#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 2.72 0.00 -1.46 0.04 -1.26 -4.70 135.00 130.35 2jpo s PRO 2 Ca 0.00 0.93 0.00 0.00 0.04 0.00 0.00 61.00 61.97 2jpo s PRO 2 Cb 0.00 -4.37 0.00 0.00 0.04 0.00 0.00 34.50 30.17 2jpo s PRO 2 CO 0.00 -2.60 0.00 -1.91 0.04 0.00 0.00 177.00 172.53 2jpo n GLU 3 N 8.98 0.00 -0.57 4.56 4.07 -1.26 -4.98 120.64 131.44 2jpo n GLU 3 Ca 0.23 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 57.23 2jpo n GLU 3 Cb 0.51 0.00 0.06 0.00 -0.06 0.00 0.00 31.44 31.95 2jpo n GLU 3 CO 0.00 0.00 0.00 0.44 -0.06 0.00 0.00 177.13 177.51 2jpo n ILE 4 N 0.00 2.06 -2.95 6.31 -5.35 -1.26 -4.88 119.36 113.28 2jpo n ILE 4 Ca 0.00 -0.93 -0.38 0.00 -0.27 0.00 0.00 62.75 61.17 2jpo n ILE 4 Cb 0.00 -0.92 -0.06 0.00 -1.74 0.00 0.00 39.64 36.92 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 -1.37 4.51 -0.96 6.28 -1.94 -1.26 -4.28 119.30 120.28 2jpo s MET 5 Ca 0.24 1.14 -0.12 0.00 -1.71 0.00 0.00 55.69 55.24 2jpo s MET 5 Cb 0.19 -3.07 0.01 0.00 2.01 0.00 0.00 34.83 33.98 2jpo s MET 5 CO 0.03 0.46 0.64 1.63 -0.01 0.00 0.00 175.02 177.77 2jpo n LYS 6 N 1.14 -1.10 -4.53 2.03 5.02 -1.26 -5.00 118.16 114.45 2jpo n LYS 6 Ca -0.03 0.56 -0.21 0.00 -2.02 0.00 0.00 58.31 56.60 2jpo n LYS 6 Cb 0.49 -2.58 -0.14 0.00 -0.02 0.00 0.00 35.03 32.78 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 1.66 0.00 4.39 0.01 -1.26 -5.01 114.94 111.55 2jpo s ASN 7 Ca 0.18 -0.33 0.14 0.00 -0.71 0.00 0.00 52.86 52.14 2jpo s ASN 7 Cb -0.09 -0.15 0.67 0.00 0.41 0.00 0.00 41.25 42.08 2jpo s ASN 7 CO 0.91 0.12 1.39 0.00 -1.51 0.00 0.00 177.10 178.01 2jpo n LEU 8 N 2.41 0.00 -0.15 0.60 -0.00 -1.26 -3.01 117.00 115.59 2jpo n LEU 8 Ca -0.16 0.35 -0.03 0.00 -0.00 0.00 0.00 56.01 56.17 2jpo n LEU 8 Cb 0.55 -0.35 0.06 0.00 -0.00 0.00 0.00 43.42 43.68 2jpo n LEU 8 CO 0.24 -0.19 0.88 -1.28 -0.00 0.00 0.00 177.39 177.04 2jpo h SER 9 N 0.00 -0.07 0.15 1.45 0.87 -1.95 -1.32 113.55 112.68 2jpo h SER 9 Ca 0.00 0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2jpo h SER 9 Cb 0.16 0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 62.26 2jpo h SER 9 CO 0.00 -0.01 -0.09 0.78 -0.53 0.00 0.00 176.83 176.98 2jpo h ASN 10 N 0.18 -0.23 0.47 6.23 2.35 -1.90 -1.96 115.58 120.71 2jpo h ASN 10 Ca 0.24 0.02 -0.18 0.00 -0.55 0.00 0.00 56.30 55.82 2jpo h ASN 10 Cb 0.33 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 2jpo h ASN 10 CO -0.34 -0.15 -0.79 0.78 -1.65 0.00 0.00 177.43 175.27 2jpo h ASN 11 N -0.24 0.31 0.18 5.81 2.35 -1.75 -2.37 115.58 119.86 2jpo h ASN 11 Ca -0.01 -0.22 0.01 0.00 -0.55 0.00 0.00 56.30 55.53 2jpo h ASN 11 Cb 0.20 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.44 2jpo h ASN 11 CO 0.01 0.98 -0.38 0.15 -1.65 0.00 0.00 177.43 176.54 2jpo h PHE 12 N 0.15 -1.04 -0.27 1.19 3.04 -1.05 -1.92 116.94 117.04 2jpo h PHE 12 Ca -0.03 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.90 2jpo h PHE 12 Cb 1.38 0.43 -0.01 0.00 2.56 0.00 0.00 35.95 40.31 2jpo h PHE 12 CO 0.03 -0.49 0.02 0.78 -2.02 0.00 0.00 178.31 176.63 2jpo h GLY 13 N -0.65 0.42 0.26 2.40 0.00 -1.22 -1.71 103.07 102.57 2jpo h GLY 13 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2jpo h GLY 13 CO -0.19 0.21 -0.46 1.70 0.00 0.00 0.00 176.54 177.81 2jpo h LYS 14 N 0.39 -0.73 0.00 4.80 3.64 -1.04 -0.85 116.57 122.78 2jpo h LYS 14 Ca 0.09 0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 2jpo h LYS 14 Cb 0.23 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2jpo h LYS 14 CO 0.00 -0.49 -0.39 0.00 -2.27 0.00 0.00 179.45 176.31 2jpo h ALA 15 N -0.82 1.34 0.03 5.00 0.00 -0.65 0.26 119.26 124.41 2jpo h ALA 15 Ca -0.03 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.54 2jpo h ALA 15 Cb 0.71 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2jpo h ALA 15 CO -0.16 0.48 -0.09 1.98 0.00 0.00 0.00 179.25 181.46 2jpo h MET 16 N 0.00 -0.17 -0.94 0.00 1.85 -1.21 -2.27 114.93 112.19 2jpo h MET 16 Ca -0.00 0.01 -0.00 0.00 -0.61 0.00 0.00 59.70 59.09 2jpo h MET 16 Cb 0.69 0.04 -0.05 0.00 0.43 0.00 0.00 31.60 32.72 2jpo h MET 16 CO 0.05 -0.11 0.57 0.22 -0.40 0.00 0.00 176.91 177.24 2jpo h ASP 17 N -0.18 1.12 -0.45 1.39 3.58 0.47 0.26 116.42 122.61 2jpo h ASP 17 Ca 0.03 -0.06 0.02 0.00 0.42 0.00 0.00 57.03 57.43 2jpo h ASP 17 Cb 0.20 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.95 2jpo h ASP 17 CO -0.07 0.86 0.30 1.56 -2.88 0.00 0.00 179.24 179.01 2jpo h GLN 18 N 1.29 0.55 0.21 0.28 1.08 -0.97 -0.12 115.11 117.43 2jpo h GLN 18 Ca 0.34 -0.03 -0.34 0.00 -1.45 0.00 0.00 58.65 57.16 2jpo h GLN 18 Cb -0.06 -0.12 0.02 0.00 -0.05 0.00 0.00 27.48 27.26 2jpo h GLN 18 CO -0.06 0.36 -1.62 0.00 -0.95 0.00 0.00 178.83 176.56 2jpo n LYS 20 N -3.63 0.02 -0.04 0.00 4.81 0.73 -0.15 118.16 119.90 2jpo n LYS 20 Ca -0.21 0.47 -0.04 0.00 -0.87 0.00 0.00 58.31 57.66 2jpo n LYS 20 Cb 1.09 -1.56 -0.01 0.00 0.02 0.00 0.00 35.03 34.57 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 -1.60 0.82 0.23 3.14 -0.08 -0.08 -2.25 116.55 116.74 2jpo n ASP 21 Ca 0.01 0.14 0.07 0.00 -1.51 0.00 0.00 54.79 53.49 2jpo n ASP 21 Cb 0.04 -0.60 0.55 0.00 2.34 0.00 0.00 41.12 43.45 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 -0.42 0.00 -0.00 -0.67 4.39 -0.82 -0.47 114.58 116.59 2jpo h GLU 22 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2jpo h GLU 22 Cb 0.42 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2jpo h GLU 22 CO 0.00 0.16 -0.87 1.28 -1.16 0.00 0.00 179.01 178.42 2jpo n LEU 23 N -4.25 0.92 -1.15 1.33 4.77 0.78 -5.00 117.00 114.41 2jpo n LEU 23 Ca -0.02 -0.51 -0.13 0.00 -0.03 0.00 0.00 56.01 55.32 2jpo n LEU 23 Cb 0.23 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2jpo n LEU 23 CO 0.35 0.23 -0.14 -0.24 -1.33 0.00 0.00 177.39 176.26 2jpo n SER 24 N -1.39 -4.37 -4.68 -1.43 2.88 -0.19 -4.91 113.62 99.54 2jpo n SER 24 Ca 0.04 0.20 -0.45 0.00 -1.33 0.00 0.00 58.87 57.33 2jpo n SER 24 Cb 0.30 -3.19 -0.03 0.00 -0.75 0.00 0.00 64.21 60.53 2jpo n SER 24 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2jpo n LEU 25 N -1.59 3.20 -4.77 2.46 4.77 -0.95 -4.92 117.00 115.20 2jpo n LEU 25 Ca -0.14 1.11 -0.33 0.00 -0.03 0.00 0.00 56.01 56.62 2jpo n LEU 25 Cb 0.49 -1.44 0.04 0.00 -2.33 0.00 0.00 43.42 40.17 2jpo n LEU 25 CO 0.19 -0.34 0.75 -2.16 -1.33 0.00 0.00 177.39 174.50 2jpo s PRO 26 N 0.20 2.93 0.56 3.23 0.04 -1.26 -4.79 135.00 135.90 2jpo s PRO 26 Ca 0.73 1.44 0.32 0.00 0.04 0.00 0.00 61.00 63.53 2jpo s PRO 26 Cb -0.65 -1.96 1.62 0.00 0.04 0.00 0.00 34.50 33.55 2jpo s PRO 26 CO 0.44 -1.16 2.11 0.22 0.04 0.00 0.00 177.00 178.65 2jpo h ASP 27 N 0.30 0.00 0.64 6.66 3.58 -1.98 0.65 116.42 126.26 2jpo h ASP 27 Ca -0.47 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 56.94 2jpo h ASP 27 Cb 1.25 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.31 2jpo h ASP 27 CO 0.55 0.07 -0.31 -1.28 -2.88 0.00 0.00 179.24 175.39 2jpo h SER 28 N 0.00 -0.73 0.06 2.28 0.87 -1.98 -0.19 113.55 113.86 2jpo h SER 28 Ca -0.00 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 2jpo h SER 28 Cb 0.32 0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2jpo h SER 28 CO 0.01 -0.46 -0.04 0.58 -0.53 0.00 0.00 176.83 176.39 2jpo h VAL 29 N -0.97 0.85 0.64 2.23 2.07 -1.32 0.57 116.25 120.31 2jpo h VAL 29 Ca -0.09 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 2jpo h VAL 29 Cb 0.66 1.08 0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2jpo h VAL 29 CO 0.14 0.04 -0.31 0.58 0.02 0.00 0.00 177.57 178.05 2jpo h VAL 30 N 0.00 0.20 -0.77 2.57 2.07 -1.10 -1.65 116.25 117.57 2jpo h VAL 30 Ca -0.00 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.25 2jpo h VAL 30 Cb 0.08 0.27 -0.05 0.00 -1.52 0.00 0.00 31.29 30.07 2jpo h VAL 30 CO 0.01 0.03 0.49 0.00 0.02 0.00 0.00 177.57 178.11 2jpo h ALA 31 N -0.94 1.02 0.00 1.67 0.00 0.80 -0.52 119.26 121.29 2jpo h ALA 31 Ca -0.09 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2jpo h ALA 31 Cb 0.70 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2jpo h ALA 31 CO 0.14 0.28 -0.08 -0.44 0.00 0.00 0.00 179.25 179.15 2jpo h ASP 32 N 0.94 0.00 0.06 0.00 3.32 -0.00 0.17 116.42 120.90 2jpo h ASP 32 Ca 0.31 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.26 2jpo h ASP 32 Cb 0.04 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.60 2jpo h ASP 32 CO -0.12 0.08 -0.44 0.25 -1.72 0.00 0.00 179.24 177.29 2jpo h LEU 33 N 0.00 0.29 -1.97 1.55 6.46 -0.13 -3.17 115.31 118.35 2jpo h LEU 33 Ca -0.00 -0.91 0.01 0.00 -0.12 0.00 0.00 57.88 56.86 2jpo h LEU 33 Cb 0.26 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 40.10 2jpo h LEU 33 CO 0.01 1.17 0.04 1.88 -0.62 0.00 0.00 178.44 180.92 2jpo h TYR 34 N -0.55 0.04 -0.19 1.25 0.05 -0.43 0.06 116.97 117.20 2jpo h TYR 34 Ca -0.07 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.69 2jpo h TYR 34 Cb 1.29 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 39.00 2jpo h TYR 34 CO 0.21 0.02 0.01 -0.91 -1.05 0.00 0.00 178.16 176.44 2jpo h ASN 35 N 0.04 0.24 0.81 3.88 2.35 -0.78 -2.92 115.58 119.21 2jpo h ASN 35 Ca 0.03 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2jpo h ASN 35 Cb 0.06 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.36 2jpo h ASN 35 CO -0.00 0.29 0.00 0.15 -1.65 0.00 0.00 177.43 176.21 2jpo h PHE 36 N 0.27 0.00 -0.07 1.19 3.57 -0.94 -2.11 116.94 118.84 2jpo h PHE 36 Ca 0.06 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2jpo h PHE 36 Cb 0.17 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.91 2jpo h PHE 36 CO 0.00 0.00 0.00 0.91 -2.23 0.00 0.00 178.31 176.99 2jpo n TRP 37 N -2.92 0.10 0.00 0.41 7.02 -1.16 -4.72 117.44 116.17 2jpo n TRP 37 Ca 0.00 -0.47 0.00 0.00 -1.02 0.00 0.00 57.50 56.01 2jpo n TRP 37 Cb 0.25 -0.04 0.00 0.00 -2.42 0.00 0.00 31.31 29.10 2jpo n TRP 37 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2jpo n LYS 38 N -0.25 0.00 0.00 -0.99 5.02 -0.79 -4.96 118.16 116.19 2jpo n LYS 38 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 2jpo n LYS 38 Cb 0.27 -0.22 0.00 0.00 -0.02 0.00 0.00 35.03 35.06 2jpo n LYS 38 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2jpo n ASP 39 N -0.18 0.00 -0.84 4.39 8.00 -1.25 -5.03 116.55 121.65 2jpo n ASP 39 Ca 0.00 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.46 2jpo n ASP 39 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 2jpo n ASP 39 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2jpo n ASP 40 N 0.00 -0.52 -4.52 -2.24 5.75 -1.26 -5.06 116.55 108.70 2jpo n ASP 40 Ca 0.00 -1.65 -0.32 0.00 -0.01 0.00 0.00 54.79 52.81 2jpo n ASP 40 Cb 0.00 0.15 0.15 0.00 -1.03 0.00 0.00 41.12 40.39 2jpo n ASP 40 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jpo n TYR 41 N 0.03 -0.44 -4.02 2.11 4.19 -1.26 -5.04 117.16 112.72 2jpo n TYR 41 Ca -0.16 0.28 -0.29 0.00 3.31 0.00 0.00 57.90 61.05 2jpo n TYR 41 Cb 0.65 -1.86 -0.17 0.00 0.49 0.00 0.00 39.34 38.45 2jpo n TYR 41 CO 0.00 0.00 0.00 0.08 0.91 0.00 0.00 176.86 177.85 2jpo s VAL 42 N -2.50 1.35 0.70 2.97 1.01 -1.26 -4.85 120.40 117.82 2jpo s VAL 42 Ca 0.62 -0.50 -0.16 0.00 0.00 0.00 0.00 61.98 61.93 2jpo s VAL 42 Cb -0.22 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 34.88 2jpo s VAL 42 CO 0.63 0.42 1.18 0.23 0.00 0.00 0.00 175.10 177.56 2jpo n MET 43 N 4.77 0.75 0.00 2.72 2.81 -1.26 -4.97 117.12 121.93 2jpo n MET 43 Ca -0.16 0.32 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 2jpo n MET 43 Cb 0.50 -2.42 0.00 0.00 -0.71 0.00 0.00 33.22 30.59 2jpo n MET 43 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2jpo n THR 44 N -2.36 0.00 -2.71 2.03 -2.24 -1.26 -5.08 114.28 102.67 2jpo n THR 44 Ca 0.15 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.51 2jpo n THR 44 Cb 0.49 -0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 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 -4.00 7.38 0.37 3.42 -1.08 -1.26 -4.93 116.67 116.58 2jpo s ASP 45 Ca 0.00 1.67 0.11 0.00 -0.52 0.00 0.00 52.55 53.81 2jpo s ASP 45 Cb 0.00 -2.57 0.87 0.00 -1.46 0.00 0.00 42.92 39.76 2jpo s ASP 45 CO 0.00 -0.25 1.88 0.08 0.52 0.00 0.00 175.17 177.40 2jpo h ARG 46 N 6.71 0.61 -0.05 4.34 0.11 -1.98 -1.92 114.38 122.20 2jpo h ARG 46 Ca -0.41 -0.04 -0.03 0.00 0.10 0.00 0.00 59.98 59.60 2jpo h ARG 46 Cb 1.22 -0.14 -0.01 0.00 1.11 0.00 0.00 29.97 32.16 2jpo h ARG 46 CO 0.75 0.40 -0.11 -0.07 0.10 0.00 0.00 179.97 181.04 2jpo h LEU 47 N 0.63 0.07 -0.75 0.08 3.38 -1.95 -0.81 115.31 115.96 2jpo h LEU 47 Ca 0.43 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.42 2jpo h LEU 47 Cb 0.77 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 2jpo h LEU 47 CO -0.19 0.19 0.48 0.00 0.09 0.00 0.00 178.44 179.01 2jpo h ALA 48 N 1.82 0.97 -0.49 1.53 0.00 -1.64 0.54 119.26 122.00 2jpo h ALA 48 Ca 0.02 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2jpo h ALA 48 Cb 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2jpo h ALA 48 CO 0.02 0.29 0.04 0.78 0.00 0.00 0.00 179.25 180.38 2jpo h GLY 49 N 0.94 0.84 1.10 0.00 0.00 -1.29 -2.21 103.07 102.46 2jpo h GLY 49 Ca 0.29 -0.53 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 2jpo h GLY 49 CO -0.10 0.49 0.13 0.00 0.00 0.00 0.00 176.54 177.07 2jpo h ALA 51 N 1.09 0.46 0.46 0.00 0.00 -0.59 -0.06 119.26 120.63 2jpo h ALA 51 Ca 0.21 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2jpo h ALA 51 Cb 0.41 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2jpo h ALA 51 CO 0.01 -0.32 -0.40 0.82 0.00 0.00 0.00 179.25 179.36 2jpo h ILE 52 N 0.21 0.20 0.00 0.00 2.04 -0.98 -1.47 117.51 117.50 2jpo h ILE 52 Ca 0.20 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.04 2jpo h ILE 52 Cb 0.25 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2jpo h ILE 52 CO -0.27 0.00 -0.10 -0.55 0.00 0.00 0.00 178.15 177.23 2jpo h ASN 53 N -0.86 0.00 -0.13 1.72 7.08 -0.95 -2.26 115.58 120.17 2jpo h ASN 53 Ca -0.05 0.00 -0.14 0.00 -3.08 0.00 0.00 56.30 53.03 2jpo h ASN 53 Cb 0.74 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 36.99 2jpo h ASN 53 CO -0.03 0.10 -0.48 0.00 -2.08 0.00 0.00 177.43 174.95 2jpo h LEU 55 N 0.19 0.55 -1.10 0.00 -0.00 -0.69 -0.65 115.31 113.60 2jpo h LEU 55 Ca -0.02 0.06 -0.01 0.00 -0.00 0.00 0.00 57.88 57.91 2jpo h LEU 55 Cb 1.11 -0.04 -0.00 0.00 -0.00 0.00 0.00 40.66 41.72 2jpo h LEU 55 CO 0.10 0.22 -0.05 0.00 -0.00 0.00 0.00 178.44 178.71 2jpo h ALA 56 N 1.61 1.00 -0.02 1.53 0.00 -1.23 -0.56 119.26 121.59 2jpo h ALA 56 Ca 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2jpo h ALA 56 Cb 1.