#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jpo s PRO 2 N 0.00 4.13 -0.01 4.33 0.04 -1.26 -5.00 135.00 137.23 2jpo s PRO 2 Ca 0.00 1.66 -0.09 0.00 0.04 0.00 0.00 61.00 62.61 2jpo s PRO 2 Cb 0.00 -2.63 -0.05 0.00 0.04 0.00 0.00 34.50 31.86 2jpo s PRO 2 CO 0.00 -0.20 0.60 0.93 0.04 0.00 0.00 177.00 178.36 2jpo h GLU 3 N 2.62 -0.31 -1.41 4.56 5.08 -2.10 -3.43 114.58 119.58 2jpo h GLU 3 Ca -0.48 0.02 -0.41 0.00 -1.00 0.00 0.00 59.36 57.48 2jpo h GLU 3 Cb 1.22 0.07 -0.33 0.00 0.50 0.00 0.00 28.75 30.22 2jpo h GLU 3 CO 0.63 -0.21 -0.97 0.44 -1.00 0.00 0.00 179.01 177.89 2jpo n ILE 4 N -3.64 -0.15 -4.18 3.13 -5.35 -1.26 -5.09 119.36 102.81 2jpo n ILE 4 Ca -0.04 -3.65 -0.16 0.00 -0.27 0.00 0.00 62.75 58.64 2jpo n ILE 4 Cb 0.13 0.15 -0.14 0.00 -1.74 0.00 0.00 39.64 38.04 2jpo n ILE 4 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2jpo s MET 5 N -1.54 0.50 -0.96 6.28 -1.94 -1.26 -4.96 119.30 115.42 2jpo s MET 5 Ca 0.35 -0.31 -0.12 0.00 -1.71 0.00 0.00 55.69 53.89 2jpo s MET 5 Cb 0.32 -0.45 0.01 0.00 2.01 0.00 0.00 34.83 36.72 2jpo s MET 5 CO -0.08 0.12 0.64 1.63 -0.01 0.00 0.00 175.02 177.32 2jpo n LYS 6 N 2.67 -1.12 -4.49 2.03 5.02 -1.26 -4.96 118.16 116.05 2jpo n LYS 6 Ca -0.15 0.56 -0.24 0.00 -2.02 0.00 0.00 58.31 56.47 2jpo n LYS 6 Cb 0.57 -2.59 -0.10 0.00 -0.02 0.00 0.00 35.03 32.89 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 -3.18 3.48 -1.31 4.39 0.01 -1.26 -5.05 114.94 112.02 2jpo s ASN 7 Ca 0.18 -1.14 -0.07 0.00 -0.71 0.00 0.00 52.86 51.11 2jpo s ASN 7 Cb -0.09 -0.30 -0.01 0.00 0.41 0.00 0.00 41.25 41.26 2jpo s ASN 7 CO 0.91 -0.15 2.78 -0.11 -1.51 0.00 0.00 177.10 179.02 2jpo n LEU 8 N -0.69 8.09 0.00 0.60 -0.00 -1.26 -4.25 117.00 119.49 2jpo n LEU 8 Ca -0.05 -4.47 0.00 0.00 -0.00 0.00 0.00 56.01 51.49 2jpo n LEU 8 Cb 0.62 -1.45 0.00 0.00 -0.00 0.00 0.00 43.42 42.59 2jpo n LEU 8 CO 0.41 2.02 0.00 -1.20 -0.00 0.00 0.00 177.39 178.62 2jpo n SER 9 N 2.60 0.00 -0.35 1.96 7.64 -1.26 -4.60 113.62 119.60 2jpo n SER 9 Ca 0.68 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.60 2jpo n SER 9 Cb 0.31 -0.01 0.21 0.00 -1.01 0.00 0.00 64.21 63.71 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 0.98 0.27 6.43 2.35 -1.97 -0.94 115.58 122.70 2jpo h ASN 10 Ca 0.00 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 2jpo h ASN 10 Cb 0.00 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.18 2jpo h ASN 10 CO 0.00 0.61 -0.13 -0.55 -1.65 0.00 0.00 177.43 175.71 2jpo h ASN 11 N 1.10 -0.31 -0.07 5.81 7.08 -1.83 -1.22 115.58 126.15 2jpo h ASN 11 Ca 0.43 -0.14 0.04 0.00 -3.08 0.00 0.00 56.30 53.55 2jpo h ASN 11 Cb 0.23 0.08 -0.05 0.00 -2.08 0.00 0.00 38.32 36.49 2jpo h ASN 11 CO -0.18 -0.03 -0.26 0.15 -2.08 0.00 0.00 177.43 175.03 2jpo h PHE 12 N -0.60 -0.70 0.00 4.14 3.04 -1.32 0.52 116.94 122.02 2jpo h PHE 12 Ca -0.04 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.87 2jpo h PHE 12 Cb 0.43 0.32 -0.01 0.00 2.56 0.00 0.00 35.95 39.25 2jpo h PHE 12 CO 0.00 -0.35 -0.34 0.78 -2.02 0.00 0.00 178.31 176.38 2jpo h GLY 13 N -0.36 0.00 0.59 2.40 0.00 -1.30 -0.91 103.07 103.50 2jpo h GLY 13 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 2jpo h GLY 13 CO -0.28 0.00 -0.00 1.70 0.00 0.00 0.00 176.54 177.96 2jpo h LYS 14 N 0.00 0.02 -0.47 4.80 3.64 -0.37 -0.28 116.57 123.91 2jpo h LYS 14 Ca -0.00 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2jpo h LYS 14 Cb 0.66 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 2jpo h LYS 14 CO 0.04 0.43 0.11 0.00 -2.27 0.00 0.00 179.45 177.76 2jpo h ALA 15 N 0.59 1.31 0.13 5.00 0.00 -0.57 0.18 119.26 125.90 2jpo h ALA 15 Ca 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2jpo h ALA 15 Cb 0.42 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2jpo h ALA 15 CO 0.00 0.48 -0.08 1.98 0.00 0.00 0.00 179.25 181.63 2jpo h MET 16 N 0.68 -0.20 -1.00 0.00 1.85 -1.16 -1.81 114.93 113.29 2jpo h MET 16 Ca 0.15 0.01 0.06 0.00 -0.61 0.00 0.00 59.70 59.32 2jpo h MET 16 Cb 0.27 0.05 -0.06 0.00 0.43 0.00 0.00 31.60 32.28 2jpo h MET 16 CO -0.00 -0.14 0.65 0.22 -0.40 0.00 0.00 176.91 177.24 2jpo h ASP 17 N -0.21 1.04 -0.53 1.39 3.58 0.07 0.38 116.42 122.14 2jpo h ASP 17 Ca -0.01 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.37 2jpo h ASP 17 Cb 0.18 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 2jpo h ASP 17 CO 0.01 0.68 0.07 1.56 -2.88 0.00 0.00 179.24 178.67 2jpo h GLN 18 N 1.19 0.94 -0.17 0.28 4.20 -0.56 0.71 115.11 121.70 2jpo h GLN 18 Ca 0.42 -0.24 -0.10 0.00 0.06 0.00 0.00 58.65 58.79 2jpo h GLN 18 Cb 0.13 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.80 2jpo h GLN 18 CO -0.16 0.89 -0.28 0.00 -0.67 0.00 0.00 