#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dth s ASN 2 N 0.00 5.19 -0.19 1.08 2.47 -1.26 -5.09 114.94 117.15 1dth s ASN 2 Ca 0.00 -0.14 -0.10 0.00 0.42 0.00 0.00 52.86 53.03 1dth s ASN 2 Cb 0.00 -1.92 -0.05 0.00 -1.45 0.00 0.00 41.25 37.84 1dth s ASN 2 CO 0.00 0.03 0.16 -0.76 -3.72 0.00 0.00 177.10 172.81 1dth s LEU 3 N 1.24 4.23 0.87 3.21 1.02 -1.26 -5.09 118.68 122.90 1dth s LEU 3 Ca 0.04 0.29 -0.10 0.00 0.02 0.00 0.00 54.13 54.38 1dth s LEU 3 Cb -0.14 -2.13 0.12 0.00 0.02 0.00 0.00 46.19 44.05 1dth s LEU 3 CO 0.03 0.18 1.14 -2.16 0.02 0.00 0.00 176.35 175.57 1dth s PRO 4 N 0.27 1.34 -0.39 1.29 0.04 -1.26 -4.74 135.00 131.55 1dth s PRO 4 Ca 0.10 1.50 -0.29 0.00 0.04 0.00 0.00 61.00 62.35 1dth s PRO 4 Cb -0.11 -1.77 0.01 0.00 0.04 0.00 0.00 34.50 32.66 1dth s PRO 4 CO -0.01 -2.39 1.44 -1.14 0.04 0.00 0.00 177.00 174.95 1dth s GLN 5 N -4.64 3.58 0.18 4.56 2.00 -1.26 -4.74 119.66 119.33 1dth s GLN 5 Ca 0.66 1.02 0.11 0.00 -2.00 0.00 0.00 55.36 55.15 1dth s GLN 5 Cb -0.22 -4.03 -0.04 0.00 0.80 0.00 0.00 33.01 29.51 1dth s GLN 5 CO 0.57 -1.56 -0.23 1.03 -0.50 0.00 0.00 175.29 174.60 1dth s ARG 6 N 4.94 1.56 -0.06 1.67 1.81 -0.60 -4.90 118.95 123.37 1dth s ARG 6 Ca 0.63 -1.46 -0.02 0.00 -1.72 0.00 0.00 55.73 53.16 1dth s ARG 6 Cb -0.15 -1.90 0.03 0.00 -0.45 0.00 0.00 34.95 32.48 1dth s ARG 6 CO 0.32 0.42 0.03 0.71 -0.68 0.00 0.00 175.30 176.10 1dth s TYR 7 N -1.55 0.37 -0.15 -0.53 1.51 0.09 -2.07 117.35 115.03 1dth s TYR 7 Ca 0.20 0.02 -0.13 0.00 -1.01 0.00 0.00 57.07 56.14 1dth s TYR 7 Cb -0.08 -0.65 -0.05 0.00 -0.11 0.00 0.00 41.96 41.07 1dth s TYR 7 CO 0.10 -0.28 0.29 0.42 -1.11 0.00 0.00 175.55 174.97 1dth s ILE 8 N 2.07 5.30 -0.50 2.71 1.01 -0.79 -4.44 121.20 126.55 1dth s ILE 8 Ca 0.05 0.55 -0.16 0.00 0.00 0.00 0.00 60.65 61.09 1dth s ILE 8 Cb -0.12 -3.62 0.10 0.00 0.01 0.00 0.00 42.46 38.82 1dth s ILE 8 CO -0.04 0.42 0.44 -1.61 0.00 0.00 0.00 174.94 174.14 1dth s GLU 9 N 0.27 2.99 -0.13 2.79 2.02 -1.26 -1.80 118.70 123.57 1dth s GLU 9 Ca 0.17 -1.49 -0.10 0.00 0.02 0.00 0.00 54.97 53.57 1dth s GLU 9 Cb -0.13 -4.20 -0.05 0.00 0.10 0.00 0.00 34.13 29.85 1dth s GLU 9 CO 0.04 -1.15 0.21 -1.17 0.02 0.00 0.00 175.26 173.21 1dth s LEU 10 N 1.64 4.33 -0.13 1.80 2.96 -0.35 -0.90 118.68 128.02 1dth s LEU 10 Ca 0.04 0.48 0.02 0.00 -0.22 0.00 0.00 54.13 54.45 1dth s LEU 10 Cb -0.26 -2.21 0.01 0.00 0.50 0.00 0.00 46.19 44.23 1dth s LEU 10 CO 0.05 0.28 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.47 1dth s VAL 11 N -0.37 1.90 -0.17 1.68 1.01 -0.60 -0.77 120.40 123.09 1dth s VAL 11 Ca 0.15 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 1dth s VAL 11 Cb -0.13 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 1dth s VAL 11 CO 0.04 0.52 0.03 -0.69 0.00 0.00 0.00 175.10 174.99 1dth s VAL 12 N 0.86 4.47 -0.26 2.92 1.01 -1.07 -0.83 120.40 127.50 1dth s VAL 12 Ca -0.07 -0.15 -0.03 0.00 0.00 0.00 0.00 61.98 61.72 1dth s VAL 12 Cb -0.15 -2.99 0.02 0.00 0.00 0.00 0.00 36.38 33.26 1dth s VAL 12 CO -0.02 0.49 -0.01 -0.69 0.00 0.00 0.00 175.10 174.86 1dth s VAL 13 N 0.25 3.24 -0.20 2.92 1.01 -0.18 -1.25 120.40 126.19 1dth s VAL 13 Ca 0.02 -0.92 -0.14 0.00 0.00 0.00 0.00 61.98 60.94 1dth s VAL 13 Cb -0.13 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1dth s VAL 13 CO 0.01 0.16 0.30 0.00 0.00 0.00 0.00 175.10 175.57 1dth s ALA 14 N 1.38 3.58 0.78 5.51 0.00 0.37 0.05 121.76 133.44 1dth s ALA 14 Ca 0.01 -0.62 -0.12 0.00 0.00 0.00 0.00 51.96 51.23 1dth s ALA 14 Cb -0.17 -2.48 0.06 0.00 0.00 0.00 0.00 23.12 20.54 1dth s ALA 14 CO -0.02 -0.17 1.16 0.16 0.00 0.00 0.00 175.76 176.88 1dth s ASP 15 N 0.91 4.74 0.44 0.00 -4.77 -0.98 -1.35 116.67 115.65 1dth s ASP 15 Ca 0.15 0.86 0.18 0.00 -3.30 0.00 0.00 52.55 50.44 1dth s ASP 15 Cb -0.14 -1.43 1.11 0.00 -1.09 0.00 0.00 42.92 41.37 1dth s ASP 15 CO 0.06 -1.77 1.90 -0.74 0.70 0.00 0.00 175.17 175.32 1dth h HIS 16 N -0.95 0.44 -0.26 2.11 -0.00 -1.89 0.19 115.15 114.79 1dth h HIS 16 Ca -0.46 0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 59.86 1dth h HIS 16 Cb 1.31 -0.14 -0.01 0.00 -0.00 0.00 0.00 27.41 28.57 1dth h HIS 16 CO 0.36 0.15 -0.14 0.00 -0.00 0.00 0.00 177.93 178.30 1dth h ARG 17 N 0.36 0.44 -0.15 5.26 3.08 -1.93 0.15 114.38 121.59 1dth h ARG 17 Ca 0.40 -0.12 -0.22 0.00 0.07 0.00 0.00 59.98 60.11 1dth h ARG 17 Cb 1.02 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 31.03 1dth h ARG 17 CO -0.12 0.57 -0.76 0.28 -1.07 0.00 0.00 179.97 178.86 1dth h VAL 18 N 0.40 1.29 -0.67 2.04 2.07 -0.98 -2.13 116.25 118.27 1dth h VAL 18 Ca 0.08 -1.98 -0.00 0.00 0.82 0.00 0.00 66.70 65.61 1dth h VAL 18 Cb 0.48 1.