#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c1j h LEU 2 N 0.00 0.00 -0.52 0.27 3.38 -1.58 -2.49 115.31 114.37 1c1j h LEU 2 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1c1j h LEU 2 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1c1j h LEU 2 CO 0.00 0.13 -0.04 -0.07 0.09 0.00 0.00 178.44 178.55 1c1j h LEU 3 N 0.00 0.00 0.18 1.67 3.38 -1.99 -0.52 115.31 118.04 1c1j h LEU 3 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 1c1j h LEU 3 Cb 0.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.25 1c1j h LEU 3 CO 0.02 0.04 -1.75 1.56 0.09 0.00 0.00 178.44 178.40 1c1j h GLN 4 N 0.00 0.38 -0.94 1.13 4.20 -1.89 -3.10 115.11 114.89 1c1j h GLN 4 Ca -0.00 -0.65 0.02 0.00 0.06 0.00 0.00 58.65 58.08 1c1j h GLN 4 Cb 0.85 0.24 -0.05 0.00 0.30 0.00 0.00 27.48 28.83 1c1j h GLN 4 CO 0.00 1.31 0.62 0.35 -0.67 0.00 0.00 178.83 180.45 1c1j h PHE 5 N 0.08 1.17 -0.94 2.96 3.57 -1.29 -1.85 116.94 120.65 1c1j h PHE 5 Ca -0.35 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.21 1c1j h PHE 5 Cb 2.08 -0.39 -0.05 0.00 2.79 0.00 0.00 35.95 40.37 1c1j h PHE 5 CO 0.10 0.71 0.62 -0.09 -2.23 0.00 0.00 178.31 177.42 1c1j h ARG 6 N 1.24 1.16 -0.18 1.11 2.43 -1.15 -2.01 114.38 116.99 1c1j h ARG 6 Ca 0.36 -0.07 -0.19 0.00 -0.81 0.00 0.00 59.98 59.27 1c1j h ARG 6 Cb -0.08 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.20 1c1j h ARG 6 CO -0.09 0.77 -0.66 0.87 -1.51 0.00 0.00 179.97 179.35 1c1j h LYS 7 N 1.19 0.68 -0.92 0.20 1.57 -1.31 -2.00 116.57 115.98 1c1j h LYS 7 Ca 0.37 -0.49 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1c1j h LYS 7 Cb -0.01 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 1c1j h LYS 7 CO -0.11 1.11 0.58 0.52 -0.57 0.00 0.00 179.45 180.98 1c1j h MET 8 N 0.50 1.23 -0.09 3.15 2.86 -0.96 -1.37 114.93 120.25 1c1j h MET 8 Ca -0.02 -0.10 -0.08 0.00 -2.06 0.00 0.00 59.70 57.44 1c1j h MET 8 Cb 1.25 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 32.65 1c1j h MET 8 CO 0.13 0.84 -0.27 0.82 1.06 0.00 0.00 176.91 179.49 1c1j h ILE 9 N 1.26 1.41 -1.00 -1.22 2.04 -1.34 -2.40 117.51 116.26 1c1j h ILE 9 Ca 0.33 -1.63 0.03 0.00 1.00 0.00 0.00 64.86 64.60 1c1j h ILE 9 Cb -0.09 2.23 -0.06 0.00 -0.74 0.00 0.00 36.82 38.16 1c1j h ILE 9 CO -0.07 0.47 0.66 0.50 0.00 0.00 0.00 178.15 179.71 1c1j h LYS 10 N -0.13 1.25 -0.05 2.37 3.64 -1.18 0.23 116.57 122.70 1c1j h LYS 10 Ca -0.01 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 1c1j h LYS 10 Cb 0.90 -0.28 -0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1c1j h LYS 10 CO 0.06 0.83 -0.03 -0.22 -2.27 0.00 0.00 179.45 177.81 1c1j h LYS 11 N 1.29 0.11 0.00 1.90 3.64 -1.28 0.24 116.57 122.48 1c1j h LYS 11 Ca 0.39 -0.05 -0.22 0.00 -1.27 0.00 0.00 60.65 59.49 1c1j h LYS 11 Cb -0.04 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1c1j h LYS 11 CO -0.11 0.52 -0.94 0.52 -2.27 0.00 0.00 179.45 177.17 1c1j h MET 12 N -0.30 0.38 0.02 1.90 2.86 -1.32 -3.37 114.93 115.10 1c1j h MET 12 Ca 0.01 -0.42 -0.35 0.00 -2.06 0.00 0.00 59.70 56.88 1c1j h MET 12 Cb 0.50 0.12 -0.06 0.00 0.06 0.00 0.00 31.60 32.22 1c1j h MET 12 CO 0.01 1.09 -2.18 -2.37 1.06 0.00 0.00 176.91 174.52 1c1j n THR 13 N -3.73 1.52 0.00 2.22 5.66 0.79 -4.80 114.28 115.94 1c1j n THR 13 Ca -0.06 -0.76 0.00 0.00 -3.05 0.00 0.00 64.05 60.18 1c1j n THR 13 Cb 0.84 -0.97 0.00 0.00 -1.55 0.00 0.00 70.33 68.65 1c1j n THR 13 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1c1j n GLY 14 N 1.84 1.74 3.90 1.09 0.00 0.85 -5.03 105.19 109.57 1c1j n GLY 14 Ca -0.31 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 1c1j n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1j s LYS 16 N -0.49 3.62 -0.47 1.61 1.02 -1.26 -5.00 