#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 0.90 3.20 -5.12 0.00 -0.93 -4.76 105.19 98.48 2jnf n GLY 2 Ca 0.00 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 0.00 5.14 -4.70 1.61 9.92 -1.01 -4.87 116.55 122.64 2jnf n ASP 3 Ca 0.00 -3.12 -0.42 0.00 -0.53 0.00 0.00 54.79 50.72 2jnf n ASP 3 Cb 0.00 -1.24 -0.03 0.00 -0.64 0.00 0.00 41.12 39.21 2jnf n ASP 3 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2jnf s VAL 4 N -1.53 3.00 -0.70 2.53 1.01 -1.26 -1.52 120.40 121.94 2jnf s VAL 4 Ca 0.30 0.60 0.00 0.00 0.00 0.00 0.00 61.98 62.88 2jnf s VAL 4 Cb -0.07 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2jnf s VAL 4 CO -0.07 0.02 0.00 -1.20 0.00 0.00 0.00 175.10 173.85 2jnf n SER 5 N 4.77 -5.14 0.06 3.32 7.64 -1.26 -4.76 113.62 118.25 2jnf n SER 5 Ca 0.14 0.16 0.11 0.00 1.01 0.00 0.00 58.87 60.30 2jnf n SER 5 Cb 0.40 -3.22 -0.06 0.00 -1.01 0.00 0.00 64.21 60.33 2jnf n SER 5 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2jnf n LYS 6 N -1.01 0.60 -2.26 1.43 4.01 -0.58 -4.86 118.16 115.50 2jnf n LYS 6 Ca -0.07 0.00 -0.43 0.00 -0.51 0.00 0.00 58.31 57.31 2jnf n LYS 6 Cb 0.44 -1.70 -0.02 0.00 -0.51 0.00 0.00 35.03 33.23 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 -4.96 4.03 0.85 -0.35 1.02 -1.20 -5.01 118.68 113.06 2jnf s LEU 7 Ca -0.03 1.63 -0.12 0.00 0.02 0.00 0.00 54.13 55.63 2jnf s LEU 7 Cb 0.11 -3.54 0.10 0.00 0.02 0.00 0.00 46.19 42.89 2jnf s LEU 7 CO 0.83 -1.03 1.12 -0.55 0.02 0.00 0.00 176.35 176.74 2jnf s SER 8 N 3.13 4.05 0.34 2.29 0.15 -1.26 -4.77 113.70 117.62 2jnf s SER 8 Ca 0.63 1.15 0.10 0.00 0.70 0.00 0.00 55.95 58.53 2jnf s SER 8 Cb -0.23 -1.81 0.84 0.00 -1.71 0.00 0.00 66.02 63.11 2jnf s SER 8 CO 0.24 -2.23 1.81 0.77 1.20 0.00 0.00 173.24 175.02 2jnf h SER 9 N -1.27 0.67 -0.37 5.45 4.64 -1.98 -1.17 113.55 119.51 2jnf h SER 9 Ca -0.49 0.07 0.07 0.00 -0.47 0.00 0.00 61.79 60.97 2jnf h SER 9 Cb 1.30 -0.05 -0.06 0.00 -0.31 0.00 0.00 62.40 63.28 2jnf h SER 9 CO 0.61 0.26 0.00 0.78 -0.87 0.00 0.00 176.83 177.61 2jnf h ASN 10 N 0.66 -0.14 -0.35 4.97 -0.26 -1.99 0.38 115.58 118.85 2jnf h ASN 10 Ca 0.54 0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 56.35 2jnf h ASN 10 Cb 0.96 0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 38.35 2jnf h ASN 10 CO -0.30 -0.03 0.17 1.56 -1.06 0.00 0.00 177.43 177.76 2jnf h GLN 11 N 0.11 0.50 -0.07 0.81 1.08 -1.57 -2.95 115.11 113.02 2jnf h GLN 11 Ca 0.18 -0.07 -0.10 0.00 -1.45 0.00 0.00 58.65 57.21 2jnf h GLN 11 Cb 0.25 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 2jnf h GLN 11 CO -0.30 0.45 -0.41 0.28 -0.95 0.00 0.00 178.83 177.91 2jnf h VAL 12 N 0.43 1.31 -0.81 -0.54 2.07 -1.06 -1.70 116.25 115.94 2jnf h VAL 12 Ca 0.12 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.15 2jnf h VAL 12 Cb 0.12 1.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 2jnf h VAL 12 CO -0.02 0.43 0.47 0.50 0.02 0.00 0.00 177.57 178.98 2jnf h LYS 13 N 0.13 1.11 -0.40 1.57 1.63 -0.11 0.77 116.57 121.27 2jnf h LYS 13 Ca 0.01 -0.11 -0.09 0.00 -0.85 0.00 0.00 60.65 59.61 2jnf h LYS 13 Cb 0.78 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 32.17 2jnf h LYS 13 CO 0.06 0.80 -0.10 -0.07 -3.45 0.00 0.00 179.45 176.69 2jnf h LEU 14 N 1.12 0.78 -0.18 5.20 -0.00 -1.36 -1.54 115.31 119.33 2jnf h LEU 14 Ca 0.29 -0.36 0.02 0.00 -0.00 0.00 0.00 57.88 57.83 2jnf h LEU 14 Cb -0.02 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 40.41 2jnf h LEU 14 CO -0.05 0.96 0.05 -0.07 -0.00 0.00 0.00 178.44 179.33 2jnf h LEU 15 N 0.59 0.04 0.31 1.67 3.38 -0.73 -1.05 115.31 119.52 2jnf h LEU 15 Ca 0.10 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2jnf h LEU 15 Cb 0.62 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2jnf h LEU 15 CO 0.04 0.05 -0.27 -0.08 0.09 0.00 0.00 178.44 178.27 2jnf h GLU 16 N 0.13 -0.57 -0.89 1.13 4.81 0.59 0.27 114.58 120.05 2jnf h GLU 16 Ca 0.08 0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2jnf h GLU 16 Cb 0.06 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 2jnf h GLU 16 CO -0.09 -0.38 0.59 1.15 -0.73 0.00 0.00 179.01 179.54 2jnf h THR 17 N -0.59 1.22 -0.05 0.32 2.02 -1.15 -0.35 112.91 114.32 2jnf h THR 17 Ca -0.02 -0.41 -0.23 0.00 0.77 0.00 0.00 66.41 66.52 2jnf h THR 17 Cb 0.53 -0.08 0.01 0.00 -1.74 0.00 0.00 68.15 66.87 2jnf h THR 17 CO -0.03 0.22 -0.89 0.00 0.37 0.00 0.00 175.52 175.18 2jnf h ALA 18 N 1.33 0.33 0.58 6.16 0.00 -1.07 -2.42 119.26 124.16 2jnf h ALA 18 Ca 0.33 -0.66 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2jnf h ALA 18 Cb -0.12 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2jnf h ALA 18 CO -0.08 0.74 -0.47 0.35 0.00 0.00 0.00 179.25 179.79 2jnf h PHE 19 N 0.37 -1.28 0.00 0.00 3.04 0.09 -2.66 116.94 116.50 2jnf h PHE 19 Ca -0.08 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.87 2jnf h PHE 19 Cb 1.52 0.48 0.00 0.00 2.56 0.00 0.00 35.95 40.51 2jnf h PHE 19 CO 0.08 -0.66 0.00 2.89 -2.02 0.00 0.00 178.31 178.59 2jnf n ARG 20 N -5.57 0.11 0.14 1.11 -4.01 -0.19 -1.11 116.66 107.15 2jnf n ARG 20 Ca -0.13 0.32 -0.25 0.00 -1.04 0.00 0.00 57.85 56.76 2jnf n ARG 20 Cb 0.46 -1.70 -0.16 0.00 -3.04 0.00 0.00 32.46 28.02 2jnf n ARG 20 CO 0.00 