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 1dth h VAL 18 CO 0.03 0.63 0.42 0.15 0.02 0.00 0.00 177.57 178.81 1dth h PHE 19 N 0.52 0.87 0.00 1.57 3.57 -0.71 -2.07 116.94 120.69 1dth h PHE 19 Ca -0.05 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1dth h PHE 19 Cb 1.39 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.84 1dth h PHE 19 CO 0.08 0.58 0.00 0.52 -2.23 0.00 0.00 178.31 177.26 1dth h MET 20 N 0.91 0.00 0.01 1.11 2.86 -0.66 -1.53 114.93 117.64 1dth h MET 20 Ca 0.24 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.81 1dth h MET 20 Cb -0.05 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.61 1dth h MET 20 CO -0.05 0.00 -0.30 -0.22 1.06 0.00 0.00 176.91 177.40 1dth h LYS 21 N 0.00 0.18 -1.08 1.72 3.64 -0.68 -3.33 116.57 117.02 1dth h LYS 21 Ca 0.00 -0.21 -0.27 0.00 -1.27 0.00 0.00 60.65 58.90 1dth h LYS 21 Cb 0.63 0.06 -0.15 0.00 -0.41 0.00 0.00 32.23 32.36 1dth h LYS 21 CO 0.00 0.98 0.35 0.66 -2.27 0.00 0.00 179.45 179.16 1dth n TYR 22 N -4.46 1.55 -3.89 1.91 4.01 -1.04 -4.87 117.16 110.38 1dth n TYR 22 Ca -0.10 -1.31 -0.28 0.00 -0.16 0.00 0.00 57.90 56.05 1dth n TYR 22 Cb 0.55 -0.66 0.02 0.00 -0.31 0.00 0.00 39.34 38.94 1dth n TYR 22 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1dth n ASN 23 N -0.23 -3.33 -1.25 7.72 5.15 -1.25 -2.20 115.26 119.87 1dth n ASN 23 Ca 0.30 -0.83 -0.14 0.00 -0.60 0.00 0.00 54.58 53.31 1dth n ASN 23 Cb 1.01 -3.77 -0.06 0.00 -0.53 0.00 0.00 39.78 36.42 1dth n ASN 23 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1dth n SER 24 N -2.89 -4.64 -4.53 1.20 7.64 -0.58 -4.94 113.62 104.89 1dth n SER 24 Ca -0.08 0.36 -0.43 0.00 1.01 0.00 0.00 58.87 59.73 1dth n SER 24 Cb 0.58 -3.92 -0.06 0.00 -1.01 0.00 0.00 64.21 59.79 1dth n SER 24 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1dth s ASP 25 N -2.33 6.35 0.28 6.43 2.15 -0.93 -4.92 116.67 123.70 1dth s ASP 25 Ca 0.00 -0.26 0.07 0.00 0.43 0.00 0.00 52.55 52.79 1dth s ASP 25 Cb 0.00 -2.33 0.41 0.00 -0.30 0.00 0.00 42.92 40.70 1dth s ASP 25 CO 0.00 -0.79 1.66 -0.07 -0.17 0.00 0.00 175.17 175.80 1dth h LEU 26 N 9.76 0.22 -0.56 -1.34 4.07 -1.92 -3.21 115.31 122.32 1dth h LEU 26 Ca -0.25 -0.10 0.02 0.00 0.08 0.00 0.00 57.88 57.63 1dth h LEU 26 Cb 1.09 -0.06 -0.03 0.00 1.08 0.00 0.00 40.66 42.74 1dth h LEU 26 CO 0.90 0.66 0.35 0.78 -1.08 0.00 0.00 178.44 180.06 1dth h ASN 27 N 0.16 0.58 -0.59 -0.43 4.21 -1.98 0.63 115.58 118.16 1dth h ASN 27 Ca 0.01 -0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.41 1dth h ASN 27 Cb 0.91 -0.13 -0.02 0.00 -1.12 0.00 0.00 38.32 37.96 1dth h ASN 27 CO 0.07 0.41 -0.04 0.74 -1.29 0.00 0.00 177.43 177.32 1dth h THR 28 N 0.70 1.27 -0.49 2.81 2.02 -1.93 -0.60 112.91 116.68 1dth h THR 28 Ca 0.22 -1.20 -0.10 0.00 0.77 0.00 0.00 66.41 66.10 1dth h THR 28 Cb -0.01 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 1dth h THR 28 CO -0.08 0.43 -0.10 0.40 0.37 0.00 0.00 175.52 176.54 1dth h ILE 29 N 0.96 1.26 -0.57 3.11 2.04 -1.48 -1.12 117.51 121.71 1dth h ILE 29 Ca 0.16 -1.21 -0.04 0.00 1.00 0.00 0.00 64.86 64.77 1dth h ILE 29 Cb 0.61 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 1dth h ILE 29 CO 0.04 0.42 0.21 -0.09 0.00 0.00 0.00 178.15 178.73 1dth h ARG 30 N 0.80 0.87 0.00 2.37 2.43 -0.50 -2.26 114.38 118.09 1dth h ARG 30 Ca 0.13 -0.17 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 1dth h ARG 30 Cb 0.62 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1dth h ARG 30 CO 0.04 0.77 -0.29 1.15 -1.51 0.00 0.00 179.97 180.13 1dth h THR 31 N 0.80 0.59 -0.04 0.20 2.02 -0.86 -2.10 112.91 113.52 1dth h THR 31 Ca 0.19 -1.45 -0.06 0.00 0.77 0.00 0.00 66.41 65.86 1dth h THR 31 Cb 0.24 1.