#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w5c n LEU 3 N 0.00 4.06 -4.92 -4.62 4.77 -1.26 -4.80 117.00 110.23 1w5c n LEU 3 Ca 0.00 -2.65 -0.29 0.00 -0.03 0.00 0.00 56.01 53.05 1w5c n LEU 3 Cb 0.00 -1.02 0.12 0.00 -2.33 0.00 0.00 43.42 40.19 1w5c n LEU 3 CO 0.00 0.08 0.78 0.42 -1.33 0.00 0.00 177.39 177.34 1w5c s THR 4 N 4.12 2.05 0.11 -5.08 -4.23 -1.26 -4.84 115.64 106.51 1w5c s THR 4 Ca 0.41 -0.07 -0.33 0.00 -1.18 0.00 0.00 61.69 60.52 1w5c s THR 4 Cb 0.10 -2.98 -0.12 0.00 1.34 0.00 0.00 72.50 70.84 1w5c s THR 4 CO 0.02 0.00 1.57 -0.65 -0.54 0.00 0.00 174.62 175.02 1w5c h PRO 5 N -1.16 -0.67 -0.83 3.99 0.11 -1.98 -1.46 132.00 129.99 1w5c h PRO 5 Ca -0.45 0.05 0.16 0.00 0.11 0.00 0.00 66.00 65.87 1w5c h PRO 5 Cb 1.29 0.15 -0.06 0.00 0.11 0.00 0.00 31.00 32.50 1w5c h PRO 5 CO 0.55 -0.45 0.55 1.49 -0.21 0.00 0.00 178.00 179.93 1w5c h GLU 6 N -0.70 0.46 -0.68 1.05 4.57 -1.94 0.29 114.58 117.63 1w5c h GLU 6 Ca 0.01 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.09 1w5c h GLU 6 Cb 0.73 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.18 1w5c h GLU 6 CO -0.29 0.31 0.14 0.28 -1.18 0.00 0.00 179.01 178.26 1w5c h VAL 7 N 0.48 1.26 -0.00 0.32 2.07 -1.61 -2.89 116.25 115.88 1w5c h VAL 7 Ca 0.42 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1w5c h VAL 7 Cb 0.92 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1w5c h VAL 7 CO -0.16 0.38 -0.58 0.18 0.02 0.00 0.00 177.57 177.41 1w5c n LEU 8 N -4.22 0.86 -4.58 2.57 4.77 -0.26 -4.73 117.00 111.41 1w5c n LEU 8 Ca 0.05 -0.24 -0.40 0.00 -0.03 0.00 0.00 56.01 55.39 1w5c n LEU 8 Cb 0.28 -0.14 -0.09 0.00 -2.33 0.00 0.00 43.42 41.13 1w5c n LEU 8 CO 0.43 0.19 0.01 -0.89 -1.33 0.00 0.00 177.39 175.80 1w5c s THR 9 N -2.86 5.19 0.30 -5.08 2.01 0.86 -1.32 115.64 114.74 1w5c s THR 9 Ca 0.13 0.29 0.03 0.00 0.31 0.00 0.00 61.69 62.45 1w5c s THR 9 Cb 0.17 -3.72 -0.06 0.00 0.01 0.00 0.00 72.50 68.90 1w5c s THR 9 CO 0.70 0.07 0.07 0.68 -0.69 0.00 0.00 174.62 175.45 1w5c s VAL 10 N 2.00 0.93 0.09 3.82 -7.23 -0.44 -4.85 120.40 114.72 1w5c s VAL 10 Ca 0.12 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 57.98 1w5c s VAL 10 Cb -0.16 -2.73 -0.08 0.00 0.56 0.00 0.00 36.38 33.98 1w5c s VAL 10 CO 0.11 -0.00 1.43 -2.84 -0.31 0.00 0.00 175.10 173.49 1w5c s PRO 11 N -3.95 4.29 -0.04 4.82 0.02 -1.26 -1.57 135.00 137.31 1w5c s PRO 11 Ca 0.37 2.10 -0.22 0.00 0.02 0.00 0.00 61.00 63.27 1w5c s PRO 11 Cb 0.08 -3.35 -0.29 0.00 0.02 0.00 0.00 34.50 30.96 1w5c s PRO 11 CO 0.15 -0.51 0.93 1.25 -0.33 0.00 0.00 177.00 178.48 1w5c h LEU 12 N 7.35 0.44 0.00 -5.54 5.85 0.14 -0.12 115.31 123.43 1w5c h LEU 12 Ca -0.41 -0.92 -0.31 0.00 0.84 0.00 0.00 57.88 57.09 1w5c h LEU 12 Cb 1.20 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 42.01 1w5c h LEU 12 CO 0.88 1.32 -0.30 -0.46 -0.34 0.00 0.00 178.44 179.54 1w5c n ASN 13 N -4.19 -0.46 0.02 1.25 0.23 -1.11 -0.19 115.26 110.82 1w5c n ASN 13 Ca -0.13 -2.41 0.14 0.00 -0.53 0.00 0.00 54.58 51.65 1w5c n ASN 13 Cb 0.76 1.07 0.53 0.00 -2.08 0.00 0.00 39.78 40.07 1w5c n ASN 13 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1w5c n SER 14 N -2.16 0.23 0.00 0.53 3.41 -1.26 -3.57 113.62 110.79 1w5c n SER 14 Ca 0.05 0.44 0.13 0.00 -0.26 0.00 0.00 58.87 59.23 1w5c n SER 14 Cb 0.39 -0.48 0.64 0.00 -0.26 0.00 0.00 64.21 64.49 1w5c n SER 14 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1w5c n GLU 15 N -1.67 0.26 0.00 4.33 4.71 -1.26 -4.88 120.64 122.13 1w5c n GLU 15 Ca 0.06 0.04 0.00 0.00 -0.01 0.00 0.00 57.16 57.25 1w5c n GLU 15 Cb 0.36 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.29 1w5c n GLU 15 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1w5c n GLY 16 N 1.06 0.67 3.77 0.62 0.00 -1.23 -5.09 105.19 104.99 1w5c n GLY 16 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1w5c n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w5c s LYS 17 N -0.55 4.05 0.44 1.61 -0.14 -1.26 -4.87 119.74 119.01 1w5c s LYS 17 Ca 0.00 1.90 0.05 0.00 -1.36 0.00 0.00 55.97 56.55 1w5c s LYS 17 Cb 0.00 -2.70 -0.06 0.00 -1.68 0.00 0.00 37.83 33.40 1w5c s LYS 17 CO 0.00 -0.34 0.01 0.95 -0.76 0.00 0.00 175.35 175.21 1w5c s THR 18 N -1.38 1.68 -0.14 2.17 -4.23 -1.26 0.16 115.64 112.65 1w5c s THR 18 Ca 0.57 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.95 1w5c s THR 18 Cb -0.32 -2.71 0.04 0.00 1.34 0.00 0.00 72.50 70.84 1w5c s THR 18 CO 0.40 0.00 0.37 -0.51 -0.54 0.00 0.00 174.62 174.34 1w5c s ILE 19 N -2.79 -0.00 -0.43 2.99 2.07 -0.61 -4.60 121.20 117.83 1w5c s ILE 19 Ca 0.25 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.41 1w5c s ILE 19 Cb 0.07 -0.52 