#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dr1 h ARG 2 N 0.00 0.77 -2.12 7.34 -0.00 -2.00 -3.47 114.38 114.89 1dr1 h ARG 2 Ca 0.00 -0.46 -0.02 0.00 -0.00 0.00 0.00 59.98 59.50 1dr1 h ARG 2 Cb 0.00 0.04 -0.18 0.00 -0.00 0.00 0.00 29.97 29.83 1dr1 h ARG 2 CO 0.00 1.08 0.26 -1.54 -0.00 0.00 0.00 179.97 179.78 1dr1 s SER 3 N -6.73 -0.59 0.22 0.08 1.04 -1.26 -4.26 113.70 102.20 1dr1 s SER 3 Ca -0.12 0.51 0.08 0.00 0.48 0.00 0.00 55.95 56.90 1dr1 s SER 3 Cb 0.09 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.68 1dr1 s SER 3 CO 0.86 -0.63 0.01 -0.76 0.98 0.00 0.00 173.24 173.70 1dr1 s LEU 4 N -1.52 3.30 0.02 2.42 1.43 -0.22 -4.68 118.68 119.44 1dr1 s LEU 4 Ca -0.07 -0.48 0.03 0.00 -1.03 0.00 0.00 54.13 52.59 1dr1 s LEU 4 Cb -0.00 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 1dr1 s LEU 4 CO 0.04 0.05 -0.10 0.20 0.23 0.00 0.00 176.35 176.76 1dr1 s ASN 5 N -3.29 1.19 0.04 2.29 0.01 -1.03 -1.74 114.94 112.41 1dr1 s ASN 5 Ca 0.29 -0.35 0.04 0.00 -0.71 0.00 0.00 52.86 52.13 1dr1 s ASN 5 Cb -0.08 -0.07 -0.02 0.00 0.41 0.00 0.00 41.25 41.48 1dr1 s ASN 5 CO 0.19 0.01 -0.11 -0.44 -1.51 0.00 0.00 177.10 175.24 1dr1 s SER 6 N -0.85 1.29 -0.00 -1.22 0.01 -0.66 0.45 113.70 112.72 1dr1 s SER 6 Ca -0.00 -0.47 0.02 0.00 1.31 0.00 0.00 55.95 56.80 1dr1 s SER 6 Cb -0.06 -0.05 -0.00 0.00 0.21 0.00 0.00 66.02 66.12 1dr1 s SER 6 CO 0.00 -0.06 -0.05 -0.51 0.41 0.00 0.00 173.24 173.04 1dr1 s ILE 7 N -1.01 0.41 0.10 1.44 2.07 -0.74 -1.19 121.20 122.28 1dr1 s ILE 7 Ca -0.03 -0.24 -0.24 0.00 -1.41 0.00 0.00 60.65 58.73 1dr1 s ILE 7 Cb -0.08 -0.35 0.06 0.00 0.13 0.00 0.00 42.46 42.22 1dr1 s ILE 7 CO 0.01 0.10 0.58 0.54 -1.91 0.00 0.00 174.94 174.26 1dr1 s VAL 8 N -0.16 0.01 -0.08 4.00 0.11 -0.86 -4.58 120.40 118.85 1dr1 s VAL 8 Ca 0.02 -0.10 0.04 0.00 -2.93 0.00 0.00 61.98 59.00 1dr1 s VAL 8 Cb -0.02 -1.01 -0.02 0.00 -1.53 0.00 0.00 36.38 33.80 1dr1 s VAL 8 CO -0.00 -0.05 -0.18 0.00 -3.33 0.00 0.00 175.10 171.53 1dr1 s ALA 9 N -3.07 2.45 0.05 1.54 0.00 -1.26 -1.26 121.76 120.22 1dr1 s ALA 9 Ca -0.02 -0.98 0.04 0.00 0.00 0.00 0.00 51.96 50.99 1dr1 s ALA 9 Cb -0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.17 1dr1 s ALA 9 CO -0.07 0.42 -0.11 0.14 0.00 0.00 0.00 175.76 176.14 1dr1 s VAL 10 N -0.20 0.83 0.65 0.00 -7.23 0.49 -4.68 120.40 110.26 1dr1 s VAL 10 Ca -0.01 -1.15 0.05 0.00 -1.81 0.00 0.00 61.98 59.06 1dr1 s VAL 10 Cb -0.13 -0.83 0.12 0.00 0.56 0.00 0.00 36.38 36.10 1dr1 s VAL 10 CO 0.03 -0.27 0.90 0.00 -0.31 0.00 0.00 175.10 175.45 1dr1 h GLN 12 N 0.00 0.00 -0.10 0.00 4.20 -0.78 0.18 115.11 118.61 1dr1 h GLN 12 Ca -0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1dr1 h GLN 12 Cb 1.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.01 1dr1 h GLN 12 CO 0.37 0.02 0.00 0.27 -0.67 0.00 0.00 178.83 178.82 1dr1 n ASN 13 N -4.14 1.72 0.00 1.46 2.04 -1.26 -4.90 115.26 110.17 1dr1 n ASN 13 Ca -0.03 -1.63 0.00 0.00 -0.44 0.00 0.00 54.58 52.48 1dr1 n ASN 13 Cb 0.10 -0.06 0.00 0.00 -2.53 0.00 0.00 39.78 37.29 1dr1 n ASN 13 CO 0.00 0.00 0.00 0.23 -0.44 0.00 0.00 177.26 177.05 1dr1 n MET 14 N 0.34 0.00 -2.40 -3.83 2.81 0.05 -4.96 117.12 109.14 1dr1 n MET 14 Ca 0.18 0.08 -0.38 0.00 -1.81 0.00 0.00 57.70 55.76 1dr1 n MET 14 Cb 0.36 -2.46 -0.03 0.00 -0.71 0.00 0.00 33.22 30.38 1dr1 n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1dr1 s GLY 15 N -2.16 2.89 0.00 3.03 0.00 -1.26 -0.35 107.32 109.48 1dr1 s GLY 15 Ca 0.00 0.89 0.00 0.00 0.00 0.00 0.00 44.72 45.61 1dr1 s GLY 15 CO 0.00 1.41 0.00 0.29 0.00 0.00 0.00 173.10 174.80 1dr1 n ILE 16 N 0.36 0.00 -3.59 0.90 -5.35 -0.14 -2.47 119.36 109.07 1dr1 n ILE 16 Ca 0.03 -0.27 -0.10 0.00 -0.27 0.00 0.00 62.75 62.13 1dr1 n ILE 16 Cb 0.47 0.82 -0.03 0.00 -1.74 0.00 0.00 39.64 39.16 1dr1 n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1dr1 s GLY 17 N -1.00 -0.36 -0.27 3.28 0.00 -1.18 -4.43 107.32 103.37 1dr1 s GLY 17 Ca 0.00 0.11 -0.11 0.00 0.00 0.00 0.00 44.72 44.72 1dr1 s GLY 17 CO 0.00 -0.06 0.60 1.25 0.00 0.00 0.00 173.10 174.90 1dr1 s LYS 18 N -3.81 0.56 -1.44 2.90 2.47 0.18 -1.14 119.74 119.45 1dr1 s LYS 18 Ca 0.05 1.26 -0.06 0.00 -1.56 0.00 0.00 55.97 55.66 1dr1 s LYS 18 Cb -0.01 0.49 0.03 0.00 -1.46 0.00 0.00 37.83 36.87 1dr1 s LYS 18 CO -0.08 -0.19 0.48 -0.25 0.16 0.00 0.00 175.35 175.48 1dr1 n ASP 19 N 4.99 -5.14 0.00 1.43 8.00 -1.26 -1.65 116.55 122.91 1dr1 n ASP 19 Ca -0.15 -0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.09 1dr1 n ASP 19 Cb 0.53 -4.20 0.00 0.00 -0.02 0.00 0.00 41.12 37.43 1dr1 n ASP 19 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dr1 n GLY 20 N -1.32 1.00 0.00 0.44 0.00 -1.26 -4.99 105.19 99.06 1dr1 n GLY 20 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1dr1 n GLY 20 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dr1 n ASN 21 N 0.00 0.52 -4.87 1.61 5.15 -0.66 -4.71 115.26 112.30 1dr1 n ASN 21 Ca 0.00 -0.47 -0.31 0.00 -0.60 0.00 0.00 54.58 53.20 1dr1 n ASN 21 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 1dr1 n ASN 21 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1dr1 s LEU 22 N 0.00 3.64 0.24 1.20 1.43 -1.26 0.48 118.68 124.41 1dr1 s LEU 22 Ca 0.00 1.30 0.26 0.00 -1.03 0.00 0.00 54.13 54.65 1dr1 s LEU 22 Cb 0.00 -4.23 0.80 0.00 0.03 0.00 0.00 46.19 42.79 1dr1 s LEU 22 CO 0.00 -0.56 1.76 -0.65 0.23 0.00 0.00 176.35 177.13 1dr1 h PRO 23 N 0.76 0.00 -6.28 1.29 0.11 -1.83 -3.40 132.00 122.64 1dr1 h PRO 23 Ca -0.46 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.06 1dr1 h PRO 23 Cb 1.19 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.18 1dr1 h PRO 23 CO 0.62 0.00 -0.70 1.67 -0.21 0.00 0.00 178.00 179.39 1dr1 s TRP 24 N -3.15 2.58 1.15 0.65 -2.14 -1.26 -4.77 118.94 112.01 1dr1 s TRP 24 Ca 0.09 -0.25 -0.16 0.00 2.66 0.00 0.00 56.10 58.45 1dr1 s TRP 24 Cb 0.11 -1.17 0.26 0.00 -3.10 0.00 0.00 33.47 29.57 1dr1 s TRP 24 CO 0.58 0.61 1.07 -2.14 -2.66 0.00 0.00 176.95 174.41 1dr1 s PRO 25 N -3.38 -0.76 0.27 3.25 0.02 -1.26 -4.89 135.00 128.25 1dr1 s PRO 25 Ca 0.29 0.29 -0.31 0.00 0.02 0.00 0.00 61.00 61.30 1dr1 s PRO 25 Cb -0.07 -1.62 -0.12 0.00 0.02 0.00 0.00 34.50 32.72 1dr1 s PRO 25 CO 0.17 -3.48 1.64 -2.30 -0.33 0.00 0.00 177.00 172.70 1dr1 n PRO 26 N -4.66 2.73 -3.97 5.54 -0.02 -1.26 -4.97 135.00 128.39 1dr1 n PRO 26 Ca 0.08 0.97 -0.32 0.00 -2.02 0.00 0.00 63.50 62.21 1dr1 n PRO 26 