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.64 1dth h THR 31 CO -0.01 0.28 -0.23 0.03 0.37 0.00 0.00 175.52 175.96 1dth h ARG 32 N 0.00 0.23 -0.53 6.66 3.08 -0.95 -3.21 114.38 119.66 1dth h ARG 32 Ca -0.00 -0.19 -0.11 0.00 0.07 0.00 0.00 59.98 59.75 1dth h ARG 32 Cb 0.97 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 1dth h ARG 32 CO 0.04 0.84 -0.11 0.28 -1.07 0.00 0.00 179.97 179.95 1dth h VAL 33 N -0.32 1.27 -0.92 2.04 2.07 -1.43 -2.39 116.25 116.56 1dth h VAL 33 Ca -0.02 -1.26 0.01 0.00 0.82 0.00 0.00 66.70 66.26 1dth h VAL 33 Cb 0.89 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.59 1dth h VAL 33 CO 0.05 0.44 0.61 -0.74 0.02 0.00 0.00 177.57 177.95 1dth h HIS 34 N 0.88 1.15 0.02 1.57 -0.00 -1.48 -1.77 115.15 115.53 1dth h HIS 34 Ca 0.14 0.03 -0.22 0.00 -0.00 0.00 0.00 60.37 60.32 1dth h HIS 34 Cb 0.67 -0.39 -0.01 0.00 -0.00 0.00 0.00 27.41 27.68 1dth h HIS 34 CO 0.04 0.72 -0.96 0.93 -0.00 0.00 0.00 177.93 178.66 1dth h GLU 35 N 1.24 0.26 -0.61 5.26 4.39 -1.54 -2.99 114.58 120.58 1dth h GLU 35 Ca 0.34 -0.31 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 1dth h GLU 35 Cb -0.12 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.59 1dth h GLU 35 CO -0.08 1.04 0.31 0.82 -1.16 0.00 0.00 179.01 179.94 1dth h ILE 36 N 0.13 1.21 -0.71 3.13 2.04 -0.89 -2.27 117.51 120.15 1dth h ILE 36 Ca -0.07 -0.56 -0.05 0.00 1.00 0.00 0.00 64.86 65.17 1dth h ILE 36 Cb 1.62 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 1dth h ILE 36 CO 0.15 0.23 0.23 0.58 0.00 0.00 0.00 178.15 179.35 1dth h VAL 37 N 0.83 1.25 -0.96 1.67 2.07 -1.38 -1.35 116.25 118.38 1dth h VAL 37 Ca 0.21 -0.87 0.04 0.00 0.82 0.00 0.00 66.70 66.91 1dth h VAL 37 Cb 0.09 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 1dth h VAL 37 CO -0.03 0.34 0.63 0.78 0.02 0.00 0.00 177.57 179.31 1dth h ASN 38 N 1.05 1.04 -0.26 0.57 2.35 -1.29 0.67 115.58 119.70 1dth h ASN 38 Ca 0.23 -0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.83 1dth h ASN 38 Cb 0.28 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1dth h ASN 38 CO -0.01 0.70 -0.38 -0.26 -1.65 0.00 0.00 177.43 175.83 1dth h PHE 39 N 1.20 0.96 -0.14 1.19 0.04 -0.91 -2.58 116.94 116.69 1dth h PHE 39 Ca 0.39 -0.28 -0.00 0.00 2.80 0.00 0.00 57.97 60.88 1dth h PHE 39 Cb 0.04 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 1dth h PHE 39 CO -0.00 1.06 0.09 0.82 -0.60 0.00 0.00 178.31 179.67 1dth h ILE 40 N 0.66 1.06 -0.94 -0.55 2.04 -0.09 -2.39 117.51 117.30 1dth h ILE 40 Ca 0.06 -0.15 0.12 0.00 1.00 0.00 0.00 64.86 65.89 1dth h ILE 40 Cb 0.94 0.91 -0.08 0.00 -0.74 0.00 0.00 36.82 37.86 1dth h ILE 40 CO 0.09 0.06 0.60 0.78 0.00 0.00 0.00 178.15 179.68 1dth h ASN 41 N 0.16 0.82 -0.12 1.72 2.35 -0.86 -0.67 115.58 118.98 1dth h ASN 41 Ca 0.05 0.04 -0.12 0.00 -0.55 0.00 0.00 56.30 55.72 1dth h ASN 41 Cb 0.02 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 1dth h ASN 41 CO -0.01 0.44 -0.33 1.23 -1.65 0.00 0.00 177.43 177.11 1dth h GLY 42 N 0.88 0.67 1.60 2.83 0.00 -1.13 -2.28 103.07 105.64 1dth h GLY 42 Ca 0.46 -0.63 -0.15 0.00 0.00 0.00 0.00 47.33 47.01 1dth h GLY 42 CO -0.23 0.57 -0.56 0.74 0.00 0.00 0.00 176.54 177.06 1dth h PHE 43 N 0.53 0.52 -0.00 5.60 0.04 -0.73 -3.17 116.94 119.72 1dth h PHE 43 Ca 0.06 -0.19 0.00 0.00 2.80 0.00 0.00 57.97 60.64 1dth h PHE 43 Cb 0.83 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.88 1dth h PHE 43 CO 0.04 0.88 -0.02 0.66 -0.60 0.00 0.00 178.31 179.27 1dth n TYR 44 N -3.93 0.00 -0.33 -0.55 4.01 -0.38 -4.05 117.16 111.92 1dth n TYR 44 Ca -0.03 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.77 1dth n TYR 44 Cb 0.60 -0.04 0.22 0.00 -0.31 0.00 0.00 39.34 39.80 1dth n TYR 44 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dth h ARG 45 N 0.71 0.87 -0.04 -0.72 2.47 -1.38 -2.17 114.38 114.12 1dth h ARG 45 Ca 0.00 -0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 58.63 1dth h ARG 45 Cb 0.20 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.32 1dth h ARG 45 CO 0.00 0.58 -0.15 0.77 0.56 0.00 0.00 179.97 181.73 1dth h SER 46 N 0.90 0.05 -0.18 7.04 0.02 -1.82 -2.89 113.55 116.67 1dth h SER 46 Ca 0.46 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 