.20 121.26 1jcn s ILE 37 Ca 0.09 0.08 -0.30 0.00 0.00 0.00 0.00 60.65 60.52 1jcn s ILE 37 Cb -0.01 -3.28 -0.05 0.00 0.01 0.00 0.00 42.46 39.14 1jcn s ILE 37 CO -0.00 0.52 0.99 -0.76 0.00 0.00 0.00 174.94 175.68 1jcn s LEU 38 N -0.20 4.45 0.83 2.97 1.02 -0.20 -4.96 118.68 122.58 1jcn s LEU 38 Ca 0.09 1.77 -0.10 0.00 0.02 0.00 0.00 54.13 55.91 1jcn s LEU 38 Cb -0.12 -3.58 0.09 0.00 0.02 0.00 0.00 46.19 42.60 1jcn s LEU 38 CO 0.01 -0.16 1.11 -2.16 0.02 0.00 0.00 176.35 175.16 1jcn s PRO 39 N 0.39 1.78 0.00 1.29 0.04 -1.26 -4.65 135.00 132.59 1jcn s PRO 39 Ca 0.49 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1jcn s PRO 39 Cb -0.23 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1jcn s PRO 39 CO 0.29 -2.00 0.00 0.41 0.04 0.00 0.00 177.00 175.74 1jcn n GLY 40 N -0.76 4.16 3.49 0.56 0.00 -0.50 -4.95 105.19 107.20 1jcn n GLY 40 Ca 0.10 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 1jcn n GLY 40 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1jcn s PHE 41 N 3.68 3.00 -0.23 1.61 5.36 -1.26 -4.85 117.98 125.29 1jcn s PHE 41 Ca 0.00 -0.32 -0.07 0.00 -0.96 0.00 0.00 56.93 55.58 1jcn s PHE 41 Cb 0.00 -1.94 -0.03 0.00 -0.34 0.00 0.00 43.02 40.71 1jcn s PHE 41 CO 0.00 -0.04 0.06 0.42 -1.46 0.00 0.00 175.22 174.21 1jcn s ILE 42 N 0.31 4.39 -0.03 3.12 1.01 -1.26 -4.06 121.20 124.68 1jcn s ILE 42 Ca -0.04 -0.15 0.25 0.00 0.00 0.00 0.00 60.65 60.70 1jcn s ILE 42 Cb -0.14 -3.03 0.43 0.00 0.01 0.00 0.00 42.46 39.74 1jcn s ILE 42 CO 0.03 0.37 1.17 -0.90 0.00 0.00 0.00 174.94 175.62 1jcn n ASP 43 N 4.54 1.10 -3.85 3.58 5.75 -1.26 -5.10 116.55 121.30 1jcn n ASP 43 Ca -0.16 -2.13 -0.08 0.00 -0.01 0.00 0.00 54.79 52.42 1jcn n ASP 43 Cb 0.52 -0.33 -0.03 0.00 -1.03 0.00 0.00 41.12 40.26 1jcn n ASP 43 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1jcn s PHE 44 N -0.46 -0.12 0.20 2.11 -0.71 -1.26 -5.17 117.98 112.57 1jcn s PHE 44 Ca 0.34 -0.31 -0.05 0.00 -1.04 0.00 0.00 56.93 55.87 1jcn s PHE 44 Cb 0.38 0.61 -0.06 0.00 -1.21 0.00 0.00 43.02 42.75 1jcn s PHE 44 CO -0.15 -1.17 0.44 0.96 -1.34 0.00 0.00 175.22 173.96 1jcn s ILE 45 N -3.92 5.11 0.28 -4.49 -4.36 -1.26 -5.00 121.20 107.55 1jcn s ILE 45 Ca 0.12 0.04 0.00 0.00 -0.26 0.00 0.00 60.65 60.55 1jcn s ILE 45 Cb -0.05 -3.66 0.28 0.00 1.25 0.00 0.00 42.46 40.28 1jcn s ILE 45 CO 0.06 -0.09 1.85 0.00 0.24 0.00 0.00 174.94 177.01 1jcn h ALA 46 N 2.41 1.49 0.00 2.27 0.00 -1.98 -0.59 119.26 122.86 1jcn h ALA 46 Ca -0.47 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1jcn h ALA 46 Cb 1.17 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1jcn h ALA 46 CO 0.70 0.29 0.00 -0.40 0.00 0.00 0.00 179.25 179.84 1jcn n ASP 47 N -4.57 0.00 0.01 0.00 5.75 -1.26 -1.42 116.55 115.06 1jcn n ASP 47 Ca 0.18 0.32 0.12 0.00 -0.01 0.00 0.00 54.79 55.40 1jcn n ASP 47 Cb 0.30 -0.37 0.20 0.00 -1.03 0.00 0.00 41.12 40.21 1jcn n ASP 47 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1jcn n GLU 48 N -1.37 0.09 -2.27 0.11 1.02 -0.23 -4.91 120.64 113.08 1jcn n GLU 48 Ca 0.02 0.02 -0.42 0.00 -0.02 0.00 0.00 57.16 56.76 1jcn n GLU 48 Cb 0.05 -1.54 -0.03 0.00 -0.02 0.00 0.00 31.44 29.90 1jcn n GLU 48 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1jcn s VAL 49 N -3.05 3.61 -0.25 2.62 1.01 -0.51 -4.91 120.40 118.92 1jcn s VAL 49 Ca 0.09 1.15 -0.15 0.00 0.00 0.00 0.00 61.98 63.07 1jcn s VAL 49 Cb 0.16 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1jcn s VAL 49 CO 0.72 0.09 0.38 -0.62 0.00 0.00 0.00 175.10 175.66 1jcn s ASP 50 N 1.12 6.31 -0.21 3.32 -1.08 -0.03 -4.96 116.67 121.14 1jcn s ASP 50 Ca 0.62 0.36 0.15 0.00 -0.52 0.00 0.00 52.55 53.16 1jcn s ASP 50 Cb -0.34 -2.21 0.76 0.00 -1.46 0.00 0.00 42.92 39.67 1jcn s ASP 50 CO 0.30 -0.14 1.68 0.18 0.52 0.00 0.00 175.17 177.70 1jcn n LEU 51 N 5.01 5.29 -4.68 -1.34 4.77 -1.26 -2.70 117.00 122.10 1jcn n LEU 51 Ca -0.09 -2.89 -0.45 0.00 -0.03 0.00 0.00 56.01 52.55 1jcn n LEU 51 Cb 0.51 -0.65 -0.04 0.00 -2.33 0.00 0.00 43.42 40.92 1jcn n LEU 51 CO 0.38 0.66 1.17 0.41 -1.33 0.00 0.00 177.39 178.68 1jcn n THR 52 N 0.47 0.22 -3.88 -5.08 -1.04 -1.15 -3.93 114.28 99.89 1jcn n THR 52 Ca 0.26 -0.05 -0.11 0.00 -2.04 0.00 0.00 64.05 62.11 1jcn n THR 52 Cb 1.11 -1.57 -0.12 0.00 -1.82 0.00 0.00 70.33 67.93 1jcn n THR 52 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1jcn s SER 53 N 0.79 0.00 -0.10 8.00 0.01 -0.20 -4.78 113.70 117.43 1jcn s SER 53 Ca 0.76 -0.04 -0.26 0.00 1.31 0.00 0.00 55.95 57.73 1jcn s SER 53 Cb -0.66 0.14 -0.02 0.00 0.21 0.00 0.00 66.02 65.69 1jcn s SER 53 CO 0.40 -0.12 0.82 0.00 0.41 0.00 0.00 173.24 174.75 1jcn s ALA 54 N -0.45 3.39 -0.06 1.44 0.00 -1.26 -0.95 121.76 123.87 1jcn s ALA 54 Ca -0.05 0.17 -0.03 0.00 0.00 0.00 0.00 51.96 52.05 1jcn s ALA 54 Cb -0.03 -3.16 -0.27 0.00 0.00 0.00 0.00 23.12 19.66 1jcn s ALA 54 CO 0.00 -0.39 0.62 1.25 0.00 0.00 0.00 175.76 177.25 1jcn h LEU 55 N 7.51 0.36 0.00 0.00 5.85 -1.07 -3.40 115.31 124.56 1jcn h LEU 55 Ca -0.35 -0.65 -0.19 0.00 0.84 0.00 0.00 57.88 57.53 1jcn h LEU 55 Cb 1.17 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 1jcn h LEU 55 CO 0.79 1.57 -0.06 0.35 -0.34 0.00 0.00 178.44 180.75 1jcn n THR 56 N -3.41 0.00 -0.29 1.05 -2.24 -1.15 -4.82 114.28 103.42 1jcn n THR 56 Ca -0.23 -1.29 0.10 0.00 -2.27 0.00 0.00 64.05 60.36 1jcn n THR 56 Cb 1.05 0.84 0.34 0.00 -2.10 0.00 0.00 70.33 70.46 1jcn n THR 56 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1jcn h ARG 57 N 0.00 0.75 -0.01 -0.78 3.08 -1.64 -3.17 114.38 112.62 1jcn h ARG 57 Ca -0.22 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.79 1jcn h ARG 57 Cb 0.93 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1jcn h ARG 57 CO 0.29 0.50 -0.06 1.63 -1.07 0.00 0.00 179.97 181.26 1jcn n LYS 58 N -4.58 1.03 -4.03 0.04 5.02 -1.26 -4.97 118.16 109.41 1jcn n LYS 58 Ca 0.18 -0.73 -0.35 0.00 -2.02 0.00 0.00 58.31 55.38 1jcn n LYS 58 Cb 0.43 -1.07 -0.13 0.00 -0.02 0.00 0.00 35.03 34.24 1jcn n LYS 58 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1jcn s ILE 59 N -0.81 3.82 -0.01 -0.18 -1.09 -1.20 -5.07 121.20 116.67 1jcn s ILE 59 Ca 0.07 -0.35 0.08 0.00 -2.23 0.00 0.00 60.65 58.22 1jcn s ILE 59 Cb 0.06 -2.73 -0.02 0.00 -1.58 0.00 0.00 42.46 38.18 1jcn s ILE 59 CO 0.13 0.42 -0.26 -0.89 -1.23 0.00 0.00 174.94 173.11 1jcn s THR 60 N 1.15 2.08 0.25 2.92 2.01 -1.26 -0.38 115.64 122.40 1jcn s THR 60 Ca 0.03 -1.13 0.11 0.00 0.31 0.00 0.00 61.69 61.00 1jcn s THR 60 Cb -0.14 -1.72 -0.05 0.00 0.01 0.00 0.00 72.50 70.59 1jcn s THR 60 CO 0.01 0.56 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.55 1jcn s LEU 61 N -0.68 2.57 0.28 4.42 1.43 -0.13 -4.93 118.68 121.63 1jcn s LEU 61 Ca 0.10 -1.01 0.14 0.00 -1.03 0.00 0.00 54.13 52.33 1jcn s LEU 61 Cb -0.10 -0.99 0.26 0.00 0.03 0.00 0.00 46.19 45.40 1jcn s LEU 61 CO -0.01 -0.01 1.53 0.11 0.23 0.00 0.00 176.35 178.21 1jcn h LYS 62 N 2.44 0.00 -5.77 1.70 1.79 -1.77 -0.50 116.57 114.45 1jcn h LYS 62 Ca -0.40 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.53 1jcn h LYS 62 Cb 1.24 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.76 1jcn h LYS 62 CO 0.59 0.57 -0.70 0.95 -1.08 0.00 0.00 179.45 179.78 1jcn s THR 63 N -3.21 1.99 -0.30 -0.16 -4.23 -0.76 -2.93 115.64 106.03 1jcn s THR 63 Ca 0.01 -2.22 0.13 0.00 -1.18 0.00 0.00 61.69 58.43 1jcn s THR 63 Cb 0.10 -2.40 0.76 0.00 1.34 0.00 0.00 72.50 72.30 1jcn s THR 63 CO 0.74 -0.35 1.66 -0.81 -0.54 0.00 0.00 174.62 175.33 1jcn n PRO 64 N -0.61 4.59 -3.45 3.99 -0.04 -1.25 -4.53 135.00 133.70 1jcn n PRO 64 Ca -0.06 -2.92 -0.37 0.00 -0.04 0.00 0.00 63.50 60.11 1jcn n PRO 64 Cb 0.62 -2.22 -0.07 0.00 -0.04 0.00 0.00 33.50 31.80 1jcn n PRO 64 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1jcn s LEU 65 N -2.57 4.24 -0.03 1.53 1.43 -1.26 -0.74 118.68 121.29 1jcn s LEU 65 Ca 0.51 0.60 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 1jcn s LEU 65 Cb 0.39 -2.49 0.01 0.00 0.03 0.00 0.00 46.19 44.13 1jcn s LEU 65 CO 0.15 0.05 -0.05 -0.51 0.23 0.00 0.00 176.35 176.22 1jcn s ILE 66 N 0.60 0.50 0.26 -0.59 2.07 -0.64 -2.64 121.20 120.77 1jcn s ILE 66 Ca 0.20 -0.17 -0.23 0.00 -1.41 0.00 0.00 60.65 59.03 1jcn s ILE 66 Cb -0.14 -0.48 -0.09 0.00 0.13 0.00 0.00 42.46 41.88 1jcn s ILE 66 CO 0.06 0.18 0.83 -0.94 -1.91 0.00 0.00 174.94 173.16 1jcn s SER 67 N 0.46 7.23 0.40 4.50 1.04 -0.64 -0.73 113.70 125.96 1jcn s SER 67 Ca -0.06 1.63 -0.23 0.00 0.48 0.00 0.00 55.95 57.77 1jcn s SER 67 Cb -0.09 -2.50 -0.09 0.00 0.10 0.00 0.00 66.02 63.43 1jcn s SER 67 CO -0.00 0.02 1.02 -0.55 0.98 0.00 0.00 173.24 174.70 1jcn s SER 68 N -1.57 6.82 -0.73 7.02 0.15 0.21 -3.04 113.70 122.56 1jcn s SER 68 Ca 0.45 1.95 -0.06 0.00 0.70 0.00 0.00 55.95 58.99 1jcn s SER 68 Cb -0.18 -2.58 -0.13 0.00 -1.71 0.00 0.00 66.02 61.42 1jcn s SER 68 CO 0.23 -0.45 2.71 -2.65 1.20 0.00 0.00 173.24 174.29 1jcn n PRO 69 N -0.16 2.33 -4.54 5.44 -0.02 -1.24 -3.64 135.00 133.16 1jcn n PRO 69 Ca 0.05 -1.38 -0.32 0.00 -2.02 0.00 0.00 63.50 59.83 1jcn n PRO 69 Cb 0.51 -2.31 -0.11 0.00 -0.02 0.00 0.00 33.50 31.56 1jcn n PRO 69 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1jcn s MET 70 N 2.21 2.47 0.04 -0.52 -1.94 -1.26 -4.40 119.30 115.89 1jcn s MET 70 Ca 0.54 -0.76 0.10 0.00 -1.71 0.00 0.00 55.69 53.85 1jcn s MET 70 Cb 0.19 -2.44 0.43 0.00 2.01 0.00 0.00 34.83 35.02 1jcn s MET 70 CO -0.03 0.60 1.30 -0.40 -0.01 0.00 0.00 175.02 176.48 1jcn n ASP 71 N 1.65 0.09 -1.07 3.03 5.68 -1.26 -0.49 116.55 124.17 1jcn n ASP 71 Ca -0.16 0.53 0.10 0.00 -0.50 0.00 0.00 54.79 54.76 1jcn n ASP 71 Cb 0.52 -0.55 0.24 0.00 -1.14 0.00 0.00 41.12 40.20 1jcn n ASP 71 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1jcn n THR 72 N -1.61 0.85 0.03 2.12 -2.24 -1.26 -4.73 114.28 107.45 1jcn n THR 72 Ca 0.02 -0.93 0.00 0.00 -2.27 0.00 0.00 64.05 60.87 1jcn n THR 72 Cb 0.09 0.63 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 1jcn n THR 72 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1jcn n VAL 73 N 1.25 0.15 -4.03 2.28 0.31 0.36 -4.42 118.33 114.23 1jcn n VAL 73 Ca 0.19 0.05 -0.31 0.00 -0.01 0.00 0.00 64.34 64.26 1jcn n VAL 73 Cb 0.55 -0.97 -0.16 0.00 -0.91 0.00 0.00 33.84 32.35 1jcn n VAL 73 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1jcn s THR 74 N -2.00 1.75 0.00 2.52 2.01 -0.60 -4.35 115.64 114.98 1jcn s THR 74 Ca 0.00 -0.99 0.00 0.00 0.31 0.00 0.00 61.69 61.01 1jcn s THR 74 Cb 0.00 -1.75 0.00 0.00 0.01 0.00 0.00 72.50 70.76 1jcn s THR 74 CO 0.00 0.27 0.00 -0.62 -0.69 0.00 0.00 174.62 173.58 1jcn n GLU 75 N 4.67 0.32 -0.27 4.92 1.02 -1.26 -2.93 120.64 127.10 1jcn n GLU 75 Ca -0.16 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 56.97 1jcn n GLU 75 Cb 0.47 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.95 1jcn n GLU 75 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1jcn h ALA 76 N 1.00 0.27 -0.20 0.62 0.00 -1.95 -1.66 119.26 117.34 1jcn h ALA 76 Ca 0.00 0.26 0.03 0.00 0.00 0.00 0.00 54.91 55.19 1jcn h ALA 76 Cb 0.00 0.75 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1jcn h ALA 76 CO 0.00 -0.54 -0.31 -0.44 0.00 0.00 0.00 179.25 177.97 1jcn h ASP 77 N -0.06 -1.02 -0.14 0.00 5.19 -1.95 -1.16 116.42 117.29 1jcn h ASP 77 Ca 0.33 0.13 0.05 0.00 -0.62 0.00 0.00 57.03 56.91 1jcn h ASP 77 Cb 0.58 0.41 -0.05 0.00 0.18 0.00 0.00 39.33 40.45 1jcn h ASP 77 CO -0.81 -0.23 -0.18 -0.03 -3.12 0.00 0.00 179.24 174.87 1jcn h MET 78 N -0.23 -0.21 -0.66 3.56 -1.53 -1.41 -2.17 114.93 112.28 1jcn h MET 78 Ca 0.04 0.01 0.10 0.00 -3.44 0.00 0.00 59.70 56.41 1jcn h MET 78 Cb 0.33 0.05 -0.08 0.00 -0.55 0.00 0.00 31.60 31.36 1jcn h MET 78 CO -0.31 -0.14 0.27 0.00 0.14 0.00 0.00 176.91 176.87 1jcn h ALA 79 N 0.82 0.88 0.26 0.39 0.00 -1.04 0.55 119.26 121.12 1jcn h ALA 79 Ca 0.10 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1jcn h ALA 79 Cb 0.37 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1jcn h ALA 79 CO -0.27 -0.15 -0.12 0.82 0.00 0.00 0.00 179.25 179.52 1jcn h ILE 80 N 0.47 0.79 -0.11 0.00 2.04 -1.00 -0.46 117.51 119.23 1jcn h ILE 80 Ca 0.33 -0.40 0.03 0.00 1.00 0.00 0.00 64.86 65.83 1jcn h ILE 80 Cb 0.41 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1jcn h ILE 80 CO -0.31 0.09 -0.10 0.00 0.00 0.00 0.00 178.15 177.83 1jcn h ALA 81 N 0.12 -0.01 -0.88 1.87 0.00 -0.87 -0.19 119.26 119.30 1jcn h ALA 81 Ca -0.04 0.05 0.11 0.00 0.00 0.00 0.00 54.91 55.03 1jcn h ALA 81 Cb 0.41 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.33 1jcn h ALA 81 CO 0.06 -0.56 0.51 1.98 0.00 0.00 0.00 179.25 181.25 1jcn h MET 82 N -0.12 0.80 -0.05 0.00 -1.53 0.11 -2.04 