#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jcz s TRP 5 N 0.00 0.06 0.32 5.64 1.48 -1.26 -4.99 118.94 120.19 1jcz s TRP 5 Ca 0.00 -0.43 0.02 0.00 -1.06 0.00 0.00 56.10 54.62 1jcz s TRP 5 Cb 0.00 0.01 -0.00 0.00 -1.16 0.00 0.00 33.47 32.31 1jcz s TRP 5 CO 0.00 -0.56 0.38 0.25 -4.06 0.00 0.00 176.95 172.96 1jcz n THR 6 N 0.03 0.00 0.96 0.66 -2.24 -0.62 -5.04 114.28 108.03 1jcz n THR 6 Ca -0.16 -1.85 0.11 0.00 -2.27 0.00 0.00 64.05 59.88 1jcz n THR 6 Cb 0.62 1.05 0.03 0.00 -2.10 0.00 0.00 70.33 69.92 1jcz n THR 6 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1jcz n TYR 7 N -0.55 0.00 -3.78 4.78 4.02 -1.26 -3.71 117.16 116.66 1jcz n TYR 7 Ca 0.03 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.79 1jcz n TYR 7 Cb 0.54 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.77 1jcz n TYR 7 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1jcz s PHE 8 N -2.26 -0.16 0.00 -0.72 0.40 -1.26 -4.40 117.98 109.58 1jcz s PHE 8 Ca 0.21 0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.78 1jcz s PHE 8 Cb 0.18 0.08 0.00 0.00 0.51 0.00 0.00 43.02 43.79 1jcz s PHE 8 CO 0.47 -0.36 0.00 0.41 0.70 0.00 0.00 175.22 176.44 1jcz n GLY 9 N 1.41 -2.26 0.28 4.36 0.00 -1.26 -4.12 105.19 103.61 1jcz n GLY 9 Ca -0.21 -2.06 0.19 0.00 0.00 0.00 0.00 46.02 43.93 1jcz n GLY 9 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jcz h PRO 10 N 0.00 0.00 -0.46 1.61 0.13 -2.00 0.23 132.00 131.51 1jcz h PRO 10 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1jcz h PRO 10 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1jcz h PRO 10 CO 0.00 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.52 1jcz n ASP 11 N -2.84 4.79 -3.97 1.44 8.00 -1.26 -4.70 116.55 118.02 1jcz n ASP 11 Ca -0.02 -2.86 -0.30 0.00 0.71 0.00 0.00 54.79 52.32 1jcz n ASP 11 Cb 0.08 -0.60 0.23 0.00 -0.02 0.00 0.00 41.12 40.81 1jcz n ASP 11 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1jcz s GLY 12 N -1.25 1.58 0.53 0.44 0.00 0.81 -1.59 107.32 107.83 1jcz s GLY 12 Ca 0.48 -0.85 0.26 0.00 0.00 0.00 0.00 44.72 44.62 1jcz s GLY 12 CO 0.14 -0.01 1.96 1.05 0.00 0.00 0.00 173.10 176.25 1jcz h GLU 13 N -2.46 0.02 0.00 2.90 4.11 -1.77 0.71 114.58 118.09 1jcz h GLU 13 Ca -0.47 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1jcz h GLU 13 Cb 1.30 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1jcz h GLU 13 CO 0.38 0.02 0.00 0.09 0.07 0.00 0.00 179.01 179.57 1jcz n ASN 14 N -4.36 0.62 -0.42 3.06 4.13 -1.26 -2.96 115.26 114.07 1jcz n ASN 14 Ca 0.12 0.62 0.07 0.00 1.68 0.00 0.00 54.58 57.07 1jcz n ASN 14 Cb 0.69 -0.76 0.02 0.00 -1.54 0.00 0.00 39.78 38.19 1jcz n ASN 14 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1jcz n SER 15 N -2.14 1.76 -0.35 6.41 7.64 0.22 -4.61 113.62 122.54 1jcz n SER 15 Ca 0.04 -1.38 0.07 0.00 1.01 0.00 0.00 58.87 58.60 1jcz n SER 15 Cb 0.29 0.33 0.23 0.00 -1.01 0.00 0.00 64.21 64.05 1jcz n SER 15 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 1jcz h TRP 16 N 2.05 1.10 0.00 1.43 6.55 -1.38 -1.39 115.95 124.30 1jcz h TRP 16 Ca 0.00 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.87 1jcz h TRP 16 Cb 0.54 -0.35 0.00 0.00 -0.86 0.00 0.00 29.16 28.50 1jcz h TRP 16 CO 0.00 0.43 0.02 0.66 -1.05 0.00 0.00 178.44 178.50 1jcz h SER 17 N 0.96 0.00 -0.69 -3.49 4.64 -1.81 0.17 113.55 113.32 1jcz h SER 17 Ca 0.48 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.74 1jcz h SER 17 Cb 0.48 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.54 1jcz h SER 17 CO -0.27 0.00 0.18 0.11 -0.87 0.00 0.00 176.83 175.98 1jcz h LYS 18 N 0.00 1.11 0.00 4.77 1.57 -1.58 -3.32 116.57 119.11 1jcz h LYS 18 Ca 0.00 -0.25 -0.27 0.00 -1.87 0.00 0.00 60.65 58.26 1jcz h LYS 18 Cb 0.05 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.16 1jcz h LYS 18 CO 0.00 0.97 -2.01 1.17 -0.57 0.00 0.00 179.45 179.01 1jcz n LYS 19 N -4.24 1.40 -3.85 3.15 4.81 -0.76 -4.84 118.16 113.83 1jcz n LYS 19 Ca 0.05 0.02 -0.33 0.00 -0.87 0.00 0.00 58.31 57.18 1jcz n LYS 19 Cb 0.25 -1.37 -0.12 0.00 0.02 0.00 0.00 35.03 33.81 1jcz n LYS 19 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1jcz s TYR 20 N -2.36 3.30 0.31 5.64 1.51 0.51 -4.99 117.35 121.27 1jcz s TYR 20 Ca -0.11 -2.97 0.06 0.00 -1.01 0.00 0.00 57.07 53.04 1jcz s TYR 20 Cb 0.05 -2.99 0.85 0.00 -0.11 0.00 0.00 41.96 39.75 1jcz s TYR 20 CO 0.56 -0.79 1.62 -1.35 -1.11 0.00 0.00 175.55 174.48 1jcz h PRO 21 N 6.75 0.14 0.00 -1.71 0.11 -1.81 -0.19 132.00 135.29 1jcz h PRO 21 Ca -0.05 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 1jcz h PRO 21 Cb 0.92 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1jcz h PRO 21 CO 0.70 0.09 -0.01 0.77 -0.21 0.00 0.00 178.00 179.33 1jcz h SER 22 N 0.14 0.00 0.55 -2.05 0.02 -1.88 -1.17 113.55 109.16 1jcz h SER 22 Ca 0.62 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.57 1jcz h SER 22 Cb 1.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.89 1jcz h SER 22 CO -0.73 0.01 0.00 0.00 -1.14 0.00 0.00 176.83 174.97 1jcz n GLY 24 N -0.39 3.08 0.00 0.00 0.00 -0.45 -4.79 105.19 102.64 1jcz n GLY 24 Ca 0.01 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1jcz n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jcz n GLY 25 N 0.17 1.21 3.94 -0.02 0.00 -0.28 -5.11 105.19 105.09 1jcz n GLY 25 Ca 0.12 -1.88 -0.26 0.00 0.00 0.00 0.00 46.02 44.00 1jcz n GLY 25 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jcz s LEU 26 N 0.00 2.84 -1.60 0.99 1.43 -1.26 -4.50 118.68 116.59 1jcz s LEU 26 Ca 0.00 0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 53.29 1jcz s LEU 26 Cb 0.00 -2.92 0.11 0.00 0.03 0.00 0.00 46.19 43.41 1jcz s LEU 26 CO 0.00 -1.70 0.91 0.18 0.23 0.00 0.00 176.35 175.98 1jcz n LEU 27 N -2.96 -2.24 -4.76 1.79 4.77 -1.26 -4.72 117.00 107.62 1jcz n LEU 27 Ca 0.09 -0.87 -0.39 0.00 -0.03 0.00 0.00 56.01 54.82 1jcz n LEU 27 Cb 0.60 -2.38 -0.06 0.00 -2.33 0.00 0.00 43.42 39.25 1jcz n LEU 27 CO 0.50 0.40 0.65 -1.10 -1.33 0.00 0.00 177.39 176.52 1jcz s GLN 28 N -6.74 4.74 0.31 3.23 -1.52 -1.26 -1.91 119.66 116.51 1jcz s GLN 28 Ca 0.69 1.42 0.10 0.00 -1.95 0.00 0.00 55.36 55.62 1jcz s GLN 28 Cb -0.36 -3.09 -0.05 0.00 -0.22 0.00 0.00 33.01 29.29 1jcz s GLN 28 CO 0.87 0.42 -0.03 -1.12 -0.25 0.00 0.00 175.29 175.18 1jcz s SER 29 N -1.36 4.18 0.88 5.90 0.01 -1.26 -4.73 113.70 117.32 1jcz s SER 29 Ca 0.45 -0.90 -0.13 0.00 1.31 0.00 0.00 55.95 56.68 1jcz s SER 29 Cb -0.23 -0.58 0.15 0.00 0.21 0.00 0.00 66.02 65.57 1jcz s SER 29 CO 0.29 -0.12 1.23 -2.16 0.41 0.00 0.00 173.24 172.89 1jcz s PRO 30 N -3.67 1.21 0.20 12.44 0.04 -1.26 -4.61 135.00 139.36 1jcz s PRO 30 Ca 0.33 -0.33 -0.00 0.00 0.04 0.00 0.00 61.00 61.04 1jcz s PRO 30 Cb -0.03 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 1jcz s PRO 30 CO 0.19 -2.01 0.10 0.96 0.04 0.00 0.00 177.00 176.28 1jcz s ILE 31 N -3.68 0.22 -0.23 0.56 -4.36 -1.26 -0.25 121.20 112.19 1jcz s ILE 31 Ca 0.69 -1.99 -0.17 0.00 -0.26 0.00 0.00 60.65 58.92 1jcz s ILE 31 Cb -0.06 -2.44 -0.03 0.00 1.25 0.00 0.00 42.46 41.17 1jcz s ILE 31 CO 0.50 -0.10 0.46 -0.62 0.24 0.00 0.00 174.94 175.42 1jcz s ASP 32 N -3.19 6.44 -0.79 4.36 2.15 -1.26 -2.76 116.67 121.62 1jcz s ASP 32 Ca 0.35 0.52 -0.21 0.00 0.43 0.00 0.00 52.55 53.65 1jcz s ASP 32 Cb 0.07 -2.26 0.10 0.00 -0.30 0.00 0.00 42.92 40.53 1jcz s ASP 32 CO 0.10 -0.19 1.05 -0.76 -0.17 0.00 0.00 175.17 175.21 1jcz s LEU 33 N 1.83 4.67 0.05 -1.34 1.43 0.72 -4.92 118.68 121.12 1jcz s LEU 33 Ca 0.20 -1.49 0.04 0.00 -1.03 0.00 0.00 54.13 51.86 1jcz s LEU 33 Cb -0.15 -2.41 -0.02 0.00 0.03 0.00 0.00 46.19 43.63 1jcz s LEU 33 CO 0.09 -1.27 -0.13 -1.38 0.23 0.00 0.00 176.35 173.89 1jcz s HIS 34 N 3.46 1.11 0.20 0.29 -3.43 -1.26 -1.30 115.29 114.37 1jcz s HIS 34 Ca 0.28 -0.41 -0.03 0.00 -0.80 0.00 0.00 55.06 54.10 1jcz s HIS 34 Cb -0.11 -0.64 0.40 0.00 -1.43 0.00 0.00 32.58 30.80 1jcz s HIS 34 CO 0.00 0.03 1.09 -1.13 -2.00 0.00 0.00 174.74 172.73 1jcz n SER 35 N 1.62 -0.19 -0.13 7.38 3.41 -1.26 -1.22 113.62 123.23 1jcz n SER 35 Ca -0.20 1.20 0.28 0.00 -0.26 0.00 0.00 58.87 59.88 1jcz n SER 35 Cb 0.55 -0.39 0.69 0.00 -0.26 0.00 0.00 64.21 64.80 1jcz n SER 35 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1jcz h ASP 36 N 0.00 0.00 -0.06 4.04 3.32 -1.98 -1.13 116.42 120.61 1jcz h ASP 36 Ca 0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.42 1jcz h ASP 36 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1jcz h ASP 36 CO -0.70 0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.12 1jcz n ILE 37 N -3.82 0.58 -3.22 0.35 -5.35 -0.36 -4.63 119.36 102.91 1jcz n ILE 37 Ca 0.17 -0.79 -0.27 0.00 -0.27 0.00 0.00 62.75 61.59 1jcz n ILE 37 Cb 1.03 0.73 -0.02 0.00 -1.74 0.00 0.00 39.64 39.65 1jcz n ILE 37 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1jcz s LEU 38 N -0.69 3.97 -0.29 7.28 1.43 -0.43 -1.93 118.68 128.02 1jcz s LEU 38 Ca 0.05 0.68 -0.09 0.00 -1.03 0.00 0.00 54.13 53.74 1jcz s LEU 38 Cb 0.03 -3.53 0.13 0.00 0.03 0.00 0.00 46.19 42.84 1jcz s LEU 38 CO 0.04 -0.30 0.61 -1.58 0.23 0.00 0.00 176.35 175.36 1jcz s GLN 39 N -4.00 0.54 0.22 1.70 2.00 0.30 -4.91 119.66 115.51 1jcz s GLN 39 Ca 0.43 1.37 -0.30 0.00 -2.00 0.00 0.00 55.36 54.86 1jcz s GLN 39 Cb -0.10 0.78 -0.10 0.00 0.80 0.00 0.00 33.01 34.39 1jcz s GLN 39 CO 0.34 -0.24 1.42 -0.47 -0.50 0.00 0.00 175.29 175.84 1jcz s TYR 40 N 2.86 3.09 -0.08 1.67 5.04 -1.26 -1.27 117.35 127.40 1jcz s TYR 40 Ca -0.04 1.04 -0.01 0.00 -2.44 0.00 0.00 57.07 55.62 1jcz s TYR 40 Cb -0.12 -3.77 0.03 0.00 0.35 0.00 0.00 41.96 38.45 1jcz s TYR 40 CO -0.18 -2.52 -0.02 0.34 -1.34 0.00 0.00 175.55 171.83 1jcz s ASP 41 N 0.46 1.73 0.22 4.32 3.68 0.37 -4.84 116.67 122.60 1jcz s ASP 41 Ca 0.60 -0.14 0.25 0.00 2.13 0.00 0.00 52.55 55.39 1jcz s ASP 41 Cb -0.40 -0.53 0.90 0.00 -1.45 0.00 0.00 42.92 41.44 1jcz s ASP 41 CO 0.40 -0.18 1.74 0.00 0.13 0.00 0.00 175.17 177.27 1jcz n ALA 42 N 5.10 1.96 0.74 3.66 0.00 -1.26 -2.81 120.51 127.90 1jcz n ALA 42 Ca -0.08 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.51 1jcz n ALA 42 Cb 0.50 -1.42 0.49 0.00 0.00 0.00 0.00 19.45 19.02 1jcz n ALA 42 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1jcz n SER 43 N -2.21 0.33 -4.56 0.00 3.41 -1.26 -4.43 113.62 104.90 1jcz n SER 43 Ca 0.04 0.54 -0.43 0.00 -0.26 0.00 0.00 58.87 58.76 1jcz n SER 43 Cb 0.32 -0.63 -0.01 0.00 -0.26 0.00 0.00 64.21 63.64 1jcz n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1jcz s LEU 44 N -3.64 3.99 0.71 1.04 1.43 -1.12 -4.97 118.68 116.12 1jcz s LEU 44 Ca 0.11 -2.37 -0.11 0.00 -1.03 0.00 0.00 54.13 50.72 1jcz s LEU 44 Cb 0.14 -2.55 0.02 0.00 0.03 0.00 0.00 46.19 43.83 1jcz s LEU 44 CO 0.49 -1.16 1.10 0.42 0.23 0.00 0.00 176.35 177.44 1jcz s THR 45 N 3.93 3.36 0.40 5.49 -4.23 -1.26 -4.76 115.64 118.56 1jcz s THR 45 Ca 0.51 0.44 -0.27 0.00 -1.18 0.00 0.00 61.69 61.18 1jcz s THR 45 Cb 0.02 -3.44 -0.10 0.00 1.34 0.00 0.00 72.50 70.32 1jcz s THR 45 CO 0.04 -0.57 1.47 -2.65 -0.54 0.00 0.00 174.62 172.36 1jcz n PRO 46 N -3.03 2.54 -3.23 3.99 -0.02 -1.26 -5.01 135.00 128.98 1jcz n PRO 46 Ca 0.07 0.89 -0.31 0.00 -2.02 0.00 0.00 63.50 62.13 1jcz n PRO 46 Cb 0.57 -2.65 -0.05 0.00 -0.02 0.00 0.00 33.50 31.36 1jcz n PRO 46 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1jcz s LEU 47 N -2.19 4.06 -0.11 2.45 1.43 -1.26 -4.79 118.68 118.27 1jcz s LEU 47 Ca 0.55 1.01 0.00 0.00 -1.03 0.00 0.00 54.13 54.66 1jcz s LEU 47 Cb -0.47 -3.81 -0.02 0.00 0.03 0.00 0.00 46.19 41.92 1jcz s LEU 47 CO 0.62 -0.19 -0.12 -1.61 0.23 0.00 0.00 176.35 175.28 1jcz s GLU 48 N -3.18 3.19 -0.42 1.70 2.02 0.15 -4.95 118.70 117.21 1jcz s GLU 48 Ca 0.49 -0.66 -0.10 0.00 0.02 0.00 0.00 54.97 54.71 1jcz s GLU 48 Cb -0.11 -2.60 0.07 0.00 0.10 0.00 0.00 34.13 31.59 1jcz s GLU 48 CO 0.24 0.33 0.28 -0.06 0.02 0.00 0.00 175.26 176.06 1jcz s PHE 49 N 0.06 3.32 -0.07 1.61 0.40 -1.26 -0.09 117.98 121.94 1jcz s PHE 49 Ca -0.04 -1.40 -0.02 0.00 -0.60 0.00 0.00 56.93 54.87 1jcz s PHE 49 Cb -0.14 -2.95 -0.03 0.00 0.51 0.00 0.00 43.02 40.40 1jcz s PHE 49 CO 0.04 -0.83 0.02 -0.65 0.70 0.00 0.00 175.22 174.50 1jcz s GLN 50 N 1.46 2.99 -0.14 0.44 -0.21 -0.68 -4.40 119.66 119.13 1jcz s GLN 50 Ca 0.03 -0.42 0.00 0.00 0.02 0.00 0.00 55.36 54.99 1jcz s GLN 50 Cb -0.23 -2.81 0.00 0.00 1.00 0.00 0.00 33.01 30.97 1jcz s GLN 50 CO 0.03 0.69 0.00 0.41 -2.12 0.00 0.00 175.29 174.30 1jcz n GLY 50 N 1.96 0.50 0.24 3.09 0.00 -1.26 -0.93 105.19 108.78 1jcz n GLY 50 Ca -0.18 -0.29 0.14 0.00 0.00 0.00 0.00 46.02 45.69 1jcz n GLY 50 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1jcz h TYR 51 N 0.00 0.00 -1.48 1.61 -1.99 -1.91 -3.38 116.97 109.82 1jcz h TYR 51 Ca -0.03 0.00 -0.69 0.00 2.00 0.00 0.00 58.73 60.01 1jcz h TYR 51 Cb 0.21 0.00 -0.12 0.00 2.00 0.00 0.00 36.73 38.82 1jcz h TYR 51 CO 0.12 0.00 1.71 1.21 -0.00 0.00 0.00 178.16 181.20 1jcz s ASN 52 N -6.03 6.86 0.23 3.88 2.47 -1.26 -1.06 114.94 120.04 1jcz s ASN 52 Ca 0.05 -2.49 -0.30 0.00 0.42 0.00 0.00 52.86 50.54 1jcz s ASN 52 Cb 0.06 -2.50 -0.10 0.00 -1.45 0.00 0.00 41.25 37.26 1jcz s ASN 52 CO 0.63 -1.05 1.43 -0.76 -3.72 0.00 0.00 177.10 173.63 1jcz s LEU 53 N 3.25 4.39 0.09 3.21 1.43 -1.09 -4.89 118.68 125.08 1jcz s LEU 53 Ca 0.47 2.62 -0.34 0.00 -1.03 0.00 0.00 54.13 55.85 1jcz s LEU 53 Cb 0.00 -3.62 -0.13 0.00 0.03 0.00 0.00 46.19 42.47 1jcz s LEU 53 CO 0.02 -0.69 1.66 -0.24 0.23 0.00 0.00 176.35 177.32 1jcz n SER 54 N 2.57 3.16 0.05 2.29 2.88 -1.26 -2.94 113.62 120.36 1jcz n SER 54 Ca 0.07 1.05 0.08 0.00 -1.33 0.00 0.00 58.87 58.75 1jcz n SER 54 Cb 0.40 -1.41 0.37 0.00 -0.75 0.00 0.00 64.21 62.82 1jcz n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1jcz n ALA 54 N 4.28 1.63 -0.29 -1.46 0.00 -1.24 -1.92 120.51 121.52 1jcz n ALA 54 Ca 0.19 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.68 1jcz n ALA 54 Cb 0.29 -1.28 0.29 0.00 0.00 0.00 0.00 19.45 18.75 1jcz n ALA 54 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jcz n ASN 54 N -1.76 4.24 -4.10 0.00 5.03 -1.26 -4.33 115.26 113.08 1jcz n ASN 54 Ca 0.03 -2.58 -0.14 0.00 0.87 0.00 0.00 54.58 52.76 1jcz n ASN 54 Cb 0.18 -0.59 -0.11 0.00 -1.02 0.00 0.00 39.78 38.23 1jcz n ASN 54 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1jcz s LYS 55 N -2.13 0.63 -0.06 3.52 2.20 -0.81 -5.05 119.74 118.05 1jcz s LYS 55 Ca 0.39 -0.86 -0.00 0.00 -0.36 0.00 0.00 55.97 55.14 1jcz s LYS 55 Cb 0.29 -0.43 -0.03 0.00 -1.51 0.00 0.00 37.83 36.15 1jcz s LYS 55 CO 0.14 0.08 -0.02 -0.65 -0.36 0.00 0.00 175.35 174.53 1jcz s GLN 56 N -1.82 2.85 -0.05 4.03 -0.21 -1.26 -1.53 119.66 121.66 1jcz s GLN 56 Ca -0.06 -0.51 0.06 0.00 0.02 0.00 0.00 55.36 54.87 1jcz s GLN 56 Cb -0.09 -2.69 -0.01 0.00 1.00 0.00 0.00 33.01 31.22 1jcz s GLN 56 CO 0.01 0.67 -0.23 -0.06 -2.12 0.00 0.00 175.29 173.56 1jcz s PHE 57 N -0.91 2.21 -0.11 0.91 0.40 -0.21 -4.90 117.98 115.37 1jcz s PHE 57 Ca 0.14 -0.63 -0.29 0.00 -0.60 0.00 0.00 56.93 55.55 1jcz s PHE 57 Cb -0.11 -1.45 -0.03 0.00 0.51 0.00 0.00 43.02 41.93 1jcz s PHE 57 CO 0.04 -0.19 1.36 -1.17 0.70 0.00 0.00 175.22 175.97 1jcz s LEU 58 N -0.15 4.23 -0.15 -0.37 2.96 -1.26 -0.93 118.68 123.02 1jcz s LEU 58 Ca -0.02 1.87 -0.06 0.00 -0.22 0.00 0.00 54.13 55.70 1jcz s LEU 58 Cb -0.13 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 1jcz s LEU 58 CO 0.03 -0.78 0.06 -0.22 -1.32 0.00 0.00 176.35 174.11 1jcz s LEU 59 N 3.42 3.85 0.02 -0.68 2.96 0.52 -0.41 118.68 128.36 1jcz s LEU 59 Ca 0.60 0.16 0.00 0.00 -0.22 0.00 0.00 54.13 54.67 1jcz s LEU 59 Cb -0.26 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 1jcz s LEU 59 CO 0.20 0.26 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.57 1jcz s THR 60 N -0.16 0.18 -0.40 3.68 2.01 0.21 -0.92 115.64 120.24 1jcz s THR 60 Ca 0.07 -0.68 -0.10 0.00 0.31 0.00 0.00 61.69 61.29 1jcz s THR 60 Cb -0.12 -0.27 0.06 0.00 0.01 0.00 0.00 72.50 72.18 1jcz s THR 60 CO 0.01 -0.32 0.23 0.21 -0.69 0.00 0.00 174.62 174.06 1jcz s ASN 61 N -1.05 5.66 -0.06 3.53 3.84 -0.85 0.06 114.94 126.07 1jcz s ASN 61 Ca -0.10 -1.28 0.17 0.00 0.21 0.00 0.00 52.86 51.86 1jcz s ASN 61 Cb -0.07 -2.00 0.60 0.00 -0.55 0.00 0.00 41.25 39.23 1jcz s ASN 61 CO -0.00 -0.47 1.49 -0.46 -2.79 0.00 0.00 177.10 174.87 1jcz n ASN 62 N 4.95 3.84 0.00 -4.21 6.94 -1.09 -0.15 115.26 125.55 1jcz n ASN 62 Ca -0.11 -2.22 0.00 0.00 -0.02 0.00 0.00 54.58 52.23 1jcz n ASN 62 Cb 0.44 -0.49 0.00 0.00 -2.36 0.00 0.00 39.78 37.37 1jcz n ASN 62 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1jcz n GLY 63 N 1.24 1.66 0.01 4.83 0.00 -1.26 -4.78 105.19 106.88 1jcz n GLY 63 Ca 0.22 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.23 1jcz n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1jcz n HIS 64 N -2.00 0.00 -3.75 1.61 8.25 -1.26 -4.68 115.22 113.39 1jcz n HIS 64 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.43 1jcz n HIS 64 Cb 0.00 -0.05 0.02 0.00 1.12 0.00 0.00 29.99 31.08 1jcz n HIS 64 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1jcz n SER 65 N -2.02 -1.39 -4.48 0.41 2.88 -1.26 -4.89 113.62 102.87 1jcz n SER 65 Ca -0.02 -1.78 -0.36 0.00 -1.33 0.00 0.00 58.87 55.38 1jcz n SER 65 Cb 0.51 2.27 -0.12 0.00 -0.75 0.00 0.00 64.21 66.12 1jcz n SER 65 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1jcz s VAL 66 N -2.21 4.30 -0.02 2.46 0.11 -1.26 -2.66 120.40 121.11 1jcz s VAL 66 Ca 0.16 -0.19 0.08 0.00 -2.93 0.00 0.00 61.98 59.10 1jcz s VAL 66 Cb -0.02 -2.98 -0.02 0.00 -1.53 0.00 0.00 36.38 31.83 1jcz s VAL 66 CO 0.05 0.39 -0.25 -0.75 -3.33 0.00 0.00 175.10 171.20 1jcz s LYS 67 N 1.20 2.10 -0.19 1.54 2.20 0.11 -3.54 119.74 123.17 1jcz s LYS 67 Ca 0.04 -0.91 -0.02 0.00 -0.36 0.00 0.00 55.97 54.72 1jcz s LYS 67 Cb -0.14 -2.01 -0.00 0.00 -1.51 0.00 0.00 37.83 34.16 1jcz s LYS 67 CO 0.03 0.54 -0.10 -1.17 -0.36 0.00 