119.74 118.78 1c1j s LYS 16 Ca 0.00 -0.08 -0.29 0.00 0.02 0.00 0.00 55.97 55.62 1c1j s LYS 16 Cb 0.00 -2.80 0.02 0.00 -0.52 0.00 0.00 37.83 34.53 1c1j s LYS 16 CO 0.00 0.42 1.26 -2.00 -0.92 0.00 0.00 175.35 174.11 1c1j s GLU 17 N -2.86 3.62 0.25 1.68 2.56 -1.26 -4.04 118.70 118.65 1c1j s GLU 17 Ca 0.42 0.66 -0.02 0.00 0.00 0.00 0.00 54.97 56.02 1c1j s GLU 17 Cb -0.12 -3.98 0.51 0.00 2.00 0.00 0.00 34.13 32.55 1c1j s GLU 17 CO 0.25 -1.52 1.73 -1.35 -0.56 0.00 0.00 175.26 173.82 1c1j h PRO 18 N 9.92 0.47 -0.10 4.30 0.11 -1.93 -1.17 132.00 143.61 1c1j h PRO 18 Ca -0.25 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.86 1c1j h PRO 18 Cb 1.08 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 1c1j h PRO 18 CO 1.12 0.31 0.11 0.28 -0.21 0.00 0.00 178.00 179.61 1c1j h VAL 19 N 0.48 0.48 0.00 3.15 2.07 -1.95 0.60 116.25 121.09 1c1j h VAL 19 Ca 0.44 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.84 1c1j h VAL 19 Cb 0.69 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1c1j h VAL 19 CO -0.41 0.00 -1.25 0.52 0.02 0.00 0.00 177.57 176.45 1c1j n VAL 20 N -3.80 1.49 0.28 2.57 0.31 -0.73 -4.34 118.33 114.11 1c1j n VAL 20 Ca -0.01 0.03 0.12 0.00 -0.01 0.00 0.00 64.34 64.48 1c1j n VAL 20 Cb 0.21 -2.23 0.22 0.00 -0.91 0.00 0.00 33.84 31.13 1c1j n VAL 20 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1c1j h SER 21 N -1.00 0.00 0.00 4.52 0.02 -1.25 -3.42 113.55 112.43 1c1j h SER 21 Ca -0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1c1j h SER 21 Cb 1.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.59 1c1j h SER 21 CO -0.11 0.00 -0.70 -1.22 -1.14 0.00 0.00 176.83 173.66 1c1j n TYR 22 N -2.98 0.00 0.21 3.45 4.02 0.00 -4.60 117.16 117.26 1c1j n TYR 22 Ca 0.04 0.00 0.18 0.00 -0.01 0.00 0.00 57.90 58.11 1c1j n TYR 22 Cb 0.51 0.00 0.82 0.00 -0.02 0.00 0.00 39.34 40.64 1c1j n TYR 22 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1c1j h ALA 23 N 0.00 1.73 0.00 -0.72 0.00 -1.20 -2.74 119.26 116.33 1c1j h ALA 23 Ca 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1c1j h ALA 23 Cb 0.68 0.02 -0.15 0.00 0.00 0.00 0.00 17.79 18.34 1c1j h ALA 23 CO 0.00 -0.43 -0.63 1.19 0.00 0.00 0.00 179.25 179.38 1c1j n PHE 24 N -3.43 0.00 -2.70 0.00 3.01 -1.26 -4.08 117.46 109.00 1c1j n PHE 24 Ca 0.02 -0.73 -0.36 0.00 1.01 0.00 0.00 57.45 57.39 1c1j n PHE 24 Cb 0.44 -0.15 -0.06 0.00 -0.01 0.00 0.00 39.48 39.70 1c1j n PHE 24 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 1c1j s TYR 25 N -1.27 3.46 0.00 1.38 5.04 -1.03 -0.67 117.35 124.25 1c1j s TYR 25 Ca 0.28 1.70 0.00 0.00 -2.44 0.00 0.00 57.07 56.60 1c1j s TYR 25 Cb 0.29 -2.99 0.00 0.00 0.35 0.00 0.00 41.96 39.61 1c1j s TYR 25 CO -0.08 -0.17 0.00 0.41 -1.34 0.00 0.00 175.55 174.37 1c1j n GLY 26 N 0.24 2.28 0.00 8.97 0.00 0.58 -3.23 105.19 114.03 1c1j n GLY 26 Ca 0.04 -0.19 0.03 0.00 0.00 0.00 0.00 46.02 45.90 1c1j n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1j n TYR 28 N -1.32 0.00 -2.02 0.00 4.02 -1.26 -1.90 117.16 114.68 1c1j n TYR 28 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.48 1c1j n TYR 28 Cb 0.11 -0.06 -0.03 0.00 -0.02 0.00 0.00 39.34 39.34 1c1j n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1c1j n GLY 30 N 2.69 -2.26 3.55 0.00 0.00 -1.26 -4.44 105.19 103.48 1c1j n GLY 30 Ca 0.09 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 43.68 1c1j n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c1j s SER 31 N -3.17 5.99 0.00 1.61 0.01 -1.26 -4.78 113.70 112.10 1c1j s SER 31 Ca 0.00 -0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.07 1c1j s SER 31 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1c1j s SER 31 CO 0.00 -1.92 0.00 0.61 0.41 