114.93 112.10 1jcn h MET 82 Ca 0.08 -0.05 -0.15 0.00 -3.44 0.00 0.00 59.70 56.14 1jcn h MET 82 Cb 0.23 -0.18 -0.01 0.00 -0.55 0.00 0.00 31.60 31.09 1jcn h MET 82 CO -0.19 0.53 -0.65 0.00 0.14 0.00 0.00 176.91 176.74 1jcn h ALA 83 N 1.50 0.80 0.00 0.39 0.00 -0.25 0.28 119.26 121.98 1jcn h ALA 83 Ca 0.44 -0.58 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1jcn h ALA 83 Cb 0.46 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1jcn h ALA 83 CO -0.27 0.77 -0.42 -0.07 0.00 0.00 0.00 179.25 179.25 1jcn h LEU 84 N 0.15 0.00 -2.30 0.00 3.38 -0.38 0.31 115.31 116.46 1jcn h LEU 84 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1jcn h LEU 84 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1jcn h LEU 84 CO 0.10 0.42 0.00 0.80 0.09 0.00 0.00 178.44 179.85 1jcn n MET 85 N -3.57 2.71 0.00 1.13 1.56 -0.88 -3.27 117.12 114.80 1jcn n MET 85 Ca -0.00 -2.14 0.00 0.00 -0.27 0.00 0.00 57.70 55.28 1jcn n MET 85 Cb 0.53 -1.59 0.00 0.00 2.15 0.00 0.00 33.22 34.31 1jcn n MET 85 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1jcn n GLY 86 N 1.20 0.53 0.00 -5.12 0.00 -1.18 -4.83 105.19 95.79 1jcn n GLY 86 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1jcn n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jcn n GLY 87 N -1.54 3.92 3.52 -0.02 0.00 0.08 -1.82 105.19 109.33 1jcn n GLY 87 Ca 0.00 -1.76 -0.14 0.00 0.00 0.00 0.00 46.02 44.13 1jcn n GLY 87 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1jcn s ILE 88 N 3.30 0.00 0.13 -0.61 2.07 -1.08 -3.99 121.20 121.02 1jcn s ILE 88 Ca 0.00 0.00 0.10 0.00 -1.41 0.00 0.00 60.65 59.34 1jcn s ILE 88 Cb 0.00 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.55 1jcn s ILE 88 CO 0.00 0.00 -0.23 -0.83 -1.91 0.00 0.00 174.94 171.97 1jcn s GLY 89 N -1.55 1.43 -0.21 1.50 0.00 -1.26 -1.62 107.32 105.61 1jcn s GLY 89 Ca -0.05 -1.40 -0.03 0.00 0.00 0.00 0.00 44.72 43.25 1jcn s GLY 89 CO 0.02 -1.40 -0.07 -1.36 0.00 0.00 0.00 173.10 170.29 1jcn s PHE 90 N -1.28 2.93 -0.01 1.90 0.40 -1.17 -1.63 117.98 119.11 1jcn s PHE 90 Ca 0.12 -1.03 -0.30 0.00 -0.60 0.00 0.00 56.93 55.11 1jcn s PHE 90 Cb -0.09 -2.07 -0.06 0.00 0.51 0.00 0.00 43.02 41.31 1jcn s PHE 90 CO 0.06 -0.58 1.49 0.42 0.70 0.00 0.00 175.22 177.30 1jcn s ILE 91 N 1.43 3.60 0.93 0.64 -1.09 0.22 -3.64 121.20 123.28 1jcn s ILE 91 Ca 0.05 0.94 -0.11 0.00 -2.23 0.00 0.00 60.65 59.31 1jcn s ILE 91 Cb -0.14 -3.60 0.15 0.00 -1.58 0.00 0.00 42.46 37.29 1jcn s ILE 91 CO -0.05 -0.02 1.12 -1.38 -1.23 0.00 0.00 174.94 173.38 1jcn s HIS 92 N 2.81 1.77 -0.21 3.97 -3.43 -1.15 -1.99 115.29 117.05 1jcn s HIS 92 Ca 0.67 1.65 0.14 0.00 -0.80 0.00 0.00 55.06 56.71 1jcn s HIS 92 Cb -0.33 -3.25 0.47 0.00 -1.43 0.00 0.00 32.58 28.04 1jcn s HIS 92 CO 0.27 -2.78 1.38 -2.39 -2.00 0.00 0.00 174.74 169.22 1jcn n HIS 93 N -4.20 0.76 -2.02 0.38 1.44 -1.26 -4.78 115.22 105.54 1jcn n HIS 93 Ca 0.10 -1.20 -0.41 0.00 -2.01 0.00 0.00 57.72 54.20 1jcn n HIS 93 Cb 0.53 -0.34 -0.00 0.00 0.12 0.00 0.00 29.99 30.29 1jcn n HIS 93 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 1jcn n ASN 94 N -0.94 6.83 -3.07 4.39 4.05 -1.26 -4.79 115.26 120.48 1jcn n ASN 94 Ca 0.24 -3.05 -0.01 0.00 0.45 0.00 0.00 54.58 52.21 1jcn n ASN 94 Cb 0.89 -1.44 0.02 0.00 1.23 0.00 0.00 39.78 40.47 1jcn n ASN 94 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1jcn s THR 96 N -2.11 4.27 0.29 0.00 -4.23 -1.26 -4.87 115.64 107.73 1jcn s THR 96 Ca 0.21 0.99 0.02 0.00 -1.18 0.00 0.00 61.69 61.73 1jcn s THR 96 Cb -0.02 -3.60 0.29 0.00 1.34 0.00 0.00 72.50 70.51 1jcn s THR 96 CO 0.03 -0.72 1.84 -0.65 -0.54 0.00 0.00 174.62 174.59 1jcn h PRO 97 N 0.40 0.94 -0.39 3.99 0.11 -1.96 -1.48 132.00 133.62 1jcn h PRO 97 Ca -0.46 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 1jcn h PRO 97 Cb 1.20 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 1jcn h PRO 97 CO 0.60 0.62 0.06 0.93 -0.21 0.00 0.00 178.00 180.01 1jcn h GLU 98 N 0.97 0.64 0.30 1.05 3.07 -1.97 -1.22 114.58 117.43 1jcn h GLU 98 Ca 0.49 -0.17 -0.01 0.00 -0.50 0.00 0.00 59.36 59.17 1jcn h GLU 98 Cb 0.50 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 1jcn h GLU 98 CO -0.26 0.70 -0.14 0.35 -1.40 0.00 0.00 179.01 178.25 1jcn h PHE 99 N 0.49 -0.37 -0.75 4.33 3.57 -1.75 -0.92 116.94 121.53 1jcn h PHE 99 Ca 0.12 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 1jcn h PHE 99 Cb 0.37 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 1jcn h PHE 99 CO 0.02 -0.22 0.48 0.37 -2.23 0.00 0.00 178.31 176.73 1jcn h GLN 100 N -0.42 0.92 -0.57 1.11 4.15 -1.27 -1.57 115.11 117.47 1jcn h GLN 100 Ca -0.04 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.29 1jcn h GLN 100 Cb 0.32 -0.21 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 1jcn h GLN 100 CO 0.07 0.61 0.21 0.00 -1.93 0.00 0.00 178.83 177.79 1jcn h ALA 101 N 1.31 1.31 -0.21 3.38 0.00 -1.08 -2.22 119.26 121.75 1jcn h ALA 101 Ca 0.30 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 1jcn h ALA 101 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1jcn h ALA 101 CO -0.10 0.51 -0.24 -0.97 0.00 0.00 0.00 179.25 178.44 1jcn h ASN 102 N 0.81 0.38 -0.43 0.00 -1.24 -0.27 -2.02 115.58 112.81 1jcn h ASN 102 Ca 0.19 -0.12 -0.12 0.00 0.71 0.00 0.00 56.30 56.96 1jcn h ASN 102 Cb 0.18 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 39.11 1jcn h ASN 102 CO -0.02 0.63 -0.20 -0.33 -1.29 0.00 0.00 177.43 176.22 1jcn h GLU 103 N 0.34 0.90 -0.09 6.67 4.39 -0.72 -2.45 114.58 123.62 1jcn h GLU 103 Ca 0.05 -0.39 0.01 0.00 0.34 0.00 0.00 59.36 59.37 1jcn h GLU 103 Cb 0.62 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 1jcn h GLU 103 CO 0.04 1.04 0.03 0.28 -1.16 0.00 0.00 179.01 179.25 1jcn h VAL 104 N 0.73 0.98 -0.60 3.13 2.07 -1.24 -2.39 116.25 118.94 1jcn h VAL 104 Ca 0.10 -0.03 0.12 0.00 0.82 0.00 0.00 66.70 67.71 1jcn h VAL 104 Cb 0.77 0.90 -0.11 0.00 -1.52 0.00 0.00 31.29 31.33 1jcn h VAL 104 CO 0.06 0.01 -0.08 -0.09 0.02 0.00 0.00 177.57 177.50 1jcn h ARG 105 N 0.08 0.05 -0.87 1.57 2.43 -1.23 0.14 114.38 116.55 1jcn h ARG 105 Ca 0.04 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.24 1jcn h ARG 105 Cb 0.02 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 1jcn h ARG 105 CO -0.04 0.03 0.57 0.87 -1.51 0.00 0.00 179.97 179.90 1jcn h LYS 106 N 0.05 1.04 -0.29 0.20 1.57 -1.03 -1.04 116.57 117.08 1jcn h LYS 106 Ca 0.30 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.94 1jcn h LYS 106 Cb 0.47 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1jcn h LYS 106 CO -0.57 0.69 -0.12 0.28 -0.57 0.00 0.00 179.45 179.17 1jcn h VAL 107 N 1.07 1.29 0.00 0.50 2.07 -0.33 -2.94 116.25 117.92 1jcn h VAL 107 Ca 0.35 -1.20 -0.05 0.00 0.82 0.00 0.00 66.70 66.63 1jcn h VAL 107 Cb 0.05 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1jcn h VAL 107 CO -0.11 0.38 -0.23 0.11 0.02 0.00 0.00 177.57 177.74 1jcn h LYS 108 N 0.33 0.00 -0.02 1.57 1.79 -0.62 -3.12 116.57 116.51 1jcn h LYS 108 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1jcn h LYS 108 Cb 0.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 1jcn h LYS 108 CO 0.04 0.23 -0.15 0.09 -1.08 0.00 0.00 179.45 178.58 1jcn n ASN 109 N -3.42 1.98 -4.76 0.86 5.03 -0.43 -4.53 115.26 110.00 1jcn n ASN 109 Ca -0.00 -1.54 -0.38 0.00 0.87 0.00 0.00 54.58 53.53 1jcn n ASN 109 Cb 0.43 0.13 0.02 0.00 -1.02 0.00 0.00 39.78 39.34 1jcn n ASN 109 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1jcn s PHE 110 N -2.20 2.48 -0.30 3.10 5.36 -1.11 -5.02 117.98 120.29 1jcn s PHE 110 Ca 0.28 1.44 -0.14 0.00 -0.96 0.00 0.00 56.93 57.55 1jcn s PHE 110 Cb 0.20 -3.64 0.16 0.00 -0.34 0.00 0.00 43.02 39.39 1jcn s PHE 110 CO 0.41 -2.41 0.94 -2.00 -1.46 0.00 0.00 175.22 170.70 1jcn s GLU 111 N -2.88 0.34 0.47 10.12 2.56 -1.26 -4.76 118.70 123.29 1jcn s GLU 111 Ca 0.70 0.84 -0.24 0.00 0.00 0.00 0.00 54.97 56.27 1jcn s GLU 111 Cb -0.36 0.49 -0.08 0.00 2.00 0.00 0.00 34.13 36.19 1jcn s GLU 111 CO 0.42 -0.11 1.30 0.00 -0.56 0.00 0.00 175.26 176.31 1jcn n GLN 112 N 5.00 1.86 0.00 4.30 10.64 -1.26 -2.24 117.38 135.67 1jcn n GLN 112 Ca -0.10 0.67 0.00 0.00 -1.83 0.00 0.00 57.00 55.74 1jcn n GLN 112 Cb 0.52 -2.46 0.00 0.00 -0.86 0.00 0.00 30.24 27.44 1jcn n GLN 112 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1jcn n GLY 113 N 0.79 0.56 3.42 2.61 0.00 -1.26 -5.01 105.19 106.29 1jcn n GLY 113 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1jcn n GLY 113 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jcn s PHE 114 N -2.18 2.51 0.02 1.61 0.40 -0.95 0.26 117.98 119.65 1jcn s PHE 114 Ca 0.00 -0.29 -0.30 0.00 -0.60 0.00 0.00 56.93 55.74 1jcn s PHE 114 Cb 0.00 -1.50 -0.05 0.00 0.51 0.00 0.00 43.02 41.98 1jcn s PHE 114 CO 0.00 0.16 1.18 0.42 0.70 0.00 0.00 175.22 177.68 1jcn s ILE 115 N -0.80 4.18 0.11 0.64 1.01 -1.26 -4.38 121.20 120.70 1jcn s ILE 115 Ca 0.12 1.55 -0.31 0.00 0.00 0.00 0.00 60.65 62.02 1jcn s ILE 115 Cb -0.10 -4.00 -0.11 0.00 0.01 0.00 0.00 42.46 38.26 1jcn s ILE 115 CO 0.02 0.09 1.60 0.71 0.00 0.00 0.00 174.94 177.36 1jcn h THR 116 N 4.69 0.20 -2.83 2.92 1.35 -1.96 -3.40 112.91 113.88 1jcn h THR 116 Ca -0.39 0.00 -0.51 0.00 -0.55 0.00 0.00 66.41 64.95 1jcn h THR 116 Cb 1.20 0.20 -0.40 0.00 -1.73 0.00 0.00 68.15 67.42 1jcn h THR 116 CO 0.82 0.00 -0.77 -1.81 -0.25 0.00 0.00 175.52 173.51 1jcn s ASP 117 N -4.68 3.26 -0.15 5.36 1.01 -1.26 -5.04 116.67 115.17 1jcn s ASP 117 Ca -0.16 -1.14 -0.21 0.00 0.71 0.00 0.00 52.55 51.75 1jcn s ASP 117 Cb 0.07 -0.31 -0.03 0.00 1.01 0.00 0.00 42.92 43.66 1jcn s ASP 117 CO 0.63 -0.42 0.63 -2.84 0.21 0.00 0.00 175.17 173.38 1jcn s PRO 118 N 2.11 4.29 -0.08 8.23 0.02 -1.26 -5.02 135.00 143.29 1jcn s PRO 118 Ca 0.08 0.67 -0.30 0.00 0.02 0.00 0.00 61.00 61.47 1jcn s PRO 118 Cb -0.16 -3.52 -0.05 0.00 0.02 0.00 0.00 34.50 30.79 1jcn s PRO 118 CO -0.31 -0.11 1.65 0.08 -0.33 0.00 0.00 177.00 177.98 1jcn s VAL 119 N 1.45 3.60 -0.12 3.83 1.01 -1.26 -4.98 120.40 123.93 1jcn s VAL 119 Ca 0.31 0.72 -0.01 0.00 0.00 0.00 0.00 61.98 63.00 1jcn s VAL 119 Cb -0.16 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 1jcn s VAL 119 CO 0.12 -0.09 -0.08 -0.69 0.00 0.00 0.00 175.10 174.36 1jcn s VAL 120 N 4.23 3.51 0.19 2.92 1.01 -1.26 -2.91 120.40 128.09 1jcn s VAL 120 Ca 0.73 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.20 1jcn s VAL 120 Cb -0.32 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.57 1jcn s VAL 120 CO 0.29 0.53 0.00 -0.11 0.00 0.00 0.00 175.10 175.82 1jcn n LEU 121 N 3.14 0.00 0.00 3.92 7.94 0.20 -4.84 117.00 127.37 1jcn n LEU 121 Ca -0.18 0.88 0.00 0.00 -1.11 0.00 0.00 56.01 55.61 1jcn n LEU 121 Cb 0.53 -2.56 0.00 0.00 0.53 0.00 0.00 43.42 41.91 1jcn n LEU 121 CO 0.30 -1.96 0.00 -0.24 -1.11 0.00 0.00 177.39 174.38 1jcn n SER 122 N -4.02 0.00 -0.70 1.96 2.88 -1.26 -4.90 113.62 107.58 1jcn n SER 122 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 1jcn n SER 122 Cb 0.38 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 1jcn n SER 122 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1jcn n PRO 123 N 0.00 0.00 0.00 -1.46 -0.02 -1.26 -5.24 135.00 127.02 1jcn n PRO 123 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1jcn n PRO 123 Cb 0.00 -0.47 0.00 0.00 -0.02 0.00 0.00 33.50 33.01 1jcn n PRO 123 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jcn n GLY 141 N 0.11 0.96 3.45 -1.23 0.00 -1.26 -5.30 105.19 101.92 1jcn n GLY 141 Ca 0.00 -0.74 -0.28 0.00 0.00 0.00 0.00 46.02 45.00 1jcn n GLY 141 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1jcn n ILE 142 N 0.00 0.00 -3.67 -0.61 -5.35 -1.20 -4.86 119.36 103.67 1jcn n ILE 142 Ca 0.00 -0.46 -0.25 0.00 -0.27 0.00 0.00 62.75 61.77 1jcn n ILE 142 Cb 0.00 -0.97 0.02 0.00 -1.74 0.00 0.00 39.64 36.95 1jcn n ILE 142 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1jcn s PRO 143 N -4.31 2.24 -0.08 6.28 0.04 -1.14 -2.95 135.00 135.08 1jcn s PRO 143 Ca 0.68 -1.96 -0.00 0.00 0.04 0.00 0.00 61.00 59.76 1jcn s PRO 143 Cb -0.25 -2.23 0.02 0.00 0.04 0.00 0.00 34.50 32.09 1jcn s PRO 143 CO 0.66 -0.74 -0.04 -1.50 0.04 0.00 0.00 177.00 175.42 1jcn s ILE 144 N -2.77 0.67 0.00 0.56 1.10 -0.43 0.62 121.20 120.94 1jcn s ILE 144 Ca 0.41 -0.11 0.00 0.00 -0.51 0.00 0.00 60.65 60.44 1jcn s ILE 144 Cb -0.03 -0.73 0.00 0.00 0.15 0.00 0.00 42.46 41.85 1jcn s ILE 144 CO 0.26 0.29 0.00 0.35 -2.11 0.00 0.00 174.94 173.73 1jcn n THR 145 N 4.71 -0.43 0.04 4.00 -2.24 -1.26 -2.82 114.28 116.27 1jcn n THR 145 Ca -0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1jcn n THR 145 Cb 0.50 -0.86 0.00 0.00 -2.10 0.00 0.00 70.33 67.87 