#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 4.84 0.25 0.00 1.01 -1.26 -1.63 121.20 124.41 2w4d s ILE 3 Ca 0.00 2.04 0.07 0.00 0.00 0.00 0.00 60.65 62.76 2w4d s ILE 3 Cb 0.00 -4.31 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 2w4d s ILE 3 CO 0.00 0.10 -0.09 0.68 0.00 0.00 0.00 174.94 175.62 2w4d s VAL 4 N 1.43 1.68 -0.07 2.92 -7.23 0.47 -4.83 120.40 114.77 2w4d s VAL 4 Ca 0.50 -2.16 0.01 0.00 -1.81 0.00 0.00 61.98 58.52 2w4d s VAL 4 Cb -0.20 -2.28 0.02 0.00 0.56 0.00 0.00 36.38 34.48 2w4d s VAL 4 CO 0.24 -0.42 -0.07 -0.60 -0.31 0.00 0.00 175.10 173.93 2w4d s ARG 5 N -3.69 1.27 -0.09 4.82 3.52 -1.24 -1.78 118.95 121.76 2w4d s ARG 5 Ca 0.27 -0.23 0.04 0.00 -0.13 0.00 0.00 55.73 55.68 2w4d s ARG 5 Cb 0.02 -1.21 0.00 0.00 -1.56 0.00 0.00 34.95 32.20 2w4d s ARG 5 CO 0.10 -0.10 -0.20 0.00 -0.81 0.00 0.00 175.30 174.28 2w4d s ALA 6 N 1.09 1.88 -0.31 6.12 0.00 0.79 -1.38 121.76 129.95 2w4d s ALA 6 Ca -0.08 -0.80 -0.10 0.00 0.00 0.00 0.00 51.96 50.99 2w4d s ALA 6 Cb -0.14 -0.72 -0.01 0.00 0.00 0.00 0.00 23.12 22.25 2w4d s ALA 6 CO -0.01 0.24 0.15 -1.58 0.00 0.00 0.00 175.76 174.56 2w4d s HIS 7 N 0.40 3.18 0.14 0.00 2.46 0.43 -0.74 115.29 121.16 2w4d s HIS 7 Ca -0.17 -0.59 0.05 0.00 0.47 0.00 0.00 55.06 54.83 2w4d s HIS 7 Cb -0.17 -2.35 -0.04 0.00 -0.13 0.00 0.00 32.58 29.89 2w4d s HIS 7 CO 0.07 -0.46 0.08 -0.51 -2.47 0.00 0.00 174.74 171.45 2w4d s LEU 8 N 1.61 3.66 -0.16 8.88 1.02 0.99 -1.29 118.68 133.40 2w4d s LEU 8 Ca 0.04 -0.17 -0.03 0.00 0.02 0.00 0.00 54.13 54.00 2w4d s LEU 8 Cb -0.17 -2.31 0.05 0.00 0.02 0.00 0.00 46.19 43.78 2w4d s LEU 8 CO 0.06 0.11 0.05 -0.54 0.02 0.00 0.00 176.35 176.04 2w4d s LYS 9 N -2.83 0.42 -0.15 1.70 1.02 -0.44 -1.92 119.74 117.53 2w4d s LYS 9 Ca 0.29 -0.19 -0.04 0.00 0.02 0.00 0.00 55.97 56.06 2w4d s LYS 9 Cb -0.11 -1.75 -0.03 0.00 -0.52 0.00 0.00 37.83 35.43 2w4d s LYS 9 CO 0.21 -0.58 -0.03 0.42 -0.92 0.00 0.00 175.35 174.46 2w4d s ILE 10 N 1.98 3.98 0.30 2.17 1.01 0.51 -1.08 121.20 130.07 2w4d s ILE 10 Ca 0.01 -0.33 0.11 0.00 0.00 0.00 0.00 60.65 60.44 2w4d s ILE 10 Cb -0.16 -2.74 -0.05 0.00 0.01 0.00 0.00 42.46 39.52 2w4d s ILE 10 CO -0.08 0.50 -0.17 -0.31 0.00 0.00 0.00 174.94 174.88 2w4d s TYR 11 N 0.30 2.33 -0.54 3.97 1.51 -0.20 -1.15 117.35 123.57 2w4d s TYR 11 Ca -0.03 -0.38 0.00 0.00 -1.01 0.00 0.00 57.07 55.65 2w4d s TYR 11 Cb -0.14 -1.11 0.00 0.00 -0.11 0.00 0.00 41.96 40.61 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 -0.67 0.25 3.40 0.71 0.00 -1.26 -1.16 105.19 106.46 2w4d n GLY 12 Ca -0.05 -1.89 -0.45 0.00 0.00 0.00 0.00 46.02 43.63 2w4d n GLY 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w4d s ARG 13 N -0.35 3.84 0.00 1.61 0.52 0.38 -4.73 118.95 120.22 2w4d s ARG 13 Ca 0.00 -2.42 0.00 0.00 -0.52 0.00 0.00 55.73 52.79 2w4d s ARG 13 Cb 0.00 -4.77 0.00 0.00 0.52 0.00 0.00 34.95 30.70 2w4d s ARG 13 CO 0.00 -1.56 0.40 1.33 0.02 0.00 0.00 175.30 175.49 2w4d n VAL 14 N 4.38 0.00 -4.27 3.52 0.24 -1.26 -0.88 118.33 120.05 2w4d n VAL 14 Ca 0.25 -0.47 -0.29 0.00 -2.04 0.00 0.00 64.34 61.79 2w4d n VAL 14 Cb 0.45 1.05 -0.10 0.00 -1.47 0.00 0.00 33.84 33.77 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 -0.15 1.98 -0.77 7.34 -0.21 -1.26 -4.53 119.66 122.06 2w4d s GLN 15 Ca 0.00 -1.14 0.00 0.00 0.02 0.00 0.00 55.36 54.24 2w4d s GLN 15 Cb 0.00 -2.20 0.00 0.00 1.00 0.00 0.00 33.01 31.81 2w4d s GLN 15 CO 0.00 0.48 0.00 0.41 -2.12 0.00 0.00 175.29 174.06 2w4d n GLY 16 N 0.60 0.65 0.14 3.09 0.00 -1.26 -4.88 105.19 103.54 2w4d n GLY 16 Ca -0.14 -0.65 0.02 0.00 0.00 0.00 0.00 46.02 45.26 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 -3.21 0.70 -2.10 1.61 0.24 -1.26 -4.99 118.33 109.32 2w4d n VAL 17 Ca -0.08 -0.79 -0.06 0.00 -2.04 0.00 0.00 64.34 61.36 2w4d n VAL 17 Cb 0.37 0.45 -0.00 0.00 -1.47 0.00 0.00 33.84 33.19 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 0.12 0.09 7.63 0.00 -1.26 -4.72 105.19 106.58 2w4d n GLY 18 Ca 0.04 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 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 0.17 -0.15 1.61 3.04 -1.94 -2.05 116.94 117.62 2w4d h PHE 19 Ca -0.15 -0.03 0.03 0.00 3.98 0.00 0.00 57.97 61.79 2w4d h PHE 19 Cb 1.10 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 39.54 2w4d h PHE 19 CO 0.17 0.42 -0.00 0.00 -2.02 0.00 0.00 178.31 176.88 2w4d h ARG 20 N -0.13 0.04 -0.53 1.11 3.08 -1.93 0.74 114.38 116.76 2w4d h ARG 20 Ca 0.02 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2w4d h ARG 20 Cb 0.36 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 2w4d h ARG 20 CO 0.01 0.03 0.34 2.35 -1.07 0.00 0.00 179.97 181.62 2w4d h TRP 21 N 0.05 0.69 -0.56 3.04 7.01 -1.98 -2.01 115.95 122.18 2w4d h TRP 21 Ca 0.07 0.01 -0.07 0.00 2.11 0.00 0.00 58.89 61.00 2w4d h TRP 21 Cb 0.09 -0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 26.90 2w4d h TRP 21 CO -0.16 0.46 0.05 0.77 -2.79 0.00 0.00 178.44 176.77 2w4d h SER 22 N 0.72 0.88 -0.11 2.65 0.02 -1.00 -1.26 113.55 115.46 2w4d h SER 22 Ca 0.19 -0.21 -0.13 0.00 -0.84 0.00 0.00 61.79 60.80 2w4d h SER 22 Cb -0.04 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.25 2w4d h SER 22 CO -0.04 0.91 -0.36 -0.03 -1.14 0.00 0.00 176.83 176.17 2w4d h MET 23 N 0.87 0.61 -0.25 3.45 1.85 -0.66 -0.63 114.93 120.17 2w4d h MET 23 Ca 0.17 -0.30 -0.02 0.00 -0.61 0.00 0.00 59.70 58.94 2w4d h MET 23 Cb 0.44 -0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.45 2w4d h MET 23 CO 0.02 0.89 0.07 0.37 -0.40 0.00 0.00 176.91 177.85 2w4d h GLN 24 N 0.51 0.40 -0.00 0.39 4.15 -1.11 0.28 115.11 119.72 2w4d h GLN 24 Ca 0.05 -0.09 0.01 0.00 0.77 0.00 0.00 58.65 59.39 2w4d h GLN 24 Cb 0.87 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.48 2w4d h GLN 24 CO 0.07 0.49 -0.07 -0.09 -1.93 0.00 0.00 178.83 