0.09 0.00 0.13 0.00 0.00 42.46 42.24 1w5c s ILE 19 CO 0.13 0.00 0.28 -0.89 -1.91 0.00 0.00 174.94 172.55 1w5c s THR 20 N 0.20 4.14 0.63 4.00 2.01 -1.26 -1.33 115.64 124.04 1w5c s THR 20 Ca -0.00 -1.57 -0.18 0.00 0.31 0.00 0.00 61.69 60.25 1w5c s THR 20 Cb -0.03 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1w5c s THR 20 CO 0.00 -0.60 1.28 -0.76 -0.69 0.00 0.00 174.62 173.85 1w5c s LEU 21 N 1.38 3.61 0.50 4.42 1.43 -0.43 -4.94 118.68 124.65 1w5c s LEU 21 Ca 0.04 2.58 -0.05 0.00 -1.03 0.00 0.00 54.13 55.68 1w5c s LEU 21 Cb -0.24 -4.59 -0.02 0.00 0.03 0.00 0.00 46.19 41.37 1w5c s LEU 21 CO 0.01 -1.89 0.79 0.42 0.23 0.00 0.00 176.35 175.91 1w5c s THR 22 N -1.43 4.50 0.27 5.49 -4.23 -1.26 -4.85 115.64 114.13 1w5c s THR 22 Ca 0.81 0.04 -0.04 0.00 -1.18 0.00 0.00 61.69 61.32 1w5c s THR 22 Cb -0.36 -3.72 0.26 0.00 1.34 0.00 0.00 72.50 70.02 1w5c s THR 22 CO 0.39 -0.68 1.95 -0.08 -0.54 0.00 0.00 174.62 175.65 1w5c h GLU 23 N 0.16 1.22 0.00 3.99 4.81 -1.98 -0.12 114.58 122.66 1w5c h GLU 23 Ca -0.47 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 58.68 1w5c h GLU 23 Cb 1.22 -0.27 -0.00 0.00 0.63 0.00 0.00 28.75 30.33 1w5c h GLU 23 CO 0.61 0.80 -0.07 0.87 -0.73 0.00 0.00 179.01 180.49 1w5c h LYS 24 N 1.25 0.00 0.04 1.92 1.57 -1.99 0.47 116.57 119.83 1w5c h LYS 24 Ca 0.34 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.90 1w5c h LYS 24 Cb -0.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1w5c h LYS 24 CO -0.08 0.07 -1.02 1.96 -0.57 0.00 0.00 179.45 179.82 1w5c h GLN 25 N 0.00 0.18 -0.19 3.15 4.20 -1.46 -1.74 115.11 119.25 1w5c h GLN 25 Ca -0.00 -0.24 -0.02 0.00 0.06 0.00 0.00 58.65 58.44 1w5c h GLN 25 Cb 0.46 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1w5c h GLN 25 CO 0.01 1.05 0.03 -0.92 -0.67 0.00 0.00 178.83 178.33 1w5c h TYR 26 N 0.07 0.33 -0.34 2.96 3.20 0.51 0.07 116.97 123.76 1w5c h TYR 26 Ca -0.06 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.73 1w5c h TYR 26 Cb 1.71 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.87 1w5c h TYR 26 CO 0.03 0.46 0.08 -0.07 -1.64 0.00 0.00 178.16 177.02 1w5c h LEU 27 N 0.11 0.52 -1.25 2.82 3.38 -1.08 -2.20 115.31 117.61 1w5c h LEU 27 Ca 0.06 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1w5c h LEU 27 Cb 0.30 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1w5c h LEU 27 CO 0.00 0.62 0.48 -0.08 0.09 0.00 0.00 178.44 179.56 1w5c h GLU 28 N 0.40 0.99 -0.58 1.13 4.57 -1.21 -1.73 114.58 118.15 1w5c h GLU 28 Ca 0.11 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1w5c h GLU 28 Cb 0.31 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 1w5c h GLU 28 CO 0.00 0.66 0.29 0.78 -1.18 0.00 0.00 179.01 179.56 1w5c h GLY 29 N 1.02 0.88 0.98 1.92 0.00 -0.60 0.27 103.07 107.55 1w5c h GLY 29 Ca 0.27 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1w5c h GLY 29 CO -0.06 0.41 0.24 0.50 0.00 0.00 0.00 176.54 177.63 1w5c h LYS 30 N 0.78 0.55 0.76 4.80 1.57 -0.73 0.18 116.57 124.48 1w5c h LYS 30 Ca 0.20 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.89 1w5c h LYS 30 Cb 0.10 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1w5c h LYS 30 CO -0.03 0.42 -0.39 -0.09 -0.57 0.00 0.00 179.45 178.79 1w5c h ARG 31 N 0.53 -1.02 -0.81 3.15 2.43 -0.92 -1.78 114.38 115.96 1w5c h ARG 31 Ca 0.14 0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.40 1w5c h ARG 31 Cb 0.01 0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 29.75 1w5c h ARG 31 CO -0.03 -0.68 0.54 -0.07 -1.51 0.00 0.00 179.97 178.22 1w5c h LEU 32 N -1.06 0.90 -0.93 3.80 3.38 -0.35 -1.13 115.31 119.93 1w5c h LEU 32 Ca -0.10 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 1w5c h LEU 32 Cb 0.82 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1w5c h LEU 32 CO 0.15 0.64 -0.27 0.15 0.09 0.00 0.00 178.44 179.20 1w5c h PHE 33 N 1.06 0.53 0.00 1.13 3.04 -0.46 -0.73 116.94 121.51 1w5c h PHE 33 Ca 0.31 -0.11 -0.13 0.00 3.98 0.00 0.00 57.97 62.01 1w5c h PHE 33 Cb -0.05 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 38.31 1w5c h PHE 33 CO -0.00 0.70 -0.63 1.96 -2.02 0.00 0.00 178.31 178.32 1w5c h GLN 34 N 0.41 0.00 -0.01 1.11 4.20 -0.77 0.19 115.11 120.24 1w5c h GLN 34 Ca 0.06 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1w5c h GLN 34 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1w5c h GLN 34 CO 0.05 0.63 -0.02 -0.92 -0.67 0.00 0.00 178.83 177.89 1w5c h TYR 35 N 0.00 0.05 -0.01 2.96 3.20 -0.50 -3.37 116.97 119.30 1w5c h TYR 35 Ca -0.01 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1w5c h TYR 35 Cb 1.23 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.49 1w5c h