#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w4d s ILE 3 N 0.00 3.72 0.24 0.00 1.09 -1.26 -3.26 121.20 121.74 2w4d s ILE 3 Ca 0.00 -0.46 0.06 0.00 -1.10 0.00 0.00 60.65 59.15 2w4d s ILE 3 Cb 0.00 -2.55 -0.05 0.00 -1.06 0.00 0.00 42.46 38.80 2w4d s ILE 3 CO 0.00 0.57 -0.07 0.68 -0.10 0.00 0.00 174.94 176.03 2w4d s VAL 4 N -0.52 1.50 -0.06 2.92 -7.23 0.54 -4.83 120.40 112.72 2w4d s VAL 4 Ca 0.08 -2.12 0.01 0.00 -1.81 0.00 0.00 61.98 58.14 2w4d s VAL 4 Cb -0.12 -2.30 0.02 0.00 0.56 0.00 0.00 36.38 34.54 2w4d s VAL 4 CO 0.02 -0.40 -0.07 -0.60 -0.31 0.00 0.00 175.10 173.74 2w4d s ARG 5 N -3.74 1.22 -0.08 4.82 3.52 -1.24 -1.78 118.95 121.67 2w4d s ARG 5 Ca 0.27 -0.22 0.04 0.00 -0.13 0.00 0.00 55.73 55.69 2w4d s ARG 5 Cb 0.03 -1.15 0.00 0.00 -1.56 0.00 0.00 34.95 32.27 2w4d s ARG 5 CO 0.09 -0.08 -0.20 0.00 -0.81 0.00 0.00 175.30 174.30 2w4d s ALA 6 N 1.00 1.83 -0.29 6.12 0.00 0.95 -1.40 121.76 129.97 2w4d s ALA 6 Ca -0.09 -0.78 -0.09 0.00 0.00 0.00 0.00 51.96 50.99 2w4d s ALA 6 Cb -0.14 -0.69 -0.02 0.00 0.00 0.00 0.00 23.12 22.27 2w4d s ALA 6 CO -0.00 0.25 0.13 -1.58 0.00 0.00 0.00 175.76 174.57 2w4d s HIS 7 N 0.34 3.16 0.16 0.00 2.46 0.31 -0.79 115.29 120.93 2w4d s HIS 7 Ca -0.14 -0.43 0.06 0.00 0.47 0.00 0.00 55.06 55.02 2w4d s HIS 7 Cb -0.16 -2.33 -0.04 0.00 -0.13 0.00 0.00 32.58 29.92 2w4d s HIS 7 CO 0.06 -0.39 0.08 -0.51 -2.47 0.00 0.00 174.74 171.51 2w4d s LEU 8 N 1.64 3.62 -0.14 8.88 1.02 0.13 -1.32 118.68 132.50 2w4d s LEU 8 Ca 0.05 -0.21 -0.04 0.00 0.02 0.00 0.00 54.13 53.95 2w4d s LEU 8 Cb -0.16 -2.26 0.05 0.00 0.02 0.00 0.00 46.19 43.84 2w4d s LEU 8 CO 0.06 0.09 0.07 -0.54 0.02 0.00 0.00 176.35 176.05 2w4d s LYS 9 N -2.95 0.16 -0.16 1.70 1.02 -0.51 -1.93 119.74 117.07 2w4d s LYS 9 Ca 0.29 -0.03 -0.04 0.00 0.02 0.00 0.00 55.97 56.21 2w4d s LYS 9 Cb -0.10 -1.57 -0.03 0.00 -0.52 0.00 0.00 37.83 35.62 2w4d s LYS 9 CO 0.21 -0.58 -0.02 0.42 -0.92 0.00 0.00 175.35 174.46 2w4d s ILE 10 N 2.09 4.00 0.27 2.17 1.01 0.43 -0.98 121.20 130.19 2w4d s ILE 10 Ca 0.02 -0.32 0.12 0.00 0.00 0.00 0.00 60.65 60.47 2w4d s ILE 10 Cb -0.15 -2.76 -0.05 0.00 0.01 0.00 0.00 42.46 39.51 2w4d s ILE 10 CO -0.07 0.49 -0.18 -0.31 0.00 0.00 0.00 174.94 174.86 2w4d s TYR 11 N 0.41 2.35 -0.75 3.97 1.51 -0.22 -1.17 117.35 123.45 2w4d s TYR 11 Ca -0.03 -0.32 0.00 0.00 -1.01 0.00 0.00 57.07 55.71 2w4d s TYR 11 Cb -0.14 -1.04 0.00 0.00 -0.11 0.00 0.00 41.96 40.67 2w4d s TYR 11 CO 0.03 0.68 0.00 0.41 -1.11 0.00 0.00 175.55 175.56 2w4d n GLY 12 N -0.56 0.28 3.41 0.71 0.00 -1.26 -1.12 105.19 106.65 2w4d n GLY 12 Ca -0.06 -1.80 -0.45 0.00 0.00 0.00 0.00 46.02 43.71 2w4d n GLY 12 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w4d s ARG 13 N -0.60 3.94 0.00 1.61 3.52 0.30 -4.72 118.95 122.99 2w4d s ARG 13 Ca 0.00 -2.54 0.02 0.00 -0.13 0.00 0.00 55.73 53.08 2w4d s ARG 13 Cb 0.00 -4.81 0.00 0.00 -1.56 0.00 0.00 34.95 28.58 2w4d s ARG 13 CO 0.00 -1.57 0.40 1.33 -0.81 0.00 0.00 175.30 174.65 2w4d n VAL 14 N 