#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jpo n PRO 2 N 0.00 2.50 0.00 4.33 -0.04 -1.26 -4.08 135.00 136.45 2jpo n PRO 2 Ca 0.00 -2.92 0.00 0.00 -0.04 0.00 0.00 63.50 60.54 2jpo n PRO 2 Cb 0.00 -3.60 0.00 0.00 -0.04 0.00 0.00 33.50 29.86 2jpo n PRO 2 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2jpo n GLU 3 N 8.32 0.00 -1.56 0.54 2.13 -1.26 -5.00 120.64 123.81 2jpo n GLU 3 Ca 0.47 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 58.24 2jpo n GLU 3 Cb 0.46 0.00 0.09 0.00 0.27 0.00 0.00 31.44 32.26 2jpo n GLU 3 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2jpo n ILE 4 N -2.42 1.81 -1.15 6.31 -5.35 -1.26 -4.83 119.36 112.47 2jpo n ILE 4 Ca 0.00 -3.15 -0.03 0.00 -0.27 0.00 0.00 62.75 59.30 2jpo n ILE 4 Cb 0.00 -0.10 0.26 0.00 -1.74 0.00 0.00 39.64 38.06 2jpo n ILE 4 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 2jpo n MET 5 N -0.64 2.92 -2.69 6.28 2.81 -1.26 -4.31 117.12 120.24 2jpo n MET 5 Ca 0.23 -3.04 -0.07 0.00 -1.81 0.00 0.00 57.70 53.01 2jpo n MET 5 Cb 0.87 -2.01 0.07 0.00 -0.71 0.00 0.00 33.22 31.44 2jpo n MET 5 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2jpo n LYS 6 N -0.57 1.22 -3.74 0.03 5.02 -1.26 -5.10 118.16 113.75 2jpo n LYS 6 Ca 0.35 -2.65 -0.12 0.00 -2.02 0.00 0.00 58.31 53.87 2jpo n LYS 6 Cb 1.19 -0.75 -0.11 0.00 -0.02 0.00 0.00 35.03 35.33 2jpo n LYS 6 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2jpo s ASN 7 N -2.38 -0.34 0.00 4.39 0.01 -1.26 -5.04 114.94 110.32 2jpo s ASN 7 Ca 0.24 0.65 0.23 0.00 -0.71 0.00 0.00 52.86 53.27 2jpo s ASN 7 Cb 0.43 0.60 1.16 0.00 0.41 0.00 0.00 41.25 43.85 2jpo s ASN 7 CO -0.02 -0.14 1.75 0.00 -1.51 0.00 0.00 177.10 177.18 2jpo n LEU 8 N 3.50 0.00 -0.24 0.60 -0.00 -1.26 -4.18 117.00 115.41 2jpo n LEU 8 Ca -0.18 0.28 -0.02 0.00 -0.00 0.00 0.00 56.01 56.09 2jpo n LEU 8 Cb 0.56 -0.28 0.01 0.00 -0.00 0.00 0.00 43.42 43.72 2jpo n LEU 8 CO 0.14 -0.07 0.35 -1.20 -0.00 0.00 0.00 177.39 176.62 2jpo n SER 9 N -1.28 -0.44 -0.07 1.45 7.64 -1.26 -0.61 113.62 119.06 2jpo n SER 9 Ca 0.11 1.09 -0.13 0.00 1.01 0.00 0.00 58.87 60.95 2jpo n SER 9 Cb 0.18 -0.23 -0.06 0.00 -1.01 0.00 0.00 64.21 63.08 2jpo n SER 9 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2jpo h ASN 10 N 0.00 0.52 -0.30 6.43 2.35 -1.96 -2.07 115.58 120.54 2jpo h ASN 10 Ca 0.20 -0.49 -0.15 0.00 -0.55 0.00 0.00 56.30 55.31 2jpo h ASN 10 Cb 0.35 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 2jpo h ASN 10 CO -0.61 0.90 -0.37 0.78 -1.65 0.00 0.00 177.43 176.48 2jpo h ASN 11 N 0.15 0.90 -0.08 5.81 2.35 -1.43 0.03 115.58 123.30 2jpo h ASN 11 Ca 0.03 -0.40 0.04 0.00 -0.55 0.00 0.00 56.30 55.42 2jpo h ASN 11 Cb 0.76 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 38.83 2jpo h ASN 11 CO 0.05 1.16 -0.28 0.15 -1.65 0.00 0.00 177.43 176.87 2jpo h PHE 12 N 0.70 -0.75 -0.40 1.19 3.04 -0.88 -0.37 116.94 119.46 2jpo h PHE 12 Ca 0.06 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.03 2jpo h PHE 12 Cb 0.94 0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.77 2jpo h PHE 12 CO 0.05 -0.36 0.18 0.78 -2.02 0.00 0.00 178.31 176.95 2jpo h GLY 13 N -0.37 0.60 0.72 2.40 0.00 -0.86 0.03 103.07 105.59 2jpo h GLY 13 Ca 0.09 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 2jpo h GLY 13 CO -0.29 0.26 -0.04 1.70 0.00 0.00 0.00 176.54 178.16 2jpo h LYS 14 N 0.56 -0.11 -0.93 4.80 3.64 -0.52 0.83 116.57 124.84 2jpo h LYS 14 Ca 0.14 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.58 2jpo h LYS 14 Cb 0.08 0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 31.87 2jpo h LYS 14 CO -0.02 0.17 0.61 0.00 -2.27 0.00 0.00 179.45 177.94 2jpo h ALA 15 N 0.48 1.45 -0.25 5.00 0.00 -0.46 0.97 119.26 126.46 2jpo h ALA 15 Ca -0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2jpo h ALA 15 Cb 0.34 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2jpo h ALA 15 CO 0.02 0.43 0.14 1.98 0.00 0.00 0.00 179.25 181.82 2jpo h MET 16 N 1.11 0.34 -0.79 0.00 1.85 -0.86 -2.00 114.93 114.58 2jpo h MET 16 Ca 0.39 -0.04 -0.00 0.00 -0.61 0.00 0.00 59.70 59.44 2jpo h MET 16 Cb 0.12 -0.07 -0.04 0.00 0.43 0.00 0.00 31.60 32.04 2jpo h MET 16 CO -0.14 0.29 0.48 0.22 -0.40 0.00 0.00 176.91 177.36 2jpo h ASP 17 N 0.30 0.94 -0.47 1.39 3.58 0.37 0.35 116.42 122.88 2jpo h ASP 17 Ca 0.09 -0.05 0.02 0.00 0.42 0.00 0.00 57.03 57.51 2jpo h ASP 17 Cb 0.04 -0.24 -0.03 0.00 1.72 0.00 0.00 39.33 40.83 2jpo h ASP 17 CO -0.02 0.71 0.28 1.56 -2.88 0.00 0.00 179.24 178.90 2jpo h GLN 18 N 1.08 0.55 -0.45 0.28 4.20 -0.65 -1.38 115.11 118.75 2jpo h GLN 18 Ca 0.28 -0.03 -0.10 0.00 0.06 0.00 0.00 58.65 58.86 2jpo h GLN 18 Cb -0.06 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 2jpo h GLN 18 CO -0.06 0.37 -0.12 0.00 -0.67 0.00 0.00 178.83 178.35 2jpo n LYS 20 N -4.25 0.12 -0.02 0.00 4.81 0.11 -1.22 118.16 117.71 2jpo n LYS 20 Ca -0.00 0.62 -0.05 0.00 -0.87 0.00 0.00 58.31 58.01 2jpo n LYS 20 Cb 0.39 -1.94 -0.02 0.00 0.02 0.00 0.00 35.03 33.49 2jpo n LYS 20 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2jpo n ASP 21 N -2.18 1.47 0.22 3.14 -0.08 -0.55 -2.48 116.55 116.09 2jpo n ASP 21 Ca -0.01 0.23 0.07 0.00 -1.51 0.00 0.00 54.79 53.56 2jpo n ASP 21 Cb 0.06 -0.52 0.53 0.00 2.34 0.00 0.00 41.12 43.53 2jpo n ASP 21 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2jpo h GLU 22 N -0.48 0.00 -0.01 -0.67 5.08 -0.49 -0.59 114.58 117.44 2jpo h GLU 22 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2jpo h GLU 22 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2jpo h GLU 22 CO -0.02 0.22 -0.49 1.28 -1.00 0.00 0.00 179.01 179.00 2jpo n LEU 23 N -4.03 1.23 -3.67 1.33 4.77 -0.35 -5.01 117.00 111.27 2jpo n LEU 23 Ca -0.02 -0.65 -0.25 0.00 -0.03 0.00 0.00 56.01 55.06 2jpo n LEU 23 Cb 0.29 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.45 2jpo n LEU 23 CO 0.35 0.25 0.21 -0.24 -1.33 0.00 0.00 177.39 176.63 2jpo n SER 24 N -0.65 -5.75 -4.75 -1.43 2.88 -0.23 -4.92 113.62 98.76 2jpo n SER 24 Ca 0.05 -0.61 -0.41 0.00 -1.33 0.00 0.00 58.87 56.57 2jpo n SER 24 Cb 0.29 -4.75 -0.02 0.00 -0.75 0.00 0.00 64.21 58.98 2jpo n SER 24 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2jpo s LEU 25 N -7.26 4.39 0.64 2.46 1.43 -1.04 -4.92 118.68 114.39 2jpo s LEU 25 Ca 0.57 2.70 -0.16 0.00 -1.03 0.00 0.00 54.13 56.22 2jpo s LEU 25 Cb -0.26 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.32 2jpo s LEU 25 CO 0.76 -0.67 1.12 -2.16 0.23 0.00 0.00 176.35 175.62 2jpo s PRO 26 N -0.91 2.86 0.55 1.29 0.04 -1.26 -4.74 135.00 132.83 2jpo s PRO 26 Ca 0.56 1.45 0.25 0.00 0.04 0.00 0.00 61.00 63.30 2jpo s PRO 26 Cb -0.42 -1.95 1.48 0.00 0.04 0.00 0.00 34.50 33.65 2jpo s PRO 26 CO 0.48 -1.21 2.06 0.22 0.04 0.00 0.00 177.00 178.58 2jpo h ASP 27 N 0.21 0.00 -0.30 6.66 1.82 -1.96 0.19 116.42 123.03 2jpo h ASP 27 Ca -0.47 0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 55.99 2jpo h ASP 27 Cb 1.25 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.26 2jpo h ASP 27 CO 0.54 0.00 -0.52 0.77 -1.61 0.00 0.00 179.24 178.43 2jpo h SER 28 N 0.00 0.98 -0.04 2.28 4.64 -1.98 0.15 113.55 119.57 2jpo h SER 28 Ca 0.14 -0.52 -0.18 0.00 -0.47 0.00 0.00 61.79 60.76 2jpo h SER 28 Cb 0.65 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2jpo h SER 28 CO -0.00 1.31 -0.61 0.58 -0.87 0.00 0.00 176.83 177.24 2jpo h VAL 29 N 0.67 1.31 -0.19 0.95 2.07 -1.38 0.56 116.25 120.24 2jpo h VAL 29 Ca 0.02 -1.86 -0.02 0.00 0.82 0.00 0.00 66.70 65.66 2jpo h VAL 29 Cb 1.13 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.71 2jpo h VAL 29 CO 0.12 0.58 0.05 0.58 0.02 0.00 0.00 177.57 178.93 2jpo h VAL 30 N 0.48 1.20 -0.63 2.57 2.07 -1.01 0.70 116.25 121.63 2jpo h VAL 30 Ca -0.01 -0.62 -0.05 0.00 0.82 0.00 0.00 66.70 66.84 2jpo h VAL 30 Cb 1.19 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 32.18 2jpo h VAL 30 CO 0.12 0.19 0.19 0.00 0.02 0.00 0.00 177.57 178.10 2jpo h ALA 31 N 0.87 0.83 -0.59 1.67 0.00 -0.73 -1.34 119.26 119.97 2jpo h ALA 31 Ca 0.06 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2jpo h ALA 31 Cb 0.25 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2jpo h ALA 31 CO -0.00 0.51 0.30 0.22 0.00 0.00 0.00 179.25 180.28 2jpo h ASP 32 N 0.91 0.42 0.43 0.00 1.82 -0.69 -0.76 116.42 118.55 2jpo h ASP 32 Ca 0.20 0.04 -0.01 0.00 -0.39 0.00 0.00 57.03 56.87 2jpo h ASP 32 Cb 0.30 -0.04 -0.01 0.00 0.68 0.00 0.00 39.33 40.26 2jpo h ASP 32 CO -0.01 0.27 -0.31 -0.07 -1.61 0.00 0.00 179.24 177.51 2jpo h LEU 33 N 0.56 -0.81 -1.68 2.28 4.07 -0.50 -1.11 115.31 118.11 2jpo h LEU 33 Ca 0.27 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.29 2jpo h LEU 33 Cb 0.20 0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.18 2jpo h LEU 33 CO -0.19 -0.47 0.19 1.88 -1.08 0.00 0.00 178.44 178.76 2jpo h TYR 34 N -0.73 0.38 0.00 1.13 0.05 -1.02 -0.92 116.97 115.86 2jpo h TYR 34 Ca -0.04 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.69 2jpo h TYR 34 Cb 0.62 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.22 2jpo h TYR 34 CO -0.14 0.25 -0.26 -0.91 -1.05 0.00 0.00 178.16 176.06 2jpo h ASN 35 N 0.41 0.00 0.06 3.88 2.35 -0.80 -3.37 115.58 118.12 2jpo h ASN 35 Ca 0.11 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.88 2jpo h ASN 35 Cb -0.03 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 2jpo h ASN 35 CO -0.02 0.26 -0.23 0.15 -1.65 0.00 0.00 177.43 175.94 2jpo h PHE 36 N 0.00 -0.60 -0.10 1.19 3.57 0.14 -2.56 116.94 118.58 2jpo h PHE 36 