TYR 35 CO 0.00 0.60 -0.16 0.00 -1.64 0.00 0.00 178.16 176.96 1w5c n ALA 36 N -2.40 2.74 0.00 1.82 0.00 -0.35 -4.82 120.51 117.50 1w5c n ALA 36 Ca -0.09 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1w5c n ALA 36 Cb 0.30 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1w5c n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w5c h ALA 38 N 0.00 1.85 -0.29 0.00 0.00 -0.87 0.29 119.26 120.23 1w5c h ALA 38 Ca 0.00 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1w5c h ALA 38 Cb 0.65 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1w5c h ALA 38 CO 0.00 -0.23 0.21 0.66 0.00 0.00 0.00 179.25 179.89 1w5c h SER 39 N 0.00 0.10 0.00 0.00 4.64 -1.86 -2.10 113.55 114.33 1w5c h SER 39 Ca 0.07 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 1w5c h SER 39 Cb 0.37 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1w5c h SER 39 CO -0.00 0.07 -1.12 0.00 -0.87 0.00 0.00 176.83 174.91 1w5c n HIS 41 N -1.70 0.76 -1.54 0.00 8.25 0.92 -0.94 115.22 120.97 1w5c n HIS 41 Ca -0.01 -1.03 -0.55 0.00 -0.26 0.00 0.00 57.72 55.87 1w5c n HIS 41 Cb 0.18 -0.31 -0.07 0.00 1.12 0.00 0.00 29.99 30.92 1w5c n HIS 41 CO 0.00 0.00 0.00 1.55 0.64 0.00 0.00 176.34 178.53 1w5c n VAL 42 N -0.81 0.07 -1.38 1.59 3.14 -0.79 -0.23 118.33 119.92 1w5c n VAL 42 Ca 0.22 -0.02 -0.13 0.00 -2.96 0.00 0.00 64.34 61.45 1w5c n VAL 42 Cb 0.86 -0.41 -0.06 0.00 -1.06 0.00 0.00 33.84 33.18 1w5c n VAL 42 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1w5c n GLY 43 N 2.00 1.30 1.07 7.55 0.00 -1.26 -2.80 105.19 113.06 1w5c n GLY 43 Ca 0.19 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1w5c n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w5c n GLY 44 N -0.45 0.80 2.92 -0.02 0.00 0.68 -4.34 105.19 104.78 1w5c n GLY 44 Ca -0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.70 1w5c n GLY 44 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1w5c n ILE 45 N -2.00 0.00 -3.66 -0.61 -5.35 -1.12 -1.59 119.36 105.03 1w5c n ILE 45 Ca 0.00 -1.05 -0.26 0.00 -0.27 0.00 0.00 62.75 61.17 1w5c n ILE 45 Cb 0.00 -1.20 -0.17 0.00 -1.74 0.00 0.00 39.64 36.53 1w5c n ILE 45 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1w5c s THR 46 N -2.55 0.13 0.02 7.28 2.01 -1.26 -4.03 115.64 117.25 1w5c s THR 46 Ca 0.52 -0.25 -0.19 0.00 0.31 0.00 0.00 61.69 62.08 1w5c s THR 46 Cb -0.02 -0.70 -0.11 0.00 0.01 0.00 0.00 72.50 71.68 1w5c s THR 46 CO 0.35 -0.21 1.06 0.11 -0.69 0.00 0.00 174.62 175.24 1w5c h LYS 47 N 8.36 -0.67 0.00 4.92 1.57 -1.41 -1.19 116.57 128.15 1w5c h LYS 47 Ca -0.15 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1w5c h LYS 47 Cb 1.14 0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1w5c h LYS 47 CO 0.30 -0.44 0.00 0.25 -0.57 0.00 0.00 179.45 178.98 1w5c n THR 48 N -4.28 1.15 -3.07 -0.16 -2.24 -1.26 -3.95 114.28 100.47 1w5c n THR 48 Ca -0.09 0.62 -0.09 0.00 -2.27 0.00 0.00 64.05 62.22 1w5c n THR 48 Cb 0.27 -1.60 -0.03 0.00 -2.10 0.00 0.00 70.33 66.87 1w5c n THR 48 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1w5c s ASN 49 N -3.88 -0.55 0.33 3.42 3.84 -1.16 -5.06 114.94 111.88 1w5c s ASN 49 Ca -0.01 -1.71 0.08 0.00 0.21 0.00 0.00 52.86 51.43 1w5c s ASN 49 Cb 0.06 1.31 0.95 0.00 -0.55 0.00 0.00 41.25 43.01 1w5c s ASN 49 CO 0.20 -0.13 1.57 -0.65 -2.79 0.00 0.00 177.10 175.30 1w5c h PRO 50 N 5.92 0.01 0.00 0.43 0.11 -1.34 -2.00 132.00 135.13 1w5c h PRO 50 Ca 0.09 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.19 1w5c h PRO 50 Cb 1.08 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1w5c h PRO 50 CO 0.12 0.00 -0.06 0.66 -0.21 0.00 0.00 178.00 178.51 1w5c h SER 51 N 0.01 0.00 -2.05 -2.05 4.64 -1.97 -3.31 113.55 108.82 1w5c h SER 51 Ca 0.68 0.00 -0.77 0.00 -0.47 0.00 0.00 61.79 61.23 1w5c h SER 51 Cb 1.56 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.45 1w5c h SER 51 CO -0.88 0.06 1.49 0.18 -0.87 0.00 0.00 176.83 176.82 1w5c n LEU 52 N -3.56 6.40 -4.96 5.97 4.77 -0.75 -4.99 117.00 119.87 1w5c n LEU 52 Ca -0.02 -4.83 -0.27 0.00 -0.03 0.00 0.00 56.01 50.86 1w5c n LEU 52 Cb 0.18 -1.43 0.15 0.00 -2.33 0.00 0.00 43.42 39.99 1w5c n LEU 52 CO 0.28 1.42 0.73 1.51 -1.33 0.00 0.00 177.39 179.99 1w5c s ASP 53 N 0.23 3.67 -0.15 -1.43 1.47 -1.25 -4.49 116.67 114.72 1w5c s ASP 53 Ca 0.37 -0.04 0.15 0.00 1.18 0.00 0.00 52.55 54.21 1w5c s ASP 53 Cb 0.06 -0.15 0.70 0.00 -0.34 0.00 0.00 42.92 43.20 1w5c s ASP 53 CO 0.03 -2.34 1.60 0.18 0.68 0.00 0.00 175.17 175.32 1w5c n LEU 54 N -3.34 4.81 -4.77 2.11 4.77 -0.62 -4.60 117.00 115.36 1w5c n LEU 54 Ca 0.15 -2.43 -0.41 0.00 -0.03 0.00 0.00 56.01 53.29 1w5c n LEU 54 Cb 0.60 -0.60 -0.01 0.00 -2.33 