#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 1.38 2.16 -5.12 0.00 -1.26 -4.97 105.19 97.38 2jnf n GLY 2 Ca 0.00 -0.64 0.13 0.00 0.00 0.00 0.00 46.02 45.51 2jnf n GLY 2 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jnf n ASP 3 N 3.62 -6.53 0.00 1.61 9.92 -1.26 -3.95 116.55 119.95 2jnf n ASP 3 Ca 0.00 1.04 0.00 0.00 -0.53 0.00 0.00 54.79 55.30 2jnf n ASP 3 Cb 0.00 -2.91 0.00 0.00 -0.64 0.00 0.00 41.12 37.57 2jnf n ASP 3 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 2jnf n VAL 4 N -3.26 0.00 1.13 2.53 0.24 -1.26 -4.39 118.33 113.31 2jnf n VAL 4 Ca 0.01 0.00 0.14 0.00 -2.04 0.00 0.00 64.34 62.45 2jnf n VAL 4 Cb 0.44 -0.54 0.60 0.00 -1.47 0.00 0.00 33.84 32.88 2jnf n VAL 4 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2jnf n SER 5 N -1.44 0.10 0.08 -1.34 3.41 -1.26 -2.59 113.62 110.58 2jnf n SER 5 Ca 0.00 0.18 0.13 0.00 -0.26 0.00 0.00 58.87 58.92 2jnf n SER 5 Cb 0.29 -0.33 0.46 0.00 -0.26 0.00 0.00 64.21 64.37 2jnf n SER 5 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jnf n LYS 6 N -1.41 0.17 -3.10 4.33 4.01 -1.26 -4.72 118.16 116.19 2jnf n LYS 6 Ca 0.09 0.19 -0.40 0.00 -0.51 0.00 0.00 58.31 57.68 2jnf n LYS 6 Cb 0.31 -1.72 -0.06 0.00 -0.51 0.00 0.00 35.03 33.05 2jnf n LYS 6 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2jnf s LEU 7 N -4.07 4.09 0.40 -0.35 1.43 -1.07 -5.06 118.68 114.06 2jnf s LEU 7 Ca 0.10 0.76 -0.21 0.00 -1.03 0.00 0.00 54.13 53.75 2jnf s LEU 7 Cb 0.13 -2.88 -0.11 0.00 0.03 0.00 0.00 46.19 43.37 2jnf s LEU 7 CO 0.54 -0.34 0.93 -0.55 0.23 0.00 0.00 176.35 177.16 2jnf s SER 8 N 1.37 7.00 0.58 2.29 0.15 -1.26 -4.94 113.70 118.89 2jnf s SER 8 Ca 0.27 1.68 0.27 0.00 0.70 0.00 0.00 55.95 58.88 2jnf s SER 8 Cb -0.16 -2.53 1.60 0.00 -1.71 0.00 0.00 66.02 63.22 2jnf s SER 8 CO 0.09 -0.29 2.10 0.28 1.20 0.00 0.00 173.24 176.61 2jnf h SER 9 N 2.17 0.00 -0.63 5.45 0.02 -1.98 -0.10 113.55 118.48 2jnf h SER 9 Ca -0.49 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 60.52 2jnf h SER 9 Cb 1.18 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.67 2jnf h SER 9 CO 0.62 0.00 0.34 0.78 -1.14 0.00 0.00 176.83 177.43 2jnf h ASN 10 N 0.00 0.49 0.25 3.07 4.21 -2.01 -1.06 115.58 120.53 2jnf h ASN 10 Ca 0.10 0.03 -0.21 0.00 1.21 0.00 0.00 56.30 57.42 2jnf h ASN 10 Cb 0.49 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.63 2jnf h ASN 10 CO -0.00 0.32 -0.86 1.56 -1.29 0.00 0.00 177.43 177.15 2jnf h GLN 11 N 0.63 0.46 -0.10 0.81 4.20 -1.41 -3.03 115.11 116.68 2jnf h GLN 11 Ca 0.28 -0.44 -0.05 0.00 0.06 0.00 0.00 58.65 58.51 2jnf h GLN 11 Cb 0.19 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 2jnf h GLN 11 CO -0.19 1.09 -0.16 0.28 -0.67 0.00 0.00 178.83 179.19 2jnf h VAL 12 N 0.28 1.17 0.02 -0.54 2.07 -1.08 -1.88 116.25 116.28 2jnf h VAL 12 Ca -0.06 -0.75 0.03 0.00 0.82 0.00 0.00 66.70 66.73 2jnf h VAL 12 Cb 1.48 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 32.48 2jnf h VAL 12 CO 0.15 0.23 -0.23 0.11 0.02 0.00 0.00 177.57 177.85 2jnf h LYS 13 N 0.14 -0.36 -0.58 1.57 6.56 -1.07 0.47 116.57 123.31 2jnf h LYS 13 Ca 0.03 0.02 0.02 0.00 -1.06 0.00 0.00 60.65 59.66 2jnf h LYS 13 Cb 0.37 0.08 -0.03 0.00 -0.57 0.00 0.00 32.23 32.08 2jnf h LYS 13 CO 0.02 -0.24 0.36 -0.07 -2.06 0.00 0.00 179.45 177.47 2jnf h LEU 14 N -0.37 0.60 0.57 2.94 4.07 -1.50 0.52 115.31 122.14 2jnf h LEU 14 Ca 0.06 -0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.99 2jnf h LEU 14 Cb 0.44 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.04 2jnf h LEU 14 CO -0.19 0.42 -0.39 -0.07 -1.08 0.00 0.00 178.44 177.13 2jnf h LEU 15 N 0.72 -1.01 -0.88 1.67 3.38 -0.99 -1.95 115.31 116.26 2jnf h LEU 15 Ca 0.23 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.29 2jnf h LEU 15 Cb -0.01 0.31 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 2jnf h LEU 15 CO -0.08 -0.59 0.57 -0.08 0.09 0.00 0.00 178.44 178.35 2jnf h GLU 16 N -0.93 1.09 -0.68 1.13 4.57 0.14 0.40 114.58 120.31 2jnf h GLU 16 Ca -0.07 -0.07 -0.05 0.00 -1.18 0.00 0.00 59.36 58.00 2jnf h GLU 16 Cb 0.77 -0.25 -0.03 0.00 -0.16 0.00 0.00 28.75 29.08 2jnf h GLU 16 CO 0.04 0.72 0.22 1.15 -1.18 0.00 0.00 179.01 179.96 2jnf h THR 17 N 1.12 1.25 0.00 0.32 2.02 -0.81 -2.38 112.91 114.43 2jnf h THR 17 Ca 0.35 -0.85 -0.17 0.00 0.77 0.00 0.00 66.41 66.50 2jnf h THR 17 Cb -0.02 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 66.89 2jnf h THR 17 CO -0.11 0.33 -0.93 0.00 0.37 0.00 0.00 175.52 175.19 2jnf h ALA 18 N 1.10 0.55 0.27 6.16 0.00 -0.91 -3.06 119.26 123.37 2jnf h ALA 18 Ca 0.22 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2jnf h ALA 18 Cb 0.28 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2jnf h ALA 18 CO -0.01 1.01 -0.25 0.35 0.00 0.00 0.00 179.25 180.35 2jnf h PHE 19 N 0.00 -0.66 0.00 0.00 3.57 0.07 -2.45 116.94 117.48 2jnf h PHE 19 Ca -0.05 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 2jnf h PHE 19 Cb 1.63 0.25 -0.00 0.00 2.79 0.00 0.00 35.95 40.62 2jnf h PHE 19 CO 0.00 -0.37 -0.09 0.00 -2.23 0.00 0.00 178.31 175.62 2jnf h ARG 20 N -0.54 0.00 -0.27 1.11 2.47 -1.53 -1.76 114.38 113.86 2jnf h ARG 20 Ca -0.01 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.63 2jnf h ARG 20 Cb 0.50 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.81 2jnf h ARG 20 CO -0.04 