#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j3c n LYS 2 N 0.00 0.00 -2.85 2.12 5.02 -1.26 -5.07 118.16 116.12 1j3c n LYS 2 Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1j3c n LYS 2 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.02 1j3c n LYS 2 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1j3c s LYS 3 N -1.00 0.59 0.06 1.97 2.20 -1.26 -5.05 119.74 117.25 1j3c s LYS 3 Ca 0.00 -0.42 -0.32 0.00 -0.36 0.00 0.00 55.97 54.87 1j3c s LYS 3 Cb 0.00 0.01 -0.18 0.00 -1.51 0.00 0.00 37.83 36.15 1j3c s LYS 3 CO 0.00 -0.78 1.57 0.87 -0.36 0.00 0.00 175.35 176.65 1j3c h LYS 4 N 5.39 -0.82 -2.70 4.03 1.57 -1.97 -3.47 116.57 118.60 1j3c h LYS 4 Ca 0.02 0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1j3c h LYS 4 Cb 1.17 0.19 -0.13 0.00 0.08 0.00 0.00 32.23 33.53 1j3c h LYS 4 CO -0.02 -0.53 0.32 -0.51 -0.57 0.00 0.00 179.45 178.14 1j3c s ASP 5 N -4.47 -0.49 -0.01 0.86 1.01 -1.26 -5.02 116.67 107.29 1j3c s ASP 5 Ca -0.17 0.02 -0.22 0.00 0.71 0.00 0.00 52.55 52.89 1j3c s ASP 5 Cb 0.03 0.52 -0.20 0.00 1.01 0.00 0.00 42.92 44.28 1j3c s ASP 5 CO 0.60 -0.83 1.17 1.55 0.21 0.00 0.00 175.17 177.87 1j3c h PRO 6 N 2.03 0.27 0.00 8.23 0.13 -2.04 -3.27 132.00 137.36 1j3c h PRO 6 Ca -0.29 -0.22 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 1j3c h PRO 6 Cb 1.28 0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 1j3c h PRO 6 CO 0.35 0.86 -0.16 -0.97 -0.23 0.00 0.00 178.00 177.86 1j3c h ASN 7 N -0.25 0.00 -3.93 1.44 -0.73 -2.03 -3.45 115.58 106.62 1j3c h ASN 7 Ca -0.02 0.00 -0.49 0.00 1.87 0.00 0.00 56.30 57.67 1j3c h ASN 7 Cb 0.91 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.52 1j3c h ASN 7 CO 0.05 0.16 0.42 0.00 -0.37 0.00 0.00 177.43 177.69 1j3c s ALA 8 N -3.16 3.14 -0.98 1.57 0.00 -1.23 -4.92 121.76 116.17 1j3c s ALA 8 Ca 0.06 0.74 -0.24 0.00 0.00 0.00 0.00 51.96 52.52 1j3c s ALA 8 Cb 0.06 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1j3c s ALA 8 CO 0.69 -0.21 1.80 -1.25 0.00 0.00 0.00 175.76 176.78 1j3c s PRO 9 N -2.30 2.91 0.20 0.00 0.04 -1.26 -4.70 135.00 129.89 1j3c s PRO 9 Ca 0.55 -0.69 -0.03 0.00 0.04 0.00 0.00 61.00 60.87 1j3c s PRO 9 Cb -0.24 -5.19 0.05 0.00 0.04 0.00 0.00 34.50 29.16 1j3c s PRO 9 CO 0.30 -3.06 0.11 1.63 0.04 0.00 0.00 177.00 176.02 1j3c n LYS 10 N 8.78 -1.59 -1.71 4.56 5.02 -1.26 -4.83 118.16 127.13 1j3c n LYS 10 Ca 0.39 -0.19 -0.42 0.00 -2.02 0.00 0.00 58.31 56.07 1j3c n LYS 10 Cb 0.48 -0.27 -0.01 0.00 -0.02 0.00 0.00 35.03 35.21 1j3c n LYS 10 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1j3c n ARG 11 N -2.01 2.26 -2.58 1.97 1.74 -1.26 -4.93 116.66 111.86 1j3c n ARG 11 Ca 0.02 0.79 -0.41 0.00 -0.77 0.00 