#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 -0.83 0.27 3.38 -1.61 -2.50 115.31 114.01 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 0.28 -0.04 -0.07 0.09 0.00 0.00 178.44 178.70 1c1j h LEU 3 N 0.00 0.00 0.17 1.67 3.38 -1.99 -0.45 115.31 118.09 1c1j h LEU 3 Ca -0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 1c1j h LEU 3 Cb 0.68 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.43 1c1j h LEU 3 CO 0.04 0.04 -1.71 1.56 0.09 0.00 0.00 178.44 178.46 1c1j h GLN 4 N 0.00 0.36 -0.70 1.13 4.20 -1.90 -3.09 115.11 115.11 1c1j h GLN 4 Ca -0.00 -0.62 0.02 0.00 0.06 0.00 0.00 58.65 58.11 1c1j h GLN 4 Cb 0.75 0.23 -0.04 0.00 0.30 0.00 0.00 27.48 28.72 1c1j h GLN 4 CO 0.00 1.27 0.44 0.35 -0.67 0.00 0.00 178.83 180.23 1c1j h PHE 5 N 0.10 0.83 -0.92 2.96 3.57 -1.18 -1.91 116.94 120.39 1c1j h PHE 5 Ca -0.32 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.27 1c1j h PHE 5 Cb 2.08 -0.27 -0.06 0.00 2.79 0.00 0.00 35.95 40.49 1c1j h PHE 5 CO 0.09 0.49 0.60 -0.09 -2.23 0.00 0.00 178.31 177.17 1c1j h ARG 6 N 0.87 1.00 -0.24 1.11 2.43 -1.12 -1.70 114.38 116.73 1c1j h ARG 6 Ca 0.27 -0.06 -0.19 0.00 -0.81 0.00 0.00 59.98 59.19 1c1j h ARG 6 Cb -0.01 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.31 1c1j h ARG 6 CO -0.09 0.66 -0.60 0.87 -1.51 0.00 0.00 179.97 179.29 1c1j h LYS 7 N 1.03 0.80 -0.88 0.20 1.57 -1.32 -1.78 116.57 116.19 1c1j h LYS 7 Ca 0.40 -0.54 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1c1j h LYS 7 Cb 0.23 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 1c1j h LYS 7 CO -0.16 1.16 0.54 0.52 -0.57 0.00 0.00 179.45 180.95 1c1j h MET 8 N 0.60 1.18 -0.12 3.15 2.86 -0.78 -1.05 114.93 120.77 1c1j h MET 8 Ca -0.00 -0.10 -0.07 0.00 -2.06 0.00 0.00 59.70 57.47 1c1j h MET 8 Cb 1.20 -0.25 -0.00 0.00 0.06 0.00 0.00 31.60 32.61 1c1j h MET 8 CO 0.13 0.82 -0.19 0.82 1.06 0.00 0.00 176.91 179.54 1c1j h ILE 9 N 1.21 1.37 -0.95 -1.22 2.04 -1.25 -2.06 117.51 116.65 1c1j h ILE 9 Ca 0.32 -1.43 0.02 0.00 1.00 0.00 0.00 64.86 64.76 1c1j h ILE 9 Cb -0.08 2.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.97 1c1j h ILE 9 CO -0.06 0.42 0.62 0.50 0.00 0.00 0.00 178.15 179.63 1c1j h LYS 10 N -0.06 1.22 -0.09 2.37 3.64 -1.10 0.13 116.57 122.68 1c1j h LYS 10 Ca 0.01 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 1c1j h LYS 10 Cb 0.76 -0.28 -0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1c1j h LYS 10 CO 0.04 0.81 -0.03 -0.22 -2.27 0.00 0.00 179.45 177.78 1c1j h LYS 11 N 1.26 0.19 0.03 1.90 3.64 -1.17 0.24 116.57 122.66 1c1j h LYS 11 Ca 0.36 -0.07 -0.22 0.00 -1.27 0.00 0.00 60.65 59.44 1c1j h LYS 11 Cb -0.11 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1c1j h LYS 11 CO -0.09 0.51 -0.98 0.52 -2.27 0.00 0.00 179.45 177.15 1c1j h MET 12 N -0.15 0.21 0.02 1.90 2.86 -1.30 -3.38 114.93 115.10 1c1j h MET 12 Ca 0.02 -0.27 -0.37 0.00 -2.06 0.00 0.00 59.70 57.03 1c1j h MET 12 Cb 0.45 0.09 -0.06 0.00 0.06 0.00 0.00 31.60 32.14 1c1j h MET 12 CO 0.01 1.03 -2.26 -2.37 1.06 0.00 0.00 176.91 174.38 1c1j n THR 13 N -3.60 1.52 0.00 2.22 5.66 0.45 -4.80 114.28 115.73 1c1j n THR 13 Ca -0.05 -0.72 0.00 0.00 -3.05 0.00 0.00 64.05 60.24 1c1j n THR 13 Cb 0.87 -1.08 0.00 0.00 -1.55 0.00 0.00 70.33 68.57 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 1.94 1.79 3.90 1.09 0.00 0.85 -5.04 105.19 109.72 1c1j n GLY 14 Ca -0.35 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.60 3.62 -0.45 1.61 1.02 -1.26 -5.00 119.74 118.69 1c1j s LYS 16 Ca 0.00 -0.09 -0.29 0.00 0.02 0.00 0.00 55.97 55.61 1c1j s LYS 16 Cb 0.00 -2.81 0.01 0.00 -0.52 0.00 0.00 37.83 34.52 1c1j s LYS 16 CO 0.00 0.42 1.35 -2.00 -0.92 0.00 0.00 175.35 174.20 1c1j s GLU 17 N -2.86 3.56 0.25 1.68 2.56 -1.26 -4.00 118.70 118.62 1c1j s GLU 17 Ca 0.41 0.78 -0.04 0.00 0.00 0.00 0.00 54.97 56.12 1c1j s GLU 17 Cb -0.12 -4.02 0.46 0.00 2.00 0.00 0.00 34.13 32.46 1c1j s GLU 17 CO 0.26 -1.59 1.73 -1.35 -0.56 0.00 0.00 175.26 173.75 1c1j h PRO 18 N 10.44 0.45 -0.31 4.30 0.11 -1.92 -0.96 132.00 144.10 1c1j h PRO 18 Ca -0.26 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.91 1c1j h PRO 18 Cb 1.09 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1c1j h PRO 18 CO 1.11 0.30 0.28 0.28 -0.21 0.00 0.00 178.00 179.75 1c1j h VAL 19 N 0.46 0.59 0.00 3.15 2.07 -1.95 0.06 116.25 120.64 1c1j h VAL 19 Ca 0.42 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.74 1c1j h VAL 19 Cb 0.62 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1c1j h VAL 19 CO -0.40 0.00 -1.52 0.52 0.02 0.00 0.00 177.57 176.20 1c1j n VAL 20 N -4.05 1.50 0.25 2.57 0.31 -0.78 -4.34 118.33 113.81 1c1j n VAL 20 Ca 0.05 -0.06 0.12 0.00 -0.01 0.00 0.00 64.34 64.44 1c1j n VAL 20 Cb 0.44 -2.15 0.18 0.00 -0.91 0.00 0.00 33.84 31.40 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 -1.18 -3.41 113.55 112.49 1c1j h SER 21 Ca -0.30 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1c1j h SER 21 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1c1j h SER 21 CO -0.18 0.00 -0.68 -1.22 -1.14 0.00 0.00 176.83 173.61 1c1j n TYR 22 N -3.01 0.00 0.30 3.45 4.02 -0.16 -4.57 117.16 117.19 1c1j n TYR 22 Ca 0.04 0.00 0.19 0.00 -0.01 0.00 0.00 57.90 58.12 1c1j n TYR 22 Cb 0.52 0.00 0.97 0.00 -0.02 0.00 0.00 39.34 40.82 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 1.37 0.00 -0.72 0.00 -1.30 -2.82 119.26 115.79 1c1j h ALA 23 Ca 0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1c1j h ALA 23 Cb 0.44 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.13 1c1j h ALA 23 CO 0.00 -0.19 -0.56 1.19 0.00 0.00 0.00 179.25 179.69 1c1j n PHE 24 N -3.28 0.00 -2.82 0.00 3.01 -1.26 -3.68 117.46 109.43 1c1j n PHE 24 Ca -0.01 -0.53 -0.40 0.00 1.01 0.00 0.00 57.45 57.52 1c1j n PHE 24 Cb 0.24 -0.12 -0.05 0.00 -0.01 0.00 0.00 39.48 39.53 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 -0.96 3.87 0.00 1.38 5.04 -1.06 -1.12 117.35 124.50 1c1j s TYR 25 Ca 0.21 1.75 0.00 0.00 -2.44 0.00 0.00 57.07 56.59 1c1j s TYR 25 Cb 0.21 -2.94 0.00 0.00 0.35 0.00 0.00 41.96 39.58 1c1j s TYR 25 CO -0.05 0.34 0.00 0.41 -1.34 0.00 0.00 175.55 174.91 1c1j n GLY 26 N 1.94 0.98 0.02 8.97 0.00 0.51 -2.45 105.19 115.16 1c1j n GLY 26 Ca -0.01 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.87 0.00 -0.11 0.00 4.02 -1.25 -3.82 117.16 114.13 1c1j n TYR 28 Ca 0.01 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.82 1c1j n TYR 28 Cb 0.43 -0.24 -0.00 0.00 -0.02 0.00 0.00 39.34 39.50 1c1j n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1c1j s GLY 30 N -2.53 2.90 0.00 0.00 0.00 -1.23 -4.73 107.32 101.73 1c1j s GLY 30 Ca -0.13 1.21 0.00 0.00 0.00 0.00 0.00 44.72 45.80 1c1j s GLY 30 CO 0.72 1.77 0.00 -1.14 0.00 0.00 0.00 173.10 174.45 1c1j n SER 31 N -0.11 0.00 0.00 1.64 3.41 -1.26 -4.25 113.62 113.05 1c1j n SER 31 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1c1j n SER 31 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 1c1j n SER 31 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c1j n GLY 32 N 0.00 0.55 0.00 5.00 