0.09 -0.15 0.22 0.56 0.00 0.00 179.97 180.65 2jnf h ASP 21 N 0.00 0.60 -0.43 7.04 3.58 -1.34 -3.02 116.42 122.85 2jnf h ASP 21 Ca -0.00 -0.42 0.00 0.00 0.42 0.00 0.00 57.03 57.03 2jnf h ASP 21 Cb 0.64 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.52 2jnf h ASP 21 CO 0.01 0.89 0.00 0.49 -2.88 0.00 0.00 179.24 177.75 2jnf n PHE 22 N -4.43 1.22 -2.07 0.28 3.01 -1.03 -5.03 117.46 109.41 2jnf n PHE 22 Ca -0.04 -0.73 -0.34 0.00 1.01 0.00 0.00 57.45 57.36 2jnf n PHE 22 Cb 0.38 -0.29 0.02 0.00 -0.01 0.00 0.00 39.48 39.57 2jnf n PHE 22 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2jnf s GLU 23 N -2.30 3.21 0.14 -1.08 2.12 -0.67 -4.19 118.70 115.93 2jnf s GLU 23 Ca 0.44 1.41 0.00 0.00 0.36 0.00 0.00 54.97 57.18 2jnf s GLU 23 Cb 0.32 -2.00 0.00 0.00 0.26 0.00 0.00 34.13 32.70 2jnf s GLU 23 CO 0.15 -0.93 0.00 -2.37 -0.54 0.00 0.00 175.26 171.57 2jnf n THR 24 N -1.82 -2.19 -0.02 -1.70 5.66 0.12 -4.85 114.28 109.49 2jnf n THR 24 Ca 0.10 0.66 -0.22 0.00 -3.05 0.00 0.00 64.05 61.55 2jnf n THR 24 Cb 0.52 -1.04 -0.13 0.00 -1.55 0.00 0.00 70.33 68.12 2jnf n THR 24 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2jnf h PRO 25 N 0.51 0.20 0.00 1.09 0.13 -1.92 -3.45 132.00 128.56 2jnf h PRO 25 Ca 0.00 -0.35 -0.07 0.00 -0.87 0.00 0.00 66.00 64.71 2jnf h PRO 25 Cb 0.00 0.13 -0.09 0.00 0.13 0.00 0.00 31.00 31.17 2jnf h PRO 25 CO 0.00 1.17 -0.27 -1.91 -0.23 0.00 0.00 178.00 176.75 2jnf n GLU 26 N -3.84 0.00 0.00 0.86 2.13 -1.26 -5.00 120.64 113.53 2jnf n GLU 26 Ca -0.30 -0.71 0.00 0.00 0.66 0.00 0.00 57.16 56.82 2jnf n GLU 26 Cb 0.92 0.15 0.00 0.00 0.27 0.00 0.00 31.44 32.79 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 0.05 0.85 0.07 8.31 0.00 -1.26 -5.06 105.19 108.15 2jnf n GLY 27 Ca -0.11 -0.80 -0.07 0.00 0.00 0.00 0.00 46.02 45.04 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 1.38 0.00 1.61 2.88 -1.26 -5.00 113.62 113.22 2jnf n SER 28 Ca 0.00 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2jnf n SER 28 Cb 0.00 0.85 0.00 0.00 -0.75 0.00 0.00 64.21 64.31 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 2.10 0.91 3.82 0.46 0.00 -1.26 -5.04 105.19 106.17 2jnf n GLY 29 Ca -0.24 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.83 2.33 -0.16 1.61 3.00 -1.26 -4.74 118.95 118.89 2jnf s ARG 30 Ca 0.00 -1.81 -0.04 0.00 0.00 0.00 0.00 55.73 53.88 2jnf s ARG 30 Cb 0.00 -2.12 -0.03 0.00 0.00 0.00 0.00 34.95 32.80 2jnf s ARG 30 CO 0.00 -0.26 -0.02 0.54 0.00 0.00 0.00 175.30 175.56 2jnf s VAL 31 N -2.61 4.06 0.39 3.52 0.11 -0.00 0.15 120.40 126.02 2jnf s VAL 31 Ca 0.41 -0.30 -0.27 0.00 -2.93 0.00 0.00 61.98 58.89 2jnf s VAL 31 Cb 0.00 -2.79 -0.11 0.00 -1.53 0.00 0.00 36.38 31.95 2jnf s VAL 31 CO 0.23 0.48 1.33 -0.24 -3.33 0.00 0.00 175.10 173.58 2jnf n SER 32 N 3.58 2.92 0.28 3.54 2.88 -1.26 -0.46 113.62 125.09 2jnf n SER 32 Ca -0.17 1.16 0.18 0.00 -1.33 0.00 0.00 58.87 58.71 2jnf n SER 32 Cb 0.52 -1.53 0.78 0.00 -0.75 0.00 0.00 64.21 63.24 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 2.41 0.00 0.00 2.46 1.35 -0.70 0.67 112.91 119.10 2jnf h THR 33 Ca -0.48 -0.36 -0.03 0.00 -0.55 0.00 0.00 66.41 64.99 2jnf h THR 33 Cb 1.28 1.32 -0.00 0.00 -1.73 0.00 0.00 68.15 69.02 2jnf h THR 33 CO 0.62 0.00 -0.14 0.44 -0.25 0.00 0.00 175.52 176.18 2jnf h ASP 34 N 0.00 0.00 0.74 5.36 3.32 -1.90 -3.07 116.42 120.86 2jnf h ASP 34 Ca 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2jnf h ASP 34 Cb 0.38 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 2jnf h ASP 34 CO 0.00 0.14 -1.30 0.00 -1.72 0.00 0.00 179.24 176.36 2jnf n GLN 35 N -3.18 0.62 -0.17 3.56 1.13 0.12 -4.15 117.38 115.32 2jnf n GLN 35 Ca 0.02 0.09 -0.02 0.00 -1.94 0.00 0.00 57.00 55.15 2jnf n GLN 35 Cb 0.50 -1.77 0.07 0.00 0.11 0.00 0.00 30.24 29.16 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 0.80 0.00 5.09 2.04 -1.17 0.29 117.51 124.55 2jnf h ILE 36 Ca -0.06 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 2jnf h ILE 36 Cb 1.17 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2jnf h ILE 36 CO 0.01 0.06 -0.06 1.23 0.00 0.00 0.00 178.15 179.39 2jnf h GLY 37 N 0.33 0.00 0.11 5.37 0.00 -1.72 0.23 103.07 107.39 2jnf h GLY 37 Ca 0.25 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.58 2jnf h GLY 37 CO -0.27 0.00 -0.03 -2.22 0.00 0.00 0.00 176.54 174.02 2jnf h ILE 38 N 0.00 0.88 -0.75 2.60 2.04 -1.08 -3.24 117.51 117.96 2jnf h ILE 38 Ca -0.00 -1.51 -0.01 0.00 1.00 0.00 0.00 64.86 64.34 2jnf h ILE 38 Cb 0.30 1.62 -0.04 0.00 -0.74 0.00 0.00 36.82 37.96 2jnf h ILE 38 CO 0.01 0.28 0.44 0.40 0.00 0.00 0.00 178.15 179.28 2jnf h ILE 39 N -0.96 1.21 0.00 -0.67 2.04 -0.23 0.24 117.51 119.14 2jnf h ILE 39 Ca -0.01 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 2jnf h ILE 39 Cb 0.51 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2jnf h ILE 39 CO 0.01 0.23 -0.01 -0.07 0.00 0.00 0.00 178.15 178.31 2jnf h LEU 40 N 1.04 0.00 0.22 1.44 4.07 -0.70 0.42 115.31 121.81 2jnf h LEU 40 Ca 0.27 0.00 -0.34 0.00 0.08 0.00 0.00 57.88 57.89 2jnf h LEU 40 Cb -0.02 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.74 2jnf h LEU 40 CO -0.05 0.01 -1.60 -0.08 -1.08 0.00 0.00 178.44 175.64 2jnf h GLU 41 N 0.00 0.47 -0.13 1.13 4.81 -0.69 0.34 114.58 120.51 2jnf h GLU 41 Ca -0.00 -0.80 -0.02 0.00 -0.13 0.00 0.00 59.36 58.41 2jnf h GLU 41 Cb 0.03 0.30 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2jnf h GLU 41 CO 0.00 1.38 -0.02 -0.39 -0.73 0.00 0.00 179.01 179.25 2jnf h VAL 42 N 0.13 1.10 -0.01 0.32 -1.51 0.10 -0.72 116.25 115.66 2jnf h VAL 42 Ca -0.29 -0.40 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 2jnf h VAL 42 Cb 2.14 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 32.33 2jnf h VAL 42 CO 0.23 0.13 -0.41 0.18 -1.23 0.00 0.00 177.57 176.47 2jnf n LEU 43 N -4.40 1.11 -2.77 4.19 4.77 0.13 -4.97 117.00 115.05 2jnf n LEU 43 Ca -0.01 -0.32 -0.18 0.00 -0.03 0.00 0.00 56.01 55.47 2jnf n LEU 43 Cb 0.17 -0.11 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 2jnf n LEU 43 CO 0.36 0.22 0.17 0.61 -1.33 0.00 0.00 177.39 177.41 2jnf n GLY 44 N 1.40 -0.18 0.00 -0.72 0.00 -0.28 -4.97 105.19 100.45 2jnf n GLY 44 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -4.37 0.00 -1.28 -0.61 -5.35 0.12 -5.01 119.36 102.86 2jnf n ILE 45 Ca -0.00 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.17 2jnf n ILE 45 Cb 0.55 -0.50 0.24 0.00 -1.74 0.00 0.00 39.64 38.20 2jnf n ILE 45 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 2jnf s GLN 46 N 0.00 -1.10 0.06 6.28 2.00 -1.17 -4.99 119.66 120.74 2jnf s GLN 46 Ca 0.00 -0.28 0.01 0.00 -2.00 0.00 0.00 55.36 53.09 2jnf s GLN 46 Cb 0.00 -1.63 0.01 0.00 0.80 0.00 0.00 33.01 32.19 2jnf s GLN 46 CO 0.00 -3.59 0.07 1.04 -0.50 0.00 0.00 175.29 172.31 2jnf n GLN 47 N -4.63 1.05 -0.44 1.67 6.02 -1.26 -4.55 117.38 115.24 2jnf n GLN 47 Ca 0.16 -0.33 -0.29 0.00 -0.01 0.00 0.00 57.00 56.52 2jnf n GLN 47 Cb 0.60 -0.01 0.27 0.00 1.02 0.00 0.00 30.24 32.12 2jnf n GLN 47 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2jnf n THR 48 N -1.03 0.00 -0.23 5.09 5.66 -1.26 -4.40 114.28 118.12 2jnf n THR 48 Ca 0.01 -0.13 0.19 0.00 -3.05 0.00 0.00 64.05 61.07 2jnf n THR 48 Cb 0.06 -1.03 0.52 0.00 -1.55 0.00 0.00 70.33 68.34 2jnf n THR 48 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 2jnf h LYS 49 N 0.00 0.37 -0.99 1.09 1.57 -1.97 0.12 116.57 116.75 2jnf h LYS 49 Ca -0.38 -0.02 0.17 0.00 -1.87 0.00 0.00 60.65 58.54 2jnf h LYS 49 Cb 1.26 -0.08 -0.10 0.00 0.08 0.00 0.00 32.23 33.38 2jnf h LYS 49 CO 0.24 0.25 0.60 0.77 -0.57 0.00 0.00 179.45 180.74 2jnf h SER 50 N 0.38 0.81 0.60 0.86 0.02 -2.01 0.17 113.55 114.38 2jnf h SER 50 Ca 0.45 0.08 -0.28 0.00 -0.84 0.00 0.00 61.79 61.21 2jnf h SER 50 Cb 1.15 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 2jnf h SER 50 CO -0.16 0.33 -1.33 0.74 -1.14 0.00 0.00 176.83 175.27 2jnf h THR 51 N 0.82 1.38 0.00 -2.27 2.02 -1.06 -3.31 112.91 110.49 2jnf h THR 51 Ca 0.55 -3.00 -0.04 0.00 0.77 0.00 0.00 66.41 64.69 2jnf h THR 51 Cb 0.77 2.86 -0.01 0.00 -1.74 0.00 0.00 68.15 70.04 2jnf h THR 51 CO -0.35 0.86 -0.17 0.40 0.37 0.00 0.00 175.52 176.63 2jnf h ILE 52 N 0.06 0.86 -0.48 3.11 1.08 -0.40 -1.20 117.51 120.55 2jnf h ILE 52 Ca -0.16 -0.65 0.07 0.00 -0.39 0.00 0.00 64.86 63.72 2jnf h ILE 52 Cb 1.97 1.38 -0.03 0.00 -3.07 0.00 0.00 36.82 37.07 2jnf h ILE 52 CO 0.18 0.17 0.32 0.03 -0.69 0.00 0.00 178.15 178.16 2jnf h ARG 53 N 0.00 0.35 -0.04 2.37 2.47 -0.85 0.13 114.38 118.81 2jnf h ARG 53 Ca -0.00 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.69 2jnf h ARG 53 Cb 0.37 -0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 28.61 2jnf h ARG 53 CO 0.02 0.23 0.00 1.96 0.56 0.00 0.00 179.97 182.75 2jnf h GLN 54 N 0.36 0.06 -0.15 0.04 1.08 -1.41 -0.43 115.11 114.67 2jnf h GLN 54 Ca 0.21 -0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.44 2jnf h GLN 54 Cb 0.38 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.75 2jnf h GLN 54 CO -0.05 0.33 -0.19 -0.07 -0.95 0.00 0.00 178.83 177.90 2jnf h LEU 55 N -0.21 -0.58 -0.41 1.46 -0.00 -1.28 -0.07 115.31 114.22 2jnf h LEU 55 Ca 0.01 0.10 -0.02 0.00 -0.00 0.00 0.00 57.88 57.97 2jnf h LEU 55 Cb 0.30 0.27 -0.02 0.00 -0.00 0.00 0.00 40.66 41.21 2jnf h LEU 55 CO 0.00 -0.23 0.16 0.40 -0.00 0.00 0.00 178.44 178.77 2jnf h ILE 56 N -0.23 1.20 -0.13 1.22 2.04 -1.00 0.22 117.51 120.82 2jnf h ILE 56 Ca 0.10 -0.62 0.01 0.00 1.00 0.00 0.00 64.86 65.36 2jnf h ILE 56 Cb 0.38 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 2jnf h ILE 56 CO -0.28 0.22 0.09 -0.78 0.00 0.00 0.00 178.15 177.40 2jnf h ASP 57 N 0.53 0.11 0.00 1.72 3.58 -0.74 0.29 116.42 121.90 2jnf h ASP 57 Ca 0.14 -0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.50 2jnf h ASP 57 Cb 0.19 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 2jnf h ASP 57 CO -0.01 0.08 -0.48 -0.08 -2.88 0.00 0.00 179.24 175.86 2jnf h GLU 58 N 0.13 0.00 0.00 0.28 4.81 -0.40 -3.33 114.58 116.07 2jnf h GLU 58 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2jnf h GLU 58 Cb 0.