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2jpo h ALA 56 CO -0.24 0.06 0.00 -2.37 0.00 0.00 0.00 179.25 176.70 2jpo n THR 57 N -3.15 0.00 -2.03 0.00 5.66 -0.29 -4.11 114.28 110.37 2jpo n THR 57 Ca 0.01 -0.29 -0.09 0.00 -3.05 0.00 0.00 64.05 60.63 2jpo n THR 57 Cb 0.38 0.66 0.08 0.00 -1.55 0.00 0.00 70.33 69.90 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 0.37 2.45 -0.04 1.09 5.02 -0.24 -4.74 118.16 122.06 2jpo n LYS 58 Ca 0.18 -3.64 0.09 0.00 -2.02 0.00 0.00 58.31 52.92 2jpo n LYS 58 Cb 0.39 -1.80 0.48 0.00 -0.02 0.00 0.00 35.03 34.08 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 1.76 0.38 0.00 -0.35 3.38 -1.64 0.14 115.31 118.98 2jpo h LEU 59 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2jpo h LEU 59 Cb 1.36 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2jpo h LEU 59 CO 0.39 0.25 0.00 -0.90 0.09 0.00 0.00 178.44 178.27 2jpo n ASP 60 N -4.47 0.00 -0.11 -0.43 5.75 -1.26 -0.88 116.55 115.14 2jpo n ASP 60 Ca 0.07 0.35 -0.21 0.00 -0.01 0.00 0.00 54.79 54.99 2jpo n ASP 60 Cb 0.25 -0.44 -0.09 0.00 -1.03 0.00 0.00 41.12 39.82 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 -1.44 1.22 0.14 2.12 0.31 -0.33 -4.25 118.33 116.09 2jpo n VAL 61 Ca 0.07 -0.36 -0.00 0.00 -0.01 0.00 0.00 64.34 64.03 2jpo n VAL 61 Cb 0.23 -1.62 0.27 0.00 -0.91 0.00 0.00 33.84 31.81 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 -0.54 1.31 -2.24 2.52 3.04 -0.71 -3.36 116.25 116.27 2jpo h VAL 62 Ca -0.54 -1.52 -0.58 0.00 -1.01 0.00 0.00 66.70 63.06 2jpo h VAL 62 Cb 1.57 1.76 -0.39 0.00 -2.01 0.00 0.00 31.29 32.22 2jpo h VAL 62 CO -0.26 0.44 -1.01 -0.67 -1.01 0.00 0.00 177.57 175.07 2jpo n ASP 63 N -4.02 -0.09 0.08 3.17 2.03 -0.06 -3.59 116.55 114.07 2jpo n ASP 63 Ca -0.02 -2.53 0.09 0.00 0.52 0.00 0.00 54.79 52.86 2jpo n ASP 63 Cb 0.47 -0.59 0.40 0.00 -0.72 0.00 0.00 41.12 40.69 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 2.25 0.11 0.26 -0.67 -0.04 -1.26 -2.80 135.00 132.85 2jpo n PRO 64 Ca 0.26 0.37 0.16 0.00 -0.04 0.00 0.00 63.50 64.26 2jpo n PRO 64 Cb 0.49 -1.72 0.63 0.00 -0.04 0.00 0.00 33.50 32.87 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 0.00 3.54 5.19 -1.92 -3.47 116.42 119.76 2jpo h ASP 65 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2jpo h ASP 65 Cb 0.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.79 2jpo h ASP 65 CO 0.00 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.73 2jpo n GLY 66 N 0.11 1.70 0.05 2.75 0.00 -1.12 -5.01 105.19 103.66 2jpo n GLY 66 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 2jpo n GLY 66 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jpo n ASN 67 N 0.00 3.18 -4.73 1.61 3.02 -1.26 -4.96 115.26 112.13 2jpo n ASN 67 Ca 0.00 -0.04 -0.41 0.00 -0.03 0.00 0.00 54.58 54.09 2jpo n ASN 67 Cb 0.00 0.01 -0.04 0.00 -0.61 0.00 0.00 39.78 39.14 2jpo n ASN 67 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2jpo s LEU 68 N -5.40 4.44 0.14 3.41 0.20 -1.26 -3.51 118.68 116.71 2jpo s LEU 68 Ca -0.12 2.02 0.01 0.00 0.69 0.00 0.00 54.13 56.74 2jpo s LEU 68 Cb 0.03 -3.59 -0.04 0.00 -0.43 0.00 0.00 46.19 42.16 2jpo s LEU 68 CO 0.25 -0.30 0.00 -1.00 -0.29 0.00 0.00 176.35 175.01 2jpo s HIS 69 N 0.28 1.03 0.25 5.38 3.76 -0.08 -4.89 115.29 121.03 2jpo s HIS 69 Ca 0.52 -1.06 -0.31 0.00 -0.15 0.00 0.00 55.06 54.07 2jpo s HIS 69 Cb -0.29 -0.60 -0.13 0.00 1.11 0.00 0.00 32.58 32.68 2jpo s HIS 69 CO 0.32 -0.29 1.46 -2.39 -0.85 0.00 0.00 174.74 173.00 2jpo n HIS 70 N -0.15 2.34 -0.96 1.40 1.44 -1.26 -1.11 115.22 116.91 2jpo n HIS 70 Ca -0.08 0.38 0.00 0.00 -2.01 0.00 0.00 57.72 56.01 2jpo n HIS 70 Cb 0.63 -2.50 0.00 0.00 0.12 0.00 0.00 29.99 28.24 2jpo n HIS 70 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2jpo n GLY 71 N 2.20 0.07 2.55 -1.39 0.00 0.93 -4.90 105.19 104.64 2jpo n GLY 71 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.01 1.08 0.00 1.61 2.47 -0.27 -4.93 114.94 112.89 2jpo s ASN 72 Ca 0.00 -2.39 0.29 0.00 0.42 0.00 0.00 52.86 51.19 2jpo s ASN 72 Cb 0.00 0.19 1.34 0.00 -1.45 0.00 0.00 41.25 41.33 2jpo s ASN 72 CO 