#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dr2 h ARG 2 N 0.00 -0.09 -2.96 7.34 -0.00 -1.99 -3.47 114.38 113.21 1dr2 h ARG 2 Ca 0.00 0.01 0.03 0.00 -0.00 0.00 0.00 59.98 60.01 1dr2 h ARG 2 Cb 0.00 0.02 -0.09 0.00 -0.00 0.00 0.00 29.97 29.90 1dr2 h ARG 2 CO 0.00 -0.06 0.23 -1.54 -0.00 0.00 0.00 179.97 178.61 1dr2 s SER 3 N -5.14 -0.42 0.27 0.08 1.04 -1.26 -4.20 113.70 104.07 1dr2 s SER 3 Ca -0.14 -0.27 0.11 0.00 0.48 0.00 0.00 55.95 56.13 1dr2 s SER 3 Cb 0.12 0.65 -0.05 0.00 0.10 0.00 0.00 66.02 66.84 1dr2 s SER 3 CO 0.69 -1.12 -0.15 -0.76 0.98 0.00 0.00 173.24 172.88 1dr2 s LEU 4 N -2.82 2.75 -0.01 2.42 1.43 0.36 -4.65 118.68 118.16 1dr2 s LEU 4 Ca 0.06 -0.91 0.02 0.00 -1.03 0.00 0.00 54.13 52.27 1dr2 s LEU 4 Cb -0.03 -1.28 -0.00 0.00 0.03 0.00 0.00 46.19 44.91 1dr2 s LEU 4 CO -0.04 0.03 -0.07 0.20 0.23 0.00 0.00 176.35 176.70 1dr2 s ASN 5 N -3.50 0.94 -0.00 2.29 0.01 -0.99 -0.84 114.94 112.85 1dr2 s ASN 5 Ca 0.30 -0.14 0.04 0.00 -0.71 0.00 0.00 52.86 52.34 1dr2 s ASN 5 Cb -0.06 -0.18 -0.01 0.00 0.41 0.00 0.00 41.25 41.41 1dr2 s ASN 5 CO 0.16 0.07 -0.12 -0.44 -1.51 0.00 0.00 177.10 175.26 1dr2 s SER 6 N 0.03 1.38 -0.02 -1.22 0.01 -0.30 0.51 113.70 114.09 1dr2 s SER 6 Ca -0.00 -0.25 0.02 0.00 1.31 0.00 0.00 55.95 57.03 1dr2 s SER 6 Cb -0.05 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.04 1dr2 s SER 6 CO -0.00 0.12 -0.08 -0.51 0.41 0.00 0.00 173.24 173.17 1dr2 s ILE 7 N -0.38 0.70 0.08 1.44 2.07 -0.86 -0.47 121.20 123.78 1dr2 s ILE 7 Ca 0.04 -0.33 -0.19 0.00 -1.41 0.00 0.00 60.65 58.76 1dr2 s ILE 7 Cb -0.05 -0.62 0.04 0.00 0.13 0.00 0.00 42.46 41.96 1dr2 s ILE 7 CO -0.00 0.22 0.45 0.54 -1.91 0.00 0.00 174.94 174.24 1dr2 s VAL 8 N 0.14 0.05 -0.08 4.00 0.11 -0.34 -4.61 120.40 119.67 1dr2 s VAL 8 Ca -0.02 -0.40 0.04 0.00 -2.93 0.00 0.00 61.98 58.66 1dr2 s VAL 8 Cb -0.07 -1.04 -0.01 0.00 -1.53 0.00 0.00 36.38 33.73 1dr2 s VAL 8 CO 0.00 -0.22 -0.20 0.00 -3.33 0.00 0.00 175.10 171.35 1dr2 s ALA 9 N -3.02 2.36 0.03 1.54 0.00 -1.26 -1.20 121.76 120.21 1dr2 s ALA 9 Ca -0.02 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 50.98 1dr2 s ALA 9 Cb 0.00 -0.88 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 1dr2 s ALA 9 CO -0.06 0.38 -0.08 0.14 0.00 0.00 0.00 175.76 176.14 1dr2 s VAL 10 N -0.04 0.55 0.61 0.00 -7.23 -0.24 -4.61 120.40 109.44 1dr2 s VAL 10 Ca -0.06 -0.80 0.06 0.00 -1.81 0.00 0.00 61.98 59.37 1dr2 s VAL 10 Cb -0.15 -0.56 0.11 0.00 0.56 0.00 0.00 36.38 36.34 1dr2 s VAL 10 CO 0.05 -0.19 0.84 0.00 -0.31 0.00 0.00 175.10 175.49 1dr2 h GLN 12 N 0.00 0.32 -0.31 0.00 4.20 -0.51 0.15 115.11 118.96 1dr2 h GLN 12 Ca -0.28 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1dr2 h GLN 12 Cb 1.18 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.89 1dr2 h GLN 12 CO 0.36 0.21 0.00 0.27 -0.67 0.00 0.00 178.83 179.00 1dr2 n ASN 13 N -4.46 1.69 -0.47 1.46 0.23 -1.26 -4.88 115.26 107.57 1dr2 n ASN 13 Ca 0.13 -1.98 -0.06 0.00 -0.53 0.00 0.00 54.58 52.14 1dr2 n ASN 13 Cb 0.54 -0.21 -0.03 0.00 -2.08 0.00 0.00 39.78 38.01 1dr2 n ASN 13 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 1dr2 n MET 14 N 0.42 -0.67 -2.80 -3.83 2.81 0.52 -4.96 117.12 108.62 1dr2 n MET 14 Ca 0.11 0.63 -0.35 0.00 -1.81 0.00 0.00 57.70 56.28 1dr2 n MET 14 Cb 0.27 -4.43 -0.07 0.00 -0.71 0.00 0.00 33.22 28.29 1dr2 n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1dr2 s GLY 15 N -2.64 2.62 0.00 3.03 0.00 -1.26 -0.58 107.32 108.48 1dr2 s GLY 15 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 44.72 45.19 1dr2 s GLY 15 CO 0.00 0.84 0.21 0.29 0.00 0.00 0.00 173.10 174.44 1dr2 n ILE 16 N 0.03 0.00 -3.55 0.90 -5.35 -0.02 -2.21 119.36 109.16 1dr2 n ILE 16 Ca 0.04 -0.32 -0.08 0.00 -0.27 0.00 0.00 62.75 62.12 1dr2 n ILE 16 Cb 0.52 1.23 -0.02 0.00 -1.74 0.00 0.00 39.64 39.63 1dr2 n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1dr2 s GLY 17 N -0.23 -0.44 -0.29 3.28 0.00 -1.17 -4.61 107.32 103.88 1dr2 s GLY 17 Ca 0.00 0.66 -0.14 0.00 0.00 0.00 0.00 44.72 45.24 1dr2 s GLY 17 CO 0.00 0.21 0.68 1.25 0.00 0.00 0.00 173.10 175.24 1dr2 s LYS 18 N -3.33 0.67 -1.55 2.90 2.47 0.41 -0.79 119.74 120.52 1dr2 s LYS 18 Ca 0.06 1.29 -0.12 0.00 -1.56 0.00 0.00 55.97 55.64 1dr2 s LYS 18 Cb -0.01 0.34 0.09 0.00 -1.46 0.00 0.00 37.83 36.79 1dr2 s LYS 18 CO -0.07 -0.16 0.82 -0.25 0.16 0.00 0.00 175.35 175.84 1dr2 n ASP 19 N 4.63 -3.36 -0.10 1.43 8.00 -1.26 -0.30 116.55 125.60 1dr2 n ASP 19 Ca -0.18 -0.89 -0.01 0.00 0.71 0.00 0.00 54.79 54.42 1dr2 n ASP 19 Cb 0.56 -3.43 -0.01 0.00 -0.02 0.00 0.00 41.12 38.23 1dr2 n ASP 19 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dr2 n GLY 20 N -1.63 0.49 0.58 0.44 0.00 -1.26 -4.98 105.19 98.83 1dr2 n GLY 20 Ca -0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 46.02 45.70 1dr2 n GLY 20 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dr2 n ASN 21 N 0.23 -0.15 -4.81 1.61 5.15 0.59 -4.74 115.26 113.14 1dr2 n ASN 21 Ca -0.01 -1.38 -0.33 0.00 -0.60 0.00 0.00 54.58 52.25 1dr2 n ASN 21 Cb 0.12 0.33 -0.06 0.00 -0.53 0.00 0.00 39.78 39.63 1dr2 n ASN 21 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1dr2 s LEU 22 N 0.00 3.93 0.44 1.20 1.43 -1.26 0.15 118.68 124.57 1dr2 s LEU 22 Ca 0.07 1.77 0.24 0.00 -1.03 0.00 0.00 54.13 55.18 1dr2 s LEU 22 Cb 0.00 -4.52 0.84 0.00 0.03 0.00 0.00 46.19 42.54 1dr2 s LEU 22 CO 0.05 -0.47 1.79 -0.65 0.23 0.00 0.00 176.35 177.30 1dr2 h PRO 23 N 1.86 0.00 -6.18 1.29 0.11 -1.84 -3.41 132.00 123.84 1dr2 h PRO 23 Ca -0.49 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.07 1dr2 h PRO 23 Cb 1.19 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.21 1dr2 h PRO 23 CO 0.61 0.22 -0.62 1.67 -0.21 0.00 0.00 178.00 179.67 1dr2 s TRP 24 N -3.56 2.72 1.03 0.65 -2.14 -1.26 -4.77 118.94 111.61 1dr2 s TRP 24 Ca 0.01 -0.25 -0.13 0.00 2.66 0.00 0.00 56.10 58.40 1dr2 s TRP 24 Cb 0.10 -1.29 0.21 0.00 -3.10 0.00 0.00 33.47 29.38 1dr2 s TRP 24 CO 0.64 0.56 1.09 -2.14 -2.66 0.00 0.00 176.95 174.44 1dr2 s PRO 25 N -3.71 0.14 0.27 3.25 0.02 -1.26 -4.92 135.00 128.79 1dr2 s PRO 25 Ca 0.33 0.50 -0.30 0.00 0.02 0.00 0.00 61.00 61.55 1dr2 s PRO 25 Cb -0.06 -1.70 -0.11 0.00 0.02 0.00 0.00 34.50 32.65 1dr2 s PRO 25 CO 0.21 -2.93 1.59 -2.14 -0.33 0.00 0.00 177.00 173.40 1dr2 s PRO 26 N -4.92 4.15 -0.23 5.54 0.02 -1.26 -5.01 135.00 133.29 1dr2 s PRO 26 Ca 0.66 2.53 0.02 0.00 0.02 0.00 0.00 61.00 64.23 1dr2 