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2jpo h PHE 36 Cb 0.74 0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.74 2jpo h PHE 36 CO 0.00 -0.32 0.00 0.91 -2.23 0.00 0.00 178.31 176.67 2jpo n TRP 37 N -5.35 0.12 0.08 0.41 7.02 -1.26 -2.72 117.44 115.75 2jpo n TRP 37 Ca -0.06 -0.06 -0.11 0.00 -1.02 0.00 0.00 57.50 56.25 2jpo n TRP 37 Cb 0.26 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 29.02 2jpo n TRP 37 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 2jpo h LYS 38 N 2.03 0.13 0.00 -0.99 3.64 -1.61 -3.45 116.57 116.33 2jpo h LYS 38 Ca 0.00 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 2jpo h LYS 38 Cb 0.44 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2jpo h LYS 38 CO 0.00 1.10 0.00 -0.25 -2.27 0.00 0.00 179.45 178.03 2jpo n ASP 39 N -3.43 0.00 -3.15 4.20 8.00 -1.26 -5.09 116.55 115.81 2jpo n ASP 39 Ca -0.05 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.50 2jpo n ASP 39 Cb 0.98 0.14 -0.01 0.00 -0.02 0.00 0.00 41.12 42.21 2jpo n ASP 39 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2jpo s ASP 40 N -2.81 -0.71 -0.02 -2.24 2.15 -1.26 -5.15 116.67 106.63 2jpo s ASP 40 Ca 0.00 0.26 0.02 0.00 0.43 0.00 0.00 52.55 53.26 2jpo s ASP 40 Cb 0.00 1.52 0.00 0.00 -0.30 0.00 0.00 42.92 44.14 2jpo s ASP 40 CO 0.00 -0.13 -0.07 -0.47 -0.17 0.00 0.00 175.17 174.33 2jpo s TYR 41 N 2.93 0.74 -0.32 -5.34 6.14 -1.10 -5.08 117.35 115.32 2jpo s TYR 41 Ca 0.13 -0.16 -0.11 0.00 0.64 0.00 0.00 57.07 57.57 2jpo s TYR 41 Cb -0.08 -0.52 -0.02 0.00 0.42 0.00 0.00 41.96 41.77 2jpo s TYR 41 CO -0.18 -0.06 0.19 0.08 0.64 0.00 0.00 175.55 176.22 2jpo s VAL 42 N 0.06 4.97 0.60 3.14 1.01 -1.26 -4.82 120.40 124.12 2jpo s VAL 42 Ca -0.01 -0.25 -0.14 0.00 0.00 0.00 0.00 61.98 61.59 2jpo s VAL 42 Cb -0.06 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 2jpo s VAL 42 CO -0.00 0.07 1.04 0.00 0.00 0.00 0.00 175.10 176.20 2jpo s MET 43 N 1.68 3.41 0.00 2.72 0.23 -1.26 -5.00 119.30 121.08 2jpo s MET 43 Ca 0.06 1.01 0.00 0.00 -1.03 0.00 0.00 55.69 55.73 2jpo s MET 43 Cb -0.17 -2.05 0.00 0.00 -1.53 0.00 0.00 34.83 31.08 2jpo s MET 43 CO 0.09 -0.72 0.00 0.25 -2.03 0.00 0.00 175.02 172.61 2jpo n THR 44 N -2.32 0.00 -0.74 3.16 -2.24 -1.26 -5.06 114.28 105.82 2jpo n THR 44 Ca 0.07 -0.33 -0.29 0.00 -2.27 0.00 0.00 64.05 61.23 2jpo n THR 44 Cb 0.53 1.00 0.25 0.00 -2.10 0.00 0.00 70.33 70.01 2jpo n THR 44 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2jpo s ASP 45 N -0.66 0.54 -0.05 3.42 -1.08 -1.26 -5.02 116.67 112.56 2jpo s ASP 45 Ca 0.00 0.99 0.11 0.00 -0.52 0.00 0.00 52.55 53.13 2jpo s ASP 45 Cb 0.00 -1.48 -0.16 0.00 -1.46 0.00 0.00 42.92 39.82 2jpo s ASP 45 CO 0.00 -4.40 0.16 -2.11 0.52 0.00 0.00 175.17 169.34 2jpo n ARG 46 N -5.00 1.17 0.20 4.34 1.85 -1.26 -4.70 116.66 113.26 2jpo n ARG 46 Ca 0.09 -0.06 0.04 0.00 -1.00 0.00 0.00 57.85 56.92 2jpo n ARG 46 Cb 0.58 -1.27 0.42 0.00 -1.05 0.00 0.00 32.46 31.14 2jpo n ARG 46 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 2jpo h LEU 47 N 0.00 0.00 -0.86 2.89 3.38 -1.95 -1.80 115.31 116.96 2jpo h LEU 47 Ca -0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2jpo h LEU 47 Cb 1.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.71 2jpo h LEU 47 CO 0.01 0.29 0.43 0.00 0.09 0.00 0.00 178.44 179.26 2jpo h ALA 48 N 1.71 1.11 -1.01 1.53 0.00 -1.88 -0.12 119.26 120.59 2jpo h ALA 48 Ca -0.00 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.78 2jpo h ALA 48 Cb 0.51 -0.34 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 2jpo h ALA 48 CO 0.04 0.65 0.66 0.78 0.00 0.00 0.00 179.25 181.39 2jpo h GLY 49 N 1.22 1.45 1.19 0.00 0.00 -1.58 -0.49 103.07 104.86 2jpo h GLY 49 Ca 0.30 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2jpo h GLY 49 CO -0.04 0.47 0.25 0.00 0.00 0.00 0.00 176.54 177.22 2jpo h ALA 51 N 1.26 0.07 0.09 0.00 0.00 -0.17 -2.45 119.26 118.07 2jpo h ALA 51 Ca 0.23 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.18 2jpo h ALA 51 Cb 0.23 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2jpo h ALA 51 CO -0.02 -0.47 -0.24 0.82 0.00 0.00 0.00 179.25 179.35 2jpo h ILE 52 N 0.03 0.46 0.00 0.00 2.04 -0.56 0.85 117.51 120.34 2jpo h ILE 52 Ca 0.04 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 2jpo h ILE 52 Cb 0.04 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 2jpo h ILE 52 CO -0.07 0.00 -0.02 -0.55 0.00 0.00 0.00 178.15 177.51 2jpo h ASN 53 N -0.43 0.00 0.03 1.72 7.08 -1.21 -1.54 115.58 121.23 2jpo h ASN 53 Ca 0.04 0.00 -0.09 0.00 -3.08 0.00 0.00 56.30 53.17 2jpo h ASN 53 Cb 0.46 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 36.71 2jpo h ASN 53 CO -0.15 0.02 -0.36 0.00 -2.08 0.00 0.00 177.43 174.86 2jpo h LEU 55 N -0.51 0.38 -0.77 0.00 -0.00 -0.11 0.12 115.31 114.41 2jpo h LEU 55 Ca -0.05 0.04 -0.06 0.00 -0.00 0.00 0.00 57.88 57.81 2jpo h LEU 55 Cb 1.17 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.79 2jpo h LEU 55 CO 0.07 0.15 -0.28 0.00 -0.00 0.00 0.00 178.44 178.38 2jpo h ALA 56 N 1.61 0.94 -0.00 1.53 0.00 -1.30 -1.75 119.26 120.28 2jpo h ALA 56 Ca 0.46 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2jpo h ALA 56 Cb 1.19 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2jpo h ALA 56 CO -0.16 0.35 -0.03 -2.37 0.00 0.00 0.00 179.25 177.05 2jpo n THR 57 N -3.34 0.00 -2.38 0.00 5.66 0.01 -4.12 114.28 110.11 2jpo n THR 57 Ca 0.01 -0.01 -0.06 0.00 -3.05 0.00 0.00 64.05 60.94 2jpo n THR 57 Cb 0.51 -0.43 0.06 0.00 -1.55 0.00 0.00 70.33 68.92 2jpo n THR 57 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2jpo n LYS 58 N -1.26 2.04 0.24 1.09 5.02 -0.66 -4.85 118.16 119.78 2jpo n LYS 58 Ca 0.13 -3.46 0.07 0.00 -2.02 0.00 0.00 58.31 53.04 2jpo n LYS 58 Cb 0.26 -1.57 0.59 0.00 -0.02 0.00 0.00 35.03 34.29 2jpo n LYS 58 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2jpo h LEU 59 N 2.03 0.00 -0.41 -0.35 3.38 -1.71 0.12 115.31 118.38 2jpo h LEU 59 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2jpo h LEU 59 Cb 1.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.17 2jpo h LEU 59 CO 0.33 0.10 0.00 -0.90 0.09 0.00 0.00 178.44 178.06 2jpo n ASP 60 N -4.34 0.49 -0.13 -0.43 5.75 -1.26 -1.28 116.55 115.34 2jpo n ASP 60 Ca -0.03 0.61 -0.20 0.00 -0.01 0.00 0.00 54.79 55.16 2jpo n ASP 60 Cb 0.17 -0.71 -0.12 0.00 -1.03 0.00 0.00 41.12 39.43 2jpo n ASP 60 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 2jpo n VAL 61 N -2.02 1.50 0.37 2.12 0.31 0.19 -3.99 118.33 116.81 2jpo n VAL 61 Ca 0.03 -0.54 -0.18 0.00 -0.01 0.00 0.00 64.34 63.64 2jpo n VAL 61 Cb 0.24 -1.51 -0.09 0.00 -0.91 0.00 0.00 33.84 31.57 2jpo n VAL 61 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2jpo h VAL 62 N -0.18 0.30 -3.23 2.52 2.07 -0.77 -3.39 116.25 113.57 2jpo h VAL 62 Ca -0.60 0.00 -0.63 0.00 0.82 0.00 0.00 66.70 66.29 2jpo h VAL 62 Cb 1.85 0.30 -0.41 0.00 -1.52 0.00 0.00 31.29 31.51 2jpo h VAL 62 CO -0.15 0.00 -0.67 -0.62 0.02 0.00 0.00 177.57 176.15 2jpo s ASP 63 N -4.37 4.05 0.00 0.57 -1.08 -0.40 -3.71 116.67 111.73 2jpo s ASP 63 Ca -0.18 -2.84 0.23 0.00 -0.52 0.00 0.00 52.55 49.25 2jpo s ASP 63 Cb 0.03 -1.39 1.35 0.00 -1.46 0.00 0.00 42.92 41.45 2jpo s ASP 63 CO 0.62 -0.25 1.74 -0.81 0.52 0.00 0.00 175.17 176.99 2jpo n PRO 64 N 3.31 0.68 0.15 4.34 -0.04 -1.26 -2.68 135.00 139.51 2jpo n PRO 64 Ca 0.06 0.01 0.01 0.00 -0.04 0.00 0.00 63.50 63.54 2jpo n PRO 64 Cb 0.33 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.50 2jpo n PRO 64 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2jpo h ASP 65 N 0.00 0.00 0.00 3.54 1.82 -1.92 -3.48 116.42 116.38 2jpo h ASP 65 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2jpo h ASP 65 Cb 0.02 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.03 2jpo h ASP 65 CO 0.00 0.54 0.00 0.61 -1.61 0.00 0.00 179.24 178.78 2jpo n GLY 66 N 0.36 1.74 0.09 -0.78 0.00 -1.09 -5.06 105.19 100.45 2jpo n GLY 66 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2jpo n GLY 66 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2jpo h ASN 67 N 0.00 0.00 -2.82 1.61 2.35 -1.93 -3.46 115.58 111.32 2jpo h ASN 67 Ca 0.00 -0.29 -0.57 0.00 -0.55 0.00 0.00 56.30 54.89 2jpo h ASN 67 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 2jpo h ASN 67 CO 0.00 1.13 1.13 -0.22 -1.65 0.00 0.00 177.43 177.82 2jpo s LEU 68 N -8.06 3.83 0.32 1.61 2.96 -1.26 -4.38 118.68 113.70 2jpo s LEU 68 Ca -0.22 1.50 -0.03 0.00 -0.22 0.00 0.00 54.13 55.16 2jpo s LEU 68 Cb 0.04 -3.53 -0.00 0.00 0.50 0.00 0.00 46.19 43.19 2jpo s LEU 68 CO 0.42 -1.31 0.44 -1.00 -1.32 0.00 0.00 176.35 173.58 2jpo s HIS 69 N 5.34 1.05 0.11 5.38 3.76 -1.26 -4.43 115.29 125.24 2jpo s HIS 69 Ca 0.70 -1.27 -0.34 0.00 -0.15 0.00 0.00 55.06 54.01 2jpo s HIS 69 Cb -0.23 -0.13 -0.13 0.00 1.11 0.00 0.00 32.58 33.19 2jpo s HIS 69 CO 0.29 -1.07 1.66 0.72 -0.85 0.00 0.00 174.74 175.49 2jpo n HIS 70 N -0.53 2.32 -1.31 1.40 8.25 -1.26 -1.46 115.22 122.63 2jpo n HIS 70 Ca 0.01 0.18 -0.12 0.00 -0.26 0.00 0.00 57.72 57.53 2jpo n HIS 70 Cb 0.62 -2.58 -0.05 0.00 1.12 0.00 0.00 29.99 29.10 2jpo n HIS 70 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jpo n GLY 71 N 3.67 1.17 0.73 -1.41 0.00 -0.18 -4.82 105.19 104.36 2jpo n GLY 71 Ca 0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.26 2jpo n GLY 71 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2jpo n ASN 72 N -0.78 1.57 0.12 1.61 5.15 -0.54 -4.74 115.26 117.66 2jpo n ASN 72 Ca -0.12 -3.35 0.08 0.00 -0.60 