#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jpf s GLN 2 N 0.00 0.89 -0.21 1.97 0.00 -1.26 -5.15 119.66 115.91 2jpf s GLN 2 Ca 0.00 -0.56 0.02 0.00 -0.00 0.00 0.00 55.36 54.81 2jpf s GLN 2 Cb 0.00 0.39 0.04 0.00 0.00 0.00 0.00 33.01 33.43 2jpf s GLN 2 CO 0.00 -0.31 -0.16 -1.14 0.00 0.00 0.00 175.29 173.68 2jpf s GLN 3 N -2.94 2.64 -0.16 9.60 0.74 -1.26 -5.09 119.66 123.19 2jpf s GLN 3 Ca -0.02 -0.99 -0.04 0.00 0.05 0.00 0.00 55.36 54.35 2jpf s GLN 3 Cb 0.00 -2.65 0.07 0.00 1.10 0.00 0.00 33.01 31.54 2jpf s GLN 3 CO -0.06 -0.35 0.17 -0.51 -0.55 0.00 0.00 175.29 173.99 2jpf s LEU 4 N 1.24 0.02 -0.19 3.68 1.43 -1.26 -5.13 118.68 118.47 2jpf s LEU 4 Ca -0.00 -0.19 -0.10 0.00 -1.03 0.00 0.00 54.13 52.81 2jpf s LEU 4 Cb -0.16 0.19 0.06 0.00 0.03 0.00 0.00 46.19 46.32 2jpf s LEU 4 CO -0.10 -0.31 0.45 0.00 0.23 0.00 0.00 176.35 176.62 2jpf s GLN 5 N 2.27 0.44 -0.25 1.70 -2.07 -1.26 -5.14 119.66 115.34 2jpf s GLN 5 Ca 0.05 0.87 -0.07 0.00 -1.82 0.00 0.00 55.36 54.39 2jpf s GLN 5 Cb -0.15 0.02 0.12 0.00 -1.09 0.00 0.00 33.01 31.91 2jpf s GLN 5 CO -0.10 -0.16 0.51 -1.83 -1.32 0.00 0.00 175.29 172.39 2jpf s GLU 6 N 1.49 0.43 0.18 9.60 -1.05 -1.26 -5.16 118.70 122.93 2jpf s GLU 6 Ca -0.09 1.10 -0.15 0.00 -0.15 0.00 0.00 54.97 55.68 2jpf s GLU 6 Cb -0.08 0.43 0.02 0.00 -0.44 0.00 0.00 34.13 34.05 2jpf s GLU 6 CO -0.14 -0.33 0.43 -3.38 0.95 0.00 0.00 175.26 172.80 2jpf s HIS 7 N 2.72 0.03 0.25 4.83 -3.43 -1.26 -5.16 115.29 113.28 2jpf s HIS 7 Ca 0.01 -0.38 -0.29 0.00 -0.80 0.00 0.00 55.06 53.60 2jpf s HIS 7 Cb -0.13 0.24 -0.09 0.00 -1.43 0.00 0.00 32.58 31.17 2jpf s HIS 7 CO -0.16 -0.83 0.94 0.00 -2.00 0.00 0.00 174.74 172.69 2jpf s ALA 8 N -3.89 3.32 0.12 -1.38 0.00 -1.26 -4.98 121.76 113.69 2jpf s ALA 8 Ca 0.11 0.60 -0.13 0.00 0.00 0.00 0.00 51.96 52.54 2jpf s ALA 8 Cb 0.01 -3.20 -0.07 0.00 0.00 0.00 0.00 23.12 19.86 2jpf s ALA 8 CO -0.03 0.21 1.45 -1.00 0.00 0.00 0.00 175.76 176.38 2jpf h PRO 9 N 3.99 0.83 -3.00 0.00 0.13 -2.07 -3.47 132.00 128.42 2jpf h PRO 9 Ca -0.45 -0.44 -0.05 0.00 -0.87 0.00 0.00 66.00 64.18 2jpf h PRO 9 Cb 1.20 0.02 -0.15 0.00 0.13 0.00 0.00 31.00 32.20 2jpf h PRO 9 CO 0.67 1.08 0.01 -1.12 -0.23 0.00 0.00 178.00 178.42 2jpf s SER 10 N -6.70 -0.38 0.31 1.44 0.01 -1.26 -5.18 113.70 101.94 2jpf s SER 10 Ca -0.12 0.00 0.04 0.00 1.31 0.00 0.00 55.95 57.19 2jpf s SER 10 Cb 0.10 0.49 -0.02 0.00 0.21 0.00 0.00 66.02 66.80 2jpf s SER 10 CO 0.86 -0.78 0.46 -1.38 0.41 0.00 0.00 173.24 172.81 2jpf s HIS 11 N -2.98 3.32 0.29 2.43 -3.43 -1.26 -5.13 115.29 108.54 2jpf s HIS 11 Ca -0.02 0.00 0.05 0.00 -0.80 0.00 0.00 55.06 54.29 2jpf s HIS 11 Cb -0.00 -1.84 -0.06 0.00 -1.43 0.00 0.00 32.58 29.25 2jpf s HIS 11 CO -0.06 0.15 0.00 0.00 -2.00 0.00 0.00 174.74 172.83 2jpf s ALA 12 N -2.16 2.29 0.22 -1.38 0.00 -1.26 -5.04 121.76 114.42 2jpf s ALA 12 Ca 0.40 -1.96 -0.07 0.00 0.00 0.00 0.00 51.96 50.33 2jpf s ALA 12 Cb -0.09 0.43 0.33 0.00 0.00 0.00 0.00 23.12 23.79 2jpf s ALA 12 CO 0.32 -0.20 1.77 -0.91 0.00 0.00 0.00 175.76 176.74 2jpf h ASN 13 N 2.23 0.41 -0.38 0.00 2.35 -2.00 -2.28 115.58 115.90 2jpf h ASN 13 Ca -0.40 0.07 0.08 0.00 -0.55 0.00 0.00 56.30 55.50 2jpf h ASN 13 Cb 1.24 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 39.52 2jpf h ASN 13 CO 0.68 0.23 -0.25 -0.07 -1.65 0.00 0.00 177.43 176.37 2jpf h LEU 14 N 0.56 -0.85 -8.96 1.61 -0.00 -2.00 -3.37 115.31 102.30 2jpf h LEU 14 Ca 0.35 0.17 -0.60 0.00 -0.00 0.00 0.00 57.88 57.79 2jpf h LEU 14 Cb 0.39 0.42 -0.10 0.00 -0.00 0.00 0.00 40.66 41.37 2jpf h LEU 14 CO -0.28 -0.27 0.36 -1.81 -0.00 0.00 0.00 178.44 176.43 