#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 4.15 0.24 0.00 -1.09 -1.26 -1.58 121.20 121.65 2w4d s ILE 3 Ca 0.00 1.51 0.06 0.00 -2.23 0.00 0.00 60.65 59.99 2w4d s ILE 3 Cb 0.00 -3.97 -0.05 0.00 -1.58 0.00 0.00 42.46 36.86 2w4d s ILE 3 CO 0.00 0.04 -0.08 0.68 -1.23 0.00 0.00 174.94 174.35 2w4d s VAL 4 N 1.79 1.54 -0.07 2.92 -7.23 0.71 -4.84 120.40 115.21 2w4d s VAL 4 Ca 0.57 -2.13 0.01 0.00 -1.81 0.00 0.00 61.98 58.62 2w4d s VAL 4 Cb -0.27 -2.25 0.02 0.00 0.56 0.00 0.00 36.38 34.44 2w4d s VAL 4 CO 0.25 -0.44 -0.08 -0.60 -0.31 0.00 0.00 175.10 173.93 2w4d s ARG 5 N -3.72 1.30 -0.07 4.82 3.52 -1.24 -1.71 118.95 121.85 2w4d s ARG 5 Ca 0.26 -0.23 0.05 0.00 -0.13 0.00 0.00 55.73 55.68 2w4d s ARG 5 Cb 0.02 -1.26 -0.00 0.00 -1.56 0.00 0.00 34.95 32.15 2w4d s ARG 5 CO 0.09 -0.12 -0.22 0.00 -0.81 0.00 0.00 175.30 174.24 2w4d s ALA 6 N 1.16 1.95 -0.29 6.12 0.00 0.89 -1.50 121.76 130.09 2w4d s ALA 6 Ca -0.06 -0.89 -0.08 0.00 0.00 0.00 0.00 51.96 50.93 2w4d s ALA 6 Cb -0.14 -0.67 -0.00 0.00 0.00 0.00 0.00 23.12 22.31 2w4d s ALA 6 CO -0.02 0.32 0.09 -1.58 0.00 0.00 0.00 175.76 174.58 2w4d s HIS 7 N 0.11 3.14 0.15 0.00 2.46 0.26 -0.74 115.29 120.67 2w4d s HIS 7 Ca -0.09 -0.75 0.06 0.00 0.47 0.00 0.00 55.06 54.74 2w4d s HIS 7 Cb -0.15 -2.27 -0.04 0.00 -0.13 0.00 0.00 32.58 29.99 2w4d s HIS 7 CO 0.05 -0.50 0.07 -0.51 -2.47 0.00 0.00 174.74 171.38 2w4d s LEU 8 N 1.55 3.60 -0.17 8.88 1.43 0.12 -1.35 118.68 132.73 2w4d s LEU 8 Ca 0.04 -0.22 -0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2w4d s LEU 8 Cb -0.17 -2.24 0.06 0.00 0.03 0.00 0.00 46.19 43.87 2w4d s LEU 8 CO 0.03 0.09 0.07 -0.54 0.23 0.00 0.00 176.35 176.24 2w4d s LYS 9 N -2.91 0.29 -0.16 1.70 -0.14 -0.45 -1.94 119.74 116.12 2w4d s LYS 9 Ca 0.29 -0.19 -0.04 0.00 -1.36 0.00 0.00 55.97 54.66 2w4d s LYS 9 Cb -0.10 -1.89 -0.03 0.00 -1.68 0.00 0.00 37.83 34.13 2w4d s LYS 9 CO 0.21 -0.64 -0.02 0.42 -0.76 0.00 0.00 175.35 174.56 2w4d s ILE 10 N 2.03 4.05 0.29 2.17 1.01 0.42 -0.94 121.20 130.23 2w4d s ILE 10 Ca 0.01 -0.30 0.12 0.00 0.00 0.00 0.00 60.65 60.48 2w4d s ILE 10 Cb -0.16 -2.79 -0.05 0.00 0.01 0.00 0.00 42.46 39.47 2w4d s ILE 10 CO -0.08 0.49 -0.18 -0.31 0.00 0.00 0.00 174.94 174.85 2w4d s TYR 11 N 0.39 2.32 -0.54 3.97 1.51 -0.14 -1.12 117.35 123.74 2w4d s TYR 11 Ca -0.03 -0.35 0.00 0.00 -1.01 0.00 0.00 57.07 55.69 2w4d s TYR 11 Cb -0.14 -1.05 0.00 0.00 -0.11 0.00 0.00 41.96 40.66 2w4d s TYR 11 CO 0.02 0.70 0.00 0.41 -1.11 0.00 0.00 175.55 175.57 2w4d n GLY 12 N -0.66 0.24 3.39 0.71 0.00 -1.26 -1.03 105.19 106.58 2w4d n GLY 12 Ca -0.05 -1.78 -0.45 0.00 0.00 0.00 0.00 46.02 43.74 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 -0.57 3.88 0.00 1.61 3.52 0.21 -4.73 118.95 122.87 2w4d s ARG 13 Ca 0.00 -2.56 0.00 0.00 -0.13 0.00 0.00 55.73 53.04 2w4d s ARG 13 Cb 0.00 -4.70 0.00 0.00 -1.56 0.00 0.00 34.95 