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2jnf h GLU 58 CO -0.01 0.83 -0.91 1.19 -0.73 0.00 0.00 179.01 179.38 2jnf n PHE 59 N -4.56 0.66 -3.21 0.92 3.72 0.72 -4.28 117.46 111.43 2jnf n PHE 59 Ca -0.17 0.19 -0.24 0.00 -0.05 0.00 0.00 57.45 57.18 2jnf n PHE 59 Cb 0.49 -0.74 -0.06 0.00 -0.94 0.00 0.00 39.48 38.23 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 -2.33 2.34 0.20 4.37 2.03 0.10 -4.87 116.55 118.40 2jnf n ASP 60 Ca 0.01 -3.20 0.15 0.00 0.52 0.00 0.00 54.79 52.27 2jnf n ASP 60 Cb 0.49 -0.63 0.59 0.00 -0.72 0.00 0.00 41.12 40.85 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 3.64 0.00 0.00 -0.67 0.11 -1.68 -2.93 132.00 130.47 2jnf h PRO 61 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2jnf h PRO 61 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.86 2jnf h PRO 61 CO 0.66 0.00 -0.01 0.74 -0.21 0.00 0.00 178.00 179.18 2jnf h PHE 62 N 0.00 0.00 -3.46 0.65 0.04 -1.91 -3.47 116.94 108.78 2jnf h PHE 62 Ca 0.00 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.57 2jnf h PHE 62 Cb 0.43 0.00 0.07 0.00 2.20 0.00 0.00 35.95 38.66 2jnf h PHE 62 CO 0.00 0.00 -0.34 0.41 -0.60 0.00 0.00 178.31 177.78 2jnf n GLY 63 N 1.19 0.19 0.18 -1.45 0.00 -1.11 -4.95 105.19 99.24 2jnf n GLY 63 Ca 0.05 -0.21 -0.19 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.33 0.79 0.00 1.61 -0.73 -1.92 -3.48 115.58 110.52 2jnf h ASN 64 Ca -0.29 -0.75 0.00 0.00 1.87 0.00 0.00 56.30 57.13 2jnf h ASN 64 Cb 1.18 -0.24 0.00 0.00 0.27 0.00 0.00 38.32 39.53 2jnf h ASN 64 CO 0.28 1.44 0.00 0.61 -0.37 0.00 0.00 177.43 179.39 2jnf n GLY 65 N 1.10 1.63 2.97 1.57 0.00 -1.26 -5.06 105.19 106.14 2jnf n GLY 65 Ca -0.11 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 2jnf n GLY 65 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2jnf s ASP 66 N -0.47 0.28 0.01 1.61 -4.77 -1.26 0.09 116.67 112.16 2jnf s ASP 66 Ca 0.00 -0.43 0.05 0.00 -3.30 0.00 0.00 52.55 48.87 2jnf s ASP 66 Cb 0.00 0.08 -0.03 0.00 -1.09 0.00 0.00 42.92 41.87 2jnf s ASP 66 CO 0.00 -0.24 -0.14 0.27 0.70 0.00 0.00 175.17 175.76 2jnf s ILE 67 N -1.22 3.07 1.01 2.11 -4.36 0.39 -4.77 121.20 117.43 2jnf s ILE 67 Ca -0.13 -0.97 -0.15 0.00 -0.26 0.00 0.00 60.65 59.14 2jnf s ILE 67 Cb -0.08 -2.28 0.20 0.00 1.25 0.00 0.00 42.46 41.54 2jnf s ILE 67 CO -0.01 0.41 1.17 1.51 0.24 0.00 0.00 174.94 178.27 2jnf s ASP 68 N -1.26 2.62 0.26 4.36 1.47 -1.26 -0.82 116.67 122.04 2jnf s ASP 68 Ca 0.15 0.72 -0.03 0.00 1.18 0.00 0.00 52.55 54.56 2jnf s ASP 68 Cb -0.11 -1.08 0.34 0.00 -0.34 0.00 0.00 42.92 41.73 2jnf s ASP 68 CO 0.05 -3.08 1.82 0.15 0.68 0.00 0.00 175.17 174.78 2jnf h PHE 69 N -1.87 0.95 -0.66 2.11 3.57 -1.98 -1.70 116.94 117.37 2jnf h PHE 69 Ca -0.48 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 60.93 2jnf h PHE 69 Cb 1.30 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 39.73 2jnf h PHE 69 CO -0.74 0.77 0.36 0.22 -2.23 0.00 0.00 178.31 176.69 2jnf h ASP 70 N 0.90 0.83 -0.47 0.41 3.58 -1.98 1.36 116.42 121.05 2jnf h ASP 70 Ca 0.20 -0.10 -0.06 0.00 0.42 0.00 0.00 57.03 57.49 2jnf h ASP 70 Cb 0.27 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 2jnf h ASP 70 CO -0.01 0.69 0.05 0.28 -2.88 0.00 0.00 179.24 177.37 2jnf h SER 71 N 0.91 0.77 0.25 2.28 0.02 -1.85 -1.59 113.55 114.34 2jnf h SER 71 Ca 0.23 -0.28 -0.11 0.00 -0.84 0.00 0.00 61.79 60.80 2jnf h SER 71 Cb 0.05 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 2jnf h SER 71 CO -0.04 0.85 -0.42 0.15 -1.14 0.00 0.00 176.83 176.23 2jnf h PHE 72 N 0.66 0.26 -0.48 3.45 3.57 -0.66 -2.32 116.94 121.42 2jnf h PHE 72 Ca 0.14 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 2jnf h PHE 72 Cb 0.43 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 2jnf h PHE 72 CO 0.03 0.61 0.19 -0.22 -2.23 0.00 0.00 178.31 176.69 2jnf h LYS 73 N 0.19 0.72 -0.80 1.11 3.64 0.21 0.25 116.57 121.89 2jnf h LYS 73 Ca 0.02 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 2jnf h LYS 73 Cb 0.83 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.50 2jnf h LYS 73 CO 0.06 0.65 0.39 0.82 -2.27 0.00 0.00 179.45 179.10 2jnf h ILE 74 N 0.63 1.25 0.01 2.00 2.04 -1.11 0.48 117.51 122.81 2jnf h ILE 74 Ca 0.16 -0.69 0.01 0.00 1.00 0.00 0.00 64.86 65.34 2jnf h ILE 74 Cb 0.20 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 2jnf h ILE 74 CO -0.01 0.30 -0.07 0.40 0.00 0.00 0.00 178.15 178.76 2jnf h ILE 75 N 1.13 0.81 -0.72 -0.67 2.04 -0.86 -1.75 117.51 117.50 2jnf h ILE 75 Ca 0.28 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.11 2jnf h ILE 75 Cb 0.11 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 2jnf h ILE 75 CO -0.04 0.00 0.34 1.23 0.00 0.00 0.00 178.15 179.68 2jnf h GLY 76 N -0.14 1.12 2.00 5.37 0.00 -0.09 -2.79 103.07 108.55 2jnf h GLY 76 Ca 0.03 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.76 2jnf h GLY 76 CO -0.07 0.53 -0.15 0.00 0.00 0.00 0.00 176.54 176.85 2jnf h ALA 77 N 1.16 1.32 0.00 3.60 0.00 0.24 0.31 119.26 125.89 2jnf h ALA 77 Ca 0.25 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2jnf h ALA 77 Cb 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2jnf h ALA 77 CO -0.03 0.19 -0.83 2.89 0.00 0.00 0.00 179.25 181.47 2jnf n ARG 78 N -3.74 0.17 0.00 0.00 1.85 -0.68 -4.52 116.66 109.74 2jnf n ARG 78 Ca -0.02 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.84 2jnf n ARG 78 Cb 0.26 -1.56 0.00 0.00 -1.05 0.00 0.00 32.46 30.11 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 -1.78 0.00 0.00 2.89 3.72 -0.76 -4.84 117.46 116.69 2jnf n PHE 79 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 2jnf n PHE 79 Cb 0.39 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 2jnf n PHE 79 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2jnf n LEU 80 N -2.33 0.00 -4.21 4.37 7.99 0.10 -4.84 117.00 118.09 2jnf n LEU 80 Ca 0.00 0.68 -0.33 0.00 -0.01 