0.00 0.00 0.22 -3.04 0.00 0.00 177.63 174.81 2jnf h ASP 21 N 0.00 0.84 -0.37 2.89 3.58 -1.08 -3.28 116.42 119.00 2jnf h ASP 21 Ca 0.00 -0.92 0.00 0.00 0.42 0.00 0.00 57.03 56.53 2jnf h ASP 21 Cb 0.35 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.13 2jnf h ASP 21 CO 0.00 1.72 0.00 0.49 -2.88 0.00 0.00 179.24 178.57 2jnf n PHE 22 N -3.72 0.48 -1.62 0.28 3.72 -1.11 -5.02 117.46 110.47 2jnf n PHE 22 Ca -0.17 -0.35 -0.35 0.00 -0.05 0.00 0.00 57.45 56.53 2jnf n PHE 22 Cb 1.11 -0.01 0.07 0.00 -0.94 0.00 0.00 39.48 39.71 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 -1.12 2.41 0.00 -1.08 -6.30 -0.27 -4.53 118.70 107.81 2jnf s GLU 23 Ca 0.30 1.82 0.00 0.00 -2.50 0.00 0.00 54.97 54.59 2jnf s GLU 23 Cb 0.17 -1.86 0.00 0.00 0.00 0.00 0.00 34.13 32.44 2jnf s GLU 23 CO 0.23 -1.64 0.00 2.41 0.02 0.00 0.00 175.26 176.28 2jnf n THR 24 N -2.32 -0.69 0.05 -1.70 -1.04 0.94 -4.91 114.28 104.63 2jnf n THR 24 Ca 0.14 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.92 2jnf n THR 24 Cb 0.50 -0.63 -0.15 0.00 -1.82 0.00 0.00 70.33 68.23 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 0.00 0.35 -0.00 -2.82 0.13 -1.91 -3.44 132.00 124.32 2jnf h PRO 25 Ca 0.00 -0.61 -0.15 0.00 -0.87 0.00 0.00 66.00 64.38 2jnf h PRO 25 Cb 0.00 0.23 -0.14 0.00 0.13 0.00 0.00 31.00 31.22 2jnf h PRO 25 CO 0.00 1.29 -0.29 -1.91 -0.23 0.00 0.00 178.00 176.86 2jnf n GLU 26 N -3.59 0.51 -0.42 0.86 4.07 -1.26 -5.01 120.64 115.79 2jnf n GLU 26 Ca -0.27 -1.08 0.00 0.00 -0.06 0.00 0.00 57.16 55.75 2jnf n GLU 26 Cb 1.06 0.47 0.00 0.00 -0.06 0.00 0.00 31.44 32.91 2jnf n GLU 26 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jnf n GLY 27 N -0.57 0.60 0.02 8.31 0.00 -1.26 -5.05 105.19 107.24 2jnf n GLY 27 Ca -0.24 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.31 3.06 0.00 1.61 2.88 -1.26 -4.99 113.62 114.60 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 0.14 1.05 0.00 0.00 -0.75 0.00 0.00 64.21 64.65 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 2.26 2.28 3.70 0.46 0.00 -1.26 -5.01 105.19 107.61 2jnf n GLY 29 Ca -0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.50 2.35 -0.20 1.61 0.52 -1.26 -4.84 118.95 116.63 2jnf s ARG 30 Ca 0.00 -1.49 -0.06 0.00 -0.52 0.00 0.00 55.73 53.65 2jnf s ARG 30 Cb 0.00 -2.17 -0.03 0.00 0.52 0.00 0.00 34.95 33.26 2jnf s ARG 30 CO 0.00 0.21 0.04 0.54 0.02 0.00 0.00 175.30 176.11 2jnf s VAL 31 N -2.38 4.38 0.31 3.52 0.11 -0.52 -0.04 120.40 125.79 2jnf s VAL 31 Ca 0.35 -0.17 -0.28 0.00 -2.93 0.00 0.00 61.98 58.95 2jnf s VAL 31 Cb -0.04 -2.99 -0.13 0.00 -1.53 0.00 0.00 36.38 31.70 2jnf s VAL 31 CO 0.22 0.43 1.20 -0.24 -3.33 0.00 0.00 175.10 173.38 2jnf n SER 32 N 3.98 2.25 0.28 3.54 2.88 -1.26 -0.66 113.62 124.64 2jnf n SER 32 Ca -0.17 1.19 0.19 0.00 -1.33 0.00 0.00 58.87 58.76 2jnf n SER 32 Cb 0.52 -1.41 0.96 0.00 -0.75 0.00 0.00 64.21 63.53 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 2.40 0.00 0.00 2.46 1.35 -0.83 -0.16 112.91 118.13 2jnf h THR 33 Ca -0.44 -0.13 -0.13 0.00 -0.55 0.00 0.00 66.41 65.16 2jnf h THR 33 Cb 1.30 1.04 -0.02 0.00 -1.73 0.00 0.00 68.15 68.74 2jnf h THR 33 CO 0.63 0.00 -0.60 -0.78 -0.25 0.00 0.00 175.52 174.52 2jnf h ASP 34 N 0.00 0.00 1.10 5.36 3.58 -1.89 -3.16 116.42 121.41 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 0.14 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.19 2jnf h ASP 34 CO 0.00 0.60 -0.59 1.56 -2.88 0.00 0.00 179.24 177.93 2jnf h GLN 35 N 0.00 0.00 -0.90 0.28 1.08 -1.38 -3.34 115.11 110.85 2jnf h GLN 35 Ca -0.01 0.00 0.10 0.00 -1.45 0.00 0.00 58.65 57.29 2jnf h GLN 35 Cb 1.15 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 28.51 2jnf h GLN 35 CO 0.08 0.00 0.54 0.82 -0.95 0.00 0.00 178.83 179.32 2jnf h ILE 36 N 0.00 0.94 -0.77 2.54 2.04 -1.46 0.16 117.51 120.95 2jnf h ILE 36 Ca 0.00 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 2jnf h ILE 36 Cb 0.84 -0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 2jnf h ILE 36 CO 0.00 0.17 0.39 1.23 0.00 0.00 0.00 178.15 179.93 2jnf h GLY 37 N 0.91 1.17 0.83 5.37 0.00 -1.75 0.38 103.07 109.97 2jnf h GLY 37 Ca 0.43 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2jnf h GLY 37 CO -0.24 0.53 -0.09 -2.22 0.00 0.00 0.00 176.54 174.52 2jnf h ILE 38 N 1.09 0.89 -0.55 2.60 2.04 -1.33 -2.20 117.51 120.05 2jnf h ILE 38 Ca 0.27 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.77 2jnf h ILE 38 Cb 0.08 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 2jnf h ILE 38 CO -0.04 0.08 0.36 0.40 0.00 0.00 0.00 178.15 178.96 2jnf h ILE 39 N -0.42 1.14 0.00 -0.67 2.04 -0.72 0.82 117.51 119.69 2jnf h ILE 39 Ca -0.03 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 2jnf h ILE 39 Cb 0.33 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 2jnf h ILE 39 CO 0.04 0.14 -0.02 -0.07 0.00 0.00 0.00 178.15 178.24 2jnf h LEU 40 N 0.75 0.00 0.24 1.44 4.07 -0.22 0.26 115.31 121.85 2jnf h LEU 40 Ca 0.20 0.00 -0.32 0.00 0.08 0.00 0.00 57.88 57.84 2jnf h LEU 40 Cb -0.08 0.00 0.04 0.00 1.08 0.00 0.00 40.66 41.70 2jnf h LEU 40 CO -0.04 0.02 -1.40 -0.08 -1.08 0.00 0.00 178.44 175.85 2jnf h GLU 41 N 0.00 0.52 -0.73 1.13 4.57 -0.52 0.44 114.58 119.98 2jnf h