#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jjj s THR 2 N 0.00 0.07 0.04 6.66 -4.23 -1.26 -1.14 115.64 115.78 2jjj s THR 2 Ca 0.00 -1.82 0.00 0.00 -1.18 0.00 0.00 61.69 58.69 2jjj s THR 2 Cb 0.00 -2.09 -0.03 0.00 1.34 0.00 0.00 72.50 71.71 2jjj s THR 2 CO 0.00 -0.34 -0.04 -0.83 -0.54 0.00 0.00 174.62 172.87 2jjj s GLY 3 N -3.05 0.41 -0.15 3.99 0.00 -0.63 -3.72 107.32 104.16 2jjj s GLY 3 Ca 0.25 -0.93 -0.05 0.00 0.00 0.00 0.00 44.72 43.99 2jjj s GLY 3 CO 0.04 -1.02 0.30 -0.45 0.00 0.00 0.00 173.10 171.97 2jjj s SER 4 N -2.21 0.27 0.05 1.64 0.15 -0.16 -0.67 113.70 112.77 2jjj s SER 4 Ca -0.03 0.62 0.06 0.00 0.70 0.00 0.00 55.95 57.29 2jjj s SER 4 Cb -0.01 0.84 -0.03 0.00 -1.71 0.00 0.00 66.02 65.11 2jjj s SER 4 CO -0.05 -0.24 -0.16 0.00 1.20 0.00 0.00 173.24 173.99 2jjj s ALA 5 N 2.46 1.34 0.01 5.45 0.00 -0.25 -4.39 121.76 126.39 2jjj s ALA 5 Ca 0.01 -0.95 -0.22 0.00 0.00 0.00 0.00 51.96 50.81 2jjj s ALA 5 Cb -0.12 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.74 2jjj s ALA 5 CO -0.10 0.26 0.64 0.95 0.00 0.00 0.00 175.76 177.51 2jjj s THR 6 N -0.96 4.85 -0.07 0.00 -4.23 -1.26 -1.04 115.64 112.93 2jjj s THR 6 Ca 0.02 1.35 0.03 0.00 -1.18 0.00 0.00 61.69 61.92 2jjj s THR 6 Cb -0.09 -3.98 -0.02 0.00 1.34 0.00 0.00 72.50 69.75 2jjj s THR 6 CO 0.02 0.41 -0.16 0.28 -0.54 0.00 0.00 174.62 174.62 2jjj s THR 7 N -0.19 2.83 -0.03 3.99 -1.32 -0.33 -4.28 115.64 116.32 2jjj s THR 7 Ca 0.33 -0.79 0.03 0.00 -1.21 0.00 0.00 61.69 60.06 2jjj s THR 7 Cb -0.19 -2.11 -0.00 0.00 -1.51 0.00 0.00 72.50 68.68 2jjj s THR 7 CO 0.19 0.57 -0.12 -0.89 -2.21 0.00 0.00 174.62 172.15 2jjj s THR 8 N -0.30 1.02 0.45 5.08 2.01 -0.20 -0.73 115.64 122.96 2jjj s THR 8 Ca 0.02 -0.51 -0.25 0.00 0.31 0.00 0.00 61.69 61.26 2jjj s THR 8 Cb -0.13 -0.88 -0.08 0.00 0.01 0.00 0.00 72.50 71.42 2jjj s THR 8 CO 0.03 0.30 1.42 -2.84 -0.69 0.00 0.00 174.62 172.83 2jjj s PRO 9 N 0.01 3.70 0.31 4.92 0.02 -1.26 -0.98 135.00 141.72 2jjj s PRO 9 Ca -0.01 2.39 0.26 0.00 0.02 0.00 0.00 61.00 63.66 2jjj s PRO 9 Cb -0.08 -2.66 0.75 0.00 0.02 0.00 0.00 34.50 32.52 2jjj s PRO 9 CO 0.01 -0.79 1.74 -0.84 -0.33 0.00 0.00 177.00 176.78 2jjj h ILE 10 N 2.31 0.00 -3.14 2.83 3.07 -1.37 -3.46 117.51 117.74 2jjj h ILE 10 Ca -0.51 -0.60 -0.05 0.00 1.55 0.00 0.00 64.86 65.25 2jjj h ILE 10 Cb 1.26 1.56 -0.00 0.00 -0.27 0.00 0.00 36.82 39.37 2jjj h ILE 10 CO 0.61 0.00 0.22 1.51 -1.05 0.00 0.00 178.15 179.44 2jjj s ASP 11 N -5.08 0.13 0.13 2.16 1.47 -1.26 -5.03 116.67 109.19 2jjj s ASP 11 Ca 0.08 -1.21 0.19 0.00 1.18 0.00 0.00 52.55 52.79 2jjj s ASP 11 Cb 0.09 0.84 0.81 0.00 -0.34 0.00 0.00 42.92 44.33 2jjj s ASP 11 CO 0.59 -1.66 1.60 -1.54 0.68 0.00 0.00 175.17 174.83 2jjj n SER 12 N -1.46 0.35 -0.80 2.11 3.41 -1.26 -2.84 113.62 113.14 2jjj n SER 12 Ca -0.07 0.58 0.12 0.00 -0.26 0.00 0.00 58.87 59.24 2jjj n SER 12 Cb 0.60 -0.66 0.19 0.00 -0.26 0.00 0.00 64.21 64.08 2jjj n SER 12 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jjj n LEU 13 N -1.88 2.54 -3.72 1.04 4.77 -1.26 -4.96 117.00 113.53 2jjj n LEU 13 Ca 0.03 -0.85 -0.26 0.00 -0.03 0.00 0.00 56.01 54.90 2jjj n LEU 13 Cb 0.21 -0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.35 2jjj n LEU 13 CO 0.17 0.43 0.16 0.47 -1.33 0.00 0.00 177.39 177.29 2jjj n ASP 14 N 0.92 -5.01 -0.18 -1.43 8.00 -1.13 -4.89 116.55 112.84 2jjj n ASP 14 Ca 0.15 -0.66 -0.01 0.00 0.71 0.00 0.00 54.79 54.97 2jjj n ASP 14 Cb 0.53 -4.51 0.21 0.00 -0.02 0.00 0.00 41.12 37.33 2jjj n ASP 14 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2jjj h ASP 15 N -2.34 0.83 -5.01 -2.24 3.32 -1.93 -3.46 116.42 105.60 2jjj h ASP 15 Ca -0.58 -0.08 0.06 0.00 0.02 0.00 0.00 57.03 56.45 2jjj h ASP 15 Cb 1.37 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 40.65 2jjj h ASP 15 CO 0.60 0.70 0.24 0.00 -1.72 0.00 0.00 179.24 179.05 2jjj s ALA 16 N -5.55 -1.27 -0.03 3.45 0.00 -1.26 -4.40 121.76 112.70 2jjj s ALA 16 Ca -0.10 -0.22 0.06 0.00 0.00 0.00 0.00 51.96 51.69 2jjj s ALA 16 Cb 0.17 0.85 -0.01 0.00 0.00 0.00 0.00 23.12 24.12 2jjj s ALA 16 CO 0.79 -1.01 -0.19 0.71 0.00 0.00 0.00 175.76 176.06 2jjj s TYR 17 N -3.89 1.77 0.11 0.00 1.51 -1.26 -0.88 117.35 114.72 2jjj s TYR 17 Ca 0.10 -0.40 0.09 0.00 -1.01 0.00 0.00 57.07 55.86 2jjj s TYR 17 Cb -0.05 -1.16 -0.04 0.00 -0.11 0.00 0.00 41.96 40.60 2jjj s TYR 17 CO 0.05 -0.08 -0.20 0.96 -1.11 0.00 0.00 175.55 175.17 2jjj s ILE 18 N -0.30 2.69 -0.02 2.71 -4.36 -0.15 -4.22 121.20 117.55 2jjj s ILE 18 Ca 0.04 -1.54 0.01 0.00 -0.26 0.00 0.00 60.65 58.90 2jjj s ILE 18 Cb -0.09 -2.22 0.01 0.00 1.25 0.00 0.00 42.46 41.42 2jjj s ILE 18 CO 0.00 0.12 -0.03 -0.89 0.24 0.00 0.00 174.94 174.38 2jjj s THR 19 N -1.10 0.33 0.42 8.37 2.01 -0.29 -1.03 115.64 124.34 2jjj s THR 19 Ca 0.17 -0.09 -0.24 0.00 0.31 0.00 0.00 61.69 61.84 2jjj s THR 19 Cb -0.10 -0.34 -0.08 0.00 0.01 0.00 0.00 72.50 71.99 2jjj s THR 19 CO 0.09 0.14 1.17 -2.84 -0.69 0.00 0.00 174.62 172.49 2jjj s PRO 20 N 0.45 3.94 -0.03 4.92 0.02 -1.26 -1.29 135.00 141.76 2jjj s PRO 20 Ca -0.05 1.82 0.00 0.00 0.02 0.00 0.00 61.00 62.80 2jjj s PRO 20 Cb -0.08 -2.58 0.03 0.00 0.02 0.00 0.00 34.50 31.89 2jjj s PRO 20 CO -0.01 -0.41 0.01 0.08 -0.33 0.00 0.00 177.00 176.34 2jjj s VAL 21 N -1.46 0.13 -0.23 3.83 1.01 0.50 -4.57 120.40 119.62 2jjj s VAL 21 Ca 0.59 0.11 -0.13 0.00 0.00 0.00 0.00 61.98 62.55 2jjj s VAL 21 Cb -0.30 -0.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 2jjj s VAL 21 CO 0.37 0.13 0.28 -1.10 0.00 0.00 0.00 175.10 174.79 2jjj s GLN 22 N 1.01 4.10 -0.09 2.72 1.11 -0.17 -1.17 119.66 127.17 2jjj s GLN 22 Ca -0.10 -0.05 0.03 0.00 0.01 0.00 0.00 55.36 55.25 2jjj s GLN 22 Cb -0.13 -3.55 0.01 0.00 -1.01 0.00 0.00 33.01 28.32 2jjj s GLN 22 CO -0.02 -0.02 -0.19 0.42 0.01 0.00 0.00 175.29 175.49 2jjj s ILE 23 N 1.29 1.70 0.00 1.08 1.01 -0.00 -0.61 121.20 125.67 2jjj s ILE 23 Ca 0.13 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 59.98 2jjj s ILE 23 Cb -0.14 -1.50 0.00 0.00 0.01 0.00 0.00 42.46 40.83 2jjj s ILE 23 CO 0.07 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.10 2jjj n GLY 24 N 3.73 -3.08 2.81 6.18 0.00 0.60 -0.53 105.19 114.89 2jjj n GLY 24 Ca -0.20 -1.80 -0.26 0.00 0.00 0.00 0.00 46.02 43.76 2jjj n GLY 24 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jjj s THR 25 N -0.86 0.65 0.89 2.61 2.01 -1.26 -2.78 115.64 116.89 2jjj s THR 25 Ca 0.00 -0.24 -0.10 0.00 0.31 0.00 0.00 61.69 61.65 2jjj s THR 25 Cb 0.00 -0.87 0.13 0.00 0.01 0.00 0.00 72.50 71.77 2jjj s THR 25 CO 0.00 0.14 1.13 -2.16 -0.69 0.00 0.00 174.62 173.04 2jjj s PRO 26 N 1.84 1.25 0.31 4.92 0.04 -1.26 -1.01 135.00 141.10 2jjj s PRO 26 Ca 0.03 1.42 -0.30 0.00 0.04 0.00 0.00 61.00 62.19 2jjj s PRO 26 Cb -0.14 -1.76 -0.12 0.00 0.04 0.00 0.00 34.50 32.52 2jjj s PRO 26 CO -0.07 -2.43 1.56 0.00 0.04 0.00 0.00 177.00 176.11 2jjj n ALA 27 N -4.08 2.44 -3.32 8.56 0.00 -1.12 -4.90 120.51 118.10 2jjj n ALA 27 Ca 0.11 0.37 -0.36 0.00 0.00 0.00 0.00 53.44 53.55 2jjj n ALA 27 Cb 0.52 -2.44 -0.13 0.00 0.00 0.00 0.00 19.45 17.40 2jjj n ALA 27 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jjj s GLN 28 N -0.87 3.27 -0.27 0.00 -0.21 0.31 -4.87 119.66 117.02 2jjj s GLN 28 Ca 0.62 -0.72 -0.18 0.00 0.02 0.00 0.00 55.36 55.10 2jjj s GLN 28 Cb -0.50 -3.20 -0.02 0.00 1.00 0.00 0.00 33.01 30.28 2jjj s GLN 28 CO 0.52 -0.31 0.50 0.99 -2.12 0.00 0.00 175.29 174.88 2jjj s THR 29 N 1.50 5.07 0.11 -0.19 2.01 -1.26 -0.82 115.64 122.06 2jjj s THR 29 Ca 0.04 0.78 0.10 0.00 0.31 0.00 0.00 61.69 62.92 2jjj s THR 29 Cb -0.16 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.48 2jjj s THR 29 CO 0.00 0.05 -0.24 -0.76 -0.69 0.00 0.00 174.62 172.98 2jjj s LEU 30 N 2.31 2.42 -0.37 4.42 1.02 -0.32 -4.95 118.68 123.21 2jjj s LEU 30 Ca 0.20 -0.67 -0.15 0.00 0.02 0.00 0.00 54.13 53.54 2jjj s LEU 30 Cb -0.16 -1.33 -0.00 0.00 0.02 0.00 0.00 46.19 44.72 2jjj s LEU 30 CO 0.10 0.19 0.34 0.20 0.02 0.00 0.00 176.35 177.20 2jjj s ASN 31 N -1.97 6.14 0.14 2.29 0.02 -1.26 -0.37 114.94 119.94 2jjj s ASN 31 Ca 0.15 -0.46 0.07 0.00 -1.02 0.00 0.00 52.86 51.60 2jjj s ASN 31 Cb -0.10 -2.18 -0.04 0.00 0.02 0.00 0.00 41.25 38.95 2jjj s ASN 31 CO 0.07 -0.38 -0.03 -0.76 0.02 0.00 0.00 177.10 176.03 2jjj s LEU 32 N 1.92 3.27 -0.44 0.60 1.43 -0.41 -0.98 118.68 124.07 2jjj s LEU 32 Ca 0.09 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 52.61 2jjj s LEU 32 Cb -0.17 -1.97 0.02 0.00 0.03 0.00 0.00 46.19 44.10 2jjj s LEU 32 CO 0.11 0.12 0.75 -0.62 0.23 0.00 0.00 176.35 176.95 2jjj s ASP 33 N -2.67 6.40 -0.18 2.29 -1.08 -0.45 -1.14 116.67 119.84 2jjj s ASP 33 Ca 0.26 -0.11 -0.29 0.00 -0.52 0.00 0.00 52.55 51.88 2jjj s ASP 33 Cb -0.10 -2.37 -0.01 0.00 -1.46 0.00 0.00 42.92 38.98 2jjj s ASP 33 CO 0.17 -0.86 1.20 -0.36 0.52 0.00 0.00 175.17 175.85 2jjj s PHE 34 N 3.15 2.98 -0.30 -5.34 0.40 -1.26 -1.38 117.98 116.22 2jjj s PHE 34 Ca 0.28 1.14 0.01 0.00 -0.60 0.00 0.00 56.93 57.75 2jjj s PHE 34 Cb -0.13 -3.44 0.09 0.00 0.51 0.00 0.00 43.02 40.06 2jjj s PHE 34 CO 0.21 -1.36 0.07 0.34 0.70 0.00 0.00 175.22 175.17 2jjj s ASP 35 N 1.76 4.15 0.00 1.36 2.15 -0.25 -4.10 116.67 121.74 2jjj s ASP 35 Ca 0.52 -1.68 0.17 0.00 0.43 0.00 0.00 52.55 51.98 2jjj s ASP 35 Cb -0.20 -1.08 1.02 0.00 -0.30 0.00 0.00 42.92 42.35 2jjj s ASP 35 CO 0.12 -0.38 1.48 0.35 -0.17 0.00 0.00 175.17 176.56 2jjj n THR 36 N 4.68 0.00 0.61 1.71 -2.24 -1.26 -0.99 114.28 116.79 2jjj n THR 36 Ca -0.02 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.88 2jjj n THR 36 Cb 0.42 -0.51 0.21 0.00 -2.10 0.00 0.00 70.33 68.35 2jjj n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jjj n GLY 37 N 0.38 1.36 3.52 3.38 0.00 -1.26 -3.54 105.19 109.03 2jjj n GLY 37 Ca 0.13 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 2jjj n GLY 37 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jjj s SER 38 N -1.65 0.54 -0.02 1.61 1.04 -1.10 -4.91 113.70 109.22 2jjj s SER 38 Ca 0.35 -1.31 0.10 0.00 0.48 0.00 0.00 55.95 55.58 2jjj s SER 38 Cb 0.22 0.64 0.18 0.00 0.10 0.00 0.00 66.02 67.16 2jjj s SER 38 CO 0.31 -1.26 1.07 -1.20 0.98 0.00 0.00 173.24 173.14 2jjj n SER 39 N -1.07 0.55 -4.46 7.02 7.64 -1.26 -0.93 113.62 121.10 2jjj n SER 39 Ca -0.00 -2.14 -0.33 0.00 1.01 0.00 0.00 58.87 57.41 2jjj n SER 39 Cb 0.62 -0.26 -0.13 0.00 -1.01 0.00 0.00 64.21 63.43 2jjj n SER 39 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2jjj s ASP 40 N -1.54 4.14 -0.47 6.43 1.11 -1.26 -4.39 116.67 120.69 2jjj s ASP 40 Ca 0.15 -0.21 -0.14 0.00 0.18 0.00 0.00 52.55 52.53 2jjj s ASP 40 Cb 0.16 -1.16 0.08 0.00 1.07 0.00 0.00 42.92 43.08 2jjj s ASP 40 CO -0.06 0.29 0.37 -0.22 1.18 0.00 0.00 175.17 176.73 2jjj s LEU 41 N -0.37 5.59 0.09 1.23 0.20 -1.26 -1.36 118.68 122.80 2jjj s LEU 41 Ca 0.04 -1.45 0.05 0.00 0.69 0.00 0.00 54.13 53.46 2jjj s LEU 41 Cb -0.12 -2.13 -0.03 0.00 -0.43 0.00 0.00 46.19 43.47 2jjj s LEU 41 CO 0.02 -0.65 -0.14 -1.66 -0.29 0.00 0.00 176.35 173.63 2jjj s TRP 42 N 1.57 1.28 0.03 5.38 1.48 -0.58 -0.93 118.94 127.17 2jjj s TRP 42 Ca 0.04 -0.50 0.02 0.00 -1.06 0.00 0.00 56.10 54.60 2jjj s TRP 42 Cb -0.25 -0.71 -0.02 0.00 -1.16 0.00 0.00 