#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dr3 h ARG 2 N 0.00 0.13 -2.49 7.34 -0.00 -1.99 -3.47 114.38 113.90 1dr3 h ARG 2 Ca 0.00 -0.01 0.02 0.00 -0.00 0.00 0.00 59.98 59.99 1dr3 h ARG 2 Cb 0.00 -0.03 -0.15 0.00 -0.00 0.00 0.00 29.97 29.79 1dr3 h ARG 2 CO 0.00 0.13 0.32 -1.54 -0.00 0.00 0.00 179.97 178.89 1dr3 s SER 3 N -5.33 -0.50 0.20 0.08 1.04 -1.26 -4.25 113.70 103.67 1dr3 s SER 3 Ca -0.13 0.15 0.07 0.00 0.48 0.00 0.00 55.95 56.52 1dr3 s SER 3 Cb 0.07 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.65 1dr3 s SER 3 CO 0.68 -0.75 0.07 -0.76 0.98 0.00 0.00 173.24 173.46 1dr3 s LEU 4 N -2.27 3.52 -0.03 2.42 1.43 0.25 -4.65 118.68 119.34 1dr3 s LEU 4 Ca 0.00 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 52.78 1dr3 s LEU 4 Cb -0.01 -2.11 0.01 0.00 0.03 0.00 0.00 46.19 44.11 1dr3 s LEU 4 CO -0.07 0.04 -0.09 0.20 0.23 0.00 0.00 176.35 176.67 1dr3 s ASN 5 N -3.28 1.22 0.05 2.29 0.01 -1.03 -1.57 114.94 112.64 1dr3 s ASN 5 Ca 0.30 -0.19 0.08 0.00 -0.71 0.00 0.00 52.86 52.34 1dr3 s ASN 5 Cb -0.09 -0.41 -0.03 0.00 0.41 0.00 0.00 41.25 41.14 1dr3 s ASN 5 CO 0.21 0.04 -0.21 -0.44 -1.51 0.00 0.00 177.10 175.19 1dr3 s SER 6 N 0.38 2.58 -0.01 -1.22 0.01 -0.52 0.90 113.70 115.81 1dr3 s SER 6 Ca -0.06 -0.56 0.02 0.00 1.31 0.00 0.00 55.95 56.66 1dr3 s SER 6 Cb -0.10 -0.20 -0.00 0.00 0.21 0.00 0.00 66.02 65.92 1dr3 s SER 6 CO 0.01 0.16 -0.06 -0.51 0.41 0.00 0.00 173.24 173.25 1dr3 s ILE 7 N -0.86 0.48 0.13 1.44 2.07 -0.67 -0.91 121.20 122.89 1dr3 s ILE 7 Ca 0.08 -0.23 -0.21 0.00 -1.41 0.00 0.00 60.65 58.87 1dr3 s ILE 7 Cb -0.09 -0.43 0.06 0.00 0.13 0.00 0.00 42.46 42.13 1dr3 s ILE 7 CO 0.02 0.15 0.54 0.54 -1.91 0.00 0.00 174.94 174.28 1dr3 s VAL 8 N 0.03 0.02 -0.10 4.00 0.11 -0.47 -4.60 120.40 119.39 1dr3 s VAL 8 Ca 0.00 -0.18 0.04 0.00 -2.93 0.00 0.00 61.98 58.91 1dr3 s VAL 8 Cb -0.04 -1.04 -0.00 0.00 -1.53 0.00 0.00 36.38 33.76 1dr3 s VAL 8 CO -0.00 -0.10 -0.23 0.00 -3.33 0.00 0.00 175.10 171.44 1dr3 s ALA 9 N -3.58 2.21 0.06 1.54 0.00 -1.26 -1.48 121.76 119.25 1dr3 s ALA 9 Ca 0.01 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.04 1dr3 s ALA 9 Cb -0.00 -0.85 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 1dr3 s ALA 9 CO -0.11 0.28 -0.11 0.14 0.00 0.00 0.00 175.76 175.96 1dr3 s VAL 10 N 0.35 0.86 0.52 0.00 -7.23 -0.21 -4.66 120.40 110.03 1dr3 s VAL 10 Ca -0.18 -1.26 0.06 0.00 -1.81 0.00 0.00 61.98 58.79 1dr3 s VAL 10 Cb -0.18 -0.92 0.09 0.00 0.56 0.00 0.00 36.38 35.94 1dr3 s VAL 10 CO 0.08 -0.33 0.72 0.00 -0.31 0.00 0.00 175.10 175.26 1dr3 h GLN 12 N 0.00 0.31 -0.39 0.00 4.20 -0.87 0.65 115.11 119.01 1dr3 h GLN 12 Ca -0.24 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1dr3 h GLN 12 Cb 1.03 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.74 1dr3 h GLN 12 CO 0.31 0.21 0.00 0.27 -0.67 0.00 0.00 178.83 178.95 1dr3 n ASN 13 N -4.48 1.89 -0.72 1.46 0.23 -1.26 -4.90 115.26 107.49 1dr3 n ASN 13 Ca 0.05 -2.05 -0.09 0.00 -0.53 0.00 0.00 54.58 51.96 1dr3 n ASN 13 Cb 0.25 -0.26 -0.04 0.00 -2.08 0.00 0.00 39.78 37.65 1dr3 n ASN 13 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 1dr3 n MET 14 N 0.41 -0.94 -2.76 -3.83 2.81 0.22 -4.96 117.12 108.07 1dr3 n MET 14 Ca 0.11 0.78 -0.36 0.00 -1.81 0.00 0.00 57.70 56.42 1dr3 n MET 14 Cb 0.32 -4.77 -0.06 0.00 -0.71 0.00 0.00 33.22 28.00 1dr3 n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1dr3 s GLY 15 N -2.66 2.68 0.00 3.03 0.00 -1.26 -0.73 107.32 108.38 1dr3 s GLY 15 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 44.72 45.23 1dr3 s GLY 15 CO 0.00 0.91 0.04 0.29 0.00 0.00 0.00 173.10 174.34 1dr3 n ILE 16 N 0.15 0.00 -3.62 0.90 -5.35 0.23 -2.43 119.36 109.23 1dr3 n ILE 16 Ca 0.04 -0.37 -0.07 0.00 -0.27 0.00 0.00 62.75 62.09 1dr3 n ILE 16 Cb 0.51 1.03 -0.02 0.00 -1.74 0.00 0.00 39.64 39.43 1dr3 n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1dr3 s GLY 17 N -0.64 -0.36 -0.26 3.28 0.00 -1.17 -4.55 107.32 103.62 1dr3 s GLY 17 Ca 0.00 0.51 -0.15 0.00 0.00 0.00 0.00 44.72 45.08 1dr3 s GLY 17 CO 0.00 0.15 0.63 1.25 0.00 0.00 0.00 173.10 175.13 1dr3 s LYS 18 N -3.30 0.65 -1.55 2.90 2.47 0.28 -0.68 119.74 120.52 1dr3 s LYS 18 Ca 0.08 1.12 -0.14 0.00 -1.56 0.00 0.00 55.97 55.47 1dr3 s LYS 18 Cb -0.01 0.12 0.10 0.00 -1.46 0.00 0.00 37.83 36.58 1dr3 s LYS 18 CO -0.04 -0.15 0.86 -0.25 0.16 0.00 0.00 175.35 175.93 1dr3 n ASP 19 N 4.21 -4.36 -0.01 1.43 8.00 -1.26 -0.86 116.55 123.70 1dr3 n ASP 19 Ca -0.20 -0.77 -0.00 0.00 0.71 0.00 0.00 54.79 54.53 1dr3 n ASP 19 Cb 0.58 -3.51 -0.00 0.00 -0.02 0.00 0.00 41.12 38.17 1dr3 n ASP 19 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dr3 n GLY 20 N -1.54 0.47 1.45 0.44 0.00 -1.26 -4.99 105.19 99.77 1dr3 n GLY 20 Ca 0.04 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 1dr3 n GLY 20 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dr3 n ASN 21 N 0.20 -0.22 -4.80 1.61 5.15 -0.04 -4.75 115.26 112.43 1dr3 n ASN 21 Ca -0.00 -1.99 -0.35 0.00 -0.60 0.00 0.00 54.58 51.64 1dr3 n ASN 21 Cb 0.02 0.74 -0.05 0.00 -0.53 0.00 0.00 39.78 39.96 1dr3 n ASN 21 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1dr3 s LEU 22 N 0.00 4.01 0.50 1.20 1.43 -1.26 0.10 118.68 124.65 1dr3 s LEU 22 Ca 0.17 1.91 0.32 0.00 -1.03 0.00 0.00 54.13 55.50 1dr3 s LEU 22 Cb 0.01 -4.38 1.27 0.00 0.03 0.00 0.00 46.19 43.12 1dr3 s LEU 22 CO 0.12 -0.54 1.93 -0.65 0.23 0.00 0.00 176.35 177.44 1dr3 h PRO 23 N 2.09 0.00 -6.23 1.29 0.11 -1.84 -3.41 132.00 124.01 1dr3 h PRO 23 Ca -0.49 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.05 1dr3 h PRO 23 Cb 1.21 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.21 1dr3 h PRO 23 CO 0.61 0.00 -0.67 1.67 -0.21 0.00 0.00 178.00 179.40 1dr3 s TRP 24 N -3.59 2.64 1.02 0.65 -2.14 -1.26 -4.76 118.94 111.49 1dr3 s TRP 24 Ca 0.02 -0.24 -0.12 0.00 2.66 0.00 0.00 56.10 58.42 1dr3 s TRP 24 Cb 0.09 -1.18 0.20 0.00 -3.10 0.00 0.00 33.47 29.48 1dr3 s TRP 24 CO 0.52 0.62 1.09 -2.14 -2.66 0.00 0.00 176.95 174.38 1dr3 s PRO 25 N -3.55 0.27 0.27 3.25 0.02 -1.26 -4.91 135.00 129.09 1dr3 s PRO 25 Ca 0.30 0.50 -0.31 0.00 0.02 0.00 0.00 61.00 61.52 1dr3 s PRO 25 Cb -0.07 -1.72 -0.12 0.00 0.02 0.00 0.00 34.50 32.61 1dr3 s PRO 25 CO 0.19 -2.83 1.57 -0.35 -0.33 0.00 0.00 177.00 175.24 1dr3 n PRO 26 N -4.24 2.55 -4.03 5.54 -0.04 -1.26 -4.99 135.00 128.52 1dr3 n PRO 26 Ca 0.05 0.91 -0.31 0.00 -0.04 0.00 0.00 