0.00 0.00 43.42 41.07 1w5c n LEU 54 CO 0.44 0.69 1.11 -0.60 -1.33 0.00 0.00 177.39 177.70 1w5c s ARG 55 N -2.14 4.19 0.27 3.23 3.52 -1.26 -4.81 118.95 121.95 1w5c s ARG 55 Ca 0.48 2.45 0.00 0.00 -0.13 0.00 0.00 55.73 58.54 1w5c s ARG 55 Cb 0.34 -3.02 0.59 0.00 -1.56 0.00 0.00 34.95 31.30 1w5c s ARG 55 CO 0.20 -0.45 1.74 1.15 -0.81 0.00 0.00 175.30 177.13 1w5c h THR 56 N 3.12 0.65 -0.33 4.11 2.02 -1.92 -1.48 112.91 119.08 1w5c h THR 56 Ca -0.49 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.50 1w5c h THR 56 Cb 1.23 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1w5c h THR 56 CO 0.68 0.10 0.19 -0.08 0.37 0.00 0.00 175.52 176.78 1w5c h GLU 57 N 0.55 0.46 -0.64 6.66 4.57 -1.99 -0.34 114.58 123.85 1w5c h GLU 57 Ca 0.49 -0.05 0.06 0.00 -1.18 0.00 0.00 59.36 58.68 1w5c h GLU 57 Cb 0.78 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 29.23 1w5c h GLU 57 CO -0.42 0.38 0.35 1.15 -1.18 0.00 0.00 179.01 179.29 1w5c h THR 58 N 0.42 0.97 -0.51 0.32 2.02 -1.65 -1.01 112.91 113.46 1w5c h THR 58 Ca 0.12 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1w5c h THR 58 Cb 0.05 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1w5c h THR 58 CO -0.02 0.12 0.29 -0.07 0.37 0.00 0.00 175.52 176.21 1w5c h LEU 59 N 0.65 0.63 -1.96 2.58 3.38 -0.98 -2.50 115.31 117.12 1w5c h LEU 59 Ca 0.28 -0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.25 1w5c h LEU 59 Cb 0.17 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1w5c h LEU 59 CO -0.18 0.53 0.22 0.00 0.09 0.00 0.00 178.44 179.10 1w5c h ALA 60 N 1.13 2.22 -0.14 1.53 0.00 0.25 -0.10 119.26 124.15 1w5c h ALA 60 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1w5c h ALA 60 Cb 0.03 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1w5c h ALA 60 CO -0.03 -0.30 0.00 1.28 0.00 0.00 0.00 179.25 180.20 1w5c n LEU 61 N -4.46 2.16 -4.82 0.00 4.77 -0.85 -4.75 117.00 109.05 1w5c n LEU 61 Ca 0.04 -0.83 -0.29 0.00 -0.03 0.00 0.00 56.01 54.90 1w5c n LEU 61 Cb 0.35 -0.08 0.14 0.00 -2.33 0.00 0.00 43.42 41.49 1w5c n LEU 61 CO 0.35 0.42 0.75 0.00 -1.33 0.00 0.00 177.39 177.58 1w5c s ALA 62 N -1.83 1.96 -0.12 -1.18 0.00 -0.07 -5.01 121.76 115.50 1w5c s ALA 62 Ca 0.34 -0.68 -0.02 0.00 0.00 0.00 0.00 51.96 51.60 1w5c s ALA 62 Cb 0.20 -2.97 0.04 0.00 0.00 0.00 0.00 23.12 20.39 1w5c s ALA 62 CO 0.30 -2.26 0.02 0.99 0.00 0.00 0.00 175.76 174.80 1w5c s THR 63 N -3.42 0.40 0.78 0.00 2.01 -0.70 -3.31 115.64 111.41 1w5c s THR 63 Ca 0.65 -0.11 -0.11 0.00 0.31 0.00 0.00 61.69 62.43 1w5c s THR 63 Cb -0.12 -0.70 0.06 0.00 0.01 0.00 0.00 72.50 71.75 1w5c s THR 63 CO 0.52 0.08 1.09 -2.16 -0.69 0.00 0.00 174.62 173.47 1w5c s PRO 64 N 1.94 2.21 0.09 4.92 0.04 -1.26 -1.25 135.00 141.68 1w5c s PRO 64 Ca 0.03 0.73 -0.37 0.00 0.04 0.00 0.00 61.00 61.44 1w5c s PRO 64 Cb -0.14 -1.92 -0.17 0.00 0.04 0.00 0.00 34.50 32.31 1w5c s PRO 64 CO -0.06 -1.56 1.28 -2.30 0.04 0.00 0.00 177.00 174.40 1w5c n PRO 65 N -3.41 1.01 -0.20 0.56 -0.02 -1.21 -4.85 135.00 126.89 1w5c n PRO 65 Ca 0.07 0.36 0.07 0.00 -2.02 0.00 0.00 63.50 61.99 1w5c n PRO 65 Cb 0.56 -1.97 0.16 0.00 -0.02 0.00 0.00 33.50 32.23 1w5c n PRO 65 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1w5c n ARG 66 N 2.30 2.32 -1.13 -0.52 5.12 -1.09 -4.57 116.66 119.09 1w5c n ARG 66 Ca 0.18 -2.41 -0.26 0.00 -1.93 0.00 0.00 57.85 53.43 1w5c n ARG 66 Cb 0.18 -1.50 0.10 0.00 -1.16 0.00 0.00 32.46 30.09 1w5c n ARG 66 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1w5c n ASP 67 N -0.71 5.82 -3.92 0.55 5.75 -1.26 -4.40 116.55 118.38 1w5c n ASP 67 Ca 0.14 -3.48 -0.09 0.00 -0.01 0.00 0.00 54.79 51.36 1w5c n ASP 67 Cb 0.63 -0.91 -0.07 0.00 -1.03 0.00 0.00 41.12 39.73 1w5c n ASP 67 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1w5c s ASN 68 N -1.09 0.12 0.09 -1.12 2.20 -1.26 -4.70 114.94 109.18 1w5c s ASN 68 Ca 0.52 -0.78 -0.34 0.00 -0.94 0.00 0.00 52.86 51.31 1w5c s ASN 68 Cb 0.42 0.36 -0.16 0.00 -2.00 0.00 0.00 41.25 39.87 1w5c s ASN 68 CO 0.03 -0.78 1.53 0.40 -2.94 0.00 0.00 177.10 175.35 1w5c h ILE 69 N 2.71 0.00 -0.45 0.54 1.08 -0.77 -1.29 117.51 119.33 1w5c h ILE 69 Ca -0.33 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.23 1w5c h ILE 69 Cb 1.21 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.86 1w5c h ILE 69 CO 0.54 0.00 -0.29 -0.33 -0.69 0.00 0.00 178.15 177.38 1w5c h GLU 70 N -0.92 -0.19 -0.94 2.37 5.08 -0.84 0.23 114.58 119.38 1w5c h GLU 70 Ca -0.05 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.47 1w5c h GLU 70 Cb 0.82 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 30.02 1w5c h GLU 70 CO -0.11 -0.13 0.55 0.78 -1.00 0.00 0.00 