33.47 31.34 2jjj s TRP 42 CO 0.05 0.08 -0.07 0.14 -4.06 0.00 0.00 176.95 173.09 2jjj s VAL 43 N -1.57 0.47 0.45 -0.66 -7.23 -0.32 -0.99 120.40 110.56 2jjj s VAL 43 Ca 0.02 -0.89 -0.24 0.00 -1.81 0.00 0.00 61.98 59.06 2jjj s VAL 43 Cb -0.08 -0.52 -0.09 0.00 0.56 0.00 0.00 36.38 36.25 2jjj s VAL 43 CO 0.02 -0.29 1.25 0.49 -0.31 0.00 0.00 175.10 176.26 2jjj n PHE 44 N 1.78 2.02 -4.05 2.82 3.01 -0.46 -1.70 117.46 120.89 2jjj n PHE 44 Ca -0.21 0.49 -0.10 0.00 1.01 0.00 0.00 57.45 58.64 2jjj n PHE 44 Cb 0.55 -2.35 -0.07 0.00 -0.01 0.00 0.00 39.48 37.60 2jjj n PHE 44 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2jjj s SER 45 N -0.64 0.02 0.48 4.37 0.15 -1.26 -1.13 113.70 115.70 2jjj s SER 45 Ca 0.63 -1.05 0.32 0.00 0.70 0.00 0.00 55.95 56.56 2jjj s SER 45 Cb -0.49 0.48 1.73 0.00 -1.71 0.00 0.00 66.02 66.03 2jjj s SER 45 CO 0.56 -0.98 1.99 0.77 1.20 0.00 0.00 173.24 176.79 2jjj h SER 46 N 2.45 0.00 1.86 5.45 4.64 -1.42 -1.59 113.55 124.95 2jjj h SER 46 Ca -0.31 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.00 2jjj h SER 46 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2jjj h SER 46 CO 0.44 0.00 -0.14 -0.33 -0.87 0.00 0.00 176.83 175.93 2jjj h GLU 47 N 0.00 0.00 -6.73 4.77 5.08 -1.84 -3.47 114.58 112.39 2jjj h GLU 47 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 2jjj h GLU 47 Cb 0.04 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.33 2jjj h GLU 47 CO 0.00 0.06 0.64 0.99 -1.00 0.00 0.00 179.01 179.70 2jjj s THR 48 N -3.19 3.12 -0.08 1.13 2.01 -0.60 -4.49 115.64 113.54 2jjj s THR 48 Ca 0.06 0.97 -0.39 0.00 0.31 0.00 0.00 61.69 62.64 2jjj s THR 48 Cb 0.06 -3.62 -0.17 0.00 0.01 0.00 0.00 72.50 68.78 2jjj s THR 48 CO 0.69 0.17 1.49 0.41 -0.69 0.00 0.00 174.62 176.68 2jjj n THR 49 N 2.17 0.12 -0.23 -0.82 -1.04 -0.32 -4.81 114.28 109.35 2jjj n THR 49 Ca 0.04 -0.02 -0.01 0.00 -2.04 0.00 0.00 64.05 62.02 2jjj n THR 49 Cb 0.43 -0.91 0.19 0.00 -1.82 0.00 0.00 70.33 68.23 2jjj n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jjj h ALA 50 N 5.49 1.34 0.00 2.41 0.00 -1.92 0.03 119.26 126.61 2jjj h ALA 50 Ca -0.47 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2jjj h ALA 50 Cb 1.34 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2jjj h ALA 50 CO 0.85 0.55 0.00 0.66 0.00 0.00 0.00 179.25 181.31 2jjj h SER 51 N 1.05 0.00 0.01 0.00 4.64 -2.02 -1.97 113.55 115.27 2jjj h SER 51 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2jjj h SER 51 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2jjj h SER 51 CO -0.05 0.00 -0.16 -0.62 -0.87 0.00 0.00 176.83 175.13 2jjj n GLU 52 N -2.29 1.69 -3.87 4.77 1.02 -0.01 -5.12 120.64 116.83 2jjj n GLU 52 Ca 0.01 -1.28 -0.21 0.00 -0.02 0.00 0.00 57.16 55.66 2jjj n GLU 52 Cb 0.16 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.09 2jjj n GLU 52 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2jjj s VAL 53 N -2.20 4.83 0.00 2.62 1.01 -0.74 -4.39 120.40 121.53 2jjj s VAL 53 Ca 0.27 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 61.20 2jjj s VAL 53 Cb 0.20 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.90 2jjj s VAL 53 CO 0.41 -0.29 0.00 0.00 0.00 0.00 0.00 175.10 175.22 2jjj n GLN 56 N -1.44 0.00 -3.18 2.72 3.00 -1.26 -5.00 117.38 112.23 2jjj n GLN 56 Ca -0.07 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.54 2jjj n GLN 56 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 30.24 30.76 2jjj n GLN 56 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 2jjj s THR 57 N -3.04 4.83 0.12 5.09 2.01 -1.26 -5.08 115.64 118.31 2jjj s THR 57 Ca 0.00 1.31 0.06 0.00 0.31 0.00 0.00 61.69 63.37 2jjj s THR 57 Cb 0.00 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 2jjj s THR 57 CO 0.00 0.44 -0.02 0.27 -0.69 0.00 0.00 174.62 174.62 2jjj s ILE 58 N -0.40 3.79 -0.09 1.82 -4.36 -1.26 -4.69 121.20 116.00 2jjj s ILE 58 Ca 0.32 -1.17 -0.19 0.00 -0.26 0.00 0.00 60.65 59.35 2jjj s ILE 58 Cb -0.19 -2.83 -0.04 0.00 1.25 0.00 0.00 42.46 40.65 2jjj s ILE 58 CO 0.19 0.06 0.52 -0.47 0.24 0.00 0.00 174.94 175.48 2jjj s TYR 59 N -1.40 3.55 -0.40 1.37 5.04 -0.28 -4.87 117.35 120.36 2jjj s TYR 59 Ca 0.25 0.99 -0.03 0.00 -2.44 0.00 0.00 57.07 55.84 2jjj s TYR 59 Cb -0.11 -2.59 0.11 0.00 0.35 0.00 0.00 41.96 39.72 2jjj s TYR 59 CO 0.17 0.20 0.19 0.99 -1.34 0.00 0.00 175.55 175.76 2jjj s THR 60 N 0.49 3.30 0.42 4.34 2.01 -1.26 -1.02 115.64 123.91 2jjj s THR 60 Ca 0.28 -1.99 0.08 0.00 0.31 0.00 0.00 61.69 60.37 2jjj s THR 60 Cb -0.16 -3.24 0.27 0.00 0.01 0.00 0.00 72.50 69.39 2jjj s THR 60 CO 0.12 -0.65 2.05 -0.65 -0.69 0.00 0.00 174.62 174.81 2jjj h PRO 61 N 8.06 0.51 0.00 4.92 0.10 -1.97 -1.56 132.00 142.06 2jjj h PRO 61 Ca -0.14 -0.03 0.00 0.00 0.10 0.00 0.00 66.00 65.93 2jjj h PRO 61 Cb 1.05 -0.11 0.00 0.00 0.10 0.00 0.00 31.00 32.04 2jjj h PRO 61 CO 0.69 0.34 0.00 -1.13 0.10 0.00 0.00 178.00 178.00 2jjj n SER 62 N -4.48 0.00 -0.59 -2.05 3.41 -1.26 -1.49 113.62 107.17 2jjj n SER 62 Ca 0.04 -0.09 0.13 0.00 -0.26 0.00 0.00 58.87 58.69 2jjj n SER 62 Cb 0.10 -0.25 0.28 0.00 -0.26 0.00 0.00 64.21 64.08 2jjj n SER 62 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jjj n LYS 63 N -1.25 1.64 -3.83 4.33 5.02 -0.59 -4.88 118.16 118.61 2jjj n LYS 63 Ca 0.11 -1.18 -0.36 0.00 -2.02 0.00 0.00 58.31 54.86 2jjj n LYS 63 Cb 0.15 -1.48 -0.13 0.00 -0.02 0.00 0.00 35.03 33.56 2jjj n LYS 63 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2jjj s SER 64 N -2.17 4.98 0.47 4.39 0.15 -0.55 -4.39 113.70 116.58 2jjj s SER 64 Ca 0.29 -0.22 0.31 0.00 0.70 0.00 0.00 55.95 57.03 2jjj s SER 64 Cb 0.20 -1.88 1.27 0.00 -1.71 0.00 0.00 66.02 63.89 2jjj s SER 64 CO 0.40 -0.01 1.91 0.71 1.20 0.00 0.00 173.24 177.45 2jjj h THR 65 N 5.52 0.00 -0.01 6.45 1.35 -1.36 -2.93 112.91 121.94 2jjj h THR 65 Ca -0.38 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 2jjj h THR 65 Cb 1.17 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 2jjj h THR 65 CO 0.59 0.00 -0.54 0.35 -0.25 0.00 0.00 175.52 175.67 2jjj n THR 66 N -2.87 0.00 -2.37 6.82 -2.24 -1.26 -4.95 114.28 107.41 2jjj n THR 66 Ca 0.01 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.24 2jjj n THR 66 Cb 0.29 0.88 -0.03 0.00 -2.10 0.00 0.00 70.33 69.36 2jjj n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jjj s ALA 67 N -2.65 3.44 -0.05 6.98 0.00 -1.11 -4.48 121.76 123.89 2jjj s ALA 67 Ca 0.17 0.96 0.03 0.00 0.00 0.00 0.00 51.96 53.12 2jjj s ALA 67 Cb 0.18 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.89 2jjj s ALA 67 CO 0.64 -0.36 -0.14 0.15 0.00 0.00 0.00 175.76 176.05 2jjj s LYS 68 N -0.45 1.58 0.12 0.00 1.02 -0.15 -4.97 119.74 116.89 2jjj s LYS 68 Ca 0.52 -0.48 -0.31 0.00 0.02 0.00 0.00 55.97 55.72 2jjj s LYS 68 Cb -0.33 -1.36 -0.08 0.00 -0.52 0.00 0.00 37.83 35.54 2jjj s LYS 68 CO 0.38 0.14 1.33 -1.17 -0.92 0.00 0.00 175.35 175.11 2jjj s LEU 69 N 0.29 4.38 -0.69 3.17 2.96 -1.26 -0.67 118.68 126.85 2jjj s LEU 69 Ca -0.07 2.27 -0.24 0.00 -0.22 0.00 0.00 54.13 55.87 2jjj s LEU 69 Cb -0.12 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 43.04 2jjj s LEU 69 CO 0.02 -0.59 1.06 -0.22 -1.32 0.00 0.00 176.35 175.31 2jjj s LEU 70 N 0.89 4.00 0.27 -0.68 2.96 0.05 -4.88 118.68 121.30 2jjj s LEU 70 Ca 0.62 -0.82 -0.30 0.00 -0.22 0.00 0.00 54.13 53.40 2jjj s LEU 70 Cb -0.35 -2.46 -0.11 0.00 0.50 0.00 0.00 46.19 43.76 2jjj s LEU 70 CO 0.31 -1.57 1.60 -0.44 -1.32 0.00 0.00 176.35 174.94 2jjj s SER 71 N 3.70 6.41 0.00 3.68 0.01 -1.26 -2.14 113.70 124.10 2jjj s SER 71 Ca 0.26 2.90 0.00 0.00 1.31 0.00 0.00 55.95 60.42 2jjj s SER 71 Cb -0.14 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.46 2jjj s SER 71 CO 0.12 -0.90 0.00 0.61 0.41 0.00 0.00 173.24 173.47 2jjj n GLY 72 N 2.54 1.56 3.81 3.44 0.00 -1.26 -5.01 105.19 110.27 2jjj n GLY 72 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2jjj n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jjj s ALA 73 N -3.66 3.66 0.17 4.61 0.00 -0.91 -4.45 121.76 121.18 2jjj s ALA 73 Ca 0.00 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.71 2jjj s ALA 73 Cb 0.00 -2.40 -0.05 0.00 0.00 0.00 0.00 23.12 20.67 2jjj s ALA 73 CO 0.00 0.38 0.03 0.95 0.00 0.00 0.00 175.76 177.12 2jjj s THR 74 N -0.66 0.52 0.05 0.00 -4.23 -0.22 -3.74 115.64 107.36 2jjj s THR 74 Ca 0.23 -1.97 -0.08 0.00 -1.18 0.00 0.00 61.69 58.69 2jjj s THR 74 Cb -0.16 -2.17 -0.00 0.00 1.34 0.00 0.00 72.50 71.51 2jjj s THR 74 CO 0.11 -0.41 0.17 -1.66 -0.54 0.00 0.00 174.62 172.30 2jjj s TRP 75 N -3.77 0.11 -0.28 3.99 1.48 -0.78 -0.70 118.94 118.99 2jjj s TRP 75 Ca 0.26 -0.40 -0.14 0.00 -1.06 0.00 0.00 56.10 54.75 2jjj s TRP 75 Cb 0.07 -0.06 0.09 0.00 -1.16 0.00 0.00 33.47 32.41 2jjj s TRP 75 CO 0.05 -0.45 0.68 0.45 -4.06 0.00 0.00 176.95 173.62 2jjj s SER 76 N -2.30 -1.00 0.03 -2.66 0.15 -1.26 -1.69 113.70 104.97 2jjj s SER 76 Ca -0.02 1.53 0.02 0.00 0.70 0.00 0.00 55.95 58.17 2jjj s SER 76 Cb 0.01 1.63 -0.02 0.00 -1.71 0.00 0.00 66.02 65.92 2jjj s SER 76 CO -0.06 -0.23 -0.06 -0.51 1.20 0.00 0.00 173.24 173.57 2jjj s ILE 77 N 1.97 0.42 0.06 6.45 2.07 -0.49 -4.84 121.20 126.85 2jjj s ILE 77 Ca -0.09 -0.93 0.03 0.00 -1.41 0.00 0.00 60.65 58.25 2jjj s ILE 77 Cb -0.07 -0.49 -0.03 0.00 0.13 0.00 0.00 42.46 42.00 2jjj s ILE 77 CO -0.20 -0.35 -0.09 -0.94 -1.91 0.00 0.00 174.94 171.45 2jjj s SER 78 N -1.37 1.17 0.39 4.50 1.04 -1.26 -2.00 113.70 116.18 2jjj s SER 78 Ca -0.10 -0.66 0.08 0.00 0.48 0.00 0.00 55.95 55.75 2jjj s SER 78 Cb -0.09 0.02 -0.05 0.00 0.10 0.00 0.00 66.02 66.00 2jjj s SER 78 CO 0.00 -0.21 0.16 -0.31 0.98 0.00 0.00 173.24 173.86 2jjj s TYR 79 N -1.79 2.62 0.49 5.02 2.02 0.01 -4.99 117.35 120.73 2jjj s TYR 79 Ca -0.03 -0.54 0.20 0.00 -0.37 0.00 0.00 57.07 56.33 2jjj s TYR 79 Cb -0.07 -1.87 1.31 0.00 -0.40 0.00 0.00 41.96 40.93 2jjj s TYR 79 CO 0.00 0.23 2.10 0.78 -1.57 0.00 0.00 175.55 177.10 2jjj h GLY 80 N 1.48 0.00 -0.52 0.71 0.00 -2.00 -0.23 103.07 102.51 2jjj h GLY 80 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 2jjj h GLY 80 CO 0.68 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.31 2jjj n ASP 81 N -4.19 0.99 0.00 0.19 5.68 -1.26 -4.90 116.55 113.06 2jjj n ASP 81 Ca -0.03 -1.84 0.00 0.00 -0.50 0.00 0.00 54.79 52.42 2jjj n ASP 81 Cb 0.17 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.04 2jjj n ASP 81 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jjj n GLY 82 N 0.87 1.00 3.83 6.12 0.00 -0.10 -5.07 105.19 111.85 2jjj n GLY 82 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 2jjj n GLY 82 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jjj s SER 83 N -3.02 5.16 0.22 1.61 1.04 -1.26 -4.75 113.70 112.70 2jjj s SER 83 Ca 0.00 1.38 -0.22 0.00 0.48 0.00 0.00 55.95 57.60 2jjj s SER 83 Cb 0.00 -2.21 0.04 0.00 0.10 0.00 0.00 66.02 63.95 2jjj s SER 83 CO 0.00 -1.56 0.66 -0.94 0.98 0.00 0.00 173.24 172.38 2jjj s SER 84 N -3.99 -0.40 0.15 7.02 1.04 -1.26 -0.81 113.70 115.45 2jjj s SER 84 Ca 0.59 -0.33 -0.24 0.00 0.48 0.00 0.00 55.95 56.44 2jjj s SER 84 Cb -0.13 0.67 0.06 0.00 0.10 0.00 0.00 66.02 66.72 2jjj s SER 84 CO 0.54 -1.17 0.79 -0.55 0.98 0.00 0.00 173.24 173.84 2jjj s SER 85 N -2.84 -0.34 0.19 7.02 0.15 -0.84 -0.87 113.70 116.17 2jjj s SER 85 Ca 0.06 -0.26 -0.23 0.00 0.70 0.00 0.00 55.95 56.22 2jjj s SER 85 Cb -0.04 0.55 0.05 0.00 -1.71 0.00 0.00 66.02 64.88 2jjj s SER 85 CO -0.02 -0.97 0.71 -0.94 1.20 0.00 0.00 173.24 173.22 2jjj s SER 86 N -2.78 -0.40 0.00 5.45 1.04 -1.07 -1.39 113.70 114.55 2jjj s SER 86 Ca 0.07 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2jjj s SER 86 Cb -0.02 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2jjj s SER 86 CO -0.03 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 173.73 2jjj n GLY 87 N -0.41 -0.66 2.74 7.32 0.00 -0.68 -0.41 105.19 113.09 2jjj n GLY 87 Ca -0.10 -0.49 -0.24 0.00 0.00 0.00 0.00 46.02 45.19 2jjj n GLY 87 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jjj n ASP 88 N 0.00 2.94 -3.87 1.61 5.68 -0.91 -1.87 116.55 120.13 2jjj n ASP 88 Ca 0.00 -2.63 -0.18 0.00 -0.50 0.00 0.00 54.79 51.48 2jjj n ASP 88 Cb 0.00 0.22 -0.16 0.00 -1.14 0.00 0.00 41.12 40.04 2jjj n ASP 88 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2jjj s VAL 89 N -2.32 0.37 0.18 2.12 1.01 -1.25 -0.94 120.40 119.58 2jjj s VAL 89 Ca 0.04 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.05 2jjj s VAL 89 Cb -0.00 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 2jjj s VAL 89 CO 0.02 0.18 -0.05 -0.31 0.00 0.00 0.00 175.10 174.94 2jjj s TYR 90 N 0.82 2.72 -0.06 5.22 1.51 -0.48 -0.77 117.35 126.31 2jjj s TYR 90 Ca -0.10 -0.19 -0.04 0.00 -1.01 0.00 0.00 57.07 55.74 2jjj s TYR 90 Cb -0.13 -1.31 -0.04 0.00 -0.11 0.00 0.00 41.96 40.37 2jjj s TYR 90 CO -0.01 0.52 0.12 0.95 -1.11 0.00 0.00 175.55 176.02 2jjj s THR 91 N -1.76 5.14 0.30 -0.71 -4.23 0.15 -0.17 115.64 114.36 2jjj s THR 91 Ca 0.26 -0.09 -0.18 0.00 -1.18 0.00 0.00 61.69 60.51 2jjj s THR 91 Cb -0.09 -3.29 0.02 0.00 1.34 0.00 0.00 72.50 70.48 2jjj s THR 91 CO 0.17 0.49 0.69 -0.62 -0.54 0.00 0.00 174.62 174.80 2jjj s ASP 92 N -1.38 -0.13 0.01 3.99 -1.08 -0.22 -0.97 116.67 116.88 2jjj s ASP 92 Ca 0.19 -0.82 -0.30 0.00 -0.52 0.00 0.00 52.55 51.11 2jjj s ASP 92 Cb -0.12 0.73 -0.03 0.00 -1.46 0.00 0.00 42.92 42.04 2jjj s ASP 92 CO 0.09 -1.39 0.96 -0.89 0.52 0.00 0.00 175.17 174.46 2jjj s THR 93 N -3.53 4.84 -0.06 1.71 2.01 -1.26 -1.23 115.64 118.12 2jjj s THR 93 Ca 0.15 2.02 0.02 0.00 0.31 0.00 0.00 61.69 64.19 2jjj s THR 93 Cb -0.05 -4.30 0.01 0.00 0.01 0.00 0.00 72.50 68.17 2jjj s THR 93 CO 0.09 0.18 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.40 2jjj s VAL 94 N 0.89 1.07 -0.03 3.82 1.01 -0.22 -0.29 120.40 126.65 2jjj s VAL 94 Ca 0.51 -0.45 0.06 0.00 0.00 0.00 0.00 61.98 62.09 2jjj s VAL 94 Cb -0.21 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 35.18 2jjj s VAL 94 CO 0.28 0.34 -0.20 -0.44 0.00 0.00 0.00 175.10 175.08 2jjj s SER 95 N 0.61 2.38 -0.15 3.32 0.01 0.22 -0.71 113.70 119.39 2jjj s SER 95 Ca -0.13 -0.38 -0.00 0.00 1.31 0.00 0.00 55.95 56.75 2jjj s SER 95 Cb -0.15 -0.44 0.03 0.00 0.21 0.00 0.00 66.02 65.67 2jjj s SER 95 CO 0.03 0.22 -0.09 -0.69 0.41 0.00 0.00 173.24 173.12 2jjj s VAL 96 N -0.27 1.25 -1.73 3.43 1.01 -0.10 -1.00 120.40 123.00 2jjj s VAL 96 Ca 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.44 2jjj s VAL 96 Cb -0.10 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 34.98 2jjj s VAL 96 CO 0.01 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2jjj n GLY 97 N 4.85 -0.38 0.84 4.51 0.00 -1.26 -1.43 105.19 112.32 2jjj n GLY 97 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2jjj n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jjj n GLY 98 N -0.96 0.82 3.62 -0.02 0.00 -1.26 -0.99 105.19 106.40 2jjj n GLY 98 Ca -0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 2jjj n GLY 98 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jjj s LEU 99 N 0.00 4.06 -0.13 0.99 2.96 -0.51 -4.86 118.68 121.19 2jjj s LEU 99 Ca 0.00 0.57 -0.03 0.00 -0.22 0.00 0.00 54.13 54.45 2jjj s LEU 99 Cb 0.00 -2.70 -0.03 0.00 0.50 0.00 0.00 46.19 43.96 2jjj s LEU 99 CO 0.00 -0.29 -0.04 -0.89 -1.32 0.00 0.00 176.35 173.81 2jjj s THR 100 N 2.27 3.93 -0.08 3.68 2.01 -1.26 -0.92 115.64 125.27 2jjj s THR 100 Ca 0.22 -0.36 0.04 0.00 0.31 0.00 0.00 61.69 61.90 2jjj s THR 100 Cb -0.16 -2.69 -0.01 0.00 0.01 0.00 0.00 72.50 69.65 2jjj s THR 100 CO 0.09 0.53 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.65 2jjj s VAL 101 N -0.02 2.42 0.10 3.82 1.01 0.11 -5.00 120.40 122.85 2jjj s VAL 101 Ca 0.01 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.09 2jjj s VAL 101 Cb -0.13 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 2jjj s VAL 101 CO 0.03 0.56 0.23 0.42 0.00 0.00 0.00 175.10 176.34 2jjj s THR 102 N -0.03 5.30 -0.63 3.92 -4.23 -1.26 -1.05 115.64 117.66 2jjj s THR 102 Ca -0.06 -0.54 0.00 0.00 -1.18 0.00 0.00 61.69 59.90 2jjj s THR 102 Cb -0.15 -3.65 0.00 0.00 1.34 0.00 0.00 72.50 70.05 2jjj s THR 102 CO 0.05 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 2jjj n GLY 103 N -0.06 0.84 3.73 3.99 0.00 -1.17 -4.95 105.19 107.57 2jjj n GLY 103 Ca -0.06 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 2jjj n GLY 103 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jjj s GLN 104 N -2.39 4.47 -0.03 1.61 2.00 -0.37 -4.64 119.66 120.31 2jjj s GLN 104 Ca 0.00 1.86 -0.30 0.00 -2.00 0.00 0.00 55.36 54.92 2jjj s GLN 104 Cb 0.00 -3.26 -0.05 0.00 0.80 0.00 0.00 33.01 30.49 2jjj s GLN 104 CO 0.00 -0.13 1.51 0.00 -0.50 0.00 0.00 175.29 176.17 2jjj s ALA 105 N 0.23 3.62 -0.29 1.58 0.00 -1.26 -1.06 121.76 124.59 2jjj s ALA 105 Ca 0.55 0.89 -0.02 0.00 0.00 0.00 0.00 51.96 53.37 2jjj s ALA 105 Cb -0.32 -3.67 0.04 0.00 0.00 0.00 0.00 23.12 19.17 2jjj s ALA 105 CO 0.35 -1.16 -0.00 0.08 0.00 0.00 0.00 175.76 175.03 2jjj s VAL 106 N 3.19 3.09 -0.41 0.00 1.01 0.77 -4.63 120.40 123.42 2jjj s VAL 106 Ca 0.68 -1.21 -0.23 0.00 0.00 0.00 0.00 61.98 61.22 2jjj s VAL 106 Cb -0.32 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.38 2jjj s VAL 106 CO 0.27 -0.01 0.76 -1.61 0.00 0.00 0.00 175.10 174.51 2jjj s GLU 107 N 1.30 3.57 -0.26 2.72 2.02 -0.11 -1.38 118.70 126.57 2jjj s GLU 107 Ca -0.03 0.06 -0.18 0.00 0.02 0.00 0.00 54.97 54.84 2jjj s GLU 107 Cb -0.19 -3.87 -0.03 0.00 0.10 0.00 0.00 34.13 30.14 2jjj s GLU 107 CO -0.01 -0.96 0.54 0.45 0.02 0.00 0.00 175.26 175.29 2jjj s SER 108 N 1.98 6.47 -0.03 -0.19 0.15 -0.12 -1.17 113.70 120.78 2jjj s SER 108 Ca 0.29 0.57 -0.30 0.00 0.70 0.00 0.00 55.95 57.21 2jjj s SER 108 Cb -0.13 -2.29 -0.04 0.00 -1.71 0.00 0.00 66.02 61.85 2jjj s SER 108 CO 0.19 -0.30 1.20 0.00 1.20 0.00 0.00 173.24 175.53 2jjj s ALA 109 N 2.34 3.47 0.10 5.45 0.00 -0.69 -2.15 121.76 130.28 2jjj s ALA 109 Ca 0.22 0.67 0.04 0.00 0.00 0.00 0.00 51.96 52.90 2jjj s ALA 109 Cb -0.16 -3.50 -0.23 0.00 0.00 0.00 0.00 23.12 19.24 2jjj s ALA 109 CO 0.09 -0.68 1.21 0.87 0.00 0.00 0.00 175.76 177.24 2jjj h LYS 110 N 7.32 0.07 -3.27 0.00 1.57 -0.96 -2.38 116.57 118.92 2jjj h LYS 110 Ca -0.36 -0.12 -0.13 0.00 -1.87 0.00 0.00 60.65 58.18 2jjj h LYS 110 Cb 1.17 0.04 -0.20 0.00 0.08 0.00 0.00 32.23 33.33 2jjj h LYS 110 CO 0.86 1.03 -0.37 0.15 -0.57 0.00 0.00 179.45 180.56 2jjj s LYS 111 N -2.69 0.60 0.04 3.15 1.02 -1.13 -1.17 119.74 119.56 2jjj s LYS 111 Ca -0.01 -0.31 0.01 0.00 0.02 0.00 0.00 55.97 55.68 2jjj s LYS 111 Cb 0.09 0.26 -0.03 0.00 -0.52 0.00 0.00 37.83 37.64 2jjj s LYS 111 CO 0.84 -0.16 -0.06 0.14 -0.92 0.00 0.00 175.35 175.19 2jjj s VAL 112 N -1.47 0.41 0.90 3.17 -7.23 -1.26 -2.59 120.40 112.33 2jjj s VAL 112 Ca -0.13 -1.17 -0.12 0.00 -1.81 0.00 0.00 61.98 58.75 2jjj s VAL 112 Cb -0.06 -0.68 0.13 0.00 0.56 0.00 0.00 36.38 36.33 2jjj s VAL 112 CO 0.02 -0.51 1.15 -0.94 -0.31 0.00 0.00 175.10 174.52 2jjj s SER 113 N -1.78 3.66 0.28 4.85 1.04 -0.05 -4.83 113.70 116.87 2jjj s SER 113 Ca -0.08 0.91 -0.02 0.00 0.48 0.00 0.00 55.95 57.24 2jjj s SER 113 Cb -0.07 -1.46 0.39 0.00 0.10 0.00 0.00 66.02 64.97 2jjj s SER 113 CO -0.01 -2.45 1.85 0.28 0.98 0.00 0.00 173.24 173.89 2jjj h SER 114 N -1.43 0.85 -0.65 7.02 0.02 -1.98 -1.63 113.55 115.74 2jjj h SER 114 Ca -0.50 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 2jjj h SER 114 Cb 1.33 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 2jjj h SER 114 CO 0.62 0.77 0.43 0.28 -1.14 0.00 0.00 176.83 177.78 2jjj h SER 115 N 0.91 0.76 -0.11 3.07 0.02 -1.96 -0.63 113.55 115.61 2jjj h SER 115 Ca 0.21 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 2jjj h SER 115 Cb 0.19 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2jjj h SER 115 CO -0.02 0.56 -0.02 -0.26 -1.14 0.00 0.00 176.83 175.96 2jjj h PHE 116 N 0.90 0.23 -0.81 3.45 0.04 -1.68 -2.80 116.94 116.27 2jjj h PHE 116 Ca 0.24 -0.05 0.12 0.00 2.80 0.00 0.00 57.97 61.09 2jjj h PHE 116 Cb -0.09 -0.06 -0.08 0.00 2.20 0.00 0.00 35.95 37.92 2jjj h PHE 116 CO 0.00 0.49 0.42 1.15 -0.60 0.00 0.00 178.31 179.77 2jjj h THR 117 N -0.10 0.79 0.00 -1.55 2.02 -0.92 -2.39 112.91 110.76 2jjj h THR 117 Ca 0.03 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.99 2jjj h THR 117 Cb 0.41 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 2jjj h THR 117 CO 0.01 0.12 0.00 -0.33 0.37 0.00 0.00 175.52 175.69 2jjj h GLU 118 N 0.64 0.00 -3.97 6.66 5.08 -1.02 -3.40 114.58 118.58 2jjj h GLU 118 Ca 0.42 0.00 -0.76 0.00 -1.00 0.00 0.00 59.36 58.02 2jjj h GLU 118 Cb 0.53 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.51 2jjj h GLU 118 CO -0.32 0.00 -0.14 -0.51 -1.00 0.00 0.00 179.01 177.04 2jjj s ASP 119 N -5.18 6.21 0.56 1.42 1.01 -0.90 -4.93 116.67 114.86 2jjj s ASP 119 Ca 0.03 -2.31 0.33 0.00 0.71 0.00 0.00 52.55 51.31 2jjj s ASP 119 Cb 0.09 -2.13 1.66 0.00 1.01 0.00 0.00 42.92 43.56 2jjj s ASP 119 CO 0.50 -0.65 2.13 0.77 0.21 0.00 0.00 175.17 178.12 2jjj h SER 120 N 8.13 0.00 1.48 0.27 4.64 -1.82 -3.13 113.55 123.13 2jjj h SER 120 Ca -0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 2jjj h SER 120 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2jjj h SER 120 CO 0.85 0.06 -0.36 0.71 -0.87 0.00 0.00 176.83 177.23 2jjj h THR 121 N 0.00 0.00 -3.58 2.95 1.35 -1.94 -3.35 112.91 108.34 2jjj h THR 121 Ca -0.00 -0.84 -0.67 0.00 -0.55 0.00 0.00 66.41 64.35 2jjj h THR 121 Cb 0.29 1.65 -0.27 0.00 -1.73 0.00 0.00 68.15 68.09 2jjj h THR 121 CO 0.01 0.00 -0.64 -0.63 -0.25 0.00 0.00 175.52 174.01 2jjj s ILE 122 N -3.23 3.83 -2.55 6.82 1.01 -1.18 -4.84 121.20 121.07 2jjj s ILE 122 Ca 0.05 -0.68 0.25 0.00 0.00 0.00 0.00 60.65 60.27 2jjj s ILE 122 Cb 0.09 -2.95 0.43 0.00 0.01 0.00 0.00 42.46 40.04 2jjj s ILE 122 CO 0.70 0.13 1.55 0.47 0.00 0.00 0.00 174.94 177.78 2jjj n ASP 123 N 4.84 2.12 0.00 3.58 8.00 -0.15 -4.93 116.55 130.01 2jjj n ASP 123 Ca -0.15 -1.73 0.00 0.00 0.71 0.00 0.00 54.79 53.62 2jjj n ASP 123 Cb 0.48 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 2jjj n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jjj n GLY 124 N 1.24 -0.21 3.32 0.44 0.00 -1.26 -1.35 105.19 107.37 2jjj n GLY 124 Ca 0.17 -1.62 -0.26 0.00 0.00 0.00 0.00 46.02 44.31 2jjj n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jjj s LEU 125 N 0.00 2.27 -0.31 0.99 2.01 -0.16 -1.34 118.68 122.14 2jjj s LEU 125 Ca 0.00 -0.67 0.02 0.00 0.01 0.00 0.00 54.13 53.50 2jjj s LEU 125 Cb 0.00 -1.05 0.09 0.00 0.01 0.00 0.00 46.19 45.24 2jjj s LEU 125 CO 0.00 0.14 0.02 -0.22 1.01 0.00 0.00 176.35 177.30 2jjj s LEU 126 N -1.75 3.72 0.26 1.79 0.20 -0.48 -1.53 118.68 120.88 2jjj s LEU 126 Ca 0.10 -1.79 -0.30 0.00 0.69 0.00 0.00 54.13 52.83 2jjj s LEU 126 Cb -0.10 -1.39 -0.09 0.00 -0.43 0.00 0.00 46.19 44.18 2jjj s LEU 126 CO 0.04 -0.34 1.04 -0.83 -0.29 0.00 0.00 176.35 175.97 2jjj s GLY 127 N 1.15 3.09 -0.01 7.98 0.00 -0.46 -1.09 107.32 117.97 2jjj s GLY 127 Ca 0.05 0.79 0.02 0.00 0.00 0.00 0.00 44.72 45.57 2jjj s GLY 127 CO -0.11 1.37 0.79 1.04 0.00 0.00 0.00 173.10 176.19 2jjj n LEU 128 N 1.30 0.92 0.00 0.66 4.77 -0.16 -4.47 117.00 120.02 2jjj n LEU 128 Ca -0.01 -1.09 -0.03 0.00 -0.03 0.00 0.00 56.01 54.85 2jjj n LEU 128 Cb 0.46 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.53 2jjj n LEU 128 CO 0.52 0.27 0.08 0.00 -1.33 0.00 0.00 177.39 176.93 2jjj n ALA 129 N -0.30 -0.21 -1.82 -1.18 0.00 -0.11 -4.75 120.51 112.15 2jjj n ALA 129 Ca 0.01 -0.16 -0.33 0.00 0.00 0.00 0.00 53.44 52.96 2jjj n ALA 129 Cb 0.44 -0.01 -0.07 0.00 0.00 0.00 0.00 19.45 19.81 2jjj n ALA 129 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2jjj s PHE 130 N -1.25 3.30 0.35 0.00 0.08 -0.67 -4.79 117.98 115.01 2jjj s PHE 130 Ca 0.07 1.61 0.39 0.00 0.12 0.00 0.00 56.93 59.12 2jjj s PHE 130 Cb -0.00 -2.87 1.85 0.00 -0.57 0.00 0.00 43.02 41.43 2jjj s PHE 130 CO 0.05 -0.15 2.16 0.77 -0.10 0.00 0.00 175.22 177.95 2jjj h SER 131 N 1.93 0.00 0.00 1.36 0.02 -1.90 -1.62 113.55 113.34 2jjj h SER 131 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 2jjj h SER 131 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2jjj h SER 131 CO 0.61 0.00 0.12 0.00 -1.14 0.00 0.00 176.83 176.42 2jjj h THR 132 N 0.00 0.00 -0.01 -2.27 1.03 -1.91 -0.67 112.91 109.07 2jjj h THR 132 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 2jjj h THR 132 Cb 0.28 0.74 0.00 0.00 -1.07 0.00 0.00 68.15 68.10 2jjj h THR 132 CO 0.00 0.00 -0.12 0.18 -0.01 0.00 0.00 175.52 175.57 2jjj n LEU 133 N -2.77 1.41 -4.77 0.00 4.77 -0.61 -4.96 117.00 110.07 2jjj n LEU 133 Ca -0.02 -0.44 -0.40 0.00 -0.03 0.00 0.00 56.01 55.12 2jjj n LEU 133 Cb 0.17 -0.05 0.01 0.00 -2.33 0.00 0.00 43.42 41.22 2jjj n LEU 133 CO 0.15 0.25 1.06 0.21 -1.33 0.00 0.00 177.39 177.72 2jjj s ASN 134 N -2.22 5.98 0.00 -1.43 2.47 -0.26 -4.62 114.94 114.85 2jjj s ASN 134 Ca 0.31 2.89 0.24 0.00 0.42 0.00 0.00 52.86 56.72 2jjj s ASN 134 Cb 0.20 -2.65 0.45 0.00 -1.45 0.00 0.00 41.25 37.80 2jjj s ASN 134 CO 0.42 -1.10 1.41 0.35 -3.72 0.00 0.00 177.10 174.45 2jjj n THR 135 N -0.09 0.23 -2.08 -5.21 -2.24 -1.26 -4.82 114.28 98.81 2jjj n THR 135 Ca 0.04 -0.55 -0.41 0.00 -2.27 0.00 0.00 64.05 60.86 2jjj n THR 135 Cb 0.42 1.03 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 2jjj n THR 135 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2jjj s VAL 136 N -1.77 2.73 0.06 2.28 1.01 -1.26 -4.20 120.40 119.25 2jjj s VAL 136 Ca 0.34 0.68 0.06 0.00 0.00 0.00 0.00 61.98 63.05 2jjj s VAL 136 Cb 0.21 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 2jjj s VAL 136 CO 0.31 0.14 -0.15 -0.94 0.00 0.00 0.00 175.10 174.45 2jjj s SER 137 N -0.10 1.83 0.35 3.32 1.04 0.12 -3.05 113.70 117.22 2jjj s SER 137 Ca 0.53 -0.53 0.21 0.00 0.48 0.00 0.00 55.95 56.64 2jjj s SER 137 Cb -0.40 -0.10 0.20 0.00 0.10 0.00 0.00 66.02 65.81 2jjj s SER 137 CO 0.48 0.02 1.45 1.55 0.98 0.00 0.00 173.24 177.72 2jjj h PRO 138 N 4.65 0.00 -5.11 4.02 0.13 -1.86 -0.56 132.00 133.27 2jjj h PRO 138 Ca -0.40 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.08 2jjj h PRO 138 Cb 1.18 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.06 2jjj h PRO 138 CO 0.42 0.14 -0.71 0.99 -0.23 0.00 0.00 178.00 178.61 2jjj s THR 139 N -3.16 3.54 0.66 1.56 2.01 -1.26 -5.10 115.64 113.90 2jjj s THR 139 Ca 0.05 -0.45 -0.17 0.00 0.31 0.00 0.00 61.69 61.42 2jjj s THR 139 Cb 0.06 -2.58 -0.00 0.00 0.01 0.00 0.00 72.50 69.99 2jjj s THR 139 CO 0.71 0.45 1.22 -1.10 -0.69 0.00 0.00 174.62 175.21 2jjj s GLN 140 N 1.06 2.56 0.05 4.92 -0.21 -1.17 -4.74 119.66 122.13 2jjj s GLN 140 Ca 0.01 1.82 0.04 0.00 0.02 0.00 0.00 55.36 57.25 2jjj s GLN 140 Cb -0.15 -1.88 -0.04 0.00 1.00 0.00 0.00 33.01 31.95 2jjj s GLN 140 CO 0.00 -1.53 -0.01 -0.65 -2.12 0.00 0.00 175.29 170.98 2jjj s GLN 141 N -3.61 2.60 0.43 2.91 -1.52 -1.26 -5.01 119.66 114.20 2jjj s GLN 141 Ca 0.77 -0.76 -0.22 0.00 -1.95 0.00 0.00 55.36 53.20 2jjj s GLN 141 Cb -0.31 -2.56 -0.09 0.00 -0.22 0.00 0.00 33.01 29.83 2jjj s GLN 141 CO 0.39 0.57 1.01 0.15 -0.25 0.00 0.00 175.29 177.17 2jjj s LYS 142 N -1.93 4.08 0.87 2.91 1.02 -1.26 -4.72 119.74 120.70 2jjj s LYS 142 Ca 0.22 1.35 -0.11 0.00 0.02 0.00 0.00 55.97 57.45 2jjj s LYS 142 Cb -0.12 -2.32 0.11 0.00 -0.52 0.00 0.00 37.83 34.99 2jjj s LYS 142 CO 0.14 -0.19 1.09 0.95 -0.92 0.00 0.00 175.35 176.42 2jjj s THR 143 N -1.89 2.80 0.20 2.17 -4.23 -1.26 -4.61 115.64 108.82 2jjj s THR 143 Ca 0.62 0.26 -0.10 0.00 -1.18 0.00 0.00 61.69 61.28 2jjj s THR 143 Cb -0.17 -2.73 0.13 0.00 1.34 0.00 0.00 72.50 71.08 2jjj s THR 143 CO 0.21 -0.34 1.74 0.15 -0.54 0.00 0.00 174.62 175.85 2jjj h PHE 144 N -1.46 0.38 -0.07 3.99 3.57 -1.94 -0.58 116.94 120.82 2jjj h PHE 144 Ca -0.48 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.05 2jjj h PHE 144 Cb 1.27 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.93 2jjj h PHE 144 CO 0.46 0.10 0.04 0.35 -2.23 0.00 0.00 178.31 177.03 2jjj h PHE 145 N 0.40 0.10 -0.64 0.41 3.57 -1.92 -1.14 116.94 117.72 2jjj h PHE 145 Ca 0.29 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.83 2jjj h PHE 145 Cb 0.35 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 2jjj h PHE 145 CO -0.17 0.11 0.38 -0.44 -2.23 0.00 0.00 178.31 175.97 2jjj h ASP 146 N 0.05 0.61 0.52 0.41 5.19 -1.81 -1.75 116.42 119.65 2jjj h ASP 146 Ca 0.03 0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.39 2jjj h ASP 146 Cb 0.05 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.43 2jjj h ASP 146 CO -0.00 0.42 -0.26 0.78 -3.12 0.00 0.00 179.24 177.05 2jjj h ASN 147 N 0.74 0.00 1.72 6.45 -0.26 -0.90 -3.10 115.58 120.24 2jjj h ASN 147 Ca 0.26 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.95 2jjj h ASN 147 Cb 0.06 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.31 2jjj h ASN 147 CO -0.12 0.26 -0.28 0.00 -1.06 0.00 0.00 177.43 176.23 2jjj h ALA 148 N 1.74 0.83 -0.77 -0.83 0.00 -0.37 -3.39 119.26 116.47 2jjj h ALA 148 Ca -0.00 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.75 2jjj h ALA 148 Cb 0.59 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2jjj h ALA 148 CO 0.03 0.30 0.50 0.87 0.00 0.00 0.00 179.25 180.96 2jjj h LYS 149 N 0.00 0.79 -0.95 0.00 1.57 -1.29 -1.26 116.57 115.43 2jjj h LYS 149 Ca -0.01 -0.05 0.08 0.00 -1.87 0.00 0.00 60.65 58.81 2jjj h LYS 149 Cb 1.19 -0.18 -0.07 0.00 0.08 0.00 0.00 32.23 33.25 2jjj h LYS 149 CO 0.03 0.52 0.59 0.00 -0.57 0.00 0.00 179.45 180.03 2jjj h ALA 150 N 1.59 1.35 0.00 3.86 0.00 -1.80 -2.96 119.26 121.30 2jjj h ALA 150 Ca 0.33 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.12 2jjj h ALA 150 Cb 0.25 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2jjj h ALA 150 CO -0.11 0.30 -1.13 0.66 0.00 0.00 0.00 179.25 178.97 2jjj h SER 151 N 1.03 0.00 -4.11 0.00 4.64 -1.55 -3.49 113.55 110.07 2jjj h SER 151 Ca 0.43 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.22 2jjj h SER 151 Cb 0.28 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 62.50 2jjj h SER 151 CO -0.21 0.46 0.47 -0.76 -0.87 0.00 0.00 176.83 175.93 2jjj s LEU 152 N -5.87 3.62 0.51 5.97 1.43 -0.77 -0.78 118.68 122.80 2jjj s LEU 152 Ca -0.01 2.42 0.21 0.00 -1.03 0.00 0.00 54.13 55.73 2jjj s LEU 152 Cb 0.08 -4.60 1.34 0.00 0.03 0.00 0.00 46.19 43.05 2jjj s LEU 152 CO 0.79 -1.71 2.10 0.44 0.23 0.00 0.00 176.35 178.20 2jjj h ASP 153 N 0.74 0.00 -4.25 2.29 5.19 -1.25 -3.42 116.42 115.72 2jjj h ASP 153 Ca -0.50 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 55.81 2jjj h ASP 153 Cb 1.30 0.00 -0.22 0.00 0.18 0.00 0.00 39.33 40.59 2jjj h ASP 153 CO 0.54 0.10 -0.13 -0.94 -3.12 0.00 0.00 179.24 175.69 2jjj s SER 154 N -6.60 -0.46 -1.45 6.45 1.04 -1.00 -5.01 113.70 106.66 2jjj s SER 154 Ca -0.04 0.77 -0.13 0.00 0.48 0.00 0.00 55.95 57.03 2jjj s SER 154 Cb 0.15 0.80 0.05 0.00 0.10 0.00 0.00 66.02 67.12 2jjj s SER 154 CO 0.63 -0.28 2.24 -0.81 0.98 0.00 0.00 173.24 176.01 2jjj n PRO 155 N 2.29 3.02 -3.98 4.02 -0.04 -1.26 -4.01 135.00 135.03 2jjj n PRO 155 Ca -0.16 -2.69 -0.09 0.00 -0.04 0.00 0.00 63.50 60.53 2jjj n PRO 155 Cb 0.57 -3.21 -0.10 0.00 -0.04 0.00 0.00 33.50 30.72 2jjj n PRO 155 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2jjj s VAL 156 N 2.76 0.15 0.06 0.52 1.01 -1.26 -0.62 120.40 123.02 2jjj s VAL 156 Ca 0.48 -1.27 0.01 0.00 0.00 0.00 0.00 61.98 61.19 2jjj s VAL 156 Cb 0.14 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2jjj s VAL 156 CO -0.08 -0.70 -0.05 0.72 0.00 0.00 0.00 175.10 174.99 2jjj s PHE 157 N -2.83 0.61 0.04 5.22 -0.12 -0.66 -0.67 117.98 119.58 2jjj s PHE 157 Ca -0.03 -0.78 0.06 0.00 -0.05 0.00 0.00 56.93 56.13 2jjj s PHE 157 Cb 0.00 -0.39 -0.02 0.00 -0.63 0.00 0.00 43.02 41.98 2jjj s PHE 157 CO -0.06 -0.21 -0.18 0.95 -0.05 0.00 0.00 175.22 175.67 2jjj s THR 158 N -2.74 1.45 -0.16 -4.49 -4.23 0.27 -0.54 115.64 105.22 2jjj s THR 158 Ca -0.00 -1.12 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 2jjj s THR 158 Cb -0.01 -1.28 -0.00 0.00 1.34 0.00 0.00 72.50 72.55 2jjj s THR 158 CO -0.04 0.13 -0.15 0.00 -0.54 0.00 0.00 174.62 174.02 2jjj s ALA 159 N -0.82 2.51 -0.54 3.99 0.00 -0.02 -1.95 121.76 124.93 2jjj s ALA 159 Ca 0.05 -1.05 0.05 0.00 0.00 0.00 0.00 51.96 51.01 2jjj s ALA 159 Cb -0.08 -1.25 0.18 0.00 0.00 0.00 0.00 23.12 21.97 2jjj s ALA 159 CO 0.02 -0.05 0.44 -3.47 0.00 0.00 0.00 175.76 172.69 2jjj n ASP 160 N 4.09 1.18 -4.77 0.00 2.03 -0.23 -1.60 116.55 117.25 2jjj n ASP 160 Ca -0.19 -2.79 -0.39 0.00 0.52 0.00 0.00 54.79 51.95 2jjj n ASP 160 Cb 0.52 -0.65 -0.06 0.00 -0.72 0.00 0.00 41.12 40.21 2jjj n ASP 160 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2jjj s LEU 161 N -0.77 4.55 0.15 -2.67 1.43 -1.26 -1.02 118.68 119.08 2jjj s LEU 161 Ca 0.30 1.77 -0.08 0.00 -1.03 0.00 0.00 54.13 55.09 2jjj s LEU 161 Cb 0.02 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.62 2jjj s LEU 161 CO -0.17 0.13 0.44 -0.83 0.23 0.00 0.00 176.35 176.14 2jjj s GLY 162 N -1.29 2.28 -0.64 -3.19 0.00 -1.24 -4.56 107.32 98.68 2jjj s GLY 162 Ca 0.41 -0.42 -0.28 0.00 0.00 0.00 0.00 44.72 44.44 2jjj s GLY 162 CO 0.27 -0.28 1.21 -0.47 0.00 0.00 0.00 173.10 173.84 2jjj s TYR 163 N -1.63 2.50 -1.52 1.90 5.04 -1.26 -4.00 117.35 118.37 2jjj s TYR 163 Ca 0.41 0.23 -0.11 0.00 -2.44 0.00 0.00 57.07 55.15 2jjj s TYR 163 Cb -0.12 -4.54 0.08 0.00 0.35 0.00 0.00 41.96 37.72 2jjj s TYR 163 CO 0.22 -1.76 0.84 0.72 -1.34 0.00 0.00 175.55 174.23 2jjj n HIS 164 N 8.74 -2.06 -3.53 4.97 8.25 -1.26 -4.94 115.22 125.40 2jjj n HIS 164 Ca 0.06 0.86 -0.15 0.00 -0.26 0.00 0.00 57.72 58.23 2jjj n HIS 164 Cb 0.49 -3.81 -0.05 0.00 1.12 0.00 0.00 29.99 27.74 2jjj n HIS 164 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jjj