#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 1.55 0.00 1.43 -0.02 -1.26 -4.93 135.00 131.77 2jpo n PRO 2 Ca 0.00 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2jpo n PRO 2 Cb 0.00 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.24 2jpo n PRO 2 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2jpo n GLU 3 N -0.16 0.00 -1.67 -0.52 4.07 -1.26 -4.96 120.64 116.14 2jpo n GLU 3 Ca 0.09 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 57.16 2jpo n GLU 3 Cb 0.41 0.00 0.08 0.00 -0.06 0.00 0.00 31.44 31.87 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 -1.90 1.44 -3.47 6.31 -5.35 -1.26 -5.09 119.36 110.04 2jpo n ILE 4 Ca 0.00 -2.75 -0.30 0.00 -0.27 0.00 0.00 62.75 59.43 2jpo n ILE 4 Cb 0.00 0.27 -0.04 0.00 -1.74 0.00 0.00 39.64 38.13 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 -2.53 3.65 -0.17 6.28 -1.94 -1.26 -4.76 119.30 118.57 2jpo s MET 5 Ca 0.37 0.01 -0.03 0.00 -1.71 0.00 0.00 55.69 54.33 2jpo s MET 5 Cb 0.37 -2.71 0.00 0.00 2.01 0.00 0.00 34.83 34.51 2jpo s MET 5 CO -0.07 0.31 0.15 1.63 -0.01 0.00 0.00 175.02 177.04 2jpo n LYS 6 N -0.51 -0.41 -3.95 2.03 5.02 -1.26 -4.89 118.16 114.20 2jpo n LYS 6 Ca -0.02 0.23 -0.31 0.00 -2.02 0.00 0.00 58.31 56.20 2jpo n LYS 6 Cb 0.53 -0.52 -0.15 0.00 -0.02 0.00 0.00 35.03 34.87 2jpo n LYS 6 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2jpo s ASN 7 N -1.67 4.55 -0.87 4.39 2.20 -1.26 -4.80 114.94 117.48 2jpo s ASN 7 Ca 0.03 -2.17 -0.10 0.00 -0.94 0.00 0.00 52.86 49.68 2jpo s ASN 7 Cb -0.00 -1.47 0.10 0.00 -2.00 0.00 0.00 41.25 37.87 2jpo s ASN 7 CO 0.22 -0.37 0.24 -0.11 -2.94 0.00 0.00 177.10 174.14 2jpo n LEU 8 N 4.21 -0.40 0.02 3.54 -0.00 -1.26 -4.67 117.00 118.44 2jpo n LEU 8 Ca 0.03 -0.59 0.00 0.00 -0.00 0.00 0.00 56.01 55.45 2jpo n LEU 8 Cb 0.41 -0.75 0.00 0.00 -0.00 0.00 0.00 43.42 43.07 2jpo n LEU 8 CO 0.21 0.07 0.00 -0.24 -0.00 0.00 0.00 177.39 177.44 2jpo n SER 9 N -0.81 0.24 -0.14 1.96 2.88 -1.26 -4.49 113.62 112.00 2jpo n SER 9 Ca 0.02 0.07 -0.10 0.00 -1.33 0.00 0.00 58.87 57.53 2jpo n SER 9 Cb 0.23 -0.05 -0.05 0.00 -0.75 0.00 0.00 64.21 63.59 2jpo n SER 9 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2jpo h ASN 10 N 0.00 -1.45 -0.02 -3.46 -0.00 -1.91 0.13 115.58 108.86 2jpo h ASN 10 Ca 0.00 0.22 0.01 0.00 -0.00 0.00 0.00 56.30 56.54 2jpo h ASN 10 Cb 0.00 0.64 -0.02 0.00 -0.00 0.00 0.00 38.32 38.94 2jpo h ASN 10 CO 0.00 -0.36 -0.06 -0.55 -0.00 0.00 0.00 177.43 176.46 2jpo h ASN 11 N -0.31 -0.16 0.22 6.14 7.08 -1.85 -0.11 115.58 126.59 2jpo h ASN 11 Ca 0.14 0.03 0.01 0.00 -3.08 0.00 0.00 56.30 53.40 2jpo h ASN 11 Cb 0.58 0.08 -0.02 0.00 -2.08 0.00 0.00 38.32 36.88 2jpo h ASN 11 CO -0.59 -0.08 -0.24 0.15 -2.08 0.00 0.00 177.43 174.58 2jpo h PHE 12 N -0.09 -0.64 -0.49 4.14 3.04 -1.49 -0.70 116.94 120.71 2jpo h PHE 12 Ca 0.03 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.93 2jpo h PHE 12 Cb 0.13 0.25 -0.02 0.00 2.56 0.00 0.00 35.95 38.87 2jpo h PHE 12 CO -0.14 -0.35 0.07 0.78 -2.02 0.00 0.00 178.31 176.65 2jpo h GLY 13 N -0.51 0.83 0.81 2.40 0.00 -0.73 -1.41 103.07 104.46 2jpo h GLY 13 Ca 0.00 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 2jpo h GLY 13 CO -0.07 0.47 -0.04 1.70 0.00 0.00 0.00 176.54 178.60 2jpo h LYS 14 N 0.74 -0.11 -0.61 4.80 3.64 -0.53 0.19 116.57 124.69 2jpo h LYS 14 Ca 0.16 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 2jpo h LYS 14 Cb 0.34 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 2jpo h LYS 14 CO 0.01 0.10 0.21 0.00 -2.27 0.00 0.00 179.45 177.50 2jpo h ALA 15 N 0.59 1.23 -0.60 5.00 0.00 -0.91 0.50 119.26 125.06 2jpo h ALA 15 Ca -0.01 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 2jpo h ALA 15 Cb 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2jpo h ALA 15 CO 0.02 0.55 0.06 1.98 0.00 0.00 0.00 179.25 181.86 2jpo h MET 16 N 0.88 1.02 -0.40 0.00 4.05 -1.01 -2.35 114.93 117.12 2jpo h MET 16 Ca 0.20 -0.29 -0.12 0.00 -0.28 0.00 0.00 59.70 59.21 2jpo h MET 16 Cb 0.22 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.90 2jpo h MET 16 CO -0.01 0.97 -0.22 0.22 0.23 0.00 0.00 176.91 178.10 2jpo h ASP 17 N 0.92 0.81 -0.54 1.39 3.58 0.14 0.43 116.42 123.14 2jpo h ASP 17 Ca 0.18 -0.29 0.02 0.00 0.42 0.00 0.00 57.03 57.36 2jpo h ASP 17 Cb 0.48 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.27 2jpo h ASP 17 CO 0.02 1.00 0.33 1.56 -2.88 0.00 0.00 179.24 179.27 2jpo h GLN 18 N 0.69 0.64 -0.49 0.28 4.20 -0.86 -0.48 115.11 119.10 2jpo h GLN 18 Ca 0.09 -0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.65 2jpo h GLN 18 Cb 0.74 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 2jpo h GLN 18 