Cb 0.58 -2.78 -0.14 0.00 -0.02 0.00 0.00 33.50 31.14 1dr1 n PRO 26 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1dr1 s LEU 27 N 0.00 4.77 0.09 2.45 1.43 -1.26 -5.03 118.68 121.14 1dr1 s LEU 27 Ca 0.67 -2.06 -0.25 0.00 -1.03 0.00 0.00 54.13 51.46 1dr1 s LEU 27 Cb -0.50 -1.67 -0.14 0.00 0.03 0.00 0.00 46.19 43.91 1dr1 s LEU 27 CO 0.44 -0.40 1.71 -0.09 0.23 0.00 0.00 176.35 178.23 1dr1 h ARG 28 N 7.72 -0.22 -0.59 1.70 2.43 -1.99 -1.81 114.38 121.62 1dr1 h ARG 28 Ca -0.07 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.03 1dr1 h ARG 28 Cb 1.03 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 1dr1 h ARG 28 CO 0.55 -0.15 0.03 -0.91 -1.51 0.00 0.00 179.97 177.99 1dr1 h ASN 29 N -0.23 0.97 -0.45 -3.80 2.35 -1.98 -0.67 115.58 111.76 1dr1 h ASN 29 Ca -0.01 -0.25 -0.07 0.00 -0.55 0.00 0.00 56.30 55.41 1dr1 h ASN 29 Cb 0.20 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1dr1 h ASN 29 CO 0.01 1.00 -0.01 -0.08 -1.65 0.00 0.00 177.43 176.70 1dr1 h GLU 30 N 0.92 0.81 -0.20 0.81 4.22 -1.96 -2.05 114.58 117.14 1dr1 h GLU 30 Ca 0.17 -0.26 -0.02 0.00 0.08 0.00 0.00 59.36 59.33 1dr1 h GLU 30 Cb 0.49 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1dr1 h GLU 30 CO 0.02 0.87 0.05 -0.92 -2.18 0.00 0.00 179.01 176.85 1dr1 h TYR 31 N 0.65 0.33 -0.10 0.92 3.20 -1.17 -1.62 116.97 119.18 1dr1 h TYR 31 Ca 0.13 -0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.99 1dr1 h TYR 31 Cb 0.51 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 1dr1 h TYR 31 CO 0.04 0.42 0.07 0.87 -1.64 0.00 0.00 178.16 177.93 1dr1 h LYS 32 N 0.14 0.00 -0.28 1.82 1.57 -1.04 -2.00 116.57 116.77 1dr1 h LYS 32 Ca 0.06 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.80 1dr1 h LYS 32 Cb 0.26 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1dr1 h LYS 32 CO -0.00 0.00 0.01 -0.92 -0.57 0.00 0.00 179.45 177.97 1dr1 h TYR 33 N 0.00 0.54 -0.51 -1.35 3.20 -0.57 -0.80 116.97 117.47 1dr1 h TYR 33 Ca 0.05 -0.09 0.02 0.00 3.14 0.00 0.00 58.73 61.85 1dr1 h TYR 33 Cb 0.19 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 1dr1 h TYR 33 CO 0.00 0.63 0.30 0.35 -1.64 0.00 0.00 178.16 177.80 1dr1 h PHE 34 N 0.29 0.57 -0.28 -3.82 3.57 -0.92 0.05 116.94 116.39 1dr1 h PHE 34 Ca 0.08 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1dr1 h PHE 34 Cb 0.41 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1dr1 h PHE 34 CO 0.03 0.32 0.19 1.96 -2.23 0.00 0.00 178.31 178.58 1dr1 h GLN 35 N 0.60 0.38 -0.24 1.11 1.08 -1.30 -1.86 115.11 114.88 1dr1 h GLN 35 Ca 0.21 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.35 1dr1 h GLN 35 Cb 0.03 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 1dr1 h GLN 35 CO -0.10 0.26 0.04 -0.09 -0.95 0.00 0.00 178.83 177.99 1dr1 h ARG 36 N 0.38 0.40 0.08 1.46 2.43 -0.97 -0.08 114.38 118.07 1dr1 h ARG 36 Ca 0.10 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1dr1 h ARG 36 Cb -0.03 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1dr1 h ARG 36 CO -0.02 0.53 -0.04 0.52 -1.51 0.00 0.00 179.97 179.45 1dr1 h MET 37 N 0.20 -0.10 -0.12 0.20 2.86 -0.94 -2.43 114.93 114.61 1dr1 h MET 37 Ca 0.07 0.01 -0.14 0.00 -2.06 0.00 0.00 59.70 57.58 1dr1 h MET 37 Cb 0.33 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1dr1 h MET 37 CO 0.00 0.06 -0.54 1.79 1.06 0.00 0.00 176.91 179.28 1dr1 h THR 38 N -0.24 1.35 0.05 2.22 1.35 -1.30 -3.32 112.91 113.02 1dr1 h THR 38 Ca -0.01 -1.81 -0.23 0.00 -0.55 0.00 0.00 66.41 63.81 1dr1 h THR 38 Cb 0.20 1.85 -0.01 0.00 -1.73 0.00 0.00 68.15 68.46 1dr1 h THR 38 CO 0.02 0.55 -1.06 0.28 -0.25 0.00 0.00 175.52 175.06 1dr1 h SER 39 N 0.26 0.21 -3.31 5.36 0.02 -1.04 -3.43 113.55 111.63 1dr1 h SER 39 Ca 0.01 -0.21 -0.57 0.00 -0.84 0.00 0.00 61.79 60.18 1dr1 h SER 39 Cb 1.03 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 63.44 1dr1 h SER 39 CO 0.09 1.13 0.96 -0.89 -1.14 0.00 0.00 176.83 176.98 1dr1 s THR 40 N -2.81 4.16 0.15 -2.27 2.01 -0.92 -4.66 115.64 111.30 1dr1 s THR 40 Ca -0.02 1.27 -0.01 0.00 0.31 0.00 0.00 61.69 63.24 1dr1 s THR 40 Cb 0.09 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.26 1dr1 s THR 40 CO 0.84 -0.64 0.33 -0.55 -0.69 0.00 0.00 174.62 173.92 1dr1 s SER 41 N 2.78 6.40 -0.30 3.53 0.15 -1.26 -4.97 113.70 120.02 1dr1 s SER 41 Ca 0.54 0.38 0.10 0.00 0.70 0.00 0.00 55.95 57.67 1dr1 s SER 41 Cb -0.13 -2.00 0.64 0.00 -1.71 0.00 0.00 66.02 62.81 1dr1 s SER 41 CO 0.25 0.04 1.66 1.41 1.20 0.00 0.00 173.24 177.81 1dr1 n HIS 42 N -0.26 1.91 -3.68 3.44 -0.00 -1.26 -4.89 115.22 110.47 1dr1 n HIS 42 Ca -0.05 -1.33 -0.12 0.00 -0.00 0.00 0.00 57.72 56.23 1dr1 n HIS 42 Cb 0.53 -0.60 -0.12 0.00 -0.00 0.00 0.00 29.99 29.79 1dr1 n HIS 42 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1dr1 s VAL 43 N -3.07 -0.32 0.31 1.59 1.01 -1.26 -5.12 120.40 113.54 1dr1 s VAL 43 Ca 0.50 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 62.41 1dr1 s VAL 43 Cb 0.42 -0.48 -0.10 0.00 0.00 0.00 0.00 36.38 36.22 1dr1 s VAL 43 CO 0.09 0.09 1.40 -1.83 0.00 0.00 0.00 175.10 174.85 1dr1 s GLU 44 N 2.06 4.26 0.00 2.72 -1.05 -1.26 -2.05 118.70 123.38 1dr1 s GLU 44 Ca -0.03 2.34 0.00 0.00 -0.15 0.00 0.00 54.97 57.13 1dr1 s GLU 44 Cb -0.11 -3.06 0.00 0.00 -0.44 0.00 0.00 34.13 30.52 1dr1 s GLU 44 CO -0.10 -0.36 0.00 0.41 0.95 0.00 0.00 175.26 176.16 1dr1 n GLY 45 N 1.27 1.42 3.59 -3.83 0.00 -1.26 -5.04 105.19 101.35 1dr1 n GLY 45 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1dr1 n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dr1 s LYS 46 N -0.56 2.12 0.21 1.61 1.02 -0.87 -4.88 119.74 118.39 1dr1 s LYS 46 Ca 0.00 -1.51 0.05 0.00 0.02 0.00 0.00 55.97 54.53 1dr1 s LYS 46 Cb 0.00 -2.05 -0.05 0.00 -0.52 0.00 0.00 37.83 35.21 1dr1 s LYS 46 CO 0.00 0.36 -0.07 -0.65 -0.92 0.00 0.00 175.35 174.07 1dr1 s GLN 47 N -3.60 1.29 0.46 1.68 -0.21 -0.53 -4.83 119.66 113.91 1dr1 s GLN 47 Ca 0.31 -1.61 -0.04 0.00 0.02 0.00 0.00 55.36 54.04 1dr1 s GLN 47 Cb -0.06 -0.80 -0.03 0.00 1.00 0.00 0.00 33.01 33.12 1dr1 s GLN 47 CO 0.18 0.03 0.74 -0.80 -2.12 0.00 0.00 175.29 173.32 1dr1 s ASN 48 N -3.29 6.20 0.02 5.90 0.01 -1.26 -0.98 114.94 121.54 1dr1 s ASN 48 Ca 0.24 0.78 0.05 0.00 -0.71 0.00 0.00 52.86 53.21 1dr1 s ASN 48 Cb 0.03 -2.13 -0.03 0.00 0.41 0.00 0.00 41.25 39.53 1dr1 s ASN 48 CO 0.06 -0.56 -0.10 0.00 -1.51 0.00 0.00 177.10 175.00 1dr1 s ALA 49 N -2.66 2.89 -0.13 0.60 0.00 0.25 -1.62 121.76 121.10 1dr1 s ALA 49 Ca 0.46 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.36 1dr1 s ALA 49 Cb -0.10 -1.01 -0.00 0.00 0.00 0.00 0.00 23.12 22.01 1dr1 s ALA 49 CO 0.43 0.60 -0.18 0.14 0.00 0.00 0.00 175.76 176.75 1dr1 s VAL 50 N -0.99 2.53 -0.04 0.00 -7.23 -0.43 0.12 120.40 114.38 1dr1 s VAL 50 Ca 0.17 -0.83 0.04 0.00 -1.81 0.00 0.00 61.98 59.54 1dr1 s VAL 50 Cb -0.11 -2.