s PRO 26 Cb -0.19 -3.05 0.04 0.00 0.02 0.00 0.00 34.50 31.32 1dr2 s PRO 26 CO 0.58 -0.62 -0.14 -0.51 -0.33 0.00 0.00 177.00 175.99 1dr2 s LEU 27 N -0.21 2.98 0.07 -5.54 1.43 -1.26 -5.04 118.68 111.12 1dr2 s LEU 27 Ca 0.64 -1.11 -0.29 0.00 -1.03 0.00 0.00 54.13 52.34 1dr2 s LEU 27 Cb -0.47 -1.53 -0.18 0.00 0.03 0.00 0.00 46.19 44.04 1dr2 s LEU 27 CO 0.45 -0.12 1.62 -0.09 0.23 0.00 0.00 176.35 178.43 1dr2 h ARG 28 N 7.84 -0.58 -0.94 1.70 2.43 -1.99 -2.50 114.38 120.35 1dr2 h ARG 28 Ca -0.29 0.04 0.03 0.00 -0.81 0.00 0.00 59.98 58.95 1dr2 h ARG 28 Cb 1.08 0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.71 1dr2 h ARG 28 CO 0.53 -0.37 0.61 -0.91 -1.51 0.00 0.00 179.97 178.32 1dr2 h ASN 29 N -0.64 1.02 -0.37 -3.80 2.35 -1.99 0.33 115.58 112.48 1dr2 h ASN 29 Ca -0.06 -0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.56 1dr2 h ASN 29 Cb 0.48 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1dr2 h ASN 29 CO 0.10 0.70 -0.20 -0.08 -1.65 0.00 0.00 177.43 176.31 1dr2 h GLU 30 N 1.19 0.86 -0.04 0.81 4.22 -1.99 -1.95 114.58 117.68 1dr2 h GLU 30 Ca 0.37 -0.34 -0.00 0.00 0.08 0.00 0.00 59.36 59.47 1dr2 h GLU 30 Cb -0.01 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 1dr2 h GLU 30 CO -0.12 0.98 0.02 -0.92 -2.18 0.00 0.00 179.01 176.79 1dr2 h TYR 31 N 0.75 0.06 -0.94 0.92 3.20 -0.90 -1.66 116.97 118.41 1dr2 h TYR 31 Ca 0.11 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.06 1dr2 h TYR 31 Cb 0.73 -0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.91 1dr2 h TYR 31 CO 0.04 0.20 0.60 0.87 -1.64 0.00 0.00 178.16 178.23 1dr2 h LYS 32 N -0.09 0.96 -0.42 1.82 1.57 -0.84 -0.51 116.57 119.06 1dr2 h LYS 32 Ca 0.01 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1dr2 h LYS 32 Cb 0.16 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 1dr2 h LYS 32 CO -0.00 0.64 0.25 -0.92 -0.57 0.00 0.00 179.45 178.84 1dr2 h TYR 33 N 0.99 0.46 -0.51 -1.35 3.20 -0.73 0.23 116.97 119.26 1dr2 h TYR 33 Ca 0.43 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.25 1dr2 h TYR 33 Cb 0.34 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 1dr2 h TYR 33 CO -0.00 0.27 0.08 0.35 -1.64 0.00 0.00 178.16 177.21 1dr2 h PHE 34 N 0.50 0.90 -0.02 -3.82 3.04 -0.40 0.11 116.94 117.25 1dr2 h PHE 34 Ca 0.17 -0.13 -0.00 0.00 3.98 0.00 0.00 57.97 61.99 1dr2 h PHE 34 Cb 0.01 -0.25 -0.00 0.00 2.56 0.00 0.00 35.95 38.28 1dr2 h PHE 34 CO -0.07 0.82 0.01 1.96 -2.02 0.00 0.00 178.31 179.01 1dr2 h GLN 35 N 0.73 0.03 -0.04 1.11 1.08 -0.61 -1.94 115.11 115.47 1dr2 h GLN 35 Ca 0.15 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 1dr2 h GLN 35 Cb 0.41 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1dr2 h GLN 35 CO 0.01 0.19 0.03 -0.09 -0.95 0.00 0.00 178.83 178.02 1dr2 h ARG 36 N -0.13 0.06 -0.34 1.46 2.43 -0.41 -0.65 114.38 116.80 1dr2 h ARG 36 Ca 0.01 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1dr2 h ARG 36 Cb 0.17 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 1dr2 h ARG 36 CO -0.00 0.07 0.20 0.52 -1.51 0.00 0.00 179.97 179.25 1dr2 h MET 37 N 0.03 0.46 0.00 0.20 2.86 -0.99 -2.27 114.93 115.22 1dr2 h MET 37 Ca 0.02 -0.04 -0.14 0.00 -2.06 0.00 0.00 59.70 57.47 1dr2 h MET 37 Cb 0.02 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 1dr2 h MET 37 CO -0.00 0.35 -0.67 1.79 1.06 0.00 0.00 176.91 179.44 1dr2 h THR 38 N 0.44 1.18 0.07 2.22 1.35 -1.23 -3.35 112.91 113.59 1dr2 h THR 38 Ca 0.12 -2.61 -0.29 0.00 -0.55 0.00 0.00 66.41 63.08 1dr2 h THR 38 Cb 0.01 2.55 -0.02 0.00 -1.73 0.00 0.00 68.15 68.96 1dr2 h THR 38 CO -0.02 0.66 -1.48 0.28 -0.25 0.00 0.00 175.52 174.71 1dr2 h SER 39 N 0.00 0.24 -2.77 5.36 0.02 -1.06 -3.43 113.55 111.91 1dr2 h SER 39 Ca -0.01 -0.34 -0.56 0.00 -0.84 0.00 0.00 61.79 60.04 1dr2 h SER 39 Cb 1.49 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.93 1dr2 h SER 39 CO 0.09 1.29 1.07 -0.89 -1.14 0.00 0.00 176.83 177.25 1dr2 s THR 40 N -2.63 3.78 -0.01 -2.27 2.01 -0.86 -4.61 115.64 111.06 1dr2 s THR 40 Ca -0.07 0.91 -0.01 0.00 0.31 0.00 0.00 61.69 62.84 1dr2 s THR 40 Cb 0.08 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 1dr2 s THR 40 CO 0.84 -0.21 0.09 -0.55 -0.69 0.00 0.00 174.62 174.09 1dr2 s SER 41 N 3.55 5.71 -0.57 3.53 0.15 -1.26 -4.94 113.70 119.87 1dr2 s SER 41 Ca 0.68 0.16 0.01 0.00 0.70 0.00 0.00 55.95 57.50 1dr2 s SER 41 Cb -0.26 -1.65 0.47 0.00 -1.71 0.00 0.00 66.02 62.87 1dr2 s SER 41 CO 0.27 0.27 1.84 1.41 1.20 0.00 0.00 173.24 178.23 1dr2 n HIS 42 N 1.19 3.06 -3.59 3.44 -0.00 -1.26 -4.87 115.22 113.18 1dr2 n HIS 42 Ca -0.13 -2.75 -0.02 0.00 -0.00 0.00 0.00 57.72 54.82 1dr2 n HIS 42 Cb 0.53 -1.17 -0.05 0.00 -0.00 0.00 0.00 29.99 29.30 1dr2 n HIS 42 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1dr2 s VAL 43 N -4.64 -0.55 0.33 1.59 1.01 -1.26 -5.14 120.40 111.74 1dr2 s VAL 43 Ca 0.61 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 62.30 1dr2 s VAL 43 Cb 0.48 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.76 1dr2 s VAL 43 CO 0.01 0.00 1.27 -1.83 0.00 0.00 0.00 175.10 174.55 1dr2 s GLU 44 N 2.34 4.38 0.00 2.72 -1.05 -1.26 -2.51 118.70 123.31 1dr2 s GLU 44 Ca -0.06 2.14 0.00 0.00 -0.15 0.00 0.00 54.97 56.89 1dr2 s GLU 44 Cb -0.08 -3.07 0.00 0.00 -0.44 0.00 0.00 34.13 30.54 1dr2 s GLU 44 CO -0.18 -0.14 0.00 0.41 0.95 0.00 0.00 175.26 176.30 1dr2 n GLY 45 N 0.85 0.80 3.50 -3.83 0.00 -1.26 -5.03 105.19 100.22 1dr2 n GLY 45 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1dr2 n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dr2 s LYS 46 N -0.21 1.75 0.14 1.61 1.02 -1.04 -4.89 119.74 118.13 1dr2 s LYS 46 Ca 0.00 -1.80 0.02 0.00 0.02 0.00 0.00 55.97 54.21 1dr2 s LYS 46 Cb 0.00 -1.77 -0.04 0.00 -0.52 0.00 0.00 37.83 35.49 1dr2 s LYS 46 CO 0.00 0.28 -0.04 -0.65 -0.92 0.00 0.00 175.35 174.02 1dr2 s GLN 47 N -3.55 1.00 0.42 1.68 -0.21 -0.39 -4.86 119.66 113.75 1dr2 s GLN 47 Ca 0.31 -1.45 -0.09 0.00 0.02 0.00 0.00 55.36 54.15 1dr2 s GLN 47 Cb -0.03 -0.31 -0.06 0.00 1.00 0.00 0.00 33.01 33.61 1dr2 s GLN 47 CO 0.16 -0.05 0.77 -0.80 -2.12 0.00 0.00 175.29 173.24 1dr2 s ASN 48 N -3.13 6.47 -0.10 5.90 0.01 -1.26 -0.59 114.94 122.25 1dr2 s ASN 48 Ca 0.18 1.09 0.00 0.00 -0.71 0.00 0.00 52.86 53.42 1dr2 s ASN 48 Cb 0.05 -2.31 -0.03 0.00 0.41 0.00 0.00 41.25 39.38 1dr2 s ASN 48 CO 0.00 -0.43 -0.09 0.00 -1.51 0.00 0.00 177.10 175.08 1dr2 s ALA 49 N -2.43 2.86 -0.10 0.60 0.00 0.14 -1.28 121.76 