#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 -0.04 0.19 2.13 1.48 -1.26 -4.98 118.94 116.46 1jcz s TRP 5 Ca 0.00 -0.25 0.02 0.00 -1.06 0.00 0.00 56.10 54.81 1jcz s TRP 5 Cb 0.00 0.09 -0.01 0.00 -1.16 0.00 0.00 33.47 32.39 1jcz s TRP 5 CO 0.00 -0.57 0.22 0.25 -4.06 0.00 0.00 176.95 172.79 1jcz n THR 6 N 0.12 0.00 0.33 0.66 -2.24 -0.64 -5.02 114.28 107.49 1jcz n THR 6 Ca -0.17 -1.20 0.06 0.00 -2.27 0.00 0.00 64.05 60.48 1jcz n THR 6 Cb 0.62 0.66 0.09 0.00 -2.10 0.00 0.00 70.33 69.59 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 -0.34 0.15 -3.67 4.78 4.02 -1.26 -3.72 117.16 117.11 1jcz n TYR 7 Ca 0.02 -0.14 -0.14 0.00 -0.01 0.00 0.00 57.90 57.63 1jcz n TYR 7 Cb 0.34 -0.01 -0.08 0.00 -0.02 0.00 0.00 39.34 39.57 1jcz n TYR 7 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 1jcz s PHE 8 N -1.05 -0.49 0.00 -0.72 5.36 -1.26 -4.61 117.98 115.21 1jcz s PHE 8 Ca 0.18 1.02 0.00 0.00 -0.96 0.00 0.00 56.93 57.18 1jcz s PHE 8 Cb 0.12 0.22 0.00 0.00 -0.34 0.00 0.00 43.02 43.02 1jcz s PHE 8 CO 0.17 -0.39 0.00 0.41 -1.46 0.00 0.00 175.22 173.95 1jcz n GLY 9 N 1.93 -1.80 0.34 13.12 0.00 -1.26 -4.31 105.19 113.22 1jcz n GLY 9 Ca -0.17 -1.86 0.13 0.00 0.00 0.00 0.00 46.02 44.12 1jcz n GLY 9 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1jcz h PRO 10 N 0.00 0.66 -0.75 1.61 0.11 -2.01 -0.80 132.00 130.82 1jcz h PRO 10 Ca 0.00 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 65.90 1jcz h PRO 10 Cb 0.00 -0.15 -0.10 0.00 0.11 0.00 0.00 31.00 30.86 1jcz h PRO 10 CO 0.00 0.44 0.21 -0.25 -0.21 0.00 0.00 178.00 178.19 1jcz n ASP 11 N -4.82 4.76 -3.59 -2.05 8.00 -1.26 -4.73 116.55 112.85 1jcz n ASP 11 Ca 0.24 -3.07 -0.30 0.00 0.71 0.00 0.00 54.79 52.36 1jcz n ASP 11 Cb 0.61 -0.72 0.25 0.00 -0.02 0.00 0.00 41.12 41.24 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 -0.85 1.59 0.52 0.44 0.00 -0.31 -1.62 107.32 107.09 1jcz s GLY 12 Ca 0.51 -1.09 0.26 0.00 0.00 0.00 0.00 44.72 44.40 1jcz s GLY 12 CO 0.13 -0.13 1.97 1.05 0.00 0.00 0.00 173.10 176.11 1jcz h GLU 13 N -2.75 0.04 0.00 2.90 4.11 -1.82 0.82 114.58 117.88 1jcz h GLU 13 Ca -0.42 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.01 1jcz h GLU 13 Cb 1.28 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1jcz h GLU 13 CO 0.28 0.02 0.00 0.09 0.07 0.00 0.00 179.01 179.48 1jcz n ASN 14 N -4.36 0.12 -0.28 3.06 4.13 -1.26 -2.93 115.26 113.73 1jcz n ASN 14 Ca 0.12 0.52 0.05 0.00 1.68 0.00 0.00 54.58 56.96 1jcz n ASN 14 Cb 0.68 -0.55 0.01 0.00 -1.54 0.00 0.00 39.78 38.38 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 -1.62 1.39 -0.35 6.41 7.64 0.26 -4.64 113.62 122.72 1jcz n SER 15 Ca 0.05 -1.20 0.06 0.00 1.01 0.00 0.00 58.87 58.79 1jcz n SER 15 Cb 0.26 0.38 0.22 0.00 -1.01 0.00 0.00 64.21 64.06 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 1.40 1.08 0.00 1.43 6.55 -1.37 -2.07 115.95 122.97 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 0.39 -0.34 0.00 0.00 -0.86 0.00 0.00 29.16 28.35 1jcz h TRP 16 CO 0.00 0.43 0.04 0.66 -1.05 0.00 0.00 178.44 178.53 1jcz h SER 17 N 0.96 0.00 -0.38 -3.49 4.64 -1.81 0.20 113.55 113.67 1jcz h SER 17 Ca 0.47 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.77 1jcz h SER 17 Cb 0.45 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 1jcz h SER 17 CO -0.26 0.00 0.12 0.11 -0.87 0.00 0.00 176.83 175.94 1jcz h LYS 18 N 0.00 0.58 0.00 4.77 1.57 -1.71 -3.27 116.57 118.51 1jcz h LYS 18 Ca 0.00 -0.12 -0.15 0.00 -1.87 0.00 0.00 60.65 58.51 1jcz h LYS 18 Cb 0.09 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1jcz h LYS 18 CO 0.00 0.58 -2.10 1.63 -0.57 0.00 0.00 179.45 178.99 1jcz n LYS 19 N -4.63 0.73 -3.87 3.15 5.02 -0.94 -4.76 118.16 112.87 1jcz n LYS 19 Ca -0.01 -0.11 -0.29 0.00 -2.02 0.00 0.00 58.31 55.88 1jcz n LYS 19 Cb 0.17 -1.49 -0.13 0.00 -0.02 0.00 0.00 35.03 33.56 1jcz n LYS 19 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1jcz s TYR 20 N -3.01 2.92 0.31 2.13 1.51 0.66 -4.99 117.35 116.88 1jcz s TYR 20 Ca -0.08 -3.01 0.08 0.00 -1.01 0.00 0.00 57.07 53.04 1jcz s TYR 20 Cb 0.10 -2.53 0.89 0.00 -0.11 0.00 0.00 41.96 40.31 1jcz s TYR 20 CO 0.82 -0.71 1.66 -1.35 -1.11 0.00 0.00 175.55 174.86 1jcz h PRO 21 N 6.31 0.28 0.00 -1.71 0.11 -1.80 -0.38 132.00 134.81 1jcz h PRO 21 Ca -0.01 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1jcz h PRO 21 Cb 0.87 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.92 1jcz h PRO 21 CO 0.64 0.19 -0.03 0.77 -0.21 0.00 0.00 178.00 179.35 1jcz h SER 22 N 0.29 0.00 0.54 -2.05 0.02 -1.89 -0.89 113.55 109.57 1jcz h SER 22 Ca 0.64 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.59 1jcz h SER 22 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 1jcz h SER 22 CO -0.62 0.03 0.00 0.00 -1.14 0.00 0.00 176.83 175.10 1jcz n GLY 24 N -0.42 3.13 0.00 0.00 0.00 -0.35 -4.80 105.19 102.75 1jcz n GLY 24 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 0.09 1.62 3.92 -0.02 0.00 -0.12 -5.12 105.19 105.56 1jcz n GLY 25 Ca 0.12 -1.87 -0.27 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 2.95 -1.58 0.99 1.43 -1.26 -4.47 118.68 116.74 1jcz s LEU 26 Ca 0.00 0.64 -0.11 0.00 -1.03 0.00 0.00 54.13 53.63 1jcz s LEU 26 Cb 0.00 -3.36 0.09 0.00 0.03 0.00 0.00 46.19 42.95 1jcz s LEU 26 CO 0.00 -1.41 0.66 0.18 0.23 0.00 0.00 176.35 176.01 1jcz n LEU 27 N -2.84 -1.97 -4.80 1.79 4.77 -1.26 -4.67 117.00 108.01 1jcz n LEU 27 Ca 0.07 -0.99 -0.35 0.00 -0.03 0.00 0.00 56.01 54.71 1jcz n LEU 27 Cb 0.59 -2.18 -0.06 0.00 -2.33 0.00 0.00 43.42 39.44 1jcz n LEU 27 CO 0.53 0.36 0.67 -1.10 -1.33 0.00 0.00 177.39 176.52 1jcz s GLN 28 N -6.77 4.29 0.23 3.23 -1.52 -1.26 -2.15 119.66 115.72 1jcz s GLN 28 Ca 0.45 1.25 0.09 0.00 -1.95 0.00 0.00 55.36 55.20 1jcz s GLN 28 Cb -0.24 -2.40 -0.05 0.00 -0.22 0.00 0.00 33.01 30.10 1jcz s GLN 28 CO 0.91 0.02 -0.15 -1.12 -0.25 0.00 0.00 175.29 174.69 1jcz s SER 29 N -1.92 2.85 0.91 5.90 0.01 -1.26 -4.71 113.70 115.48 1jcz s SER 29 Ca 0.58 -1.04 -0.11 0.00 1.31 0.00 0.00 55.95 56.69 1jcz s SER 29 Cb -0.14 -0.18 0.20 0.00 0.21 0.00 0.00 66.02 66.11 1jcz s SER 29 CO 0.19 -0.14 1.24 -2.16 0.41 0.00 0.00 173.24 172.78 1jcz s PRO 30 N -3.62 0.75 0.14 12.44 0.04 -1.26 -4.63 135.00 138.86 1jcz s PRO 30 Ca 0.25 -0.76 -0.04 0.00 0.04 0.00 0.00 61.00 60.49 1jcz s PRO 30 Cb -0.01 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 1jcz s PRO 30 CO 0.09 -2.25 0.13 0.96 0.04 0.00 0.00 177.00 175.98 1jcz s ILE 31 N -3.70 0.09 -0.05 0.56 -4.36 -1.26 -0.37 121.20 112.10 1jcz s ILE 31 Ca 0.74 -1.71 -0.19 0.00 -0.26 0.00 0.00 60.65 59.22 1jcz s ILE 31 Cb -0.03 -1.94 -0.05 0.00 1.25 0.00 0.00 42.46 41.69 1jcz s ILE 31 CO 0.51 -0.43 0.54 -0.62 0.24 0.00 0.00 174.94 175.18 1jcz s ASP 32 N -3.01 6.85 -0.49 4.36 2.15 -1.26 -3.09 116.67 122.17 1jcz s ASP 32 Ca 0.21 1.01 -0.16 0.00 0.43 0.00 0.00 52.55 54.04 1jcz s ASP 32 Cb 0.06 -2.33 0.09 0.00 -0.30 0.00 0.00 42.92 40.44 1jcz s ASP 32 CO 0.01 0.06 0.44 -0.76 -0.17 0.00 0.00 175.17 174.75 1jcz s LEU 33 N 0.15 5.74 0.07 -1.34 1.43 0.92 -4.94 118.68 120.71 1jcz s LEU 33 Ca 0.29 -1.43 0.03 0.00 -1.03 0.00 0.00 54.13 51.99 1jcz s LEU 33 Cb -0.17 -2.20 -0.03 0.00 0.03 0.00 0.00 46.19 43.82 1jcz s LEU 33 CO 0.14 -0.72 -0.09 -1.38 0.23 0.00 0.00 176.35 174.53 1jcz s HIS 34 N 1.69 0.86 0.20 0.29 -3.43 -1.26 -0.31 115.29 113.34 1jcz s HIS 34 Ca 0.04 -0.61 -0.09 0.00 -0.80 0.00 0.00 55.06 53.60 1jcz s HIS 34 Cb -0.26 -0.50 0.29 0.00 -1.43 0.00 0.00 32.58 30.69 1jcz s HIS 34 CO 0.06 -0.06 1.19 -1.13 -2.00 0.00 0.00 174.74 172.80 1jcz n SER 35 N 0.94 -0.35 -0.18 7.38 3.41 -1.26 -1.49 113.62 122.06 1jcz n SER 35 Ca -0.19 1.33 0.25 0.00 -0.26 0.00 0.00 58.87 59.99 1jcz n SER 35 Cb 0.56 -0.37 0.65 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 0.13 -0.16 4.04 5.19 -2.01 -1.99 116.42 121.62 1jcz h ASP 36 Ca 0.33 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.76 1jcz h ASP 36 Cb 0.53 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.03 1jcz h ASP 36 CO -0.78 0.05 0.00 2.30 -3.12 0.00 0.00 179.24 177.69 1jcz n ILE 37 N -4.36 1.98 -4.42 0.35 -6.64 -0.55 -4.99 119.36 100.73 1jcz n ILE 37 Ca 0.18 -1.90 -0.34 0.00 -1.77 0.00 0.00 62.75 58.92 1jcz n ILE 37 Cb 0.84 -0.15 -0.10 0.00 -1.44 0.00 0.00 39.64 38.80 1jcz n ILE 37 CO 0.00 0.00 0.00 -0.76 -1.77 0.00 0.00 176.55 174.02 1jcz s LEU 38 N -2.61 3.44 -0.10 7.28 1.43 -0.75 -0.42 118.68 126.96 1jcz s LEU 38 Ca 0.35 0.05 -0.05 0.00 -1.03 0.00 0.00 54.13 53.45 1jcz s LEU 38 Cb 0.29 -1.83 0.05 0.00 0.03 0.00 0.00 46.19 44.72 1jcz s LEU 38 CO 0.07 0.35 0.23 -1.58 0.23 0.00 0.00 176.35 175.64 1jcz s GLN 39 N -1.06 0.17 0.19 