CO 0.06 0.42 -0.15 0.00 -0.67 0.00 0.00 178.83 178.49 2jpo n LYS 20 N -4.18 0.03 -0.03 0.00 4.81 0.14 -0.41 118.16 118.52 2jpo n LYS 20 Ca 0.00 0.42 -0.05 0.00 -0.87 0.00 0.00 58.31 57.81 2jpo n LYS 20 Cb 0.42 -1.59 -0.02 0.00 0.02 0.00 0.00 35.03 33.86 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 -1.66 1.57 0.14 3.14 -0.08 -0.24 -2.03 116.55 117.40 2jpo n ASP 21 Ca 0.01 0.25 0.05 0.00 -1.51 0.00 0.00 54.79 53.59 2jpo n ASP 21 Cb 0.08 -0.57 0.52 0.00 2.34 0.00 0.00 41.12 43.49 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 -0.58 0.23 0.00 -0.67 5.08 -0.77 -0.81 114.58 117.06 2jpo h GLU 22 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2jpo h GLU 22 Cb 0.58 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2jpo h GLU 22 CO 0.00 0.20 -1.21 1.28 -1.00 0.00 0.00 179.01 178.27 2jpo n LEU 23 N -4.46 0.55 -3.62 1.33 4.77 0.45 -5.01 117.00 111.02 2jpo n LEU 23 Ca -0.00 -0.02 -0.26 0.00 -0.03 0.00 0.00 56.01 55.70 2jpo n LEU 23 Cb 0.12 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.18 2jpo n LEU 23 CO 0.35 0.03 -0.06 -0.24 -1.33 0.00 0.00 177.39 176.14 2jpo n SER 24 N -2.07 -4.46 -4.74 -1.43 2.88 -0.31 -4.96 113.62 98.54 2jpo n SER 24 Ca 0.01 -0.92 -0.41 0.00 -1.33 0.00 0.00 58.87 56.22 2jpo n SER 24 Cb 0.47 -3.86 -0.03 0.00 -0.75 0.00 0.00 64.21 60.04 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 -6.33 4.46 0.71 2.46 1.43 -0.86 -4.96 118.68 115.59 2jpo s LEU 25 Ca 0.35 2.26 -0.11 0.00 -1.03 0.00 0.00 54.13 55.60 2jpo s LEU 25 Cb -0.10 -3.61 0.02 0.00 0.03 0.00 0.00 46.19 42.52 2jpo s LEU 25 CO 0.83 -0.36 1.07 -2.16 0.23 0.00 0.00 176.35 175.96 2jpo s PRO 26 N -0.40 2.78 0.55 1.29 0.04 -1.26 -4.83 135.00 133.17 2jpo s PRO 26 Ca 0.52 0.83 0.30 0.00 0.04 0.00 0.00 61.00 62.69 2jpo s PRO 26 Cb -0.33 -1.98 1.63 0.00 0.04 0.00 0.00 34.50 33.86 2jpo s PRO 26 CO 0.38 -1.18 2.14 0.22 0.04 0.00 0.00 177.00 178.60 2jpo h ASP 27 N -0.77 0.00 0.86 6.66 3.58 -1.97 0.45 116.42 125.22 2jpo h ASP 27 Ca -0.45 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 56.96 2jpo h ASP 27 Cb 1.23 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.28 2jpo h ASP 27 CO 0.58 0.07 -0.42 0.77 -2.88 0.00 0.00 179.24 177.37 2jpo h SER 28 N 0.00 -1.01 -0.57 2.28 4.64 -1.98 0.98 113.55 117.90 2jpo h SER 28 Ca -0.00 0.04 -0.07 0.00 -0.47 0.00 0.00 61.79 61.29 2jpo h SER 28 Cb 0.24 0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.57 2jpo h SER 28 CO 0.01 -0.71 0.10 0.58 -0.87 0.00 0.00 176.83 175.94 2jpo h VAL 29 N -1.16 1.25 -0.27 0.95 2.07 -1.68 0.14 116.25 117.54 2jpo h VAL 29 Ca -0.12 -0.97 -0.07 0.00 0.82 0.00 0.00 66.70 66.36 2jpo h VAL 29 Cb 0.90 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 2jpo h VAL 29 CO 0.19 0.35 -0.12 0.58 0.02 0.00 0.00 177.57 178.59 2jpo h VAL 30 N 0.84 1.30 -0.55 2.57 2.07 -0.96 0.19 116.25 121.70 2jpo h VAL 30 Ca 0.17 -1.20 -0.11 0.00 0.82 0.00 0.00 66.70 66.39 2jpo h VAL 30 Cb 0.41 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2jpo h VAL 30 CO 0.01 0.38 -0.08 0.00 0.02 0.00 0.00 177.57 177.90 2jpo h ALA 31 N 0.74 0.81 -0.81 1.67 0.00 -0.71 -0.21 119.26 120.76 2jpo h ALA 31 Ca 0.06 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 2jpo h ALA 31 Cb 0.63 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2jpo h ALA 31 CO 0.04 0.67 0.40 -0.44 0.00 0.00 0.00 179.25 179.92 2jpo h ASP 32 N 0.91 1.05 0.27 0.00 5.19 -0.57 0.38 116.42 123.66 2jpo h ASP 32 Ca 0.15 -0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.43 2jpo h ASP 32 Cb 0.64 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.87 2jpo h ASP 32 CO 0.04 0.88 -0.18 -0.07 -3.12 0.00 0.00 179.24 176.79 2jpo h LEU 33 N 1.14 -0.44 -1.46 1.55 -0.00 -0.33 -1.08 115.31 114.68 2jpo h LEU 33 Ca 0.28 0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 58.19 2jpo h LEU 33 Cb 0.10 0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.87 2jpo h LEU 33 CO -0.04 -0.28 0.31 1.88 -0.00 0.00 0.00 178.44 180.31 2jpo h TYR 34 N -0.44 0.65 -0.10 1.13 0.05 -0.79 -1.17 116.97 116.30 2jpo h TYR 34 Ca -0.03 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.72 2jpo h TYR 34 Cb 0.37 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.88 2jpo h TYR 34 CO -0.10 0.43 -0.12 -0.91 -1.05 0.00 0.00 178.16 176.42 2jpo h ASN 35 N 0.69 0.14 0.43 3.88 2.35 -0.43 -3.11 115.58 119.53 2jpo h ASN 35 Ca 0.18 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.89 2jpo h ASN 35 Cb -0.04 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.29 2jpo h ASN 35 CO -0.04 0.28 -0.09 0.15 -1.65 0.00 0.00 177.43 176.09 2jpo h PHE 36 N 0.15 0.00 -0.16 1.19 3.04 0.09 -2.27 116.94 118.98 