121.55 1dr2 s ALA 49 Ca 0.50 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.59 1dr2 s ALA 49 Cb -0.10 -1.25 -0.02 0.00 0.00 0.00 0.00 23.12 21.75 1dr2 s ALA 49 CO 0.34 0.43 -0.15 0.14 0.00 0.00 0.00 175.76 176.52 1dr2 s VAL 50 N -0.31 2.91 -0.08 0.00 -7.23 -0.08 0.29 120.40 115.89 1dr2 s VAL 50 Ca 0.04 -0.74 0.03 0.00 -1.81 0.00 0.00 61.98 59.50 1dr2 s VAL 50 Cb -0.13 -2.18 -0.02 0.00 0.56 0.00 0.00 36.38 34.62 1dr2 s VAL 50 CO 0.02 0.55 -0.16 -0.63 -0.31 0.00 0.00 175.10 174.57 1dr2 s ILE 51 N -0.02 2.84 0.10 -0.62 1.01 0.72 -1.17 121.20 124.06 1dr2 s ILE 51 Ca -0.04 -0.78 -0.16 0.00 0.00 0.00 0.00 60.65 59.67 1dr2 s ILE 51 Cb -0.14 -2.13 0.03 0.00 0.01 0.00 0.00 42.46 40.23 1dr2 s ILE 51 CO 0.04 0.56 0.38 0.00 0.00 0.00 0.00 174.94 175.93 1dr2 s MET 52 N -0.21 1.01 0.83 2.79 0.23 -0.46 -0.85 119.30 122.65 1dr2 s MET 52 Ca -0.00 -0.65 -0.12 0.00 -1.03 0.00 0.00 55.69 53.89 1dr2 s MET 52 Cb -0.13 0.44 0.09 0.00 -1.53 0.00 0.00 34.83 33.70 1dr2 s MET 52 CO 0.03 -0.38 1.15 0.20 -2.03 0.00 0.00 175.02 173.99 1dr2 s GLY 53 N -2.62 1.59 0.13 3.16 0.00 -0.09 -0.73 107.32 108.78 1dr2 s GLY 53 Ca 0.01 -0.53 -0.19 0.00 0.00 0.00 0.00 44.72 44.02 1dr2 s GLY 53 CO -0.10 -0.03 1.79 1.70 0.00 0.00 0.00 173.10 176.46 1dr2 h LYS 54 N -1.17 0.33 -0.69 2.90 3.64 -1.87 -2.11 116.57 117.60 1dr2 h LYS 54 Ca -0.48 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 58.86 1dr2 h LYS 54 Cb 1.32 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 33.03 1dr2 h LYS 54 CO 0.64 0.22 0.33 0.87 -2.27 0.00 0.00 179.45 179.24 1dr2 h LYS 55 N 0.34 1.00 -0.22 1.90 1.57 -1.94 -1.59 116.57 117.62 1dr2 h LYS 55 Ca 0.10 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1dr2 h LYS 55 Cb -0.03 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1dr2 h LYS 55 CO -0.03 0.79 0.13 1.15 -0.57 0.00 0.00 179.45 180.92 1dr2 h THR 56 N 0.97 1.10 -0.45 -0.16 2.02 -1.84 -0.58 112.91 113.97 1dr2 h THR 56 Ca 0.24 -0.26 0.06 0.00 0.77 0.00 0.00 66.41 67.22 1dr2 h THR 56 Cb 0.12 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.35 1dr2 h THR 56 CO -0.03 0.10 0.14 -0.25 0.37 0.00 0.00 175.52 175.85 1dr2 h TRP 57 N 0.26 0.24 0.00 3.16 2.91 -1.06 -0.54 115.95 120.92 1dr2 h TRP 57 Ca 0.08 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.12 1dr2 h TRP 57 Cb 0.05 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 28.66 1dr2 h TRP 57 CO -0.04 0.07 0.00 0.74 -1.03 0.00 0.00 178.44 178.18 1dr2 h PHE 58 N 0.30 0.00 0.00 2.65 0.04 -0.96 -2.22 116.94 116.75 1dr2 h PHE 58 Ca 0.21 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.98 1dr2 h PHE 58 Cb 0.23 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.38 1dr2 h PHE 58 CO -0.17 0.00 0.00 0.66 -0.60 0.00 0.00 178.31 178.20 1dr2 h SER 59 N 0.00 0.00 -3.39 2.17 4.64 0.54 -3.43 113.55 114.07 1dr2 h SER 59 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 1dr2 h SER 59 Cb 0.41 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.46 1dr2 h SER 59 CO 0.00 0.00 0.20 -0.63 -0.87 0.00 0.00 176.83 175.53 1dr2 s ILE 60 N -3.18 4.93 0.19 0.95 1.01 -0.84 -4.97 121.20 119.29 1dr2 s ILE 60 Ca 0.08 1.69 -0.33 0.00 0.00 0.00 0.00 60.65 62.10 1dr2 s ILE 60 Cb 0.11 -4.15 -0.14 0.00 0.01 0.00 0.00 42.46 38.29 1dr2 s ILE 60 CO 0.54 0.24 1.42 -2.65 0.00 0.00 0.00 174.94 174.48 1dr2 n PRO 61 N 3.68 1.84 -0.32 2.79 -0.02 -1.26 -4.84 135.00 136.86 1dr2 n PRO 61 Ca 0.01 0.66 0.13 0.00 -2.02 0.00 0.00 63.50 62.28 1dr2 n PRO 61 Cb 0.51 -2.33 0.32 0.00 -0.02 0.00 0.00 33.50 31.98 1dr2 n PRO 61 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1dr2 h GLU 62 N 4.67 0.48 0.00 -0.52 4.81 -1.93 0.59 114.58 122.69 1dr2 h GLU 62 Ca -0.45 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1dr2 h GLU 62 Cb 1.29 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.56 1dr2 h GLU 62 CO 0.79 0.32 0.00 0.87 -0.73 0.00 0.00 179.01 180.26 1dr2 h LYS 63 N 0.50 0.00 -0.51 1.92 1.79 -2.02 -2.50 116.57 115.75 1dr2 h LYS 63 Ca 0.57 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.04 1dr2 h LYS 63 Cb 1.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.69 1dr2 h LYS 63 CO -0.48 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 177.98 1dr2 n ASN 64 N -3.07 2.74 -4.68 0.86 3.02 0.20 -4.92 115.26 109.40 1dr2 n ASN 64 Ca 0.00 -2.09 -0.31 0.00 -0.03 0.00 0.00 54.58 52.15 1dr2 n ASN 64 Cb 0.28 -0.36 -0.08 0.00 -0.61 0.00 0.00 39.78 39.01 1dr2 n ASN 64 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1dr2 s ARG 65 N -1.49 2.62 0.86 3.52 0.52 -0.94 -3.90 118.95 120.14 1dr2 s ARG 65 Ca 0.32 -0.75 -0.12 0.00 -0.52 0.00 0.00 55.73 54.65 1dr2 s ARG 65 Cb 0.18 -2.58 0.11 0.00 0.52 0.00 0.00 34.95 33.18 1dr2 s ARG 65 CO 0.20 0.57 1.17 -1.25 0.02 0.00 0.00 175.30 176.01 1dr2 s PRO 66 N -1.98 1.53 -0.12 3.54 0.04 -1.26 -4.93 135.00 131.82 1dr2 s PRO 66 Ca 0.23 0.15 -0.30 0.00 0.04 0.00 0.00 61.00 61.12 1dr2 s PRO 66 Cb -0.12 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.45 1dr2 s PRO 66 CO 0.15 -1.90 2.09 1.28 0.04 0.00 0.00 177.00 178.65 1dr2 n LEU 67 N -3.54 3.52 -4.69 -3.56 4.77 -1.25 -4.85 117.00 107.40 1dr2 n LEU 67 Ca 0.08 0.56 -0.43 0.00 -0.03 0.00 0.00 56.01 56.19 1dr2 n LEU 67 Cb 0.60 -1.50 -0.01 0.00 -2.33 0.00 0.00 43.42 40.18 1dr2 n LEU 67 CO 0.56 -0.29 0.94 1.17 -1.33 0.00 0.00 177.39 178.44 1dr2 n LYS 68 N 8.01 2.11 -1.04 3.23 4.81 -1.26 -2.70 118.16 131.32 1dr2 n LYS 68 Ca 0.26 0.74 -0.02 0.00 -0.87 0.00 0.00 58.31 58.43 1dr2 n LYS 68 Cb 0.40 -2.35 -0.01 0.00 0.02 0.00 0.00 35.03 33.09 1dr2 n LYS 68 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1dr2 n ASP 69 N 1.21 -3.90 -4.14 3.14 8.00 -1.26 -4.97 116.55 114.62 1dr2 n ASP 69 Ca 0.07 0.04 -0.14 0.00 0.71 0.00 0.00 54.79 55.47 1dr2 n ASP 69 Cb 0.35 -1.54 -0.11 0.00 -0.02 0.00 0.00 41.12 39.80 1dr2 n ASP 69 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1dr2 s ARG 70 N -1.08 0.74 -0.36 -1.24 0.52 -1.10 -4.31 118.95 112.13 1dr2 s ARG 70 Ca 0.00 -1.04 -0.26 0.00 -0.52 0.00 0.00 55.73 53.92 1dr2 s ARG 70 Cb 0.00 -0.43 0.01 0.00 0.52 0.00 0.00 34.95 35.05 1dr2 s ARG 70 CO 0.00 0.07 0.92 0.42 0.02 0.00 0.00 175.30 176.73 1dr2 s ILE 71 N -2.16 4.60 -0.26 1.52 1.01 -0.40 -4.76 121.20 120.75 1dr2 s ILE 71 Ca 0.01 1.23 -0.20 0.00 0.00 0.00 0.00 60.65 61.68 1dr2 s ILE 71 Cb -0.05 -4.32 -0.02 0.00 0.01 0.00 0.00 42.46 38.09 1dr2 s ILE 71 CO -0.00 -0.50 0.64 0.20 0.00 0.00 0.00 174.94 