#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j5y s VAL -6 N 0.00 3.64 0.83 4.08 1.01 -1.26 -5.00 120.40 123.70 2j5y s VAL -6 Ca 0.00 1.16 -0.12 0.00 0.00 0.00 0.00 61.98 63.02 2j5y s VAL -6 Cb 0.00 -3.74 0.09 0.00 0.00 0.00 0.00 36.38 32.73 2j5y s VAL -6 CO 0.00 0.08 1.13 -2.16 0.00 0.00 0.00 175.10 174.15 2j5y s PRO -5 N 1.28 1.80 -0.32 2.72 0.04 -1.26 -4.97 135.00 134.30 2j5y s PRO -5 Ca 0.62 0.37 -0.11 0.00 0.04 0.00 0.00 61.00 61.93 2j5y s PRO -5 Cb -0.33 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.29 2j5y s PRO -5 CO 0.29 -1.76 0.18 0.50 0.04 0.00 0.00 177.00 176.25 2j5y s ARG -4 N -5.32 3.41 0.77 4.56 3.52 -1.26 -5.08 118.95 119.55 2j5y s ARG -4 Ca 0.62 -0.68 -0.11 0.00 -0.13 0.00 0.00 55.73 55.42 2j5y s ARG -4 Cb -0.13 -3.64 0.05 0.00 -1.56 0.00 0.00 34.95 29.66 2j5y s ARG -4 CO 0.52 -0.42 1.10 0.20 -0.81 0.00 0.00 175.30 175.89 2j5y s GLY -3 N 1.65 1.63 0.24 8.12 0.00 -1.26 -4.91 107.32 112.78 2j5y s GLY -3 Ca 0.05 -0.23 0.20 0.00 0.00 0.00 0.00 44.72 44.74 2j5y s GLY -3 CO 0.08 0.17 1.60 -1.14 0.00 0.00 0.00 173.10 173.81 2j5y n SER -2 N -3.30 0.50 -1.52 1.64 3.41 -1.26 -2.16 113.62 110.93 2j5y n SER -2 Ca 0.07 0.68 0.08 0.00 -0.26 0.00 0.00 58.87 59.44 2j5y n SER -2 Cb 0.56 -0.76 0.35 0.00 -0.26 0.00 0.00 64.21 64.10 2j5y n SER -2 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2j5y n HIS -1 N -2.11 1.55 -4.35 7.33 -0.00 -1.26 -4.89 115.22 111.49 2j5y n HIS -1 Ca 0.00 -0.70 -0.34 0.00 -0.00 0.00 0.00 57.72 56.69 2j5y n HIS -1 Cb 0.12 -0.34 -0.11 0.00 -0.00 0.00 0.00 29.99 29.66 2j5y n HIS -1 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2j5y s MET 0 N -2.31 3.35 0.78 1.57 1.00 -0.92 -5.12 119.30 117.65 2j5y s MET 0 Ca 0.49 -0.45 -0.11 0.00 0.00 0.00 0.00 55.69 55.62 2j5y s MET 0 Cb 0.35 -2.88 0.06 0.00 0.00 0.00 0.00 34.83 32.36 2j5y s MET 0 CO 0.18 0.48 1.08 0.95 0.00 0.00 0.00 175.02 177.72 2j5y s THR 1 N -0.27 3.32 0.24 2.05 -4.23 -1.26 -4.87 115.64 110.61 2j5y s THR 1 Ca 0.06 0.43 -0.06 0.00 -1.18 0.00 0.00 61.69 60.94 2j5y s THR 1 Cb -0.12 -3.11 0.20 0.00 1.34 0.00 0.00 72.50 70.81 2j5y s THR 1 CO 0.02 -0.56 1.82 0.40 -0.54 0.00 0.00 174.62 175.76 2j5y h ILE 2 N -1.05 0.96 -0.42 2.99 1.08 -1.99 -0.22 117.51 118.87 2j5y h ILE 2 Ca -0.46 -0.28 -0.01 0.00 -0.39 0.00 0.00 64.86 63.71 2j5y h ILE 2 Cb 1.25 0.06 -0.02 0.00 -3.07 0.00 0.00 36.82 35.04 2j5y h ILE 2 CO 0.57 0.15 0.21 0.44 -0.69 0.00 0.00 178.15 178.83 2j5y h ASP 3 N 0.83 0.54 -0.73 1.72 3.32 -1.99 0.53 116.42 120.63 2j5y h ASP 3 Ca 0.37 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.28 2j5y h ASP 3 Cb 0.27 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 2j5y h ASP 3 CO -0.21 0.50 0.35 1.56 -1.72 0.00 0.00 179.24 179.71 2j5y h GLN 4 N 0.54 1.05 -0.49 3.56 4.20 -1.85 -1.85 115.11 