GLU 41 Ca -0.00 -0.88 0.11 0.00 -1.18 0.00 0.00 59.36 57.40 2jnf h GLU 41 Cb 0.04 0.33 -0.08 0.00 -0.16 0.00 0.00 28.75 28.89 2jnf h GLU 41 CO 0.00 1.42 0.35 0.28 -1.18 0.00 0.00 179.01 179.89 2jnf h VAL 42 N 0.08 0.80 -0.01 0.32 2.07 0.87 -0.71 116.25 119.68 2jnf h VAL 42 Ca -0.24 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2jnf h VAL 42 Cb 2.11 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2jnf h VAL 42 CO 0.26 0.11 -0.13 0.18 0.02 0.00 0.00 177.57 178.01 2jnf n LEU 43 N -4.89 0.70 -2.33 2.57 4.77 0.74 -4.94 117.00 113.63 2jnf n LEU 43 Ca 0.12 -0.12 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 2jnf n LEU 43 Cb 0.31 -0.14 0.05 0.00 -2.33 0.00 0.00 43.42 41.31 2jnf n LEU 43 CO 0.23 0.13 0.13 0.61 -1.33 0.00 0.00 177.39 177.17 2jnf n GLY 44 N 1.27 0.04 0.00 -0.72 0.00 -0.27 -4.97 105.19 100.53 2jnf n GLY 44 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -4.02 0.00 -1.04 -0.61 -5.35 0.15 -5.00 119.36 103.48 2jnf n ILE 45 Ca -0.00 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.44 2jnf n ILE 45 Cb 0.54 -0.36 0.03 0.00 -1.74 0.00 0.00 39.64 38.12 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 -0.57 -0.38 -2.21 6.28 -0.06 -1.19 -4.96 117.38 114.29 2jnf n GLN 46 Ca 0.00 -0.29 -0.02 0.00 -2.00 0.00 0.00 57.00 54.69 2jnf n GLN 46 Cb 0.00 -0.20 -0.01 0.00 -4.06 0.00 0.00 30.24 25.97 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 -1.51 1.59 -0.57 3.69 6.02 -1.26 -4.26 117.38 121.08 2jnf n GLN 47 Ca 0.02 -0.30 -0.30 0.00 -0.01 0.00 0.00 57.00 56.41 2jnf n GLN 47 Cb 0.08 0.10 0.21 0.00 1.02 0.00 0.00 30.24 31.66 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 -0.10 0.00 -0.25 5.09 5.66 -1.26 -4.36 114.28 119.06 2jnf n THR 48 Ca -0.01 -0.34 0.21 0.00 -3.05 0.00 0.00 64.05 60.86 2jnf n THR 48 Cb 0.05 -0.75 0.54 0.00 -1.55 0.00 0.00 70.33 68.63 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 -2.42 0.34 -0.32 1.09 1.57 -1.93 0.32 116.57 115.21 2jnf h LYS 49 Ca -0.55 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.24 2jnf h LYS 49 Cb 1.33 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 2jnf h LYS 49 CO 0.41 0.23 0.22 0.77 -0.57 0.00 0.00 179.45 180.50 2jnf h SER 50 N 0.35 0.27 0.70 0.86 0.02 -2.01 0.91 113.55 114.64 2jnf h SER 50 Ca 0.49 -0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 61.17 2jnf h SER 50 Cb 1.31 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.77 2jnf h SER 50 CO -0.17 0.18 -1.29 0.74 -1.14 0.00 0.00 176.83 175.15 2jnf h THR 51 N 0.31 1.40 0.00 -2.27 2.02 -0.64 -3.31 112.91 110.42 2jnf h THR 51 Ca 0.13 -3.08 -0.03 0.00 0.77 0.00 0.00 66.41 64.20 2jnf h THR 51 Cb 0.15 2.80 -0.00 0.00 -1.74 0.00 0.00 68.15 69.35 2jnf h THR 51 CO -0.03 0.85 -0.16 0.40 0.37 0.00 0.00 175.52 176.96 2jnf h ILE 52 N 0.04 0.48 -0.98 3.11 1.08 -0.58 -2.00 117.51 118.65 2jnf h ILE 52 Ca -0.14 -0.82 0.28 0.00 -0.39 0.00 0.00 64.86 63.79 2jnf h ILE 52 Cb 1.92 1.57 -0.05 0.00 -3.07 0.00 0.00 36.82 37.19 2jnf h ILE 52 CO 0.15 0.15 0.70 0.03 -0.69 0.00 0.00 178.15 178.49 2jnf h ARG 53 N 0.00 0.07 0.37 2.37 2.47 -1.00 0.21 114.38 118.86 2jnf h ARG 53 Ca -0.00 -0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 2jnf h ARG 53 Cb 0.56 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 2jnf h ARG 53 CO 0.02 0.04 -0.18 1.96 0.56 0.00 0.00 179.97 182.38 2jnf h GLN 54 N 0.07 -0.48 -0.36 0.04 1.08 -1.59 -2.19 115.11 111.67 2jnf h GLN 54 Ca 0.48 0.03 0.07 0.00 -1.45 0.00 0.00 58.65 57.79 2jnf h GLN 54 Cb 1.79 0.11 -0.07 0.00 -0.05 0.00 0.00 27.48 29.26 2jnf h GLN 54 CO -0.05 -0.18 -0.09 -0.07 -0.95 0.00 0.00 178.83 177.49 2jnf h LEU 55 N -0.80 -0.34 -0.24 1.46 -0.00 -1.05 -1.74 115.31 112.59 2jnf h LEU 55 Ca -0.05 0.11 -0.02 0.00 -0.00 0.00 0.00 57.88 57.92 2jnf h LEU 55 Cb 0.53 0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 41.40 2jnf h LEU 55 CO 0.08 -0.12 0.09 0.40 -0.00 0.00 0.00 178.44 178.89 2jnf h ILE 56 N -0.01 1.18 0.00 1.22 2.04 -0.77 0.13 117.51 121.30 2jnf h ILE 56 Ca 0.17 -0.55 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 2jnf h ILE 56 Cb 0.27 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2jnf h ILE 56 CO -0.37 0.18 -0.03 -0.78 0.00 0.00 0.00 178.15 177.15 2jnf h ASP 57 N 0.24 0.00 0.00 1.72 3.58 -1.12 0.30 116.42 121.13 2jnf h ASP 57 Ca 0.08 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.37 2jnf h ASP 57 Cb 0.20 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.22 2jnf h ASP 57 CO -0.01 0.03 -0.94 -0.08 -2.88 0.00 0.00 179.24 175.37 2jnf h GLU 58 N 0.00 0.00 0.00 0.28 4.81 -0.73 -3.34 114.58 115.60 2jnf h GLU 58 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2jnf h GLU 58 Cb 0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.47 2jnf h GLU 58 CO 0.00 0.87 -1.24 1.19 -0.73 0.00 0.00 179.01 179.10 2jnf n PHE 59 N -4.49 0.38 -3.13 0.92 3.72 0.39 -4.33 117.46 110.91 2jnf n PHE 59 Ca -0.25 0.11 -0.23 0.00 -0.05 0.00 0.00 57.45 57.03 2jnf n PHE 59 Cb 0.59 -0.57 -0.05 0.00 -0.94 0.00 0.00 39.48 38.51 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 -2.20 2.48 0.28 4.37 2.03 0.10 -4.91 116.55 118.70 2jnf n ASP 60 Ca 0.00 -3.28 0.14 0.00 0.52 0.00 0.00 54.79 52.17 2jnf n ASP 60 Cb 0.49 -0.61 0.80 0.00 -0.72 0.00 0.00 41.12 41.09 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 3.28 0.00 0.00 -0.67 0.11 -1.69 -1.00 132.00 132.04 2jnf h PRO 61 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 2jnf h PRO 61 Cb 0.