175.27 1dr2 s ASN 72 N 1.83 6.58 -0.18 3.58 0.02 -1.26 -0.90 114.94 124.61 1dr2 s ASN 72 Ca 0.38 0.70 -0.01 0.00 -1.02 0.00 0.00 52.86 52.91 1dr2 s ASN 72 Cb -0.12 -2.34 0.00 0.00 0.02 0.00 0.00 41.25 38.81 1dr2 s ASN 72 CO 0.18 -0.38 -0.14 -0.63 0.02 0.00 0.00 177.10 176.14 1dr2 s ILE 73 N 2.52 2.67 -0.12 0.60 1.01 -0.32 -1.70 121.20 125.87 1dr2 s ILE 73 Ca 0.26 -0.75 -0.03 0.00 0.00 0.00 0.00 60.65 60.14 1dr2 s ILE 73 Cb -0.15 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.13 1dr2 s ILE 73 CO 0.09 0.50 -0.01 -0.69 0.00 0.00 0.00 174.94 174.82 1dr2 s VAL 74 N 1.13 4.17 -0.11 2.92 1.01 -0.69 -1.35 120.40 127.47 1dr2 s VAL 74 Ca 0.01 -0.28 -0.06 0.00 0.00 0.00 0.00 61.98 61.65 1dr2 s VAL 74 Cb -0.14 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 1dr2 s VAL 74 CO -0.05 0.55 0.10 -0.76 0.00 0.00 0.00 175.10 174.94 1dr2 s LEU 75 N -0.30 4.15 -0.28 3.92 1.43 0.10 -1.08 118.68 126.61 1dr2 s LEU 75 Ca 0.06 0.37 -0.25 0.00 -1.03 0.00 0.00 54.13 53.28 1dr2 s LEU 75 Cb -0.12 -2.00 0.12 0.00 0.03 0.00 0.00 46.19 44.22 1dr2 s LEU 75 CO 0.02 0.39 1.04 -0.55 0.23 0.00 0.00 176.35 177.48 1dr2 s SER 76 N -0.92 -0.44 0.14 2.29 0.15 -0.68 -2.81 113.70 111.42 1dr2 s SER 76 Ca 0.14 0.85 0.24 0.00 0.70 0.00 0.00 55.95 57.88 1dr2 s SER 76 Cb -0.12 0.87 0.22 0.00 -1.71 0.00 0.00 66.02 65.28 1dr2 s SER 76 CO 0.03 -0.15 1.22 0.03 1.20 0.00 0.00 173.24 175.58 1dr2 h ARG 77 N 4.21 0.00 0.06 5.44 3.08 -1.85 -3.37 114.38 121.95 1dr2 h ARG 77 Ca -0.28 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.40 1dr2 h ARG 77 Cb 1.18 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.19 1dr2 h ARG 77 CO 0.11 0.00 -2.17 0.39 -1.07 0.00 0.00 179.97 177.23 1dr2 n GLU 78 N -2.27 0.70 -2.35 0.04 1.02 -1.26 -4.99 120.64 111.53 1dr2 n GLU 78 Ca 0.02 0.24 -0.35 0.00 -0.02 0.00 0.00 57.16 57.05 1dr2 n GLU 78 Cb 0.47 -1.63 -0.01 0.00 -0.02 0.00 0.00 31.44 30.25 1dr2 n GLU 78 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1dr2 s LEU 79 N -6.91 3.80 -0.08 -4.62 1.43 -1.26 -4.96 118.68 106.08 1dr2 s LEU 79 Ca -0.29 2.11 0.16 0.00 -1.03 0.00 0.00 54.13 55.08 1dr2 s LEU 79 Cb 0.08 -4.55 -0.22 0.00 0.03 0.00 0.00 46.19 41.53 1dr2 s LEU 79 CO 0.68 -1.05 0.48 1.17 0.23 0.00 0.00 176.35 177.86 1dr2 n LYS 80 N -1.12 0.65 -3.88 1.70 4.81 -1.26 -4.97 118.16 114.09 1dr2 n LYS 80 Ca 0.11 0.15 -0.10 0.00 -0.87 0.00 0.00 58.31 57.60 1dr2 n LYS 80 Cb 0.51 -1.69 -0.09 0.00 0.02 0.00 0.00 35.03 33.79 1dr2 n LYS 80 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1dr2 s GLU 81 N -2.68 0.68 0.28 1.64 2.02 -1.26 -5.12 118.70 114.26 1dr2 s GLU 81 Ca -0.06 -0.73 -0.30 0.00 0.02 0.00 0.00 54.97 53.90 1dr2 s GLU 81 Cb 0.08 0.28 -0.13 0.00 0.10 0.00 0.00 34.13 34.45 1dr2 s GLU 81 CO 0.83 -0.19 1.31 0.00 0.02 0.00 0.00 175.26 177.23 1dr2 n ALA 82 N 0.58 0.94 -1.43 5.21 0.00 -1.26 -4.91 120.51 119.65 1dr2 n ALA 82 Ca -0.18 0.39 -0.35 0.00 0.00 0.00 0.00 53.44 53.31 1dr2 n ALA 82 Cb 0.59 -2.23 0.09 0.00 0.00 0.00 0.00 19.45 17.90 1dr2 n ALA 82 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1dr2 s PRO 83 N -1.04 2.24 -0.22 0.00 0.02 -1.26 -4.83 135.00 129.89 1dr2 s PRO 83 Ca 0.63 1.81 -0.33 0.00 0.02 0.00 0.00 61.00 63.12 1dr2 s PRO 83 Cb -0.64 -1.84 -0.10 0.00 0.02 0.00 0.00 34.50 31.94 1dr2 s PRO 83 CO 0.55 -1.77 2.07 1.17 -0.33 0.00 0.00 177.00 178.69 1dr2 n LYS 84 N -2.55 1.68 0.00 5.54 3.00 -1.26 -0.62 118.16 123.94 1dr2 n LYS 84 Ca 0.14 0.53 0.00 0.00 -0.00 0.00 0.00 58.31 58.98 1dr2 n LYS 84 Cb 0.50 -2.69 0.00 0.00 0.00 0.00 0.00 35.03 32.83 1dr2 n LYS 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1dr2 n GLY 85 N 5.53 2.53 3.82 3.14 0.00 -1.26 -4.91 105.19 114.03 1dr2 n GLY 85 Ca 0.32 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.00 1dr2 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dr2 s ALA 86 N -2.61 3.12 0.04 4.61 0.00 0.20 -4.00 121.76 123.13 1dr2 s ALA 86 Ca 0.00 0.36 -0.14 0.00 0.00 0.00 0.00 51.96 52.18 1dr2 s ALA 86 Cb 0.00 -3.09 -0.33 0.00 0.00 0.00 0.00 23.12 19.70 1dr2 s ALA 86 CO 0.00 0.17 1.05 0.45 0.00 0.00 0.00 175.76 177.43 1dr2 h HIS 87 N 2.21 0.92 -3.33 0.00 -0.00 -1.62 -3.44 115.15 109.89 1dr2 h HIS 87 Ca -0.48 -0.65 -0.08 0.00 -0.00 0.00 0.00 60.37 59.15 1dr2 h HIS 87 Cb 1.18 -0.05 -0.16 0.00 -0.00 0.00 0.00 27.41 28.39 1dr2 h HIS 87 CO 0.62 1.50 -0.21 0.71 -0.00 0.00 0.00 177.93 180.55 1dr2 s TYR 88 N -2.69 -0.12 -0.03 2.45 2.02 -0.92 -5.03 117.35 113.03 1dr2 s TYR 88 Ca -0.08 -0.06 0.05 0.00 -0.37 0.00 0.00 57.07 56.61 1dr2 s TYR 88 Cb 0.05 0.12 -0.01 0.00 -0.40 0.00 0.00 41.96 41.72 1dr2 s TYR 88 CO 0.94 -0.55 -0.20 -1.17 -1.57 0.00 0.00 175.55 173.00 1dr2 s LEU 89 N -2.24 1.99 0.06 -1.29 2.96 -1.26 -1.70 118.68 117.20 1dr2 s LEU 89 Ca -0.03 -0.39 0.03 0.00 -0.22 0.00 0.00 54.13 53.52 1dr2 s LEU 89 Cb 0.00 -1.07 -0.03 0.00 0.50 0.00 0.00 46.19 45.59 1dr2 s LEU 89 CO -0.05 0.21 -0.09 -0.44 -1.32 0.00 0.00 176.35 174.65 1dr2 s SER 90 N -0.20 1.13 0.11 3.68 0.01 -0.24 -4.94 113.70 113.25 1dr2 s SER 90 Ca 0.01 -0.65 0.23 0.00 1.31 0.00 0.00 55.95 56.85 1dr2 s SER 90 Cb -0.10 0.02 0.04 0.00 0.21 0.00 0.00 66.02 66.19 1dr2 s SER 90 CO 0.01 -0.21 1.02 0.29 0.41 0.00 0.00 173.24 174.76 1dr2 n LYS 91 N 1.15 0.45 -3.88 12.44 4.01 -1.26 -1.68 118.16 129.39 1dr2 n LYS 91 Ca -0.20 0.04 -0.08 0.00 -0.51 0.00 0.00 58.31 57.55 1dr2 n LYS 91 Cb 0.56 -1.69 -0.03 0.00 -0.51 0.00 0.00 35.03 33.35 1dr2 n LYS 91 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1dr2 s SER 92 N -4.60 -0.21 0.13 4.39 1.04 -1.26 -4.54 113.70 108.66 1dr2 s SER 92 Ca 0.01 -0.68 -0.17 0.00 0.48 0.00 0.00 55.95 55.59 1dr2 s SER 92 Cb 0.12 0.65 -0.02 0.00 0.10 0.00 0.00 66.02 66.87 1dr2 s SER 92 CO 0.79 -1.22 1.74 0.25 0.98 0.00 0.00 173.24 175.79 1dr2 h LEU 93 N 2.12 0.41 -0.46 2.42 5.85 -1.99 -1.27 115.31 122.39 1dr2 h LEU 93 Ca -0.23 -0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.50 1dr2 h LEU 93 Cb 1.25 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 42.09 1dr2 h LEU 93 CO 0.30 0.37 -0.15 0.44 -0.34 0.00 0.00 178.44 179.06 1dr2 h ASP 94 N 0.42 -0.54 -0.62 1.25 5.19 -1.98 0.76 116.42 120.91 1dr2 h ASP 94 Ca 0.12 0.15 0.06 0.00 -0.62 0.00 0.00 57.03 56.74 1dr2 h ASP 94 Cb 0.04 0.33 -0.05 0.00 0.18 0.00 0.00 39.33 39.83 1dr2 h ASP 94 CO -0.02 -0.19 0.33 0.44 -3.12 0.00 0.00 179.24 176.68 1dr2 h ASP 95 N -0.05 0.48 -0.47 6.45 3.32 -1.84 0.21 116.42 