178.83 178.61 2jpo n LYS 20 N -4.38 0.00 -0.05 0.00 4.81 0.12 -0.31 118.16 118.34 2jpo n LYS 20 Ca -0.06 0.46 -0.06 0.00 -0.87 0.00 0.00 58.31 57.78 2jpo n LYS 20 Cb 0.46 -1.50 -0.02 0.00 0.02 0.00 0.00 35.03 33.99 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 -1.50 1.56 -0.01 3.14 -0.08 0.22 -2.86 116.55 117.02 2jpo n ASP 21 Ca 0.01 0.25 0.00 0.00 -1.51 0.00 0.00 54.79 53.54 2jpo n ASP 21 Cb 0.03 -0.61 0.31 0.00 2.34 0.00 0.00 41.12 43.19 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 -0.66 0.54 0.00 -0.67 5.08 -0.63 -2.45 114.58 115.80 2jpo h GLU 22 Ca 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2jpo h GLU 22 Cb 0.66 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2jpo h GLU 22 CO 0.00 0.54 -1.67 1.28 -1.00 0.00 0.00 179.01 178.16 2jpo n LEU 23 N -4.31 0.27 -3.47 1.33 4.77 0.57 -5.01 117.00 111.15 2jpo n LEU 23 Ca 0.02 0.06 -0.22 0.00 -0.03 0.00 0.00 56.01 55.84 2jpo n LEU 23 Cb 0.22 -0.02 0.06 0.00 -2.33 0.00 0.00 43.42 41.34 2jpo n LEU 23 CO 0.38 -0.03 -0.01 -1.20 -1.33 0.00 0.00 177.39 175.20 2jpo n SER 24 N -2.31 -5.14 -4.75 -1.43 7.64 -0.92 -4.98 113.62 101.72 2jpo n SER 24 Ca -0.02 -0.83 -0.40 0.00 1.01 0.00 0.00 58.87 58.63 2jpo n SER 24 Cb 0.55 -4.42 -0.05 0.00 -1.01 0.00 0.00 64.21 59.29 2jpo n SER 24 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jpo s LEU 25 N -6.00 4.56 0.74 -3.43 1.43 -1.16 -4.98 118.68 109.84 2jpo s LEU 25 Ca 0.37 2.17 -0.11 0.00 -1.03 0.00 0.00 54.13 55.53 2jpo s LEU 25 Cb -0.09 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.55 2jpo s LEU 25 CO 0.79 -0.09 1.08 -2.16 0.23 0.00 0.00 176.35 176.21 2jpo s PRO 26 N -1.20 2.59 0.22 1.29 0.04 -1.26 -4.81 135.00 131.87 2jpo s PRO 26 Ca 0.44 0.69 0.22 0.00 0.04 0.00 0.00 61.00 62.40 2jpo s PRO 26 Cb -0.30 -1.97 0.92 0.00 0.04 0.00 0.00 34.50 33.19 2jpo s PRO 26 CO 0.38 -1.28 1.68 -3.47 0.04 0.00 0.00 177.00 174.35 2jpo n ASP 27 N -3.21 0.57 0.11 6.66 2.03 -1.26 -0.85 116.55 120.60 2jpo n ASP 27 Ca 0.07 0.64 -0.05 0.00 0.52 0.00 0.00 54.79 55.97 2jpo n ASP 27 Cb 0.56 -0.76 -0.02 0.00 -0.72 0.00 0.00 41.12 40.17 2jpo n ASP 27 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2jpo h SER 28 N 0.00 -0.25 -0.72 1.67 0.87 -1.98 -2.39 113.55 110.74 2jpo h SER 28 Ca 0.00 0.01 0.04 0.00 -1.23 0.00 0.00 61.79 60.61 2jpo h SER 28 Cb 0.36 0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.34 2jpo h SER 28 CO 0.00 -0.15 0.48 0.58 -0.53 0.00 0.00 176.83 177.21 2jpo h VAL 29 N -0.36 1.08 -0.04 2.23 2.07 -1.57 0.52 116.25 120.19 2jpo h VAL 29 Ca -0.03 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2jpo h VAL 29 Cb 0.23 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 2jpo h VAL 29 CO 0.05 0.15 -0.00 0.58 0.02 0.00 0.00 177.57 178.37 2jpo h VAL 30 N 0.84 1.25 -0.42 2.57 2.07 -1.13 0.85 116.25 122.28 2jpo h VAL 30 Ca 0.29 -0.76 -0.13 0.00 0.82 0.00 0.00 66.70 66.93 2jpo h VAL 30 Cb 0.11 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 2jpo h VAL 30 CO -0.09 0.20 -0.24 0.00 0.02 0.00 0.00 177.57 177.47 2jpo h ALA 31 N 0.71 0.78 -0.78 1.67 0.00 -0.57 -2.75 119.26 118.31 2jpo h ALA 31 Ca 0.01 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.58 2jpo h ALA 31 Cb 0.33 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 2jpo h ALA 31 CO 0.00 0.65 0.49 -0.44 0.00 0.00 0.00 179.25 179.95 2jpo h ASP 32 N 0.75 0.77 0.49 0.00 3.32 -0.01 0.78 116.42 122.52 2jpo h ASP 32 Ca 0.10 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 2jpo h ASP 32 Cb 0.78 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.18 2jpo h ASP 32 CO 0.06 0.51 -0.26 -0.07 -1.72 0.00 0.00 179.24 177.77 2jpo h LEU 33 N 0.91 -0.63 -1.53 1.55 4.07 -0.56 0.10 115.31 119.23 2jpo h LEU 33 Ca 0.33 0.03 0.01 0.00 0.08 0.00 0.00 57.88 58.32 2jpo h LEU 33 Cb 0.10 0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 2jpo h LEU 33 CO -0.15 -0.43 0.32 1.88 -1.08 0.00 0.00 178.44 178.99 2jpo h TYR 34 N -0.69 0.61 0.00 1.13 -1.99 -1.24 -2.06 116.97 112.73 2jpo h TYR 34 Ca -0.06 0.01 -0.04 0.00 2.00 0.00 0.00 58.73 60.65 2jpo h TYR 34 Cb 0.55 -0.21 -0.01 0.00 2.00 0.00 0.00 36.73 39.06 2jpo h TYR 34 CO -0.06 0.38 -0.17 -0.91 -0.00 0.00 0.00 178.16 177.40 2jpo h ASN 35 N 0.65 0.00 0.17 3.88 2.35 -0.21 -3.28 115.58 119.14 2jpo h ASN 35 Ca 0.18 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.92 2jpo h ASN 35 Cb -0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.30 2jpo h ASN 35 CO -0.04 0.17 -0.08 0.15 -1.65 0.00 0.00 177.43 175.98 2jpo h PHE 36 N 0.00 -0.21 0.00 1.19 3.57 -0.06 -1.29 116.94 120.15 2jpo h PHE 36 Ca -0.00 -0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.33 2jpo h PHE 36 Cb 0.62 