1.70 2.00 -0.43 -4.93 119.66 117.29 1jcz s GLN 39 Ca 0.15 0.52 -0.30 0.00 -2.00 0.00 0.00 55.36 53.73 1jcz s GLN 39 Cb -0.11 -0.13 -0.08 0.00 0.80 0.00 0.00 33.01 33.48 1jcz s GLN 39 CO 0.04 -0.18 1.28 -0.47 -0.50 0.00 0.00 175.29 175.46 1jcz s TYR 40 N 1.40 3.31 -0.32 1.67 5.04 -1.26 -0.79 117.35 126.39 1jcz s TYR 40 Ca -0.08 1.27 0.01 0.00 -2.44 0.00 0.00 57.07 55.83 1jcz s TYR 40 Cb -0.11 -3.55 0.10 0.00 0.35 0.00 0.00 41.96 38.75 1jcz s TYR 40 CO -0.08 -1.68 0.09 0.34 -1.34 0.00 0.00 175.55 172.88 1jcz s ASP 41 N 0.33 4.21 0.31 4.32 3.68 0.15 -4.84 116.67 124.83 1jcz s ASP 41 Ca 0.56 -1.81 0.18 0.00 2.13 0.00 0.00 52.55 53.60 1jcz s ASP 41 Cb -0.35 -1.07 0.97 0.00 -1.45 0.00 0.00 42.92 41.02 1jcz s ASP 41 CO 0.37 -0.40 1.50 0.00 0.13 0.00 0.00 175.17 176.78 1jcz n ALA 42 N 4.64 0.89 0.98 3.66 0.00 -1.26 -1.39 120.51 128.03 1jcz n ALA 42 Ca -0.00 0.17 0.13 0.00 0.00 0.00 0.00 53.44 53.74 1jcz n ALA 42 Cb 0.42 -1.11 0.52 0.00 0.00 0.00 0.00 19.45 19.27 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 -2.15 0.16 -4.55 0.00 3.41 -1.26 -4.70 113.62 104.53 1jcz n SER 43 Ca -0.01 0.31 -0.39 0.00 -0.26 0.00 0.00 58.87 58.52 1jcz n SER 43 Cb 0.13 -0.31 -0.03 0.00 -0.26 0.00 0.00 64.21 63.74 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 -3.06 3.25 0.59 1.04 1.43 -0.49 -4.98 118.68 116.47 1jcz s LEU 44 Ca 0.13 -0.39 -0.07 0.00 -1.03 0.00 0.00 54.13 52.77 1jcz s LEU 44 Cb 0.18 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.85 1jcz s LEU 44 CO 0.58 -2.06 0.92 0.42 0.23 0.00 0.00 176.35 176.43 1jcz s THR 45 N 7.16 3.84 0.35 5.49 -4.23 -1.26 -4.79 115.64 122.20 1jcz s THR 45 Ca 0.51 0.13 -0.28 0.00 -1.18 0.00 0.00 61.69 60.87 1jcz s THR 45 Cb -0.08 -3.53 -0.11 0.00 1.34 0.00 0.00 72.50 70.13 1jcz s THR 45 CO 0.11 -0.57 1.39 -2.84 -0.54 0.00 0.00 174.62 172.18 1jcz s PRO 46 N -5.02 4.23 0.42 3.99 0.02 -1.26 -5.01 135.00 132.37 1jcz s PRO 46 Ca 0.54 2.39 -0.13 0.00 0.02 0.00 0.00 61.00 63.82 1jcz s PRO 46 Cb -0.11 -3.02 -0.07 0.00 0.02 0.00 0.00 34.50 31.32 1jcz s PRO 46 CO 0.46 -0.36 0.82 -0.51 -0.33 0.00 0.00 177.00 177.09 1jcz s LEU 47 N -1.94 3.82 -0.13 -5.54 1.43 -1.26 -4.84 118.68 110.21 1jcz s LEU 47 Ca 0.51 1.28 0.00 0.00 -1.03 0.00 0.00 54.13 54.89 1jcz s LEU 47 Cb -0.43 -4.16 -0.01 0.00 0.03 0.00 0.00 46.19 41.62 1jcz s LEU 47 CO 0.58 -0.41 -0.15 -1.61 0.23 0.00 0.00 176.35 174.99 1jcz s GLU 48 N -3.75 3.32 -0.37 1.70 2.02 0.85 -4.96 118.70 117.50 1jcz s GLU 48 Ca 0.54 -0.72 -0.12 0.00 0.02 0.00 0.00 54.97 54.69 1jcz s GLU 48 Cb -0.10 -2.59 0.02 0.00 0.10 0.00 0.00 34.13 31.55 1jcz s GLU 48 CO 0.29 0.18 0.23 -0.06 0.02 0.00 0.00 175.26 175.92 1jcz s PHE 49 N 0.43 3.23 -0.04 1.61 0.40 -1.26 -0.29 117.98 122.05 1jcz s PHE 49 Ca -0.11 -0.73 0.00 0.00 -0.60 0.00 0.00 56.93 55.50 1jcz s PHE 49 Cb -0.16 -2.48 -0.03 0.00 0.51 0.00 0.00 43.02 40.86 1jcz s PHE 49 CO 0.05 -0.58 -0.02 -0.65 0.70 0.00 0.00 175.22 174.72 1jcz s GLN 50 N 1.62 2.82 -0.94 0.44 -1.52 -0.07 -4.50 119.66 117.50 1jcz s GLN 50 Ca 0.04 -0.54 0.00 0.00 -1.95 0.00 0.00 55.36 52.91 1jcz s GLN 50 Cb -0.19 -2.68 0.00 0.00 -0.22 0.00 0.00 33.01 29.93 1jcz s GLN 50 CO 0.08 0.66 0.00 0.41 -0.25 0.00 0.00 175.29 176.19 1jcz n GLY 50 N 1.85 1.01 0.22 3.09 0.00 -1.26 -0.12 105.19 109.98 1jcz n GLY 50 Ca -0.17 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.51 1.61 -1.99 -1.89 -3.39 116.97 109.80 1jcz h TYR 51 Ca -0.18 0.00 -0.68 0.00 2.00 0.00 0.00 58.73 59.87 1jcz h TYR 51 Cb 0.76 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 39.36 1jcz h TYR 51 CO 0.36 0.16 1.62 1.21 -0.00 0.00 0.00 178.16 181.51 1jcz s ASN 52 N -6.13 6.80 0.34 3.88 2.47 -1.26 -1.14 114.94 119.91 1jcz s ASN 52 Ca 0.03 -2.33 -0.29 0.00 0.42 0.00 0.00 52.86 50.69 1jcz s ASN 52 Cb 0.08 -2.50 -0.11 0.00 -1.45 0.00 0.00 41.25 37.27 1jcz s ASN 52 CO 0.64 -1.11 1.37 -0.76 -3.72 0.00 0.00 177.10 173.53 1jcz s LEU 53 N 3.42 4.39 0.22 3.21 1.43 -0.97 -4.89 118.68 125.49 1jcz s LEU 53 Ca 0.46 2.81 -0.31 0.00 -1.03 0.00 0.00 54.13 56.06 1jcz s LEU 53 Cb -0.00 -3.65 -0.11 0.00 0.03 0.00 0.00 46.19 42.46 1jcz s LEU 53 CO -0.01 -0.65 1.59 -0.55 0.23 0.00 0.00 176.35 176.96 1jcz s SER 54 N -0.35 6.50 0.00 2.29 0.15 -1.26 -3.15 113.70 117.88 1jcz s SER 54 Ca 0.50 2.75 0.18 0.00 0.70 0.00 0.00 55.95 60.09 1jcz s SER 54 Cb -0.42 -2.61 0.86 0.00 -1.71 0.00 0.00 66.02 62.14 1jcz s SER 54 CO 0.56 -0.86 1.56 0.00 1.20 0.00 0.00 173.24 175.70 1jcz n ALA 54 N 3.31 1.92 0.88 5.45 0.00 -1.24 -1.90 120.51 128.94 1jcz n ALA 54 Ca 0.12 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.60 1jcz n ALA 54 Cb 0.38 -1.29 0.29 0.00 0.00 0.00 0.00 19.45 18.83 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 -1.36 2.48 -4.51 0.00 5.03 -1.26 -4.33 115.26 111.30 1jcz n ASN 54 Ca 0.07 -1.84 -0.29 0.00 0.87 0.00 0.00 54.58 53.40 1jcz n ASN 54 Cb 0.17 -0.14 -0.11 0.00 -1.02 0.00 0.00 39.78 38.68 1jcz n ASN 54 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1jcz s LYS 55 N -1.72 1.86 -0.06 3.52 1.02 -0.80 -5.02 119.74 118.54 1jcz s LYS 55 Ca 0.35 -1.18 0.02 0.00 0.02 0.00 0.00 55.97 55.17 1jcz s LYS 55 Cb 0.20 -2.14 -0.03 0.00 -0.52 0.00 0.00 37.83 35.34 1jcz s LYS 55 CO 0.29 0.47 -0.09 -0.65 -0.92 0.00 0.00 175.35 174.46 1jcz s GLN 56 N -2.28 2.68 -0.06 1.68 -1.52 -1.26 -1.05 119.66 117.84 1jcz s GLN 56 Ca 0.20 -0.59 0.06 0.00 -1.95 0.00 0.00 55.36 53.08 1jcz s GLN 56 Cb -0.10 -2.53 -0.01 0.00 -0.22 0.00 0.00 33.01 30.15 1jcz s GLN 56 CO 0.11 0.65 -0.25 -0.06 -0.25 0.00 0.00 175.29 175.50 1jcz s PHE 57 N -0.79 2.45 -0.08 0.91 0.40 0.61 -4.90 117.98 116.58 1jcz s PHE 57 Ca 0.12 -0.78 -0.30 0.00 -0.60 0.00 0.00 56.93 55.38 1jcz s PHE 57 Cb -0.11 -1.61 -0.03 0.00 0.51 0.00 0.00 43.02 41.78 1jcz s PHE 57 CO 0.01 -0.25 1.28 -1.17 0.70 0.00 0.00 175.22 175.80 1jcz s LEU 58 N -0.08 4.26 -0.17 -0.37 2.96 -1.26 -0.54 118.68 123.47 1jcz s LEU 58 Ca -0.06 1.86 -0.06 0.00 -0.22 0.00 0.00 54.13 55.65 1jcz s LEU 58 Cb -0.14 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1jcz s LEU 58 CO 0.05 -0.68 0.03 -0.22 -1.32 0.00 0.00 176.35 174.21 1jcz s LEU 59 N 2.72 3.65 0.02 -0.68 2.96 0.54 -0.66 118.68 127.24 1jcz s LEU 59 Ca 0.58 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.53 1jcz s LEU 59 Cb -0.26 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 1jcz s LEU 59 CO 0.21 0.17 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.46 1jcz s THR 60 N 0.35 0.52 -0.44 3.68 2.01 0.13 -0.93 115.64 120.97 1jcz s THR 60 Ca 0.01 -0.74 -0.14 0.00 0.31 0.00 0.00 61.69 61.13 1jcz s THR 60 Cb -0.13 -0.53 0.05 0.00 0.01 0.00 0.00 72.50 71.90 1jcz s THR 60 CO 0.01 -0.17 0.33 0.21 -0.69 0.00 0.00 174.62 174.31 1jcz s ASN 61 N -0.98 6.05 -0.06 3.53 3.84 -0.85 -0.31 114.94 126.16 1jcz s ASN 61 Ca -0.05 -1.15 0.16 0.00 0.21 0.00 0.00 52.86 52.04 1jcz s ASN 61 Cb -0.07 -2.14 0.59 0.00 -0.55 0.00 0.00 41.25 39.07 1jcz s ASN 61 CO 0.00 -0.54 1.48 -0.46 -2.79 0.00 0.00 177.10 174.79 1jcz n ASN 62 N 5.14 3.81 0.00 -4.21 0.23 -1.10 -0.14 115.26 118.99 1jcz n ASN 62 Ca -0.12 -2.25 0.00 0.00 -0.53 0.00 0.00 54.58 51.68 1jcz n ASN 62 Cb 0.45 -0.49 0.00 0.00 -2.08 0.00 0.00 39.78 37.66 1jcz n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1jcz n GLY 63 N 1.16 1.38 0.00 4.83 0.00 -1.26 -4.78 105.19 106.52 1jcz n GLY 63 Ca 0.21 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 -3.82 1.61 8.25 -1.26 -4.66 115.22 113.34 1jcz n HIS 64 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 1jcz n HIS 64 Cb 0.00 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.12 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 -1.30 -1.24 -4.49 0.41 2.88 -1.26 -4.91 113.62 103.72 1jcz n SER 65 Ca 0.00 -1.60 -0.35 0.00 -1.33 0.00 0.00 58.87 55.59 1jcz n SER 65 Cb 0.19 2.00 -0.12 0.00 -0.75 0.00 0.00 64.21 65.54 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 -2.16 4.15 0.02 2.46 0.11 -1.26 -2.72 120.40 121.00 1jcz s VAL 66 Ca 0.18 -0.25 0.09 0.00 -2.93 0.00 0.00 61.98 59.07 1jcz s VAL 66 Cb -0.02 -2.88 -0.03 0.00 -1.53 0.00 0.00 36.38 31.93 1jcz s VAL 66 CO 0.03 0.43 -0.26 -0.75 -3.33 0.00 0.00 175.10 171.22 1jcz s LYS 67 N 0.91 1.92 -0.17 1.54 2.20 0.58 -3.60 119.74 123.11 1jcz s LYS 67 Ca 0.02 -1.05 -0.00 0.00 -0.36 0.00 0.00 55.97 54.58 1jcz s LYS 67 Cb -0.14 -2.01 0.00 0.00 -1.51 0.00 0.00 37.83 34.18 1jcz s LYS 67 CO 0.02 0.53 -0.15 -1.17 -0.36 0.00 0.00 175.35 174.22 1jcz s LEU 68 N -1.03 2.43 0.26 5.43 2.96 -0.04 0.19 118.68 128.88 1jcz s LEU 68 Ca 0.11 -0.52 -0.30 0.00 -0.22 0.00 0.00 54.13 53.21 1jcz s LEU 68 Cb -0.10 -1.56 -0.09 0.00 0.50 0.00 0.00 46.19 44.93 