63.50 64.10 1dr3 n PRO 26 Cb 0.57 -2.67 -0.15 0.00 -0.04 0.00 0.00 33.50 31.21 1dr3 n PRO 26 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1dr3 s LEU 27 N -0.13 4.07 0.11 1.53 1.43 -1.26 -5.02 118.68 119.40 1dr3 s LEU 27 Ca 0.67 -1.79 -0.25 0.00 -1.03 0.00 0.00 54.13 51.73 1dr3 s LEU 27 Cb -0.54 -1.56 -0.08 0.00 0.03 0.00 0.00 46.19 44.04 1dr3 s LEU 27 CO 0.47 -0.29 1.66 -0.09 0.23 0.00 0.00 176.35 178.33 1dr3 h ARG 28 N 7.70 -0.31 -0.48 1.70 2.43 -1.99 -2.21 114.38 121.22 1dr3 h ARG 28 Ca -0.11 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 1dr3 h ARG 28 Cb 1.03 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.63 1dr3 h ARG 28 CO 0.49 -0.21 -0.04 -0.91 -1.51 0.00 0.00 179.97 177.80 1dr3 h ASN 29 N -0.32 0.79 -0.28 -3.80 2.35 -1.99 -0.97 115.58 111.36 1dr3 h ASN 29 Ca 0.04 -0.21 -0.12 0.00 -0.55 0.00 0.00 56.30 55.46 1dr3 h ASN 29 Cb 0.37 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1dr3 h ASN 29 CO -0.14 0.88 -0.25 -0.08 -1.65 0.00 0.00 177.43 176.19 1dr3 h GLU 30 N 0.75 0.77 -0.16 0.81 4.22 -1.97 -2.04 114.58 116.96 1dr3 h GLU 30 Ca 0.14 -0.32 -0.02 0.00 0.08 0.00 0.00 59.36 59.24 1dr3 h GLU 30 Cb 0.51 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 1dr3 h GLU 30 CO 0.03 0.94 0.03 -0.92 -2.18 0.00 0.00 179.01 176.91 1dr3 h TYR 31 N 0.67 0.28 -0.18 0.92 3.20 -1.05 -2.01 116.97 118.80 1dr3 h TYR 31 Ca 0.09 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.93 1dr3 h TYR 31 Cb 0.76 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1dr3 h TYR 31 CO 0.04 0.42 0.12 0.87 -1.64 0.00 0.00 178.16 177.97 1dr3 h LYS 32 N 0.06 0.20 -0.41 1.82 1.57 -1.12 -1.44 116.57 117.25 1dr3 h LYS 32 Ca 0.05 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1dr3 h LYS 32 Cb 0.28 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1dr3 h LYS 32 CO 0.00 0.14 0.02 -0.92 -0.57 0.00 0.00 179.45 178.12 1dr3 h TYR 33 N 0.21 0.77 -0.44 -1.35 3.20 -0.71 0.13 116.97 118.79 1dr3 h TYR 33 Ca 0.07 -0.12 -0.06 0.00 3.14 0.00 0.00 58.73 61.76 1dr3 h TYR 33 Cb 0.02 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.07 1dr3 h TYR 33 CO -0.00 0.76 0.04 0.35 -1.64 0.00 0.00 178.16 177.68 1dr3 h PHE 34 N 0.55 0.79 0.03 -3.82 3.04 -0.69 0.14 116.94 116.99 1dr3 h PHE 34 Ca 0.12 -0.12 -0.00 0.00 3.98 0.00 0.00 57.97 61.95 1dr3 h PHE 34 Cb 0.44 -0.21 -0.00 0.00 2.56 0.00 0.00 35.95 38.74 1dr3 h PHE 34 CO 0.03 0.77 -0.03 1.96 -2.02 0.00 0.00 178.31 179.03 1dr3 h GLN 35 N 0.59 -0.06 -0.13 1.11 1.08 -1.17 -1.27 115.11 115.26 1dr3 h GLN 35 Ca 0.13 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.33 1dr3 h GLN 35 Cb 0.42 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.86 1dr3 h GLN 35 CO 0.01 -0.04 0.08 -0.09 -0.95 0.00 0.00 178.83 177.84 1dr3 h ARG 36 N -0.06 0.17 -0.50 1.46 2.43 -0.77 -0.94 114.38 116.17 1dr3 h ARG 36 Ca -0.00 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.04 1dr3 h ARG 36 Cb 0.06 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1dr3 h ARG 36 CO -0.00 0.16 -0.14 0.52 -1.51 0.00 0.00 179.97 179.00 1dr3 h MET 37 N 0.14 0.96 0.03 0.20 2.86 -0.67 -2.69 114.93 115.75 1dr3 h MET 37 Ca 0.05 -0.36 -0.22 0.00 -2.06 0.00 0.00 59.70 57.11 1dr3 h MET 37 Cb 0.03 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1dr3 h MET 37 CO -0.01 1.03 -0.98 1.79 1.06 0.00 0.00 176.91 179.80 1dr3 h THR 38 N 0.85 1.56 0.00 2.22 1.35 -1.11 -3.35 112.91 114.44 1dr3 h THR 38 Ca 0.13 -2.94 -0.17 0.00 -0.55 0.00 0.00 66.41 62.88 1dr3 h THR 38 Cb 0.69 2.67 -0.03 0.00 -1.73 0.00 0.00 68.15 69.76 1dr3 h THR 38 CO 0.05 0.85 -0.93 0.28 -0.25 0.00 0.00 175.52 175.52 1dr3 h SER 39 N 0.06 0.00 -3.21 5.36 0.02 -1.21 -3.43 113.55 111.14 1dr3 h SER 39 Ca -0.05 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.34 1dr3 h SER 39 Cb 1.67 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 64.14 1dr3 h SER 39 CO 0.15 0.73 1.01 -0.89 -1.14 0.00 0.00 176.83 176.68 1dr3 s THR 40 N -2.84 3.98 0.25 -2.27 2.01 -1.02 -4.68 115.64 111.07 1dr3 s THR 40 Ca 0.01 0.91 -0.06 0.00 0.31 0.00 0.00 61.69 62.85 1dr3 s THR 40 Cb 0.09 -4.58 -0.06 0.00 0.01 0.00 0.00 72.50 67.96 1dr3 s THR 40 CO 0.79 -1.17 0.52 -0.55 -0.69 0.00 0.00 174.62 173.52 1dr3 s SER 41 N 3.34 6.51 -0.33 3.53 0.15 -1.26 -4.97 113.70 120.67 1dr3 s SER 41 Ca 0.48 0.76 0.08 0.00 0.70 0.00 0.00 55.95 57.97 1dr3 s SER 41 Cb -0.09 -2.16 0.55 0.00 -1.71 0.00 0.00 66.02 62.61 1dr3 s SER 41 CO 0.27 -0.12 1.57 1.41 1.20 0.00 0.00 173.24 177.58 1dr3 n HIS 42 N -0.52 1.54 -3.70 3.44 -0.00 -1.26 -4.93 115.22 109.80 1dr3 n HIS 42 Ca -0.01 -1.66 -0.11 0.00 -0.00 0.00 0.00 57.72 55.93 1dr3 n HIS 42 Cb 0.53 -0.60 -0.12 0.00 -0.00 0.00 0.00 29.99 29.81 1dr3 n HIS 42 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1dr3 s VAL 43 N -3.26 -0.10 0.28 1.59 1.01 -1.26 -5.14 120.40 113.53 1dr3 s VAL 43 Ca 0.47 0.13 -0.29 0.00 0.00 0.00 0.00 61.98 62.29 1dr3 s VAL 43 Cb 0.42 -0.54 -0.10 0.00 0.00 0.00 0.00 36.38 36.17 1dr3 s VAL 43 CO 0.02 0.05 1.23 -1.83 0.00 0.00 0.00 175.10 174.57 1dr3 s GLU 44 N 1.50 4.47 0.00 2.72 -1.05 -1.26 -2.50 118.70 122.58 1dr3 s GLU 44 Ca -0.08 2.02 0.00 0.00 -0.15 0.00 0.00 54.97 56.76 1dr3 s GLU 44 Cb -0.09 -3.14 0.00 0.00 -0.44 0.00 0.00 34.13 30.45 1dr3 s GLU 44 CO -0.11 -0.05 0.00 0.41 0.95 0.00 0.00 175.26 176.46 1dr3 n GLY 45 N 1.27 0.90 3.50 -3.83 0.00 -1.26 -5.03 105.19 100.74 1dr3 n GLY 45 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1dr3 n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dr3 s LYS 46 N -0.46 1.78 0.20 1.61 1.02 -1.04 -4.86 119.74 117.99 1dr3 s LYS 46 Ca 0.00 -1.55 0.04 0.00 0.02 0.00 0.00 55.97 54.49 1dr3 s LYS 46 Cb 0.00 -1.92 -0.05 0.00 -0.52 0.00 0.00 37.83 35.34 1dr3 s LYS 46 CO 0.00 0.38 -0.06 -0.65 -0.92 0.00 0.00 175.35 174.10 1dr3 s GLN 47 N -3.12 1.23 0.37 1.68 -0.21 -0.65 -4.83 119.66 114.14 1dr3 s GLN 47 Ca 0.26 -1.58 -0.07 0.00 0.02 0.00 0.00 55.36 53.99 1dr3 s GLN 47 Cb -0.07 -0.68 -0.05 0.00 1.00 0.00 0.00 33.01 33.21 1dr3 s GLN 47 CO 0.14 -0.00 0.69 -0.80 -2.12 0.00 0.00 175.29 173.19 1dr3 s ASN 48 N -3.26 6.45 -0.10 5.90 0.01 -1.26 -0.71 114.94 121.98 1dr3 s ASN 48 Ca 0.23 0.93 -0.02 0.00 -0.71 0.00 0.00 52.86 53.30 1dr3 s ASN 48 Cb 0.04 -2.24 -0.03 0.00 0.41 0.00 0.00 41.25 39.43 1dr3 s ASN 48 CO 0.05 -0.34 -0.02 0.00 -1.51 0.00 0.00 177.10 175.28 1dr3 s ALA 49 N -2.31 3.18 -0.10 0.60 0.00 0.14 -0.85 121.76 