s ALA 165 N -3.43 -1.54 0.75 -1.41 0.00 -1.26 -5.07 121.76 109.80 2jjj s ALA 165 Ca 0.50 0.87 -0.14 0.00 0.00 0.00 0.00 51.96 53.19 2jjj s ALA 165 Cb -0.26 0.31 0.05 0.00 0.00 0.00 0.00 23.12 23.22 2jjj s ALA 165 CO 0.85 -0.49 1.18 -2.14 0.00 0.00 0.00 175.76 175.16 2jjj s PRO 166 N -2.13 2.04 0.00 0.00 0.02 -1.26 -3.69 135.00 129.97 2jjj s PRO 166 Ca -0.07 1.65 0.00 0.00 0.02 0.00 0.00 61.00 62.60 2jjj s PRO 166 Cb -0.01 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.68 2jjj s PRO 166 CO 0.01 -1.89 0.00 0.41 -0.33 0.00 0.00 177.00 175.20 2jjj n GLY 167 N 0.16 4.12 3.00 0.52 0.00 0.10 -4.35 105.19 108.74 2jjj n GLY 167 Ca 0.13 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.71 2jjj n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jjj s THR 168 N -1.86 -0.01 -0.21 2.61 2.01 -0.19 -1.19 115.64 116.80 2jjj s THR 168 Ca 0.00 0.05 -0.05 0.00 0.31 0.00 0.00 61.69 62.00 2jjj s THR 168 Cb 0.00 -0.23 -0.02 0.00 0.01 0.00 0.00 72.50 72.26 2jjj s THR 168 CO 0.00 0.02 0.00 -0.31 -0.69 0.00 0.00 174.62 173.64 2jjj s TYR 169 N 0.39 3.04 -0.02 4.92 2.02 -0.20 -1.06 117.35 126.43 2jjj s TYR 169 Ca -0.03 -0.49 0.03 0.00 -0.37 0.00 0.00 57.07 56.22 2jjj s TYR 169 Cb -0.04 -2.10 -0.03 0.00 -0.40 0.00 0.00 41.96 39.39 2jjj s TYR 169 CO -0.02 -0.27 -0.10 -0.80 -1.57 0.00 0.00 175.55 172.79 2jjj s ASN 170 N 1.09 4.37 -0.13 2.29 0.02 -0.82 -1.09 114.94 120.66 2jjj s ASN 170 Ca 0.02 -0.17 0.03 0.00 -1.02 0.00 0.00 52.86 51.72 2jjj s ASN 170 Cb -0.14 -0.97 0.01 0.00 0.02 0.00 0.00 41.25 40.16 2jjj s ASN 170 CO 0.02 0.31 -0.22 -0.36 0.02 0.00 0.00 177.10 176.86 2jjj s PHE 171 N -0.88 2.62 0.00 2.20 0.40 0.15 -0.56 117.98 121.91 2jjj s PHE 171 Ca 0.14 -1.27 0.00 0.00 -0.60 0.00 0.00 56.93 55.20 2jjj s PHE 171 Cb -0.11 -1.78 0.00 0.00 0.51 0.00 0.00 43.02 41.64 2jjj s PHE 171 CO 0.04 -0.57 0.00 0.41 0.70 0.00 0.00 175.22 175.80 2jjj n GLY 172 N 3.96 0.69 3.40 4.36 0.00 0.16 -1.60 105.19 116.16 2jjj n GLY 172 Ca -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 2jjj n GLY 172 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jjj s PHE 173 N -2.64 -0.46 -0.26 1.61 -0.71 -1.26 -2.38 117.98 111.88 2jjj s PHE 173 Ca 0.00 0.26 -0.04 0.00 -1.04 0.00 0.00 56.93 56.11 2jjj s PHE 173 Cb 0.00 0.47 0.01 0.00 -1.21 0.00 0.00 43.02 42.30 2jjj s PHE 173 CO 0.00 -0.80 -0.01 0.42 -1.34 0.00 0.00 175.22 173.50 2jjj s ILE 174 N -3.61 3.36 -0.66 -4.49 1.01 -1.26 -4.71 121.20 110.83 2jjj s ILE 174 Ca 0.01 -0.81 -0.27 0.00 0.00 0.00 0.00 60.65 59.58 2jjj s ILE 174 Cb -0.00 -2.69 0.03 0.00 0.01 0.00 0.00 42.46 39.81 2jjj s ILE 174 CO -0.11 0.20 1.22 -0.62 0.00 0.00 0.00 174.94 175.63 2jjj s ASP 175 N 1.42 6.29 0.23 3.58 -1.08 -1.26 -4.89 116.67 120.96 2jjj s ASP 175 Ca 0.02 -0.21 0.20 0.00 -0.52 0.00 0.00 52.55 52.04 2jjj s ASP 175 Cb -0.16 -2.55 0.92 0.00 -1.46 0.00 0.00 42.92 39.66 2jjj s ASP 175 CO -0.02 -1.65 1.61 0.35 0.52 0.00 0.00 175.17 175.98 2jjj n THR 176 N 6.50 0.99 1.44 1.71 -2.24 -1.26 -1.62 114.28 119.79 2jjj n THR 176 Ca 0.05 0.39 0.14 0.00 -2.27 0.00 0.00 64.05 62.36 2jjj n THR 176 Cb 0.49 -1.33 0.50 0.00 -2.10 0.00 0.00 70.33 67.89 2jjj n THR 176 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2jjj n THR 177 N -2.10 0.00 1.31 4.28 -2.24 -1.26 -4.21 114.28 110.06 2jjj n THR 177 Ca 0.01 -0.19 0.13 0.00 -2.27 0.00 0.00 64.05 61.73 2jjj n THR 177 Cb 0.15 0.39 0.39 0.00 -2.10 0.00 0.00 70.33 69.16 2jjj n THR 177 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jjj n ALA 178 N -0.19 2.53 -2.72 6.98 0.00 -0.64 -4.94 120.51 121.53 2jjj n ALA 178 Ca 0.17 -0.53 -0.09 0.00 0.00 0.00 0.00 53.44 52.98 2jjj n ALA 178 Cb 0.34 -1.05 -0.07 0.00 0.00 0.00 0.00 19.45 18.67 2jjj n ALA 178 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2jjj s TYR 179 N -1.98 0.34 0.30 0.00 1.13 -1.26 -4.84 117.35 111.05 2jjj s TYR 179 Ca 0.35 -0.71 0.08 0.00 -1.41 0.00 0.00 57.07 55.37 2jjj s TYR 179 Cb 0.21 -0.04 -0.04 0.00 -1.10 0.00 0.00 41.96 40.99 2jjj s TYR 179 CO 0.32 -0.71 0.17 -0.08 -2.51 0.00 0.00 175.55 172.75 2jjj s THR 180 N -3.95 3.60 0.00 -3.49 -1.32 -0.12 -4.96 115.64 105.40 2jjj s THR 180 Ca 0.15 -1.56 0.00 0.00 -1.21 0.00 0.00 61.69 59.07 2jjj s THR 180 Cb 0.03 -3.12 0.00 0.00 -1.51 0.00 0.00 72.50 67.90 2jjj s THR 180 CO -0.02 -0.26 0.00 0.61 -2.21 0.00 0.00 174.62 172.75 2jjj n GLY 181 N -1.18 1.67 3.46 6.08 0.00 -1.26 -4.11 105.19 109.85 2jjj n GLY 181 Ca -0.04 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 2jjj n GLY 181 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jjj s SER 182 N -4.00 3.40 0.09 1.61 1.04 -1.26 -5.04 113.70 109.54 2jjj s SER 182 Ca 0.00 -1.07 -0.30 0.00 0.48 0.00 0.00 55.95 55.05 2jjj s SER 182 Cb 0.00 -0.27 -0.05 0.00 0.10 0.00 0.00 66.02 65.79 2jjj s SER 182 CO 0.00 -0.07 0.99 -0.63 0.98 0.00 0.00 173.24 174.51 2jjj s ILE 183 N -2.64 4.50 -0.18 -1.02 1.01 -1.26 -4.61 121.20 117.00 2jjj s ILE 183 Ca 0.29 2.00 -0.06 0.00 0.00 0.00 0.00 60.65 62.89 2jjj s ILE 183 Cb -0.02 -4.28 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 2jjj s ILE 183 CO 0.14 0.27 0.02 -0.89 0.00 0.00 0.00 174.94 174.47 2jjj s THR 184 N 0.25 4.27 0.13 2.92 2.01 -0.55 -4.91 115.64 119.76 2jjj s THR 184 Ca 0.49 -0.21 -0.02 0.00 0.31 0.00 0.00 61.69 62.25 2jjj s THR 184 Cb -0.24 -2.92 -0.05 0.00 0.01 0.00 0.00 72.50 69.31 2jjj s THR 184 CO 0.30 0.45 0.33 -0.31 -0.69 0.00 0.00 174.62 174.70 2jjj s TYR 185 N 0.62 3.49 0.03 4.92 2.02 -1.26 -1.15 117.35 126.01 2jjj s TYR 185 Ca 0.01 0.41 -0.03 0.00 -0.37 0.00 0.00 57.07 57.09 2jjj s TYR 185 Cb -0.14 -1.89 -0.02 0.00 -0.40 0.00 0.00 41.96 39.51 2jjj s TYR 185 CO 0.02 0.47 0.04 -0.08 -1.57 0.00 0.00 175.55 174.43 2jjj s THR 186 N -1.65 0.12 0.51 -0.71 -1.32 0.26 -4.85 115.64 107.99 2jjj s THR 186 Ca 0.39 -1.03 -0.21 0.00 -1.21 0.00 0.00 61.69 59.62 2jjj s THR 186 Cb -0.12 -0.64 -0.06 0.00 -1.51 0.00 0.00 72.50 70.17 2jjj s THR 186 CO 0.27 -0.57 1.18 0.00 -2.21 0.00 0.00 174.62 173.29 2jjj s ALA 187 N -2.09 2.84 -0.07 11.08 0.00 -1.26 -1.70 121.76 130.55 2jjj s ALA 187 Ca -0.10 0.96 0.04 0.00 0.00 0.00 0.00 51.96 52.87 2jjj s ALA 187 Cb -0.05 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.65 2jjj s ALA 187 CO -0.03 -0.82 -0.20 0.08 0.00 0.00 0.00 175.76 174.79 2jjj s VAL 188 N -1.58 2.54 -0.19 0.00 1.01 -1.24 -4.43 120.40 116.52 2jjj s VAL 188 Ca 0.68 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 61.69 2jjj s VAL 188 Cb -0.29 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2jjj s VAL 188 CO 0.34 0.57 0.10 -0.55 0.00 0.00 0.00 175.10 175.55 2jjj s SER 189 N -0.22 5.93 -0.09 3.32 0.15 0.19 -4.83 113.70 118.14 2jjj s SER 189 Ca -0.01 0.17 0.17 0.00 0.70 0.00 0.00 55.95 56.98 2jjj s SER 189 Cb -0.13 -2.02 0.60 0.00 -1.71 0.00 0.00 66.02 62.76 2jjj s SER 189 CO 0.03 0.19 1.52 0.35 1.20 0.00 0.00 173.24 176.53 2jjj n THR 190 N 3.44 1.70 0.28 6.45 -2.24 -1.26 -3.39 114.28 119.25 2jjj n THR 190 Ca -0.16 -1.26 0.14 0.00 -2.27 0.00 0.00 64.05 60.50 2jjj n THR 190 Cb 0.52 0.16 0.82 0.00 -2.10 0.00 0.00 70.33 69.73 2jjj n THR 190 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2jjj h LYS 191 N 3.31 0.00 -0.37 -0.78 3.64 -1.94 -0.53 116.57 119.90 2jjj h LYS 191 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jjj h LYS 191 Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 2jjj h LYS 191 CO 0.17 0.07 0.00 1.04 -2.27 0.00 0.00 179.45 178.46 2jjj n GLN 192 N -3.66 2.61 -0.76 1.90 3.00 -1.26 -4.98 117.38 114.21 2jjj n GLN 192 Ca -0.02 -2.06 0.00 0.00 -0.01 0.00 0.00 57.00 54.91 2jjj n GLN 192 Cb 0.18 -1.32 0.00 0.00 0.00 0.00 0.00 30.24 29.10 2jjj n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jjj n GLY 193 N 0.73 0.88 3.96 1.08 0.00 -0.21 -4.98 105.19 106.66 2jjj n GLY 193 Ca 0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 2jjj n GLY 193 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jjj s PHE 194 N -3.49 2.85 -1.36 1.61 0.08 -1.26 -1.66 117.98 114.74 2jjj s PHE 194 Ca 0.00 -0.38 -0.16 0.00 0.12 0.00 0.00 56.93 56.51 2jjj s PHE 194 Cb 0.00 -2.21 0.07 0.00 -0.57 0.00 0.00 43.02 40.30 2jjj s PHE 194 CO 0.00 -0.23 1.93 0.91 -0.10 0.00 0.00 175.22 177.74 2jjj n TRP 195 N -1.70 4.15 -3.65 0.36 7.02 -1.26 -4.39 117.44 117.96 2jjj n TRP 195 Ca 0.05 -2.92 -0.36 0.00 -1.02 0.00 0.00 57.50 53.24 2jjj n TRP 195 Cb 0.60 -2.56 -0.07 0.00 -2.42 0.00 0.00 31.31 26.86 2jjj n TRP 195 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2jjj s GLU 196 N 3.55 4.00 0.28 -0.99 2.12 -1.22 -1.23 118.70 125.20 2jjj s GLU 196 Ca 0.50 0.02 -0.06 0.00 0.36 0.00 0.00 54.97 55.79 2jjj s GLU 196 Cb 0.08 -3.34 -0.01 0.00 0.26 0.00 0.00 34.13 31.12 2jjj s GLU 196 CO 0.00 0.44 0.41 1.67 -0.54 0.00 0.00 175.26 177.25 2jjj s TRP 197 N -0.13 0.80 -0.24 5.30 1.48 -0.10 -0.64 118.94 125.41 2jjj s TRP 197 Ca 0.15 -1.08 0.01 0.00 -1.06 0.00 0.00 56.10 54.13 2jjj s TRP 197 Cb -0.13 -0.06 0.06 0.00 -1.16 0.00 0.00 33.47 32.18 2jjj s TRP 197 CO 0.04 -0.99 -0.08 0.99 -4.06 0.00 0.00 176.95 172.85 2jjj s THR 198 N -3.65 1.76 0.44 0.66 2.01 -1.26 -0.98 115.64 114.63 2jjj s THR 198 Ca 0.29 -1.31 -0.24 0.00 0.31 0.00 0.00 61.69 60.74 2jjj s THR 198 Cb 0.01 -1.94 -0.08 0.00 0.01 0.00 0.00 72.50 70.50 2jjj s THR 198 CO 0.14 -0.02 1.18 -0.55 -0.69 0.00 0.00 174.62 174.68 2jjj s SER 199 N 1.30 6.26 0.00 3.53 0.15 0.22 -4.77 113.70 120.39 2jjj s SER 199 Ca -0.06 2.36 0.29 0.00 0.70 0.00 0.00 55.95 59.24 2jjj s SER 199 Cb -0.19 -2.61 1.24 0.00 -1.71 0.00 0.00 66.02 62.76 2jjj s SER 199 CO -0.06 -0.86 1.90 0.35 1.20 0.00 0.00 173.24 175.76 2jjj n THR 200 N -0.29 0.00 -1.81 6.45 -2.24 -1.04 -1.27 114.28 114.07 2jjj n THR 200 Ca 0.06 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2jjj n THR 200 Cb 0.47 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 2jjj n THR 200 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jjj n GLY 201 N 1.38 0.15 3.47 3.38 0.00 -1.23 -3.53 105.19 108.80 2jjj n GLY 201 Ca 0.11 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.47 2jjj n GLY 201 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jjj s TYR 202 N -2.77 -0.10 0.03 1.61 1.13 -0.84 -0.83 117.35 115.58 2jjj s TYR 202 Ca 0.00 -0.23 0.00 0.00 -1.41 0.00 0.00 57.07 55.43 2jjj s TYR 202 Cb 0.00 0.34 -0.02 0.00 -1.10 0.00 0.00 41.96 41.18 2jjj s TYR 202 CO 0.00 -0.86 -0.04 0.00 -2.51 0.00 0.00 175.55 172.14 2jjj s ALA 203 N -3.87 0.23 -0.23 9.51 0.00 -0.16 -0.39 121.76 126.86 2jjj s ALA 203 Ca 0.09 -0.65 -0.07 0.00 0.00 0.00 0.00 51.96 51.32 2jjj s ALA 203 Cb -0.00 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.22 2jjj s ALA 203 CO -0.04 -0.14 0.07 0.08 0.00 0.00 0.00 175.76 175.73 2jjj s VAL 204 N -1.53 4.42 0.00 0.00 1.01 -1.26 -0.98 120.40 122.06 2jjj s VAL 204 Ca -0.14 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2jjj s VAL 204 Cb -0.09 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.24 2jjj s VAL 204 CO -0.01 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2jjj n GLY 205 N 4.59 3.18 1.34 4.51 0.00 0.38 -1.36 105.19 117.83 2jjj n GLY 205 Ca -0.16 -0.16 0.05 0.00 0.00 0.00 0.00 46.02 45.75 2jjj