0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.37 2jpo h PHE 36 CO 0.00 -0.13 -0.30 -2.67 -2.23 0.00 0.00 178.31 172.98 2jpo n TRP 37 N -2.61 0.00 0.04 0.41 2.14 -1.25 -2.19 117.44 113.98 2jpo n TRP 37 Ca -0.03 -1.35 0.00 0.00 2.07 0.00 0.00 57.50 58.19 2jpo n TRP 37 Cb 0.09 -1.42 0.00 0.00 -0.81 0.00 0.00 31.31 29.17 2jpo n TRP 37 CO 0.00 0.00 0.00 1.17 2.07 0.00 0.00 177.69 180.93 2jpo n LYS 38 N 2.44 0.00 -0.00 -2.67 4.81 -1.01 -4.90 118.16 116.83 2jpo n LYS 38 Ca 0.36 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.86 2jpo n LYS 38 Cb 0.82 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.80 2jpo n LYS 38 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2jpo n ASP 39 N -2.74 1.26 -1.09 3.14 9.92 -0.52 -5.04 116.55 121.47 2jpo n ASP 39 Ca 0.00 -0.46 0.00 0.00 -0.53 0.00 0.00 54.79 53.80 2jpo n ASP 39 Cb 0.00 1.20 0.00 0.00 -0.64 0.00 0.00 41.12 41.68 2jpo n ASP 39 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 2jpo n ASP 40 N -1.50 -1.45 -4.89 -2.24 2.03 -0.93 -5.08 116.55 102.48 2jpo n ASP 40 Ca 0.00 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.01 2jpo n ASP 40 Cb 0.22 -0.73 -0.04 0.00 -0.72 0.00 0.00 41.12 39.85 2jpo n ASP 40 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2jpo s TYR 41 N -2.54 3.45 -0.45 -0.67 5.04 -1.25 -5.04 117.35 115.89 2jpo s TYR 41 Ca 0.00 0.77 -0.20 0.00 -2.44 0.00 0.00 57.07 55.19 2jpo s TYR 41 Cb 0.00 -2.19 0.03 0.00 0.35 0.00 0.00 41.96 40.15 2jpo s TYR 41 CO 0.00 0.20 0.62 0.08 -1.34 0.00 0.00 175.55 175.11 2jpo s VAL 42 N -1.98 4.86 0.21 3.14 1.01 -1.26 -4.84 120.40 121.54 2jpo s VAL 42 Ca 0.46 -0.04 -0.32 0.00 0.00 0.00 0.00 61.98 62.08 2jpo s VAL 42 Cb -0.11 -4.20 -0.13 0.00 0.00 0.00 0.00 36.38 31.94 2jpo s VAL 42 CO 0.26 -0.61 1.56 0.23 0.00 0.00 0.00 175.10 176.53 2jpo n MET 43 N 6.18 2.30 0.00 2.72 0.00 -1.26 -4.88 117.12 122.18 2jpo n MET 43 Ca -0.03 0.83 0.00 0.00 0.00 0.00 0.00 57.70 58.50 2jpo n MET 43 Cb 0.47 -2.58 0.00 0.00 0.00 0.00 0.00 33.22 31.12 2jpo n MET 43 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2jpo n THR 44 N 2.88 0.00 -2.71 2.03 -2.24 -1.26 -5.00 114.28 107.98 2jpo n THR 44 Ca 0.14 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.50 2jpo n THR 44 Cb 0.32 -0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 68.05 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 -2.06 7.21 0.49 3.42 -1.08 -1.26 -4.93 116.67 118.47 2jpo s ASP 45 Ca 0.00 1.49 0.26 0.00 -0.52 0.00 0.00 52.55 53.78 2jpo s ASP 45 Cb 0.00 -2.55 1.33 0.00 -1.46 0.00 0.00 42.92 40.24 2jpo s ASP 45 CO 0.00 -0.45 1.88 0.08 0.52 0.00 0.00 175.17 177.20 2jpo h ARG 46 N 7.13 0.15 -0.10 4.34 0.11 -1.94 -1.96 114.38 122.10 2jpo h ARG 46 Ca -0.30 -0.01 0.03 0.00 0.10 0.00 0.00 59.98 59.80 2jpo h ARG 46 Cb 1.14 -0.03 -0.00 0.00 1.11 0.00 0.00 29.97 32.18 2jpo h ARG 46 CO 0.86 0.10 0.08 -0.07 0.10 0.00 0.00 179.97 181.03 2jpo h LEU 47 N 0.15 0.00 -0.42 0.08 3.38 -1.95 -1.61 115.31 114.95 2jpo h LEU 47 Ca 0.43 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.45 2jpo h LEU 47 Cb 1.46 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.16 2jpo h LEU 47 CO -0.07 0.00 0.15 0.00 0.09 0.00 0.00 178.44 178.60 2jpo h ALA 48 N 1.95 0.50 0.00 1.53 0.00 -1.70 0.57 119.26 122.10 2jpo h ALA 48 Ca 0.05 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 2jpo h ALA 48 Cb 0.20 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2jpo h ALA 48 CO -0.00 -0.24 -0.33 0.78 0.00 0.00 0.00 179.25 179.46 2jpo h GLY 49 N 0.31 0.00 0.81 0.00 0.00 -1.48 -2.39 103.07 100.32 2jpo h GLY 49 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.45 2jpo h GLY 49 CO -0.20 0.00 -0.20 0.00 0.00 0.00 0.00 176.54 176.13 2jpo h ALA 51 N 0.62 0.73 0.72 0.00 0.00 -0.67 0.26 119.26 120.92 2jpo h ALA 51 Ca 0.03 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2jpo h ALA 51 Cb 0.75 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2jpo h ALA 51 CO 0.05 -0.17 -0.37 0.82 0.00 0.00 0.00 179.25 179.58 2jpo h ILE 52 N 0.42 0.25 0.00 0.00 2.04 -1.42 -2.04 117.51 116.77 2jpo h ILE 52 Ca 0.28 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.12 2jpo h ILE 52 Cb 0.31 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 2jpo h ILE 52 CO -0.27 0.00 -0.08 -0.55 0.00 0.00 0.00 178.15 177.25 2jpo h ASN 53 N -1.00 0.00 -0.58 1.72 7.08 -0.86 -1.47 115.58 120.47 2jpo h ASN 53 Ca -0.10 0.00 -0.10 0.00 -3.08 0.00 0.00 56.30 53.02 2jpo h ASN 53 Cb 0.77 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.99 2jpo h ASN 53 CO 0.15 0.08 -0.05 0.00 -2.08 0.00 0.00 177.43 175.53 2jpo h LEU 55 N 0.94 0.69 -1.55 0.00 3.38 -0.53 -0.90 115.31 117.34 2jpo h LEU 55 Ca 