179.01 179.11 1w5c h GLY 71 N -0.20 1.58 1.16 -3.84 0.00 -1.69 0.29 103.07 100.37 1w5c h GLY 71 Ca 0.20 -0.34 -0.20 0.00 0.00 0.00 0.00 47.33 46.99 1w5c h GLY 71 CO -0.56 0.03 -0.60 1.41 0.00 0.00 0.00 176.54 176.81 1w5c h LEU 72 N 0.79 0.98 -0.51 3.11 3.38 0.04 -1.80 115.31 121.31 1w5c h LEU 72 Ca 0.50 -0.55 0.07 0.00 0.09 0.00 0.00 57.88 57.99 1w5c h LEU 72 Cb 0.66 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 1w5c h LEU 72 CO -0.33 1.35 0.20 0.58 0.09 0.00 0.00 178.44 180.33 1w5c h VAL 73 N 0.65 0.85 -0.71 1.22 2.07 0.21 0.15 116.25 120.69 1w5c h VAL 73 Ca -0.00 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.42 1w5c h VAL 73 Cb 1.21 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1w5c h VAL 73 CO 0.13 0.07 0.47 -0.78 0.02 0.00 0.00 177.57 177.48 1w5c h ASP 74 N 0.39 0.75 -0.54 0.57 3.58 -0.39 -2.49 116.42 118.28 1w5c h ASP 74 Ca 0.24 -0.01 -0.09 0.00 0.42 0.00 0.00 57.03 57.59 1w5c h ASP 74 Cb 0.24 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 1w5c h ASP 74 CO -0.23 0.52 -0.02 0.22 -2.88 0.00 0.00 179.24 176.84 1w5c h TYR 75 N 0.87 1.06 0.00 0.28 5.03 0.15 0.58 116.97 124.93 1w5c h TYR 75 Ca 0.28 -0.19 0.00 0.00 2.58 0.00 0.00 58.73 61.40 1w5c h TYR 75 Cb 0.05 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.05 1w5c h TYR 75 CO -0.00 0.97 0.00 -1.33 -1.32 0.00 0.00 178.16 176.48 1w5c n MET 76 N -4.25 0.12 -0.12 1.82 2.81 -0.56 -1.07 117.12 115.86 1w5c n MET 76 Ca 0.02 0.40 -0.19 0.00 -1.81 0.00 0.00 57.70 56.11 1w5c n MET 76 Cb 0.34 -1.75 -0.10 0.00 -0.71 0.00 0.00 33.22 31.00 1w5c n MET 76 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1w5c n LYS 77 N -1.98 0.58 -3.25 0.03 5.02 -0.80 -1.33 118.16 116.42 1w5c n LYS 77 Ca 0.02 0.16 -0.20 0.00 -2.02 0.00 0.00 58.31 56.28 1w5c n LYS 77 Cb 0.18 -1.46 -0.07 0.00 -0.02 0.00 0.00 35.03 33.66 1w5c n LYS 77 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1w5c s ASN 78 N -6.56 0.83 0.40 4.39 2.47 0.20 -3.17 114.94 113.50 1w5c s ASN 78 Ca -0.33 -2.36 -0.26 0.00 0.42 0.00 0.00 52.86 50.33 1w5c s ASN 78 Cb 0.10 0.32 -0.09 0.00 -1.45 0.00 0.00 41.25 40.13 1w5c s ASN 78 CO 0.52 -0.18 1.26 -2.16 -3.72 0.00 0.00 177.10 172.83 1w5c s PRO 79 N 0.64 4.02 0.27 0.43 0.04 -0.24 -4.46 135.00 135.70 1w5c s PRO 79 Ca 0.27 2.07 0.04 0.00 0.04 0.00 0.00 61.00 63.42 1w5c s PRO 79 Cb -0.04 -2.76 -0.06 0.00 0.04 0.00 0.00 34.50 31.69 1w5c s PRO 79 CO -0.11 -0.42 0.02 0.95 0.04 0.00 0.00 177.00 177.48 1w5c s THR 80 N -1.29 1.13 1.14 1.26 -4.23 -1.26 -0.50 115.64 111.90 1w5c s THR 80 Ca 0.56 -2.03 -0.17 0.00 -1.18 0.00 0.00 61.69 58.87 1w5c s THR 80 Cb -0.36 -2.52 0.26 0.00 1.34 0.00 0.00 72.50 71.22 1w5c s THR 80 CO 0.46 -0.20 1.10 0.42 -0.54 0.00 0.00 174.62 175.87 1w5c s THR 81 N -3.35 1.73 0.46 3.99 -4.23 -0.06 -4.81 115.64 109.38 1w5c s THR 81 Ca 0.32 0.00 0.31 0.00 -1.18 0.00 0.00 61.69 61.14 1w5c s THR 81 Cb 0.06 -2.48 0.34 0.00 1.34 0.00 0.00 72.50 71.77 1w5c s THR 81 CO 0.12 0.00 2.15 0.22 -0.54 0.00 0.00 174.62 176.57 1w5c h TYR 82 N -2.39 0.00 -0.05 3.99 3.20 -1.92 -0.16 116.97 119.64 1w5c h TYR 82 Ca -0.48 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.39 1w5c h TYR 82 Cb 1.31 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.58 1w5c h TYR 82 CO -1.32 0.07 0.00 -0.40 -1.64 0.00 0.00 178.16 174.87 1w5c n ASP 83 N -3.54 1.85 0.00 -2.11 5.68 -1.26 -1.72 116.55 115.46 1w5c n ASP 83 Ca -0.02 -1.63 0.00 0.00 -0.50 0.00 0.00 54.79 52.64 1w5c n ASP 83 Cb 0.19 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 1w5c n ASP 83 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1w5c n GLY 84 N 1.21 0.32 0.21 6.12 0.00 -0.07 -4.72 105.19 108.25 1w5c n GLY 84 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 1w5c n GLY 84 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1w5c h GLU 85 N 0.83 0.00 -3.73 1.61 5.08 -1.83 -3.45 114.58 113.09 1w5c h GLU 85 Ca 0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 1w5c h GLU 85 Cb 0.31 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 29.24 1w5c h GLU 85 CO 0.00 0.16 -0.74 -1.14 -1.00 0.00 0.00 179.01 176.30 1w5c s GLN 86 N -3.27 0.18 0.35 2.33 2.00 -1.26 -5.00 119.66 114.99 1w5c s GLN 86 Ca 0.04 0.06 -0.27 0.00 -2.00 0.00 0.00 55.36 53.20 1w5c s GLN 86 Cb 0.07 -0.34 -0.09 0.00 0.80 0.00 0.00 33.01 33.45 1w5c s GLN 86 CO 0.67 -0.10 1.10 -1.21 -0.50 0.00 0.00 175.29 175.25 1w5c s GLU 87 N 0.76 4.34 -0.30 1.67 2.02 -1.26 -0.88 118.70 125.05 1w5c s GLU 87 Ca -0.07 1.70 0.16 0.00 0.02 0.00 0.00 54.97 56.79 1w5c s GLU 87 Cb -0.10 -2.84 0.48 0.00 0.10 0.00 0.00 34.13 31.76 1w5c s GLU 87 CO -0.02 -0.03 1.08 0.44 0.02 0.00 0.00 175.26 176.76 1w5c n ILE 88 N 0.49 1.56 0.27 -1.63 -5.35 0.35 -4.89 119.36 110.16 1w5c n ILE 88 Ca 0.02 -3.44 0.14 0.00 -0.27 0.00 0.00 62.75 59.21 1w5c n ILE 88 Cb 0.47 0.37 0.73 0.00 -1.74 0.00 0.00 39.64 39.47 1w5c n ILE 88 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1w5c h ALA 89 N 2.63 1.13 0.00 -1.28 0.00 -1.76 -1.34 119.26 118.64 1w5c h ALA 89 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1w5c h ALA 89 Cb 1.