0.00 175.35 174.28 1jcz s LEU 68 N -0.57 2.65 0.23 5.43 2.96 0.12 0.66 118.68 130.16 1jcz s LEU 68 Ca 0.09 -0.44 -0.30 0.00 -0.22 0.00 0.00 54.13 53.26 1jcz s LEU 68 Cb -0.10 -1.64 -0.09 0.00 0.50 0.00 0.00 46.19 44.86 1jcz s LEU 68 CO -0.01 0.03 1.15 0.20 -1.32 0.00 0.00 176.35 176.40 1jcz s ASN 69 N 1.15 7.17 0.14 3.68 0.01 0.45 -1.45 114.94 126.10 1jcz s ASN 69 Ca 0.01 2.25 0.10 0.00 -0.71 0.00 0.00 52.86 54.51 1jcz s ASN 69 Cb -0.14 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 38.86 1jcz s ASN 69 CO -0.03 -0.26 -0.24 -0.76 -1.51 0.00 0.00 177.10 174.30 1jcz s LEU 70 N -0.82 2.45 0.30 0.60 1.43 -0.57 -4.41 118.68 117.67 1jcz s LEU 70 Ca 0.49 -0.71 -0.24 0.00 -1.03 0.00 0.00 54.13 52.63 1jcz s LEU 70 Cb -0.32 -1.31 -0.09 0.00 0.03 0.00 0.00 46.19 44.50 1jcz s LEU 70 CO 0.39 0.17 0.88 -2.16 0.23 0.00 0.00 176.35 175.86 1jcz s PRO 71 N -2.20 4.47 0.00 1.29 0.04 -1.26 -4.32 135.00 133.03 1jcz s PRO 71 Ca 0.16 1.19 0.10 0.00 0.04 0.00 0.00 61.00 62.50 1jcz s PRO 71 Cb -0.10 -2.79 0.59 0.00 0.04 0.00 0.00 34.50 32.24 1jcz s PRO 71 CO 0.08 0.29 1.12 -1.13 0.04 0.00 0.00 177.00 177.40 1jcz n SER 72 N 0.53 0.00 0.16 6.66 3.41 -1.24 -1.93 113.62 121.21 1jcz n SER 72 Ca 0.01 -0.17 0.01 0.00 -0.26 0.00 0.00 58.87 58.46 1jcz n SER 72 Cb 0.51 -0.10 0.25 0.00 -0.26 0.00 0.00 64.21 64.61 1jcz n SER 72 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1jcz h ASP 73 N 0.00 0.00 -3.28 4.04 3.32 -1.91 -3.42 116.42 115.17 1jcz h ASP 73 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 1jcz h ASP 73 Cb 0.03 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.54 1jcz h ASP 73 CO 0.00 0.51 -0.03 0.00 -1.72 0.00 0.00 179.24 178.00 1jcz s MET 74 N -3.82 4.18 0.20 3.56 0.23 -0.81 -4.58 119.30 118.25 1jcz s MET 74 Ca -0.02 0.71 -0.17 0.00 -1.03 0.00 0.00 55.69 55.18 1jcz s MET 74 Cb 0.13 -3.16 0.03 0.00 -1.53 0.00 0.00 34.83 30.30 1jcz s MET 74 CO 0.74 0.59 0.53 -3.38 -2.03 0.00 0.00 175.02 171.47 1jcz s HIS 78 N -1.20 -0.11 -0.05 3.16 -3.43 -0.11 -0.88 115.29 112.67 1jcz s HIS 78 Ca 0.32 -0.23 -0.14 0.00 -0.80 0.00 0.00 55.06 54.20 1jcz s HIS 78 Cb -0.19 0.39 -0.05 0.00 -1.43 0.00 0.00 32.58 31.31 1jcz s HIS 78 CO 0.19 -0.92 0.38 0.42 -2.00 0.00 0.00 174.74 172.81 1jcz s ILE 79 N -3.88 5.12 -0.04 -5.38 1.01 -0.19 -1.68 121.20 116.16 1jcz s ILE 79 Ca 0.09 0.77 0.07 0.00 0.00 0.00 0.00 60.65 61.58 1jcz s ILE 79 Cb -0.01 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 1jcz s ILE 79 CO -0.02 0.52 -0.24 -1.58 0.00 0.00 0.00 174.94 173.62 1jcz s GLN 80 N -0.62 2.35 0.00 2.79 2.00 0.87 -3.70 119.66 123.35 1jcz s GLN 80 Ca 0.22 -0.89 0.00 0.00 -2.00 0.00 0.00 55.36 52.70 1jcz s GLN 80 Cb -0.16 -2.14 0.00 0.00 0.80 0.00 0.00 33.01 31.51 1jcz s GLN 80 CO 0.11 0.49 0.00 0.41 -0.50 0.00 0.00 175.29 175.80 1jcz n GLY 81 N 2.64 1.74 3.97 2.59 0.00 -1.26 0.32 105.19 115.19 1jcz n GLY 81 Ca -0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 1jcz n GLY 81 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jcz s LEU 84 N 0.00 3.23 0.20 0.99 1.43 -1.26 -4.95 118.68 118.32 1jcz s LEU 84 Ca 0.00 -0.03 -0.11 0.00 -1.03 0.00 0.00 54.13 52.96 1jcz s LEU 84 Cb 0.00 -2.80 0.25 0.00 0.03 0.00 0.00 46.19 43.66 1jcz s LEU 84 CO 0.00 -1.21 1.73 -0.61 0.23 0.00 0.00 176.35 176.49 1jcz h GLN 85 N 0.01 0.31 -6.03 1.70 4.15 -1.99 -3.42 115.11 109.83 1jcz h GLN 85 Ca -0.42 -0.02 -0.58 0.00 0.77 0.00 0.00 58.65 58.41 1jcz h GLN 85 Cb 1.30 -0.07 -0.10 0.00 0.21 0.00 0.00 27.48 28.81 1jcz h GLN 85 CO 0.51 0.21 -0.60 -1.12 -1.93 0.00 0.00 178.83 175.90 1jcz s SER 86 N -5.35 4.29 0.09 -0.69 0.01 -1.26 -5.11 113.70 105.68 1jcz s SER 86 Ca -0.13 -0.94 -0.26 0.00 1.31 0.00 0.00 55.95 55.93 1jcz s SER 86 Cb 0.16 -0.58 -0.06 0.00 0.21 0.00 0.00 66.02 65.75 1jcz s SER 86 CO 0.74 -0.25 0.80 -0.60 0.41 0.00 0.00 173.24 174.34 1jcz s ARG 87 N -3.74 4.55 -0.16 12.44 3.52 -1.26 -4.86 118.95 129.44 1jcz s ARG 87 Ca 0.35 1.15 0.01 0.00 -0.13 0.00 0.00 55.73 57.11 1jcz s ARG 87 Cb -0.01 -3.33 0.01 0.00 -1.56 0.00 0.00 34.95 30.05 1jcz s ARG 87 CO 0.20 0.36 -0.17 0.71 -0.81 0.00 0.00 175.30 175.59 1jcz s TYR 88 N -0.38 2.76 -0.08 5.12 1.51 -1.24 -2.55 117.35 122.49 1jcz s TYR 88 Ca 0.39 -1.23 -0.07 0.00 -1.01 0.00 0.00 57.07 55.15 1jcz s TYR 88 Cb -0.22 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.70 1jcz s TYR 88 CO 0.25 -0.58 0.18 -1.12 -1.11 0.00 0.00 175.55 173.17 1jcz s SER 89 N 0.96 6.43 0.60 2.29 0.01 0.08 -1.03 113.70 123.04 1jcz s SER 89 Ca -0.03 0.49 -0.18 0.00 1.31 0.00 0.00 55.95 57.55 1jcz s SER 89 Cb -0.15 -2.07 -0.03 0.00 0.21 0.00 0.00 66.02 63.98 1jcz s SER 89 CO -0.03 0.37 1.15 0.00 0.41 0.00 0.00 173.24 175.14 1jcz s ALA 90 N -1.11 2.55 0.00 1.44 0.00 -0.06 -0.56 121.76 124.02 1jcz s ALA 90 Ca 0.19 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.97 1jcz s ALA 90 Cb -0.13 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1jcz s ALA 90 CO 0.08 -1.09 0.00 -2.37 0.00 0.00 0.00 175.76 172.39 1jcz n THR 91 N -1.75 0.00 -3.60 0.00 5.66 -0.28 -3.71 114.28 110.60 1jcz n THR 91 Ca 0.12 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.08 1jcz n THR 91 Cb 0.51 -0.26 -0.02 0.00 -1.55 0.00 0.00 70.33 69.01 1jcz n THR 91 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1jcz s GLN 92 N -1.51 0.57 0.08 1.09 1.03 -1.19 -1.51 119.66 118.22 1jcz s GLN 92 Ca 0.00 -0.26 0.03 0.00 0.04 0.00 0.00 55.36 55.18 1jcz s GLN 92 Cb 0.00 0.23 -0.03 0.00 0.03 0.00 0.00 33.01 33.24 1jcz s GLN 92 CO 0.00 -0.26 -0.10 -0.48 -2.54 0.00 0.00 175.29 171.91 1jcz s LEU 93 N -2.53 2.35 0.32 2.60 0.05 -0.53 -0.41 118.68 120.54 1jcz s LEU 93 Ca 0.10 -0.72 -0.17 0.00 0.05 0.00 0.00 54.13 53.39 1jcz s LEU 93 Cb 0.00 -0.29 0.03 0.00 -2.05 0.00 0.00 46.19 43.88 1jcz s LEU 93 CO -0.05 -0.23 0.71 -1.38 -0.55 0.00 0.00 176.35 174.85 1jcz s HIS 94 N -2.03 0.08 0.28 3.48 -3.43 -0.61 -0.70 115.29 112.37 1jcz s HIS 94 Ca 0.00 -0.60 0.06 0.00 -0.80 0.00 0.00 55.06 53.72 1jcz s HIS 94 Cb -0.05 0.65 -0.06 0.00 -1.43 0.00 0.00 32.58 31.69 1jcz s HIS 94 CO 0.00 -1.34 -0.03 -0.51 -2.00 0.00 0.00 174.74 170.86 1jcz s LEU 95 N -3.01 2.39 -0.01 5.38 1.43 -1.23 -1.17 118.68 122.46 1jcz s LEU 95 Ca 0.15 -1.23 0.01 0.00 -1.03 0.00 0.00 54.13 52.04 1jcz s LEU 95 Cb -0.05 -0.53 0.00 0.00 0.03 0.00 0.00 46.19 45.64 1jcz s LEU 95 CO 0.10 -0.42 -0.03 -1.00 0.23 0.00 0.00 176.35 175.23 1jcz s HIS 96 N -3.13 0.35 0.32 0.29 3.76 -0.48 -4.62 115.29 111.78 1jcz s HIS 96 Ca 0.30 -0.06 -0.07 0.00 -0.15 0.00 0.00 55.06 55.08 1jcz s HIS 96 Cb 0.05 -0.28 0.01 0.00 1.11 0.00 0.00 32.58 33.47 1jcz s HIS 96 CO 0.12 -0.04 0.51 1.67 -0.85 0.00 0.00 174.74 176.15 1jcz s TRP 97 N 0.18 0.74 0.00 1.40 -2.14 -1.21 -1.69 118.94 116.23 1jcz s TRP 97 Ca -0.02 -1.07 0.00 0.00 2.66 0.00 0.00 56.10 57.68 1jcz s TRP 97 Cb -0.05 0.11 0.00 0.00 -3.10 0.00 0.00 33.47 30.43 1jcz s TRP 97 CO -0.00 -1.14 0.00 0.41 -2.66 0.00 0.00 176.95 173.55 1jcz n GLY 98 N -0.50 0.53 3.40 3.67 0.00 -1.25 -2.16 105.19 108.87 1jcz n GLY 98 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1jcz n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jcz s ASN 99 N -0.80 -0.21 0.31 1.61 2.20 -1.18 -0.87 114.94 116.00 1jcz s ASN 99 Ca 0.00 -0.45 0.05 0.00 -0.94 0.00 0.00 52.86 51.52 1jcz s ASN 99 Cb 0.00 0.51 0.67 0.00 -2.00 0.00 0.00 41.25 40.43 1jcz s ASN 99 CO 0.00 -0.93 1.83 -0.65 -2.94 0.00 0.00 177.10 174.41 1jcz h PRO 100 N 2.33 0.84 0.00 3.55 0.11 -1.96 0.16 132.00 137.02 1jcz h PRO 100 Ca -0.32 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1jcz h PRO 100 Cb 1.25 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1jcz h PRO 100 CO 0.43 0.55 0.00 -0.91 -0.21 0.00 0.00 178.00 177.87 1jcz h ASN 101 N 0.86 0.00 -0.91 -2.05 2.35 -2.02 -3.37 115.58 110.45 1jcz h ASN 101 Ca 0.50 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.92 1jcz h ASN 101 Cb 0.65 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 38.79 1jcz h ASN 101 CO -0.27 0.00 -0.71 -0.67 -1.65 0.00 0.00 177.43 174.13 1jcz n ASP 102 N -2.50 -1.92 -3.01 5.81 2.03 -0.78 -5.06 116.55 111.12 1jcz n ASP 102 Ca 0.04 -3.00 -0.21 0.00 0.52 0.00 0.00 54.79 52.14 1jcz n ASP 102 Cb 0.41 0.93 -0.03 0.00 -0.72 0.00 0.00 41.12 41.70 1jcz n ASP 102 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1jcz n PRO 102 N 1.87 2.14 -3.33 -0.67 -0.04 -0.03 -3.12 135.00 131.82 1jcz n PRO 102 Ca 0.15 -1.40 -0.26 0.00 -0.04 0.00 0.00 63.50 61.96 1jcz n PRO 102 Cb 0.58 -2.38 -0.09 0.00 -0.04 0.00 0.00 33.50 31.57 1jcz n PRO 102 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1jcz n HIS 103 N 3.85 -0.43 -1.34 0.54 8.25 -1.26 -4.12 115.22 120.71 1jcz n HIS 103 Ca 0.46 -3.47 0.01 0.00 -0.26 0.00 0.00 57.72 54.46 1jcz n HIS 103 Cb 0.22 -0.03 0.21 0.00 1.12 0.00 0.00 29.99 31.51 1jcz n HIS 103 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jcz n GLY 104 N 2.18 4.75 3.73 -1.41 0.00 -0.50 -4.74 105.19 109.20 1jcz n GLY 104 Ca 0.26 -1.19 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 1jcz n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jcz s SER 105 N -2.53 3.62 -0.20 1.61 1.04 -0.58 -3.30 113.70 113.36 1jcz s SER 105 Ca 0.42 1.44 -0.18 0.00 0.48 0.00 0.00 55.95 58.11 1jcz s SER 105 Cb 0.38 -2.12 -0.14 0.00 0.10 0.00 0.00 66.02 64.23 1jcz s SER 105 CO 0.01 -2.54 0.02 -0.62 0.98 0.00 0.00 173.24 171.10 1jcz n GLU 106 N -3.81 0.54 -2.63 4.02 1.02 -1.26 -4.80 120.64 113.72 1jcz n GLU 106 Ca 0.07 0.51 -0.33 0.00 -0.02 0.00 0.00 57.16 57.39 1jcz n GLU 106 Cb 0.56 -1.69 -0.05 0.00 -0.02 0.00 0.00 31.44 30.24 1jcz n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1jcz s HIS 107 N -2.38 3.38 0.21 -0.32 3.76 -1.26 -4.58 115.29 114.09 1jcz s HIS 107 Ca -0.27 1.53 0.10 0.00 -0.15 0.00 0.00 55.06 56.26 1jcz s HIS 107 Cb 0.06 -2.81 -0.05 0.00 1.11 0.00 0.00 32.58 30.89 1jcz s HIS 107 CO 0.49 -0.22 -0.18 0.95 -0.85 0.00 0.00 174.74 174.93 1jcz s THR 108 N -2.38 2.03 -0.17 1.30 -4.23 -1.11 -4.52 115.64 106.56 1jcz s THR 108 Ca 0.60 -2.15 0.01 0.00 -1.18 0.00 0.00 61.69 58.97 1jcz s THR 108 Cb -0.09 -2.06 0.03 0.00 1.34 0.00 0.00 72.50 71.71 1jcz s THR 108 CO 0.22 -0.40 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.06 1jcz s VAL 109 N -2.41 1.70 -1.45 2.29 1.01 -0.34 -0.20 120.40 121.00 1jcz s VAL 109 Ca 0.22 -0.80 -0.09 0.00 0.00 0.00 0.00 61.98 61.32 1jcz s VAL 109 Cb -0.04 -1.62 0.05 0.00 0.00 0.00 0.00 36.38 34.77 1jcz s VAL 109 CO 0.09 0.41 0.88 -1.20 0.00 0.00 0.00 175.10 175.28 1jcz n SER 110 N 4.72 -3.50 0.00 3.32 7.64 -0.42 -1.10 113.62 124.28 1jcz n SER 110 Ca -0.17 -0.79 0.00 0.00 1.01 0.00 0.00 58.87 58.92 1jcz n SER 110 Cb 0.49 -3.96 0.00 0.00 -1.01 0.00 0.00 64.21 59.73 1jcz n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jcz n GLY 111 N -1.67 1.59 3.74 0.23 0.00 -1.26 -5.00 105.19 102.82 1jcz n GLY 111 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1jcz n GLY 111 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jcz s GLN 112 N -0.10 4.24 0.35 1.61 -1.52 -0.26 -5.01 119.66 118.98 1jcz s GLN 112 Ca 0.00 0.26 -0.12 0.00 -1.95 0.00 0.00 55.36 53.56 1jcz s GLN 112 Cb 0.00 -3.40 -0.07 0.00 -0.22 0.00 0.00 33.01 29.31 1jcz s GLN 112 CO 0.00 0.26 0.73 -1.01 -0.25 0.00 0.00 175.29 175.02 1jcz s HIS 113 N 0.34 3.43 0.44 0.91 3.76 -1.26 -1.20 115.29 121.71 1jcz s HIS 113 Ca 0.21 1.08 0.08 0.00 -0.15 0.00 0.00 55.06 56.27 1jcz s HIS 113 Cb -0.14 -2.45 -0.00 0.00 1.11 0.00 0.00 32.58 31.10 1jcz s HIS 113 CO 0.07 0.01 0.42 -0.06 -0.85 0.00 0.00 174.74 174.34 1jcz s PHE 114 N -2.17 2.51 0.23 1.40 0.40 -1.26 -4.94 117.98 114.15 1jcz s PHE 114 Ca 0.52 -0.54 -0.08 0.00 -0.60 0.00 0.00 56.93 56.23 1jcz s PHE 114 Cb -0.10 -2.16 0.22 0.00 0.51 0.00 0.00 43.02 41.48 1jcz s PHE 114 CO 0.25 -0.25 1.91 0.00 0.70 0.00 0.00 175.22 177.83 1jcz h ALA 115 N 0.91 1.14 -2.99 5.36 0.00 -1.14 -1.38 119.26 121.16 1jcz h ALA 115 Ca -0.40 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 1jcz h ALA 115 Cb 1.27 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1jcz h ALA 115 CO 0.55 0.53 0.16 0.00 0.00 0.00 0.00 179.25 180.49 1jcz s ALA 116 N -6.13 -0.30 -0.15 0.00 0.00 -0.76 -1.41 121.76 113.02 1jcz s ALA 116 Ca -0.13 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.71 1jcz s ALA 116 Cb 0.17 0.78 0.04 0.00 0.00 0.00 0.00 23.12 24.11 1jcz s ALA 116 CO 0.80 -0.93 0.39 -2.00 0.00 0.00 0.00 175.76 174.02 1jcz s GLU 117 N -2.33 0.43 -0.13 0.00 2.12 -0.68 -0.79 118.70 117.32 1jcz s GLU 117 Ca 0.20 0.59 -0.03 0.00 0.36 0.00 0.00 54.97 56.08 1jcz s GLU 117 Cb -0.04 0.16 -0.03 0.00 0.26 0.00 0.00 34.13 34.48 1jcz s GLU 117 CO 0.14 -0.08 -0.00 -1.17 -0.54 0.00 0.00 175.26 173.61 1jcz s LEU 118 N 0.47 3.51 -0.14 2.70 2.96 -0.14 -1.38 118.68 126.65 1jcz s LEU 118 Ca -0.02 0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.95 1jcz s LEU 118 Cb -0.04 -1.83 0.01 0.00 0.50 0.00 0.00 46.19 44.83 1jcz s LEU 118 CO -0.02 0.27 -0.21 -1.00 -1.32 0.00 0.00 176.35 174.07 1jcz s HIS 119 N -0.24 2.55 -0.37 5.38 3.76 -0.32 -0.87 115.29 125.18 1jcz s HIS 119 Ca 0.06 -1.29 -0.04 0.00 -0.15 0.00 0.00 55.06 53.64 1jcz s HIS 119 Cb -0.12 -1.75 0.08 0.00 1.11 0.00 0.00 32.58 31.89 1jcz s HIS 119 CO 0.02 -0.60 0.13 0.42 -0.85 0.00 0.00 174.74 173.86 1jcz s ILE 120 N 0.88 3.39 0.03 0.60 1.01 -0.16 -1.57 121.20 125.37 1jcz s ILE 120 Ca -0.06 -1.63 -0.24 0.00 0.00 0.00 0.00 60.65 58.73 1jcz s ILE 120 Cb -0.15 -3.11 -0.05 0.00 0.01 0.00 0.00 42.46 39.15 1jcz s ILE 120 CO -0.03 -0.41 0.71 -0.69 0.00 0.00 0.00 174.94 174.53 1jcz s VAL 121 N 1.25 4.79 0.11 2.92 1.01 0.45 -1.43 120.40 129.50 1jcz s VAL 121 Ca 0.02 1.51 0.04 0.00 0.00 0.00 0.00 61.98 63.55 1jcz s VAL 121 Cb -0.21 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 1jcz s VAL 121 CO -0.01 0.38 -0.11 -1.00 0.00 0.00 0.00 175.10 174.36 1jcz s HIS 122 N -0.07 1.15 0.18 5.22 3.76 0.17 -1.12 115.29 124.58 1jcz s HIS 122 Ca 0.36 -0.66 0.09 0.00 -0.15 0.00 0.00 55.06 54.71 1jcz s HIS 122 Cb -0.20 -0.62 -0.04 0.00 1.11 0.00 0.00 32.58 32.83 1jcz s HIS 122 CO 0.21 0.04 -0.20 1.52 -0.85 0.00 0.00 174.74 175.46 1jcz s TYR 123 N -2.55 1.96 -0.76 1.40 -0.85 0.27 -1.40 117.35 115.42 1jcz s TYR 123 Ca 0.08 -0.44 -0.26 0.00 -0.52 0.00 0.00 57.07 55.93 1jcz s TYR 123 Cb -0.02 -0.96 -0.00 0.00 0.38 0.00 0.00 41.96 41.35 1jcz s TYR 123 CO 0.01 0.40 1.65 1.21 -1.52 0.00 0.00 175.55 177.30 1jcz s ASN 124 N -2.75 5.68 0.00 -0.18 3.84 0.71 -0.74 114.94 121.50 1jcz s ASN 124 Ca 0.18 -0.34 0.28 0.00 0.21 0.00 0.00 52.86 53.19 1jcz s ASN 124 Cb -0.06 -2.55 1.20 0.00 -0.55 0.00 0.00 41.25 39.29 1jcz s ASN 124 CO 0.08 -2.17 1.90 -1.54 -2.79 0.00 0.00 177.10 172.58 1jcz n SER 125 N 11.46 0.00 0.11 -4.21 3.41 -1.06 -0.92 113.62 122.42 1jcz n SER 125 Ca 0.21 0.46 -0.22 0.00 -0.26 0.00 0.00 58.87 59.06 1jcz n SER 125 Cb 0.50 -0.49 -0.14 0.00 -0.26 0.00 0.00 64.21 63.83 1jcz n SER 125 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1jcz h ASP 126 N 0.00 0.80 0.35 4.04 3.32 -1.88 -3.37 116.42 119.69 1jcz h ASP 126 Ca 0.00 -0.78 -0.32 0.00 0.02 0.00 0.00 57.03 55.95 1jcz h ASP 126 Cb 0.47 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.71 1jcz h ASP 126 CO 0.00 1.60 -1.86 0.18 -1.72 0.00 0.00 179.24 177.44 1jcz n LEU 127 N -3.73 1.17 -4.29 1.55 4.77 -1.18 -4.98 117.00 110.31 1jcz n LEU 127 Ca -0.14 0.32 -0.23 0.00 -0.03 0.00 0.00 56.01 55.92 1jcz n LEU 127 Cb 1.03 -0.07 -0.12 0.00 -2.33 0.00 0.00 43.42 41.93 1jcz n LEU 127 CO 0.58 0.50 -0.51 -0.31 -1.33 0.00 0.00 177.39 176.33 1jcz s TYR 128 N -2.58 1.77 0.28 -1.77 1.51 -0.10 -5.06 117.35 111.41 1jcz s TYR 128 Ca -0.09 -0.43 0.12 0.00 -1.01 0.00 0.00 57.07 55.66 1jcz s TYR 128 Cb 0.08 -0.96 0.49 0.00 -0.11 0.00 0.00 41.96 41.45 1jcz s TYR 128 CO 0.81 0.22 1.68 -1.00 -1.11 0.00 0.00 175.55 176.14 1jcz h PRO 129 N 3.97 0.00 -3.22 -1.71 0.13 -1.84 -3.36 132.00 125.96 1jcz h PRO 129 Ca -0.45 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.70 1jcz h PRO 129 Cb 1.18 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 1jcz h PRO 129 CO 0.41 0.53 0.11 0.16 -0.23 0.00 0.00 178.00 178.98 1jcz s ASP 130 N -6.81 -0.21 0.20 1.44 1.47 -1.26 -5.04 116.67 106.46 1jcz s ASP 130 Ca -0.01 -0.70 -0.11 0.00 1.18 0.00 0.00 52.55 52.91 1jcz s ASP 130 Cb 0.13 0.68 0.14 0.00 -0.34 0.00 0.00 42.92 43.53 1jcz s ASP 130 CO 0.74 -1.27 1.85 0.00 0.68 0.00 0.00 175.17 177.18 1jcz h ALA 131 N 2.09 0.92 -0.46 2.11 0.00 -1.95 -1.64 119.26 120.33 1jcz h ALA 131 Ca -0.22 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.64 1jcz h ALA 131 Cb 1.25 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1jcz h ALA 131 CO 0.28 0.38 0.26 1.03 0.00 0.00 0.00 179.25 181.20 1jcz h SER 132 N 0.99 0.40 -0.41 0.00 0.87 -2.00 0.63 113.55 114.03 1jcz h SER 132 Ca 0.26 0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.71 1jcz h SER 132 Cb -0.05 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 1jcz h SER 132 CO -0.05 0.29 -0.21 0.74 -0.53 0.00 0.00 176.83 177.06 1jcz h THR 133 N 0.52 1.27 -0.01 2.23 2.02 -1.94 -3.21 112.91 113.79 1jcz h THR 133 Ca 0.19 -1.36 -0.14 0.00 0.77 0.00 0.00 66.41 65.87 1jcz h THR 133 Cb 0.05 1.