28.69 2w4d s ARG 13 CO 0.00 -1.47 0.33 1.33 -0.81 0.00 0.00 175.30 174.68 2w4d n VAL 14 N 4.05 0.00 -4.22 7.11 0.24 -1.26 -0.79 118.33 123.46 2w4d n VAL 14 Ca 0.24 -0.45 -0.30 0.00 -2.04 0.00 0.00 64.34 61.79 2w4d n VAL 14 Cb 0.44 1.08 -0.10 0.00 -1.47 0.00 0.00 33.84 33.79 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 -0.23 2.14 -0.72 7.34 -0.21 -1.26 -4.51 119.66 122.19 2w4d s GLN 15 Ca 0.00 -1.02 0.00 0.00 0.02 0.00 0.00 55.36 54.36 2w4d s GLN 15 Cb 0.00 -2.31 0.00 0.00 1.00 0.00 0.00 33.01 31.70 2w4d s GLN 15 CO 0.00 0.51 0.00 0.41 -2.12 0.00 0.00 175.29 174.09 2w4d n GLY 16 N 0.69 0.66 0.11 3.09 0.00 -1.26 -4.88 105.19 103.59 2w4d n GLY 16 Ca -0.13 -0.67 0.02 0.00 0.00 0.00 0.00 46.02 45.23 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 -3.19 0.71 -2.07 1.61 0.24 -1.26 -4.99 118.33 109.39 2w4d n VAL 17 Ca -0.08 -0.80 -0.06 0.00 -2.04 0.00 0.00 64.34 61.37 2w4d n VAL 17 Cb 0.35 0.48 -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 -0.46 0.17 0.08 7.63 0.00 -1.26 -4.72 105.19 106.62 2w4d n GLY 18 Ca 0.03 -0.66 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 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 0.13 -0.35 1.61 3.04 -1.94 -2.02 116.94 117.40 2w4d h PHE 19 Ca -0.13 -0.02 0.03 0.00 3.98 0.00 0.00 57.97 61.82 2w4d h PHE 19 Cb 1.07 -0.03 -0.03 0.00 2.56 0.00 0.00 35.95 39.51 2w4d h PHE 19 CO 0.15 0.39 0.16 0.00 -2.02 0.00 0.00 178.31 176.99 2w4d h ARG 20 N -0.18 0.32 -0.50 1.11 3.08 -1.93 0.63 114.38 116.91 2w4d h ARG 20 Ca 0.02 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2w4d h ARG 20 Cb 0.34 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 2w4d h ARG 20 CO 0.00 0.21 0.20 2.35 -1.07 0.00 0.00 179.97 181.66 2w4d h TRP 21 N 0.33 0.76 -0.56 3.04 7.01 -1.98 -2.17 115.95 122.39 2w4d h TRP 21 Ca 0.15 -0.06 -0.08 0.00 2.11 0.00 0.00 58.89 61.01 2w4d h TRP 21 Cb 0.08 -0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 26.89 2w4d h TRP 21 CO -0.11 0.64 0.04 0.77 -2.79 0.00 0.00 178.44 176.99 2w4d h SER 22 N 0.67 0.90 -0.19 2.65 0.02 -1.01 -1.37 113.55 115.22 2w4d h SER 22 Ca 0.17 -0.22 -0.13 0.00 -0.84 0.00 0.00 61.79 60.77 2w4d h SER 22 Cb 0.20 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 2w4d h SER 22 CO -0.01 0.94 -0.34 -0.03 -1.14 0.00 0.00 176.83 176.24 2w4d h MET 23 N 0.87 0.71 -0.19 3.45 1.85 -0.75 -0.64 114.93 120.23 2w4d h MET 23 Ca 0.17 -0.33 -0.01 0.00 -0.61 0.00 0.00 59.70 58.92 2w4d h MET 23 Cb 0.46 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.47 2w4d h MET 23 CO 0.02 0.94 0.09 0.37 -0.40 0.00 0.00 176.91 177.93 2w4d h GLN 24 N 0.59 0.28 0.01 0.39 -0.00 -1.15 0.26 115.11 115.50 2w4d h GLN 24 Ca 0.06 -0.04 -0.00 0.00 -0.00 0.00 0.00 58.65 58.67 2w4d h GLN 24 Cb 0.86 -0.05 -0.00 0.00 0.00 0.00 0.00 27.48 28.29 2w4d h GLN 24 CO 0.07 0.32 -0.01 -0.09 0.00 0.00 0.00 178.83 179.12 2w4d h ARG 