1jcn n THR 145 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1jcn n GLU 146 N -0.06 0.04 -4.30 -0.78 4.07 -1.26 -4.65 120.64 113.69 1jcn n GLU 146 Ca 0.00 0.00 -0.18 0.00 -0.06 0.00 0.00 57.16 56.92 1jcn n GLU 146 Cb 0.00 -1.21 -0.15 0.00 -0.06 0.00 0.00 31.44 30.03 1jcn n GLU 146 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1jcn s VAL 155 N -0.21 0.63 -2.01 6.31 1.01 -1.25 -4.67 120.40 120.21 1jcn s VAL 155 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.67 1jcn s VAL 155 Cb 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.84 1jcn s VAL 155 CO 0.00 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.90 1jcn n GLY 156 N 3.07 -1.44 3.31 4.51 0.00 -1.13 -4.86 105.19 108.65 1jcn n GLY 156 Ca -0.15 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.71 1jcn n GLY 156 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1jcn s ILE 157 N -2.74 0.03 -0.10 -0.61 2.07 -0.81 -1.32 121.20 117.74 1jcn s ILE 157 Ca 0.00 -0.27 0.03 0.00 -1.41 0.00 0.00 60.65 59.00 1jcn s ILE 157 Cb 0.00 -0.67 -0.01 0.00 0.13 0.00 0.00 42.46 41.91 1jcn s ILE 157 CO 0.00 -0.15 -0.20 -0.69 -1.91 0.00 0.00 174.94 171.99 1jcn s VAL 158 N -0.90 2.49 0.08 4.00 1.01 -1.15 -2.12 120.40 123.81 1jcn s VAL 158 Ca -0.10 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 1jcn s VAL 158 Cb -0.04 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 1jcn s VAL 158 CO 0.04 0.55 0.02 0.28 0.00 0.00 0.00 175.10 176.00 1jcn s THR 159 N 0.12 0.17 0.60 3.92 -1.32 -1.26 -3.23 115.64 114.64 1jcn s THR 159 Ca -0.10 -1.80 0.30 0.00 -1.21 0.00 0.00 61.69 58.87 1jcn s THR 159 Cb -0.16 -1.71 0.42 0.00 -1.51 0.00 0.00 72.50 69.54 1jcn s THR 159 CO 0.06 -0.77 1.57 -1.28 -2.21 0.00 0.00 174.62 172.00 1jcn h SER 160 N 3.01 0.00 0.14 8.08 0.87 -2.00 -1.38 113.55 122.28 1jcn h SER 160 Ca -0.34 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.21 1jcn h SER 160 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 1jcn h SER 160 CO 0.62 0.00 -0.07 -0.09 -0.53 0.00 0.00 176.83 176.76 1jcn h ARG 161 N 0.00 -0.19 0.00 2.24 2.43 -1.97 -2.14 114.38 114.75 1jcn h ARG 161 Ca 0.42 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.60 1jcn h ARG 161 Cb 2.27 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.87 1jcn h ARG 161 CO -0.00 -0.12 0.29 -0.25 -1.51 0.00 0.00 179.97 178.37 1jcn n ASP 162 N -3.49 0.11 -0.03 -3.80 9.92 -0.56 -0.69 116.55 118.02 1jcn n ASP 162 Ca -0.02 0.35 0.02 0.00 -0.53 0.00 0.00 54.79 54.60 1jcn n ASP 162 Cb 0.08 -0.32 -0.10 0.00 -0.64 0.00 0.00 41.12 40.14 1jcn n ASP 162 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1jcn n ILE 163 N -1.53 0.31 -1.67 0.53 3.06 -0.96 -4.85 119.36 114.25 1jcn n ILE 163 Ca -0.00 -0.38 0.02 0.00 -2.50 0.00 0.00 62.75 59.89 1jcn n ILE 163 Cb 0.30 -0.13 0.18 0.00 0.54 0.00 0.00 39.64 40.53 1jcn n ILE 163 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 1jcn n ASP 164 N -2.14 2.14 0.01 9.51 2.03 0.14 -5.09 116.55 123.14 1jcn n ASP 164 Ca -0.09 -3.86 -0.21 0.00 0.52 0.00 0.00 54.79 51.15 1jcn n ASP 164 Cb 0.55 -0.50 -0.14 0.00 -0.72 0.00 0.00 41.12 40.31 1jcn n ASP 164 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1jcn h PRO 181 N 1.16 0.24 0.00 -0.67 0.13 -2.00 -3.50 132.00 127.36 1jcn h PRO 181 Ca 0.05 -0.41 -0.29 0.00 -0.87 0.00 0.00 66.00 64.48 1jcn h PRO 181 Cb 1.09 0.15 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 1jcn h PRO 181 CO 0.10 1.20 -0.09 2.89 -0.23 0.00 0.00 178.00 181.87 1jcn n ARG 182 N -3.90 0.92 -1.35 0.86 1.85 -1.26 -4.87 116.66 108.90 1jcn n ARG 182 Ca -0.25 -1.78 0.00 0.00 -1.00 0.00 0.00 57.85 54.82 1jcn n ARG 182 Cb 0.91 0.03 0.00 0.00 -1.05 0.00 0.00 32.46 32.35 1jcn n ARG 182 CO 0.00 0.00 0.00 0.44 -0.01 0.00 0.00 177.63 178.06 1jcn n ILE 183 N -1.45 0.00 -3.68 8.89 -5.35 -0.90 -4.93 119.36 111.94 1jcn n ILE 183 Ca 0.04 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.23 1jcn n ILE 183 Cb 0.33 -0.06 -0.13 0.00 -1.74 0.00 0.00 39.64 38.05 1jcn n ILE 183 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1jcn s GLU 184 N -1.05 1.25 0.51 6.28 -6.30 -1.26 -1.92 118.70 116.21 1jcn s GLU 184 Ca 0.00 -1.99 -0.04 0.00 -2.50 0.00 0.00 54.97 50.44 1jcn s GLU 184 Cb 0.00 -2.24 -0.01 0.00 0.00 0.00 0.00 34.13 31.88 1jcn s GLU 184 CO 0.00 -1.18 0.79 -1.17 0.02 0.00 0.00 175.26 173.72 1jcn s LEU 185 N 0.35 3.49 1.07 2.70 0.20 -1.26 -5.02 118.68 120.21 1jcn s LEU 185 Ca 0.19 0.64 -0.12 0.00 0.69 0.00 0.00 54.13 55.53 1jcn s LEU 185 Cb -0.22 -3.52 0.23 0.00 -0.43 0.00 0.00 46.19 42.25 1jcn s LEU 185 CO -0.01 -0.80 1.06 0.68 -0.29 0.00 0.00 176.35 176.99 1jcn s VAL 186 N -2.77 2.12 0.21 1.68 -7.23 -1.26 -4.96 120.40 108.18 1jcn s VAL 186 Ca 0.50 0.04 -0.03 0.00 -1.81 0.00 0.00 61.98 60.67 1jcn s VAL 186 Cb -0.10 -2.20 0.01 0.00 0.56 0.00 0.00 36.38 34.65 1jcn s VAL 186 CO 0.43 -0.05 0.34 1.33 -0.31 0.00 0.00 175.10 176.84 1jcn n VAL 187 N -4.60 0.00 -4.04 1.32 0.24 -1.26 -4.53 118.33 105.46 1jcn n VAL 187 Ca 0.05 -0.91 -0.11 0.00 -2.04 0.00 0.00 64.34 61.33 1jcn n VAL 187 Cb 0.54 0.63 -0.11 0.00 -1.47 0.00 0.00 33.84 33.43 1jcn n VAL 187 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jcn s ALA 188 N -2.09 0.43 0.30 2.33 0.00 -0.85 -4.96 121.76 116.92 1jcn s ALA 188 Ca 0.15 -0.80 -0.28 0.00 0.00 0.00 0.00 51.96 51.03 1jcn s ALA 188 Cb -0.01 0.12 -0.09 0.00 0.00 0.00 0.00 23.12 23.13 1jcn s ALA 188 CO 0.11 -0.13 1.06 -2.14 0.00 0.00 0.00 175.76 174.66 1jcn s PRO 189 N -1.98 4.57 0.84 0.00 0.02 -1.26 0.14 135.00 137.34 1jcn s PRO 189 Ca -0.09 1.67 -0.14 0.00 0.02 0.00 0.00 61.00 62.47 1jcn s PRO 189 Cb -0.07 -3.05 0.01 0.00 0.02 0.00 0.00 34.50 31.41 1jcn s PRO 189 CO -0.02 0.19 0.57 0.00 -0.33 0.00 0.00 177.00 177.42 1jcn n ALA 190 N 0.95 -1.78 -0.04 -1.55 0.00 -1.18 -1.98 120.51 114.92 1jcn n ALA 190 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1jcn n ALA 190 Cb 0.46 -1.89 0.00 0.00 0.00 0.00 0.00 19.45 18.03 1jcn n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jcn n GLY 191 N 1.42 1.59 3.56 0.00 0.00 -1.26 -4.98 105.19 105.52 1jcn n GLY 191 Ca 0.09 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.65 1jcn n GLY 191 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1jcn n VAL 192 N -2.00 0.32 -0.96 1.61 3.14 -0.84 -4.95 118.33 114.66 1jcn n VAL 192 Ca 0.00 -0.36 -0.29 0.00 -2.96 0.00 0.00 64.34 60.72 1jcn n VAL 192 Cb 0.00 -2.22 0.22 0.00 -1.06 0.00 0.00 33.84 30.78 1jcn n VAL 192 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 1jcn s THR 193 N 7.61 1.82 -0.80 1.55 -1.32 -1.26 -4.80 115.64 118.43 1jcn s THR 193 Ca 1.03 0.00 0.19 0.00 -1.21 0.00 0.00 61.69 61.70 1jcn s THR 193 Cb -0.53 -2.38 0.18 0.00 -1.51 0.00 0.00 72.50 68.26 1jcn s THR 193 CO 0.41 0.00 1.58 0.18 -2.21 0.00 0.00 174.62 174.58 1jcn n LEU 194 N -4.63 0.27 0.11 9.08 7.99 -1.26 -1.84 117.00 126.71 1jcn n LEU 194 Ca 0.07 0.56 -0.24 0.00 -0.01 0.00 0.00 56.01 56.40 1jcn n LEU 194 Cb 0.58 -0.52 -0.15 0.00 -0.11 0.00 0.00 43.42 43.21 1jcn n LEU 194 CO 0.53 -0.35 -0.32 0.50 -1.51 0.00 0.00 177.39 176.23 1jcn h LYS 195 N 0.00 0.46 0.00 3.23 3.64 -2.00 -3.25 116.57 118.64 1jcn h LYS 195 Ca 0.00 -0.78 0.00 0.00 -1.27 0.00 0.00 60.65 58.60 1jcn h LYS 195 Cb 0.32 0.29 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1jcn h LYS 195 CO 0.00 1.37 0.00 1.49 -2.27 0.00 0.00 179.45 180.04 1jcn h GLU 196 N 0.06 0.00 0.68 1.90 4.81 -1.84 -1.13 114.58 119.06 1jcn h GLU 196 Ca -0.28 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.92 1jcn h GLU 196 Cb 2.08 0.00 0.01 0.00 0.63 0.00 0.00 28.75 31.46 1jcn h GLU 196 CO 0.22 0.00 -0.33 0.00 -0.73 0.00 0.00 179.01 178.17 1jcn h ALA 197 N 2.18 -0.92 0.00 2.92 0.00 -1.40 -1.73 119.26 120.31 1jcn h ALA 197 Ca 0.00 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1jcn h ALA 197 Cb 0.76 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1jcn h ALA 197 CO 0.00 -0.93 -0.39 -0.91 0.00 0.00 0.00 179.25 177.02 1jcn h ASN 198 N -1.09 0.00 -0.36 0.00 4.21 -1.60 0.27 115.58 117.01 1jcn h ASN 198 Ca -0.09 0.00 0.03 0.00 1.21 0.00 0.00 56.30 57.45 1jcn h ASN 198 Cb 0.73 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.92 1jcn h ASN 198 CO 0.15 0.39 0.24 -0.08 -1.29 0.00 0.00 177.43 176.85 1jcn h GLU 199 N 0.00 0.37 0.02 0.81 4.57 -1.04 -0.26 114.58 119.05 1jcn h GLU 199 Ca -0.00 -0.02 -0.39 0.00 -1.18 0.00 0.00 59.36 57.76 1jcn h GLU 199 Cb 1.00 -0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 29.45 1jcn h GLU 199 CO 0.05 0.24 -2.36 -0.89 -1.18 0.00 0.00 179.01 174.87 1jcn n ILE 200 N -4.48 1.55 0.40 2.32 5.41 -0.66 -4.11 119.36 119.79 1jcn n ILE 200 Ca 0.03 -0.55 -0.18 0.00 1.00 0.00 0.00 62.75 63.05 1jcn n ILE 200 Cb 0.15 -1.55 -0.09 0.00 -0.71 0.00 0.00 39.64 37.44 1jcn n ILE 200 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1jcn h LEU 201 N -0.14 -0.86 -2.55 1.39 3.38 -0.78 0.33 115.31 116.08 1jcn h LEU 201 Ca -0.56 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.43 1jcn h LEU 201 Cb 1.87 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.84 1jcn h LEU 201 CO -0.10 -0.58 -0.01 -0.61 0.09 0.00 0.00 178.44 177.23 1jcn h GLN 202 N -1.07 0.00 0.00 1.13 4.15 -1.29 0.83 115.11 118.86 1jcn h GLN 202 Ca -0.10 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.10 1jcn h GLN 202 Cb 0.79 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.45 1jcn h GLN 202 CO 0.17 0.01 -1.02 -0.09 -1.93 0.00 0.00 178.83 175.97 1jcn h ARG 203 N 0.00 0.01 -0.01 1.69 2.43 -1.63 -3.22 114.38 113.66 1jcn h ARG 203 Ca -0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1jcn h ARG 203 Cb 0.04 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1jcn h ARG 203 CO 0.00 1.00 -0.53 0.43 -1.51 0.00 0.00 179.97 179.36 1jcn n SER 204 N -3.35 1.40 -3.42 -3.80 7.64 0.08 -4.99 113.62 107.18 1jcn n SER 204 Ca -0.01 -1.12 -0.18 0.00 1.01 0.00 0.00 58.87 58.57 1jcn n SER 204 Cb 0.94 0.47 0.07 0.00 -1.01 0.00 0.00 64.21 64.68 1jcn n SER 204 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1jcn n LYS 205 N -0.64 -3.89 -4.40 1.43 5.02 0.27 -5.02 118.16 110.92 1jcn n LYS 205 Ca 0.09 0.78 -0.21 0.00 -2.02 0.00 0.00 58.31 56.94 1jcn n LYS 205 Cb 0.40 -5.55 -0.09 0.00 -0.02 0.00 0.00 35.03 29.77 1jcn n LYS 205 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1jcn s LYS 206 N -5.11 1.74 -0.12 1.97 1.02 -0.96 -5.03 119.74 113.24 1jcn s LYS 206 Ca 0.25 -2.02 -0.01 0.00 0.02 0.00 0.00 55.97 54.21 1jcn s LYS 206 Cb -0.04 -0.30 -0.07 0.00 -0.52 0.00 0.00 37.83 36.89 1jcn s LYS 206 CO 0.76 -0.46 -0.12 0.41 -0.92 0.00 0.00 175.35 175.02 1jcn n GLY 207 N -0.71 -0.17 3.93 -3.33 0.00 -1.26 -4.64 105.19 99.00 1jcn n GLY 207 Ca -0.01 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 1jcn n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jcn s LYS 208 N -2.23 3.47 -0.28 1.61 1.02 -1.25 -3.31 119.74 118.77 1jcn s LYS 208 Ca -0.16 -0.45 -0.03 0.00 0.02 0.00 0.00 55.97 55.35 1jcn s LYS 208 Cb 0.05 -2.96 0.09 0.00 -0.52 0.00 0.00 37.83 34.49 1jcn s LYS 208 CO 0.26 0.53 0.11 -1.17 -0.92 0.00 0.00 175.35 174.15 1jcn s LEU 209 N -2.93 1.07 0.04 3.17 0.20 -1.25 -5.00 118.68 113.98 1jcn s LEU 209 Ca 0.36 -1.29 -0.30 0.00 0.69 0.00 0.00 54.13 53.58 1jcn s LEU 209 Cb -0.12 -0.51 -0.08 0.00 -0.43 0.00 0.00 46.19 45.05 1jcn s LEU 209 CO 0.28 -0.41 1.64 -2.84 -0.29 0.00 0.00 176.35 174.73 1jcn s PRO 210 N 1.94 4.20 -0.32 0.98 0.02 -1.26 -4.90 135.00 135.67 1jcn s PRO 210 Ca 0.08 2.28 -0.14 0.00 0.02 0.00 0.00 61.00 63.24 1jcn s PRO 210 Cb -0.16 -3.68 -0.02 0.00 0.02 0.00 0.00 34.50 30.65 1jcn s PRO 210 CO -0.29 -0.75 0.31 0.42 -0.33 0.00 0.00 177.00 176.37 1jcn s ILE 211 N 2.92 5.21 -0.56 2.83 1.01 -1.26 -2.02 121.20 129.34 1jcn s ILE 211 Ca 0.73 0.10 -0.19 0.00 0.00 0.00 0.00 60.65 61.29 1jcn s ILE 211 Cb -0.38 -3.74 0.09 0.00 0.01 0.00 0.00 42.46 38.44 1jcn s ILE 211 CO 0.32 0.02 0.67 -0.69 0.00 0.00 0.00 174.94 175.26 1jcn s VAL 212 N 1.93 4.84 0.00 2.92 1.01 0.12 -3.24 120.40 127.99 1jcn s VAL 212 Ca 0.10 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1jcn s VAL 212 Cb -0.16 -4.42 0.00 0.00 0.00 0.00 0.00 36.38 31.80 1jcn s VAL 212 CO 0.11 -1.00 0.00 -0.46 0.00 0.00 0.00 175.10 173.75 1jcn n ASN 213 N 6.27 0.00 0.00 3.32 2.04 -1.25 -3.13 115.26 122.51 1jcn n ASN 213 Ca -0.08 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.06 1jcn n ASN 213 Cb 0.44 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.69 1jcn n ASN 213 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 1jcn n ASP 214 N -0.31 0.00 -0.08 0.53 10.43 -1.26 -4.70 116.55 121.16 1jcn n ASP 