0.00 57.85 57.48 1j3c n ARG 11 Cb 0.08 -2.42 -0.04 0.00 -1.02 0.00 0.00 32.46 29.06 1j3c n ARG 11 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1j3c s PRO 12 N -1.77 4.58 0.00 5.56 0.04 -1.26 -5.05 135.00 137.09 1j3c s PRO 12 Ca 0.56 1.62 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1j3c s PRO 12 Cb -0.55 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 30.64 1j3c s PRO 12 CO 0.61 0.01 0.00 -0.35 0.04 0.00 0.00 177.00 177.32 1j3c n PRO 13 N 3.07 0.96 -2.71 0.56 -0.04 -1.26 -5.08 135.00 130.50 1j3c n PRO 13 Ca 0.05 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.44 1j3c n PRO 13 Cb 0.48 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 34.02 1j3c n PRO 13 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1j3c n SER 14 N -0.75 -2.10 0.00 3.54 2.88 -1.26 -4.87 113.62 111.06 1j3c n SER 14 Ca 0.00 -2.97 0.00 0.00 -1.33 0.00 0.00 58.87 54.57 1j3c n SER 14 Cb 0.00 1.59 0.00 0.00 -0.75 0.00 0.00 64.21 65.05 1j3c n SER 14 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j3c n ALA 15 N 0.83 0.00 -0.21 -1.46 0.00 -1.26 -4.17 120.51 114.23 1j3c n ALA 15 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.46 1j3c n ALA 15 Cb 0.70 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.20 1j3c n ALA 15 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1j3c h PHE 16 N 0.00 -0.40 -0.97 0.00 3.57 -1.96 0.19 116.94 117.37 1j3c h PHE 16 Ca 0.00 0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.59 1j3c h PHE 16 Cb 0.00 0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.96 1j3c h PHE 16 CO 0.00 -0.29 0.64 0.74 -2.23 0.00 0.00 178.31 177.17 1j3c h PHE 17 N -0.02 1.19 -0.46 0.41 0.04 -1.95 0.28 116.94 116.44 1j3c h PHE 17 Ca 0.30 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 61.01 1j3c h PHE 17 Cb 0.48 -0.40 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 1j3c h PHE 17 CO -0.53 0.71 -0.06 -0.07 -0.60 0.00 0.00 178.31 177.76 1j3c h LEU 18 N 1.25 0.77 0.05 1.54 3.38 -1.06 -1.40 115.31 119.85 1j3c h LEU 18 Ca 0.37 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1j3c h LEU 18 Cb -0.05 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1j3c h LEU 18 CO -0.10 0.87 -0.03 0.15 0.09 0.00 0.00 178.44 179.43 1j3c h PHE 19 N 0.72 -0.07 0.11 1.13 3.04 -0.03 -3.03 116.94 118.81 1j3c h PHE 19 Ca 0.13 -0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.09 1j3c h PHE 19 Cb 0.53 0.02 -0.02 0.00 2.56 0.00 0.00 35.95 39.04 1j3c h PHE 19 CO 0.03 0.47 -0.18 0.00 -2.02 0.00 0.00 178.31 176.61 1j3c h SER 21 N -0.36 0.00 0.23 0.00 4.64 -1.41 0.20 113.55 116.87 1j3c h SER 21 Ca 0.02 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.12 1j3c h SER 