0.00 0.00 173.24 172.34 1c1j n GLY 32 N 5.42 0.73 0.00 3.44 0.00 -1.26 -5.14 105.19 108.38 1c1j n GLY 32 Ca 0.08 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1c1j n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c1j n GLY 33 N 0.00 4.26 3.19 -0.02 0.00 -1.24 -4.72 105.19 106.66 1c1j n GLY 33 Ca 0.00 -0.68 -0.13 0.00 0.00 0.00 0.00 46.02 45.21 1c1j n GLY 33 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1c1j s ARG 34 N -3.95 0.48 2.39 1.61 3.03 -0.80 -4.96 118.95 116.76 1c1j s ARG 34 Ca 0.00 0.06 0.00 0.00 2.03 0.00 0.00 55.73 57.82 1c1j s ARG 34 Cb 0.00 0.22 0.00 0.00 -1.03 0.00 0.00 34.95 34.14 1c1j s ARG 34 CO 0.00 -0.10 0.00 0.41 -1.13 0.00 0.00 175.30 174.48 1c1j n GLY 35 N 2.08 0.66 3.39 3.88 0.00 -1.17 -4.38 105.19 109.65 1c1j n GLY 35 Ca -0.18 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.31 1c1j n GLY 35 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1c1j s LYS 36 N 0.00 2.46 0.13 1.61 2.20 -1.26 -1.60 119.74 123.28 1c1j s LYS 36 Ca 0.00 -0.79 -0.35 0.00 -0.36 0.00 0.00 55.97 54.47 1c1j s LYS 36 Cb 0.00 -2.27 -0.16 0.00 -1.51 0.00 0.00 37.83 33.89 1c1j s LYS 36 CO 0.00 0.54 1.36 -2.30 -0.36 0.00 0.00 175.35 174.59 1c1j n PRO 37 N 2.52 1.41 0.15 4.03 -0.02 -1.26 -4.79 135.00 137.03 1c1j n PRO 37 Ca -0.17 0.51 -0.14 0.00 -2.02 0.00 0.00 63.50 61.68 1c1j n PRO 37 Cb 0.52 -2.15 -0.08 0.00 -0.02 0.00 0.00 33.50 31.77 1c1j n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1c1j h LYS 38 N 4.60 -0.29 0.00 -0.52 6.56 -1.95 -3.47 116.57 121.50 1c1j h LYS 38 Ca -0.46 0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.15 1c1j h LYS 38 Cb 1.32 0.07 0.00 0.00 -0.57 0.00 0.00 32.23 33.04 1c1j h LYS 38 CO 0.78 -0.15 0.00 0.27 -2.06 0.00 0.00 179.45 178.29 1c1j n ASN 39 N -5.20 0.00 -0.32 0.86 6.94 -1.26 -4.99 115.26 111.29 1c1j n ASN 39 Ca -0.09 -0.71 0.02 0.00 -0.02 0.00 0.00 54.58 53.77 1c1j n ASN 39 Cb 0.16 0.00 0.16 0.00 -2.36 0.00 0.00 39.78 37.74 1c1j n ASN 39 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1c1j h ALA 40 N 1.43 1.25 -0.10 -2.53 0.00 -1.92 -1.39 119.26 115.98 1c1j h ALA 40 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1c1j h ALA 40 Cb 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1c1j h ALA 40 CO 0.00 0.26 -0.59 1.15 0.00 0.00 0.00 179.25 180.07 1c1j h THR 41 N 0.97 1.37 0.00 0.00 2.02 -1.88 -2.92 112.91 112.47 1c1j h THR 41 Ca 0.40 -1.93 -0.08 0.00 0.77 0.00 0.00 66.41 65.58 1c1j h THR 41 Cb 0.24 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.58 1c1j h THR 41 CO -0.20 0.58 -0.37 -0.78 0.37 0.00 0.00 175.52 175.12 1c1j h ASP 42 N 0.25 0.00 0.63 4.18 -0.00 -1.77 -2.64 116.42 117.07 1c1j h ASP 42 Ca -0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.03 56.87 1c1j h ASP 42 Cb 1.11 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.42 1c1j h ASP 42 CO 0.10 0.37 -0.70 -0.09 -0.00 0.00 0.00 179.24 178.91 1c1j h ARG 43 N 0.00 0.06 -0.67 0.28 2.43 -1.13 -1.73 114.38 113.62 1c1j h ARG 43 Ca -0.00 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1c1j h ARG 43 Cb 0.82 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.35 1c1j h ARG 43 CO 0.05 0.74 0.31 0.00 -1.51 0.00 0.00 179.97 179.56 1c1j h PHE 46 N 0.43 0.15 -0.39 0.00 3.04 -0.54 -0.82 116.94 118.82 1c1j h PHE 46 Ca -0.03 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 61.89 1c1j h PHE 46 Cb 1.30 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 39.75 1c1j h PHE 46 CO 0.06 0.09 0.09 0.28 -2.02 0.00 0.00 178.31 176.81 1c1j h VAL 47 N 0.18 1.23 -0.39 1.41 2.07 -1.11 -1.58 116.25 118.06 1c1j h VAL 47 Ca 0.07 -0.78 0.08 0.00 0.82 0.00 0.00 66.70 66.89 1c1j h VAL 47 Cb 0.01 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1c1j