177.30 2w4d h ARG 25 N 0.24 -0.12 -0.72 1.69 2.43 -1.04 -1.06 114.38 115.80 2w4d h ARG 25 Ca 0.08 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2w4d h ARG 25 Cb 0.26 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.80 2w4d h ARG 25 CO -0.00 -0.08 0.32 0.93 -1.51 0.00 0.00 179.97 179.63 2w4d h GLU 26 N -0.12 1.03 -0.28 0.20 4.39 -0.99 -2.29 114.58 116.51 2w4d h GLU 26 Ca 0.03 -0.15 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 2w4d h GLU 26 Cb 0.16 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 2w4d h GLU 26 CO -0.08 0.81 0.15 0.00 -1.16 0.00 0.00 179.01 178.73 2w4d h ALA 27 N 1.33 0.36 -0.84 3.43 0.00 0.01 -1.43 119.26 122.13 2w4d h ALA 27 Ca 0.25 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2w4d h ALA 27 Cb 0.13 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2w4d h ALA 27 CO -0.03 -0.09 0.44 0.00 0.00 0.00 0.00 179.25 179.57 2w4d h ARG 28 N 0.33 1.19 -0.73 0.00 3.08 -1.00 0.54 114.38 117.78 2w4d h ARG 28 Ca 0.10 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 2w4d h ARG 28 Cb 0.09 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.88 2w4d h ARG 28 CO -0.01 0.89 0.35 0.87 -1.07 0.00 0.00 179.97 180.99 2w4d h LYS 29 N 1.18 1.06 0.00 0.04 1.57 -1.15 -2.56 116.57 116.71 2w4d h LYS 29 Ca 0.29 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2w4d h LYS 29 Cb 0.07 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.19 2w4d h LYS 29 CO -0.04 0.83 -0.31 -0.07 -0.57 0.00 0.00 179.45 179.29 2w4d h LEU 30 N 1.03 0.00 -0.43 2.94 3.38 -0.88 -3.48 115.31 117.88 2w4d h LEU 30 Ca 0.25 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2w4d h LEU 30 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2w4d h LEU 30 CO -0.03 0.04 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2w4d n GLY 31 N 1.29 0.73 3.87 0.83 0.00 0.16 -4.88 105.19 107.19 2w4d n GLY 31 Ca 0.04 -0.72 -0.37 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 -2.43 5.40 0.27 1.61 1.01 0.49 -4.82 120.40 121.93 2w4d s VAL 32 Ca 0.00 0.30 0.07 0.00 0.00 0.00 0.00 61.98 62.35 2w4d s VAL 32 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 2w4d s VAL 32 CO 0.00 0.57 0.23 0.20 0.00 0.00 0.00 175.10 176.10 2w4d s ASN 33 N -1.17 5.54 0.00 3.32 0.01 0.05 -4.26 114.94 118.43 2w4d s ASN 33 Ca 0.19 -0.27 0.00 0.00 -0.71 0.00 0.00 52.86 52.06 2w4d s ASN 33 Cb -0.13 -1.35 0.00 0.00 0.41 0.00 0.00 41.25 40.18 2w4d s ASN 33 CO 0.08 -0.11 0.00 0.61 -1.51 0.00 0.00 177.10 176.17 2w4d n GLY 34 N -1.24 0.65 3.54 0.66 0.00 -0.47 -0.16 105.19 108.17 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 -2.82 0.20 -0.00 1.61 1.48 -0.80 -1.17 118.94 117.44 2w4d s TRP 35 Ca 0.00 -0.56 -0.09 0.00 -1.06 0.00 0.00 56.10 54.39 2w4d s TRP 35 Cb 0.00 0.24 0.01 0.00 -1.16 0.00 0.00 33.47 32.55 2w4d s TRP 35 CO 0.00 -0.94 0.17 0.54 -4.06 0.00 0.00 176.95 172.66 2w4d s VAL 36 N -3.96 0.08 0.03 -0.66 0.11 -0.82 -0.84 120.40 114.34 2w4d s VAL 36 Ca 0.17 -0.63 -0.27 0.00 -2.93 0.00 0.00 61.98 58.32 2w4d s VAL 36 Cb -0.00 -0.46 0.09 0.00 -1.53 0.00 0.00 36.38 34.47 2w4d s VAL 36 CO 0.04 -0.35 0.77 0.00 -3.33 0.00 0.00 175.10 172.23 2w4d s ARG 37 N -1.33 0.99 0.10 1.54 1.70 0.19 -1.56 118.95 120.58 2w4d s ARG 37 Ca -0.14 -0.22 -0.21 0.00 -0.47 0.00 0.00 55.73 54.69 2w4d s ARG 37 Cb -0.07 0.46 -0.07 0.00 -0.57 0.00 0.00 34.95 34.70 2w4d s ARG 37 CO 0.02 -0.40 0.62 -0.80 -1.08 0.00 0.00 175.30 173.66 2w4d s ASN 38 N -2.21 7.15 0.17 -2.89 0.02 -1.26 -0.67 114.94 115.25 2w4d s ASN 38 Ca 0.00 1.36 0.06 0.00 -1.02 0.00 0.00 52.86 53.27 2w4d s ASN 38 Cb -0.01 -2.40 -0.04 0.00 0.02 0.00 0.00 41.25 38.83 2w4d s ASN 38 CO -0.06 0.25 0.08 -0.76 0.02 0.00 0.00 177.10 176.63 2w4d s LEU 39 N -1.10 3.59 0.45 0.60 1.43 -0.41 -4.93 118.68 118.32 2w4d s LEU 39 Ca 0.31 -0.25 0.30 0.00 -1.03 0.00 0.00 54.13 53.46 2w4d s LEU 39 Cb -0.20 -2.21 1.65 0.00 0.03 0.00 0.00 46.19 45.45 2w4d s LEU 39 CO 0.21 0.07 1.93 1.55 0.23 0.00 0.00 176.35 180.34 2w4d h PRO 40 N 2.50 0.00 -0.29 1.29 0.13 -1.98 -1.40 132.00 132.25 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 0.61 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.98 2w4d n ASP 41 N -2.56 1.53 0.00 1.44 5.75 -1.26 -4.89 116.55 116.56 2w4d n ASP 41 Ca -0.02 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.76 2w4d n ASP 41 Cb 0.05 -0.19 0.00 0.00 -1.03 0.00 0.00 41.12 39.95 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 0.96 1.20 4.00 6.12 0.00 -0.53 -5.05 105.19 111.90 2w4d n GLY 42 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.11 4.69 -0.03 1.61 1.04 -1.25 -4.53 113.70 112.13 2w4d s SER 43 Ca 0.00 -0.47 0.07 0.00 0.48 0.00 0.00 55.95 56.03 2w4d s SER 43 Cb 0.00 -0.03 -0.02 0.00 0.10 0.00 0.00 66.02 66.07 2w4d s SER 43 CO 0.00 -1.61 -0.24 -0.69 0.98 0.00 0.00 173.24 171.68 2w4d s VAL 44 N -2.94 2.21 -0.02 5.02 1.01 -0.30 -1.29 120.40 124.09 2w4d s VAL 44 Ca 0.64 -1.05 0.07 0.00 0.00 0.00 0.00 61.98 61.64 2w4d s VAL 44 Cb -0.06 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.52 2w4d s VAL 44 CO 0.42 0.58 -0.23 -0.70 0.00 0.00 0.00 175.10 175.17 2w4d s GLU 45 N -0.62 1.93 0.06 2.72 2.12 0.15 -0.36 118.70 124.70 2w4d s GLU 45 Ca 0.10 -0.84 -0.15 0.00 0.36 0.00 0.00 54.97 54.45 2w4d s GLU 45 Cb -0.10 -1.85 0.02 0.00 0.26 0.00 0.00 34.13 32.46 2w4d s GLU 45 CO -0.01 0.49 0.33 0.00 -0.54 0.00 0.00 175.26 175.54 2w4d s ALA 46 N -0.52 -0.76 -0.11 6.30 0.00 -0.81 -0.63 121.76 125.22 2w4d s ALA 46 Ca 0.08 0.03 0.02 0.00 0.00 0.00 0.00 51.96 52.09 2w4d s ALA 46 Cb -0.09 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.42 2w4d s ALA 46 CO -0.01 -0.46 -0.16 0.08 0.00 0.00 0.00 175.76 175.22 2w4d s VAL 47 N -2.76 1.58 -0.10 0.00 1.01 -0.02 -0.00 120.40 120.11 2w4d s VAL 47 Ca -0.03 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.29 