2jpo h PHE 36 Ca 0.03 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.98 2jpo h PHE 36 Cb 0.31 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.82 2jpo h PHE 36 CO 0.00 0.09 0.00 0.91 -2.02 0.00 0.00 178.31 177.29 2jpo n TRP 37 N -3.47 0.19 0.00 0.41 7.02 -1.17 -4.46 117.44 115.95 2jpo n TRP 37 Ca -0.02 -0.13 0.00 0.00 -1.02 0.00 0.00 57.50 56.34 2jpo n TRP 37 Cb 0.23 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.12 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 1.04 0.00 0.00 -0.99 5.02 -0.85 -4.80 118.16 117.57 2jpo n LYS 38 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 2jpo n LYS 38 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.48 2jpo n LYS 38 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2jpo n ASP 39 N 0.00 0.00 -2.83 4.39 2.03 -1.26 -5.01 116.55 113.87 2jpo n ASP 39 Ca 0.00 0.05 0.02 0.00 0.52 0.00 0.00 54.79 55.37 2jpo n ASP 39 Cb 0.00 -0.06 0.00 0.00 -0.72 0.00 0.00 41.12 40.34 2jpo n ASP 39 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jpo s ASP 40 N -1.26 -0.49 0.30 1.67 2.15 -1.26 -5.09 116.67 112.69 2jpo s ASP 40 Ca 0.00 -0.25 0.10 0.00 0.43 0.00 0.00 52.55 52.83 2jpo s ASP 40 Cb 0.00 0.62 -0.06 0.00 -0.30 0.00 0.00 42.92 43.18 2jpo s ASP 40 CO 0.00 -0.05 -0.14 -0.47 -0.17 0.00 0.00 175.17 174.34 2jpo s TYR 41 N 1.95 2.27 -0.11 -5.34 6.14 -1.26 -5.07 117.35 115.92 2jpo s TYR 41 Ca 0.15 -0.45 -0.00 0.00 0.64 0.00 0.00 57.07 57.40 2jpo s TYR 41 Cb 0.02 -1.16 0.02 0.00 0.42 0.00 0.00 41.96 41.27 2jpo s TYR 41 CO -0.14 0.60 -0.08 0.08 0.64 0.00 0.00 175.55 176.65 2jpo s VAL 42 N -2.63 1.03 0.73 3.14 1.01 -1.26 -4.82 120.40 117.59 2jpo s VAL 42 Ca 0.31 -0.29 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 2jpo s VAL 42 Cb -0.01 -1.05 0.03 0.00 0.00 0.00 0.00 36.38 35.36 2jpo s VAL 42 CO 0.15 0.37 1.26 -0.04 0.00 0.00 0.00 175.10 176.83 2jpo s MET 43 N 1.70 2.09 0.00 2.72 -1.94 -1.26 -4.97 119.30 117.64 2jpo s MET 43 Ca 0.05 1.93 0.00 0.00 -1.71 0.00 0.00 55.69 55.96 2jpo s MET 43 Cb -0.13 -1.81 0.00 0.00 2.01 0.00 0.00 34.83 34.91 2jpo s MET 43 CO -0.08 -1.91 0.00 0.25 -0.01 0.00 0.00 175.02 173.26 2jpo n THR 44 N -2.58 0.00 -2.50 2.05 -2.24 -1.26 -5.09 114.28 102.65 2jpo n THR 44 Ca 0.15 -0.06 -0.24 0.00 -2.27 0.00 0.00 64.05 61.63 2jpo n THR 44 Cb 0.49 0.48 0.04 0.00 -2.10 0.00 0.00 70.33 69.24 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 -0.46 5.27 -0.04 3.42 2.15 -1.26 -5.04 116.67 120.72 2jpo s ASP 45 Ca 0.00 0.33 0.07 0.00 0.43 0.00 0.00 52.55 53.37 2jpo s ASP 45 Cb 0.00 -1.21 -0.24 0.00 -0.30 0.00 0.00 42.92 41.17 2jpo s ASP 45 CO 0.00 -1.21 0.69 0.08 -0.17 0.00 0.00 175.17 174.56 2jpo h ARG 46 N -0.14 0.08 -0.31 4.34 0.11 -1.98 -3.38 114.38 113.09 2jpo h ARG 46 Ca -0.44 -0.13 0.01 0.00 0.10 0.00 0.00 59.98 59.52 2jpo h ARG 46 Cb 1.29 0.05 -0.02 0.00 1.11 0.00 0.00 29.97 32.40 2jpo h ARG 46 CO 0.57 0.74 0.20 -0.07 0.10 0.00 0.00 179.97 181.51 2jpo h LEU 47 N 0.02 0.33 -0.35 0.08 3.38 -1.96 -0.82 115.31 115.99 2jpo h LEU 47 Ca -0.28 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 57.76 2jpo h LEU 47 Cb 2.00 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 42.58 2jpo h LEU 47 CO 0.09 0.23 -0.24 0.00 0.09 0.00 0.00 178.44 178.61 2jpo h ALA 48 N 1.81 -0.05 0.00 1.53 0.00 -1.89 0.41 119.26 121.08 2jpo h ALA 48 Ca 0.12 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2jpo h ALA 48 Cb -0.00 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2jpo h ALA 48 CO -0.03 -0.64 -0.21 0.78 0.00 0.00 0.00 179.25 179.16 2jpo h GLY 49 N -0.20 0.00 1.49 0.00 0.00 -1.37 -1.95 103.07 101.03 2jpo h GLY 49 Ca 0.17 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.33 2jpo h GLY 49 CO -0.47 0.00 -0.60 0.00 0.00 0.00 0.00 176.54 175.48 2jpo h ALA 51 N 0.95 -0.31 0.20 0.00 0.00 -0.25 -0.68 119.26 119.18 2jpo h ALA 51 Ca -0.00 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2jpo h ALA 51 Cb 1.15 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 19.18 2jpo h ALA 51 CO 0.11 -0.71 -0.40 0.82 0.00 0.00 0.00 179.25 179.07 2jpo h ILE 52 N -0.35 0.19 0.00 0.00 2.04 -1.24 -0.53 117.51 117.62 2jpo h ILE 52 Ca 0.02 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 2jpo h ILE 52 Cb 0.37 0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2jpo h ILE 52 CO -0.10 0.00 -0.13 -0.55 0.00 0.00 0.00 178.15 177.38 2jpo h ASN 53 N -0.69 0.00 -0.32 1.72 7.08 -1.05 -1.06 115.58 121.26 2jpo h ASN 53 Ca 0.01 0.00 -0.12 0.00 -3.08 0.00 0.00 56.30 53.11 2jpo h ASN 53 Cb 0.68 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.92 2jpo h ASN 53 CO -0.18 0.13 -0.26 0.00 -2.08 0.00 0.00 177.43 