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.77 1dr1 s VAL 50 CO 0.07 0.53 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.63 1dr1 s ILE 51 N 0.57 3.15 0.16 -0.62 1.01 0.46 -1.52 121.20 124.42 1dr1 s ILE 51 Ca -0.11 -0.75 -0.13 0.00 0.00 0.00 0.00 60.65 59.66 1dr1 s ILE 51 Cb -0.16 -2.26 0.01 0.00 0.01 0.00 0.00 42.46 40.06 1dr1 s ILE 51 CO 0.04 0.55 0.38 0.00 0.00 0.00 0.00 174.94 175.91 1dr1 s MET 52 N -0.88 1.18 0.75 2.79 0.23 -0.40 -1.85 119.30 121.11 1dr1 s MET 52 Ca 0.12 -0.94 -0.09 0.00 -1.03 0.00 0.00 55.69 53.75 1dr1 s MET 52 Cb -0.11 0.44 0.06 0.00 -1.53 0.00 0.00 34.83 33.70 1dr1 s MET 52 CO 0.02 -0.46 1.09 0.20 -2.03 0.00 0.00 175.02 173.84 1dr1 s GLY 53 N -2.89 1.63 0.15 3.16 0.00 0.09 -0.37 107.32 109.10 1dr1 s GLY 53 Ca 0.10 -0.74 -0.16 0.00 0.00 0.00 0.00 44.72 43.92 1dr1 s GLY 53 CO -0.05 -0.31 1.78 1.70 0.00 0.00 0.00 173.10 176.23 1dr1 h LYS 54 N -0.79 0.59 -0.52 2.90 3.64 -1.88 -1.87 116.57 118.64 1dr1 h LYS 54 Ca -0.45 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 58.77 1dr1 h LYS 54 Cb 1.31 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.99 1dr1 h LYS 54 CO 0.63 0.44 -0.07 0.87 -2.27 0.00 0.00 179.45 179.05 1dr1 h LYS 55 N 0.58 0.94 -0.48 1.90 1.57 -1.95 -2.15 116.57 116.98 1dr1 h LYS 55 Ca 0.16 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1dr1 h LYS 55 Cb 0.00 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 1dr1 h LYS 55 CO -0.03 0.97 0.25 1.15 -0.57 0.00 0.00 179.45 181.22 1dr1 h THR 56 N 0.85 1.18 0.09 -0.16 2.02 -1.84 -1.81 112.91 113.24 1dr1 h THR 56 Ca 0.14 -0.48 0.02 0.00 0.77 0.00 0.00 66.41 66.86 1dr1 h THR 56 Cb 0.60 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.58 1dr1 h THR 56 CO 0.04 0.19 -0.36 -0.25 0.37 0.00 0.00 175.52 175.51 1dr1 h TRP 57 N 0.64 -0.99 0.00 3.16 2.91 -1.03 -1.67 115.95 118.96 1dr1 h TRP 57 Ca 0.17 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.21 1dr1 h TRP 57 Cb 0.08 0.42 0.00 0.00 -0.51 0.00 0.00 29.16 29.16 1dr1 h TRP 57 CO -0.01 -0.46 0.00 1.19 -1.03 0.00 0.00 178.44 178.13 1dr1 n PHE 58 N -5.44 0.15 0.76 2.65 3.72 -0.83 -2.14 117.46 116.32 1dr1 n PHE 58 Ca -0.06 0.06 0.13 0.00 -0.05 0.00 0.00 57.45 57.53 1dr1 n PHE 58 Cb 0.35 -0.60 0.49 0.00 -0.94 0.00 0.00 39.48 38.78 1dr1 n PHE 58 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1dr1 n SER 59 N -1.64 0.48 -4.71 4.37 3.41 -0.63 -4.73 113.62 110.18 1dr1 n SER 59 Ca 0.03 0.55 -0.38 0.00 -0.26 0.00 0.00 58.87 58.80 1dr1 n SER 59 Cb 0.15 -0.68 -0.06 0.00 -0.26 0.00 0.00 64.21 63.36 1dr1 n SER 59 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1dr1 s ILE 60 N -3.07 5.16 0.26 -1.33 1.01 -0.91 -4.99 121.20 117.33 1dr1 s ILE 60 Ca 0.12 1.00 -0.29 0.00 0.00 0.00 0.00 60.65 61.47 1dr1 s ILE 60 Cb 0.15 -3.84 -0.14 0.00 0.01 0.00 0.00 42.46 38.63 1dr1 s ILE 60 CO 0.56 0.28 1.11 -2.65 0.00 0.00 0.00 174.94 174.24 1dr1 n PRO 61 N 3.95 1.45 -0.34 2.79 -0.02 -1.26 -4.85 135.00 136.73 1dr1 n PRO 61 Ca -0.06 0.51 0.12 0.00 -2.02 0.00 0.00 63.50 62.05 1dr1 n PRO 61 Cb 0.51 -1.95 0.33 0.00 -0.02 0.00 0.00 33.50 32.37 1dr1 n PRO 61 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1dr1 h GLU 62 N 2.56 0.75 0.00 -0.52 4.81 -1.94 -1.03 114.58 119.22 1dr1 h GLU 62 Ca -0.41 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 1dr1 h GLU 62 Cb 1.33 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 1dr1 h GLU 62 CO 0.64 0.50 -0.05 0.87 -0.73 0.00 0.00 179.01 180.24 1dr1 h LYS 63 N 0.77 0.00 -0.35 1.92 1.79 -2.03 -2.94 116.57 115.74 1dr1 h LYS 63 Ca 0.54 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.01 1dr1 h LYS 63 Cb 0.82 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 1dr1 h LYS 63 CO -0.31 0.05 0.00 0.09 -1.08 0.00 0.00 179.45 178.20 1dr1 n ASN 64 N -3.16 2.26 -4.70 0.86 3.02 -0.39 -4.92 115.26 108.22 1dr1 n ASN 64 Ca 0.01 -1.91 -0.34 0.00 -0.03 0.00 0.00 54.58 52.31 1dr1 n ASN 64 Cb 0.35 -0.23 -0.09 0.00 -0.61 0.00 0.00 39.78 39.20 1dr1 n ASN 64 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1dr1 s ARG 65 N -1.54 2.92 0.56 3.52 0.52 -1.11 -3.87 118.95 119.95 1dr1 s ARG 65 Ca 0.31 -0.49 -0.10 0.00 -0.52 0.00 0.00 55.73 54.93 1dr1 s ARG 65 Cb 0.17 -2.75 -0.04 0.00 0.52 0.00 0.00 34.95 32.84 1dr1 s ARG 65 CO 0.23 0.67 0.94 -1.25 0.02 0.00 0.00 175.30 175.90 1dr1 s PRO 66 N -1.25 3.62 -0.11 3.54 0.04 -1.26 -4.92 135.00 134.67 1dr1 s PRO 66 Ca 0.17 0.58 -0.36 0.00 0.04 0.00 0.00 61.00 61.43 1dr1 s PRO 66 Cb -0.11 -2.19 -0.13 0.00 0.04 0.00 0.00 34.50 32.10 1dr1 s PRO 66 CO 0.07 -0.40 1.81 1.28 0.04 0.00 0.00 177.00 179.79 1dr1 n LEU 67 N -2.43 3.12 -4.71 -3.56 4.77 -1.25 -4.81 117.00 108.12 1dr1 n LEU 67 Ca 0.04 1.01 -0.40 0.00 -0.03 0.00 0.00 56.01 56.63 1dr1 n LEU 67 Cb 0.54 -1.32 0.02 0.00 -2.33 0.00 0.00 43.42 40.34 1dr1 n LEU 67 CO 0.55 -0.19 0.89 1.17 -1.33 0.00 0.00 177.39 178.48 1dr1 n LYS 68 N 5.95 1.81 -1.26 3.23 4.81 -1.26 -3.23 118.16 128.20 1dr1 n LYS 68 Ca 0.23 0.65 -0.09 0.00 -0.87 0.00 0.00 58.31 58.23 1dr1 n LYS 68 Cb 0.25 -2.43 -0.04 0.00 0.02 0.00 0.00 35.03 32.84 1dr1 n LYS 68 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1dr1 n ASP 69 N -0.18 -4.59 -4.08 3.14 8.00 -1.26 -4.96 116.55 112.62 1dr1 n ASP 69 Ca 0.08 0.22 -0.08 0.00 0.71 0.00 0.00 54.79 55.72 1dr1 n ASP 69 Cb 0.42 -2.88 -0.10 0.00 -0.02 0.00 0.00 41.12 38.53 1dr1 n ASP 69 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1dr1 s ARG 70 N -2.55 0.59 -0.20 -1.24 0.52 -1.20 -4.38 118.95 110.49 1dr1 s ARG 70 Ca 0.00 -1.12 -0.23 0.00 -0.52 0.00 0.00 55.73 53.87 1dr1 s ARG 70 Cb 0.00 0.11 -0.02 0.00 0.52 0.00 0.00 34.95 35.56 1dr1 s ARG 70 CO 0.00 -0.08 0.72 0.42 0.02 0.00 0.00 175.30 176.39 1dr1 s ILE 71 N -3.36 4.94 -0.26 1.52 1.01 -0.64 -4.82 121.20 119.59 1dr1 s ILE 71 Ca 0.03 1.38 -0.17 0.00 0.00 0.00 0.00 60.65 61.89 1dr1 s ILE 71 Cb 0.04 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.45 1dr1 s ILE 71 CO -0.07 0.05 0.47 0.20 0.00 0.00 0.00 174.94 