25 N 0.17 -0.02 -0.70 1.69 2.43 -1.08 -1.15 114.38 115.72 2w4d h ARG 25 Ca 0.07 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2w4d h ARG 25 Cb 0.13 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 2w4d h ARG 25 CO -0.01 -0.01 0.38 1.49 -1.51 0.00 0.00 179.97 180.31 2w4d h GLU 26 N -0.02 0.97 -0.28 0.20 4.57 -0.97 -2.17 114.58 116.87 2w4d h GLU 26 Ca -0.00 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 2w4d h GLU 26 Cb 0.02 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 2w4d h GLU 26 CO 0.00 0.72 0.10 0.00 -1.18 0.00 0.00 179.01 178.65 2w4d h ALA 27 N 1.44 0.37 -0.57 2.92 0.00 -0.05 -1.61 119.26 121.76 2w4d h ALA 27 Ca 0.25 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2w4d h ALA 27 Cb 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2w4d h ALA 27 CO -0.04 -0.02 0.37 -0.09 0.00 0.00 0.00 179.25 179.48 2w4d h ARG 28 N 0.30 0.74 -0.86 0.00 9.65 -0.97 0.56 114.38 123.81 2w4d h ARG 28 Ca 0.09 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.90 2w4d h ARG 28 Cb 0.21 -0.17 -0.04 0.00 -1.39 0.00 0.00 29.97 28.58 2w4d h ARG 28 CO -0.01 0.49 0.44 0.87 2.80 0.00 0.00 179.97 184.56 2w4d h LYS 29 N 0.76 1.21 0.00 0.20 1.57 -1.20 -2.33 116.57 116.79 2w4d h LYS 29 Ca 0.21 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2w4d h LYS 29 Cb -0.08 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.00 2w4d h LYS 29 CO -0.05 0.91 -0.36 1.28 -0.57 0.00 0.00 179.45 180.66 2w4d n LEU 30 N -4.32 0.74 -0.22 2.94 4.77 -0.62 -4.95 117.00 115.34 2w4d n LEU 30 Ca 0.09 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 2w4d n LEU 30 Cb 0.12 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2w4d n LEU 30 CO 0.39 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 2w4d n GLY 31 N 1.33 0.72 3.89 -0.72 0.00 0.17 -4.88 105.19 105.70 2w4d n GLY 31 Ca 0.04 -0.73 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.45 5.45 0.27 1.61 1.01 0.48 -4.82 120.40 121.95 2w4d s VAL 32 Ca 0.00 0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.12 2w4d s VAL 32 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 2w4d s VAL 32 CO 0.00 0.48 0.25 0.20 0.00 0.00 0.00 175.10 176.03 2w4d s ASN 33 N -1.44 5.63 0.00 3.32 0.01 0.03 -4.26 114.94 118.23 2w4d s ASN 33 Ca 0.21 -0.23 0.00 0.00 -0.71 0.00 0.00 52.86 52.13 2w4d s ASN 33 Cb -0.12 -1.40 0.00 0.00 0.41 0.00 0.00 41.25 40.13 2w4d s ASN 33 CO 0.11 -0.11 0.00 0.61 -1.51 0.00 0.00 177.10 176.20 2w4d n GLY 34 N -1.26 0.64 3.46 0.66 0.00 -0.41 -0.35 105.19 107.93 2w4d n GLY 34 Ca -0.07 -1.79 -0.09 0.00 0.00 0.00 0.00 46.02 44.07 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 -2.67 0.23 0.01 1.61 1.48 -0.83 -0.99 118.94 117.78 2w4d s TRP 35 Ca 0.00 -0.59 -0.05 0.00 -1.06 0.00 0.00 56.10 54.40 2w4d s TRP 35 Cb 0.00 0.14 -0.01 0.00 -1.16 0.00 0.00 33.47 32.45 2w4d s TRP 35 CO 0.00 -0.85 0.09 0.54 -4.06 