175.04 2jpo h LEU 55 N 0.51 0.11 -0.65 0.00 -0.00 0.13 -1.37 115.31 114.04 2jpo h LEU 55 Ca 0.06 -0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 2jpo h LEU 55 Cb 0.82 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 2jpo h LEU 55 CO 0.07 0.08 0.00 0.00 -0.00 0.00 0.00 178.44 178.58 2jpo h ALA 56 N 1.90 1.00 -0.12 1.53 0.00 -0.89 -0.69 119.26 121.99 2jpo h ALA 56 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2jpo h ALA 56 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2jpo h ALA 56 CO -0.01 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.49 2jpo n THR 57 N -2.85 0.14 -3.78 0.00 -2.24 -0.56 -4.37 114.28 100.62 2jpo n THR 57 Ca 0.03 -0.39 -0.28 0.00 -2.27 0.00 0.00 64.05 61.14 2jpo n THR 57 Cb 0.39 0.68 -0.12 0.00 -2.10 0.00 0.00 70.33 69.18 2jpo n THR 57 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2jpo s LYS 58 N -1.86 2.01 -0.01 -0.78 1.02 -0.27 -4.85 119.74 115.01 2jpo s LYS 58 Ca 0.35 -2.95 0.17 0.00 0.02 0.00 0.00 55.97 53.56 2jpo s LYS 58 Cb 0.20 -2.90 -0.19 0.00 -0.52 0.00 0.00 37.83 34.42 2jpo s LYS 58 CO 0.30 -1.29 0.63 1.28 -0.92 0.00 0.00 175.35 175.35 2jpo n LEU 59 N 2.33 0.62 0.13 3.17 7.99 -1.25 -3.51 117.00 126.47 2jpo n LEU 59 Ca 0.20 0.28 -0.22 0.00 -0.01 0.00 0.00 56.01 56.26 2jpo n LEU 59 Cb 0.38 0.16 -0.15 0.00 -0.11 0.00 0.00 43.42 43.69 2jpo n LEU 59 CO 0.23 0.23 -0.20 -2.24 -1.51 0.00 0.00 177.39 173.89 2jpo h ASP 60 N 0.00 0.69 0.73 -1.43 2.03 -1.85 -0.48 116.42 116.10 2jpo h ASP 60 Ca -0.23 -0.76 -0.04 0.00 -0.73 0.00 0.00 57.03 55.27 2jpo h ASP 60 Cb 1.70 -0.22 0.01 0.00 -0.83 0.00 0.00 39.33 39.99 2jpo h ASP 60 CO 0.04 1.60 -0.35 0.58 -1.03 0.00 0.00 179.24 180.08 2jpo h VAL 61 N 0.12 0.00 0.00 4.15 2.07 -1.95 -3.18 116.25 117.46 2jpo h VAL 61 Ca -0.23 -0.18 -0.06 0.00 0.82 0.00 0.00 66.70 67.06 2jpo h VAL 61 Cb 2.10 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 2jpo h VAL 61 CO 0.24 0.00 -0.27 1.62 0.02 0.00 0.00 177.57 179.19 2jpo h VAL 62 N -1.16 1.06 -2.50 2.57 3.04 -1.60 -3.35 116.25 114.32 2jpo h VAL 62 Ca -0.10 -0.95 -0.59 0.00 -1.01 0.00 0.00 66.70 64.04 2jpo h VAL 62 Cb 0.75 1.53 -0.39 0.00 -2.01 0.00 0.00 31.29 31.17 2jpo h VAL 62 CO 0.16 0.26 -0.90 -0.62 -1.01 0.00 0.00 177.57 175.46 2jpo s ASP 63 N -6.77 2.10 0.00 3.17 2.15 -0.19 -3.85 116.67 113.27 2jpo s ASP 63 Ca -0.03 -3.03 0.19 0.00 0.43 0.00 0.00 52.55 50.11 2jpo s ASP 63 Cb 0.14 -0.60 1.14 0.00 -0.30 0.00 0.00 42.92 43.31 2jpo s ASP 63 CO 0.69 -0.18 1.69 -0.81 -0.17 0.00 0.00 175.17 176.38 2jpo n PRO 64 N 2.92 0.93 0.06 4.34 -0.04 -1.20 -2.89 135.00 139.12 2jpo n PRO 64 Ca 0.26 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.85 2jpo n PRO 64 Cb 0.44 -1.32 0.41 0.00 -0.04 0.00 0.00 33.50 32.99 2jpo n PRO 64 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2jpo n ASP 65 N -0.82 0.57 0.00 3.54 8.00 -1.26 -4.96 116.55 121.62 2jpo n ASP 65 Ca 0.14 0.42 0.00 0.00 0.71 0.00 0.00 54.79 56.06 2jpo n ASP 65 Cb 0.07 -0.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.69 2jpo n ASP 65 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jpo n GLY 66 N 1.37 1.12 0.11 0.44 0.00 -1.14 -5.02 105.19 102.08 2jpo n GLY 66 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 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 1.95 -4.70 1.61 5.03 -1.26 -4.92 115.26 112.97 2jpo n ASN 67 Ca 0.00 0.34 -0.42 0.00 0.87 0.00 0.00 54.58 55.37 2jpo n ASN 67 Cb 0.00 -0.78 -0.03 0.00 -1.02 0.00 0.00 39.78 37.95 2jpo n ASN 67 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2jpo s LEU 68 N -7.74 4.36 0.17 3.41 2.96 -1.26 -4.17 118.68 116.41 2jpo s LEU 68 Ca -0.33 2.43 -0.03 0.00 -0.22 0.00 0.00 54.13 55.98 2jpo s LEU 68 Cb 0.09 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.18 2jpo s LEU 68 CO 0.46 -0.83 0.14 -1.00 -1.32 0.00 0.00 176.35 173.80 2jpo s HIS 69 N 2.21 0.91 0.40 5.38 3.76 -0.22 -4.74 115.29 122.97 2jpo s HIS 69 Ca 0.71 -1.21 -0.26 0.00 -0.15 0.00 0.00 55.06 54.14 2jpo s HIS 69 Cb -0.39 -0.42 -0.11 0.00 1.11 0.00 0.00 32.58 32.77 2jpo s HIS 69 CO 0.31 -0.63 1.23 -2.39 -0.85 0.00 0.00 174.74 172.41 2jpo n HIS 70 N -0.20 2.01 -0.94 1.40 1.44 -1.26 -1.37 115.22 116.29 2jpo n HIS 70 Ca -0.02 0.53 0.00 0.00 -2.01 0.00 0.00 57.72 56.22 2jpo n HIS 70 Cb 0.64 -2.36 0.00 0.00 0.12 0.00 0.00 29.99 28.39 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 0.87 0.00 2.55 -1.39 0.00 0.13 -4.89 105.19 102.46 2jpo n GLY 71 Ca 0.07 0.00 -0.17 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 -1.97 0.17 0.00 1.61 2.47 -0.47 -4.92 114.94 111.82 2jpo s ASN 72 Ca 0.00 -2.49 0.20 0.00 0.42 0.00 0.00 52.86 50.99 2jpo s ASN 72 