124.53 1dr2 h ASP 95 Ca 0.22 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.28 1dr2 h ASP 95 Cb 0.39 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1dr2 h ASP 95 CO -0.50 0.31 0.19 0.00 -1.72 0.00 0.00 179.24 177.53 1dr2 h ALA 96 N 1.33 0.61 -0.01 3.45 0.00 0.08 0.83 119.26 125.54 1dr2 h ALA 96 Ca 0.28 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1dr2 h ALA 96 Cb 0.18 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1dr2 h ALA 96 CO -0.18 0.22 -0.06 -0.07 0.00 0.00 0.00 179.25 179.15 1dr2 h LEU 97 N 0.62 -0.18 -0.45 0.00 3.38 0.19 -1.53 115.31 117.33 1dr2 h LEU 97 Ca 0.16 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.22 1dr2 h LEU 97 Cb 0.19 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 1dr2 h LEU 97 CO -0.01 -0.09 0.15 0.00 0.09 0.00 0.00 178.44 178.57 1dr2 h ALA 98 N 0.90 0.53 -0.39 1.53 0.00 -0.42 -1.95 119.26 119.47 1dr2 h ALA 98 Ca 0.03 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.09 1dr2 h ALA 98 Cb 0.14 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.90 1dr2 h ALA 98 CO -0.08 -0.25 -0.21 1.25 0.00 0.00 0.00 179.25 179.96 1dr2 h LEU 99 N 0.31 -0.72 -0.59 0.00 5.85 -0.40 -1.27 115.31 118.50 1dr2 h LEU 99 Ca 0.21 0.16 0.09 0.00 0.84 0.00 0.00 57.88 59.18 1dr2 h LEU 99 Cb 0.23 0.38 -0.07 0.00 0.37 0.00 0.00 40.66 41.56 1dr2 h LEU 99 CO -0.23 -0.24 0.21 -0.07 -0.34 0.00 0.00 178.44 177.77 1dr2 h LEU 100 N -0.14 0.20 -1.18 2.25 3.38 -0.54 0.32 115.31 119.60 1dr2 h LEU 100 Ca 0.19 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1dr2 h LEU 100 Cb 0.44 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1dr2 h LEU 100 CO -0.48 0.13 0.00 0.44 0.09 0.00 0.00 178.44 178.62 1dr2 h ASP 101 N 0.39 0.00 -3.72 -0.43 3.32 -0.79 -1.60 116.42 113.60 1dr2 h ASP 101 Ca 0.29 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.80 1dr2 h ASP 101 Cb 0.36 0.00 0.19 0.00 0.22 0.00 0.00 39.33 40.09 1dr2 h ASP 101 CO -0.30 0.00 -0.04 -1.54 -1.72 0.00 0.00 179.24 175.64 1dr2 n SER 102 N -2.44 -0.13 0.25 6.45 3.41 0.11 -4.48 113.62 116.80 1dr2 n SER 102 Ca 0.01 0.57 -0.16 0.00 -0.26 0.00 0.00 58.87 59.03 1dr2 n SER 102 Cb 0.18 -1.36 -0.08 0.00 -0.26 0.00 0.00 64.21 62.69 1dr2 n SER 102 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1dr2 h PRO 103 N -0.68 -0.72 -0.79 4.33 0.11 -1.86 0.91 132.00 133.30 1dr2 h PRO 103 Ca -0.46 0.05 0.18 0.00 0.11 0.00 0.00 66.00 65.88 1dr2 h PRO 103 Cb 1.32 0.16 -0.12 0.00 0.11 0.00 0.00 31.00 32.47 1dr2 h PRO 103 CO 0.44 -0.48 0.21 1.05 -0.21 0.00 0.00 178.00 179.01 1dr2 h GLU 104 N -0.75 0.26 0.00 1.05 9.09 -1.92 -2.95 114.58 119.36 1dr2 h GLU 104 Ca -0.04 -0.02 -0.06 0.00 0.05 0.00 0.00 59.36 59.30 1dr2 h GLU 104 Cb 0.65 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.68 1dr2 h GLU 104 CO -0.01 0.17 -0.34 -0.07 0.05 0.00 0.00 179.01 178.82 1dr2 h LEU 105 N 0.27 0.00 -0.81 3.06 3.38 -1.75 -3.34 115.31 116.13 1dr2 h LEU 105 Ca 0.46 -0.68 0.20 0.00 0.09 0.00 0.00 57.88 57.95 1dr2 h LEU 105 Cb 0.84 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.44 1dr2 h LEU 105 CO -0.55 1.04 -0.08 0.29 0.09 0.00 0.00 178.44 179.23 1dr2 n LYS 106 N -4.59 -0.07 0.13 1.13 4.76 0.32 0.17 118.16 120.00 1dr2 n LYS 106 Ca -0.14 1.23 0.13 0.00 -2.87 0.00 0.00 58.31 56.66 1dr2 n LYS 106 Cb 0.45 -1.90 0.28 0.00 -1.84 0.00 0.00 35.03 32.02 1dr2 n LYS 106 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1dr2 h SER 107 N 0.00 0.00 0.60 4.39 4.64 -1.71 -3.29 113.55 118.18 1dr2 h SER 107 Ca 0.44 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1dr2 h SER 107 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1dr2 h SER 107 CO -0.79 0.02 -1.15 0.29 -0.87 0.00 0.00 176.83 174.33 1dr2 n LYS 108 N -2.49 0.46 -4.48 4.77 4.01 0.44 -4.87 118.16 116.00 1dr2 n LYS 108 Ca 0.04 0.02 -0.34 0.00 -0.51 0.00 0.00 58.31 57.52 1dr2 n LYS 108 Cb 0.47 -1.67 -0.11 0.00 -0.51 0.00 0.00 35.03 33.20 1dr2 n LYS 108 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1dr2 s VAL 109 N -3.31 3.90 0.00 -0.18 1.01 -0.17 -1.26 120.40 120.39 1dr2 s VAL 109 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1dr2 s VAL 109 Cb 0.12 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.85 1dr2 s VAL 109 CO 0.81 0.55 0.00 -0.67 0.00 0.00 0.00 175.10 175.79 1dr2 n ASP 110 N 2.81 0.00 -4.71 3.32 2.03 0.24 -4.86 116.55 115.38 1dr2 n ASP 110 Ca -0.18 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 54.81 1dr2 n ASP 110 Cb 0.53 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.85 1dr2 n ASP 110 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1dr2 s MET 111 N 0.00 2.78 -0.21 -0.67 -1.94 -1.26 -4.98 119.30 113.02 1dr2 s MET 111 Ca 0.00 -0.66 -0.08 0.00 -1.71 0.00 0.00 55.69 53.24 1dr2 s MET 111 Cb 0.00 -2.67 -0.04 0.00 2.01 0.00 0.00 34.83 34.13 1dr2 s MET 111 CO 0.00 0.60 0.09 0.08 -0.01 0.00 0.00 175.02 175.78 1dr2 s VAL 112 N -1.20 4.82 -0.07 -6.03 1.01 -1.26 -0.68 120.40 116.98 1dr2 s VAL 112 Ca 0.23 -0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.24 1dr2 s VAL 112 Cb -0.12 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 1dr2 s VAL 112 CO 0.14 0.41 -0.24 0.26 0.00 0.00 0.00 175.10 175.67 1dr2 s TRP 113 N 0.80 2.43 -0.28 5.22 0.52 0.14 -2.34 118.94 125.43 1dr2 s TRP 113 Ca 0.05 -0.84 -0.11 0.00 0.02 0.00 0.00 56.10 55.22 1dr2 s TRP 113 Cb -0.13 -1.61 -0.05 0.00 -1.15 0.00 0.00 33.47 30.53 1dr2 s TRP 113 CO 0.02 -0.30 0.19 0.42 0.02 0.00 0.00 176.95 177.30 1dr2 s ILE 114 N 0.07 5.27 -0.31 2.03 -1.09 0.18 -0.20 121.20 127.15 1dr2 s ILE 114 Ca -0.10 0.13 0.15 0.00 -2.23 0.00 0.00 60.65 58.60 1dr2 s ILE 114 Cb -0.15 -3.52 0.45 0.00 -1.58 0.00 0.00 42.46 37.66 1dr2 s ILE 114 CO 0.06 0.24 1.35 1.33 -1.23 0.00 0.00 174.94 176.69 1dr2 n VAL 115 N 5.06 1.97 -0.91 2.92 0.24 -0.03 -2.04 118.33 125.54 1dr2 n VAL 115 Ca -0.14 -1.72 0.00 0.00 -2.04 0.00 0.00 64.34 60.44 1dr2 n VAL 115 Cb 0.52 -0.09 0.00 0.00 -1.47 0.00 0.00 33.84 32.80 1dr2 n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dr2 n GLY 116 N -0.39 -2.69 0.00 7.63 0.00 -1.25 -4.93 105.19 103.56 1dr2 n GLY 116 Ca 0.18 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.45 1dr2 n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dr2 n GLY 117 N -0.35 0.34 0.16 -0.02 0.00 -1.26 -0.91 105.19 103.16 1dr2 n GLY 117 Ca 0.00 -1.57 -0.04 0.00 0.00 0.00 0.00 46.02 44.40 1dr2 n GLY 117 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1dr2 