21 Cb 0.37 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.42 1j3c h SER 21 CO -0.09 0.00 -1.97 -0.62 -0.87 0.00 0.00 176.83 173.27 1j3c n GLU 22 N -3.80 0.66 0.01 4.77 -0.58 -0.58 -4.43 120.64 116.68 1j3c n GLU 22 Ca 0.00 0.03 -0.15 0.00 -0.42 0.00 0.00 57.16 56.63 1j3c n GLU 22 Cb 0.25 -1.62 -0.14 0.00 -0.57 0.00 0.00 31.44 29.36 1j3c n GLU 22 CO 0.00 0.00 0.00 1.88 -0.48 0.00 0.00 177.13 178.53 1j3c h TYR 23 N 0.00 0.27 -0.47 -0.32 -1.99 0.14 -3.38 116.97 111.22 1j3c h TYR 23 Ca -0.29 -0.20 0.09 0.00 2.00 0.00 0.00 58.73 60.33 1j3c h TYR 23 Cb 1.75 -0.01 -0.10 0.00 2.00 0.00 0.00 36.73 40.37 1j3c h TYR 23 CO 0.00 1.35 -0.26 0.00 -0.00 0.00 0.00 178.16 179.25 1j3c h ARG 24 N 0.04 -0.15 -0.03 4.88 3.08 -0.82 0.21 114.38 121.59 1j3c h ARG 24 Ca -0.31 0.01 0.01 0.00 0.07 0.00 0.00 59.98 59.76 1j3c h ARG 24 Cb 2.01 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 32.10 1j3c h ARG 24 CO 0.10 -0.10 0.02 -1.00 -1.07 0.00 0.00 179.97 177.93 1j3c h PRO 25 N -0.16 0.00 -0.16 0.04 0.13 -1.79 -0.96 132.00 129.10 1j3c h PRO 25 Ca 0.21 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.28 1j3c h PRO 25 Cb 0.50 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.63 1j3c h PRO 25 CO -0.57 0.00 -0.16 -0.22 -0.23 0.00 0.00 178.00 176.83 1j3c h LYS 26 N 0.00 0.39 -0.35 0.86 3.11 -0.81 -2.91 116.57 116.86 1j3c h LYS 26 Ca 0.01 -0.21 0.06 0.00 -2.81 0.00 0.00 60.65 57.71 1j3c h LYS 26 Cb 0.06 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.28 1j3c h LYS 26 CO -0.00 0.76 0.24 0.82 -2.81 0.00 0.00 179.45 178.46 1j3c h ILE 27 N 0.03 0.93 -0.18 2.00 1.08 0.16 -2.05 117.51 119.48 1j3c h ILE 27 Ca 0.03 -0.07 -0.16 0.00 -0.39 0.00 0.00 64.86 64.27 1j3c h ILE 27 Cb 0.69 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 35.15 1j3c h ILE 27 CO 0.04 0.04 -0.55 0.11 -0.69 0.00 0.00 178.15 177.09 1j3c h LYS 28 N 0.19 0.56 0.00 2.37 1.79 -1.23 0.92 116.57 121.17 1j3c h LYS 28 Ca 0.16 -0.35 -0.01 0.00 -2.18 0.00 0.00 60.65 58.26 1j3c h LYS 28 Cb 0.37 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.06 1j3c h LYS 28 CO -0.03 0.96 -0.05 1.03 -1.08 0.00 0.00 179.45 180.28 1j3c h SER 29 N 0.43 0.00 0.00 0.86 0.87 -1.25 -3.12 113.55 111.34 1j3c h SER 29 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1j3c h SER 29 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 1j3c h SER 29 CO 0.10 0.05 -1.03 -0.62 -0.53 0.00 0.00 176.83 174.81 1j3c n GLU 30 N -3.51 0.76 -3.91 2.24 -0.58 -1.12 -4.90 120.64 109.61 1j3c n GLU 30 Ca -0.02 -0.03 -0.30 0.00 -0.42 0.00 0.00 57.16 56.39 1j3c n GLU 30 Cb 0.17 -1.03 -0.14 0.00 -0.57 0.00 0.00 31.44 29.87 1j3c n GLU 30 