Cb 0.00 0.58 0.10 0.00 -1.45 0.00 0.00 41.25 40.48 2jpo s ASN 72 CO 0.00 -0.12 1.09 0.00 -3.72 0.00 0.00 177.10 174.35 2jpo n ALA 73 N 2.89 2.79 0.03 1.71 0.00 -1.26 -1.06 120.51 125.60 2jpo n ALA 73 Ca 0.25 -0.64 -0.13 0.00 0.00 0.00 0.00 53.44 52.92 2jpo n ALA 73 Cb 0.51 -0.69 -0.09 0.00 0.00 0.00 0.00 19.45 19.18 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 3.36 -0.09 -0.75 0.00 1.57 -1.90 -0.50 116.57 118.25 2jpo h LYS 74 Ca 0.00 0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.92 2jpo h LYS 74 Cb 0.79 0.02 -0.09 0.00 0.08 0.00 0.00 32.23 33.03 2jpo h LYS 74 CO 0.00 0.33 0.33 0.22 -0.57 0.00 0.00 179.45 179.76 2jpo h ASP 75 N -0.55 0.34 0.40 0.86 1.82 -1.82 0.27 116.42 117.73 2jpo h ASP 75 Ca -0.01 0.10 -0.02 0.00 -0.39 0.00 0.00 57.03 56.71 2jpo h ASP 75 Cb 0.47 0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.54 2jpo h ASP 75 CO 0.02 0.15 -0.19 0.15 -1.61 0.00 0.00 179.24 177.75 2jpo h PHE 76 N 0.49 -0.49 -0.74 0.28 3.57 -1.70 -2.28 116.94 116.08 2jpo h PHE 76 Ca 0.41 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 62.00 2jpo h PHE 76 Cb 0.58 0.16 -0.08 0.00 2.79 0.00 0.00 35.95 39.40 2jpo h PHE 76 CO -0.15 -0.20 0.36 0.00 -2.23 0.00 0.00 178.31 176.10 2jpo h ALA 77 N -0.23 1.04 -0.40 2.41 0.00 -0.02 -1.59 119.26 120.46 2jpo h ALA 77 Ca -0.05 0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2jpo h ALA 77 Cb 0.51 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2jpo h ALA 77 CO 0.09 -0.07 0.16 0.52 0.00 0.00 0.00 179.25 179.95 2jpo h MET 78 N 0.59 0.32 0.00 0.00 2.86 -0.39 0.61 114.93 118.93 2jpo h MET 78 Ca 0.38 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 58.00 2jpo h MET 78 Cb 0.44 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.03 2jpo h MET 78 CO -0.30 0.21 0.00 1.63 1.06 0.00 0.00 176.91 179.52 2jpo n LYS 79 N -4.98 0.68 0.00 1.72 4.76 -0.69 -3.56 118.16 116.08 2jpo n LYS 79 Ca 0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 2jpo n LYS 79 Cb 0.13 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.82 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 -1.00 0.00 -0.18 2.13 8.25 0.04 -5.02 115.22 119.44 2jpo n HIS 80 Ca 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 2jpo n HIS 80 Cb 0.08 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.19 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 0.12 0.85 3.44 -1.41 0.00 -0.52 -4.98 105.19 102.69 2jpo n GLY 81 Ca 0.00 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.12 0.75 0.30 4.61 0.00 -0.22 -4.93 121.76 120.14 2jpo s ALA 82 Ca 0.00 -1.48 0.03 0.00 0.00 0.00 0.00 51.96 50.51 2jpo s ALA 82 Cb 0.00 1.21 -0.06 0.00 0.00 0.00 0.00 23.12 24.27 2jpo s ALA 82 CO 0.00 -0.76 0.08 -0.51 0.00 0.00 0.00 175.76 174.57 2jpo s ASP 83 N -3.20 1.85 0.65 0.00 1.01 -1.26 -4.26 116.67 111.47 2jpo s ASP 83 Ca 0.31 -1.39 0.33 0.00 0.71 0.00 0.00 52.55 52.52 2jpo s ASP 83 Cb 0.01 0.04 1.83 0.00 1.01 0.00 0.00 42.92 45.81 2jpo s ASP 83 CO 0.17 -0.67 2.06 -0.33 0.21 0.00 0.00 175.17 176.62 2jpo h GLU 84 N 2.23 0.00 0.00 8.23 4.39 -1.98 0.30 114.58 127.75 2jpo h GLU 84 Ca -0.39 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.31 2jpo h GLU 84 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 2jpo h GLU 84 CO 0.65 0.00 0.00 2.41 -1.16 0.00 0.00 179.01 180.91 2jpo n THR 85 N -3.14 0.00 -0.08 1.13 -1.04 -1.26 -3.75 114.28 106.14 2jpo n THR 85 Ca -0.01 0.15 0.17 0.00 -2.04 0.00 0.00 64.05 62.32 2jpo n THR 85 Cb 0.31 -0.39 0.58 0.00 -1.82 0.00 0.00 70.33 69.02 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 0.23 -0.09 -2.82 2.86 -1.77 0.13 114.93 113.47 2jpo h MET 86 Ca 0.00 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2jpo h MET 86 Cb 0.00 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 2jpo h MET 86 CO 0.00 0.15 -0.09 0.00 1.06 0.00 0.00 176.91 178.03 2jpo h ALA 87 N 1.70 0.13 -0.32 6.32 0.00 -0.69 -2.93 119.26 123.47 2jpo h ALA 87 Ca 0.30 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2jpo h ALA 87 Cb 0.86 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2jpo h ALA 87 CO -0.06 -0.03 0.16 0.37 0.00 0.00 0.00 179.25 179.68 2jpo h GLN 88 N -0.19 0.44 -0.14 0.00 5.75 -0.95 -1.79 115.11 118.22 2jpo h GLN 88 Ca 0.01 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.50 2jpo h GLN 88 Cb 0.61 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 2jpo h GLN 88 CO 0.02 0.34 -0.06 1.96 -2.65 0.00 0.00 178.83 178.45 2jpo h GLN 89 N 0.44 -0.04 -0.42 1.69 4.20 -0.72 -0.38 115.11 119.88 2jpo h GLN 89 Ca 0.11 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.72 2jpo h GLN 89 Cb 0.04 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 