0.00 -1.26 -4.97 105.19 104.50 1c1j n GLY 32 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 3.18 3.66 -0.02 0.00 -1.26 -4.52 105.19 106.23 1c1j n GLY 33 Ca 0.00 0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1c1j n GLY 33 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1c1j s ARG 34 N -0.42 2.09 2.15 1.61 3.52 -1.25 -4.99 118.95 121.66 1c1j s ARG 34 Ca 0.00 -2.32 0.00 0.00 -0.13 0.00 0.00 55.73 53.28 1c1j s ARG 34 Cb 0.00 -1.13 0.00 0.00 -1.56 0.00 0.00 34.95 32.26 1c1j s ARG 34 CO 0.00 -0.42 0.00 0.41 -0.81 0.00 0.00 175.30 174.48 1c1j n GLY 35 N -1.12 -0.62 3.88 8.12 0.00 -0.83 -4.58 105.19 110.04 1c1j n GLY 35 Ca -0.14 -1.07 -0.36 0.00 0.00 0.00 0.00 46.02 44.46 1c1j n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1j s LYS 36 N 0.00 3.53 0.17 1.61 1.02 -1.26 -3.16 119.74 121.66 1c1j s LYS 36 Ca 0.00 -0.09 -0.33 0.00 0.02 0.00 0.00 55.97 55.57 1c1j s LYS 36 Cb 0.00 -3.14 -0.15 0.00 -0.52 0.00 0.00 37.83 34.02 1c1j s LYS 36 CO 0.00 0.71 1.41 -2.30 -0.92 0.00 0.00 175.35 174.25 1c1j n PRO 37 N 1.53 1.76 0.05 -1.68 -0.02 -1.26 -4.79 135.00 130.58 1c1j n PRO 37 Ca -0.15 0.63 -0.12 0.00 -2.02 0.00 0.00 63.50 61.83 1c1j n PRO 37 Cb 0.54 -2.29 -0.07 0.00 -0.02 0.00 0.00 33.50 31.65 1c1j n PRO 37 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1c1j h LYS 38 N 4.68 -0.04 0.00 -0.52 1.63 -1.95 -3.47 116.57 116.89 1c1j h LYS 38 Ca -0.45 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 1c1j h LYS 38 Cb 1.29 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.93 1c1j h LYS 38 CO 0.79 0.04 0.00 0.27 -3.45 0.00 0.00 179.45 177.10 1c1j n ASN 39 N -5.08 0.00 -0.34 4.20 6.94 -1.26 -4.99 115.26 114.74 1c1j n ASN 39 Ca -0.08 -0.88 0.07 0.00 -0.02 0.00 0.00 54.58 53.67 1c1j n ASN 39 Cb 0.08 0.00 0.25 0.00 -2.36 0.00 0.00 39.78 37.75 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 1.61 1.56 -0.04 -2.53 0.00 -1.92 -0.94 119.26 116.99 1c1j h ALA 40 Ca 0.00 0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1c1j h ALA 40 Cb 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1c1j h ALA 40 CO 0.00 0.23 -0.77 1.15 0.00 0.00 0.00 179.25 179.86 1c1j h THR 41 N 0.98 1.42 0.00 0.00 2.02 -1.88 -2.99 112.91 112.45 1c1j h THR 41 Ca 0.47 -2.28 -0.08 0.00 0.77 0.00 0.00 66.41 65.28 1c1j h THR 41 Cb 0.44 2.23 -0.01 0.00 -1.74 0.00 0.00 68.15 69.07 1c1j h THR 41 CO -0.23 0.68 -0.38 -0.78 0.37 0.00 0.00 175.52 175.18 1c1j h ASP 42 N 0.20 0.00 0.46 4.18 -0.00 -1.68 -2.75 116.42 116.84 1c1j h ASP 42 Ca -0.03 0.00 -0.15 0.00 -0.00 0.00 0.00 57.03 56.84 1c1j h ASP 42 Cb 1.35 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.67 1c1j h ASP 42 CO 0.12 0.38 -0.66 -0.09 -0.00 0.00 0.00 179.24 179.00 1c1j h ARG 43 N 0.00 0.18 -0.67 0.28 2.43 -1.11 -1.67 114.38 113.82 1c1j h ARG 43 Ca -0.00 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.02 1c1j h ARG 43 Cb 0.87 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.41 1c1j h ARG 43 CO 0.05 0.77 0.34 0.00 -1.51 0.00 0.00 179.97 179.62 1c1j h PHE 46 N 0.34 0.25 -0.31 0.00 3.04 -0.40 -0.99 116.94 118.88 1c1j h PHE 46 Ca -0.01 -0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.90 1c1j h PHE 46 Cb 1.20 -0.08 -0.01 0.00 2.56 0.00 0.00 35.95 39.62 1c1j h PHE 46 CO 0.04 0.28 0.09 0.28 -2.02 0.00 0.00 178.31 176.99 1c1j h VAL 47 N 0.16 1.21 -0.45 1.41 2.07 -1.06 -1.40 116.25 118.19 1c1j h VAL 47 Ca 0.06 -0.67 0.10 0.00 0.82 0.00 0.00 66.70 67.01 1c1j h VAL 47 Cb 0.12 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1c1j