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 1j3c s HIS 31 N -2.11 3.04 0.13 -0.32 3.76 0.32 -4.95 115.29 115.16 1j3c s HIS 31 Ca -0.01 -2.77 -0.06 0.00 -0.15 0.00 0.00 55.06 52.08 1j3c s HIS 31 Cb 0.02 -2.56 -0.08 0.00 1.11 0.00 0.00 32.58 31.07 1j3c s HIS 31 CO 0.13 -0.86 1.33 -1.00 -0.85 0.00 0.00 174.74 173.48 1j3c h PRO 32 N 7.29 0.51 0.00 8.40 0.13 -1.81 -3.07 132.00 143.44 1j3c h PRO 32 Ca -0.06 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 1j3c h PRO 32 Cb 0.97 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1j3c h PRO 32 CO 0.55 1.12 0.00 0.78 -0.23 0.00 0.00 178.00 180.22 1j3c h GLY 33 N 1.04 0.00 -7.08 1.56 0.00 -1.93 -3.41 103.07 93.24 1j3c h GLY 33 Ca -0.07 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1j3c h GLY 33 CO 0.16 0.00 0.01 1.04 0.00 0.00 0.00 176.54 177.75 1j3c n LEU 34 N -2.60 1.28 -4.77 3.11 7.99 -1.16 -4.91 117.00 115.95 1j3c n LEU 34 Ca 0.03 -2.46 -0.29 0.00 -0.01 0.00 0.00 56.01 53.28 1j3c n LEU 34 Cb 0.35 -1.72 0.17 0.00 -0.11 0.00 0.00 43.42 42.11 1j3c n LEU 34 CO 0.27 -3.66 0.72 -0.94 -1.51 0.00 0.00 177.39 172.26 1j3c s SER 35 N 8.51 2.87 0.53 -1.43 1.04 -1.26 -4.49 113.70 119.46 1j3c s SER 35 Ca 0.81 0.78 0.29 0.00 0.48 0.00 0.00 55.95 58.31 1j3c s SER 35 Cb -0.05 -1.20 1.43 0.00 0.10 0.00 0.00 66.02 66.30 1j3c s SER 35 CO 0.19 -2.93 1.92 0.40 0.98 0.00 0.00 173.24 173.79 1j3c h ILE 36 N -1.77 0.61 0.12 -1.02 1.08 -1.95 0.57 117.51 115.15 1j3c h ILE 36 Ca -0.48 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 63.97 1j3c h ILE 36 Cb 1.31 0.58 0.00 0.00 -3.07 0.00 0.00 36.82 35.64 1j3c h ILE 36 CO 0.52 0.01 -0.06 1.23 -0.69 0.00 0.00 178.15 179.16 1j3c h GLY 37 N 0.03 -0.17 2.00 5.37 0.00 -1.96 0.04 103.07 108.38 1j3c h GLY 37 Ca 0.38 0.06 -0.07 0.00 0.00 0.00 0.00 47.33 47.70 1j3c h GLY 37 CO -0.02 -0.06 -0.34 -0.55 0.00 0.00 0.00 176.54 175.58 1j3c h ASP 38 N -0.16 0.00 0.33 0.19 5.19 -1.81 -2.58 116.42 117.58 1j3c h ASP 38 Ca -0.02 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.33 1j3c h ASP 38 Cb 0.12 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.62 1j3c h ASP 38 CO 0.03 0.34 -0.31 0.74 -3.12 0.00 0.00 179.24 176.91 1j3c h THR 39 N 0.00 1.20 -0.01 0.35 2.02 0.19 0.45 112.91 117.11 1j3c h THR 39 Ca -0.00 -1.09 -0.10 0.00 0.77 0.00 0.00 66.41 65.99 1j3c h THR 39 Cb 0.65 1.59 0.01 0.00 -1.74 0.00 0.00 68.15 68.66 1j3c h THR 39 CO 0.04 0.31 -0.39 0.00 0.37 0.00 0.00 175.52 175.85 1j3c h ALA 40 N 1.69 0.06 0.00 6.16 0.00 -0.57 -3.20 119.26 123.40 1j3c h ALA 40 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1j3c h ALA 40 Cb 0.