h VAL 47 CO -0.05 0.27 0.27 -0.74 0.02 0.00 0.00 177.57 177.34 1c1j h HIS 48 N 0.48 0.20 -0.09 1.57 -0.00 -1.01 0.92 115.15 117.22 1c1j h HIS 48 Ca 0.12 0.01 -0.24 0.00 -0.00 0.00 0.00 60.37 60.26 1c1j h HIS 48 Cb 0.31 -0.07 0.01 0.00 -0.00 0.00 0.00 27.41 27.67 1c1j h HIS 48 CO 0.02 0.10 -0.89 -0.44 -0.00 0.00 0.00 177.93 176.72 1c1j h ASP 49 N 0.20 0.92 0.45 3.26 3.45 -0.57 -2.39 116.42 121.74 1c1j h ASP 49 Ca 0.18 -0.66 -0.08 0.00 0.43 0.00 0.00 57.03 56.91 1c1j h ASP 49 Cb 0.45 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.94 1c1j h ASP 49 CO -0.03 1.46 -0.36 0.00 -1.57 0.00 0.00 179.24 178.74 1c1j h TYR 52 N -0.76 0.00 0.00 0.00 -1.99 -1.31 -0.86 116.97 112.05 1c1j h TYR 52 Ca -0.04 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.61 1c1j h TYR 52 Cb 0.50 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.22 1c1j h TYR 52 CO 0.02 0.00 -0.37 1.49 -0.00 0.00 0.00 178.16 179.30 1c1j h GLU 53 N 0.00 0.00 0.11 4.88 4.57 -1.23 -3.18 114.58 119.74 1c1j h GLU 53 Ca 0.00 0.00 -0.28 0.00 -1.18 0.00 0.00 59.36 57.90 1c1j h GLU 53 Cb 0.11 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1c1j h GLU 53 CO 0.00 0.37 -1.31 0.87 -1.18 0.00 0.00 179.01 177.76 1c1j h LYS 54 N 0.00 0.24 -6.29 1.92 6.56 -1.14 -3.45 116.57 114.41 1c1j h LYS 54 Ca -0.00 -0.41 -0.57 0.00 -1.06 0.00 0.00 60.65 58.61 1c1j h LYS 54 Cb 0.97 0.15 0.02 0.00 -0.57 0.00 0.00 32.23 32.80 1c1j h LYS 54 CO 0.05 1.16 1.21 0.28 -2.06 0.00 0.00 179.45 180.09 1c1j n VAL 55 N -3.49 0.66 -0.09 0.50 0.31 -1.20 -4.87 118.33 110.16 1c1j n VAL 55 Ca -0.10 -0.16 -0.18 0.00 -0.01 0.00 0.00 64.34 63.90 1c1j n VAL 55 Cb 1.02 -2.17 -0.06 0.00 -0.91 0.00 0.00 33.84 31.73 1c1j n VAL 55 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1c1j n THR 56 N 5.63 1.13 0.75 2.52 -1.04 -1.26 -4.76 114.28 117.24 1c1j n THR 56 Ca 0.22 -0.16 0.08 0.00 -2.04 0.00 0.00 64.05 62.15 1c1j n THR 56 Cb 0.37 -1.84 0.41 0.00 -1.82 0.00 0.00 70.33 67.45 1c1j n THR 56 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1c1j n GLY 59 N 1.86 -0.89 3.46 3.41 0.00 -1.26 -4.90 105.19 106.87 1c1j n GLY 59 Ca -0.32 -0.07 -0.16 0.00 0.00 0.00 0.00 46.02 45.47 1c1j n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1j s ASP 67 N -3.27 6.18 0.61 0.00 3.68 -1.26 -4.93 116.67 117.67 1c1j s ASP 67 Ca 0.32 -1.55 0.38 0.00 2.13 0.00 0.00 52.55 53.84 1c1j s ASP 67 Cb -0.00 -2.22 1.98 0.00 -1.45 0.00 0.00 42.92 41.23 1c1j s ASP 67 CO 0.22 -0.82 2.23 1.55 0.13 0.00 0.00 175.17 178.48 1c1j h PRO 68 N 8.88 0.00 0.02 4.34 0.13 -1.92 0.69 132.00 144.14 1c1j h PRO 68 Ca -0.29 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.72 1c1j h PRO 68 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1c1j h PRO 68 CO 0.99 0.02 -0.64 -0.22 -0.23 0.00 0.00 178.00 177.92 1c1j h LYS 69 N 0.00 0.04 -0.07 0.86 3.64 -1.94 -3.33 116.57 115.77 1c1j h LYS 69 Ca -0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1c1j h LYS 69 Cb 0.17 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1c1j h LYS 69 CO 0.00 1.03 0.00 0.91 -2.27 0.00 0.00 179.45 179.13 1c1j n TRP 70 N -4.45 0.07 -3.23 1.91 7.02 -1.20 -1.77 117.44 115.80 1c1j n TRP 70 Ca -0.20 -0.07 -0.39 0.00 -1.02 0.00 0.00 57.50 55.82 1c1j n TRP 70 Cb 0.61 -0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.44 1c1j n TRP 70 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1c1j s ASP 71 N -1.00 6.66 0.08 -0.99 1.01 0.23 -4.78 116.67 117.87 1c1j s ASP 71 Ca 0.16 0.79 -0.30 0.00 0.71 0.00 0.00 52.55 53.90 1c1j s ASP 71 Cb 0.10 -2.31 -0.05 0.00 1.01 0.00 0.00 42.92 41.67 1c1j s ASP 71 CO 0.15 -0.13 1.11 -1.81 0.21 0.00 0.00 175.17 174.70 1c1j s ASP 72 N 