0.16 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 2jpo h LEU 55 Cb 0.61 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2jpo h LEU 55 CO 0.04 0.50 -0.20 0.00 0.09 0.00 0.00 178.44 178.87 2jpo h ALA 56 N 1.62 1.22 -0.00 1.53 0.00 -1.12 0.00 119.26 122.51 2jpo h ALA 56 Ca 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2jpo h ALA 56 Cb -0.09 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2jpo h ALA 56 CO -0.05 0.25 -0.03 0.25 0.00 0.00 0.00 179.25 179.67 2jpo n THR 57 N -3.65 0.00 -2.08 0.00 -2.24 -0.36 -4.09 114.28 101.86 2jpo n THR 57 Ca -0.01 -0.03 -0.08 0.00 -2.27 0.00 0.00 64.05 61.66 2jpo n THR 57 Cb 0.33 -0.34 0.08 0.00 -2.10 0.00 0.00 70.33 68.30 2jpo n THR 57 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2jpo n LYS 58 N -1.05 2.27 -0.13 -0.78 5.02 -0.02 -4.79 118.16 118.68 2jpo n LYS 58 Ca 0.17 -3.54 0.06 0.00 -2.02 0.00 0.00 58.31 52.97 2jpo n LYS 58 Cb 0.22 -1.70 0.37 0.00 -0.02 0.00 0.00 35.03 33.90 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 1.74 0.61 -2.44 -0.35 -0.00 -1.70 0.77 115.31 113.95 2jpo h LEU 59 Ca 0.10 -0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.86 2jpo h LEU 59 Cb 1.37 -0.14 -0.07 0.00 -0.00 0.00 0.00 40.66 41.82 2jpo h LEU 59 CO 0.36 0.41 0.15 -0.67 -0.00 0.00 0.00 178.44 178.69 2jpo n ASP 60 N -4.47 3.08 0.05 -0.43 2.03 -1.26 -0.96 116.55 114.59 2jpo n ASP 60 Ca 0.08 -2.50 0.00 0.00 0.52 0.00 0.00 54.79 52.90 2jpo n ASP 60 Cb 0.17 -0.60 0.00 0.00 -0.72 0.00 0.00 41.12 39.97 2jpo n ASP 60 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2jpo n VAL 61 N 0.02 0.12 0.20 5.18 0.31 -0.66 -4.76 118.33 118.75 2jpo n VAL 61 Ca 0.18 0.04 0.07 0.00 -0.01 0.00 0.00 64.34 64.62 2jpo n VAL 61 Cb 0.81 -0.74 0.41 0.00 -0.91 0.00 0.00 33.84 33.40 2jpo n VAL 61 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 2jpo h VAL 62 N 0.00 0.78 -2.28 2.52 3.04 -0.83 -3.37 116.25 116.11 2jpo h VAL 62 Ca 0.00 -1.30 -0.58 0.00 -1.01 0.00 0.00 66.70 63.81 2jpo h VAL 62 Cb 0.14 1.81 -0.38 0.00 -2.01 0.00 0.00 31.29 30.84 2jpo h VAL 62 CO 0.00 0.30 -1.00 -0.67 -1.01 0.00 0.00 177.57 175.19 2jpo n ASP 63 N -3.54 -0.18 0.00 3.17 2.03 -0.13 -3.65 116.55 114.25 2jpo n ASP 63 Ca -0.00 -2.49 0.01 0.00 0.52 0.00 0.00 54.79 52.83 2jpo n ASP 63 Cb 0.45 -0.58 0.07 0.00 -0.72 0.00 0.00 41.12 40.34 2jpo n ASP 63 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2jpo n PRO 64 N 2.42 0.81 0.18 -0.67 -0.04 -1.26 -2.66 135.00 133.77 2jpo n PRO 64 Ca 0.27 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.82 2jpo n PRO 64 Cb 0.49 -1.05 0.10 0.00 -0.04 0.00 0.00 33.50 33.00 2jpo n PRO 64 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2jpo h ASP 65 N 0.00 0.00 -0.11 3.54 3.32 -1.93 -3.48 116.42 117.76 2jpo h ASP 65 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2jpo h ASP 65 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2jpo h ASP 65 CO 0.00 0.18 -0.02 0.61 -1.72 0.00 0.00 179.24 178.29 2jpo n GLY 66 N 1.16 0.35 0.07 2.75 0.00 -1.09 -4.97 105.19 103.46 2jpo n GLY 66 Ca 0.02 -0.88 -0.05 0.00 0.00 0.00 0.00 46.02 45.11 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 -3.02 1.61 -0.26 -1.93 -3.47 115.58 108.51 2jpo h ASN 67 Ca -0.02 -0.04 -0.54 0.00 -0.56 0.00 0.00 56.30 55.15 2jpo h ASN 67 Cb 0.91 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 38.18 2jpo h ASN 67 CO 0.02 0.78 0.72 -0.22 -1.06 0.00 0.00 177.43 177.68 2jpo s LEU 68 N -8.23 4.35 0.23 1.61 0.20 -1.26 -4.20 118.68 111.38 2jpo s LEU 68 Ca -0.14 2.18 -0.05 0.00 0.69 0.00 0.00 54.13 56.81 2jpo s LEU 68 Cb 0.02 -3.58 -0.02 0.00 -0.43 0.00 0.00 46.19 42.18 2jpo s LEU 68 CO 0.23 -0.63 0.28 -1.00 -0.29 0.00 0.00 176.35 174.93 2jpo s HIS 69 N 1.53 0.91 0.35 5.38 3.76 -0.52 -4.81 115.29 121.89 2jpo s HIS 69 Ca 0.63 -1.16 -0.28 0.00 -0.15 0.00 0.00 55.06 54.09 2jpo s HIS 69 Cb -0.33 -0.28 -0.10 0.00 1.11 0.00 0.00 32.58 32.97 2jpo s HIS 69 CO 0.29 -0.80 1.38 -3.38 -0.85 0.00 0.00 174.74 171.37 2jpo s HIS 70 N -4.01 2.85 0.00 1.40 -3.43 -1.26 -1.00 115.29 109.84 2jpo s HIS 70 Ca 0.33 1.32 0.00 0.00 -0.80 0.00 0.00 55.06 55.91 2jpo s HIS 70 Cb 0.04 -3.82 0.00 0.00 -1.43 0.00 0.00 32.58 27.37 2jpo s HIS 70 CO 0.12 -2.32 0.00 0.41 -2.00 0.00 0.00 174.74 170.95 2jpo n GLY 71 N 0.66 0.26 2.49 -1.38 0.00 0.99 -4.92 105.19 103.29 2jpo n GLY 71 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2jpo n GLY 71 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jpo s ASN 72 N -2.26 2.65 0.00 1.61 2.47 -0.17 -4.86 114.94 114.38 2jpo s ASN 72 Ca 0.00 -2.56 0.22 0.00 0.42 0.00 0.00 52.86 50.94 2jpo s ASN 72 Cb 0.00 -0.53 0.59 0.00 -1.45 0.00 0.00 41.25 39.86 2jpo s ASN 72 