122.41 1dr3 s ALA 49 Ca 0.48 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.63 1dr3 s ALA 49 Cb -0.10 -1.45 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 1dr3 s ALA 49 CO 0.33 0.51 -0.14 0.14 0.00 0.00 0.00 175.76 176.59 1dr3 s VAL 50 N -0.61 2.98 -0.06 0.00 -7.23 -0.14 0.72 120.40 116.06 1dr3 s VAL 50 Ca 0.10 -0.71 0.02 0.00 -1.81 0.00 0.00 61.98 59.58 1dr3 s VAL 50 Cb -0.12 -2.22 -0.03 0.00 0.56 0.00 0.00 36.38 34.58 1dr3 s VAL 50 CO 0.02 0.55 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.61 1dr3 s ILE 51 N -0.00 3.26 0.09 -0.62 1.01 0.72 -1.55 121.20 124.12 1dr3 s ILE 51 Ca -0.04 -0.64 -0.19 0.00 0.00 0.00 0.00 60.65 59.77 1dr3 s ILE 51 Cb -0.14 -2.31 0.05 0.00 0.01 0.00 0.00 42.46 40.07 1dr3 s ILE 51 CO 0.04 0.59 0.47 0.00 0.00 0.00 0.00 174.94 176.04 1dr3 s MET 52 N -0.65 1.06 0.91 2.79 0.23 -0.41 -1.58 119.30 121.65 1dr3 s MET 52 Ca 0.10 -0.47 -0.12 0.00 -1.03 0.00 0.00 55.69 54.16 1dr3 s MET 52 Cb -0.11 0.48 0.14 0.00 -1.53 0.00 0.00 34.83 33.80 1dr3 s MET 52 CO 0.01 -0.41 1.15 0.20 -2.03 0.00 0.00 175.02 173.94 1dr3 s GLY 53 N -2.41 1.58 0.10 3.16 0.00 -0.42 -0.48 107.32 108.86 1dr3 s GLY 53 Ca -0.01 -0.56 -0.20 0.00 0.00 0.00 0.00 44.72 43.95 1dr3 s GLY 53 CO -0.07 0.00 1.68 1.70 0.00 0.00 0.00 173.10 176.40 1dr3 h LYS 54 N -1.48 0.27 -0.20 2.90 3.64 -1.88 -2.26 116.57 117.56 1dr3 h LYS 54 Ca -0.50 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 58.86 1dr3 h LYS 54 Cb 1.33 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.08 1dr3 h LYS 54 CO 0.61 0.29 0.10 0.87 -2.27 0.00 0.00 179.45 179.05 1dr3 h LYS 55 N 0.18 0.21 -0.28 1.90 1.57 -1.94 -1.04 116.57 117.17 1dr3 h LYS 55 Ca 0.06 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.88 1dr3 h LYS 55 Cb 0.11 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 1dr3 h LYS 55 CO -0.01 0.14 -0.01 1.15 -0.57 0.00 0.00 179.45 180.15 1dr3 h THR 56 N 0.22 0.78 -0.51 -0.16 2.02 -1.87 -0.62 112.91 112.76 1dr3 h THR 56 Ca 0.08 -0.02 0.07 0.00 0.77 0.00 0.00 66.41 67.31 1dr3 h THR 56 Cb 0.02 0.71 -0.06 0.00 -1.74 0.00 0.00 68.15 67.07 1dr3 h THR 56 CO -0.06 0.01 0.16 -0.25 0.37 0.00 0.00 175.52 175.76 1dr3 h TRP 57 N 0.07 0.28 0.00 3.16 2.91 -1.04 -0.24 115.95 121.10 1dr3 h TRP 57 Ca 0.14 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.18 1dr3 h TRP 57 Cb 0.18 -0.05 0.00 0.00 -0.51 0.00 0.00 29.16 28.78 1dr3 h TRP 57 CO -0.22 0.07 0.00 1.19 -1.03 0.00 0.00 178.44 178.45 1dr3 n PHE 58 N -5.03 0.48 0.38 2.65 3.72 -0.43 -2.47 117.46 116.76 1dr3 n PHE 58 Ca 0.06 0.17 0.13 0.00 -0.05 0.00 0.00 57.45 57.76 1dr3 n PHE 58 Cb 0.22 -0.78 0.40 0.00 -0.94 0.00 0.00 39.48 38.38 1dr3 n PHE 58 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1dr3 h SER 59 N 0.00 0.00 -3.36 4.37 4.64 0.53 -3.43 113.55 116.30 1dr3 h SER 59 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 1dr3 h SER 59 Cb 0.42 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.46 1dr3 h SER 59 CO 0.00 0.00 0.18 -0.63 -0.87 0.00 0.00 176.83 175.51 1dr3 s ILE 60 N -3.29 4.99 0.18 0.95 1.01 -1.03 -4.98 121.20 119.03 1dr3 s ILE 60 Ca 0.06 1.54 -0.33 0.00 0.00 0.00 0.00 60.65 61.93 1dr3 s ILE 60 Cb 0.09 -4.09 -0.15 0.00 0.01 0.00 0.00 42.46 38.31 1dr3 s ILE 60 CO 0.58 0.19 1.19 -2.65 0.00 0.00 0.00 174.94 174.24 1dr3 n PRO 61 N 4.15 1.26 -0.32 2.79 -0.02 -1.26 -4.83 135.00 136.76 1dr3 n PRO 61 Ca 0.01 0.45 0.12 0.00 -2.02 0.00 0.00 63.50 62.05 1dr3 n PRO 61 Cb 0.51 -1.96 0.33 0.00 -0.02 0.00 0.00 33.50 32.36 1dr3 n PRO 61 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1dr3 h GLU 62 N 3.43 0.76 0.00 -0.52 4.81 -1.93 0.10 114.58 121.23 1dr3 h GLU 62 Ca -0.43 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1dr3 h GLU 62 Cb 1.34 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1dr3 h GLU 62 CO 0.70 0.50 0.00 0.87 -0.73 0.00 0.00 179.01 180.36 1dr3 h LYS 63 N 0.78 0.00 -0.28 1.92 1.79 -2.03 -2.14 116.57 116.62 1dr3 h LYS 63 Ca 0.51 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.98 1dr3 h LYS 63 Cb 0.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 1dr3 h LYS 63 CO -0.28 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.18 1dr3 n ASN 64 N -3.05 1.80 -4.69 0.86 3.02 0.35 -4.89 115.26 108.67 1dr3 n ASN 64 Ca 0.01 -1.87 -0.33 0.00 -0.03 0.00 0.00 54.58 52.35 1dr3 n ASN 64 Cb 0.31 -0.18 -0.09 0.00 -0.61 0.00 0.00 39.78 39.21 1dr3 n ASN 64 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1dr3 s ARG 65 N -1.64 2.82 0.72 3.52 0.52 -0.81 -3.82 118.95 120.27 1dr3 s ARG 65 Ca 0.27 -0.58 -0.09 0.00 -0.52 0.00 0.00 55.73 54.81 1dr3 s ARG 65 Cb 0.15 -2.69 0.05 0.00 0.52 0.00 0.00 34.95 32.97 1dr3 s ARG 65 CO 0.21 0.64 1.07 -1.25 0.02 0.00 0.00 175.30 175.98 1dr3 s PRO 66 N -1.47 2.40 -0.20 3.54 0.04 -1.26 -4.94 135.00 133.11 1dr3 s PRO 66 Ca 0.19 0.08 -0.33 0.00 0.04 0.00 0.00 61.00 60.97 1dr3 s PRO 66 Cb -0.11 -2.08 -0.10 0.00 0.04 0.00 0.00 34.50 32.25 1dr3 s PRO 66 CO 0.09 -1.22 2.05 1.28 0.04 0.00 0.00 177.00 179.24 1dr3 n LEU 67 N -3.02 3.00 -4.65 -3.56 4.77 -1.25 -4.82 117.00 107.48 1dr3 n LEU 67 Ca 0.07 0.63 -0.44 0.00 -0.03 0.00 0.00 56.01 56.24 1dr3 n LEU 67 Cb 0.59 -1.38 -0.01 0.00 -2.33 0.00 0.00 43.42 40.29 1dr3 n LEU 67 CO 0.55 -0.40 0.76 1.17 -1.33 0.00 0.00 177.39 178.14 1dr3 n LYS 68 N 7.59 1.76 -1.29 3.23 4.81 -1.26 -2.89 118.16 130.11 1dr3 n LYS 68 Ca 0.30 0.62 -0.10 0.00 -0.87 0.00 0.00 58.31 58.26 1dr3 n LYS 68 Cb 0.31 -2.11 -0.04 0.00 0.02 0.00 0.00 35.03 33.20 1dr3 n LYS 68 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1dr3 n ASP 69 N 1.11 -4.53 -4.10 3.14 8.00 -1.26 -4.96 116.55 113.95 1dr3 n ASP 69 Ca 0.08 0.25 -0.11 0.00 0.71 0.00 0.00 54.79 55.72 1dr3 n ASP 69 Cb 0.34 -2.92 -0.11 0.00 -0.02 0.00 0.00 41.12 38.41 1dr3 n ASP 69 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1dr3 s ARG 70 N -2.71 0.63 -0.37 -1.24 0.52 -1.14 -4.39 118.95 110.25 1dr3 s ARG 70 Ca 0.00 -1.03 -0.25 0.00 -0.52 0.00 0.00 55.73 53.93 1dr3 s ARG 70 Cb 0.00 -0.12 0.01 0.00 0.52 0.00 0.00 34.95 35.36 1dr3 s ARG 70 CO 0.00 -0.01 0.90 0.42 0.02 0.00 0.00 175.30 176.62 1dr3 s ILE 71 N -2.64 4.62 -0.21 1.52 1.01 -0.03 -4.80 121.20 120.66 1dr3 s ILE 71 Ca 0.00 1.14 -0.21 0.00 0.00 0.00 0.00 60.65 61.58 1dr3 s ILE 71 Cb -0.01 -4.31 -0.02 0.00 0.01 0.00 0.00 42.46 38.13 1dr3 s ILE 71 CO -0.03 -0.51 0.63 0.20 0.00 0.00 0.00 174.94 175.23 1dr3 s ASN 72 N 1.86 6.66 -0.16 3.58 0.02 -1.26 -0.97 114.94 124.68 1dr3 s ASN 72 Ca 0.37 0.81 0.01 0.00 -1.02 0.00 0.00 52.86 53.02 1dr3 s ASN 72 Cb -0.12 -2.35 0.02 0.00 0.02 0.00 0.00 41.25 38.82 1dr3 s ASN 72 CO 0.18 -0.30 -0.18 -0.63 0.02 0.00 0.00 177.10 176.19 1dr3 s ILE 73 N 2.09 1.86 -0.05 0.60 1.01 -0.59 -1.76 121.20 124.36 1dr3 s ILE 73 Ca 0.28 -0.83 -0.03 0.00 0.00 0.00 0.00 60.65 60.08 1dr3 s ILE 73 Cb -0.16 -1.69 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 1dr3 s ILE 73 CO 0.10 0.51 0.09 -0.69 0.00 0.00 0.00 174.94 174.94 1dr3 s VAL 74 N 1.25 4.89 -0.10 2.92 1.01 -0.47 -1.29 120.40 128.61 1dr3 s VAL 74 Ca 0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 1dr3 s VAL 74 Cb -0.14 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 1dr3 s VAL 74 CO -0.09 0.47 -0.00 -0.76 0.00 0.00 0.00 175.10 174.71 1dr3 s LEU 75 N -1.40 3.55 -0.28 3.92 1.43 0.37 -1.16 118.68 125.11 1dr3 s LEU 75 Ca 0.19 0.11 -0.23 0.00 -1.03 0.00 0.00 54.13 53.17 1dr3 s LEU 75 Cb -0.12 -1.82 0.12 0.00 0.03 0.00 0.00 46.19 44.40 1dr3 s LEU 75 CO 0.09 0.34 1.00 -0.55 0.23 0.00 0.00 176.35 177.47 1dr3 s SER 76 N -0.67 -0.49 0.13 2.29 0.15 -0.51 -2.76 113.70 111.85 1dr3 s SER 76 Ca 0.11 0.90 0.23 0.00 0.70 0.00 0.00 55.95 57.89 1dr3 s SER 76 Cb -0.12 0.97 0.07 0.00 -1.71 0.00 0.00 66.02 65.24 1dr3 s SER 76 CO 0.02 -0.15 1.07 0.54 1.20 0.00 0.00 173.24 175.92 1dr3 n ARG 77 N 2.55 0.46 -0.10 5.44 1.74 -1.26 -4.12 116.66 121.37 1dr3 n ARG 77 Ca -0.14 0.07 -0.15 0.00 -0.77 0.00 0.00 57.85 56.86 1dr3 n ARG 77 Cb 0.56 -1.72 -0.14 0.00 -1.02 0.00 0.00 32.46 30.14 1dr3 n ARG 77 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1dr3 n GLU 78 N -2.36 0.67 -2.28 5.56 1.02 -1.26 -4.99 120.64 117.00 1dr3 n GLU 78 Ca 0.01 0.11 -0.35 0.00 -0.02 0.00 0.00 57.16 56.92 1dr3 n GLU 78 Cb 0.50 -1.56 -0.00 0.00 -0.02 0.00 0.00 31.44 30.36 1dr3 n GLU 78 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1dr3 s LEU 79 N -6.18 3.75 -0.14 -4.62 1.43 -1.26 -4.96 118.68 106.69 1dr3 s LEU 79 Ca -0.23 2.13 0.09 0.00 -1.03 0.00 0.00 54.13 55.09 1dr3 s LEU 79 Cb 0.08 -4.58 -0.23 0.00 0.03 0.00 0.00 46.19 41.49 1dr3 s LEU 79 CO 0.71 -1.17 0.27 1.17 0.23 0.00 0.00 176.35 177.56 1dr3 n LYS 80 N -1.29 0.68 -3.98 1.70 3.00 -1.26 -4.97 118.16 112.03 1dr3 n LYS 80 Ca 0.11 0.17 -0.09 0.00 -0.00 0.00 0.00 58.31 58.50 1dr3 n LYS 80 Cb 0.51 -1.64 -0.10 0.00 0.00 0.00 0.00 35.03 33.80 1dr3 n LYS 80 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1dr3 s GLU 81 N -2.54 0.46 0.30 1.64 2.02 -1.26 -5.13 118.70 114.19 1dr3 s GLU 81 Ca -0.15 -0.76 -0.29 0.00 0.02 0.00 0.00 54.97 53.79 1dr3 s GLU 81 Cb 0.07 0.17 -0.12 0.00 0.10 0.00 0.00 34.13 34.35 1dr3 s GLU 81 CO 0.78 -0.09 1.38 0.00 0.02 0.00 0.00 175.26 177.35 1dr3 n ALA 82 N 1.05 1.47 -1.51 5.21 0.00 -1.26 -4.90 120.51 120.56 1dr3 n ALA 82 Ca -0.20 0.38 -0.35 0.00 0.00 0.00 0.00 53.44 53.26 1dr3 n ALA 82 Cb 0.57 -2.30 0.08 0.00 0.00 0.00 0.00 19.45 17.80 1dr3 n ALA 82 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1dr3 s PRO 83 N -1.23 2.37 -0.30 0.00 0.02 -1.26 -4.81 135.00 129.79 1dr3 s PRO 83 Ca 0.61 1.84 -0.37 0.00 0.02 0.00 0.00 61.00 63.10 1dr3 s PRO 83 Cb -0.58 -1.85 -0.13 0.00 0.02 0.00 0.00 34.50 31.96 1dr3 s PRO 83 CO 0.56 -1.68 2.03 1.17 -0.33 0.00 0.00 177.00 178.76 1dr3 n LYS 84 N -2.35 1.21 0.00 5.54 3.00 -1.26 -1.09 118.16 123.21 1dr3 n LYS 84 Ca 0.14 0.38 0.00 0.00 -0.00 0.00 0.00 58.31 58.83 1dr3 n LYS 84 Cb 0.50 -2.36 0.00 0.00 0.00 0.00 0.00 35.03 33.17 1dr3 n LYS 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1dr3 n GLY 85 N 5.69 2.98 3.82 3.14 0.00 -1.26 -4.92 105.19 114.64 1dr3 n GLY 85 Ca 0.35 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.05 1dr3 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dr3 s ALA 86 N -2.67 3.02 0.00 4.61 0.00 -0.25 -4.10 121.76 122.37 1dr3 s ALA 86 Ca 0.00 0.37 -0.19 0.00 0.00 0.00 0.00 51.96 52.15 1dr3 s ALA 86 Cb 0.00 -3.16 -0.30 0.00 0.00 0.00 0.00 23.12 19.66 1dr3 s ALA 86 CO 0.00 -0.04 1.00 0.45 0.00 0.00 0.00 175.76 177.18 1dr3 h HIS 87 N 1.59 0.76 -3.44 0.00 -0.00 -1.65 -3.45 115.15 108.95 1dr3 h HIS 87 Ca -0.48 -0.51 -0.12 0.00 -0.00 0.00 0.00 60.37 59.26 1dr3 h HIS 87 Cb 1.19 -0.05 -0.18 0.00 -0.00 0.00 0.00 27.41 28.36 1dr3 h HIS 87 CO 0.62 1.37 -0.38 0.71 -0.00 0.00 0.00 177.93 180.25 1dr3 s TYR 88 N -2.75 -0.00 -0.02 2.45 2.02 -0.93 -5.03 117.35 113.10 1dr3 s TYR 88 Ca -0.12 -0.14 0.08 0.00 -0.37 0.00 0.00 57.07 56.52 1dr3 s TYR 88 Cb 0.03 -0.00 -0.02 0.00 -0.40 0.00 0.00 41.96 41.57 1dr3 s TYR 88 CO 0.88 -0.40 -0.25 -1.17 -1.57 0.00 0.00 175.55 173.04 1dr3 s LEU 89 N -1.83 2.05 0.03 -1.29 2.96 -1.26 -1.37 118.68 117.98 1dr3 s LEU 89 Ca -0.08 -0.45 0.00 0.00 -0.22 0.00 0.00 54.13 53.38 1dr3 s LEU 89 Cb -0.03 -1.26 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 1dr3 s LEU 89 CO -0.01 0.30 -0.04 -0.44 -1.32 0.00 0.00 176.35 174.83 1dr3 s SER 90 N -0.60 0.48 0.01 3.68 0.01 -0.31 -4.95 113.70 112.02 1dr3 s SER 90 Ca 0.09 -0.61 0.23 0.00 1.31 0.00 0.00 55.95 56.97 1dr3 s SER 90 Cb -0.09 0.10 0.07 0.00 0.21 0.00 0.00 66.02 66.31 1dr3 s SER 90 CO -0.01 -0.33 1.09 0.29 0.41 0.00 0.00 173.24 174.69 1dr3 n LYS 91 N 1.26 0.08 -3.71 12.44 5.02 -1.26 -1.42 118.16 130.58 1dr3 n LYS 91 Ca -0.22 -0.01 -0.08 0.00 -2.02 0.00 0.00 58.31 55.98 1dr3 n LYS 91 Cb 0.56 -1.52 -0.02 0.00 -0.02 0.00 0.00 35.03 34.03 1dr3 n LYS 91 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1dr3 s SER 92 N -3.25 -0.35 0.15 4.39 1.04 -1.26 -4.58 113.70 109.83 1dr3 s SER 92 Ca 0.08 -0.39 -0.16 0.00 0.48 0.00 0.00 55.95 55.95 1dr3 s SER 92 Cb 0.16 0.66 0.02 0.00 0.10 0.00 0.00 66.02 66.96 1dr3 s SER 92 CO 0.80 -1.18 1.79 0.25 0.98 0.00 0.00 173.24 175.87 1dr3 h LEU 93 N 2.00 0.50 -0.31 2.42 5.85 -1.99 -1.11 115.31 122.66 1dr3 h LEU 93 Ca -0.24 -0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.50 1dr3 h LEU 93 Cb 1.27 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 42.09 1dr3 h LEU 93 CO 0.28 0.40 -0.25 0.44 -0.34 0.00 0.00 178.44 178.97 1dr3 h ASP 94 N 0.55 -0.82 -0.42 1.25 5.19 -1.99 0.97 116.42 121.16 1dr3 h ASP 94 Ca 0.15 0.15 0.08 0.00 -0.62 0.00 0.00 57.03 56.80 1dr3 h ASP 94 Cb -0.01 0.40 -0.08 0.00 0.18 0.00 0.00 39.33 39.82 1dr3 h ASP 94 CO -0.03 -0.28 -0.09 0.44 -3.12 0.00 0.00 179.24 176.17 1dr3 h ASP 95 N -0.22 -0.35 -0.73 6.45 3.32 -1.90 0.15 116.42 123.14 1dr3 