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.85 2jnf h PRO 61 CO 0.66 0.08 0.00 0.74 -0.21 0.00 0.00 178.00 179.26 2jnf h PHE 62 N 0.00 0.00 -3.18 0.65 0.04 -1.90 -3.47 116.94 109.08 2jnf h PHE 62 Ca -0.00 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.60 2jnf h PHE 62 Cb 0.21 0.00 0.06 0.00 2.20 0.00 0.00 35.95 38.43 2jnf h PHE 62 CO 0.00 0.00 -0.30 0.41 -0.60 0.00 0.00 178.31 177.82 2jnf n GLY 63 N 0.81 0.27 0.29 -1.45 0.00 -0.38 -4.95 105.19 99.78 2jnf n GLY 63 Ca 0.04 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.14 1.03 0.00 1.61 -0.73 -1.92 -3.47 115.58 110.97 2jnf h ASN 64 Ca -0.25 -0.37 0.00 0.00 1.87 0.00 0.00 56.30 57.55 2jnf h ASN 64 Cb 1.16 -0.28 0.00 0.00 0.27 0.00 0.00 38.32 39.47 2jnf h ASN 64 CO 0.24 1.17 0.00 0.61 -0.37 0.00 0.00 177.43 179.08 2jnf n GLY 65 N -0.19 1.87 3.28 1.57 0.00 -1.26 -5.08 105.19 105.38 2jnf n GLY 65 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.72 1.58 -0.01 1.61 1.11 -1.26 -0.15 116.67 117.83 2jnf s ASP 66 Ca 0.00 -1.73 -0.03 0.00 0.18 0.00 0.00 52.55 50.97 2jnf s ASP 66 Cb 0.00 0.54 0.00 0.00 1.07 0.00 0.00 42.92 44.53 2jnf s ASP 66 CO 0.00 -1.04 0.06 0.27 1.18 0.00 0.00 175.17 175.64 2jnf s ILE 67 N -3.50 0.04 0.69 0.77 -4.36 0.17 -4.72 121.20 110.28 2jnf s ILE 67 Ca 0.40 -0.30 -0.09 0.00 -0.26 0.00 0.00 60.65 60.40 2jnf s ILE 67 Cb 0.03 -0.20 0.04 0.00 1.25 0.00 0.00 42.46 43.57 2jnf s ILE 67 CO 0.26 -0.17 1.03 -0.62 0.24 0.00 0.00 174.94 175.68 2jnf s ASP 68 N -0.51 5.18 0.56 4.36 2.15 -1.26 -1.44 116.67 125.72 2jnf s ASP 68 Ca -0.06 0.77 0.26 0.00 0.43 0.00 0.00 52.55 53.95 2jnf s ASP 68 Cb -0.04 -1.54 1.52 0.00 -0.30 0.00 0.00 42.92 42.57 2jnf s ASP 68 CO 0.00 -1.41 2.06 0.15 -0.17 0.00 0.00 175.17 175.80 2jnf h PHE 69 N -0.55 0.00 -0.46 -5.34 3.04 -1.96 -0.23 116.94 111.43 2jnf h PHE 69 Ca -0.45 0.00 0.09 0.00 3.98 0.00 0.00 57.97 61.59 2jnf h PHE 69 Cb 1.28 0.00 -0.10 0.00 2.56 0.00 0.00 35.95 39.70 2jnf h PHE 69 CO 0.42 0.00 -0.19 0.22 -2.02 0.00 0.00 178.31 176.74 2jnf h ASP 70 N 0.00 -0.67 0.43 0.41 3.58 -1.99 0.66 116.42 118.84 2jnf h ASP 70 Ca 0.14 0.16 -0.31 0.00 0.42 0.00 0.00 57.03 57.44 2jnf h ASP 70 Cb 0.65 0.38 0.01 0.00 1.72 0.00 0.00 39.33 42.09 2jnf h ASP 70 CO -0.00 -0.22 -1.47 0.28 -2.88 0.00 0.00 179.24 174.94 2jnf h SER 71 N -0.09 0.52 -0.35 2.28 0.02 -1.56 -3.31 113.55 111.05 2jnf h SER 71 Ca 0.22 -0.64 -0.07 0.00 -0.84 0.00 0.00 61.79 60.47 2jnf h SER 71 Cb 0.43 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 2jnf h SER 71 CO -0.53 1.52 0.00 0.15 -1.14 0.00 0.00 176.83 176.84 2jnf h PHE 72 N 0.09 0.76 -0.74 3.45 3.57 -0.77 -1.33 116.94 121.97 2jnf h PHE 72 Ca -0.23 -0.10 -0.03 0.00 3.53 0.00 0.00 57.97 61.15 2jnf h PHE 72 Cb 2.05 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 40.54 2jnf h PHE 72 CO 0.08 0.71 0.34 -0.22 -2.23 0.00 0.00 178.31 177.00 2jnf h LYS 73 N 0.68 1.07 -0.40 1.11 3.64 0.22 0.37 116.57 123.26 2jnf h LYS 73 Ca 0.14 -0.15 -0.15 0.00 -1.27 0.00 0.00 60.65 59.21 2jnf h LYS 73 Cb 0.41 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2jnf h LYS 73 CO 0.02 0.83 -0.35 0.82 -2.27 0.00 0.00 179.45 178.50 2jnf h ILE 74 N 1.06 1.27 -0.27 2.00 2.04 -1.51 0.55 117.51 122.65 2jnf h ILE 74 Ca 0.26 -1.52 0.03 0.00 1.00 0.00 0.00 64.86 64.63 2jnf h ILE 74 Cb 0.12 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 2jnf h ILE 74 CO -0.03 0.51 0.07 0.40 0.00 0.00 0.00 178.15 179.10 2jnf h ILE 75 N 0.78 0.90 -0.41 -0.67 2.04 -0.67 -0.60 117.51 118.87 2jnf h ILE 75 Ca 0.07 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 2jnf h ILE 75 Cb 0.94 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 2jnf h ILE 75 CO 0.09 0.03 0.19 1.23 0.00 0.00 0.00 178.15 179.70 2jnf h GLY 76 N 0.18 0.64 2.00 5.37 0.00 -0.04 -2.96 103.07 108.26 2jnf h GLY 76 Ca 0.12 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 2jnf h GLY 76 CO -0.14 0.30 -0.02 0.00 0.00 0.00 0.00 176.54 176.68 2jnf h ALA 77 N 1.04 1.01 0.00 3.60 0.00 0.49 0.71 119.26 126.11 2jnf h ALA 77 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2jnf h ALA 77 Cb 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2jnf h ALA 77 CO -0.02 0.02 -0.94 2.89 0.00 0.00 0.00 179.25 181.20 2jnf n ARG 78 N -3.13 0.41 -0.01 0.00 1.85 -0.27 -2.20 116.66 113.31 2jnf n ARG 78 Ca -0.00 0.06 -0.02 0.00 -1.00 0.00 0.00 57.85 56.88 2jnf n ARG 78 Cb 0.26 -1.69 -0.01 0.00 -1.05 0.00 0.00 32.46 29.97 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 -2.26 0.00 0.26 2.89 3.72 -0.87 -4.26 117.46 116.95 2jnf n PHE 79 Ca 0.01 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.57 2jnf n PHE 79 Cb 0.48 -0.08 0.50 0.00 -0.94 0.00 0.00 39.48 39.43 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 -1.59 4.37 4.07 0.18 -2.95 115.31 119.33 2jnf h LEU 80 Ca -0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.90 2jnf h LEU 80 Cb 1.