h VAL 47 CO -0.01 0.23 0.31 -0.74 0.02 0.00 0.00 177.57 177.38 1c1j h HIS 48 N 0.34 0.16 -0.09 1.57 -0.00 -0.97 0.62 115.15 116.77 1c1j h HIS 48 Ca 0.10 0.00 -0.23 0.00 -0.00 0.00 0.00 60.37 60.24 1c1j h HIS 48 Cb 0.25 -0.05 0.01 0.00 -0.00 0.00 0.00 27.41 27.63 1c1j h HIS 48 CO 0.01 0.07 -0.87 -0.44 -0.00 0.00 0.00 177.93 176.70 1c1j h ASP 49 N 0.15 0.87 0.08 3.26 3.45 -0.53 -2.59 116.42 121.11 1c1j h ASP 49 Ca 0.21 -0.62 -0.08 0.00 0.43 0.00 0.00 57.03 56.97 1c1j h ASP 49 Cb 0.64 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 39.13 1c1j h ASP 49 CO -0.03 1.42 -0.26 0.00 -1.57 0.00 0.00 179.24 178.80 1c1j h TYR 52 N -0.61 0.00 0.00 0.00 -1.99 -1.37 -0.77 116.97 112.23 1c1j h TYR 52 Ca -0.03 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.60 1c1j h TYR 52 Cb 0.44 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.16 1c1j h TYR 52 CO 0.01 0.00 -0.44 1.49 -0.00 0.00 0.00 178.16 179.23 1c1j h GLU 53 N 0.00 0.00 0.10 4.88 4.57 -1.15 -3.18 114.58 119.81 1c1j h GLU 53 Ca 0.01 0.00 -0.26 0.00 -1.18 0.00 0.00 59.36 57.93 1c1j h GLU 53 Cb 0.14 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1c1j h GLU 53 CO -0.00 0.44 -1.19 0.87 -1.18 0.00 0.00 179.01 177.94 1c1j h LYS 54 N 0.00 0.22 -6.29 1.92 6.56 -1.11 -3.45 116.57 114.43 1c1j h LYS 54 Ca -0.00 -0.38 -0.57 0.00 -1.06 0.00 0.00 60.65 58.64 1c1j h LYS 54 Cb 0.95 0.14 0.02 0.00 -0.57 0.00 0.00 32.23 32.76 1c1j h LYS 54 CO 0.06 1.18 1.22 0.28 -2.06 0.00 0.00 179.45 180.12 1c1j n VAL 55 N -3.50 0.66 -0.07 0.50 0.31 -1.19 -4.87 118.33 110.17 1c1j n VAL 55 Ca -0.07 -0.16 -0.15 0.00 -0.01 0.00 0.00 64.34 63.96 1c1j n VAL 55 Cb 1.01 -2.17 -0.05 0.00 -0.91 0.00 0.00 33.84 31.72 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 5.64 1.05 0.63 2.52 -1.04 -1.26 -4.76 114.28 117.06 1c1j n THR 56 Ca 0.22 -0.11 0.07 0.00 -2.04 0.00 0.00 64.05 62.20 1c1j n THR 56 Cb 0.37 -1.81 0.36 0.00 -1.82 0.00 0.00 70.33 67.42 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 2.02 -0.90 3.29 3.41 0.00 -1.26 -4.89 105.19 106.86 1c1j n GLY 59 Ca -0.27 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.52 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 -3.22 6.16 0.60 0.00 3.68 -1.26 -4.94 116.67 117.70 1c1j s ASP 67 Ca 0.33 -1.56 0.38 0.00 2.13 0.00 0.00 52.55 53.83 1c1j s ASP 67 Cb 0.00 -2.19 1.90 0.00 -1.45 0.00 0.00 42.92 41.18 1c1j s ASP 67 CO 0.24 -0.75 2.19 1.55 0.13 0.00 0.00 175.17 178.52 1c1j h PRO 68 N 8.82 0.00 0.05 4.34 0.13 -1.92 0.12 132.00 143.52 1c1j h PRO 68 Ca -0.29 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.96 0.02 -0.94 -0.22 -0.23 0.00 0.00 178.00 177.58 1c1j h LYS 69 N 0.00 0.10 -0.03 0.86 3.64 -1.94 -3.35 116.57 115.84 1c1j h LYS 69 Ca -0.00 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1c1j h LYS 69 Cb 0.24 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1c1j h LYS 69 CO 0.00 1.08 0.00 0.91 -2.27 0.00 0.00 179.45 179.17 1c1j n TRP 70 N -4.30 0.02 -3.13 1.91 7.02 -1.20 -1.89 117.44 115.87 1c1j n TRP 70 Ca -0.23 -0.02 -0.39 0.00 -1.02 0.00 0.00 57.50 55.83 1c1j n TRP 70 Cb 0.71 -0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 29.54 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 -0.96 6.79 0.12 -0.99 1.01 0.40 -4.76 116.67 118.28 1c1j s ASP 71 Ca 0.14 0.95 -0.30 0.00 0.71 0.00 0.00 52.55 54.05 1c1j s ASP 71 Cb 0.10 -2.36 -0.06 0.00 1.01 0.00 0.00 42.92 41.61 1c1j s ASP 71 CO 0.14 -0.16 1.05 -1.81 0.21 0.00 0.00 175.17 174.60 1c1j s ASP 72 N 0.93 7.34 0.50 0.27 