214 Ca 0.00 0.00 -0.22 0.00 2.57 0.00 0.00 54.79 57.14 1jcn n ASP 214 Cb 0.00 0.00 -0.12 0.00 1.84 0.00 0.00 41.12 42.84 1jcn n ASP 214 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1jcn n ASP 216 N -3.69 1.32 -4.27 0.00 3.85 -1.26 -5.11 116.55 107.39 1jcn n ASP 216 Ca -0.40 -0.78 -0.38 0.00 -0.71 0.00 0.00 54.79 52.52 1jcn n ASP 216 Cb 0.95 0.00 -0.12 0.00 -1.35 0.00 0.00 41.12 40.60 1jcn n ASP 216 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1jcn s GLU 217 N -1.19 2.60 0.00 0.11 0.41 -1.26 -3.79 118.70 115.59 1jcn s GLU 217 Ca 0.00 -1.25 0.00 0.00 -0.41 0.00 0.00 54.97 53.31 1jcn s GLU 217 Cb 0.00 -3.54 0.00 0.00 -1.78 0.00 0.00 34.13 28.81 1jcn s GLU 217 CO 0.00 -0.73 0.90 1.47 -0.49 0.00 0.00 175.26 176.40 1jcn n LEU 218 N 4.83 0.00 0.00 1.80 -0.00 -1.20 -5.01 117.00 117.43 1jcn n LEU 218 Ca -0.12 0.90 0.00 0.00 -0.00 0.00 0.00 56.01 56.79 1jcn n LEU 218 Cb 0.44 -0.40 0.00 0.00 -0.00 0.00 0.00 43.42 43.47 1jcn n LEU 218 CO 0.33 -0.40 0.00 0.55 -0.00 0.00 0.00 177.39 177.87 1jcn n VAL 219 N -1.70 0.00 0.00 1.47 3.14 -1.26 -5.03 118.33 114.95 1jcn n VAL 219 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1jcn n VAL 219 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1jcn n VAL 219 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1jcn n ARG 224 N 0.00 0.00 0.00 1.45 5.12 0.71 -4.40 116.66 119.54 1jcn n ARG 224 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1jcn n ARG 224 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1jcn n ARG 224 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1jcn n THR 225 N 0.00 0.00 -3.23 0.55 -1.04 -1.21 -3.80 114.28 105.55 1jcn n THR 225 Ca 0.00 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.83 1jcn n THR 225 Cb 0.00 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1jcn n THR 225 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1jcn s ASP 226 N 1.87 5.51 -0.04 8.00 2.15 -1.26 -4.85 116.67 128.04 1jcn s ASP 226 Ca 0.00 -0.49 0.02 0.00 0.43 0.00 0.00 52.55 52.50 1jcn s ASP 226 Cb 0.00 -0.70 0.05 0.00 -0.30 0.00 0.00 42.92 41.97 1jcn s ASP 226 CO 0.00 -0.69 0.57 0.00 -0.17 0.00 0.00 175.17 174.88 1jcn n LEU 227 N -1.73 -0.20 0.00 -1.34 -0.00 -1.26 -4.80 117.00 107.67 1jcn n LEU 227 Ca 0.06 -1.15 0.02 0.00 -0.00 0.00 0.00 56.01 54.94 1jcn n LEU 227 Cb 0.60 0.73 0.10 0.00 -0.00 0.00 0.00 43.42 44.85 1jcn n LEU 227 CO 0.40 1.03 0.56 0.29 -0.00 0.00 0.00 177.39 179.67 1jcn n LYS 228 N -0.18 1.00 -1.93 1.47 4.76 -1.26 -4.06 118.16 117.95 1jcn n LYS 228 Ca -0.03 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.40 1jcn n LYS 228 Cb 0.52 -1.05 0.01 0.00 -1.84 0.00 0.00 35.03 32.66 1jcn n LYS 228 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1jcn n LYS 229 N -0.55 0.16 -1.83 1.97 2.85 -1.26 -5.17 118.16 114.33 1jcn n LYS 229 Ca 0.02 -0.30 -0.28 0.00 -1.05 0.00 0.00 58.31 56.70 1jcn n LYS 229 Cb 0.01 0.04 0.20 0.00 -0.65 0.00 0.00 35.03 34.63 1jcn n LYS 229 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1jcn n ASN 230 N -0.28 0.09 -4.63 -5.58 6.94 -1.26 -5.10 115.26 105.43 1jcn n ASN 230 Ca -0.10 -1.46 -0.24 0.00 -0.02 0.00 0.00 54.58 52.76 1jcn n ASN 230 Cb 0.57 -0.98 -0.08 0.00 -2.36 0.00 0.00 39.78 36.93 1jcn n ASN 230 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1jcn s ARG 231 N -5.81 2.24 -0.14 -3.83 0.52 -1.26 -5.06 118.95 105.62 1jcn s ARG 231 Ca 0.73 -1.40 0.15 0.00 -0.52 0.00 0.00 55.73 54.69 1jcn s ARG 231 Cb -0.02 -2.15 0.54 0.00 0.52 0.00 0.00 34.95 33.84 1jcn s ARG 231 CO 0.51 0.37 1.45 -0.40 0.02 0.00 0.00 175.30 177.25 1jcn n ASP 232 N -0.74 3.98 -1.44 0.23 5.75 -1.26 -5.04 116.55 118.03 1jcn n ASP 232 Ca -0.07 -2.73 -0.05 0.00 -0.01 0.00 0.00 54.79 51.93 1jcn n ASP 232 Cb 0.58 -0.50 0.01 0.00 -1.03 0.00 0.00 41.12 40.18 1jcn n ASP 232 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1jcn n TYR 233 N 0.02 -0.36 0.23 2.11 4.02 -1.26 -4.84 117.16 117.07 1jcn n TYR 233 Ca 0.20 0.15 0.08 0.00 -0.01 0.00 0.00 57.90 58.33 1jcn n TYR 233 Cb 0.83 -0.36 0.53 0.00 -0.02 0.00 0.00 39.34 40.32 1jcn n TYR 233 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1jcn h PRO 234 N 1.12 0.00 -0.02 -0.72 0.11 -1.97 -3.08 132.00 127.44 1jcn h PRO 234 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1jcn h PRO 234 Cb 0.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.43 1jcn h PRO 234 CO 0.03 0.24 -0.31 1.28 -0.21 0.00 0.00 178.00 179.03 1jcn n LEU 235 N -3.78 1.88 -4.32 2.35 4.77 -1.26 -5.02 117.00 111.62 1jcn n LEU 235 Ca -0.01 -0.65 -0.56 0.00 -0.03 0.00 0.00 56.01 54.76 1jcn n LEU 235 Cb 0.34 -0.03 -0.07 0.00 -2.33 0.00 0.00 43.42 41.32 1jcn n LEU 235 CO 0.34 0.34 0.49 0.00 -1.33 0.00 0.00 177.39 177.23 1jcn n ALA 236 N 0.05 -3.47 -2.56 -1.18 0.00 -1.17 -3.39 120.51 108.79 1jcn n ALA 236 Ca 0.12 0.56 -0.42 0.00 0.00 0.00 0.00 53.44 53.69 1jcn n ALA 236 Cb 0.45 -1.68 -0.06 0.00 0.00 0.00 0.00 19.45 18.16 1jcn n ALA 236 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1jcn s SER 237 N -0.10 6.46 0.10 0.00 0.01 0.11 -4.87 113.70 115.41 1jcn s SER 237 Ca 0.85 0.12 0.04 0.00 1.31 0.00 0.00 55.95 58.27 1jcn s SER 237 Cb -1.19 -2.37 -0.04 0.00 0.21 0.00 0.00 66.02 62.63 1jcn s SER 237 CO 0.55 -0.75 -0.11 -0.54 0.41 0.00 0.00 173.24 172.79 1jcn s LYS 238 N 3.04 0.88 0.67 12.44 1.02 -1.26 -1.53 119.74 135.01 1jcn s LYS 238 Ca 0.29 -1.14 -0.07 0.00 0.02 0.00 0.00 55.97 55.06 1jcn s LYS 238 Cb -0.13 -0.66 0.15 0.00 -0.52 0.00 0.00 37.83 36.67 1jcn s LYS 238 CO 0.18 0.12 0.92 -0.40 -0.92 0.00 0.00 175.35 175.25 1jcn n ASP 239 N 0.66 0.57 0.30 2.83 5.68 0.10 -4.82 116.55 121.87 1jcn n ASP 239 Ca -0.17 -1.63 0.19 0.00 -0.50 0.00 0.00 54.79 52.68 1jcn n ASP 239 Cb 0.57 -0.66 1.00 0.00 -1.14 0.00 0.00 41.12 40.89 1jcn n ASP 239 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 1jcn h SER 240 N -0.93 0.00 -0.68 -1.12 0.87 -2.02 -0.87 113.55 108.80 1jcn h SER 240 Ca -0.30 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1jcn h SER 240 Cb 0.95 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.91 1jcn h SER 240 CO 0.26 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.56 1jcn n GLN 241 N -3.28 2.59 -1.09 2.24 6.02 -1.26 -4.93 117.38 117.66 1jcn n GLN 241 Ca -0.02 -2.45 -0.03 0.00 -0.01 0.00 0.00 57.00 54.49 1jcn n GLN 241 Cb 0.21 -1.53 -0.01 0.00 1.02 0.00 0.00 30.24 29.92 1jcn n GLN 241 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1jcn n LYS 242 N 1.49 -0.38 -3.65 -1.09 4.76 -0.33 -5.03 118.16 113.93 1jcn n LYS 242 Ca 0.23 0.49 -0.32 0.00 -2.87 0.00 0.00 58.31 55.84 1jcn n LYS 242 Cb 0.58 -4.08 -0.05 0.00 -1.84 0.00 0.00 35.03 29.64 1jcn n LYS 242 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1jcn s GLN 243 N -1.77 3.64 0.46 1.97 -0.21 -1.26 -4.80 119.66 117.69 1jcn s GLN 243 Ca 0.00 -0.04 -0.25 0.00 0.02 0.00 0.00 55.36 55.09 1jcn s GLN 243 Cb 0.00 -2.84 -0.08 0.00 1.00 0.00 0.00 33.01 31.09 1jcn s GLN 243 CO 0.00 0.46 1.34 -0.51 -2.12 0.00 0.00 175.29 174.46 1jcn s LEU 244 N -2.61 4.08 0.40 2.90 1.43 -1.26 0.03 118.68 123.65 1jcn s LEU 244 Ca 0.41 2.72 -0.23 0.00 -1.03 0.00 0.00 54.13 56.00 1jcn s LEU 244 Cb -0.12 -4.03 -0.10 0.00 0.03 0.00 0.00 46.19 41.97 1jcn s LEU 244 CO 0.24 -1.12 0.97 -0.76 0.23 0.00 0.00 176.35 175.91 1jcn s LEU 245 N -2.82 4.09 -0.02 1.79 1.43 -0.58 -4.54 118.68 118.03 1jcn s LEU 245 Ca 0.62 1.81 -0.04 0.00 -1.03 0.00 0.00 54.13 55.50 1jcn s LEU 245 Cb -0.39 -4.32 0.00 0.00 0.03 0.00 0.00 46.19 41.51 1jcn s LEU 245 CO 0.49 -0.32 0.08 0.00 0.23 0.00 0.00 176.35 176.83 1jcn s GLY 247 N -0.60 1.94 -0.12 0.00 0.00 -0.65 -1.79 107.32 106.10 1jcn s GLY 247 Ca -0.07 -1.93 -0.20 0.00 0.00 0.00 0.00 44.72 42.52 1jcn s GLY 247 CO 0.00 -1.96 0.50 0.00 0.00 0.00 0.00 173.10 171.65 1jcn s ALA 248 N -2.64 -1.27 0.08 3.20 0.00 -0.75 -0.61 121.76 119.78 1jcn s ALA 248 Ca 0.30 1.18 -0.05 0.00 0.00 0.00 0.00 51.96 53.38 1jcn s ALA 248 Cb -0.01 -0.47 -0.05 0.00 0.00 0.00 0.00 23.12 22.59 1jcn s ALA 248 CO 0.14 -0.27 0.32 0.00 0.00 0.00 0.00 175.76 175.95 1jcn s ALA 249 N -0.39 3.83 0.06 0.00 0.00 -0.84 -1.57 121.76 122.85 1jcn s ALA 249 Ca -0.05 -0.58 -0.10 0.00 0.00 0.00 0.00 51.96 51.22 1jcn s ALA 249 Cb -0.03 -2.08 0.01 0.00 0.00 0.00 0.00 23.12 21.01 1jcn s ALA 249 CO 0.03 0.68 0.22 0.14 0.00 0.00 0.00 175.76 176.82 1jcn s VAL 250 N -1.50 0.12 0.00 0.00 -7.23 -0.72 -4.41 120.40 106.66 1jcn s VAL 250 Ca 0.35 -0.96 0.00 0.00 -1.81 0.00 0.00 61.98 59.56 1jcn s VAL 250 Cb -0.13 -1.08 0.00 0.00 0.56 0.00 0.00 36.38 35.73 1jcn s VAL 250 CO 0.22 -0.53 0.00 0.61 -0.31 0.00 0.00 175.10 175.09 1jcn n GLY 251 N 0.36 -0.57 0.72 2.32 0.00 -1.26 -1.28 105.19 105.49 1jcn n GLY 251 Ca -0.17 -1.71 0.05 0.00 0.00 0.00 0.00 46.02 44.19 1jcn n GLY 251 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jcn n THR 252 N -0.96 1.04 -3.54 2.61 -2.24 -1.26 -4.80 114.28 105.12 1jcn n THR 252 Ca 0.00 -1.71 -0.26 0.00 -2.27 0.00 0.00 64.05 59.80 1jcn n THR 252 Cb 0.00 0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.48 1jcn n THR 252 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1jcn s ARG 253 N -1.56 3.53 0.29 -0.78 6.06 -1.26 -4.72 118.95 120.52 1jcn s ARG 253 Ca 0.28 -0.28 0.04 0.00 -2.50 0.00 0.00 55.73 53.26 1jcn s ARG 253 Cb 0.28 -2.75 0.72 0.00 0.06 0.00 0.00 34.95 33.26 1jcn s ARG 253 CO -0.06 0.29 1.73 0.93 -2.50 0.00 0.00 175.30 175.69 1jcn h GLU 254 N 1.55 0.53 -0.61 5.12 3.07 -1.99 0.40 114.58 122.64 1jcn h GLU 254 Ca -0.49 -0.03 0.18 0.00 -0.50 0.00 0.00 59.36 58.52 1jcn h GLU 254 Cb 1.20 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.97 1jcn h GLU 254 CO 0.65 0.35 0.49 -0.44 -1.40 0.00 0.00 179.01 178.66 1jcn h ASP 255 N 0.55 0.00 0.86 1.42 5.19 -2.00 0.44 116.42 122.87 1jcn h ASP 255 Ca 0.56 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.97 1jcn h ASP 255 Cb 0.98 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.49 1jcn h ASP 255 CO -0.46 0.00 0.00 0.47 -3.12 0.00 0.00 179.24 176.13 1jcn n ASP 256 N -4.12 0.43 0.10 6.45 8.00 0.14 -3.16 116.55 124.39 1jcn n ASP 256 Ca 0.12 0.58 0.01 0.00 0.71 0.00 0.00 54.79 56.21 1jcn n ASP 256 Cb 0.73 -0.68 0.35 0.00 -0.02 0.00 0.00 41.12 41.49 1jcn n ASP 256 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1jcn h LYS 257 N 0.00 0.26 -0.35 -1.24 1.57 -0.99 -0.69 116.57 115.14 1jcn h LYS 257 Ca 0.00 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.57 1jcn h LYS 257 Cb 0.43 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1jcn h LYS 257 CO 0.00 0.44 -0.32 -0.92 -0.57 0.00 0.00 179.45 178.08 1jcn h TYR 258 N 0.24 0.99 -0.52 -1.35 3.20 -1.73 -2.38 116.97 115.43 1jcn h TYR 258 Ca 0.05 -0.29 -0.05 0.00 3.14 0.00 0.00 58.73 61.57 1jcn h TYR 258 Cb 0.47 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 1jcn h TYR 258 CO 0.01 1.08 0.11 -0.09 -1.64 0.00 0.00 178.16 177.63 1jcn h ARG 259 N 0.62 0.84 -0.92 1.82 2.43 -1.62 -2.64 114.38 114.91 1jcn h ARG 259 Ca 0.06 -0.21 0.04 0.00 -0.81 0.00 0.00 59.98 59.06 1jcn h ARG 259 Cb 0.90 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 30.29 1jcn h ARG 259 CO 0.08 0.81 0.60 1.25 -1.51 0.00 0.00 179.97 181.20 1jcn h LEU 260 N 0.73 0.99 -0.55 3.80 5.85 -1.08 -1.78 115.31 123.28 1jcn h LEU 260 Ca 0.16 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 1jcn h LEU 260 Cb 0.35 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 1jcn h LEU 260 CO 0.00 0.68 0.34 -0.78 -0.34 0.00 0.00 178.44 178.35 1jcn h ASP 261 N 1.16 0.65 -0.38 1.25 1.82 -1.10 -0.80 116.42 119.02 1jcn h ASP 261 Ca 0.37 -0.04 -0.05 0.00 -0.39 0.00 0.00 57.03 56.92 1jcn h ASP 261 Cb 0.01 -0.16 -0.01 0.00 0.68 0.00 0.00 39.33 39.84 1jcn h ASP 261 CO -0.12 0.50 0.06 -0.07 -1.61 0.00 0.00 179.24 177.99 1jcn h LEU 262 N 0.74 0.60 -0.82 2.28 3.38 -1.08 -1.36 115.31 119.05 1jcn h LEU 262 Ca 0.20 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1jcn h LEU 262 Cb -0.04 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 1jcn h LEU 262 CO -0.04 0.71 0.48 -0.07 0.09 0.00 0.00 178.44 179.61 1jcn h LEU 263 N 0.47 0.99 -0.66 1.67 3.38 -1.11 0.12 115.31 120.16 1jcn h LEU 263 Ca 0.11 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1jcn h LEU 263 Cb 0.37 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1jcn h LEU 263 CO 0.01 0.77 -0.28 0.00 0.09 0.00 0.00 178.44 179.03 1jcn h THR 264 N 1.12 1.28 -0.23 0.22 1.03 -1.01 -1.84 112.91 113.49 1jcn h THR 264 Ca 0.29 -1.41 -0.10 0.00 -0.01 0.00 0.00 66.41 65.18 1jcn h THR 264 Cb -0.02 1.31 -0.01 0.00 -1.07 0.00 0.00 68.15 68.35 1jcn h THR 264 CO -0.05 0.47 -0.29 1.56 -0.01 0.00 