#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jnf n GLY 2 N 0.00 0.00 3.56 -5.12 0.00 -1.26 -4.54 105.19 97.83 2jnf n GLY 2 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2jnf n GLY 2 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jnf s ASP 3 N 0.00 6.58 0.57 1.61 1.11 -1.25 -4.72 116.67 120.57 2jnf s ASP 3 Ca 0.00 -1.68 0.37 0.00 0.18 0.00 0.00 52.55 51.42 2jnf s ASP 3 Cb 0.00 -2.56 1.83 0.00 1.07 0.00 0.00 42.92 43.26 2jnf s ASP 3 CO 0.00 -1.41 2.13 -0.37 1.18 0.00 0.00 175.17 176.69 2jnf h VAL 4 N 6.50 0.00 -0.00 -1.27 -1.51 -1.87 -1.39 116.25 116.71 2jnf h VAL 4 Ca 0.24 -0.22 0.00 0.00 -1.23 0.00 0.00 66.70 65.49 2jnf h VAL 4 Cb 0.98 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.31 2jnf h VAL 4 CO 1.41 0.00 -0.55 -1.54 -1.23 0.00 0.00 177.57 175.67 2jnf n SER 5 N -2.98 0.78 -0.04 4.19 3.41 -1.26 -4.06 113.62 113.66 2jnf n SER 5 Ca -0.01 -0.58 -0.17 0.00 -0.26 0.00 0.00 58.87 57.85 2jnf n SER 5 Cb 0.17 0.38 -0.14 0.00 -0.26 0.00 0.00 64.21 64.37 2jnf n SER 5 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2jnf n LYS 6 N -1.26 0.71 -2.08 4.33 0.00 -0.55 -4.70 118.16 114.61 2jnf n LYS 6 Ca 0.07 0.22 -0.40 0.00 0.00 0.00 0.00 58.31 58.20 2jnf n LYS 6 Cb 0.34 -1.67 -0.03 0.00 0.00 0.00 0.00 35.03 33.68 2jnf n LYS 6 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2jnf s LEU 7 N -6.62 3.35 -1.34 3.14 1.43 -1.04 -4.88 118.68 112.72 2jnf s LEU 7 Ca -0.21 0.54 -0.08 0.00 -1.03 0.00 0.00 54.13 53.35 2jnf s LEU 7 Cb 0.07 -2.81 0.12 0.00 0.03 0.00 0.00 46.19 43.60 2jnf s LEU 7 CO 0.75 -2.15 2.21 -0.24 0.23 0.00 0.00 176.35 177.15 2jnf n SER 8 N 11.82 6.62 0.00 2.29 2.88 -1.26 -4.67 113.62 131.30 2jnf n SER 8 Ca 0.20 -3.06 0.00 0.00 -1.33 0.00 0.00 58.87 54.68 2jnf n SER 8 Cb 0.51 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.52 2jnf n SER 8 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2jnf n SER 9 N 3.04 0.00 -0.00 -3.46 7.64 -1.26 -4.69 113.62 114.88 2jnf n SER 9 Ca 0.54 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 60.31 2jnf n SER 9 Cb 0.30 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.46 2jnf n SER 9 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2jnf h ASN 10 N 0.00 -0.05 0.08 6.43 -1.07 -1.98 0.49 115.58 119.48 2jnf h ASN 10 Ca 0.00 0.02 -0.24 0.00 0.07 0.00 0.00 56.30 56.15 2jnf h ASN 10 Cb 0.00 0.04 0.01 0.00 -2.07 0.00 0.00 38.32 36.31 2jnf h ASN 10 CO 0.00 -0.01 -0.95 1.56 0.07 0.00 0.00 177.43 178.10 2jnf h GLN 11 N 0.03 0.63 -0.02 4.14 1.08 -1.88 -3.23 115.11 115.87 2jnf h GLN 11 Ca 0.05 -0.63 -0.03 0.00 -1.45 0.00 0.00 58.65 56.59 2jnf h GLN 11 Cb 0.06 0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.66 2jnf h GLN 11 CO -0.09 1.24 -0.14 0.28 -0.95 0.00 0.00 178.83 179.16 2jnf h VAL 12 N 0.37 1.11 -0.04 -0.54 2.07 -1.77 -1.77 116.25 115.68 2jnf h VAL 12 Ca -0.10 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 66.92 2jnf h VAL 12 Cb 1.59 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 32.59 2jnf h VAL 12 CO 0.18 0.16 -0.16 0.50 0.02 0.00 0.00 177.57 178.26 2jnf h LYS 13 N 0.03 -0.24 -0.60 1.57 1.63 -0.04 0.33 116.57 119.24 2jnf h LYS 13 Ca 0.00 0.02 -0.05 0.00 -0.85 0.00 0.00 60.65 59.77 2jnf h LYS 13 Cb 0.27 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.93 2jnf h LYS 13 CO 0.02 -0.16 0.18 -0.07 -3.45 0.00 0.00 179.45 175.97 2jnf h LEU 14 N -0.25 0.85 0.27 5.20 -0.00 -1.49 0.41 115.31 120.30 2jnf h LEU 14 Ca 0.07 -0.14 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 2jnf h LEU 14 Cb 0.34 -0.22 -0.04 0.00 -0.00 0.00 0.00 40.66 40.74 2jnf h LEU 14 CO -0.19 0.80 -0.50 -0.07 -0.00 0.00 0.00 178.44 178.49 2jnf h LEU 15 N 0.88 -1.44 -1.11 1.67 4.07 -0.78 -0.75 115.31 117.87 2jnf h LEU 15 Ca 0.20 0.14 0.04 0.00 0.08 0.00 0.00 57.88 58.34 2jnf h LEU 15 Cb 0.27 0.51 -0.06 0.00 1.08 0.00 0.00 40.66 42.46 2jnf h LEU 15 CO -0.01 -0.59 0.61 -0.08 -1.08 0.00 0.00 178.44 177.29 2jnf h GLU 16 N -0.83 1.10 -0.39 1.13 4.57 -0.05 0.44 114.58 120.54 2jnf h GLU 16 Ca -0.02 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2jnf h GLU 16 Cb 0.79 -0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 2jnf h GLU 16 CO -0.19 0.73 0.26 1.15 -1.18 0.00 0.00 179.01 179.78 2jnf h THR 17 N 1.13 1.10 0.00 0.32 2.02 -0.55 -1.44 112.91 115.50 2jnf h THR 17 Ca 0.38 -0.19 -0.20 0.00 0.77 0.00 0.00 66.41 67.16 2jnf h THR 17 Cb 0.06 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 2jnf h THR 17 CO -0.12 0.10 -0.97 0.00 0.37 0.00 0.00 175.52 174.90 2jnf h ALA 18 N 1.14 0.38 0.36 6.16 0.00 -0.61 -3.04 119.26 123.65 2jnf h ALA 18 Ca 0.14 -0.88 -0.00 0.00 0.00 0.00 0.00 54.91 54.17 2jnf h ALA 18 Cb -0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2jnf h ALA 18 CO -0.03 1.21 -0.32 0.35 0.00 0.00 0.00 179.25 180.46 2jnf h PHE 19 N 0.00 -0.85 0.00 0.00 3.04 0.20 -2.66 116.94 116.66 2jnf h PHE 19 Ca -0.01 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.94 2jnf h PHE 19 Cb 1.74 0.33 -0.00 0.00 2.56 0.00 0.00 35.95 40.58 2jnf h PHE 19 CO 0.00 -0.46 -0.00 0.00 -2.02 0.00 0.00 178.31 175.83 2jnf h ARG 20 N -0.70 0.00 -0.12 1.11 2.47 -1.36 -0.97 114.38 114.82 2jnf h ARG 20 Ca -0.03 0.00 -0.17 0.00 -1.26 0.00 0.00 59.98 58.52 2jnf h ARG 20 Cb 0.62 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.93 2jnf h ARG 20 CO -0.03 0.00 -0.64 0.22 0.56 0.00 0.00 179.97 180.08 2jnf h ASP 21 N 0.00 0.50 -0.14 7.04 3.58 -1.36 -3.18 116.42 122.86 2jnf h ASP 21 Ca -0.00 -0.30 0.00 0.00 0.42 0.00 0.00 57.03 57.15 2jnf h ASP 21 Cb 0.59 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.49 2jnf h ASP 21 CO 0.00 1.01 0.00 0.49 -2.88 0.00 0.00 179.24 177.86 2jnf n PHE 22 N -3.89 0.40 -2.41 0.28 3.72 -1.06 -5.05 117.46 109.44 2jnf n PHE 22 Ca -0.04 -0.80 -0.33 0.00 -0.05 0.00 0.00 57.45 56.23 2jnf n PHE 22 Cb 0.65 -0.17 -0.03 0.00 -0.94 0.00 0.00 39.48 38.99 2jnf n PHE 22 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 2jnf s GLU 23 N -2.28 3.75 0.03 -1.08 2.12 -0.39 -4.35 118.70 116.51 2jnf s GLU 23 Ca 0.29 1.20 0.00 0.00 0.36 0.00 0.00 54.97 56.82 2jnf s GLU 23 Cb 0.23 -2.10 0.00 0.00 0.26 0.00 0.00 34.13 32.53 2jnf s GLU 23 CO 0.06 -0.45 0.00 2.41 -0.54 0.00 0.00 175.26 176.74 2jnf n THR 24 N -1.34 -1.29 -0.08 -1.70 -1.04 0.81 -4.90 114.28 104.73 2jnf n THR 24 Ca 0.08 0.16 -0.14 0.00 -2.04 0.00 0.00 64.05 62.11 2jnf n THR 24 Cb 0.53 -0.81 -0.08 0.00 -1.82 0.00 0.00 70.33 68.14 2jnf n THR 24 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2jnf h PRO 25 N 0.16 0.00 0.00 -2.82 0.13 -1.93 -3.43 132.00 124.11 2jnf h PRO 25 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2jnf h PRO 25 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2jnf h PRO 25 CO 0.00 0.67 0.00 -1.91 -0.23 0.00 0.00 178.00 176.53 2jnf n GLU 26 N -4.54 0.20 0.00 0.86 2.13 -1.26 -4.99 120.64 113.03 2jnf n GLU 26 Ca -0.19 -0.53 0.00 0.00 0.66 0.00 0.00 57.16 57.10 2jnf n GLU 26 Cb 0.48 -0.76 0.00 0.00 0.27 0.00 0.00 31.44 31.42 2jnf n GLU 26 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jnf n GLY 27 N -0.09 0.66 0.17 8.31 0.00 -1.26 -5.06 105.19 107.91 2jnf n GLY 27 Ca 0.00 -0.73 0.06 0.00 0.00 0.00 0.00 46.02 45.34 2jnf n GLY 27 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jnf n SER 28 N 0.00 1.04 0.00 1.61 2.88 -1.26 -4.96 113.62 112.93 2jnf n SER 28 Ca 0.00 -1.02 0.00 0.00 -1.33 0.00 0.00 58.87 56.52 2jnf n SER 28 Cb 0.00 0.68 0.00 0.00 -0.75 0.00 0.00 64.21 64.14 2jnf n SER 28 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jnf n GLY 29 N 1.10 0.68 3.44 0.46 0.00 -1.26 -4.96 105.19 104.64 2jnf n GLY 29 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 2jnf n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jnf s ARG 30 N -0.32 1.58 -0.16 1.61 0.52 -1.26 -4.67 118.95 116.25 2jnf s ARG 30 Ca 0.00 -1.79 -0.06 0.00 -0.52 0.00 0.00 55.73 53.36 2jnf s ARG 30 Cb 0.00 -1.27 -0.04 0.00 0.52 0.00 0.00 34.95 34.16 2jnf s ARG 30 CO 0.00 0.08 0.04 0.54 0.02 0.00 0.00 175.30 175.98 2jnf s VAL 31 N -2.92 4.59 0.38 3.52 0.11 -0.53 -0.13 120.40 125.42 2jnf s VAL 31 Ca 0.29 -0.11 -0.28 0.00 -2.93 0.00 0.00 61.98 58.96 2jnf s VAL 31 Cb 0.03 -3.04 -0.11 0.00 -1.53 0.00 0.00 36.38 31.72 2jnf s VAL 31 CO 0.12 0.49 1.47 -0.24 -3.33 0.00 0.00 175.10 173.61 2jnf n SER 32 N 3.33 3.67 0.32 3.54 2.88 -1.26 -0.38 113.62 125.72 2jnf n SER 32 Ca -0.17 1.22 0.21 0.00 -1.33 0.00 0.00 58.87 58.80 2jnf n SER 32 Cb 0.52 -1.61 1.07 0.00 -0.75 0.00 0.00 64.21 63.45 2jnf n SER 32 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 2jnf h THR 33 N 2.87 0.00 0.00 2.46 1.35 -0.99 0.44 112.91 119.04 2jnf h THR 33 Ca -0.50 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 2jnf h THR 33 Cb 1.25 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 2jnf h THR 33 CO 0.64 0.00 0.00 -0.78 -0.25 0.00 0.00 175.52 175.13 2jnf h ASP 34 N 0.00 0.00 0.27 5.36 3.58 -1.90 -3.13 116.42 120.61 2jnf h ASP 34 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jnf h ASP 34 Cb 0.13 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.18 2jnf h ASP 34 CO 0.00 0.00 -1.31 0.00 -2.88 0.00 0.00 179.24 175.05 2jnf n GLN 35 N -2.84 0.37 -0.31 0.28 1.13 0.13 -4.41 117.38 111.73 2jnf n GLN 35 Ca 0.03 -0.05 0.01 0.00 -1.94 0.00 0.00 57.00 55.05 2jnf n GLN 35 Cb 0.41 -1.57 0.14 0.00 0.11 0.00 0.00 30.24 29.33 2jnf n GLN 35 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 2jnf h ILE 36 N 0.00 1.03 -0.62 5.09 2.04 -1.45 0.03 117.51 123.63 2jnf h ILE 36 Ca 0.00 -0.33 -0.06 0.00 1.00 0.00 0.00 64.86 65.47 2jnf h ILE 36 Cb 0.79 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 2jnf h ILE 36 CO 0.00 0.17 0.14 1.23 0.00 0.00 0.00 178.15 179.69 2jnf h GLY 37 N 0.95 1.05 0.93 5.37 0.00 -1.77 0.34 103.07 109.94 2jnf h GLY 37 Ca 0.37 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 2jnf h GLY 37 CO -0.18 0.60 -0.09 -2.22 0.00 0.00 0.00 176.54 174.64 2jnf h ILE 38 N 0.93 0.84 -0.75 2.60 2.04 -1.47 -1.33 117.51 120.36 2jnf h ILE 38 Ca 0.20 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.92 2jnf h ILE 38 Cb 0.35 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.32 2jnf h ILE 38 CO 0.00 0.04 0.49 0.40 0.00 0.00 0.00 178.15 179.08 2jnf h ILE 39 N -0.34 1.18 0.00 -0.67 2.04 -0.77 0.33 117.51 119.28 2jnf h ILE 39 Ca -0.03 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 2jnf h ILE 39 Cb 0.26 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.43 2jnf h ILE 39 CO 0.04 0.18 -0.06 -0.07 0.00 0.00 0.00 178.15 178.25 2jnf h LEU 40 N 1.00 0.00 0.12 1.44 4.07 -0.16 0.23 115.31 122.00 2jnf h LEU 40 Ca 0.28 0.00 -0.22 0.00 0.08 0.00 0.00 57.88 58.01 2jnf h LEU 40 Cb -0.10 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.67 2jnf h LEU 40 CO -0.07 0.06 -0.95 -0.08 -1.08 0.00 0.00 178.44 176.32 2jnf h GLU 41 N 0.00 0.44 -0.61 1.13 4.57 -0.10 0.12 114.58 