n THR 118 N 0.00 -0.27 -0.13 2.61 -1.04 -1.26 -0.77 114.28 113.42 1dr2 n THR 118 Ca 0.00 1.78 0.08 0.00 -2.04 0.00 0.00 64.05 63.88 1dr2 n THR 118 Cb 0.00 -2.29 0.41 0.00 -1.82 0.00 0.00 70.33 66.64 1dr2 n THR 118 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dr2 h ALA 119 N -0.36 1.82 -0.19 2.41 0.00 -1.96 -1.00 119.26 119.97 1dr2 h ALA 119 Ca 0.06 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1dr2 h ALA 119 Cb 0.16 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1dr2 h ALA 119 CO -0.37 0.07 -0.12 0.28 0.00 0.00 0.00 179.25 179.11 1dr2 h VAL 120 N 0.61 1.31 -0.23 0.00 2.07 -1.37 -2.55 116.25 116.10 1dr2 h VAL 120 Ca 0.29 -1.20 0.01 0.00 0.82 0.00 0.00 66.70 66.62 1dr2 h VAL 120 Cb 0.34 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1dr2 h VAL 120 CO -0.09 0.36 0.13 1.88 0.02 0.00 0.00 177.57 179.87 1dr2 h TYR 121 N 0.11 0.24 -0.10 1.57 0.05 -0.46 -2.08 116.97 116.30 1dr2 h TYR 121 Ca 0.04 0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.86 1dr2 h TYR 121 Cb 0.62 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 1dr2 h TYR 121 CO 0.07 0.14 -0.10 -0.22 -1.05 0.00 0.00 178.16 177.00 1dr2 h LYS 122 N 0.27 -0.12 -0.49 4.88 3.64 -1.21 -0.75 116.57 122.78 1dr2 h LYS 122 Ca 0.09 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 1dr2 h LYS 122 Cb -0.00 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.80 1dr2 h LYS 122 CO -0.04 -0.08 0.23 0.00 -2.27 0.00 0.00 179.45 177.28 1dr2 h ALA 123 N 0.94 0.62 -0.43 5.00 0.00 -1.34 -2.17 119.26 121.88 1dr2 h ALA 123 Ca 0.07 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1dr2 h ALA 123 Cb 0.23 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1dr2 h ALA 123 CO -0.17 -0.14 -0.05 0.00 0.00 0.00 0.00 179.25 178.89 1dr2 h ALA 124 N 1.29 1.10 -0.01 0.00 0.00 -1.03 -2.74 119.26 117.87 1dr2 h ALA 124 Ca 0.22 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1dr2 h ALA 124 Cb 0.17 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1dr2 h ALA 124 CO -0.18 0.56 -0.38 0.52 0.00 0.00 0.00 179.25 179.77 1dr2 h MET 125 N 0.68 0.01 0.00 0.00 2.86 -0.62 -2.97 114.93 114.89 1dr2 h MET 125 Ca 0.13 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.73 1dr2 h MET 125 Cb 0.50 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1dr2 h MET 125 CO 0.03 0.39 -0.16 0.93 1.06 0.00 0.00 176.91 179.16 1dr2 h GLU 126 N 0.01 0.00 -6.64 1.72 5.08 -1.10 -3.45 114.58 110.20 1dr2 h GLU 126 Ca -0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.83 1dr2 h GLU 126 Cb 0.68 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.98 1dr2 h GLU 126 CO 0.05 0.16 0.89 0.15 -1.00 0.00 0.00 179.01 179.25 1dr2 s LYS 127 N -3.22 4.20 -1.36 2.33 -0.14 -1.13 -4.85 119.74 115.58 1dr2 s LYS 127 Ca 0.05 2.40 -0.14 0.00 -1.36 0.00 0.00 55.97 56.92 1dr2 s LYS 127 Cb 0.06 -3.13 -0.02 0.00 -1.68 0.00 0.00 37.83 33.06 1dr2 s LYS 127 CO 0.68 -0.61 2.35 -0.35 -0.76 0.00 0.00 175.35 176.65 1dr2 n PRO 128 N 3.72 2.80 -4.01 -1.68 -0.04 -1.26 -4.82 135.00 129.71 1dr2 n PRO 128 Ca 0.13 -2.33 -0.09 0.00 -0.04 0.00 0.00 63.50 61.17 1dr2 n PRO 128 Cb 0.38 -3.07 -0.11 0.00 -0.04 0.00 0.00 33.50 30.66 1dr2 n PRO 128 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1dr2 s ILE 129 N 3.24 0.20 0.14 0.52 -4.36 -1.26 -4.94 121.20 114.74 1dr2 s ILE 129 Ca 0.53 -1.09 -0.34 0.00 -0.26 0.00 0.00 60.65 59.49 1dr2 s ILE 129 Cb 0.15 -0.52 -0.14 0.00 1.25 0.00 0.00 42.46 43.19 1dr2 s ILE 129 CO -0.05 -0.56 1.54 0.59 0.24 0.00 0.00 174.94 176.69 1dr2 n ASN 130 N 1.33 2.82 -3.71 4.36 4.13 -1.26 -4.70 115.26 118.23 1dr2 n ASN 130 Ca -0.22 1.09 -0.12 0.00 1.68 0.00 0.00 54.58 57.01 1dr2 n ASN 130 Cb 0.56 -1.38 -0.11 0.00 -1.54 0.00 0.00 39.78 37.31 1dr2 n ASN 130 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 1dr2 s HIS 131 N 0.87 -0.52 -0.13 3.10 2.46 -0.79 -0.49 115.29 119.79 1dr2 s HIS 131 Ca 0.80 1.16 0.00 0.00 0.47 0.00 0.00 55.06 57.49 1dr2 s HIS 131 Cb -0.73 0.21 -0.01 0.00 -0.13 0.00 0.00 32.58 31.91 1dr2 s HIS 131 CO 0.40 -0.29 -0.14 1.03 -2.47 0.00 0.00 174.74 173.27 1dr2 s ARG 132 N 0.96 3.34 -0.22 2.88 0.52 -0.02 -0.77 118.95 125.64 1dr2 s ARG 132 Ca -0.06 -0.71 -0.02 0.00 -0.52 0.00 0.00 55.73 54.42 1dr2 s ARG 132 Cb -0.07 -2.61 0.01 0.00 0.52 0.00 0.00 34.95 32.80 1dr2 s ARG 132 CO -0.08 0.17 -0.09 -1.17 0.02 0.00 0.00 175.30 174.15 1dr2 s LEU 133 N 0.44 2.76 -0.34 2.53 2.96 0.11 -1.15 118.68 125.99 1dr2 s LEU 133 Ca -0.10 -0.61 -0.11 0.00 -0.22 0.00 0.00 54.13 53.09 1dr2 s LEU 133 Cb -0.16 -1.64 0.01 0.00 0.50 0.00 0.00 46.19 44.90 1dr2 s LEU 133 CO 0.05 -0.05 0.19 -0.36 -1.32 0.00 0.00 176.35 174.86 1dr2 s PHE 134 N 1.38 3.21 -0.12 5.38 0.40 0.39 -0.36 117.98 128.25 1dr2 s PHE 134 Ca 0.04 -0.71 0.01 0.00 -0.60 0.00 0.00 56.93 55.67 1dr2 s PHE 134 Cb -0.15 -2.41 -0.01 0.00 0.51 0.00 0.00 43.02 40.97 1dr2 s PHE 134 CO -0.06 -0.53 -0.16 0.08 0.70 0.00 0.00 175.22 175.25 1dr2 s VAL 135 N 1.60 2.81 -0.33 -0.44 1.01 0.30 -1.20 120.40 124.15 1dr2 s VAL 135 Ca 0.04 -0.75 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 1dr2 s VAL 135 Cb -0.18 -2.16 -0.00 0.00 0.00 0.00 0.00 36.38 34.04 1dr2 s VAL 135 CO 0.07 0.53 0.18 -0.89 0.00 0.00 0.00 175.10 174.99 1dr2 s THR 136 N 0.35 4.75 -0.44 3.92 2.01 -0.34 -0.76 115.64 125.12 1dr2 s THR 136 Ca -0.13 -0.46 -0.21 0.00 0.31 0.00 0.00 61.69 61.20 1dr2 s THR 136 Cb -0.16 -3.47 0.03 0.00 0.01 0.00 0.00 72.50 68.90 1dr2 s THR 136 CO 0.06 -0.01 0.64 -0.13 -0.69 0.00 0.00 174.62 174.50 1dr2 s ARG 137 N 1.63 3.26 -0.35 4.92 1.81 0.21 -1.08 118.95 129.35 1dr2 s ARG 137 Ca 0.04 -0.41 -0.21 0.00 -1.72 0.00 0.00 55.73 53.43 1dr2 s ARG 137 Cb -0.18 -3.96 0.00 0.00 -0.45 0.00 0.00 34.95 30.36 1dr2 s ARG 137 CO 0.07 -1.03 0.65 0.42 -0.68 0.00 0.00 175.30 174.73 1dr2 s ILE 138 N 2.81 4.88 0.00 1.52 1.01 0.80 -0.77 121.20 131.45 1dr2 s ILE 138 Ca 0.22 0.65 -0.04 0.00 0.00 0.00 0.00 60.65 61.48 1dr2 s ILE 138 Cb -0.14 -4.08 -0.18 0.00 0.01 0.00 0.00 42.46 38.06 1dr2 s ILE 138 CO 0.18 -0.31 2.73 0.18 0.00 0.00 0.00 174.94 177.73 1dr2 n LEU 139 N 6.07 4.06 -3.64 2.97 4.77 -0.63 -2.64 117.00 127.95 1dr2 n LEU 139 Ca -0.01 -2.47 -0.10 0.00 -0.03 0.00 0.00 56.01 53.40 1dr2 n LEU 139 Cb 0.49 -1.07 -0.03 0.00 -2.33 0.00 0.00 43.42 40.48 1dr2 n LEU 139 CO 0.49 1.14 0.38 -1.00 -1.33 0.00 0.00 177.39 177.07 1dr2 s HIS 140 N 1.32 -0.31 -0.03 -1.77 3.76 -1.26 -4.86 115.29 112.14 1dr2 