h ASP 95 Ca 0.16 0.12 0.03 0.00 0.02 0.00 0.00 57.03 57.36 1dr3 h ASP 95 Cb 0.47 0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.22 1dr3 h ASP 95 CO -0.44 -0.12 0.46 0.00 -1.72 0.00 0.00 179.24 177.42 1dr3 h ALA 96 N 1.41 0.96 -0.24 3.45 0.00 0.44 -0.05 119.26 125.24 1dr3 h ALA 96 Ca 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1dr3 h ALA 96 Cb 0.31 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1dr3 h ALA 96 CO -0.42 0.26 0.13 -0.07 0.00 0.00 0.00 179.25 179.15 1dr3 h LEU 97 N 0.91 0.30 -0.29 0.00 3.38 0.34 -2.35 115.31 117.60 1dr3 h LEU 97 Ca 0.29 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.22 1dr3 h LEU 97 Cb 0.00 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 1dr3 h LEU 97 CO -0.11 0.30 0.03 0.00 0.09 0.00 0.00 178.44 178.76 1dr3 h ALA 98 N 1.01 0.28 -0.66 1.53 0.00 -0.42 -1.88 119.26 119.12 1dr3 h ALA 98 Ca 0.08 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.18 1dr3 h ALA 98 Cb 0.07 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 1dr3 h ALA 98 CO -0.01 -0.38 0.20 1.25 0.00 0.00 0.00 179.25 180.31 1dr3 h LEU 99 N 0.13 0.13 -0.58 0.00 5.85 -0.82 -0.63 115.31 119.39 1dr3 h LEU 99 Ca 0.14 0.11 0.08 0.00 0.84 0.00 0.00 57.88 59.04 1dr3 h LEU 99 Cb 0.16 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.25 1dr3 h LEU 99 CO -0.20 0.06 0.24 -0.07 -0.34 0.00 0.00 178.44 178.13 1dr3 h LEU 100 N 0.34 0.29 -1.63 2.25 3.38 -0.81 0.04 115.31 119.17 1dr3 h LEU 100 Ca 0.35 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.35 1dr3 h LEU 100 Cb 0.52 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 1dr3 h LEU 100 CO -0.40 0.18 -0.17 0.44 0.09 0.00 0.00 178.44 178.59 1dr3 h ASP 101 N 0.45 0.00 -2.63 -0.43 3.32 -0.76 -2.05 116.42 114.32 1dr3 h ASP 101 Ca 0.28 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.75 1dr3 h ASP 101 Cb 0.29 0.00 0.18 0.00 0.22 0.00 0.00 39.33 40.02 1dr3 h ASP 101 CO -0.25 0.17 -0.73 -0.24 -1.72 0.00 0.00 179.24 176.47 1dr3 n SER 102 N -3.57 -2.23 -0.01 6.45 2.88 -0.00 -4.44 113.62 112.70 1dr3 n SER 102 Ca -0.01 0.65 -0.11 0.00 -1.33 0.00 0.00 58.87 58.08 1dr3 n SER 102 Cb 0.31 -1.05 -0.05 0.00 -0.75 0.00 0.00 64.21 62.67 1dr3 n SER 102 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1dr3 h PRO 103 N -0.02 0.16 -0.98 -1.46 0.13 -1.87 0.10 132.00 128.07 1dr3 h PRO 103 Ca -0.44 -0.01 0.13 0.00 -0.87 0.00 0.00 66.00 64.81 1dr3 h PRO 103 Cb 1.40 -0.04 -0.08 0.00 0.13 0.00 0.00 31.00 32.41 1dr3 h PRO 103 CO 0.43 0.11 0.62 1.05 -0.23 0.00 0.00 178.00 179.98 1dr3 h GLU 104 N 0.17 0.88 0.00 0.86 9.09 -1.92 -3.25 114.58 120.41 1dr3 h GLU 104 Ca 0.05 -0.05 -0.11 0.00 0.05 0.00 0.00 59.36 59.30 1dr3 h GLU 104 Cb -0.01 -0.20 -0.02 0.00 -1.65 0.00 0.00 28.75 26.88 1dr3 h GLU 104 CO -0.02 0.58 -0.71 -0.07 0.05 0.00 0.00 179.01 178.84 1dr3 h LEU 105 N 0.90 0.00 -0.62 3.06 3.38 -1.77 -3.39 115.31 116.88 1dr3 h LEU 105 Ca 0.49 -0.42 0.13 0.00 0.09 0.00 0.00 57.88 58.17 1dr3 h LEU 105 Cb 0.58 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.22 1dr3 h LEU 105 CO -0.26 1.11 -0.15 1.17 0.09 0.00 0.00 178.44 180.41 1dr3 n LYS 106 N -4.55 -0.06 0.02 1.13 3.00 0.34 0.20 118.16 118.25 1dr3 n LYS 106 Ca -0.18 0.97 0.13 0.00 -0.00 0.00 0.00 58.31 59.22 1dr3 n LYS 106 Cb 0.47 -1.45 0.49 0.00 0.00 0.00 0.00 35.03 34.54 1dr3 n LYS 106 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1dr3 n SER 107 N -5.00 0.28 0.02 3.14 3.41 -1.25 -3.47 113.62 110.76 1dr3 n SER 107 Ca 0.10 0.36 0.11 0.00 -0.26 0.00 0.00 58.87 59.19 1dr3 n SER 107 Cb 0.32 -0.39 -0.04 0.00 -0.26 0.00 0.00 64.21 63.85 1dr3 n SER 107 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1dr3 n LYS 108 N -1.68 0.36 -4.42 4.33 4.81 0.52 -4.83 118.16 117.25 1dr3 n LYS 108 Ca 0.06 -0.03 -0.34 0.00 -0.87 0.00 0.00 58.31 57.13 1dr3 n LYS 108 Cb 0.36 -1.59 -0.11 0.00 0.02 0.00 0.00 35.03 33.71 1dr3 n LYS 108 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1dr3 s VAL 109 N -3.26 3.98 0.00 3.15 1.01 -0.51 -1.63 120.40 123.13 1dr3 s VAL 109 Ca 0.01 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1dr3 s VAL 109 Cb 0.14 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.81 1dr3 s VAL 109 CO 0.83 0.53 0.00 -0.67 0.00 0.00 0.00 175.10 175.80 1dr3 n ASP 110 N 3.01 0.00 -4.90 3.32 2.03 0.11 -4.87 116.55 115.25 1dr3 n ASP 110 Ca -0.18 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 54.83 1dr3 n ASP 110 Cb 0.53 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.88 1dr3 n ASP 110 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1dr3 s MET 111 N 0.00 3.34 -0.22 -0.67 -1.94 -1.26 -4.95 119.30 113.60 1dr3 s MET 111 Ca 0.00 -0.49 -0.06 0.00 -1.71 0.00 0.00 55.69 53.43 1dr3 s MET 111 Cb 0.00 -2.98 -0.02 0.00 2.01 0.00 0.00 34.83 33.83 1dr3 s MET 111 CO 0.00 0.60 0.02 0.08 -0.01 0.00 0.00 175.02 175.71 1dr3 s VAL 112 N -1.50 4.00 -0.09 -6.03 1.01 -1.26 0.25 120.40 116.78 1dr3 s VAL 112 Ca 0.34 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.06 1dr3 s VAL 112 Cb -0.13 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.40 1dr3 s VAL 112 CO 0.27 0.39 -0.16 0.26 0.00 0.00 0.00 175.10 175.86 1dr3 s TRP 113 N 1.33 2.70 -0.27 5.22 0.52 0.22 -2.46 118.94 126.21 1dr3 s TRP 113 Ca 0.04 -0.55 -0.13 0.00 0.02 0.00 0.00 56.10 55.49 1dr3 s TRP 113 Cb -0.15 -1.73 -0.04 0.00 -1.15 0.00 0.00 33.47 30.40 1dr3 s TRP 113 CO 0.01 -0.12 0.27 0.42 0.02 0.00 0.00 176.95 177.56 1dr3 s ILE 114 N -0.05 5.25 -0.16 2.03 -1.09 0.26 -0.20 121.20 127.25 1dr3 s ILE 114 Ca -0.04 0.35 0.18 0.00 -2.23 0.00 0.00 60.65 58.91 1dr3 s ILE 114 Cb -0.14 -3.60 0.44 0.00 -1.58 0.00 0.00 42.46 37.57 1dr3 s ILE 114 CO 0.04 0.22 1.32 1.33 -1.23 0.00 0.00 174.94 176.61 1dr3 n VAL 115 N 5.02 2.13 -1.12 2.92 0.24 -0.61 -1.67 118.33 125.24 1dr3 n VAL 115 Ca -0.12 -2.03 0.00 0.00 -2.04 0.00 0.00 64.34 60.15 1dr3 n VAL 115 Cb 0.51 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 1dr3 n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dr3 n GLY 116 N -0.87 -2.52 0.00 7.63 0.00 -1.26 -4.94 105.19 103.23 1dr3 n GLY 116 Ca 0.19 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1dr3 n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dr3 n GLY 117 N -0.46 0.63 0.38 -0.02 0.00 -1.26 -1.31 105.19 103.16 1dr3 n GLY 117 Ca 0.00 -1.63 -0.11 0.00 0.00 0.00 0.00 46.02 44.28 1dr3 n GLY 117 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1dr3 