2jpf s ASP 15 N -5.10 6.68 -0.05 -0.43 1.11 -0.86 -4.97 116.67 113.06 2jpf s ASP 15 Ca -0.15 0.76 0.01 0.00 0.18 0.00 0.00 52.55 53.36 2jpf s ASP 15 Cb 0.14 -2.40 0.02 0.00 1.07 0.00 0.00 42.92 41.75 2jpf s ASP 15 CO 0.69 -0.53 -0.06 0.68 1.18 0.00 0.00 175.17 177.12 2jpf s VAL 16 N 2.82 0.68 1.10 -1.27 -7.23 -1.26 -4.30 120.40 110.94 2jpf s VAL 16 Ca 0.31 -0.22 -0.16 0.00 -1.81 0.00 0.00 61.98 60.11 2jpf s VAL 16 Cb -0.15 -0.68 0.20 0.00 0.56 0.00 0.00 36.38 36.32 2jpf s VAL 16 CO 0.10 0.25 0.40 2.29 -0.31 0.00 0.00 175.10 177.83 2jpf n LYS 17 N 3.94 -2.66 -0.48 4.82 2.85 -1.26 -4.94 118.16 120.43 2jpf n LYS 17 Ca -0.25 -0.78 -0.30 0.00 -1.05 0.00 0.00 58.31 55.92 2jpf n LYS 17 Cb 0.51 -1.59 0.28 0.00 -0.65 0.00 0.00 35.03 33.59 2jpf n LYS 17 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 2jpf s TRP 18 N -2.10 -0.46 -2.00 5.58 0.51 -1.26 -4.84 118.94 114.36 2jpf s TRP 18 Ca 0.44 0.57 0.14 0.00 -2.12 0.00 0.00 56.10 55.12 2jpf s TRP 18 Cb -0.08 -2.99 0.81 0.00 -0.81 0.00 0.00 33.47 30.40 2jpf s TRP 18 CO 0.42 -4.83 1.31 1.28 -0.51 0.00 0.00 176.95 174.62 2jpf n LEU 19 N -5.51 0.00 -4.55 2.99 4.77 -1.26 -4.57 117.00 108.87 2jpf n LEU 19 Ca 0.13 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.69 2jpf n LEU 19 Cb 0.60 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.66 2jpf n LEU 19 CO 0.43 0.00 1.06 -0.62 -1.33 0.00 0.00 177.39 176.93 2jpf s ASP 20 N -1.73 6.29 0.00 -1.43 -1.08 -1.26 -4.27 116.67 113.19 2jpf s ASP 20 Ca 0.20 -0.27 0.00 0.00 -0.52 0.00 0.00 52.55 51.96 2jpf s ASP 20 Cb 0.09 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 39.02 2jpf s ASP 20 CO 0.16 -1.61 0.00 0.61 0.52 0.00 0.00 175.17 174.85 2jpf n GLY 21 N 5.23 0.00 3.87 2.66 0.00 -1.26 -4.91 105.19 110.77 2jpf n GLY 21 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2jpf n GLY 21 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jpf s LEU 22 N -0.60 2.36 0.26 0.99 0.20 -1.26 -5.03 118.68 115.59 2jpf s LEU 22 Ca 0.00 0.82 -0.11 0.00 0.69 0.00 0.00 54.13 55.52 2jpf s LEU 22 Cb 0.00 -3.24 -0.00 0.00 -0.43 0.00 0.00 46.19 42.51 2jpf s LEU 22 CO 0.00 -2.12 0.47 -0.13 -0.29 0.00 0.00 176.35 174.28 2jpf s ARG 23 N -5.50 1.58 -0.87 1.98 1.81 -1.26 -4.94 118.95 111.74 2jpf s ARG 23 Ca 0.63 -1.32 -0.06 0.00 -1.72 0.00 0.00 55.73 53.27 2jpf s ARG 23 Cb -0.12 0.46 0.01 0.00 -0.45 0.00 0.00 34.95 34.85 2jpf s ARG 23 CO 0.50 -0.66 0.73 0.00 -0.68 0.00 0.00 175.30 175.20 2jpf n ALA 24 N -0.40 -0.82 0.00 2.13 0.00 -1.26 -4.71 120.51 115.46 2jpf n ALA 24 Ca -0.01 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2jpf n ALA 24 Cb 0.62 -3.63 0.00 0.00 0.00 0.00 0.00 19.45 16.44 2jpf n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jpf n GLY 25 N -1.45 0.07 2.98 0.00 0.00 -1.26 -5.01 105.19 100.52 2jpf n GLY 25 Ca 0.00 -1.67 -0.20 0.00 0.00 0.00 0.00 46.02 44.14 2jpf n GLY 25 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jpf n SER 26 N 0.00 -4.71 -0.03 1.61 2.88 -1.26 -4.85 113.62 107.25 2jpf n SER 26 Ca 0.00 -0.20 -0.16 0.00 -1.33 0.00 0.00 58.87 57.18 2jpf n SER 26 Cb 0.00 -3.88 -0.14 0.00 -0.75 0.00 0.00 64.21 59.44 2jpf n SER 26 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 2jpf n MET 27 N -3.57 0.70 -0.03 -1.46 0.00 -1.26 -4.74 117.12 106.76 2jpf n MET 27 Ca -0.09 0.23 -0.03 0.00 0.00 0.00 0.00 57.70 57.81 2jpf n MET 27 Cb 0.59 -1.69 -0.01 0.00 0.00 0.00 0.00 33.22 32.12 2jpf n MET 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2jpf n ALA 28 N -2.88 0.26 -1.99 3.17 0.00 -1.26 -5.04 120.51 112.76 2jpf n ALA 28 Ca -0.30 -0.39 -0.24 0.00 0.00 0.00 0.00 53.44 52.51 