175.58 1dr1 s ASN 72 N 1.24 6.39 -0.12 3.58 0.02 -1.26 -1.31 114.94 123.47 1dr1 s ASN 72 Ca 0.32 0.46 0.02 0.00 -1.02 0.00 0.00 52.86 52.65 1dr1 s ASN 72 Cb -0.16 -2.26 -0.00 0.00 0.02 0.00 0.00 41.25 38.85 1dr1 s ASN 72 CO 0.10 -0.24 -0.20 -0.63 0.02 0.00 0.00 177.10 176.14 1dr1 s ILE 73 N 2.17 2.33 -0.03 0.60 1.01 -0.57 -1.84 121.20 124.86 1dr1 s ILE 73 Ca 0.19 -0.91 -0.02 0.00 0.00 0.00 0.00 60.65 59.91 1dr1 s ILE 73 Cb -0.16 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1dr1 s ILE 73 CO 0.09 0.55 0.10 -0.69 0.00 0.00 0.00 174.94 174.99 1dr1 s VAL 74 N 0.49 4.92 -0.13 2.92 1.01 -0.81 -1.28 120.40 127.51 1dr1 s VAL 74 Ca -0.14 -0.25 -0.04 0.00 0.00 0.00 0.00 61.98 61.55 1dr1 s VAL 74 Cb -0.17 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 1dr1 s VAL 74 CO 0.05 0.42 0.02 -0.76 0.00 0.00 0.00 175.10 174.83 1dr1 s LEU 75 N -1.54 3.60 -0.28 3.92 1.43 0.51 -1.65 118.68 124.66 1dr1 s LEU 75 Ca 0.21 0.07 -0.23 0.00 -1.03 0.00 0.00 54.13 53.15 1dr1 s LEU 75 Cb -0.12 -1.86 0.10 0.00 0.03 0.00 0.00 46.19 44.34 1dr1 s LEU 75 CO 0.12 0.26 0.86 -0.55 0.23 0.00 0.00 176.35 177.27 1dr1 s SER 76 N -0.19 -0.64 0.08 2.29 0.15 -0.76 -2.92 113.70 111.72 1dr1 s SER 76 Ca 0.06 1.17 0.19 0.00 0.70 0.00 0.00 55.95 58.07 1dr1 s SER 76 Cb -0.12 1.21 -0.12 0.00 -1.71 0.00 0.00 66.02 65.27 1dr1 s SER 76 CO 0.02 -0.20 0.80 0.54 1.20 0.00 0.00 173.24 175.60 1dr1 n ARG 77 N 2.88 0.62 -0.06 5.44 1.74 -1.26 -4.22 116.66 121.81 1dr1 n ARG 77 Ca -0.15 0.12 -0.07 0.00 -0.77 0.00 0.00 57.85 56.98 1dr1 n ARG 77 Cb 0.56 -1.76 -0.15 0.00 -1.02 0.00 0.00 32.46 30.09 1dr1 n ARG 77 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1dr1 n GLU 78 N -2.73 0.66 -2.76 5.56 1.02 -1.26 -4.95 120.64 116.17 1dr1 n GLU 78 Ca -0.07 0.09 -0.32 0.00 -0.02 0.00 0.00 57.16 56.84 1dr1 n GLU 78 Cb 0.73 -1.63 -0.05 0.00 -0.02 0.00 0.00 31.44 30.48 1dr1 n GLU 78 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1dr1 s LEU 79 N -5.63 3.84 -0.20 -4.62 1.43 -1.26 -5.01 118.68 107.23 1dr1 s LEU 79 Ca -0.08 1.41 0.04 0.00 -1.03 0.00 0.00 54.13 54.47 1dr1 s LEU 79 Cb 0.07 -4.29 -0.21 0.00 0.03 0.00 0.00 46.19 41.79 1dr1 s LEU 79 CO 0.83 -0.41 0.03 0.29 0.23 0.00 0.00 176.35 177.32 1dr1 n LYS 80 N -1.06 0.68 -4.15 1.70 4.01 -1.26 -4.96 118.16 113.13 1dr1 n LYS 80 Ca 0.05 0.16 -0.11 0.00 -0.51 0.00 0.00 58.31 57.90 1dr1 n LYS 80 Cb 0.54 -1.58 -0.10 0.00 -0.51 0.00 0.00 35.03 33.37 1dr1 n LYS 80 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 1dr1 s GLU 81 N -2.53 0.79 0.26 1.97 2.02 -1.26 -5.12 118.70 114.82 1dr1 s GLU 81 Ca -0.25 -1.25 -0.30 0.00 0.02 0.00 0.00 54.97 53.19 1dr1 s GLU 81 Cb 0.08 -0.22 -0.11 0.00 0.10 0.00 0.00 34.13 33.99 1dr1 s GLU 81 CO 0.70 -0.01 1.51 0.00 0.02 0.00 0.00 175.26 177.48 1dr1 s ALA 82 N -3.29 3.69 0.75 5.21 0.00 -1.26 -4.94 121.76 121.92 1dr1 s ALA 82 Ca 0.09 1.42 -0.15 0.00 0.00 0.00 0.00 51.96 53.32 1dr1 s ALA 82 Cb 0.03 -3.60 0.03 0.00 0.00 0.00 0.00 23.12 19.58 1dr1 s ALA 82 CO -0.04 -0.83 1.09 -2.30 0.00 0.00 0.00 175.76 173.67 1dr1 n PRO 83 N 2.47 0.46 -1.68 0.00 -0.02 -1.26 -4.81 135.00 130.16 1dr1 n PRO 83 Ca 0.08 0.22 -0.47 0.00 -2.02 0.00 0.00 63.50 61.31 1dr1 n PRO 83 Cb 0.39 -2.34 -0.04 0.00 -0.02 0.00 0.00 33.50 31.49 1dr1 n PRO 83 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1dr1 n LYS 84 N -2.37 2.28 0.00 -0.52 3.00 -1.26 -1.54 118.16 117.75 1dr1 n LYS 84 Ca 0.13 0.83 0.00 0.00 -0.00 0.00 0.00 58.31 59.28 1dr1 n LYS 84 Cb 0.50 -2.68 0.00 0.00 0.00 0.00 0.00 35.03 32.85 1dr1 n LYS 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1dr1 n GLY 85 N 4.18 3.38 3.84 3.14 0.00 -1.26 -4.94 105.19 113.53 1dr1 n GLY 85 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1dr1 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dr1 s ALA 86 N -2.99 3.09 -0.02 4.61 0.00 -0.59 -3.98 121.76 121.87 1dr1 s ALA 86 Ca 0.00 0.16 -0.13 0.00 0.00 0.00 0.00 51.96 51.99 1dr1 s ALA 86 Cb 0.00 -3.09 -0.32 0.00 0.00 0.00 0.00 23.12 19.71 1dr1 s ALA 86 CO 0.00 -0.21 0.77 0.45 0.00 0.00 0.00 175.76 176.77 1dr1 h HIS 87 N 0.96 0.81 -3.40 0.00 -0.00 -1.68 -3.45 115.15 108.39 1dr1 h HIS 87 Ca -0.47 -0.59 -0.13 0.00 -0.00 0.00 0.00 60.37 59.18 1dr1 h HIS 87 Cb 1.18 -0.03 -0.20 0.00 -0.00 0.00 0.00 27.41 28.37 1dr1 h HIS 87 CO 0.64 1.65 -0.41 0.71 -0.00 0.00 0.00 177.93 180.51 1dr1 s TYR 88 N -2.58 -0.01 -0.07 2.45 2.02 -0.98 -5.01 117.35 113.16 1dr1 s TYR 88 Ca -0.14 -0.07 0.04 0.00 -0.37 0.00 0.00 57.07 56.53 1dr1 s TYR 88 Cb 0.05 -0.01 -0.01 0.00 -0.40 0.00 0.00 41.96 41.59 1dr1 s TYR 88 CO 0.88 -0.35 -0.20 -1.17 -1.57 0.00 0.00 175.55 173.14 1dr1 s LEU 89 N -1.55 2.36 0.08 -1.29 2.96 -1.26 -1.92 118.68 118.05 1dr1 s LEU 89 Ca -0.12 -0.41 0.03 0.00 -0.22 0.00 0.00 54.13 53.41 1dr1 s LEU 89 Cb -0.05 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 1dr1 s LEU 89 CO 0.01 0.24 -0.09 -0.44 -1.32 0.00 0.00 176.35 174.76 1dr1 s SER 90 N -0.13 1.18 0.01 3.68 0.01 -0.66 -4.96 113.70 112.83 1dr1 s SER 90 Ca -0.03 -0.75 0.23 0.00 1.31 0.00 0.00 55.95 56.70 1dr1 s SER 90 Cb -0.14 0.04 0.13 0.00 0.21 0.00 0.00 66.02 66.25 1dr1 s SER 90 CO 0.04 -0.28 1.13 0.29 0.41 0.00 0.00 173.24 174.83 1dr1 n LYS 91 N 0.78 0.09 -3.81 12.44 5.02 -1.26 -1.82 118.16 129.59 1dr1 n LYS 91 Ca -0.18 -0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.05 1dr1 n LYS 91 Cb 0.57 -1.53 -0.02 0.00 -0.02 0.00 0.00 35.03 34.04 1dr1 n LYS 91 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1dr1 s SER 92 N -3.27 -0.23 0.14 4.39 1.04 -1.26 -4.55 113.70 109.96 1dr1 s SER 92 Ca 0.08 -0.52 -0.15 0.00 0.48 0.00 0.00 55.95 55.84 1dr1 s SER 92 Cb 0.16 0.63 0.02 0.00 0.10 0.00 0.00 66.02 66.93 1dr1 s SER 92 CO 0.79 -1.17 1.69 0.25 0.98 0.00 0.00 173.24 175.78 1dr1 h LEU 93 N 2.00 0.62 -0.80 2.42 5.85 -1.99 -2.02 115.31 121.39 1dr1 h LEU 93 Ca -0.21 -0.17 0.19 0.00 0.84 0.00 0.00 57.88 58.53 1dr1 h LEU 93 Cb 1.24 -0.16 -0.13 0.00 0.37 0.00 0.00 40.66 41.99 1dr1 h LEU 93 CO 0.24 0.62 0.16 0.44 -0.34 0.00 0.00 178.44 179.55 1dr1 h ASP 94 N 0.58 -0.08 -0.20 1.25 3.32 -1.99 0.70 116.42 120.00 1dr1 h ASP 94 Ca 0.15 0.18 -0.13 0.00 0.02 0.00 0.00 57.03 57.24 1dr1 h ASP 94 Cb 0.19 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1dr1 h ASP 94 CO -0.01 -0.12 -0.34 0.44 -1.72 0.00 0.00 179.24 177.49 1dr1 h ASP 95 N 0.21 0.75 -0.46 6.45 3.32 -1.91 -0.48 116.42 