1jcz s LEU 68 CO 0.01 0.04 1.13 0.20 -1.32 0.00 0.00 176.35 176.41 1jcz s ASN 69 N 1.09 7.20 0.17 3.68 0.01 0.17 -1.48 114.94 125.78 1jcz s ASN 69 Ca -0.00 2.28 0.11 0.00 -0.71 0.00 0.00 52.86 54.54 1jcz s ASN 69 Cb -0.14 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 38.85 1jcz s ASN 69 CO -0.05 -0.22 -0.25 -0.76 -1.51 0.00 0.00 177.10 174.32 1jcz s LEU 70 N -1.17 2.39 0.39 0.60 1.43 -0.57 -4.44 118.68 117.32 1jcz s LEU 70 Ca 0.47 -0.82 -0.19 0.00 -1.03 0.00 0.00 54.13 52.55 1jcz s LEU 70 Cb -0.32 -1.18 -0.10 0.00 0.03 0.00 0.00 46.19 44.61 1jcz s LEU 70 CO 0.41 0.14 0.88 -2.16 0.23 0.00 0.00 176.35 175.85 1jcz s PRO 71 N -2.45 4.17 0.00 1.29 0.04 -1.26 -4.26 135.00 132.53 1jcz s PRO 71 Ca 0.18 0.98 0.17 0.00 0.04 0.00 0.00 61.00 62.37 1jcz s PRO 71 Cb -0.09 -2.28 0.76 0.00 0.04 0.00 0.00 34.50 32.93 1jcz s PRO 71 CO 0.08 0.04 1.52 -1.13 0.04 0.00 0.00 177.00 177.56 1jcz n SER 72 N -0.51 0.00 0.04 6.66 3.41 -1.24 -2.43 113.62 119.54 1jcz n SER 72 Ca 0.06 0.36 0.13 0.00 -0.26 0.00 0.00 58.87 59.15 1jcz n SER 72 Cb 0.54 -0.43 0.53 0.00 -0.26 0.00 0.00 64.21 64.58 1jcz n SER 72 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1jcz n ASP 73 N -1.43 0.28 -4.79 4.04 3.85 -1.26 -4.47 116.55 112.76 1jcz n ASP 73 Ca 0.05 0.53 -0.37 0.00 -0.71 0.00 0.00 54.79 54.29 1jcz n ASP 73 Cb 0.18 -0.60 -0.06 0.00 -1.35 0.00 0.00 41.12 39.28 1jcz n ASP 73 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jcz s MET 74 N -3.04 4.01 0.21 0.11 0.23 -1.02 -4.46 119.30 115.33 1jcz s MET 74 Ca 0.12 0.18 -0.12 0.00 -1.03 0.00 0.00 55.69 54.84 1jcz s MET 74 Cb 0.16 -3.32 -0.00 0.00 -1.53 0.00 0.00 34.83 30.14 1jcz s MET 74 CO 0.53 0.48 0.41 -3.38 -2.03 0.00 0.00 175.02 171.02 1jcz s HIS 78 N -0.28 0.30 -0.17 3.16 -3.43 0.84 -1.09 115.29 114.61 1jcz s HIS 78 Ca 0.19 -0.66 -0.09 0.00 -0.80 0.00 0.00 55.06 53.71 1jcz s HIS 78 Cb -0.14 0.12 -0.05 0.00 -1.43 0.00 0.00 32.58 31.09 1jcz s HIS 78 CO 0.07 -0.88 0.12 0.42 -2.00 0.00 0.00 174.74 172.48 1jcz s ILE 79 N -3.98 5.34 -0.04 -5.38 1.01 -0.12 -0.89 121.20 117.15 1jcz s ILE 79 Ca 0.19 0.16 0.06 0.00 0.00 0.00 0.00 60.65 61.06 1jcz s ILE 79 Cb 0.01 -3.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 1jcz s ILE 79 CO 0.04 0.50 -0.22 -1.58 0.00 0.00 0.00 174.94 173.67 1jcz s GLN 80 N -0.07 2.32 0.00 2.79 0.74 0.60 -3.53 119.66 122.51 1jcz s GLN 80 Ca 0.10 -0.86 0.00 0.00 0.05 0.00 0.00 55.36 54.65 1jcz s GLN 80 Cb -0.11 -2.16 0.00 0.00 1.10 0.00 0.00 33.01 31.83 1jcz s GLN 80 CO 0.00 0.54 0.00 0.41 -0.55 0.00 0.00 175.29 175.69 1jcz n GLY 81 N 2.52 1.35 4.00 2.59 0.00 -1.26 -0.11 105.19 114.28 1jcz n GLY 81 Ca -0.17 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.66 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 3.33 0.52 0.99 1.43 -1.26 -4.99 118.68 118.70 1jcz s LEU 84 Ca 0.00 -0.35 0.21 0.00 -1.03 0.00 0.00 54.13 52.96 1jcz s LEU 84 Cb 0.00 -2.45 1.32 0.00 0.03 0.00 0.00 46.19 45.09 1jcz s LEU 84 CO 0.00 -1.16 2.06 -0.61 0.23 0.00 0.00 176.35 176.88 1jcz h GLN 85 N 0.19 0.02 -4.98 1.70 4.15 -2.00 -3.43 115.11 110.77 1jcz h GLN 85 Ca -0.38 -0.00 -0.34 0.00 0.77 0.00 0.00 58.65 58.70 1jcz h GLN 85 Cb 1.29 -0.00 -0.14 0.00 0.21 0.00 0.00 27.48 28.83 1jcz h GLN 85 CO 0.46 0.01 -0.67 -1.12 -1.93 0.00 0.00 178.83 175.59 1jcz s SER 86 N -6.60 1.59 0.11 -0.69 0.01 -1.26 -5.13 113.70 101.74 1jcz s SER 86 Ca -0.05 -1.17 -0.28 0.00 1.31 0.00 0.00 55.95 55.76 1jcz s SER 86 Cb 0.18 0.05 -0.06 0.00 0.21 0.00 0.00 66.02 66.40 1jcz s SER 86 CO 0.70 -0.51 0.88 -0.60 0.41 0.00 0.00 173.24 174.13 1jcz s ARG 87 N -3.87 4.64 -0.17 12.44 3.52 -1.26 -4.83 118.95 129.43 1jcz s ARG 87 Ca 0.25 1.31 0.01 0.00 -0.13 0.00 0.00 55.73 57.17 1jcz s ARG 87 Cb 0.05 -3.35 0.01 0.00 -1.56 0.00 0.00 34.95 30.10 1jcz s ARG 87 CO 0.06 0.30 -0.19 0.71 -0.81 0.00 0.00 175.30 175.36 1jcz s TYR 88 N -0.24 2.75 -0.03 5.12 1.51 -1.23 -2.42 117.35 122.81 1jcz s TYR 88 Ca 0.43 -1.45 -0.03 0.00 -1.01 0.00 0.00 57.07 55.00 1jcz s TYR 88 Cb -0.23 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.69 1jcz s TYR 88 CO 0.28 -0.70 0.17 -1.12 -1.11 0.00 0.00 175.55 173.07 1jcz s SER 89 N 1.09 6.33 0.63 2.29 0.01 0.07 -0.94 113.70 123.19 1jcz s SER 89 Ca -0.00 0.36 -0.16 0.00 1.31 0.00 0.00 55.95 57.46 1jcz s SER 89 Cb -0.14 -1.99 -0.01 0.00 0.21 0.00 0.00 66.02 64.08 1jcz s SER 89 CO -0.07 0.29 1.11 0.00 0.41 0.00 0.00 173.24 174.98 1jcz s ALA 90 N -1.26 2.52 0.00 1.44 0.00 -0.25 -0.14 121.76 124.07 1jcz s ALA 90 Ca 0.25 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1jcz s ALA 90 Cb -0.12 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.67 1jcz s ALA 90 CO 0.16 -1.16 0.00 -2.37 0.00 0.00 0.00 175.76 172.39 1jcz n THR 91 N -2.18 0.00 -3.59 0.00 5.66 -0.32 -3.72 114.28 110.13 1jcz n THR 91 Ca 0.11 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.07 1jcz n THR 91 Cb 0.52 -0.18 -0.02 0.00 -1.55 0.00 0.00 70.33 69.10 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 -1.32 0.47 0.09 1.09 1.03 -1.18 -1.51 119.66 118.33 1jcz s GLN 92 Ca 0.00 -0.20 0.04 0.00 0.04 0.00 0.00 55.36 55.24 1jcz s GLN 92 Cb 0.00 0.20 -0.03 0.00 0.03 0.00 0.00 33.01 33.20 1jcz s GLN 92 CO 0.00 -0.21 -0.10 -0.48 -2.54 0.00 0.00 175.29 171.96 1jcz s LEU 93 N -2.42 2.39 0.35 2.60 0.05 -0.55 -0.23 118.68 120.87 1jcz s LEU 93 Ca 0.10 -0.79 -0.16 0.00 0.05 0.00 0.00 54.13 53.32 1jcz s LEU 93 Cb 0.00 -0.30 0.04 0.00 -2.05 0.00 0.00 46.19 43.88 1jcz s LEU 93 CO -0.05 -0.25 0.74 -1.38 -0.55 0.00 0.00 176.35 174.85 1jcz s HIS 94 N -2.35 0.10 0.28 3.48 -3.43 -0.61 -0.86 115.29 111.92 1jcz s HIS 94 Ca 0.04 -0.68 0.04 0.00 -0.80 0.00 0.00 55.06 53.66 1jcz s HIS 94 Cb -0.03 0.72 -0.06 0.00 -1.43 0.00 0.00 32.58 31.78 1jcz s HIS 94 CO 0.00 -1.43 0.03 -0.51 -2.00 0.00 0.00 174.74 170.83 1jcz s LEU 95 N -3.04 2.15 -0.01 5.38 1.02 -1.24 -1.09 118.68 121.85 1jcz s LEU 95 Ca 0.15 -1.31 0.01 0.00 0.02 0.00 0.00 54.13 53.01 1jcz s LEU 95 Cb -0.05 -0.33 0.00 0.00 0.02 0.00 0.00 46.19 45.83 1jcz s LEU 95 CO 0.11 -0.57 -0.04 -1.00 0.02 0.00 0.00 176.35 174.87 1jcz s HIS 96 N -3.35 0.45 0.33 0.29 3.76 -0.42 -4.65 115.29 111.69 1jcz s HIS 96 Ca 0.34 -0.08 -0.08 0.00 -0.15 0.00 0.00 55.06 55.08 1jcz s HIS 96 Cb 0.07 -0.34 0.01 0.00 1.11 0.00 0.00 32.58 33.44 1jcz s HIS 96 CO 0.13 -0.04 0.55 1.67 -0.85 0.00 0.00 174.74 176.19 1jcz s TRP 97 N 0.16 0.68 0.00 1.40 -2.14 -1.22 -1.50 118.94 116.31 1jcz s TRP 97 Ca -0.01 -1.04 0.00 0.00 2.66 0.00 0.00 56.10 57.71 1jcz s TRP 97 Cb -0.05 0.19 0.00 0.00 -3.10 0.00 0.00 33.47 30.51 1jcz s TRP 97 CO -0.00 -1.20 0.00 0.41 -2.66 0.00 0.00 176.95 173.50 1jcz n GLY 98 N -0.51 0.47 3.53 3.67 0.00 -1.26 -2.03 105.19 109.06 1jcz n GLY 98 Ca -0.02 0.00 -0.09 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 -0.88 -0.19 0.40 1.61 2.20 -1.05 -0.59 114.94 116.43 1jcz s ASN 99 Ca 0.00 -0.61 0.16 0.00 -0.94 0.00 0.00 52.86 51.46 1jcz s ASN 99 Cb 0.00 0.57 1.03 0.00 -2.00 0.00 0.00 41.25 40.85 1jcz s ASN 99 CO 0.00 -1.07 1.86 -0.65 -2.94 0.00 0.00 177.10 174.30 1jcz h PRO 100 N 2.24 0.45 0.00 3.55 0.11 -1.95 -1.01 132.00 135.39 1jcz h PRO 100 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1jcz h PRO 100 Cb 1.25 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1jcz h PRO 100 CO 0.37 0.30 -0.19 0.09 -0.21 0.00 0.00 178.00 178.36 1jcz n ASN 101 N -4.53 0.59 -2.98 -2.05 3.02 -1.26 -4.38 115.26 103.67 1jcz n ASN 101 Ca 0.19 0.38 -0.13 0.00 -0.03 0.00 0.00 54.58 54.99 1jcz n ASN 101 Cb 0.65 -0.42 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 1jcz n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1jcz n ASP 102 N -2.00 -2.21 -2.91 6.41 -0.08 -0.47 -5.05 116.55 110.25 1jcz n ASP 102 Ca 0.05 -2.80 -0.25 0.00 -1.51 0.00 0.00 54.79 50.28 1jcz n ASP 102 Cb 0.40 0.90 -0.06 0.00 2.34 0.00 0.00 41.12 44.71 1jcz n ASP 102 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1jcz n PRO 102 N 2.57 2.54 -3.20 -0.67 -0.04 -0.69 -2.54 135.00 132.98 1jcz n PRO 102 Ca 0.20 -1.54 -0.23 0.00 -0.04 0.00 0.00 63.50 61.89 1jcz n PRO 102 Cb 0.55 -2.42 -0.07 0.00 -0.04 0.00 0.00 33.50 31.52 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 3.49 -0.71 -1.39 0.54 8.25 -1.26 -4.16 115.22 119.98 1jcz n HIS 103 Ca 0.54 -3.37 -0.03 0.00 -0.26 0.00 0.00 57.72 54.60 1jcz n HIS 103 Cb 0.35 -0.09 0.21 0.00 1.12 0.00 0.00 29.99 31.57 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 1.73 4.79 3.76 -1.41 0.00 -0.07 -4.75 105.19 109.23 1jcz n GLY 104 Ca 0.22 -1.20 -0.31 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.44 4.28 -0.19 1.61 1.04 -0.71 -3.40 113.70 113.89 1jcz s SER 105 Ca 