2jpf n ALA 28 Cb 1.05 0.01 0.12 0.00 0.00 0.00 0.00 19.45 20.63 2jpf n ALA 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2jpf s LEU 29 N -5.92 2.94 -0.23 0.00 2.01 -1.26 -5.10 118.68 111.11 2jpf s LEU 29 Ca -0.09 -0.41 -0.01 0.00 0.01 0.00 0.00 54.13 53.63 2jpf s LEU 29 Cb 0.01 -1.86 0.07 0.00 0.01 0.00 0.00 46.19 44.42 2jpf s LEU 29 CO 0.13 -1.97 0.03 -1.10 1.01 0.00 0.00 176.35 174.44 2jpf s GLN 30 N -5.20 0.93 0.34 1.70 -0.21 -1.26 -4.56 119.66 111.39 2jpf s GLN 30 Ca 0.68 -0.73 0.11 0.00 0.02 0.00 0.00 55.36 55.43 2jpf s GLN 30 Cb -0.05 -2.22 0.60 0.00 1.00 0.00 0.00 33.01 32.34 2jpf s GLN 30 CO 0.45 -0.71 1.76 0.78 -2.12 0.00 0.00 175.29 175.45 2jpf h GLY 31 N 8.13 0.06 0.61 3.09 0.00 -1.95 -2.86 103.07 110.14 2jpf h GLY 31 Ca -0.16 -0.05 0.11 0.00 0.00 0.00 0.00 47.33 47.23 2jpf h GLY 31 CO 0.39 0.05 0.60 -0.55 0.00 0.00 0.00 176.54 177.02 2jpf h ASP 32 N 0.05 0.82 1.45 0.19 5.19 -1.92 0.17 116.42 122.37 2jpf h ASP 32 Ca 0.00 0.03 -0.06 0.00 -0.62 0.00 0.00 57.03 56.38 2jpf h ASP 32 Cb 0.76 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 40.13 2jpf h ASP 32 CO 0.06 0.46 -0.56 0.58 -3.12 0.00 0.00 179.24 176.65 2jpf h VAL 33 N 0.89 0.38 0.00 -1.35 2.07 -1.96 -2.85 116.25 113.44 2jpf h VAL 33 Ca 0.45 -1.58 -0.18 0.00 0.82 0.00 0.00 66.70 66.21 2jpf h VAL 33 Cb 0.48 2.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.30 2jpf h VAL 33 CO -0.21 0.22 -0.85 0.50 0.02 0.00 0.00 177.57 177.25 2jpf h LYS 34 N 0.00 0.00 0.00 1.57 3.64 -0.83 -3.22 116.57 117.73 2jpf h LYS 34 Ca -0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2jpf h LYS 34 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2jpf h LYS 34 CO 0.03 0.85 -0.85 -0.39 -2.27 0.00 0.00 179.45 176.81 2jpf h VAL 35 N 0.00 0.00 -0.86 2.00 -1.51 -0.82 -3.32 116.25 111.74 2jpf h VAL 35 Ca -0.01 -0.83 0.11 0.00 -1.23 0.00 0.00 66.70 64.73 2jpf h VAL 35 Cb 1.56 1.37 -0.13 0.00 -2.13 0.00 0.00 31.29 31.96 2jpf h VAL 35 CO 0.11 0.00 -0.48 -0.25 -1.23 0.00 0.00 177.57 175.72 2jpf h TRP 36 N 0.00 -1.47 0.22 5.19 2.91 -1.51 0.51 115.95 121.81 2jpf h TRP 36 Ca 0.00 0.11 -0.34 0.00 1.13 0.00 0.00 58.89 59.79 2jpf h TRP 36 Cb 0.92 0.76 0.03 0.00 -0.51 0.00 0.00 29.16 30.35 2jpf h TRP 36 CO 0.00 -0.40 -1.57 0.00 -1.03 0.00 0.00 178.44 175.43 2jpf h MET 37 N -0.08 0.47 -0.42 2.65 -0.00 -1.77 -3.27 114.93 112.50 2jpf h MET 37 Ca 0.22 -0.80 0.12 0.00 -0.00 0.00 0.00 59.70 59.24 2jpf h MET 37 Cb 0.52 0.30 -0.02 0.00 -0.00 0.00 0.00 31.60 32.40 2jpf h MET 37 CO -0.87 1.38 0.44 -0.56 -0.00 0.00 0.00 176.91 177.30 2jpf h GLN 38 N 0.10 0.00 0.24 -0.10 -0.00 -1.46 0.81 115.11 114.70 2jpf h GLN 38 Ca -0.29 0.00 -0.31 0.00 -0.00 0.00 0.00 58.65 58.04 2jpf h GLN 38 Cb 2.11 0.00 0.04 0.00 -0.00 0.00 0.00 27.48 29.63 2jpf h GLN 38 CO 0.23 0.00 -1.39 -0.97 -0.00 0.00 0.00 178.83 176.70 2jpf h ASN 39 N 0.00 0.79 1.68 0.06 -0.73 -0.07 -3.29 115.58 114.01 2jpf h ASN 39 Ca 0.20 -0.93 0.00 0.00 1.87 0.00 0.00 56.30 57.44 2jpf h ASN 39 Cb 1.08 -0.26 0.00 0.00 0.27 0.00 0.00 38.32 39.41 2jpf h ASN 39 CO -0.00 1.67 -0.14 -0.07 -0.37 0.00 0.00 177.43 178.52 2jpf h LEU 40 N 0.06 0.00 -0.89 0.34 3.38 -0.97 -3.31 115.31 113.93 2jpf h LEU 40 Ca -0.24 -0.01 0.13 0.00 0.09 0.00 0.00 57.88 57.84 2jpf h LEU 40 Cb 2.