1.01 -1.26 0.13 116.67 125.60 1c1j s ASP 72 Ca 0.31 1.93 0.04 0.00 0.71 0.00 0.00 52.55 55.54 1c1j s ASP 72 Cb -0.16 -2.59 -0.00 0.00 1.01 0.00 0.00 42.92 41.17 1c1j s ASP 72 CO 0.13 -0.19 0.17 -0.72 0.21 0.00 0.00 175.17 174.76 1c1j s TYR 73 N 0.11 1.93 -0.09 4.23 -0.85 -1.26 -4.82 117.35 116.60 1c1j s TYR 73 Ca 0.50 -0.85 0.04 0.00 -0.52 0.00 0.00 57.07 56.24 1c1j s TYR 73 Cb -0.26 -1.78 -0.01 0.00 0.38 0.00 0.00 41.96 40.29 1c1j s TYR 73 CO 0.32 -0.01 -0.23 -0.08 -1.52 0.00 0.00 175.55 174.03 1c1j s THR 74 N -2.79 2.21 0.24 -3.49 -1.32 -1.26 -4.94 115.64 104.29 1c1j s THR 74 Ca 0.22 -0.98 -0.12 0.00 -1.21 0.00 0.00 61.69 59.60 1c1j s THR 74 Cb 0.01 -1.84 -0.01 0.00 -1.51 0.00 0.00 72.50 69.15 1c1j s THR 74 CO 0.13 0.56 0.44 -0.72 -2.21 0.00 0.00 174.62 172.82 1c1j s TYR 75 N 0.17 0.44 -0.04 9.09 1.13 -1.26 -0.85 117.35 126.03 1c1j s TYR 75 Ca -0.13 -0.79 -0.06 0.00 -1.41 0.00 0.00 57.07 54.69 1c1j s TYR 75 Cb -0.16 0.11 0.01 0.00 -1.10 0.00 0.00 41.96 40.82 1c1j s TYR 75 CO 0.07 -0.95 0.14 -1.54 -2.51 0.00 0.00 175.55 170.75 1c1j s SER 76 N -3.03 -0.09 -0.13 -0.18 1.04 0.12 -4.90 113.70 106.53 1c1j s SER 76 Ca 0.24 0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.80 1c1j s SER 76 Cb 0.00 0.27 0.15 0.00 0.10 0.00 0.00 66.02 66.54 1c1j s SER 76 CO 0.09 -0.16 1.42 0.79 0.98 0.00 0.00 173.24 176.37 1c1j n TRP 77 N 2.48 0.78 -1.57 5.02 7.02 -1.26 0.21 117.44 130.12 1c1j n TRP 77 Ca -0.16 -1.00 -0.44 0.00 -1.02 0.00 0.00 57.50 54.88 1c1j n TRP 77 Cb 0.58 -0.50 -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 0.28 1.82 -2.48 -0.99 4.81 -1.03 -2.67 118.16 117.90 1c1j n LYS 78 Ca 0.15 0.50 -0.05 0.00 -0.87 0.00 0.00 58.31 58.04 1c1j n LYS 78 Cb 0.73 -3.11 0.02 0.00 0.02 0.00 0.00 35.03 32.70 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 11.38 -2.31 0.00 3.14 2.85 -1.26 -3.46 115.26 125.60 1c1j n ASN 79 Ca 0.32 -0.15 0.00 0.00 -0.11 0.00 0.00 54.58 54.64 1c1j n ASN 79 Cb 0.41 -1.67 0.00 0.00 1.24 0.00 0.00 39.78 39.76 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 -0.99 0.00 3.15 8.20 0.00 -1.09 -4.92 105.19 109.54 1c1j n GLY 80 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.95 1.20 0.10 2.61 2.01 -1.22 -5.08 115.64 114.30 1c1j s THR 81 Ca 0.00 -0.92 -0.31 0.00 0.31 0.00 0.00 61.69 60.77 1c1j s THR 81 Cb 0.00 -1.06 -0.07 0.00 0.01 0.00 0.00 72.50 71.39 1c1j s THR 81 CO 0.00 0.12 1.24 -0.63 -0.69 0.00 0.00 174.62 174.66 1c1j s ILE 82 N -0.70 3.78 -0.33 1.82 1.01 -1.26 -2.46 121.20 123.06 1c1j s ILE 82 Ca 0.04 1.31 0.03 0.00 0.00 0.00 0.00 60.65 62.03 1c1j s ILE 82 Cb -0.07 -3.84 0.09 0.00 0.01 0.00 0.00 42.46 38.65 1c1j s ILE 82 CO 0.01 0.12 0.03 -0.69 0.00 0.00 0.00 174.94 174.41 1c1j s VAL 83 N 0.88 2.12 0.10 2.92 1.01 0.55 -4.91 120.40 123.07 1c1j s VAL 83 Ca 0.59 -2.16 -0.30 0.00 0.00 0.00 0.00 61.98 60.11 1c1j s VAL 83 Cb -0.32 -2.53 -0.06 0.00 0.00 0.00 0.00 36.38 33.47 1c1j s VAL 83 CO 0.31 -0.53 1.12 0.00 0.00 0.00 0.00 175.10 175.99 1c1j n GLY 85 N 2.67 5.63 0.00 0.00 0.00 -0.03 -4.96 105.19 108.50 1c1j n GLY 85 Ca 0.06 -1.48 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 1.73 1.14 0.00 -0.02 0.00 -1.26 -4.52 105.19 102.26 1c1j n GLY 86 Ca 0.00 -1.89 0.11 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.33 0.81 -4.63 1.61 8.00 -1.26 -4.85 116.55 115.89 1c1j n ASP 88 Ca 0.00 -0.71 -0.41 0.00 0.71 0.00 0.00 54.79 54.38 1c1j n ASP 88 Cb 0.00 0.84 -0.06 0.00 -0.02 0.00 0.00 41.12 41.88 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 -3.14 6.61 0.24 -2.24 -1.08 -1.26 -4.95 116.67 110.85 1c1j s ASP 89 Ca 0.08 0.75 0.11 0.00 -0.52 0.00 0.00 52.55 52.97 1c1j s ASP 89 Cb 0.16 -2.35 0.17 0.00 -1.46 0.00 0.00 42.92 39.44 1c1j s ASP 89 CO 0.83 -0.37 1.49 -0.65 0.52 0.00 0.00 175.17 176.99 1c1j h PRO 90 N 7.82 0.00 -0.15 4.34 0.11 -1.95 -1.95 132.00 140.22 1c1j h PRO 90 Ca -0.27 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.82 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 0.70 0.01 0.00 -0.21 0.00 0.00 178.00 179.28 1c1j h LYS 92 N 0.01 0.96 -0.45 0.00 1.57 -1.97 -1.95 116.57 114.75 1c1j h LYS 92 Ca 0.04 -0.40 -0.01 0.00 -1.87 0.00 0.00 60.65 58.41 1c1j h LYS 92 Cb 0.34 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 1c1j h LYS 92 CO 0.01 1.06 0.22 -0.22 -0.57 0.00 0.00 179.45 179.95 1c1j h LYS 93 N 0.81 0.62 0.28 3.15 3.64 -1.26 -0.08 116.57 123.74 1c1j h LYS 93 Ca 0.11 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1c1j h LYS 93 Cb 0.75 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1c1j h LYS 93 CO 0.06 0.48 -0.14 1.49 -2.27 0.00 0.00 179.45 179.07 1c1j h GLU 94 N 0.63 -0.37 -0.07 1.90 4.81 -0.16 -0.66 114.58 120.65 1c1j h GLU 94 Ca 0.16 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 1c1j h GLU 94 Cb 0.06 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1c1j h GLU 94 CO -0.02 -0.22 -0.21 -0.39 -0.73 0.00 0.00 179.01 177.44 1c1j h VAL 95 N -0.42 1.19 -0.50 0.32 -1.51 -0.82 -1.91 116.25 112.60 1c1j h VAL 95 Ca -0.04 -0.88 -0.08 0.00 -1.23 0.00 0.00 66.70 64.47 1c1j h VAL 95 Cb 0.32 1.38 -0.02 0.00 -2.13 0.00 0.00 31.29 30.84 1c1j h VAL 95 CO 0.06 0.26 -0.03 0.00 -1.23 0.00 0.00 177.57 176.64 1c1j h GLU 97 N 0.79 0.00 0.14 0.00 4.39 -0.36 -0.03 114.58 119.51 1c1j h GLU 97 Ca 0.15 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 1c1j h GLU 97 Cb 0.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 1c1j h GLU 97 CO 0.03 0.27 -0.07 0.00 -1.16 0.00 0.00 179.01 178.09 1c1j h ASP 99 N -0.59 0.47 -0.87 0.00 3.45 -1.09 -2.32 116.42 115.48 1c1j h ASP 99 Ca -0.02 -0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.43 1c1j h ASP 99 Cb 0.45 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 39.08 1c1j h ASP 99 CO 0.03 0.34 0.51 0.50 -1.57 0.00 0.00 179.24 179.05 1c1j h LYS 100 N 0.57 1.19 -0.32 3.56 3.64 -1.03 -1.91 116.57 122.28 1c1j h LYS 100 Ca 0.18 -0.11 -0.14 0.00 -1.27 0.00 0.00 60.65 59.31 1c1j h LYS 100 Cb -0.01 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.55 1c1j h LYS 100 CO -0.07 0.84 -0.37 0.00 -2.27 0.00 0.00 179.45 177.58 1c1j h ALA 101 N 1.36 0.76 -0.05 5.00 0.00 -1.18 -2.70 119.26 122.45 1c1j h ALA 101 Ca 0.31 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1c1j h ALA 101 Cb -0.03 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1c1j h ALA 101 CO -0.06 0.66 -0.00 0.00 0.00 0.00 0.00 179.25 179.85 1c1j h ALA 102 N 0.98 0.06 -0.79 0.00 0.00 -1.09 0.12 119.26 118.54 1c1j h ALA 102 Ca 0.06 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.89 1c1j h ALA 102 Cb 0.91 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 1c1j h ALA 102 CO 0.08 -0.27 0.45 0.00 0.00 0.00 0.00 179.25 179.51 1c1j h ALA 103 N 0.71 1.12 -0.39 0.00 0.00 -1.40 0.28 119.26 119.58 1c1j h ALA 103 Ca 0.01 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1c1j h ALA 103 Cb 0.34 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1c1j h ALA 103 CO 0.00 0.08 0.09 0.82 0.00 0.00 0.00 179.25 180.24 1c1j h ILE 104 N 0.76 1.23 -0.48 0.00 2.04 -1.34 -2.15 