2jpo h GLN 89 CO -0.02 -0.03 -0.15 -0.07 -0.67 0.00 0.00 178.83 177.90 2jpo h LEU 90 N -0.04 0.79 -1.22 1.46 3.38 -1.30 -1.55 115.31 116.83 2jpo h LEU 90 Ca 0.08 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.84 2jpo h LEU 90 Cb 0.15 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 2jpo h LEU 90 CO -0.17 0.95 0.55 0.58 0.09 0.00 0.00 178.44 180.44 2jpo h VAL 91 N 0.71 1.09 0.00 1.22 2.07 -0.82 -1.01 116.25 119.50 2jpo h VAL 91 Ca 0.11 -0.33 -0.09 0.00 0.82 0.00 0.00 66.70 67.21 2jpo h VAL 91 Cb 0.65 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2jpo h VAL 91 CO 0.05 0.18 -0.42 -0.78 0.02 0.00 0.00 177.57 176.62 2jpo h ASP 92 N 0.97 0.00 0.01 0.57 3.58 -0.62 0.49 116.42 121.42 2jpo h ASP 92 Ca 0.35 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.78 2jpo h ASP 92 Cb 0.14 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.19 2jpo h ASP 92 CO -0.12 0.42 -0.06 0.40 -2.88 0.00 0.00 179.24 177.00 2jpo h ILE 93 N 0.00 1.68 -0.28 2.25 1.08 -0.86 -1.72 117.51 119.67 2jpo h ILE 93 Ca -0.00 -2.09 -0.04 0.00 -0.39 0.00 0.00 64.86 62.34 2jpo h ILE 93 Cb 1.25 3.09 -0.01 0.00 -3.07 0.00 0.00 36.82 38.08 2jpo h ILE 93 CO 0.05 0.55 0.01 -0.29 -0.69 0.00 0.00 178.15 177.78 2jpo h ILE 94 N -0.82 1.25 0.00 -0.67 6.09 -1.18 0.26 117.51 122.44 2jpo h ILE 94 Ca -0.01 -0.89 0.00 0.00 -1.37 0.00 0.00 64.86 62.59 2jpo h ILE 94 Cb 0.93 1.28 0.00 0.00 0.47 0.00 0.00 36.82 39.50 2jpo h ILE 94 CO 0.01 0.29 0.00 1.41 -3.07 0.00 0.00 178.15 176.79 2jpo n HIS 95 N -4.61 0.55 0.08 2.19 8.25 0.16 0.02 115.22 121.86 2jpo n HIS 95 Ca -0.03 0.26 -0.12 0.00 -0.26 0.00 0.00 57.72 57.57 2jpo n HIS 95 Cb 0.24 -0.91 -0.13 0.00 1.12 0.00 0.00 29.99 30.31 2jpo n HIS 95 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2jpo h GLY 96 N 0.85 0.17 0.30 -1.41 0.00 -0.01 -3.32 103.07 99.65 2jpo h GLY 96 Ca 0.00 -0.42 -0.35 0.00 0.00 0.00 0.00 47.33 46.55 2jpo h GLY 96 CO 0.00 0.37 -2.20 0.00 0.00 0.00 0.00 176.54 174.71 2jpo n GLU 98 N -2.99 0.05 0.00 0.00 -0.58 0.10 -0.30 120.64 116.92 2jpo n GLU 98 Ca -0.31 0.30 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 2jpo n GLU 98 Cb 1.09 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.46 2jpo n GLU 98 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2jpo n LYS 99 N -1.39 -0.31 0.00 3.49 4.01 -1.25 -4.75 118.16 117.97 2jpo n LYS 99 Ca 0.02 -0.48 0.00 0.00 -0.51 0.00 0.00 58.31 57.35 2jpo n LYS 99 Cb 0.07 -0.85 0.00 0.00 -0.51 0.00 0.00 35.03 33.73 2jpo n LYS 99 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2jpo n SER 100 N -0.05 0.52 -4.63 4.39 2.88 -0.26 -5.08 113.62 111.39 2jpo n SER 100 Ca 0.00 -1.13 -0.41 0.00 -1.33 0.00 0.00 58.87 56.00 2jpo n SER 100 Cb 0.11 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.58 2jpo n SER 100 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jpo n ALA 101 N -0.07 0.42 -1.30 -1.46 0.00 0.59 -5.00 120.51 113.69 2jpo n ALA 101 Ca 0.00 0.21 -0.32 0.00 0.00 0.00 0.00 53.44 53.33 2jpo n ALA 101 Cb 0.24 -2.12 0.08 0.00 0.00 0.00 0.00 19.45 17.65 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 -2.14 2.28 -0.97 0.00 0.04 -1.26 -4.91 135.00 128.05 2jpo s PRO 102 Ca 0.64 1.40 -0.24 0.00 0.04 0.00 0.00 61.00 62.84 2jpo s PRO 102 Cb -0.53 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.10 2jpo s PRO 102 CO 0.56 -1.65 1.82 -1.25 0.04 0.00 0.00 177.00 176.52 2jpo s PRO 103 N -4.39 2.84 -0.40 0.56 0.04 -1.26 -4.69 135.00 127.70 2jpo s PRO 103 Ca 0.66 -0.62 0.09 0.00 0.04 0.00 0.00 61.00 61.17 2jpo s PRO 103 Cb -0.21 -5.16 0.29 0.00 0.04 0.00 0.00 34.50 29.45 2jpo s PRO 103 CO 0.49 -3.13 0.61 0.27 0.04 0.00 0.00 177.00 175.28 2jpo n ASN 104 N 12.65 0.68 -4.61 6.66 6.94 -1.26 -5.07 115.26 131.25 2jpo n ASN 104 Ca 0.39 -2.86 -0.43 0.00 -0.02 0.00 0.00 54.58 51.66 2jpo n ASN 104 Cb 0.48 -0.63 -0.03 0.00 -2.36 0.00 0.00 39.78 37.23 2jpo n ASN 104 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2jpo n ASP 105 N 0.95 3.38 -3.50 0.53 2.03 -1.26 -3.25 116.55 115.43 2jpo n ASP 105 Ca 0.23 0.34 0.01 0.00 0.52 0.00 0.00 54.79 55.89 2jpo n ASP 105 Cb 0.57 -1.54 -0.05 0.00 -0.72 0.00 0.00 41.12 39.37 2jpo n ASP 105 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jpo s ASP 106 N 7.57 -0.32 0.42 1.67 -1.08 -1.26 -4.96 116.67 118.71 2jpo s ASP 106 Ca 0.99 0.47 0.09 0.00 -0.52 0.00 0.00 52.55 53.59 2jpo s ASP 106 Cb -0.38 1.24 0.93 0.00 -1.46 0.00 0.00 42.92 43.25 2jpo s ASP 106 CO 0.37 -0.07 2.05 0.07 0.52 0.00 0.00 175.17 178.11 2jpo h LYS 107 N 6.35 0.47 0.16 4.34 2.10 -1.99 -0.74 116.57 127.25 2jpo h LYS 107 Ca -0.22 -0.03 -0.36 0.00 -2.00 0.00 0.00 60.65 58.05 