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.82 2jpf h LEU 40 CO 0.26 0.01 0.94 -0.08 0.09 0.00 0.00 178.44 179.65 2jpf h GLU 41 N 0.00 0.00 0.00 1.13 4.81 0.45 0.47 114.58 121.44 2jpf h GLU 41 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2jpf h GLU 41 Cb 0.91 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2jpf h GLU 41 CO 0.00 0.00 -0.05 0.22 -0.73 0.00 0.00 179.01 178.45 2jpf h ASP 42 N 0.00 0.00 0.15 1.04 3.58 -1.80 -3.35 116.42 116.04 2jpf h ASP 42 Ca 0.22 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.65 2jpf h ASP 42 Cb 2.10 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 43.14 2jpf h ASP 42 CO -0.00 0.46 -0.05 0.25 -2.88 0.00 0.00 179.24 177.02 2jpf h LEU 43 N -0.87 0.00 -1.09 2.28 5.85 -1.17 -2.79 115.31 117.51 2jpf h LEU 43 Ca 0.00 0.00 0.39 0.00 0.84 0.00 0.00 57.88 59.11 2jpf h LEU 43 Cb 0.05 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 40.93 2jpf h LEU 43 CO 0.00 0.05 0.62 -0.74 -0.34 0.00 0.00 178.44 178.03 2jpf h HIS 44 N 0.00 0.80 -0.99 1.25 -0.00 -0.31 0.66 115.15 116.56 2jpf h HIS 44 Ca -0.00 0.04 0.29 0.00 -0.00 0.00 0.00 60.37 60.69 2jpf h HIS 44 Cb 0.14 -0.20 -0.14 0.00 -0.00 0.00 0.00 27.41 27.21 2jpf h HIS 44 CO 0.00 -0.31 0.55 0.00 -0.00 0.00 0.00 177.93 178.17 2jpf h THR 45 N 0.14 0.38 0.00 6.26 1.03 -1.70 -3.27 112.91 115.74 2jpf h THR 45 Ca 0.80 -0.14 -0.07 0.00 -0.01 0.00 0.00 66.41 66.99 2jpf h THR 45 Cb 2.11 -0.05 -0.01 0.00 -1.07 0.00 0.00 68.15 69.12 2jpf h THR 45 CO -0.63 0.07 -0.94 -1.14 -0.01 0.00 0.00 175.52 172.88 2jpf n ARG 46 N -5.01 0.31 -3.19 0.00 3.00 0.19 -5.02 116.66 106.93 2jpf n ARG 46 Ca 0.29 0.13 0.01 0.00 -0.00 0.00 0.00 57.85 58.28 2jpf n ARG 46 Cb 0.88 -1.04 -0.02 0.00 0.00 0.00 0.00 32.46 32.29 2jpf n ARG 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 2jpf s ARG 47 N -2.45 0.52 -0.02 -0.14 6.06 0.11 -5.05 118.95 117.98 2jpf s ARG 47 Ca -0.18 0.53 -0.25 0.00 -2.50 0.00 0.00 55.73 53.33 2jpf s ARG 47 Cb 0.04 0.15 -0.20 0.00 0.06 0.00 0.00 34.95 35.00 2jpf s ARG 47 CO 0.25 -0.96 1.23 -1.00 -2.50 0.00 0.00 175.30 172.32 2jpf h PRO 48 N 8.04 -0.06 0.00 5.12 0.13 -1.72 -3.03 132.00 140.48 2jpf h PRO 48 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2jpf h PRO 48 Cb 1.17 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2jpf h PRO 48 CO 0.20 0.41 0.61 0.22 -0.23 0.00 0.00 178.00 179.21 2jpf h ASP 49 N -0.55 0.00 0.05 1.44 3.58 -1.95 0.28 116.42 119.27 2jpf h ASP 49 Ca -0.01 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.36 2jpf h ASP 49 Cb 0.49 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2jpf h ASP 49 CO 0.01 0.00 -0.41 -0.08 -2.88 0.00 0.00 179.24 175.88 2jpf h GLU 50 N 0.00 0.10 0.00 0.28 4.57 -1.93 -3.28 114.58 114.32 2jpf h GLU 50 Ca 0.00 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 2jpf h GLU 50 Cb 1.22 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 2jpf h GLU 50 CO 0.00 1.08 0.19 0.35 -1.18 0.00 0.00 179.01 179.45 2jpf h PHE 51 N -0.78 0.00 -0.66 0.92 3.04 -0.46 -2.69 116.94 116.30 2jpf h PHE 51 Ca -0.09 0.00 0.19 0.00 3.98 0.00 0.00 57.97 62.06 2jpf h PHE 51 Cb 1.25 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.73 2jpf h PHE 51 CO 0.23 0.00 1.13 0.25 -2.02 0.00 0.00 178.31 177.91 2jpf n THR 52 N -2.83 0.00 0.26 4.41 -2.24 -1.08 0.77 114.28 113.56 2jpf n THR 52 Ca -0.02 1.15 0.13 0.00 -2.27 0.00 0.00 64.05 63.04 2jpf n THR 52 Cb 0.24 -2.14 0.67 0.00 -2.10 0.00 0.00 70.33 67.00 2jpf n THR 52 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jpf h ALA 53 N 0.33 1.22 0.00 6.98 0.00 -1.76 1.06 119.26 127.09 2jpf h ALA 53 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2jpf h ALA 53 Cb 2.