0.96 7.22 0.54 0.27 1.01 -1.26 0.88 116.67 126.28 1c1j s ASP 72 Ca 0.27 1.93 0.04 0.00 0.71 0.00 0.00 52.55 55.49 1c1j s ASP 72 Cb -0.16 -2.58 0.02 0.00 1.01 0.00 0.00 42.92 41.21 1c1j s ASP 72 CO 0.11 -0.34 0.26 -0.72 0.21 0.00 0.00 175.17 174.68 1c1j s TYR 73 N 0.69 1.69 -0.08 4.23 -0.85 -1.26 -4.84 117.35 116.94 1c1j s TYR 73 Ca 0.54 -0.89 0.05 0.00 -0.52 0.00 0.00 57.07 56.25 1c1j s TYR 73 Cb -0.27 -1.80 -0.00 0.00 0.38 0.00 0.00 41.96 40.27 1c1j s TYR 73 CO 0.30 -0.22 -0.23 -0.08 -1.52 0.00 0.00 175.55 173.80 1c1j s THR 74 N -2.82 1.93 0.26 -3.49 -1.32 -1.26 -4.95 115.64 104.00 1c1j s THR 74 Ca 0.23 -0.97 -0.12 0.00 -1.21 0.00 0.00 61.69 59.61 1c1j s THR 74 Cb -0.01 -1.66 -0.00 0.00 -1.51 0.00 0.00 72.50 69.32 1c1j s THR 74 CO 0.14 0.54 0.50 -0.72 -2.21 0.00 0.00 174.62 172.87 1c1j s TYR 75 N 0.14 0.41 -0.04 9.09 1.13 -1.26 -1.04 117.35 125.78 1c1j s TYR 75 Ca -0.11 -0.77 -0.08 0.00 -1.41 0.00 0.00 57.07 54.69 1c1j s TYR 75 Cb -0.16 0.21 0.01 0.00 -1.10 0.00 0.00 41.96 40.93 1c1j s TYR 75 CO 0.06 -1.04 0.19 -1.54 -2.51 0.00 0.00 175.55 170.71 1c1j s SER 76 N -3.04 -0.12 -0.13 -0.18 1.04 0.15 -4.90 113.70 106.53 1c1j s SER 76 Ca 0.23 0.13 0.01 0.00 0.48 0.00 0.00 55.95 56.80 1c1j s SER 76 Cb -0.01 0.33 0.17 0.00 0.10 0.00 0.00 66.02 66.61 1c1j s SER 76 CO 0.10 -0.24 1.36 0.79 0.98 0.00 0.00 173.24 176.24 1c1j n TRP 77 N 2.16 0.84 -1.55 5.02 7.02 -1.26 0.25 117.44 129.92 1c1j n TRP 77 Ca -0.18 -0.97 -0.44 0.00 -1.02 0.00 0.00 57.50 54.89 1c1j n TRP 77 Cb 0.57 -0.49 -0.04 0.00 -2.42 0.00 0.00 31.31 28.93 1c1j n TRP 77 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 1c1j n LYS 78 N 0.17 1.61 -2.40 -0.99 4.81 -1.03 -2.66 118.16 117.66 1c1j n LYS 78 Ca 0.16 0.41 -0.04 0.00 -0.87 0.00 0.00 58.31 57.97 1c1j n LYS 78 Cb 0.78 -3.03 0.02 0.00 0.02 0.00 0.00 35.03 32.82 1c1j n LYS 78 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1c1j n ASN 79 N 11.62 -2.24 0.00 3.14 2.85 -1.26 -3.49 115.26 125.89 1c1j n ASN 79 Ca 0.34 -0.12 0.00 0.00 -0.11 0.00 0.00 54.58 54.69 1c1j n ASN 79 Cb 0.39 -1.44 0.00 0.00 1.24 0.00 0.00 39.78 39.97 1c1j n ASN 79 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1c1j n GLY 80 N -0.97 0.00 3.17 8.20 0.00 -1.09 -4.92 105.19 109.59 1c1j n GLY 80 Ca -0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 1c1j n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c1j s THR 81 N -0.93 1.27 0.13 2.61 2.01 -1.23 -5.08 115.64 114.42 1c1j s THR 81 Ca 0.00 -1.05 -0.30 0.00 0.31 0.00 0.00 61.69 60.64 1c1j s THR 81 Cb 0.00 -1.13 -0.07 0.00 0.01 0.00 0.00 72.50 71.31 1c1j s THR 81 CO 0.00 0.06 1.20 -0.63 -0.69 0.00 0.00 174.62 174.56 1c1j s ILE 82 N -0.83 3.80 -0.32 1.82 1.01 -1.26 -2.48 121.20 122.94 1c1j s ILE 82 Ca 0.03 1.40 0.03 0.00 0.00 0.00 0.00 60.65 62.11 1c1j s ILE 82 Cb -0.08 -3.89 0.09 0.00 0.01 0.00 0.00 42.46 38.59 1c1j s ILE 82 CO 0.01 0.17 0.02 -0.69 0.00 0.00 0.00 174.94 174.46 1c1j s VAL 83 N 0.48 2.13 0.06 2.92 1.01 0.70 -4.91 120.40 122.79 1c1j s VAL 83 Ca 0.56 -2.12 -0.30 0.00 0.00 0.00 0.00 61.98 60.11 1c1j s VAL 83 Cb -0.31 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 1c1j s VAL 83 CO 0.33 -0.50 1.13 0.00 0.00 0.00 0.00 175.10 176.06 1c1j n GLY 85 N 3.00 5.68 0.00 0.00 0.00 -0.20 -4.96 105.19 108.70 1c1j n GLY 85 Ca 0.07 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1c1j n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c1j n GLY 86 N 1.77 0.84 0.01 -0.02 0.00 -1.26 -4.53 105.19 102.00 1c1j n GLY 86 Ca 0.00 -1.86 0.11 0.00 0.00 0.00 0.00 46.02 44.27 1c1j n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1c1j n ASP 88 N -0.50 0.69 -4.63 1.61 8.00 -1.26 -4.84 116.55 115.62 1c1j n