CO 0.00 -0.26 1.47 0.00 -3.72 0.00 0.00 177.10 174.60 2jpo n ALA 73 N 3.55 2.47 0.31 1.71 0.00 -1.26 -1.44 120.51 125.86 2jpo n ALA 73 Ca 0.17 -0.73 -0.15 0.00 0.00 0.00 0.00 53.44 52.74 2jpo n ALA 73 Cb 0.40 -0.99 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 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 3.23 -0.77 -0.88 0.00 1.57 -1.88 0.71 116.57 118.54 2jpo h LYS 74 Ca 0.00 0.05 0.13 0.00 -1.87 0.00 0.00 60.65 58.96 2jpo h LYS 74 Cb 0.71 0.18 -0.09 0.00 0.08 0.00 0.00 32.23 33.11 2jpo h LYS 74 CO 0.00 -0.46 0.50 -0.44 -0.57 0.00 0.00 179.45 178.48 2jpo h ASP 75 N -1.08 0.66 -0.43 0.86 5.19 -1.84 -1.48 116.42 118.30 2jpo h ASP 75 Ca -0.08 0.07 -0.11 0.00 -0.62 0.00 0.00 57.03 56.29 2jpo h ASP 75 Cb 0.67 -0.05 -0.02 0.00 0.18 0.00 0.00 39.33 40.11 2jpo h ASP 75 CO 0.13 0.32 -0.12 0.15 -3.12 0.00 0.00 179.24 176.60 2jpo h PHE 76 N 0.75 1.00 -0.19 4.55 3.57 -1.61 -1.56 116.94 123.45 2jpo h PHE 76 Ca 0.46 -0.20 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 2jpo h PHE 76 Cb 0.57 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2jpo h PHE 76 CO -0.06 0.96 -0.07 0.00 -2.23 0.00 0.00 178.31 176.91 2jpo h ALA 77 N 1.05 0.27 -0.32 2.41 0.00 -0.49 -3.25 119.26 118.93 2jpo h ALA 77 Ca 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2jpo h ALA 77 Cb 0.65 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2jpo h ALA 77 CO 0.05 0.07 0.15 0.52 0.00 0.00 0.00 179.25 180.03 2jpo h MET 78 N 0.09 0.44 -0.73 0.00 2.86 -0.82 0.30 114.93 117.07 2jpo h MET 78 Ca 0.05 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2jpo h MET 78 Cb 0.54 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 2jpo h MET 78 CO 0.02 0.35 0.02 1.63 1.06 0.00 0.00 176.91 180.00 2jpo n LYS 79 N -4.43 3.61 0.08 1.72 4.76 -0.63 -4.26 118.16 119.01 2jpo n LYS 79 Ca 0.02 -2.17 0.00 0.00 -2.87 0.00 0.00 58.31 53.29 2jpo n LYS 79 Cb 0.12 -2.02 0.00 0.00 -1.84 0.00 0.00 35.03 31.28 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 0.38 -0.92 0.00 2.13 8.25 -0.64 -5.05 115.22 119.36 2jpo n HIS 80 Ca 0.20 0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.83 2jpo n HIS 80 Cb 0.93 0.24 0.00 0.00 1.12 0.00 0.00 29.99 32.28 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 2.69 -1.07 3.39 -1.41 0.00 0.00 -5.12 105.19 103.66 2jpo n GLY 81 Ca 0.00 0.46 -0.13 0.00 0.00 0.00 0.00 46.02 46.35 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 0.78 0.38 4.61 0.00 -0.74 -4.96 121.76 121.82 2jpo s ALA 82 Ca 0.00 -1.49 0.04 0.00 0.00 0.00 0.00 51.96 50.52 2jpo s ALA 82 Cb 0.00 1.26 -0.03 0.00 0.00 0.00 0.00 23.12 24.35 2jpo s ALA 82 CO 0.00 -0.72 0.17 -0.51 0.00 0.00 0.00 175.76 174.70 2jpo s ASP 83 N -3.17 2.36 0.35 0.00 1.01 -1.26 -4.18 116.67 111.77 2jpo s ASP 83 Ca 0.33 -1.68 0.13 0.00 0.71 0.00 0.00 52.55 52.04 2jpo s ASP 83 Cb 0.02 0.50 0.98 0.00 1.01 0.00 0.00 42.92 45.44 2jpo s ASP 83 CO 0.15 -0.96 1.73 -0.33 0.21 0.00 0.00 175.17 175.97 2jpo h GLU 84 N 1.93 0.47 0.03 8.23 5.08 -1.95 0.23 114.58 128.60 2jpo h GLU 84 Ca -0.33 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2jpo h GLU 84 Cb 1.26 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 2jpo h GLU 84 CO 0.51 0.31 -0.04 1.15 -1.00 0.00 0.00 179.01 179.95 2jpo h THR 85 N 0.49 0.00 -0.46 1.13 2.02 -1.97 0.40 112.91 114.52 2jpo h THR 85 Ca 0.65 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.90 2jpo h THR 85 Cb 1.40 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.75 2jpo h THR 85 CO -0.44 0.00 0.13 0.24 0.37 0.00 0.00 175.52 175.82 2jpo h MET 86 N -0.07 0.28 0.00 6.66 2.86 -1.75 0.26 114.93 123.17 2jpo h MET 86 Ca -0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2jpo h MET 86 Cb 0.06 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2jpo h MET 86 CO -0.01 0.18 0.00 0.00 1.06 0.00 0.00 176.91 178.15 2jpo h ALA 87 N 1.33 1.00 0.00 6.32 0.00 -0.41 -0.45 119.26 127.05 2jpo h ALA 87 Ca 0.22 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.84 2jpo h ALA 87 Cb 0.25 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 2jpo h ALA 87 CO -0.25 0.00 -2.28 0.94 0.00 0.00 0.00 179.25 177.66 2jpo n GLN 88 N -2.81 0.76 0.18 0.00 -0.06 0.14 -3.93 117.38 111.66 2jpo n GLN 88 Ca -0.00 -0.04 -0.14 0.00 -2.00 0.00 0.00 57.00 54.81 2jpo n GLN 88 Cb 0.20 -1.50 -0.08 0.00 -4.06 0.00 0.00 30.24 24.80 2jpo n GLN 88 CO 0.00 0.00 0.00 1.96 -0.20 0.00 0.00 177.06 178.82 2jpo h GLN 89 N 0.00 -0.41 -0.24 3.69 4.20 0.21 -2.30 115.11 120.26 2jpo h GLN 89 Ca -0.43 0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.33 2jpo h GLN 89 Cb 1.97 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 29.83 2jpo h GLN 89 CO 0.02 -0.19 0.10 -0.07 -0.67 0.00 0.00 178.83 178.02 2jpo h LEU 90 N -0.56 0.13 -1.47 1.46 4.07 -1.33 -1.12 115.31 116.47 2jpo h LEU 90 Ca -0.04 0.02 0.04 0.00 0.08 0.00 0.00 57.88 57.97 2jpo h LEU 90 Cb 0.41 -0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.12 2jpo h LEU 90 CO 0.07 0.10 0.39 1.62 -1.08 0.00 0.00 178.44 179.55 2jpo h VAL 91 N 0.22 1.07 -0.10 1.22 3.04 -1.68 0.09 116.25 120.11 2jpo h VAL 91 Ca 0.10 -0.23 -0.07 0.00 -1.01 0.00 0.00 66.70 65.49 2jpo h VAL 91 Cb 0.05 0.32 -0.01 0.00 -2.01 0.00 0.00 31.29 29.65 2jpo h VAL 91 CO -0.09 0.12 -0.24 -0.78 -1.01 0.00 0.00 177.57 175.57 2jpo h ASP 92 N 0.68 0.17 -0.37 3.17 1.82 -0.64 0.15 116.42 121.41 2jpo h ASP 92 Ca 0.24 -0.05 -0.15 0.00 -0.39 0.00 0.00 57.03 56.69 2jpo h ASP 92 Cb 0.11 -0.04 -0.01 0.00 0.68 0.00 0.00 39.33 40.06 2jpo h ASP 92 CO -0.07 0.42 -0.35 0.40 -1.61 0.00 0.00 179.24 178.03 2jpo h ILE 93 N 0.16 1.28 0.03 2.25 2.04 -0.11 0.16 117.51 123.31 2jpo h ILE 93 Ca 0.03 -1.52 -0.25 0.00 1.00 0.00 0.00 64.86 64.12 2jpo h ILE 93 Cb 0.52 1.40 0.01 0.00 -0.74 0.00 0.00 36.82 38.01 2jpo h ILE 93 CO 0.04 0.51 -1.04 -0.29 0.00 0.00 0.00 178.15 177.37 2jpo h ILE 94 N 0.71 1.37 -0.26 -0.67 6.09 -1.13 0.54 117.51 124.16 2jpo h ILE 94 Ca 0.06 -2.47 -0.07 0.00 -1.37 0.00 0.00 64.86 61.01 2jpo h ILE 94 Cb 0.94 2.50 -0.01 0.00 0.47 0.00 0.00 36.82 40.72 2jpo h ILE 94 CO 0.09 0.74 -0.15 0.45 -3.07 0.00 0.00 178.15 176.21 2jpo h HIS 95 N 0.26 0.48 -0.05 2.19 3.86 -1.00 0.16 115.15 121.05 2jpo h HIS 95 Ca -0.11 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.01 2jpo h HIS 95 Cb 1.69 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 30.03 2jpo h HIS 95 CO 0.08 0.58 -0.01 0.78 0.86 0.00 0.00 177.93 180.22 2jpo h GLY 96 N 0.92 0.10 1.40 2.45 0.00 -0.44 -3.20 103.07 104.31 2jpo h GLY 96 Ca 0.08 -0.09 -0.15 0.00 0.00 0.00 0.00 47.33 47.17 2jpo h GLY 96 CO 0.03 0.08 -0.43 0.00 0.00 0.00 0.00 176.54 176.21 2jpo h GLU 98 N 0.53 0.00 0.06 0.00 -0.00 -0.71 0.27 114.58 114.74 2jpo h GLU 98 Ca 0.04 0.00 -0.29 0.00 -0.00 0.00 0.00 59.36 59.11 2jpo h GLU 98 Cb 0.97 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.70 2jpo h GLU 98 CO 0.09 0.02 -1.55 0.87 -0.00 0.00 0.00 179.01 178.45 2jpo h LYS 99 N 0.00 0.13 0.00 1.06 6.56 -1.53 -3.37 116.57 119.42 2jpo h LYS 99 Ca -0.00 -0.23 0.00 0.00 -1.06 0.00 0.00 60.65 59.36 2jpo h LYS 99 Cb 0.11 0.08 0.00 0.00 -0.57 0.00 0.00 32.23 31.85 2jpo h LYS 99 CO 0.00 1.11 0.00 0.77 -2.06 0.00 0.00 179.45 179.27 2jpo h SER 100 N -0.51 0.00 -2.59 0.86 0.02 -0.45 -3.44 113.55 107.43 2jpo h SER 100 Ca -0.37 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.00 2jpo h SER 100 Cb 1.64 0.00 0.08 0.00 0.14 0.00 0.00 62.40 64.25 2jpo h SER 100 CO -0.06 0.00 0.67 0.00 -1.14 0.00 0.00 176.83 176.30 2jpo n ALA 101 N -1.82 1.23 -0.88 3.77 0.00 0.02 -4.96 120.51 117.87 2jpo n ALA 101 Ca 0.00 0.42 -0.30 0.00 0.00 0.00 0.00 53.44 53.56 2jpo n ALA 101 Cb 0.15 -2.30 0.18 0.00 0.00 0.00 0.00 19.45 17.47 2jpo n ALA 101 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2jpo s PRO 102 N -0.07 0.62 -0.49 0.00 0.04 -1.26 -4.87 135.00 128.97 2jpo s PRO 102 Ca 0.71 1.05 -0.27 0.00 0.04 0.00 0.00 61.00 62.53 2jpo s PRO 102 Cb -0.65 -1.72 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 2jpo s PRO 102 CO 0.47 -2.74 1.91 -1.25 0.04 0.00 0.00 177.00 175.42 2jpo s PRO 103 N -4.72 2.83 0.00 0.56 0.04 -1.26 -4.26 135.00 128.19 2jpo s PRO 103 Ca 0.66 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.72 2jpo s PRO 103 Cb -0.21 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 29.99 2jpo s PRO 103 CO 0.59 -2.47 0.00 -1.71 0.04 0.00 0.00 177.00 173.45 2jpo n ASN 104 N 12.21 0.00 -2.51 6.66 5.15 -1.26 -5.14 115.26 130.37 2jpo n ASN 104 Ca 0.23 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.21 2jpo n ASN 104 Cb 0.50 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.75 2jpo n ASN 104 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2jpo n ASP 105 N -1.25 -5.34 -3.83 1.20 8.00 -1.26 -4.97 116.55 109.10 2jpo n ASP 105 Ca 0.00 0.45 -0.12 0.00 0.71 0.00 0.00 54.79 55.83 2jpo n ASP 105 Cb 0.00 -1.20 -0.09 0.00 -0.02 0.00 0.00 41.12 39.80 2jpo n ASP 105 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2jpo s ASP 106 N -0.52 -0.06 0.46 -2.24 -1.08 -1.26 -4.96 116.67 107.01 2jpo s ASP 106 Ca 0.00 -0.09 0.26 0.00 -0.52 0.00 0.00 52.55 52.20 2jpo s ASP 106 Cb 0.00 0.25 0.85 0.00 -1.46 0.00 0.00 42.92 42.56 2jpo s ASP 106 CO 0.00 -0.39 1.79 0.11 0.52 0.00 0.00 175.17 177.21 2jpo h LYS 107 N 4.19 0.00 0.00 4.34 1.57 -1.98 -3.01 116.57 121.68 2jpo h LYS 107 Ca -0.30 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.25 