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1jcz h THR 133 CO -0.10 0.47 -0.65 0.00 0.37 0.00 0.00 175.52 175.60 1jcz h ALA 134 N 0.96 0.92 -1.00 6.16 0.00 -0.89 -3.37 119.26 122.03 1jcz h ALA 134 Ca 0.11 -0.59 0.32 0.00 0.00 0.00 0.00 54.91 54.75 1jcz h ALA 134 Cb 0.77 -0.10 -0.15 0.00 0.00 0.00 0.00 17.79 18.31 1jcz h ALA 134 CO 0.06 0.80 0.56 0.66 0.00 0.00 0.00 179.25 181.33 1jcz h SER 135 N 0.02 0.51 -0.31 0.00 4.64 -0.88 -1.66 113.55 115.86 1jcz h SER 135 Ca -0.01 0.19 -0.11 0.00 -0.47 0.00 0.00 61.79 61.40 1jcz h SER 135 Cb 1.15 0.14 -0.06 0.00 -0.31 0.00 0.00 62.40 63.31 1jcz h SER 135 CO 0.09 -0.13 -0.02 -0.46 -0.87 0.00 0.00 176.83 175.43 1jcz n ASN 136 N -5.05 3.09 -4.43 4.97 6.94 -1.26 -4.70 115.26 114.82 1jcz n ASN 136 Ca 0.31 -3.42 -0.23 0.00 -0.02 0.00 0.00 54.58 51.22 1jcz n ASN 136 Cb 0.97 -0.59 -0.10 0.00 -2.36 0.00 0.00 39.78 37.69 1jcz n ASN 136 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1jcz s LYS 137 N -3.06 1.57 0.13 -3.83 1.02 -0.62 -5.06 119.74 109.89 1jcz s LYS 137 Ca 0.43 -1.69 -0.35 0.00 0.02 0.00 0.00 55.97 54.39 1jcz s LYS 137 Cb 0.38 -1.63 -0.15 0.00 -0.52 0.00 0.00 37.83 35.90 1jcz s LYS 137 CO 0.04 0.31 1.49 0.45 -0.92 0.00 0.00 175.35 176.72 1jcz n SER 138 N -0.42 2.53 -2.31 2.83 2.88 -1.26 -1.34 113.62 116.54 1jcz n SER 138 Ca -0.07 1.10 -0.18 0.00 -1.33 0.00 0.00 58.87 58.39 1jcz n SER 138 Cb 0.59 -1.33 -0.02 0.00 -0.75 0.00 0.00 64.21 62.70 1jcz n SER 138 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1jcz n GLU 139 N 3.08 -1.80 0.04 -1.46 -0.58 -1.26 -4.90 120.64 113.76 1jcz n GLU 139 Ca 0.18 0.91 -0.10 0.00 -0.42 0.00 0.00 57.16 57.72 1jcz n GLU 139 Cb 0.25 -5.52 0.03 0.00 -0.57 0.00 0.00 31.44 25.64 1jcz n GLU 139 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1jcz h GLY 140 N 0.00 0.50 -3.25 0.62 0.00 -1.30 -3.40 103.07 96.24 1jcz h GLY 140 Ca -0.43 -0.67 -0.42 0.00 0.00 0.00 0.00 47.33 45.81 1jcz h GLY 140 CO 0.51 0.60 -0.75 1.08 0.00 0.00 0.00 176.54 177.99 1jcz s LEU 141 N -8.07 2.46 -0.03 3.11 1.43 -0.68 -0.21 118.68 116.69 1jcz s LEU 141 Ca -0.06 -0.89 -0.01 0.00 -1.03 0.00 0.00 54.13 52.14 1jcz s LEU 141 Cb 0.11 -0.58 0.03 0.00 0.03 0.00 0.00 46.19 45.78 1jcz s LEU 141 CO 0.84 -0.16 0.05 0.00 0.23 0.00 0.00 176.35 177.31 1jcz s ALA 142 N -2.46 0.07 -0.04 4.21 0.00 -0.49 -1.00 121.76 122.05 1jcz s ALA 142 Ca 0.14 0.33 0.05 0.00 0.00 0.00 0.00 51.96 52.48 1jcz s ALA 142 Cb -0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 1jcz s ALA 142 CO 0.04 -0.21 -0.20 0.08 0.00 0.00 0.00 175.76 175.47 1jcz s VAL 143 N 1.37 1.60 -0.19 0.00 1.01 -0.79 -0.65 120.40 122.74 1jcz s VAL 143 Ca -0.06 -0.83 -0.09 0.00 0.00 0.00 0.00 61.98 61.00 1jcz s VAL 143 Cb -0.13 -1.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.85 1jcz s VAL 143 CO -0.03 0.45 0.11 -0.76 0.00 0.00 0.00 175.10 174.87 1jcz s LEU 144 N -0.17 4.12 -0.13 3.92 1.43 -0.51 -1.66 118.68 125.68 1jcz s LEU 144 Ca 0.00 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 1jcz s LEU 144 Cb -0.11 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1jcz s LEU 144 CO 0.01 0.19 -0.18 0.00 0.23 0.00 0.00 176.35 176.60 1jcz s ALA 145 N 0.32 2.43 -0.19 4.21 0.00 0.32 -0.99 121.76 127.86 1jcz s ALA 145 Ca 0.07 -0.97 -0.01 0.00 0.00 0.00 0.00 51.96 51.05 1jcz s ALA 145 Cb -0.11 -1.08 0.01 0.00 0.00 0.00 0.00 23.12 21.93 1jcz s ALA 145 CO -0.01 0.17 -0.13 0.08 0.00 0.00 0.00 175.76 175.87 1jcz s VAL 146 N 0.49 2.69 0.23 0.00 1.01 -0.05 -1.67 120.40 123.10 1jcz s VAL 146 Ca -0.12 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 1jcz s VAL 146 Cb -0.16 -2.18 -0.09 0.00 0.00 0.00 0.00 36.38 33.95 1jcz s VAL 146 CO 0.05 0.49 0.97 -0.76 0.00 0.00 0.00 175.10 175.85 1jcz s LEU 147 N 1.30 4.61 -0.07 3.92 1.43 -1.26 -0.97 118.68 127.63 1jcz s LEU 147 Ca 0.04 1.98 0.05 0.00 -1.03 0.00 0.00 54.13 55.17 1jcz s LEU 147 Cb -0.14 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.47 1jcz s LEU 147 CO -0.07 0.07 -0.23 -0.63 0.23 0.00 0.00 176.35 175.72 1jcz s ILE 148 N -0.98 1.94 0.15 -0.59 1.01 0.03 -0.94 121.20 121.82 1jcz s ILE 148 Ca 0.43 -0.98 0.06 0.00 0.00 0.00 0.00 60.65 60.16 1jcz s ILE 148 Cb -0.27 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 1jcz s ILE 148 CO 0.33 0.54 -0.13 -1.83 0.00 0.00 0.00 174.94 173.85 1jcz s GLU 149 N 0.11 1.10 0.17 2.79 -1.05 -0.49 -0.83 118.70 120.50 1jcz s GLU 149 Ca -0.10 -1.40 -0.30 0.00 -0.15 0.00 0.00 54.97 53.02 1jcz s GLU 149 Cb -0.15 -0.84 -0.08 0.00 -0.44 0.00 0.00 34.13 32.62 1jcz s GLU 149 CO 0.06 0.14 1.18 1.41 0.95 0.00 0.00 175.26 178.99 1jcz s MET 150 N -3.31 4.51 0.00 -4.83 -2.45 -1.26 -1.75 119.30 110.20 1jcz s MET 150 Ca 0.15 1.83 0.00 0.00 -1.25 0.00 0.00 55.69 56.42 1jcz s MET 150 Cb -0.01 -3.26 0.00 0.00 1.25 0.00 0.00 34.83 32.81 1jcz s MET 150 CO 0.03 -0.07 0.00 0.41 1.05 0.00 0.00 175.02 176.44 1jcz n GLY 151 N 2.23 1.15 3.79 2.11 0.00 0.19 -4.80 105.19 109.86 1jcz n GLY 151 Ca 0.04 0.22 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 1jcz n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jcz s SER 152 N 2.00 6.15 0.33 1.61 1.04 -1.26 -3.51 113.70 120.06 1jcz s SER 152 Ca 0.00 2.01 -0.28 0.00 0.48 0.00 0.00 55.95 58.16 1jcz s SER 152 Cb 0.00 -2.57 -0.13 0.00 0.10 0.00 0.00 66.02 63.43 1jcz s SER 152 CO 0.00 -0.91 1.27 0.33 0.98 0.00 0.00 173.24 174.90 1jcz n PHE 153 N -1.06 2.17 -3.93 5.02 7.35 -1.26 -2.91 117.46 122.85 1jcz n PHE 153 Ca 0.10 0.56 -0.33 0.00 -0.76 0.00 0.00 57.45 57.02 1jcz n PHE 153 Cb 0.52 -2.40 -0.14 0.00 0.35 0.00 0.00 39.48 37.81 1jcz n PHE 153 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1jcz s ASN 154 N -0.30 4.91 0.35 -2.13 3.84 -1.26 -4.82 114.94 115.52 1jcz s ASN 154 Ca 0.56 -1.86 0.03 0.00 0.21 0.00 0.00 52.86 51.80 1jcz s ASN 154 Cb -0.59 -1.70 0.67 0.00 -0.55 0.00 0.00 41.25 39.08 1jcz s ASN 154 CO 0.61 -0.39 2.00 -0.65 -2.79 0.00 0.00 177.10 175.89 1jcz h PRO 155 N 7.84 0.80 -0.23 0.43 0.11 -1.94 -2.26 132.00 136.76 1jcz h PRO 155 Ca -0.12 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.90 1jcz h PRO 155 Cb 1.04 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 1jcz h PRO 155 CO 0.57 0.53 -0.02 0.77 -0.21 0.00 0.00 178.00 179.64 1jcz h SER 156 N 0.83 0.41 0.61 -2.05 0.02 -1.94 -2.75 113.55 108.68 1jcz h SER 156 Ca 0.25 -0.33 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1jcz h SER 156 Cb -0.01 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1jcz h SER 156 CO -0.06 0.65 -0.19 1.88 -1.14 0.00 0.00 176.83 177.97 1jcz h TYR 157 N 0.17 0.00 0.00 3.45 -1.99 -1.85 -1.88 116.97 114.87 1jcz h TYR 157 Ca 0.06 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.79 1jcz h TYR 157 Cb 0.45 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.18 1jcz h TYR 157 CO 0.04 0.19 0.00 0.22 -0.00 0.00 0.00 178.16 178.61 1jcz h ASP 158 N 0.00 0.00 0.43 3.88 -0.00 -1.12 -1.10 116.42 118.52 1jcz h ASP 158 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1jcz h ASP 158 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.87 1jcz h ASP 158 CO 0.02 0.00 0.00 0.29 -0.00 0.00 0.00 179.24 179.55 1jcz n LYS 159 N -2.31 0.08 -0.07 0.28 5.02 -0.71 -0.88 118.16 119.58 1jcz n LYS 159 Ca 0.03 0.39 -0.14 0.00 -2.02 0.00 0.00 58.31 56.57 1jcz n LYS 159 Cb 0.28 -1.67 -0.05 0.00 -0.02 0.00 0.00 35.03 33.57 1jcz n LYS 159 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1jcz n ILE 160 N -1.83 0.76 0.09 -0.18 5.41 -0.59 -4.66 119.36 118.37 1jcz n ILE 160 Ca 0.02 -0.20 0.10 0.00 1.00 0.00 0.00 62.75 63.66 1jcz n ILE 160 Cb 0.14 -1.61 0.57 0.00 -0.71 0.00 0.00 39.64 38.03 1jcz n ILE 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1jcz h PHE 161 N -0.45 0.20 0.00 1.39 0.04 -1.12 -1.27 116.94 115.73 1jcz h PHE 161 Ca -0.35 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.43 1jcz h PHE 161 Cb 1.32 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 39.41 1jcz h PHE 161 CO -0.04 0.11 0.00 -1.13 -0.60 0.00 0.00 178.31 176.66 1jcz n SER 162 N -4.48 0.32 -0.67 2.17 3.41 -0.06 -1.69 113.62 112.62 1jcz n SER 162 Ca 0.03 0.62 0.09 0.00 -0.26 0.00 0.00 58.87 59.35 1jcz n SER 162 Cb 0.22 -0.67 0.06 0.00 -0.26 0.00 0.00 64.21 63.56 1jcz n SER 162 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1jcz n HIS 163 N -1.90 0.00 -0.31 7.33 8.25 -0.48 -4.69 115.22 123.42 1jcz n HIS 163 Ca 0.01 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.54 1jcz n HIS 163 Cb 0.09 0.00 0.23 0.00 1.12 0.00 0.00 29.99 31.43 1jcz n HIS 163 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1jcz h LEU 164 N 3.28 0.63 -2.07 2.41 3.38 -1.39 -1.37 115.31 120.18 1jcz h LEU 164 Ca 0.00 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1jcz h LEU 164 Cb 0.73 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 1jcz h LEU 164 CO 0.00 0.29 -0.08 -0.61 0.09 0.00 0.00 178.44 178.13 1jcz h GLN 165 N 0.71 0.00 0.00 1.13 4.15 -1.84 -1.42 115.11 117.85 1jcz h GLN 165 Ca 0.47 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.89 1jcz h GLN 165 Cb 0.61 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.30 1jcz h GLN 165 CO -0.33 0.08 0.00 0.45 -1.93 0.00 0.00 178.83 177.09 1jcz h HIS 166 N 0.00 0.00 -0.51 3.99 3.86 -1.59 -2.99 115.15 117.90 1jcz h HIS 166 Ca -0.00 0.00 -0.37 0.00 -1.16 0.00 0.00 60.37 58.84 1jcz h HIS 166 Cb 0.27 0.00 -0.36 0.00 1.06 0.00 0.00 27.41 28.38 1jcz h HIS 166 CO 0.00 0.00 -0.88 1.33 0.86 0.00 0.00 177.93 179.24 1jcz n VAL 167 N -2.86 1.96 -0.37 2.45 0.24 -0.57 -4.42 118.33 114.76 1jcz n