2w4d s VAL 47 Cb -0.00 -1.44 -0.00 0.00 0.00 0.00 0.00 36.38 34.94 2w4d s VAL 47 CO -0.05 0.46 -0.23 -0.76 0.00 0.00 0.00 175.10 174.52 2w4d s LEU 48 N 0.97 2.15 -0.01 3.92 1.02 0.08 -1.91 118.68 124.90 2w4d s LEU 48 Ca -0.06 -0.53 -0.00 0.00 0.02 0.00 0.00 54.13 53.56 2w4d s LEU 48 Cb -0.15 -1.42 0.02 0.00 0.02 0.00 0.00 46.19 44.65 2w4d s LEU 48 CO -0.02 0.17 0.02 -0.70 0.02 0.00 0.00 176.35 175.85 2w4d s GLU 49 N 0.26 -0.02 0.00 1.70 2.12 0.78 -0.15 118.70 123.39 2w4d s GLU 49 Ca -0.16 0.12 0.00 0.00 0.36 0.00 0.00 54.97 55.29 2w4d s GLU 49 Cb -0.17 -0.14 0.00 0.00 0.26 0.00 0.00 34.13 34.08 2w4d s GLU 49 CO 0.08 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.11 2w4d n GLY 50 N 3.72 -0.21 3.73 -1.50 0.00 -0.74 -0.77 105.19 109.43 2w4d n GLY 50 Ca -0.21 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 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 6.66 0.39 1.61 1.01 -1.26 -0.39 116.67 120.68 2w4d s ASP 51 Ca 0.00 2.60 0.17 0.00 0.71 0.00 0.00 52.55 56.02 2w4d s ASP 51 Cb 0.00 -2.61 1.05 0.00 1.01 0.00 0.00 42.92 42.37 2w4d s ASP 51 CO 0.00 -0.73 1.78 1.05 0.21 0.00 0.00 175.17 177.48 2w4d h GLU 52 N 5.89 0.43 -0.64 8.23 4.11 -1.65 0.15 114.58 131.11 2w4d h GLU 52 Ca -0.44 -0.03 -0.03 0.00 0.07 0.00 0.00 59.36 58.93 2w4d h GLU 52 Cb 1.21 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 2w4d h GLU 52 CO 0.84 0.29 0.27 1.49 0.07 0.00 0.00 179.01 181.97 2w4d h GLU 53 N 0.44 0.94 -0.23 1.06 4.81 -1.89 -0.36 114.58 119.35 2w4d h GLU 53 Ca 0.58 -0.16 -0.11 0.00 -0.13 0.00 0.00 59.36 59.54 2w4d h GLU 53 Cb 1.38 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 2w4d h GLU 53 CO -0.29 0.77 -0.30 0.00 -0.73 0.00 0.00 179.01 178.46 2w4d h ARG 54 N 0.89 0.60 -0.41 1.92 2.47 -1.11 -2.26 114.38 116.48 2w4d h ARG 54 Ca 0.21 -0.34 -0.03 0.00 -1.26 0.00 0.00 59.98 58.56 2w4d h ARG 54 Cb 0.17 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.50 2w4d h ARG 54 CO -0.02 0.95 0.14 0.28 0.56 0.00 0.00 179.97 181.88 2w4d h VAL 55 N 0.30 1.21 -0.83 2.04 2.07 -1.00 -2.05 116.25 117.98 2w4d h VAL 55 Ca 0.03 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 2w4d h VAL 55 Cb 0.87 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2w4d h VAL 55 CO 0.07 0.24 0.46 -0.33 0.02 0.00 0.00 177.57 178.03 2w4d h GLU 56 N 0.51 1.15 -0.78 1.57 5.08 -1.09 0.41 114.58 121.43 2w4d h GLU 56 Ca 0.13 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2w4d h GLU 56 Cb 0.24 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 2w4d h GLU 56 CO -0.01 0.84 0.33 0.00 -1.00 0.00 0.00 179.01 179.17 2w4d h ALA 57 N 1.35 1.11 -0.07 3.43 0.00 -1.13 -0.62 119.26 123.32 2w4d h ALA 57 Ca 0.29 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.86 2w4d h ALA 57 Cb 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2w4d h ALA 57 CO -0.05 0.65 -0.67 1.25 0.00 0.00 0.00 179.25 