124.30 1dr1 h ASP 95 Ca 0.47 -0.32 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 1dr1 h ASP 95 Cb 0.86 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 1dr1 h ASP 95 CO -0.60 1.03 -0.15 0.00 -1.72 0.00 0.00 179.24 177.79 1dr1 h ALA 96 N 1.02 0.80 -0.08 3.45 0.00 -0.20 -0.51 119.26 123.73 1dr1 h ALA 96 Ca 0.06 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1dr1 h ALA 96 Cb 0.87 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1dr1 h ALA 96 CO 0.08 0.66 0.03 -0.07 0.00 0.00 0.00 179.25 179.94 1dr1 h LEU 97 N 0.84 0.11 -0.76 0.00 3.38 0.10 -2.27 115.31 116.71 1dr1 h LEU 97 Ca 0.12 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 57.97 1dr1 h LEU 97 Cb 0.70 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 1dr1 h LEU 97 CO 0.05 0.26 0.46 0.00 0.09 0.00 0.00 178.44 179.30 1dr1 h ALA 98 N 0.86 1.03 -0.53 1.53 0.00 -1.11 -1.90 119.26 119.13 1dr1 h ALA 98 Ca 0.03 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.00 1dr1 h ALA 98 Cb 0.18 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 1dr1 h ALA 98 CO -0.00 0.19 0.21 1.25 0.00 0.00 0.00 179.25 180.90 1dr1 h LEU 99 N 0.86 0.24 -0.72 0.00 5.85 -0.91 -2.33 115.31 118.29 1dr1 h LEU 99 Ca 0.33 0.06 0.05 0.00 0.84 0.00 0.00 57.88 59.16 1dr1 h LEU 99 Cb 0.14 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 1dr1 h LEU 99 CO -0.16 0.16 0.43 -0.07 -0.34 0.00 0.00 178.44 178.46 1dr1 h LEU 100 N 0.41 0.66 -0.18 2.25 3.38 -0.76 -1.15 115.31 119.91 1dr1 h LEU 100 Ca 0.26 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1dr1 h LEU 100 Cb 0.26 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1dr1 h LEU 100 CO -0.24 0.43 0.00 0.47 0.09 0.00 0.00 178.44 179.19 1dr1 n ASP 101 N -4.72 0.31 -4.59 -0.43 8.00 -0.98 -2.31 116.55 111.83 1dr1 n ASP 101 Ca 0.09 0.56 -0.30 0.00 0.71 0.00 0.00 54.79 55.85 1dr1 n ASP 101 Cb 0.15 -0.63 0.21 0.00 -0.02 0.00 0.00 41.12 40.83 1dr1 n ASP 101 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1dr1 s SER 102 N -3.58 2.02 0.08 -2.24 1.04 -0.44 -4.67 113.70 105.91 1dr1 s SER 102 Ca 0.09 1.95 -0.29 0.00 0.48 0.00 0.00 55.95 58.18 1dr1 s SER 102 Cb 0.12 -2.49 -0.17 0.00 0.10 0.00 0.00 66.02 63.59 1dr1 s SER 102 CO 0.42 -3.63 1.67 1.55 0.98 0.00 0.00 173.24 174.23 1dr1 h PRO 103 N -2.23 -0.50 -0.07 4.02 0.13 -1.89 -1.66 132.00 129.80 1dr1 h PRO 103 Ca -0.51 0.03 0.02 0.00 -0.87 0.00 0.00 66.00 64.68 1dr1 h PRO 103 Cb 1.30 0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.54 1dr1 h PRO 103 CO 0.44 -0.33 0.06 1.05 -0.23 0.00 0.00 178.00 178.99 1dr1 h GLU 104 N -0.52 0.00 0.00 0.86 9.09 -1.92 -3.30 114.58 118.79 1dr1 h GLU 104 Ca -0.05 0.00 -0.35 0.00 0.05 0.00 0.00 59.36 59.01 1dr1 h GLU 104 Cb 0.41 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.45 1dr1 h GLU 104 CO 0.07 0.00 -2.01 1.28 0.05 0.00 0.00 179.01 178.40 1dr1 n LEU 105 N -4.23 1.93 -0.30 3.06 4.77 -1.22 -4.45 117.00 116.56 1dr1 n LEU 105 Ca -0.01 0.37 0.04 0.00 -0.03 0.00 0.00 56.01 56.38 1dr1 n LEU 105 Cb 0.16 -0.85 0.10 0.00 -2.33 0.00 0.00 43.42 40.50 1dr1 n LEU 105 CO 0.31 0.39 0.53 1.17 -1.33 0.00 0.00 177.39 178.47 1dr1 n LYS 106 N -4.33 -0.09 0.05 3.23 3.00 -0.63 0.24 118.16 119.63 1dr1 n LYS 106 Ca -0.44 1.28 0.11 0.00 -0.00 0.00 0.00 58.31 59.27 1dr1 n LYS 106 Cb 0.78 -1.92 0.46 0.00 0.00 0.00 0.00 35.03 34.35 1dr1 n LYS 106 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1dr1 n SER 107 N -5.32 0.28 -0.01 3.14 3.41 -1.24 -3.52 113.62 110.36 1dr1 n SER 107 Ca 0.12 0.55 0.09 0.00 -0.26 0.00 0.00 58.87 59.37 1dr1 n SER 107 Cb 0.40 -0.62 -0.12 0.00 -0.26 0.00 0.00 64.21 63.61 1dr1 n SER 107 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1dr1 n LYS 108 N -1.79 0.81 -4.55 4.33 4.81 0.67 -4.86 118.16 117.58 1dr1 n LYS 108 Ca 0.05 -0.11 -0.34 0.00 -0.87 0.00 0.00 58.31 57.04 1dr1 n LYS 108 Cb 0.28 -1.38 -0.12 0.00 0.02 0.00 0.00 35.03 33.83 1dr1 n LYS 108 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1dr1 s VAL 109 N -3.02 3.70 0.00 3.15 1.01 -0.41 -1.45 120.40 123.38 1dr1 s VAL 109 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1dr1 s VAL 109 Cb 0.12 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.94 1dr1 s VAL 109 CO 0.72 0.55 0.00 -0.67 0.00 0.00 0.00 175.10 175.70 1dr1 n ASP 110 N 2.92 0.00 -4.94 3.32 2.03 -0.15 -4.87 116.55 114.86 1dr1 n ASP 110 Ca -0.18 0.00 -0.27 0.00 0.52 0.00 0.00 54.79 54.86 1dr1 n ASP 110 Cb 0.53 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.89 1dr1 n ASP 110 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1dr1 s MET 111 N 0.00 3.45 -0.23 -0.67 1.00 -1.26 -4.93 119.30 116.65 1dr1 s MET 111 Ca 0.00 -0.54 -0.05 0.00 0.00 0.00 0.00 55.69 55.10 1dr1 s MET 111 Cb 0.00 -2.98 -0.02 0.00 0.00 0.00 0.00 34.83 31.84 1dr1 s MET 111 CO 0.00 0.54 0.00 0.08 0.00 0.00 0.00 175.02 175.64 1dr1 s VAL 112 N -1.69 3.76 -0.07 -6.03 1.01 -1.26 0.87 120.40 116.99 1dr1 s VAL 112 Ca 0.35 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 62.01 1dr1 s VAL 112 Cb -0.12 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1dr1 s VAL 112 CO 0.28 0.39 -0.20 0.26 0.00 0.00 0.00 175.10 175.83 1dr1 s TRP 113 N 1.53 2.57 -0.28 5.22 0.52 0.12 -2.47 118.94 126.16 1dr1 s TRP 113 Ca 0.06 -0.54 -0.13 0.00 0.02 0.00 0.00 56.10 55.51 1dr1 s TRP 113 Cb -0.15 -1.65 -0.04 0.00 -1.15 0.00 0.00 33.47 30.49 1dr1 s TRP 113 CO -0.00 -0.10 0.30 0.42 0.02 0.00 0.00 176.95 177.59 1dr1 s ILE 114 N -0.25 5.23 -0.48 2.03 -1.09 0.17 -0.40 121.20 126.40 1dr1 s ILE 114 Ca -0.00 0.40 0.11 0.00 -2.23 0.00 0.00 60.65 58.93 1dr1 s ILE 114 Cb -0.13 -3.64 0.31 0.00 -1.58 0.00 0.00 42.46 37.42 1dr1 s ILE 114 CO 0.03 0.18 1.25 1.33 -1.23 0.00 0.00 174.94 176.50 1dr1 n VAL 115 N 5.10 1.44 -0.06 2.92 0.24 -0.77 -1.79 118.33 125.40 1dr1 n VAL 115 Ca -0.11 -1.36 0.00 0.00 -2.04 0.00 0.00 64.34 60.83 1dr1 n VAL 115 Cb 0.51 0.22 0.00 0.00 -1.47 0.00 0.00 33.84 33.10 1dr1 n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dr1 n GLY 116 N -0.13 -3.62 0.00 7.63 0.00 -1.26 -4.93 105.19 102.88 1dr1 n GLY 116 Ca 0.13 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1dr1 n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dr1 n GLY 117 N -0.32 1.21 0.37 -0.02 0.00 -1.26 -0.73 105.19 104.43 1dr1 n GLY 117 Ca 0.00 -1.70 -0.11 0.00 0.00 0.00 0.00 46.02 44.21 1dr1 n GLY 117 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1dr1 