0.00 0.00 54.58 50.59 2jpo n ASN 72 Cb 0.52 -0.46 0.43 0.00 -0.53 0.00 0.00 39.78 39.75 2jpo n ASN 72 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jpo n ALA 73 N -0.77 1.06 0.16 5.20 0.00 -1.26 -3.13 120.51 121.77 2jpo n ALA 73 Ca 0.15 0.14 -0.14 0.00 0.00 0.00 0.00 53.44 53.60 2jpo n ALA 73 Cb 0.78 -1.24 -0.08 0.00 0.00 0.00 0.00 19.45 18.91 2jpo n ALA 73 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2jpo h LYS 74 N 0.00 -0.38 -0.95 0.00 1.57 -1.85 0.11 116.57 115.07 2jpo h LYS 74 Ca 0.00 0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 2jpo h LYS 74 Cb 0.02 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.35 2jpo h LYS 74 CO 0.00 -0.12 0.61 -0.44 -0.57 0.00 0.00 179.45 178.93 2jpo h ASP 75 N -0.62 1.00 -0.64 0.86 3.32 -1.83 0.75 116.42 119.26 2jpo h ASP 75 Ca -0.04 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.93 2jpo h ASP 75 Cb 0.44 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 2jpo h ASP 75 CO 0.07 0.66 0.10 0.15 -1.72 0.00 0.00 179.24 178.50 2jpo h PHE 76 N 1.15 1.14 -0.23 4.55 3.57 -1.55 -1.48 116.94 124.09 2jpo h PHE 76 Ca 0.39 -0.16 -0.05 0.00 3.53 0.00 0.00 57.97 61.69 2jpo h PHE 76 Cb 0.07 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.49 2jpo h PHE 76 CO -0.01 0.96 -0.05 0.00 -2.23 0.00 0.00 178.31 176.98 2jpo h ALA 77 N 1.09 0.31 -0.75 2.41 0.00 -0.24 -3.23 119.26 118.85 2jpo h ALA 77 Ca 0.20 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2jpo h ALA 77 Cb 0.44 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2jpo h ALA 77 CO 0.01 0.09 0.45 0.52 0.00 0.00 0.00 179.25 180.33 2jpo h MET 78 N 0.17 0.81 0.00 0.00 2.86 -0.38 0.96 114.93 119.35 2jpo h MET 78 Ca 0.06 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2jpo h MET 78 Cb 0.49 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2jpo h MET 78 CO 0.02 0.54 0.00 1.63 1.06 0.00 0.00 176.91 180.16 2jpo n LYS 79 N -4.69 0.95 0.01 1.72 4.76 -0.60 -4.12 118.16 116.18 2jpo n LYS 79 Ca 0.10 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.53 2jpo n LYS 79 Cb 0.16 -1.48 -0.00 0.00 -1.84 0.00 0.00 35.03 31.87 2jpo n LYS 79 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2jpo n HIS 80 N -0.98 0.00 0.00 2.13 8.25 -0.57 -5.05 115.22 119.01 2jpo n HIS 80 Ca 0.22 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.68 2jpo n HIS 80 Cb 0.10 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.16 2jpo n HIS 80 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jpo n GLY 81 N 3.04 -0.88 3.33 -1.41 0.00 0.23 -5.11 105.19 104.38 2jpo n GLY 81 Ca -0.01 0.43 -0.10 0.00 0.00 0.00 0.00 46.02 46.33 2jpo n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jpo s ALA 82 N 0.00 0.51 0.41 4.61 0.00 -0.67 -4.93 121.76 121.69 2jpo s ALA 82 Ca 0.00 -1.28 0.03 0.00 0.00 0.00 0.00 51.96 50.71 2jpo s ALA 82 Cb 0.00 1.14 -0.04 0.00 0.00 0.00 0.00 23.12 24.22 2jpo s ALA 82 CO 0.00 -0.66 0.07 -0.51 0.00 0.00 0.00 175.76 174.65 2jpo s ASP 83 N -3.07 3.11 0.62 0.00 1.11 -1.26 -4.20 116.67 112.98 2jpo s ASP 83 Ca 0.28 -1.57 0.25 0.00 0.18 0.00 0.00 52.55 51.70 2jpo s ASP 83 Cb 0.04 0.28 1.26 0.00 1.07 0.00 0.00 42.92 45.57 2jpo s ASP 83 CO 0.08 -0.79 1.70 -0.08 1.18 0.00 0.00 175.17 177.26 2jpo h GLU 84 N 1.76 0.00 0.06 8.23 4.81 -1.95 0.22 114.58 127.72 2jpo h GLU 84 Ca -0.40 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.83 2jpo h GLU 84 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2jpo h GLU 84 CO 0.66 0.00 -0.03 1.15 -0.73 0.00 0.00 179.01 180.06 2jpo h THR 85 N 0.00 0.00 -0.66 0.32 2.02 -1.98 -2.97 112.91 109.64 2jpo h THR 85 Ca 0.17 -0.39 0.14 0.00 0.77 0.00 0.00 66.41 67.11 2jpo h THR 85 Cb 1.41 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.70 2jpo h THR 85 CO -0.00 0.00 -0.04 0.24 0.37 0.00 0.00 175.52 176.09 2jpo h MET 86 N -0.47 0.08 0.00 6.66 2.86 -1.62 0.16 114.93 122.59 2jpo h MET 86 Ca -0.01 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2jpo h MET 86 Cb 0.07 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 2jpo h MET 86 CO 0.01 0.05 -0.18 0.00 1.06 0.00 0.00 176.91 177.85 2jpo h ALA 87 N 1.63 1.23 0.12 6.32 0.00 -0.78 -2.23 119.26 125.54 2jpo h ALA 87 Ca 0.35 -0.17 -0.32 0.00 0.00 0.00 0.00 54.91 54.77 2jpo h ALA 87 Cb 0.57 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2jpo h ALA 87 CO -0.60 0.23 -1.65 0.37 0.00 0.00 0.00 179.25 177.60 2jpo h GLN 88 N 0.00 0.25 -0.48 0.00 5.75 -1.06 -3.31 115.11 116.26 2jpo h GLN 88 Ca -0.00 -0.43 0.09 0.00 -0.15 0.00 0.00 58.65 58.16 2jpo h GLN 88 Cb 0.49 0.16 -0.07 0.00 1.07 0.00 0.00 27.48 29.12 2jpo h GLN 88 CO 0.02 1.10 0.04 1.96 -2.65 0.00 0.00 178.83 179.30 2jpo h GLN 89 N 0.07 0.15 -0.38 1.69 4.20 -0.13 0.26 115.11 120.96 2jpo h