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1j3c h ALA 40 CO 0.04 0.20 -0.25 0.36 0.00 0.00 0.00 179.25 179.60 1j3c n LYS 41 N -4.39 0.17 0.02 0.00 2.85 -1.14 -3.77 118.16 111.90 1j3c n LYS 41 Ca -0.10 0.10 -0.03 0.00 -1.05 0.00 0.00 58.31 57.23 1j3c n LYS 41 Cb 0.57 -1.66 -0.02 0.00 -0.65 0.00 0.00 35.03 33.28 1j3c n LYS 41 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 1j3c h LYS 42 N 0.00 -0.16 -0.59 -1.58 1.63 -0.17 -2.88 116.57 112.82 1j3c h LYS 42 Ca 0.00 0.01 0.17 0.00 -0.85 0.00 0.00 60.65 59.98 1j3c h LYS 42 Cb 0.65 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.29 1j3c h LYS 42 CO 0.00 -0.07 0.46 -0.07 -3.45 0.00 0.00 179.45 176.32 1j3c h LEU 43 N -1.04 0.00 -0.16 5.20 4.07 -1.72 -0.07 115.31 121.59 1j3c h LEU 43 Ca -0.02 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.84 1j3c h LEU 43 Cb 0.16 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.90 1j3c h LEU 43 CO 0.03 0.00 -0.30 1.23 -1.08 0.00 0.00 178.44 178.32 1j3c h GLY 44 N 0.00 0.53 0.87 0.83 0.00 -1.65 -2.21 103.07 101.44 1j3c h GLY 44 Ca 0.28 -0.62 0.13 0.00 0.00 0.00 0.00 47.33 47.12 1j3c h GLY 44 CO -0.00 0.55 0.45 0.83 0.00 0.00 0.00 176.54 178.37 1j3c h GLU 45 N 0.12 0.37 0.00 4.80 4.39 -0.78 -1.71 114.58 121.77 1j3c h GLU 45 Ca 0.01 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1j3c h GLU 45 Cb 0.88 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 1j3c h GLU 45 CO 0.07 0.24 -0.04 0.52 -1.16 0.00 0.00 179.01 178.64 1j3c h MET 46 N 0.38 0.03 -0.32 2.33 2.86 -1.41 -2.86 114.93 115.93 1j3c h MET 46 Ca 0.32 -0.03 0.07 0.00 -2.06 0.00 0.00 59.70 58.00 1j3c h MET 46 Cb 0.72 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 32.31 1j3c h MET 46 CO -0.09 0.86 -0.25 2.35 1.06 0.00 0.00 176.91 180.84 1j3c h TRP 47 N -0.80 -0.65 -0.38 -0.22 2.91 -0.80 -0.17 115.95 115.84 1j3c h TRP 47 Ca -0.01 0.04 -0.03 0.00 1.13 0.00 0.00 58.89 60.03 1j3c h TRP 47 Cb 0.88 0.34 -0.02 0.00 -0.51 0.00 0.00 29.16 29.84 1j3c h TRP 47 CO 0.22 -0.32 0.10 1.03 -1.03 0.00 0.00 178.44 178.43 1j3c h SER 48 N -0.21 0.52 -0.74 2.65 0.87 -1.46 -2.48 113.55 112.70 1j3c h SER 48 Ca 0.16 -0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.59 1j3c h SER 48 Cb 0.47 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.26 1j3c h SER 48 CO -0.45 0.52 0.24 -0.33 -0.53 0.00 0.00 176.83 176.28 1j3c h GLU 49 N 0.55 1.14 -7.08 2.24 4.39 -0.85 -3.44 114.58 111.55 1j3c h GLU 49 Ca 0.13 -0.24 -0.53 0.00 0.34 0.00 0.00 59.36 59.06 1j3c h GLU 49 Cb 0.21 -0.17 0.19 0.00 -0.10 0.00 0.00 28.75 28.88 1j3c h GLU 49 CO -0.00 0.97 0.05 1.04 -1.16 0.00 0.00 179.01 179.90 1j3c n GLN 50 N -4.25 -0.07 0.00 2.33 1.13 -0.36 -5.03 117.38 111.13 1j3c n GLN 50 Ca 0.06 0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.17 