0.00 0.00 56.01 56.35 2jnf n LEU 80 Cb 0.48 -0.18 -0.05 0.00 -0.11 0.00 0.00 43.42 43.56 2jnf n LEU 80 CO 0.00 -0.18 -0.22 0.61 -1.51 0.00 0.00 177.39 176.09 2jnf n GLY 81 N -0.86 -0.29 0.55 -0.72 0.00 -1.26 -4.80 105.19 97.80 2jnf n GLY 81 Ca 0.00 0.14 0.01 0.00 0.00 0.00 0.00 46.02 46.17 2jnf n GLY 81 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2jnf n GLU 82 N -4.39 1.36 -2.57 1.61 0.28 -1.26 -4.73 120.64 110.94 2jnf n GLU 82 Ca -0.13 -0.32 -0.41 0.00 -0.16 0.00 0.00 57.16 56.14 2jnf n GLU 82 Cb 0.59 -1.48 -0.03 0.00 1.43 0.00 0.00 31.44 31.96 2jnf n GLU 82 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 2jnf s GLU 83 N -1.32 3.57 -0.57 3.44 2.12 -1.26 -4.82 118.70 119.86 2jnf s GLU 83 Ca 0.06 -1.08 0.05 0.00 0.36 0.00 0.00 54.97 54.36 2jnf s GLU 83 Cb 0.04 -5.28 0.19 0.00 0.26 0.00 0.00 34.13 29.34 2jnf s GLU 83 CO 0.02 -2.20 0.47 0.28 -0.54 0.00 0.00 175.26 173.30 2jnf n VAL 84 N 6.83 0.49 -3.08 3.70 0.31 -1.26 -5.10 118.33 120.22 2jnf n VAL 84 Ca 0.31 -4.32 -0.39 0.00 -0.01 0.00 0.00 64.34 59.93 2jnf n VAL 84 Cb 0.51 -1.97 -0.06 0.00 -0.91 0.00 0.00 33.84 31.41 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 -1.02 7.25 0.44 4.52 2.47 -1.26 -4.96 114.94 122.37 2jnf s ASN 85 Ca 0.30 1.49 0.24 0.00 0.42 0.00 0.00 52.86 55.31 2jnf s ASN 85 Cb 0.03 -2.45 0.69 0.00 -1.45 0.00 0.00 41.25 38.07 2jnf s ASN 85 CO -0.16 0.20 1.73 -0.65 -3.72 0.00 0.00 177.10 174.50 2jnf h PRO 86 N 4.64 0.00 -0.67 0.43 0.11 -1.99 -2.77 132.00 131.76 2jnf h PRO 86 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2jnf h PRO 86 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2jnf h PRO 86 CO 0.66 0.16 0.00 0.39 -0.21 0.00 0.00 178.00 179.00 2jnf n GLU 87 N -3.21 4.01 -2.64 1.05 4.71 -1.26 -4.62 120.64 118.68 2jnf n GLU 87 Ca 0.02 -2.47 -0.43 0.00 -0.01 0.00 0.00 57.16 54.27 2jnf n GLU 87 Cb 0.49 -2.08 -0.02 0.00 -1.01 0.00 0.00 31.44 28.82 2jnf n GLU 87 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 2jnf s GLN 88 N -2.34 4.16 -0.60 3.49 -2.07 -1.05 -3.03 119.66 118.22 2jnf s GLN 88 Ca 0.43 1.24 -0.02 0.00 -1.82 0.00 0.00 55.36 55.19 2jnf s GLN 88 Cb 0.32 -3.69 0.01 0.00 -1.09 0.00 0.00 33.01 28.56 2jnf s GLN 88 CO 0.13 -0.77 0.06 0.00 -1.32 0.00 0.00 175.29 173.39 2jnf n MET 89 N 6.61 -2.64 -3.97 9.60 0.00 -1.26 -4.93 117.12 120.52 2jnf n MET 89 Ca 0.12 0.29 -0.10 0.00 0.00 0.00 0.00 57.70 58.01 2jnf n MET 89 Cb 0.46 -4.85 -0.12 0.00 0.00 0.00 0.00 33.22 28.72 2jnf n MET 89 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 2jnf s GLN 90 N -5.17 0.28 -1.39 3.17 -0.21 -1.17 -4.78 119.66 110.40 2jnf s GLN 90 Ca 0.06 -0.52 0.00 0.00 0.02 0.00 0.00 55.36 54.92 2jnf s GLN 90 Cb -0.03 0.05 0.00 0.00 1.00 0.00 0.00 33.01 34.02 2jnf s GLN 90 CO 0.07 -0.03 0.00 1.04 -2.12 0.00 0.00 175.29 174.25 2jnf n GLN 91 N 1.84 -1.86 0.29 2.91 6.02 -1.26 -4.50 117.38 120.82 2jnf n GLN 91 Ca -0.22 0.78 0.20 0.00 -0.01 0.00 0.00 57.00 57.75 2jnf n GLN 91 Cb 0.56 -5.32 1.02 0.00 1.02 0.00 0.00 30.24 27.52 2jnf n GLN 91 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2jnf h GLU 92 N 0.00 0.00 -0.60 -1.09 5.08 -1.86 -2.60 114.58 113.51 2jnf h GLU 92 Ca -0.35 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.18 2jnf h GLU 92 Cb 1.20 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 2jnf h GLU 92 CO 0.44 0.00 0.50 -0.07 -1.00 0.00 0.00 179.01 178.88 2jnf h LEU 93 N 0.00 0.00 -0.03 1.33 -0.00 -1.96 -0.27 115.31 114.38 2jnf h LEU 93 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.90 2jnf h LEU 93 Cb 0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.68 2jnf h LEU 93 CO 0.00 0.00 -0.10 0.03 -0.00 0.00 0.00 178.44 178.37 2jnf h ARG 94 N 0.00 -0.16 0.00 1.13 2.47 -1.85 0.10 114.38 116.08 2jnf h ARG 94 Ca 0.28 0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.98 2jnf h ARG 94 Cb 1.28 0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 29.63 2jnf h ARG 94 CO -0.00 -0.10 -0.15 0.93 0.56 0.00 0.00 179.97 181.20 2jnf h GLU 95 N -0.16 0.00 0.00 0.04 5.08 -1.35 -2.93 114.58 115.26 2jnf h GLU 95 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2jnf h GLU 95 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2jnf h GLU 95 CO -0.13 0.15 0.00 0.00 -1.00 0.00 0.00 179.01 178.04 2jnf n ALA 96 N -2.14 2.14 -0.03 3.43 0.00 -0.46 -3.26 120.51 120.19 2jnf n ALA 96 Ca 0.03 -0.02 -0.11 0.00 0.00 0.00 0.00 53.44 53.34 2jnf n ALA 96 Cb 0.54 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.50 2jnf n ALA 96 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2jnf h PHE 97 N 0.00 0.22 0.00 0.00 0.04 -0.61 -0.90 116.94 115.68 2jnf h PHE 97 Ca 0.00 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 2jnf h PHE 97 Cb 0.60 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.68 2jnf h PHE 97 CO 0.00 0.21 -0.13 0.00 -0.60 0.00 0.00 178.31 177.78 2jnf h ARG 98 N 0.17 0.00 -0.38 1.51 3.08 -1.73 0.45 114.38 117.48 2jnf h ARG 98 Ca 0.06 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.99 2jnf h ARG 98 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2jnf h ARG 98 CO -0.01 0.13 -0.23 1.25 -1.07 0.00 0.00 179.97 180.05 2jnf h LEU 99 N 0.00 0.76 -0.75 3.04 5.85 -1.33 -3.22 115.31 119.67 2jnf h LEU 99 Ca -0.00 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.44 2jnf h LEU 99 