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1w5c h ALA 89 CO 0.46 0.13 0.00 -1.91 0.00 0.00 0.00 179.25 177.92 1w5c n GLU 90 N -3.40 0.04 -0.03 0.00 2.13 -1.26 -3.32 120.64 114.81 1w5c n GLU 90 Ca -0.01 0.21 -0.03 0.00 0.66 0.00 0.00 57.16 57.99 1w5c n GLU 90 Cb 0.27 -1.57 -0.03 0.00 0.27 0.00 0.00 31.44 30.38 1w5c n GLU 90 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1w5c n VAL 91 N -1.65 0.32 -3.85 6.31 0.31 -1.09 -4.98 118.33 113.70 1w5c n VAL 91 Ca 0.04 -0.16 -0.36 0.00 -0.01 0.00 0.00 64.34 63.85 1w5c n VAL 91 Cb 0.24 -0.80 -0.12 0.00 -0.91 0.00 0.00 33.84 32.25 1w5c n VAL 91 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1w5c s HIS 92 N -2.11 3.12 0.29 3.52 5.65 -0.53 -5.07 115.29 120.17 1w5c s HIS 92 Ca -0.05 -0.27 -0.29 0.00 0.25 0.00 0.00 55.06 54.70 1w5c s HIS 92 Cb 0.02 -2.19 -0.13 0.00 -1.18 0.00 0.00 32.58 29.09 1w5c s HIS 92 CO 0.16 -0.21 1.16 -2.30 -0.65 0.00 0.00 174.74 172.90 1w5c n PRO 93 N 4.54 1.67 -3.74 2.88 -0.02 -1.26 -4.35 135.00 134.71 1w5c n PRO 93 Ca -0.16 0.59 -0.01 0.00 -2.02 0.00 0.00 63.50 61.90 1w5c n PRO 93 Cb 0.52 -2.07 -0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1w5c n PRO 93 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1w5c s SER 94 N -0.33 -0.09 0.37 2.55 1.04 -1.26 -4.87 113.70 111.10 1w5c s SER 94 Ca 0.60 -0.34 0.12 0.00 0.48 0.00 0.00 55.95 56.81 1w5c s SER 94 Cb -0.66 0.35 0.70 0.00 0.10 0.00 0.00 66.02 66.51 1w5c s SER 94 CO 0.59 -0.65 1.82 -0.07 0.98 0.00 0.00 173.24 175.91 1w5c h LEU 95 N 2.00 0.04 -0.68 2.42 4.07 -1.35 -1.50 115.31 120.31 1w5c h LEU 95 Ca -0.27 -0.01 -0.14 0.00 0.08 0.00 0.00 57.88 57.54 1w5c h LEU 95 Cb 1.21 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.93 1w5c h LEU 95 CO 0.29 0.39 -0.50 0.03 -1.08 0.00 0.00 178.44 177.57 1w5c h ARG 96 N 0.03 0.41 -0.86 1.13 3.08 -1.81 -3.02 114.38 113.34 1w5c h ARG 96 Ca 0.00 -0.24 -0.53 0.00 0.07 0.00 0.00 59.98 59.29 1w5c h ARG 96 Cb 0.65 0.02 -0.28 0.00 0.08 0.00 0.00 29.97 30.43 1w5c h ARG 96 CO 0.05 0.82 0.43 -1.13 -1.07 0.00 0.00 179.97 179.07 1w5c n SER 97 N -3.96 5.24 0.26 7.04 3.41 -0.73 -4.60 113.62 120.27 1w5c n SER 97 Ca -0.02 -3.73 0.17 0.00 -0.26 0.00 0.00 58.87 55.03 1w5c n SER 97 Cb 0.56 -0.80 0.79 0.00 -0.26 0.00 0.00 64.21 64.50 1w5c n SER 97 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w5c h ALA 98 N 1.54 1.00 -0.10 7.33 0.00 -1.17 -1.72 119.26 126.14 1w5c h ALA 98 Ca 0.52 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.30 1w5c h ALA 98 Cb 1.68 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 1w5c h ALA 98 CO 1.13 0.00 -0.53 0.38 0.00 0.00 0.00 179.25 180.24 1w5c h ASP 99 N 0.00 0.31 0.03 0.00 2.03 -1.87 -3.07 116.42 113.86 1w5c h ASP 99 Ca 0.00 -0.16 0.00 0.00 -0.73 0.00 0.00 57.03 56.14 1w5c h ASP 99 Cb 0.30 -0.09 0.00 0.00 -0.83 0.00 0.00 39.33 38.71 1w5c h ASP 99 CO 0.00 0.78 -1.38 2.30 -1.03 0.00 0.00 179.24 179.92 1w5c n ILE 100 N -3.94 0.01 -3.30 4.15 -5.35 -1.00 -4.48 119.36 105.45 1w5c n ILE 100 Ca -0.02 -0.20 -0.27 0.00 -0.27 0.00 0.00 62.75 61.99 1w5c n ILE 100 Cb 0.57 0.57 -0.07 0.00 -1.74 0.00 0.00 39.64 38.96 1w5c n ILE 100 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1w5c n PHE 101 N -1.82 3.67 -0.32 4.28 3.72 -0.68 -4.98 117.46 121.33 1w5c n PHE 101 Ca 0.01 -4.11 0.30 0.00 -0.05 0.00 0.00 57.45 53.60 1w5c n PHE 101 Cb 0.43 -0.54 0.56 0.00 -0.94 0.00 0.00 39.48 38.99 1w5c n PHE 101 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1w5c h PRO 102 N 3.88 0.05 0.00 -1.08 0.11 -1.76 0.13 132.00 133.33 1w5c h PRO 102 Ca 0.18 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1w5c h PRO 102 Cb 0.63 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.73 1w5c h PRO 102 CO 0.83 0.03 0.00 0.87 -0.21 0.00 0.00 178.00 179.52 1w5c h LYS 103 N 0.05 0.00 0.00 1.05 1.57 -1.94 0.25 116.57 117.56 1w5c h LYS 103 Ca 0.82 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.59 1w5c h LYS 103 Cb 2.12 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.43 1w5c h LYS 103 CO -0.75 0.00 -0.13 0.52 -0.57 0.00 0.00 179.45 178.53 1w5c h MET 104 N 0.00 0.00 -1.00 3.15 2.86 -1.27 -3.33 114.93 115.35 1w5c h