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.80 2jnf h LEU 80 CO -0.03 0.01 0.00 0.61 -1.08 0.00 0.00 178.44 177.95 2jnf n GLY 81 N 0.42 1.01 1.38 0.83 0.00 -1.18 -3.21 105.19 104.44 2jnf n GLY 81 Ca 0.02 -0.48 0.01 0.00 0.00 0.00 0.00 46.02 45.57 2jnf n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jnf n GLU 82 N 0.77 3.00 -2.87 1.61 -0.58 -1.12 -4.53 120.64 116.92 2jnf n GLU 82 Ca 0.15 -1.81 -0.43 0.00 -0.42 0.00 0.00 57.16 54.65 2jnf n GLU 82 Cb 0.37 -1.90 -0.04 0.00 -0.57 0.00 0.00 31.44 29.31 2jnf n GLU 82 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2jnf s GLU 83 N -2.00 3.11 -0.71 3.49 2.12 -1.20 -4.92 118.70 118.59 2jnf s GLU 83 Ca 0.32 -0.86 0.04 0.00 0.36 0.00 0.00 54.97 54.83 2jnf s GLU 83 Cb 0.25 -4.23 0.24 0.00 0.26 0.00 0.00 34.13 30.64 2jnf s GLU 83 CO 0.09 -1.80 0.77 1.55 -0.54 0.00 0.00 175.26 175.32 2jnf n VAL 84 N 5.90 2.54 -2.97 3.70 3.14 -1.26 -4.85 118.33 124.53 2jnf n VAL 84 Ca -0.04 -5.21 -0.38 0.00 -2.96 0.00 0.00 64.34 55.74 2jnf n VAL 84 Cb 0.45 -2.14 -0.06 0.00 -1.06 0.00 0.00 33.84 31.03 2jnf n VAL 84 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 2jnf s ASN 85 N -2.05 7.32 0.08 6.55 2.47 -1.26 -4.94 114.94 123.11 2jnf s ASN 85 Ca 0.35 1.64 -0.30 0.00 0.42 0.00 0.00 52.86 54.96 2jnf s ASN 85 Cb 0.08 -2.50 -0.14 0.00 -1.45 0.00 0.00 41.25 37.25 2jnf s ASN 85 CO -0.04 0.12 1.47 -0.65 -3.72 0.00 0.00 177.10 174.28 2jnf h PRO 86 N 3.91 -0.76 -0.93 0.43 0.11 -1.97 -1.07 132.00 131.71 2jnf h PRO 86 Ca -0.47 0.05 -0.21 0.00 0.11 0.00 0.00 66.00 65.48 2jnf h PRO 86 Cb 1.20 0.17 -0.13 0.00 0.11 0.00 0.00 31.00 32.36 2jnf h PRO 86 CO 0.66 -0.50 0.27 0.39 -0.21 0.00 0.00 178.00 178.60 2jnf n GLU 87 N -5.05 2.13 0.04 1.05 1.02 -1.26 -3.11 120.64 115.46 2jnf n GLU 87 Ca -0.09 -1.72 0.00 0.00 -0.02 0.00 0.00 57.16 55.32 2jnf n GLU 87 Cb 0.38 -1.74 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 2jnf n GLU 87 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 2jnf n GLN 88 N -0.21 0.00 -0.09 3.49 7.27 -0.89 -4.93 117.38 122.02 2jnf n GLN 88 Ca 0.29 0.00 -0.09 0.00 0.07 0.00 0.00 57.00 57.26 2jnf n GLN 88 Cb 1.06 -0.39 -0.14 0.00 2.41 0.00 0.00 30.24 33.19 2jnf n GLN 88 CO 0.00 0.00 0.00 -0.12 0.07 0.00 0.00 177.06 177.01 2jnf n MET 89 N -3.23 1.05 -1.24 3.69 1.56 -0.46 -4.99 117.12 113.50 2jnf n MET 89 Ca 0.00 0.01 0.00 0.00 -0.27 0.00 0.00 57.70 57.44 2jnf n MET 89 Cb 0.17 -1.45 0.00 0.00 2.15 0.00 0.00 33.22 34.09 2jnf n MET 89 CO 0.00 0.00 0.00 1.04 -0.73 0.00 0.00 175.97 176.28 2jnf n GLN 90 N -2.71 1.79 -4.22 2.12 6.02 -1.18 -4.86 117.38 114.35 2jnf n GLN 90 Ca -0.30 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.39 2jnf n GLN 90 Cb 1.06 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 32.23 2jnf n GLN 90 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jnf n GLN 91 N 0.00 -0.92 0.32 -1.09 10.64 -1.26 -4.52 117.38 120.55 2jnf n GLN 91 Ca 0.00 0.09 0.21 0.00 -1.83 0.00 0.00 57.00 55.47 2jnf n GLN 91 Cb 0.00 -3.45 1.11 0.00 -0.86 0.00 0.00 30.24 27.04 2jnf n GLN 91 CO 0.00 0.00 0.00 0.93 -1.83 0.00 0.00 177.06 176.16 2jnf h GLU 92 N -1.52 0.00 -0.40 2.61 3.07 -1.89 -2.04 114.58 114.41 2jnf h GLU 92 Ca -0.61 0.00 0.12 0.00 -0.50 0.00 0.00 59.36 58.36 2jnf h GLU 92 Cb 1.31 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.20 2jnf h GLU 92 CO 0.68 0.00 0.37 -0.07 -1.40 0.00 0.00 179.01 178.60 2jnf h LEU 93 N 0.00 0.00 -1.44 1.33 -0.00 -1.96 -0.10 115.31 113.13 2jnf h LEU 93 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.89 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 0.38 0.03 -0.00 0.00 0.00 178.44 178.85 2jnf h ARG 94 N 0.00 0.74 0.00 1.13 2.47 -1.74 -0.44 114.38 116.54 2jnf h ARG 94 Ca 0.19 -0.04 -0.18 0.00 -1.26 0.00 0.00 59.98 58.68 2jnf h ARG 94 Cb 0.93 -0.17 -0.03 0.00 -1.65 0.00 0.00 29.97 29.06 2jnf h ARG 94 CO -0.00 0.49 -1.21 0.93 0.56 0.00 0.00 179.97 180.74 2jnf h GLU 95 N 0.76 0.00 0.00 0.04 5.08 -1.27 -3.31 114.58 115.88 2jnf h GLU 95 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2jnf h GLU 95 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2jnf h GLU 95 CO -0.05 0.47 0.00 0.00 -1.00 0.00 0.00 179.01 178.43 2jnf n ALA 96 N -2.38 1.84 0.13 3.43 0.00 -0.46 -2.88 120.51 120.20 2jnf n ALA 96 Ca -0.07 -0.04 -0.14 0.00 0.00 0.00 0.00 53.44 53.20 2jnf n ALA 96 Cb 0.87 -1.32 -0.08 0.00 0.00 0.00 0.00 19.45 18.91 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 -0.26 0.00 0.00 0.04 -1.23 -0.88 116.94 114.61 2jnf h PHE 97 Ca 0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2jnf h PHE 97 Cb 0.35 0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.59 2jnf h PHE 97 CO 0.00 -0.09 0.00 0.00 -0.60 0.00 0.00 178.31 177.62 2jnf h ARG 98 N -0.36 0.00 -0.13 1.51 3.08 -1.77 0.66 114.38 117.37 2jnf h ARG 98 Ca -0.03 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.81 2jnf h ARG 98 Cb 0.28 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.34 2jnf h ARG 98 CO 0.05 0.00 -0.78 1.25 -1.07 0.00 0.00 179.97 179.41 2jnf h LEU 99 N 0.00 0.82 0.00 3.04 5.85 -1.35 -3.34 115.31 120.33 2jnf h LEU 99 Ca 0.00 -0.55 -0.17 0.00 0.84 0.00 0.00 57.88 58.01 2jnf h LEU 99 Cb 0.25 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2jnf h LEU 