2jpo h LYS 107 Cb 1.15 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 32.37 2jpo h LYS 107 CO 0.15 0.31 -1.86 0.00 -2.00 0.00 0.00 179.45 176.05 2jpo h MET 109 N 0.09 0.02 -0.86 0.00 2.86 -1.56 -2.64 114.93 112.84 2jpo h MET 109 Ca -0.38 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.30 2jpo h MET 109 Cb 2.07 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 33.68 2jpo h MET 109 CO 0.14 0.39 0.56 -0.22 1.06 0.00 0.00 176.91 178.84 2jpo h LYS 110 N -0.35 0.99 -0.89 1.72 3.64 -1.15 -0.22 116.57 120.31 2jpo h LYS 110 Ca 0.00 -0.06 0.06 0.00 -1.27 0.00 0.00 60.65 59.38 2jpo h LYS 110 Cb 0.38 -0.22 -0.06 0.00 -0.41 0.00 0.00 32.23 31.91 2jpo h LYS 110 CO 0.00 0.66 0.56 1.15 -2.27 0.00 0.00 179.45 179.55 2jpo h THR 111 N 1.02 1.06 -0.30 1.00 2.02 -1.62 -1.60 112.91 114.50 2jpo h THR 111 Ca 0.35 -0.35 -0.12 0.00 0.77 0.00 0.00 66.41 67.05 2jpo h THR 111 Cb 0.10 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.45 2jpo h THR 111 CO -0.11 0.19 -0.30 0.40 0.37 0.00 0.00 175.52 176.07 2jpo h ILE 112 N 1.03 1.30 0.12 3.11 2.04 -0.73 -0.29 117.51 124.09 2jpo h ILE 112 Ca 0.38 -1.46 0.02 0.00 1.00 0.00 0.00 64.86 64.80 2jpo h ILE 112 Cb 0.15 1.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.73 2jpo h ILE 112 CO -0.17 0.47 -0.43 -2.24 0.00 0.00 0.00 178.15 175.79 2jpo h ASP 113 N 0.49 -1.26 -0.61 1.72 3.04 -0.68 -0.56 116.42 118.57 2jpo h ASP 113 Ca 0.05 0.14 -0.06 0.00 -3.24 0.00 0.00 57.03 53.92 2jpo h ASP 113 Cb 0.87 0.47 -0.02 0.00 -1.04 0.00 0.00 39.33 39.60 2jpo h ASP 113 CO 0.07 -0.49 0.15 0.58 -2.04 0.00 0.00 179.24 177.51 2jpo h VAL 114 N -0.66 1.25 -0.68 4.15 2.07 -1.36 -1.52 116.25 119.50 2jpo h VAL 114 Ca 0.02 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.55 2jpo h VAL 114 Cb 0.69 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 2jpo h VAL 114 CO -0.24 0.34 0.13 0.00 0.02 0.00 0.00 177.57 177.82 2jpo h ALA 115 N 1.04 0.94 -0.15 1.67 0.00 -0.60 0.35 119.26 122.51 2jpo h ALA 115 Ca 0.19 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 2jpo h ALA 115 Cb 0.35 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.89 2jpo h ALA 115 CO 0.00 0.67 -0.66 0.00 0.00 0.00 0.00 179.25 179.26 2jpo h MET 116 N 1.05 0.72 -0.30 0.00 -0.00 -0.94 -3.13 114.93 112.32 2jpo h MET 116 Ca 0.21 -0.57 0.07 0.00 -0.00 0.00 0.00 59.70 59.41 2jpo h MET 116 Cb 0.42 0.11 -0.07 0.00 -0.00 0.00 0.00 31.60 32.06 2jpo h MET 116 CO 0.01 1.18 -0.16 0.00 -0.00 0.00 0.00 176.91 177.94 2jpo h PHE 118 N -0.12 -1.44 -0.74 0.00 3.04 -0.99 -1.09 116.94 115.59 2jpo h PHE 118 Ca 0.16 0.10 -0.03 0.00 3.98 0.00 0.00 57.97 62.17 2jpo h PHE 118 Cb 0.36 0.73 -0.03 0.00 2.56 0.00 0.00 35.95 39.57 2jpo h PHE 118 CO -0.36 -0.42 0.35 -0.22 -2.02 0.00 0.00 178.31 175.65 2jpo h LYS 119 N -0.17 1.06 -0.69 1.11 1.63 -1.06 -1.14 116.57 117.30 2jpo h LYS 119 Ca 0.19 -0.15 0.06 0.00 -0.85 0.00 0.00 60.65 59.90 2jpo h LYS 119 Cb 0.54 -0.19 -0.06 0.00 -0.60 0.00 0.00 32.23 31.92 2jpo h LYS 119 CO -0.78 0.82 0.39 0.87 -3.45 0.00 0.00 179.45 177.30 2jpo h LYS 120 N 1.05 0.71 0.00 1.90 1.79 -0.22 -1.85 116.57 119.94 2jpo h LYS 120 Ca 0.26 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.68 2jpo h LYS 120 Cb 0.11 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 2jpo h LYS 120 CO -0.03 0.47 0.00 0.39 -1.08 0.00 0.00 179.45 179.19 2jpo n GLU 121 N -4.76 0.03 0.11 3.15 -0.58 -0.53 -1.94 120.64 116.12 2jpo n GLU 121 Ca 0.09 0.16 -0.01 0.00 -0.42 0.00 0.00 57.16 56.97 2jpo n GLU 121 Cb 0.17 -1.55 0.23 0.00 -0.57 0.00 0.00 31.44 29.73 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 0.00 1.32 0.00 -3.67 2.04 -0.38 -2.12 117.51 114.70 2jpo h ILE 122 Ca 0.00 -1.56 0.00 0.00 1.00 0.00 0.00 64.86 64.30 2jpo h ILE 122 Cb 0.39 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 2jpo h ILE 122 CO 0.00 0.46 0.00 1.41 0.00 0.00 0.00 178.15 180.02 2jpo n HIS 123 N -4.01 0.00 0.09 1.37 8.25 -0.82 -1.24 115.22 118.86 2jpo n HIS 123 Ca -0.02 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.46 2jpo n HIS 123 Cb 0.49 -0.08 0.01 0.00 1.12 0.00 0.00 29.99 31.53 2jpo n HIS 123 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 2jpo n LYS 124 N -1.08 -0.42 0.10 -0.41 -0.00 -0.81 -4.64 118.16 110.90 2jpo n LYS 124 Ca 0.05 -0.71 -0.01 0.00 -0.00 0.00 0.00 58.31 57.64 2jpo n LYS 124 Cb 0.03 -1.05 0.27 0.00 -0.00 0.00 0.00 35.03 34.29 2jpo n LYS 124 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2jpo h LEU 125 N 0.47 0.24 0.10 -5.58 3.38 -0.99 -3.47 115.31 109.46 2jpo h LEU 125 Ca 0.00 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 2jpo h LEU 125 Cb 0.13 