VAL 167 Ca 0.01 -3.51 0.02 0.00 -2.04 0.00 0.00 64.34 58.82 1jcz n VAL 167 Cb 0.31 -0.19 0.17 0.00 -1.47 0.00 0.00 33.84 32.66 1jcz n VAL 167 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1jcz h LYS 168 N 2.07 1.16 -6.23 7.34 3.64 -1.32 -3.42 116.57 119.81 1jcz h LYS 168 Ca 0.14 -0.07 -0.55 0.00 -1.27 0.00 0.00 60.65 58.90 1jcz h LYS 168 Cb 1.42 -0.26 -0.08 0.00 -0.41 0.00 0.00 32.23 32.90 1jcz h LYS 168 CO 0.46 0.77 -0.60 0.71 -2.27 0.00 0.00 179.45 178.51 1jcz s TYR 169 N -6.05 2.91 0.31 1.91 1.51 -1.26 -0.79 117.35 115.90 1jcz s TYR 169 Ca -0.13 -0.14 -0.29 0.00 -1.01 0.00 0.00 57.07 55.50 1jcz s TYR 169 Cb 0.20 -1.34 -0.12 0.00 -0.11 0.00 0.00 41.96 40.59 1jcz s TYR 169 CO 0.81 0.55 1.42 1.17 -1.11 0.00 0.00 175.55 178.40 1jcz n LYS 170 N -0.74 2.32 0.00 -0.62 4.81 -0.85 -2.02 118.16 121.07 1jcz n LYS 170 Ca -0.08 0.82 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 1jcz n LYS 170 Cb 0.57 -2.49 0.00 0.00 0.02 0.00 0.00 35.03 33.13 1jcz n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jcz n GLY 171 N 1.36 2.86 3.80 3.14 0.00 0.79 -4.57 105.19 112.58 1jcz n GLY 171 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1jcz n GLY 171 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jcz s GLN 172 N -0.48 3.69 0.09 1.61 -0.21 -0.85 -4.86 119.66 118.64 1jcz s GLN 172 Ca 0.00 1.29 0.03 0.00 0.02 0.00 0.00 55.36 56.71 1jcz s GLN 172 Cb 0.00 -2.08 -0.04 0.00 1.00 0.00 0.00 33.01 31.89 1jcz s GLN 172 CO 0.00 -0.51 -0.09 -1.21 -2.12 0.00 0.00 175.29 171.35 1jcz s GLU 173 N -3.50 0.81 0.12 2.91 2.02 -1.26 -2.01 118.70 117.79 1jcz s GLU 173 Ca 0.66 -1.13 -0.11 0.00 0.02 0.00 0.00 54.97 54.40 1jcz s GLU 173 Cb -0.16 -0.47 0.01 0.00 0.10 0.00 0.00 34.13 33.61 1jcz s GLU 173 CO 0.25 0.07 0.28 0.00 0.02 0.00 0.00 175.26 175.88 1jcz s ALA 174 N -2.46 -0.39 -0.17 5.21 0.00 -0.10 -4.81 121.76 119.05 1jcz s ALA 174 Ca 0.04 -0.51 -0.06 0.00 0.00 0.00 0.00 51.96 51.43 1jcz s ALA 174 Cb -0.03 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.69 1jcz s ALA 174 CO -0.00 -0.59 0.05 -0.06 0.00 0.00 0.00 175.76 175.15 1jcz s PHE 175 N -3.87 3.23 -0.19 0.00 2.99 -1.26 -0.35 117.98 118.53 1jcz s PHE 175 Ca 0.07 0.05 0.00 0.00 0.00 0.00 0.00 56.93 57.06 1jcz s PHE 175 Cb 0.03 -2.03 0.02 0.00 0.00 0.00 0.00 43.02 41.04 1jcz s PHE 175 CO -0.08 0.18 -0.18 0.08 -0.00 0.00 0.00 175.22 175.21 1jcz s VAL 176 N 0.21 2.22 0.55 -0.44 1.01 -0.11 -4.90 120.40 118.93 1jcz s VAL 176 Ca 0.03 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 60.90 1jcz s VAL 176 Cb -0.12 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.26 1jcz s VAL 176 CO 0.01 0.52 1.34 -2.65 0.00 0.00 0.00 175.10 174.32 1jcz n PRO 177 N 4.64 1.65 -1.96 2.72 -0.02 -1.26 -1.04 135.00 139.72 1jcz n PRO 177 Ca -0.21 0.61 -0.39 0.00 -2.02 0.00 0.00 63.50 61.49 1jcz n PRO 177 Cb 0.50 -2.55 0.01 0.00 -0.02 0.00 0.00 33.50 31.44 1jcz n PRO 177 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1jcz s GLY 178 N -0.93 2.89 0.24 -1.23 0.00 -0.58 -4.85 107.32 102.86 1jcz s GLY 178 Ca 0.72 1.26 -0.08 0.00 0.00 0.00 0.00 44.72 46.62 1jcz s GLY 178 CO 0.49 1.81 0.38 -0.11 0.00 0.00 0.00 173.10 175.67 1jcz s PHE 179 N -1.31 0.67 -0.57 1.90 -0.12 -1.15 -3.59 117.98 113.81 1jcz s PHE 179 Ca 0.63 -0.98 -0.27 0.00 -0.05 0.00 0.00 56.93 56.26 1jcz s PHE 179 Cb -0.38 -0.06 0.00 0.00 -0.63 0.00 0.00 43.02 41.95 1jcz s PHE 179 CO 0.48 -0.91 1.58 1.21 -0.05 0.00 0.00 175.22 177.53 1jcz s ASN 180 N -3.08 5.84 0.63 1.98 2.47 -1.26 -2.66 114.94 118.85 1jcz s ASN 180 Ca 0.28 0.33 0.38 0.00 0.42 0.00 0.00 52.86 54.27 1jcz s ASN 180 Cb 0.02 -2.54 2.10 0.00 -1.45 0.00 0.00 41.25 39.38 1jcz s ASN 180 CO 0.11 -1.93 2.30 0.40 -3.72 0.00 0.00 177.10 174.26 1jcz h ILE 181 N 6.54 0.23 0.00 -5.21 1.08 -1.49 -0.55 117.51 118.12 1jcz h ILE 181 Ca -0.27 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 64.13 1jcz h ILE 181 Cb 1.12 1.05 0.00 0.00 -3.07 0.00 0.00 36.82 35.92 1jcz h ILE 181 CO 1.18 0.01 0.00 -0.08 -0.69 0.00 0.00 178.15 178.57 1jcz h GLU 182 N 0.00 0.00 0.00 2.37 4.81 -1.89 -1.63 114.58 118.24 1jcz h GLU 182 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1jcz h GLU 182 Cb 0.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1jcz h GLU 182 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 179.01 179.21 1jcz h GLU 183 N 0.00 0.00 0.00 1.92 5.08 -1.48 -2.35 114.58 117.75 1jcz h GLU 183 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1jcz h GLU 183 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1jcz h GLU 183 CO 0.00 0.00 -0.43 1.28 -1.00 0.00 0.00 179.01 178.86 1jcz n LEU 184 N -2.52 0.61 -4.84 1.33 4.77 -0.61 -4.83 117.00 110.92 1jcz n LEU 184 Ca 0.01 0.28 -0.32 0.00 -0.03 0.00 0.00 56.01 55.94 1jcz n LEU 184 Cb 0.23 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.02 1jcz n LEU 184 CO 0.21 -0.04 0.65 -0.76 -1.33 0.00 0.00 177.39 176.12 1jcz s LEU 185 N -3.93 3.75 0.91 2.23 1.43 -0.89 -4.96 118.68 117.22 1jcz s LEU 185 Ca 0.09 1.58 -0.13 0.00 -1.03 0.00 0.00 54.13 54.63 1jcz s LEU 185 Cb 0.15 -4.48 0.17 0.00 0.03 0.00 0.00 46.19 42.06 1jcz s LEU 185 CO 0.68 -0.49 1.26 -2.16 0.23 0.00 0.00 176.35 175.86 1jcz s PRO 186 N -3.73 0.96 0.67 1.29 0.04 -1.26 -5.01 135.00 127.97 1jcz s PRO 186 Ca 0.59 -0.43 -0.13 0.00 0.04 0.00 0.00 61.00 61.07 1jcz s PRO 186 Cb -0.10 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1jcz s PRO 186 CO 0.25 -2.17 1.07 -1.21 0.04 0.00 0.00 177.00 174.98 1jcz s GLU 187 N -5.74 2.89 -1.24 4.56 0.41 -1.26 -3.96 118.70 114.35 1jcz s GLU 187 Ca 0.71 1.15 -0.07 0.00 -0.41 0.00 0.00 54.97 56.35 1jcz s GLU 187 Cb -0.05 -1.98 -0.01 0.00 -1.78 0.00 0.00 34.13 30.31 1jcz s GLU 187 CO 0.51 -1.15 0.71 0.54 -0.49 0.00 0.00 175.26 175.38 1jcz n ARG 187 N -2.76 -3.19 0.14 1.61 1.74 -1.26 -4.64 116.66 108.30 1jcz n ARG 187 Ca 0.09 0.56 0.10 0.00 -0.77 0.00 0.00 57.85 57.83 1jcz n ARG 187 Cb 0.53 -4.80 0.51 0.00 -1.02 0.00 0.00 32.46 27.68 1jcz n ARG 187 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1jcz n THR 188 N -4.16 1.09 0.29 0.55 -2.24 -1.25 -0.80 114.28 107.76 1jcz n THR 188 Ca -0.21 0.62 0.18 0.00 -2.27 0.00 0.00 64.05 62.37 1jcz n THR 188 Cb 0.65 -1.60 0.82 0.00 -2.10 0.00 0.00 70.33 68.09 1jcz n THR 188 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jcz h ALA 189 N 2.05 1.02 -2.58 6.98 0.00 -1.94 -3.40 119.26 121.40 1jcz h ALA 189 Ca 0.00 -0.02 -0.67 0.00 0.00 0.00 0.00 54.91 54.23 1jcz h ALA 189 Cb 0.07 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 17.68 1jcz h ALA 189 CO 0.00 0.02 -0.29 -1.21 0.00 0.00 0.00 179.25 177.77 1jcz s GLU 190 N -3.83 3.50 0.21 0.00 2.02 0.02 -4.74 118.70 115.88 1jcz s GLU 190 Ca -0.01 -0.47 -0.18 0.00 0.02 0.00 0.00 54.97 54.33 1jcz s GLU 190 Cb 0.10 -3.82 0.03 0.00 0.10 0.00 0.00 34.13 30.54 1jcz s GLU 190 CO 0.52 -0.56 0.56 1.52 0.02 0.00 0.00 175.26 177.32 1jcz s TYR 191 N 2.01 -0.12 -0.08 1.61 -0.85 -1.26 -1.53 117.35 117.13 1jcz s TYR 191 Ca 0.11 -0.23 -0.05 0.00 -0.52 0.00 0.00 57.07 56.39 1jcz s TYR 191 Cb -0.17 0.44 -0.04 0.00 0.38 0.00 0.00 41.96 42.58 1jcz s TYR 191 CO 0.12 -0.97 0.13 0.71 -1.52 0.00 0.00 175.55 174.01 1jcz s TYR 192 N -3.88 3.51 -0.05 -3.49 1.51 0.58 -1.92 117.35 113.60 1jcz s TYR 192 Ca 0.10 0.42 0.01 0.00 -1.01 0.00 0.00 57.07 56.59 1jcz s TYR 192 Cb -0.02 -1.88 0.02 0.00 -0.11 0.00 0.00 41.96 39.97 1jcz s TYR 192 CO -0.01 0.67 -0.07 0.50 -1.11 0.00 0.00 175.55 175.53 1jcz s ARG 193 N -1.29 1.13 0.07 -0.62 6.06 0.19 -1.14 118.95 123.35 1jcz s ARG 193 Ca 0.18 -0.21 -0.26 0.00 -2.50 0.00 0.00 55.73 52.95 1jcz s ARG 193 Cb -0.12 -1.05 0.08 0.00 0.06 0.00 0.00 34.95 33.92 1jcz s ARG 193 CO 0.08 -0.06 0.68 1.52 -2.50 0.00 0.00 175.30 175.03 1jcz s TYR 194 N 0.88 -0.53 -0.24 5.12 -0.85 -1.04 -0.59 117.35 120.11 1jcz s TYR 194 Ca -0.11 0.50 -0.18 0.00 -0.52 0.00 0.00 57.07 56.76 1jcz s TYR 194 Cb -0.15 0.52 -0.03 0.00 0.38 0.00 0.00 41.96 42.68 1jcz s TYR 194 CO 0.01 -0.73 0.52 1.03 -1.52 0.00 0.00 175.55 174.86 1jcz s ARG 195 N -2.96 4.12 0.00 -3.49 0.52 -1.26 -0.79 118.95 115.08 1jcz s ARG 195 Ca -0.01 0.37 0.00 0.00 -0.52 0.00 0.00 55.73 55.56 1jcz s ARG 195 Cb -0.01 -3.62 0.00 0.00 0.52 0.00 0.00 34.95 31.84 1jcz s ARG 195 CO -0.07 -0.28 0.00 0.41 0.02 0.00 0.00 175.30 175.38 1jcz n GLY 196 N 4.19 5.43 3.32 -3.53 0.00 0.50 -4.93 105.19 110.17 1jcz n GLY 196 Ca -0.04 -0.91 -0.19 0.00 0.00 0.00 0.00 46.02 44.88 1jcz n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jcz s SER 197 N 1.09 1.58 0.45 1.61 1.04 -0.80 -1.94 113.70 116.74 1jcz s SER 197 Ca 0.00 -1.64 -0.23 0.00 0.48 0.00 0.00 55.95 54.56 1jcz s SER 197 Cb 0.00 0.48 -0.08 0.00 0.10 0.00 0.00 66.02 66.52 1jcz s SER 197 CO 0.00 -0.97 1.14 -0.76 0.98 0.00 0.00 173.24 173.63 1jcz s LEU 198 N -3.38 4.01 -0.04 2.42 1.43 -0.65 -4.46 118.68 118.01 1jcz s LEU 198 Ca 0.37 2.25 0.17 0.00 -1.03 0.00 