99 CO 0.00 1.33 -2.17 -1.22 -0.34 0.00 0.00 178.44 176.05 2jnf n TYR 100 N -3.90 0.00 -2.04 1.25 4.01 -0.43 -4.79 117.16 111.26 2jnf n TYR 100 Ca -0.07 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.40 2jnf n TYR 100 Cb 0.75 -0.72 -0.06 0.00 -0.31 0.00 0.00 39.34 38.99 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 -4.94 4.98 0.19 7.72 2.15 0.22 -4.73 116.67 122.25 2jnf s ASP 101 Ca -0.09 -1.39 -0.12 0.00 0.43 0.00 0.00 52.55 51.38 2jnf s ASP 101 Cb 0.10 -2.58 0.16 0.00 -0.30 0.00 0.00 42.92 40.30 2jnf s ASP 101 CO 0.87 -3.08 1.78 0.11 -0.17 0.00 0.00 175.17 174.67 2jnf h LYS 102 N 10.20 0.46 -0.42 4.34 6.56 -1.87 -3.25 116.57 132.59 2jnf h LYS 102 Ca 0.18 -0.03 -0.10 0.00 -1.06 0.00 0.00 60.65 59.64 2jnf h LYS 102 Cb 0.96 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 32.50 2jnf h LYS 102 CO 1.21 0.31 -0.13 0.93 -2.06 0.00 0.00 179.45 179.71 2jnf h GLU 103 N 0.48 0.77 -0.39 3.15 5.08 -1.94 -3.47 114.58 118.27 2jnf h GLU 103 Ca 0.24 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2jnf h GLU 103 Cb 0.18 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2jnf h GLU 103 CO -0.19 0.87 0.00 0.41 -1.00 0.00 0.00 179.01 179.10 2jnf n GLY 104 N -0.41 0.62 0.01 -3.84 0.00 -1.23 -5.02 105.19 95.32 2jnf n GLY 104 Ca 0.01 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.08 0.27 0.00 1.61 3.02 -1.26 -4.95 115.26 113.87 2jnf n ASN 105 Ca 0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.30 2jnf n ASN 105 Cb 0.11 1.74 0.00 0.00 -0.61 0.00 0.00 39.78 41.02 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 1.32 3.02 3.66 7.41 0.00 -1.26 -4.98 105.19 114.37 2jnf n GLY 106 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.86 2.65 -0.19 1.61 2.02 -1.26 -4.69 117.35 115.63 2jnf s TYR 107 Ca 0.00 -0.31 -0.13 0.00 -0.37 0.00 0.00 57.07 56.26 2jnf s TYR 107 Cb 0.00 -1.37 -0.05 0.00 -0.40 0.00 0.00 41.96 40.15 2jnf s TYR 107 CO 0.00 0.52 0.26 0.96 -1.57 0.00 0.00 175.55 175.72 2jnf s ILE 108 N -2.40 5.31 0.95 2.71 -4.36 -0.71 -4.82 121.20 117.88 2jnf s ILE 108 Ca 0.34 0.45 -0.12 0.00 -0.26 0.00 0.00 60.65 61.05 2jnf s ILE 108 Cb -0.04 -3.60 0.16 0.00 1.25 0.00 0.00 42.46 40.23 2jnf s ILE 108 CO 0.20 0.36 1.09 -0.44 0.24 0.00 0.00 174.94 176.40 2jnf s SER 109 N 0.68 3.03 0.55 4.36 0.01 -1.26 0.36 113.70 121.43 2jnf s SER 109 Ca 0.14 1.37 0.29 0.00 1.31 0.00 0.00 55.95 59.05 2jnf s SER 109 Cb -0.13 -2.04 1.61 0.00 0.21 0.00 0.00 66.02 65.67 2jnf s SER 109 CO 0.04 -2.90 2.15 0.71 0.41 0.00 0.00 173.24 173.65 2jnf h THR 110 N -1.73 0.54 0.14 1.44 1.35 -1.94 -0.12 112.91 112.58 2jnf h THR 110 Ca -0.52 -0.32 -0.01 0.00 -0.55 0.00 0.00 66.41 65.01 2jnf h THR 110 Cb 1.30 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.93 2jnf h THR 110 CO 0.56 0.07 -0.07 0.44 -0.25 0.00 0.00 175.52 176.27 2jnf h ASP 111 N 0.00 -0.16 -0.02 5.36 3.32 -1.92 0.16 116.42 123.16 2jnf h ASP 111 Ca -0.00 -0.19 -0.12 0.00 0.02 0.00 0.00 57.03 56.74 2jnf h ASP 111 Cb 0.20 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2jnf h ASP 111 CO 0.01 0.10 -0.35 1.62 -1.72 0.00 0.00 179.24 178.90 2jnf h VAL 112 N -0.43 1.29 -0.99 -1.35 3.04 -1.79 -2.03 116.25 114.00 2jnf h VAL 112 Ca -0.02 -1.47 0.04 0.00 -1.01 0.00 0.00 66.70 64.25 2jnf h VAL 112 Cb 0.34 1.50 -0.06 0.00 -2.01 0.00 0.00 31.29 31.06 2jnf h VAL 112 CO 0.03 0.46 0.65 -0.03 -1.01 0.00 0.00 177.57 177.67 2jnf h MET 113 N 0.42 1.20 -0.43 4.17 1.85 -0.94 0.98 114.93 122.18 2jnf h MET 113 Ca 0.05 -0.07 0.02 0.00 -0.61 0.00 0.00 59.70 59.08 2jnf h MET 113 Cb 0.82 -0.27 -0.03 0.00 0.43 0.00 0.00 31.60 32.55 2jnf h MET 113 CO 0.07 0.79 0.25 -0.09 -0.40 0.00 0.00 176.91 177.53 2jnf h ARG 114 N 1.23 0.50 0.05 0.39 2.43 -0.06 0.78 114.38 119.69 2jnf h ARG 114 Ca 0.40 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.54 2jnf h ARG 114 Cb 0.04 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 2jnf h ARG 114 CO -0.14 0.33 -0.02 0.93 -1.51 0.00 0.00 179.97 179.56 2jnf h GLU 115 N 0.51 -0.06 0.11 0.20 5.08 -0.65 -1.37 114.58 118.41 2jnf h GLU 115 Ca 0.17 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 2jnf h GLU 115 Cb 0.01 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 2jnf h GLU 115 CO -0.08 -0.01 -0.21 0.82 -1.00 0.00 0.00 179.01 178.53 2jnf h ILE 116 N -0.10 0.52 0.16 3.13 2.04 -0.53 0.61 117.51 123.33 2jnf h ILE 116 Ca -0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.86 2jnf h ILE 116 Cb 0.08 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 2jnf h ILE 116 CO 0.01 0.00 -0.19 0.25 0.00 0.00 0.00 178.15 178.22 2jnf h LEU 117 N -0.40 -0.51 -1.77 1.44 7.12 -0.82 -0.80 115.31 119.56 2jnf h LEU 117 Ca 0.03 0.05 0.00 0.00 0.13 0.00 0.00 57.88 58.09 2jnf h LEU 117 Cb 0.42 0.18 0.00 0.00 -0.53 0.00 0.00 40.66 40.74 2jnf h LEU 117 CO -0.12 -0.28 0.00 0.00 -0.13 0.00 0.00 178.44 177.91 2jnf h ALA 118 N 0.39 1.00 0.00 1.25 0.00 -1.09 0.36 119.26 121.17 2jnf h ALA 118 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2jnf h ALA 118 Cb 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2jnf h ALA 118 CO -0.07 0.00 -0.39 1.49 0.00 0.00 0.00 179.25 180.28 2jnf h GLU 119 N 0.00 0.00 -0.32 0.00 4.81 0.28 -2.99 114.58 116.37 