0.00 -0.19 1.94 0.00 -3.72 0.00 0.00 177.10 175.13 2jpo n ALA 73 N 3.34 2.63 -0.05 1.71 0.00 -1.26 -0.90 120.51 125.98 2jpo n ALA 73 Ca 0.21 -0.20 -0.13 0.00 0.00 0.00 0.00 53.44 53.32 2jpo n ALA 73 Cb 0.47 -1.41 -0.12 0.00 0.00 0.00 0.00 19.45 18.39 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 0.22 -0.01 0.00 0.00 1.57 -1.92 0.16 116.57 116.59 2jpo h LYS 74 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2jpo h LYS 74 Cb 0.34 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 2jpo h LYS 74 CO 0.00 0.80 -0.15 -0.44 -0.57 0.00 0.00 179.45 179.09 2jpo h ASP 75 N -0.86 0.00 0.28 0.86 3.32 -1.83 0.10 116.42 118.30 2jpo h ASP 75 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2jpo h ASP 75 Cb 0.81 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 2jpo h ASP 75 CO 0.00 0.15 -0.13 0.15 -1.72 0.00 0.00 179.24 177.68 2jpo h PHE 76 N 0.00 -0.35 -0.98 4.55 3.57 -1.52 -3.32 116.94 118.89 2jpo h PHE 76 Ca -0.00 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.66 2jpo h PHE 76 Cb 0.39 0.11 -0.09 0.00 2.79 0.00 0.00 35.95 39.16 2jpo h PHE 76 CO 0.00 -0.22 0.61 0.00 -2.23 0.00 0.00 178.31 176.48 2jpo h ALA 77 N -1.64 1.73 -0.97 2.41 0.00 -0.40 -1.26 119.26 119.14 2jpo h ALA 77 Ca -0.04 0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.04 2jpo h ALA 77 Cb 0.29 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 2jpo h ALA 77 CO 0.06 -0.05 0.59 0.52 0.00 0.00 0.00 179.25 180.37 2jpo h MET 78 N 0.76 0.91 -0.05 0.00 2.86 -0.92 -0.58 114.93 117.91 2jpo h MET 78 Ca 0.53 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 58.12 2jpo h MET 78 Cb 0.83 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.29 2jpo h MET 78 CO -0.31 0.60 0.00 1.63 1.06 0.00 0.00 176.91 179.89 2jpo n LYS 79 N -4.66 1.63 -0.06 1.72 4.76 -0.48 -4.33 118.16 116.74 2jpo n LYS 79 Ca 0.18 -0.93 -0.13 0.00 -2.87 0.00 0.00 58.31 54.57 2jpo n LYS 79 Cb 0.35 -1.46 -0.04 0.00 -1.84 0.00 0.00 35.03 32.04 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 0.13 0.00 0.00 2.13 8.25 -0.37 -5.03 115.22 120.33 2jpo n HIS 80 Ca 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.65 2jpo n HIS 80 Cb 0.33 -0.43 0.00 0.00 1.12 0.00 0.00 29.99 31.01 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 2.25 -0.67 3.20 -1.41 0.00 -0.37 -5.11 105.19 103.08 2jpo n GLY 81 Ca -0.23 0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.25 0.27 4.61 0.00 -0.68 -4.97 121.76 120.74 2jpo s ALA 82 Ca 0.00 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 51.46 2jpo s ALA 82 Cb 0.00 0.43 0.04 0.00 0.00 0.00 0.00 23.12 23.59 2jpo s ALA 82 CO 0.00 -0.47 0.34 -0.25 0.00 0.00 0.00 175.76 175.38 2jpo n ASP 83 N 0.13 1.22 -0.31 0.00 8.00 -1.26 -3.88 116.55 120.44 2jpo n ASP 83 Ca -0.16 -1.78 0.17 0.00 0.71 0.00 0.00 54.79 53.73 2jpo n ASP 83 Cb 0.61 -0.16 0.36 0.00 -0.02 0.00 0.00 41.12 41.92 2jpo n ASP 83 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2jpo h GLU 84 N 0.00 0.27 0.00 -1.24 5.08 -1.97 0.67 114.58 117.39 2jpo h GLU 84 Ca -0.14 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2jpo h GLU 84 Cb 0.60 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2jpo h GLU 84 CO 0.20 0.18 0.00 2.41 -1.00 0.00 0.00 179.01 180.80 2jpo n THR 85 N -5.14 0.00 -0.13 1.13 -1.04 -1.26 -0.79 114.28 107.05 2jpo n THR 85 Ca 0.25 1.33 -0.04 0.00 -2.04 0.00 0.00 64.05 63.55 2jpo n THR 85 Cb 0.79 -2.31 0.03 0.00 -1.82 0.00 0.00 70.33 67.02 2jpo n THR 85 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 2jpo h MET 86 N 0.00 0.15 -0.59 -2.82 2.86 -1.92 0.16 114.93 112.76 2jpo h MET 86 Ca 0.00 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.67 2jpo h MET 86 Cb 0.00 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.59 2jpo h MET 86 CO 0.00 0.10 0.35 0.00 1.06 0.00 0.00 176.91 178.41 2jpo h ALA 87 N 1.34 0.77 -0.77 6.32 0.00 -0.92 -0.87 119.26 125.13 2jpo h ALA 87 Ca 0.20 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2jpo h ALA 87 Cb 0.28 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2jpo h ALA 87 CO -0.31 0.06 0.33 0.37 0.00 0.00 0.00 179.25 179.69 2jpo h GLN 88 N 0.67 1.13 -0.16 0.00 5.75 -0.04 -1.20 115.11 121.26 2jpo h GLN 88 Ca 0.25 -0.19 -0.00 0.00 -0.15 0.00 0.00 58.65 58.56 2jpo h GLN 88 Cb 0.07 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 2jpo h GLN 88 CO -0.12 0.90 0.09 1.96 -2.65 0.00 0.00 178.83 179.00 2jpo h GLN 89 N 1.11 0.21 -0.49 1.69 4.20 0.30 0.77 115.11 122.89 2jpo h GLN 89 Ca 0.26 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.88 2jpo h GLN 89 Cb 0.18 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 2jpo h GLN 89 CO -0.03 