0.00 175.52 177.19 1jcn h GLN 265 N 0.63 0.45 0.00 0.00 4.20 -0.76 -1.43 115.11 118.20 1jcn h GLN 265 Ca 0.08 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1jcn h GLN 265 Cb 0.80 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1jcn h GLN 265 CO 0.07 0.70 0.00 0.00 -0.67 0.00 0.00 178.83 178.93 1jcn n ALA 266 N -2.49 1.86 -1.51 3.87 0.00 0.36 -4.87 120.51 117.73 1jcn n ALA 266 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1jcn n ALA 266 Cb 0.43 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1jcn n ALA 266 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jcn n GLY 267 N 0.09 0.87 3.77 0.00 0.00 -0.54 -4.44 105.19 104.95 1jcn n GLY 267 Ca 0.07 -0.60 -0.38 0.00 0.00 0.00 0.00 46.02 45.11 1jcn n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jcn s VAL 268 N -2.17 2.96 -0.18 1.61 0.11 -0.74 -4.87 120.40 117.13 1jcn s VAL 268 Ca 0.00 0.77 0.05 0.00 -2.93 0.00 0.00 61.98 59.86 1jcn s VAL 268 Cb 0.00 -3.41 -0.22 0.00 -1.53 0.00 0.00 36.38 31.22 1jcn s VAL 268 CO 0.00 0.03 0.13 0.47 -3.33 0.00 0.00 175.10 172.41 1jcn n ASP 269 N -0.27 1.42 -4.10 3.54 8.00 -0.74 -4.87 116.55 119.52 1jcn n ASP 269 Ca 0.06 0.07 -0.20 0.00 0.71 0.00 0.00 54.79 55.44 1jcn n ASP 269 Cb 0.47 -0.18 -0.14 0.00 -0.02 0.00 0.00 41.12 41.25 1jcn n ASP 269 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1jcn s VAL 270 N -2.54 0.98 -0.09 2.53 1.01 -1.10 -2.62 120.40 118.57 1jcn s VAL 270 Ca -0.22 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 60.99 1jcn s VAL 270 Cb 0.08 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.60 1jcn s VAL 270 CO 0.73 0.07 -0.16 -0.63 0.00 0.00 0.00 175.10 175.12 1jcn s ILE 271 N -0.65 1.45 -0.17 2.22 -1.09 -0.56 -1.81 121.20 120.59 1jcn s ILE 271 Ca 0.02 -0.64 -0.03 0.00 -2.23 0.00 0.00 60.65 57.77 1jcn s ILE 271 Cb -0.07 -1.31 -0.02 0.00 -1.58 0.00 0.00 42.46 39.48 1jcn s ILE 271 CO 0.01 0.43 -0.05 0.54 -1.23 0.00 0.00 174.94 174.63 1jcn s VAL 272 N 0.76 3.60 -0.69 2.92 0.11 -0.61 -1.08 120.40 125.42 1jcn s VAL 272 Ca -0.12 -0.45 -0.25 0.00 -2.93 0.00 0.00 61.98 58.23 1jcn s VAL 272 Cb -0.16 -2.59 0.04 0.00 -1.53 0.00 0.00 36.38 32.15 1jcn s VAL 272 CO 0.02 0.48 1.14 -0.76 -3.33 0.00 0.00 175.10 172.65 1jcn s LEU 273 N 0.69 3.66 -0.30 2.54 1.43 -0.88 -1.75 118.68 124.06 1jcn s LEU 273 Ca -0.03 -0.59 -0.29 0.00 -1.03 0.00 0.00 54.13 52.20 1jcn s LEU 273 Cb -0.15 -2.57 -0.02 0.00 0.03 0.00 0.00 46.19 43.48 1jcn s LEU 273 CO 0.02 -1.64 1.69 -0.62 0.23 0.00 0.00 176.35 176.03 1jcn s ASP 274 N 3.60 6.11 -0.05 2.29 2.15 -0.41 -3.11 116.67 127.27 1jcn s ASP 274 Ca 0.31 1.35 -0.30 0.00 0.43 0.00 0.00 52.55 54.34 1jcn s ASP 274 Cb -0.11 -2.53 0.07 0.00 -0.30 0.00 0.00 42.92 40.04 1jcn s ASP 274 CO 0.14 -1.52 0.65 -0.55 -0.17 0.00 0.00 175.17 173.73 1jcn s SER 275 N 5.19 -0.63 0.41 -0.34 0.15 -1.26 -4.71 113.70 112.51 1jcn s SER 275 Ca 0.75 0.67 0.23 0.00 0.70 0.00 0.00 55.95 58.31 1jcn s SER 275 Cb -0.22 0.52 0.38 0.00 -1.71 0.00 0.00 66.02 64.99 1jcn s SER 275 CO 0.32 -0.60 1.61 0.77 1.20 0.00 0.00 173.24 176.54 1jcn h SER 276 N 3.05 0.00 -1.79 5.45 4.64 -1.94 -3.11 113.55 119.86 1jcn h SER 276 Ca -0.27 -0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.72 1jcn h SER 276 Cb 1.14 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.94 1jcn h SER 276 CO 0.39 0.00 -0.66 -1.58 -0.87 0.00 0.00 176.83 174.12 1jcn s GLN 277 N -3.20 0.69 0.00 4.77 -0.44 -1.26 -4.78 119.66 115.44 1jcn s GLN 277 Ca 0.07 -0.83 0.18 0.00 -2.50 0.00 0.00 55.36 52.28 1jcn s GLN 277 Cb 0.06 -0.61 0.80 0.00 -1.64 0.00 0.00 33.01 31.62 1jcn s GLN 277 CO 0.67 -1.21 1.55 0.41 0.50 0.00 0.00 175.29 177.21 1jcn n GLY 278 N 4.18 -1.03 3.17 2.59 0.00 0.16 -4.45 105.19 109.81 1jcn n GLY 278 Ca 0.12 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1jcn n GLY 278 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1jcn n ASN 279 N -1.43 4.62 -4.07 1.61 5.15 -1.26 -4.67 115.26 115.21 1jcn n ASN 279 Ca 0.06 -2.92 -0.09 0.00 -0.60 0.00 0.00 54.58 51.02 1jcn n ASN 279 Cb 0.18 -1.66 -0.11 0.00 -0.53 0.00 0.00 39.78 37.67 1jcn n ASN 279 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1jcn s SER 280 N 3.25 0.58 0.49 1.20 1.04 -1.26 -5.03 113.70 113.97 1jcn s SER 280 Ca 0.48 -0.78 0.15 0.00 0.48 0.00 0.00 55.95 56.28 1jcn s SER 280 Cb 0.07 0.13 1.15 0.00 0.10 0.00 0.00 66.02 67.47 1jcn s SER 280 CO -0.00 -0.42 2.10 1.62 0.98 0.00 0.00 173.24 177.51 1jcn h VAL 281 N 3.78 1.05 0.12 5.02 3.04 -1.99 -0.82 116.25 126.46 1jcn h VAL 281 Ca -0.34 -0.20 -0.01 0.00 -1.01 0.00 0.00 66.70 65.15 1jcn h VAL 281 Cb 1.18 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 31.51 1jcn h VAL 281 CO 0.54 0.06 -0.06 1.88 -1.01 0.00 0.00 177.57 178.98 1jcn h TYR 282 N 0.05 -0.15 -0.51 3.17 0.05 -1.94 -0.49 116.97 117.15 1jcn h TYR 282 Ca 0.01 -0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.70 1jcn h TYR 282 Cb 0.09 0.05 -0.02 0.00 1.01 0.00 0.00 36.73 37.86 1jcn h TYR 282 CO 0.00 0.08 -0.02 0.37 -1.05 0.00 0.00 178.16 177.54 1jcn h GLN 283 N -0.37 0.91 -0.41 4.88 4.15 -1.74 -1.62 115.11 120.90 1jcn h GLN 283 Ca -0.02 -0.30 0.03 0.00 0.77 0.00 0.00 58.65 59.14 1jcn h GLN 283 Cb 0.30 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 27.88 1jcn h GLN 283 CO 0.03 0.94 0.20 0.82 -1.93 0.00 0.00 178.83 178.89 1jcn h ILE 284 N 0.77 0.96 -0.31 2.39 2.04 -1.11 0.11 117.51 122.36 1jcn h ILE 284 Ca 0.14 -0.14 -0.08 0.00 1.00 0.00 0.00 64.86 65.78 1jcn h ILE 284 Cb 0.55 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1jcn h ILE 284 CO 0.03 0.07 -0.14 0.00 0.00 0.00 0.00 178.15 178.11 1jcn h ALA 285 N 1.22 1.17 -0.36 1.87 0.00 -0.93 -1.06 119.26 121.18 1jcn h ALA 285 Ca 0.18 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 1jcn h ALA 285 Cb 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1jcn h ALA 285 CO -0.13 0.53 -0.21 1.98 0.00 0.00 0.00 179.25 181.41 1jcn h MET 286 N 0.50 0.70 -0.33 0.00 1.85 -0.54 -1.26 114.93 115.85 1jcn h MET 286 Ca 0.09 -0.27 -0.07 0.00 -0.61 0.00 0.00 59.70 58.84 1jcn h MET 286 Cb 0.54 -0.04 -0.01 0.00 0.43 0.00 0.00 31.60 32.52 1jcn h MET 286 CO 0.03 0.85 -0.07 0.28 -0.40 0.00 0.00 176.91 177.61 1jcn h VAL 287 N 0.61 1.28 -0.29 -5.77 2.07 -0.26 -1.79 116.25 112.10 1jcn h VAL 287 Ca 0.09 -1.11 0.04 0.00 0.82 0.00 0.00 66.70 66.54 1jcn h VAL 287 Cb 0.69 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.76 1jcn h VAL 287 CO 0.05 0.36 0.05 0.45 0.02 0.00 0.00 177.57 178.51 1jcn h HIS 288 N 0.40 0.09 0.46 1.57 3.86 -1.01 -1.32 115.15 119.20 1jcn h HIS 288 Ca 0.08 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 1jcn h HIS 288 Cb 0.56 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.01 1jcn h HIS 288 CO 0.05 0.02 -0.41 -0.92 0.86 0.00 0.00 177.93 177.53 1jcn h TYR 289 N 0.16 -1.10 -0.30 2.45 3.20 -1.11 -1.82 116.97 118.46 1jcn h TYR 289 Ca 0.13 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.05 1jcn h TYR 289 Cb 0.14 0.42 -0.04 0.00 1.54 0.00 0.00 36.73 38.80 1jcn h TYR 289 CO -0.17 -0.57 0.07 0.82 -1.64 0.00 0.00 178.16 176.67 1jcn h ILE 290 N -0.87 0.87 -0.49 1.81 2.04 -1.24 0.25 117.51 119.88 1jcn h ILE 290 Ca -0.05 -0.06 0.13 0.00 1.00 0.00 0.00 64.86 65.89 1jcn h ILE 290 Cb 0.75 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1jcn h ILE 290 CO -0.03 0.03 0.35 0.50 0.00 0.00 0.00 178.15 179.00 1jcn h LYS 291 N 0.18 0.04 0.01 2.37 1.63 -1.15 0.32 116.57 119.97 1jcn h LYS 291 Ca 0.14 -0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.82 1jcn h LYS 291 Cb 0.14 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.75 1jcn h LYS 291 CO -0.17 0.03 -0.62 0.37 -3.45 0.00 0.00 179.45 175.60 1jcn h GLN 292 N 0.04 0.03 0.00 1.90 5.75 -0.27 -3.37 115.11 119.19 1jcn h GLN 292 Ca 0.23 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.60 1jcn h GLN 292 Cb 0.88 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.43 1jcn h GLN 292 CO -0.01 1.02 -0.70 -0.22 -2.65 0.00 0.00 178.83 176.27 1jcn h LYS 293 N -0.93 0.00 -2.09 1.69 3.64 -0.27 -3.40 116.57 115.22 1jcn h LYS 293 Ca -0.16 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.65 1jcn h LYS 293 Cb 1.20 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 32.61 1jcn h LYS 293 CO -0.07 0.29 -0.89 0.66 -2.27 0.00 0.00 179.45 177.17 1jcn n TYR 294 N -3.05 1.49 -0.11 1.91 4.01 0.11 -4.97 117.16 116.55 1jcn n TYR 294 Ca -0.01 -3.84 0.27 0.00 -0.16 0.00 0.00 57.90 54.17 1jcn n TYR 294 Cb 0.70 -0.44 0.70 0.00 -0.31 0.00 0.00 39.34 39.99 1jcn n TYR 294 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1jcn h PRO 295 N 3.90 0.00 -0.32 -0.72 0.11 -1.72 -0.06 132.00 133.20 1jcn h PRO 295 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1jcn h PRO 295 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1jcn h PRO 295 CO 0.63 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.14 1jcn n HIS 296 N -3.88 0.42 -3.95 0.65 8.25 -1.26 -4.88 115.22 110.56 1jcn n HIS 296 Ca 0.16 -0.21 -0.35 0.00 -0.26 0.00 0.00 57.72 57.07 1jcn n HIS 296 Cb 0.97 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.98 1jcn n HIS 296 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1jcn s LEU 297 N -1.37 3.89 0.16 2.41 2.96 -0.04 -5.00 118.68 121.69 1jcn s LEU 297 Ca 0.34 0.11 -0.23 0.00 -0.22 0.00 0.00 54.13 54.12 1jcn s LEU 297 Cb 0.19 -1.99 -0.08 0.00 0.50 0.00 0.00 46.19 44.81 1jcn s LEU 297 CO 0.26 0.17 0.73 -1.10 -1.32 0.00 0.00 176.35 175.10 1jcn s GLN 298 N 0.38 4.46 -0.13 1.98 -1.52 -1.08 -4.92 119.66 118.83 1jcn s GLN 298 Ca 0.04 1.05 0.02 0.00 -1.95 0.00 0.00 55.36 54.52 1jcn s GLN 298 Cb -0.12 -3.20 0.01 0.00 -0.22 0.00 0.00 33.01 29.48 1jcn s GLN 298 CO -0.00 0.56 -0.20 0.08 -0.25 0.00 0.00 175.29 175.48 1jcn s VAL 299 N -1.20 1.85 -0.20 1.09 1.01 -1.26 -1.50 120.40 120.19 1jcn s VAL 299 Ca 0.36 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 1jcn s VAL 299 Cb -0.22 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 1jcn s VAL 299 CO 0.24 0.51 0.11 -0.63 0.00 0.00 0.00 175.10 175.33 1jcn s ILE 300 N 0.86 5.17 0.11 2.22 1.01 -0.24 0.31 121.20 130.64 1jcn s ILE 300 Ca -0.07 0.10 -0.22 0.00 0.00 0.00 0.00 60.65 60.46 1jcn s ILE 300 Cb -0.15 -3.35 -0.07 0.00 0.01 0.00 0.00 42.46 38.89 1jcn s ILE 300 CO -0.01 0.44 0.66 -0.83 0.00 0.00 0.00 174.94 175.20 1jcn s GLY 301 N 0.41 2.78 0.38 6.18 0.00 0.44 -2.07 107.32 115.45 1jcn s GLY 301 Ca 0.06 0.18 -0.10 0.00 0.00 0.00 0.00 44.72 44.86 1jcn s GLY 301 CO -0.01 0.66 -0.21 0.61 0.00 0.00 0.00 173.10 174.15 1jcn n GLY 302 N 1.72 -2.11 3.71 0.20 0.00 -1.18 -2.44 105.19 105.08 1jcn n GLY 302 Ca -0.08 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 1jcn n GLY 302 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jcn n ASN 303 N 1.61 3.44 -4.13 1.61 4.13 -1.17 -4.30 115.26 116.44 1jcn n ASN 303 Ca 0.02 1.12 -0.09 0.00 1.68 0.00 0.00 54.58 57.32 1jcn n ASN 303 Cb 0.28 -1.52 -0.10 0.00 -1.54 0.00 0.00 39.78 36.91 1jcn n ASN 303 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1jcn s VAL 304 N 0.28 0.12 0.00 2.41 -7.23 -1.03 -0.67 120.40 114.27 1jcn s VAL 304 Ca 0.69 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 59.00 1jcn s VAL 304 Cb -0.57 -1.95 0.00 0.00 0.56 0.00 0.00 36.38 34.42 1jcn s VAL 304 CO 0.45 -0.53 0.16 1.33 -0.31 0.00 0.00 175.10 176.20 1jcn n VAL 305 N -0.07 0.00 -4.21 1.32 0.24 -1.26 -2.56 118.33 111.78 1jcn n VAL 305 Ca -0.07 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.07 1jcn n VAL 305 Cb 0.63 1.60 -0.11 0.00 -1.47 0.00 0.00 33.84 34.49 1jcn n VAL 305 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1jcn s THR 306 N 0.00 1.11 0.30 3.34 -4.23 -1.26 -4.68 115.64 110.22 1jcn s THR 306 Ca 0.00 -1.72 0.01 0.00 -1.18 0.00 0.00 61.69 58.80 1jcn s THR 306 Cb 0.00 -1.48 0.15 0.00 1.34 0.00 0.00 72.50 72.51 1jcn s THR 306 CO 0.00 -0.53 1.83 0.00 -0.54 0.00 0.00 174.62 175.39 1jcn h ALA 307 N 3.45 1.25 -0.76 3.99 0.00 -1.93 -2.27 119.26 123.00 1jcn h ALA 307 Ca -0.38 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1jcn h ALA 307 Cb 1.19 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 1jcn h ALA 307 CO 0.53 0.51 0.48 0.00 0.00 0.00 0.00 179.25 180.78 1jcn h ALA 308 N 1.39 1.42 -0.29 0.00 0.00 -1.96 0.62 119.26 120.44 1jcn h ALA 308 Ca 0.15 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1jcn h ALA 308 Cb 0.33 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1jcn h ALA 308 CO 0.00 0.52 -0.30 1.96 0.00 0.00 0.00 179.25 181.43 1jcn h GLN 309 N 1.04 0.71 -0.88 0.00 4.20 -1.89 -3.13 115.11 115.17 1jcn h GLN 309 Ca 0.28 -0.38 0.04 0.00 0.06 0.00 0.00 