0.00 0.00 176.95 172.67 2w4d s VAL 36 N -3.95 0.10 -0.04 -0.66 0.11 -0.72 -0.84 120.40 114.39 2w4d s VAL 36 Ca 0.16 -0.80 -0.29 0.00 -2.93 0.00 0.00 61.98 58.12 2w4d s VAL 36 Cb 0.01 -0.45 0.11 0.00 -1.53 0.00 0.00 36.38 34.52 2w4d s VAL 36 CO 0.01 -0.44 0.90 0.00 -3.33 0.00 0.00 175.10 172.25 2w4d s ARG 37 N -1.56 0.78 0.16 1.54 1.70 0.10 -1.50 118.95 120.17 2w4d s ARG 37 Ca -0.14 -0.16 -0.20 0.00 -0.47 0.00 0.00 55.73 54.76 2w4d s ARG 37 Cb -0.07 0.36 -0.08 0.00 -0.57 0.00 0.00 34.95 34.59 2w4d s ARG 37 CO 0.00 -0.32 0.67 -0.80 -1.08 0.00 0.00 175.30 173.77 2w4d s ASN 38 N -2.07 7.11 0.15 -2.89 0.02 -1.26 -0.53 114.94 115.46 2w4d s ASN 38 Ca 0.02 1.38 0.07 0.00 -1.02 0.00 0.00 52.86 53.31 2w4d s ASN 38 Cb -0.01 -2.40 -0.04 0.00 0.02 0.00 0.00 41.25 38.82 2w4d s ASN 38 CO -0.05 0.15 0.00 -0.76 0.02 0.00 0.00 177.10 176.46 2w4d s LEU 39 N -1.53 3.36 0.61 0.60 1.43 -0.46 -4.92 118.68 117.76 2w4d s LEU 39 Ca 0.36 -0.34 0.39 0.00 -1.03 0.00 0.00 54.13 53.52 2w4d s LEU 39 Cb -0.19 -2.03 2.11 0.00 0.03 0.00 0.00 46.19 46.11 2w4d s LEU 39 CO 0.21 0.11 2.19 1.55 0.23 0.00 0.00 176.35 180.64 2w4d h PRO 40 N 2.88 0.00 -0.19 1.29 0.13 -1.98 -0.81 132.00 133.32 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 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 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 -2.90 1.13 0.00 1.44 3.85 -1.26 -4.89 116.55 113.91 2w4d n ASP 41 Ca -0.03 -1.91 0.00 0.00 -0.71 0.00 0.00 54.79 52.14 2w4d n ASP 41 Cb 0.10 -0.13 0.00 0.00 -1.35 0.00 0.00 41.12 39.75 2w4d n ASP 41 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2w4d n GLY 42 N 0.88 1.14 4.01 6.12 0.00 -0.31 -5.05 105.19 111.98 2w4d n GLY 42 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.08 4.67 -0.04 1.61 1.04 -1.25 -4.53 113.70 112.12 2w4d s SER 43 Ca 0.00 -0.57 0.06 0.00 0.48 0.00 0.00 55.95 55.92 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 -1.64 -0.23 -0.69 0.98 0.00 0.00 173.24 171.66 2w4d s VAL 44 N -2.94 2.27 -0.02 5.02 1.01 -0.27 -1.36 120.40 124.11 2w4d s VAL 44 Ca 0.64 -1.01 0.08 0.00 0.00 0.00 0.00 61.98 61.69 2w4d s VAL 44 Cb -0.05 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 2w4d s VAL 44 CO 0.42 0.58 -0.25 -0.70 0.00 0.00 0.00 175.10 175.14 2w4d s GLU 45 N -0.47 2.14 0.05 2.72 2.12 0.31 -0.44 118.70 125.13 2w4d s GLU 45 Ca 0.05 -0.92 -0.18 0.00 0.36 0.00 0.00 54.97 54.28 2w4d s GLU 45 Cb -0.11 -2.06 0.04 0.00 0.26 0.00 0.00 34.13 32.25 2w4d s GLU 45 CO 0.01 0.56 0.42 0.00 -0.54 0.00 0.00 175.26 175.71 2w4d s ALA 46 N -0.61 -1.04 -0.12 6.30 0.00 -0.82 -0.72 121.76 124.76 2w4d s ALA 46 Ca 0.10 0.33 0.02 0.00 0.00 0.00 0.00 51.96 52.41 2w4d s ALA 46 Cb -0.10 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.39 2w4d s ALA 46 CO -0.01 -0.46 -0.16 0.08 0.00 0.00 0.00 175.76 175.20 2w4d s VAL 47 N -2.49 1.59 -0.09 0.00 1.01 -0.02 0.10 120.40 120.50 2w4d s VAL 47 Ca -0.05 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.28 2w4d s VAL 47 Cb -0.01 -1.