1dth h SER 46 Cb 0.47 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1dth h SER 46 CO -0.27 0.21 0.00 0.18 -1.14 0.00 0.00 176.83 175.81 1dth n LEU 47 N -4.34 3.19 -2.79 5.07 4.32 -0.85 -4.96 117.00 116.64 1dth n LEU 47 Ca -0.02 -1.21 -0.18 0.00 -0.02 0.00 0.00 56.01 54.58 1dth n LEU 47 Cb 0.23 -0.10 0.06 0.00 -1.62 0.00 0.00 43.42 41.99 1dth n LEU 47 CO 0.36 0.60 0.18 0.59 -1.22 0.00 0.00 177.39 177.91 1dth n ASN 48 N 1.41 -5.27 -4.25 -1.43 4.13 -1.02 -4.79 115.26 104.05 1dth n ASN 48 Ca 0.16 -0.40 -0.32 0.00 1.68 0.00 0.00 54.58 55.71 1dth n ASN 48 Cb 0.60 -3.87 -0.17 0.00 -1.54 0.00 0.00 39.78 34.81 1dth n ASN 48 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1dth s ILE 49 N -3.23 2.04 -0.12 2.41 1.01 -1.15 -1.56 121.20 120.59 1dth s ILE 49 Ca 0.44 -1.04 0.01 0.00 0.00 0.00 0.00 60.65 60.05 1dth s ILE 49 Cb -0.19 -1.74 -0.01 0.00 0.01 0.00 0.00 42.46 40.52 1dth s ILE 49 CO 0.54 0.56 -0.15 -2.28 0.00 0.00 0.00 174.94 173.61 1dth s HIS 50 N 0.02 2.76 -0.18 3.97 5.65 -0.88 -4.43 115.29 122.21 1dth s HIS 50 Ca -0.09 -0.71 -0.07 0.00 0.25 0.00 0.00 55.06 54.44 1dth s HIS 50 Cb -0.15 -1.82 -0.04 0.00 -1.18 0.00 0.00 32.58 29.39 1dth s HIS 50 CO 0.06 -0.25 0.04 0.08 -0.65 0.00 0.00 174.74 174.02 1dth s VAL 51 N 0.34 4.53 -0.07 0.89 1.01 -1.26 -1.89 120.40 123.95 1dth s VAL 51 Ca -0.12 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 61.75 1dth s VAL 51 Cb -0.16 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 1dth s VAL 51 CO 0.06 0.45 -0.11 -0.44 0.00 0.00 0.00 175.10 175.07 1dth s SER 52 N 0.50 4.30 -0.87 3.32 0.01 -0.74 -4.89 113.70 115.32 1dth s SER 52 Ca 0.02 -0.14 -0.21 0.00 1.31 0.00 0.00 55.95 56.92 1dth s SER 52 Cb -0.13 -1.09 0.09 0.00 0.21 0.00 0.00 66.02 65.10 1dth s SER 52 CO 0.01 0.33 1.18 -0.22 0.41 0.00 0.00 173.24 174.95 1dth s LEU 53 N -0.60 4.35 0.09 2.44 0.20 -1.26 -1.22 118.68 122.69 1dth s LEU 53 Ca 0.09 -1.52 -0.16 0.00 0.69 0.00 0.00 54.13 53.23 1dth s LEU 53 Cb -0.11 -2.46 -0.09 0.00 -0.43 0.00 0.00 46.19 43.10 1dth s LEU 53 CO 0.01 -1.33 1.43 0.74 -0.29 0.00 0.00 176.35 176.92 1dth h THR 54 N 6.13 1.30 -2.05 3.68 2.02 -1.30 -3.47 112.91 119.22 1dth h THR 54 Ca 0.03 -1.38 -0.04 0.00 0.77 0.00 0.00 66.41 65.79 1dth h THR 54 Cb 1.03 1.57 -0.19 0.00 -1.74 0.00 0.00 68.15 68.83 1dth h THR 54 CO 1.22 0.44 0.23 -0.62 0.37 0.00 0.00 175.52 177.16 1dth s ASP 55 N -6.44 -0.62 -0.22 4.18 2.15 -1.23 -5.05 116.67 109.43 1dth s ASP 55 Ca -0.13 0.62 0.01 0.00 0.43 0.00 0.00 52.55 53.48 1dth s ASP 55 Cb 0.08 0.52 0.05 0.00 -0.30 0.00 0.00 42.92 43.28 1dth s ASP 55 CO 0.81 -0.62 -0.09 -0.22 -0.17 0.00 0.00 175.17 174.89 1dth s LEU 56 N -1.33 2.58 -0.33 -1.34 2.96 -1.26 -2.59 118.68 117.38 1dth s LEU 56 Ca -0.09 -1.08 -0.13 0.00 -0.22 0.00 0.00 54.13 52.61 1dth s LEU 56 Cb -0.00 -1.27 -0.02 0.00 0.50 0.00 0.00 46.19 45.40 1dth s LEU 56 CO 0.07 -0.18 0.24 -1.61 -1.32 0.00 0.00 176.35 173.54 1dth s GLU 57 N 1.34 3.60 -0.23 1.98 0.41 -0.38 -5.00 118.70 120.42 1dth s GLU 57 Ca -0.04 -0.56 -0.03 0.00 -0.41 0.00 0.00 54.97 53.93 1dth s GLU 57 Cb -0.18 -3.78 0.01 0.00 -1.78 0.00 0.00 34.13 28.40 1dth s GLU 57 CO -0.07 -0.39 -0.05 0.42 -0.49 0.00 0.00 175.26 174.68 1dth s ILE 58 N 1.75 3.17 -1.28 -1.63 1.01 -1.26 -0.48 121.20 122.48 1dth s ILE 58 Ca 0.07 -0.70 -0.19 0.00 0.00 0.00 0.00 60.65 59.83 1dth s ILE 58 Cb -0.17 -2.50 0.03 0.00 0.01 0.00 0.00 42.46 39.83 1dth s ILE 58 CO 0.11 0.34 1.81 0.79 0.00 0.00 0.00 174.94 177.98 1dth n TRP 59 N 4.75 4.19 -0.24 3.97 8.01 -0.46 -4.77 117.44 132.89 1dth n TRP 59 Ca -0.18 -2.57 -0.08 0.00 -1.31 0.00 0.00 57.50 53.37 1dth n TRP 59 Cb 0.49 -2.62 0.05 0.00 -2.01 0.00 0.00 31.31 27.22 1dth n TRP 59 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1dth h SER 60 N 7.90 1.07 0.00 -0.99 4.64 -1.92 -3.26 113.55 120.98 1dth h SER 60 Ca 0.41 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1dth h SER 60 Cb 0.87 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1dth h SER 60 CO 1.45 1.05 -0.20 -1.13 -0.87 0.00 0.00 176.83 177.12 1dth h ASN 61 N 1.05 0.00 -5.12 4.97 -0.00 -2.00 -3.49 115.58 110.99 1dth h ASN 61 Ca 0.21 0.00 -0.07 0.00 -0.00 0.00 