#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j3x n GLY 2 N 0.00 1.34 0.03 3.17 0.00 -1.26 -4.99 105.19 103.47 1j3x n GLY 2 Ca 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 46.02 45.69 1j3x n GLY 2 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j3x n LYS 3 N -0.83 1.17 -1.47 1.61 5.02 -1.26 -5.03 118.16 117.37 1j3x n LYS 3 Ca 0.00 0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 55.98 1j3x n LYS 3 Cb 0.18 -1.12 0.08 0.00 -0.02 0.00 0.00 35.03 34.15 1j3x n LYS 3 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1j3x s GLY 4 N -4.24 2.18 0.13 0.72 0.00 -1.15 -4.85 107.32 100.10 1j3x s GLY 4 Ca -0.06 0.70 0.00 0.00 0.00 0.00 0.00 44.72 45.36 1j3x s GLY 4 CO 0.15 1.08 0.00 1.22 0.00 0.00 0.00 173.10 175.55 1j3x n ASP 5 N -2.80 -1.16 -0.04 1.64 8.00 0.28 -3.65 116.55 118.82 1j3x n ASP 5 Ca 0.12 0.61 -0.16 0.00 0.71 0.00 0.00 54.79 56.07 1j3x n ASP 5 Cb 0.51 1.44 -0.07 0.00 -0.02 0.00 0.00 41.12 42.97 1j3x n ASP 5 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1j3x h PRO 6 N 0.00 0.65 0.00 -0.24 0.13 -1.96 -3.42 132.00 127.15 1j3x h PRO 6 Ca 0.00 -0.49 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 1j3x h PRO 6 Cb 0.00 0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.22 1j3x h PRO 6 CO 0.00 1.11 -0.68 0.09 -0.23 0.00 0.00 178.00 178.29 1j3x n ASN 7 N -4.14 0.49 -4.89 1.44 3.02 -1.26 -5.06 115.26 104.86 1j3x n ASN 7 Ca -0.07 0.07 -0.29 0.00 -0.03 0.00 0.00 54.58 54.26 1j3x n ASN 7 Cb 0.63 -0.16 -0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1j3x n ASN 7 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1j3x s LYS 8 N -2.03 3.58 0.88 3.52 3.01 -1.26 -5.06 119.74 122.38 1j3x s LYS 8 Ca -0.02 0.39 -0.12 0.00 -1.01 0.00 0.00 55.97 55.22 1j3x s LYS 8 Cb 0.00 -2.29 0.12 0.00 -1.01 0.00 0.00 37.83 34.66 1j3x s LYS 8 CO 0.02 -0.30 1.10 -1.25 0.51 0.00 0.00 175.35 175.43 1j3x s PRO 9 N -4.81 1.39 -0.42 -1.68 0.04 -1.26 0.10 135.00 128.36 1j3x s PRO 9 Ca 0.50 0.58 0.04 0.00 0.04 0.00 0.00 61.00 62.16 1j3x s PRO 9 Cb -0.10 -1.84 0.63 0.00 0.04 0.00 0.00 34.50 33.23 1j3x s PRO 9 CO 0.47 -2.09 1.87 2.89 0.04 0.00 0.00 177.00 180.18 1j3x n ARG 10 N -3.74 2.20 0.00 4.56 1.85 -1.24 -2.96 116.66 117.33 1j3x n ARG 10 Ca 0.07 -2.85 0.00 0.00 -1.00 0.00 0.00 57.85 54.07 1j3x n ARG 10 Cb 0.57 -2.12 0.00 0.00 -1.05 0.00 0.00 32.46 29.86 1j3x n ARG 10 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1j3x n GLY 11 N -1.05 -2.04 0.05 2.89 0.00 -1.26 -4.09 105.19 99.69 1j3x n GLY 11 Ca 0.57 -1.63 -0.06 0.00 0.00 0.00 0.00 46.02 44.89 1j3x n GLY 11 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j3x