GLN 89 Ca -0.29 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.36 2jpo h GLN 89 Cb 2.03 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.76 2jpo h GLN 89 CO 0.15 0.10 0.02 -0.07 -0.67 0.00 0.00 178.83 178.36 2jpo h LEU 90 N 0.15 0.64 -0.86 1.46 3.38 -1.68 -0.98 115.31 117.43 2jpo h LEU 90 Ca 0.24 -0.29 0.13 0.00 0.09 0.00 0.00 57.88 58.05 2jpo h LEU 90 Cb 0.34 -0.17 -0.09 0.00 0.09 0.00 0.00 40.66 40.84 2jpo h LEU 90 CO -0.37 0.77 0.47 0.58 0.09 0.00 0.00 178.44 179.98 2jpo h VAL 91 N 0.49 0.79 0.00 1.22 2.07 -1.52 -1.61 116.25 117.69 2jpo h VAL 91 Ca 0.11 -0.24 -0.11 0.00 0.82 0.00 0.00 66.70 67.28 2jpo h VAL 91 Cb 0.43 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 2jpo h VAL 91 CO 0.02 0.13 -0.52 -0.78 0.02 0.00 0.00 177.57 176.43 2jpo h ASP 92 N 0.70 0.00 -0.17 0.57 3.58 -0.14 0.12 116.42 121.08 2jpo h ASP 92 Ca 0.45 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.88 2jpo h ASP 92 Cb 0.57 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.61 2jpo h ASP 92 CO -0.32 0.52 0.04 0.40 -2.88 0.00 0.00 179.24 176.99 2jpo h ILE 93 N 0.00 1.21 -0.20 2.25 2.04 -0.27 0.20 117.51 122.75 2jpo h ILE 93 Ca -0.01 -0.68 -0.14 0.00 1.00 0.00 0.00 64.86 65.04 2jpo h ILE 93 Cb 1.00 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 2jpo h ILE 93 CO 0.07 0.21 -0.42 -0.29 0.00 0.00 0.00 178.15 177.71 2jpo h ILE 94 N 0.08 1.33 0.00 -0.67 6.09 -1.12 0.60 117.51 123.82 2jpo h ILE 94 Ca 0.05 -1.65 -0.02 0.00 -1.37 0.00 0.00 64.86 61.87 2jpo h ILE 94 Cb 0.28 1.87 -0.00 0.00 0.47 0.00 0.00 36.82 39.44 2jpo h ILE 94 CO 0.00 0.51 -0.09 0.45 -3.07 0.00 0.00 178.15 175.95 2jpo h HIS 95 N 0.32 0.00 0.26 2.19 3.86 -0.77 0.32 115.15 121.33 2jpo h HIS 95 Ca 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2jpo h HIS 95 Cb 1.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.50 2jpo h HIS 95 CO 0.09 0.09 -0.12 0.78 0.86 0.00 0.00 177.93 179.63 2jpo h GLY 96 N 0.75 -0.36 1.51 2.45 0.00 -0.29 -3.36 103.07 103.77 2jpo h GLY 96 Ca -0.00 0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.45 2jpo h GLY 96 CO 0.01 -0.13 0.25 0.00 0.00 0.00 0.00 176.54 176.67 2jpo h GLU 98 N 0.66 0.37 0.15 0.00 4.11 -1.11 -1.41 114.58 117.34 2jpo h GLU 98 Ca 0.17 -0.11 -0.36 0.00 0.07 0.00 0.00 59.36 59.13 2jpo h GLU 98 Cb 0.04 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2jpo h GLU 98 CO -0.03 0.55 -1.92 0.87 0.07 0.00 0.00 179.01 178.55 2jpo h LYS 99 N 0.34 0.31 0.00 1.06 6.56 -1.61 -3.31 116.57 119.92 2jpo h LYS 99 Ca 0.06 -0.53 0.00 0.00 -1.06 0.00 0.00 60.65 59.12 2jpo h LYS 99 Cb 0.52 0.20 0.00 0.00 -0.57 0.00 0.00 32.23 32.38 2jpo h LYS 99 CO 0.03 1.25 0.00 0.43 -2.06 0.00 0.00 179.45 179.11 2jpo n SER 100 N -3.53 0.10 -4.75 0.86 7.64 -0.69 -4.84 113.62 108.43 2jpo n SER 100 Ca -0.30 0.53 -0.37 0.00 1.01 0.00 0.00 58.87 59.74 2jpo n SER 100 Cb 1.05 -0.55 0.05 0.00 -1.01 0.00 0.00 64.21 63.75 2jpo n SER 100 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jpo s ALA 101 N -3.06 2.59 1.03 -0.43 0.00 -0.54 -5.01 121.76 116.34 2jpo s ALA 101 Ca 0.05 1.18 -0.12 0.00 0.00 0.00 0.00 51.96 53.06 2jpo s ALA 101 Cb 0.07 -3.52 0.20 0.00 0.00 0.00 0.00 23.12 19.87 2jpo s ALA 101 CO 0.21 -1.35 1.08 -1.25 0.00 0.00 0.00 175.76 174.45 2jpo s PRO 102 N -3.18 0.20 -1.10 0.00 0.04 -1.26 -4.87 135.00 124.83 2jpo s PRO 102 Ca 0.77 0.59 -0.23 0.00 0.04 0.00 0.00 61.00 62.17 2jpo s PRO 102 Cb -0.36 -1.70 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 2jpo s PRO 102 CO 0.40 -2.90 1.85 -1.25 0.04 0.00 0.00 177.00 175.14 2jpo s PRO 103 N -4.87 2.86 -0.28 0.56 0.04 -1.26 -4.71 135.00 127.34 2jpo s PRO 103 Ca 0.66 -1.02 0.02 0.00 0.04 0.00 0.00 61.00 60.69 2jpo s PRO 103 Cb -0.20 -5.25 0.17 0.00 0.04 0.00 0.00 34.50 29.26 2jpo s PRO 103 CO 0.59 -3.34 0.45 1.21 0.04 0.00 0.00 177.00 175.95 2jpo s ASN 104 N 6.45 -0.13 -0.43 6.66 2.47 -1.26 -5.12 114.94 123.58 2jpo s ASN 104 Ca 0.64 -0.09 -0.10 0.00 0.42 0.00 0.00 52.86 53.74 2jpo s ASN 104 Cb -0.02 1.35 0.09 0.00 -1.45 0.00 0.00 41.25 41.22 2jpo s ASN 104 CO 0.06 -0.33 0.29 -1.81 -3.72 0.00 0.00 177.10 171.58 2jpo s ASP 105 N 2.62 5.69 0.16 -4.21 1.11 -1.26 -4.45 116.67 116.33 2jpo s ASP 105 Ca 0.11 -1.57 -0.03 0.00 0.18 0.00 0.00 52.55 51.23 2jpo s ASP 105 Cb -0.13 -2.01 -0.03 0.00 1.07 0.00 0.00 42.92 41.83 2jpo s ASP 105 CO -0.26 -0.58 0.15 -0.62 1.18 0.00 0.00 175.17 175.04 2jpo s ASP 106 N 2.27 0.18 0.07 0.27 -1.08 -1.26 -5.00 116.67 112.12 2jpo s ASP 106 Ca 0.04 -1.16 0.04 0.00 -0.52 0.00 0.00 52.55 50.95 2jpo s ASP 106 Cb -0.24 0.37 -0.24 0.00 -1.46 0.00 0.00 42.92 41.35 2jpo s ASP 106 CO 0.02 -0.82 1.09 0.11 0.52 0.00 0.00 175.17 176.09 2jpo h LYS 107 N 2.70 0.08 0.00 4.34 1.79 -1.99 -3.37 116.57 120.12 2jpo h LYS 107 Ca -0.34 -0.14 -0.11 0.00 -2.18 0.00 0.00 60.65 57.88 2jpo h LYS 107 Cb 1.22 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.91 2jpo h LYS 107 CO 0.54 0.97 -1.39 0.00 -1.08 0.00 0.00 179.45 178.49 2jpo h MET 109 N -0.07 0.53 -0.48 0.00 2.86 -1.87 -2.44 114.93 113.47 2jpo h MET 109 Ca -0.16 -0.33 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2jpo h MET 109 Cb 1.22 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.88 2jpo h MET 109 CO -0.05 0.93 0.31 -0.22 1.06 0.00 0.00 176.91 178.94 2jpo h LYS 110 N 0.19 0.64 -0.65 1.72 3.64 -1.78 -1.06 116.57 119.27 2jpo h LYS 110 Ca 0.02 -0.05 0.14 0.00 -1.27 0.00 0.00 60.65 59.49 2jpo h LYS 110 Cb 0.88 -0.14 -0.11 0.00 -0.41 0.00 0.00 32.23 32.45 2jpo h LYS 110 CO 0.07 0.44 0.00 1.15 -2.27 0.00 0.00 179.45 178.84 2jpo h THR 111 N 0.64 0.45 -0.26 1.00 2.02 -1.79 -1.04 112.91 113.93 2jpo h THR 111 Ca 0.17 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.31 2jpo h THR 111 Cb -0.05 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 2jpo h THR 111 CO -0.04 0.02 0.16 0.40 0.37 0.00 0.00 175.52 176.43 2jpo h ILE 112 N 0.12 1.10 0.50 3.11 2.04 -0.72 -0.05 117.51 123.61 2jpo h ILE 112 Ca 0.35 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 2jpo h ILE 112 Cb 0.57 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2jpo h ILE 112 CO -0.56 0.10 -0.30 0.44 0.00 0.00 0.00 178.15 177.82 2jpo h ASP 113 N 0.32 -0.76 -0.64 1.72 3.32 -0.60 0.62 116.42 120.41 2jpo h ASP 113 Ca 0.09 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 2jpo h ASP 113 Cb 0.02 0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 2jpo h ASP 113 CO -0.02 -0.48 0.31 0.58 -1.72 0.00 0.00 179.24 177.91 2jpo h VAL 114 N -0.76 1.22 -0.41 -1.35 2.07 -1.18 0.21 116.25 116.04 2jpo h VAL 114 Ca -0.06 -0.64 -0.11 0.00 0.82 0.00 0.00 66.70 66.72 2jpo h VAL 114 Cb 0.62 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2jpo h VAL 114 CO 0.06 0.26 -0.17 0.00 0.02 0.00 0.00 177.57 177.75 2jpo h ALA 115 N 1.39 0.57 -0.29 1.67 0.00 -0.78 0.10 119.26 121.92 2jpo h ALA 115 Ca 0.23 -0.36 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 2jpo h ALA 115 Cb 0.12 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2jpo h ALA 115 CO -0.03 0.51 -0.52 0.00 0.00 0.00 0.00 179.25 179.21 2jpo h MET 116 N 0.65 0.84 -0.46 0.00 -0.00 -0.49 -2.82 114.93 112.66 2jpo h MET 116 Ca 0.09 -0.52 0.05 0.00 -0.00 0.00 0.00 59.70 59.33 2jpo h MET 116 Cb 0.72 0.05 -0.05 0.00 -0.00 0.00 0.00 31.60 32.33 2jpo h MET 116 CO 0.05 1.15 0.20 0.00 -0.00 0.00 0.00 176.91 178.31 2jpo h PHE 118 N 0.39 -0.70 -0.72 0.00 3.04 -0.84 -0.93 116.94 117.17 2jpo h PHE 118 Ca 0.21 0.03 0.01 0.00 3.98 0.00 0.00 57.97 62.20 2jpo h PHE 118 Cb 0.16 0.33 -0.04 0.00 2.56 0.00 0.00 35.95 38.96 2jpo h PHE 118 CO -0.13 -0.34 0.48 -0.22 -2.02 0.00 0.00 178.31 176.08 2jpo h LYS 119 N -0.33 0.92 -0.33 1.11 3.64 -1.23 -0.26 116.57 120.10 2jpo h LYS 119 Ca 0.10 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2jpo h LYS 119 Cb 0.48 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 2jpo h LYS 119 CO -0.32 0.61 0.13 0.87 -2.27 0.00 0.00 179.45 178.47 2jpo h LYS 120 N 0.95 0.28 0.00 1.90 1.79 -0.62 -2.51 116.57 118.36 2jpo h LYS 120 Ca 0.27 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.72 2jpo h LYS 120 Cb -0.07 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.52 2jpo h LYS 120 CO -0.06 0.19 0.00 0.93 -1.08 0.00 0.00 179.45 179.42 2jpo h GLU 121 N 0.29 0.00 -0.04 3.15 4.39 0.09 -2.00 114.58 120.45 2jpo h GLU 121 Ca 0.14 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.86 2jpo h GLU 121 Cb 0.09 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2jpo h GLU 121 CO -0.13 0.00 0.04 0.82 -1.16 0.00 0.00 179.01 178.58 2jpo h ILE 122 N 0.00 0.70 -0.87 3.13 2.04 -0.64 0.33 117.51 122.21 2jpo h ILE 122 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 2jpo h ILE 122 Cb 0.46 0.97 -0.07 0.00 -0.74 0.00 0.00 36.82 37.44 2jpo h ILE 122 CO 0.00 0.00 0.52 0.45 0.00 0.00 0.00 178.15 179.12 2jpo h HIS 123 N 0.00 0.95 0.00 1.37 3.86 -1.46 -2.73 115.15 117.14 2jpo h HIS 123 Ca 0.02 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 2jpo h HIS 123 Cb 0.09 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.26 2jpo h HIS 123 CO 0.00 0.43 0.00 1.57 0.86 0.00 0.00 177.93 180.79 2jpo h LYS 124 N 0.90 0.00 -0.79 2.45 5.09 -1.12 -3.18 116.57 119.93 2jpo h LYS 124 Ca 0.40 0.00 -0.04 0.00 0.09 0.00 0.00 60.65 61.10 2jpo h LYS 124 Cb 0.29 0.00 -0.04 0.00 0.10 0.00 0.00 32.23 32.59 2jpo h LYS 124 CO -0.22 0.00 0.35 -0.07 -2.09 0.00 0.00 179.45 177.42 2jpo h LEU 125 N 0.00 1.05 0.60 7.07 3.38 -1.49 -3.46 115.31 122.45 2jpo h LEU 125 