120.12 2jnf h GLU 41 Ca -0.00 -0.63 0.10 0.00 -1.18 0.00 0.00 59.36 57.66 2jnf h GLU 41 Cb 0.32 0.21 -0.08 0.00 -0.16 0.00 0.00 28.75 29.05 2jnf h GLU 41 CO 0.01 1.27 0.20 0.28 -1.18 0.00 0.00 179.01 179.58 2jnf h VAL 42 N -0.09 0.72 -0.00 0.32 2.07 0.69 -1.46 116.25 118.50 2jnf h VAL 42 Ca -0.15 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2jnf h VAL 42 Cb 1.70 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2jnf h VAL 42 CO 0.18 0.07 -0.18 0.18 0.02 0.00 0.00 177.57 177.83 2jnf n LEU 43 N -5.04 0.48 -2.46 2.57 4.77 0.64 -4.94 117.00 113.01 2jnf n LEU 43 Ca 0.09 0.05 -0.14 0.00 -0.03 0.00 0.00 56.01 55.98 2jnf n LEU 43 Cb 0.30 -0.23 0.05 0.00 -2.33 0.00 0.00 43.42 41.20 2jnf n LEU 43 CO 0.20 0.09 0.13 0.61 -1.33 0.00 0.00 177.39 177.09 2jnf n GLY 44 N 1.36 -0.01 0.66 -0.72 0.00 -0.55 -4.97 105.19 100.96 2jnf n GLY 44 Ca 0.11 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2jnf n GLY 44 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2jnf n ILE 45 N -3.71 0.00 -2.07 -0.61 -5.35 0.33 -5.02 119.36 102.93 2jnf n ILE 45 Ca -0.05 0.01 -0.13 0.00 -0.27 0.00 0.00 62.75 62.30 2jnf n ILE 45 Cb 0.56 -0.85 0.08 0.00 -1.74 0.00 0.00 39.64 37.69 2jnf n ILE 45 CO 0.00 0.00 0.00 1.67 -1.76 0.00 0.00 176.55 176.46 2jnf n GLN 46 N -2.01 -0.10 -1.47 6.28 -0.06 -1.19 -5.03 117.38 113.79 2jnf n GLN 46 Ca 0.00 -1.28 -0.01 0.00 -2.00 0.00 0.00 57.00 53.71 2jnf n GLN 46 Cb 0.00 -0.48 0.00 0.00 -4.06 0.00 0.00 30.24 25.70 2jnf n GLN 46 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2jnf n GLN 47 N -2.15 1.32 -0.32 3.69 6.02 -1.26 -4.58 117.38 120.10 2jnf n GLN 47 Ca 0.09 -0.18 -0.30 0.00 -0.01 0.00 0.00 57.00 56.59 2jnf n GLN 47 Cb 0.30 0.01 0.29 0.00 1.02 0.00 0.00 30.24 31.86 2jnf n GLN 47 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2jnf s THR 48 N 0.13 1.27 0.42 5.09 -1.32 -1.26 -4.45 115.64 115.52 2jnf s THR 48 Ca 0.02 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 60.64 2jnf s THR 48 Cb -0.00 -2.02 0.34 0.00 -1.51 0.00 0.00 72.50 69.30 2jnf s THR 48 CO 0.01 0.00 1.93 0.11 -2.21 0.00 0.00 174.62 174.47 2jnf h LYS 49 N -3.42 0.46 -0.92 7.08 1.57 -1.97 0.58 116.57 119.95 2jnf h LYS 49 Ca -0.46 -0.03 0.14 0.00 -1.87 0.00 0.00 60.65 58.43 2jnf h LYS 49 Cb 1.34 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.48 2jnf h LYS 49 CO 0.31 0.30 0.59 0.77 -0.57 0.00 0.00 179.45 180.85 2jnf h SER 50 N 0.47 0.71 0.62 0.86 0.02 -2.01 0.86 113.55 115.07 2jnf h SER 50 Ca 0.35 0.04 -0.28 0.00 -0.84 0.00 0.00 61.79 61.07 2jnf h SER 50 Cb 0.70 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 2jnf h SER 50 CO -0.12 0.35 -1.33 0.74 -1.14 0.00 0.00 176.83 175.34 2jnf h THR 51 N 0.74 1.38 0.00 -2.27 2.02 -1.21 -3.33 112.91 110.25 2jnf h THR 51 Ca 0.46 -3.01 -0.03 0.00 0.77 0.00 0.00 66.41 64.61 2jnf h THR 51 Cb 0.70 2.84 -0.00 0.00 -1.74 0.00 0.00 68.15 69.94 2jnf h THR 51 CO -0.23 0.86 -0.12 0.40 0.37 0.00 0.00 175.52 176.80 2jnf h ILE 52 N 0.06 0.52 0.00 3.11 1.08 0.03 -0.95 117.51 121.36 2jnf h ILE 52 Ca -0.16 -0.59 -0.02 0.00 -0.39 0.00 0.00 64.86 63.70 2jnf h ILE 52 Cb 1.96 1.40 -0.00 0.00 -3.07 0.00 0.00 36.82 37.10 2jnf h ILE 52 CO 0.17 0.12 -0.09 -0.09 -0.69 0.00 0.00 178.15 177.57 2jnf h ARG 53 N 0.00 0.00 -0.26 2.37 9.65 -1.09 0.19 114.38 125.24 2jnf h ARG 53 Ca -0.00 0.00 -0.07 0.00 -1.10 0.00 0.00 59.98 58.81 2jnf h ARG 53 Cb 0.39 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.96 2jnf h ARG 53 CO 0.02 0.09 -0.10 1.96 2.80 0.00 0.00 179.97 184.74 2jnf h GLN 54 N 0.00 0.52 -0.47 0.20 1.08 -1.38 0.90 115.11 115.97 2jnf h GLN 54 Ca -0.00 -0.22 0.07 0.00 -1.45 0.00 0.00 58.65 57.05 2jnf h GLN 54 Cb 0.18 -0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.53 2jnf h GLN 54 CO 0.01 0.76 0.12 -0.07 -0.95 0.00 0.00 178.83 178.71 2jnf h LEU 55 N 0.25 0.07 -0.21 1.46 -0.00 -1.10 0.50 115.31 116.28 2jnf h LEU 55 Ca 0.06 0.07 -0.01 0.00 -0.00 0.00 0.00 57.88 58.00 2jnf h LEU 55 Cb 0.59 0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.33 2jnf h LEU 55 CO 0.03 0.07 0.10 0.40 -0.00 0.00 0.00 178.44 179.05 2jnf h ILE 56 N 0.27 1.13 -0.58 1.22 2.04 -0.59 -0.31 117.51 120.70 2jnf h ILE 56 Ca 0.23 -0.37 0.12 0.00 1.00 0.00 0.00 64.86 65.84 2jnf h ILE 56 Cb 0.27 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 2jnf h ILE 56 CO -0.27 0.13 0.39 -0.78 0.00 0.00 0.00 178.15 177.62 2jnf h ASP 57 N 0.22 0.25 0.08 1.72 3.58 -0.34 0.56 116.42 122.49 2jnf h ASP 57 Ca 0.07 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 2jnf h ASP 57 Cb 0.11 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2jnf h ASP 57 CO -0.01 0.14 -0.04 -0.08 -2.88 0.00 0.00 179.24 176.38 2jnf h GLU 58 N 0.28 -0.10 0.00 0.28 4.57 -0.30 -3.38 114.58 115.92 2jnf h GLU 58 Ca 0.27 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.46 2jnf h GLU 58 Cb 0.70 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 2jnf h GLU 58 CO -0.06 0.39 -1.11 1.19 -1.18 0.00 0.00 179.01 178.25 2jnf n PHE 59 N -4.80 0.00 -3.25 0.92 3.72 -0.18 -4.47 117.46 109.40 2jnf n PHE 59 Ca -0.07 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.08 2jnf n PHE 59 Cb 0.27 -0.07 -0.06 0.00 -0.94 0.00 0.00 39.48 38.68 2jnf n PHE 59 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2jnf n ASP 60 N -1.59 3.00 0.25 4.37 2.03 0.19 -4.87 116.55 119.93 2jnf n ASP 60 Ca 0.03 -3.32 0.12 0.00 0.52 0.00 0.00 54.79 52.14 2jnf n ASP 60 