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.37 2jpf h ALA 53 CO -0.00 -0.22 -0.00 -0.09 0.00 0.00 0.00 179.25 178.93 2jpf h ARG 54 N 0.00 0.00 0.00 0.00 1.12 0.05 -3.38 114.38 112.18 2jpf h ARG 54 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 2jpf h ARG 54 Cb 0.51 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.47 2jpf h ARG 54 CO 0.00 0.00 0.00 1.37 -3.11 0.00 0.00 179.97 178.23 2jpf h LEU 55 N -0.04 0.00 -2.52 3.80 -0.00 -1.70 -2.85 115.31 112.00 2jpf h LEU 55 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.89 2jpf h LEU 55 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.66 2jpf h LEU 55 CO 0.00 0.00 0.10 -0.61 -0.00 0.00 0.00 178.44 177.93 2jpf h GLN 56 N 0.00 0.00 0.00 0.17 4.15 0.10 0.14 115.11 119.67 2jpf h GLN 56 Ca 0.00 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.34 2jpf h GLN 56 Cb 0.44 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.12 2jpf h GLN 56 CO 0.00 0.00 -0.65 1.96 -1.93 0.00 0.00 178.83 178.21 2jpf h GLN 57 N 0.00 0.00 0.25 1.69 1.08 -1.67 -3.36 115.11 113.10 2jpf h GLN 57 Ca 0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 2jpf h GLN 57 Cb 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 2jpf h GLN 57 CO -0.00 0.26 -0.12 0.77 -0.95 0.00 0.00 178.83 178.79 2jpf h SER 58 N 0.00 -0.28 -0.36 1.46 0.02 -0.89 -3.20 113.55 110.30 2jpf h SER 58 Ca -0.04 0.01 0.10 0.00 -0.84 0.00 0.00 61.79 61.03 2jpf h SER 58 Cb 1.27 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.87 2jpf h SER 58 CO 0.04 0.02 0.99 0.00 -1.14 0.00 0.00 176.83 176.74 2jpf h THR 59 N -0.78 0.02 -0.04 -2.27 1.03 -1.68 0.35 112.91 109.54 2jpf h THR 59 Ca -0.03 0.00 0.01 0.00 -0.01 0.00 0.00 66.41 66.38 2jpf h THR 59 Cb 0.25 0.09 -0.01 0.00 -1.07 0.00 0.00 68.15 67.41 2jpf h THR 59 CO 0.06 0.00 -0.03 -0.78 -0.01 0.00 0.00 175.52 174.76 2jpf h ASP 60 N 0.00 -0.08 -0.49 0.00 3.58 -1.69 0.58 116.42 118.32 2jpf h ASP 60 Ca 0.17 0.02 0.06 0.00 0.42 0.00 0.00 57.03 57.70 2jpf h ASP 60 Cb 2.14 0.04 -0.05 0.00 1.72 0.00 0.00 39.33 43.19 2jpf h ASP 60 CO -0.00 -0.04 0.21 0.00 -2.88 0.00 0.00 179.24 176.53 2jpf h ALA 61 N 1.01 0.62 0.00 -0.78 0.00 -0.45 0.24 119.26 119.89 2jpf h ALA 61 Ca 0.03 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2jpf h ALA 61 Cb 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2jpf h ALA 61 CO -0.06 -0.16 -0.53 1.25 0.00 0.00 0.00 179.25 179.75 2jpf h LEU 62 N 0.42 0.00 -0.15 0.00 5.85 -1.56 0.41 115.31 120.28 2jpf h LEU 62 Ca 0.23 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.81 2jpf h LEU 62 Cb 0.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2jpf h LEU 62 CO -0.20 0.53 -0.45 0.22 -0.34 0.00 0.00 178.44 178.20 2jpf h TYR 63 N 0.00 0.75 0.05 1.25 5.03 0.12 -2.81 116.97 121.36 2jpf h TYR 63 Ca -0.01 -0.30 -0.27 0.00 2.58 0.00 0.00 58.73 60.74 2jpf h TYR 63 Cb 1.02 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 39.15 2jpf h TYR 63 CO 0.00 1.07 -1.36 1.03 -1.32 0.00 0.00 178.16 177.57 2jpf h SER 64 N 0.22 0.15 0.26 -2.11 0.87 -0.55 -2.53 113.55 109.86 2jpf h SER 64 Ca -0.01 -0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 60.33 2jpf h SER 64 Cb 1.08 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.98 2jpf h SER 64 CO 0.10 1.17 -0.16 -0.74 -0.53 0.00 0.00 176.83 176.67 2jpf h HIS 65 N 0.03 -0.41 -0.03 2.24 -0.00 -0.24 0.69 115.15 117.44 2jpf h HIS 65 Ca -0.16 -0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.17 2jpf h HIS 65 Cb 1.92 0.15 0.00 0.00 -0.00 0.00 0.00 27.41 29.48 2jpf h HIS 65 CO 0.02 -0.25 -0.13 1.25 -0.00 0.00 0.00 177.93 178.83 2jpf h LEU 66 N -0.40 0.16 -1.50 0.26 5.85 -1.64 0.41 115.31 118.45 2jpf h LEU 66 Ca -0.03 -0.67 0.02 0.00 0.84 0.00 0.00 57.88 58.05 2jpf h LEU 66 Cb 0.33 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 2jpf h LEU 66 CO 0.03 0.80 0.36 -0.08 -0.34 0.00 0.00 178.44 179.21 2jpf h GLU 67 N -0.47 