1j3c n GLN 50 Cb 0.23 -2.24 0.00 0.00 0.11 0.00 0.00 30.24 28.33 1j3c n GLN 50 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1j3c n SER 51 N -2.83 0.00 -2.30 1.08 2.88 -1.26 -4.90 113.62 106.29 1j3c n SER 51 Ca 0.11 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.43 1j3c n SER 51 Cb 0.51 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1j3c n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j3c n ALA 52 N -3.00 6.12 0.00 -1.46 0.00 -1.26 -4.09 120.51 116.82 1j3c n ALA 52 Ca 0.00 -2.59 0.00 0.00 0.00 0.00 0.00 53.44 50.85 1j3c n ALA 52 Cb 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 17.47 1j3c n ALA 52 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1j3c n LYS 53 N 0.91 0.00 0.12 0.00 5.02 -1.26 -4.66 118.16 118.29 1j3c n LYS 53 Ca 0.44 0.00 0.19 0.00 -2.02 0.00 0.00 58.31 56.91 1j3c n LYS 53 Cb 0.59 -0.70 0.76 0.00 -0.02 0.00 0.00 35.03 35.67 1j3c n LYS 53 CO 0.00 0.00 0.00 0.38 -0.52 0.00 0.00 177.40 177.26 1j3c h ASP 54 N 0.00 0.00 -0.55 4.39 2.03 -1.94 -0.09 116.42 120.26 1j3c h ASP 54 Ca 0.00 0.00 -0.23 0.00 -0.73 0.00 0.00 57.03 56.07 1j3c h ASP 54 Cb 0.65 0.00 -0.14 0.00 -0.83 0.00 0.00 39.33 39.02 1j3c h ASP 54 CO 0.00 0.00 0.16 1.17 -1.03 0.00 0.00 179.24 179.54 1j3c n LYS 55 N -3.90 2.51 -0.11 4.15 4.81 -1.26 -4.35 118.16 120.02 1j3c n LYS 55 Ca 0.05 -3.07 -0.19 0.00 -0.87 0.00 0.00 58.31 54.23 1j3c n LYS 55 Cb 0.49 -1.98 -0.06 0.00 0.02 0.00 0.00 35.03 33.50 1j3c n LYS 55 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1j3c n GLN 56 N -0.82 0.56 0.08 1.64 1.13 -0.05 -4.17 117.38 115.75 1j3c n GLN 56 Ca 0.38 0.24 -0.19 0.00 -1.94 0.00 0.00 57.00 55.49 1j3c n GLN 56 Cb 1.22 -1.46 -0.15 0.00 0.11 0.00 0.00 30.24 29.96 1j3c n GLN 56 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1j3c h PRO 57 N -1.00 0.33 -0.01 -1.09 0.13 -1.82 -3.31 132.00 125.23 1j3c h PRO 57 Ca -0.34 -0.56 0.00 0.00 -0.87 0.00 0.00 66.00 64.23 1j3c h PRO 57 Cb 1.29 0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.63 1j3c h PRO 57 CO -0.20 1.22 0.00 0.66 -0.23 0.00 0.00 178.00 179.45 1j3c n TYR 58 N -3.53 0.01 0.03 1.56 4.01 -1.26 -3.38 117.16 114.60 1j3c n TYR 58 Ca -0.17 -0.01 0.11 0.00 -0.16 0.00 0.00 57.90 57.67 1j3c n TYR 58 Cb 1.06 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.97 1j3c n TYR 58 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 1j3c n GLU 59 N -0.70 0.64 0.17 -0.72 -0.00 -1.24 -4.09 120.64 114.69 1j3c n GLU 59 Ca 0.12 -0.10 0.05 0.00 -0.00 0.00 0.00 57.16 57.23 1j3c n GLU 59 Cb 0.07 -1.61 0.15 0.00 -0.00 0.00 0.00 31.44 30.05 1j3c n GLU 59 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.13 176.57 1j3c