Ca 0.00 -0.14 -0.24 0.00 0.09 0.00 0.00 57.88 57.59 2jpo h LEU 125 Cb 0.66 -0.27 -0.09 0.00 0.09 0.00 0.00 40.66 41.05 2jpo h LEU 125 CO 0.00 0.91 -0.22 0.59 0.09 0.00 0.00 178.44 179.81 2jpo n ASN 126 N -4.30 -4.38 -0.80 -0.43 5.03 -1.20 -4.99 115.26 104.18 2jpo n ASN 126 Ca 0.07 0.28 0.00 0.00 0.87 0.00 0.00 54.58 55.80 2jpo n ASN 126 Cb 0.16 -2.94 0.00 0.00 -1.02 0.00 0.00 39.78 35.98 2jpo n ASN 126 CO 0.00 0.00 0.00 -2.67 -1.83 0.00 0.00 177.26 172.76 2jpo n TRP 127 N -2.71 0.00 -3.64 3.10 4.27 -1.26 -5.16 117.44 112.05 2jpo n TRP 127 Ca -0.12 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.20 2jpo n TRP 127 Cb 0.39 0.00 -0.15 0.00 -1.36 0.00 0.00 31.31 30.19 2jpo n TRP 127 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 2jpo s VAL 128 N -1.39 0.35 0.40 -1.67 0.11 -1.26 -4.91 120.40 112.03 2jpo s VAL 128 Ca 0.00 -0.95 -0.26 0.00 -2.93 0.00 0.00 61.98 57.85 2jpo s VAL 128 Cb 0.00 -1.22 -0.09 0.00 -1.53 0.00 0.00 36.38 33.54 2jpo s VAL 128 CO 0.00 -0.63 1.26 -2.16 -3.33 0.00 0.00 175.10 170.24 2jpo s PRO 129 N 1.90 3.99 0.85 1.54 0.04 -1.26 -5.01 135.00 137.05 2jpo s PRO 129 Ca 0.08 2.06 -0.13 0.00 0.04 0.00 0.00 61.00 63.05 2jpo s PRO 129 Cb -0.17 -2.73 0.06 0.00 0.04 0.00 0.00 34.50 31.70 2jpo s PRO 129 CO -0.28 -0.44 0.85 0.09 0.04 0.00 0.00 177.00 177.26 2jpo n ASN 130 N 0.11 -0.34 -0.33 6.66 3.02 -1.26 -4.71 115.26 118.42 2jpo n ASN 130 Ca 0.04 0.49 0.13 0.00 -0.03 0.00 0.00 54.58 55.21 2jpo n ASN 130 Cb 0.44 -1.37 0.31 0.00 -0.61 0.00 0.00 39.78 38.55 2jpo n ASN 130 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2jpo h MET 131 N -1.15 0.59 0.14 3.52 2.86 -1.95 -0.64 114.93 118.30 2jpo h MET 131 Ca -0.45 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2jpo h MET 131 Cb 1.30 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.80 2jpo h MET 131 CO 0.41 0.39 -0.31 -0.44 1.06 0.00 0.00 176.91 178.03 2jpo h ASP 132 N 0.61 -0.90 -0.93 1.22 3.32 -1.99 -1.44 116.42 116.31 2jpo h ASP 132 Ca 0.56 0.09 0.15 0.00 0.02 0.00 0.00 57.03 57.85 2jpo h ASP 132 Cb 0.95 0.32 -0.08 0.00 0.22 0.00 0.00 39.33 40.74 2jpo h ASP 132 CO -0.43 -0.35 0.60 -0.07 -1.72 0.00 0.00 179.24 177.26 2jpo h LEU 133 N -0.49 0.72 0.41 1.55 4.07 -1.59 0.17 115.31 120.15 2jpo h LEU 133 Ca -0.01 0.05 -0.02 0.00 0.08 0.00 0.00 57.88 57.97 2jpo h LEU 133 Cb 0.47 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.12 2jpo h LEU 133 CO -0.13 0.35 -0.20 0.58 -1.08 0.00 0.00 178.44 177.97 2jpo h VAL 134 N 0.76 0.00 -0.27 1.22 2.07 -0.97 -3.24 116.25 115.81 2jpo h VAL 134 Ca 0.48 -0.44 -0.13 0.00 0.82 0.00 0.00 66.70 67.42 2jpo h VAL 134 Cb 0.72 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2jpo h VAL 134 CO -0.24 0.00 -0.38 0.40 0.02 0.00 0.00 177.57 177.37 2jpo h ILE 135 N -1.00 1.29 0.00 4.57 2.04 -1.06 -2.36 117.51 121.00 2jpo h ILE 135 Ca -0.06 -1.54 -0.02 0.00 1.00 0.00 0.00 64.86 64.24 2jpo h ILE 135 Cb 0.43 1.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 2jpo h ILE 135 CO 0.09 0.49 -0.11 1.23 0.00 0.00 0.00 178.15 179.86 2jpo h GLY 136 N 1.01 0.00 0.28 5.37 0.00 -0.83 -2.78 103.07 106.12 2jpo h GLY 136 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 2jpo h GLY 136 CO 0.08 0.00 -0.04 -2.09 0.00 0.00 0.00 176.54 174.49 2jpo h GLU 137 N 0.00 -0.11 -0.37 4.80 4.57 -1.44 -2.16 114.58 119.86 2jpo h GLU 137 Ca -0.00 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.26 2jpo h GLU 137 Cb 0.20 0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 28.75 2jpo h GLU 137 CO 0.01 0.42 -0.07 -0.24 -1.18 0.00 0.00 179.01 177.96 2jpo h VAL 138 N -0.84 0.65 -0.74 0.32 3.04 -1.54 -1.23 116.25 115.91 2jpo h VAL 138 Ca -0.01 -0.01 0.17 0.00 -1.01 0.00 0.00 66.70 65.84 2jpo h VAL 138 Cb 0.59 0.62 -0.12 0.00 -2.01 0.00 0.00 31.29 30.37 2jpo h VAL 138 CO 0.02 0.00 0.11 -0.07 -1.01 0.00 0.00 177.57 176.62 2jpo h LEU 139 N 0.03 -0.13 -1.18 3.16 4.07 -1.56 -0.32 115.31 119.37 2jpo h LEU 139 Ca 0.18 0.17 -0.07 0.00 0.08 0.00 0.00 57.88 58.24 2jpo h LEU 139 Cb 0.27 0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.26 2jpo h LEU 139 CO -0.36 -0.10 -0.35 0.00 -1.08 0.00 0.00 178.44 176.55 2jpo h ALA 140 N 1.65 1.14 0.01 1.53 0.00 -0.54 -3.31 119.26 119.75 2jpo h ALA 140 Ca 0.42 -0.32 -0.36 0.00 0.00 0.00 0.00 54.91 54.65 2jpo h ALA 140 Cb 0.74 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 2jpo h ALA 140 CO -0.57 0.43 -2.25 -1.91 0.00 0.00 0.00 179.25 174.95 2jpo n GLU 141 N -3.71 0.68 0.00 0.00 4.07 -0.85 -1.01 120.64 119.81 2jpo n GLU 141 Ca -0.01 0.11 0.12 0.00 -0.06 0.00 0.00 57.16 57.32 2jpo n GLU 141 Cb 0.44 -1.59 0.70 0.00 -0.06 0.00 0.00 31.44 30.94 2jpo n GLU 141 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35