0.21 0.03 -0.07 -0.67 0.00 0.00 178.83 178.31 2jpo h LEU 90 N 0.16 0.83 -1.62 1.46 3.38 -1.12 -1.90 115.31 116.50 2jpo h LEU 90 Ca 0.06 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 2jpo h LEU 90 Cb 0.05 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2jpo h LEU 90 CO -0.01 0.91 -0.07 0.58 0.09 0.00 0.00 178.44 179.94 2jpo h VAL 91 N 0.72 1.12 0.00 1.22 2.07 -0.99 -1.45 116.25 118.94 2jpo h VAL 91 Ca 0.14 -0.49 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 2jpo h VAL 91 Cb 0.46 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 2jpo h VAL 91 CO 0.02 0.15 -0.21 -0.78 0.02 0.00 0.00 177.57 176.77 2jpo h ASP 92 N 0.15 0.00 0.05 0.57 3.58 -0.07 0.12 116.42 120.82 2jpo h ASP 92 Ca 0.03 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 2jpo h ASP 92 Cb 0.22 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.27 2jpo h ASP 92 CO 0.01 0.21 -0.03 0.40 -2.88 0.00 0.00 179.24 176.96 2jpo h ILE 93 N 0.00 1.20 -0.25 2.25 1.08 -0.71 0.18 117.51 121.26 2jpo h ILE 93 Ca -0.00 -0.88 -0.19 0.00 -0.39 0.00 0.00 64.86 63.40 2jpo h ILE 93 Cb 0.64 1.78 0.00 0.00 -3.07 0.00 0.00 36.82 36.17 2jpo h ILE 93 CO 0.03 0.22 -0.60 -0.29 -0.69 0.00 0.00 178.15 176.82 2jpo h ILE 94 N -0.46 1.28 -0.56 -0.67 6.09 -1.25 -1.71 117.51 120.22 2jpo h ILE 94 Ca -0.01 -1.79 -0.06 0.00 -1.37 0.00 0.00 64.86 61.63 2jpo h ILE 94 Cb 0.41 1.72 -0.02 0.00 0.47 0.00 0.00 36.82 39.40 2jpo h ILE 94 CO 0.01 0.58 0.11 0.45 -3.07 0.00 0.00 178.15 176.23 2jpo h HIS 95 N 0.61 0.92 0.09 2.19 3.86 -0.83 0.25 115.15 122.25 2jpo h HIS 95 Ca -0.00 -0.10 0.02 0.00 -1.16 0.00 0.00 60.37 59.13 2jpo h HIS 95 Cb 1.20 -0.26 -0.04 0.00 1.06 0.00 0.00 27.41 29.37 2jpo h HIS 95 CO 0.07 0.78 -0.28 0.78 0.86 0.00 0.00 177.93 180.14 2jpo h GLY 96 N 1.00 -0.51 1.92 2.45 0.00 -0.28 -2.04 103.07 105.62 2jpo h GLY 96 Ca 0.18 0.34 -0.21 0.00 0.00 0.00 0.00 47.33 47.63 2jpo h GLY 96 CO 0.00 -0.23 -1.00 0.00 0.00 0.00 0.00 176.54 175.31 2jpo h GLU 98 N 0.02 0.64 0.00 0.00 -0.00 -0.38 0.12 114.58 114.98 2jpo h GLU 98 Ca -0.03 -0.23 -0.03 0.00 -0.00 0.00 0.00 59.36 59.06 2jpo h GLU 98 Cb 1.73 -0.04 -0.00 0.00 -0.00 0.00 0.00 28.75 30.43 2jpo h GLU 98 CO 0.14 0.80 -0.16 0.87 -0.00 0.00 0.00 179.01 180.65 2jpo h LYS 99 N 0.43 0.00 -0.62 1.06 6.56 -1.47 -2.49 116.57 120.04 2jpo h LYS 99 Ca 0.09 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.68 2jpo h LYS 99 Cb 0.55 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.21 2jpo h LYS 99 CO 0.03 0.16 0.00 0.45 -2.06 0.00 0.00 179.45 178.03 2jpo n SER 100 N -3.61 3.78 -4.76 0.86 2.88 -0.79 -5.01 113.62 106.96 2jpo n SER 100 Ca -0.01 -1.99 -0.41 0.00 -1.33 0.00 0.00 58.87 55.12 2jpo n SER 100 Cb 0.29 -0.41 -0.02 0.00 -0.75 0.00 0.00 64.21 63.33 2jpo n SER 100 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jpo s ALA 101 N -1.14 3.59 0.87 -1.46 0.00 0.37 -4.97 121.76 119.01 2jpo s ALA 101 Ca 0.45 1.36 -0.11 0.00 0.00 0.00 0.00 51.96 53.65 2jpo s ALA 101 Cb 0.24 -3.55 0.11 0.00 0.00 0.00 0.00 23.12 19.93 2jpo s ALA 101 CO 0.32 -0.77 1.09 -1.25 0.00 0.00 0.00 175.76 175.16 2jpo s PRO 102 N -1.04 1.50 -1.10 0.00 0.04 -1.26 -4.85 135.00 128.28 2jpo s PRO 102 Ca 0.55 0.78 -0.22 0.00 0.04 0.00 0.00 61.00 62.15 2jpo s PRO 102 Cb -0.42 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 2jpo s PRO 102 CO 0.49 -2.06 1.82 -1.25 0.04 0.00 0.00 177.00 176.04 2jpo s PRO 103 N -5.00 2.99 -0.48 0.56 0.04 -1.26 -4.51 135.00 127.35 2jpo s PRO 103 Ca 0.63 -1.09 0.06 0.00 0.04 0.00 0.00 61.00 60.64 2jpo s PRO 103 Cb -0.17 -5.27 0.26 0.00 0.04 0.00 0.00 34.50 29.36 2jpo s PRO 103 CO 0.56 -3.18 0.94 -1.71 0.04 0.00 0.00 177.00 173.65 2jpo n ASN 104 N 12.16 -2.77 -4.72 6.66 5.15 -1.26 -5.13 115.26 125.35 2jpo n ASN 104 Ca 0.42 -3.40 -0.42 0.00 -0.60 0.00 0.00 54.58 50.58 2jpo n ASN 104 Cb 0.47 1.86 -0.03 0.00 -0.53 0.00 0.00 39.78 41.55 2jpo n ASN 104 CO 0.00 0.00 0.00 1.51 1.40 0.00 0.00 177.26 180.17 2jpo s ASP 105 N -1.60 6.77 0.21 1.20 -4.77 -1.26 -4.02 116.67 113.20 2jpo s ASP 105 Ca 0.30 2.42 -0.22 0.00 -3.30 0.00 0.00 52.55 51.74 2jpo s ASP 105 Cb 0.24 -2.59 0.05 0.00 -1.09 0.00 0.00 42.92 39.53 2jpo s ASP 105 CO -0.20 -0.68 0.65 -0.62 0.70 0.00 0.00 175.17 175.01 2jpo s ASP 106 N 1.01 -0.44 0.21 2.11 -1.08 -1.26 -4.93 116.67 112.28 2jpo s ASP 106 Ca 0.65 -0.25 0.11 0.00 -0.52 0.00 0.00 52.55 52.54 2jpo s ASP 106 Cb -0.39 0.65 -0.06 0.00 -1.46 0.00 0.00 42.92 41.67 2jpo s ASP 106 CO 0.32 -1.12 1.37 0.11 0.52 0.00 0.00 175.17 176.36 2jpo h LYS 107 N 2.00 0.00 0.00 4.34 1.57 -2.00 -3.37 116.57 119.11 2jpo h LYS 107 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2jpo