58.65 58.64 1jcn h GLN 309 Cb -0.08 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.66 1jcn h GLN 309 CO -0.06 1.00 0.58 0.00 -0.67 0.00 0.00 178.83 179.68 1jcn h ALA 310 N 0.70 1.45 -0.43 3.87 0.00 -0.76 -2.92 119.26 121.17 1jcn h ALA 310 Ca 0.04 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1jcn h ALA 310 Cb 0.87 -0.31 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 1jcn h ALA 310 CO 0.07 0.46 0.09 -0.22 0.00 0.00 0.00 179.25 179.65 1jcn h LYS 311 N 1.09 0.22 -0.61 0.00 3.64 -0.85 -1.19 116.57 118.87 1jcn h LYS 311 Ca 0.35 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.69 1jcn h LYS 311 Cb 0.03 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 1jcn h LYS 311 CO -0.10 0.14 0.26 -0.91 -2.27 0.00 0.00 179.45 176.57 1jcn h ASN 312 N 0.22 0.82 0.53 4.20 -0.26 -1.59 -0.80 115.58 118.71 1jcn h ASN 312 Ca 0.21 -0.15 -0.12 0.00 -0.56 0.00 0.00 56.30 55.68 1jcn h ASN 312 Cb 0.26 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 37.29 1jcn h ASN 312 CO -0.27 0.75 -0.55 -0.07 -1.06 0.00 0.00 177.43 176.23 1jcn h LEU 313 N 0.84 0.02 -0.02 1.61 3.38 -1.52 -1.78 115.31 117.84 1jcn h LEU 313 Ca 0.20 -0.01 -0.26 0.00 0.09 0.00 0.00 57.88 57.90 1jcn h LEU 313 Cb 0.17 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 40.93 1jcn h LEU 313 CO -0.02 0.56 -1.02 0.40 0.09 0.00 0.00 178.44 178.46 1jcn h ILE 314 N 0.01 1.28 -0.26 1.22 2.04 -0.97 -1.95 117.51 118.88 1jcn h ILE 314 Ca -0.00 -2.21 -0.04 0.00 1.00 0.00 0.00 64.86 63.60 1jcn h ILE 314 Cb 0.97 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 39.37 1jcn h ILE 314 CO 0.07 0.69 -0.00 0.44 0.00 0.00 0.00 178.15 179.35 1jcn h ASP 315 N 0.42 0.36 1.09 1.72 3.32 -1.06 -1.02 116.42 121.25 1jcn h ASP 315 Ca -0.12 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.87 1jcn h ASP 315 Cb 1.67 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 41.12 1jcn h ASP 315 CO 0.20 0.43 0.00 0.00 -1.72 0.00 0.00 179.24 178.15 1jcn h ALA 316 N 1.62 1.00 0.00 3.45 0.00 -1.19 -3.47 119.26 120.68 1jcn h ALA 316 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1jcn h ALA 316 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1jcn h ALA 316 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1jcn n GLY 317 N 0.25 1.44 3.75 0.00 0.00 -0.39 -4.41 105.19 105.83 1jcn n GLY 317 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1jcn n GLY 317 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1jcn s VAL 318 N -2.00 2.73 -1.60 1.61 -7.23 -0.76 -4.91 120.40 108.24 1jcn s VAL 318 Ca 0.00 0.39 0.23 0.00 -1.81 0.00 0.00 61.98 60.79 1jcn s VAL 318 Cb 0.00 -3.02 -0.03 0.00 0.56 0.00 0.00 36.38 33.90 1jcn s VAL 318 CO 0.00 -0.16 1.14 0.47 -0.31 0.00 0.00 175.10 176.24 1jcn n ASP 319 N -2.13 1.44 -3.56 4.85 8.00 0.15 -4.89 116.55 120.41 1jcn n ASP 319 Ca 0.13 -1.15 -0.06 0.00 0.71 0.00 0.00 54.79 54.41 1jcn n ASP 319 Cb 0.50 0.56 -0.02 0.00 -0.02 0.00 0.00 41.12 42.14 1jcn n ASP 319 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1jcn s GLY 320 N -2.68 -0.39 -0.05 0.44 0.00 -1.12 -1.82 107.32 101.71 1jcn s GLY 320 Ca 0.16 1.13 0.04 0.00 0.00 0.00 0.00 44.72 46.05 1jcn s GLY 320 CO 0.66 0.37 -0.18 1.08 0.00 0.00 0.00 173.10 175.03 1jcn s LEU 321 N -2.44 1.92 -0.29 0.66 1.43 -0.72 -0.42 118.68 118.83 1jcn s LEU 321 Ca 0.07 -0.37 -0.14 0.00 -1.03 0.00 0.00 54.13 52.67 1jcn s LEU 321 Cb -0.01 -1.02 -0.04 0.00 0.03 0.00 0.00 46.19 45.16 1jcn s LEU 321 CO -0.06 0.16 0.30 -0.60 0.23 0.00 0.00 176.35 176.38 1jcn s ARG 322 N 0.06 3.88 -0.16 1.70 3.52 -1.02 -0.54 118.95 126.38 1jcn s ARG 322 Ca -0.05 -0.20 -0.04 0.00 -0.13 0.00 0.00 55.73 55.31 1jcn s ARG 322 Cb -0.12 -3.69 -0.03 0.00 -1.56 0.00 0.00 34.95 29.55 1jcn s ARG 322 CO 0.03 -0.30 -0.04 0.08 -0.81 0.00 0.00 175.30 174.26 1jcn s VAL 323 N 1.94 3.84 0.00 7.11 1.01 0.19 -2.46 120.40 132.03 1jcn s VAL 323 Ca 0.11 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1jcn s VAL 323 Cb -0.16 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.53 1jcn s VAL 323 CO 0.11 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.30 1jcn n GLY 324 N 3.67 4.50 3.28 4.51 0.00 -1.06 -0.88 105.19 119.21 1jcn n GLY 324 Ca -0.17 -0.64 0.03 0.00 0.00 0.00 0.00 46.02 45.24 1jcn n GLY 324 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1jcn s MET 325 N -3.15 0.34 0.00 1.61 1.75 -1.26 -4.46 119.30 114.12 1jcn s MET 325 Ca 0.00 0.72 0.00 0.00 -1.25 0.00 0.00 55.69 55.16 1jcn s MET 325 Cb 0.00 0.42 0.00 0.00 2.84 0.00 0.00 34.83 38.09 1jcn s MET 325 CO 0.00 -0.26 0.00 0.41 -0.65 0.00 0.00 175.02 174.52 1jcn n GLY 326 N 5.28 2.12 2.87 2.11 0.00 -1.26 -1.95 105.19 114.36 1jcn n GLY 326 Ca -0.07 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 1jcn n GLY 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jcn n GLY 328 N -0.63 -2.55 3.28 0.00 0.00 -1.26 -4.76 105.19 99.27 1jcn n GLY 328 Ca 0.12 -1.27 -0.33 0.00 0.00 0.00 0.00 46.02 44.54 1jcn n GLY 328 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1jcn n SER 329 N -3.38 -2.56 -4.28 1.61 7.64 -1.26 -4.88 113.62 106.51 1jcn n SER 329 Ca -0.03 0.05 -0.16 0.00 1.01 0.00 0.00 58.87 59.75 1jcn n SER 329 Cb 0.36 -0.99 -0.10 0.00 -1.01 0.00 0.00 64.21 62.46 1jcn n SER 329 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1jcn s ILE 330 N -2.26 1.35 0.02 0.44 -4.36 -1.26 -5.04 121.20 110.09 1jcn s ILE 330 Ca 0.54 -2.10 0.01 0.00 -0.26 0.00 0.00 60.65 58.84 1jcn s ILE 330 Cb -0.13 -1.90 -0.01 0.00 1.25 0.00 0.00 42.46 41.67 1jcn s ILE 330 CO 0.68 -0.69 -0.04 0.00 0.24 0.00 0.00 174.94 175.13 1jcn h ILE 332 N 4.81 0.81 0.00 0.00 2.10 -2.01 -0.66 117.51 122.56 1jcn h ILE 332 Ca -0.30 -0.83 0.00 0.00 1.08 0.00 0.00 64.86 64.81 1jcn h ILE 332 Cb 1.20 1.50 0.00 0.00 -1.09 0.00 0.00 36.82 38.43 1jcn h ILE 332 CO 0.45 0.21 0.00 0.41 -1.08 0.00 0.00 178.15 178.14 1jcn n THR 333 N -3.79 0.20 -2.73 2.19 -1.04 -1.26 -4.14 114.28 103.70 1jcn n THR 333 Ca -0.02 0.05 -0.01 0.00 -2.04 0.00 0.00 64.05 62.03 1jcn n THR 333 Cb 0.31 -0.82 0.02 0.00 -1.82 0.00 0.00 70.33 68.02 1jcn n THR 333 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1jcn s GLN 334 N -2.18 0.25 0.55 -2.82 -0.21 -0.27 -5.17 119.66 109.81 1jcn s GLN 334 Ca 0.19 -0.19 -0.08 0.00 0.02 0.00 0.00 55.36 55.31 1jcn s GLN 334 Cb 0.10 0.00 -0.03 0.00 1.00 0.00 0.00 33.01 34.08 1jcn s GLN 334 CO 0.18 -0.33 0.89 -1.21 -2.12 0.00 0.00 175.29 172.70 1jcn s GLU 335 N 1.39 3.49 0.15 2.91 8.01 -1.10 -3.89 118.70 129.66 1jcn s GLU 335 Ca 0.20 0.39 -0.26 0.00 0.01 0.00 0.00 54.97 55.31 1jcn s GLU 335 Cb 0.08 -2.25 -0.07 0.00 -4.31 0.00 0.00 34.13 27.58 1jcn s GLU 335 CO -0.12 -0.40 0.82 0.54 0.01 0.00 0.00 175.26 176.11 1jcn s VAL 336 N -2.94 4.39 0.00 2.63 0.11 -1.26 -5.04 120.40 118.29 1jcn s VAL 336 Ca 0.51 1.79 0.00 0.00 -2.93 0.00 0.00 61.98 61.35 1jcn s VAL 336 Cb -0.11 -4.19 0.00 0.00 -1.53 0.00 0.00 36.38 30.56 1jcn s VAL 336 CO 0.48 0.47 0.00 0.23 -3.33 0.00 0.00 175.10 172.96 1jcn n MET 337 N 1.91 0.00 0.06 1.54 2.81 -1.26 -5.01 117.12 117.18 1jcn n MET 337 Ca -0.04 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 55.87 1jcn n MET 337 Cb 0.49 0.00 -0.05 0.00 -0.71 0.00 0.00 33.22 32.94 1jcn n MET 337 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1jcn h ALA 338 N -0.45 0.64 -2.68 3.04 0.00 -2.06 -3.47 119.26 114.28 1jcn h ALA 338 Ca 0.00 -0.68 -0.56 0.00 0.00 0.00 0.00 54.91 53.67 1jcn h ALA 338 Cb 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1jcn h ALA 338 CO 0.00 0.76 0.00 0.00 0.00 0.00 0.00 179.25 180.01 1jcn n GLY 340 N 1.56 -1.89 3.64 0.00 0.00 -1.26 -4.70 105.19 102.53 1jcn n GLY 340 Ca -0.09 -1.23 -0.08 0.00 0.00 0.00 0.00 46.02 44.62 1jcn n GLY 340 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1jcn s ARG 341 N -1.90 0.58 0.15 1.61 3.52 -0.82 -5.02 118.95 117.07 1jcn s ARG 341 Ca 0.00 0.81 -0.34 0.00 -0.13 0.00 0.00 55.73 56.07 1jcn s ARG 341 Cb 0.00 0.22 -0.15 0.00 -1.56 0.00 0.00 34.95 33.45 1jcn s ARG 341 CO 0.00 -0.09 1.32 -2.30 -0.81 0.00 0.00 175.30 173.42 1jcn n PRO 342 N 3.06 1.43 -0.16 5.12 -0.02 -1.26 -4.63 135.00 138.53 1jcn n PRO 342 Ca -0.16 0.51 -0.03 0.00 -2.02 0.00 0.00 63.50 61.81 1jcn n PRO 342 Cb 0.57 -2.12 0.06 0.00 -0.02 0.00 0.00 33.50 31.99 1jcn n PRO 342 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1jcn h GLN 343 N 4.27 0.28 -0.16 -0.52 5.75 -1.92 -1.97 115.11 120.84 1jcn h GLN 343 Ca -0.45 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.08 1jcn h GLN 343 Cb 1.32 -0.06 -0.06 0.00 1.07 0.00 0.00 27.48 29.75 1jcn h GLN 343 CO 0.76 0.19 -0.23 0.78 -2.65 0.00 0.00 178.83 177.68 1jcn h GLY 344 N 0.29 -0.20 1.00 2.39 0.00 -1.54 -1.29 103.07 103.72 1jcn h GLY 344 Ca 0.24 0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.82 1jcn h GLY 344 CO -0.29 -0.19 0.27 -0.84 0.00 0.00 0.00 176.54 175.49 1jcn h THR 345 N -0.27 1.22 -0.03 4.70 2.02 -1.29 -2.60 112.91 116.67 1jcn h THR 345 Ca 0.11 -0.67 0.03 0.00 0.77 0.00 0.00 66.41 66.65 1jcn h THR 345 Cb 0.44 0.53 -0.04 0.00 -1.74 0.00 0.00 68.15 67.33 1jcn h THR 345 CO -0.32 0.27 -0.21 0.00 0.37 0.00 0.00 175.52 175.63 1jcn h ALA 346 N 1.11 -0.24 -0.35 6.16 0.00 -0.91 -0.28 119.26 124.75 1jcn h ALA 346 Ca 0.21 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.16 1jcn h ALA 346 Cb 0.16 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1jcn h ALA 346 CO -0.02 -0.70 0.16 0.28 0.00 0.00 0.00 179.25 178.98 1jcn h VAL 347 N -0.32 0.97 0.01 0.00 2.07 -1.15 -1.58 116.25 116.25 1jcn h VAL 347 Ca 0.07 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1jcn h VAL 347 Cb 0.41 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1jcn h VAL 347 CO -0.21 0.06 -0.00 0.22 0.02 0.00 0.00 177.57 177.66 1jcn h TYR 348 N 0.34 -0.01 -0.35 1.57 3.20 -1.17 0.52 116.97 121.07 1jcn h TYR 348 Ca 0.15 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.94 1jcn h TYR 348 Cb 0.07 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 1jcn h TYR 348 CO -0.11 0.12 -0.11 0.87 -1.64 0.00 0.00 178.16 177.29 1jcn h LYS 349 N -0.14 0.61 0.23 1.82 1.79 -0.99 -0.98 116.57 118.91 1jcn h LYS 349 Ca -0.00 -0.19 -0.32 0.00 -2.18 0.00 0.00 60.65 57.96 1jcn h LYS 349 Cb 0.13 -0.06 0.03 0.00 -1.58 0.00 0.00 32.23 30.76 1jcn h LYS 349 CO 0.00 0.72 -1.43 0.28 -1.08 0.00 0.00 179.45 177.93 1jcn h VAL 350 N 0.56 1.33 -0.33 0.50 2.07 -1.27 -3.24 116.25 115.88 1jcn h VAL 350 Ca 0.10 -2.78 -0.09 0.00 0.82 0.00 0.00 66.70 64.76 1jcn h VAL 350 Cb 0.53 3.02 -0.02 0.00 -1.52 0.00 0.00 31.29 33.30 1jcn h VAL 350 CO 0.03 0.83 -0.16 0.00 0.02 0.00 0.00 177.57 178.29 1jcn h ALA 351 N 0.25 1.11 -0.55 1.67 0.00 -0.81 -0.28 119.26 120.64 1jcn h ALA 351 Ca -0.23 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1jcn h ALA 351 Cb 2.13 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.75 1jcn h ALA 351 CO 0.26 0.55 0.31 1.49 0.00 0.00 0.00 179.25 181.86 1jcn h GLU 352 N 0.53 0.75 0.16 0.00 4.81 -1.26 -1.76 114.58 117.82 1jcn h GLU 352 Ca 0.09 -0.07 -0.34 0.00 -0.13 0.00 0.00 59.36 58.90 1jcn h GLU 352 Cb 0.59 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.81 1jcn h GLU 352 CO 0.04 0.55 -1.74 -0.92 -0.73 0.00 0.00 179.01 176.21 1jcn h TYR 353 N 0.76 0.62 -0.38 0.92 3.20 -1.51 -3.38 116.97 117.19 1jcn h TYR 353 Ca 0.20 -0.45 -0.08 0.00 3.14 0.00 0.00 58.73 61.54 1jcn h TYR 353 Cb 0.01 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 1jcn h TYR 353 CO 0.00 1.62 -0.09 0.00 -1.64 0.00 0.00 178.16 178.06 1jcn h ALA 354 N 0.21 1.14 0.00 1.82 0.00 -0.87 -2.88 119.26 118.67 1jcn h ALA 354 Ca -0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1jcn h ALA 354 Cb 2.07 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.70 1jcn h ALA 354 CO 0.16 0.55 -0.07 0.07 0.00 0.00 0.00 179.25 179.96 1jcn h ARG 355 N 0.60 0.00 -0.37 0.00 0.11 -1.51 -0.85 114.38 112.37 1jcn h ARG 355 Ca 0.11 0.00 0.06 0.00 0.10 0.00 0.00 59.98 60.25 1jcn h ARG 355 Cb 0.51 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.57 1jcn h ARG 355 CO 0.03 0.07 0.26 -0.09 0.10 0.00 0.00 179.97 180.33 1jcn h ARG 356 N 0.00 0.24 -0.27 0.08 1.12 -1.71 -2.14 114.38 111.70 1jcn h ARG 356 Ca -0.00 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 1jcn h ARG 356 Cb 0.21 -0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.12 1jcn h ARG 356 CO 0.01 0.16 0.00 1.19 -3.11 0.00 0.00 179.97 178.22 1jcn n PHE 357 N -4.47 0.64 -1.86 2.20 3.01 -0.39 -4.97 117.46 111.63 1jcn n PHE 357 Ca 0.05 -0.70 -0.14 0.00 1.01 0.00 0.00 57.45 57.67 1jcn n PHE 357 Cb 0.27 -0.17 -0.03 0.00 -0.01 0.00 0.00 39.48 39.54 1jcn n PHE 357 