n LYS 12 N -0.05 1.59 -0.75 1.61 5.02 -1.26 -4.97 118.16 119.36 1j3x n LYS 12 Ca 0.00 0.03 0.10 0.00 -2.02 0.00 0.00 58.31 56.42 1j3x n LYS 12 Cb 0.00 -1.25 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 1j3x n LYS 12 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1j3x n MET 13 N -2.56 -1.50 -4.02 1.97 2.81 -1.26 -4.70 117.12 107.86 1j3x n MET 13 Ca -0.18 0.99 -0.16 0.00 -1.81 0.00 0.00 57.70 56.54 1j3x n MET 13 Cb 0.78 -1.83 -0.04 0.00 -0.71 0.00 0.00 33.22 31.42 1j3x n MET 13 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1j3x n SER 14 N -4.08 -1.19 0.24 7.83 2.88 -1.26 -4.91 113.62 113.14 1j3x n SER 14 Ca 0.01 -2.95 0.10 0.00 -1.33 0.00 0.00 58.87 54.70 1j3x n SER 14 Cb 0.34 2.31 0.69 0.00 -0.75 0.00 0.00 64.21 66.80 1j3x n SER 14 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1j3x h SER 15 N 1.98 0.00 -0.00 -3.46 4.64 -1.93 -1.17 113.55 113.60 1j3x h SER 15 Ca -0.26 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.82 1j3x h SER 15 Cb 1.18 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.29 1j3x h SER 15 CO 0.36 0.00 -0.94 0.22 -0.87 0.00 0.00 176.83 175.60 1j3x h TYR 16 N 0.00 0.96 -0.21 4.77 3.20 -1.95 -2.46 116.97 121.27 1j3x h TYR 16 Ca 0.02 -0.52 -0.11 0.00 3.14 0.00 0.00 58.73 61.27 1j3x h TYR 16 Cb 0.10 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1j3x h TYR 16 CO 0.00 1.35 -0.33 0.00 -1.64 0.00 0.00 178.16 177.54 1j3x h ALA 17 N 0.39 1.03 0.00 1.82 0.00 -1.77 -2.78 119.26 117.95 1j3x h ALA 17 Ca -0.12 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.28 1j3x h ALA 17 Cb 1.61 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 1j3x h ALA 17 CO 0.19 0.59 -0.62 0.74 0.00 0.00 0.00 179.25 180.15 1j3x h PHE 18 N 0.38 0.00 0.52 0.00 0.04 -1.27 -2.81 116.94 113.80 1j3x h PHE 18 Ca 0.05 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.79 1j3x h PHE 18 Cb 0.77 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.92 1j3x h PHE 18 CO 0.02 0.62 -0.25 0.35 -0.60 0.00 0.00 178.31 178.45 1j3x h PHE 19 N 0.00 -0.65 -0.09 -0.55 3.57 -1.15 0.13 116.94 118.20 1j3x h PHE 19 Ca -0.01 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 1j3x h PHE 19 Cb 1.16 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 40.11 1j3x h PHE 19 CO 0.00 -0.37 -0.08 0.28 -2.23 0.00 0.00 178.31 175.91 1j3x h VAL 20 N -0.79 1.12 -0.11 1.41 2.07 -1.60 0.84 116.25 119.19 1j3x h VAL 20 Ca -0.07 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 1j3x h VAL 20 Cb 0.58 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1j3x h VAL 20 CO 0.12 0.16 -0.07 -0.61 0.02 0.00 