0.45 1.71 -0.18 0.00 0.48 0.00 0.00 55.95 58.41 1jcz s SER 105 Cb 0.40 -2.41 -0.15 0.00 0.10 0.00 0.00 66.02 63.96 1jcz s SER 105 CO 0.01 -2.16 0.13 -0.33 0.98 0.00 0.00 173.24 171.87 1jcz h GLU 106 N -1.22 0.00 -7.03 4.02 5.08 -1.88 -3.45 114.58 110.10 1jcz h GLU 106 Ca -0.45 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.45 1jcz h GLU 106 Cb 1.24 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 1jcz h GLU 106 CO 0.53 0.72 0.36 -1.01 -1.00 0.00 0.00 179.01 178.60 1jcz s HIS 107 N -2.31 3.27 0.17 4.33 3.76 -1.26 -4.62 115.29 118.64 1jcz s HIS 107 Ca -0.24 1.62 0.08 0.00 -0.15 0.00 0.00 55.06 56.37 1jcz s HIS 107 Cb 0.04 -2.94 -0.04 0.00 1.11 0.00 0.00 32.58 30.75 1jcz s HIS 107 CO 0.48 -0.31 -0.17 0.95 -0.85 0.00 0.00 174.74 174.85 1jcz s THR 108 N -2.02 1.75 -0.16 1.30 -4.23 -1.18 -4.54 115.64 106.56 1jcz s THR 108 Ca 0.62 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.17 1jcz s THR 108 Cb -0.13 -1.85 0.02 0.00 1.34 0.00 0.00 72.50 71.88 1jcz s THR 108 CO 0.17 -0.39 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.01 1jcz s VAL 109 N -2.27 1.76 -1.47 2.29 1.01 -0.45 -0.06 120.40 121.21 1jcz s VAL 109 Ca 0.17 -0.76 -0.10 0.00 0.00 0.00 0.00 61.98 61.29 1jcz s VAL 109 Cb -0.04 -1.63 0.06 0.00 0.00 0.00 0.00 36.38 34.77 1jcz s VAL 109 CO 0.06 0.48 0.90 -1.20 0.00 0.00 0.00 175.10 175.35 1jcz n SER 110 N 4.71 -3.79 0.00 3.32 7.64 0.58 -1.02 113.62 125.06 1jcz n SER 110 Ca -0.18 -0.79 0.00 0.00 1.01 0.00 0.00 58.87 58.90 1jcz n SER 110 Cb 0.50 -3.92 0.00 0.00 -1.01 0.00 0.00 64.21 59.78 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 -1.68 1.04 3.76 0.23 0.00 -1.26 -5.01 105.19 102.27 1jcz n GLY 111 Ca -0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.16 4.05 0.48 1.61 -1.52 -0.19 -5.04 119.66 118.88 1jcz s GLN 112 Ca 0.00 -0.12 -0.10 0.00 -1.95 0.00 0.00 55.36 53.18 1jcz s GLN 112 Cb 0.00 -3.37 -0.06 0.00 -0.22 0.00 0.00 33.01 29.36 1jcz s GLN 112 CO 0.00 0.40 0.86 -1.01 -0.25 0.00 0.00 175.29 175.28 1jcz s HIS 113 N 0.06 3.52 0.43 0.91 3.76 -1.26 -1.33 115.29 121.37 1jcz s HIS 113 Ca 0.12 1.11 0.08 0.00 -0.15 0.00 0.00 55.06 56.21 1jcz s HIS 113 Cb -0.12 -2.52 -0.01 0.00 1.11 0.00 0.00 32.58 31.04 1jcz s HIS 113 CO 0.01 -0.29 0.40 -0.06 -0.85 0.00 0.00 174.74 173.95 1jcz s PHE 114 N -2.64 2.60 0.22 1.40 0.40 -1.26 -4.94 117.98 113.75 1jcz s PHE 114 Ca 0.52 -0.52 -0.08 0.00 -0.60 0.00 0.00 56.93 56.25 1jcz s PHE 114 Cb -0.10 -2.17 0.19 0.00 0.51 0.00 0.00 43.02 41.45 1jcz s PHE 114 CO 0.38 -0.20 1.88 0.00 0.70 0.00 0.00 175.22 177.98 1jcz h ALA 115 N 0.96 1.08 -3.34 5.36 0.00 -1.06 -1.80 119.26 120.46 1jcz h ALA 115 Ca -0.41 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 1jcz h ALA 115 Cb 1.27 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1jcz h ALA 115 CO 0.56 0.53 0.13 0.00 0.00 0.00 0.00 179.25 180.47 1jcz n ALA 116 N -2.36 -1.26 -3.46 0.00 0.00 -0.84 -0.89 120.51 111.70 1jcz n ALA 116 Ca 0.09 -1.38 -0.12 0.00 0.00 0.00 0.00 53.44 52.03 1jcz n ALA 116 Cb 0.05 1.10 -0.11 0.00 0.00 0.00 0.00 19.45 20.49 1jcz n ALA 116 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1jcz s GLU 117 N -2.33 0.42 -0.13 0.00 2.12 -0.57 -1.18 118.70 117.03 1jcz s GLU 117 Ca 0.20 0.64 -0.05 0.00 0.36 0.00 0.00 54.97 56.11 1jcz s GLU 117 Cb -0.04 0.11 -0.04 0.00 0.26 0.00 0.00 34.13 34.43 1jcz s GLU 117 CO 0.15 -0.10 0.07 -1.17 -0.54 0.00 0.00 175.26 173.67 1jcz s LEU 118 N 0.72 3.94 -0.15 2.70 2.96 -0.12 -1.30 118.68 127.42 1jcz s LEU 118 Ca -0.04 0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.11 1jcz s LEU 118 Cb -0.05 -1.95 0.02 0.00 0.50 0.00 0.00 46.19 44.70 1jcz s LEU 118 CO -0.05 0.32 -0.17 -1.00 -1.32 0.00 0.00 176.35 174.13 1jcz s HIS 119 N -0.52 2.37 -0.38 5.38 3.76 -0.25 -1.00 115.29 124.65 1jcz s HIS 119 Ca 0.11 -1.30 -0.07 0.00 -0.15 0.00 0.00 55.06 53.64 1jcz s HIS 119 Cb -0.12 -1.68 0.06 0.00 1.11 0.00 0.00 32.58 31.95 1jcz s HIS 119 CO 0.02 -0.66 0.19 0.42 -0.85 0.00 0.00 174.74 173.86 1jcz s ILE 120 N 1.24 3.96 -0.04 0.60 1.01 -0.09 -1.57 121.20 126.31 1jcz s ILE 120 Ca 0.01 -1.34 -0.22 0.00 0.00 0.00 0.00 60.65 59.11 1jcz s ILE 120 Cb -0.14 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 1jcz s ILE 120 CO -0.08 -0.38 0.64 -0.69 0.00 0.00 0.00 174.94 174.42 1jcz s VAL 121 N 1.39 4.98 0.15 2.92 1.01 0.68 -1.41 120.40 130.11 1jcz s VAL 121 Ca 0.02 1.32 0.06 0.00 0.00 0.00 0.00 61.98 63.37 1jcz s VAL 121 Cb -0.21 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 1jcz s VAL 121 CO 0.02 0.34 -0.13 -1.00 0.00 0.00 0.00 175.10 174.33 1jcz s HIS 122 N 0.29 1.42 0.18 5.22 3.76 -0.00 -1.17 115.29 124.98 1jcz s HIS 122 Ca 0.33 -0.62 0.08 0.00 -0.15 0.00 0.00 55.06 54.71 1jcz s HIS 122 Cb -0.18 -0.72 -0.04 0.00 1.11 0.00 0.00 32.58 32.75 1jcz s HIS 122 CO 0.17 0.17 -0.18 1.52 -0.85 0.00 0.00 174.74 175.58 1jcz s TYR 123 N -2.68 1.82 -0.78 1.40 -0.85 0.81 -1.62 117.35 115.44 1jcz s TYR 123 Ca 0.14 -0.48 -0.25 0.00 -0.52 0.00 0.00 57.07 55.95 1jcz s TYR 123 Cb -0.02 -0.89 -0.01 0.00 0.38 0.00 0.00 41.96 41.42 1jcz s TYR 123 CO 0.03 0.35 1.75 1.21 -1.52 0.00 0.00 175.55 177.37 1jcz s ASN 124 N -2.83 5.53 0.00 -0.18 3.84 -0.02 -0.75 114.94 120.53 1jcz s ASN 124 Ca 0.18 -0.35 0.26 0.00 0.21 0.00 0.00 52.86 53.16 1jcz s ASN 124 Cb -0.05 -2.55 1.10 0.00 -0.55 0.00 0.00 41.25 39.20 1jcz s ASN 124 CO 0.07 -2.30 1.82 -1.54 -2.79 0.00 0.00 177.10 172.36 1jcz n SER 125 N 12.12 0.00 0.09 -4.21 3.41 -1.02 -1.03 113.62 122.99 1jcz n SER 125 Ca 0.26 0.48 -0.13 0.00 -0.26 0.00 0.00 58.87 59.22 1jcz n SER 125 Cb 0.50 -0.49 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 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 0.29 0.00 4.04 3.32 -1.87 -3.37 116.42 118.83 1jcz h ASP 126 Ca 0.00 -0.32 -0.27 0.00 0.02 0.00 0.00 57.03 56.46 1jcz h ASP 126 Cb 0.43 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.84 1jcz h ASP 126 CO 0.00 1.25 -2.18 0.18 -1.72 0.00 0.00 179.24 176.77 1jcz n LEU 127 N -3.47 0.00 -4.27 1.55 4.77 -1.19 -5.01 117.00 109.38 1jcz n LEU 127 Ca -0.06 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.69 1jcz n LEU 127 Cb 1.00 0.37 -0.12 0.00 -2.33 0.00 0.00 43.42 42.33 1jcz n LEU 127 CO 0.52 0.37 -0.51 -0.31 -1.33 0.00 0.00 177.39 176.13 1jcz s TYR 128 N -2.60 1.72 0.28 -1.77 1.51 -0.19 -5.05 117.35 111.25 1jcz s TYR 128 Ca -0.09 -0.42 0.13 0.00 -1.01 0.00 0.00 57.07 55.68 1jcz s TYR 128 Cb 0.07 -0.94 0.53 0.00 -0.11 0.00 0.00 41.96 41.50 1jcz s TYR 128 CO 0.76 0.19 1.70 -1.00 -1.11 0.00 0.00 175.55 176.08 1jcz h PRO 129 N 4.11 0.00 -3.12 -1.71 0.13 -1.85 -3.37 132.00 126.19 1jcz h PRO 129 Ca -0.45 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.72 1jcz h PRO 129 Cb 1.18 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.25 1jcz h PRO 129 CO 0.40 0.50 0.17 0.16 -0.23 0.00 0.00 178.00 179.00 1jcz s ASP 130 N -6.79 -0.22 0.21 1.44 1.47 -1.26 -5.05 116.67 106.47 1jcz s ASP 130 Ca -0.01 -0.68 -0.08 0.00 1.18 0.00 0.00 52.55 52.96 1jcz s ASP 130 Cb 0.13 0.71 0.16 0.00 -0.34 0.00 0.00 42.92 43.58 1jcz s ASP 130 CO 0.74 -1.32 1.80 0.00 0.68 0.00 0.00 175.17 177.07 1jcz h ALA 131 N 2.05 1.04 -0.68 2.11 0.00 -1.95 -1.83 119.26 119.99 1jcz h ALA 131 Ca -0.20 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.62 1jcz h ALA 131 Cb 1.25 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.66 1jcz h ALA 131 CO 0.25 0.61 0.35 1.03 0.00 0.00 0.00 179.25 181.50 1jcz h SER 132 N 1.14 0.48 -0.16 0.00 0.87 -2.00 0.13 113.55 114.02 1jcz h SER 132 Ca 0.28 0.05 -0.22 0.00 -1.23 0.00 0.00 61.79 60.67 1jcz h SER 132 Cb 0.13 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.07 1jcz h SER 132 CO -0.03 0.29 -0.74 0.74 -0.53 0.00 0.00 176.83 176.55 1jcz h THR 133 N 0.62 1.28 0.00 2.23 2.02 -1.92 -3.27 112.91 113.86 1jcz h THR 133 Ca 0.33 -1.94 -0.10 0.00 0.77 0.00 0.00 66.41 65.47 1jcz h THR 133 Cb 0.30 1.93 -0.01 0.00 -1.74 0.00 0.00 68.15 68.62 1jcz h THR 133 CO -0.24 0.62 -0.47 0.00 0.37 0.00 0.00 175.52 175.80 1jcz h ALA 134 N 0.59 0.96 -0.97 6.16 0.00 -0.90 -3.35 119.26 121.75 1jcz h ALA 134 Ca -0.04 -0.43 0.27 0.00 0.00 0.00 0.00 54.91 54.71 1jcz h ALA 134 Cb 1.37 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.95 1jcz h ALA 134 CO 0.15 0.59 0.51 1.03 0.00 0.00 0.00 179.25 181.53 1jcz h SER 135 N 0.00 0.47 -0.47 0.00 0.87 -0.80 -1.94 113.55 111.68 1jcz h SER 135 Ca -0.00 0.17 -0.29 0.00 -1.23 0.00 0.00 61.79 60.44 1jcz h SER 135 Cb 1.00 0.12 -0.18 0.00 -0.44 0.00 0.00 62.40 62.91 1jcz h SER 135 CO 0.06 -0.05 -0.13 -0.46 -0.53 0.00 0.00 176.83 175.72 1jcz n ASN 136 N -5.03 3.31 -4.27 6.23 6.94 -1.26 -4.71 