180.43 2w4d h LEU 58 N 1.13 0.37 -0.22 0.00 5.85 -0.65 -1.78 115.31 120.00 2w4d h LEU 58 Ca 0.26 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2w4d h LEU 58 Cb 0.18 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2w4d h LEU 58 CO -0.03 0.93 0.09 0.40 -0.34 0.00 0.00 178.44 179.49 2w4d h ILE 59 N 0.22 1.17 -0.36 4.05 2.04 -0.55 -0.69 117.51 123.38 2w4d h ILE 59 Ca -0.02 -0.50 0.03 0.00 1.00 0.00 0.00 64.86 65.37 2w4d h ILE 59 Cb 1.21 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 2w4d h ILE 59 CO 0.11 0.16 0.17 1.23 0.00 0.00 0.00 178.15 179.83 2w4d h GLY 60 N 0.20 0.49 0.76 5.37 0.00 -1.03 -2.15 103.07 106.71 2w4d h GLY 60 Ca 0.07 -0.12 0.06 0.00 0.00 0.00 0.00 47.33 47.34 2w4d h GLY 60 CO -0.01 0.09 0.56 -0.25 0.00 0.00 0.00 176.54 176.93 2w4d h TRP 61 N 0.36 1.04 0.00 5.60 7.01 -1.07 -1.93 115.95 126.95 2w4d h TRP 61 Ca 0.16 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.18 2w4d h TRP 61 Cb 0.08 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 26.80 2w4d h TRP 61 CO -0.11 0.55 0.14 0.00 -2.79 0.00 0.00 178.44 176.23 2w4d h ALA 62 N 1.40 1.13 0.00 2.65 0.00 -0.44 0.52 119.26 124.53 2w4d h ALA 62 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2w4d h ALA 62 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2w4d h ALA 62 CO -0.16 -0.13 -0.14 0.45 0.00 0.00 0.00 179.25 179.26 2w4d h HIS 63 N 0.00 0.00 0.00 0.00 3.86 -1.28 -3.35 115.15 114.38 2w4d h HIS 63 Ca 0.00 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.14 2w4d h HIS 63 Cb 0.29 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 2w4d h HIS 63 CO 0.00 0.00 -1.10 0.94 0.86 0.00 0.00 177.93 178.63 2w4d n GLN 64 N -2.29 0.45 -0.62 2.45 -0.06 0.15 -4.50 117.38 112.96 2w4d n GLN 64 Ca 0.05 0.18 0.08 0.00 -2.00 0.00 0.00 57.00 55.31 2w4d n GLN 64 Cb 0.44 -1.28 -0.02 0.00 -4.06 0.00 0.00 30.24 25.32 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 1.76 -1.87 3.70 1.69 0.00 0.93 -4.69 105.19 106.71 2w4d n GLY 65 Ca -0.18 -1.27 -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 -1.23 1.55 0.21 1.61 0.04 -1.26 -4.83 135.00 131.08 2w4d s PRO 66 Ca 0.00 1.60 -0.07 0.00 0.04 0.00 0.00 61.00 62.57 2w4d s PRO 66 Cb 0.00 -1.78 0.33 0.00 0.04 0.00 0.00 34.50 33.08 2w4d s PRO 66 CO 0.00 -2.25 1.17 -2.30 0.04 0.00 0.00 177.00 173.66 2w4d n PRO 67 N -3.60 -0.08 0.00 0.56 -0.02 -1.26 -0.68 135.00 129.91 2w4d n PRO 67 Ca 0.12 1.17 0.15 0.00 -2.02 0.00 0.00 63.50 62.92 2w4d n PRO 67 Cb 0.51 -1.75 0.71 0.00 -0.02 0.00 0.00 33.50 32.96 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 -5.21 0.00 -4.78 2.45 7.99 -1.26 -4.87 117.00 111.31 2w4d n LEU 68 Ca 0.11 0.35 -0.36 0.00 -0.01 0.00 0.00 56.01 56.10 2w4d n LEU 68 Cb 0.37 -0.35 -0.05 0.00 -0.11 0.00 0.00 43.42 43.28 2w4d n LEU 68 CO -0.09 0.00 0.72 0.00 -1.51 0.00 0.00 177.39 176.50 2w4d s ALA 69 N -2.71 3.12 -0.36 -1.18 0.00 0.14 -4.95 