2jnf h GLU 119 Ca 0.00 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 2jnf h GLU 119 Cb 0.19 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2jnf h GLU 119 CO 0.00 0.67 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.80 2jnf h LEU 120 N -1.00 0.62 -7.41 1.64 -0.00 -1.04 -3.34 115.31 104.78 2jnf h LEU 120 Ca -0.09 -0.37 -0.69 0.00 -0.00 0.00 0.00 57.88 56.72 2jnf h LEU 120 Cb 0.82 -0.17 -0.36 0.00 -0.00 0.00 0.00 40.66 40.95 2jnf h LEU 120 CO -0.06 0.85 -0.25 -1.81 -0.00 0.00 0.00 178.44 177.17 2jnf s ASP 121 N -6.24 5.55 0.00 -0.43 1.01 0.12 -4.89 116.67 111.80 2jnf s ASP 121 Ca -0.13 -3.35 0.00 0.00 0.71 0.00 0.00 52.55 49.78 2jnf s ASP 121 Cb 0.09 -1.86 0.00 0.00 1.01 0.00 0.00 42.92 42.15 2jnf s ASP 121 CO 0.79 -0.26 0.86 -1.84 0.21 0.00 0.00 175.17 174.93 2jnf n GLU 122 N 2.81 0.99 0.00 8.23 0.28 -1.13 -2.61 120.64 129.21 2jnf n GLU 122 Ca 0.15 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 57.27 2jnf n GLU 122 Cb 0.37 -1.13 0.16 0.00 1.43 0.00 0.00 31.44 32.27 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 -0.37 0.00 -2.75 3.84 -2.24 -1.26 -4.87 114.28 106.62 2jnf n THR 123 Ca 0.00 -0.17 -0.34 0.00 -2.27 0.00 0.00 64.05 61.27 2jnf n THR 123 Cb 0.07 0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 69.06 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 -2.56 3.96 0.41 3.22 2.01 -1.07 -5.08 118.68 119.58 2jnf s LEU 124 Ca 0.20 1.76 0.07 0.00 0.01 0.00 0.00 54.13 56.17 2jnf s LEU 124 Cb 0.18 -4.49 -0.06 0.00 0.01 0.00 0.00 46.19 41.83 2jnf s LEU 124 CO 0.58 -0.43 0.10 -0.44 1.01 0.00 0.00 176.35 177.17 2jnf s SER 125 N -2.07 4.16 0.22 2.29 0.01 -1.26 -4.88 113.70 112.16 2jnf s SER 125 Ca 0.62 -1.23 -0.10 0.00 1.31 0.00 0.00 55.95 56.55 2jnf s SER 125 Cb -0.12 -0.42 0.32 0.00 0.21 0.00 0.00 66.02 66.02 2jnf s SER 125 CO 0.16 -0.51 1.65 0.77 0.41 0.00 0.00 173.24 175.72 2jnf h SER 126 N 1.59 -0.36 -0.15 2.44 4.64 -1.98 0.76 113.55 120.48 2jnf h SER 126 Ca -0.43 0.17 -0.22 0.00 -0.47 0.00 0.00 61.79 60.84 2jnf h SER 126 Cb 1.25 0.32 0.01 0.00 -0.31 0.00 0.00 62.40 63.67 2jnf h SER 126 CO 0.75 -0.15 -0.78 -0.33 -0.87 0.00 0.00 176.83 175.45 2jnf h GLU 127 N 0.09 0.80 -0.35 4.77 5.08 -1.99 -1.35 114.58 121.63 2jnf h GLU 127 Ca 0.34 -0.66 -0.08 0.00 -1.00 0.00 0.00 59.36 57.97 2jnf h GLU 127 Cb 0.57 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2jnf h GLU 127 CO -0.59 1.26 -0.09 -0.44 -1.00 0.00 0.00 179.01 178.15 2jnf h ASP 128 N 0.54 0.69 -0.64 1.42 3.32 -1.70 -2.33 116.42 117.71 2jnf h ASP 128 Ca -0.05 -0.36 -0.05 0.00 0.02 0.00 0.00 57.03 56.59 2jnf h ASP 128 Cb 1.41 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.74 2jnf h ASP 128 CO 0.16 0.89 0.23 0.25 -1.72 0.00 0.00 179.24 179.06 2jnf h LEU 129 N 0.48 0.93 -0.68 1.55 5.85 0.49 -0.17 115.31 123.75 2jnf h LEU 129 Ca 0.09 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 2jnf h LEU 129 Cb 0.59 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 2jnf h LEU 129 CO 0.04 0.86 0.27 -0.78 -0.34 0.00 0.00 178.44 178.48 2jnf h ASP 130 N 0.98 0.95 -0.38 1.25 3.58 -1.12 0.16 116.42 121.84 2jnf h ASP 130 Ca 0.22 -0.17 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 2jnf h ASP 130 Cb 0.24 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.03 2jnf h ASP 130 CO -0.01 0.86 0.20 0.00 -2.88 0.00 0.00 179.24 177.41 2jnf h ALA 131 N 1.12 0.49 -0.69 -0.78 0.00 -0.87 -0.34 119.26 118.18 2jnf h ALA 131 Ca 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2jnf h ALA 131 Cb 0.22 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2jnf h ALA 131 CO -0.02 0.03 0.44 0.52 0.00 0.00 0.00 179.25 180.22 2jnf h MET 132 N 0.49 0.92 -0.26 0.00 2.86 -0.65 0.19 114.93 118.48 2jnf h MET 132 Ca 0.13 -0.07 0.05 0.00 -2.06 0.00 0.00 59.70 57.76 2jnf h MET 132 Cb 0.08 -0.20 -0.05 0.00 0.06 0.00 0.00 31.60 31.48 2jnf h MET 132 CO -0.02 0.63 -0.08 0.82 1.06 0.00 0.00 176.91 179.32 2jnf h ILE 133 N 0.94 0.71 -0.65 -1.22 1.08 -0.32 1.06 117.51 119.11 2jnf h ILE 133 Ca 0.25 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.80 2jnf h ILE 133 Cb -0.08 0.71 -0.06 0.00 -3.07 0.00 0.00 36.82 34.32 2jnf h ILE 133 CO -0.05 0.00 0.31 -0.78 -0.69 0.00 0.00 178.15 176.94 2jnf h ASP 134 N -0.02 0.40 1.31 1.72 3.58 -0.33 -2.59 116.42 120.48 2jnf h ASP 134 Ca 0.13 0.06 -0.14 0.00 0.42 0.00 0.00 57.03 57.50 2jnf h ASP 134 Cb 0.22 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 2jnf h ASP 134 CO -0.28 0.24 -0.70 -0.33 -2.88 0.00 0.00 179.24 175.29 2jnf h GLU 135 N 0.55 0.00 0.38 0.28 5.08 0.23 -3.31 114.58 117.79 2jnf h GLU 135 Ca 0.31 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 2jnf h GLU 135 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2jnf h GLU 135 CO -0.25 0.62 -0.18 0.82 -1.00 0.00 0.00 179.01 179.01 2jnf h ILE 136 N 0.00 0.61 -0.86 3.13 2.04 0.15 -3.35 117.51 119.23 2jnf h ILE 136 Ca -0.02 -0.37 -0.53 0.00 1.00 0.00 0.00 64.86 64.94 2jnf h ILE 136 Cb 1.51 0.79 -0.08 0.00 -0.74 0.00 0.00 36.82 38.30 2jnf h ILE 136 CO 0.08 0.07 1.54 -0.62 0.00 0.00 0.00 178.15 179.22 2jnf s ASP 137 N -4.89 6.14 0.11 1.72 2.15 -1.01 -4.34 116.67 116.55 2jnf s ASP 137 Ca -0.15 -1.69 -0.03 0.00 0.43 0.00 