0.00 177.57 177.18 1j3x h GLN 21 N 0.13 0.25 0.02 1.57 5.75 -1.20 -0.20 115.11 121.43 1j3x h GLN 21 Ca 0.03 -0.12 -0.21 0.00 -0.15 0.00 0.00 58.65 58.21 1j3x h GLN 21 Cb 0.24 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.77 1j3x h GLN 21 CO 0.01 0.62 -0.95 1.15 -2.65 0.00 0.00 178.83 177.01 1j3x h THR 22 N -0.12 1.58 -0.04 2.39 2.02 -0.41 -3.09 112.91 115.24 1j3x h THR 22 Ca 0.02 -2.95 -0.12 0.00 0.77 0.00 0.00 66.41 64.14 1j3x h THR 22 Cb 0.55 2.65 -0.01 0.00 -1.74 0.00 0.00 68.15 69.60 1j3x h THR 22 CO 0.02 0.85 -0.52 0.28 0.37 0.00 0.00 175.52 176.52 1j3x h SER 23 N 0.05 0.11 -0.27 4.18 0.02 0.71 -2.50 113.55 115.85 1j3x h SER 23 Ca -0.04 -0.05 -0.12 0.00 -0.84 0.00 0.00 61.79 60.74 1j3x h SER 23 Cb 1.63 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 64.14 1j3x h SER 23 CO 0.14 0.61 -0.29 0.03 -1.14 0.00 0.00 176.83 176.18 1j3x h ARG 24 N 0.08 0.67 -0.50 3.45 3.08 -1.02 -2.72 114.38 117.42 1j3x h ARG 24 Ca -0.00 -0.36 -0.04 0.00 0.07 0.00 0.00 59.98 59.65 1j3x h ARG 24 Cb 0.94 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 1j3x h ARG 24 CO 0.07 0.97 0.14 0.93 -1.07 0.00 0.00 179.97 181.02 1j3x h GLU 25 N 0.40 0.75 0.00 0.04 5.08 -1.45 -0.94 114.58 118.47 1j3x h GLU 25 Ca 0.04 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1j3x h GLU 25 Cb 0.86 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 1j3x h GLU 25 CO 0.07 0.67 -0.05 1.49 -1.00 0.00 0.00 179.01 180.18 1j3x h GLU 26 N 0.73 0.00 -1.12 2.33 4.22 -1.30 -2.57 114.58 116.88 1j3x h GLU 26 Ca 0.17 0.00 -0.45 0.00 0.08 0.00 0.00 59.36 59.16 1j3x h GLU 26 Cb 0.24 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.26 1j3x h GLU 26 CO -0.01 0.05 0.58 1.58 -2.18 0.00 0.00 179.01 179.04 1j3x n HIS 27 N -3.25 2.38 -1.45 0.92 -0.00 -0.36 -4.26 115.22 109.20 1j3x n HIS 27 Ca -0.01 -2.02 0.07 0.00 0.46 0.00 0.00 57.72 56.22 1j3x n HIS 27 Cb 0.25 -1.00 0.19 0.00 -0.12 0.00 0.00 29.99 29.31 1j3x n HIS 27 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1j3x n LYS 28 N -0.54 1.50 0.00 1.57 4.76 -0.97 -4.67 118.16 119.82 1j3x n LYS 28 Ca 0.46 -3.10 0.00 0.00 -2.87 0.00 0.00 58.31 52.80 1j3x n LYS 28 Cb 1.01 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 32.62 1j3x n LYS 28 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1j3x n LYS 29 N -1.21 0.00 -1.69 1.97 4.01 -1.26 -4.87 118.16 115.12 1j3x n LYS 29 Ca 0.18 0.00 -0.32 0.00 -0.51 0.00 0.00 58.31 57.66 1j3x n LYS 29 Cb 0.68 0.00 -0.03 0.00 -0.51 0.00 0.00 35.03 35.17 1j3x n LYS 29 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 1j3x n LYS 30 N -0.94 2.80 -2.82 1.97 2.85 -1.26 -4.48 118.16 116.29 1j3x n LYS 30 Ca 0.00 -2.84 -0.11 0.00 -1.05 0.00 0.00 58.31 54.31 1j3x n LYS 30 Cb 0.00 -2.23 0.03 0.00 -0.65 0.00 0.00 35.03 32.17 1j3x n LYS 30 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1j3x n HIS 31 N 0.55 0.28 -0.03 5.58 8.25 -1.26 -4.92 115.22 123.67 1j3x n HIS 31 Ca 0.51 -2.95 -0.14 0.00 -0.26 0.00 0.00 57.72 54.88 1j3x n HIS 31 Cb 0.43 -0.08 -0.11 0.00 1.12 0.00 0.00 29.99 31.36 1j3x n HIS 31 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1j3x h PRO 32 N 2.90 0.06 0.00 -0.41 0.13 -1.93 -3.34 132.00 129.42 1j3x h PRO 32 Ca -0.06 -0.05 -0.20 0.00 -0.87 0.00 0.00 66.00 64.81 1j3x h PRO 32 Cb 1.13 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 1j3x h PRO 32 CO 0.42 0.69 -1.36 0.38 -0.23 0.00 0.00 178.00 177.90 1j3x h ASP 33 N -0.55 0.00 -0.88 1.44 2.03 -1.98 -3.42 116.42 113.06 1j3x h ASP 33 Ca -0.00 0.00 -0.54 0.00 -0.73 0.00 0.00 57.03 55.76 1j3x h ASP 33 Cb 0.70 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 39.12 1j3x h ASP 33 CO 0.01 0.75 1.54 -0.55 -1.03 0.00 0.00 179.24 179.96 1j3x s SER 34 N -6.06 6.19 1.08 4.15 0.15 -1.25 -4.97 113.70 112.98 1j3x s SER 34 Ca -0.02 -1.67 -0.16 0.00 0.70 0.00 0.00 55.95 54.80 1j3x s SER 34 Cb 0.08 -2.57 0.23 0.00 -1.71 0.00 0.00 66.02 62.05 1j3x s SER 34 CO 0.81 -1.82 1.15 -0.55 1.20 0.00 0.00 173.24 174.03 1j3x s SER 35 N 5.44 2.04 -0.45 5.45 0.15 -1.26 -4.88 113.70 120.19 1j3x s SER 35 Ca 0.55 0.72 0.05 0.00 0.70 0.00 0.00 55.95 57.97 1j3x s SER 35 Cb 0.00 -1.06 0.18 0.00 -1.71 0.00 0.00 66.02 63.43 1j3x s SER 35 CO 0.00 -3.44 0.47 1.33 1.20 0.00 0.00 173.24 172.80 1j3x n VAL 36 N -4.32 -0.82 -0.95 4.45 0.24 -1.26 -4.97 118.33 110.71 1j3x n VAL 36 Ca 0.11 -2.62 -0.30 0.00 -2.04 0.00 0.00 64.34 59.48 1j3x n VAL 36 Cb 0.59 -0.77 -0.03 0.00 -1.47 0.00 0.00 33.84 32.16 1j3x n VAL 36 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1j3x n ASN 37 N 2.87 4.35 0.00 -1.34 6.94 -1.26 -4.79 115.26 122.03 1j3x n ASN 37 Ca 0.26 -2.47 0.00 0.00 -0.02 0.00 0.00 54.58 52.35 1j3x n ASN 37 Cb 0.51 -1.16 0.00 0.00 -2.36 0.00 0.00 39.78 36.77 1j3x n ASN 37 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 1j3x n PHE 38 N 5.27 0.00 -0.30 -2.53 3.72 -1.26 -3.84 117.46 118.52 1j3x n PHE 38 Ca 0.48 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 58.00 1j3x n PHE 38 Cb 0.23 0.00 0.26 0.00 -0.94 0.00 0.00 39.48 39.03 1j3x n PHE 38 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1j3x h ALA 39 N -0.84 1.12 -0.01 4.37 0.00 -1.95 1.83 119.26 123.78 1j3x h ALA 39 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1j3x h