n GLY 205 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jjj n SER 206 N 3.06 3.89 -2.21 1.61 3.41 -1.26 -4.84 113.62 117.27 2jjj n SER 206 Ca 0.00 -2.50 -0.02 0.00 -0.26 0.00 0.00 58.87 56.08 2jjj n SER 206 Cb 0.00 -0.57 0.01 0.00 -0.26 0.00 0.00 64.21 63.39 2jjj n SER 206 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jjj n GLY 207 N 0.59 0.09 3.79 5.00 0.00 -0.46 -5.06 105.19 109.14 2jjj n GLY 207 Ca 0.18 -1.86 -0.36 0.00 0.00 0.00 0.00 46.02 43.98 2jjj n GLY 207 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jjj s THR 208 N -0.48 4.28 -0.11 2.61 -4.23 -1.26 -4.67 115.64 111.78 2jjj s THR 208 Ca 0.06 1.71 -0.30 0.00 -1.18 0.00 0.00 61.69 61.99 2jjj s THR 208 Cb -0.00 -3.95 -0.02 0.00 1.34 0.00 0.00 72.50 69.87 2jjj s THR 208 CO 0.04 0.10 1.22 0.12 -0.54 0.00 0.00 174.62 175.56 2jjj s PHE 209 N -1.66 3.05 -0.27 3.99 5.36 -1.26 -4.45 117.98 122.73 2jjj s PHE 209 Ca 0.50 1.14 -0.12 0.00 -0.96 0.00 0.00 56.93 57.49 2jjj s PHE 209 Cb -0.17 -3.45 -0.05 0.00 -0.34 0.00 0.00 43.02 39.01 2jjj s PHE 209 CO 0.22 -1.44 0.26 0.15 -1.46 0.00 0.00 175.22 172.95 2jjj s LYS 210 N 2.81 3.99 -1.54 10.12 -0.14 0.48 -4.93 119.74 130.53 2jjj s LYS 210 Ca 0.55 -0.18 -0.09 0.00 -1.36 0.00 0.00 55.97 54.89 2jjj s LYS 210 Cb -0.23 -3.65 -0.02 0.00 -1.68 0.00 0.00 37.83 32.25 2jjj s LYS 210 CO 0.18 -0.20 2.75 -1.13 -0.76 0.00 0.00 175.35 176.20 2jjj n SER 211 N 5.10 8.20 -4.49 2.83 3.41 -1.26 -1.98 113.62 125.43 2jjj n SER 211 Ca -0.12 -2.74 -0.37 0.00 -0.26 0.00 0.00 58.87 55.38 2jjj n SER 211 Cb 0.52 -1.52 -0.12 0.00 -0.26 0.00 0.00 64.21 62.83 2jjj n SER 211 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2jjj s THR 212 N 1.39 4.59 0.30 6.66 -4.23 -1.23 -4.84 115.64 118.28 2jjj s THR 212 Ca 0.64 -0.08 -0.30 0.00 -1.18 0.00 0.00 61.69 60.77 2jjj s THR 212 Cb 0.18 -3.16 -0.11 0.00 1.34 0.00 0.00 72.50 70.74 2jjj s THR 212 CO -0.07 0.31 1.54 -0.44 -0.54 0.00 0.00 174.62 175.42 2jjj s SER 213 N 1.66 6.43 -0.27 3.99 0.01 -1.26 -3.54 113.70 120.71 2jjj s SER 213 Ca 0.07 2.91 0.00 0.00 1.31 0.00 0.00 55.95 60.23 2jjj s SER 213 Cb -0.15 -2.64 0.08 0.00 0.21 0.00 0.00 66.02 63.52 2jjj s SER 213 CO 0.06 -0.86 0.02 -0.63 0.41 0.00 0.00 173.24 172.24 2jjj s ILE 214 N -0.22 1.26 -0.08 1.44 1.01 -0.40 -4.97 121.20 119.24 2jjj s ILE 214 Ca 0.60 -1.32 -0.30 0.00 0.00 0.00 0.00 60.65 59.64 2jjj s ILE 214 Cb -0.46 -1.75 -0.02 0.00 0.01 0.00 0.00 42.46 40.24 2jjj s ILE 214 CO 0.50 -0.37 1.04 -0.62 0.00 0.00 0.00 174.94 175.49 2jjj s ASP 215 N 1.48 7.23 0.33 3.58 -1.08 -1.26 -0.61 116.67 126.33 2jjj s ASP 215 Ca 0.02 1.60 -0.12 0.00 -0.52 0.00 0.00 52.55 53.53 2jjj s ASP 215 Cb -0.18 -2.56 0.05 0.00 -1.46 0.00 0.00 42.92 38.77 2jjj s ASP 215 CO -0.13 -0.45 0.65 0.61 0.52 0.00 0.00 175.17 176.37 2jjj n GLY 216 N 3.12 1.21 3.40 2.66 0.00 -0.15 -4.07 105.19 111.36 2jjj n GLY 216 Ca 0.09 -1.23 -0.30 0.00 0.00 0.00 0.00 46.02 44.57 2jjj n GLY 216 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jjj s ILE 217 N -2.28 2.42 -0.47 -0.61 -4.36 -0.42 -0.93 121.20 114.56 2jjj s ILE 217 Ca 0.14 -1.35 -0.25 0.00 -0.26 0.00 0.00 60.65 58.93 2jjj s ILE 217 Cb -0.04 -1.99 0.03 0.00 1.25 0.00 0.00 42.46 41.71 2jjj s ILE 217 CO 0.10 0.32 0.90 0.00 0.24 0.00 0.00 174.94 176.51 2jjj s ALA 218 N -0.89 3.24 -0.34 2.27 0.00 -0.37 -0.32 121.76 125.36 2jjj s ALA 218 Ca 0.13 -0.86 -0.00 0.00 0.00 0.00 0.00 51.96 51.23 2jjj s ALA 218 Cb -0.10 -3.62 0.11 0.00 0.00 0.00 0.00 23.12 19.51 2jjj s ALA 218 CO 0.04 -2.07 0.13 0.34 0.00 0.00 0.00 175.76 174.20 2jjj s ASP 219 N 2.29 3.90 0.60 0.00 -1.08 -0.49 -4.55 116.67 117.35 2jjj s ASP 219 Ca 0.35 -1.86 0.39 0.00 -0.52 0.00 0.00 52.55 50.91 2jjj s ASP 219 Cb -0.11 -0.87 1.90 0.00 -1.46 0.00 0.00 42.92 42.38 2jjj s ASP 219 CO 0.25 -0.38 2.17 0.71 0.52 0.00 0.00 175.17 178.44 2jjj h THR 220 N 6.17 0.00 -0.33 1.71 1.35 -1.84 -2.72 112.91 117.24 2jjj h THR 220 Ca -0.10 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2jjj h THR 220 Cb 0.99 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 2jjj h THR 220 CO 0.46 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.34 2jjj n GLY 221 N -0.55 0.65 3.36 5.82 0.00 -1.26 -4.70 105.19 108.51 2jjj n GLY 221 Ca -0.01 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 2jjj n GLY 221 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jjj s THR 222 N -1.56 2.82 0.01 2.61 2.01 -1.03 -5.05 115.64 115.46 2jjj s THR 222 Ca 0.26 -0.76 -0.23 0.00 0.31 0.00 0.00 61.69 61.26 2jjj s THR 222 Cb 0.14 -2.14 -0.17 0.00 0.01 0.00 0.00 72.50 70.33 2jjj s THR 222 CO 0.19 0.55 1.33 0.74 -0.69 0.00 0.00 174.62 176.74 2jjj h THR 223 N 5.17 1.35 -1.25 -0.82 2.02 -1.87 0.18 112.91 117.69 2jjj h THR 223 Ca -0.30 -1.12 -0.45 0.00 0.77 0.00 0.00 66.41 65.31 2jjj h THR 223 Cb 1.20 1.96 0.01 0.00 -1.74 0.00 0.00 68.15 69.58 2jjj h THR 223 CO 0.52 0.31 -0.23 -0.76 0.37 0.00 0.00 175.52 175.73 2jjj s LEU 224 N -9.26 3.46 -0.40 2.58 1.43 -1.26 -1.72 118.68 113.51 2jjj s LEU 224 Ca -0.15 -0.59 -0.15 0.00 -1.03 0.00 0.00 54.13 52.21 2jjj s LEU 224 Cb 0.03 -2.28 0.01 0.00 0.03 0.00 0.00 46.19 43.98 2jjj s LEU 224 CO 0.70 -0.91 0.31 -0.22 0.23 0.00 0.00 176.35 176.46 2jjj s LEU 225 N -4.41 4.94 -0.26 1.79 2.96 -0.64 -2.57 118.68 120.49 2jjj s LEU 225 Ca 0.55 -0.75 -0.06 0.00 -0.22 0.00 0.00 54.13 53.65 2jjj s LEU 225 Cb -0.08 -2.20 -0.01 0.00 0.50 0.00 0.00 46.19 44.40 2jjj s LEU 225 CO 0.34 -0.43 0.04 -0.31 -1.32 0.00 0.00 176.35 174.67 2jjj s TYR 226 N 1.77 3.08 0.28 5.38 2.02 -0.28 -1.20 117.35 128.41 2jjj s TYR 226 Ca 0.07 -0.78 0.02 0.00 -0.37 0.00 0.00 57.07 56.01 2jjj s TYR 226 Cb -0.18 -2.21 -0.06 0.00 -0.40 0.00 0.00 41.96 39.11 2jjj s TYR 226 CO 0.11 -0.49 0.08 -0.51 -1.57 0.00 0.00 175.55 173.16 2jjj s LEU 227 N 1.53 1.86 0.63 -1.29 1.43 -0.56 -0.90 118.68 121.37 2jjj s LEU 227 Ca 0.05 -1.37 -0.19 0.00 -1.03 0.00 0.00 54.13 51.59 2jjj s LEU 227 Cb -0.16 -0.14 -0.02 0.00 0.03 0.00 0.00 46.19 45.90 2jjj s LEU 227 CO 0.01 -0.68 1.22 -2.65 0.23 0.00 0.00 176.35 174.49 2jjj n PRO 228 N -0.54 1.12 -0.33 1.29 -0.02 -1.26 -0.44 135.00 134.82 2jjj n PRO 228 Ca -0.01 0.44 0.09 0.00 -2.02 0.00 0.00 63.50 62.00 2jjj n PRO 228 Cb 0.66 -2.45 0.26 0.00 -0.02 0.00 0.00 33.50 31.96 2jjj n PRO 228 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jjj h ALA 229 N 0.62 1.45 -0.25 3.55 0.00 -1.94 -0.83 119.26 121.86 2jjj h ALA 229 Ca -0.50 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.37 2jjj h ALA 229 Cb 1.34 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2jjj h ALA 229 CO 0.53 -0.02 -0.29 0.00 0.00 0.00 0.00 179.25 179.46 2jjj h THR 230 N 0.73 1.28 -0.12 0.00 1.03 -1.99 -0.24 112.91 113.60 2jjj h THR 230 Ca 0.51 -1.36 -0.04 0.00 -0.01 0.00 0.00 66.41 65.51 2jjj h THR 230 Cb 0.71 1.41 -0.00 0.00 -1.07 0.00 0.00 68.15 69.20 2jjj h THR 230 CO -0.35 0.43 -0.08 0.58 -0.01 0.00 0.00 175.52 176.09 2jjj h VAL 231 N 0.44 1.33 -0.66 0.00 2.07 -1.56 -2.01 116.25 115.86 2jjj h VAL 231 Ca 0.06 -1.16 -0.04 0.00 0.82 0.00 0.00 66.70 66.38 2jjj h VAL 231 Cb 0.73 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.32 2jjj h VAL 231 CO 0.06 0.33 0.25 0.58 0.02 0.00 0.00 177.57 178.81 2jjj h VAL 232 N -0.11 1.24 -0.87 2.57 2.07 -1.09 -1.67 116.25 118.39 2jjj h VAL 232 Ca 0.02 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 66.79 2jjj h VAL 232 Cb 0.56 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2jjj h VAL 232 CO 0.02 0.30 0.58 -1.28 0.02 0.00 0.00 177.57 177.21 2jjj h SER 233 N 0.94 0.99 -0.67 0.57 0.87 -1.04 -1.52 113.55 113.68 2jjj h SER 233 Ca 0.22 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.73 2jjj h SER 233 Cb 0.22 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.91 2jjj h SER 233 CO -0.02 0.71 0.34 0.00 -0.53 0.00 0.00 176.83 177.33 2jjj h ALA 234 N 1.32 1.28 0.53 6.23 0.00 -0.79 -0.50 119.26 127.34 2jjj h ALA 234 Ca 0.32 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2jjj h ALA 234 Cb -0.12 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.40 2jjj h ALA 234 CO -0.08 0.56 -0.25 -0.92 0.00 0.00 0.00 179.25 178.56 2jjj h TYR 235 N 0.98 -0.66 0.00 0.00 3.20 -0.82 -3.23 116.97 116.45 2jjj h TYR 235 Ca 0.24 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.10 2jjj h TYR 235 Cb 0.10 0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.58 2jjj h TYR 235 CO 0.01 -0.34 0.00 -1.49 -1.64 0.00 0.00 178.16 174.70 2jjj h TRP 236 N -0.91 0.00 -0.06 -3.82 4.06 -1.15 -1.26 115.95 112.81 2jjj h TRP 236 Ca -0.07 0.00 0.02 0.00 2.06 0.00 0.00 58.89 60.89 2jjj h TRP 236 Cb 0.61 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.77 2jjj h TRP 236 CO -0.00 0.00 0.09 0.00 -3.56 0.00 0.00 178.44 174.97 2jjj h ALA 237 N 2.17 1.48 -0.47 1.49 0.00 -1.10 -1.60 119.26 121.23 2jjj h ALA 237 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jjj h ALA 237 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2jjj h ALA 237 CO 0.00 -0.12 0.00 1.04 0.00 0.00 0.00 179.25 180.17 2jjj n GLN 238 N -3.59 2.36 -3.92 0.00 1.13 -0.47 -4.72 117.38 108.16 2jjj n GLN 238 Ca -0.01 -1.80 -0.30 0.00 -1.94 0.00 0.00 57.00 52.94 2jjj n GLN 238 Cb 0.18 -1.48 -0.15 0.00 0.11 0.00 0.00 30.24 28.90 2jjj n GLN 238 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2jjj s VAL 239 N -1.48 1.54 0.31 5.09 1.01 -0.60 -4.81 120.40 121.46 2jjj s VAL 239 Ca 0.33 -1.38 0.20 0.00 0.00 0.00 0.00 61.98 61.13 2jjj s VAL 239 Cb 0.19 -1.89 0.18 0.00 0.00 0.00 0.00 36.38 34.85 2jjj s VAL 239 CO 0.20 -0.23 1.88 0.77 0.00 0.00 0.00 175.10 177.72 2jjj h SER 240 N 7.93 0.00 -0.01 3.32 4.64 -1.84 -1.76 113.55 125.82 2jjj h SER 240 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2jjj h SER 240 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2jjj h SER 240 CO 0.43 0.28 -0.01 0.61 -0.87 0.00 0.00 176.83 177.27 2jjj n GLY 241 N -0.29 0.20 3.77 -0.77 0.00 -1.26 -4.97 105.19 101.87 2jjj n GLY 241 Ca -0.01 -0.50 -0.38 0.00 0.00 0.00 0.00 46.02 45.13 2jjj n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jjj s ALA 242 N -2.02 3.29 0.10 4.61 0.00 -0.66 -4.41 121.76 122.67 2jjj s ALA 242 Ca 0.35 0.52 -0.16 0.00 0.00 0.00 0.00 51.96 52.67 2jjj s ALA 242 Cb 0.21 -3.15 0.03 0.00 0.00 0.00 0.00 23.12 20.21 2jjj s ALA 242 CO 0.33 0.21 0.39 -1.59 0.00 0.00 0.00 175.76 175.10 2jjj s LYS 243 N -1.67 1.02 0.09 0.00 -2.85 -0.44 -4.98 119.74 110.91 2jjj s LYS 243 Ca 0.45 -0.63 -0.28 0.00 -1.00 0.00 0.00 55.97 54.52 2jjj s LYS 243 Cb -0.21 0.45 -0.06 0.00 -2.06 0.00 0.00 37.83 35.94 2jjj s LYS 243 CO 0.27 -0.38 0.86 0.45 0.10 0.00 0.00 175.35 176.65 2jjj s SER 244 N -2.59 7.38 -0.28 0.03 0.15 -1.26 -1.19 113.70 115.93 2jjj s SER 244 Ca 0.01 1.64 -0.04 0.00 0.70 0.00 0.00 55.95 58.27 2jjj s SER 244 Cb 0.01 -2.53 0.03 0.00 -1.71 0.00 0.00 66.02 61.82 2jjj s SER 244 CO -0.09 0.00 0.01 -0.55 1.20 0.00 0.00 173.24 173.81 2jjj s SER 245 N -0.17 4.80 0.14 5.45 0.15 -0.26 -4.94 113.70 118.87 2jjj s SER 245 Ca 0.42 -0.95 -0.17 0.00 0.70 0.00 0.00 55.95 55.95 2jjj s SER 245 Cb -0.22 -1.76 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 2jjj s SER 245 CO 0.27 -0.20 1.78 -1.28 1.20 0.00 0.00 