0.00 52.55 51.11 2jnf s ASP 137 Cb 0.03 -2.57 -0.16 0.00 -0.30 0.00 0.00 42.92 39.92 2jnf s ASP 137 CO 0.57 -1.86 1.25 0.00 -0.17 0.00 0.00 175.17 174.96 2jnf h ALA 138 N 9.30 0.28 0.00 3.66 0.00 -1.79 -3.28 119.26 127.42 2jnf h ALA 138 Ca 0.27 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2jnf h ALA 138 Cb 0.95 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2jnf h ALA 138 CO 1.37 0.89 -0.61 -3.47 0.00 0.00 0.00 179.25 177.43 2jnf n ASP 139 N -3.65 0.59 -0.40 0.00 2.03 -1.26 -4.95 116.55 108.91 2jnf n ASP 139 Ca -0.07 -0.33 0.00 0.00 0.52 0.00 0.00 54.79 54.91 2jnf n ASP 139 Cb 0.91 0.39 0.00 0.00 -0.72 0.00 0.00 41.12 41.69 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 1.48 0.90 0.21 0.27 0.00 -1.24 -4.95 105.19 101.86 2jnf n GLY 140 Ca 0.05 -0.65 0.13 0.00 0.00 0.00 0.00 46.02 45.55 2jnf n GLY 140 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2jnf h SER 141 N 0.00 0.00 0.00 1.61 0.02 -1.92 -3.47 113.55 109.79 2jnf h SER 141 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jnf h SER 141 Cb 0.92 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2jnf h SER 141 CO 0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 2jnf n GLY 142 N 0.86 1.79 3.43 -3.77 0.00 -1.26 -4.91 105.19 101.34 2jnf n GLY 142 Ca 0.03 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.33 2.95 -0.13 2.61 -4.23 -1.26 -3.88 115.64 111.37 2jnf s THR 143 Ca 0.00 -0.75 -0.28 0.00 -1.18 0.00 0.00 61.69 59.48 2jnf s THR 143 Cb 0.00 -2.16 -0.01 0.00 1.34 0.00 0.00 72.50 71.66 2jnf s THR 143 CO 0.00 0.58 0.92 -0.69 -0.54 0.00 0.00 174.62 174.89 2jnf s VAL 144 N -0.47 4.83 0.00 2.29 1.01 0.16 -4.85 120.40 123.36 2jnf s VAL 144 Ca 0.06 1.85 0.00 0.00 0.00 0.00 0.00 61.98 63.89 2jnf s VAL 144 Cb -0.12 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.03 2jnf s VAL 144 CO 0.02 0.03 0.00 -0.67 0.00 0.00 0.00 175.10 174.47 2jnf n ASP 145 N 5.03 0.00 0.00 3.32 2.03 -1.26 -1.73 116.55 123.94 2jnf n ASP 145 Ca 0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.38 2jnf n ASP 145 Cb 0.49 0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 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 -1.18 0.00 0.59 -0.67 -1.74 -1.26 -4.04 117.46 109.15 2jnf n PHE 146 Ca 0.00 0.00 0.11 0.00 -0.56 0.00 0.00 57.45 57.00 2jnf n PHE 146 Cb 0.00 0.00 0.02 0.00 1.52 0.00 0.00 39.48 41.02 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 -0.18 0.28 0.02 3.97 1.02 -1.26 -2.52 120.64 121.96 2jnf n GLU 147 Ca 0.00 -0.01 -0.12 0.00 -0.02 0.00 0.00 57.16 57.01 2jnf n GLU 147 Cb 0.00 -1.59 -0.08 0.00 -0.02 0.00 0.00 31.44 29.75 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 -0.01 -0.02 3.49 3.07 -1.82 0.36 114.58 119.66 2jnf h GLU 148 Ca 0.00 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.67 2jnf h GLU 148 Cb 0.72 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.64 2jnf h GLU 148 CO 0.00 0.21 -0.74 0.35 -1.40 0.00 0.00 179.01 177.43 2jnf h PHE 149 N -0.22 0.78 -0.51 4.33 3.04 -1.70 -2.51 116.94 120.15 2jnf h PHE 149 Ca -0.00 -0.41 0.06 0.00 3.98 0.00 0.00 57.97 61.60 2jnf h PHE 149 Cb 0.22 -0.10 -0.05 0.00 2.56 0.00 0.00 35.95 38.58 2jnf h PHE 149 CO -0.00 1.23 0.21 1.98 -2.02 0.00 0.00 178.31 179.71 2jnf h MET 150 N 0.11 0.40 0.00 1.11 4.05 -1.54 0.72 114.93 119.80 2jnf h MET 150 Ca -0.09 -0.02 -0.09 0.00 -0.28 0.00 0.00 59.70 59.22 2jnf h MET 150 Cb 1.42 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 32.11 2jnf h MET 150 CO 0.15 0.27 -0.41 0.78 0.23 0.00 0.00 176.91 177.93 2jnf h GLY 151 N 0.42 0.00 0.91 1.39 0.00 -0.93 -0.89 103.07 103.96 2jnf h GLY 151 Ca 0.24 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.24 2jnf h GLY 151 CO -0.22 0.00 -1.77 -0.24 0.00 0.00 0.00 176.54 174.31 2jnf h VAL 152 N 0.00 0.87 0.00 4.60 3.04 -0.96 -2.99 116.25 120.82 2jnf h VAL 152 Ca -0.00 -2.56 -0.09 0.00 -1.01 0.00 0.00 66.70 63.03 2jnf h VAL 152 Cb 0.80 2.61 -0.01 0.00 -2.01 0.00 0.00 31.29 32.68 2jnf h VAL 152 CO 0.05 0.80 -0.65 -0.03 -1.01 0.00 0.00 177.57 176.74 2jnf h MET 153 N 0.07 0.00 0.05 4.17 -1.53 -0.88 -3.40 114.93 113.40 2jnf h MET 153 Ca -0.34 0.00 -0.33 0.00 -3.44 0.00 0.00 59.70 55.60 2jnf h MET 153 Cb 2.04 0.00 -0.04 0.00 -0.55 0.00 0.00 31.60 33.05 2jnf h MET 153 CO 0.13 0.61 -1.89 0.25 0.14 0.00 0.00 176.91 176.15 2jnf n THR 154 N -4.56 1.66 0.00 -0.77 -2.24 -0.60 -5.06 114.28 102.71 2jnf n THR 154 Ca -0.17 -0.74 0.00 0.00 -2.27 0.00 0.00 64.05 60.87 2jnf n THR 154 Cb 0.44 -1.28 0.00 0.00 -2.10 0.00 0.00 70.33 67.39 2jnf n THR 154 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jnf n GLY 155 N 1.76 0.67 1.05 3.38 0.00 -0.44 -4.46 105.19 107.15 2jnf n GLY 155 Ca -0.25 -1.23 -0.03 0.00 0.00 0.00 0.00 46.02 44.50 2jnf n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jnf n GLY 156 N 0.00 5.46 2.81 -0.02 0.00 -1.26 -3.85 105.19 108.32 2jnf n GLY 156 Ca 0.00 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.01 4.31 -0.19 1.61 9.92 -1.26 -5.18 116.55 124.75 2jnf n ASP 157 Ca 0.28 -2.93 0.02 0.00 -0.53 0.00 0.00 54.79 51.63 2jnf n ASP 157 Cb 0.80 -1.60 0.02 0.00 -0.64 0.00 0.00 41.12 39.70 2jnf n ASP 157 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71