0.00 56.30 56.44 1dth h ASN 61 Cb 0.43 0.00 -0.14 0.00 -0.00 0.00 0.00 38.32 38.61 1dth h ASN 61 CO 0.01 0.45 -0.24 -1.83 -0.00 0.00 0.00 177.43 175.82 1dth s GLU 62 N -1.66 0.94 0.37 6.67 -1.05 -1.26 -5.03 118.70 117.68 1dth s GLU 62 Ca -0.06 -0.85 -0.26 0.00 -0.15 0.00 0.00 54.97 53.65 1dth s GLU 62 Cb 0.01 0.40 -0.09 0.00 -0.44 0.00 0.00 34.13 34.01 1dth s GLU 62 CO 0.09 -0.33 1.13 -0.51 0.95 0.00 0.00 175.26 176.59 1dth s ASP 63 N -2.83 6.77 0.10 0.83 1.01 -1.26 -4.80 116.67 116.50 1dth s ASP 63 Ca 0.04 2.28 0.23 0.00 0.71 0.00 0.00 52.55 55.81 1dth s ASP 63 Cb 0.04 -2.61 0.14 0.00 1.01 0.00 0.00 42.92 41.49 1dth s ASP 63 CO -0.11 -0.49 1.12 0.00 0.21 0.00 0.00 175.17 175.89 1dth n GLN 64 N 0.36 0.36 -4.39 8.23 1.13 -1.26 -4.92 117.38 116.89 1dth n GLN 64 Ca 0.03 0.05 -0.20 0.00 -1.94 0.00 0.00 57.00 54.94 1dth n GLN 64 Cb 0.46 -1.67 -0.10 0.00 0.11 0.00 0.00 30.24 29.04 1dth n GLN 64 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1dth s ILE 65 N -3.23 1.48 -0.52 5.09 -4.36 -1.26 -5.09 121.20 113.32 1dth s ILE 65 Ca 0.03 -2.11 -0.27 0.00 -0.26 0.00 0.00 60.65 58.05 1dth s ILE 65 Cb 0.13 -2.38 0.03 0.00 1.25 0.00 0.00 42.46 41.49 1dth s ILE 65 CO 0.77 -0.34 1.08 0.21 0.24 0.00 0.00 174.94 176.91 1dth s ASN 66 N -3.39 6.50 -0.40 4.36 2.47 -1.26 -4.98 114.94 118.24 1dth s ASN 66 Ca 0.28 0.14 -0.29 0.00 0.42 0.00 0.00 52.86 53.42 1dth s ASN 66 Cb 0.04 -2.51 0.02 0.00 -1.45 0.00 0.00 41.25 37.35 1dth s ASN 66 CO 0.10 -1.29 1.13 -0.63 -3.72 0.00 0.00 177.10 172.70 1dth s ILE 67 N 4.41 4.31 0.24 -5.21 -1.09 -1.26 -4.70 121.20 117.90 1dth s ILE 67 Ca 0.41 1.43 0.11 0.00 -2.23 0.00 0.00 60.65 60.38 1dth s ILE 67 Cb -0.09 -4.48 -0.05 0.00 -1.58 0.00 0.00 42.46 36.26 1dth s ILE 67 CO 0.27 -0.75 -0.20 -1.10 -1.23 0.00 0.00 174.94 171.93 1dth s GLN 68 N 4.13 1.67 0.27 2.79 -0.21 -1.26 -5.04 119.66 122.01 1dth s GLN 68 Ca 0.48 -1.62 -0.03 0.00 0.02 0.00 0.00 55.36 54.21 1dth s GLN 68 Cb -0.10 -1.85 0.36 0.00 1.00 0.00 0.00 33.01 32.42 1dth s GLN 68 CO 0.24 0.37 1.90 0.77 -2.12 0.00 0.00 175.29 176.45 1dth h SER 69 N 2.69 0.97 -2.23 5.90 0.02 -1.96 -3.39 113.55 115.55 1dth h SER 69 Ca -0.43 -0.08 -0.55 0.00 -0.84 0.00 0.00 61.79 59.89 1dth h SER 69 Cb 1.23 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 1dth h SER 69 CO 0.55 0.78 1.40 0.00 -1.14 0.00 0.00 176.83 178.41 1dth s ALA 70 N -5.73 2.52 0.25 3.77 0.00 -1.26 -1.69 121.76 119.62 1dth s ALA 70 Ca -0.12 0.18 -0.04 0.00 0.00 0.00 0.00 51.96 51.99 1dth s ALA 70 Cb 0.17 -4.13 0.45 0.00 0.00 0.00 0.00 23.12 19.61 1dth s ALA 70 CO 0.81 -3.18 1.77 0.66 0.00 0.00 0.00 175.76 175.81 1dth h SER 71 N 14.80 0.49 -0.45 0.00 4.64 -1.97 -2.15 113.55 128.92 1dth h SER 71 Ca -0.32 0.08 -0.06 0.00 -0.47 0.00 0.00 61.79 61.01 1dth h SER 71 Cb 1.20 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.27 1dth h SER 71 CO 1.07 0.24 0.06 0.28 -0.87 0.00 0.00 176.83 177.61 1dth h SER 72 N 0.61 0.78 -0.62 4.97 0.02 -1.93 -0.95 113.55 116.43 1dth h SER 72 Ca 0.42 -0.16 -0.08 0.00 -0.84 0.00 0.00 61.79 61.12 1dth h SER 72 Cb 0.53 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 1dth h SER 72 CO -0.33 0.81 0.06 0.44 -1.14 0.00 0.00 176.83 176.67 1dth h ASP 73 N 0.78 1.02 0.47 3.07 3.32 -1.77 -2.44 116.42 120.87 1dth h ASP 73 Ca 0.16 -0.28 -0.15 0.00 0.02 0.00 0.00 57.03 56.78 1dth h ASP 73 Cb 0.38 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1dth h ASP 73 CO 0.01 1.05 -0.65 0.74 -1.72 0.00 0.00 179.24 178.67 1dth h THR 74 N 0.96 1.42 0.10 0.35 2.02 -1.29 -2.42 112.91 114.06 1dth h THR 74 Ca 0.18 -2.12 -0.00 0.00 0.77 0.00 0.00 66.41 65.24 1dth h THR 74 Cb 0.49 2.11 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 1dth h THR 74 CO 0.02 0.62 -0.05 0.25 0.37 0.00 0.00 175.52 176.73 1dth h LEU 75 N 0.12 -0.12 -1.61 2.58 7.12 -1.00 -1.26 115.31 121.14 1dth h LEU 75 Ca -0.01 -0.28 -0.04 0.00 0.13 0.00 0.00 57.88 57.68 1dth h LEU 75 Cb 1.16 0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 41.32 1dth h LEU 75 CO 0.10 0.22 -0.20 0.78 -0.13 0.00 0.00 178.44 179.21 1dth h ASN 76 N -0.47 0.00 0.16 1.25 2.35 -1.45 -0.65 115.58 116.77 1dth h ASN 76 Ca -0.01 