115.26 116.48 1jcz n ASN 136 Ca 0.28 -3.79 -0.17 0.00 -0.02 0.00 0.00 54.58 50.87 1jcz n ASN 136 Cb 0.83 -0.62 -0.10 0.00 -2.36 0.00 0.00 39.78 37.52 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 -3.37 1.11 0.12 -3.83 1.02 -0.73 -5.08 119.74 108.98 1jcz s LYS 137 Ca 0.48 -1.40 -0.35 0.00 0.02 0.00 0.00 55.97 54.72 1jcz s LYS 137 Cb 0.42 -0.86 -0.16 0.00 -0.52 0.00 0.00 37.83 36.70 1jcz s LYS 137 CO 0.00 0.14 1.30 0.45 -0.92 0.00 0.00 175.35 176.33 1jcz n SER 138 N 0.06 1.65 -2.56 2.83 2.88 -1.26 -0.87 113.62 116.35 1jcz n SER 138 Ca -0.12 1.12 -0.14 0.00 -1.33 0.00 0.00 58.87 58.41 1jcz n SER 138 Cb 0.59 -1.21 -0.00 0.00 -0.75 0.00 0.00 64.21 62.83 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 2.34 -2.44 0.14 -1.46 1.02 -1.26 -4.86 120.64 114.11 1jcz n GLU 139 Ca 0.17 0.58 -0.01 0.00 -0.02 0.00 0.00 57.16 57.88 1jcz n GLU 139 Cb 0.21 -5.20 0.21 0.00 -0.02 0.00 0.00 31.44 26.65 1jcz n GLU 139 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1jcz h GLY 140 N -0.14 0.05 -3.36 0.62 0.00 -1.07 -3.40 103.07 95.76 1jcz h GLY 140 Ca -0.31 -0.05 -0.31 0.00 0.00 0.00 0.00 47.33 46.66 1jcz h GLY 140 CO 0.36 0.05 -0.72 1.08 0.00 0.00 0.00 176.54 177.31 1jcz s LEU 141 N -7.83 2.45 -0.04 3.11 1.43 -0.55 -0.84 118.68 116.41 1jcz s LEU 141 Ca -0.02 -0.89 -0.01 0.00 -1.03 0.00 0.00 54.13 52.17 1jcz s LEU 141 Cb 0.13 -0.29 0.03 0.00 0.03 0.00 0.00 46.19 46.09 1jcz s LEU 141 CO 0.76 -0.30 0.07 0.00 0.23 0.00 0.00 176.35 177.11 1jcz s ALA 142 N -2.83 0.01 -0.03 4.21 0.00 -0.64 -1.11 121.76 121.38 1jcz s ALA 142 Ca 0.09 0.39 0.06 0.00 0.00 0.00 0.00 51.96 52.50 1jcz s ALA 142 Cb -0.00 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 1jcz s ALA 142 CO -0.00 -0.23 -0.20 0.08 0.00 0.00 0.00 175.76 175.41 1jcz s VAL 143 N 1.42 1.58 -0.18 0.00 1.01 -0.76 -0.82 120.40 122.64 1jcz s VAL 143 Ca -0.05 -0.83 -0.09 0.00 0.00 0.00 0.00 61.98 61.01 1jcz s VAL 143 Cb -0.12 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.89 1jcz s VAL 143 CO -0.04 0.45 0.10 -0.76 0.00 0.00 0.00 175.10 174.85 1jcz s LEU 144 N -0.31 4.08 -0.12 3.92 1.43 -0.50 -1.89 118.68 125.28 1jcz s LEU 144 Ca 0.04 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.36 1jcz s LEU 144 Cb -0.09 -2.04 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 1jcz s LEU 144 CO 0.00 0.21 -0.17 0.00 0.23 0.00 0.00 176.35 176.62 1jcz s ALA 145 N 0.18 2.44 -0.17 4.21 0.00 0.20 -0.92 121.76 127.69 1jcz s ALA 145 Ca 0.07 -0.94 -0.00 0.00 0.00 0.00 0.00 51.96 51.09 1jcz s ALA 145 Cb -0.12 -1.06 0.01 0.00 0.00 0.00 0.00 23.12 21.95 1jcz s ALA 145 CO -0.01 0.23 -0.15 0.08 0.00 0.00 0.00 175.76 175.91 1jcz s VAL 146 N 0.40 2.54 0.17 0.00 1.01 -0.17 -1.74 120.40 122.61 1jcz s VAL 146 Ca -0.13 -0.80 -0.29 0.00 0.00 0.00 0.00 61.98 60.76 1jcz s VAL 146 Cb -0.17 -2.08 -0.07 0.00 0.00 0.00 0.00 36.38 34.06 1jcz s VAL 146 CO 0.06 0.51 0.92 -0.76 0.00 0.00 0.00 175.10 175.83 1jcz s LEU 147 N 1.09 4.57 -0.08 3.92 1.43 -1.26 -0.95 118.68 127.39 1jcz s LEU 147 Ca -0.00 1.82 0.05 0.00 -1.03 0.00 0.00 54.13 54.97 1jcz s LEU 147 Cb -0.14 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.53 1jcz s LEU 147 CO -0.05 0.07 -0.24 -0.63 0.23 0.00 0.00 176.35 175.73 1jcz s ILE 148 N -0.65 2.13 0.25 -0.59 1.01 -0.32 -1.22 121.20 121.81 1jcz s ILE 148 Ca 0.42 -1.01 0.06 0.00 0.00 0.00 0.00 60.65 60.12 1jcz s ILE 148 Cb -0.24 -1.80 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 1jcz s ILE 148 CO 0.30 0.56 -0.07 -1.83 0.00 0.00 0.00 174.94 173.90 1jcz s GLU 149 N 0.10 1.46 0.12 2.79 -1.05 -0.40 -0.67 118.70 121.05 1jcz s GLU 149 Ca -0.11 -1.72 -0.30 0.00 -0.15 0.00 0.00 54.97 52.69 1jcz s GLU 149 Cb -0.16 -1.07 -0.06 0.00 -0.44 0.00 0.00 34.13 32.40 1jcz s GLU 149 CO 0.06 0.06 0.96 1.41 0.95 0.00 0.00 175.26 178.70 1jcz s MET 150 N -3.72 4.70 0.00 -4.83 -2.45 -1.26 -1.71 119.30 110.02 1jcz s MET 150 Ca 0.27 1.44 0.00 0.00 -1.25 0.00 0.00 55.69 56.16 1jcz s MET 150 Cb 0.03 -3.37 0.00 0.00 1.25 0.00 0.00 34.83 32.74 1jcz s MET 150 CO 0.10 0.23 0.00 0.41 1.05 0.00 0.00 175.02 176.81 1jcz n GLY 151 N 2.21 1.11 3.79 2.11 0.00 0.90 -4.81 105.19 110.51 1jcz n GLY 151 Ca 0.02 0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.95 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 5.75 0.34 1.61 1.04 -1.26 -3.69 113.70 119.50 1jcz s SER 152 Ca 0.00 1.96 -0.29 0.00 0.48 0.00 0.00 55.95 58.10 1jcz s SER 152 Cb 0.00 -2.55 -0.11 0.00 0.10 0.00 0.00 66.02 63.45 1jcz s SER 152 CO 0.00 -1.19 1.50 0.33 0.98 0.00 0.00 173.24 174.85 1jcz n PHE 153 N -1.72 2.85 -3.87 5.02 7.35 -1.26 -2.82 117.46 123.01 1jcz n PHE 153 Ca 0.10 0.40 -0.35 0.00 -0.76 0.00 0.00 57.45 56.84 1jcz n PHE 153 Cb 0.52 -2.54 -0.13 0.00 0.35 0.00 0.00 39.48 37.69 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 0.05 5.05 0.45 -2.13 3.84 -1.26 -4.84 114.94 116.10 1jcz s ASN 154 Ca 0.57 -1.90 0.12 0.00 0.21 0.00 0.00 52.86 51.86 1jcz s ASN 154 Cb -0.50 -1.75 1.04 0.00 -0.55 0.00 0.00 41.25 39.49 1jcz s ASN 154 CO 0.59 -0.44 2.07 -0.65 -2.79 0.00 0.00 177.10 175.88 1jcz h PRO 155 N 7.93 0.33 -0.17 0.43 0.11 -1.94 -1.79 132.00 136.90 1jcz h PRO 155 Ca -0.13 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.89 1jcz h PRO 155 Cb 1.04 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 1jcz h PRO 155 CO 0.62 0.22 -0.18 0.77 -0.21 0.00 0.00 178.00 179.21 1jcz h SER 156 N 0.34 0.45 0.61 -2.05 0.02 -1.93 -2.86 113.55 108.13 1jcz h SER 156 Ca 0.13 -0.49 -0.05 0.00 -0.84 0.00 0.00 61.79 60.54 1jcz h SER 156 Cb 0.11 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1jcz h SER 156 CO -0.03 0.85 -0.25 1.88 -1.14 0.00 0.00 176.83 178.14 1jcz h TYR 157 N 0.06 0.00 0.00 3.45 -1.99 -1.83 -2.03 116.97 114.63 1jcz h TYR 157 Ca 0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1jcz h TYR 157 Cb 0.73 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.46 1jcz h TYR 157 CO 0.08 0.25 0.00 -3.47 -0.00 0.00 0.00 178.16 175.02 1jcz n ASP 158 N -3.64 0.73 0.28 3.88 4.64 -0.70 -1.21 116.55 120.53 1jcz n ASP 158 Ca -0.01 0.66 0.18 0.00 -1.38 0.00 0.00 54.79 54.24 1jcz n ASP 158 Cb 0.38 -0.82 0.84 0.00 -1.04 0.00 0.00 41.12 40.48 1jcz n ASP 158 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 1jcz h LYS 159 N 0.00 0.00 0.00 -0.67 1.57 -1.18 -0.16 116.57 116.13 1jcz h LYS 159 Ca 0.00 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.35 1jcz h LYS 159 Cb 0.42 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.67 1jcz h LYS 159 CO 0.00 0.00 -2.43 -0.89 -0.57 0.00 0.00 179.45 175.56 1jcz n ILE 160 N -2.94 1.47 0.25 1.86 5.41 -0.44 -4.59 119.36 120.38 1jcz n ILE 160 Ca -0.01 -0.35 0.11 0.00 1.00 0.00 0.00 62.75 63.50 1jcz n ILE 160 Cb 0.20 -1.89 0.72 0.00 -0.71 0.00 0.00 39.64 37.97 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 -0.96 0.00 0.00 1.39 0.04 -1.02 -1.92 116.94 114.47 1jcz h PHE 161 Ca -0.65 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.12 1jcz h PHE 161 Cb 1.57 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.72 1jcz h PHE 161 CO -0.10 0.00 0.00 -1.13 -0.60 0.00 0.00 178.31 176.48 1jcz n SER 162 N -4.32 0.35 -0.52 2.17 3.41 -0.09 -1.92 113.62 112.71 1jcz n SER 162 Ca -0.02 0.62 0.10 0.00 -0.26 0.00 0.00 58.87 59.31 1jcz n SER 162 Cb 0.12 -0.68 0.01 0.00 -0.26 0.00 0.00 64.21 63.40 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 -1.93 0.00 -0.32 7.33 8.25 -0.72 -4.61 115.22 123.22 1jcz n HIS 163 Ca 0.01 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.55 1jcz n HIS 163 Cb 0.11 0.00 0.24 0.00 1.12 0.00 0.00 29.99 31.46 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 2.53 0.68 0.00 2.41 3.38 -1.49 -0.49 115.31 122.33 1jcz h LEU 164 Ca 0.00 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1jcz h LEU 164 Cb 0.72 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1jcz h LEU 164 CO 0.00 0.30 0.00 0.00 0.09 0.00 0.00 178.44 178.83 1jcz n GLN 165 N -4.79 0.43 -0.05 1.13 1.13 -1.26 -1.85 117.38 112.13 1jcz n GLN 165 Ca 0.18 0.00 0.05 0.00 -1.94 0.00 0.00 57.00 55.29 1jcz n GLN 165 Cb 0.43 -1.47 0.07 0.00 0.11 0.00 0.00 30.24 29.38 1jcz n GLN 165 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1jcz n HIS 166 N -0.97 0.13 -2.55 1.08 8.25 -0.19 -4.46 115.22 116.51 1jcz n HIS 166 Ca 0.10 -0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1jcz n HIS 166 Cb 0.04 -0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.19 1jcz n HIS 166 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1jcz n VAL 167 N 0.47 0.93 0.04 1.59 0.24 -0.77 -4.41 118.33 116.42 1jcz n VAL 167 Ca 0.07 -2.28 0.05 0.00 -2.04 0.00 0.00 64.34 60.13 1jcz n VAL 