4.24 0.00 -4.26 7.11 0.24 -1.26 -1.06 118.33 123.33 2w4d n VAL 14 Ca 0.27 -0.49 -0.29 0.00 -2.04 0.00 0.00 64.34 61.79 2w4d n VAL 14 Cb 0.44 1.03 -0.10 0.00 -1.47 0.00 0.00 33.84 33.73 2w4d n VAL 14 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2w4d s GLN 15 N -0.49 1.98 -0.74 7.34 -0.21 -1.26 -4.53 119.66 121.74 2w4d s GLN 15 Ca 0.02 -1.12 0.00 0.00 0.02 0.00 0.00 55.36 54.28 2w4d s GLN 15 Cb 0.01 -2.21 0.00 0.00 1.00 0.00 0.00 33.01 31.81 2w4d s GLN 15 CO 0.04 0.49 0.00 0.41 -2.12 0.00 0.00 175.29 174.11 2w4d n GLY 16 N 0.65 0.74 0.06 3.09 0.00 -1.26 -4.89 105.19 103.59 2w4d n GLY 16 Ca -0.14 -0.69 0.02 0.00 0.00 0.00 0.00 46.02 45.21 2w4d n GLY 16 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2w4d n VAL 17 N -3.07 0.78 -2.11 1.61 0.24 -1.26 -4.99 118.33 109.53 2w4d n VAL 17 Ca -0.08 -0.84 -0.06 0.00 -2.04 0.00 0.00 64.34 61.33 2w4d n VAL 17 Cb 0.32 0.52 -0.00 0.00 -1.47 0.00 0.00 33.84 33.20 2w4d n VAL 17 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2w4d n GLY 18 N -0.47 0.13 0.11 7.63 0.00 -1.26 -4.72 105.19 106.62 2w4d n GLY 18 Ca 0.03 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 2w4d n GLY 18 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2w4d h PHE 19 N 0.00 0.29 -0.10 1.61 3.04 -1.94 -2.24 116.94 117.60 2w4d h PHE 19 Ca -0.14 -0.06 0.01 0.00 3.98 0.00 0.00 57.97 61.77 2w4d h PHE 19 Cb 1.10 -0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.52 2w4d h PHE 19 CO 0.15 0.52 0.01 0.00 -2.02 0.00 0.00 178.31 176.97 2w4d h ARG 20 N -0.02 0.04 -0.63 1.11 3.08 -1.93 0.55 114.38 116.57 2w4d h ARG 20 Ca 0.04 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2w4d h ARG 20 Cb 0.41 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 2w4d h ARG 20 CO 0.01 0.03 0.37 2.35 -1.07 0.00 0.00 179.97 181.66 2w4d h TRP 21 N 0.04 0.85 -0.53 3.04 7.01 -1.98 -2.02 115.95 122.35 2w4d h TRP 21 Ca 0.04 -0.01 -0.09 0.00 2.11 0.00 0.00 58.89 60.94 2w4d h TRP 21 Cb 0.05 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 26.81 2w4d h TRP 21 CO -0.12 0.59 -0.04 0.77 -2.79 0.00 0.00 178.44 176.85 2w4d h SER 22 N 0.86 0.92 -0.01 2.65 0.02 -1.11 -1.42 113.55 115.45 2w4d h SER 22 Ca 0.23 -0.26 -0.13 0.00 -0.84 0.00 0.00 61.79 60.78 2w4d h SER 22 Cb 0.00 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 2w4d h SER 22 CO -0.04 1.00 -0.42 -0.03 -1.14 0.00 0.00 176.83 176.19 2w4d h MET 23 N 0.85 0.54 -0.23 3.45 1.85 -0.72 -0.45 114.93 120.22 2w4d h MET 23 Ca 0.15 -0.28 -0.02 0.00 -0.61 0.00 0.00 59.70 58.94 2w4d h MET 23 Cb 0.56 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.58 2w4d h MET 23 CO 0.03 0.86 0.07 0.37 -0.40 0.00 0.00 176.91 177.84 2w4d h GLN 24 N 0.44 0.35 -0.18 0.39 4.15 -1.12 0.28 115.11 119.42 2w4d h GLN 24 Ca 0.03 -0.08 0.01 0.00 0.77 0.00 0.00 58.65 59.39 2w4d h GLN 24 Cb 0.92 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.55 2w4d h GLN 24 CO 0.08 0.44 0.09 -0.09 -1.93 0.00 0.00 178.83 177.43 2w4d h ARG 25 N 0.20 0.19 -0.84 1.69 2.43 -1.10 -1.03 114.38 115.92 2w4d h ARG 25 Ca 0.07 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2w4d h ARG 25 Cb 0.24 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 2w4d h ARG 25 CO -0.00 0.13 0.42 1.49 -1.51 0.00 0.00 179.97 180.50 2w4d h GLU 26 N 0.20 1.19 -0.30 0.20 4.57 -0.92 -2.20 114.58 117.32 2w4d h GLU 26 Ca 0.07 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2w4d h GLU 26 Cb 0.01 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 2w4d h GLU 26 CO -0.04 0.89 0.16 0.00 -1.18 0.00 0.00 179.01 178.84 2w4d h ALA 27 N 1.28 0.38 -0.79 2.92 0.00 0.02 -1.59 119.26 121.48 2w4d h ALA 27 Ca 0.29 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2w4d h ALA 27 Cb 0.08 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2w4d h ALA 27 CO -0.04 -0.09 0.45 0.00 0.00 0.00 0.00 179.25 179.57 2w4d h ARG 28 N 0.36 1.10 -0.70 0.00 3.08 -0.98 0.57 114.38 117.81 2w4d h ARG 28 Ca 0.10 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2w4d h ARG 28 Cb 0.06 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 2w4d h ARG 28 CO -0.02 0.80 0.43 -0.22 -1.07 0.00 0.00 179.97 179.90 2w4d h LYS 29 N 1.09 0.94 0.00 0.04 3.64 -1.15 -2.53 116.57 118.61 2w4d h LYS 29 Ca 0.28 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 2w4d h LYS 29 Cb 0.01 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 2w4d h LYS 29 CO -0.05 0.66 -0.29 -0.07 -2.27 0.00 0.00 179.45 177.44 2w4d h LEU 30 N 0.95 0.00 -0.37 5.20 3.38 -0.91 -3.48 115.31 120.09 2w4d h LEU 30 Ca 0.25 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2w4d h LEU 30 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2w4d h LEU 30 CO -0.05 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.12 2w4d n GLY 31 N 1.25 0.75 3.88 0.83 0.00 0.17 -4.88 105.19 107.19 2w4d n GLY 31 Ca 0.04 -0.69 -0.36 0.00 0.00 0.00 0.00 46.02 45.01 2w4d n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w4d s VAL 32 N -2.37 5.37 0.27 1.61 1.01 0.38 -4.82 120.40 121.85 2w4d s VAL 32 Ca 0.00 0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.28 2w4d s VAL 32 Cb 0.00 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 2w4d s VAL 32 CO 0.00 0.49 0.20 0.20 0.00 0.00 0.00 175.10 175.98 2w4d s ASN 33 N -1.40 5.40 0.00 3.32 0.01 0.12 -4.25 114.94 118.14 2w4d s ASN 33 Ca 0.22 -0.33 0.00 0.00 -0.71 0.00 0.00 52.86 52.04 2w4d s ASN 33 Cb -0.13 -1.28 0.00 0.00 0.41 0.00 0.00 41.25 40.25 2w4d s ASN 33 CO 0.11 -0.09 0.00 0.61 -1.51 0.00 0.00 177.10 176.22 2w4d n GLY 34 N -1.19 0.67 3.55 0.66 0.00 -0.48 -0.12 105.19 108.28 2w4d n GLY 34 Ca -0.07 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.10 2w4d n GLY 34 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2w4d s TRP 35 N -2.88 0.36 -0.01 1.61 1.48 -0.83 -1.07 118.94 117.60 2w4d s TRP 35 Ca 0.00 -0.72 -0.10 0.00 -1.06 0.00 0.00 56.10 54.22 2w4d s TRP 35 Cb 0.00 0.15 0.01 0.00 -1.16 0.00 0.00 33.47 32.48 2w4d s TRP 35 CO 0.00 -0.95 0.21 0.54 -4.06 0.00 0.00 176.95 172.69 2w4d s VAL 36 N -4.01 0.06 -0.00 -0.66 0.11 -0.79 -0.93 120.40 114.18 2w4d s VAL 36 Ca 0.22 -0.53 -0.28 0.00 -2.93 0.00 0.00 61.98 58.46 2w4d s VAL 36 Cb -0.00 -0.49 0.10 0.00 -1.53 0.00 0.00 36.38 34.46 2w4d s VAL 36 CO 0.08 -0.29 0.83 0.00 -3.33 0.00 0.00 175.10 172.38 2w4d s ARG 37 N -1.18 0.90 0.15 1.54 1.70 0.16 -1.54 118.95 120.67 2w4d s ARG 37 Ca -0.12 -0.21 -0.20 0.00 -0.47 0.00 0.00 55.73 54.73 2w4d s ARG 37 Cb -0.06 0.42 -0.07 0.00 -0.57 0.00 0.00 34.95 34.66 2w4d s ARG 37 CO 0.02 -0.37 0.65 -0.80 -1.08 0.00 0.00 175.30 173.73 2w4d s ASN 38 N -2.19 7.09 0.18 -2.89 0.02 -1.26 -0.73 114.94 115.16 2w4d s ASN 38 Ca 0.02 1.35 0.07 0.00 -1.02 0.00 0.00 52.86 53.28 2w4d s ASN 38 Cb -0.01 -2.39 -0.04 0.00 0.02 0.00 0.00 41.25 38.83 2w4d s ASN 38 CO -0.06 0.17 -0.00 -0.76 0.02 0.00 0.00 177.10 176.46 2w4d s LEU 39 N -1.50 3.29 0.52 0.60 1.43 -0.46 -4.92 118.68 117.65 2w4d s LEU 39 Ca 0.36 -0.41 0.34 0.00 -1.03 0.00 0.00 54.13 53.38 2w4d s LEU 39 Cb -0.19 -1.94 1.83 0.00 0.03 0.00 0.00 46.19 45.92 2w4d s LEU 39 CO 0.21 0.09 2.03 1.55 0.23 0.00 0.00 176.35 180.45 2w4d h PRO 40 N 2.68 0.00 -0.22 1.29 0.13 -1.98 -1.23 132.00 132.67 2w4d h PRO 40 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2w4d h PRO 40 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2w4d h PRO 40 CO 0.58 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.95 2w4d n ASP 41 N -2.70 1.27 0.00 1.44 5.75 -1.26 -4.89 116.55 116.15 2w4d n ASP 41 Ca -0.02 -1.92 0.00 0.00 -0.01 0.00 0.00 54.79 52.84 2w4d n ASP 41 Cb 0.09 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 2w4d n ASP 41 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w4d n GLY 42 N 0.92 1.06 4.02 6.12 0.00 -0.46 -5.05 105.19 111.78 2w4d n GLY 42 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 2w4d n GLY 42 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w4d s SER 43 N -3.06 4.79 -0.03 1.61 1.04 -1.25 -4.54 113.70 112.26 2w4d s SER 43 Ca 0.00 -0.62 0.07 0.00 0.48 0.00 0.00 55.95 55.89 2w4d s SER 43 Cb 0.00 0.12 -0.02 0.00 0.10 0.00 0.00 66.02 66.22 2w4d s SER 43 CO 0.00 -1.55 -0.26 -0.69 0.98 0.00 0.00 173.24 171.73 2w4d s VAL 44 N -2.86 2.04 -0.02 5.02 1.01 -0.32 -1.35 120.40 123.92 2w4d s VAL 44 Ca 0.64 -1.09 0.08 0.00 0.00 0.00 0.00 61.98 61.60 2w4d s VAL 44 Cb -0.06 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 2w4d s VAL 44 CO 0.41 0.57 -0.25 -0.70 0.00 0.00 0.00 175.10 175.14 2w4d s GLU 45 N -0.49 2.01 0.05 2.72 2.12 0.09 -0.43 118.70 124.78 2w4d s GLU 45 Ca 0.06 -0.90 -0.17 0.00 0.36 0.00 0.00 54.97 54.33 2w4d s GLU 45 Cb -0.11 -1.95 0.03 0.00 0.26 0.00 0.00 34.13 32.36 2w4d s GLU 45 CO 0.00 0.53 0.38 0.00 -0.54 0.00 0.00 175.26 175.64 2w4d s ALA 46 N -0.59 -0.92 -0.11 6.30 0.00 -0.81 -0.67 121.76 124.96 2w4d s ALA 46 Ca 0.10 0.19 0.02 0.00 0.00 0.00 0.00 51.96 52.27 2w4d s ALA 46 Cb -0.10 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.42 2w4d s ALA 46 CO -0.01 -0.47 -0.15 0.08 0.00 0.00 0.00 175.76 175.21 2w4d s VAL 47 