0.65 0.00 1.25 4.22 -1.46 1.13 114.58 119.90 2jpf h GLU 67 Ca -0.01 -0.04 -0.05 0.00 0.08 0.00 0.00 59.36 59.34 2jpf h GLU 67 Cb 0.80 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2jpf h GLU 67 CO 0.03 0.43 -0.39 0.00 -2.18 0.00 0.00 179.01 176.90 2jpf h ALA 68 N 1.68 0.06 0.43 2.92 0.00 0.39 -2.94 119.26 121.80 2jpf h ALA 68 Ca 0.21 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2jpf h ALA 68 Cb 0.02 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2jpf h ALA 68 CO -0.05 0.26 -0.21 0.37 0.00 0.00 0.00 179.25 179.62 2jpf h GLN 69 N -1.00 -0.55 0.00 0.00 -0.00 -0.12 -3.08 115.11 110.36 2jpf h GLN 69 Ca -0.08 0.04 -0.00 0.00 -0.00 0.00 0.00 58.65 58.60 2jpf h GLN 69 Cb 0.72 0.13 -0.00 0.00 0.00 0.00 0.00 27.48 28.33 2jpf h GLN 69 CO -0.05 -0.25 -0.01 2.35 0.00 0.00 0.00 178.83 180.87 2jpf h TRP 70 N -0.98 0.00 -0.91 3.99 -0.00 0.12 -2.72 115.95 115.45 2jpf h TRP 70 Ca -0.06 0.00 0.26 0.00 -0.00 0.00 0.00 58.89 59.09 2jpf h TRP 70 Cb 0.56 0.00 -0.15 0.00 -0.00 0.00 0.00 29.16 29.57 2jpf h TRP 70 CO 0.02 0.01 0.29 0.00 -0.00 0.00 0.00 178.44 178.76 2jpf h ALA 71 N 1.99 1.41 -1.25 2.65 0.00 -1.31 0.52 119.26 123.27 2jpf h ALA 71 Ca -0.00 0.23 0.37 0.00 0.00 0.00 0.00 54.91 55.51 2jpf h ALA 71 Cb 0.04 0.31 -0.09 0.00 0.00 0.00 0.00 17.79 18.05 2jpf h ALA 71 CO 0.00 -0.51 0.84 0.87 0.00 0.00 0.00 179.25 180.45 2jpf h LYS 72 N 0.21 0.16 -0.39 0.00 1.79 -1.63 -0.36 116.57 116.35 2jpf h LYS 72 Ca 0.60 -0.01 0.04 0.00 -2.18 0.00 0.00 60.65 59.10 2jpf h LYS 72 Cb 1.25 -0.04 -0.07 0.00 -1.58 0.00 0.00 32.23 31.79 2jpf h LYS 72 CO -0.67 0.10 -0.49 1.96 -1.08 0.00 0.00 179.45 179.27 2jpf h GLN 73 N 0.16 -0.32 0.00 3.15 1.08 -0.17 -3.42 115.11 115.59 2jpf h GLN 73 Ca 0.70 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.92 2jpf h GLN 73 Cb 2.25 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 29.75 2jpf h GLN 73 CO -0.25 -0.22 -0.13 0.72 -0.95 0.00 0.00 178.83 178.01 2jpf n HIS 74 N -5.05 -0.67 0.00 2.96 8.25 -0.50 -5.05 115.22 115.15 2jpf n HIS 74 Ca -0.03 0.12 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 2jpf n HIS 74 Cb 0.30 0.43 0.00 0.00 1.12 0.00 0.00 29.99 31.84 2jpf n HIS 74 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jpf n GLY 75 N 1.82 3.43 0.08 -1.41 0.00 -0.26 -4.88 105.19 103.97 2jpf n GLY 75 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2jpf n GLY 75 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jpf h THR 76 N 0.00 0.80 0.00 2.61 1.35 -1.97 -3.38 112.91 112.32 2jpf h THR 76 Ca 0.00 -1.84 -0.07 0.00 -0.55 0.00 0.00 66.41 63.95 2jpf h THR 76 Cb 0.00 1.74 -0.01 0.00 -1.73 0.00 0.00 68.15 68.15 2jpf h THR 76 CO 0.00 0.27 -0.35 1.55 -0.25 0.00 0.00 175.52 176.74 2jpf h PRO 77 N -1.00 0.00 -5.79 4.72 0.13 -1.97 -3.41 132.00 124.69 2jpf h PRO 77 Ca -0.17 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.61 2jpf h PRO 77 Cb 0.94 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.03 2jpf h PRO 77 CO -0.10 0.35 0.91 -1.25 -0.23 0.00 0.00 178.00 177.67 2jpf s PRO 78 N -3.85 2.58 0.06 1.56 0.04 -1.26 -4.42 135.00 129.70 2jpf s PRO 78 Ca -0.01 -0.05 -0.10 0.00 0.04 0.00 0.00 61.00 60.88 2jpf s PRO 78 Cb 0.12 -4.88 0.01 0.00 0.04 0.00 0.00 34.50 29.79 2jpf s PRO 78 CO 0.68 -3.20 0.21 0.99 0.04 0.00 0.00 177.00 175.73 2jpf s THR 79 N 9.78 0.11 0.66 1.26 2.01 -1.26 -4.91 115.64 123.29 2jpf s THR 79 Ca 0.69 -0.93 0.15 0.00 0.31 0.00 0.00 61.69 61.91 2jpf s THR 79 Cb -0.08 -1.04 0.16 0.00 0.01 0.00 0.00 72.50 71.55 2jpf s THR 79 CO 0.05 -0.52 1.45 0.00 -0.69 0.00 0.00 174.62 174.92 2jpf h ALA 80 N 3.20 1.75 0.19 7.40 0.00 -1.96 