ASP 88 Ca 0.00 -0.49 -0.41 0.00 0.71 0.00 0.00 54.79 54.60 1c1j n ASP 88 Cb 0.00 0.69 -0.06 0.00 -0.02 0.00 0.00 41.12 41.73 1c1j n ASP 88 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1c1j s ASP 89 N -3.29 6.63 0.22 -2.24 -1.08 -1.26 -4.95 116.67 110.70 1c1j s ASP 89 Ca 0.08 0.77 0.10 0.00 -0.52 0.00 0.00 52.55 52.98 1c1j s ASP 89 Cb 0.16 -2.35 0.14 0.00 -1.46 0.00 0.00 42.92 39.40 1c1j s ASP 89 CO 0.79 -0.37 1.48 -0.65 0.52 0.00 0.00 175.17 176.94 1c1j h PRO 90 N 7.79 0.00 -0.21 4.34 0.11 -1.95 -1.85 132.00 140.23 1c1j h PRO 90 Ca -0.27 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.80 1c1j h PRO 90 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1c1j h PRO 90 CO 0.78 0.74 -0.03 0.00 -0.21 0.00 0.00 178.00 179.29 1c1j h LYS 92 N 0.12 0.93 -0.48 0.00 1.57 -1.97 -1.81 116.57 114.93 1c1j h LYS 92 Ca 0.06 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.46 1c1j h LYS 92 Cb 0.45 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 1c1j h LYS 92 CO 0.02 1.01 0.22 -0.22 -0.57 0.00 0.00 179.45 179.91 1c1j h LYS 93 N 0.78 0.68 0.30 3.15 3.64 -1.23 -0.67 116.57 123.21 1c1j h LYS 93 Ca 0.12 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1c1j h LYS 93 Cb 0.67 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1c1j h LYS 93 CO 0.05 0.53 -0.14 1.49 -2.27 0.00 0.00 179.45 179.11 1c1j h GLU 94 N 0.68 -0.38 -0.08 1.90 4.81 -0.03 -0.90 114.58 120.56 1c1j h GLU 94 Ca 0.17 0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.38 1c1j h GLU 94 Cb 0.09 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1c1j h GLU 94 CO -0.02 -0.23 -0.15 -0.39 -0.73 0.00 0.00 179.01 177.50 1c1j h VAL 95 N -0.44 1.15 -0.43 0.32 -1.51 -0.89 -1.75 116.25 112.71 1c1j h VAL 95 Ca -0.04 -0.69 -0.09 0.00 -1.23 0.00 0.00 66.70 64.65 1c1j h VAL 95 Cb 0.33 1.26 -0.02 0.00 -2.13 0.00 0.00 31.29 30.73 1c1j h VAL 95 CO 0.07 0.21 -0.10 0.00 -1.23 0.00 0.00 177.57 176.52 1c1j h GLU 97 N 0.69 0.00 0.27 0.00 4.39 -0.32 0.13 114.58 119.75 1c1j h GLU 97 Ca 0.12 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1c1j h GLU 97 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1c1j h GLU 97 CO 0.04 0.40 -0.13 0.00 -1.16 0.00 0.00 179.01 178.16 1c1j h ASP 99 N -0.62 0.34 -0.94 0.00 3.45 -1.12 -2.21 116.42 115.33 1c1j h ASP 99 Ca -0.04 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.45 1c1j h ASP 99 Cb 0.44 -0.04 -0.05 0.00 -0.56 0.00 0.00 39.33 39.12 1c1j h ASP 99 CO 0.06 0.24 0.60 0.50 -1.57 0.00 0.00 179.24 179.08 1c1j h LYS 100 N 0.46 1.24 -0.43 3.56 3.64 -0.97 -2.28 116.57 121.79 1c1j h LYS 100 Ca 0.19 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.37 1c1j h LYS 100 Cb 0.09 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1c1j h LYS 100 CO -0.13 0.84 -0.20 0.00 -2.27 0.00 0.00 179.45 177.69 1c1j h ALA 101 N 1.33 0.83 -0.17 5.00 0.00 -1.01 -2.71 119.26 122.54 1c1j h ALA 101 Ca 0.34 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1c1j h ALA 101 Cb -0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1c1j h ALA 101 CO -0.07 0.64 -0.04 0.00 0.00 0.00 0.00 179.25 179.78 1c1j h ALA 102 N 1.02 0.23 -0.63 0.00 0.00 -1.14 -0.40 119.26 118.34 1c1j h ALA 102 Ca 0.11 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.82 1c1j h ALA 102 Cb 0.73 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1c1j h ALA 102 CO 0.06 -0.01 0.35 0.00 0.00 0.00 0.00 179.25 179.65 1c1j h ALA 103 N 0.72 0.83 -0.30 0.00 0.00 -1.44 0.25 119.26 119.31 1c1j h ALA 103 Ca 0.04 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1c1j h ALA 103 Cb 0.48 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1c1j h ALA 103 CO 0.02 0.04 0.17 0.82 0.00 0.00 0.00 179.25 180.30 