173.24 175.01 2jjj h SER 246 N 8.10 0.26 0.05 5.45 0.87 -1.96 -1.05 113.55 125.27 2jjj h SER 246 Ca -0.28 0.01 -0.20 0.00 -1.23 0.00 0.00 61.79 60.09 2jjj h SER 246 Cb 1.10 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 2jjj h SER 246 CO 0.58 0.19 -0.73 0.77 -0.53 0.00 0.00 176.83 177.11 2jjj h SER 247 N 0.35 0.70 0.94 6.23 4.64 -1.95 -3.21 113.55 121.25 2jjj h SER 247 Ca 0.13 -0.45 -0.19 0.00 -0.47 0.00 0.00 61.79 60.81 2jjj h SER 247 Cb 0.03 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 61.88 2jjj h SER 247 CO -0.08 1.21 -0.90 0.58 -0.87 0.00 0.00 176.83 176.77 2jjj h VAL 248 N 0.41 1.63 0.00 0.95 2.07 -1.98 -3.48 116.25 115.86 2jjj h VAL 248 Ca -0.03 -3.11 0.00 0.00 0.82 0.00 0.00 66.70 64.37 2jjj h VAL 248 Cb 1.32 2.69 0.00 0.00 -1.52 0.00 0.00 31.29 33.78 2jjj h VAL 248 CO 0.14 0.88 0.00 0.61 0.02 0.00 0.00 177.57 179.22 2jjj n GLY 249 N 1.12 1.68 0.00 2.17 0.00 -0.43 -5.07 105.19 104.66 2jjj n GLY 249 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2jjj n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jjj n GLY 250 N -1.23 -1.59 3.73 -0.02 0.00 -1.01 -5.01 105.19 100.05 2jjj n GLY 250 Ca 0.00 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 2jjj n GLY 250 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jjj s TYR 251 N -2.81 3.16 0.14 1.61 2.02 -1.26 -1.10 117.35 119.11 2jjj s TYR 251 Ca 0.00 1.01 0.08 0.00 -0.37 0.00 0.00 57.07 57.80 2jjj s TYR 251 Cb 0.00 -3.73 -0.04 0.00 -0.40 0.00 0.00 41.96 37.79 2jjj s TYR 251 CO 0.00 -2.44 -0.19 0.14 -1.57 0.00 0.00 175.55 171.50 2jjj s VAL 252 N 0.49 1.73 0.20 0.71 -7.23 -0.33 -1.20 120.40 114.76 2jjj s VAL 252 Ca 0.61 -1.78 -0.16 0.00 -1.81 0.00 0.00 61.98 58.84 2jjj s VAL 252 Cb -0.39 -1.72 0.02 0.00 0.56 0.00 0.00 36.38 34.85 2jjj s VAL 252 CO 0.36 -0.24 0.50 0.72 -0.31 0.00 0.00 175.10 176.13 2jjj s PHE 253 N -1.77 -0.02 0.10 2.82 -0.71 -0.36 -1.33 117.98 116.71 2jjj s PHE 253 Ca 0.12 -0.33 -0.31 0.00 -1.04 0.00 0.00 56.93 55.37 2jjj s PHE 253 Cb -0.07 0.34 -0.08 0.00 -1.21 0.00 0.00 43.02 42.00 2jjj s PHE 253 CO 0.05 -0.92 1.49 -2.14 -1.34 0.00 0.00 175.22 172.37 2jjj s PRO 254 N -3.90 4.26 0.59 1.99 0.02 -1.26 -0.46 135.00 136.24 2jjj s PRO 254 Ca 0.11 2.18 0.28 0.00 0.02 0.00 0.00 61.00 63.60 2jjj s PRO 254 Cb -0.01 -3.35 1.58 0.00 0.02 0.00 0.00 34.50 32.74 2jjj s PRO 254 CO -0.01 -0.56 2.02 0.00 -0.33 0.00 0.00 177.00 178.12 2jjj n SER 256 N -3.79 0.00 -4.76 0.00 7.64 -1.26 -4.87 113.62 106.58 2jjj n SER 256 Ca 0.04 0.28 -0.39 0.00 1.01 0.00 0.00 58.87 59.82 2jjj n SER 256 Cb 0.46 -0.41 0.03 0.00 -1.01 0.00 0.00 64.21 63.27 2jjj n SER 256 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jjj s ALA 257 N -2.83 2.95 -0.54 -0.43 0.00 -0.32 -4.97 121.76 115.62 2jjj s ALA 257 Ca 0.15 1.31 -0.16 0.00 0.00 0.00 0.00 51.96 53.25 2jjj s ALA 257 Cb 0.15 -3.55 0.12 0.00 0.00 0.00 0.00 23.12 19.84 2jjj s ALA 257 CO 0.37 -1.23 0.52 0.99 0.00 0.00 0.00 175.76 176.42 2jjj s THR 258 N -1.31 5.16 0.42 0.00 2.01 -1.26 -5.05 115.64 115.60 2jjj s THR 258 Ca 0.68 -1.40 -0.23 0.00 0.31 0.00 0.00 61.69 61.04 2jjj s THR 258 Cb -0.40 -4.35 -0.09 0.00 0.01 0.00 0.00 72.50 67.68 2jjj s THR 258 CO 0.48 -0.89 1.05 -0.76 -0.69 0.00 0.00 174.62 173.82 2jjj s LEU 259 N 1.75 4.08 0.65 4.42 1.43 -1.26 -5.02 118.68 124.74 2jjj s LEU 259 Ca 0.04 2.03 -0.14 0.00 -1.03 0.00 0.00 54.13 55.04 2jjj s LEU 259 Cb -0.29 -4.25 -0.01 0.00 0.03 0.00 0.00 46.19 41.67 2jjj s LEU 259 CO 0.04 -0.57 1.08 -2.16 0.23 0.00 0.00 176.35 174.97 2jjj s PRO 260 N -2.64 2.95 1.02 1.29 0.04 -1.26 -4.19 135.00 132.21 2jjj s PRO 260 Ca 0.60 1.21 -0.12 0.00 0.04 0.00 0.00 61.00 62.73 2jjj s PRO 260 Cb -0.21 -1.98 0.20 0.00 0.04 0.00 0.00 34.50 32.55 2jjj s PRO 260 CO 0.27 -1.11 1.08 -1.54 0.04 0.00 0.00 177.00 175.74 2jjj s SER 261 N -2.97 2.33 -0.07 6.66 1.04 -1.26 -3.89 113.70 115.54 2jjj s SER 261 Ca 0.63 1.36 0.00 0.00 0.48 0.00 0.00 55.95 58.43 2jjj s SER 261 Cb -0.17 -2.06 0.02 0.00 0.10 0.00 0.00 66.02 63.92 2jjj s SER 261 CO 0.44 -3.34 -0.05 0.12 0.98 0.00 0.00 173.24 171.40 2jjj s PHE 262 N -2.82 0.95 -0.12 5.02 5.36 -0.60 -0.47 117.98 125.31 2jjj s PHE 262 Ca 0.66 -0.34 -0.01 0.00 -0.96 0.00 0.00 56.93 56.28 2jjj s PHE 262 Cb -0.20 -0.86 -0.02 0.00 -0.34 0.00 0.00 43.02 41.59 2jjj s PHE 262 CO 0.59 -0.30 -0.07 0.99 -1.46 0.00 0.00 175.22 174.97 2jjj s THR 263 N 1.32 3.59 0.13 0.12 2.01 -0.15 -0.24 115.64 122.42 2jjj s THR 263 Ca -0.04 -0.48 0.10 0.00 0.31 0.00 0.00 61.69 61.58 2jjj s THR 263 Cb -0.14 -2.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 2jjj s THR 263 CO -0.02 0.53 -0.22 0.72 -0.69 0.00 0.00 174.62 174.94 2jjj s PHE 264 N 0.03 2.42 0.05 4.92 -0.71 -0.41 -0.99 117.98 123.30 2jjj s PHE 264 Ca -0.01 -0.32 -0.17 0.00 -1.04 0.00 0.00 56.93 55.38 2jjj s PHE 264 Cb -0.14 -1.28 -0.06 0.00 -1.21 0.00 0.00 43.02 40.33 2jjj s PHE 264 CO 0.03 0.39 0.51 0.20 -1.34 0.00 0.00 175.22 175.01 2jjj s GLY 265 N -2.20 2.58 -0.35 1.99 0.00 -0.01 -1.08 107.32 108.26 2jjj s GLY 265 Ca 0.17 -0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.83 2jjj s GLY 265 CO 0.09 0.32 0.12 0.14 0.00 0.00 0.00 173.10 173.76 2jjj s VAL 266 N -1.13 1.44 0.00 1.40 1.01 -0.27 -2.50 120.40 120.35 2jjj s VAL 266 Ca 0.28 -1.97 0.00 0.00 0.00 0.00 0.00 61.98 60.29 2jjj s VAL 266 Cb -0.18 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.14 2jjj s VAL 266 CO 0.17 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 175.18 2jjj n GLY 267 N 4.36 3.19 0.00 4.51 0.00 -1.26 -0.74 105.19 115.25 2jjj n GLY 267 Ca 0.02 -0.19 0.14 0.00 0.00 0.00 0.00 46.02 45.99 2jjj n GLY 267 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jjj n SER 268 N 2.93 0.00 -4.91 1.61 7.64 -1.26 -4.73 113.62 114.90 2jjj n SER 268 Ca 0.00 0.40 -0.28 0.00 1.01 0.00 0.00 58.87 60.00 2jjj n SER 268 Cb 0.00 -0.47 0.04 0.00 -1.01 0.00 0.00 64.21 62.77 2jjj n SER 268 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jjj s ALA 269 N -2.93 3.16 -0.03 -0.43 0.00 0.09 -5.09 121.76 116.51 2jjj s ALA 269 Ca 0.16 -0.57 0.01 0.00 0.00 0.00 0.00 51.96 51.56 2jjj s ALA 269 Cb 0.19 -2.75 0.02 0.00 0.00 0.00 0.00 23.12 20.58 2jjj s ALA 269 CO 0.52 -0.92 -0.03 1.03 0.00 0.00 0.00 175.76 176.36 2jjj s ARG 270 N -5.12 0.57 -0.19 0.00 1.81 -1.26 -1.11 118.95 113.65 2jjj s ARG 270 Ca 0.55 -0.03 -0.04 0.00 -1.72 0.00 0.00 55.73 54.49 2jjj s ARG 270 Cb -0.11 -0.65 -0.02 0.00 -0.45 0.00 0.00 34.95 33.72 2jjj s ARG 270 CO 0.47 -0.09 -0.03 0.42 -0.68 0.00 0.00 175.30 175.39 2jjj s ILE 271 N 0.88 3.66 -0.27 1.52 -1.09 -0.24 -4.84 121.20 120.81 2jjj s ILE 271 Ca -0.10 -0.42 -0.09 0.00 -2.23 0.00 0.00 60.65 57.81 2jjj s ILE 271 Cb -0.13 -2.64 -0.02 0.00 -1.58 0.00 0.00 42.46 38.09 2jjj s ILE 271 CO -0.01 0.45 0.12 -0.69 -1.23 0.00 0.00 174.94 173.58 2jjj s VAL 272 N 0.96 4.56 -0.37 2.92 1.01 -1.26 -1.28 120.40 126.94 2jjj s VAL 272 Ca 0.00 -0.21 -0.23 0.00 0.00 0.00 0.00 61.98 61.55 2jjj s VAL 272 Cb -0.15 -3.21 0.01 0.00 0.00 0.00 0.00 36.38 33.04 2jjj s VAL 272 CO 0.01 0.23 0.77 -0.63 0.00 0.00 0.00 175.10 175.48 2jjj s ILE 273 N 1.64 4.74 0.60 2.22 1.01 0.66 -4.92 121.20 127.15 2jjj s ILE 273 Ca 0.06 0.82 -0.19 0.00 0.00 0.00 0.00 60.65 61.33 2jjj s ILE 273 Cb -0.16 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.07 2jjj s ILE 273 CO 0.06 -0.44 1.22 -2.65 0.00 0.00 0.00 174.94 173.13 2jjj n PRO 274 N 6.40 1.25 -0.31 2.79 -0.02 -1.26 -1.55 135.00 142.29 2jjj n PRO 274 Ca 0.02 0.47 0.08 0.00 -2.02 0.00 0.00 63.50 62.06 2jjj n PRO 274 Cb 0.48 -2.44 0.25 0.00 -0.02 0.00 0.00 33.50 31.77 2jjj n PRO 274 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2jjj h GLY 275 N 0.83 1.48 2.00 -1.23 0.00 -1.73 -0.89 103.07 103.53 2jjj h GLY 275 Ca -0.50 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.55 2jjj h GLY 275 CO 0.54 -0.04 0.00 2.09 0.00 0.00 0.00 176.54 179.13 2jjj n ASP 276 N -4.84 0.43 0.23 0.19 5.75 -1.26 -1.00 116.55 116.05 2jjj n ASP 276 Ca 0.19 0.59 0.09 0.00 -0.01 0.00 0.00 54.79 55.65 2jjj n ASP 276 Cb 0.46 -0.69 0.56 0.00 -1.03 0.00 0.00 41.12 40.42 2jjj n ASP 276 CO 0.00 0.00 0.00 1.88 -0.11 0.00 0.00 177.20 178.97 2jjj h TYR 277 N 0.00 0.00 -0.00 2.11 -1.99 -1.51 -2.67 116.97 112.91 2jjj h TYR 277 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2jjj h TYR 277 Cb 0.38 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.11 2jjj h TYR 277 CO 0.00 0.22 -0.25 -0.89 -0.00 0.00 0.00 178.16 177.23 2jjj n ILE 278 N -3.71 0.00 -2.70 -2.88 5.41 -0.17 -4.48 119.36 110.82 2jjj n ILE 278 Ca -0.01 -0.02 -0.42 0.00 1.00 0.00 0.00 62.75 63.30 2jjj n ILE 278 Cb 0.33 -0.04 -0.03 0.00 -0.71 0.00 0.00 39.64 39.18 2jjj n ILE 278 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2jjj s ASP 279 N -2.87 6.26 0.13 4.38 2.15 -1.01 -0.11 116.67 125.60 2jjj s ASP 279 Ca 0.16 -0.95 -0.15 0.00 0.43 0.00 0.00 52.55 52.04 2jjj s ASP 279 Cb 0.19 -2.49 -0.01 0.00 -0.30 0.00 0.00 42.92 40.30 2jjj s ASP 279 CO 0.59 -1.57 1.59 0.15 -0.17 0.00 0.00 175.17 175.76 2jjj h PHE 280 N 9.71 0.77 0.00 -5.34 3.57 -1.62 -3.47 116.94 120.55 2jjj h PHE 280 Ca -0.17 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.21 2jjj h PHE 280 Cb 1.05 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.59 2jjj h PHE 280 CO 1.10 0.76 0.00 0.41 -2.23 0.00 0.00 178.31 178.34 2jjj n GLY 281 N -0.42 -0.23 3.75 2.40 0.00 -1.24 -4.79 105.19 104.65 2jjj n GLY 281 Ca -0.00 -1.72 -0.38 0.00 0.00 0.00 0.00 46.02 43.92 2jjj n GLY 281 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2jjj s PRO 282 N -1.51 3.19 0.41 1.61 0.02 -1.26 -0.86 135.00 136.60 2jjj s PRO 282 Ca 0.00 2.10 0.12 0.00 0.02 0.00 0.00 61.00 63.24 2jjj s PRO 282 Cb 0.00 -2.22 0.86 0.00 0.02 0.00 0.00 34.50 33.16 2jjj s PRO 282 CO 0.00 -1.11 1.94 -0.84 -0.33 0.00 0.00 177.00 176.65 2jjj h ILE 283 N 1.40 1.17 -3.50 2.83 3.07 -1.49 -3.43 117.51 117.56 2jjj h ILE 283 Ca -0.51 -0.78 -0.08 0.00 1.55 0.00 0.00 64.86 65.05 2jjj h ILE 283 Cb 1.29 1.32 -0.15 0.00 -0.27 0.00 0.00 36.82 39.02 2jjj h ILE 283 CO 0.57 0.23 -0.23 -0.55 -1.05 0.00 0.00 178.15 177.13 2jjj s SER 284 N -6.94 -0.08 0.08 2.16 0.15 -1.26 -5.06 113.70 102.75 2jjj s SER 284 Ca -0.04 -0.39 -0.35 0.00 0.70 0.00 0.00 55.95 55.87 2jjj s SER 284 Cb 0.15 0.39 -0.14 0.00 -1.71 0.00 0.00 66.02 64.72 2jjj s SER 284 CO 0.72 -0.74 1.61 0.41 1.20 0.00 0.00 173.24 176.45 2jjj n THR 285 N 0.08 0.13 -0.54 6.45 -1.04 -1.26 -1.24 114.28 116.87 2jjj n THR 285 Ca -0.17 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 2jjj n THR 285 Cb 0.62 -1.50 0.00 0.00 -1.82 0.00 0.00 70.33 67.63 2jjj n THR 285 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jjj n GLY 286 N 3.53 1.19 3.74 3.41 0.00 -1.26 -5.03 105.19 110.77 2jjj n GLY 286 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2jjj n GLY 286 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jjj s SER 287 N -3.11 4.78 0.42 1.61 0.15 -0.37 -4.94 113.70 112.23 2jjj s SER 287 Ca 0.00 2.28 0.23 0.00 0.70 0.00 0.00 55.95 59.16 2jjj s SER 287 Cb 0.00 -2.58 0.49 0.00 -1.71 0.00 0.00 66.02 62.22 2jjj s SER 287 CO 0.00 -1.86 1.65 0.28 1.20 0.00 0.00 173.24 174.51 2jjj h SER 288 