167 Cb 0.29 0.88 0.46 0.00 -1.47 0.00 0.00 33.84 34.00 1jcz n VAL 167 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1jcz h LYS 168 N 1.82 0.44 -6.41 7.34 1.57 -1.74 -3.41 116.57 116.17 1jcz h LYS 168 Ca -0.12 -0.03 -0.62 0.00 -1.87 0.00 0.00 60.65 58.01 1jcz h LYS 168 Cb 1.52 -0.10 -0.15 0.00 0.08 0.00 0.00 32.23 33.59 1jcz h LYS 168 CO 0.18 0.29 -0.75 0.71 -0.57 0.00 0.00 179.45 179.31 1jcz s TYR 169 N -5.42 2.46 0.15 -1.35 1.51 -1.26 -0.21 117.35 113.23 1jcz s TYR 169 Ca -0.08 -0.29 -0.34 0.00 -1.01 0.00 0.00 57.07 55.35 1jcz s TYR 169 Cb 0.17 -1.16 -0.15 0.00 -0.11 0.00 0.00 41.96 40.71 1jcz s TYR 169 CO 0.72 0.57 1.41 1.17 -1.11 0.00 0.00 175.55 178.31 1jcz n LYS 170 N -0.16 1.66 0.00 -0.62 4.81 -0.83 -1.74 118.16 121.27 1jcz n LYS 170 Ca -0.09 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 57.94 1jcz n LYS 170 Cb 0.57 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.35 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 2.72 1.98 3.82 3.14 0.00 0.80 -4.59 105.19 113.06 1jcz n GLY 171 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.53 3.80 0.07 1.61 -0.21 -0.71 -4.86 119.66 118.83 1jcz s GLN 172 Ca 0.00 1.13 0.01 0.00 0.02 0.00 0.00 55.36 56.52 1jcz s GLN 172 Cb 0.00 -2.11 -0.04 0.00 1.00 0.00 0.00 33.01 31.86 1jcz s GLN 172 CO 0.00 -0.40 -0.05 -1.21 -2.12 0.00 0.00 175.29 171.50 1jcz s GLU 173 N -3.74 0.71 0.11 2.91 2.02 -1.26 -2.00 118.70 117.45 1jcz s GLU 173 Ca 0.62 -1.23 -0.11 0.00 0.02 0.00 0.00 54.97 54.28 1jcz s GLU 173 Cb -0.13 -0.05 0.01 0.00 0.10 0.00 0.00 34.13 34.06 1jcz s GLU 173 CO 0.27 -0.05 0.26 0.00 0.02 0.00 0.00 175.26 175.77 1jcz s ALA 174 N -3.49 -0.41 -0.16 5.21 0.00 -0.10 -4.81 121.76 117.99 1jcz s ALA 174 Ca 0.08 -0.48 -0.05 0.00 0.00 0.00 0.00 51.96 51.51 1jcz s ALA 174 Cb 0.05 0.58 -0.03 0.00 0.00 0.00 0.00 23.12 23.72 1jcz s ALA 174 CO -0.06 -0.56 -0.01 -0.06 0.00 0.00 0.00 175.76 175.06 1jcz s PHE 175 N -3.86 3.08 -0.20 0.00 0.40 -1.26 -0.34 117.98 115.80 1jcz s PHE 175 Ca 0.06 -0.20 -0.03 0.00 -0.60 0.00 0.00 56.93 56.15 1jcz s PHE 175 Cb 0.04 -1.99 -0.01 0.00 0.51 0.00 0.00 43.02 41.57 1jcz s PHE 175 CO -0.10 0.01 -0.06 0.08 0.70 0.00 0.00 175.22 175.85 1jcz s VAL 176 N 0.35 3.26 0.53 -0.44 1.01 0.29 -4.89 120.40 120.51 1jcz s VAL 176 Ca -0.02 -0.54 -0.22 0.00 0.00 0.00 0.00 61.98 61.20 1jcz s VAL 176 Cb -0.14 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.73 1jcz s VAL 176 CO 0.02 0.45 1.28 -2.84 0.00 0.00 0.00 175.10 174.01 1jcz s PRO 177 N 1.28 3.29 0.50 2.72 0.02 -1.26 -0.28 135.00 141.27 1jcz s PRO 177 Ca 0.03 2.05 -0.23 0.00 0.02 0.00 0.00 61.00 62.87 1jcz s PRO 177 Cb -0.14 -2.26 -0.07 0.00 0.02 0.00 0.00 34.50 32.05 1jcz s PRO 177 CO -0.03 -1.01 1.33 0.41 -0.33 0.00 0.00 177.00 177.37 1jcz n GLY 178 N 0.62 0.69 3.48 0.52 0.00 -0.21 -4.84 105.19 105.45 1jcz n GLY 178 Ca 0.10 0.09 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 1jcz n GLY 178 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1jcz s PHE 179 N -1.26 0.78 -0.66 1.61 -0.12 -1.19 -3.60 117.98 113.54 1jcz s PHE 179 Ca 0.67 -1.07 -0.27 0.00 -0.05 0.00 0.00 56.93 56.21 1jcz s PHE 179 Cb -0.45 -0.05 0.02 0.00 -0.63 0.00 0.00 43.02 41.91 1jcz s PHE 179 CO 0.53 -0.99 1.33 1.21 -0.05 0.00 0.00 175.22 177.26 1jcz s ASN 180 N -3.13 6.15 0.60 1.98 2.47 -1.26 -2.28 114.94 119.46 1jcz s ASN 180 Ca 0.29 -0.12 0.32 0.00 0.42 0.00 0.00 52.86 53.77 1jcz s ASN 180 Cb 0.01 -2.55 1.89 0.00 -1.45 0.00 0.00 41.25 39.15 1jcz s ASN 180 CO 0.14 -1.78 2.26 0.40 -3.72 0.00 0.00 177.10 174.40 1jcz h ILE 181 N 6.20 0.45 0.00 -5.21 1.08 -1.52 -0.35 117.51 118.16 1jcz h ILE 181 Ca -0.27 -0.04 0.00 0.00 -0.39 0.00 0.00 64.86 64.16 1jcz h ILE 181 Cb 1.07 1.03 0.00 0.00 -3.07 0.00 0.00 36.82 35.84 1jcz h ILE 181 CO 1.23 0.01 0.00 -0.08 -0.69 0.00 0.00 178.15 178.62 1jcz h GLU 182 N 0.00 0.00 0.00 2.37 4.81 -1.89 -0.79 114.58 119.08 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 0.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1jcz h GLU 182 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 178.67 1jcz n GLU 183 N -3.08 0.18 0.00 1.92 1.02 -0.14 -1.68 120.64 118.86 1jcz n GLU 183 Ca -0.01 0.48 0.12 0.00 -0.02 0.00 0.00 57.16 57.72 1jcz n GLU 183 Cb 0.17 -1.89 0.30 0.00 -0.02 0.00 0.00 31.44 30.00 1jcz n GLU 183 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1jcz n LEU 184 N -2.24 0.54 -4.86 -4.62 4.77 -0.30 -4.84 117.00 105.45 1jcz n LEU 184 Ca 0.01 -0.01 -0.32 0.00 -0.03 0.00 0.00 56.01 55.67 1jcz n LEU 184 Cb 0.18 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 40.98 1jcz n LEU 184 CO 0.17 0.13 0.44 -0.76 -1.33 0.00 0.00 177.39 176.04 1jcz s LEU 185 N -2.92 3.96 1.03 2.23 1.43 -0.68 -4.96 118.68 118.78 1jcz s LEU 185 Ca 0.14 1.25 -0.17 0.00 -1.03 0.00 0.00 54.13 54.31 1jcz s LEU 185 Cb 0.18 -4.08 0.23 0.00 0.03 0.00 0.00 46.19 42.55 1jcz s LEU 185 CO 0.66 -0.29 1.30 -2.16 0.23 0.00 0.00 176.35 176.09 1jcz s PRO 186 N -3.33 0.07 0.54 1.29 0.04 -1.26 -5.01 135.00 127.33 1jcz s PRO 186 Ca 0.53 -0.43 -0.19 0.00 0.04 0.00 0.00 61.00 60.96 1jcz s PRO 186 Cb -0.10 -1.78 -0.06 0.00 0.04 0.00 0.00 34.50 32.59 1jcz s PRO 186 CO 0.23 -2.79 1.06 -1.21 0.04 0.00 0.00 177.00 174.33 1jcz s GLU 187 N -5.85 3.53 -1.11 4.56 2.02 -1.26 -4.08 118.70 116.51 1jcz s GLU 187 Ca 0.75 1.36 -0.18 0.00 0.02 0.00 0.00 54.97 56.92 1jcz s GLU 187 Cb -0.04 -2.05 -0.02 0.00 0.10 0.00 0.00 34.13 32.12 1jcz s GLU 187 CO 0.54 -0.65 0.81 0.54 0.02 0.00 0.00 175.26 176.52 1jcz n ARG 187 N -1.40 -1.37 0.06 1.61 1.74 -1.26 -4.62 116.66 111.42 1jcz n ARG 187 Ca 0.10 0.54 0.06 0.00 -0.77 0.00 0.00 57.85 57.77 1jcz n ARG 187 Cb 0.52 -4.39 0.28 0.00 -1.02 0.00 0.00 32.46 27.86 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 -3.98 1.41 0.28 0.55 -2.24 -1.26 -1.33 114.28 107.71 1jcz n THR 188 Ca -0.09 0.49 0.16 0.00 -2.27 0.00 0.00 64.05 62.35 1jcz n THR 188 Cb 0.59 -1.44 0.82 0.00 -2.10 0.00 0.00 70.33 68.20 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 2.12 1.11 -2.65 6.98 0.00 -1.94 -3.40 119.26 121.48 1jcz h ALA 189 Ca 0.00 -0.06 -0.66 0.00 0.00 0.00 0.00 54.91 54.19 1jcz h ALA 189 Cb 0.09 -0.01 -0.17 0.00 0.00 0.00 0.00 17.79 17.70 1jcz h ALA 189 CO 0.00 0.08 -0.33 -1.21 0.00 0.00 0.00 179.25 177.79 1jcz s GLU 190 N -3.99 3.61 0.25 0.00 2.02 -0.44 -4.72 118.70 115.44 1jcz s GLU 190 Ca -0.02 -0.41 -0.17 0.00 0.02 0.00 0.00 54.97 54.39 1jcz s GLU 190 Cb 0.12 -3.78 0.01 0.00 0.10 0.00 0.00 34.13 30.57 1jcz s GLU 190 CO 0.53 -0.47 0.58 1.52 0.02 0.00 0.00 175.26 177.45 1jcz s TYR 191 N 1.95 0.08 -0.05 1.61 -0.85 -1.26 -1.37 117.35 117.46 1jcz s TYR 191 Ca 0.11 -0.48 -0.02 0.00 -0.52 0.00 0.00 57.07 56.16 1jcz s TYR 191 Cb -0.17 0.43 -0.04 0.00 0.38 0.00 0.00 41.96 42.56 1jcz s TYR 191 CO 0.11 -1.09 0.08 0.71 -1.52 0.00 0.00 175.55 173.85 1jcz s TYR 192 N -3.96 3.35 -0.03 -3.49 1.51 0.10 -1.73 117.35 113.10 1jcz s TYR 192 Ca 0.16 0.29 0.01 0.00 -1.01 0.00 0.00 57.07 56.52 1jcz s TYR 192 Cb -0.03 -1.80 0.02 0.00 -0.11 0.00 0.00 41.96 40.04 1jcz s TYR 192 CO 0.07 0.58 -0.03 0.50 -1.11 0.00 0.00 175.55 175.56 1jcz s ARG 193 N -1.40 0.54 0.07 -0.62 6.06 0.96 -1.24 118.95 123.31 1jcz s ARG 193 Ca 0.19 -0.04 -0.26 0.00 -2.50 0.00 0.00 55.73 53.12 1jcz s ARG 193 Cb -0.12 -0.62 0.09 0.00 0.06 0.00 0.00 34.95 34.36 1jcz s ARG 193 CO 0.09 -0.07 0.78 1.52 -2.50 0.00 0.00 175.30 175.12 1jcz s TYR 194 N 0.80 -0.41 -0.18 5.12 -0.85 -1.10 -1.65 117.35 119.07 1jcz s TYR 194 Ca -0.09 0.24 -0.19 0.00 -0.52 0.00 0.00 57.07 56.51 1jcz s TYR 194 Cb -0.12 0.55 -0.03 0.00 0.38 0.00 0.00 41.96 42.74 1jcz s TYR 194 CO -0.01 -0.68 0.56 1.03 -1.52 0.00 0.00 175.55 174.94 1jcz s ARG 195 N -3.38 4.23 0.00 -3.49 0.52 -1.26 -0.93 118.95 114.64 1jcz s ARG 195 Ca 0.04 0.51 0.00 0.00 -0.52 0.00 0.00 55.73 55.76 1jcz s ARG 195 Cb -0.01 -3.55 0.00 0.00 0.52 0.00 0.00 34.95 31.91 1jcz s ARG 195 CO -0.10 -0.14 0.00 0.41 0.02 0.00 0.00 175.30 175.49 1jcz n GLY 196 N 3.75 5.09 3.33 -3.53 0.00 0.71 -4.86 105.19 109.67 1jcz n GLY 196 Ca -0.04 -0.97 -0.19 0.00 0.00 0.00 0.00 46.02 44.83 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 1.20 1.56 0.48 1.61 1.04 -0.91 -1.74 113.70 116.94 1jcz s SER 197 Ca 0.00 -1.61 -0.22 0.00 0.48 0.00 0.00 55.95 54.60 1jcz s SER 197 Cb 0.00 0.44 -0.07 0.00 0.10 0.00 0.00 66.02 66.50 1jcz s SER 197 CO 0.00 -0.93 1.20 -0.76 0.98 0.00 0.00 173.24 173.72 1jcz s LEU 198 N -3.38 3.97 -0.03 2.42 1.43 -0.78 -4.51 118.68 117.80 1jcz s LEU 198 Ca 0.36 2.38 0.17 0.00 -1.03 0.00 0.00 54.13 56.01 1jcz s LEU 198 Cb 0.04 -4.27 0.55 0.00 0.03 0.00 0.00 46.19 42.54 1jcz s