117.51 117.56 1c1j h ILE 104 Ca 0.38 -0.79 0.05 0.00 1.00 0.00 0.00 64.86 65.50 1c1j h ILE 104 Cb 0.34 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 1c1j h ILE 104 CO -0.24 0.27 0.22 0.00 0.00 0.00 0.00 178.15 178.40 1c1j h PHE 106 N 0.43 1.12 -0.44 0.00 0.04 -0.32 -2.36 116.94 115.41 1c1j h PHE 106 Ca 0.22 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.99 1c1j h PHE 106 Cb 0.17 -0.37 -0.02 0.00 2.20 0.00 0.00 35.95 37.92 1c1j h PHE 106 CO -0.12 0.67 0.19 -0.09 -0.60 0.00 0.00 178.31 178.36 1c1j h ARG 107 N 1.18 0.66 0.00 1.51 2.43 -0.67 -1.58 114.38 117.91 1c1j h ARG 107 Ca 0.35 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 1c1j h ARG 107 Cb -0.07 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.37 1c1j h ARG 107 CO -0.10 0.59 -0.05 -0.44 -1.51 0.00 0.00 179.97 178.46 1c1j h ASP 108 N 0.57 0.00 -0.24 -3.80 3.32 -0.93 -3.11 116.42 112.23 1c1j h ASP 108 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1c1j h ASP 108 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1c1j h ASP 108 CO -0.01 0.05 0.00 0.59 -1.72 0.00 0.00 179.24 178.15 1c1j n ASN 109 N -3.18 2.65 -0.28 6.45 3.02 -0.92 -4.63 115.26 118.37 1c1j n ASN 109 Ca 0.00 -1.80 0.33 0.00 -0.03 0.00 0.00 54.58 53.08 1c1j n ASN 109 Cb 0.33 -0.15 0.73 0.00 -0.61 0.00 0.00 39.78 40.07 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 2.45 0.04 -1.31 3.41 5.85 -1.22 0.26 115.31 124.78 1c1j h LEU 110 Ca 0.00 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1c1j h LEU 110 Cb 0.67 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1c1j h LEU 110 CO 0.00 0.01 -0.19 0.07 -0.34 0.00 0.00 178.44 177.99 1c1j h LYS 111 N 0.03 0.00 -0.45 1.25 2.10 -1.84 -2.93 116.57 114.72 1c1j h LYS 111 Ca 0.53 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.18 1c1j h LYS 111 Cb 2.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.39 1c1j h LYS 111 CO -0.03 0.19 0.00 0.25 -2.00 0.00 0.00 179.45 177.86 1c1j n THR 112 N -3.42 2.27 -2.38 0.07 -2.24 0.07 -4.98 114.28 103.68 1c1j n THR 112 Ca -0.00 -1.51 -0.43 0.00 -2.27 0.00 0.00 64.05 59.84 1c1j n THR 112 Cb 0.38 -0.12 -0.02 0.00 -2.10 0.00 0.00 70.33 68.46 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 -2.47 2.85 -0.18 4.78 6.14 -1.11 -4.84 117.35 122.53 1c1j s TYR 113 Ca 0.47 0.97 -0.05 0.00 0.64 0.00 0.00 57.07 59.09 1c1j s TYR 113 Cb 0.35 -3.53 -0.03 0.00 0.42 0.00 0.00 41.96 39.16 1c1j s TYR 113 CO 0.15 -1.86 0.01 0.15 0.64 0.00 0.00 175.55 174.64 1c1j s LYS 114 N 3.16 3.76 0.40 4.97 3.01 -1.26 -4.98 119.74 128.79 1c1j s LYS 114 Ca 0.57 -0.46 0.28 0.00 -1.01 0.00 0.00 55.97 55.36 1c1j s LYS 114 Cb -0.24 -3.08 1.32 0.00 -1.01 0.00 0.00 37.83 34.82 1c1j s LYS 114 CO 0.19 0.17 1.85 -0.22 0.51 0.00 0.00 175.35 177.85 1c1j h LYS 115 N 6.98 0.00 0.00 1.68 3.64 -1.96 -2.58 116.57 124.33 1c1j h LYS 115 Ca -0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 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 -2.02 -3.17 114.38 111.21 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 0.