Cb 0.35 -0.63 0.63 0.00 -0.72 0.00 0.00 41.12 40.74 2jnf n ASP 60 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2jnf h PRO 61 N 3.76 0.00 0.00 -0.67 0.11 -1.74 -2.91 132.00 130.55 2jnf h PRO 61 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2jnf h PRO 61 Cb 0.69 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 2jnf h PRO 61 CO 0.73 0.15 0.00 0.74 -0.21 0.00 0.00 178.00 179.42 2jnf h PHE 62 N 0.00 0.00 -2.34 0.65 0.04 -1.93 -3.47 116.94 109.89 2jnf h PHE 62 Ca -0.00 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.64 2jnf h PHE 62 Cb 0.51 0.00 0.04 0.00 2.20 0.00 0.00 35.95 38.70 2jnf h PHE 62 CO 0.00 0.00 -0.21 0.41 -0.60 0.00 0.00 178.31 177.91 2jnf n GLY 63 N 0.98 0.42 0.18 -1.45 0.00 -1.10 -4.95 105.19 99.27 2jnf n GLY 63 Ca 0.04 -0.41 -0.06 0.00 0.00 0.00 0.00 46.02 45.58 2jnf n GLY 63 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2jnf h ASN 64 N -0.76 0.39 0.00 1.61 -0.73 -1.91 -3.47 115.58 110.71 2jnf h ASN 64 Ca -0.18 -0.21 0.00 0.00 1.87 0.00 0.00 56.30 57.77 2jnf h ASN 64 Cb 1.12 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.60 2jnf h ASN 64 CO 0.18 0.88 0.00 0.61 -0.37 0.00 0.00 177.43 178.73 2jnf n GLY 65 N 0.24 3.18 3.17 1.57 0.00 -1.26 -5.03 105.19 107.06 2jnf n GLY 65 Ca -0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 2jnf n GLY 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jnf s ASP 66 N -1.01 0.27 0.02 1.61 1.11 -1.26 -0.33 116.67 117.09 2jnf s ASP 66 Ca 0.00 -1.28 0.05 0.00 0.18 0.00 0.00 52.55 51.50 2jnf s ASP 66 Cb 0.00 0.32 -0.02 0.00 1.07 0.00 0.00 42.92 44.29 2jnf s ASP 66 CO 0.00 -0.77 -0.15 0.27 1.18 0.00 0.00 175.17 175.71 2jnf s ILE 67 N -4.08 1.16 0.77 0.77 -4.36 0.49 -4.80 121.20 111.15 2jnf s ILE 67 Ca 0.30 -0.89 -0.12 0.00 -0.26 0.00 0.00 60.65 59.68 2jnf s ILE 67 Cb 0.07 -1.02 0.05 0.00 1.25 0.00 0.00 42.46 42.81 2jnf s ILE 67 CO 0.06 0.12 1.11 -0.62 0.24 0.00 0.00 174.94 175.85 2jnf s ASP 68 N -0.89 4.85 0.44 4.36 2.15 -1.26 -1.45 116.67 124.86 2jnf s ASP 68 Ca 0.03 1.11 0.11 0.00 0.43 0.00 0.00 52.55 54.24 2jnf s ASP 68 Cb -0.07 -1.82 0.99 0.00 -0.30 0.00 0.00 42.92 41.71 2jnf s ASP 68 CO 0.01 -1.72 2.04 0.15 -0.17 0.00 0.00 175.17 175.48 2jnf h PHE 69 N -0.92 0.40 -0.78 -5.34 3.57 -1.98 -0.63 116.94 111.26 2jnf h PHE 69 Ca -0.46 0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.18 2jnf h PHE 69 Cb 1.28 -0.13 -0.09 0.00 2.79 0.00 0.00 35.95 39.79 2jnf h PHE 69 CO 0.44 0.23 0.37 0.22 -2.23 0.00 0.00 178.31 177.35 2jnf h ASP 70 N 0.42 0.44 0.19 0.41 3.58 -1.99 0.90 116.42 120.37 2jnf h ASP 70 Ca 0.17 0.09 -0.31 0.00 0.42 0.00 0.00 57.03 57.40 2jnf h ASP 70 Cb 0.18 0.02 0.03 0.00 1.72 0.00 0.00 39.33 41.28 2jnf h ASP 70 CO -0.04 0.20 -1.32 0.28 -2.88 0.00 0.00 179.24 175.48 2jnf h SER 71 N 0.57 0.83 0.28 2.28 0.02 -1.59 -3.19 113.55 112.76 2jnf h SER 71 Ca 0.41 -0.88 -0.11 0.00 -0.84 0.00 0.00 61.79 60.37 2jnf h SER 71 Cb 0.55 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 2jnf h SER 71 CO -0.34 1.64 -0.46 0.15 -1.14 0.00 0.00 176.83 176.68 2jnf h PHE 72 N 0.15 0.27 -0.83 3.45 3.57 -0.57 -1.85 116.94 121.13 2jnf h PHE 72 Ca -0.22 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.17 2jnf h PHE 72 Cb 2.02 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 40.66 2jnf h PHE 72 CO 0.13 0.64 0.40 -0.22 -2.23 0.00 0.00 178.31 177.03 2jnf h LYS 73 N 0.18 1.19 -0.56 1.11 3.64 0.74 0.11 116.57 122.98 2jnf h LYS 73 Ca 0.01 -0.17 -0.09 0.00 -1.27 0.00 0.00 60.65 59.13 2jnf h LYS 73 Cb 0.88 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 2jnf h LYS 73 CO 0.07 0.92 0.01 0.82 -2.27 0.00 0.00 179.45 179.00 2jnf h ILE 74 N 1.18 1.26 0.39 2.00 2.04 -1.43 0.29 117.51 123.24 2jnf h ILE 74 Ca 0.28 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 2jnf h ILE 74 Cb 0.12 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 2jnf h ILE 74 CO -0.04 0.39 -0.32 0.40 0.00 0.00 0.00 178.15 178.58 2jnf h ILE 75 N 0.89 0.33 -0.44 -0.67 2.04 -0.50 0.21 117.51 119.38 2jnf h ILE 75 Ca 0.17 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.00 2jnf h ILE 75 Cb 0.51 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 2jnf h ILE 75 CO 0.02 0.00 0.15 1.23 0.00 0.00 0.00 178.15 179.55 2jnf h GLY 76 N -0.72 0.69 2.00 5.37 0.00 -0.68 -2.49 103.07 107.23 2jnf h GLY 76 Ca -0.03 -0.34 -0.06 0.00 0.00 0.00 0.00 47.33 46.89 2jnf h GLY 76 CO -0.02 0.33 -0.28 0.00 0.00 0.00 0.00 176.54 176.56 2jnf h ALA 77 N 1.53 1.12 0.00 3.60 0.00 0.04 0.54 119.26 126.10 2jnf h ALA 77 Ca 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2jnf h ALA 77 Cb 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2jnf h ALA 77 CO -0.01 0.35 -0.86 2.89 0.00 0.00 0.00 179.25 181.62 2jnf n ARG 78 N -3.61 0.27 -0.02 0.00 1.85 0.02 -3.81 116.66 111.37 2jnf n ARG 78 Ca -0.01 0.03 -0.03 0.00 -1.00 0.00 0.00 57.85 56.84 2jnf n ARG 78 Cb 0.41 -1.62 -0.01 0.00 -1.05 0.00 0.00 32.46 30.19 2jnf n ARG 78 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2jnf n PHE 79 N -1.99 0.00 0.27 2.89 3.72 -0.98 -4.68 117.46 116.70 2jnf n PHE 79 Ca 0.03 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.54 2jnf n PHE 79 Cb 0.43 -0.11 0.74 0.00 -0.94 0.00 0.00 39.48 39.60 2jnf n PHE 79 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2jnf h LEU 80 N -0.05 0.00 -2.50 4.37 -0.00 -0.15 -2.52 115.31 114.46 2jnf h LEU 80 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 