120.26 2j5y h GLN 4 Ca 0.14 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 2j5y h GLN 4 Cb 0.09 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2j5y h GLN 4 CO -0.02 0.82 0.22 2.35 -0.67 0.00 0.00 178.83 181.53 2j5y h TRP 5 N 1.02 0.72 -0.63 2.96 7.01 -0.46 -0.10 115.95 126.46 2j5y h TRP 5 Ca 0.25 -0.04 -0.06 0.00 2.11 0.00 0.00 58.89 61.15 2j5y h TRP 5 Cb 0.12 -0.22 -0.03 0.00 -2.10 0.00 0.00 29.16 26.93 2j5y h TRP 5 CO 0.01 0.58 0.16 -0.07 -2.79 0.00 0.00 178.44 176.33 2j5y h LEU 6 N 0.65 0.92 -0.41 0.65 3.38 -0.77 -0.58 115.31 119.15 2j5y h LEU 6 Ca 0.17 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2j5y h LEU 6 Cb 0.14 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2j5y h LEU 6 CO -0.02 0.88 0.14 0.25 0.09 0.00 0.00 178.44 179.79 2j5y h LEU 7 N 0.94 0.58 -0.71 1.67 5.85 -1.04 -1.02 115.31 121.59 2j5y h LEU 7 Ca 0.20 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 2j5y h LEU 7 Cb 0.32 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 2j5y h LEU 7 CO -0.00 0.62 0.30 0.50 -0.34 0.00 0.00 178.44 179.51 2j5y h LYS 8 N 0.52 1.05 -0.72 1.25 1.63 -0.65 -1.01 116.57 118.64 2j5y h LYS 8 Ca 0.13 -0.18 -0.06 0.00 -0.85 0.00 0.00 60.65 59.69 2j5y h LYS 8 Cb 0.23 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.66 2j5y h LYS 8 CO -0.01 0.86 0.20 -0.91 -3.45 0.00 0.00 179.45 176.14 2j5y h ASN 9 N 1.01 1.07 -0.86 4.20 4.21 -1.02 -1.68 115.58 122.51 2j5y h ASN 9 Ca 0.24 -0.22 0.00 0.00 1.21 0.00 0.00 56.30 57.53 2j5y h ASN 9 Cb 0.19 -0.28 -0.04 0.00 -1.12 0.00 0.00 38.32 37.07 2j5y h ASN 9 CO -0.02 1.01 0.55 0.00 -1.29 0.00 0.00 177.43 177.68 2j5y h ALA 10 N 1.10 1.09 -0.10 -0.83 0.00 -0.72 -0.74 119.26 119.06 2j5y h ALA 10 Ca 0.23 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2j5y h ALA 10 Cb 0.34 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2j5y h ALA 10 CO -0.00 0.51 0.05 0.87 0.00 0.00 0.00 179.25 180.68 2j5y h LYS 11 N 1.17 0.15 -0.75 0.00 1.57 -0.87 -0.16 116.57 117.67 2j5y h LYS 11 Ca 0.31 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.07 2j5y h LYS 11 Cb -0.11 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.14 2j5y h LYS 11 CO -0.07 0.19 0.46 0.93 -0.57 0.00 0.00 179.45 180.40 2j5y h GLU 12 N 0.06 1.02 -0.61 3.15 4.39 -1.10 -0.82 114.58 120.67 2j5y h GLU 12 Ca 0.04 -0.09 -0.09 0.00 0.34 0.00 0.00 59.36 59.56 2j5y h GLU 12 Cb 0.09 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 2j5y h GLU 12 CO -0.01 0.72 0.02 -0.44 -1.16 0.00 0.00 179.01 178.15 2j5y h ASP 13 N 1.03 1.03 -0.20 1.42 3.32 -0.97 -0.64 116.42 121.40 2j5y h ASP 13 Ca 0.27 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 2j5y h ASP 13 Cb -0.05 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.22 2j5y h ASP 13 CO -0.05 1.06 0.07 0.00 -1.72 0.00 0.00 179.24 