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.44 1dth h ASN 76 Cb 0.39 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.78 1dth h ASN 76 CO 0.02 0.20 -1.22 0.00 -1.65 0.00 0.00 177.43 174.79 1dth h ALA 77 N 1.80 0.03 0.00 -0.83 0.00 -1.33 -3.14 119.26 115.79 1dth h ALA 77 Ca -0.00 -0.77 -0.11 0.00 0.00 0.00 0.00 54.91 54.03 1dth h ALA 77 Cb 0.47 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1dth h ALA 77 CO 0.03 0.71 -0.53 0.35 0.00 0.00 0.00 179.25 179.82 1dth h PHE 78 N 0.27 0.00 -0.39 0.00 3.57 -0.83 -3.06 116.94 116.50 1dth h PHE 78 Ca -0.18 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.30 1dth h PHE 78 Cb 1.89 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.61 1dth h PHE 78 CO 0.11 0.53 0.14 0.00 -2.23 0.00 0.00 178.31 176.86 1dth h ALA 79 N 1.47 0.51 0.00 2.41 0.00 -1.12 -1.55 119.26 120.99 1dth h ALA 79 Ca -0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1dth h ALA 79 Cb 0.95 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1dth h ALA 79 CO 0.07 0.13 -0.10 1.05 0.00 0.00 0.00 179.25 180.40 1dth h GLU 80 N 0.49 0.00 0.02 0.00 4.11 -1.58 -2.89 114.58 114.73 1dth h GLU 80 Ca 0.13 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.42 1dth h GLU 80 Cb 0.22 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.48 1dth h GLU 80 CO -0.01 0.10 -0.56 2.35 0.07 0.00 0.00 179.01 180.96 1dth h TRP 81 N 0.00 0.53 -0.66 2.06 7.01 -1.41 -2.86 115.95 120.61 1dth h TRP 81 Ca -0.00 -0.30 0.03 0.00 2.11 0.00 0.00 58.89 60.72 1dth h TRP 81 Cb 0.90 -0.06 -0.04 0.00 -2.10 0.00 0.00 29.16 27.87 1dth h TRP 81 CO 0.00 1.13 0.44 -0.09 -2.79 0.00 0.00 178.44 177.13 1dth h ARG 82 N -0.22 0.80 -0.02 2.65 1.12 -1.28 0.85 114.38 118.27 1dth h ARG 82 Ca -0.08 -0.05 -0.25 0.00 -1.11 0.00 0.00 59.98 58.49 1dth h ARG 82 Cb 1.30 -0.18 0.02 0.00 -0.01 0.00 0.00 29.97 31.10 1dth h ARG 82 CO 0.11 0.53 -0.97 1.49 -3.11 0.00 0.00 179.97 178.01 1dth h GLU 83 N 0.82 0.70 0.02 0.20 4.81 -1.55 -0.21 114.58 119.37 1dth h GLU 83 Ca 0.26 -0.72 -0.32 0.00 -0.13 0.00 0.00 59.36 58.44 1dth h GLU 83 Cb 0.02 0.20 -0.05 0.00 0.63 0.00 0.00 28.75 29.55 1dth h GLU 83 CO -0.07 1.30 -1.92 0.25 -0.73 0.00 0.00 179.01 177.85 1dth n THR 84 N -3.90 1.59 0.00 0.32 -2.24 -1.08 -4.57 114.28 104.40 1dth n THR 84 Ca -0.10 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.90 1dth n THR 84 Cb 0.85 -1.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1dth n THR 84 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1dth n ASP 85 N -3.06 0.00 -0.16 3.42 -0.08 0.28 -4.62 116.55 112.33 1dth n ASP 85 Ca -0.23 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 53.02 1dth n ASP 85 Cb 1.07 0.00 0.07 0.00 2.34 0.00 0.00 41.12 44.60 1dth n ASP 85 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1dth h LEU 86 N 0.00 -0.08 -1.62 -2.67 5.85 -1.60 -2.50 115.31 112.68 1dth h LEU 86 Ca 0.00 0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1dth h LEU 86 Cb 0.00 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1dth h LEU 86 CO 0.00 -0.02 0.28 0.25 -0.34 0.00 0.00 178.44 178.61 1dth h LEU 87 N 0.19 0.44 -0.29 2.25 5.85 -1.21 0.19 115.31 122.72 1dth h LEU 87 Ca 0.25 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1dth h LEU 87 Cb 0.36 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1dth h LEU 87 CO -0.37 0.31 0.00 0.59 -0.34 0.00 0.00 178.44 178.64 1dth n ASN 88 N -4.48 0.44 0.00 1.25 3.02 -0.95 -3.85 115.26 110.70 1dth n ASN 88 Ca 0.04 -1.58 0.00 0.00 -0.03 0.00 0.00 54.58 53.01 1dth n ASN 88 Cb 0.10 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.23 1dth n ASN 88 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1dth n ARG 89 N -0.46 0.00 -3.95 3.52 1.74 -0.58 -5.03 116.66 111.90 1dth n ARG 89 Ca 0.13 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.92 1dth n ARG 89 Cb 0.12 -0.78 -0.17 0.00 -1.02 0.00 0.00 32.46 30.62 1dth n ARG 89 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1dth s LYS 90 N -1.85 1.81 -0.35 5.56 2.47 0.58 -5.09 119.74 122.86 1dth s LYS 90 Ca 0.00 -0.48 -0.29 0.00 -1.56 0.00 0.00 55.97 53.64 1dth s LYS 90 Cb 0.00 -1.95 0.00 0.00 -1.46 0.00 0.00 37.83 34.43 1dth s LYS 90 CO 0.00 -0.31 1.37 0.45 