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2jpo h LEU 125 CO 0.00 0.57 -0.04 0.59 0.09 0.00 0.00 178.44 179.65 2jpo n ASN 126 N -4.09 -3.89 -3.43 -0.43 5.03 -1.25 -5.00 115.26 102.19 2jpo n ASN 126 Ca -0.01 0.05 -0.19 0.00 0.87 0.00 0.00 54.58 55.30 2jpo n ASN 126 Cb 0.42 -1.57 -0.08 0.00 -1.02 0.00 0.00 39.78 37.53 2jpo n ASN 126 CO 0.00 0.00 0.00 -1.66 -1.83 0.00 0.00 177.26 173.77 2jpo s TRP 127 N -1.86 1.68 -0.19 3.10 1.48 -1.26 -5.15 118.94 116.74 2jpo s TRP 127 Ca 0.00 -1.63 0.01 0.00 -1.06 0.00 0.00 56.10 53.42 2jpo s TRP 127 Cb 0.00 -0.68 0.04 0.00 -1.16 0.00 0.00 33.47 31.67 2jpo s TRP 127 CO 0.00 -0.86 -0.12 0.08 -4.06 0.00 0.00 176.95 171.99 2jpo s VAL 128 N -3.50 1.69 0.76 -0.66 1.01 -1.26 -4.82 120.40 113.61 2jpo s VAL 128 Ca 0.40 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 61.32 2jpo s VAL 128 Cb 0.03 -1.71 0.05 0.00 0.00 0.00 0.00 36.38 34.75 2jpo s VAL 128 CO 0.26 0.25 1.08 -2.16 0.00 0.00 0.00 175.10 174.53 2jpo s PRO 129 N 1.39 2.41 0.63 2.72 0.04 -1.26 -5.04 135.00 135.90 2jpo s PRO 129 Ca 0.00 0.92 -0.18 0.00 0.04 0.00 0.00 61.00 61.79 2jpo s PRO 129 Cb -0.15 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 2jpo s PRO 129 CO -0.09 -1.47 0.97 0.09 0.04 0.00 0.00 177.00 176.55 2jpo n ASN 130 N -3.37 0.74 0.24 6.66 3.02 -1.26 -4.87 115.26 116.42 2jpo n ASN 130 Ca 0.08 0.77 0.07 0.00 -0.03 0.00 0.00 54.58 55.47 2jpo n ASN 130 Cb 0.54 -1.40 0.60 0.00 -0.61 0.00 0.00 39.78 38.91 2jpo n ASN 130 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jpo h MET 131 N 0.30 0.02 0.22 3.52 -0.00 -1.96 -2.17 114.93 114.85 2jpo h MET 131 Ca -0.49 -0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.22 2jpo h MET 131 Cb 1.36 -0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.94 2jpo h MET 131 CO 0.50 0.06 -0.24 -0.44 -0.00 0.00 0.00 176.91 176.79 2jpo h ASP 132 N 0.02 -0.64 -0.33 -0.10 5.19 -1.95 -2.55 116.42 116.06 2jpo h ASP 132 Ca 0.00 0.06 0.07 0.00 -0.62 0.00 0.00 57.03 56.54 2jpo h ASP 132 Cb 0.08 0.22 -0.07 0.00 0.18 0.00 0.00 39.33 39.75 2jpo h ASP 132 CO 0.01 -0.34 -0.12 -0.07 -3.12 0.00 0.00 179.24 175.60 2jpo h LEU 133 N -0.50 -0.41 -0.45 1.55 4.07 -1.76 0.74 115.31 118.56 2jpo h LEU 133 Ca 0.00 0.11 0.02 0.00 0.08 0.00 0.00 57.88 58.09 2jpo h LEU 133 Cb 0.47 0.25 -0.03 0.00 1.08 0.00 0.00 40.66 42.43 2jpo h LEU 133 CO -0.07 -0.15 0.27 0.58 -1.08 0.00 0.00 178.44 178.00 2jpo h VAL 134 N -0.05 1.06 0.43 1.22 2.07 -1.33 -2.09 116.25 117.56 2jpo h VAL 134 Ca 0.16 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 2jpo h VAL 134 Cb 0.30 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2jpo h VAL 134 CO -0.37 0.10 -0.21 0.40 0.02 0.00 0.00 177.57 177.52 2jpo h ILE 135 N 0.55 0.00 -1.38 4.57 2.04 -1.18 -3.24 117.51 118.86 2jpo h ILE 135 Ca 0.17 -0.43 0.42 0.00 1.00 0.00 0.00 64.86 66.03 2jpo h ILE 135 Cb -0.01 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 35.97 2jpo h ILE 135 CO -0.07 0.00 0.94 1.23 0.00 0.00 0.00 178.15 180.25 2jpo h GLY 136 N -1.00 0.76 0.97 5.37 0.00 -0.80 -0.40 103.07 107.96 2jpo h GLY 136 Ca -0.06 -0.08 -0.22 0.00 0.00 0.00 0.00 47.33 46.97 2jpo h GLY 136 CO 0.10 -0.19 -0.90 -2.09 0.00 0.00 0.00 176.54 173.45 2jpo h GLU 137 N 0.10 0.51 -0.61 4.80 4.57 -1.47 -2.94 114.58 119.54 2jpo h GLU 137 Ca 0.76 -0.62 0.04 0.00 -1.18 0.00 0.00 59.36 58.35 2jpo h GLU 137 Cb 2.59 0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 31.33 2jpo h GLU 137 CO -0.23 1.25 0.36 -0.24 -1.18 0.00 0.00 179.01 178.97 2jpo h VAL 138 N 0.05 1.04 0.00 0.32 3.04 -1.12 -2.18 116.25 117.40 2jpo h VAL 138 Ca -0.13 -0.24 0.00 0.00 -1.01 0.00 0.00 66.70 65.32 2jpo h VAL 138 Cb 1.61 0.27 0.00 0.00 -2.01 0.00 0.00 31.29 31.17 2jpo h VAL 138 CO 0.17 0.13 0.00 -0.07 -1.01 0.00 0.00 177.57 176.79 2jpo h LEU 139 N 0.70 0.00 0.08 3.16 3.38 -1.40 -1.71 115.31 119.52 2jpo h LEU 139 Ca 0.26 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.88 2jpo h LEU 139 Cb 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2jpo h LEU 139 CO -0.12 0.00 -1.93 0.00 0.09 0.00 0.00 178.44 176.48 2jpo n ALA 140 N -1.89 0.94 0.27 1.53 0.00 -0.85 -4.36 120.51 116.14 2jpo n ALA 140 Ca -0.00 -0.65 -0.15 0.00 0.00 0.00 0.00 53.44 52.64 2jpo n ALA 140 Cb 0.15 -0.56 -0.08 0.00 0.00 0.00 0.00 19.45 18.96 2jpo n ALA 140 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2jpo h GLU 141 N -0.20 -0.65 0.00 0.00 4.39 -1.24 0.37 114.58 117.26 2jpo h GLU 141 Ca -0.44 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.30 2jpo h GLU 141 Cb 1.86 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.65 2jpo h GLU 141 CO -0.01 -0.36 0.00 0.28 -1.16 0.00 0.00 179.01 177.76