LEU 198 CO 0.19 -1.06 1.45 0.35 0.23 0.00 0.00 176.35 177.52 1jcz n THR 199 N -0.64 1.05 -4.15 5.49 -2.24 -1.26 -4.35 114.28 108.19 1jcz n THR 199 Ca 0.08 -0.86 -0.13 0.00 -2.27 0.00 0.00 64.05 60.87 1jcz n THR 199 Cb 0.48 0.27 -0.11 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 -1.42 0.78 0.53 4.28 -4.23 -1.26 -4.67 115.64 109.65 1jcz s THR 200 Ca 0.41 -1.57 -0.20 0.00 -1.18 0.00 0.00 61.69 59.14 1jcz s THR 200 Cb 0.23 -1.25 -0.07 0.00 1.34 0.00 0.00 72.50 72.75 1jcz s THR 200 CO 0.25 -0.59 0.94 -2.65 -0.54 0.00 0.00 174.62 172.03 1jcz n PRO 201 N 0.64 1.04 0.00 3.99 -0.02 -1.26 -0.38 135.00 139.01 1jcz n PRO 201 Ca -0.17 0.39 0.01 0.00 -2.02 0.00 0.00 63.50 61.71 1jcz n PRO 201 Cb 0.58 -2.08 0.03 0.00 -0.02 0.00 0.00 33.50 32.00 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 -0.48 0.90 -2.72 0.52 -0.04 -1.26 -4.99 135.00 126.92 1jcz n PRO 202 Ca 0.12 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.37 1jcz n PRO 202 Cb 0.44 -1.02 0.01 0.00 -0.04 0.00 0.00 33.50 32.89 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 -2.20 3.58 -2.75 0.00 4.13 -1.26 -4.35 115.26 112.41 1jcz n ASN 204 Ca -0.16 1.08 -0.27 0.00 1.68 0.00 0.00 54.58 56.90 1jcz n ASN 204 Cb 0.64 -1.51 -0.09 0.00 -1.54 0.00 0.00 39.78 37.28 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 3.56 3.01 -0.09 3.52 -0.04 -1.26 -1.87 135.00 141.84 1jcz n PRO 205 Ca 0.16 -1.81 0.08 0.00 -0.04 0.00 0.00 63.50 61.88 1jcz n PRO 205 Cb 0.32 -2.43 0.11 0.00 -0.04 0.00 0.00 33.50 31.46 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 2.87 1.59 -4.00 0.52 -2.24 -1.12 -4.82 114.28 107.07 1jcz n THR 206 Ca 0.62 -1.88 -0.35 0.00 -2.27 0.00 0.00 64.05 60.17 1jcz n THR 206 Cb 0.53 -0.05 -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 -2.34 4.51 -0.41 2.28 1.01 -0.71 -1.48 120.40 123.26 1jcz s VAL 207 Ca 0.24 -0.13 -0.19 0.00 0.00 0.00 0.00 61.98 61.90 1jcz s VAL 207 Cb 0.21 -3.05 0.02 0.00 0.00 0.00 0.00 36.38 33.56 1jcz s VAL 207 CO 0.02 0.43 0.57 -0.22 0.00 0.00 0.00 175.10 175.90 1jcz s LEU 208 N 0.73 4.53 0.06 3.92 2.96 -0.27 -0.21 118.68 130.41 1jcz s LEU 208 Ca 0.03 -0.32 -0.18 0.00 -0.22 0.00 0.00 54.13 53.44 1jcz s LEU 208 Cb -0.14 -2.63 -0.06 0.00 0.50 0.00 0.00 46.19 43.86 1jcz s LEU 208 CO 0.02 -0.67 0.54 0.26 -1.32 0.00 0.00 176.35 175.18 1jcz s TRP 209 N 2.58 3.79 -0.24 5.38 0.52 -0.10 -1.82 118.94 129.05 1jcz s TRP 209 Ca 0.20 1.22 -0.02 0.00 0.02 0.00 0.00 56.10 57.51 1jcz s TRP 209 Cb -0.15 -2.45 0.07 0.00 -1.15 0.00 0.00 33.47 29.79 1jcz s TRP 209 CO 0.16 0.60 0.05 0.99 0.02 0.00 0.00 176.95 178.77 1jcz s THR 210 N -1.11 0.70 -0.27 2.01 2.01 -0.79 -2.69 115.64 115.50 1jcz s THR 210 Ca 0.28 -0.89 -0.08 0.00 0.31 0.00 0.00 61.69 61.31 1jcz s THR 210 Cb -0.19 -1.30 -0.02 0.00 0.01 0.00 0.00 72.50 71.00 1jcz s THR 210 CO 0.18 -0.37 0.08 -0.69 -0.69 0.00 0.00 174.62 173.13 1jcz s VAL 211 N 1.75 4.31 0.44 3.82 1.01 -0.38 -0.63 120.40 130.73 1jcz s VAL 211 Ca 0.02 -0.28 -0.24 0.00 0.00 0.00 0.00 61.98 61.48 1jcz s VAL 211 Cb -0.17 -3.07 -0.08 0.00 0.00 0.00 0.00 36.38 33.06 1jcz s VAL 211 CO -0.15 0.26 1.24 -0.36 0.00 0.00 0.00 175.10 176.09 1jcz s PHE 212 N 1.60 2.82 0.14 5.22 0.40 -0.71 0.00 117.98 127.45 1jcz s PHE 212 Ca 0.06 1.48 -0.14 0.00 -0.60 0.00 0.00 56.93 57.72 1jcz s PHE 212 Cb -0.16 -3.53 0.00 0.00 0.51 0.00 0.00 43.02 39.84 1jcz s PHE 212 CO 0.04 -1.84 1.61 -0.09 0.70 0.00 0.00 175.22 175.64 1jcz h ARG 213 N 2.31 0.75 -5.97 0.44 2.43 -1.54 -3.44 114.38 109.36 1jcz h ARG 213 Ca -0.49 -0.21 -0.62 0.00 -0.81 0.00 0.00 59.98 57.85 1jcz h ARG 213 Cb 1.25 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 30.66 1jcz h ARG 213 CO 0.61 0.78 -0.26 -0.80 -1.51 0.00 0.00 179.97 178.79 1jcz s ASN 214 N -6.18 6.69 0.52 -3.80 0.01 -1.26 -5.03 114.94 105.89 1jcz s ASN 214 Ca -0.13 0.83 -0.04 0.00 -0.71 0.00 0.00 52.86 52.81 1jcz s ASN 214 Cb 0.11 -2.20 -0.01 0.00 0.41 0.00 0.00 41.25 39.56 1jcz s ASN 214 CO 0.79 0.31 0.81 -2.16 -1.51 0.00 0.00 177.10 175.34 1jcz s PRO 215 N -1.27 3.18 0.38 -0.60 0.04 -1.26 -4.58 135.00 130.88 1jcz s PRO 215 Ca 0.24 -0.03 0.08 0.00 0.04 0.00 0.00 61.00 61.33 1jcz s PRO 215 Cb -0.15 -2.37 -0.02 0.00 0.04 0.00 0.00 34.50 32.00 1jcz s PRO 215 CO 0.13 -0.42 0.36 0.14 0.04 0.00 0.00 177.00 177.24 1jcz s VAL 216 N -2.81 3.11 0.06 -0.36 -7.23 -0.36 -4.74 120.40 108.07 1jcz s VAL 216 Ca 0.50 -1.32 0.09 0.00 -1.81 0.00 0.00 61.98 59.44 1jcz s VAL 216 Cb -0.10 -3.09 -0.03 0.00 0.56 0.00 0.00 36.38 33.71 1jcz s VAL 216 CO 0.43 -0.08 -0.23 -1.10 -0.31 0.00 0.00 175.10 173.81 1jcz s GLN 217 N -4.09 1.83 0.07 4.82 -0.21 -1.26 -1.27 119.66 119.55 1jcz s GLN 217 Ca 0.45 -1.11 0.02 0.00 0.02 0.00 0.00 55.36 54.75 1jcz s GLN 217 Cb -0.05 -2.04 -0.03 0.00 1.00 0.00 0.00 33.01 31.89 1jcz s GLN 217 CO 0.28 0.51 -0.08 0.96 -2.12 0.00 0.00 175.29 174.84 1jcz s ILE 218 N -0.90 0.69 0.88 1.08 -4.36 -0.70 -4.33 121.20 113.57 1jcz s ILE 218 Ca 0.13 -1.50 -0.12 0.00 -0.26 0.00 0.00 60.65 58.91 1jcz s ILE 218 Cb -0.10 -1.15 0.12 0.00 1.25 0.00 0.00 42.46 42.58 1jcz s ILE 218 CO 0.04 -0.58 1.10 -0.94 0.24 0.00 0.00 174.94 174.80 1jcz s SER 219 N -2.27 3.66 0.22 4.36 1.04 -1.13 -0.07 113.70 119.52 1jcz s SER 219 Ca 0.01 1.33 -0.08 0.00 0.48 0.00 0.00 55.95 57.69 1jcz s SER 219 Cb -0.03 -2.02 0.27 0.00 0.10 0.00 0.00 66.02 64.35 1jcz s SER 219 CO -0.01 -2.50 1.81 1.56 0.98 0.00 0.00 173.24 175.08 1jcz h GLN 220 N -1.45 0.68 -0.62 4.02 4.20 -1.93 -1.03 115.11 118.98 1jcz h GLN 220 Ca -0.50 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.13 1jcz h GLN 220 Cb 1.29 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.89 1jcz h GLN 220 CO 0.57 0.45 0.22 1.49 -0.67 0.00 0.00 178.83 180.90 1jcz h GLU 221 N 0.70 0.94 -0.61 1.46 4.57 -1.95 0.03 114.58 119.73 1jcz h GLU 221 Ca 0.32 -0.19 -0.03 0.00 -1.18 0.00 0.00 59.36 58.28 1jcz h GLU 221 Cb 0.23 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 1jcz h GLU 221 CO -0.20 0.82 0.25 1.96 -1.18 0.00 0.00 179.01 180.66 1jcz h GLN 222 N 0.88 0.90 -0.40 1.92 4.20 -1.75 -0.11 115.11 120.75 1jcz h GLN 222 Ca 0.20 -0.16 -0.06 0.00 0.06 0.00 0.00 58.65 58.69 1jcz h GLN 222 Cb 0.25 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1jcz h GLN 222 CO -0.01 0.76 0.01 1.25 -0.67 0.00 0.00 178.83 180.17 1jcz h LEU 223 N 0.84 0.68 -0.89 1.46 5.85 -0.97 -1.84 115.31 120.44 1jcz h LEU 223 Ca 0.20 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 1jcz h LEU 223 Cb 0.19 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1jcz h LEU 223 CO -0.02 0.81 0.43 0.25 -0.34 0.00 0.00 178.44 179.58 1jcz h LEU 224 N 0.53 1.11 -0.47 2.25 5.85 -0.76 -1.05 115.31 122.77 1jcz h LEU 224 Ca 0.11 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1jcz h LEU 224 Cb 0.46 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1jcz h LEU 224 CO 0.02 0.92 0.28 0.00 -0.34 0.00 0.00 178.44 179.32 1jcz h ALA 225 N 1.25 0.60 -0.67 1.25 0.00 -0.80 -0.73 119.26 120.17 1jcz h ALA 225 Ca 0.30 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1jcz h ALA 225 Cb 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1jcz h ALA 225 CO -0.04 0.10 0.32 1.25 0.00 0.00 0.00 179.25 180.88 1jcz h LEU 226 N 0.63 0.86 -0.00 0.00 5.85 -0.87 0.42 115.31 122.20 1jcz h LEU 226 Ca 0.17 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1jcz h LEU 226 Cb 0.00 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.82 1jcz h LEU 226 CO -0.03 0.73 -0.02 -0.62 -0.34 0.00 0.00 178.44 178.16 1jcz n GLU 227 N -4.34 0.07 0.00 1.25 1.02 -0.44 -4.28 120.64 113.92 1jcz n GLU 227 Ca 0.06 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 1jcz n GLU 227 Cb 0.13 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 1jcz n GLU 227 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1jcz n THR 228 N -1.46 0.00 0.27 2.62 -2.24 -0.34 -4.68 114.28 108.45 1jcz n THR 228 Ca 0.08 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 62.01 1jcz n THR 228 Cb 0.33 0.05 0.52 0.00 -2.10 0.00 0.00 70.33 69.13 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 1.00 -3.47 6.98 0.00 -1.11 -3.46 119.26 119.20 1jcz h ALA 229 Ca 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.25 1jcz h ALA 229 Cb 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.85 1jcz h ALA 229 CO 0.00 0.00 -0.69 -0.51 0.00 0.00 0.00 179.25 178.05 1jcz s LEU 230 N -6.10 3.29 0.06 0.00 1.43 -1.26 -4.42 118.68 111.68 1jcz s LEU 230 Ca 0.03 -0.21 0.06 0.00 -1.03 0.00 0.00 54.13 52.99 1jcz s LEU 230 Cb 0.08 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 1jcz s LEU 230 CO 0.58 0.21 -0.17 -0.31 0.23 0.00 0.00 176.35 176.89 