h THR 118 N 0.00 0.00 -0.97 2.61 2.02 -1.98 0.15 112.91 114.73 1dr3 h THR 118 Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.22 1dr3 h THR 118 Cb 0.00 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.35 1dr3 h THR 118 CO 0.00 0.00 0.64 0.00 0.37 0.00 0.00 175.52 176.53 1dr3 h ALA 119 N 0.15 1.37 -0.51 6.16 0.00 -1.96 -0.11 119.26 124.34 1dr3 h ALA 119 Ca 0.11 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1dr3 h ALA 119 Cb 0.42 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1dr3 h ALA 119 CO -0.73 0.54 0.28 0.28 0.00 0.00 0.00 179.25 179.62 1dr3 h VAL 120 N 1.24 1.18 -0.40 0.00 2.07 -1.40 -1.71 116.25 117.23 1dr3 h VAL 120 Ca 0.39 -0.47 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 1dr3 h VAL 120 Cb -0.00 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1dr3 h VAL 120 CO -0.12 0.19 0.05 1.88 0.02 0.00 0.00 177.57 179.59 1dr3 h TYR 121 N 0.68 0.73 0.41 1.57 0.05 -0.21 -2.15 116.97 118.05 1dr3 h TYR 121 Ca 0.18 -0.11 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 1dr3 h TYR 121 Cb 0.06 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.59 1dr3 h TYR 121 CO -0.01 0.72 -0.36 -0.22 -1.05 0.00 0.00 178.16 177.24 1dr3 h LYS 122 N 0.52 -0.75 -0.64 4.88 3.64 -0.88 -0.13 116.57 123.22 1dr3 h LYS 122 Ca 0.12 0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.68 1dr3 h LYS 122 Cb 0.40 0.17 -0.10 0.00 -0.41 0.00 0.00 32.23 32.29 1dr3 h LYS 122 CO 0.01 -0.50 0.09 0.00 -2.27 0.00 0.00 179.45 176.79 1dr3 h ALA 123 N -0.34 0.73 -0.41 5.00 0.00 -1.29 -0.94 119.26 122.00 1dr3 h ALA 123 Ca -0.03 0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1dr3 h ALA 123 Cb 0.68 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1dr3 h ALA 123 CO -0.03 -0.35 -0.20 0.00 0.00 0.00 0.00 179.25 178.67 1dr3 h ALA 124 N 1.54 0.87 -0.53 0.00 0.00 -1.13 -3.04 119.26 116.97 1dr3 h ALA 124 Ca 0.34 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1dr3 h ALA 124 Cb 0.54 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1dr3 h ALA 124 CO -0.47 0.63 0.25 0.52 0.00 0.00 0.00 179.25 180.18 1dr3 h MET 125 N 0.70 0.75 0.00 0.00 2.07 0.31 -2.54 114.93 116.22 1dr3 h MET 125 Ca 0.10 -0.09 0.00 0.00 -2.07 0.00 0.00 59.70 57.64 1dr3 h MET 125 Cb 0.72 -0.14 0.00 0.00 -1.87 0.00 0.00 31.60 30.30 1dr3 h MET 125 CO 0.06 0.58 0.00 0.93 1.07 0.00 0.00 176.91 179.55 1dr3 h GLU 126 N 0.75 0.00 -6.68 1.72 5.08 -1.25 -3.45 114.58 110.75 1dr3 h GLU 126 Ca 0.19 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 58.02 1dr3 h GLU 126 Cb 0.09 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.39 1dr3 h GLU 126 CO -0.02 0.00 0.82 0.15 -1.00 0.00 0.00 179.01 178.96 1dr3 s LYS 127 N -3.38 4.24 -1.39 2.33 -0.14 -0.96 -4.85 119.74 115.58 1dr3 s LYS 127 Ca 0.05 2.34 -0.13 0.00 -1.36 0.00 0.00 55.97 56.87 1dr3 s LYS 127 Cb 0.07 -3.13 0.09 0.00 -1.68 0.00 0.00 37.83 33.17 1dr3 s LYS 127 CO 0.62 -0.52 2.08 -0.35 -0.76 0.00 0.00 175.35 176.42 1dr3 n PRO 128 N 3.14 3.13 -3.97 -1.68 -0.04 -1.26 -4.82 135.00 129.50 1dr3 n PRO 128 Ca 0.10 -2.96 -0.08 0.00 -0.04 0.00 0.00 63.50 60.52 1dr3 n PRO 128 Cb 0.39 -3.17 -0.09 0.00 -0.04 0.00 0.00 33.50 30.59 1dr3 n PRO 128 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1dr3 s ILE 129 N 2.26 0.16 0.21 0.52 2.07 -1.26 -4.95 121.20 120.21 1dr3 s ILE 129 Ca 0.45 -1.33 -0.32 0.00 -1.41 0.00 0.00 60.65 58.03 1dr3 s ILE 129 Cb 0.12 -1.16 -0.12 0.00 0.13 0.00 0.00 42.46 41.43 1dr3 s ILE 129 CO -0.05 -0.74 1.69 0.59 -1.91 0.00 0.00 174.94 174.52 1dr3 n ASN 130 N 0.43 3.86 -3.73 4.50 4.13 -1.26 -4.65 115.26 118.54 1dr3 n ASN 130 Ca -0.17 1.07 -0.12 0.00 1.68 0.00 0.00 54.58 57.04 1dr3 n ASN 130 Cb 0.60 -1.56 -0.11 0.00 -1.54 0.00 0.00 39.78 37.17 1dr3 n ASN 130 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 1dr3 s HIS 131 N 1.01 -0.46 -0.14 3.10 2.46 -0.54 -0.58 115.29 120.14 1dr3 s HIS 131 Ca 0.74 1.06 0.02 0.00 0.47 0.00 0.00 55.06 57.35 1dr3 s HIS 131 Cb -0.53 0.17 0.00 0.00 -0.13 0.00 0.00 32.58 32.10 1dr3 s HIS 131 CO 0.35 -0.25 -0.19 1.03 -2.47 0.00 0.00 174.74 173.21 1dr3 s ARG 132 N 0.70 3.12 -0.22 2.88 0.52 -0.61 0.30 118.95 125.63 1dr3 s ARG 132 Ca -0.04 -0.81 -0.05 0.00 -0.52 0.00 0.00 55.73 54.31 1dr3 s ARG 132 Cb -0.05 -2.51 -0.01 0.00 0.52 0.00 0.00 34.95 32.90 1dr3 s ARG 132 CO -0.05 0.03 -0.01 -1.17 0.02 0.00 0.00 175.30 174.12 1dr3 s LEU 133 N 0.75 3.05 -0.42 2.53 2.96 0.13 -1.44 118.68 126.24 1dr3 s LEU 133 Ca -0.08 -0.33 -0.13 0.00 -0.22 0.00 0.00 54.13 53.37 1dr3 s LEU 133 Cb -0.16 -1.79 0.05 0.00 0.50 0.00 0.00 46.19 44.79 1dr3 s LEU 133 CO 0.00 -0.02 0.29 -0.36 -1.32 0.00 0.00 176.35 174.94 1dr3 s PHE 134 N 1.47 3.26 -0.14 5.38 0.40 -0.09 -0.23 117.98 128.04 1dr3 s PHE 134 Ca 0.05 -0.97 -0.01 0.00 -0.60 0.00 0.00 56.93 55.40 1dr3 s PHE 134 Cb -0.14 -2.75 -0.02 0.00 0.51 0.00 0.00 43.02 40.61 1dr3 s PHE 134 CO -0.01 -0.71 -0.10 0.08 0.70 0.00 0.00 175.22 175.18 1dr3 s VAL 135 N 1.58 3.32 -0.33 -0.44 1.01 0.41 -1.37 120.40 124.59 1dr3 s VAL 135 Ca 0.03 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 61.34 1dr3 s VAL 135 Cb -0.21 -2.42 -0.00 0.00 0.00 0.00 0.00 36.38 33.75 1dr3 s VAL 135 CO 0.07 0.52 0.19 -0.89 0.00 0.00 0.00 175.10 174.98 1dr3 s THR 136 N 0.33 4.79 -0.46 3.92 2.01 -0.55 -0.47 115.64 125.21 1dr3 s THR 136 Ca -0.08 -0.43 -0.19 0.00 0.31 0.00 0.00 61.69 61.30 1dr3 s THR 136 Cb -0.15 -3.48 0.04 0.00 0.01 0.00 0.00 72.50 68.92 1dr3 s THR 136 CO 0.05 0.00 0.56 -0.13 -0.69 0.00 0.00 174.62 174.41 1dr3 s ARG 137 N 1.64 3.14 -0.31 4.92 0.52 0.38 -1.04 118.95 128.20 1dr3 s ARG 137 Ca 0.05 -0.76 -0.22 0.00 -0.52 0.00 0.00 55.73 54.28 1dr3 s ARG 137 Cb -0.17 -4.03 -0.00 0.00 0.52 0.00 0.00 34.95 31.26 1dr3 s ARG 137 CO 0.07 -1.06 0.73 0.42 0.02 0.00 0.00 175.30 175.48 1dr3 s ILE 138 N 2.49 4.84 0.00 1.52 1.01 0.31 -0.47 121.20 130.91 1dr3 s ILE 138 Ca 0.15 1.05 -0.05 0.00 0.00 0.00 0.00 60.65 61.80 1dr3 s ILE 138 Cb -0.18 -4.09 -0.23 0.00 0.01 0.00 0.00 42.46 37.97 1dr3 s ILE 138 CO 0.14 -0.22 3.30 0.18 0.00 0.00 0.00 174.94 178.34 1dr3 n LEU 139 N 6.09 5.03 -3.81 2.97 4.77 -0.23 -2.96 117.00 128.86 1dr3 n LEU 139 Ca 0.02 -2.97 -0.09 0.00 -0.03 0.00 0.00 56.01 52.94 1dr3 n LEU 139 Cb 0.48 -1.33 -0.03 0.00 -2.33 0.00 0.00 43.42 40.22 1dr3 n LEU 139 CO 0.49 1.53 0.34 -1.00 -1.33 0.00 0.00 177.39 177.41 1dr3 s HIS 140 N 0.96 -0.09 -0.06 -1.77 3.76 -1.26 -4.85 115.29 111.98 1dr3 s HIS 140 Ca 0.56 -0.29 0.02 0.00 -0.15 0.00 0.00 55.06 55.19 1dr3 s HIS 140 Cb 0.27 0.49 -0.03 0.00 1.11 0.00 0.00 32.58 34.42 1dr3 s HIS 140 CO 0.00 -1.05 -0.09 -1.21 -0.85 0.00 0.00 174.74 171.54 1dr3 s GLU 141 N -3.91 2.67 0.05 1.40 2.02 -1.26 -0.83 118.70 118.84 1dr3 s GLU 141 Ca 0.12 -0.59 0.03 0.00 0.02 0.00 0.00 54.97 54.54 1dr3 s GLU 141 Cb -0.03 -2.53 -0.03 0.00 0.10 0.00 0.00 34.13 31.65 1dr3 s GLU 141 CO 0.02 0.65 -0.09 -0.06 0.02 0.00 0.00 175.26 175.80 1dr3 s PHE 142 N -0.79 0.79 0.12 1.61 0.40 -1.26 -5.01 117.98 113.84 1dr3 s PHE 142 Ca 0.12 -0.49 -0.31 0.00 -0.60 0.00 0.00 56.93 55.65 1dr3 s PHE 142 Cb -0.11 -0.46 -0.09 0.00 0.51 0.00 0.00 43.02 42.87 1dr3 s PHE 142 CO 0.01 -0.05 1.52 -1.83 0.70 0.00 0.00 175.22 175.57 1dr3 s GLU 143 N -1.60 4.25 0.06 0.44 -1.05 -1.26 -4.90 118.70 114.63 1dr3 s GLU 143 Ca -0.08 2.24 0.04 0.00 -0.15 0.00 0.00 54.97 57.01 1dr3 s GLU 143 Cb -0.10 -3.31 -0.03 0.00 -0.44 0.00 0.00 34.13 30.26 1dr3 s GLU 143 CO 0.01 -0.58 -0.11 -1.12 0.95 0.00 0.00 175.26 174.41 1dr3 s SER 144 N 1.45 1.30 0.00 0.83 0.01 -1.26 -4.74 113.70 111.29 1dr3 s SER 144 Ca 0.69 -0.59 0.02 0.00 1.31 0.00 0.00 55.95 57.38 1dr3 s SER 144 Cb -0.40 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 65.82 1dr3 s SER 144 CO 0.31 -0.14 0.38 -0.90 0.41 0.00 0.00 173.24 173.30 1dr3 n ASP 145 N 1.36 0.76 -3.98 2.44 5.68 0.14 -4.98 116.55 117.96 1dr3 n ASP 145 Ca -0.22 -0.88 -0.17 0.00 -0.50 0.00 0.00 54.79 53.02 1dr3 n ASP 145 Cb 0.54 0.35 -0.15 0.00 -1.14 0.00 0.00 41.12 40.73 1dr3 n ASP 145 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1dr3 s THR 146 N -0.49 0.54 0.13 2.12 2.01 -0.92 -5.00 115.64 114.03 1dr3 s THR 146 Ca 0.01 -0.29 0.05 0.00 0.31 0.00 0.00 61.69 61.77 1dr3 s THR 146 Cb 0.01 -0.46 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 1dr3 s THR 146 CO 0.03 0.15 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.64 1dr3 s PHE 147 N -0.15 1.27 0.08 4.92 0.40 -1.26 -0.60 117.98 122.64 1dr3 s PHE 147 Ca 0.02 -0.65 -0.30 0.00 -0.60 0.00 0.00 56.93 55.40 1dr3 s PHE 147 Cb -0.03 -0.66 -0.05 0.00 0.51 0.00 0.00 43.02 42.79 1dr3 s PHE 147 CO -0.00 0.09 1.04 0.12 0.70 0.00 0.00 175.22 177.17 1dr3 s PHE 148 N -2.63 3.65 0.91 0.36 5.36 0.09 -4.65 117.98 121.07 1dr3 s PHE 148 Ca 0.11 1.64 -0.11 0.00 -0.96 0.00 0.00 56.93 57.61 1dr3 s PHE 148 Cb -0.02 -3.19 0.14 0.00 -0.34 0.00 0.00 43.02 39.61 1dr3 s PHE 148 CO 0.01 -0.30 1.12 -1.25 -1.46 0.00 0.00 175.22 173.34 1dr3 s PRO 149 N 0.42 1.11 0.04 10.12 0.04 -1.26 -4.94 135.00 140.53 1dr3 s PRO 149 Ca 0.51 1.32 -0.31 0.00 0.04 0.00 0.00 61.00 62.57 1dr3 s PRO 149 Cb -0.25 -1.75 -0.06 0.00 0.04 0.00 0.00 34.50 32.47 1dr3 s PRO 149 CO 0.30 -2.49 1.34 -1.21 0.04 0.00 0.00 177.00 174.98 1dr3 s GLU 150 N -4.71 4.33 -0.05 4.56 2.02 -1.26 -5.02 118.70 118.56 1dr3 s GLU 150 Ca 0.65 1.93 -0.16 0.00 0.02 0.00 0.00 54.97 57.42 1dr3 s GLU 150 Cb -0.21 -3.42 -0.05 0.00 0.10 0.00 0.00 34.13 30.54 1dr3 s GLU 150 CO 0.58 -0.45 0.41 -1.50 0.02 0.00 0.00 175.26 174.32 1dr3 s ILE 151 N 1.70 5.11 -0.75 -1.63 2.07 -1.26 -5.02 121.20 121.41 1dr3 s ILE 151 Ca 0.62 0.83 -0.26 0.00 -1.41 0.00 0.00 60.65 60.44 1dr3 s ILE 151 Cb -0.32 -3.73 0.01 0.00 0.13 0.00 0.00 42.46 38.55 1dr3 s ILE 151 CO 0.28 0.49 1.50 -0.62 -1.91 0.00 0.00 174.94 174.68 1dr3 s ASP 152 N -0.42 5.90 0.27 4.50 -1.08 -1.26 -4.82 116.67 119.75 1dr3 s ASP 152 Ca 0.23 -0.38 0.17 0.00 -0.52 0.00 0.00 52.55 52.05 1dr3 s ASP 152 Cb -0.16 -2.55 0.93 0.00 -1.46 0.00 0.00 42.92 39.68 1dr3 s ASP 152 CO 0.11 -2.00 1.51 -1.22 0.52 0.00 0.00 175.17 174.09 1dr3 n TYR 153 N 10.54 0.58 0.08 -5.34 4.01 -1.26 -0.73 117.16 125.03 1dr3 n TYR 153 Ca 0.14 0.30 -0.09 0.00 -0.16 0.00 0.00 57.90 58.10 1dr3 n TYR 153 Cb 0.50 -0.97 -0.10 0.00 -0.31 0.00 0.00 39.34 38.46 1dr3 n TYR 153 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1dr3 h LYS 154 N 0.00 0.08 0.02 -0.72 1.57 -2.03 -3.37 116.57 112.12 1dr3 h LYS 154 Ca 0.00 -0.12 -0.26 0.00 -1.87 0.00 0.00 60.65 58.39 1dr3 h LYS 154 Cb 0.05 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 1dr3 h LYS 154 CO 0.00 1.02 -1.44 -0.25 -0.57 0.00 0.00 179.45 178.21 1dr3 n ASP 155 N -3.45 1.90 -4.51 0.86 8.00 -0.00 -4.84 116.55 114.52 1dr3 n ASP 155 Ca -0.02 0.38 -0.43 0.00 0.71 0.00 0.00 54.79 55.43 1dr3 n ASP 155 Cb 0.93 -0.94 -0.05 0.00 -0.02 0.00 0.00 41.12 41.04 1dr3 n ASP 155 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1dr3 s PHE 156 N -2.40 2.88 -0.17 1.24 0.40 0.09 -4.24 117.98 115.78 1dr3 s PHE 156 Ca -0.28 -0.09 -0.15 0.00 -0.60 0.00 0.00 56.93 55.81 1dr3 s PHE 156 Cb 0.06 -3.89 -0.04 0.00 0.51 0.00 0.00 43.02 39.66 1dr3 s PHE 156 CO 0.61 -1.22 0.36 0.15 0.70 0.00 0.00 175.22 175.83 1dr3 s LYS 157 N 3.56 4.25 0.07 0.44 -0.14 -0.33 -4.53 119.74 123.06 1dr3 s LYS 157 Ca 0.27 0.20 -0.31 0.00 -1.36 0.00 0.00 55.97 54.77 1dr3 s LYS 157 Cb -0.14 -3.47 -0.07 0.00 -1.68 0.00 0.00 37.83 32.47 1dr3 s LYS 157 CO 0.18 0.13 1.44 -1.17 -0.76 0.00 0.00 175.35 175.17 1dr3 s LEU 158 N 0.79 4.35 0.35 3.17 2.96 -1.26 -0.81 118.68 128.23 1dr3 s LEU 158 Ca 0.19 2.29 -0.17 0.00 -0.22 0.00 0.00 54.13 56.22 1dr3 s LEU 158 Cb -0.14 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 42.88 1dr3 s LEU 158 CO 0.07 -0.71 0.80 -0.76 -1.32 0.00 0.00 176.35 174.42 1dr3 s LEU 159 N 1.75 4.04 0.19 -0.68 1.43 0.94 -4.95 118.68 121.40 1dr3 s LEU 159 Ca 0.66 1.40 0.23 0.00 -1.03 0.00 0.00 54.13 55.39 1dr3 s LEU 159 Cb -0.36 -4.20 0.16 0.00 0.03 0.00 0.00 46.19 41.83 1dr3 s LEU 159 CO 0.29 -0.24 1.20 0.71 0.23 0.00 0.00 176.35 178.54 1dr3 h THR 160 N 1.97 0.00 -2.16 5.49 1.35 -1.95 -3.42 112.91 114.19 1dr3 h THR 160 Ca -0.48 -0.80 -0.07 0.00 -0.55 0.00 0.00 66.41 64.51 1dr3 h THR 160 Cb 1.18 1.37 -0.19 0.00 -1.73 0.00 0.00 68.15 68.78 1dr3 h THR 160 CO 0.64 0.00 0.11 -0.70 -0.25 0.00 0.00 175.52 175.32 1dr3 s GLU 161 N -3.27 0.98 -0.16 4.72 2.12 -1.26 -5.06 118.70 116.76 1dr3 s GLU 161 Ca 0.03 0.24 -0.11 0.00 0.36 0.00 0.00 54.97 55.49 1dr3 s GLU 161 Cb 0.11 0.46 0.05 0.00 0.26 0.00 0.00 34.13 35.01 1dr3 s GLU 161 CO 0.75 -0.29 0.40 -0.47 -0.54 0.00 0.00 175.26 175.11 1dr3 s TYR 162 N -1.10 -0.54 -0.15 5.30 5.04 -1.26 -5.09 117.35 119.55 1dr3 s TYR 162 Ca -0.11 1.20 -0.34 0.00 -2.44 0.00 0.00 57.07 55.38 1dr3 s TYR 162 Cb -0.01 0.22 -0.11 0.00 0.35 0.00 0.00 41.96 42.41 