1c1j h ILE 104 N 0.67 1.12 -0.61 0.00 2.04 -1.40 -1.79 117.51 117.54 1c1j h ILE 104 Ca 0.28 -0.31 0.07 0.00 1.00 0.00 0.00 64.86 65.90 1c1j h ILE 104 Cb 0.14 0.79 -0.06 0.00 -0.74 0.00 0.00 36.82 36.95 1c1j h ILE 104 CO -0.16 0.12 0.28 0.00 0.00 0.00 0.00 178.15 178.39 1c1j h PHE 106 N 0.51 1.07 -0.33 0.00 0.04 -0.29 -2.54 116.94 115.40 1c1j h PHE 106 Ca 0.29 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 61.04 1c1j h PHE 106 Cb 0.28 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 1c1j h PHE 106 CO -0.12 0.72 0.15 -0.09 -0.60 0.00 0.00 178.31 178.37 1c1j h ARG 107 N 1.10 0.47 0.00 1.51 1.12 -0.39 -1.63 114.38 116.57 1c1j h ARG 107 Ca 0.29 -0.07 -0.03 0.00 -1.11 0.00 0.00 59.98 59.06 1c1j h ARG 107 Cb -0.02 -0.08 -0.00 0.00 -0.01 0.00 0.00 29.97 29.85 1c1j h ARG 107 CO -0.05 0.45 -0.12 -0.44 -3.11 0.00 0.00 179.97 176.69 1c1j h ASP 108 N 0.39 0.00 -0.23 -3.80 3.32 -1.01 -3.06 116.42 112.03 1c1j h ASP 108 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1c1j h ASP 108 Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1c1j h ASP 108 CO -0.01 0.12 0.00 0.59 -1.72 0.00 0.00 179.24 178.22 1c1j n ASN 109 N -3.39 2.66 -0.37 6.45 3.02 -0.97 -4.63 115.26 118.03 1c1j n ASN 109 Ca -0.01 -1.79 0.36 0.00 -0.03 0.00 0.00 54.58 53.11 1c1j n ASN 109 Cb 0.31 -0.15 0.73 0.00 -0.61 0.00 0.00 39.78 40.06 1c1j n ASN 109 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1c1j h LEU 110 N 2.58 0.07 -1.41 3.41 5.85 -1.19 0.41 115.31 125.03 1c1j h LEU 110 Ca 0.00 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1c1j h LEU 110 Cb 0.68 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1c1j h LEU 110 CO 0.00 0.00 -0.23 0.07 -0.34 0.00 0.00 178.44 177.94 1c1j h LYS 111 N 0.05 0.00 -0.40 1.25 2.10 -1.84 -2.86 116.57 114.88 1c1j h LYS 111 Ca 0.62 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.27 1c1j h LYS 111 Cb 2.35 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.68 1c1j h LYS 111 CO -0.06 0.23 0.00 0.25 -2.00 0.00 0.00 179.45 177.86 1c1j n THR 112 N -3.59 2.50 -2.46 0.07 -2.24 0.13 -4.97 114.28 103.72 1c1j n THR 112 Ca -0.01 -1.67 -0.43 0.00 -2.27 0.00 0.00 64.05 59.67 1c1j n THR 112 Cb 0.37 -0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 1c1j n THR 112 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1c1j s TYR 113 N -2.80 3.03 -0.19 4.78 6.14 -1.08 -4.84 117.35 122.39 1c1j s TYR 113 Ca 0.48 1.14 -0.06 0.00 0.64 0.00 0.00 57.07 59.26 1c1j s TYR 113 Cb 0.38 -3.45 -0.03 0.00 0.42 0.00 0.00 41.96 39.28 1c1j s TYR 113 CO 0.12 -1.42 0.03 0.15 0.64 0.00 0.00 175.55 175.08 1c1j s LYS 114 N 2.97 3.79 0.46 4.97 3.01 -1.26 -4.99 119.74 128.69 1c1j s LYS 114 Ca 0.54 -0.44 0.31 0.00 -1.01 0.00 0.00 55.97 55.38 1c1j s LYS 114 Cb -0.22 -3.16 1.47 0.00 -1.01 0.00 0.00 37.83 34.91 1c1j s LYS 114 CO 0.17 0.13 1.94 -0.22 0.51 0.00 0.00 175.35 177.87 1c1j h LYS 115 N 7.16 0.00 0.00 1.68 3.64 -1.96 -2.43 116.57 124.66 1c1j h LYS 115 Ca -0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1c1j h LYS 115 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1c1j h LYS 115 CO 0.64 0.00 0.00 0.07 -2.27 0.00 0.00 179.45 177.89 1c1j h ARG 116 N 0.00 0.00 0.00 1.90 0.11 -2.01 -3.14 114.38 111.23 1c1j h ARG 116 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1c1j h ARG 116 Cb 0.