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.92 2w4d s VAL 47 CO -0.02 0.46 -0.24 -0.76 0.00 0.00 0.00 175.10 174.54 2w4d s LEU 48 N 0.99 2.10 -0.01 3.92 1.43 0.08 -1.96 118.68 125.22 2w4d s LEU 48 Ca -0.06 -0.55 -0.00 0.00 -1.03 0.00 0.00 54.13 52.49 2w4d s LEU 48 Cb -0.15 -1.41 0.01 0.00 0.03 0.00 0.00 46.19 44.68 2w4d s LEU 48 CO -0.02 0.17 0.02 -0.70 0.23 0.00 0.00 176.35 176.05 2w4d s GLU 49 N 0.27 -0.01 0.00 1.70 2.12 0.52 -0.08 118.70 123.23 2w4d s GLU 49 Ca -0.17 0.09 0.00 0.00 0.36 0.00 0.00 54.97 55.26 2w4d s GLU 49 Cb -0.17 -0.11 0.00 0.00 0.26 0.00 0.00 34.13 34.11 2w4d s GLU 49 CO 0.08 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.14 2w4d n GLY 50 N 3.57 -0.12 3.73 -1.50 0.00 -0.69 -0.79 105.19 109.39 2w4d n GLY 50 Ca -0.19 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 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 6.63 0.33 1.61 -0.00 -1.26 -0.21 116.67 119.78 2w4d s ASP 51 Ca 0.00 2.60 0.11 0.00 -0.00 0.00 0.00 52.55 55.27 2w4d s ASP 51 Cb 0.00 -2.60 0.94 0.00 -0.00 0.00 0.00 42.92 41.25 2w4d s ASP 51 CO 0.00 -0.76 1.73 1.05 -0.00 0.00 0.00 175.17 177.19 2w4d h GLU 52 N 6.19 0.52 -0.59 8.23 4.11 -1.64 0.13 114.58 131.53 2w4d h GLU 52 Ca -0.44 -0.03 -0.00 0.00 0.07 0.00 0.00 59.36 58.96 2w4d h GLU 52 Cb 1.21 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 2w4d h GLU 52 CO 0.86 0.35 0.36 0.93 0.07 0.00 0.00 179.01 181.57 2w4d h GLU 53 N 0.54 0.80 -0.21 1.06 4.39 -1.90 -0.20 114.58 119.07 2w4d h GLU 53 Ca 0.64 -0.07 -0.16 0.00 0.34 0.00 0.00 59.36 60.11 2w4d h GLU 53 Cb 1.30 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 2w4d h GLU 53 CO -0.45 0.58 -0.51 0.00 -1.16 0.00 0.00 179.01 177.47 2w4d h ARG 54 N 0.80 0.71 -0.41 2.33 3.08 -1.16 -2.24 114.38 117.48 2w4d h ARG 54 Ca 0.21 -0.49 -0.04 0.00 0.07 0.00 0.00 59.98 59.74 2w4d h ARG 54 Cb -0.02 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2w4d h ARG 54 CO -0.04 1.11 0.12 0.28 -1.07 0.00 0.00 179.97 180.36 2w4d h VAL 55 N 0.42 1.22 -0.70 2.04 2.07 -1.01 -1.95 116.25 118.34 2w4d h VAL 55 Ca -0.01 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.75 2w4d h VAL 55 Cb 1.12 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 2w4d h VAL 55 CO 0.11 0.26 0.36 -0.33 0.02 0.00 0.00 177.57 178.00 2w4d h GLU 56 N 0.53 0.98 -0.74 1.57 5.08 -1.05 0.18 114.58 121.12 2w4d h GLU 56 Ca 0.13 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2w4d h GLU 56 Cb 0.28 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2w4d h GLU 56 CO -0.00 0.74 0.29 0.00 -1.00 0.00 0.00 179.01 179.04 2w4d h ALA 57 N 1.41 0.97 -0.09 3.43 0.00 -1.08 -0.54 119.26 123.36 2w4d h ALA 57 Ca 0.25 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 2w4d h ALA 57 Cb 0.06 