MET 104 Ca 0.00 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1w5c h MET 104 Cb 0.00 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.59 1w5c h MET 104 CO 0.00 0.06 0.64 0.00 1.06 0.00 0.00 176.91 178.67 1w5c h ARG 105 N 0.00 1.10 -0.82 1.72 3.08 -1.09 -2.70 114.38 115.67 1w5c h ARG 105 Ca -0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1w5c h ARG 105 Cb 1.05 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1w5c h ARG 105 CO 0.01 0.73 0.00 0.09 -1.07 0.00 0.00 179.97 179.72 1w5c n ASN 106 N -4.52 2.72 -4.76 7.04 5.03 -1.25 -4.88 115.26 114.64 1w5c n ASN 106 Ca 0.16 -2.33 -0.36 0.00 0.87 0.00 0.00 54.58 52.92 1w5c n ASN 106 Cb 0.22 -0.56 -0.07 0.00 -1.02 0.00 0.00 39.78 38.35 1w5c n ASN 106 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1w5c s LEU 107 N -1.03 4.25 0.35 3.41 1.43 -1.02 -5.06 118.68 121.01 1w5c s LEU 107 Ca 0.20 0.33 0.05 0.00 -1.03 0.00 0.00 54.13 53.69 1w5c s LEU 107 Cb 0.15 -2.14 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1w5c s LEU 107 CO 0.06 0.21 0.50 0.42 0.23 0.00 0.00 176.35 177.77 1w5c s THR 108 N 0.12 4.12 0.27 5.49 -4.23 -1.26 -4.92 115.64 115.23 1w5c s THR 108 Ca 0.11 -0.91 -0.00 0.00 -1.18 0.00 0.00 61.69 59.70 1w5c s THR 108 Cb -0.12 -3.44 0.26 0.00 1.34 0.00 0.00 72.50 70.54 1w5c s THR 108 CO 0.00 -0.19 1.82 -0.08 -0.54 0.00 0.00 174.62 175.63 1w5c h GLU 109 N 0.82 0.86 -0.52 3.99 4.57 -1.99 0.47 114.58 122.78 1w5c h GLU 109 Ca -0.46 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 57.67 1w5c h GLU 109 Cb 1.25 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 29.62 1w5c h GLU 109 CO 0.54 0.57 0.32 -0.22 -1.18 0.00 0.00 179.01 179.04 1w5c h LYS 110 N 0.89 0.71 -0.44 1.92 3.64 -1.99 -1.52 116.57 119.77 1w5c h LYS 110 Ca 0.47 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.81 1w5c h LYS 110 Cb 0.48 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 1w5c h LYS 110 CO -0.27 0.51 0.24 -0.44 -2.27 0.00 0.00 179.45 177.22 1w5c h ASP 111 N 0.70 0.38 -0.28 4.20 3.32 -0.61 -1.39 116.42 122.74 1w5c h ASP 111 Ca 0.19 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 1w5c h ASP 111 Cb -0.02 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1w5c h ASP 111 CO -0.04 0.27 0.15 -0.07 -1.72 0.00 0.00 179.24 177.83 1w5c h LEU 112 N 0.49 0.39 -0.36 1.55 3.38 -0.22 -1.38 115.31 119.16 1w5c h LEU 112 Ca 0.18 -0.03 -0.16 0.00 0.09 0.00 0.00 57.88 57.96 1w5c h LEU 112 Cb 0.05 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1w5c h LEU 112 CO -0.10 0.34 -0.42 0.58 0.09 0.00 0.00 178.44 178.93 1w5c h VAL 113 N 0.44 1.27 0.01 1.22 2.07 -0.27 -1.96 116.25 119.04 1w5c h VAL 113 Ca 0.11 -1.59 -0.00 0.00 0.82 0.00 0.00 66.70 66.04 1w5c h VAL 113 Cb 0.06 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1w5c h VAL 113 CO -0.02 0.53 -0.01 0.00 0.02 0.00 0.00 177.57 178.10 1w5c h ALA 114 N 0.75 -0.02 -0.66 1.67 0.00 -0.80 0.41 119.26 120.60 1w5c h ALA 114 Ca 0.05 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 54.96 1w5c h ALA 114 Cb 1.02 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.73 1w5c h ALA 114 CO 0.10 -0.40 0.23 0.82 0.00 0.00 0.00 179.25 180.00 1w5c h ILE 115 N -0.24 0.70 -0.55 0.00 2.04 -1.26 0.32 117.51 118.52 1w5c h ILE 115 Ca -0.00 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1w5c h ILE 115 Cb 0.23 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 1w5c h ILE 115 CO 0.00 0.07 0.33 0.00 0.00 0.00 0.00 178.15 178.56 1w5c h ALA 116 N 1.48 0.70 -0.71 1.87 0.00 -1.21 -2.19 119.26 119.20 1w5c h ALA 116 Ca 0.35 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.24 1w5c h ALA 116 Cb 0.49 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1w5c h ALA 116 CO -0.36 0.18 0.47 0.78 0.00 0.00 0.00 179.25 180.32 1w5c h GLY 117 N 0.74 0.97 0.94 0.00 0.00 0.18 -1.83 103.07 104.07 1w5c h GLY 117 Ca 0.20 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 1w5c h GLY 117 CO -0.04 0.27 0.16 0.84 0.00 0.00 0.00 176.54 177.77 1w5c h HIS 118 N 0.82 0.48 -0.88 5.60 6.17 -0.11 -0.93 115.15 126.30 1w5c h HIS 118 Ca 0.29 -0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.34 1w5c h HIS 118 Cb 0.13 -0.15 -0.04 0.00 2.52 0.00 0.00 27.41 29.87 1w5c h HIS 118 CO -0.00 0.41 0.51 0.82 0.71 0.00 0.00 177.93 180.39 1w5c h ILE 119 N 0.40 1.25 0.00 6.26 2.04 -0.88 -1.63 117.51 124.95 1w5c h ILE 119 Ca 0.11 -0.56 -0.06 0.00 1.00 0.00 0.00 64.86 65.36 1w5c h ILE 119 Cb 0.11 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 1w5c h ILE 119 CO -0.01 0.26 -0.48 -0.07 0.00 0.00 0.00 178.15 177.85 1w5c h LEU 120 N 1.21 0.00 0.04 1.44 3.38 -1.21 -3.38 115.31 116.80 