h GLN 60 N 0.00 0.00 -0.82 3.44 3.07 -1.72 -3.24 115.11 115.84 1j3c h GLN 60 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.74 1j3c h GLN 60 Cb 1.00 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.52 1j3c h GLN 60 CO 0.00 0.40 0.50 -0.22 0.09 0.00 0.00 178.83 179.60 1j3c h LYS 61 N 0.00 1.10 0.00 0.06 3.64 -1.74 -1.05 116.57 118.58 1j3c h LYS 61 Ca -0.00 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1j3c h LYS 61 Cb 1.19 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1j3c h LYS 61 CO 0.05 0.77 0.00 0.00 -2.27 0.00 0.00 179.45 178.00 1j3c n ALA 62 N -2.35 1.80 0.57 5.00 0.00 -1.22 -2.45 120.51 121.86 1j3c n ALA 62 Ca 0.08 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.59 1j3c n ALA 62 Cb 0.05 -1.30 0.23 0.00 0.00 0.00 0.00 19.45 18.44 1j3c n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j3c n ALA 63 N -1.52 2.44 -0.09 0.00 0.00 -0.41 -4.06 120.51 116.87 1j3c n ALA 63 Ca 0.04 -0.87 -0.14 0.00 0.00 0.00 0.00 53.44 52.47 1j3c n ALA 63 Cb 0.21 -0.91 -0.09 0.00 0.00 0.00 0.00 19.45 18.67 1j3c n ALA 63 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1j3c n LYS 64 N 1.27 0.46 0.00 0.00 4.76 -1.02 -4.41 118.16 119.21 1j3c n LYS 64 Ca 0.18 0.11 0.15 0.00 -2.87 0.00 0.00 58.31 55.89 1j3c n LYS 64 Cb 0.56 -1.36 0.89 0.00 -1.84 0.00 0.00 35.03 33.28 1j3c n LYS 64 CO 0.00 0.00 0.00 1.47 -1.37 0.00 0.00 177.40 177.50 1j3c n LEU 65 N -3.10 0.00 0.06 -0.35 -0.00 -1.23 -3.08 117.00 109.30 1j3c n LEU 65 Ca -0.33 0.01 0.09 0.00 -0.00 0.00 0.00 56.01 55.78 1j3c n LEU 65 Cb 0.85 -0.01 -0.05 0.00 -0.00 0.00 0.00 43.42 44.20 1j3c n LEU 65 CO 0.17 -0.00 -0.23 1.17 -0.00 0.00 0.00 177.39 178.51 1j3c n LYS 66 N -1.01 0.62 0.04 1.47 4.81 -1.26 -2.73 118.16 120.11 1j3c n LYS 66 Ca 0.22 0.06 0.13 0.00 -0.87 0.00 0.00 58.31 57.86 1j3c n LYS 66 Cb 0.11 -1.75 0.41 0.00 0.02 0.00 0.00 35.03 33.81 1j3c n LYS 66 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1j3c n GLU 67 N -2.62 0.14 -0.07 1.64 1.02 -1.18 -2.62 120.64 116.95 1j3c n GLU 67 Ca -0.03 0.08 -0.08 0.00 -0.02 0.00 0.00 57.16 57.12 1j3c n GLU 67 Cb 0.61 -1.63 -0.12 0.00 -0.02 0.00 0.00 31.44 30.28 1j3c n GLU 67 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1j3c n LYS 68 N -1.85 1.53 0.01 3.49 4.81 -1.25 -4.31 118.16 120.58 1j3c n LYS 68 Ca 0.06 -0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.39 1j3c n LYS 68 Cb 0.39 -1.38 -0.08 0.00 0.02 0.00 0.00 35.03 33.97 1j3c n LYS 68 CO 0.00 0.00 0.00 -0.92 1.17 0.00 0.00 177.40 177.65 1j3c h TYR 69 N 0.00 -0.12 0.00 5.64 3.20 -1.61 0.83 116.97 124.92 1j3c h TYR 69 Ca -0.40 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.46 1j3c h TYR 69 