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jcn n GLY 358 N -0.12 0.57 3.48 1.37 0.00 -0.81 -4.99 105.19 104.68 1jcn n GLY 358 Ca 0.16 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 1jcn n GLY 358 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jcn s VAL 359 N -2.60 5.24 0.73 1.61 1.01 -0.81 -4.71 120.40 120.87 1jcn s VAL 359 Ca 0.00 -0.53 -0.16 0.00 0.00 0.00 0.00 61.98 61.29 1jcn s VAL 359 Cb 0.00 -3.91 0.04 0.00 0.00 0.00 0.00 36.38 32.51 1jcn s VAL 359 CO 0.00 -0.28 1.25 -2.65 0.00 0.00 0.00 175.10 173.42 1jcn n PRO 360 N 5.22 0.62 -4.85 2.72 -0.02 -1.26 -4.30 135.00 133.14 1jcn n PRO 360 Ca -0.11 0.28 -0.26 0.00 -2.02 0.00 0.00 63.50 61.40 1jcn n PRO 360 Cb 0.47 -2.48 -0.16 0.00 -0.02 0.00 0.00 33.50 31.31 1jcn n PRO 360 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1jcn s ILE 361 N -1.77 1.43 -0.31 4.25 1.01 -1.26 -1.75 121.20 122.80 1jcn s ILE 361 Ca 0.78 -0.74 -0.09 0.00 0.00 0.00 0.00 60.65 60.59 1jcn s ILE 361 Cb -0.33 -1.21 -0.00 0.00 0.01 0.00 0.00 42.46 40.92 1jcn s ILE 361 CO 0.46 0.41 0.14 -0.63 0.00 0.00 0.00 174.94 175.31 1jcn s ILE 362 N -0.19 4.47 -0.74 2.92 1.01 0.30 0.03 121.20 129.01 1jcn s ILE 362 Ca 0.01 -0.46 -0.27 0.00 0.00 0.00 0.00 60.65 59.93 1jcn s ILE 362 Cb -0.09 -3.28 0.02 0.00 0.01 0.00 0.00 42.46 39.12 1jcn s ILE 362 CO 0.01 0.08 1.35 0.00 0.00 0.00 0.00 174.94 176.38 1jcn s ALA 363 N 1.59 2.68 -0.34 9.38 0.00 -0.43 -0.63 121.76 134.01 1jcn s ALA 363 Ca 0.04 -1.33 -0.10 0.00 0.00 0.00 0.00 51.96 50.57 1jcn s ALA 363 Cb -0.17 -4.28 0.02 0.00 0.00 0.00 0.00 23.12 18.69 1jcn s ALA 363 CO 0.05 -3.38 0.17 0.34 0.00 0.00 0.00 175.76 172.94 1jcn s ASP 364 N 4.28 5.57 0.00 0.00 2.15 -0.06 -1.17 116.67 127.45 1jcn s ASP 364 Ca 0.39 -0.82 0.00 0.00 0.43 0.00 0.00 52.55 52.55 1jcn s ASP 364 Cb -0.08 -1.99 0.00 0.00 -0.30 0.00 0.00 42.92 40.55 1jcn s ASP 364 CO 0.14 -0.30 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 1jcn n GLY 365 N 4.96 2.71 1.53 2.66 0.00 -1.23 -4.31 105.19 111.51 1jcn n GLY 365 Ca -0.13 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1jcn n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jcn n GLY 366 N 1.16 1.33 3.69 -0.02 0.00 -1.26 -4.53 105.19 105.56 1jcn n GLY 366 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1jcn n GLY 366 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jcn s ILE 367 N -2.64 3.66 0.00 -0.61 -1.09 -1.26 -4.83 121.20 114.43 1jcn s ILE 367 Ca 0.00 1.07 0.00 0.00 -2.23 0.00 0.00 60.65 59.49 1jcn s ILE 367 Cb 0.00 -3.69 0.00 0.00 -1.58 0.00 0.00 42.46 37.19 1jcn s ILE 367 CO 0.00 0.01 0.00 0.00 -1.23 0.00 0.00 174.94 173.72 1jcn n GLN 368 N 5.20 2.98 -3.95 2.79 6.02 -1.26 -4.60 117.38 124.55 1jcn n GLN 368 Ca 0.13 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 57.03 1jcn n GLN 368 Cb 0.43 -0.29 -0.05 0.00 1.02 0.00 0.00 30.24 31.35 1jcn n GLN 368 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1jcn s THR 369 N -0.48 0.01 0.22 5.09 -4.23 -1.26 -5.02 115.64 109.97 1jcn s THR 369 Ca 0.00 -1.30 -0.08 0.00 -1.18 0.00 0.00 61.69 59.13 1jcn s THR 369 Cb 0.00 -2.06 0.19 0.00 1.34 0.00 0.00 72.50 71.97 1jcn s THR 369 CO 0.00 -0.05 1.84 0.58 -0.54 0.00 0.00 174.62 176.45 1jcn h VAL 370 N 2.27 1.25 -0.92 2.29 2.07 -1.98 -2.08 116.25 119.15 1jcn h VAL 370 Ca -0.27 -0.64 0.13 0.00 0.82 0.00 0.00 66.70 66.75 1jcn h VAL 370 Cb 1.25 0.11 -0.09 0.00 -1.52 0.00 0.00 31.29 31.05 1jcn h VAL 370 CO 0.37 0.28 0.54 1.23 0.02 0.00 0.00 177.57 180.01 1jcn h GLY 371 N 1.19 1.51 1.05 2.17 0.00 -1.95 0.11 103.07 107.14 1jcn h GLY 371 Ca 0.30 -0.35 -0.07 0.00 0.00 0.00 0.00 47.33 47.21 1jcn h GLY 371 CO -0.05 0.07 0.12 0.45 0.00 0.00 0.00 176.54 177.14 1jcn h HIS 372 N 0.82 1.10 0.09 5.60 -0.00 -1.78 -2.20 115.15 118.79 1jcn h HIS 372 Ca 0.48 -0.15 -0.00 0.00 -0.00 0.00 0.00 60.37 60.70 1jcn h HIS 372 Cb 0.55 -0.31 0.00 0.00 -0.00 0.00 0.00 27.41 27.66 1jcn h HIS 372 CO -0.04 0.93 -0.04 0.28 -0.00 0.00 0.00 177.93 179.05 1jcn h VAL 373 N 0.96 0.92 -0.08 2.45 2.07 -0.63 -1.44 116.25 120.49 1jcn h VAL 373 Ca 0.20 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.67 1jcn h VAL 373 Cb 0.41 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1jcn h VAL 373 CO 0.01 0.01 -0.00 1.62 0.02 0.00 0.00 177.57 179.23 1jcn h VAL 374 N -0.14 1.06 -0.11 2.57 3.04 -1.03 -1.71 116.25 119.93 1jcn h VAL 374 Ca -0.01 -0.22 -0.22 0.00 -1.01 0.00 0.00 66.70 65.24 1jcn h VAL 374 Cb 0.11 1.00 0.01 0.00 -2.01 0.00 0.00 31.29 30.41 1jcn h VAL 374 CO 0.02 0.07 -0.77 0.11 -1.01 0.00 0.00 177.57 175.99 1jcn h LYS 375 N 0.11 0.72 -0.67 4.17 1.57 -1.08 -1.32 116.57 120.07 1jcn h LYS 375 Ca 0.03 -0.63 0.01 0.00 -1.87 0.00 0.00 60.65 58.19 1jcn h LYS 375 Cb 0.09 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1jcn h LYS 375 CO 0.00 1.23 0.44 0.00 -0.57 0.00 0.00 179.45 180.55 1jcn h ALA 376 N 0.50 0.85 -0.29 3.86 0.00 -0.74 -1.22 119.26 122.23 1jcn h ALA 376 Ca -0.07 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 1jcn h ALA 376 Cb 1.42 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1jcn h ALA 376 CO 0.16 0.26 -0.24 -0.07 0.00 0.00 0.00 179.25 179.36 1jcn h LEU 377 N 0.90 0.71 -2.08 0.00 3.38 -1.32 -2.64 115.31 114.25 1jcn h LEU 377 Ca 0.25 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1jcn h LEU 377 Cb -0.09 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 1jcn h LEU 377 CO -0.06 1.02 -0.07 0.00 0.09 0.00 0.00 178.44 179.42 1jcn h ALA 378 N 0.71 1.56 -0.00 1.53 0.00 -0.93 -1.83 119.26 120.31 1jcn h ALA 378 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1jcn h ALA 378 Cb 0.80 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1jcn h ALA 378 CO 0.06 0.09 -0.05 1.28 0.00 0.00 0.00 179.25 180.63 1jcn n LEU 379 N -3.99 0.32 0.00 0.00 4.77 -0.49 -4.62 117.00 112.99 1jcn n LEU 379 Ca -0.03 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1jcn n LEU 379 Cb 0.16 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1jcn n LEU 379 CO 0.31 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1jcn n GLY 380 N 1.20 1.70 3.77 -0.72 0.00 -0.69 -4.01 105.19 106.44 1jcn n GLY 380 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1jcn n GLY 380 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jcn s ALA 381 N -1.55 2.90 -0.05 4.61 0.00 -1.01 -4.70 121.76 121.96 1jcn s ALA 381 Ca 0.00 1.01 0.07 0.00 0.00 0.00 0.00 51.96 53.04 1jcn s ALA 381 Cb 0.00 -3.42 -0.24 0.00 0.00 0.00 0.00 23.12 19.46 1jcn s ALA 381 CO 0.00 -0.83 0.62 0.77 0.00 0.00 0.00 175.76 176.32 1jcn h SER 382 N 1.81 0.12 -5.50 0.00 0.02 -0.69 -3.40 113.55 105.90 1jcn h SER 382 Ca -0.50 -0.26 -0.20 0.00 -0.84 0.00 0.00 61.79 59.99 1jcn h SER 382 Cb 1.26 -0.04 -0.14 0.00 0.14 0.00 0.00 62.40 63.62 1jcn h SER 382 CO 0.59 1.23 -0.54 0.42 -1.14 0.00 0.00 176.83 177.39 1jcn s THR 383 N -2.59 0.02 -0.04 -2.27 -4.23 -1.02 -4.54 115.64 100.97 1jcn s THR 383 Ca -0.09 -1.88 0.03 0.00 -1.18 0.00 0.00 61.69 58.58 1jcn s THR 383 Cb 0.08 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.57 1jcn s THR 383 CO 0.81 -0.10 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.97 1jcn s VAL 384 N -4.11 1.13 -0.20 2.29 1.01 0.08 -1.31 120.40 119.30 1jcn s VAL 384 Ca 0.33 -0.53 -0.12 0.00 0.00 0.00 0.00 61.98 61.66 1jcn s VAL 384 Cb 0.06 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1jcn s VAL 384 CO 0.09 0.34 0.21 -0.32 0.00 0.00 0.00 175.10 175.42 1jcn s MET 385 N 0.25 4.18 -0.03 2.72 -2.45 -0.32 -1.62 119.30 122.03 1jcn s MET 385 Ca -0.06 -0.10 0.07 0.00 -1.25 0.00 0.00 55.69 54.35 1jcn s MET 385 Cb -0.12 -3.46 -0.02 0.00 1.25 0.00 0.00 34.83 32.49 1jcn s MET 385 CO 0.02 0.19 -0.26 -1.64 1.05 0.00 0.00 175.02 174.39 1jcn s MET 386 N 0.65 2.23 0.00 4.11 1.00 0.09 -3.53 119.30 123.85 1jcn s MET 386 Ca 0.11 -0.92 0.00 0.00 0.00 0.00 0.00 55.69 54.88 1jcn s MET 386 Cb -0.12 -2.07 0.00 0.00 0.00 0.00 0.00 34.83 32.64 1jcn s MET 386 CO 0.02 0.50 0.00 0.41 0.00 0.00 0.00 175.02 175.95 1jcn n GLY 387 N 2.59 0.35 0.39 -0.03 0.00 -1.26 -0.62 105.19 106.61 1jcn n GLY 387 Ca -0.16 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.07 1jcn n GLY 387 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jcn h SER 388 N 0.00 0.00 0.50 1.61 4.64 -1.97 -0.04 113.55 118.29 1jcn h SER 388 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1jcn h SER 388 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1jcn h SER 388 CO 0.00 0.00 -0.12 0.25 -0.87 0.00 0.00 176.83 176.09 1jcn h LEU 389 N 0.00 0.00 0.00 5.97 5.85 -1.89 -2.53 115.31 122.71 1jcn h LEU 389 Ca 0.26 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1jcn h LEU 389 Cb 1.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1jcn h LEU 389 CO -0.00 0.12 -1.14 0.18 -0.34 0.00 0.00 178.44 177.26 1jcn n LEU 390 N -3.50 0.61 -0.11 2.25 4.77 -0.11 -4.42 117.00 116.48 1jcn n LEU 390 Ca -0.01 -0.36 0.24 0.00 -0.03 0.00 0.00 56.01 55.85 1jcn n LEU 390 Cb 0.27 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 42.04 1jcn n LEU 390 CO 0.30 0.15 1.23 0.00 -1.33 0.00 0.00 177.39 177.73 1jcn h ALA 391 N 2.31 2.64 -0.42 -1.18 0.00 -0.87 -1.58 119.26 120.16 1jcn h ALA 391 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1jcn h ALA 391 Cb 0.55 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1jcn h ALA 391 CO 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 179.25 178.40 1jcn n ALA 392 N -2.66 2.93 -2.51 0.00 0.00 -1.26 -4.78 120.51 112.22 1jcn n ALA 392 Ca 0.15 -1.03 -0.25 0.00 0.00 0.00 0.00 53.44 52.31 1jcn n ALA 392 Cb 0.78 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 19.20 1jcn n ALA 392 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1jcn s THR 393 N -1.76 4.90 0.25 0.00 -4.23 -0.60 -2.77 115.64 111.43 1jcn s THR 393 Ca 0.33 -0.28 -0.03 0.00 -1.18 0.00 0.00 61.69 60.53 1jcn s THR 393 Cb 0.22 -3.81 0.22 0.00 1.34 0.00 0.00 72.50 70.47 1jcn s THR 393 CO 0.16 -0.61 1.80 0.74 -0.54 0.00 0.00 174.62 176.17 1jcn h THR 394 N 0.55 0.87 0.00 3.99 2.02 -0.90 -2.16 112.91 117.29 1jcn h THR 394 Ca -0.48 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1jcn h THR 394 Cb 1.22 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1jcn h THR 394 CO 0.61 0.14 0.00 -0.62 0.37 0.00 0.00 175.52 176.02 1jcn n GLU 395 N -4.76 0.48 -2.63 6.66 4.71 -1.26 -4.80 120.64 119.03 1jcn n GLU 395 Ca 0.15 0.05 -0.41 0.00 -0.01 0.00 0.00 57.16 56.93 1jcn n GLU 395 Cb 0.32 -1.50 -0.04 0.00 -1.01 0.00 0.00 31.44 29.20 1jcn n GLU 395 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1jcn s ALA 396 N -2.34 3.30 0.48 0.62 0.00 -0.81 -3.14 121.76 119.87 1jcn s ALA 396 Ca 0.26 0.68 -0.21 0.00 0.00 0.00 0.00 51.96 52.69 1jcn s ALA 396 Cb 0.15 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.86 1jcn s ALA 396 CO 0.31 -0.11 0.73 -0.35 0.00 0.00 0.00 175.76 176.34 1jcn n PRO 397 N 2.63 0.82 0.00 0.00 -0.04 -1.26 -4.91 135.00 132.24 1jcn n PRO 397 Ca 0.03 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.79 1jcn n PRO 397 Cb 0.48 -1.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 1jcn n PRO 397 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1jcn n GLY 398 N 1.54 3.21 0.42 0.55 0.00 -1.26 -4.83 105.19 104.81 1jcn n GLY 398 Ca 0.11 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1jcn n GLY 398 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jcn n GLU 399 N 0.00 0.00 -0.23 1.61 1.02 -1.26 -5.14 120.64 116.64 1jcn n GLU 399 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1jcn n GLU 399 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1jcn n GLU 399 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1jcn n LYS 450 N 0.00 -0.03 0.00 3.49 4.81 -1.12 -5.23 118.16 120.08 1jcn n LYS 450 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1jcn n LYS 450 Cb 0.00 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 32.45 1jcn n LYS 450 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jcn n GLY 451 N -0.35 -1.93 3.84 3.14 0.00 -1.26 -4.80 105.19 103.83 1jcn n GLY 451 Ca 0.00 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 1jcn n GLY 451 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jcn s SER 452 N -4.00 6.78 0.54 1.61 0.15 -1.26 -0.18 113.70 117.34 1jcn s SER 452 Ca 0.00 1.53 0.20 0.00 0.70 0.00 0.00 55.95 58.39 1jcn s SER 452 Cb 0.00 -2.48 1.44 0.00 -1.71 0.00 0.00 66.02 63.27 1jcn s SER 452 CO 0.00 -0.41 2.18 0.40 1.20 0.00 0.00 173.24 176.61 1jcn h ILE 453 N 1.54 0.85 0.00 6.45 1.08 -1.94 -1.31 117.51 124.18 1jcn h ILE 453 Ca -0.48 -0.01 0.00 0.00 -0.39 0.00 0.00 64.86 63.98 1jcn h ILE 453 Cb 1.18 1.01 0.00 0.00 -3.07 0.00 0.00 36.82 35.94 1jcn h ILE 453 CO 0.62 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 178.08 1jcn n GLN 454 N -4.32 0.17 -0.07 2.37 3.00 -1.26 -1.61 117.38 115.66 1jcn n GLN 454 Ca -0.03 0.54 -0.10 0.00 -0.01 0.00 0.00 57.00 57.40 1jcn n GLN 454 Cb 0.09 -1.93 -0.06 0.00 0.00 0.00 0.00 30.24 28.34 1jcn n GLN 454 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1jcn n LYS 455 N -2.26 0.34 0.11 -1.09 4.76 -0.58 -4.61 118.16 114.82 1jcn n LYS 455 Ca 0.00 0.08 -0.13 0.00 -2.87 0.00 0.00 58.31 55.40 1jcn n LYS 455 Cb 0.13 -1.25 -0.08 0.00 -1.84 0.00 0.00 35.03 31.99 1jcn n LYS 455 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1jcn h PHE 456 N -0.05 -0.27 -0.67 2.13 3.57 -1.18 -2.84 116.94 117.63 1jcn h PHE 456 Ca -0.31 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.25 1jcn h PHE 456 Cb 1.46 0.09 -0.06 0.00 2.79 0.00 0.00 35.95 40.23 1jcn h PHE 456 CO 0.01 0.08 0.36 0.28 -2.23 0.00 0.00 178.31 176.80 1jcn h VAL 457 N -0.67 0.92 0.00 1.41 2.07 -1.57 0.10 116.25 118.52 1jcn h VAL 457 Ca -0.03 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1jcn h VAL 457 Cb 0.47 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1jcn h VAL 457 CO 0.05 0.12 -0.06 -0.65 0.02 0.00 0.00 177.57 177.04 1jcn h PRO 458 N 0.64 0.00 -0.43 1.57 0.11 -1.75 0.65 132.00 132.80 1jcn h PRO 458 Ca 0.31 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.28 1jcn h PRO 458 Cb 0.