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2w4d h ALA 57 CO -0.04 0.60 -0.60 1.25 0.00 0.00 0.00 179.25 180.46 2w4d h LEU 58 N 1.08 0.36 -0.30 0.00 5.85 -0.61 -1.83 115.31 119.87 2w4d h LEU 58 Ca 0.25 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2w4d h LEU 58 Cb 0.23 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2w4d h LEU 58 CO -0.02 0.88 0.10 0.40 -0.34 0.00 0.00 178.44 179.47 2w4d h ILE 59 N 0.24 1.19 -0.40 4.05 2.04 -0.58 -0.37 117.51 123.68 2w4d h ILE 59 Ca -0.01 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.28 2w4d h ILE 59 Cb 1.12 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 2w4d h ILE 59 CO 0.10 0.20 0.21 1.23 0.00 0.00 0.00 178.15 179.89 2w4d h GLY 60 N 0.33 0.54 0.77 5.37 0.00 -1.00 -2.01 103.07 107.07 2w4d h GLY 60 Ca 0.10 -0.15 0.05 0.00 0.00 0.00 0.00 47.33 47.33 2w4d h GLY 60 CO -0.01 0.11 0.55 -0.25 0.00 0.00 0.00 176.54 176.94 2w4d h TRP 61 N 0.42 1.01 0.00 5.60 7.01 -1.03 -1.71 115.95 127.25 2w4d h TRP 61 Ca 0.17 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.19 2w4d h TRP 61 Cb 0.06 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 26.79 2w4d h TRP 61 CO -0.09 0.53 0.11 0.00 -2.79 0.00 0.00 178.44 176.20 2w4d h ALA 62 N 1.39 1.09 0.00 2.65 0.00 -0.29 0.45 119.26 124.55 2w4d h ALA 62 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2w4d h ALA 62 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2w4d h ALA 62 CO -0.16 -0.09 -0.23 0.72 0.00 0.00 0.00 179.25 179.49 2w4d n HIS 63 N -2.63 0.51 -0.07 0.00 8.25 -0.64 -4.11 115.22 116.52 2w4d n HIS 63 Ca -0.02 0.15 -0.09 0.00 -0.26 0.00 0.00 57.72 57.50 2w4d n HIS 63 Cb 0.15 -0.68 -0.03 0.00 1.12 0.00 0.00 29.99 30.56 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 -1.96 0.43 -0.57 -0.41 -0.06 0.12 -4.48 117.38 110.45 2w4d n GLN 64 Ca 0.05 0.17 0.08 0.00 -2.00 0.00 0.00 57.00 55.30 2w4d n GLN 64 Cb 0.40 -1.25 -0.02 0.00 -4.06 0.00 0.00 30.24 25.31 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 1.83 -1.95 3.70 1.69 0.00 0.90 -4.68 105.19 106.68 2w4d n GLY 65 Ca -0.14 -1.31 -0.32 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.25 1.47 0.18 1.61 0.04 -1.26 -4.83 135.00 130.95 2w4d s PRO 66 Ca 0.00 1.58 -0.09 0.00 0.04 0.00 0.00 61.00 62.53 2w4d s PRO 66 Cb 0.00 -1.77 0.25 0.00 0.04 0.00 0.00 34.50 33.01 2w4d s PRO 66 CO 0.00 -2.31 1.08 -2.30 0.04 0.00 0.00 177.00 173.51 2w4d n PRO 67 N -3.72 -0.11 0.00 0.56 -0.02 -1.26 -0.71 135.00 129.73 2w4d n PRO 67 Ca 0.12 1.08 0.15 0.00 -2.02 0.00 0.00 63.50 62.82 2w4d n PRO 67 Cb 0.52 -1.60 0.70 0.00 -0.02 0.00 0.00 33.50 33.09 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 -5.08 0.16 -4.77 2.45 4.77 -1.26 -4.88 117.00 108.38 2w4d n LEU 68 Ca 0.09 0.20 -0.38 0.00 -0.03 0.00 0.00 56.01 55.90 2w4d n LEU 68 Cb 0.31 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 41.10 2w4d n LEU 68 