ALA 39 Cb 0.00 0.43 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1j3x h ALA 39 CO 0.00 -0.49 0.07 0.93 0.00 0.00 0.00 179.25 179.76 1j3x h GLU 40 N 0.12 0.00 0.00 0.00 3.07 -1.89 -1.91 114.58 113.96 1j3x h GLU 40 Ca 0.53 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 59.20 1j3x h GLU 40 Cb 1.06 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.94 1j3x h GLU 40 CO -0.74 0.00 -1.72 0.34 -1.40 0.00 0.00 179.01 175.49 1j3x n PHE 41 N -3.17 0.00 0.26 4.33 7.35 0.33 -4.20 117.46 122.36 1j3x n PHE 41 Ca -0.03 0.00 0.18 0.00 -0.76 0.00 0.00 57.45 56.84 1j3x n PHE 41 Cb 0.14 -0.49 0.91 0.00 0.35 0.00 0.00 39.48 40.40 1j3x n PHE 41 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 1j3x h SER 42 N 0.00 0.00 0.69 -2.13 4.64 0.25 0.15 113.55 117.15 1j3x h SER 42 Ca -0.28 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.82 1j3x h SER 42 Cb 1.45 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.50 1j3x h SER 42 CO -0.04 0.00 -1.45 0.11 -0.87 0.00 0.00 176.83 174.58 1j3x h LYS 43 N 0.00 0.00 0.14 4.77 1.79 -1.56 -3.35 116.57 118.36 1j3x h LYS 43 Ca 0.05 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.20 1j3x h LYS 43 Cb 0.41 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.06 1j3x h LYS 43 CO -0.00 0.42 -1.64 -0.22 -1.08 0.00 0.00 179.45 176.93 1j3x h LYS 44 N 0.00 0.31 -0.13 3.15 1.63 -1.13 -3.33 116.57 117.07 1j3x h LYS 44 Ca -0.19 -0.52 0.03 0.00 -0.85 0.00 0.00 60.65 59.12 1j3x h LYS 44 Cb 1.75 0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 33.57 1j3x h LYS 44 CO 0.07 1.19 0.09 0.00 -3.45 0.00 0.00 179.45 177.34 1j3x h SER 46 N 0.01 1.01 -0.07 0.00 4.64 -1.70 0.15 113.55 117.59 1j3x h SER 46 Ca 0.06 -0.45 -0.05 0.00 -0.47 0.00 0.00 61.79 60.88 1j3x h SER 46 Cb 0.22 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1j3x h SER 46 CO -0.00 1.25 -0.08 -0.33 -0.87 0.00 0.00 176.83 176.80 1j3x h GLU 47 N 0.78 0.33 0.21 4.77 4.39 -1.42 0.20 114.58 123.83 1j3x h GLU 47 Ca 0.07 -0.07 -0.35 0.00 0.34 0.00 0.00 59.36 59.36 1j3x h GLU 47 Cb 0.95 -0.05 0.02 0.00 -0.10 0.00 0.00 28.75 29.57 1j3x h GLU 47 CO 0.09 0.42 -1.65 0.00 -1.16 0.00 0.00 179.01 176.71 1j3x h ARG 48 N 0.31 0.44 -0.26 2.33 2.47 -1.30 -2.99 114.38 115.37 1j3x h ARG 48 Ca 0.07 -0.75 -0.14 0.00 -1.26 0.00 0.00 59.98 57.90 1j3x h ARG 48 Cb 0.34 0.28 -0.01 0.00 -1.65 0.00 0.00 29.97 28.93 1j3x h ARG 48 CO 0.02 1.35 -0.40 2.35 0.56 0.00 0.00 179.97 183.85 1j3x h TRP 49 N 0.12 0.74 0.00 3.04 2.91 -0.52 -0.67 115.95 121.56 1j3x h TRP 49 Ca -0.31 -0.21 -0.12 0.00 1.13 0.00 0.00 58.89 59.38 1j3x h TRP 49 Cb 2.12 