178.60 2j5y h ALA 14 N 1.04 0.26 -0.92 3.45 0.00 -0.72 -1.25 119.26 121.13 2j5y h ALA 14 Ca 0.18 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2j5y h ALA 14 Cb 0.53 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 2j5y h ALA 14 CO 0.03 -0.13 0.60 0.82 0.00 0.00 0.00 179.25 180.57 2j5y h ILE 15 N 0.16 1.17 -0.92 0.00 2.04 -1.00 -0.66 117.51 118.32 2j5y h ILE 15 Ca 0.07 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 2j5y h ILE 15 Cb 0.20 -0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.13 2j5y h ILE 15 CO -0.00 0.21 0.54 0.00 0.00 0.00 0.00 178.15 178.90 2j5y h ALA 16 N 1.37 1.22 -0.52 1.87 0.00 -0.93 -0.16 119.26 122.12 2j5y h ALA 16 Ca 0.36 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 2j5y h ALA 16 Cb -0.03 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.37 2j5y h ALA 16 CO -0.11 0.65 0.08 1.49 0.00 0.00 0.00 179.25 181.37 2j5y h GLU 17 N 1.27 0.86 -0.63 0.00 4.81 -0.62 -0.64 114.58 119.62 2j5y h GLU 17 Ca 0.33 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2j5y h GLU 17 Cb -0.03 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 2j5y h GLU 17 CO -0.06 0.84 0.37 -0.07 -0.73 0.00 0.00 179.01 179.37 2j5y h LEU 18 N 0.74 0.76 -0.81 1.64 3.38 -0.73 -2.19 115.31 118.10 2j5y h LEU 18 Ca 0.16 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2j5y h LEU 18 Cb 0.41 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2j5y h LEU 18 CO 0.01 0.60 0.45 0.11 0.09 0.00 0.00 178.44 179.70 2j5y h LYS 19 N 0.86 1.13 -0.29 1.13 1.57 -0.81 -1.46 116.57 118.69 2j5y h LYS 19 Ca 0.23 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2j5y h LYS 19 Cb -0.01 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 2j5y h LYS 19 CO -0.04 0.83 0.14 -0.22 -0.57 0.00 0.00 179.45 179.58 2j5y h LYS 20 N 1.12 0.39 -0.01 3.15 3.64 -0.74 -1.58 116.57 122.55 2j5y h LYS 20 Ca 0.29 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 2j5y h LYS 20 Cb 0.03 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2j5y h LYS 20 CO -0.05 0.31 0.00 0.00 -2.27 0.00 0.00 179.45 177.45 2j5y n ALA 21 N -2.49 2.64 -0.42 5.00 0.00 -0.73 -4.92 120.51 119.59 2j5y n ALA 21 Ca 0.01 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2j5y n ALA 21 Cb 0.11 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.19 2j5y n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j5y n GLY 22 N 1.04 0.79 3.72 0.00 0.00 -0.59 -5.06 105.19 105.09 2j5y n GLY 22 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2j5y n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j5y s ILE 23 N -2.03 4.77 -0.02 -0.61 -1.09 -0.63 -4.93 121.20 116.67 2j5y s ILE 23 Ca 0.00 1.96 0.03 0.00 -2.23 0.00 0.00 60.65 60.41 2j5y s ILE 23 Cb 0.00 -4.27 0.04 0.00 -1.58 0.00 0.00 42.46 36.65 2j5y s ILE 23 CO 0.00 0.23 0.88 0.35 -1.23 