2jpo h LYS 107 Cb 1.19 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.46 2jpo h LYS 107 CO 0.40 0.15 -1.79 0.00 -0.57 0.00 0.00 179.45 177.64 2jpo h MET 109 N -0.37 0.75 0.02 0.00 2.86 -1.84 -0.73 114.93 115.62 2jpo h MET 109 Ca -0.35 -0.42 -0.00 0.00 -2.06 0.00 0.00 59.70 56.87 2jpo h MET 109 Cb 1.36 0.03 0.00 0.00 0.06 0.00 0.00 31.60 33.05 2jpo h MET 109 CO -0.17 1.05 -0.01 -0.22 1.06 0.00 0.00 176.91 178.62 2jpo h LYS 110 N 0.60 -0.03 -0.82 1.72 3.64 -1.83 -2.95 116.57 116.91 2jpo h LYS 110 Ca 0.04 0.00 0.19 0.00 -1.27 0.00 0.00 60.65 59.61 2jpo h LYS 110 Cb 1.02 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.79 2jpo h LYS 110 CO 0.10 0.12 0.55 1.15 -2.27 0.00 0.00 179.45 179.10 2jpo h THR 111 N -0.17 0.70 0.46 1.00 2.02 -1.59 -0.06 112.91 115.27 2jpo h THR 111 Ca -0.00 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 2jpo h THR 111 Cb 0.16 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 2jpo h THR 111 CO 0.00 0.06 -0.22 0.40 0.37 0.00 0.00 175.52 176.13 2jpo h ILE 112 N 0.32 0.46 -0.31 3.11 2.04 -1.03 -1.02 117.51 121.07 2jpo h ILE 112 Ca 0.41 -0.42 0.06 0.00 1.00 0.00 0.00 64.86 65.90 2jpo h ILE 112 Cb 1.13 0.63 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 2jpo h ILE 112 CO -0.12 0.06 -0.02 -0.78 0.00 0.00 0.00 178.15 177.30 2jpo h ASP 113 N -0.89 -0.16 -0.79 1.72 3.58 -0.97 -0.18 116.42 118.72 2jpo h ASP 113 Ca -0.06 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 2jpo h ASP 113 Cb 0.58 0.14 -0.04 0.00 1.72 0.00 0.00 39.33 41.73 2jpo h ASP 113 CO 0.10 -0.05 0.47 0.58 -2.88 0.00 0.00 179.24 177.47 2jpo h VAL 114 N 0.07 1.22 -0.04 2.25 2.07 -1.11 0.28 116.25 120.99 2jpo h VAL 114 Ca 0.15 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 2jpo h VAL 114 Cb 0.21 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 2jpo h VAL 114 CO -0.27 0.24 -0.09 0.00 0.02 0.00 0.00 177.57 177.47 2jpo h ALA 115 N 1.42 0.07 -0.60 1.67 0.00 -0.25 0.59 119.26 122.16 2jpo h ALA 115 Ca 0.29 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2jpo h ALA 115 Cb -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2jpo h ALA 115 CO -0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 179.25 179.11 2jpo h MET 116 N -0.38 1.05 -0.98 0.00 -0.00 -0.90 -2.21 114.93 111.51 2jpo h MET 116 Ca 0.00 -0.33 0.11 0.00 -0.00 0.00 0.00 59.70 59.48 2jpo h MET 116 Cb 0.67 -0.10 -0.08 0.00 -0.00 0.00 0.00 31.60 32.09 2jpo h MET 116 CO 0.02 1.03 0.63 0.00 -0.00 0.00 0.00 176.91 178.58 2jpo h PHE 118 N 1.00 -1.27 -0.93 0.00 3.04 -0.24 0.15 116.94 118.68 2jpo h PHE 118 Ca 0.47 0.03 0.06 0.00 3.98 0.00 0.00 57.97 62.51 2jpo h PHE 118 Cb 0.43 0.53 -0.06 0.00 2.56 0.00 0.00 35.95 39.41 2jpo h PHE 118 CO -0.00 -0.53 0.61 -0.22 -2.02 0.00 0.00 178.31 176.14 2jpo h LYS 119 N -0.71 1.05 0.00 1.11 1.63 -1.17 -0.06 116.57 118.42 2jpo h LYS 119 Ca -0.02 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 2jpo h LYS 119 Cb 0.68 -0.24 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 2jpo h LYS 119 CO -0.18 0.69 0.00 1.63 -3.45 0.00 0.00 179.45 178.14 2jpo n LYS 120 N -4.49 0.73 0.00 1.90 4.76 0.10 -2.25 118.16 118.92 2jpo n LYS 120 Ca 0.14 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.65 2jpo n LYS 120 Cb 0.18 -1.50 0.03 0.00 -1.84 0.00 0.00 35.03 31.90 2jpo n LYS 120 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2jpo n GLU 121 N -1.12 1.38 -0.10 1.97 -0.58 0.47 -4.61 120.64 118.05 2jpo n GLU 121 Ca 0.19 -1.01 0.02 0.00 -0.42 0.00 0.00 57.16 55.94 2jpo n GLU 121 Cb 0.16 -1.22 0.33 0.00 -0.57 0.00 0.00 31.44 30.14 2jpo n GLU 121 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2jpo h ILE 122 N 2.05 1.16 -0.70 -3.67 1.08 -0.90 -2.33 117.51 114.20 2jpo h ILE 122 Ca 0.00 -0.35 0.20 0.00 -0.39 0.00 0.00 64.86 64.33 2jpo h ILE 122 Cb 0.50 0.38 -0.03 0.00 -3.07 0.00 0.00 36.82 34.60 2jpo h ILE 122 CO 0.00 0.16 0.67 1.12 -0.69 0.00 0.00 178.15 179.41 2jpo h HIS 123 N 0.76 0.00 -0.59 1.37 2.07 -1.81 -0.04 115.15 116.90 2jpo h HIS 123 Ca 0.20 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.67 2jpo h HIS 123 Cb -0.03 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 29.92 2jpo h HIS 123 CO 0.00 0.00 0.19 0.87 -3.07 0.00 0.00 177.93 175.92 2jpo h LYS 124 N 0.00 0.89 -0.07 5.12 1.57 -1.78 -3.00 116.57 119.31 2jpo h LYS 124 Ca 0.33 -0.17 -0.21 0.00 -1.87 0.00 0.00 60.65 58.74 2jpo h LYS 124 Cb 1.67 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.84 2jpo h LYS 124 CO -0.00 0.77 -0.82 -0.07 -0.57 0.00 0.00 179.45 178.76 2jpo h LEU 125 N 0.87 0.61 0.00 2.94 3.38 -1.18 -3.47 115.31 118.45 2jpo h LEU 125 Ca 0.20 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2jpo