2jnf h LEU 80 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.75 2jnf h LEU 80 CO -0.03 0.07 0.00 1.23 -0.00 0.00 0.00 178.44 179.71 2jnf h GLY 81 N 0.32 0.00 2.00 0.83 0.00 -1.72 -0.05 103.07 104.45 2jnf h GLY 81 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2jnf h GLY 81 CO 0.01 0.00 -0.11 1.05 0.00 0.00 0.00 176.54 177.49 2jnf h GLU 82 N 0.00 0.00 -1.30 4.80 4.11 -1.76 -3.47 114.58 116.96 2jnf h GLU 82 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2jnf h GLU 82 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2jnf h GLU 82 CO 0.00 0.11 -0.02 -1.91 0.07 0.00 0.00 179.01 177.26 2jnf n GLU 83 N -4.07 -0.24 -3.36 1.06 4.07 -0.04 -4.97 120.64 113.09 2jnf n GLU 83 Ca -0.02 0.24 -0.26 0.00 -0.06 0.00 0.00 57.16 57.05 2jnf n GLU 83 Cb 0.19 -0.17 -0.10 0.00 -0.06 0.00 0.00 31.44 31.31 2jnf n GLU 83 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 2jnf n VAL 84 N 1.24 -1.18 -2.70 6.31 0.31 -1.26 -5.02 118.33 116.03 2jnf n VAL 84 Ca 0.00 -3.33 -0.41 0.00 -0.01 0.00 0.00 64.34 60.60 2jnf n VAL 84 Cb 0.01 -1.55 -0.05 0.00 -0.91 0.00 0.00 33.84 31.34 2jnf n VAL 84 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2jnf s ASN 85 N 0.09 7.51 0.12 4.52 2.47 -1.26 -4.96 114.94 123.43 2jnf s ASN 85 Ca 0.33 1.89 -0.26 0.00 0.42 0.00 0.00 52.86 55.24 2jnf s ASN 85 Cb 0.04 -2.60 -0.06 0.00 -1.45 0.00 0.00 41.25 37.18 2jnf s ASN 85 CO -0.19 -0.01 1.63 -0.65 -3.72 0.00 0.00 177.10 174.16 2jnf h PRO 86 N 5.01 -0.41 -0.70 0.43 0.11 -1.99 -0.14 132.00 134.30 2jnf h PRO 86 Ca -0.44 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2jnf h PRO 86 Cb 1.21 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2jnf h PRO 86 CO 0.71 -0.27 0.00 -0.85 -0.21 0.00 0.00 178.00 177.37 2jnf n GLU 87 N -5.38 2.81 -0.10 1.05 0.00 -1.26 -3.16 120.64 114.60 2jnf n GLU 87 Ca -0.05 -2.60 -0.12 0.00 0.00 0.00 0.00 57.16 54.39 2jnf n GLU 87 Cb 0.29 -1.61 -0.12 0.00 0.00 0.00 0.00 31.44 30.01 2jnf n GLU 87 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 2jnf n GLN 88 N 1.51 0.85 0.10 3.44 -0.06 -0.78 -4.41 117.38 118.03 2jnf n GLN 88 Ca 0.24 0.06 0.12 0.00 -2.00 0.00 0.00 57.00 55.42 2jnf n GLN 88 Cb 0.64 -1.45 0.11 0.00 -4.06 0.00 0.00 30.24 25.49 2jnf n GLN 88 CO 0.00 0.00 0.00 1.98 -0.20 0.00 0.00 177.06 178.84 2jnf h MET 89 N 0.00 0.00 0.00 3.69 4.05 -1.18 -3.47 114.93 118.02 2jnf h MET 89 Ca -0.48 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.94 2jnf h MET 89 Cb 1.92 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.72 2jnf h MET 89 CO -0.03 0.00 0.00 1.04 0.23 0.00 0.00 176.91 178.15 2jnf n GLN 90 N -2.50 3.13 -3.35 0.39 6.02 -1.19 -4.82 117.38 115.07 2jnf n GLN 90 Ca 0.02 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.77 2jnf n GLN 90 Cb 0.50 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.79 2jnf n GLN 90 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2jnf n GLN 91 N -0.05 -4.98 0.34 -1.09 7.27 -1.26 -4.80 117.38 112.81 2jnf n GLN 91 Ca 0.00 0.72 0.22 0.00 0.07 0.00 0.00 57.00 58.02 2jnf n GLN 91 Cb 0.00 -5.57 1.19 0.00 2.41 0.00 0.00 30.24 28.27 2jnf n GLN 91 CO 0.00 0.00 0.00 1.05 0.07 0.00 0.00 177.06 178.18 2jnf h GLU 92 N -1.56 0.00 -0.90 3.69 4.11 -1.91 -2.47 114.58 115.53 2jnf h GLU 92 Ca -0.52 0.00 0.18 0.00 0.07 0.00 0.00 59.36 59.09 2jnf h GLU 92 Cb 1.35 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.52 2jnf h GLU 92 CO 0.58 0.00 0.59 -0.07 0.07 0.00 0.00 179.01 180.17 2jnf h LEU 93 N 0.00 0.55 -1.50 3.06 -0.00 -1.97 0.04 115.31 115.49 2jnf h LEU 93 Ca -0.00 0.05 -0.03 0.00 -0.00 0.00 0.00 57.88 57.90 2jnf h LEU 93 Cb 0.02 -0.06 -0.01 0.00 -0.00 0.00 0.00 40.66 40.61 2jnf h LEU 93 CO 0.00 0.24 -0.00 0.03 -0.00 0.00 0.00 178.44 178.71 2jnf h ARG 94 N 0.57 0.31 0.04 1.13 2.47 -1.78 -0.89 114.38 116.24 2jnf h ARG 94 Ca 0.47 -0.05 -0.28 0.00 -1.26 0.00 0.00 59.98 58.86 2jnf h ARG 94 Cb 0.94 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 29.18 2jnf h ARG 94 CO -0.21 0.34 -1.51 0.93 0.56 0.00 0.00 179.97 180.08 2jnf h GLU 95 N 0.31 0.09 0.00 0.04 5.08 -1.25 -3.30 114.58 115.54 2jnf h GLU 95 Ca 0.07 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2jnf h GLU 95 Cb 0.22 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2jnf h GLU 95 CO 0.01 0.85 0.00 0.00 -1.00 0.00 0.00 179.01 178.86 2jnf h ALA 96 N 0.78 1.00 -0.44 3.43 0.00 -0.36 -2.33 119.26 121.34 2jnf h ALA 96 Ca -0.22 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.72 2jnf h ALA 96 Cb 1.96 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.72 2jnf h ALA 96 CO 0.12 0.00 0.25 0.74 0.00 0.00 0.00 179.25 180.36 2jnf h PHE 97 N 0.00 0.46 0.00 0.00 0.04 -1.27 -1.09 116.94 115.08 2jnf h PHE 97 Ca 0.00 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.79 2jnf h PHE 97 Cb 0.30 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.31 2jnf h PHE 97 CO 0.00 0.26 0.00 0.54 -0.60 0.00 0.00 178.31 178.51 2jnf n ARG 98 N -4.86 0.19 0.11 1.51 1.74 -0.88 0.11 116.66 114.58 2jnf n ARG 98 Ca 0.02 0.39 -0.20 0.00 -0.77 0.00 0.00 57.85 57.30 2jnf n ARG 98 Cb 0.08 -1.84 -0.15 0.00 -1.02 0.00 0.00 32.46 29.53 2jnf n ARG 98 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2jnf h LEU 99 N 0.00 0.58 0.00 0.55 -0.00 -1.29 -3.37 115.31 111.78 2jnf h LEU 99 Ca 0.00 -0.67 -0.30 0.00 -0.00 0.00 0.00 57.88 56.92 2jnf h LEU 99 Cb 0.39 -0.19 -0.05 0.00 -0.00 0.00 0.00 40.66 40.80 2jnf