CO -0.09 0.03 0.74 0.00 -1.33 0.00 0.00 177.39 176.74 2w4d s ALA 69 N -2.57 3.19 -0.36 -1.18 0.00 0.11 -4.96 121.76 115.99 2w4d s ALA 69 Ca 0.28 0.73 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2w4d s ALA 69 Cb 0.20 -3.27 0.12 0.00 0.00 0.00 0.00 23.12 20.17 2w4d s ALA 69 CO 0.48 -0.14 0.17 0.50 0.00 0.00 0.00 175.76 176.77 2w4d s ARG 70 N -2.12 0.82 -0.17 0.00 3.52 0.03 -4.90 118.95 116.13 2w4d s ARG 70 Ca 0.53 -1.39 -0.27 0.00 -0.13 0.00 0.00 55.73 54.46 2w4d s ARG 70 Cb -0.24 -1.87 -0.01 0.00 -1.56 0.00 0.00 34.95 31.27 2w4d s ARG 70 CO 0.31 -1.10 0.93 0.08 -0.81 0.00 0.00 175.30 174.71 2w4d s VAL 71 N 1.11 4.81 -0.18 7.11 1.01 -1.26 -0.62 120.40 132.37 2w4d s VAL 71 Ca 0.14 1.84 0.18 0.00 0.00 0.00 0.00 61.98 64.14 2w4d s VAL 71 Cb -0.21 -4.23 -0.26 0.00 0.00 0.00 0.00 36.38 31.68 2w4d s VAL 71 CO -0.12 -0.03 0.47 0.35 0.00 0.00 0.00 175.10 175.77 2w4d n THR 72 N 4.83 0.00 -3.59 3.92 -2.24 -0.20 -4.98 114.28 112.02 2w4d n THR 72 Ca 0.07 -0.35 -0.11 0.00 -2.27 0.00 0.00 64.05 61.40 2w4d n THR 72 Cb 0.48 0.27 -0.06 0.00 -2.10 0.00 0.00 70.33 68.92 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 -3.13 0.63 -0.04 -0.78 3.52 -1.21 -5.02 118.95 112.91 2w4d s ARG 73 Ca -0.04 0.34 0.01 0.00 -0.13 0.00 0.00 55.73 55.92 2w4d s ARG 73 Cb 0.12 0.30 0.02 0.00 -1.56 0.00 0.00 34.95 33.83 2w4d s ARG 73 CO 0.74 -0.16 -0.05 0.08 -0.81 0.00 0.00 175.30 175.11 2w4d s VAL 74 N -0.61 0.53 -0.21 7.11 1.01 -1.26 -0.97 120.40 126.00 2w4d s VAL 74 Ca -0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 2w4d s VAL 74 Cb -0.02 -0.56 -0.02 0.00 0.00 0.00 0.00 36.38 35.78 2w4d s VAL 74 CO -0.00 0.22 -0.01 -1.61 0.00 0.00 0.00 175.10 173.70 2w4d s GLU 75 N 0.88 3.52 0.07 2.72 2.02 -0.12 -4.96 118.70 122.83 2w4d s GLU 75 Ca -0.12 -0.56 0.07 0.00 0.02 0.00 0.00 54.97 54.38 2w4d s GLU 75 Cb -0.14 -3.08 -0.04 0.00 0.10 0.00 0.00 34.13 30.97 2w4d s GLU 75 CO 0.00 -0.10 -0.13 0.54 0.02 0.00 0.00 175.26 175.60 2w4d s VAL 76 N 1.27 3.20 -0.05 2.63 0.11 -1.26 -1.34 120.40 124.96 2w4d s VAL 76 Ca 0.04 -1.19 -0.02 0.00 -2.93 0.00 0.00 61.98 57.87 2w4d s VAL 76 Cb -0.15 -2.44 0.03 0.00 -1.53 0.00 0.00 36.38 32.30 2w4d s VAL 76 CO 0.00 0.22 0.09 -0.75 -3.33 0.00 0.00 175.10 171.33 2w4d s LYS 77 N -1.86 -0.05 0.00 1.54 2.20 -0.46 -4.96 119.74 116.16 2w4d s LYS 77 Ca 0.18 0.42 -0.21 0.00 -0.36 0.00 0.00 55.97 56.01 2w4d s LYS 77 Cb -0.11 -0.44 -0.05 0.00 -1.51 0.00 0.00 37.83 35.72 2w4d s LYS 77 CO 0.10 -0.32 0.62 -1.58 -0.36 0.00 0.00 175.35 173.81 2w4d s TRP 78 N 2.17 3.69 0.35 4.03 0.52 -1.26 -0.57 118.94 127.86 2w4d s TRP 78 Ca 0.04 1.24 0.04 0.00 0.02 0.00 0.00 56.10 57.44 2w4d s TRP 78 Cb -0.12 -2.64 -0.03 0.00 -1.15 0.00 0.00 33.47 29.53 2w4d s TRP 78 CO -0.04 0.34 0.18 -1.21 0.02 0.00 0.00 176.95 176.24 2w4d s GLU 79 N -0.15 1.76 0.01 4.98 2.02 -0.56 -4.99 118.70 121.76 2w4d s GLU 