h LEU 125 Cb 0.25 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2jpo h LEU 125 CO -0.01 1.20 0.00 0.59 0.09 0.00 0.00 178.44 180.31 2jpo n ASN 126 N -3.83 0.00 -3.64 -0.43 5.03 -1.14 -4.94 115.26 106.32 2jpo n ASN 126 Ca -0.06 0.00 -0.27 0.00 0.87 0.00 0.00 54.58 55.12 2jpo n ASN 126 Cb 0.76 -0.20 0.20 0.00 -1.02 0.00 0.00 39.78 39.52 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 -1.40 -3.94 -3.75 3.10 4.27 -1.26 -5.06 117.44 109.40 2jpo n TRP 127 Ca 0.00 -1.01 -0.28 0.00 -3.89 0.00 0.00 57.50 52.32 2jpo n TRP 127 Cb 0.00 -0.96 -0.16 0.00 -1.36 0.00 0.00 31.31 28.82 2jpo n TRP 127 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 2jpo s VAL 128 N -3.38 0.60 0.60 -1.67 1.01 -1.26 -4.86 120.40 111.45 2jpo s VAL 128 Ca 0.67 -0.65 -0.18 0.00 0.00 0.00 0.00 61.98 61.83 2jpo s VAL 128 Cb -0.03 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 2jpo s VAL 128 CO 0.48 -0.23 1.15 -2.84 0.00 0.00 0.00 175.10 173.66 2jpo s PRO 129 N 1.82 3.00 0.99 2.72 0.02 -1.26 -5.04 135.00 137.26 2jpo s PRO 129 Ca -0.01 1.60 -0.12 0.00 0.02 0.00 0.00 61.00 62.50 2jpo s PRO 129 Cb -0.17 -1.96 0.14 0.00 0.02 0.00 0.00 34.50 32.53 2jpo s PRO 129 CO -0.09 -1.13 0.83 0.09 -0.33 0.00 0.00 177.00 176.37 2jpo n ASN 130 N -1.82 -0.91 -0.10 2.53 3.02 -1.26 -4.77 115.26 111.95 2jpo n ASN 130 Ca 0.12 0.24 -0.06 0.00 -0.03 0.00 0.00 54.58 54.85 2jpo n ASN 130 Cb 0.51 -1.32 0.01 0.00 -0.61 0.00 0.00 39.78 38.36 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 -1.98 -0.10 0.07 3.52 2.86 -1.96 -1.69 114.93 115.64 2jpo h MET 131 Ca -0.47 0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.17 2jpo h MET 131 Cb 1.29 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.98 2jpo h MET 131 CO 0.40 -0.07 -0.03 -0.44 1.06 0.00 0.00 176.91 177.83 2jpo h ASP 132 N -0.11 -0.08 -0.57 1.22 3.32 -1.97 -0.57 116.42 117.66 2jpo h ASP 132 Ca 0.18 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.29 2jpo h ASP 132 Cb 0.39 0.02 -0.09 0.00 0.22 0.00 0.00 39.33 39.86 2jpo h ASP 132 CO -0.43 -0.05 -0.56 -0.07 -1.72 0.00 0.00 179.24 176.41 2jpo h LEU 133 N -0.10 -1.93 -0.55 1.55 4.07 -1.88 0.28 115.31 116.76 2jpo h LEU 133 Ca -0.01 0.27 0.03 0.00 0.08 0.00 0.00 57.88 58.25 2jpo h LEU 133 Cb 0.08 0.81 -0.04 0.00 1.08 0.00 0.00 40.66 42.59 2jpo h LEU 133 CO 0.02 -0.36 0.32 0.58 -1.08 0.00 0.00 178.44 177.92 2jpo h VAL 134 N -0.29 1.04 0.23 1.22 2.07 -0.58 -2.30 116.25 117.64 2jpo h VAL 134 Ca 0.10 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 2jpo h VAL 134 Cb 0.55 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2jpo h VAL 134 CO -0.69 0.11 -0.11 0.40 0.02 0.00 0.00 177.57 177.30 2jpo h ILE 135 N 0.63 0.41 -1.31 4.57 2.04 -0.90 -3.29 117.51 119.66 2jpo h ILE 135 Ca 0.22 -0.95 0.42 0.00 1.00 0.00 0.00 64.86 65.55 2jpo h ILE 135 Cb 0.05 0.71 -0.12 0.00 -0.74 0.00 0.00 36.82 36.72 2jpo h ILE 135 CO -0.11 0.11 0.85 1.23 0.00 0.00 0.00 178.15 180.24 2jpo h GLY 136 N -1.00 1.20 0.88 5.37 0.00 -0.45 -0.98 103.07 108.09 2jpo h GLY 136 Ca -0.03 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.14 2jpo h GLY 136 CO 0.05 -0.34 0.02 -2.09 0.00 0.00 0.00 176.54 174.18 2jpo h GLU 137 N 0.11 0.50 0.08 4.80 4.57 -1.48 -0.86 114.58 122.30 2jpo h GLU 137 Ca 0.79 -0.15 0.02 0.00 -1.18 0.00 0.00 59.36 58.84 2jpo h GLU 137 Cb 2.50 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 31.00 2jpo h GLU 137 CO -0.38 0.63 -0.22 0.28 -1.18 0.00 0.00 179.01 178.14 2jpo h VAL 138 N 0.31 0.51 -0.55 0.32 2.07 -1.32 -1.10 116.25 116.49 2jpo h VAL 138 Ca 0.09 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.66 2jpo h VAL 138 Cb 0.39 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2jpo h VAL 138 CO 0.01 0.00 0.37 -0.07 0.02 0.00 0.00 177.57 177.90 2jpo h LEU 139 N -0.39 0.49 -0.03 2.57 4.07 -1.23 0.14 115.31 120.93 2jpo h LEU 139 Ca 0.04 -0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.97 2jpo h LEU 139 Cb 0.43 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.06 2jpo h LEU 139 CO -0.14 0.33 -0.08 0.00 -1.08 0.00 0.00 178.44 177.46 2jpo h ALA 140 N 1.69 0.05 0.52 1.53 0.00 -0.99 -3.39 119.26 118.67 2jpo h ALA 140 Ca 0.23 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2jpo h ALA 140 Cb 0.21 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.00 2jpo h ALA 140 CO -0.06 -0.09 -0.25 1.49 0.00 0.00 0.00 179.25 180.34 2jpo h GLU 141 N -0.47 -0.67 0.00 0.00 4.57 -0.18 0.28 114.58 118.11 2jpo h GLU 141 Ca -0.00 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2jpo h GLU 141 Cb 0.70 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 2jpo h GLU 141 CO 0.02 -0.37 0.00 0.28 -1.18 0.00 0.00 179.01 177.76