h LEU 99 CO 0.00 1.53 -2.04 -1.22 -0.00 0.00 0.00 178.44 176.71 2jnf n TYR 100 N -3.59 0.42 -2.14 1.13 4.01 -0.68 -4.68 117.16 111.64 2jnf n TYR 100 Ca -0.14 0.15 -0.35 0.00 -0.16 0.00 0.00 57.90 57.40 2jnf n TYR 100 Cb 1.06 -1.03 -0.04 0.00 -0.31 0.00 0.00 39.34 39.02 2jnf n TYR 100 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2jnf n ASP 101 N -2.82 3.71 0.00 7.72 2.03 0.30 -4.61 116.55 122.88 2jnf n ASP 101 Ca -0.23 -2.78 0.12 0.00 0.52 0.00 0.00 54.79 52.42 2jnf n ASP 101 Cb 1.05 -1.68 0.62 0.00 -0.72 0.00 0.00 41.12 40.39 2jnf n ASP 101 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2jnf n LYS 102 N 8.08 0.30 0.08 -0.67 4.76 -1.26 -3.70 118.16 125.74 2jnf n LYS 102 Ca 0.47 0.05 -0.19 0.00 -2.87 0.00 0.00 58.31 55.77 2jnf n LYS 102 Cb 0.45 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 32.00 2jnf n LYS 102 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2jnf h GLU 103 N 0.00 0.33 0.00 1.97 5.08 -1.93 -3.49 114.58 116.53 2jnf h GLU 103 Ca 0.00 -0.56 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 2jnf h GLU 103 Cb 0.28 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2jnf h GLU 103 CO 0.00 1.22 0.00 0.41 -1.00 0.00 0.00 179.01 179.64 2jnf n GLY 104 N 1.72 0.73 0.00 -3.84 0.00 -1.24 -5.03 105.19 97.53 2jnf n GLY 104 Ca -0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.87 2jnf n GLY 104 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jnf n ASN 105 N 0.00 2.82 0.00 1.61 3.02 -1.26 -4.97 115.26 116.48 2jnf n ASN 105 Ca 0.00 -0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 2jnf n ASN 105 Cb 0.00 1.24 0.00 0.00 -0.61 0.00 0.00 39.78 40.41 2jnf n ASN 105 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jnf n GLY 106 N 1.92 3.07 3.46 7.41 0.00 -1.26 -4.96 105.19 114.83 2jnf n GLY 106 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2jnf n GLY 106 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jnf s TYR 107 N -1.39 2.52 -0.11 1.61 2.02 -1.26 -4.55 117.35 116.19 2jnf s TYR 107 Ca 0.00 -0.28 -0.17 0.00 -0.37 0.00 0.00 57.07 56.25 2jnf s TYR 107 Cb 0.00 -1.39 -0.04 0.00 -0.40 0.00 0.00 41.96 40.12 2jnf s TYR 107 CO 0.00 0.31 0.45 0.96 -1.57 0.00 0.00 175.55 175.69 2jnf s ILE 108 N -1.02 5.18 1.00 2.71 -4.36 -1.12 -4.84 121.20 118.76 2jnf s ILE 108 Ca 0.16 0.89 -0.13 0.00 -0.26 0.00 0.00 60.65 61.30 2jnf s ILE 108 Cb -0.10 -3.78 0.19 0.00 1.25 0.00 0.00 42.46 40.01 2jnf s ILE 108 CO 0.07 0.36 1.11 -0.44 0.24 0.00 0.00 174.94 176.29 2jnf s SER 109 N 0.41 2.61 0.52 4.36 0.01 -1.26 0.79 113.70 121.14 2jnf s SER 109 Ca 0.24 1.03 0.20 0.00 1.31 0.00 0.00 55.95 58.73 2jnf s SER 109 Cb -0.15 -1.61 1.35 0.00 0.21 0.00 0.00 66.02 65.82 2jnf s SER 109 CO 0.10 -3.12 2.12 0.71 0.41 0.00 0.00 173.24 173.46 2jnf h THR 110 N -1.89 0.87 0.72 1.44 1.35 -1.84 -1.95 112.91 111.61 2jnf h THR 110 Ca -0.53 -0.27 -0.04 0.00 -0.55 0.00 0.00 66.41 65.03 2jnf h THR 110 Cb 1.33 1.15 0.01 0.00 -1.73 0.00 0.00 68.15 68.91 2jnf h THR 110 CO 0.56 0.07 -0.35 0.44 -0.25 0.00 0.00 175.52 175.99 2jnf h ASP 111 N 0.00 -0.82 -0.32 5.36 3.32 -1.90 0.28 116.42 122.33 2jnf h ASP 111 Ca -0.00 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 2jnf h ASP 111 Cb 0.14 0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2jnf h ASP 111 CO 0.01 -0.58 0.04 1.62 -1.72 0.00 0.00 179.24 178.62 2jnf h VAL 112 N -0.99 1.21 -1.00 -1.35 3.04 -1.87 -2.14 116.25 113.15 2jnf h VAL 112 Ca -0.10 -0.80 0.02 0.00 -1.01 0.00 0.00 66.70 64.81 2jnf h VAL 112 Cb 0.75 0.85 -0.05 0.00 -2.01 0.00 0.00 31.29 30.82 2jnf h VAL 112 CO 0.16 0.28 0.66 -0.03 -1.01 0.00 0.00 177.57 177.64 2jnf h MET 113 N 0.62 1.28 -0.34 4.17 1.85 -1.15 -0.94 114.93 120.42 2jnf h MET 113 Ca 0.13 -0.08 0.07 0.00 -0.61 0.00 0.00 59.70 59.22 2jnf h MET 113 Cb 0.32 -0.29 -0.07 0.00 0.43 0.00 0.00 31.60 31.99 2jnf h MET 113 CO 0.01 0.85 -0.14 -0.09 -0.40 0.00 0.00 176.91 177.13 2jnf h ARG 114 N 1.32 -0.07 -0.52 0.39 2.43 -0.25 0.21 114.38 117.89 2jnf h ARG 114 Ca 0.38 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.51 2jnf h ARG 114 Cb -0.09 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 2jnf h ARG 114 CO -0.10 -0.05 0.15 0.93 -1.51 0.00 0.00 179.97 179.39 2jnf h GLU 115 N -0.08 0.82 -0.23 0.20 3.07 -1.32 -1.30 114.58 115.75 2jnf h GLU 115 Ca 0.17 -0.18 0.03 0.00 -0.50 0.00 0.00 59.36 58.88 2jnf h GLU 115 Cb 0.34 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.10 2jnf h GLU 115 CO -0.40 0.77 0.03 0.82 -1.40 0.00 0.00 179.01 178.83 2jnf h ILE 116 N 0.72 0.88 0.23 3.13 2.04 -0.54 0.28 117.51 124.25 2jnf h ILE 116 Ca 0.17 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.99 2jnf h ILE 116 Cb 0.30 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 2jnf h ILE 116 CO -0.00 0.02 -0.23 0.25 0.00 0.00 0.00 178.15 178.19 2jnf h LEU 117 N 0.12 -0.61 -1.01 1.44 7.12 -0.42 -2.39 115.31 119.56 2jnf h LEU 117 Ca 0.11 0.06 0.00 0.00 0.13 0.00 0.00 57.88 58.17 2jnf h LEU 117 Cb 0.11 0.21 0.00 0.00 -0.53 0.00 0.00 40.66 40.46 2jnf h LEU 117 CO -0.15 -0.34 0.00 0.00 -0.13 0.00 0.00 178.44 177.82 2jnf h ALA 118 N 0.20 1.00 0.00 1.25 0.00 -1.02 0.16 119.26 120.85 2jnf h ALA 118 Ca -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 2jnf h ALA 118 Cb 0.46 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2jnf h ALA 118 CO -0.05 0.00 -0.88 1.49 0.00 0.00 0.00 179.25 179.81 2jnf h GLU 119 N 0.00 0.00 0.00 0.00 4.81 -0.43 -3.35 114.58 115.61 2jnf h GLU 119 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2jnf h GLU 119 Cb 0.