N -2.64 1.50 -0.09 0.00 1.01 -0.11 0.22 120.40 120.28 2w4d s VAL 47 Ca -0.04 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.34 2w4d s VAL 47 Cb -0.00 -1.37 -0.00 0.00 0.00 0.00 0.00 36.38 35.00 2w4d s VAL 47 CO -0.04 0.44 -0.24 -0.76 0.00 0.00 0.00 175.10 174.51 2w4d s LEU 48 N 1.01 2.07 -0.02 3.92 1.02 0.03 -1.96 118.68 124.76 2w4d s LEU 48 Ca -0.06 -0.55 0.00 0.00 0.02 0.00 0.00 54.13 53.55 2w4d s LEU 48 Cb -0.15 -1.39 0.02 0.00 0.02 0.00 0.00 46.19 44.69 2w4d s LEU 48 CO -0.02 0.16 -0.00 -0.70 0.02 0.00 0.00 176.35 175.81 2w4d s GLU 49 N 0.30 0.18 0.00 1.70 2.12 0.83 -0.03 118.70 123.79 2w4d s GLU 49 Ca -0.17 0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.20 2w4d s GLU 49 Cb -0.17 -0.30 0.00 0.00 0.26 0.00 0.00 34.13 33.91 2w4d s GLU 49 CO 0.08 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.14 2w4d n GLY 50 N 3.70 -0.12 3.73 -1.50 0.00 -0.74 -0.70 105.19 109.56 2w4d n GLY 50 Ca -0.21 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 2w4d n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2w4d s ASP 51 N -4.00 6.55 0.36 1.61 1.01 -1.26 -0.33 116.67 120.61 2w4d s ASP 51 Ca 0.00 2.70 0.14 0.00 0.71 0.00 0.00 52.55 56.10 2w4d s ASP 51 Cb 0.00 -2.60 0.99 0.00 1.01 0.00 0.00 42.92 42.31 2w4d s ASP 51 CO 0.00 -0.83 1.77 1.05 0.21 0.00 0.00 175.17 177.37 2w4d h GLU 52 N 6.26 0.49 -0.63 8.23 4.11 -1.90 0.20 114.58 131.34 2w4d h GLU 52 Ca -0.44 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 58.95 2w4d h GLU 52 Cb 1.21 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.32 2w4d h GLU 52 CO 0.88 0.32 0.35 1.49 0.07 0.00 0.00 179.01 182.13 2w4d h GLU 53 N 0.50 0.88 -0.20 1.06 4.57 -1.89 -0.60 114.58 118.90 2w4d h GLU 53 Ca 0.60 -0.10 -0.18 0.00 -1.18 0.00 0.00 59.36 58.50 2w4d h GLU 53 Cb 1.32 -0.17 0.01 0.00 -0.16 0.00 0.00 28.75 29.74 2w4d h GLU 53 CO -0.35 0.66 -0.59 0.00 -1.18 0.00 0.00 179.01 177.55 2w4d h ARG 54 N 0.86 0.74 -0.37 1.92 2.47 -1.03 -2.44 114.38 116.54 2w4d h ARG 54 Ca 0.22 -0.54 -0.03 0.00 -1.26 0.00 0.00 59.98 58.38 2w4d h ARG 54 Cb 0.03 0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.42 2w4d h ARG 54 CO -0.04 1.16 0.12 0.28 0.56 0.00 0.00 179.97 182.06 2w4d h VAL 55 N 0.47 1.21 -0.61 2.04 2.07 -0.98 -1.99 116.25 118.46 2w4d h VAL 55 Ca -0.02 -0.67 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 2w4d h VAL 55 Cb 1.21 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 2w4d h VAL 55 CO 0.13 0.23 0.21 -0.33 0.02 0.00 0.00 177.57 177.83 2w4d h GLU 56 N 0.46 0.91 -0.81 1.57 5.08 -1.15 -0.03 114.58 120.61 2w4d h GLU 56 Ca 0.12 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 2w4d h GLU 56 Cb 0.24 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 2w4d h GLU 56 CO -0.01 0.77 0.35 0.00 -1.00 0.00 0.00 179.01 179.13 2w4d h ALA 57 N 1.34 1.05 -0.21 3.43 0.00 -1.16 -0.78 119.26 122.92 2w4d h ALA 57 Ca 0.20 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 2w4d h ALA 57 Cb 0.23 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2w4d