0.16 0.00 0.00 175.35 177.01 1dth s SER 91 N 1.58 6.50 0.19 1.43 0.15 -1.26 -4.29 113.70 118.00 1dth s SER 91 Ca 0.03 1.04 -0.08 0.00 0.70 0.00 0.00 55.95 57.64 1dth s SER 91 Cb -0.14 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.62 1dth s SER 91 CO -0.09 -1.26 0.30 -1.38 1.20 0.00 0.00 173.24 172.01 1dth s HIS 92 N 4.91 0.54 -0.24 3.44 -3.43 -1.26 -5.07 115.29 114.19 1dth s HIS 92 Ca 0.59 -0.88 -0.11 0.00 -0.80 0.00 0.00 55.06 53.86 1dth s HIS 92 Cb -0.15 -0.10 -0.17 0.00 -1.43 0.00 0.00 32.58 30.73 1dth s HIS 92 CO 0.28 -0.77 -0.09 -0.25 -2.00 0.00 0.00 174.74 171.91 1dth n ASP 93 N -0.26 1.96 -4.01 7.38 8.00 -0.08 -4.99 116.55 124.55 1dth n ASP 93 Ca -0.04 0.24 -0.12 0.00 0.71 0.00 0.00 54.79 55.58 1dth n ASP 93 Cb 0.63 -0.77 -0.12 0.00 -0.02 0.00 0.00 41.12 40.84 1dth n ASP 93 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1dth s ASN 94 N -7.07 0.56 -0.09 -2.24 3.84 -0.72 -4.16 114.94 105.06 1dth s ASN 94 Ca -0.33 -0.46 -0.01 0.00 0.21 0.00 0.00 52.86 52.27 1dth s ASN 94 Cb 0.10 0.05 0.03 0.00 -0.55 0.00 0.00 41.25 40.88 1dth s ASN 94 CO 0.58 -0.21 -0.04 0.00 -2.79 0.00 0.00 177.10 174.64 1dth s ALA 95 N -1.23 1.01 -0.18 1.71 0.00 -1.06 -1.55 121.76 120.45 1dth s ALA 95 Ca -0.11 -0.33 -0.04 0.00 0.00 0.00 0.00 51.96 51.49 1dth s ALA 95 Cb -0.09 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 1dth s ALA 95 CO -0.00 -0.38 -0.02 -0.65 0.00 0.00 0.00 175.76 174.71 1dth s GLN 96 N 1.71 3.61 -0.19 0.00 -1.52 -0.01 -2.49 119.66 120.77 1dth s GLN 96 Ca 0.03 -0.54 -0.17 0.00 -1.95 0.00 0.00 55.36 52.73 1dth s GLN 96 Cb -0.13 -2.99 -0.04 0.00 -0.22 0.00 0.00 33.01 29.64 1dth s GLN 96 CO -0.06 0.09 0.46 -1.17 -0.25 0.00 0.00 175.29 174.36 1dth s LEU 97 N 0.77 4.17 -0.43 2.90 2.96 -0.54 -1.01 118.68 127.50 1dth s LEU 97 Ca -0.01 0.63 -0.15 0.00 -0.22 0.00 0.00 54.13 54.38 1dth s LEU 97 Cb -0.14 -2.62 0.04 0.00 0.50 0.00 0.00 46.19 43.97 1dth s LEU 97 CO 0.02 -0.10 0.33 -0.22 -1.32 0.00 0.00 176.35 175.06 1dth s LEU 98 N 1.32 5.29 0.16 -0.68 2.96 0.11 -0.90 118.68 126.93 1dth s LEU 98 Ca 0.22 -1.07 0.07 0.00 -0.22 0.00 0.00 54.13 53.14 1dth s LEU 98 Cb -0.15 -2.16 -0.04 0.00 0.50 0.00 0.00 46.19 44.34 1dth s LEU 98 CO 0.09 -0.52 -0.01 0.28 -1.32 0.00 0.00 176.35 174.87 1dth s THR 99 N 1.66 3.72 -0.95 3.68 -1.32 -0.16 -2.32 115.64 119.95 1dth s THR 99 Ca 0.05 -1.37 0.11 0.00 -1.21 0.00 0.00 61.69 59.27 1dth s THR 99 Cb -0.21 -2.85 0.29 0.00 -1.51 0.00 0.00 72.50 68.22 1dth s THR 99 CO 0.09 -0.07 1.22 0.00 -2.21 0.00 0.00 174.62 173.65 1dth n ALA 100 N 0.02 2.20 -1.98 11.08 0.00 -1.26 -0.71 120.51 129.85 1dth n ALA 100 Ca -0.10 -1.10 -0.36 0.00 0.00 0.00 0.00 53.44 51.87 1dth n ALA 100 Cb 0.55 -0.43 -0.06 0.00 0.00 0.00 0.00 19.45 19.50 1dth n ALA 100 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1dth s ILE 101 N -0.99 4.44 -0.53 0.00 2.07 -1.26 -4.90 121.20 120.02 1dth s ILE 101 Ca 0.22 1.47 -0.28 0.00 -1.41 0.00 0.00 60.65 60.65 1dth s ILE 101 Cb 0.12 -3.89 0.02 0.00 0.13 0.00 0.00 42.46 38.84 1dth s ILE 101 CO 0.16 0.14 1.26 -0.70 -1.91 0.00 0.00 174.94 173.89 1dth s GLU 102 N -2.10 3.52 0.55 3.50 2.56 -1.26 -4.88 118.70 120.60 1dth s GLU 102 Ca 0.47 0.47 -0.19 0.00 0.00 0.00 0.00 54.97 55.71 1dth s GLU 102 Cb -0.17 -4.02 -0.05 0.00 2.00 0.00 0.00 34.13 31.89 1dth s GLU 102 CO 0.21 -1.66 1.15 -0.51 -0.56 0.00 0.00 175.26 173.89 1dth s LEU 103 N 5.17 3.73 0.00 2.70 2.01 -1.26 -4.82 118.68 126.20 1dth s LEU 103 Ca 0.49 2.22 0.00 0.00 0.01 0.00 0.00 54.13 56.85 1dth s LEU 103 Cb -0.09 -4.58 0.00 0.00 0.01 0.00 0.00 46.19 41.53 1dth s LEU 103 CO 0.28 -1.30 0.12 -0.90 1.01 0.00 0.00 176.35 175.56 1dth n ASP 104 N -1.37 0.00 -1.48 2.29 5.75 -0.68 -2.12 116.55 118.94 1dth n ASP 104 Ca 0.12 0.12 -0.05 0.00 -0.01 0.00 0.00 54.79 54.97 1dth n ASP 104 Cb 0.51 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.62 1dth n ASP 104 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1dth n GLU 105 N -0.40 1.26 -3.12 0.11 2.13 -1.26 -4.61 120.64 114.74 1dth n GLU 105 Ca 0.00 -0.53 -0.13 0.00 0.66 0.00 0.00 57.16 57.15 1dth n GLU 105 Cb 0.00 -1.21 0.07 0.00 0.27 0.00 0.00 31.44 30.57 1dth n GLU 105 