121.76 115.81 2w4d s ALA 69 Ca 0.24 0.66 -0.00 0.00 0.00 0.00 0.00 51.96 52.85 2w4d s ALA 69 Cb 0.20 -3.25 0.12 0.00 0.00 0.00 0.00 23.12 20.19 2w4d s ALA 69 CO 0.48 -0.12 0.18 0.50 0.00 0.00 0.00 175.76 176.81 2w4d s ARG 70 N -2.42 0.78 -0.17 0.00 3.52 -0.06 -4.91 118.95 115.69 2w4d s ARG 70 Ca 0.56 -1.38 -0.27 0.00 -0.13 0.00 0.00 55.73 54.51 2w4d s ARG 70 Cb -0.21 -1.78 -0.01 0.00 -1.56 0.00 0.00 34.95 31.40 2w4d s ARG 70 CO 0.26 -1.12 0.90 0.08 -0.81 0.00 0.00 175.30 174.61 2w4d s VAL 71 N 1.10 4.83 -0.04 7.11 1.01 -1.26 -0.47 120.40 132.68 2w4d s VAL 71 Ca 0.15 1.77 0.21 0.00 0.00 0.00 0.00 61.98 64.11 2w4d s VAL 71 Cb -0.21 -4.20 -0.33 0.00 0.00 0.00 0.00 36.38 31.65 2w4d s VAL 71 CO -0.10 -0.02 0.47 0.35 0.00 0.00 0.00 175.10 175.80 2w4d n THR 72 N 4.84 0.00 -3.57 3.92 -2.24 -0.31 -4.98 114.28 111.93 2w4d n THR 72 Ca 0.07 -0.47 -0.11 0.00 -2.27 0.00 0.00 64.05 61.26 2w4d n THR 72 Cb 0.48 0.03 -0.05 0.00 -2.10 0.00 0.00 70.33 68.69 2w4d n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w4d s ARG 73 N -3.45 0.64 -0.05 -0.78 1.70 -1.22 -5.03 118.95 110.77 2w4d s ARG 73 Ca -0.07 0.18 0.01 0.00 -0.47 0.00 0.00 55.73 55.38 2w4d s ARG 73 Cb 0.14 0.30 0.02 0.00 -0.57 0.00 0.00 34.95 34.84 2w4d s ARG 73 CO 0.88 -0.19 -0.06 0.08 -1.08 0.00 0.00 175.30 174.92 2w4d s VAL 74 N -1.05 0.62 -0.19 4.99 1.01 -1.26 -1.03 120.40 123.49 2w4d s VAL 74 Ca -0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 61.98 61.75 2w4d s VAL 74 Cb -0.01 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.74 2w4d s VAL 74 CO 0.02 0.24 -0.06 -1.61 0.00 0.00 0.00 175.10 173.69 2w4d s GLU 75 N 0.83 3.42 0.05 2.72 2.02 -0.24 -4.96 118.70 122.53 2w4d s GLU 75 Ca -0.12 -0.62 0.06 0.00 0.02 0.00 0.00 54.97 54.30 2w4d s GLU 75 Cb -0.14 -2.91 -0.04 0.00 0.10 0.00 0.00 34.13 31.14 2w4d s GLU 75 CO 0.01 -0.04 -0.11 0.08 0.02 0.00 0.00 175.26 175.21 2w4d s VAL 76 N 1.06 3.28 -0.07 2.63 1.01 -1.26 -1.33 120.40 125.71 2w4d s VAL 76 Ca 0.01 -1.07 -0.02 0.00 0.00 0.00 0.00 61.98 60.90 2w4d s VAL 76 Cb -0.15 -2.45 0.03 0.00 0.00 0.00 0.00 36.38 33.82 2w4d s VAL 76 CO -0.00 0.29 0.03 -0.75 0.00 0.00 0.00 175.10 174.66 2w4d s LYS 77 N -1.68 0.32 -0.00 2.72 2.47 -0.41 -4.96 119.74 118.20 2w4d s LYS 77 Ca 0.18 0.16 -0.21 0.00 -1.56 0.00 0.00 55.97 54.54 2w4d s LYS 77 Cb -0.11 -0.93 -0.05 0.00 -1.46 0.00 0.00 37.83 35.28 2w4d s LYS 77 CO 0.09 -0.36 0.62 -1.58 0.16 0.00 0.00 175.35 174.28 2w4d s TRP 78 N 2.05 3.68 0.33 4.03 0.52 -1.26 -0.43 118.94 127.86 2w4d s TRP 78 Ca 0.04 1.23 0.04 0.00 0.02 0.00 0.00 56.10 57.44 2w4d s TRP 78 Cb -0.13 -2.64 -0.03 0.00 -1.15 0.00 0.00 33.47 29.52 2w4d s TRP 78 CO -0.05 0.33 0.19 -1.21 0.02 0.00 0.00 176.95 176.23 2w4d s GLU 79 N -0.11 1.69 0.00 4.98 2.02 -0.48 -4.99 118.70 121.81 2w4d s GLU 79 Ca 0.32 -1.98 -0.29 0.00 0.02 0.00 0.00 54.97 53.04 2w4d s GLU 79 Cb -0.18 -0.05 -0.03 0.00 