h ALA 57 CO -0.01 0.65 -0.50 1.25 0.00 0.00 0.00 179.25 180.64 2w4d h LEU 58 N 1.16 0.63 -0.34 0.00 5.85 -0.69 -1.82 115.31 120.12 2w4d h LEU 58 Ca 0.27 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2w4d h LEU 58 Cb 0.17 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2w4d h LEU 58 CO -0.03 1.02 0.15 0.40 -0.34 0.00 0.00 178.44 179.64 2w4d h ILE 59 N 0.46 1.17 -0.32 4.05 2.04 -0.63 -0.35 117.51 123.93 2w4d h ILE 59 Ca 0.02 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.38 2w4d h ILE 59 Cb 1.03 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 2w4d h ILE 59 CO 0.10 0.18 0.16 1.23 0.00 0.00 0.00 178.15 179.83 2w4d h GLY 60 N 0.40 0.43 0.54 5.37 0.00 -1.05 -2.05 103.07 106.72 2w4d h GLY 60 Ca 0.11 -0.12 0.09 0.00 0.00 0.00 0.00 47.33 47.41 2w4d h GLY 60 CO -0.01 0.10 0.42 -0.25 0.00 0.00 0.00 176.54 176.79 2w4d h TRP 61 N 0.34 0.76 0.00 5.60 7.01 -1.01 -1.35 115.95 127.29 2w4d h TRP 61 Ca 0.13 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.16 2w4d h TRP 61 Cb 0.04 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 26.87 2w4d h TRP 61 CO -0.09 0.31 0.10 0.00 -2.79 0.00 0.00 178.44 175.97 2w4d h ALA 62 N 1.42 1.08 0.00 2.65 0.00 -0.32 0.49 119.26 124.59 2w4d h ALA 62 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2w4d h ALA 62 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2w4d h ALA 62 CO -0.24 -0.08 -0.27 0.72 0.00 0.00 0.00 179.25 179.38 2w4d n HIS 63 N -2.54 0.62 -0.07 0.00 8.25 -0.51 -4.11 115.22 116.85 2w4d n HIS 63 Ca -0.02 0.18 -0.09 0.00 -0.26 0.00 0.00 57.72 57.53 2w4d n HIS 63 Cb 0.14 -0.73 -0.03 0.00 1.12 0.00 0.00 29.99 30.49 2w4d n HIS 63 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2w4d n GLN 64 N -2.06 0.45 -0.67 -0.41 -0.06 0.14 -4.48 117.38 110.27 2w4d n GLN 64 Ca 0.05 0.18 0.09 0.00 -2.00 0.00 0.00 57.00 55.32 2w4d n GLN 64 Cb 0.42 -1.28 -0.02 0.00 -4.06 0.00 0.00 30.24 25.29 2w4d n GLN 64 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2w4d n GLY 65 N 1.78 -2.01 3.70 1.69 0.00 0.75 -4.67 105.19 106.43 2w4d n GLY 65 Ca -0.15 -1.32 -0.32 0.00 0.00 0.00 0.00 46.02 44.23 2w4d n GLY 65 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2w4d s PRO 66 N -1.45 1.59 0.21 1.61 0.04 -1.26 -4.82 135.00 130.92 2w4d s PRO 66 Ca 0.00 1.63 -0.06 0.00 0.04 0.00 0.00 61.00 62.61 2w4d s PRO 66 Cb 0.00 -1.78 0.35 0.00 0.04 0.00 0.00 34.50 33.11 2w4d s PRO 66 CO 0.00 -2.22 1.16 -2.30 0.04 0.00 0.00 177.00 173.68 2w4d n PRO 67 N -3.52 -0.07 0.00 0.56 -0.02 -1.26 -0.62 135.00 130.07 2w4d n PRO 67 Ca 0.12 1.16 0.13 0.00 -2.02 0.00 0.00 63.50 62.89 2w4d n PRO 67 Cb 0.51 -1.74 0.59 0.00 -0.02 0.00 0.00 33.50 32.85 2w4d n PRO 67 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2w4d n LEU 68 N -5.20 0.00 -4.78 2.45 7.99 -1.26 -4.87 117.00 111.33 2w4d n LEU 68 Ca 0.12 0.49 -0.37 0.00 -0.01 0.00 0.00 56.01 56.24 2w4d n LEU 68 Cb 0.38 -0.49 -0.03 0.00 -0.11 0.00 0.00 43.42 43.18 2w4d n LEU 68 CO -0.09 -0.03 0.78 