h THR 118 N 0.00 0.00 -0.49 2.61 2.02 -1.98 -1.25 112.91 113.83 1dr1 h THR 118 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1dr1 h THR 118 Cb 0.00 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.39 1dr1 h THR 118 CO 0.00 0.00 0.27 0.00 0.37 0.00 0.00 175.52 176.16 1dr1 h ALA 119 N -0.04 1.56 -0.18 6.16 0.00 -1.96 -1.16 119.26 123.64 1dr1 h ALA 119 Ca 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1dr1 h ALA 119 Cb 0.44 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1dr1 h ALA 119 CO -0.62 0.37 0.05 0.28 0.00 0.00 0.00 179.25 179.33 1dr1 h VAL 120 N 0.67 1.20 -0.52 0.00 2.07 -1.68 -2.37 116.25 115.62 1dr1 h VAL 120 Ca 0.17 -0.64 0.03 0.00 0.82 0.00 0.00 66.70 67.09 1dr1 h VAL 120 Cb 0.01 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1dr1 h VAL 120 CO -0.03 0.20 0.30 1.88 0.02 0.00 0.00 177.57 179.94 1dr1 h TYR 121 N 0.11 0.56 0.12 1.57 0.05 -1.04 -2.09 116.97 116.25 1dr1 h TYR 121 Ca 0.06 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.85 1dr1 h TYR 121 Cb 0.26 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 37.82 1dr1 h TYR 121 CO 0.01 0.31 -0.06 -0.22 -1.05 0.00 0.00 178.16 177.15 1dr1 h LYS 122 N 0.60 -0.15 -0.49 4.88 3.64 -1.21 -0.35 116.57 123.48 1dr1 h LYS 122 Ca 0.21 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.68 1dr1 h LYS 122 Cb 0.05 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 31.84 1dr1 h LYS 122 CO -0.11 -0.04 0.12 0.00 -2.27 0.00 0.00 179.45 177.16 1dr1 h ALA 123 N 0.63 0.57 -0.47 5.00 0.00 -1.38 -2.43 119.26 121.18 1dr1 h ALA 123 Ca -0.02 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1dr1 h ALA 123 Cb 0.19 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1dr1 h ALA 123 CO 0.03 -0.28 -0.17 0.00 0.00 0.00 0.00 179.25 178.82 1dr1 h ALA 124 N 1.36 0.80 -0.30 0.00 0.00 -1.20 -2.94 119.26 116.98 1dr1 h ALA 124 Ca 0.24 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1dr1 h ALA 124 Cb 0.30 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1dr1 h ALA 124 CO -0.29 0.65 0.03 0.52 0.00 0.00 0.00 179.25 180.16 1dr1 h MET 125 N 0.81 0.45 0.00 0.00 2.07 -0.75 -2.73 114.93 114.78 1dr1 h MET 125 Ca 0.12 -0.08 0.00 0.00 -2.07 0.00 0.00 59.70 57.67 1dr1 h MET 125 Cb 0.72 -0.07 0.00 0.00 -1.87 0.00 0.00 31.60 30.38 1dr1 h MET 125 CO 0.06 0.46 0.00 0.93 1.07 0.00 0.00 176.91 179.42 1dr1 h GLU 126 N 0.44 0.00 -6.79 1.72 5.08 -1.26 -3.46 114.58 110.30 1dr1 h GLU 126 Ca 0.10 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.94 1dr1 h GLU 126 Cb 0.25 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.55 1dr1 h GLU 126 CO 0.00 0.00 0.66 0.15 -1.00 0.00 0.00 179.01 178.82 1dr1 s LYS 127 N -3.33 4.36 -1.40 2.33 -0.14 -1.03 -4.89 119.74 115.65 1dr1 s LYS 127 Ca 0.06 2.17 -0.13 0.00 -1.36 0.00 0.00 55.97 56.71 1dr1 s LYS 127 Cb 0.08 -3.12 0.08 0.00 -1.68 0.00 0.00 37.83 33.19 1dr1 s LYS 127 CO 0.59 -0.23 2.08 -0.35 -0.76 0.00 0.00 175.35 176.68 1dr1 n PRO 128 N 1.63 3.08 -3.96 -1.68 -0.04 -1.26 -4.81 135.00 127.96 1dr1 n PRO 128 Ca 0.03 -2.91 -0.09 0.00 -0.04 0.00 0.00 63.50 60.48 1dr1 n PRO 128 Cb 0.42 -3.21 -0.10 0.00 -0.04 0.00 0.00 33.50 30.57 1dr1 n PRO 128 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1dr1 s ILE 129 N 2.56 0.14 0.28 0.52 2.07 -1.26 -4.98 121.20 120.53 1dr1 s ILE 129 Ca 0.46 -1.16 -0.30 0.00 -1.41 0.00 0.00 60.65 58.24 1dr1 s ILE 129 Cb 0.12 -0.89 -0.12 0.00 0.13 0.00 0.00 42.46 41.70 1dr1 s ILE 129 CO -0.05 -0.64 1.53 0.59 -1.91 0.00 0.00 174.94 174.46 1dr1 n ASN 130 N 0.80 3.47 -3.67 4.50 4.13 -1.26 -4.76 115.26 118.46 1dr1 n ASN 130 Ca -0.19 1.15 -0.14 0.00 1.68 0.00 0.00 54.58 57.08 1dr1 n ASN 130 Cb 0.58 -1.54 -0.08 0.00 -1.54 0.00 0.00 39.78 37.21 1dr1 n ASN 130 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 1dr1 s HIS 131 N -0.06 -0.65 -0.11 3.10 2.46 -0.60 -1.06 115.29 118.37 1dr1 s HIS 131 Ca 0.65 1.59 0.03 0.00 0.47 0.00 0.00 55.06 57.79 1dr1 s HIS 131 Cb -0.55 0.23 -0.01 0.00 -0.13 0.00 0.00 32.58 32.12 1dr1 s HIS 131 CO 0.49 -0.32 -0.20 1.03 -2.47 0.00 0.00 174.74 173.27 1dr1 s ARG 132 N 0.28 3.16 -0.17 2.88 0.52 -0.71 0.48 118.95 125.39 1dr1 s ARG 132 Ca -0.00 -0.81 -0.00 0.00 -0.52 0.00 0.00 55.73 54.40 1dr1 s ARG 132 Cb -0.04 -2.42 0.00 0.00 0.52 0.00 0.00 34.95 33.01 1dr1 s ARG 132 CO 0.01 0.20 -0.15 -1.17 0.02 0.00 0.00 175.30 174.21 1dr1 s LEU 133 N 0.32 2.46 -0.41 2.53 2.96 0.19 -1.65 118.68 125.08 1dr1 s LEU 133 Ca -0.15 -0.50 -0.15 0.00 -0.22 0.00 0.00 54.13 53.11 1dr1 s LEU 133 Cb -0.17 -1.57 0.02 0.00 0.50 0.00 0.00 46.19 44.97 1dr1 s LEU 133 CO 0.08 0.05 0.29 -0.36 -1.32 0.00 0.00 176.35 175.09 1dr1 s PHE 134 N 1.00 3.24 -0.18 5.38 0.40 -0.33 -0.05 117.98 127.43 1dr1 s PHE 134 Ca -0.02 -0.65 -0.03 0.00 -0.60 0.00 0.00 56.93 55.64 1dr1 s PHE 134 Cb -0.15 -2.60 -0.02 0.00 0.51 0.00 0.00 43.02 40.77 1dr1 s PHE 134 CO -0.03 -0.61 -0.06 0.08 0.70 0.00 0.00 175.22 175.30 1dr1 s VAL 135 N 1.66 3.45 -0.31 -0.44 1.01 0.10 -2.03 120.40 123.85 1dr1 s VAL 135 Ca 0.05 -0.49 -0.18 0.00 0.00 0.00 0.00 61.98 61.36 1dr1 s VAL 135 Cb -0.19 -2.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 1dr1 s VAL 135 CO 0.09 0.47 0.49 -0.89 0.00 0.00 0.00 175.10 175.27 1dr1 s THR 136 N 0.87 5.06 -0.42 3.92 2.01 -0.39 -0.91 115.64 125.77 1dr1 s THR 136 Ca -0.01 0.56 -0.20 0.00 0.31 0.00 0.00 61.69 62.34 1dr1 s THR 136 Cb -0.15 -3.88 0.02 0.00 0.01 0.00 0.00 72.50 68.50 1dr1 s THR 136 CO 0.01 -0.06 0.60 -0.13 -0.69 0.00 0.00 174.62 174.35 1dr1 s ARG 137 N 2.32 3.31 -0.30 4.92 1.81 0.42 -0.38 118.95 131.06 1dr1 s ARG 137 Ca 0.19 -0.37 -0.20 0.00 -1.72 0.00 0.00 55.73 53.62 1dr1 s ARG 137 Cb -0.16 -3.93 -0.01 0.00 -0.45 0.00 0.00 34.95 30.40 1dr1 s ARG 137 CO 0.11 -0.94 0.62 0.42 -0.68 0.00 0.00 175.30 174.84 1dr1 s ILE 138 N 2.69 4.95 -0.29 1.52 1.01 0.24 -1.07 121.20 130.25 1dr1 s ILE 138 Ca 0.21 0.88 -0.06 0.00 0.00 0.00 0.00 60.65 61.68 1dr1 s ILE 138 Cb -0.15 -3.98 -0.22 0.00 0.01 0.00 0.00 42.46 38.12 1dr1 s ILE 138 CO 0.17 -0.11 3.46 0.18 0.00 0.00 0.00 174.94 178.65 1dr1 n LEU 139 N 5.84 5.89 -3.55 2.97 4.77 -0.05 -3.05 117.00 129.82 1dr1 n LEU 139 Ca -0.01 -3.44 -0.11 0.00 -0.03 0.00 0.00 56.01 52.42 1dr1 n LEU 139 Cb 0.49 -1.43 -0.02 0.00 -2.33 0.00 0.00 43.42 40.13 1dr1 n LEU 139 CO 0.45 1.76 0.38 -1.00 -1.33 0.00 0.00 177.39 177.65 1dr1 s HIS 140 N 0.98 -0.40 -0.15 -1.77 3.76 -1.26 -4.84 115.29 111.61 1dr1 s HIS 140 Ca 0.67 0.12 -0.06 0.00 -0.15 0.00 0.00 55.06 55.64 1dr1 s HIS 140 Cb 0.30 0.54 -0.04 0.00 1.11 0.00 0.00 32.58 34.49 1dr1 s HIS 140 CO -0.02 -0.91 0.04 -1.21 -0.85 0.00 0.00 174.74 171.79 1dr1 s GLU 141 N -3.80 3.66 0.03 1.40 2.02 -1.26 -0.61 118.70 120.14 1dr1 s GLU 141 Ca 0.04 -0.35 0.04 0.00 0.02 0.00 0.00 54.97 54.72 1dr1 s GLU 141 Cb -0.02 -3.08 -0.02 0.00 0.10 0.00 0.00 34.13 31.11 1dr1 s GLU 141 CO -0.08 0.42 -0.12 -0.06 0.02 0.00 0.00 175.26 175.44 1dr1 s PHE 142 N -0.07 1.09 0.26 1.61 0.40 -1.26 -5.00 117.98 115.00 1dr1 s PHE 142 Ca 0.06 -0.34 -0.30 0.00 -0.60 0.00 0.00 56.93 55.75 1dr1 s PHE 142 Cb -0.12 -0.65 -0.10 0.00 0.51 0.00 0.00 43.02 42.65 1dr1 s PHE 142 CO 0.01 0.01 1.43 -1.83 0.70 0.00 0.00 175.22 175.54 1dr1 s GLU 143 N -1.03 4.27 0.04 0.44 -1.05 -1.26 -4.89 118.70 115.22 1dr1 s GLU 143 Ca 0.01 2.30 -0.00 0.00 -0.15 0.00 0.00 54.97 57.12 1dr1 s GLU 143 Cb -0.07 -3.10 -0.03 0.00 -0.44 0.00 0.00 34.13 30.48 1dr1 s GLU 143 CO 0.01 -0.40 -0.03 -1.12 0.95 0.00 0.00 175.26 174.67 1dr1 s SER 144 N 0.26 0.46 0.00 0.83 0.01 -1.26 -4.74 113.70 109.25 1dr1 s SER 144 Ca 0.58 -0.81 0.00 0.00 1.31 0.00 0.00 55.95 57.03 1dr1 s SER 144 Cb -0.42 0.15 0.00 0.00 0.21 0.00 0.00 66.02 65.97 1dr1 s SER 144 CO 0.45 -0.47 0.14 -0.90 0.41 0.00 0.00 173.24 172.86 1dr1 n ASP 145 N 0.67 0.27 -4.08 2.44 5.68 -0.30 -5.00 116.55 116.24 1dr1 n ASP 145 Ca -0.18 -0.60 -0.22 0.00 -0.50 0.00 0.00 54.79 53.29 1dr1 n ASP 145 Cb 0.59 0.41 -0.15 0.00 -1.14 0.00 0.00 41.12 40.82 1dr1 n ASP 145 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1dr1 s THR 146 N -0.41 1.06 0.12 2.12 2.01 -1.03 -5.01 115.64 114.51 1dr1 s THR 146 Ca 0.00 -0.54 0.05 0.00 0.31 0.00 0.00 61.69 61.51 1dr1 s THR 146 Cb 0.00 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 1dr1 s THR 146 CO 0.00 0.31 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.75 1dr1 s PHE 147 N -0.07 1.33 0.32 4.92 0.08 -1.26 -0.97 117.98 122.33 1dr1 s PHE 147 Ca 0.01 -0.60 -0.26 0.00 0.12 0.00 0.00 56.93 56.20 1dr1 s PHE 147 Cb -0.08 -0.69 -0.10 0.00 -0.57 0.00 0.00 43.02 41.58 1dr1 s PHE 147 CO 0.00 0.12 0.96 0.12 -0.10 0.00 0.00 175.22 176.32 1dr1 s PHE 148 N -2.35 3.68 0.87 0.36 5.36 0.53 -4.63 117.98 121.79 1dr1 s PHE 148 Ca 0.09 1.78 -0.11 0.00 -0.96 0.00 0.00 56.93 57.74 1dr1 s PHE 148 Cb -0.04 -2.95 0.11 0.00 -0.34 0.00 0.00 43.02 39.81 1dr1 s PHE 148 CO 0.02 0.15 1.09 -1.25 -1.46 0.00 0.00 175.22 173.78 1dr1 s PRO 149 N -2.01 1.50 0.16 10.12 0.04 -1.26 -4.96 135.00 138.58 1dr1 s PRO 149 Ca 0.50 1.02 -0.31 0.00 0.04 0.00 0.00 61.00 62.26 1dr1 s PRO 149 Cb -0.20 -1.82 -0.08 0.00 0.04 0.00 0.00 34.50 32.44 1dr1 s PRO 149 CO 0.25 -2.13 1.38 -1.21 0.04 0.00 0.00 177.00 175.33 1dr1 s GLU 150 N -4.87 4.33 -0.08 4.56 2.02 -1.26 -5.01 118.70 118.39 1dr1 s GLU 150 Ca 0.63 2.11 -0.13 0.00 0.02 0.00 0.00 54.97 57.59 1dr1 s GLU 150 Cb -0.18 -3.21 -0.05 0.00 0.10 0.00 0.00 34.13 30.78 1dr1 s GLU 150 CO 0.57 -0.39 0.33 -1.50 0.02 0.00 0.00 175.26 174.29 1dr1 s ILE 151 N 0.69 5.21 -0.69 -1.63 1.10 -1.26 -5.05 121.20 119.57 1dr1 s ILE 151 Ca 0.62 0.65 -0.27 0.00 -0.51 0.00 0.00 60.65 61.13 1dr1 s ILE 151 Cb -0.38 -3.64 0.03 0.00 0.15 0.00 0.00 42.46 38.62 1dr1 s ILE 151 CO 0.34 0.52 1.28 -0.62 -2.11 0.00 0.00 174.94 174.35 1dr1 s ASP 152 N -0.52 6.20 0.06 4.50 -1.08 -1.26 -4.87 116.67 119.71 1dr1 s ASP 152 Ca 0.20 -0.25 0.13 0.00 -0.52 0.00 0.00 52.55 52.11 1dr1 s ASP 152 Cb -0.15 -2.56 0.56 0.00 -1.46 0.00 0.00 42.92 39.32 1dr1 s ASP 152 CO 0.09 -1.76 1.40 -1.22 0.52 0.00 0.00 175.17 174.20 1dr1 n TYR 153 N 9.25 0.18 0.07 -5.34 4.01 -1.26 -0.78 117.16 123.29 1dr1 n TYR 153 Ca 0.05 0.08 -0.05 0.00 -0.16 0.00 0.00 57.90 57.82 1dr1 n TYR 153 Cb 0.49 -0.62 -0.09 0.00 -0.31 0.00 0.00 39.34 38.81 1dr1 n TYR 153 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1dr1 h LYS 154 N 0.00 0.00 0.02 -0.72 1.57 -2.03 -3.38 116.57 112.03 1dr1 h LYS 154 Ca 0.00 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 1dr1 h LYS 154 Cb 0.19 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 1dr1 h LYS 154 CO 0.00 0.85 -1.50 -0.25 -0.57 0.00 0.00 179.45 177.98 1dr1 n ASP 155 N -3.30 1.90 -4.51 0.86 8.00 -0.34 -4.81 116.55 114.36 1dr1 n ASP 155 Ca -0.01 0.38 -0.43 0.00 0.71 0.00 0.00 54.79 55.44 1dr1 n ASP 155 Cb 0.90 -0.93 -0.07 0.00 -0.02 0.00 0.00 41.12 41.00 1dr1 n ASP 155 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1dr1 s PHE 156 N -2.40 3.09 -0.10 1.24 0.40 0.04 -4.20 117.98 116.04 1dr1 s PHE 156 Ca -0.29 -0.09 -0.15 0.00 -0.60 0.00 0.00 56.93 55.80 1dr1 s PHE 156 Cb 0.07 -3.26 -0.05 0.00 0.51 0.00 0.00 43.02 40.29 1dr1 s PHE 156 CO 0.60 -0.83 0.37 0.15 0.70 0.00 0.00 175.22 176.22 1dr1 s LYS 157 N 2.69 4.15 0.09 0.44 -0.14 -0.83 -4.45 119.74 121.69 1dr1 s LYS 157 Ca 0.21 0.27 -0.31 0.00 -1.36 0.00 0.00 55.97 54.78 1dr1 s LYS 157 Cb -0.15 -3.36 -0.06 0.00 -1.68 0.00 0.00 37.83 32.58 1dr1 s LYS 157 CO 0.18 0.36 1.25 -1.17 -0.76 0.00 0.00 175.35 175.21 1dr1 s LEU 158 N 0.04 4.38 0.28 3.17 2.96 -1.26 -0.99 118.68 127.25 1dr1 s LEU 158 Ca 0.21 2.12 -0.18 0.00 -0.22 0.00 0.00 54.13 56.06 1dr1 s LEU 158 Cb -0.15 -3.58 -0.09 0.00 0.50 0.00 0.00 46.19 42.87 1dr1 s LEU 158 CO 0.08 -0.51 0.75 -0.76 -1.32 0.00 0.00 176.35 174.59 1dr1 s LEU 159 N 0.95 4.20 0.19 -0.68 1.43 -0.04 -4.95 118.68 119.79 1dr1 s LEU 159 Ca 0.60 1.39 0.24 0.00 -1.03 0.00 0.00 54.13 55.32 1dr1 s LEU 159 Cb -0.32 -3.87 0.33 0.00 0.03 0.00 0.00 46.19 42.36 1dr1 s LEU 159 CO 0.30 -0.10 1.36 0.71 0.23 0.00 0.00 176.35 178.86 1dr1 h THR 160 N 2.35 0.00 -2.55 5.49 1.35 -1.95 -3.43 112.91 114.17 1dr1 h THR 160 Ca -0.48 -0.67 -0.04 0.00 -0.55 0.00 0.00 66.41 64.67 1dr1 h THR 160 Cb 1.18 1.35 -0.15 0.00 -1.73 0.00 0.00 68.15 68.80 1dr1 h THR 160 CO 0.65 0.00 0.20 -0.70 -0.25 0.00 0.00 175.52 175.42 1dr1 s GLU 161 N -3.21 1.18 -0.19 4.72 2.12 -1.26 -5.04 118.70 117.01 1dr1 s GLU 161 Ca 0.05 -0.14 -0.24 0.00 0.36 0.00 0.00 54.97 55.00 1dr1 s GLU 161 Cb 0.11 0.55 0.06 0.00 0.26 0.00 0.00 34.13 35.11 1dr1 s GLU 161 CO 0.71 -0.45 0.65 -0.47 -0.54 0.00 0.00 175.26 175.16 1dr1 s TYR 162 N -2.58 -0.69 -0.34 5.30 5.04 -1.26 -5.08 117.35 117.73 1dr1 s TYR 162 Ca -0.04 1.57 -0.35 0.00 -2.44 0.00 0.00 57.07 55.80 1dr1 s TYR 162 Cb -0.01 0.28 -0.11 0.00 0.35 0.00 0.00 41.96 42.47 1dr1 s TYR 162 