0.00 0.00 174.94 175.17 2j5y n THR 24 N 3.47 0.76 -2.62 2.92 -2.24 -1.26 -4.03 114.28 111.28 2j5y n THR 24 Ca 0.03 -0.82 -0.43 0.00 -2.27 0.00 0.00 64.05 60.57 2j5y n THR 24 Cb 0.50 0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 69.25 2j5y n THR 24 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2j5y s SER 25 N -0.99 6.75 0.47 3.42 0.15 -1.26 -4.91 113.70 117.33 2j5y s SER 25 Ca 0.05 0.69 0.13 0.00 0.70 0.00 0.00 55.95 57.52 2j5y s SER 25 Cb 0.04 -2.54 1.10 0.00 -1.71 0.00 0.00 66.02 62.91 2j5y s SER 25 CO 0.00 -1.10 2.10 0.44 1.20 0.00 0.00 173.24 175.89 2j5y h ASP 26 N 8.76 0.21 -0.36 5.45 3.32 -1.99 -1.38 116.42 130.44 2j5y h ASP 26 Ca -0.22 -0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.83 2j5y h ASP 26 Cb 1.06 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 2j5y h ASP 26 CO 1.09 0.15 0.23 0.15 -1.72 0.00 0.00 179.24 179.13 2j5y h PHE 27 N 0.24 0.43 -0.27 4.55 3.57 -1.99 0.13 116.94 123.61 2j5y h PHE 27 Ca 0.08 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.51 2j5y h PHE 27 Cb 0.04 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 2j5y h PHE 27 CO -0.00 0.27 -0.16 1.88 -2.23 0.00 0.00 178.31 178.06 2j5y h TYR 28 N 0.47 0.69 -0.89 0.41 0.05 -1.81 -2.42 116.97 113.46 2j5y h TYR 28 Ca 0.13 -0.18 0.05 0.00 0.05 0.00 0.00 58.73 58.78 2j5y h TYR 28 Cb -0.04 -0.15 -0.05 0.00 1.01 0.00 0.00 36.73 37.49 2j5y h TYR 28 CO -0.06 0.85 0.58 0.74 -1.05 0.00 0.00 178.16 179.23 2j5y h PHE 29 N 0.32 1.05 -0.34 4.88 0.04 -1.06 -2.21 116.94 119.61 2j5y h PHE 29 Ca 0.06 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.79 2j5y h PHE 29 Cb 0.69 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 38.48 2j5y h PHE 29 CO 0.07 0.58 -0.06 -0.97 -0.60 0.00 0.00 178.31 177.32 2j5y h ASN 30 N 1.06 0.54 -0.43 2.17 -1.24 -0.53 -0.32 115.58 116.84 2j5y h ASN 30 Ca 0.37 -0.12 -0.02 0.00 0.71 0.00 0.00 56.30 57.24 2j5y h ASN 30 Cb 0.12 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.01 2j5y h ASN 30 CO -0.13 0.65 0.20 0.00 -1.29 0.00 0.00 177.43 176.86 2j5y h ALA 31 N 1.41 0.55 -0.33 1.57 0.00 -0.91 -1.02 119.26 120.54 2j5y h ALA 31 Ca 0.10 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2j5y h ALA 31 Cb 0.43 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 2j5y h ALA 31 CO 0.02 0.12 0.04 0.82 0.00 0.00 0.00 179.25 180.26 2j5y h ILE 32 N 0.55 0.81 0.00 0.00 1.08 -1.07 -2.51 117.51 116.37 2j5y h ILE 32 Ca 0.15 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.56 2j5y h ILE 32 Cb 0.13 0.65 0.00 0.00 -3.07 0.00 0.00 36.82 34.53 2j5y h ILE 32 CO -0.02 0.03 0.00 0.78 -0.69 0.00 0.00 178.15 178.25 2j5y h ASN 33 N 0.15 0.00 0.46 1.72 2.35 -0.35 -1.90 115.58 118.01 2j5y h ASN 33 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2j5y h ASN 33 