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 1jcn h PRO 458 CO -0.21 0.06 -0.30 -0.92 -0.21 0.00 0.00 178.00 176.42 1jcn h TYR 459 N 0.00 1.11 -0.25 0.65 3.20 -0.61 -2.30 116.97 118.77 1jcn h TYR 459 Ca -0.00 -0.30 -0.14 0.00 3.14 0.00 0.00 58.73 61.43 1jcn h TYR 459 Cb 0.12 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 1jcn h TYR 459 CO 0.00 1.12 -0.43 -0.07 -1.64 0.00 0.00 178.16 177.14 1jcn h LEU 460 N 0.80 0.67 -0.11 2.82 3.38 0.32 -2.23 115.31 120.95 1jcn h LEU 460 Ca 0.09 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 1jcn h LEU 460 Cb 0.88 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1jcn h LEU 460 CO 0.08 1.01 0.06 0.40 0.09 0.00 0.00 178.44 180.08 1jcn h ILE 461 N 0.50 1.09 -0.89 1.22 2.04 -0.84 0.09 117.51 120.73 1jcn h ILE 461 Ca 0.04 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 1jcn h ILE 461 Cb 0.96 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 38.07 1jcn h ILE 461 CO 0.09 0.08 0.52 0.00 0.00 0.00 0.00 178.15 178.84 1jcn h ALA 462 N 0.95 1.24 -0.44 1.87 0.00 -1.37 -0.16 119.26 121.35 1jcn h ALA 462 Ca 0.04 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1jcn h ALA 462 Cb 0.08 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1jcn h ALA 462 CO -0.01 0.64 0.15 0.78 0.00 0.00 0.00 179.25 180.82 1jcn h GLY 463 N 1.24 0.72 1.02 0.00 0.00 -0.91 -1.14 103.07 103.99 1jcn h GLY 463 Ca 0.32 -0.41 -0.07 0.00 0.00 0.00 0.00 47.33 47.16 1jcn h GLY 463 CO -0.06 0.39 0.08 -2.22 0.00 0.00 0.00 176.54 174.73 1jcn h ILE 464 N 0.57 1.26 -0.60 2.60 2.04 -0.61 -0.54 117.51 122.22 1jcn h ILE 464 Ca 0.14 -0.99 0.01 0.00 1.00 0.00 0.00 64.86 65.02 1jcn h ILE 464 Cb 0.23 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1jcn h ILE 464 CO -0.01 0.36 0.40 1.56 0.00 0.00 0.00 178.15 180.46 1jcn h GLN 465 N 0.81 0.79 -0.04 2.37 4.20 -0.81 0.33 115.11 122.76 1jcn h GLN 465 Ca 0.17 -0.05 -0.19 0.00 0.06 0.00 0.00 58.65 58.64 1jcn h GLN 465 Cb 0.43 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1jcn h GLN 465 CO 0.01 0.52 -0.78 0.45 -0.67 0.00 0.00 178.83 178.36 1jcn h HIS 466 N 0.81 0.46 -0.08 2.96 3.86 -0.84 -2.17 115.15 120.14 1jcn h HIS 466 Ca 0.22 -0.22 0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1jcn h HIS 466 Cb -0.08 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.31 1jcn h HIS 466 CO -0.00 0.99 -0.02 0.78 0.86 0.00 0.00 177.93 180.54 1jcn h GLY 467 N 1.44 0.06 1.01 2.45 0.00 0.33 -1.59 103.07 106.77 1jcn h GLY 467 Ca -0.04 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1jcn h GLY 467 CO 0.13 -0.03 0.49 0.00 0.00 0.00 0.00 176.54 177.13 1jcn h GLN 469 N 1.04 0.30 -0.91 0.00 4.15 -1.05 -0.73 115.11 117.91 1jcn h GLN 469 Ca 0.28 -0.02 0.16 0.00 0.77 0.00 0.00 58.65 59.84 1jcn h GLN 469 Cb -0.09 -0.07 -0.07 0.00 0.21 0.00 0.00 27.48 27.46 1jcn h GLN 469 CO -0.06 0.21 0.59 -0.44 -1.93 0.00 0.00 178.83 177.20 1jcn h ASP 470 N 0.30 0.62 0.41 -0.69 3.32 -1.09 0.16 116.42 119.45 1jcn h ASP 470 Ca 0.08 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1jcn h ASP 470 Cb -0.02 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.46 1jcn h ASP 470 CO -0.02 0.29 -0.29 2.30 -1.72 0.00 0.00 179.24 179.80 1jcn n ILE 471 N -4.58 0.00 -0.84 0.35 -5.35 -0.94 -1.40 119.36 106.60 1jcn n ILE 471 Ca 0.19 -0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.61 1jcn n ILE 471 Cb 0.53 0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.61 1jcn n ILE 471 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1jcn n GLY 472 N 1.40 0.71 3.52 3.28 0.00 0.58 -3.96 105.19 110.72 1jcn n GLY 472 Ca 0.10 -0.66 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 1jcn n GLY 472 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jcn s ALA 473 N -2.00 3.00 -1.41 4.61 0.00 -0.39 -4.90 121.76 120.67 1jcn s ALA 473 Ca 0.00 -0.83 0.30 0.00 0.00 0.00 0.00 51.96 51.42 1jcn s ALA 473 Cb 0.00 -1.48 1.38 0.00 0.00 0.00 0.00 23.12 23.02 1jcn s ALA 473 CO 0.00 0.31 1.97 0.54 0.00 0.00 0.00 175.76 178.58 1jcn n ARG 474 N 3.20 0.42 -3.52 0.00 1.74 -1.26 -4.10 116.66 113.14 1jcn n ARG 474 Ca -0.18 -0.06 -0.10 0.00 -0.77 0.00 0.00 57.85 56.75 1jcn n ARG 474 Cb 0.53 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.45 1jcn n ARG 474 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1jcn s SER 475 N -2.62 -0.47 0.43 0.55 1.04 -1.26 -0.85 113.70 110.53 1jcn s SER 475 Ca 0.26 -0.11 0.16 0.00 0.48 0.00 0.00 55.95 56.74 1jcn s SER 475 Cb 0.20 0.58 0.97 0.00 0.10 0.00 0.00 66.02 67.87 1jcn s SER 475 CO 0.48 -0.96 1.95 -0.07 0.98 0.00 0.00 173.24 175.62 1jcn h LEU 476 N 2.00 0.00 -0.34 2.42 3.38 -1.83 -2.30 115.31 118.64 1jcn h LEU 476 Ca -0.29 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.56 1jcn h LEU 476 Cb 1.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1jcn h LEU 476 CO 0.34 0.23 -0.26 -1.28 0.09 0.00 0.00 178.44 177.56 1jcn h SER 477 N 0.00 0.83 -0.58 -0.43 0.87 -1.86 -2.26 113.55 110.11 1jcn h SER 477 Ca -0.00 -0.44 -0.02 0.00 -1.23 0.00 0.00 61.79 60.10 1jcn h SER 477 Cb 0.43 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 1jcn h SER 477 CO 0.03 1.10 0.30 0.58 -0.53 0.00 0.00 176.83 178.31 1jcn h VAL 478 N 0.57 1.19 0.63 2.23 2.07 -1.85 -2.07 116.25 119.02 1jcn h VAL 478 Ca 0.06 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 1jcn h VAL 478 Cb 0.83 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1jcn h VAL 478 CO 0.07 0.22 -0.38 0.25 0.02 0.00 0.00 177.57 177.75 1jcn h LEU 479 N 0.85 -0.96 -1.56 2.57 6.46 -1.08 0.21 115.31 121.80 1jcn h LEU 479 Ca 0.21 0.05 0.04 0.00 -0.12 0.00 0.00 57.88 58.07 1jcn h LEU 479 Cb 0.07 0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 40.25 1jcn h LEU 479 CO -0.03 -0.60 0.35 0.03 -0.62 0.00 0.00 178.44 177.57 1jcn h ARG 480 N -0.96 0.55 -0.48 1.25 3.08 -1.32 -1.57 114.38 114.93 1jcn h ARG 480 Ca -0.08 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.86 1jcn h ARG 480 Cb 0.77 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 1jcn h ARG 480 CO 0.08 0.36 -0.00 1.03 -1.07 0.00 0.00 179.97 180.38 1jcn h SER 481 N 0.57 0.83 0.22 7.04 0.87 -0.84 -1.09 113.55 121.14 1jcn h SER 481 Ca 0.22 -0.31 -0.06 0.00 -1.23 0.00 0.00 61.79 60.41 1jcn h SER 481 Cb 0.16 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 1jcn h SER 481 CO -0.06 0.94 -0.26 0.24 -0.53 0.00 0.00 176.83 177.16 1jcn h MET 482 N 0.70 0.07 0.06 2.24 2.86 0.34 -2.14 114.93 119.06 1jcn h MET 482 Ca 0.14 -0.02 -0.20 0.00 -2.06 0.00 0.00 59.70 57.56 1jcn h MET 482 Cb 0.51 -0.01 0.02 0.00 0.06 0.00 0.00 31.60 32.18 1jcn h MET 482 CO 0.03 0.33 -0.82 0.00 1.06 0.00 0.00 176.91 177.51 1jcn h MET 483 N 0.07 0.44 -0.11 1.72 -0.00 -0.97 0.83 114.93 116.91 1jcn h MET 483 Ca 0.01 -0.56 -0.05 0.00 -0.00 0.00 0.00 59.70 59.10 1jcn h MET 483 Cb 0.49 0.18 -0.01 0.00 -0.00 0.00 0.00 31.60 32.26 1jcn h MET 483 CO 0.04 1.21 -0.15 1.88 -0.00 0.00 0.00 176.91 179.89 1jcn h TYR 484 N -0.07 0.18 0.00 -0.10 0.99 -1.17 -2.31 116.97 114.49 1jcn h TYR 484 Ca -0.12 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.59 1jcn h TYR 484 Cb 1.55 -0.05 0.00 0.00 1.00 0.00 0.00 36.73 39.22 1jcn h TYR 484 CO 0.15 0.32 0.00 0.77 -0.00 0.00 0.00 178.16 179.40 1jcn h SER 485 N 0.17 0.00 0.00 3.88 0.02 -1.43 -3.47 113.55 112.72 1jcn h SER 485 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1jcn h SER 485 Cb 0.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1jcn h SER 485 CO 0.02 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.32 1jcn n GLY 486 N 0.42 0.70 0.21 -3.77 0.00 -0.87 -4.95 105.19 96.94 1jcn n GLY 486 Ca 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 1jcn n GLY 486 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1jcn h GLU 487 N 4.21 0.69 -6.52 1.61 4.81 -1.29 -3.44 114.58 114.66 1jcn h GLU 487 Ca 0.00 -0.51 -0.53 0.00 -0.13 0.00 0.00 59.36 58.19 1jcn h GLU 487 Cb 0.00 0.09 0.02 0.00 0.63 0.00 0.00 28.75 29.48 1jcn h GLU 487 CO 0.00 1.13 0.71 -1.17 -0.73 0.00 0.00 179.01 178.95 1jcn s LEU 488 N -8.62 4.36 0.01 1.64 2.96 0.11 -4.98 118.68 114.15 1jcn s LEU 488 Ca -0.12 2.26 0.04 0.00 -0.22 0.00 0.00 54.13 56.09 1jcn s LEU 488 Cb 0.08 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.15 1jcn s LEU 488 CO 0.86 -0.63 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.63 1jcn s LYS 489 N 1.24 2.44 0.47 1.98 -0.14 -1.26 -4.28 119.74 120.19 1jcn s LYS 489 Ca 0.64 -0.78 0.03 0.00 -1.36 0.00 0.00 55.97 54.49 1jcn s LYS 489 Cb -0.35 -2.43 -0.03 0.00 -1.68 0.00 0.00 37.83 33.35 1jcn s LYS 489 CO 0.30 0.59 0.03 -0.06 -0.76 0.00 0.00 175.35 175.44 1jcn s PHE 490 N -0.97 1.95 -0.17 3.18 0.40 0.25 -1.04 117.98 121.58 1jcn s PHE 490 Ca 0.16 -0.98 -0.06 0.00 -0.60 0.00 0.00 56.93 55.46 1jcn s PHE 490 Cb -0.11 -1.54 0.08 0.00 0.51 0.00 0.00 43.02 41.97 1jcn s PHE 490 CO 0.07 0.15 0.35 -2.00 0.70 0.00 0.00 175.22 174.49 1jcn s GLU 491 N -3.82 0.25 0.25 0.44 2.56 -0.56 -0.60 118.70 117.21 1jcn s GLU 491 Ca 0.15 0.91 -0.30 0.00 0.00 0.00 0.00 54.97 55.72 1jcn s GLU 491 Cb 0.03 0.16 -0.09 0.00 2.00 0.00 0.00 34.13 36.23 1jcn s GLU 491 CO 0.08 -0.27 0.99 0.21 -0.56 0.00 0.00 175.26 175.70 1jcn s LYS 492 N 2.53 4.79 0.07 4.30 2.20 -1.26 -1.41 119.74 130.96 1jcn s LYS 492 Ca -0.00 1.58 -0.01 0.00 -0.36 0.00 0.00 55.97 57.18 1jcn s LYS 492 Cb -0.12 -3.26 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 1jcn s LYS 492 CO -0.11 0.42 0.24 1.03 -0.36 0.00 0.00 175.35 176.57 1jcn s ARG 493 N -1.22 3.47 0.41 4.03 0.52 -0.05 -4.97 118.95 121.14 1jcn s ARG 493 Ca 0.42 -0.39 -0.23 0.00 -0.52 0.00 0.00 55.73 55.01 1jcn s ARG 493 Cb -0.28 -3.01 -0.09 0.00 0.52 0.00 0.00 34.95 32.09 1jcn s ARG 493 CO 0.35 0.59 1.01 0.95 0.02 0.00 0.00 175.30 178.21 1jcn s THR 494 N -1.54 3.94 0.64 0.02 -4.23 -1.26 -4.89 115.64 108.33 1jcn s THR 494 Ca 0.36 1.40 0.17 0.00 -1.18 0.00 0.00 61.69 62.44 1jcn s THR 494 Cb -0.13 -3.68 0.17 0.00 1.34 0.00 0.00 72.50 70.20 1jcn s THR 494 CO 0.27 -0.08 1.51 0.24 -0.54 0.00 0.00 174.62 176.03 1jcn h MET 495 N 2.32 0.00 -4.16 3.99 0.00 -1.98 -3.17 114.93 111.92 1jcn h MET 495 Ca -0.48 0.00 -0.77 0.00 0.00 0.00 0.00 59.70 58.45 1jcn h MET 495 Cb 1.21 0.00 -0.23 0.00 0.00 0.00 0.00 31.60 32.57 1jcn h MET 495 CO 0.62 0.00 0.75 0.45 0.00 0.00 0.00 176.91 178.73 1jcn s SER 496 N -3.79 7.09 0.22 1.22 0.15 -1.26 -5.02 113.70 112.32 1jcn s SER 496 Ca -0.02 -3.11 -0.32 0.00 0.70 0.00 0.00 55.95 53.21 1jcn s SER 496 Cb 0.05 -2.30 -0.12 0.00 -1.71 0.00 0.00 66.02 61.94 1jcn s SER 496 CO 0.15 -0.56 1.63 0.00 1.20 0.00 0.00 173.24 175.66 1jcn n ALA 497 N 4.29 2.27 -3.41 5.45 0.00 -1.20 -4.98 120.51 122.93 1jcn n ALA 497 Ca 0.27 0.40 -0.27 0.00 0.00 0.00 0.00 53.44 53.85 1jcn n ALA 497 Cb 0.43 -2.45 -0.10 0.00 0.00 0.00 0.00 19.45 17.33 1jcn n ALA 497 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1jcn n GLN 498 N 3.19 0.43 0.00 0.00 3.00 -1.26 -5.15 117.38 117.59 1jcn n GLN 498 Ca 0.14 -3.31 0.00 0.00 -0.01 0.00 0.00 57.00 53.82 1jcn n GLN 498 Cb 0.34 -1.67 0.00 0.00 0.00 0.00 0.00 30.24 28.91 1jcn n GLN 498 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.06 178.57