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 2jnf h GLU 119 CO 0.00 0.88 -0.03 -0.07 -0.73 0.00 0.00 179.01 179.06 2jnf h LEU 120 N 0.00 0.00 -9.66 1.64 4.07 -1.04 -3.47 115.31 106.85 2jnf h LEU 120 Ca -0.01 0.00 -0.60 0.00 0.08 0.00 0.00 57.88 57.35 2jnf h LEU 120 Cb 1.61 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 43.30 2jnf h LEU 120 CO 0.11 0.43 -0.15 -0.62 -1.08 0.00 0.00 178.44 177.14 2jnf s ASP 121 N -5.15 6.88 0.00 -0.43 -1.08 -0.05 -4.97 116.67 111.88 2jnf s ASP 121 Ca -0.01 1.05 0.13 0.00 -0.52 0.00 0.00 52.55 53.20 2jnf s ASP 121 Cb 0.00 -2.29 0.05 0.00 -1.46 0.00 0.00 42.92 39.22 2jnf s ASP 121 CO 0.01 0.29 0.82 -1.84 0.52 0.00 0.00 175.17 174.98 2jnf n GLU 122 N 1.89 1.43 -0.03 4.34 0.28 -1.26 -4.32 120.64 122.97 2jnf n GLU 122 Ca -0.13 -0.98 0.04 0.00 -0.16 0.00 0.00 57.16 55.94 2jnf n GLU 122 Cb 0.52 -1.21 -0.13 0.00 1.43 0.00 0.00 31.44 32.04 2jnf n GLU 122 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2jnf n THR 123 N 0.24 0.30 -1.69 3.84 -2.24 -1.26 -4.78 114.28 108.69 2jnf n THR 123 Ca 0.06 -0.48 -0.37 0.00 -2.27 0.00 0.00 64.05 61.00 2jnf n THR 123 Cb 0.30 -0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.42 2jnf n THR 123 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2jnf s LEU 124 N -4.47 3.38 1.02 3.22 2.01 -1.26 -4.96 118.68 117.62 2jnf s LEU 124 Ca -0.07 0.94 -0.14 0.00 0.01 0.00 0.00 54.13 54.88 2jnf s LEU 124 Cb 0.09 -2.59 0.20 0.00 0.01 0.00 0.00 46.19 43.90 2jnf s LEU 124 CO 0.71 -2.68 1.12 -0.55 1.01 0.00 0.00 176.35 175.96 2jnf s SER 125 N 10.80 2.49 0.23 2.29 0.15 -1.26 -4.55 113.70 123.85 2jnf s SER 125 Ca 0.90 0.96 -0.06 0.00 0.70 0.00 0.00 55.95 58.44 2jnf s SER 125 Cb -0.17 -1.49 0.37 0.00 -1.71 0.00 0.00 66.02 63.02 2jnf s SER 125 CO 0.25 -3.19 1.76 0.77 1.20 0.00 0.00 173.24 174.04 2jnf h SER 126 N -1.93 0.38 -0.54 5.45 4.64 -1.99 0.46 113.55 120.01 2jnf h SER 126 Ca -0.51 0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 60.80 2jnf h SER 126 Cb 1.32 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.42 2jnf h SER 126 CO 0.53 0.20 -0.01 -0.33 -0.87 0.00 0.00 176.83 176.35 2jnf h GLU 127 N 0.53 0.97 -0.41 4.77 4.39 -2.00 -2.21 114.58 120.62 2jnf h GLU 127 Ca 0.37 -0.31 -0.07 0.00 0.34 0.00 0.00 59.36 59.69 2jnf h GLU 127 Cb 0.46 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 2jnf h GLU 127 CO -0.32 0.98 -0.01 -0.44 -1.16 0.00 0.00 179.01 178.07 2jnf h ASP 128 N 0.84 0.71 -0.75 1.42 5.19 -1.51 -2.18 116.42 120.15 2jnf h ASP 128 Ca 0.15 -0.31 0.14 0.00 -0.62 0.00 0.00 57.03 56.39 2jnf h ASP 128 Cb 0.55 -0.19 -0.10 0.00 0.18 0.00 0.00 39.33 39.77 2jnf h ASP 128 CO 0.03 0.85 0.30 -0.07 -3.12 0.00 0.00 179.24 177.23 2jnf h LEU 129 N 0.55 0.27 -0.79 1.55 3.38 -0.04 0.28 115.31 120.51 2jnf h LEU 129 Ca 0.11 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 2jnf h LEU 129 Cb 0.49 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 2jnf h LEU 129 CO 0.02 0.10 0.43 -0.78 0.09 0.00 0.00 178.44 178.30 2jnf h ASP 130 N 0.44 0.99 -0.17 -0.43 1.82 -0.88 0.48 116.42 118.66 2jnf h ASP 130 Ca 0.41 -0.10 -0.13 0.00 -0.39 0.00 0.00 57.03 56.82 2jnf h ASP 130 Cb 0.63 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 40.38 2jnf h ASP 130 CO -0.41 0.81 -0.35 0.00 -1.61 0.00 0.00 179.24 177.68 2jnf h ALA 131 N 1.23 0.81 -0.14 -0.78 0.00 -0.74 -2.41 119.26 117.23 2jnf h ALA 131 Ca 0.28 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2jnf h ALA 131 Cb 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2jnf h ALA 131 CO -0.04 0.64 -0.22 0.52 0.00 0.00 0.00 179.25 180.15 2jnf h MET 132 N 0.58 0.24 -0.44 0.00 2.86 0.38 -0.38 114.93 118.16 2jnf h MET 132 Ca 0.06 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2jnf h MET 132 Cb 0.87 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.47 2jnf h MET 132 CO 0.08 0.45 0.27 0.82 1.06 0.00 0.00 176.91 179.59 2jnf h ILE 133 N 0.22 1.06 -0.39 -1.22 1.08 0.39 0.94 117.51 119.59 2jnf h ILE 133 Ca 0.04 -0.19 -0.06 0.00 -0.39 0.00 0.00 64.86 64.26 2jnf h ILE 133 Cb 0.52 0.47 -0.02 0.00 -3.07 0.00 0.00 36.82 34.72 2jnf h ILE 133 CO 0.03 0.10 -0.02 -0.78 -0.69 0.00 0.00 178.15 176.80 2jnf h ASP 134 N 0.54 0.60 -0.17 1.72 1.82 -1.04 -0.90 116.42 119.00 2jnf h ASP 134 Ca 0.17 -0.13 -0.15 0.00 -0.39 0.00 0.00 57.03 56.53 2jnf h ASP 134 Cb -0.00 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 39.85 2jnf h ASP 134 CO -0.07 0.69 -0.46 -0.08 -1.61 0.00 0.00 179.24 177.70 2jnf h GLU 135 N 0.60 0.61 0.49 0.28 4.57 -0.20 -3.33 114.58 117.60 2jnf h GLU 135 Ca 0.12 -0.43 -0.02 0.00 -1.18 0.00 0.00 59.36 57.84 2jnf h GLU 135 Cb 0.40 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 2jnf h GLU 135 CO 0.02 1.05 -0.24 0.82 -1.18 0.00 0.00 179.01 179.48 2jnf h ILE 136 N 0.27 0.42 -1.02 2.32 2.04 0.11 -3.34 117.51 118.30 2jnf h ILE 136 Ca -0.01 -0.39 -0.66 0.00 1.00 0.00 0.00 64.86 64.80 2jnf h ILE 136 Cb 1.08 0.56 -0.09 0.00 -0.74 0.00 0.00 36.82 37.63 2jnf h ILE 136 CO 0.10 0.06 1.95 -0.62 0.00 0.00 0.00 178.15 179.63 2jnf s ASP 137 N -4.77 6.75 0.22 1.72 2.15 -0.36 -4.47 116.67 117.91 2jnf s ASP 137 Ca -0.15 -2.19 -0.01 0.00 0.43 0.00 0.00 52.55 50.63 2jnf s ASP 137 Cb 0.02 -2.57 0.22 0.00 -0.30 0.00 0.00 42.92 40.30 2jnf s ASP 137 CO 0.52 -1.24 1.60 0.00 -0.17 0.00 