Cb 0.46 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.28 2jnf h LEU 99 CO 0.02 0.97 -0.45 -1.22 -0.34 0.00 0.00 178.44 177.41 2jnf n TYR 100 N -4.11 0.00 -2.49 1.25 4.01 -0.43 -4.83 117.16 110.56 2jnf n TYR 100 Ca 0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.34 2jnf n TYR 100 Cb 0.43 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.45 2jnf n TYR 100 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2jnf s ASP 101 N -2.16 6.52 0.25 7.72 2.15 0.15 -4.71 116.67 126.59 2jnf s ASP 101 Ca 0.13 -2.29 -0.06 0.00 0.43 0.00 0.00 52.55 50.76 2jnf s ASP 101 Cb 0.14 -2.58 0.26 0.00 -0.30 0.00 0.00 42.92 40.44 2jnf s ASP 101 CO 0.50 -1.50 1.90 0.11 -0.17 0.00 0.00 175.17 176.01 2jnf h LYS 102 N 8.00 1.27 -0.16 4.34 6.56 -1.87 -3.27 116.57 131.43 2jnf h LYS 102 Ca 0.40 -0.11 -0.18 0.00 -1.06 0.00 0.00 60.65 59.70 2jnf h LYS 102 Cb 0.89 -0.27 -0.00 0.00 -0.57 0.00 0.00 32.23 32.27 2jnf h LYS 102 CO 1.42 0.88 -0.64 0.93 -2.06 0.00 0.00 179.45 179.97 2jnf h GLU 103 N 1.29 0.61 -0.35 3.15 4.39 -1.92 -3.48 114.58 118.27 2jnf h GLU 103 Ca 0.34 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.61 2jnf h GLU 103 Cb -0.07 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2jnf h GLU 103 CO -0.07 1.05 0.00 0.41 -1.16 0.00 0.00 179.01 179.25 2jnf n GLY 104 N 0.44 0.57 0.00 -3.84 0.00 -1.23 -5.02 105.19 96.10 2jnf n GLY 104 Ca -0.04 -0.10 0.04 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.12 2.47 0.00 1.61 3.02 -1.26 -4.97 115.26 116.01 2jnf n ASN 105 Ca 0.00 -0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 2jnf n ASN 105 Cb 0.10 1.25 0.00 0.00 -0.61 0.00 0.00 39.78 40.51 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 1.83 3.01 3.68 7.41 0.00 -1.26 -4.99 105.19 114.86 2jnf n GLY 106 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.77 2.95 -0.10 1.61 2.02 -1.26 -4.47 117.35 116.32 2jnf s TYR 107 Ca 0.00 -0.06 -0.18 0.00 -0.37 0.00 0.00 57.07 56.46 2jnf s TYR 107 Cb 0.00 -1.50 -0.04 0.00 -0.40 0.00 0.00 41.96 40.01 2jnf s TYR 107 CO 0.00 0.48 0.48 0.96 -1.57 0.00 0.00 175.55 175.90 2jnf s ILE 108 N -1.38 5.16 1.03 2.71 -4.36 -0.74 -4.79 121.20 118.82 2jnf s ILE 108 Ca 0.26 0.96 -0.13 0.00 -0.26 0.00 0.00 60.65 61.48 2jnf s ILE 108 Cb -0.11 -3.81 0.20 0.00 1.25 0.00 0.00 42.46 39.99 2jnf s ILE 108 CO 0.18 0.35 1.09 -0.44 0.24 0.00 0.00 174.94 176.36 2jnf s SER 109 N 0.43 2.38 0.50 4.36 0.01 -1.26 0.08 113.70 120.20 2jnf s SER 109 Ca 0.26 1.17 0.28 0.00 1.31 0.00 0.00 55.95 58.96 2jnf s SER 109 Cb -0.15 -1.84 1.30 0.00 0.21 0.00 0.00 66.02 65.54 2jnf s SER 109 CO 0.11 -3.28 1.99 0.71 0.41 0.00 0.00 173.24 173.18 2jnf h THR 110 N -1.99 0.47 0.04 1.44 1.35 -1.95 -1.58 112.91 110.70 2jnf h THR 110 Ca -0.56 -0.72 -0.00 0.00 -0.55 0.00 0.00 66.41 64.58 2jnf h THR 110 Cb 1.34 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.26 2jnf h THR 110 CO 0.57 0.14 -0.02 0.44 -0.25 0.00 0.00 175.52 176.40 2jnf h ASP 111 N 0.00 -0.05 0.16 5.36 3.32 -1.93 -1.53 116.42 121.75 2jnf h ASP 111 Ca -0.00 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 56.78 2jnf h ASP 111 Cb 0.49 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 2jnf h ASP 111 CO 0.02 0.08 -0.59 1.62 -1.72 0.00 0.00 179.24 178.65 2jnf h VAL 112 N -0.18 1.35 -1.00 -1.35 3.04 -1.84 -2.79 116.25 113.47 2jnf h VAL 112 Ca -0.01 -1.89 0.06 0.00 -1.01 0.00 0.00 66.70 63.86 2jnf h VAL 112 Cb 0.16 1.88 -0.07 0.00 -2.01 0.00 0.00 31.29 31.26 2jnf h VAL 112 CO 0.01 0.57 0.65 -0.03 -1.01 0.00 0.00 177.57 177.76 2jnf h MET 113 N 0.33 1.15 0.11 4.17 1.85 -1.21 -1.07 114.93 120.26 2jnf h MET 113 Ca -0.00 -0.07 0.02 0.00 -0.61 0.00 0.00 59.70 59.04 2jnf h MET 113 Cb 1.12 -0.26 -0.04 0.00 0.43 0.00 0.00 31.60 32.85 2jnf h MET 113 CO 0.10 0.76 -0.39 0.00 -0.40 0.00 0.00 176.91 176.98 2jnf h ARG 114 N 1.18 -0.59 -0.03 0.39 3.08 -1.00 -1.76 114.38 115.65 2jnf h ARG 114 Ca 0.43 0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.47 2jnf h ARG 114 Cb 0.16 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2jnf h ARG 114 CO -0.17 -0.40 -0.25 1.05 -1.07 0.00 0.00 179.97 179.14 2jnf h GLU 115 N -0.62 0.04 -0.18 0.04 4.11 -1.35 -2.01 114.58 114.62 2jnf h GLU 115 Ca 0.03 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.43 2jnf h GLU 115 Cb 0.65 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2jnf h GLU 115 CO -0.23 0.29 0.07 0.82 0.07 0.00 0.00 179.01 180.03 2jnf h ILE 116 N 0.04 1.17 0.46 -1.06 2.04 -0.87 -2.08 117.51 117.21 2jnf h ILE 116 Ca 0.01 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 2jnf h ILE 116 Cb 0.46 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 2jnf h ILE 116 CO 0.03 0.16 -0.29 -0.07 0.00 0.00 0.00 178.15 177.98 2jnf h LEU 117 N 0.13 -0.73 -1.23 1.44 3.38 -0.84 -2.40 115.31 115.07 2jnf h LEU 117 Ca 0.06 0.04 0.25 0.00 0.09 0.00 0.00 57.88 58.32 2jnf h LEU 117 Cb 0.19 0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.05 2jnf h LEU 117 CO -0.00 -0.45 0.64 0.00 0.09 0.00 0.00 178.44 178.71 2jnf h ALA 118 N -0.22 2.04 0.49 1.53 0.00 -1.37 0.71 119.26 122.44 2jnf h ALA 118 Ca -0.05 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2jnf h ALA 118 Cb 0.59 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2jnf h ALA 118 CO 0.05 -0.46 -0.24 1.49 0.00 0.00 0.00 179.25 