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.33 1c1j h ARG 116 CO 0.00 0.00 -1.22 0.66 0.10 0.00 0.00 179.97 179.51 1c1j n TYR 117 N -2.36 0.72 -2.03 4.08 4.01 -0.97 -4.66 117.16 115.95 1c1j n TYR 117 Ca 0.04 0.21 -0.34 0.00 -0.16 0.00 0.00 57.90 57.65 1c1j n TYR 117 Cb 0.35 -0.83 0.02 0.00 -0.31 0.00 0.00 39.34 38.57 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 -3.39 3.11 -1.42 -0.72 0.23 -1.20 -0.37 119.30 115.55 1c1j s MET 118 Ca -0.02 1.49 -0.07 0.00 -1.03 0.00 0.00 55.69 56.07 1c1j s MET 118 Cb 0.11 -1.98 0.04 0.00 -1.53 0.00 0.00 34.83 31.46 1c1j s MET 118 CO 0.82 -1.02 0.54 0.00 -2.03 0.00 0.00 175.02 173.33 1c1j n ALA 119 N -1.82 -1.01 -2.70 3.16 0.00 -0.27 -4.87 120.51 113.00 1c1j n ALA 119 Ca 0.11 0.19 -0.42 0.00 0.00 0.00 0.00 53.44 53.32 1c1j n ALA 119 Cb 0.51 -3.34 -0.03 0.00 0.00 0.00 0.00 19.45 16.60 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 -3.05 3.57 0.19 0.00 5.04 -1.02 -5.01 117.35 117.06 1c1j s TYR 120 Ca 0.34 1.61 -0.31 0.00 -2.44 0.00 0.00 57.07 56.27 1c1j s TYR 120 Cb -0.17 -3.14 -0.09 0.00 0.35 0.00 0.00 41.96 38.91 1c1j s TYR 120 CO 0.42 -0.13 1.45 -2.14 -1.34 0.00 0.00 175.55 173.80 1c1j s PRO 121 N 1.60 4.28 0.28 4.97 0.02 -1.26 -4.86 135.00 140.02 1c1j s PRO 121 Ca 0.49 2.24 0.06 0.00 0.02 0.00 0.00 61.00 63.81 1c1j s PRO 121 Cb -0.19 -3.16 0.39 0.00 0.02 0.00 0.00 34.50 31.56 1c1j s PRO 121 CO 0.21 -0.45 1.66 -0.44 -0.33 0.00 0.00 177.00 177.65 1c1j h ASP 122 N 5.89 0.26 -0.00 2.53 3.32 -1.95 -2.80 116.42 123.67 1c1j h ASP 122 Ca -0.44 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.49 1c1j h ASP 122 Cb 1.21 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 1c1j h ASP 122 CO 0.83 0.69 0.00 0.16 -1.72 0.00 0.00 179.24 179.20 1c1j h ILE 124 N 0.20 0.06 -0.00 0.35 -0.00 -2.00 0.28 117.51 116.40 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 0.90 1.00 0.00 0.00 -0.00 0.00 0.00 36.82 38.72 1c1j h ILE 124 CO 0.07 0.00 -0.10 0.18 -0.00 0.00 0.00 178.15 178.30 1c1j n LEU 125 N -3.17 0.39 -4.84 0.16 4.77 -1.05 -4.88 117.00 108.38 1c1j n LEU 125 Ca -0.03 0.05 -0.33 0.00 -0.03 0.00 0.00 56.01 55.68 1c1j n LEU 125 Cb 0.07 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 40.90 1c1j n LEU 125 CO 0.21 0.07 0.53 0.00 -1.33 0.00 0.00 177.39 176.87 1c1j n SER 127 N -0.61 -1.40 0.10 0.00 2.88 -1.26 -4.75 113.62 108.58 1c1j n SER 127 Ca 0.05 0.67 0.09 0.00 -1.33 0.00 0.00 58.87 58.35 1c1j n SER 127 Cb 0.54 -1.16 -0.01 0.00 -0.75 0.00 0.00 64.21 62.83 1c1j n SER 127 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1c1j h SER 128 N -0.02 0.00 -3.20 -3.46 4.64 -1.94 -2.21 113.55 107.36 1c1j h SER 128 Ca -0.45 0.00 -0.75 0.00 -0.47 0.00 0.00 61.79 60.12 1c1j h SER 128 Cb 1.38 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 63.21 1c1j h SER 128 CO 0.44 0.12 -0.27 -0.75 -0.87 0.00 0.00 176.83 175.51 1c1j s LYS 129 N -3.27 2.84 0.44 4.77 2.47 -1.26 -4.75 119.74 120.97 1c1j s LYS 129 Ca -0.01 -1.77 -0.23 0.00 -1.56 0.00 0.00 55.97 52.41 1c1j s LYS 129 Cb 0.09 -4.17 -0.08 0.00 -1.46 0.00 0.00 37.83 32.20 1c1j s LYS 129 CO 0.79 -1.28 1.07 -1.12 0.16 0.00 0.00 175.35 174.96 1c1j s SER 130 N 3.20 6.51 0.54 1.43 0.01 -1.26 -4.10 113.70 120.03 1c1j s SER 130 Ca 0.05 2.05 -0.17 0.00 1.31 0.00 0.00 55.95 59.19 1c1j s SER 130 Cb -0.28 -2.58 -0.06 0.00 0.21 0.00 0.00 66.02 63.31 1c1j s SER 130 CO 0.01 -0.67 1.02 -0.70 0.41 0.00 0.00 173.24 173.32 1c1j s GLU 131 N -2.76 3.68 -0.07 12.44 2.12 -1.19 -4.90 118.70 128.02 1c1j s GLU 131 Ca 0.62 1.11 -0.19 0.00 0.36 0.00 0.00 54.97 56.87 1c1j s GLU 131 Cb -0.21 -2.09 -0.05 0.00 0.26 0.00 0.00 34.13 32.04 1c1j s GLU 131 CO 0.26 -0.50 0.54 0.15 -0.54 0.00 0.00 175.26 175.17 1c1j s LYS 132 N -3.94 4.32 0.00 4.30 3.01 -1.26 -5.05 119.74 121.12 1c1j s LYS 132 Ca 0.62 0.60 0.00 0.00 -1.01 0.00 0.00 55.97 56.18 1c1j s LYS 132 Cb -0.13 -3.39 0.00 0.00 -1.01 0.00 0.00 37.83 33.30 1c1j s LYS 132 CO 0.31 0.25 0.41 0.00 0.51 0.00 0.00 175.35 176.83