0.00 -1.51 0.00 0.00 177.39 176.55 2w4d s ALA 69 N -2.98 3.05 -0.40 -1.18 0.00 0.20 -4.96 121.76 115.50 2w4d s ALA 69 Ca 0.14 0.82 0.01 0.00 0.00 0.00 0.00 51.96 52.94 2w4d s ALA 69 Cb 0.18 -3.33 0.14 0.00 0.00 0.00 0.00 23.12 20.11 2w4d s ALA 69 CO 0.50 -0.43 0.24 0.50 0.00 0.00 0.00 175.76 176.57 2w4d s ARG 70 N -2.55 0.89 -0.12 0.00 3.52 -0.23 -4.90 118.95 115.56 2w4d s ARG 70 Ca 0.60 -1.71 -0.27 0.00 -0.13 0.00 0.00 55.73 54.22 2w4d s ARG 70 Cb -0.26 -1.72 -0.02 0.00 -1.56 0.00 0.00 34.95 31.40 2w4d s ARG 70 CO 0.32 -1.22 0.90 0.08 -0.81 0.00 0.00 175.30 174.57 2w4d s VAL 71 N 0.63 4.86 -0.03 7.11 1.01 -1.26 -0.54 120.40 132.18 2w4d s VAL 71 Ca 0.20 1.81 0.19 0.00 0.00 0.00 0.00 61.98 64.18 2w4d s VAL 71 Cb -0.19 -4.21 -0.29 0.00 0.00 0.00 0.00 36.38 31.68 2w4d s VAL 71 CO -0.02 0.05 0.41 0.35 0.00 0.00 0.00 175.10 175.89 2w4d n THR 72 N 4.51 0.00 -3.58 3.92 -2.24 -0.27 -4.98 114.28 111.64 2w4d n THR 72 Ca 0.06 -0.43 -0.14 0.00 -2.27 0.00 0.00 64.05 61.27 2w4d n THR 72 Cb 0.49 0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 2w4d n THR 72 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2w4d s ARG 73 N -3.31 0.79 -0.04 -0.78 3.52 -1.21 -5.03 118.95 112.90 2w4d s ARG 73 Ca -0.07 0.43 0.01 0.00 -0.13 0.00 0.00 55.73 55.97 2w4d s ARG 73 Cb 0.12 0.38 0.02 0.00 -1.56 0.00 0.00 34.95 33.91 2w4d s ARG 73 CO 0.79 -0.20 -0.04 0.08 -0.81 0.00 0.00 175.30 175.12 2w4d s VAL 74 N -0.61 0.50 -0.17 7.11 1.01 -1.26 -1.05 120.40 125.92 2w4d s VAL 74 Ca -0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 61.98 61.82 2w4d s VAL 74 Cb -0.02 -0.53 -0.01 0.00 0.00 0.00 0.00 36.38 35.82 2w4d s VAL 74 CO 0.03 0.21 -0.09 -1.61 0.00 0.00 0.00 175.10 173.65 2w4d s GLU 75 N 0.90 3.39 0.04 2.72 2.02 -0.15 -4.97 118.70 122.65 2w4d s GLU 75 Ca -0.11 -0.65 0.06 0.00 0.02 0.00 0.00 54.97 54.28 2w4d s GLU 75 Cb -0.14 -2.81 -0.03 0.00 0.10 0.00 0.00 34.13 31.24 2w4d s GLU 75 CO 0.00 0.02 -0.13 0.08 0.02 0.00 0.00 175.26 175.25 2w4d s VAL 76 N 0.87 3.16 -0.10 2.63 1.01 -1.26 -1.42 120.40 125.29 2w4d s VAL 76 Ca -0.02 -1.07 -0.02 0.00 0.00 0.00 0.00 61.98 60.87 2w4d s VAL 76 Cb -0.15 -2.37 0.03 0.00 0.00 0.00 0.00 36.38 33.89 2w4d s VAL 76 CO 0.01 0.32 0.01 -0.54 0.00 0.00 0.00 175.10 174.89 2w4d s LYS 77 N -1.56 0.63 0.01 2.72 1.02 -0.44 -4.96 119.74 117.16 2w4d s LYS 77 Ca 0.17 -0.01 -0.23 0.00 0.02 0.00 0.00 55.97 55.92 2w4d s LYS 77 Cb -0.11 -1.23 -0.05 0.00 -0.52 0.00 0.00 37.83 35.92 2w4d s LYS 77 CO 0.07 -0.38 0.68 -1.58 -0.92 0.00 0.00 175.35 173.23 2w4d s TRP 78 N 1.95 3.69 0.35 3.18 0.52 -1.26 -0.53 118.94 126.84 2w4d s TRP 78 Ca 0.04 1.32 0.05 0.00 0.02 0.00 0.00 56.10 57.53 2w4d s TRP 78 Cb -0.13 -2.72 -0.03 0.00 -1.15 0.00 0.00 33.47 29.44 2w4d s TRP 78 CO -0.06 0.28 0.21 -1.21 0.02 0.00 0.00 176.95 176.19 2w4d s GLU 79 N 0.01 1.78 -0.06 4.98 2.02 -0.49 -4.99 118.70 121.95 2w4d s GLU 79 Ca 0.35 -2.05 -0.30 0.00 0.02 0.00 0.00 54.97 52.99 2w4d s GLU 79 Cb -0.19 -0.04 -0.02 0.00 0.10 0.00 