79 Ca 0.32 -2.03 -0.29 0.00 0.02 0.00 0.00 54.97 52.99 2w4d s GLU 79 Cb -0.18 -0.17 -0.03 0.00 0.10 0.00 0.00 34.13 33.84 2w4d s GLU 79 CO 0.18 -0.51 0.94 -0.65 0.02 0.00 0.00 175.26 175.24 2w4d s GLN 80 N -3.68 4.56 0.44 1.61 -1.52 -1.26 -3.68 119.66 116.12 2w4d s GLN 80 Ca 0.33 1.35 -0.23 0.00 -1.95 0.00 0.00 55.36 54.85 2w4d s GLN 80 Cb 0.03 -3.45 -0.10 0.00 -0.22 0.00 0.00 33.01 29.27 2w4d s GLN 80 CO 0.19 0.00 0.88 -2.30 -0.25 0.00 0.00 175.29 173.82 2w4d n PRO 81 N 3.73 1.10 0.00 2.91 -0.02 -1.26 -4.91 135.00 136.54 2w4d n PRO 81 Ca 0.05 0.40 0.02 0.00 -2.02 0.00 0.00 63.50 61.95 2w4d n PRO 81 Cb 0.51 -1.91 0.01 0.00 -0.02 0.00 0.00 33.50 32.08 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 0.15 1.24 -0.46 -0.52 5.02 -1.26 -5.00 118.16 117.32 2w4d n LYS 82 Ca 0.10 -0.59 0.00 0.00 -2.02 0.00 0.00 58.31 55.81 2w4d n LYS 82 Cb 0.40 -0.99 0.00 0.00 -0.02 0.00 0.00 35.03 34.42 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 0.50 1.23 3.64 0.72 0.00 -1.26 -5.05 105.19 104.97 2w4d n GLY 83 Ca 0.02 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.53 1.57 -3.73 1.61 -0.58 -1.26 -5.00 120.64 111.72 2w4d n GLU 84 Ca 0.00 0.56 -0.22 0.00 -0.42 0.00 0.00 57.16 57.08 2w4d n GLU 84 Cb 0.09 -2.16 -0.18 0.00 -0.57 0.00 0.00 31.44 28.62 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 -2.06 0.38 0.00 3.49 2.20 -1.26 -4.79 119.74 117.70 2w4d s LYS 85 Ca 0.62 0.16 0.00 0.00 -0.36 0.00 0.00 55.97 56.39 2w4d s LYS 85 Cb -0.55 -0.91 0.00 0.00 -1.51 0.00 0.00 37.83 34.86 2w4d s LYS 85 CO 0.57 -0.34 0.00 0.41 -0.36 0.00 0.00 175.35 175.63 2w4d n GLY 86 N 5.20 -2.17 3.29 5.54 0.00 -1.26 -4.80 105.19 110.99 2w4d n GLY 86 Ca -0.06 -1.49 -0.34 0.00 0.00 0.00 0.00 46.02 44.13 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 -3.04 2.88 0.22 1.61 5.36 -1.26 -1.29 117.98 122.47 2w4d s PHE 87 Ca 0.00 -0.99 0.10 0.00 -0.96 0.00 0.00 56.93 55.07 2w4d s PHE 87 Cb 0.00 -2.00 -0.05 0.00 -0.34 0.00 0.00 43.02 40.64 2w4d s PHE 87 CO 0.00 -0.51 -0.19 1.03 -1.46 0.00 0.00 175.22 174.10 2w4d s ARG 88 N 1.13 1.45 -0.29 10.12 3.00 -0.16 -4.95 118.95 129.26 2w4d s ARG 88 Ca 0.01 -1.59 -0.13 0.00 0.00 0.00 0.00 55.73 54.02 2w4d s ARG 88 Cb -0.14 -1.49 -0.04 0.00 0.00 0.00 0.00 34.95 33.28 2w4d s ARG 88 CO -0.03 0.29 0.30 0.42 0.00 0.00 0.00 175.30 176.28 2w4d s ILE 89 N -2.37 5.23 0.41 1.52 1.01 -1.26 -1.76 121.20 123.97 2w4d s ILE 89 Ca 0.23 0.28 0.01 0.00 0.00 0.00 0.00 60.65 61.17 2w4d s ILE 89 Cb -0.05 -3.66 0.01 0.00 0.01 0.00 0.00 42.46 38.78 2w4d s ILE 89 CO 0.10 0.14 0.11 1.33 0.00 0.00 0.00 174.94 176.62 2w4d n VAL 90 N 5.12 0.00 0.95 2.92 0.24 -0.56 -4.96 118.33 122.04 2w4d n VAL 90 Ca -0.11 -1.82 0.11 0.00 -2.04 0.00 0.00 64.34 60.49 2w4d n VAL 90 Cb 0.51 0.20 0.09 0.00 -1.47 0.00 0.00 33.84 33.17 2w4d n VAL 90 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69