Cb 1.91 0.04 0.00 0.00 1.54 0.00 0.00 36.73 40.22 1j3c h TYR 69 CO 0.00 0.40 0.17 0.93 -1.64 0.00 0.00 178.16 178.02 1j3c h GLU 70 N -0.87 0.00 0.00 1.82 4.39 -1.76 0.17 114.58 118.33 1j3c h GLU 70 Ca -0.01 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.45 1j3c h GLU 70 Cb 0.57 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.18 1j3c h GLU 70 CO 0.02 0.00 -1.95 1.63 -1.16 0.00 0.00 179.01 177.55 1j3c n LYS 71 N -2.89 1.55 0.05 2.33 5.02 -1.22 -4.48 118.16 118.53 1j3c n LYS 71 Ca -0.02 -0.02 -0.22 0.00 -2.02 0.00 0.00 58.31 56.03 1j3c n LYS 71 Cb 0.23 -1.37 -0.15 0.00 -0.02 0.00 0.00 35.03 33.73 1j3c n LYS 71 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 1j3c h ASP 72 N 0.00 0.55 0.14 4.39 3.58 -0.18 -3.33 116.42 121.57 1j3c h ASP 72 Ca -0.35 -0.91 -0.00 0.00 0.42 0.00 0.00 57.03 56.19 1j3c h ASP 72 Cb 1.76 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 42.63 1j3c h ASP 72 CO 0.02 1.78 -0.01 -0.29 -2.88 0.00 0.00 179.24 177.86 1j3c h ILE 73 N 0.10 0.11 -0.62 2.25 6.09 -0.89 -1.90 117.51 122.65 1j3c h ILE 73 Ca -0.36 -0.09 -0.02 0.00 -1.37 0.00 0.00 64.86 63.01 1j3c h ILE 73 Cb 2.08 1.08 -0.03 0.00 0.47 0.00 0.00 36.82 40.42 1j3c h ILE 73 CO 0.15 0.01 0.29 0.00 -3.07 0.00 0.00 178.15 175.53 1j3c h ALA 74 N 1.99 1.34 0.00 0.18 0.00 -1.76 -2.57 119.26 118.45 1j3c h ALA 74 Ca -0.00 -0.13 -0.20 0.00 0.00 0.00 0.00 54.91 54.58 1j3c h ALA 74 Cb 0.08 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1j3c h ALA 74 CO 0.00 0.51 -1.75 0.00 0.00 0.00 0.00 179.25 178.01 1j3c n ALA 75 N -2.45 1.95 0.23 0.00 0.00 -0.81 -4.02 120.51 115.42 1j3c n ALA 75 Ca 0.06 -0.74 0.06 0.00 0.00 0.00 0.00 53.44 52.82 1j3c n ALA 75 Cb 0.14 -0.74 0.54 0.00 0.00 0.00 0.00 19.45 19.40 1j3c n ALA 75 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1j3c h TYR 76 N 0.00 0.00 0.00 0.00 3.20 -1.16 -3.32 116.97 115.69 1j3c h TYR 76 Ca -0.24 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.63 1j3c h TYR 76 Cb 1.67 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.94 1j3c h TYR 76 CO 0.00 0.16 0.00 0.54 -1.64 0.00 0.00 178.16 177.22 1j3c n ARG 77 N -4.24 0.00 -3.76 1.82 1.74 -0.99 -4.95 116.66 106.28 1j3c n ARG 77 Ca -0.02 0.21 -0.24 0.00 -0.77 0.00 0.00 57.85 57.02 1j3c n ARG 77 Cb 0.23 -0.73 0.03 0.00 -1.02 0.00 0.00 32.46 30.97 1j3c n ARG 77 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1j3c n ALA 78 N -1.12 -1.78 -0.88 7.54 0.00 -1.25 -5.15 120.51 117.87 1j3c n ALA 78 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1j3c n ALA 78 Cb 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 16.67 1j3c n ALA 78 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86