0.00 54.13 55.88 1jcz s LEU 198 Cb 0.04 -4.26 0.55 0.00 0.03 0.00 0.00 46.19 42.55 1jcz s LEU 198 CO 0.21 -0.86 1.45 0.35 0.23 0.00 0.00 176.35 177.73 1jcz n THR 199 N -0.48 1.08 -4.12 5.49 -2.24 -1.26 -4.37 114.28 108.39 1jcz n THR 199 Ca 0.07 -0.86 -0.10 0.00 -2.27 0.00 0.00 64.05 60.89 1jcz n THR 199 Cb 0.49 0.26 -0.10 0.00 -2.10 0.00 0.00 70.33 68.87 1jcz n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1jcz s THR 200 N -1.44 0.54 0.56 4.28 -4.23 -1.26 -4.67 115.64 109.41 1jcz s THR 200 Ca 0.41 -1.65 -0.20 0.00 -1.18 0.00 0.00 61.69 59.06 1jcz s THR 200 Cb 0.23 -1.32 -0.06 0.00 1.34 0.00 0.00 72.50 72.70 1jcz s THR 200 CO 0.24 -0.76 1.03 -2.65 -0.54 0.00 0.00 174.62 171.94 1jcz n PRO 201 N 0.43 1.11 0.00 3.99 -0.02 -1.26 -0.31 135.00 138.94 1jcz n PRO 201 Ca -0.16 0.42 0.03 0.00 -2.02 0.00 0.00 63.50 61.78 1jcz n PRO 201 Cb 0.59 -2.20 0.21 0.00 -0.02 0.00 0.00 33.50 32.08 1jcz n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1jcz n PRO 202 N -0.76 0.78 -2.79 0.52 -0.04 -1.26 -4.98 135.00 126.46 1jcz n PRO 202 Ca 0.12 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.38 1jcz n PRO 202 Cb 0.45 -1.14 0.01 0.00 -0.04 0.00 0.00 33.50 32.78 1jcz n PRO 202 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jcz n ASN 204 N -2.22 3.72 -2.98 0.00 4.13 -1.26 -4.33 115.26 112.31 1jcz n ASN 204 Ca -0.14 1.10 -0.32 0.00 1.68 0.00 0.00 54.58 56.90 1jcz n ASN 204 Cb 0.63 -1.55 -0.06 0.00 -1.54 0.00 0.00 39.78 37.26 1jcz n ASN 204 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1jcz n PRO 205 N 3.09 3.33 -0.14 3.52 -0.04 -1.26 -1.64 135.00 141.86 1jcz n PRO 205 Ca 0.13 -2.03 0.06 0.00 -0.04 0.00 0.00 63.50 61.63 1jcz n PRO 205 Cb 0.34 -2.57 0.09 0.00 -0.04 0.00 0.00 33.50 31.32 1jcz n PRO 205 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1jcz n THR 206 N 3.06 1.31 -3.88 0.52 -2.24 -1.12 -4.82 114.28 107.11 1jcz n THR 206 Ca 0.68 -1.54 -0.35 0.00 -2.27 0.00 0.00 64.05 60.56 1jcz n THR 206 Cb 0.41 0.07 -0.11 0.00 -2.10 0.00 0.00 70.33 68.60 1jcz n THR 206 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1jcz s VAL 207 N -1.92 4.76 -0.45 2.28 1.01 -0.82 -1.69 120.40 123.58 1jcz s VAL 207 Ca 0.20 -0.03 -0.20 0.00 0.00 0.00 0.00 61.98 61.94 1jcz s VAL 207 Cb 0.17 -3.19 0.03 0.00 0.00 0.00 0.00 36.38 33.39 1jcz s VAL 207 CO 0.02 0.40 0.62 -0.22 0.00 0.00 0.00 175.10 175.92 1jcz s LEU 208 N 0.88 4.58 0.09 3.92 2.96 -0.17 -0.37 118.68 130.58 1jcz s LEU 208 Ca 0.04 -0.44 -0.21 0.00 -0.22 0.00 0.00 54.13 53.31 1jcz s LEU 208 Cb -0.14 -2.66 -0.07 0.00 0.50 0.00 0.00 46.19 43.82 1jcz s LEU 208 CO 0.03 -0.78 0.62 0.26 -1.32 0.00 0.00 176.35 175.16 1jcz s TRP 209 N 2.75 3.83 -0.28 5.38 0.52 0.03 -1.88 118.94 129.28 1jcz s TRP 209 Ca 0.21 1.36 -0.01 0.00 0.02 0.00 0.00 56.10 57.68 1jcz s TRP 209 Cb -0.15 -2.57 0.09 0.00 -1.15 0.00 0.00 33.47 29.69 1jcz s TRP 209 CO 0.18 0.56 0.07 0.99 0.02 0.00 0.00 176.95 178.77 1jcz s THR 210 N -1.07 0.82 -0.33 2.01 2.01 -0.67 -2.48 115.64 115.93 1jcz s THR 210 Ca 0.31 -1.19 -0.10 0.00 0.31 0.00 0.00 61.69 61.02 1jcz s THR 210 Cb -0.20 -1.52 0.00 0.00 0.01 0.00 0.00 72.50 70.79 1jcz s THR 210 CO 0.21 -0.54 0.16 -0.69 -0.69 0.00 0.00 174.62 173.07 1jcz s VAL 211 N 1.67 4.55 0.29 3.82 1.01 -0.29 -0.52 120.40 130.93 1jcz s VAL 211 Ca 0.06 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.18 1jcz s VAL 211 Cb -0.17 -3.39 -0.11 0.00 0.00 0.00 0.00 36.38 32.71 1jcz s VAL 211 CO -0.21 -0.02 1.47 -0.36 0.00 0.00 0.00 175.10 175.98 1jcz s PHE 212 N 1.59 2.89 0.19 5.22 0.40 -0.67 -0.31 117.98 127.29 1jcz s PHE 212 Ca 0.04 1.04 -0.12 0.00 -0.60 0.00 0.00 56.93 57.29 1jcz s PHE 212 Cb -0.18 -3.90 0.12 0.00 0.51 0.00 0.00 43.02 39.57 1jcz s PHE 212 CO 0.06 -2.84 1.86 -0.09 0.70 0.00 0.00 175.22 174.91 1jcz h ARG 213 N 4.43 0.84 -5.77 0.44 2.43 -1.60 -3.43 114.38 111.72 1jcz h ARG 213 Ca -0.47 -0.05 -0.61 0.00 -0.81 0.00 0.00 59.98 58.04 1jcz h ARG 213 Cb 1.22 -0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 30.51 1jcz h ARG 213 CO 0.74 0.55 -0.27 -0.80 -1.51 0.00 0.00 179.97 178.69 1jcz s ASN 214 N -5.77 6.62 0.64 -3.80 0.01 -1.26 -5.03 114.94 106.35 1jcz s ASN 214 Ca -0.13 0.74 -0.08 0.00 -0.71 0.00 0.00 52.86 52.68 1jcz s ASN 214 Cb 0.14 -2.21 0.02 0.00 0.41 0.00 0.00 41.25 39.61 1jcz s ASN 214 CO 0.76 0.23 0.97 -2.16 -1.51 0.00 0.00 177.10 175.39 1jcz s PRO 215 N -0.39 2.81 0.38 -0.60 0.04 -1.26 -4.63 135.00 131.35 1jcz s PRO 215 Ca 0.21 0.10 0.08 0.00 0.04 0.00 0.00 61.00 61.43 1jcz s PRO 215 Cb -0.15 -2.18 -0.02 0.00 0.04 0.00 0.00 34.50 32.19 1jcz s PRO 215 CO 0.09 -0.87 0.37 0.14 0.04 0.00 0.00 177.00 176.77 1jcz s VAL 216 N -3.13 3.07 0.06 -0.36 -7.23 -0.12 -4.73 120.40 107.97 1jcz s VAL 216 Ca 0.56 -1.30 0.09 0.00 -1.81 0.00 0.00 61.98 59.51 1jcz s VAL 216 Cb -0.11 -3.08 -0.03 0.00 0.56 0.00 0.00 36.38 33.72 1jcz s VAL 216 CO 0.47 -0.07 -0.24 -1.10 -0.31 0.00 0.00 175.10 173.85 1jcz s GLN 217 N -4.10 1.53 0.04 4.82 -0.21 -1.26 -1.40 119.66 119.07 1jcz s GLN 217 Ca 0.46 -1.10 0.01 0.00 0.02 0.00 0.00 55.36 54.75 1jcz s GLN 217 Cb -0.05 -1.74 -0.02 0.00 1.00 0.00 0.00 33.01 32.19 1jcz s GLN 217 CO 0.28 0.44 -0.06 0.96 -2.12 0.00 0.00 175.29 174.79 1jcz s ILE 218 N -0.88 0.38 0.76 1.08 -4.36 -0.72 -4.30 121.20 113.16 1jcz s ILE 218 Ca 0.10 -1.11 -0.11 0.00 -0.26 0.00 0.00 60.65 59.28 1jcz s ILE 218 Cb -0.10 -0.59 0.05 0.00 1.25 0.00 0.00 42.46 43.07 1jcz s ILE 218 CO 0.03 -0.49 1.09 -0.94 0.24 0.00 0.00 174.94 174.87 1jcz s SER 219 N -1.69 4.60 0.36 4.36 1.04 -1.15 0.54 113.70 121.76 1jcz s SER 219 Ca -0.10 1.79 0.08 0.00 0.48 0.00 0.00 55.95 58.20 1jcz s SER 219 Cb -0.08 -2.51 0.80 0.00 0.10 0.00 0.00 66.02 64.33 1jcz s SER 219 CO -0.01 -1.97 1.89 1.56 0.98 0.00 0.00 173.24 175.69 1jcz h GLN 220 N -1.08 0.69 -0.45 4.02 4.20 -1.94 -0.22 115.11 120.33 1jcz h GLN 220 Ca -0.44 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.18 1jcz h GLN 220 Cb 1.23 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.84 1jcz h GLN 220 CO 0.52 0.46 0.09 0.93 -0.67 0.00 0.00 178.83 180.15 1jcz h GLU 221 N 0.71 0.73 -0.34 1.46 3.07 -1.94 -0.25 114.58 118.03 1jcz h GLU 221 Ca 0.42 -0.19 -0.04 0.00 -0.50 0.00 0.00 59.36 59.05 1jcz h GLU 221 Cb 0.62 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 1jcz h GLU 221 CO -0.18 0.75 0.07 1.96 -1.40 0.00 0.00 179.01 180.21 1jcz h GLN 222 N 0.60 0.55 -0.68 2.33 4.20 -1.51 -0.95 115.11 119.65 1jcz h GLN 222 Ca 0.14 -0.14 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1jcz h GLN 222 Cb 0.36 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 1jcz h GLN 222 CO 0.01 0.62 0.32 1.25 -0.67 0.00 0.00 178.83 180.36 1jcz h LEU 223 N 0.39 0.90 -0.74 1.46 5.85 -1.01 -1.41 115.31 120.75 1jcz h LEU 223 Ca 0.10 -0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 1jcz h LEU 223 Cb 0.33 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1jcz h LEU 223 CO 0.00 0.79 0.17 0.25 -0.34 0.00 0.00 178.44 179.31 1jcz h LEU 224 N 0.95 1.07 -0.35 2.25 5.85 -0.89 -0.73 115.31 123.45 1jcz h LEU 224 Ca 0.23 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1jcz h LEU 224 Cb 0.13 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1jcz h LEU 224 CO -0.03 1.02 0.22 0.00 -0.34 0.00 0.00 178.44 179.31 1jcz h ALA 225 N 1.11 0.45 -0.83 1.25 0.00 -0.78 -0.70 119.26 119.75 1jcz h ALA 225 Ca 0.22 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1jcz h ALA 225 Cb 0.37 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1jcz h ALA 225 CO 0.00 -0.06 0.41 1.25 0.00 0.00 0.00 179.25 180.85 1jcz h LEU 226 N 0.46 1.08 -0.29 0.00 5.85 -0.90 0.21 115.31 121.71 1jcz h LEU 226 Ca 0.13 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1jcz h LEU 226 Cb -0.00 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.75 1jcz h LEU 226 CO -0.02 0.90 0.00 -0.33 -0.34 0.00 0.00 178.44 178.65 1jcz h GLU 227 N 1.18 0.00 0.00 1.25 5.08 -0.71 -3.37 114.58 118.01 1jcz h GLU 227 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1jcz h GLU 227 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1jcz h GLU 227 CO -0.04 0.00 -0.09 0.25 -1.00 0.00 0.00 179.01 178.13 1jcz n THR 228 N -2.65 0.00 0.13 1.13 -2.24 -0.31 -4.77 114.28 105.58 1jcz n THR 228 Ca 0.04 -0.37 0.01 0.00 -2.27 0.00 0.00 64.05 61.46 1jcz n THR 228 Cb 0.42 0.94 0.08 0.00 -2.10 0.00 0.00 70.33 69.66 1jcz n THR 228 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jcz h ALA 229 N 0.00 0.69 -2.73 6.98 0.00 -0.75 -3.47 119.26 119.99 1jcz h ALA 229 Ca 0.00 -0.53 -0.58 0.00 0.00 0.00 0.00 54.91 53.80 1jcz h ALA 229 Cb 0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 1jcz h ALA 229 CO 0.00 0.73 -0.59 -0.51 0.00 0.00 0.00 179.25 178.88 1jcz s LEU 230 N -6.70 3.67 0.11 0.00 1.43 -1.26 -4.66 118.68 111.26 1jcz s LEU 230 Ca 0.02 -0.21 0.07 0.00 -1.03 0.00 0.00 54.13 52.98 1jcz s LEU 230 Cb 0.09 