s HIS 140 Ca 0.45 -0.02 0.02 0.00 -0.15 0.00 0.00 55.06 55.36 1dr2 s HIS 140 Cb 0.21 0.54 -0.03 0.00 1.11 0.00 0.00 32.58 34.42 1dr2 s HIS 140 CO 0.00 -0.98 -0.08 -1.21 -0.85 0.00 0.00 174.74 171.63 1dr2 s GLU 141 N -3.84 2.62 0.01 1.40 2.02 -1.26 -0.44 118.70 119.21 1dr2 s GLU 141 Ca 0.06 -0.65 0.01 0.00 0.02 0.00 0.00 54.97 54.41 1dr2 s GLU 141 Cb -0.02 -2.52 -0.01 0.00 0.10 0.00 0.00 34.13 31.67 1dr2 s GLU 141 CO -0.04 0.63 -0.03 -0.06 0.02 0.00 0.00 175.26 175.78 1dr2 s PHE 142 N -0.89 0.29 0.15 1.61 0.40 -1.26 -4.99 117.98 113.29 1dr2 s PHE 142 Ca 0.14 -0.20 -0.31 0.00 -0.60 0.00 0.00 56.93 55.96 1dr2 s PHE 142 Cb -0.11 -0.19 -0.11 0.00 0.51 0.00 0.00 43.02 43.13 1dr2 s PHE 142 CO 0.04 -0.05 1.75 -1.83 0.70 0.00 0.00 175.22 175.83 1dr2 s GLU 143 N -0.55 4.15 0.09 0.44 -1.05 -1.26 -4.89 118.70 115.62 1dr2 s GLU 143 Ca -0.04 2.55 0.05 0.00 -0.15 0.00 0.00 54.97 57.38 1dr2 s GLU 143 Cb -0.04 -3.37 -0.03 0.00 -0.44 0.00 0.00 34.13 30.25 1dr2 s GLU 143 CO -0.00 -0.78 -0.12 -1.12 0.95 0.00 0.00 175.26 174.19 1dr2 s SER 144 N 1.99 1.62 0.00 0.83 0.01 -1.26 -4.75 113.70 112.13 1dr2 s SER 144 Ca 0.77 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 57.30 1dr2 s SER 144 Cb -0.46 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 65.74 1dr2 s SER 144 CO 0.34 -0.17 0.30 -0.90 0.41 0.00 0.00 173.24 173.22 1dr2 n ASP 145 N 0.85 0.60 -4.02 2.44 5.68 0.03 -4.99 116.55 117.14 1dr2 n ASP 145 Ca -0.18 -0.80 -0.19 0.00 -0.50 0.00 0.00 54.79 53.11 1dr2 n ASP 145 Cb 0.56 0.37 -0.15 0.00 -1.14 0.00 0.00 41.12 40.76 1dr2 n ASP 145 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1dr2 s THR 146 N -0.37 0.73 0.13 2.12 2.01 -0.84 -4.99 115.64 114.44 1dr2 s THR 146 Ca 0.00 -0.38 0.05 0.00 0.31 0.00 0.00 61.69 61.67 1dr2 s THR 146 Cb 0.00 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 1dr2 s THR 146 CO 0.00 0.21 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.67 1dr2 s PHE 147 N -0.12 1.30 0.14 4.92 0.40 -1.26 -0.84 117.98 122.52 1dr2 s PHE 147 Ca 0.02 -0.65 -0.30 0.00 -0.60 0.00 0.00 56.93 55.40 1dr2 s PHE 147 Cb -0.05 -0.67 -0.07 0.00 0.51 0.00 0.00 43.02 42.74 1dr2 s PHE 147 CO -0.00 0.11 1.05 0.12 0.70 0.00 0.00 175.22 177.19 1dr2 s PHE 148 N -2.69 3.68 1.03 0.36 5.36 0.25 -4.60 117.98 121.37 1dr2 s PHE 148 Ca 0.12 1.66 -0.11 0.00 -0.96 0.00 0.00 56.93 57.64 1dr2 s PHE 148 Cb -0.01 -3.19 0.21 0.00 -0.34 0.00 0.00 43.02 39.68 1dr2 s PHE 148 CO 0.02 -0.30 1.08 -1.25 -1.46 0.00 0.00 175.22 173.31 1dr2 s PRO 149 N -0.07 0.17 0.15 10.12 0.04 -1.26 -4.95 135.00 139.20 1dr2 s PRO 149 Ca 0.49 1.13 -0.30 0.00 0.04 0.00 0.00 61.00 62.36 1dr2 s PRO 149 Cb -0.27 -1.66 -0.07 0.00 0.04 0.00 0.00 34.50 32.54 1dr2 s PRO 149 CO 0.32 -3.08 1.16 -1.21 0.04 0.00 0.00 177.00 174.23 1dr2 s GLU 150 N -4.60 4.52 -0.13 4.56 2.02 -1.26 -5.03 118.70 118.77 1dr2 s GLU 150 Ca 0.67 1.78 -0.11 0.00 0.02 0.00 0.00 54.97 57.34 1dr2 s GLU 150 Cb -0.23 -3.28 -0.05 0.00 0.10 0.00 0.00 34.13 30.67 1dr2 s GLU 150 CO 0.61 -0.07 0.22 0.96 0.02 0.00 0.00 175.26 177.00 1dr2 s ILE 151 N 0.16 5.36 -0.73 -1.63 -4.36 -1.26 -5.03 121.20 113.71 1dr2 s ILE 151 Ca 0.53 0.40 -0.26 0.00 -0.26 0.00 0.00 60.65 61.05 1dr2 s ILE 151 Cb -0.30 -3.52 0.01 0.00 1.25 0.00 0.00 42.46 39.89 1dr2 s ILE 151 CO 0.34 0.52 1.53 -0.62 0.24 0.00 0.00 174.94 176.95 1dr2 s ASP 152 N -0.39 5.83 0.35 4.36 -1.08 -1.26 -4.84 116.67 119.65 1dr2 s ASP 152 Ca 0.15 -0.30 0.24 0.00 -0.52 0.00 0.00 52.55 52.13 1dr2 s ASP 152 Cb -0.13 -2.55 1.29 0.00 -1.46 0.00 0.00 42.92 40.08 1dr2 s ASP 152 CO 0.04 -2.05 1.74 1.88 0.52 0.00 0.00 175.17 177.31 1dr2 h TYR 153 N 11.74 0.00 0.00 -5.34 0.05 -1.96 0.66 116.97 122.12 1dr2 h TYR 153 Ca -0.20 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.45 1dr2 h TYR 153 Cb 1.08 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.80 1dr2 h TYR 153 CO 1.12 0.00 -0.70 0.87 -1.05 0.00 0.00 178.16 178.40 1dr2 h LYS 154 N 0.00 0.00 0.01 4.88 1.57 -2.02 -3.37 116.57 117.64 1dr2 h LYS 154 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.45 1dr2 h LYS 154 Cb 0.03 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.29 1dr2 h LYS 154 CO 0.00 0.54 -1.80 -0.25 -0.57 0.00 0.00 179.45 177.37 1dr2 n ASP 155 N -3.20 1.93 -4.46 0.86 8.00 -0.30 -4.84 116.55 114.55 1dr2 n ASP 155 Ca 0.00 0.34 -0.44 0.00 0.71 0.00 0.00 54.79 55.41 1dr2 n ASP 155 Cb 0.78 -0.88 -0.06 0.00 -0.02 0.00 0.00 41.12 40.94 1dr2 n ASP 155 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1dr2 s PHE 156 N -2.44 3.01 -0.15 1.24 0.40 0.07 -4.13 117.98 115.99 1dr2 s PHE 156 Ca -0.31 -0.45 -0.18 0.00 -0.60 0.00 0.00 56.93 55.38 1dr2 s PHE 156 Cb 0.09 -3.61 -0.04 0.00 0.51 0.00 0.00 43.02 39.97 1dr2 s PHE 156 CO 0.58 -1.07 0.48 0.15 0.70 0.00 0.00 175.22 176.06 1dr2 s LYS 157 N 2.82 4.29 0.05 0.44 -0.14 -0.25 -4.53 119.74 122.42 1dr2 s LYS 157 Ca 0.17 0.42 -0.31 0.00 -1.36 0.00 0.00 55.97 54.90 1dr2 s LYS 157 Cb -0.18 -3.48 -0.07 0.00 -1.68 0.00 0.00 37.83 32.42 1dr2 s LYS 157 CO 0.13 0.06 1.49 -1.17 -0.76 0.00 0.00 175.35 175.10 1dr2 s LEU 158 N 0.96 4.34 0.46 3.17 2.96 -1.26 -0.97 118.68 128.34 1dr2 s LEU 158 Ca 0.25 2.29 -0.18 0.00 -0.22 0.00 0.00 54.13 56.27 1dr2 s LEU 158 Cb -0.15 -3.57 -0.09 0.00 0.50 0.00 0.00 46.19 42.88 1dr2 s LEU 158 CO 0.10 -0.77 0.94 -0.76 -1.32 0.00 0.00 176.35 174.54 1dr2 s LEU 159 N 2.21 3.79 0.00 -0.68 1.43 0.94 -4.96 118.68 121.41 1dr2 s LEU 159 Ca 0.67 1.57 0.23 0.00 -1.03 0.00 0.00 54.13 55.57 1dr2 s LEU 159 Cb -0.35 -4.46 0.14 0.00 0.03 0.00 0.00 46.19 41.54 1dr2 s LEU 159 CO 0.29 -0.46 1.16 0.35 0.23 0.00 0.00 176.35 177.92 1dr2 n THR 160 N -1.11 0.00 -3.54 5.49 -2.24 -1.26 -4.66 114.28 106.95 1dr2 n THR 160 Ca 0.06 -0.03 -0.16 0.00 -2.27 0.00 0.00 64.05 61.66 1dr2 n THR 160 Cb 0.54 0.69 -0.06 0.00 -2.10 0.00 0.00 70.33 69.40 1dr2 n THR 160 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1dr2 s GLU 161 N -2.93 0.91 -0.19 -0.78 2.12 -1.26 -5.05 118.70 111.52 1dr2 s GLU 161 Ca 0.11 0.28 -0.13 0.00 0.36 0.00 0.00 54.97 55.60 1dr2 s GLU 161 Cb 0.17 0.43 0.06 0.00 0.26 0.00 0.00 34.13 35.05 1dr2 s GLU 161 CO 0.76 -0.27 0.47 -0.47 -0.54 0.00 0.00 175.26 175.21 1dr2 s TYR 162 N -1.04 -0.63 -0.34 5.30 5.04 -1.26 -5.07 117.35 119.35 1dr2 s TYR 162 Ca -0.08 1.38 -0.33 0.00 -2.44 0.00 0.00 57.07 55.61 1dr2 s TYR 162 Cb -0.01 0.28 -0.10 0.00 0.35 0.00 0.00 41.96 42.48 1dr2 s TYR 162 