h LYS 107 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 2jpo h LYS 107 CO 0.32 0.73 -0.93 0.00 -0.57 0.00 0.00 179.45 179.00 2jpo h MET 109 N 0.00 0.75 -0.60 0.00 2.86 -1.85 -1.09 114.93 115.00 2jpo h MET 109 Ca 0.00 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.41 2jpo h MET 109 Cb 0.93 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.49 2jpo h MET 109 CO 0.00 0.80 0.33 -0.22 1.06 0.00 0.00 176.91 178.88 2jpo h LYS 110 N 0.60 0.84 -0.48 1.72 1.63 -1.73 -1.85 116.57 117.30 2jpo h LYS 110 Ca 0.13 -0.10 0.06 0.00 -0.85 0.00 0.00 60.65 59.89 2jpo h LYS 110 Cb 0.43 -0.17 -0.05 0.00 -0.60 0.00 0.00 32.23 31.85 2jpo h LYS 110 CO 0.02 0.64 0.19 1.15 -3.45 0.00 0.00 179.45 178.00 2jpo h THR 111 N 0.82 0.88 -0.99 1.00 2.02 -1.72 -1.93 112.91 112.98 2jpo h THR 111 Ca 0.21 -0.13 0.02 0.00 0.77 0.00 0.00 66.41 67.28 2jpo h THR 111 Cb 0.04 0.46 -0.05 0.00 -1.74 0.00 0.00 68.15 66.86 2jpo h THR 111 CO -0.03 0.07 0.65 0.40 0.37 0.00 0.00 175.52 176.98 2jpo h ILE 112 N 0.38 1.22 1.00 3.11 2.04 -0.66 0.19 117.51 124.78 2jpo h ILE 112 Ca 0.22 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 2jpo h ILE 112 Cb 0.20 -0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.09 2jpo h ILE 112 CO -0.21 0.24 -0.48 0.44 0.00 0.00 0.00 178.15 178.14 2jpo h ASP 113 N 1.31 -1.15 -0.18 1.72 3.32 -0.63 0.95 116.42 121.76 2jpo h ASP 113 Ca 0.38 0.04 -0.10 0.00 0.02 0.00 0.00 57.03 57.36 2jpo h ASP 113 Cb -0.09 0.30 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2jpo h ASP 113 CO -0.10 -0.82 -0.22 0.58 -1.72 0.00 0.00 179.24 176.96 2jpo h VAL 114 N -1.35 1.27 0.02 -1.35 2.07 -1.29 -1.36 116.25 114.25 2jpo h VAL 114 Ca -0.14 -1.28 -0.00 0.00 0.82 0.00 0.00 66.70 66.10 2jpo h VAL 114 Cb 1.03 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2jpo h VAL 114 CO 0.22 0.42 -0.01 0.00 0.02 0.00 0.00 177.57 178.22 2jpo h ALA 115 N 1.20 -0.02 -0.07 1.67 0.00 -0.61 -0.17 119.26 121.26 2jpo h ALA 115 Ca 0.08 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2jpo h ALA 115 Cb 0.68 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2jpo h ALA 115 CO 0.05 -0.28 -0.10 0.00 0.00 0.00 0.00 179.25 178.92 2jpo h MET 116 N -0.50 0.11 0.10 0.00 -0.00 -0.75 -0.78 114.93 113.11 2jpo h MET 116 Ca -0.00 -0.02 -0.00 0.00 -0.00 0.00 0.00 59.70 59.67 2jpo h MET 116 Cb 0.48 -0.02 0.00 0.00 -0.00 0.00 0.00 31.60 32.06 2jpo h MET 116 CO 0.00 0.22 -0.05 0.00 -0.00 0.00 0.00 176.91 177.08 2jpo h PHE 118 N -0.14 -1.03 -0.56 0.00 3.04 0.50 0.18 116.94 118.93 2jpo h PHE 118 Ca -0.01 0.05 0.11 0.00 3.98 0.00 0.00 57.97 62.09 2jpo h PHE 118 Cb 0.11 0.48 -0.09 0.00 2.56 0.00 0.00 35.95 39.01 2jpo h PHE 118 CO -0.07 -0.31 0.04 -0.22 -2.02 0.00 0.00 178.31 175.73 2jpo h LYS 119 N -0.27 0.15 -0.63 1.11 3.64 -1.56 -0.04 116.57 118.96 2jpo h LYS 119 Ca 0.04 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.49 2jpo h LYS 119 Cb 0.38 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.10 2jpo h LYS 119 CO -0.34 0.10 0.29 0.87 -2.27 0.00 0.00 179.45 178.10 2jpo h LYS 120 N 0.15 0.50 0.00 1.90 1.79 -1.04 -2.44 116.57 117.44 2jpo h LYS 120 Ca 0.29 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 58.70 2jpo h LYS 120 Cb 0.44 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.97 2jpo h LYS 120 CO -0.44 0.33 -0.14 0.93 -1.08 0.00 0.00 179.45 179.05 2jpo h GLU 121 N 0.52 0.00 0.00 3.15 4.39 0.11 -3.08 114.58 119.67 2jpo h GLU 121 Ca 0.31 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.99 2jpo h GLU 121 Cb 0.32 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2jpo h GLU 121 CO -0.26 0.14 -0.10 0.82 -1.16 0.00 0.00 179.01 178.45 2jpo h ILE 122 N 0.00 0.80 -0.42 3.13 2.04 -0.60 -1.68 117.51 120.78 2jpo h ILE 122 Ca -0.00 -0.40 0.12 0.00 1.00 0.00 0.00 64.86 65.58 2jpo h ILE 122 Cb 0.75 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 2jpo h ILE 122 CO 0.02 0.10 0.38 0.45 0.00 0.00 0.00 178.15 179.10 2jpo h HIS 123 N 0.00 0.00 -0.35 1.37 3.86 -1.65 -0.75 115.15 117.62 2jpo h HIS 123 Ca -0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.17 2jpo h HIS 123 Cb 0.22 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.68 2jpo h HIS 123 CO 0.00 0.00 0.06 0.87 0.86 0.00 0.00 177.93 179.72 2jpo h LYS 124 N 0.00 0.53 0.00 2.45 1.57 -1.54 -3.05 116.57 116.53 2jpo h LYS 124 Ca 0.20 -0.09 -0.15 0.00 -1.87 0.00 0.00 60.65 58.73 2jpo h LYS 124 Cb 0.95 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 2jpo h LYS 124 CO -0.00 0.51 -0.73 -0.07 -0.57 0.00 0.00 179.45 178.59 2jpo h LEU 125 N 0.51 0.00 0.00 2.94 3.38 -1.31 -3.47 115.31 117.37 2jpo h LEU 