0.00 175.17 175.88 2jnf h ALA 138 N 8.19 0.86 0.00 3.66 0.00 -1.73 -2.98 119.26 127.27 2jnf h ALA 138 Ca 0.37 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2jnf h ALA 138 Cb 0.91 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2jnf h ALA 138 CO 1.43 0.64 -0.48 -3.47 0.00 0.00 0.00 179.25 177.37 2jnf n ASP 139 N -4.04 0.62 -1.80 0.00 2.03 -1.26 -4.93 116.55 107.17 2jnf n ASP 139 Ca -0.02 0.13 -0.09 0.00 0.52 0.00 0.00 54.79 55.34 2jnf n ASP 139 Cb 0.51 0.01 0.03 0.00 -0.72 0.00 0.00 41.12 40.95 2jnf n ASP 139 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jnf n GLY 140 N 1.38 0.29 0.15 0.27 0.00 -1.13 -4.94 105.19 101.21 2jnf n GLY 140 Ca 0.04 -0.29 0.12 0.00 0.00 0.00 0.00 46.02 45.89 2jnf n GLY 140 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2jnf h SER 141 N -0.99 0.00 0.00 1.61 0.87 -1.92 -3.47 113.55 109.65 2jnf h SER 141 Ca -0.23 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 2jnf h SER 141 Cb 1.14 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2jnf h SER 141 CO 0.22 0.02 0.00 0.61 -0.53 0.00 0.00 176.83 177.14 2jnf n GLY 142 N 1.21 2.57 3.49 5.77 0.00 -1.26 -4.96 105.19 112.00 2jnf n GLY 142 Ca 0.04 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 2jnf n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jnf s THR 143 N -1.29 3.07 -0.42 2.61 -4.23 -1.26 -2.51 115.64 111.61 2jnf s THR 143 Ca 0.00 -0.85 -0.16 0.00 -1.18 0.00 0.00 61.69 59.51 2jnf s THR 143 Cb 0.00 -2.24 0.03 0.00 1.34 0.00 0.00 72.50 71.63 2jnf s THR 143 CO 0.00 0.50 0.35 -0.69 -0.54 0.00 0.00 174.62 174.24 2jnf s VAL 144 N -0.82 5.22 0.00 2.29 1.01 0.24 -4.77 120.40 123.56 2jnf s VAL 144 Ca 0.13 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.45 2jnf s VAL 144 Cb -0.11 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.29 2jnf s VAL 144 CO 0.03 -0.38 0.00 -0.90 0.00 0.00 0.00 175.10 173.85 2jnf n ASP 145 N 5.27 0.00 0.00 3.32 5.75 -1.26 -2.79 116.55 126.84 2jnf n ASP 145 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.68 2jnf n ASP 145 Cb 0.47 0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.66 2jnf n ASP 145 CO 0.00 0.00 0.00 2.22 -0.11 0.00 0.00 177.20 179.31 2jnf n PHE 146 N -1.80 0.00 0.07 2.11 -1.74 -1.26 -4.59 117.46 110.25 2jnf n PHE 146 Ca 0.00 0.00 -0.05 0.00 -0.56 0.00 0.00 57.45 56.84 2jnf n PHE 146 Cb 0.00 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 40.91 2jnf n PHE 146 CO 0.00 0.00 0.00 0.93 -0.56 0.00 0.00 176.76 177.13 2jnf h GLU 147 N 0.00 0.00 0.18 3.97 4.39 -1.97 -2.94 114.58 118.21 2jnf h GLU 147 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2jnf h GLU 147 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2jnf h GLU 147 CO 0.00 0.84 -0.09 0.93 -1.16 0.00 0.00 179.01 179.53 2jnf h GLU 148 N 0.00 -0.24 -0.19 2.33 3.07 -1.88 0.64 114.58 118.30 2jnf h GLU 148 Ca -0.04 0.02 -0.19 0.00 -0.50 0.00 0.00 59.36 58.65 2jnf h GLU 148 Cb 1.71 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.67 2jnf h GLU 148 CO 0.11 -0.15 -0.64 0.35 -1.40 0.00 0.00 179.01 177.28 2jnf h PHE 149 N -0.26 0.90 -0.46 4.33 3.04 -1.81 -2.29 116.94 120.39 2jnf h PHE 149 Ca -0.03 -0.35 0.08 0.00 3.98 0.00 0.00 57.97 61.65 2jnf h PHE 149 Cb 0.20 -0.16 -0.06 0.00 2.56 0.00 0.00 35.95 38.49 2jnf h PHE 149 CO -0.06 1.14 0.09 1.98 -2.02 0.00 0.00 178.31 179.44 2jnf h MET 150 N 0.51 0.22 0.00 1.11 4.05 -1.36 -0.12 114.93 119.34 2jnf h MET 150 Ca -0.01 -0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.36 2jnf h MET 150 Cb 1.23 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.97 2jnf h MET 150 CO 0.13 0.15 -0.17 0.78 0.23 0.00 0.00 176.91 178.03 2jnf h GLY 151 N 0.23 0.00 0.57 1.39 0.00 -0.74 -2.18 103.07 102.35 2jnf h GLY 151 Ca 0.23 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.21 2jnf h GLY 151 CO -0.30 0.00 -2.02 1.55 0.00 0.00 0.00 176.54 175.76 2jnf n VAL 152 N -3.20 1.69 -0.08 4.60 3.14 -0.87 -3.65 118.33 119.96 2jnf n VAL 152 Ca 0.02 -0.69 -0.10 0.00 -2.96 0.00 0.00 64.34 60.62 2jnf n VAL 152 Cb 0.51 -1.48 -0.05 0.00 -1.06 0.00 0.00 33.84 31.77 2jnf n VAL 152 CO 0.00 0.00 0.00 -0.03 -6.46 0.00 0.00 176.83 170.34 2jnf h MET 153 N 0.04 0.00 -1.38 1.45 -1.53 -1.11 -3.37 114.93 109.03 2jnf h MET 153 Ca -0.42 0.00 -0.51 0.00 -3.44 0.00 0.00 59.70 55.33 2jnf h MET 153 Cb 2.02 0.00 -0.21 0.00 -0.55 0.00 0.00 31.60 32.86 2jnf h MET 153 CO 0.06 0.32 0.64 0.25 0.14 0.00 0.00 176.91 178.32 2jnf n THR 154 N -4.57 3.22 -3.35 -0.77 -2.24 -0.82 -4.81 114.28 100.94 2jnf n THR 154 Ca -0.15 -2.43 -0.45 0.00 -2.27 0.00 0.00 64.05 58.75 2jnf n THR 154 Cb 0.38 -1.28 -0.06 0.00 -2.10 0.00 0.00 70.33 67.27 2jnf n THR 154 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jnf s GLY 155 N -0.68 2.07 0.00 3.38 0.00 -1.23 -4.42 107.32 106.44 2jnf s GLY 155 Ca 0.48 -2.43 0.00 0.00 0.00 0.00 0.00 44.72 42.78 2jnf s GLY 155 CO -0.05 1.15 0.00 0.61 0.00 0.00 0.00 173.10 174.81 2jnf n GLY 156 N 5.21 3.14 3.21 0.20 0.00 -1.26 -4.43 105.19 111.25 2jnf n GLY 156 Ca -0.13 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.73 2jnf n GLY 156 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jnf n ASP 157 N 0.01 -2.37 0.00 1.61 8.00 -1.26 -5.28 116.55 117.27 2jnf n ASP 157 Ca 0.00 -0.55 0.00 0.00 0.71 0.00 0.00 54.79 54.95 2jnf n ASP 157 Cb 0.00 -4.67 0.00 0.00 -0.02 0.00 0.00 41.12 36.43 2jnf n ASP 157 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97