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 30.60 1j3x h TRP 49 CO 0.11 0.92 -0.56 0.87 -1.03 0.00 0.00 178.44 178.75 1j3x h LYS 50 N 0.51 0.00 0.00 2.65 1.79 -0.72 -3.04 116.57 117.75 1j3x h LYS 50 Ca 0.04 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.34 1j3x h LYS 50 Cb 0.91 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.53 1j3x h LYS 50 CO 0.08 0.56 -1.00 1.79 -1.08 0.00 0.00 179.45 179.80 1j3x h THR 51 N 0.00 1.04 -4.04 -0.16 1.35 -1.35 -3.46 112.91 106.29 1j3x h THR 51 Ca -0.01 -2.60 -0.56 0.00 -0.55 0.00 0.00 66.41 62.70 1j3x h THR 51 Cb 1.02 2.47 0.15 0.00 -1.73 0.00 0.00 68.15 70.05 1j3x h THR 51 CO 0.07 0.59 0.57 0.23 -0.25 0.00 0.00 175.52 176.73 1j3x n MET 52 N -3.17 1.51 -2.53 4.72 2.81 -0.28 -5.02 117.12 115.16 1j3x n MET 52 Ca -0.03 0.56 -0.15 0.00 -1.81 0.00 0.00 57.70 56.27 1j3x n MET 52 Cb 0.86 -2.56 0.05 0.00 -0.71 0.00 0.00 33.22 30.86 1j3x n MET 52 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1j3x n SER 53 N -1.27 1.63 0.26 7.83 7.64 -1.26 -4.86 113.62 123.59 1j3x n SER 53 Ca 0.12 -2.19 0.14 0.00 1.01 0.00 0.00 58.87 57.95 1j3x n SER 53 Cb 0.46 -0.33 0.65 0.00 -1.01 0.00 0.00 64.21 63.98 1j3x n SER 53 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1j3x h ALA 54 N 0.20 1.08 -0.01 -0.43 0.00 -1.96 0.97 119.26 119.11 1j3x h ALA 54 Ca -0.21 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 1j3x h ALA 54 Cb 0.96 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1j3x h ALA 54 CO 0.30 0.14 -0.45 0.87 0.00 0.00 0.00 179.25 180.11 1j3x h LYS 55 N 0.00 0.03 0.01 0.00 1.57 -2.00 -1.94 116.57 114.23 1j3x h LYS 55 Ca -0.00 -0.01 -0.40 0.00 -1.87 0.00 0.00 60.65 58.36 1j3x h LYS 55 Cb 0.52 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.76 1j3x h LYS 55 CO 0.01 0.48 -2.46 0.39 -0.57 0.00 0.00 179.45 177.31 1j3x n GLU 56 N -4.00 0.64 0.30 3.15 1.02 -1.01 -4.30 120.64 116.44 1j3x n GLU 56 Ca -0.02 0.19 0.17 0.00 -0.02 0.00 0.00 57.16 57.48 1j3x n GLU 56 Cb 0.48 -1.53 0.93 0.00 -0.02 0.00 0.00 31.44 31.30 1j3x n GLU 56 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1j3x h LYS 57 N -0.23 0.00 0.00 3.49 1.57 -0.89 -2.22 116.57 118.29 1j3x h LYS 57 Ca -0.60 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.17 1j3x h LYS 57 Cb 1.84 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.14 1j3x h LYS 57 CO -0.16 0.04 -0.05 0.66 -0.57 0.00 0.00 179.45 179.37 1j3x h SER 58 N 0.00 0.00 0.32 0.86 4.64 -1.53 -0.80 113.55 117.03 1j3x h SER 58 Ca -0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1j3x h SER 58 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1j3x h SER 