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2j5y h ASN 33 CO -0.22 0.00 -0.49 0.29 -1.65 0.00 0.00 177.43 175.36 2j5y n LYS 34 N -2.99 0.10 -1.93 0.81 5.02 -0.45 -4.96 118.16 113.75 2j5y n LYS 34 Ca -0.01 -0.06 -0.36 0.00 -2.02 0.00 0.00 58.31 55.86 2j5y n LYS 34 Cb 0.20 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.76 2j5y n LYS 34 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j5y s ALA 35 N -2.94 2.50 -0.74 7.82 0.00 -0.71 -4.96 121.76 122.73 2j5y s ALA 35 Ca 0.12 1.08 0.12 0.00 0.00 0.00 0.00 51.96 53.29 2j5y s ALA 35 Cb 0.18 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.73 2j5y s ALA 35 CO 0.68 -1.30 0.56 1.63 0.00 0.00 0.00 175.76 177.34 2j5y n LYS 36 N -1.66 2.77 -4.12 0.00 5.02 -1.26 -4.98 118.16 113.92 2j5y n LYS 36 Ca 0.14 -0.23 -0.11 0.00 -2.02 0.00 0.00 58.31 56.10 2j5y n LYS 36 Cb 0.49 -1.08 -0.10 0.00 -0.02 0.00 0.00 35.03 34.32 2j5y n LYS 36 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2j5y s THR 37 N -1.91 0.57 0.29 -0.18 -4.23 -1.26 -5.04 115.64 103.89 2j5y s THR 37 Ca 0.06 -1.65 -0.02 0.00 -1.18 0.00 0.00 61.69 58.90 2j5y s THR 37 Cb 0.09 -1.32 0.25 0.00 1.34 0.00 0.00 72.50 72.86 2j5y s THR 37 CO 0.42 -0.74 1.95 0.58 -0.54 0.00 0.00 174.62 176.29 2j5y h VAL 38 N 3.47 1.22 -0.46 2.29 2.07 -1.94 -1.85 116.25 121.05 2j5y h VAL 38 Ca -0.35 -0.44 -0.07 0.00 0.82 0.00 0.00 66.70 66.65 2j5y h VAL 38 Cb 1.17 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 2j5y h VAL 38 CO 0.57 0.22 -0.01 -0.33 0.02 0.00 0.00 177.57 178.04 2j5y h GLU 39 N 1.10 0.77 -0.58 1.57 3.07 -1.99 -0.11 114.58 118.42 2j5y h GLU 39 Ca 0.29 -0.21 -0.03 0.00 -0.50 0.00 0.00 59.36 58.92 2j5y h GLU 39 Cb -0.08 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 27.71 2j5y h GLU 39 CO -0.06 0.79 0.26 0.93 -1.40 0.00 0.00 179.01 179.53 2j5y h GLU 40 N 0.72 0.85 -0.44 2.33 5.08 -1.84 -0.99 114.58 120.29 2j5y h GLU 40 Ca 0.14 -0.14 0.05 0.00 -1.00 0.00 0.00 59.36 58.41 2j5y h GLU 40 Cb 0.46 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.52 2j5y h GLU 40 CO 0.02 0.71 0.17 0.28 -1.00 0.00 0.00 179.01 179.19 2j5y h VAL 41 N 0.79 0.89 -0.61 3.13 2.07 -0.92 -0.18 116.25 121.42 2j5y h VAL 41 Ca 0.20 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 2j5y h VAL 41 Cb 0.15 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 2j5y h VAL 41 CO -0.02 0.07 0.35 0.78 0.02 0.00 0.00 177.57 178.76 2j5y h ASN 42 N 0.36 0.75 -0.30 0.57 2.35 -0.79 -0.20 115.58 118.32 2j5y h ASN 42 Ca 0.20 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.80 2j5y h ASN 42 Cb 0.17 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 2j5y h ASN 42 CO -0.19 0.61 -0.12 0.00 -1.65 0.00 0.00 177.43 176.08 2j5y h ALA 43 N 1.17 0.41 0.02 -0.83 0.00 -0.79 0.12 119.26 119.36 2j5y h ALA 43 Ca 0.22 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2j5y