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 1jcz s LEU 230 CO 0.75 0.07 -0.17 -0.31 0.23 0.00 0.00 176.35 176.92 1jcz s TYR 231 N -1.76 1.55 -2.69 0.29 1.51 0.03 -0.87 117.35 115.41 1jcz s TYR 231 Ca 0.30 -0.47 0.25 0.00 -1.01 0.00 0.00 57.07 56.14 1jcz s TYR 231 Cb -0.10 -0.83 0.56 0.00 -0.11 0.00 0.00 41.96 41.48 1jcz s TYR 231 CO 0.22 0.17 1.47 0.00 -1.11 0.00 0.00 175.55 176.30 1jcz s THR 233 N -1.90 4.87 0.80 0.00 -4.23 -1.25 -4.63 115.64 109.30 1jcz s THR 233 Ca 0.33 -1.08 -0.11 0.00 -1.18 0.00 0.00 61.69 59.65 1jcz s THR 233 Cb 0.20 -3.59 0.08 0.00 1.34 0.00 0.00 72.50 70.53 1jcz s THR 233 CO 0.31 -0.25 1.09 -1.00 -0.54 0.00 0.00 174.62 174.23 1jcz s HIS 234 N -1.94 2.55 0.28 3.99 3.76 -1.26 -2.00 115.29 120.65 1jcz s HIS 234 Ca 0.33 1.44 -0.30 0.00 -0.15 0.00 0.00 55.06 56.39 1jcz s HIS 234 Cb -0.09 -3.07 -0.13 0.00 1.11 0.00 0.00 32.58 30.40 1jcz s HIS 234 CO 0.27 -1.94 1.35 -0.12 -0.85 0.00 0.00 174.74 173.45 1jcz n MET 235 N -3.60 2.04 -1.72 1.40 1.56 -1.26 -2.37 117.12 113.17 1jcz n MET 235 Ca 0.08 0.72 -0.18 0.00 -0.27 0.00 0.00 57.70 58.05 1jcz n MET 235 Cb 0.54 -2.34 -0.06 0.00 2.15 0.00 0.00 33.22 33.50 1jcz n MET 235 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1jcz n ASP 236 N 1.65 -5.24 -4.77 6.12 8.00 -1.26 -4.97 116.55 116.07 1jcz n ASP 236 Ca 0.09 0.35 -0.40 0.00 0.71 0.00 0.00 54.79 55.53 1jcz n ASP 236 Cb 0.33 -4.35 -0.01 0.00 -0.02 0.00 0.00 41.12 37.07 1jcz n ASP 236 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1jcz s ASP 237 N -2.66 6.49 0.53 -2.24 -1.08 -1.00 -4.88 116.67 111.83 1jcz s ASP 237 Ca 0.00 2.80 0.20 0.00 -0.52 0.00 0.00 52.55 55.04 1jcz s ASP 237 Cb 0.00 -2.65 1.36 0.00 -1.46 0.00 0.00 42.92 40.17 1jcz s ASP 237 CO 0.00 -0.74 2.11 -0.65 0.52 0.00 0.00 175.17 176.41 1jcz h PRO 238 N 3.05 0.00 -2.42 4.34 0.11 -1.93 -3.24 132.00 131.91 1jcz h PRO 238 Ca -0.50 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.02 1jcz h PRO 238 Cb 1.24 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.94 1jcz h PRO 238 CO 0.64 0.00 -0.77 0.43 -0.21 0.00 0.00 178.00 178.09 1jcz n SER 239 N -4.41 2.02 -4.71 -2.05 7.64 -1.26 -5.11 113.62 105.74 1jcz n SER 239 Ca 0.01 -3.03 -0.42 0.00 1.01 0.00 0.00 58.87 56.44 1jcz n SER 239 Cb 0.26 -0.67 -0.01 0.00 -1.01 0.00 0.00 64.21 62.78 1jcz n SER 239 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1jcz n PRO 240 N 1.62 2.21 -4.12 1.43 -0.02 -1.23 -5.00 135.00 129.89 1jcz n PRO 240 Ca 0.25 0.78 -0.28 0.00 -2.02 0.00 0.00 63.50 62.23 1jcz n PRO 240 Cb 0.43 -2.39 -0.17 0.00 -0.02 0.00 0.00 33.50 31.36 1jcz n PRO 240 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1jcz s ARG 240 N -1.78 1.90 0.44 -0.52 0.52 -1.26 -5.05 118.95 113.19 1jcz s ARG 240 Ca 0.56 -0.42 -0.24 0.00 -0.52 0.00 0.00 55.73 55.12 1jcz s ARG 240 Cb -0.56 -1.77 -0.08 0.00 0.52 0.00 0.00 34.95 33.06 1jcz s ARG 240 CO 0.61 -0.19 1.19 -1.21 0.02 0.00 0.00 175.30 175.73 1jcz s GLU 240 N 1.39 3.86 -0.64 3.54 2.02 -1.26 -0.97 118.70 126.63 1jcz s GLU 240 Ca 0.01 1.86 -0.22 0.00 0.02 0.00 0.00 54.97 56.63 1jcz s GLU 240 Cb -0.13 -2.53 0.08 0.00 0.10 0.00 0.00 34.13 31.64 1jcz s GLU 240 CO -0.06 -0.49 0.90 1.41 0.02 0.00 0.00 175.26 177.03 1jcz s MET 241 N -2.52 3.11 0.12 1.61 -2.45 -0.05 -4.55 119.30 114.58 1jcz s MET 241 Ca 0.61 -0.92 -0.03 0.00 -1.25 0.00 0.00 55.69 54.10 1jcz s MET 241 Cb -0.31 -4.23 -0.03 0.00 1.25 0.00 0.00 34.83 31.52 1jcz s MET 241 CO 0.38 -1.73 0.10 0.96 1.05 0.00 0.00 175.02 175.79 1jcz s ILE 242 N 3.72 0.11 -1.63 10.11 -4.36 -1.26 -4.78 121.20 123.12 1jcz s ILE 242 Ca 0.20 -1.74 -0.16 0.00 -0.26 0.00 0.00 60.65 58.69 1jcz s ILE 242 Cb -0.18 -1.89 0.12 0.00 1.25 0.00 0.00 42.46 41.76 1jcz s ILE 242 CO 0.10 -0.51 0.82 0.59 0.24 0.00 0.00 174.94 176.18 1jcz n ASN 243 N -0.09 -3.51 -3.58 4.36 3.02 -0.05 -4.84 115.26 110.57 1jcz n ASN 243 Ca -0.08 -0.94 -0.41 0.00 -0.03 0.00 0.00 54.58 53.13 1jcz n ASN 243 Cb 0.63 -3.13 0.00 0.00 -0.61 0.00 0.00 39.78 36.68 1jcz n ASN 243 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1jcz n ASN 244 N -2.74 7.51 -3.95 6.41 6.94 -0.92 -4.88 115.26 123.64 1jcz n ASN 244 Ca 0.03 -3.26 -0.10 0.00 -0.02 0.00 0.00 54.58 51.24 1jcz n ASN 244 Cb 0.52 -1.33 -0.10 0.00 -2.36 0.00 0.00 39.78 36.50 1jcz n ASN 244 CO 0.00 0.00 0.00 0.72 -1.03 0.00 0.00 177.26 176.95 1jcz s PHE 245 N -1.67 0.20 0.18 -2.53 -0.12 -1.26 -4.27 117.98 108.51 1jcz s PHE 245 Ca 0.48 -0.45 -0.13 0.00 -0.05 0.00 0.00 56.93 56.79 1jcz s PHE 245 Cb 0.17 -0.15 -0.07 0.00 -0.63 0.00 0.00 43.02 42.33 1jcz s PHE 245 CO -0.08 -0.26 0.55 0.50 -0.05 0.00 0.00 175.22 175.88 1jcz s ARG 246 N -1.79 3.91 0.63 1.99 3.52 -1.26 -5.04 118.95 120.91 1jcz s ARG 246 Ca -0.12 0.42 -0.17 0.00 -0.13 0.00 0.00 55.73 55.73 1jcz s ARG 246 Cb -0.07 -2.81 -0.01 0.00 -1.56 0.00 0.00 34.95 30.50 1jcz s ARG 246 CO -0.01 0.41 1.15 -0.65 -0.81 0.00 0.00 175.30 175.38 1jcz s GLN 247 N -2.30 2.86 0.46 5.12 -1.52 -1.26 -4.76 119.66 118.25 1jcz s GLN 247 Ca 0.42 1.57 -0.24 0.00 -1.95 0.00 0.00 55.36 55.16 1jcz s GLN 247 Cb -0.13 -1.94 -0.07 0.00 -0.22 0.00 0.00 33.01 30.64 1jcz s GLN 247 CO 0.20 -1.24 1.30 0.14 -0.25 0.00 0.00 175.29 175.44 1jcz s VAL 248 N -2.03 2.50 0.18 1.09 -7.23 -1.26 -4.41 120.40 109.25 1jcz s VAL 248 Ca 0.71 0.41 0.04 0.00 -1.81 0.00 0.00 61.98 61.33 1jcz s VAL 248 Cb -0.24 -3.23 -0.03 0.00 0.56 0.00 0.00 36.38 33.44 1jcz s VAL 248 CO 0.37 0.03 0.26 -1.10 -0.31 0.00 0.00 175.10 174.35 1jcz s GLN 249 N -2.55 3.26 0.49 4.82 -1.52 0.65 -4.97 119.66 119.84 1jcz s GLN 249 Ca 0.63 -0.74 -0.23 0.00 -1.95 0.00 0.00 55.36 53.07 1jcz s GLN 249 Cb -0.37 -2.84 -0.06 0.00 -0.22 0.00 0.00 33.01 29.52 1jcz s GLN 249 CO 0.46 0.48 1.24 0.15 -0.25 0.00 0.00 175.29 177.38 1jcz s LYS 250 N -3.43 3.53 -0.30 2.91 1.02 -1.26 -4.53 119.74 117.67 1jcz s LYS 250 Ca 0.33 1.96 -0.00 0.00 0.02 0.00 0.00 55.97 58.28 1jcz s LYS 250 Cb -0.10 -2.36 0.13 0.00 -0.52 0.00 0.00 37.83 34.99 1jcz s LYS 250 CO 0.27 -0.79 0.28 0.12 -0.92 0.00 0.00 175.35 174.31 1jcz s PHE 251 N -1.45 -0.29 0.00 3.18 5.36 -1.26 -4.83 117.98 118.69 1jcz s PHE 251 Ca 0.66 -0.41 0.00 0.00 -0.96 0.00 0.00 56.93 56.22 1jcz s PHE 251 Cb -0.33 -0.53 0.00 0.00 -0.34 0.00 0.00 43.02 41.82 1jcz s PHE 251 CO 0.40 -0.91 0.00 -0.25 -1.46 0.00 0.00 175.22 173.00 1jcz n ASP 252 N 5.11 0.00 -3.96 6.13 8.00 -1.26 -4.92 116.55 125.65 1jcz n ASP 252 Ca -0.00 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.14 1jcz n ASP 252 Cb 0.45 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.58 1jcz n ASP 252 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1jcz n GLU 253 N 0.00 0.00 -1.77 -1.24 4.07 -1.26 -4.77 120.64 115.67 1jcz n GLU 253 Ca 0.00 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.68 1jcz n GLU 253 Cb 0.00 -0.97 -0.01 0.00 -0.06 0.00 0.00 31.44 30.40 1jcz n GLU 253 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 1jcz n ARG 254 N 2.16 2.64 -0.78 5.31 0.63 -1.26 -4.60 116.66 120.75 1jcz n ARG 254 Ca 0.01 -2.57 -0.03 0.00 -0.92 0.00 0.00 57.85 54.33 1jcz n ARG 254 Cb 0.52 -3.27 0.20 0.00 0.45 0.00 0.00 32.46 30.36 1jcz n ARG 254 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1jcz n LEU 255 N 6.96 4.15 -4.20 6.15 4.77 -1.20 -4.84 117.00 128.78 1jcz n LEU 255 Ca 0.51 -3.69 -0.34 0.00 -0.03 0.00 0.00 56.01 52.45 1jcz n LEU 255 Cb 0.41 -0.63 -0.15 0.00 -2.33 0.00 0.00 43.42 40.72 1jcz n LEU 255 CO 0.90 1.19 -0.44 -0.69 -1.33 0.00 0.00 177.39 177.02 1jcz s VAL 256 N -3.21 2.74 0.13 4.08 1.01 -0.81 -4.51 120.40 119.83 1jcz s VAL 256 Ca 0.45 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1jcz s VAL 256 Cb 0.40 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1jcz s VAL 256 CO 0.01 0.37 0.09 -0.31 0.00 0.00 0.00 175.10 175.26 1jcz s TYR 257 N 1.36 3.12 0.08 5.22 1.51 0.24 -0.54 117.35 128.35 1jcz s TYR 257 Ca 0.03 0.01 0.08 0.00 -1.01 0.00 0.00 57.07 56.18 1jcz s TYR 257 Cb -0.15 -1.54 -0.03 0.00 -0.11 0.00 0.00 41.96 40.13 1jcz s TYR 257 CO -0.07 0.52 -0.21 0.95 -1.11 0.00 0.00 175.55 175.63 1jcz s THR 258 N -1.58 1.69 -2.11 -0.71 -4.23 -0.39 0.56 115.64 108.87 1jcz s THR 258 Ca 0.30 -1.43 0.17 0.00 -1.18 0.00 0.00 61.69 59.54 1jcz s THR 258 Cb -0.11 -1.51 0.44 0.00 1.34 0.00 0.00 72.50 72.65 1jcz s THR 258 CO 0.22 0.02 1.40 -1.54 -0.54 0.00 0.00 174.62 174.18 1jcz n SER 259 N 1.32 2.53 -4.25 3.99 3.41 -0.81 -0.48 113.62 119.34 1jcz n SER 259 Ca -0.19 -1.94 -0.14 0.00 -0.26 0.00 0.00 58.87 56.34 1jcz n SER 259 Cb 0.53 -0.28 -0.10 0.00 -0.26 0.00 0.00 64.21 64.11 1jcz n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1jcz s PHE 260 N -1.45 1.27 0.00 7.33 -0.12 -1.26 -4.86 117.98 118.90 1jcz s PHE 260 Ca 0.33 -1.15 0.00 0.00 -0.05 0.00 0.00 56.93 56.06 1jcz s PHE 260 Cb 0.18 -0.72 0.00 0.00 -0.63 0.00 0.00 43.02 41.85 1jcz s PHE 260 CO 0.24 -0.35 0.47 -1.13 -0.05 0.00 0.00 175.22 174.40