58 CO 0.01 0.05 -0.27 0.50 -0.87 0.00 0.00 176.83 176.24 1j3x h LYS 59 N 0.00 0.00 0.00 4.77 3.64 -1.64 -2.03 116.57 121.31 1j3x h LYS 59 Ca -0.00 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.12 1j3x h LYS 59 Cb 0.09 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.86 1j3x h LYS 59 CO 0.01 0.27 -1.77 1.19 -2.27 0.00 0.00 179.45 176.88 1j3x n PHE 60 N -4.11 0.77 0.15 1.91 3.01 -0.53 -3.73 117.46 114.93 1j3x n PHE 60 Ca -0.02 0.27 0.00 0.00 1.01 0.00 0.00 57.45 58.71 1j3x n PHE 60 Cb 0.33 -1.10 0.21 0.00 -0.01 0.00 0.00 39.48 38.91 1j3x n PHE 60 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1j3x h GLU 61 N 0.00 0.00 0.00 -1.08 4.81 -0.99 -2.71 114.58 114.61 1j3x h GLU 61 Ca -0.29 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.78 1j3x h GLU 61 Cb 1.91 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.26 1j3x h GLU 61 CO 0.06 0.56 -0.74 0.22 -0.73 0.00 0.00 179.01 178.38 1j3x h ASP 62 N 0.00 0.00 1.02 1.04 3.58 -1.52 -2.89 116.42 117.65 1j3x h ASP 62 Ca -0.01 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.28 1j3x h ASP 62 Cb 1.03 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.06 1j3x h ASP 62 CO 0.07 0.74 -0.77 0.24 -2.88 0.00 0.00 179.24 176.64 1j3x h MET 63 N 0.00 0.00 0.00 0.28 2.86 -1.61 -2.90 114.93 113.56 1j3x h MET 63 Ca -0.01 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.44 1j3x h MET 63 Cb 1.49 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.12 1j3x h MET 63 CO 0.10 0.77 -0.94 0.00 1.06 0.00 0.00 176.91 177.90 1j3x h ALA 64 N 1.23 0.42 0.00 6.32 0.00 -1.50 -3.27 119.26 122.46 1j3x h ALA 64 Ca -0.01 -0.85 -0.17 0.00 0.00 0.00 0.00 54.91 53.89 1j3x h ALA 64 Cb 1.49 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 1j3x h ALA 64 CO 0.10 1.15 -0.79 -0.22 0.00 0.00 0.00 179.25 179.49 1j3x h LYS 65 N 0.00 0.00 -0.47 0.00 1.63 -1.53 -2.68 116.57 113.52 1j3x h LYS 65 Ca -0.02 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.73 1j3x h LYS 65 Cb 1.71 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 33.32 1j3x h LYS 65 CO 0.12 0.79 0.10 1.03 -3.45 0.00 0.00 179.45 178.04 1j3x h SER 66 N 0.00 0.67 0.47 4.20 0.87 -1.56 -1.13 113.55 117.07 1j3x h SER 66 Ca -0.01 -0.11 -0.30 0.00 -1.23 0.00 0.00 61.79 60.14 1j3x h SER 66 Cb 1.47 -0.17 0.01 0.00 -0.44 0.00 0.00 62.40 63.26 1j3x h SER 66 CO 0.10 0.67 -1.44 -0.78 -0.53 0.00 0.00 176.83 174.86 1j3x h ASP 67 N 0.69 0.49 0.34 6.23 1.82 -1.64 -2.29 116.42 122.05 1j3x h ASP 67 Ca 0.15 -0.59 -0.07 0.00 -0.39 0.00 0.00 57.03 56.13 1j3x h ASP 67 Cb 0.28 -0.16 -0.01 0.00 0.68 0.00 0.00 39.33 40.12 1j3x h ASP 67 