0.00 34.13 33.98 2w4d s GLU 79 CO 0.20 -0.57 1.01 -1.14 0.02 0.00 0.00 175.26 174.78 2w4d s GLN 80 N -3.60 4.47 0.48 1.61 0.74 -1.26 -3.68 119.66 118.41 2w4d s GLN 80 Ca 0.34 1.42 -0.22 0.00 0.05 0.00 0.00 55.36 56.96 2w4d s GLN 80 Cb 0.03 -3.51 -0.09 0.00 1.10 0.00 0.00 33.01 30.53 2w4d s GLN 80 CO 0.21 -0.23 0.84 -2.30 -0.55 0.00 0.00 175.29 173.26 2w4d n PRO 81 N 4.62 0.98 -0.00 1.67 -0.02 -1.26 -4.91 135.00 136.07 2w4d n PRO 81 Ca 0.08 0.36 0.01 0.00 -2.02 0.00 0.00 63.50 61.93 2w4d n PRO 81 Cb 0.49 -1.92 0.01 0.00 -0.02 0.00 0.00 33.50 32.06 2w4d n PRO 81 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2w4d n LYS 82 N -0.04 -0.36 -0.54 -0.52 5.02 -1.26 -5.01 118.16 115.45 2w4d n LYS 82 Ca 0.11 -0.69 0.00 0.00 -2.02 0.00 0.00 58.31 55.71 2w4d n LYS 82 Cb 0.42 -1.02 0.00 0.00 -0.02 0.00 0.00 35.03 34.41 2w4d n LYS 82 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2w4d n GLY 83 N 0.00 1.15 3.62 0.72 0.00 -1.26 -5.05 105.19 104.38 2w4d n GLY 83 Ca 0.01 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 2w4d n GLY 83 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2w4d n GLU 84 N -1.58 1.28 -3.70 1.61 -0.58 -1.26 -5.00 120.64 111.41 2w4d n GLU 84 Ca 0.00 0.47 -0.23 0.00 -0.42 0.00 0.00 57.16 56.97 2w4d n GLU 84 Cb 0.10 -2.11 -0.17 0.00 -0.57 0.00 0.00 31.44 28.68 2w4d n GLU 84 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2w4d s LYS 85 N -2.25 0.27 0.00 3.49 2.20 -1.26 -4.80 119.74 117.38 2w4d s LYS 85 Ca 0.67 0.07 0.00 0.00 -0.36 0.00 0.00 55.97 56.34 2w4d s LYS 85 Cb -0.50 -1.21 0.00 0.00 -1.51 0.00 0.00 37.83 34.61 2w4d s LYS 85 CO 0.54 -0.45 0.00 0.41 -0.36 0.00 0.00 175.35 175.49 2w4d n GLY 86 N 5.21 -2.29 3.31 5.54 0.00 -1.26 -4.79 105.19 110.91 2w4d n GLY 86 Ca -0.06 -1.47 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 2w4d n GLY 86 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2w4d s PHE 87 N -3.08 2.92 0.20 1.61 5.36 -1.26 -1.39 117.98 122.35 2w4d s PHE 87 Ca 0.00 -0.92 0.10 0.00 -0.96 0.00 0.00 56.93 55.15 2w4d s PHE 87 Cb 0.00 -2.04 -0.04 0.00 -0.34 0.00 0.00 43.02 40.59 2w4d s PHE 87 CO 0.00 -0.49 -0.20 -0.98 -1.46 0.00 0.00 175.22 172.09 2w4d s ARG 88 N 1.24 1.45 -0.32 10.12 1.70 -0.23 -4.95 118.95 127.96 2w4d s ARG 88 Ca 0.03 -1.55 -0.13 0.00 -0.47 0.00 0.00 55.73 53.61 2w4d s ARG 88 Cb -0.14 -1.57 -0.03 0.00 -0.57 0.00 0.00 34.95 32.64 2w4d s ARG 88 CO -0.02 0.32 0.27 0.42 -1.08 0.00 0.00 175.30 175.20 2w4d s ILE 89 N -2.13 5.26 0.45 4.99 1.01 -1.26 -1.88 121.20 127.63 2w4d s ILE 89 Ca 0.21 0.04 0.02 0.00 0.00 0.00 0.00 60.65 60.92 2w4d s ILE 89 Cb -0.06 -3.68 0.02 0.00 0.01 0.00 0.00 42.46 38.76 2w4d s ILE 89 CO 0.10 0.07 0.21 1.33 0.00 0.00 0.00 174.94 176.64 2w4d n VAL 90 N 5.12 0.00 0.87 2.92 0.24 -0.59 -4.96 118.33 121.94 2w4d n VAL 90 Ca -0.12 -1.92 0.10 0.00 -2.04 0.00 0.00 64.34 60.37 2w4d n VAL 90 Cb 0.50 0.10 0.09 0.00 -1.47 0.00 0.00 33.84 33.07 2w4d n VAL 90 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69