1.07 119.26 130.92 2jpf h ALA 80 Ca -0.33 -0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.27 2jpf h ALA 80 Cb 1.20 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.01 2jpf h ALA 80 CO 0.50 -0.73 -1.40 1.03 0.00 0.00 0.00 179.25 178.66 2jpf h SER 81 N 0.00 0.63 0.00 0.00 0.87 -1.94 -3.21 113.55 109.90 2jpf h SER 81 Ca 0.03 -0.69 -0.12 0.00 -1.23 0.00 0.00 61.79 59.77 2jpf h SER 81 Cb 1.42 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 63.16 2jpf h SER 81 CO -0.00 1.55 -0.98 0.47 -0.53 0.00 0.00 176.83 177.34 2jpf n ASP 82 N -3.62 1.85 -0.35 6.23 9.92 0.33 -4.30 116.55 126.61 2jpf n ASP 82 Ca -0.14 0.51 0.25 0.00 -0.53 0.00 0.00 54.79 54.89 2jpf n ASP 82 Cb 1.07 -0.90 0.50 0.00 -0.64 0.00 0.00 41.12 41.15 2jpf n ASP 82 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2jpf h VAL 83 N -1.00 0.33 -1.21 2.53 2.07 -0.44 2.83 116.25 121.36 2jpf h VAL 83 Ca -0.18 -0.11 0.35 0.00 0.82 0.00 0.00 66.70 67.57 2jpf h VAL 83 Cb 0.93 -0.02 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 2jpf h VAL 83 CO -0.11 0.06 0.82 1.62 0.02 0.00 0.00 177.57 179.98 2jpf h VAL 84 N 0.32 0.37 0.00 2.57 3.04 -1.71 -2.95 116.25 117.88 2jpf h VAL 84 Ca 0.71 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 66.35 2jpf h VAL 84 Cb 1.75 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 31.23 2jpf h VAL 84 CO -0.50 0.03 -0.22 0.61 -1.01 0.00 0.00 177.57 176.48 2jpf n GLY 85 N -1.63 -0.15 0.10 3.17 0.00 0.15 -4.57 105.19 102.27 2jpf n GLY 85 Ca 0.29 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.17 2jpf n GLY 85 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2jpf h MET 86 N 0.00 0.18 0.00 1.61 -1.53 0.49 -3.41 114.93 112.26 2jpf h MET 86 Ca 0.00 -0.14 0.00 0.00 -3.44 0.00 0.00 59.70 56.12 2jpf h MET 86 Cb 1.18 0.03 0.00 0.00 -0.55 0.00 0.00 31.60 32.25 2jpf h MET 86 CO 0.00 0.79 0.00 -0.35 0.14 0.00 0.00 176.91 177.49 2jpf n PRO 87 N -4.60 0.21 0.03 0.39 -0.04 -1.26 -4.91 135.00 124.82 2jpf n PRO 87 Ca -0.09 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.27 2jpf n PRO 87 Cb 0.41 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.79 2jpf n PRO 87 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2jpf h GLN 88 N 0.00 -0.16 -0.43 0.54 3.07 -1.95 -3.17 115.11 113.01 2jpf h GLN 88 Ca 0.00 0.01 0.13 0.00 0.09 0.00 0.00 58.65 58.88 2jpf h GLN 88 Cb 0.00 0.04 -0.02 0.00 0.08 0.00 0.00 27.48 27.58 2jpf h GLN 88 CO 0.00 0.31 0.98 0.11 0.09 0.00 0.00 178.83 180.32 2jpf h TRP 89 N -0.86 0.00 -0.92 0.06 0.09 -1.94 -0.24 115.95 112.13 2jpf h TRP 89 Ca -0.02 0.00 0.27 0.00 0.09 0.00 0.00 58.89 59.23 2jpf h TRP 89 Cb 0.55 0.00 -0.16 0.00 0.08 0.00 0.00 29.16 29.63 2jpf h TRP 89 CO 0.10 0.00 0.22 -0.56 0.09 0.00 0.00 178.44 178.29 2jpf h GLN 90 N 0.00 0.13 0.20 0.12 -0.00 -1.79 0.80 115.11 114.57 2jpf h GLN 90 Ca 0.21 -0.01 -0.34 0.00 -0.00 0.00 0.00 58.65 58.51 2jpf h GLN 90 Cb 2.17 -0.03 0.02 0.00 -0.00 0.00 0.00 27.48 29.64 2jpf h GLN 90 CO -0.00 0.08 -1.63 1.49 -0.00 0.00 0.00 178.83 178.77 2jpf h GLU 91 N 0.13 0.43 0.58 0.06 4.81 -1.28 -3.30 114.58 116.00 2jpf h GLU 91 Ca 0.60 -0.74 -0.03 0.00 -0.13 0.00 0.00 59.36 59.07 2jpf h GLU 91 Cb 1.29 0.27 0.01 0.00 0.63 0.00 0.00 28.75 30.95 2jpf h GLU 91 CO -0.74 1.34 -0.28 1.88 -0.73 0.00 0.00 179.01 180.48 2jpf h TYR 92 N 0.12 -0.72 -1.45 0.92 -1.99 -0.97 0.39 116.97 113.27 2jpf h TYR 92 Ca -0.30 -0.02 0.43 0.00 2.00 0.00 0.00 58.73 60.84 2jpf h TYR 92 Cb 2.12 0.24 -0.08 0.00 2.00 0.00 0.00 36.73 41.00 2jpf h TYR 92 CO 0.11 -0.45 1.01 0.00 -0.00 0.00 0.00 178.16 178.83 2jpf h THR 93 N -0.83 0.22 0.13 -2.88 1.03 0.29 