N 0.23 0.00 -2.84 5.45 0.02 -1.96 -3.46 113.55 110.99 2jjj h SER 288 Ca -0.48 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 59.82 2jjj h SER 288 Cb 1.28 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.74 2jjj h SER 288 CO 0.53 0.15 -0.49 -0.44 -1.14 0.00 0.00 176.83 175.44 2jjj s SER 289 N -6.19 6.32 0.13 3.07 0.01 -1.26 -0.97 113.70 114.80 2jjj s SER 289 Ca 0.05 0.39 0.10 0.00 1.31 0.00 0.00 55.95 57.80 2jjj s SER 289 Cb 0.07 -2.07 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 2jjj s SER 289 CO 0.67 0.34 -0.25 0.00 0.41 0.00 0.00 173.24 174.40 2jjj s PHE 291 N -1.14 3.68 0.46 0.00 5.36 -0.04 -1.22 117.98 125.09 2jjj s PHE 291 Ca 0.13 1.12 -0.22 0.00 -0.96 0.00 0.00 56.93 57.00 2jjj s PHE 291 Cb -0.10 -2.53 -0.08 0.00 -0.34 0.00 0.00 43.02 39.97 2jjj s PHE 291 CO 0.06 0.40 1.09 0.20 -1.46 0.00 0.00 175.22 175.51 2jjj s GLY 292 N -0.33 2.67 0.00 13.12 0.00 -0.34 -2.00 107.32 120.44 2jjj s GLY 292 Ca 0.29 0.75 0.26 0.00 0.00 0.00 0.00 44.72 46.02 2jjj s GLY 292 CO 0.16 1.15 1.55 0.61 0.00 0.00 0.00 173.10 176.56 2jjj n GLY 293 N 0.17 -1.03 3.26 0.20 0.00 0.84 -4.69 105.19 103.94 2jjj n GLY 293 Ca 0.08 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 2jjj n GLY 293 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jjj s ILE 294 N -2.78 2.90 0.08 -0.61 1.01 -1.26 -1.62 121.20 118.91 2jjj s ILE 294 Ca 0.17 -0.67 0.01 0.00 0.00 0.00 0.00 60.65 60.17 2jjj s ILE 294 Cb 0.18 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 2jjj s ILE 294 CO 0.61 0.48 -0.06 -1.10 0.00 0.00 0.00 174.94 174.86 2jjj s GLN 295 N 1.21 0.74 0.34 2.79 -1.52 -0.34 -4.81 119.66 118.06 2jjj s GLN 295 Ca 0.02 -1.20 -0.29 0.00 -1.95 0.00 0.00 55.36 51.95 2jjj s GLN 295 Cb -0.14 -0.16 -0.10 0.00 -0.22 0.00 0.00 33.01 32.38 2jjj s GLN 295 CO -0.04 -0.02 1.35 0.45 -0.25 0.00 0.00 175.29 176.78 2jjj s SER 296 N -2.72 6.67 0.00 5.90 0.15 -1.26 -1.50 113.70 120.94 2jjj s SER 296 Ca 0.06 2.77 0.23 0.00 0.70 0.00 0.00 55.95 59.72 2jjj s SER 296 Cb 0.02 -2.65 1.07 0.00 -1.71 0.00 0.00 66.02 62.75 2jjj s SER 296 CO -0.04 -0.62 1.73 -1.54 1.20 0.00 0.00 173.24 173.97 2jjj n SER 297 N 0.78 0.97 -0.28 5.45 3.41 0.41 -4.42 113.62 119.94 2jjj n SER 297 Ca 0.00 -1.49 -0.01 0.00 -0.26 0.00 0.00 58.87 57.12 2jjj n SER 297 Cb 0.41 -0.04 0.12 0.00 -0.26 0.00 0.00 64.21 64.44 2jjj n SER 297 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jjj h ALA 298 N 3.98 1.05 0.00 7.33 0.00 -1.91 0.24 119.26 129.96 2jjj h ALA 298 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2jjj h ALA 298 Cb 0.29 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2jjj h ALA 298 CO 0.00 0.21 -0.48 0.78 0.00 0.00 0.00 179.25 179.76 2jjj h GLY 299 N 0.88 0.00 0.64 0.00 0.00 -1.98 -3.25 103.07 99.35 2jjj h GLY 299 Ca 0.34 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.59 2jjj h GLY 299 CO -0.16 0.00 -1.50 0.29 0.00 0.00 0.00 176.54 175.17 2jjj n ILE 300 N -3.94 0.67 -0.70 2.60 -5.35 -0.86 -4.98 119.36 106.79 2jjj n ILE 300 Ca -0.01 -0.60 0.00 0.00 -0.27 0.00 0.00 62.75 61.86 2jjj n ILE 300 Cb 0.50 -0.36 0.00 0.00 -1.74 0.00 0.00 39.64 38.04 2jjj n ILE 300 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jjj n GLY 301 N 1.31 0.78 3.16 3.28 0.00 0.02 -5.01 105.19 108.72 2jjj n GLY 301 Ca -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 2jjj n GLY 301 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jjj s ILE 302 N -2.91 0.02 0.21 -0.61 2.07 -1.25 -5.06 121.20 113.67 2jjj s ILE 302 Ca 0.00 -0.13 -0.30 0.00 -1.41 0.00 0.00 60.65 58.81 2jjj s ILE 302 Cb 0.00 -0.41 -0.08 0.00 0.13 0.00 0.00 42.46 42.10 2jjj s ILE 302 CO 0.00 -0.07 0.99 0.20 -1.91 0.00 0.00 174.94 174.15 2jjj s ASN 303 N -0.20 7.51 -0.17 4.50 0.02 -1.26 -4.81 114.94 120.52 2jjj s ASN 303 Ca -0.03 1.99 -0.01 0.00 -1.02 0.00 0.00 52.86 53.79 2jjj s ASN 303 Cb -0.03 -2.61 0.04 0.00 0.02 0.00 0.00 41.25 38.68 2jjj s ASN 303 CO 0.01 0.01 -0.04 -0.63 0.02 0.00 0.00 177.10 176.48 2jjj s ILE 304 N -0.80 1.02 -1.12 0.60 1.01 -0.08 -1.30 121.20 120.53 2jjj s ILE 304 Ca 0.44 -0.63 -0.18 0.00 0.00 0.00 0.00 60.65 60.28 2jjj s ILE 304 Cb -0.27 -1.25 0.10 0.00 0.01 0.00 0.00 42.46 41.06 2jjj s ILE 304 CO 0.33 0.07 1.45 -0.36 0.00 0.00 0.00 174.94 176.43 2jjj s PHE 305 N 1.66 2.98 0.00 3.97 0.08 0.56 -1.13 117.98 126.11 2jjj s PHE 305 Ca 0.00 -1.51 0.00 0.00 0.12 0.00 0.00 56.93 55.55 2jjj s PHE 305 Cb -0.16 -4.52 0.00 0.00 -0.57 0.00 0.00 43.02 37.77 2jjj s PHE 305 CO -0.07 -1.66 0.00 0.41 -0.10 0.00 0.00 175.22 173.79 2jjj n GLY 306 N 5.47 0.03 0.33 4.36 0.00 -1.06 -1.39 105.19 112.92 2jjj n GLY 306 Ca 0.36 -1.80 0.02 0.00 0.00 0.00 0.00 46.02 44.61 2jjj n GLY 306 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2jjj h ASP 307 N 0.00 0.63 -0.89 1.61 3.32 -0.34 -0.68 116.42 120.07 2jjj h ASP 307 Ca 0.00 -0.02 0.14 0.00 0.02 0.00 0.00 57.03 57.17 2jjj h ASP 307 Cb 0.00 -0.16 -0.09 0.00 0.22 0.00 0.00 39.33 39.30 2jjj h ASP 307 CO 0.00 0.46 0.50 0.58 -1.72 0.00 0.00 179.24 179.07 2jjj h VAL 308 N 0.75 0.80 0.02 -1.35 2.07 -1.58 0.34 116.25 117.30 2jjj h VAL 308 Ca 0.20 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 2jjj h VAL 308 Cb -0.08 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.67 2jjj h VAL 308 CO -0.04 0.14 -0.01 0.00 0.02 0.00 0.00 177.57 177.67 2jjj h ALA 309 N 1.55 -0.03 -0.53 1.67 0.00 -1.58 -3.38 119.26 116.97 2jjj h ALA 309 Ca 0.47 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2jjj h ALA 309 Cb 0.60 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2jjj h ALA 309 CO -0.32 -0.08 0.24 -0.07 0.00 0.00 0.00 179.25 179.02 2jjj h LEU 310 N -0.89 0.66 -0.60 0.00 3.38 -0.88 -2.11 115.31 114.87 2jjj h LEU 310 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2jjj h LEU 310 Cb 0.76 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2jjj h LEU 310 CO 0.00 0.58 0.00 2.29 0.09 0.00 0.00 178.44 181.40 2jjj n LYS 311 N -4.37 0.15 0.00 1.13 2.85 0.08 -1.37 118.16 116.63 2jjj n LYS 311 Ca 0.04 0.41 0.15 0.00 -1.05 0.00 0.00 58.31 57.86 2jjj n LYS 311 Cb 0.13 -1.80 0.83 0.00 -0.65 0.00 0.00 35.03 33.54 2jjj n LYS 311 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2jjj n ALA 312 N -1.72 2.65 -2.20 0.58 0.00 -0.79 -4.67 120.51 114.36 2jjj n ALA 312 Ca 0.02 -0.23 -0.12 0.00 0.00 0.00 0.00 53.44 53.11 2jjj n ALA 312 Cb 0.20 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.10 2jjj n ALA 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jjj s ALA 313 N -2.15 1.15 -0.26 0.00 0.00 -0.47 -4.29 121.76 115.73 2jjj s ALA 313 Ca 0.41 -1.51 -0.13 0.00 0.00 0.00 0.00 51.96 50.73 2jjj s ALA 313 Cb 0.21 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.83 2jjj s ALA 313 CO 0.39 -0.34 0.30 0.12 0.00 0.00 0.00 175.76 176.23 2jjj s PHE 314 N -3.74 3.26 -0.14 0.00 5.36 -0.16 -4.53 117.98 118.02 2jjj s PHE 314 Ca 0.21 0.33 0.01 0.00 -0.96 0.00 0.00 56.93 56.52 2jjj s PHE 314 Cb 0.06 -2.47 0.00 0.00 -0.34 0.00 0.00 43.02 40.27 2jjj s PHE 314 CO 0.01 -0.15 -0.18 0.08 -1.46 0.00 0.00 175.22 173.53 2jjj s VAL 315 N 1.76 2.42 -0.24 3.12 1.01 -0.63 -1.13 120.40 126.72 2jjj s VAL 315 Ca 0.12 -0.86 -0.07 0.00 0.00 0.00 0.00 61.98 61.17 2jjj s VAL 315 Cb -0.15 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.20 2jjj s VAL 315 CO 0.09 0.53 0.06 -0.69 0.00 0.00 0.00 175.10 175.09 2jjj s VAL 316 N 0.73 4.24 -0.60 2.92 1.01 0.33 -0.84 120.40 128.18 2jjj s VAL 316 Ca -0.08 -0.20 -0.14 0.00 0.00 0.00 0.00 61.98 61.56 2jjj s VAL 316 Cb -0.16 -2.97 0.15 0.00 0.00 0.00 0.00 36.38 33.40 2jjj s VAL 316 CO 0.01 0.36 0.55 -0.36 0.00 0.00 0.00 175.10 175.65 2jjj s PHE 317 N 1.49 3.40 -0.50 5.22 0.40 0.30 -0.60 117.98 127.69 2jjj s PHE 317 Ca 0.06 -1.56 -0.22 0.00 -0.60 0.00 0.00 56.93 54.61 2jjj s PHE 317 Cb -0.15 -3.76 0.04 0.00 0.51 0.00 0.00 43.02 39.67 2jjj s PHE 317 CO 0.03 -1.01 0.77 1.21 0.70 0.00 0.00 175.22 176.92 2jjj s ASN 318 N 3.08 6.31 -0.46 1.36 2.47 -0.48 -1.65 114.94 125.57 2jjj s ASN 318 Ca 0.07 -0.50 0.03 0.00 0.42 0.00 0.00 52.86 52.88 2jjj s ASN 318 Cb -0.25 -2.36 0.63 0.00 -1.45 0.00 0.00 41.25 37.82 2jjj s ASN 318 CO -0.00 -1.00 1.91 0.61 -3.72 0.00 0.00 177.10 174.89 2jjj n GLY 319 N 5.10 4.59 3.39 1.21 0.00 0.21 -1.91 105.19 117.79 2jjj n GLY 319 Ca -0.01 -1.20 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 2jjj n GLY 319 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jjj n ALA 320 N -1.08 -3.32 -0.35 4.61 0.00 -1.22 -4.87 120.51 114.28 2jjj n ALA 320 Ca 0.59 -1.14 0.09 0.00 0.00 0.00 0.00 53.44 52.97 2jjj n ALA 320 Cb 1.53 -1.78 0.27 0.00 0.00 0.00 0.00 19.45 19.47 2jjj n ALA 320 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2jjj h THR 321 N -2.27 0.88 -3.39 0.00 2.02 -1.96 -2.48 112.91 105.70 2jjj h THR 321 Ca -0.56 -0.32 -0.73 0.00 0.77 0.00 0.00 66.41 65.58 2jjj h THR 321 Cb 1.34 -0.14 -0.25 0.00 -1.74 0.00 0.00 68.15 67.36 2jjj h THR 321 CO 0.43 0.17 -0.40 -0.89 0.37 0.00 0.00 175.52 175.19 2jjj s THR 322 N -5.91 4.78 0.59 3.16 2.01 -1.26 -5.08 115.64 113.92 2jjj s THR 322 Ca -0.12 -1.18 -0.15 0.00 0.31 0.00 0.00 61.69 60.55 2jjj s THR 322 Cb 0.23 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 2jjj s THR 322 CO 0.81 -0.52 1.05 -2.16 -0.69 0.00 0.00 174.62 173.11 2jjj s PRO 323 N 1.55 3.33 0.16 4.92 0.04 -0.94 -4.93 135.00 139.12 2jjj s PRO 323 Ca 0.03 1.18 -0.01 0.00 0.04 0.00 0.00 61.00 62.24 2jjj s PRO 323 Cb -0.23 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2jjj s PRO 323 CO 0.05 -0.80 0.08 0.95 0.04 0.00 0.00 177.00 177.32 2jjj s THR 324 N -2.50 0.11 -0.09 1.26 -4.23 -0.80 -3.67 115.64 105.72 2jjj s THR 324 Ca 0.63 -1.94 0.04 0.00 -1.18 0.00 0.00 61.69 59.24 2jjj s THR 324 Cb -0.16 -2.20 -0.00 0.00 1.34 0.00 0.00 72.50 71.48 2jjj s THR 324 CO 0.38 -0.31 -0.23 -0.76 -0.54 0.00 0.00 174.62 173.15 2jjj s LEU 325 N -3.09 2.05 0.01 4.79 1.02 -0.69 -1.38 118.68 121.38 2jjj s LEU 325 Ca 0.29 -0.53 0.06 0.00 0.02 0.00 0.00 54.13 53.97 2jjj s LEU 325 Cb 0.07 -1.35 -0.03 0.00 0.02 0.00 0.00 46.19 44.90 2jjj s LEU 325 CO 0.05 0.17 -0.17 -0.83 0.02 0.00 0.00 176.35 175.60 2jjj s GLY 326 N 0.26 1.55 -0.02 -3.19 0.00 0.23 -0.58 107.32 105.57 2jjj s GLY 326 Ca -0.15 -1.11 0.05 0.00 0.00 0.00 0.00 44.72 43.51 2jjj s GLY 326 CO 0.07 -0.96 -0.15 -1.36 0.00 0.00 0.00 173.10 170.70 2jjj s PHE 327 N -0.85 1.43 0.06 1.90 0.40 -0.30 -0.51 117.98 120.12 2jjj s PHE 327 Ca 0.14 -0.31 0.05 0.00 -0.60 0.00 0.00 56.93 56.20 2jjj s PHE 327 Cb -0.11 -0.94 -0.03 0.00 0.51 0.00 0.00 43.02 42.46 2jjj s PHE 327 CO 0.04 -0.06 -0.13 0.00 0.70 0.00 0.00 175.22 175.76 2jjj s ALA 328 N -0.23 1.10 0.87 5.36 0.00 -0.28 -1.48 121.76 127.11 2jjj s ALA 328 Ca 0.03 -0.94 -0.11 0.00 0.00 0.00 0.00 51.96 50.94 2jjj s ALA 328 Cb -0.07 -0.09 0.12 0.00 0.00 0.00 0.00 23.12 23.07 2jjj s ALA 328 CO 0.00 0.15 1.11 -1.12 0.00 0.00 0.00 175.76 175.90 2jjj s SER 329 N -1.63 3.50 0.00 0.00 0.01 -1.26 -0.99 113.70 113.34 2jjj s SER 329 Ca -0.02 1.90 0.00 0.00 1.31 0.00 0.00 55.95 59.14 2jjj s SER 329 Cb -0.10 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2jjj s SER 329 CO 0.02 -2.69 0.00 2.29 0.41 0.00 0.00 173.24 173.27