CO -0.03 -0.41 2.18 -2.30 -1.34 0.00 0.00 175.55 173.66 1dr1 n PRO 163 N 2.25 1.09 -0.38 4.97 -0.02 -1.26 -2.37 135.00 139.29 1dr1 n PRO 163 Ca -0.15 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1dr1 n PRO 163 Cb 0.56 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1dr1 n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dr1 n GLY 164 N 6.51 0.78 3.28 -1.23 0.00 -1.26 -5.05 105.19 108.22 1dr1 n GLY 164 Ca 0.41 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.08 1dr1 n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dr1 s VAL 165 N -2.16 3.19 0.55 1.61 1.01 -1.00 -5.09 120.40 118.50 1dr1 s VAL 165 Ca 0.00 -0.62 -0.20 0.00 0.00 0.00 0.00 61.98 61.16 1dr1 s VAL 165 Cb 0.00 -2.47 -0.06 0.00 0.00 0.00 0.00 36.38 33.84 1dr1 s VAL 165 CO 0.00 0.39 1.02 -2.65 0.00 0.00 0.00 175.10 173.86 1dr1 n PRO 166 N 4.76 1.12 -0.08 2.72 -0.02 -1.26 -4.64 135.00 137.60 1dr1 n PRO 166 Ca -0.18 0.42 -0.14 0.00 -2.02 0.00 0.00 63.50 61.57 1dr1 n PRO 166 Cb 0.50 -2.18 -0.14 0.00 -0.02 0.00 0.00 33.50 31.66 1dr1 n PRO 166 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dr1 n ALA 167 N -1.30 1.37 -1.38 3.55 0.00 -1.26 -4.55 120.51 116.94 1dr1 n ALA 167 Ca 0.12 -1.04 -0.30 0.00 0.00 0.00 0.00 53.44 52.22 1dr1 n ALA 167 Cb 0.45 -0.35 0.10 0.00 0.00 0.00 0.00 19.45 19.65 1dr1 n ALA 167 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dr1 s ASP 168 N -6.20 4.31 0.21 0.00 1.01 -1.26 -4.86 116.67 109.88 1dr1 s ASP 168 Ca -0.20 1.53 -0.30 0.00 0.71 0.00 0.00 52.55 54.29 1dr1 s ASP 168 Cb 0.07 -2.26 -0.10 0.00 1.01 0.00 0.00 42.92 41.65 1dr1 s ASP 168 CO 0.74 -2.11 1.42 -0.63 0.21 0.00 0.00 175.17 174.80 1dr1 s ILE 169 N -3.01 2.85 0.24 0.77 1.01 -1.26 -4.69 121.20 117.11 1dr1 s ILE 169 Ca 0.61 0.69 0.05 0.00 0.00 0.00 0.00 60.65 62.00 1dr1 s ILE 169 Cb -0.16 -3.44 -0.03 0.00 0.01 0.00 0.00 42.46 38.84 1dr1 s ILE 169 CO 0.56 0.10 0.36 -1.10 0.00 0.00 0.00 174.94 174.85 1dr1 s GLN 170 N -0.00 3.44 0.01 2.79 -1.52 0.28 -4.94 119.66 119.72 1dr1 s GLN 170 Ca 0.60 -0.73 -0.01 0.00 -1.95 0.00 0.00 55.36 53.27 1dr1 s GLN 170 Cb -0.40 -2.89 -0.01 0.00 -0.22 0.00 0.00 33.01 29.48 1dr1 s GLN 170 CO 0.39 0.43 0.00 -2.00 -0.25 0.00 0.00 175.29 173.86 1dr1 s GLU 171 N -3.93 0.31 -0.28 2.91 2.12 -1.26 -1.23 118.70 117.34 1dr1 s GLU 171 Ca 0.34 -0.52 -0.22 0.00 0.36 0.00 0.00 54.97 54.94 1dr1 s GLU 171 Cb -0.09 0.12 0.12 0.00 0.26 0.00 0.00 34.13 34.54 1dr1 s GLU 171 CO 0.29 -0.06 0.98 -2.00 -0.54 0.00 0.00 175.26 173.94 1dr1 s GLU 172 N -1.31 0.49 -1.42 4.30 2.12 0.11 -4.91 118.70 118.07 1dr1 s GLU 172 Ca -0.14 0.67 -0.08 0.00 0.36 0.00 0.00 54.97 55.78 1dr1 s GLU 172 Cb -0.09 0.19 0.05 0.00 0.26 0.00 0.00 34.13 34.54 1dr1 s GLU 172 CO -0.00 -0.07 0.62 -0.25 -0.54 0.00 0.00 175.26 175.01 1dr1 n ASP 173 N 2.81 -4.89 0.00 -1.70 8.00 -1.26 -0.75 116.55 118.76 1dr1 n ASP 173 Ca -0.15 -0.40 0.00 0.00 0.71 0.00 0.00 54.79 54.96 1dr1 n ASP 173 Cb 0.57 -3.97 0.00 0.00 -0.02 0.00 0.00 41.12 37.69 1dr1 n ASP 173 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dr1 n GLY 174 N -1.40 0.93 3.60 0.44 0.00 -1.26 -5.01 105.19 102.49 1dr1 n GLY 174 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 1dr1 n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dr1 s ILE 175 N -3.71 3.71 0.07 -0.61 -1.09 0.07 -5.13 121.20 114.51 1dr1 s ILE 175 Ca 0.00 -0.72 0.05 0.00 -2.23 0.00 0.00 60.65 57.75 1dr1 s ILE 175 Cb 0.00 -2.61 -0.04 0.00 -1.58 0.00 0.00 42.46 38.23 1dr1 s ILE 175 CO 0.00 0.42 -0.03 -1.10 -1.23 0.00 0.00 174.94 173.00 1dr1 s GLN 176 N -1.36 2.49 0.14 2.79 -0.21 -1.26 0.05 119.66 122.31 1dr1 s GLN 176 Ca 0.17 -0.84 -0.13 0.00 0.02 0.00 0.00 55.36 54.58 1dr1 s GLN 176 Cb -0.11 -2.50 0.02 0.00 1.00 0.00 0.00 33.01 31.41 1dr1 s GLN 176 CO 0.07 0.55 0.36 1.52 -2.12 0.00 0.00 175.29 175.67 1dr1 s TYR 177 N -1.22 0.03 0.03 0.91 -0.85 -0.36 -0.87 117.35 115.02 1dr1 s TYR 177 Ca 0.23 -0.39 0.02 0.00 -0.52 0.00 0.00 57.07 56.41 1dr1 s TYR 177 Cb -0.11 0.15 -0.02 0.00 0.38 0.00 0.00 41.96 42.36 1dr1 s TYR 177 CO 0.15 -0.73 -0.07 -1.59 -1.52 0.00 0.00 175.55 171.80 1dr1 s LYS 178 N -3.87 0.47 -0.10 -3.49 -2.85 -0.23 1.00 119.74 110.66 1dr1 s LYS 178 Ca 0.08 -0.62 -0.14 0.00 -1.00 0.00 0.00 55.97 54.29 1dr1 s LYS 178 Cb 0.02 -0.26 -0.05 0.00 -2.06 0.00 0.00 37.83 35.48 1dr1 s LYS 178 CO -0.07 0.05 0.33 -0.06 0.10 0.00 0.00 175.35 175.70 1dr1 s PHE 179 N -1.13 3.56 0.06 1.78 0.08 -1.26 -0.43 117.98 120.64 1dr1 s PHE 179 Ca -0.08 0.74 0.05 0.00 0.12 0.00 0.00 56.93 57.75 1dr1 s PHE 179 Cb -0.08 -2.30 -0.03 0.00 -0.57 0.00 0.00 43.02 40.04 1dr1 s PHE 179 CO 0.00 0.42 -0.13 -1.21 -0.10 0.00 0.00 175.22 174.19 1dr1 s GLU 180 N -0.17 0.80 -0.09 0.44 2.02 -0.09 -4.91 118.70 116.71 1dr1 s GLU 180 Ca 0.19 -0.90 0.01 0.00 0.02 0.00 0.00 54.97 54.30 1dr1 s GLU 180 Cb -0.14 -0.78 0.02 0.00 0.10 0.00 0.00 34.13 33.32 1dr1 s GLU 180 CO 0.07 0.17 -0.11 0.08 0.02 0.00 0.00 175.26 175.50 1dr1 s VAL 181 N -1.21 1.15 0.05 2.63 1.01 -1.26 0.01 120.40 122.78 1dr1 s VAL 181 Ca -0.02 -0.44 0.06 0.00 0.00 0.00 0.00 61.98 61.58 1dr1 s VAL 181 Cb -0.10 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 1dr1 s VAL 181 CO 0.02 0.37 -0.11 -0.31 0.00 0.00 0.00 175.10 175.07 1dr1 s TYR 182 N 1.07 2.74 -0.07 5.22 1.51 0.92 -0.86 117.35 127.88 1dr1 s TYR 182 Ca -0.07 -0.14 0.01 0.00 -1.01 0.00 0.00 57.07 55.87 1dr1 s TYR 182 Cb -0.15 -1.50 0.02 0.00 -0.11 0.00 0.00 41.96 40.22 1dr1 s TYR 182 CO -0.01 0.36 -0.09 -1.14 -1.11 0.00 0.00 175.55 173.56 1dr1 s GLN 183 N -1.73 1.41 -0.14 -0.62 0.74 -0.17 0.54 119.66 119.69 1dr1 s GLN 183 Ca 0.18 -0.29 -0.01 0.00 0.05 0.00 0.00 55.36 55.29 1dr1 s GLN 183 Cb -0.11 -1.27 -0.02 0.00 1.10 0.00 0.00 33.01 32.71 1dr1 s GLN 183 CO 0.09 -0.05 -0.09 0.21 -0.55 0.00 0.00 175.29 174.89 1dr1 s LYS 184 N 0.92 3.48 -0.16 1.67 2.20 0.18 -1.96 119.74 126.07 1dr1 s LYS 184 Ca -0.10 -0.62 0.01 0.00 -0.36 0.00 0.00 55.97 54.90 1dr1 s LYS 184 Cb -0.15 -2.74 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 1dr1 s LYS 184 CO 0.01 0.24 -0.17 -1.12 -0.36 0.00 0.00 175.35 173.94 1dr1 s SER 185 N 0.33 3.45 0.00 1.43 0.01 -1.26 -1.56 113.70 116.10 1dr1 s SER 185 Ca -0.08 -0.53 0.12 0.00 1.31 0.00 0.00 55.95 56.77 1dr1 s SER 185 Cb -0.15 -1.53 0.09 0.00 0.21 0.00 0.00 66.02 64.65 1dr1 s SER 185 CO 0.05 0.07 0.87 0.52 0.41 0.00 0.00 173.24 175.15