0.33 112.91 111.21 2jpf h THR 93 Ca -0.08 -0.02 -0.22 0.00 -0.01 0.00 0.00 66.41 66.08 2jpf h THR 93 Cb 0.59 0.15 0.01 0.00 -1.07 0.00 0.00 68.15 67.83 2jpf h THR 93 CO 0.13 0.01 -1.03 0.00 -0.01 0.00 0.00 175.52 174.62 2jpf h ALA 94 N 1.36 0.01 -0.43 0.00 0.00 -1.57 -3.30 119.26 115.33 2jpf h ALA 94 Ca 0.75 -0.84 0.12 0.00 0.00 0.00 0.00 54.91 54.94 2jpf h ALA 94 Cb 2.73 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 20.75 2jpf h ALA 94 CO -0.15 0.54 0.92 0.52 0.00 0.00 0.00 179.25 181.08 2jpf h MET 95 N -0.37 0.00 0.13 0.00 2.07 0.38 0.90 114.93 118.05 2jpf h MET 95 Ca -0.20 0.00 -0.01 0.00 -2.07 0.00 0.00 59.70 57.42 2jpf h MET 95 Cb 1.67 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 31.40 2jpf h MET 95 CO 0.11 0.00 -0.06 -0.07 1.07 0.00 0.00 176.91 177.96 2jpf h LEU 96 N 0.00 -0.15 0.01 1.22 3.38 -1.60 -2.52 115.31 115.65 2jpf h LEU 96 Ca 0.20 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2jpf h LEU 96 Cb 2.04 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.82 2jpf h LEU 96 CO -0.00 0.45 -0.12 0.08 0.09 0.00 0.00 178.44 178.93 2jpf h ARG 97 N -0.94 0.01 0.28 1.13 0.11 -0.65 -0.14 114.38 114.18 2jpf h ARG 97 Ca -0.02 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 60.04 2jpf h ARG 97 Cb 0.48 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.56 2jpf h ARG 97 CO 0.03 1.01 -0.19 1.49 0.10 0.00 0.00 179.97 182.41 2jpf h GLU 98 N -0.97 -0.45 -0.71 0.08 4.81 0.42 -2.61 114.58 115.15 2jpf h GLU 98 Ca -0.03 0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2jpf h GLU 98 Cb 1.05 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 30.47 2jpf h GLU 98 CO -0.01 -0.30 0.13 -2.13 -0.73 0.00 0.00 179.01 175.97 2jpf n ARG 99 N -5.32 4.02 0.31 1.92 3.00 -0.95 -4.53 116.66 115.10 2jpf n ARG 99 Ca -0.09 -2.83 0.09 0.00 -0.00 0.00 0.00 57.85 55.02 2jpf n ARG 99 Cb 0.23 -2.17 0.49 0.00 0.00 0.00 0.00 32.46 31.00 2jpf n ARG 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 2jpf h PHE 100 N 3.02 0.00 0.00 -0.14 -0.00 -0.61 -0.25 116.94 118.97 2jpf h PHE 100 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.10 2jpf h PHE 100 Cb 2.03 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.98 2jpf h PHE 100 CO 1.10 0.00 0.39 0.00 -0.00 0.00 0.00 178.31 179.80 2jpf h ALA 101 N 0.86 1.32 -1.42 12.09 0.00 -1.82 -1.97 119.26 128.32 2jpf h ALA 101 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.50 2jpf h ALA 101 Cb 1.09 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 18.49 2jpf h ALA 101 CO 0.00 -0.32 -1.16 0.41 0.00 0.00 0.00 179.25 178.18 2jpf n GLY 102 N -1.27 2.47 3.56 0.00 0.00 -0.10 -5.07 105.19 104.77 2jpf n GLY 102 Ca -0.01 -1.42 -0.39 0.00 0.00 0.00 0.00 46.02 44.20 2jpf n GLY 102 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jpf s LEU 103 N -2.78 3.36 0.11 0.99 1.43 -0.74 -4.91 118.68 116.14 2jpf s LEU 103 Ca 0.33 0.70 -0.21 0.00 -1.03 0.00 0.00 54.13 53.92 2jpf s LEU 103 Cb 0.40 -2.79 0.05 0.00 0.03 0.00 0.00 46.19 43.89 2jpf s LEU 103 CO -0.02 -2.27 0.51 -1.81 0.23 0.00 0.00 176.35 172.99 2jpf s ASP 104 N 8.15 -0.42 -0.51 2.29 1.01 -1.26 -5.09 116.67 120.85 2jpf s ASP 104 Ca 0.75 -0.03 -0.27 0.00 0.71 0.00 0.00 52.55 53.71 2jpf s ASP 104 Cb -0.16 0.52 -0.03 0.00 1.01 0.00 0.00 42.92 44.26 2jpf s ASP 104 CO 0.25 -0.84 1.97 0.28 0.21 0.00 0.00 175.17 177.03 2jpf s THR 105 N -3.28 3.30 -1.20 -1.27 -1.32 -1.26 -5.09 115.64 105.52 2jpf s THR 105 Ca -0.01 0.23 0.00 0.00 -1.21 0.00 0.00 61.69 60.70 2jpf s THR 105 Cb 0.00 -3.65 0.00 0.00 -1.51 0.00 0.00 72.50 67.34 2jpf s THR 105 CO -0.08 -0.58 0.30 2.30 -2.21 0.00 0.00 174.62 174.35