CO 0.07 -0.33 2.23 -0.35 -1.34 0.00 0.00 175.55 175.82 1dr2 n PRO 163 N 3.74 1.25 -0.43 4.97 -0.04 -1.26 -1.53 135.00 141.69 1dr2 n PRO 163 Ca -0.19 0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1dr2 n PRO 163 Cb 0.56 -2.68 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 1dr2 n PRO 163 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dr2 n GLY 164 N 6.34 0.78 3.17 0.55 0.00 -1.26 -5.05 105.19 109.72 1dr2 n GLY 164 Ca 0.39 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 46.06 1dr2 n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dr2 s VAL 165 N -2.00 2.66 0.55 1.61 1.01 -0.58 -5.09 120.40 118.56 1dr2 s VAL 165 Ca 0.00 -1.13 -0.22 0.00 0.00 0.00 0.00 61.98 60.63 1dr2 s VAL 165 Cb 0.00 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 1dr2 s VAL 165 CO 0.00 0.19 1.35 -0.81 0.00 0.00 0.00 175.10 175.83 1dr2 n PRO 166 N 4.62 1.68 0.00 2.72 -0.04 -1.26 -4.56 135.00 138.16 1dr2 n PRO 166 Ca -0.16 0.62 -0.21 0.00 -0.04 0.00 0.00 63.50 63.70 1dr2 n PRO 166 Cb 0.46 -2.57 -0.14 0.00 -0.04 0.00 0.00 33.50 31.22 1dr2 n PRO 166 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1dr2 n ALA 167 N -1.05 0.88 -0.74 0.55 0.00 -1.26 -4.59 120.51 114.29 1dr2 n ALA 167 Ca 0.10 -0.58 -0.29 0.00 0.00 0.00 0.00 53.44 52.67 1dr2 n ALA 167 Cb 0.45 -0.68 0.20 0.00 0.00 0.00 0.00 19.45 19.42 1dr2 n ALA 167 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dr2 s ASP 168 N -7.04 2.09 0.05 0.00 1.01 -1.26 -4.84 116.67 106.67 1dr2 s ASP 168 Ca -0.23 1.70 -0.30 0.00 0.71 0.00 0.00 52.55 54.43 1dr2 s ASP 168 Cb 0.07 -2.34 -0.05 0.00 1.01 0.00 0.00 42.92 41.61 1dr2 s ASP 168 CO 0.76 -3.54 1.13 -0.63 0.21 0.00 0.00 175.17 173.10 1dr2 s ILE 169 N -2.63 4.27 0.20 0.77 1.01 -1.26 -4.66 121.20 118.90 1dr2 s ILE 169 Ca 0.67 1.64 0.00 0.00 0.00 0.00 0.00 60.65 62.96 1dr2 s ILE 169 Cb -0.23 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 1dr2 s ILE 169 CO 0.61 0.13 0.37 -1.10 0.00 0.00 0.00 174.94 174.95 1dr2 s GLN 170 N 1.00 3.50 0.00 2.79 -1.52 0.46 -4.94 119.66 120.95 1dr2 s GLN 170 Ca 0.57 -0.42 -0.02 0.00 -1.95 0.00 0.00 55.36 53.53 1dr2 s GLN 170 Cb -0.27 -2.87 -0.01 0.00 -0.22 0.00 0.00 33.01 29.65 1dr2 s GLN 170 CO 0.29 0.42 0.04 -2.00 -0.25 0.00 0.00 175.29 173.79 1dr2 s GLU 171 N -3.36 0.26 -0.29 2.91 2.12 -1.26 -0.40 118.70 118.67 1dr2 s GLU 171 Ca 0.37 -0.31 -0.21 0.00 0.36 0.00 0.00 54.97 55.19 1dr2 s GLU 171 Cb -0.11 0.10 0.14 0.00 0.26 0.00 0.00 34.13 34.52 1dr2 s GLU 171 CO 0.29 -0.05 1.03 -2.00 -0.54 0.00 0.00 175.26 173.99 1dr2 s GLU 172 N -0.89 0.42 -1.45 4.30 2.12 0.79 -4.93 118.70 119.06 1dr2 s GLU 172 Ca -0.10 0.60 -0.10 0.00 0.36 0.00 0.00 54.97 55.73 1dr2 s GLU 172 Cb -0.06 0.15 0.06 0.00 0.26 0.00 0.00 34.13 34.54 1dr2 s GLU 172 CO -0.00 -0.07 0.73 -0.25 -0.54 0.00 0.00 175.26 175.13 1dr2 n ASP 173 N 2.92 -4.83 0.00 -1.70 8.00 -1.26 -0.33 116.55 119.34 1dr2 n ASP 173 Ca -0.15 -0.51 0.00 0.00 0.71 0.00 0.00 54.79 54.84 1dr2 n ASP 173 Cb 0.57 -3.91 0.00 0.00 -0.02 0.00 0.00 41.12 37.76 1dr2 n ASP 173 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dr2 n GLY 174 N -1.48 0.29 3.56 0.44 0.00 -1.26 -5.00 105.19 101.74 1dr2 n GLY 174 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1dr2 n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dr2 s ILE 175 N -1.61 3.54 0.09 -0.61 -1.09 0.55 -5.12 121.20 116.95 1dr2 s ILE 175 Ca 0.00 -0.55 0.04 0.00 -2.23 0.00 0.00 60.65 57.91 1dr2 s ILE 175 Cb 0.00 -2.44 -0.04 0.00 -1.58 0.00 0.00 42.46 38.40 1dr2 s ILE 175 CO 0.00 0.59 0.02 -1.10 -1.23 0.00 0.00 174.94 173.22 1dr2 s GLN 176 N -0.82 2.65 0.22 2.79 -0.21 -1.26 -0.15 119.66 122.87 1dr2 s GLN 176 Ca 0.12 -0.80 -0.17 0.00 0.02 0.00 0.00 55.36 54.54 1dr2 s GLN 176 Cb -0.11 -2.59 0.02 0.00 1.00 0.00 0.00 33.01 31.32 1dr2 s GLN 176 CO 0.01 0.55 0.53 1.52 -2.12 0.00 0.00 175.29 175.78 1dr2 s TYR 177 N -1.34 -0.00 0.02 0.91 -0.85 0.46 -1.60 117.35 114.94 1dr2 s TYR 177 Ca 0.27 -0.36 0.01 0.00 -0.52 0.00 0.00 57.07 56.47 1dr2 s TYR 177 Cb -0.12 0.37 -0.01 0.00 0.38 0.00 0.00 41.96 42.58 1dr2 s TYR 177 CO 0.19 -0.97 -0.05 -1.59 -1.52 0.00 0.00 175.55 171.61 1dr2 s LYS 178 N -3.91 0.40 0.03 -3.49 -2.85 0.05 -0.41 119.74 109.56 1dr2 s LYS 178 Ca 0.13 -0.48 -0.14 0.00 -1.00 0.00 0.00 55.97 54.48 1dr2 s LYS 178 Cb -0.01 -0.22 -0.06 0.00 -2.06 0.00 0.00 37.83 35.48 1dr2 s LYS 178 CO 0.01 0.04 0.43 -0.06 0.10 0.00 0.00 175.35 175.88 1dr2 s PHE 179 N -0.87 3.70 -0.04 1.78 0.08 -1.26 0.66 117.98 122.02 1dr2 s PHE 179 Ca -0.06 0.98 -0.07 0.00 0.12 0.00 0.00 56.93 57.89 1dr2 s PHE 179 Cb -0.07 -2.29 0.01 0.00 -0.57 0.00 0.00 43.02 40.11 1dr2 s PHE 179 CO -0.00 0.60 0.18 -1.21 -0.10 0.00 0.00 175.22 174.69 1dr2 s GLU 180 N -1.32 0.35 -0.11 0.44 2.02 0.06 -4.93 118.70 115.22 1dr2 s GLU 180 Ca 0.27 -0.00 0.02 0.00 0.02 0.00 0.00 54.97 55.28 1dr2 s GLU 180 Cb -0.16 0.15 0.01 0.00 0.10 0.00 0.00 34.13 34.23 1dr2 s GLU 180 CO 0.15 -0.07 -0.18 0.08 0.02 0.00 0.00 175.26 175.27 1dr2 s VAL 181 N -0.53 1.66 0.05 2.63 1.01 -1.26 -0.53 120.40 123.42 1dr2 s VAL 181 Ca -0.06 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.23 1dr2 s VAL 181 Cb -0.04 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1dr2 s VAL 181 CO 0.01 0.47 -0.14 -0.31 0.00 0.00 0.00 175.10 175.13 1dr2 s TYR 182 N 0.80 2.65 -0.03 5.22 1.51 0.51 -0.04 117.35 127.98 1dr2 s TYR 182 Ca -0.10 -0.19 0.01 0.00 -1.01 0.00 0.00 57.07 55.78 1dr2 s TYR 182 Cb -0.16 -1.48 0.02 0.00 -0.11 0.00 0.00 41.96 40.23 1dr2 s TYR 182 CO 0.01 0.31 -0.04 -1.14 -1.11 0.00 0.00 175.55 173.59 1dr2 s GLN 183 N -1.60 0.58 -0.16 -0.62 0.74 -0.14 0.09 119.66 118.55 1dr2 s GLN 183 Ca 0.16 -0.08 0.01 0.00 0.05 0.00 0.00 55.36 55.50 1dr2 s GLN 183 Cb -0.11 -0.63 0.01 0.00 1.10 0.00 0.00 33.01 33.38 1dr2 s GLN 183 CO 0.07 -0.04 -0.17 0.21 -0.55 0.00 0.00 175.29 174.81 1dr2 s LYS 184 N 0.66 3.12 -0.27 1.67 2.20 0.05 -1.09 119.74 126.08 1dr2 s LYS 184 Ca -0.08 -0.79 -0.08 0.00 -0.36 0.00 0.00 55.97 54.67 1dr2 s LYS 184 Cb -0.11 -2.60 -0.02 0.00 -1.51 0.00 0.00 37.83 33.59 1dr2 s LYS 184 CO -0.00 -0.07 0.10 -1.12 -0.36 0.00 0.00 175.35 173.89 1dr2 s SER 185 N 1.00 5.28 0.00 1.43 0.01 -1.26 -1.88 113.70 118.28 1dr2 s SER 185 Ca -0.02 -0.33 0.13 0.00 1.31 0.00 0.00 55.95 57.04 1dr2 s SER 185 Cb -0.15 -1.95 0.10 0.00 0.21 0.00 0.00 66.02 64.24 1dr2 s SER 185 CO -0.04 -0.09 0.90 0.52 0.41 0.00 0.00 173.24 174.94