1jcz s TYR 231 N -1.19 1.47 -2.33 0.29 1.51 0.71 -0.52 117.35 117.30 1jcz s TYR 231 Ca 0.22 -0.39 0.27 0.00 -1.01 0.00 0.00 57.07 56.16 1jcz s TYR 231 Cb -0.11 -0.85 0.90 0.00 -0.11 0.00 0.00 41.96 41.79 1jcz s TYR 231 CO 0.14 0.09 1.66 0.00 -1.11 0.00 0.00 175.55 176.32 1jcz s THR 233 N -2.14 4.85 0.71 0.00 -4.23 -1.26 -4.57 115.64 109.01 1jcz s THR 233 Ca 0.33 -1.05 -0.14 0.00 -1.18 0.00 0.00 61.69 59.65 1jcz s THR 233 Cb 0.20 -3.56 0.03 0.00 1.34 0.00 0.00 72.50 70.51 1jcz s THR 233 CO 0.39 -0.22 1.14 -1.00 -0.54 0.00 0.00 174.62 174.38 1jcz s HIS 234 N -1.90 2.40 0.30 3.99 3.76 -1.26 -1.96 115.29 120.61 1jcz s HIS 234 Ca 0.33 1.58 0.00 0.00 -0.15 0.00 0.00 55.06 56.82 1jcz s HIS 234 Cb -0.09 -3.25 0.51 0.00 1.11 0.00 0.00 32.58 30.86 1jcz s HIS 234 CO 0.26 -2.02 1.94 1.98 -0.85 0.00 0.00 174.74 176.05 1jcz h MET 235 N -0.30 1.01 0.00 1.40 4.05 -1.90 -2.12 114.93 117.07 1jcz h MET 235 Ca -0.46 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 58.89 1jcz h MET 235 Cb 1.26 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 31.83 1jcz h MET 235 CO 0.52 0.67 0.00 -0.40 0.23 0.00 0.00 176.91 177.93 1jcz n ASP 236 N -4.46 0.00 -4.66 1.39 5.68 -1.26 -4.84 116.55 108.40 1jcz n ASP 236 Ca 0.12 -0.71 -0.42 0.00 -0.50 0.00 0.00 54.79 53.27 1jcz n ASP 236 Cb 0.14 -0.08 -0.03 0.00 -1.14 0.00 0.00 41.12 40.01 1jcz n ASP 236 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1jcz s ASP 237 N -2.15 6.65 0.39 -1.12 -1.08 -0.80 -4.88 116.67 113.68 1jcz s ASP 237 Ca 0.40 2.21 0.27 0.00 -0.52 0.00 0.00 52.55 54.91 1jcz s ASP 237 Cb 0.20 -2.53 1.39 0.00 -1.46 0.00 0.00 42.92 40.52 1jcz s ASP 237 CO 0.37 -0.95 1.83 -0.65 0.52 0.00 0.00 175.17 176.29 1jcz h PRO 238 N 9.63 0.00 -2.53 4.34 0.11 -1.90 -3.28 132.00 138.38 1jcz h PRO 238 Ca -0.39 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.12 1jcz h PRO 238 Cb 1.18 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.88 1jcz h PRO 238 CO 0.96 0.00 -0.74 0.43 -0.21 0.00 0.00 178.00 178.43 1jcz n SER 239 N -2.47 2.06 -4.68 -2.05 7.64 -1.26 -5.11 113.62 107.75 1jcz n SER 239 Ca -0.01 -3.02 -0.39 0.00 1.01 0.00 0.00 58.87 56.46 1jcz n SER 239 Cb 0.10 -0.67 0.03 0.00 -1.01 0.00 0.00 64.21 62.66 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 1.76 1.48 -4.21 1.43 -0.02 -1.24 -5.01 135.00 129.20 1jcz n PRO 240 Ca 0.25 0.54 -0.29 0.00 -2.02 0.00 0.00 63.50 61.99 1jcz n PRO 240 Cb 0.42 -2.34 -0.17 0.00 -0.02 0.00 0.00 33.50 31.39 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 -2.56 2.09 0.27 -0.52 0.52 -1.26 -5.05 118.95 112.44 1jcz s ARG 240 Ca 0.69 -0.50 -0.29 0.00 -0.52 0.00 0.00 55.73 55.11 1jcz s ARG 240 Cb -0.46 -1.88 -0.09 0.00 0.52 0.00 0.00 34.95 33.03 1jcz s ARG 240 CO 0.52 -0.16 1.25 -1.21 0.02 0.00 0.00 175.30 175.73 1jcz s GLU 240 N 1.27 4.44 -0.80 3.54 2.02 -1.26 -1.29 118.70 126.62 1jcz s GLU 240 Ca -0.01 2.05 -0.21 0.00 0.02 0.00 0.00 54.97 56.82 1jcz s GLU 240 Cb -0.14 -3.15 0.09 0.00 0.10 0.00 0.00 34.13 31.04 1jcz s GLU 240 CO -0.06 -0.11 1.07 1.41 0.02 0.00 0.00 175.26 177.59 1jcz s MET 241 N -1.07 3.35 0.13 1.61 -2.45 0.32 -4.63 119.30 116.55 1jcz s MET 241 Ca 0.51 -1.25 0.01 0.00 -1.25 0.00 0.00 55.69 53.71 1jcz s MET 241 Cb -0.36 -4.60 -0.04 0.00 1.25 0.00 0.00 34.83 31.07 1jcz s MET 241 CO 0.44 -1.83 -0.01 0.96 1.05 0.00 0.00 175.02 175.64 1jcz s ILE 242 N 3.55 0.47 -1.53 10.11 -4.36 -1.26 -4.76 121.20 123.41 1jcz s ILE 242 Ca 0.28 -1.93 -0.08 0.00 -0.26 0.00 0.00 60.65 58.66 1jcz s ILE 242 Cb -0.11 -1.91 0.07 0.00 1.25 0.00 0.00 42.46 41.76 1jcz s ILE 242 CO 0.00 -0.65 0.61 0.59 0.24 0.00 0.00 174.94 175.73 1jcz n ASN 243 N -0.10 -1.84 -3.38 4.36 3.02 0.24 -4.85 115.26 112.71 1jcz n ASN 243 Ca -0.09 -0.99 -0.39 0.00 -0.03 0.00 0.00 54.58 53.09 1jcz n ASN 243 Cb 0.62 -3.02 -0.01 0.00 -0.61 0.00 0.00 39.78 36.77 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 -2.85 7.77 -4.08 6.41 6.94 -0.86 -4.89 115.26 123.69 1jcz n ASN 244 Ca -0.13 -3.25 -0.14 0.00 -0.02 0.00 0.00 54.58 51.04 1jcz n ASN 244 Cb 0.60 -1.31 -0.12 0.00 -2.36 0.00 0.00 39.78 36.59 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 -1.76 0.78 0.14 -2.53 -0.12 -1.26 -4.34 117.98 108.89 1jcz s PHE 245 Ca 0.52 -0.49 -0.10 0.00 -0.05 0.00 0.00 56.93 56.81 1jcz s PHE 245 Cb 0.21 -0.46 -0.06 0.00 -0.63 0.00 0.00 43.02 42.08 1jcz s PHE 245 CO -0.12 -0.05 0.47 0.50 -0.05 0.00 0.00 175.22 175.96 1jcz s ARG 246 N -1.60 3.81 0.66 1.99 3.52 -1.26 -5.05 118.95 121.03 1jcz s ARG 246 Ca -0.08 0.25 -0.16 0.00 -0.13 0.00 0.00 55.73 55.61 1jcz s ARG 246 Cb -0.10 -2.88 0.00 0.00 -1.56 0.00 0.00 34.95 30.41 1jcz s ARG 246 CO 0.01 0.47 1.15 -0.65 -0.81 0.00 0.00 175.30 175.47 1jcz s GLN 247 N -2.23 2.67 0.52 5.12 -1.52 -1.26 -4.76 119.66 118.20 1jcz s GLN 247 Ca 0.39 1.57 -0.21 0.00 -1.95 0.00 0.00 55.36 55.15 1jcz s GLN 247 Cb -0.13 -1.92 -0.06 0.00 -0.22 0.00 0.00 33.01 30.68 1jcz s GLN 247 CO 0.20 -1.39 1.23 0.14 -0.25 0.00 0.00 175.29 175.22 1jcz s VAL 248 N -2.10 2.70 0.25 1.09 -7.23 -1.26 -4.40 120.40 109.44 1jcz s VAL 248 Ca 0.71 0.49 0.05 0.00 -1.81 0.00 0.00 61.98 61.42 1jcz s VAL 248 Cb -0.24 -3.23 -0.03 0.00 0.56 0.00 0.00 36.38 33.43 1jcz s VAL 248 CO 0.40 -0.04 0.37 -1.10 -0.31 0.00 0.00 175.10 174.42 1jcz s GLN 249 N -2.96 3.39 0.46 4.82 -1.52 0.50 -4.96 119.66 119.38 1jcz s GLN 249 Ca 0.70 -0.79 -0.25 0.00 -1.95 0.00 0.00 55.36 53.07 1jcz s GLN 249 Cb -0.32 -2.87 -0.08 0.00 -0.22 0.00 0.00 33.01 29.52 1jcz s GLN 249 CO 0.37 0.39 1.42 0.15 -0.25 0.00 0.00 175.29 177.37 1jcz s LYS 250 N -3.99 3.65 -0.34 2.91 -0.14 -1.26 -4.65 119.74 115.92 1jcz s LYS 250 Ca 0.35 2.39 -0.01 0.00 -1.36 0.00 0.00 55.97 57.34 1jcz s LYS 250 Cb -0.09 -2.62 0.13 0.00 -1.68 0.00 0.00 37.83 33.57 1jcz s LYS 250 CO 0.29 -0.84 0.19 0.12 -0.76 0.00 0.00 175.35 174.35 1jcz s PHE 251 N -1.21 0.61 0.12 3.18 5.36 -1.26 -4.88 117.98 119.90 1jcz s PHE 251 Ca 0.62 -1.43 0.09 0.00 -0.96 0.00 0.00 56.93 55.24 1jcz s PHE 251 Cb -0.43 -0.91 -0.04 0.00 -0.34 0.00 0.00 43.02 41.31 1jcz s PHE 251 CO 0.55 -0.83 -0.22 -0.51 -1.46 0.00 0.00 175.22 172.75 1jcz s ASP 252 N 1.33 2.73 -0.44 6.13 1.01 -1.26 -4.68 116.67 121.49 1jcz s ASP 252 Ca 0.16 -0.73 0.00 0.00 0.71 0.00 0.00 52.55 52.69 1jcz s ASP 252 Cb -0.21 -0.16 0.00 0.00 1.01 0.00 0.00 42.92 43.56 1jcz s ASP 252 CO -0.08 0.07 0.00 -0.62 0.21 0.00 0.00 175.17 174.75 1jcz n GLU 253 N 0.92 -1.28 -4.44 8.23 -0.58 -1.26 -4.96 120.64 117.28 1jcz n GLU 253 Ca -0.18 0.53 -0.21 0.00 -0.42 0.00 0.00 57.16 56.88 1jcz n GLU 253 Cb 0.54 -4.60 -0.10 0.00 -0.57 0.00 0.00 31.44 26.71 1jcz n GLU 253 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1jcz s ARG 254 N -1.91 1.66 0.03 3.49 0.52 -1.26 -5.16 118.95 116.32 1jcz s ARG 254 Ca 0.00 -1.94 0.02 0.00 -0.52 0.00 0.00 55.73 53.29 1jcz s ARG 254 Cb 0.00 -0.71 -0.02 0.00 0.52 0.00 0.00 34.95 34.74 1jcz s ARG 254 CO 0.00 -0.26 -0.07 -0.51 0.02 0.00 0.00 175.30 174.47 1jcz s LEU 255 N -3.48 2.19 -0.18 2.53 1.43 -1.26 -4.87 118.68 115.04 1jcz s LEU 255 Ca 0.34 -0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 52.95 1jcz s LEU 255 Cb 0.07 -0.21 -0.04 0.00 0.03 0.00 0.00 46.19 46.05 1jcz s LEU 255 CO 0.15 -0.12 0.04 -0.69 0.23 0.00 0.00 176.35 175.96 1jcz s VAL 256 N -1.03 4.58 0.01 -1.59 1.01 0.44 -4.91 120.40 118.92 1jcz s VAL 256 Ca -0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 1jcz s VAL 256 Cb -0.08 -3.05 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 1jcz s VAL 256 CO 0.00 0.47 0.25 -0.31 0.00 0.00 0.00 175.10 175.51 1jcz s TYR 257 N 0.38 3.57 0.13 5.22 1.51 -0.66 -1.32 117.35 126.18 1jcz s TYR 257 Ca 0.01 0.53 0.11 0.00 -1.01 0.00 0.00 57.07 56.71 1jcz s TYR 257 Cb -0.13 -1.96 -0.04 0.00 -0.11 0.00 0.00 41.96 39.73 1jcz s TYR 257 CO 0.01 0.61 -0.26 0.95 -1.11 0.00 0.00 175.55 175.76 1jcz s THR 258 N -1.32 2.35 -2.19 -0.71 -4.23 0.03 -0.03 115.64 109.55 1jcz s THR 258 Ca 0.28 -1.71 0.18 0.00 -1.18 0.00 0.00 61.69 59.26 1jcz s THR 258 Cb -0.13 -2.05 0.42 0.00 1.34 0.00 0.00 72.50 72.08 1jcz s THR 258 CO 0.17 0.10 1.43 -1.54 -0.54 0.00 0.00 174.62 174.24 1jcz n SER 259 N 0.92 2.07 -4.18 3.99 3.41 -0.71 -0.67 113.62 118.45 1jcz n SER 259 Ca -0.18 -1.86 -0.17 0.00 -0.26 0.00 0.00 58.87 56.41 1jcz n SER 259 Cb 0.53 -0.19 -0.11 0.00 -0.26 0.00 0.00 64.21 64.17 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 -1.62 1.18 -2.31 7.33 -0.12 -1.26 -4.84 117.98 116.33 1jcz s PHE 260 Ca 0.31 -0.52 0.30 0.00 -0.05 0.00 0.00 56.93 56.96 1jcz s PHE 260 Cb 0.17 -0.65 1.38 0.00 -0.63 0.00 0.00 43.02 43.28 1jcz s PHE 260 CO 0.24 0.05 1.93 -1.13 -0.05 0.00 0.00 175.22 176.26