1w5c h LEU 120 Ca 0.31 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.10 1w5c h LEU 120 Cb -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1w5c h LEU 120 CO -0.06 0.24 -0.99 0.58 0.09 0.00 0.00 178.44 178.30 1w5c h VAL 121 N 0.00 1.18 -0.99 1.22 2.07 -0.95 -3.40 116.25 115.38 1w5c h VAL 121 Ca -0.02 -2.30 0.18 0.00 0.82 0.00 0.00 66.70 65.38 1w5c h VAL 121 Cb 1.20 2.70 -0.18 0.00 -1.52 0.00 0.00 31.29 33.49 1w5c h VAL 121 CO 0.03 0.53 -0.30 -0.33 0.02 0.00 0.00 177.57 177.51 1w5c h GLU 122 N -0.75 -0.00 -0.14 1.57 4.39 -1.47 0.59 114.58 118.77 1w5c h GLU 122 Ca -0.24 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.50 1w5c h GLU 122 Cb 1.39 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.04 1w5c h GLU 122 CO -0.06 -0.00 0.16 -1.00 -1.16 0.00 0.00 179.01 176.95 1w5c h PRO 123 N -0.00 0.00 0.00 2.33 0.13 -1.78 0.39 132.00 133.08 1w5c h PRO 123 Ca 0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.56 1w5c h PRO 123 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1w5c h PRO 123 CO -1.01 0.00 0.00 0.87 -0.23 0.00 0.00 178.00 177.63 1w5c h LYS 124 N 0.00 0.00 0.00 0.86 1.57 -0.03 0.10 116.57 119.07 1w5c h LYS 124 Ca 0.07 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 58.44 1w5c h LYS 124 Cb 0.38 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.63 1w5c h LYS 124 CO -0.00 0.00 -2.46 -0.89 -0.57 0.00 0.00 179.45 175.52 1w5c n ILE 125 N -2.39 1.46 0.04 1.86 5.41 0.11 -4.64 119.36 121.21 1w5c n ILE 125 Ca 0.04 -0.49 0.03 0.00 1.00 0.00 0.00 62.75 63.33 1w5c n ILE 125 Cb 0.38 -1.57 -0.07 0.00 -0.71 0.00 0.00 39.64 37.68 1w5c n ILE 125 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1w5c n LEU 126 N -3.60 0.81 0.00 1.39 4.77 0.50 -5.06 117.00 115.80 1w5c n LEU 126 Ca -0.48 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1w5c n LEU 126 Cb 0.94 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 42.08 1w5c n LEU 126 CO 0.17 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 1w5c n GLY 127 N 1.35 1.25 0.31 -0.72 0.00 0.36 -3.24 105.19 104.50 1w5c n GLY 127 Ca -0.08 -0.63 -0.02 0.00 0.00 0.00 0.00 46.02 45.29 1w5c n GLY 127 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1w5c h ASP 128 N 4.51 0.78 -1.36 1.61 3.32 -1.97 -2.92 116.42 120.39 1w5c h ASP 128 Ca 0.00 -0.11 0.39 0.00 0.02 0.00 0.00 57.03 57.34 1w5c h ASP 128 Cb 0.00 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.29 1w5c h ASP 128 CO 0.00 0.71 1.20 0.11 -1.72 0.00 0.00 179.24 179.55 1w5c h LYS 129 N 0.84 0.00 0.00 3.56 1.57 -1.92 0.80 116.57 121.42 1w5c h LYS 129 Ca 0.20 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.75 1w5c h LYS 129 Cb 0.19 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 1w5c h LYS 129 CO -0.02 0.00 -1.18 2.35 -0.57 0.00 0.00 179.45 180.03 1w5c h TRP 130 N 0.00 0.00 0.00 -1.35 2.91 -1.71 -3.19 115.95 112.61 1w5c h TRP 130 Ca 0.64 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.66 1w5c h TRP 130 Cb 3.05 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 31.70 1w5c h TRP 130 CO 0.00 0.99 0.00 0.41 -1.03 0.00 0.00 178.44 178.81 1w5c n GLY 131 N 1.40 -1.34 1.52 2.65 0.00 0.28 -3.69 105.19 106.01 1w5c n GLY 131 Ca -0.05 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.02 1w5c n GLY 131 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w5c n GLY 132 N 0.80 3.60 2.56 -0.02 0.00 -1.25 -3.98 105.19 106.90 1w5c n GLY 132 Ca 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.01 1w5c n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w5c n GLY 133 N -0.02 -4.29 0.05 -0.02 0.00 -1.20 -4.57 105.19 95.13 1w5c n GLY 133 Ca 0.28 0.56 -0.02 0.00 0.00 0.00 0.00 46.02 46.84 1w5c n GLY 133 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w5c h LYS 134 N 2.83 0.00 0.00 1.61 1.79 -1.73 1.31 116.57 122.39 1w5c h LYS 134 Ca -0.08 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.38 1w5c h LYS 134 Cb 0.17 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1w5c h LYS 134 CO 0.08 0.00 -0.06 0.28 -1.08 0.00 0.00 179.45 178.67 1w5c h VAL 135 N -0.77 0.53 0.00 0.50 2.07 -1.91 2.09 116.25 118.76 1w5c h VAL 135 Ca 0.00 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1w5c h VAL 135 Cb 0.25 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1w5c h VAL 135 CO 0.00 0.06 -0.87 0.00 0.02 0.00 0.00 177.57 176.78 1w5c n TYR 136 N -3.73 0.29 -0.74 1.57 -0.00 -1.25 -5.16 117.16 108.14 1w5c n TYR 136 Ca -0.02 0.08 0.00 0.00 -0.00 0.00 0.00 57.90 57.96 1w5c n TYR 136 Cb 0.15 -0.45 0.00 0.00 -0.00 0.00 0.00 39.34 39.05 1w5c n TYR 136 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.86 177.52