h ALA 43 Cb 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2j5y h ALA 43 CO -0.04 0.28 -0.14 -0.07 0.00 0.00 0.00 179.25 179.28 2j5y h LEU 44 N 0.36 -0.41 -0.20 0.00 3.38 -0.83 -1.07 115.31 116.53 2j5y h LEU 44 Ca 0.07 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2j5y h LEU 44 Cb 0.63 0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 2j5y h LEU 44 CO 0.04 -0.20 -0.01 0.50 0.09 0.00 0.00 178.44 178.85 2j5y h LYS 45 N -0.25 0.04 -0.82 1.13 3.64 -0.94 -1.74 116.57 117.64 2j5y h LYS 45 Ca 0.04 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2j5y h LYS 45 Cb 0.30 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 2j5y h LYS 45 CO -0.13 0.03 0.42 -0.91 -2.27 0.00 0.00 179.45 176.60 2j5y h ASN 46 N 0.05 1.04 -0.58 4.20 2.35 -0.59 -0.87 115.58 121.18 2j5y h ASN 46 Ca 0.10 -0.11 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 2j5y h ASN 46 Cb 0.13 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 2j5y h ASN 46 CO -0.17 0.86 -0.01 -0.33 -1.65 0.00 0.00 177.43 176.13 2j5y h GLU 47 N 1.14 1.02 -0.50 0.81 4.39 -1.00 -0.99 114.58 119.46 2j5y h GLU 47 Ca 0.28 -0.33 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 2j5y h GLU 47 Cb 0.07 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 2j5y h GLU 47 CO -0.04 1.01 0.19 0.82 -1.16 0.00 0.00 179.01 179.83 2j5y h ILE 48 N 0.91 1.22 -0.66 3.13 2.04 -1.03 -0.44 117.51 122.67 2j5y h ILE 48 Ca 0.16 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 2j5y h ILE 48 Cb 0.56 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 2j5y h ILE 48 CO 0.03 0.26 0.36 -0.07 0.00 0.00 0.00 178.15 178.73 2j5y h LEU 49 N 0.67 0.84 -0.61 1.44 3.38 -1.02 -1.96 115.31 118.03 2j5y h LEU 49 Ca 0.16 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2j5y h LEU 49 Cb 0.22 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2j5y h LEU 49 CO -0.01 0.70 0.35 0.11 0.09 0.00 0.00 178.44 179.67 2j5y h LYS 50 N 0.91 0.85 -0.06 1.13 1.57 -0.94 -1.40 116.57 118.63 2j5y h LYS 50 Ca 0.23 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.85 2j5y h LYS 50 Cb 0.05 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 2j5y h LYS 50 CO -0.04 0.63 -0.28 0.00 -0.57 0.00 0.00 179.45 179.19 2j5y h ALA 51 N 1.17 1.42 -0.25 3.86 0.00 -0.73 -3.01 119.26 121.72 2j5y h ALA 51 Ca 0.22 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2j5y h ALA 51 Cb 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2j5y h ALA 51 CO -0.04 0.42 0.00 0.72 0.00 0.00 0.00 179.25 180.35 2j5y n HIS 52 N -4.17 0.31 1.15 0.00 8.25 -0.77 -5.10 115.22 114.89 2j5y n HIS 52 Ca -0.02 -0.19 0.09 0.00 -0.26 0.00 0.00 57.72 57.34 2j5y n HIS 52 Cb 0.36 -0.00 0.54 0.00 1.12 0.00 0.00 29.99 32.01 2j5y n HIS 52 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98