180.09 2jnf h GLU 119 N 0.49 -0.64 -0.32 0.00 4.57 -0.94 -2.65 114.58 115.09 2jnf h GLU 119 Ca 0.60 0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 58.77 2jnf h GLU 119 Cb 1.35 0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 30.07 2jnf h GLU 119 CO -0.35 -0.34 -0.03 -0.07 -1.18 0.00 0.00 179.01 177.04 2jnf h LEU 120 N -0.93 0.58 -7.33 1.64 -0.00 -0.90 -3.37 115.31 105.00 2jnf h LEU 120 Ca -0.07 -0.33 -0.64 0.00 -0.00 0.00 0.00 57.88 56.84 2jnf h LEU 120 Cb 0.60 -0.16 -0.41 0.00 -0.00 0.00 0.00 40.66 40.69 2jnf h LEU 120 CO 0.11 0.77 -0.60 -1.81 -0.00 0.00 0.00 178.44 176.92 2jnf s ASP 121 N -6.13 4.48 0.00 -0.43 1.01 0.24 -4.93 116.67 110.91 2jnf s ASP 121 Ca -0.13 -3.18 0.00 0.00 0.71 0.00 0.00 52.55 49.95 2jnf s ASP 121 Cb 0.09 -1.66 0.00 0.00 1.01 0.00 0.00 42.92 42.36 2jnf s ASP 121 CO 0.78 -0.21 0.52 -1.84 0.21 0.00 0.00 175.17 174.63 2jnf n GLU 122 N 2.89 0.80 -0.00 8.23 0.28 -1.00 -2.23 120.64 129.61 2jnf n GLU 122 Ca 0.08 0.00 0.09 0.00 -0.16 0.00 0.00 57.16 57.17 2jnf n GLU 122 Cb 0.33 -1.31 -0.12 0.00 1.43 0.00 0.00 31.44 31.77 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 0.25 0.00 -2.86 3.84 -2.24 -1.26 -4.88 114.28 107.13 2jnf n THR 123 Ca 0.00 -0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 2jnf n THR 123 Cb 0.26 0.68 -0.04 0.00 -2.10 0.00 0.00 70.33 69.13 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 -3.36 4.05 0.91 3.22 2.01 -0.95 -5.05 118.68 119.51 2jnf s LEU 124 Ca 0.02 0.63 -0.13 0.00 0.01 0.00 0.00 54.13 54.66 2jnf s LEU 124 Cb 0.13 -3.19 0.14 0.00 0.01 0.00 0.00 46.19 43.29 2jnf s LEU 124 CO 0.76 -0.75 1.18 -0.44 1.01 0.00 0.00 176.35 178.12 2jnf s SER 125 N 1.75 3.53 0.22 2.29 0.01 -1.26 -4.70 113.70 115.53 2jnf s SER 125 Ca 0.36 0.74 -0.08 0.00 1.31 0.00 0.00 55.95 58.28 2jnf s SER 125 Cb -0.13 -1.16 0.27 0.00 0.21 0.00 0.00 66.02 65.20 2jnf s SER 125 CO 0.16 -2.52 1.82 0.77 0.41 0.00 0.00 173.24 173.88 2jnf h SER 126 N -1.48 0.61 -0.45 2.44 4.64 -1.99 0.28 113.55 117.61 2jnf h SER 126 Ca -0.47 0.03 -0.14 0.00 -0.47 0.00 0.00 61.79 60.73 2jnf h SER 126 Cb 1.31 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 2jnf h SER 126 CO 0.56 0.39 -0.28 -0.33 -0.87 0.00 0.00 176.83 176.31 2jnf h GLU 127 N 0.75 0.98 -0.78 4.77 4.39 -2.00 -2.62 114.58 120.07 2jnf h GLU 127 Ca 0.32 -0.45 0.02 0.00 0.34 0.00 0.00 59.36 59.58 2jnf h GLU 127 Cb 0.19 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.79 2jnf h GLU 127 CO -0.18 1.13 0.51 -0.44 -1.16 0.00 0.00 179.01 178.86 2jnf h ASP 128 N 0.82 0.86 -0.76 1.42 5.19 -1.61 -1.58 116.42 120.77 2jnf h ASP 128 Ca 0.09 -0.01 0.10 0.00 -0.62 0.00 0.00 57.03 56.59 2jnf h ASP 128 Cb 0.87 -0.20 -0.07 0.00 0.18 0.00 0.00 39.33 40.10 2jnf h ASP 128 CO 0.08 0.61 0.40 -0.07 -3.12 0.00 0.00 179.24 177.13 2jnf h LEU 129 N 1.01 0.53 -0.79 1.55 3.38 -0.30 0.11 115.31 120.81 2jnf h LEU 129 Ca 0.30 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.28 2jnf h LEU 129 Cb -0.06 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2jnf h LEU 129 CO -0.09 0.30 0.32 -0.78 0.09 0.00 0.00 178.44 178.28 2jnf h ASP 130 N 0.66 1.08 -0.46 -0.43 3.58 -0.94 0.30 116.42 120.21 2jnf h ASP 130 Ca 0.37 -0.17 -0.13 0.00 0.42 0.00 0.00 57.03 57.53 2jnf h ASP 130 Cb 0.39 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.15 2jnf h ASP 130 CO -0.27 0.96 -0.20 0.00 -2.88 0.00 0.00 179.24 176.85 2jnf h ALA 131 N 1.17 0.65 -0.69 -0.78 0.00 -0.76 -1.89 119.26 116.94 2jnf h ALA 131 Ca 0.26 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.83 2jnf h ALA 131 Cb 0.21 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 2jnf h ALA 131 CO -0.02 0.62 0.42 0.52 0.00 0.00 0.00 179.25 180.79 2jnf h MET 132 N 0.80 0.77 -0.42 0.00 2.86 -0.28 -0.27 114.93 118.38 2jnf h MET 132 Ca 0.11 -0.05 0.08 0.00 -2.06 0.00 0.00 59.70 57.78 2jnf h MET 132 Cb 0.78 -0.17 -0.08 0.00 0.06 0.00 0.00 31.60 32.18 2jnf h MET 132 CO 0.06 0.51 -0.10 0.82 1.06 0.00 0.00 176.91 179.26 2jnf h ILE 133 N 0.79 0.59 -0.69 -1.22 1.08 -0.02 0.73 117.51 118.77 2jnf h ILE 133 Ca 0.29 -0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.79 2jnf h ILE 133 Cb 0.10 0.58 -0.04 0.00 -3.07 0.00 0.00 36.82 34.39 2jnf h ILE 133 CO -0.14 0.00 0.44 -0.78 -0.69 0.00 0.00 178.15 176.98 2jnf h ASP 134 N 0.01 0.73 0.18 1.72 3.58 -0.71 -2.38 116.42 119.54 2jnf h ASP 134 Ca 0.20 -0.01 -0.16 0.00 0.42 0.00 0.00 57.03 57.48 2jnf h ASP 134 Cb 0.31 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 2jnf h ASP 134 CO -0.43 0.51 -0.62 -0.08 -2.88 0.00 0.00 179.24 175.74 2jnf h GLU 135 N 0.87 0.43 0.64 0.28 4.81 0.20 -3.32 114.58 118.48 2jnf h GLU 135 Ca 0.27 -0.30 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 2jnf h GLU 135 Cb -0.01 0.05 0.01 0.00 0.63 0.00 0.00 28.75 29.42 2jnf h GLU 135 CO -0.09 0.92 -0.31 0.82 -0.73 0.00 0.00 179.01 179.62 2jnf h ILE 136 N 0.32 0.15 -1.13 2.32 2.04 0.73 -3.39 117.51 118.54 2jnf h ILE 136 Ca -0.01 -0.34 -0.34 0.00 1.00 0.00 0.00 64.86 65.17 2jnf h ILE 136 Cb 1.16 0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 2jnf h ILE 136 CO 0.11 0.02 0.91 -0.62 0.00 0.00 0.00 178.15 178.57 2jnf s ASP 137 N -4.57 5.01 0.18 1.72 2.15 -0.92 -4.41 116.67 115.83 2jnf s ASP 137 Ca -0.14 -0.18 0.09 0.00 0.43 0.00 0.00 52.55 52.75 2jnf s ASP 137 