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.34 1c1j h ARG 116 CO 0.00 0.00 -1.07 0.66 0.10 0.00 0.00 179.97 179.66 1c1j n TYR 117 N -2.52 0.58 -2.36 4.08 4.01 -0.91 -4.65 117.16 115.38 1c1j n TYR 117 Ca 0.03 0.17 -0.35 0.00 -0.16 0.00 0.00 57.90 57.59 1c1j n TYR 117 Cb 0.34 -0.70 -0.01 0.00 -0.31 0.00 0.00 39.34 38.66 1c1j n TYR 117 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1c1j s MET 118 N -3.30 3.55 -1.53 -0.72 0.23 -1.19 -0.31 119.30 116.04 1c1j s MET 118 Ca 0.01 1.55 -0.05 0.00 -1.03 0.00 0.00 55.69 56.17 1c1j s MET 118 Cb 0.12 -2.08 0.02 0.00 -1.53 0.00 0.00 34.83 31.35 1c1j s MET 118 CO 0.80 -0.67 0.51 0.00 -2.03 0.00 0.00 175.02 173.63 1c1j n ALA 119 N -1.09 -0.95 -2.59 3.16 0.00 0.15 -4.89 120.51 114.30 1c1j n ALA 119 Ca 0.10 0.24 -0.42 0.00 0.00 0.00 0.00 53.44 53.37 1c1j n ALA 119 Cb 0.51 -3.50 -0.03 0.00 0.00 0.00 0.00 19.45 16.43 1c1j n ALA 119 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1c1j s TYR 120 N -3.11 3.70 0.16 0.00 5.04 -1.04 -5.02 117.35 117.07 1c1j s TYR 120 Ca 0.28 1.70 -0.31 0.00 -2.44 0.00 0.00 57.07 56.30 1c1j s TYR 120 Cb -0.13 -3.08 -0.08 0.00 0.35 0.00 0.00 41.96 39.02 1c1j s TYR 120 CO 0.35 0.06 1.36 -2.14 -1.34 0.00 0.00 175.55 173.83 1c1j s PRO 121 N 0.72 4.35 0.28 4.97 0.02 -1.26 -4.86 135.00 139.22 1c1j s PRO 121 Ca 0.50 2.08 0.07 0.00 0.02 0.00 0.00 61.00 63.66 1c1j s PRO 121 Cb -0.21 -3.22 0.41 0.00 0.02 0.00 0.00 34.50 31.50 1c1j s PRO 121 CO 0.28 -0.36 1.66 -0.44 -0.33 0.00 0.00 177.00 177.81 1c1j h ASP 122 N 6.13 0.21 -0.03 2.53 3.32 -1.95 -2.86 116.42 123.77 1c1j h ASP 122 Ca -0.43 -0.10 0.01 0.00 0.02 0.00 0.00 57.03 56.53 1c1j h ASP 122 Cb 1.21 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 1c1j h ASP 122 CO 0.82 0.66 0.04 0.16 -1.72 0.00 0.00 179.24 179.20 1c1j h ILE 124 N 0.16 0.43 -0.00 0.35 -0.00 -2.00 0.20 117.51 116.64 1c1j h ILE 124 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.87 1c1j h ILE 124 Cb 0.91 0.97 0.00 0.00 -0.00 0.00 0.00 36.82 38.70 1c1j h ILE 124 CO 0.07 0.00 -0.02 0.18 -0.00 0.00 0.00 178.15 178.38 1c1j n LEU 125 N -3.70 0.04 -4.82 0.16 4.77 -1.08 -4.86 117.00 107.50 1c1j n LEU 125 Ca -0.02 0.37 -0.33 0.00 -0.03 0.00 0.00 56.01 55.99 1c1j n LEU 125 Cb 0.13 -0.38 -0.07 0.00 -2.33 0.00 0.00 43.42 40.77 1c1j n LEU 125 CO 0.26 0.01 0.60 0.00 -1.33 0.00 0.00 177.39 176.93 1c1j n SER 127 N -0.48 -2.08 0.11 0.00 2.88 -1.26 -4.80 113.62 108.00 1c1j n SER 127 Ca 0.06 0.59 0.11 0.00 -1.33 0.00 0.00 58.87 58.30 1c1j n SER 127 Cb 0.53 -1.10 0.01 0.00 -0.75 0.00 0.00 64.21 62.91 1c1j n SER 127 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1c1j h SER 128 N -0.26 0.00 -3.19 -3.46 0.02 -1.93 -3.10 113.55 101.63 1c1j h SER 128 Ca -0.44 0.00 -0.74 0.00 -0.84 0.00 0.00 61.79 59.76 1c1j h SER 128 Cb 1.37 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 63.65 1c1j h SER 128 CO 0.41 0.04 -0.30 -0.75 -1.14 0.00 0.00 176.83 175.09 1c1j s LYS 129 N -3.33 2.74 0.43 3.45 2.47 -1.26 -4.85 119.74 119.39 1c1j s LYS 129 Ca -0.00 -1.74 -0.23 0.00 -1.56 0.00 0.00 55.97 52.44 1c1j s LYS 129 Cb 0.09 -4.12 -0.08 0.00 -1.46 0.00 0.00 37.83 32.26 1c1j s LYS 129 CO 0.78 -1.26 1.08 -1.12 0.16 0.00 0.00 175.35 174.99 1c1j s SER 130 N 3.14 6.52 0.56 1.43 0.01 -1.25 -4.14 113.70 119.96 1c1j s SER 130 Ca 0.04 2.09 -0.16 0.00 1.31 0.00 0.00 55.95 59.24 1c1j s SER 130 Cb -0.28 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.31 1c1j s SER 130 CO 0.01 -0.66 1.02 -0.70 0.41 0.00 0.00 173.24 173.32 1c1j s GLU 131 N -2.68 3.61 -0.06 12.44 2.12 -0.63 -4.93 118.70 128.57 1c1j s GLU 131 Ca 0.61 1.07 -0.18 0.00 0.36 0.00 0.00 54.97 56.83 1c1j s GLU 131 Cb -0.23 -2.08 -0.05 0.00 0.26 0.00 0.00 34.13 32.03 1c1j s GLU 131 CO 0.28 -0.56 0.49 0.15 -0.54 0.00 0.00 175.26 175.08 1c1j s LYS 132 N -4.14 4.24 0.00 4.30 3.01 -1.26 -5.04 119.74 120.85 1c1j s LYS 132 Ca 0.61 0.51 0.00 0.00 -1.01 0.00 0.00 55.97 56.08 1c1j s LYS 132 Cb -0.13 -3.36 0.00 0.00 -1.01 0.00 0.00 37.83 33.33 1c1j s LYS 132 CO 0.35 0.33 0.43 0.00 0.51 0.00 0.00 175.35 176.98