1dr3 s TYR 162 CO 0.09 -0.29 1.96 -0.35 -1.34 0.00 0.00 175.55 175.61 1dr3 n PRO 163 N 3.79 1.96 -0.38 4.97 -0.04 -1.26 -1.76 135.00 142.27 1dr3 n PRO 163 Ca -0.20 0.69 0.00 0.00 -0.04 0.00 0.00 63.50 63.95 1dr3 n PRO 163 Cb 0.56 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.36 1dr3 n PRO 163 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dr3 n GLY 164 N 4.84 0.75 3.19 0.55 0.00 -1.26 -5.04 105.19 108.22 1dr3 n GLY 164 Ca 0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 1dr3 n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dr3 s VAL 165 N -2.42 2.95 0.43 1.61 1.01 -0.72 -5.08 120.40 118.18 1dr3 s VAL 165 Ca 0.00 -1.15 -0.23 0.00 0.00 0.00 0.00 61.98 60.60 1dr3 s VAL 165 Cb 0.00 -2.57 -0.11 0.00 0.00 0.00 0.00 36.38 33.70 1dr3 s VAL 165 CO 0.00 0.08 0.78 -2.65 0.00 0.00 0.00 175.10 173.31 1dr3 n PRO 166 N 4.66 0.93 -0.03 2.72 -0.02 -1.26 -4.65 135.00 137.34 1dr3 n PRO 166 Ca -0.15 0.34 -0.21 0.00 -2.02 0.00 0.00 63.50 61.46 1dr3 n PRO 166 Cb 0.46 -1.78 -0.13 0.00 -0.02 0.00 0.00 33.50 32.02 1dr3 n PRO 166 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dr3 n ALA 167 N -0.74 0.99 -1.56 3.55 0.00 -1.26 -4.67 120.51 116.83 1dr3 n ALA 167 Ca 0.11 -0.69 -0.29 0.00 0.00 0.00 0.00 53.44 52.56 1dr3 n ALA 167 Cb 0.40 -0.54 0.11 0.00 0.00 0.00 0.00 19.45 19.41 1dr3 n ALA 167 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dr3 s ASP 168 N -6.94 4.11 0.24 0.00 1.01 -1.26 -4.88 116.67 108.96 1dr3 s ASP 168 Ca -0.26 1.16 -0.30 0.00 0.71 0.00 0.00 52.55 53.86 1dr3 s ASP 168 Cb 0.07 -1.82 -0.10 0.00 1.01 0.00 0.00 42.92 42.08 1dr3 s ASP 168 CO 0.72 -2.19 1.46 -0.63 0.21 0.00 0.00 175.17 174.73 1dr3 s ILE 169 N -3.22 2.64 0.23 0.77 1.01 -1.26 -4.72 121.20 116.65 1dr3 s ILE 169 Ca 0.62 0.53 0.07 0.00 0.00 0.00 0.00 60.65 61.86 1dr3 s ILE 169 Cb -0.14 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 1dr3 s ILE 169 CO 0.54 0.08 0.19 -1.10 0.00 0.00 0.00 174.94 174.65 1dr3 s GLN 170 N -0.23 2.94 -0.00 2.79 -1.52 0.15 -4.95 119.66 118.83 1dr3 s GLN 170 Ca 0.60 -1.01 -0.05 0.00 -1.95 0.00 0.00 55.36 52.96 1dr3 s GLN 170 Cb -0.42 -2.59 -0.00 0.00 -0.22 0.00 0.00 33.01 29.78 1dr3 s GLN 170 CO 0.42 0.42 0.10 -2.00 -0.25 0.00 0.00 175.29 173.98 1dr3 s GLU 171 N -3.71 0.36 -0.28 2.91 2.12 -1.26 -0.69 118.70 118.16 1dr3 s GLU 171 Ca 0.33 -0.31 -0.23 0.00 0.36 0.00 0.00 54.97 55.11 1dr3 s GLU 171 Cb -0.08 0.15 0.13 0.00 0.26 0.00 0.00 34.13 34.59 1dr3 s GLU 171 CO 0.25 -0.08 1.03 -2.00 -0.54 0.00 0.00 175.26 173.92 1dr3 s GLU 172 N -1.06 0.46 -1.42 4.30 2.12 0.76 -4.92 118.70 118.94 1dr3 s GLU 172 Ca -0.11 0.60 -0.10 0.00 0.36 0.00 0.00 54.97 55.71 1dr3 s GLU 172 Cb -0.07 0.20 0.07 0.00 0.26 0.00 0.00 34.13 34.60 1dr3 s GLU 172 CO 0.01 -0.06 0.66 -0.25 -0.54 0.00 0.00 175.26 175.08 1dr3 n ASP 173 N 2.52 -4.41 0.00 -1.70 8.00 -1.26 -0.32 116.55 119.38 1dr3 n ASP 173 Ca -0.14 -0.51 0.00 0.00 0.71 0.00 0.00 54.79 54.85 1dr3 n ASP 173 Cb 0.56 -3.59 0.00 0.00 -0.02 0.00 0.00 41.12 38.08 1dr3 n ASP 173 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dr3 n GLY 174 N -1.39 0.55 3.57 0.44 0.00 -1.26 -5.00 105.19 102.11 1dr3 n GLY 174 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1dr3 n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dr3 s ILE 175 N -2.41 3.78 0.02 -0.61 -1.09 0.56 -5.12 121.20 116.33 1dr3 s ILE 175 Ca 0.00 -0.44 0.01 0.00 -2.23 0.00 0.00 60.65 57.99 1dr3 s ILE 175 Cb 0.00 -2.57 -0.04 0.00 -1.58 0.00 0.00 42.46 38.27 1dr3 s ILE 175 CO 0.00 0.58 0.08 -1.10 -1.23 0.00 0.00 174.94 173.27 1dr3 s GLN 176 N -0.56 3.02 0.17 2.79 -0.21 -1.26 -0.17 119.66 123.44 1dr3 s GLN 176 Ca 0.09 -0.55 -0.17 0.00 0.02 0.00 0.00 55.36 54.75 1dr3 s GLN 176 Cb -0.12 -2.82 0.03 0.00 1.00 0.00 0.00 33.01 31.10 1dr3 s GLN 176 CO 0.02 0.62 0.48 1.52 -2.12 0.00 0.00 175.29 175.81 1dr3 s TYR 177 N -1.26 -0.12 0.01 0.91 -0.85 0.14 -1.07 117.35 115.11 1dr3 s TYR 177 Ca 0.25 -0.21 0.01 0.00 -0.52 0.00 0.00 57.07 56.60 1dr3 s TYR 177 Cb -0.12 0.33 -0.01 0.00 0.38 0.00 0.00 41.96 42.54 1dr3 s TYR 177 CO 0.17 -0.84 -0.03 -1.59 -1.52 0.00 0.00 175.55 171.73 1dr3 s LYS 178 N -3.86 0.26 0.03 -3.49 -2.85 0.39 0.29 119.74 110.51 1dr3 s LYS 178 Ca 0.08 -0.39 -0.16 0.00 -1.00 0.00 0.00 55.97 54.50 1dr3 s LYS 178 Cb 0.00 -0.05 -0.06 0.00 -2.06 0.00 0.00 37.83 35.66 1dr3 s LYS 178 CO -0.05 0.00 0.46 -0.06 0.10 0.00 0.00 175.35 175.80 1dr3 s PHE 179 N -0.82 3.74 -0.02 1.78 0.08 -1.26 0.14 117.98 121.62 1dr3 s PHE 179 Ca -0.08 1.07 -0.06 0.00 0.12 0.00 0.00 56.93 57.98 1dr3 s PHE 179 Cb -0.06 -2.35 0.01 0.00 -0.57 0.00 0.00 43.02 40.05 1dr3 s PHE 179 CO -0.00 0.62 0.15 -1.21 -0.10 0.00 0.00 175.22 174.67 1dr3 s GLU 180 N -1.15 0.35 -0.13 0.44 2.02 0.38 -4.96 118.70 115.66 1dr3 s GLU 180 Ca 0.26 -0.13 0.02 0.00 0.02 0.00 0.00 54.97 55.14 1dr3 s GLU 180 Cb -0.17 0.15 0.01 0.00 0.10 0.00 0.00 34.13 34.22 1dr3 s GLU 180 CO 0.15 -0.07 -0.18 0.08 0.02 0.00 0.00 175.26 175.26 1dr3 s VAL 181 N -0.74 1.80 0.05 2.63 1.01 -1.26 -0.44 120.40 123.44 1dr3 s VAL 181 Ca -0.08 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.13 1dr3 s VAL 181 Cb -0.05 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 1dr3 s VAL 181 CO 0.01 0.50 -0.07 -0.31 0.00 0.00 0.00 175.10 175.23 1dr3 s TYR 182 N 1.01 2.86 -0.03 5.22 1.51 0.69 -0.04 117.35 128.56 1dr3 s TYR 182 Ca -0.04 -0.07 0.01 0.00 -1.01 0.00 0.00 57.07 55.95 1dr3 s TYR 182 Cb -0.15 -1.55 0.02 0.00 -0.11 0.00 0.00 41.96 40.18 1dr3 s TYR 182 CO -0.04 0.40 -0.02 -1.14 -1.11 0.00 0.00 175.55 173.65 1dr3 s GLN 183 N -1.79 0.50 -0.16 -0.62 0.74 0.01 0.19 119.66 118.53 1dr3 s GLN 183 Ca 0.20 0.00 -0.01 0.00 0.05 0.00 0.00 55.36 55.60 1dr3 s GLN 183 Cb -0.11 -0.61 -0.01 0.00 1.10 0.00 0.00 33.01 33.38 1dr3 s GLN 183 CO 0.11 -0.11 -0.10 0.21 -0.55 0.00 0.00 175.29 174.85 1dr3 s LYS 184 N 0.96 3.38 -0.25 1.67 2.20 0.15 -1.18 119.74 126.67 1dr3 s LYS 184 Ca -0.11 -0.66 -0.07 0.00 -0.36 0.00 0.00 55.97 54.78 1dr3 s LYS 184 Cb -0.14 -2.77 -0.02 0.00 -1.51 0.00 0.00 37.83 33.39 1dr3 s LYS 184 CO -0.01 0.07 0.05 -1.12 -0.36 0.00 0.00 175.35 173.98 1dr3 s SER 185 N 0.75 4.99 0.00 1.43 0.01 -1.26 -1.46 113.70 118.15 1dr3 s SER 185 Ca -0.04 -0.27 0.06 0.00 1.31 0.00 0.00 55.95 57.01 1dr3 s SER 185 Cb -0.15 -1.89 0.05 0.00 0.21 0.00 0.00 66.02 64.24 1dr3 s SER 185 CO 0.02 -0.04 0.69 0.52 0.41 0.00 0.00 173.24 174.83