125 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2jpo h LEU 125 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2jpo h LEU 125 CO 0.00 0.73 0.00 0.59 0.09 0.00 0.00 178.44 179.85 2jpo n ASN 126 N -3.34 0.00 -3.38 -0.43 5.03 -1.15 -4.95 115.26 107.03 2jpo n ASN 126 Ca 0.01 0.00 -0.13 0.00 0.87 0.00 0.00 54.58 55.33 2jpo n ASN 126 Cb 0.81 0.00 0.07 0.00 -1.02 0.00 0.00 39.78 39.64 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 -1.65 -3.22 -3.70 3.10 4.27 -1.26 -5.09 117.44 109.89 2jpo n TRP 127 Ca 0.00 -0.95 -0.12 0.00 -3.89 0.00 0.00 57.50 52.54 2jpo n TRP 127 Cb 0.00 -0.42 -0.12 0.00 -1.36 0.00 0.00 31.31 29.41 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 -1.71 -0.20 1.06 -1.67 0.11 -1.26 -4.79 120.40 111.94 2jpo s VAL 128 Ca 0.37 0.17 -0.14 0.00 -2.93 0.00 0.00 61.98 59.46 2jpo s VAL 128 Cb -0.02 -0.48 0.22 0.00 -1.53 0.00 0.00 36.38 34.58 2jpo s VAL 128 CO 0.25 0.07 1.08 -2.84 -3.33 0.00 0.00 175.10 170.34 2jpo s PRO 129 N 1.74 -0.10 1.00 1.54 0.02 -1.26 -5.07 135.00 132.87 2jpo s PRO 129 Ca -0.06 0.44 -0.15 0.00 0.02 0.00 0.00 61.00 61.25 2jpo s PRO 129 Cb -0.11 -1.68 0.19 0.00 0.02 0.00 0.00 34.50 32.92 2jpo s PRO 129 CO -0.10 -3.07 1.17 -0.80 -0.33 0.00 0.00 177.00 173.87 2jpo s ASN 130 N -3.40 2.77 0.11 2.53 0.01 -1.26 -4.79 114.94 110.90 2jpo s ASN 130 Ca 0.67 0.74 -0.32 0.00 -0.71 0.00 0.00 52.86 53.23 2jpo s ASN 130 Cb -0.18 -1.13 -0.12 0.00 0.41 0.00 0.00 41.25 40.23 2jpo s ASN 130 CO 0.58 -2.99 1.58 0.24 -1.51 0.00 0.00 177.10 175.00 2jpo h MET 131 N -1.81 -0.69 -0.62 -0.60 2.86 -1.97 -1.06 114.93 111.04 2jpo h MET 131 Ca -0.48 0.05 0.10 0.00 -2.06 0.00 0.00 59.70 57.31 2jpo h MET 131 Cb 1.30 0.16 -0.12 0.00 0.06 0.00 0.00 31.60 33.00 2jpo h MET 131 CO 0.50 -0.46 -0.36 0.38 1.06 0.00 0.00 176.91 178.03 2jpo h ASP 132 N -0.72 -1.25 0.62 1.22 2.03 -1.98 -1.78 116.42 114.56 2jpo h ASP 132 Ca 0.01 0.24 -0.03 0.00 -0.73 0.00 0.00 57.03 56.51 2jpo h ASP 132 Cb 0.72 0.61 0.01 0.00 -0.83 0.00 0.00 39.33 39.84 2jpo h ASP 132 CO -0.23 -0.31 -0.30 -0.07 -1.03 0.00 0.00 179.24 177.30 2jpo h LEU 133 N -0.17 -0.71 -1.13 0.15 3.38 -1.78 0.33 115.31 115.39 2jpo h LEU 133 Ca 0.23 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.24 2jpo h LEU 133 Cb 0.56 0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 2jpo h LEU 133 CO -0.70 -0.43 0.59 0.58 0.09 0.00 0.00 178.44 178.56 2jpo h VAL 134 N -0.94 1.11 0.18 1.22 2.07 -1.11 -2.00 116.25 116.78 2jpo h VAL 134 Ca -0.09 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 2jpo h VAL 134 Cb 0.67 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2jpo h VAL 134 CO 0.14 0.20 -0.09 0.40 0.02 0.00 0.00 177.57 178.24 2jpo h ILE 135 N 1.08 0.75 -1.09 4.57 2.04 -1.22 -3.31 117.51 120.33 2jpo h ILE 135 Ca 0.38 -1.07 0.33 0.00 1.00 0.00 0.00 64.86 65.50 2jpo h ILE 135 Cb 0.12 1.27 -0.13 0.00 -0.74 0.00 0.00 36.82 37.33 2jpo h ILE 135 CO -0.13 0.20 0.66 1.23 0.00 0.00 0.00 178.15 180.10 2jpo h GLY 136 N -0.89 1.71 0.81 5.37 0.00 -0.05 -1.67 103.07 108.35 2jpo h GLY 136 Ca -0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 2jpo h GLY 136 CO 0.04 -0.39 -0.26 0.83 0.00 0.00 0.00 176.54 176.77 2jpo h GLU 137 N 0.29 -0.69 0.01 4.80 3.07 -1.46 -0.74 114.58 119.87 2jpo h GLU 137 Ca 0.72 0.05 0.02 0.00 -0.50 0.00 0.00 59.36 59.65 2jpo h GLU 137 Cb 1.84 0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 29.88 2jpo h GLU 137 CO -0.49 -0.39 -0.16 -0.24 -1.40 0.00 0.00 179.01 176.33 2jpo h VAL 138 N -0.91 0.61 -0.90 3.13 3.04 -1.54 -2.15 116.25 117.53 2jpo h VAL 138 Ca -0.07 0.00 0.25 0.00 -1.01 0.00 0.00 66.70 65.86 2jpo h VAL 138 Cb 0.62 0.61 -0.14 0.00 -2.01 0.00 0.00 31.29 30.37 2jpo h VAL 138 CO 0.12 0.00 0.32 -0.07 -1.01 0.00 0.00 177.57 176.93 2jpo h LEU 139 N -0.27 0.15 -0.07 3.16 4.07 -1.33 0.16 115.31 121.18 2jpo h LEU 139 Ca 0.05 0.19 -0.01 0.00 0.08 0.00 0.00 57.88 58.19 2jpo h LEU 139 Cb 0.33 0.22 -0.00 0.00 1.08 0.00 0.00 40.66 42.29 2jpo h LEU 139 CO -0.14 -0.12 0.00 0.00 -1.08 0.00 0.00 178.44 177.10 2jpo h ALA 140 N 1.78 0.09 -0.20 1.53 0.00 -0.64 -3.34 119.26 118.47 2jpo h ALA 140 Ca 0.58 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 55.19 2jpo h ALA 140 Cb 1.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2jpo h ALA 140 CO -0.62 -0.24 -0.43 1.49 0.00 0.00 0.00 179.25 179.44 2jpo h GLU 141 N -0.15 0.65 0.00 0.00 4.57 -0.60 0.26 114.58 119.31 2jpo h GLU 141 Ca 0.02 -0.43 0.00 0.00 -1.18 0.00 0.00 59.36 57.77 2jpo h GLU 141 Cb 0.32 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 2jpo h GLU 141 CO 0.00 1.05 0.00 1.55 -1.18 0.00 0.00 179.01 180.43