0.10 0.00 0.00 34.13 33.96 2w4d s GLU 79 CO 0.18 -0.51 0.95 -1.14 0.02 0.00 0.00 175.26 174.75 2w4d s GLN 80 N -3.70 4.56 0.46 1.61 0.74 -1.26 -3.66 119.66 118.40 2w4d s GLN 80 Ca 0.35 1.37 -0.23 0.00 0.05 0.00 0.00 55.36 56.90 2w4d s GLN 80 Cb 0.04 -3.45 -0.10 0.00 1.10 0.00 0.00 33.01 30.60 2w4d s GLN 80 CO 0.20 -0.01 0.88 -2.30 -0.55 0.00 0.00 175.29 173.50 2w4d n PRO 81 N 3.79 1.08 0.00 1.67 -0.02 -1.26 -4.91 135.00 135.34 2w4d n PRO 81 Ca 0.05 0.39 0.01 0.00 -2.02 0.00 0.00 63.50 61.94 2w4d n PRO 81 Cb 0.51 -1.93 0.01 0.00 -0.02 0.00 0.00 33.50 32.07 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 0.05 -0.02 -0.41 -0.52 5.02 -1.26 -5.01 118.16 116.01 2w4d n LYS 82 Ca 0.11 -0.62 0.00 0.00 -2.02 0.00 0.00 58.31 55.77 2w4d n LYS 82 Cb 0.41 -1.02 0.00 0.00 -0.02 0.00 0.00 35.03 34.40 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 0.24 1.27 3.61 0.72 0.00 -1.26 -5.05 105.19 104.72 2w4d n GLY 83 Ca 0.02 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 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 1.37 -3.70 1.61 -0.58 -1.26 -5.00 120.64 111.55 2w4d n GLU 84 Ca 0.00 0.49 -0.23 0.00 -0.42 0.00 0.00 57.16 57.00 2w4d n GLU 84 Cb 0.08 -2.05 -0.18 0.00 -0.57 0.00 0.00 31.44 28.72 2w4d n GLU 84 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2w4d s LYS 85 N -2.02 0.26 0.00 3.49 1.02 -1.26 -4.80 119.74 116.43 2w4d s LYS 85 Ca 0.63 0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.75 2w4d s LYS 85 Cb -0.55 -1.04 0.00 0.00 -0.52 0.00 0.00 37.83 35.72 2w4d s LYS 85 CO 0.57 -0.40 0.00 0.41 -0.92 0.00 0.00 175.35 175.00 2w4d n GLY 86 N 5.22 -2.47 3.27 -3.33 0.00 -1.26 -4.79 105.19 101.82 2w4d n GLY 86 Ca -0.06 -1.46 -0.34 0.00 0.00 0.00 0.00 46.02 44.17 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 -3.03 2.86 0.23 1.61 2.19 -1.26 -1.37 117.98 119.22 2w4d s PHE 87 Ca 0.00 -1.08 0.08 0.00 0.33 0.00 0.00 56.93 56.27 2w4d s PHE 87 Cb 0.00 -1.98 -0.05 0.00 -1.31 0.00 0.00 43.02 39.68 2w4d s PHE 87 CO 0.00 -0.54 -0.14 -0.98 1.83 0.00 0.00 175.22 175.38 2w4d s ARG 88 N 1.14 1.44 -0.30 10.12 1.70 -0.31 -4.95 118.95 127.79 2w4d s ARG 88 Ca 0.01 -1.66 -0.13 0.00 -0.47 0.00 0.00 55.73 53.48 2w4d s ARG 88 Cb -0.14 -1.27 -0.03 0.00 -0.57 0.00 0.00 34.95 32.93 2w4d s ARG 88 CO -0.04 0.19 0.27 0.42 -1.08 0.00 0.00 175.30 175.06 2w4d s ILE 89 N -2.88 5.25 0.43 4.99 1.01 -1.26 -1.94 121.20 126.81 2w4d s ILE 89 Ca 0.25 0.16 0.02 0.00 0.00 0.00 0.00 60.65 61.08 2w4d s ILE 89 Cb -0.01 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.83 2w4d s ILE 89 CO 0.09 0.12 0.15 1.33 0.00 0.00 0.00 174.94 176.63 2w4d n VAL 90 N 5.11 0.00 0.89 2.92 0.24 -0.60 -4.96 118.33 121.93 2w4d n VAL 90 Ca -0.12 -1.88 0.11 0.00 -2.04 0.00 0.00 64.34 60.41 2w4d n VAL 90 Cb 0.51 0.17 0.09 0.00 -1.47 0.00 0.00 33.84 33.13 2w4d n VAL 90 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69