CO -0.00 1.48 -0.34 0.50 -1.61 0.00 0.00 179.24 179.27 1j3x h LYS 68 N 0.08 0.00 0.00 0.28 3.11 -1.28 -0.61 116.57 118.16 1j3x h LYS 68 Ca -0.21 0.00 -0.28 0.00 -2.81 0.00 0.00 60.65 57.35 1j3x h LYS 68 Cb 2.03 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 33.21 1j3x h LYS 68 CO 0.20 0.34 -1.59 0.00 -2.81 0.00 0.00 179.45 175.58 1j3x h ALA 69 N 1.66 0.71 0.00 5.00 0.00 -1.28 -3.35 119.26 122.00 1j3x h ALA 69 Ca -0.00 -1.38 -0.17 0.00 0.00 0.00 0.00 54.91 53.36 1j3x h ALA 69 Cb 0.60 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1j3x h ALA 69 CO 0.04 1.54 -0.80 -0.09 0.00 0.00 0.00 179.25 179.93 1j3x h ARG 70 N 0.00 0.00 0.00 0.00 2.43 -1.22 -3.18 114.38 112.41 1j3x h ARG 70 Ca -0.24 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.91 1j3x h ARG 70 Cb 1.97 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.52 1j3x h ARG 70 CO 0.09 0.80 -0.07 -0.92 -1.51 0.00 0.00 179.97 178.36 1j3x h TYR 71 N 0.00 0.00 -0.57 2.20 5.03 -1.24 -2.23 116.97 120.15 1j3x h TYR 71 Ca -0.01 0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.31 1j3x h TYR 71 Cb 1.50 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 39.75 1j3x h TYR 71 CO 0.00 0.07 0.38 -0.44 -1.32 0.00 0.00 178.16 176.85 1j3x h ASP 72 N 0.00 0.65 -0.61 -2.11 5.19 -1.71 -2.83 116.42 114.99 1j3x h ASP 72 Ca -0.00 -0.02 -0.37 0.00 -0.62 0.00 0.00 57.03 56.02 1j3x h ASP 72 Cb 0.17 -0.16 -0.22 0.00 0.18 0.00 0.00 39.33 39.30 1j3x h ASP 72 CO 0.01 0.47 0.05 0.54 -3.12 0.00 0.00 179.24 177.19 1j3x n ARG 73 N -4.69 2.32 -0.09 3.56 1.74 -0.98 -4.33 116.66 114.19 1j3x n ARG 73 Ca 0.04 -3.35 -0.13 0.00 -0.77 0.00 0.00 57.85 53.64 1j3x n ARG 73 Cb 0.02 -2.02 -0.06 0.00 -1.02 0.00 0.00 32.46 29.38 1j3x n ARG 73 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1j3x n GLU 74 N -1.03 0.51 -0.07 5.56 4.07 -0.88 -4.69 120.64 124.11 1j3x n GLU 74 Ca 0.44 0.55 -0.06 0.00 -0.06 0.00 0.00 57.16 58.03 1j3x n GLU 74 Cb 1.06 -1.72 -0.12 0.00 -0.06 0.00 0.00 31.44 30.61 1j3x n GLU 74 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 1j3x n MET 75 N -4.52 1.47 -2.63 5.31 2.81 -1.26 -4.90 117.12 113.40 1j3x n MET 75 Ca -0.20 -0.02 -0.43 0.00 -1.81 0.00 0.00 57.70 55.24 1j3x n MET 75 Cb 0.47 -1.38 -0.02 0.00 -0.71 0.00 0.00 33.22 31.58 1j3x n MET 75 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1j3x s LYS 76 N -2.43 3.84 0.00 0.03 -0.14 -1.26 -5.21 119.74 114.57 1j3x s LYS 76 Ca -0.07 0.73 0.25 0.00 -1.36 0.00 0.00 55.97 55.52 1j3x s LYS 76 Cb 0.05 -3.84 0.32 0.00 -1.68 0.00 0.00 37.83 32.68 1j3x s LYS 76 CO 0.61 -1.19 1.33 0.09 -0.76 0.00 0.00 175.35 175.43