Cb 0.02 -2.55 -0.03 0.00 -0.30 0.00 0.00 42.92 40.07 2jnf s ASP 137 CO 0.46 -2.75 1.39 0.00 -0.17 0.00 0.00 175.17 174.09 2jnf h ALA 138 N 13.10 0.55 0.00 3.66 0.00 -1.84 -3.26 119.26 131.47 2jnf h ALA 138 Ca -0.05 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.09 2jnf h ALA 138 Cb 1.07 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2jnf h ALA 138 CO 1.19 1.07 -0.59 -3.47 0.00 0.00 0.00 179.25 177.44 2jnf n ASP 139 N -3.46 0.67 -1.22 0.00 2.03 -1.26 -4.93 116.55 108.39 2jnf n ASP 139 Ca -0.00 0.11 -0.11 0.00 0.52 0.00 0.00 54.79 55.30 2jnf n ASP 139 Cb 0.83 0.13 -0.01 0.00 -0.72 0.00 0.00 41.12 41.35 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 1.35 0.13 0.18 0.27 0.00 -1.23 -4.90 105.19 100.99 2jnf n GLY 140 Ca 0.04 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 0.00 0.00 1.61 0.87 -1.91 -3.47 113.55 110.65 2jnf h SER 141 Ca -0.26 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 2jnf h SER 141 Cb 1.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 2jnf h SER 141 CO 0.32 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 177.23 2jnf n GLY 142 N 1.17 2.94 3.48 5.77 0.00 -1.26 -5.01 105.19 112.27 2jnf n GLY 142 Ca 0.04 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.67 2.98 -0.29 2.61 -4.23 -1.26 -4.00 115.64 108.77 2jnf s THR 143 Ca 0.00 -0.97 -0.21 0.00 -1.18 0.00 0.00 61.69 59.33 2jnf s THR 143 Cb 0.00 -2.22 -0.01 0.00 1.34 0.00 0.00 72.50 71.61 2jnf s THR 143 CO 0.00 0.44 0.67 -0.69 -0.54 0.00 0.00 174.62 174.50 2jnf s VAL 144 N -0.86 4.92 0.00 2.29 1.01 0.11 -4.84 120.40 123.03 2jnf s VAL 144 Ca 0.14 1.05 0.00 0.00 0.00 0.00 0.00 61.98 63.17 2jnf s VAL 144 Cb -0.11 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2jnf s VAL 144 CO 0.04 -0.11 0.00 -0.67 0.00 0.00 0.00 175.10 174.36 2jnf n ASP 145 N 5.90 0.00 0.00 3.32 2.03 -1.26 -1.79 116.55 124.75 2jnf n ASP 145 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2jnf n ASP 145 Cb 0.49 0.07 0.00 0.00 -0.72 0.00 0.00 41.12 40.96 2jnf n ASP 145 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 2jnf n PHE 146 N -2.01 0.00 0.86 -0.67 -1.74 -1.26 -3.99 117.46 108.64 2jnf n PHE 146 Ca 0.00 0.00 0.13 0.00 -0.56 0.00 0.00 57.45 57.02 2jnf n PHE 146 Cb 0.00 0.00 0.44 0.00 1.52 0.00 0.00 39.48 41.44 2jnf n PHE 146 CO 0.00 0.00 0.00 0.39 -0.56 0.00 0.00 176.76 176.59 2jnf n GLU 147 N 0.00 0.10 0.41 3.97 1.02 -1.26 -2.51 120.64 122.38 2jnf n GLU 147 Ca 0.00 0.06 -0.18 0.00 -0.02 0.00 0.00 57.16 57.02 2jnf n GLU 147 Cb 0.00 -1.60 -0.09 0.00 -0.02 0.00 0.00 31.44 29.73 2jnf n GLU 147 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2jnf h GLU 148 N 0.00 -1.01 -0.04 3.49 3.07 -1.81 -0.82 114.58 117.45 2jnf h GLU 148 Ca 0.00 0.07 -0.08 0.00 -0.50 0.00 0.00 59.36 58.85 2jnf h GLU 148 Cb 0.59 0.23 0.00 0.00 -0.84 0.00 0.00 28.75 28.73 2jnf h GLU 148 CO 0.00 -0.66 -0.27 0.35 -1.40 0.00 0.00 179.01 177.03 2jnf h PHE 149 N -1.14 0.35 0.00 4.33 3.04 -1.69 -1.51 116.94 120.33 2jnf h PHE 149 Ca -0.11 -0.16 0.00 0.00 3.98 0.00 0.00 57.97 61.68 2jnf h PHE 149 Cb 0.82 -0.05 0.00 0.00 2.56 0.00 0.00 35.95 39.28 2jnf h PHE 149 CO -0.01 0.90 0.00 0.52 -2.02 0.00 0.00 178.31 177.70 2jnf h MET 150 N -0.29 0.00 0.00 1.11 0.00 -1.61 0.55 114.93 114.69 2jnf h MET 150 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 59.70 59.67 2jnf h MET 150 Cb 0.94 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 32.54 2jnf h MET 150 CO 0.06 0.00 -1.61 0.41 0.00 0.00 0.00 176.91 175.76 2jnf n GLY 151 N -1.02 -1.18 0.12 8.32 0.00 -0.31 -3.11 105.19 108.00 2jnf n GLY 151 Ca -0.02 -0.40 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 2jnf n GLY 151 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2jnf n VAL 152 N -2.44 1.57 -0.08 1.61 3.14 -0.59 -3.26 118.33 118.27 2jnf n VAL 152 Ca -0.03 -0.69 -0.22 0.00 -2.96 0.00 0.00 64.34 60.44 2jnf n VAL 152 Cb 0.58 -1.25 -0.12 0.00 -1.06 0.00 0.00 33.84 31.99 2jnf n VAL 152 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 2jnf n MET 153 N -3.18 0.61 -1.90 1.45 0.00 0.09 -4.41 117.12 109.79 2jnf n MET 153 Ca -0.35 0.48 -0.28 0.00 0.00 0.00 0.00 57.70 57.56 2jnf n MET 153 Cb 1.05 -1.72 0.03 0.00 0.00 0.00 0.00 33.22 32.59 2jnf n MET 153 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2jnf n THR 154 N -4.19 2.83 0.06 1.12 -2.24 -1.19 -4.74 114.28 105.94 2jnf n THR 154 Ca -0.34 -3.98 -0.17 0.00 -2.27 0.00 0.00 64.05 57.29 2jnf n THR 154 Cb 0.78 -1.16 -0.14 0.00 -2.10 0.00 0.00 70.33 67.71 2jnf n THR 154 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2jnf h GLY 155 N 2.21 0.28 -0.39 3.38 0.00 -1.52 -3.43 103.07 103.61 2jnf h GLY 155 Ca 0.43 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2jnf h GLY 155 CO 1.01 0.63 0.00 0.61 0.00 0.00 0.00 176.54 178.78 2jnf n GLY 156 N 1.68 0.58 0.19 4.60 0.00 -1.26 -5.01 105.19 105.98 2jnf n GLY 156 Ca -0.17 -0.61 -0.04 0.00 0.00 0.00 0.00 46.02 45.20 2jnf n GLY 156 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2jnf h ASP 157 N 0.00 0.23 0.00 1.61 5.19 -1.95 -3.54 116.42 117.96 2jnf h ASP 157 Ca 0.00 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 2jnf h ASP 157 Cb 0.04 0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.57 2jnf h ASP 157 CO 0.00 0.16 0.00 -0.62 -3.12 0.00 0.00 179.24 175.66