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1dth n GLU 106 N 0.79 -5.21 -3.14 5.31 -0.58 -0.90 -4.98 120.64 111.93 1dth n GLU 106 Ca 0.10 0.66 -0.39 0.00 -0.42 0.00 0.00 57.16 57.11 1dth n GLU 106 Cb 0.59 -5.13 -0.05 0.00 -0.57 0.00 0.00 31.44 26.28 1dth n GLU 106 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1dth s THR 107 N -3.28 5.01 -0.67 2.62 2.01 -1.15 -4.97 115.64 115.21 1dth s THR 107 Ca 0.02 1.30 0.10 0.00 0.31 0.00 0.00 61.69 63.42 1dth s THR 107 Cb -0.01 -3.97 -0.07 0.00 0.01 0.00 0.00 72.50 68.47 1dth s THR 107 CO 0.57 0.32 0.52 0.18 -0.69 0.00 0.00 174.62 175.52 1dth n LEU 108 N 3.38 0.78 -3.56 4.42 4.32 -1.26 -4.13 117.00 120.96 1dth n LEU 108 Ca -0.04 -0.61 -0.11 0.00 -0.02 0.00 0.00 56.01 55.24 1dth n LEU 108 Cb 0.51 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.27 1dth n LEU 108 CO 0.45 0.17 0.73 -0.83 -1.22 0.00 0.00 177.39 176.69 1dth s GLY 109 N -1.73 -0.34 -0.28 -0.72 0.00 -1.26 -1.45 107.32 101.54 1dth s GLY 109 Ca 0.06 1.76 -0.18 0.00 0.00 0.00 0.00 44.72 46.35 1dth s GLY 109 CO 0.35 0.88 0.71 -2.27 0.00 0.00 0.00 173.10 172.77 1dth s LEU 110 N -1.40 -0.89 -0.10 0.66 2.96 -0.84 -4.98 118.68 114.09 1dth s LEU 110 Ca -0.01 1.47 -0.30 0.00 -0.22 0.00 0.00 54.13 55.08 1dth s LEU 110 Cb -0.01 2.38 0.07 0.00 0.50 0.00 0.00 46.19 49.14 1dth s LEU 110 CO 0.00 -0.24 0.70 0.00 -1.32 0.00 0.00 176.35 175.49 1dth s ALA 111 N 1.34 -1.78 0.52 5.97 0.00 -1.26 0.81 121.76 127.36 1dth s ALA 111 Ca -0.08 1.49 -0.20 0.00 0.00 0.00 0.00 51.96 53.17 1dth s ALA 111 Cb -0.05 -0.29 -0.06 0.00 0.00 0.00 0.00 23.12 22.72 1dth s ALA 111 CO -0.15 -0.36 1.14 -2.14 0.00 0.00 0.00 175.76 174.25 1dth s PRO 112 N -0.83 3.44 -0.03 0.00 0.02 -1.26 -4.85 135.00 131.50 1dth s PRO 112 Ca -0.08 1.65 -0.19 0.00 0.02 0.00 0.00 61.00 62.40 1dth s PRO 112 Cb -0.01 -2.10 -0.05 0.00 0.02 0.00 0.00 34.50 32.36 1dth s PRO 112 CO 0.08 -0.78 0.55 -1.17 -0.33 0.00 0.00 177.00 175.34 1dth s LEU 113 N -3.62 4.40 -1.39 -5.54 2.96 -1.26 -3.05 118.68 111.17 1dth s LEU 113 Ca 0.71 1.06 -0.03 0.00 -0.22 0.00 0.00 54.13 55.65 1dth s LEU 113 Cb -0.25 -2.83 0.02 0.00 0.50 0.00 0.00 46.19 43.63 1dth s LEU 113 CO 0.29 0.11 0.68 0.61 -1.32 0.00 0.00 176.35 176.72 1dth n GLY 114 N 2.53 -0.31 0.04 7.98 0.00 -0.36 -4.85 105.19 110.21 1dth n GLY 114 Ca -0.08 0.14 0.03 0.00 0.00 0.00 0.00 46.02 46.12 1dth n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dth n THR 115 N -4.38 1.22 -1.68 2.61 -2.24 -0.79 -4.86 114.28 104.16 1dth n THR 115 Ca -0.23 -1.35 -0.42 0.00 -2.27 0.00 0.00 64.05 59.78 1dth n THR 115 Cb 0.65 0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 69.12 1dth n THR 115 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1dth n MET 116 N -0.78 2.83 -0.07 -0.78 0.00 -0.63 -2.03 117.12 115.66 1dth n MET 116 Ca 0.05 1.03 0.00 0.00 0.00 0.00 0.00 57.70 58.79 1dth n MET 116 Cb 0.41 -2.95 0.00 0.00 0.00 0.00 0.00 33.22 30.68 1dth n MET 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1dth s ASP 118 N -2.63 6.76 0.48 0.00 -1.08 -0.86 -4.89 116.67 114.44 1dth s ASP 118 Ca 0.00 2.68 0.26 0.00 -0.52 0.00 0.00 52.55 54.97 1dth s ASP 118 Cb 0.00 -2.64 1.15 0.00 -1.46 0.00 0.00 42.92 39.96 1dth s ASP 118 CO 0.00 -0.56 1.93 1.55 0.52 0.00 0.00 175.17 178.61 1dth h PRO 119 N 3.64 0.00 0.00 4.34 0.13 -1.95 -3.14 132.00 135.02 1dth h PRO 119 Ca -0.48 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.43 1dth h PRO 119 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.32 1dth h PRO 119 CO 0.67 0.18 -1.79 1.17 -0.23 0.00 0.00 178.00 178.01 1dth n LYS 120 N -3.47 0.34 -0.24 0.86 4.81 -1.26 -4.11 118.16 115.09 1dth n LYS 120 Ca -0.01 0.09 0.11 0.00 -0.87 0.00 0.00 58.31 57.63 1dth n LYS 120 Cb 0.35 -1.25 0.27 0.00 0.02 0.00 0.00 35.03 34.42 1dth n LYS 120 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1dth n LEU 121 N -2.99 3.23 -3.50 3.14 4.32 -1.26 -4.55 117.00 115.39 1dth n LEU 121 Ca -0.25 -1.50 -0.40 0.00 -0.02 0.00 0.00 56.01 53.84 1dth n LEU 121 Cb 0.75 -0.32 -0.01 0.00 -1.62 0.00 0.00 43.42 42.22 1dth n LEU 121 CO 0.12 0.75 2.61 -0.24 -1.22 0.00 0.00 177.39 179.41 1dth n SER 122 N 1.30 7.62 -3.92 -1.43 2.88 -1.19 -4.61 113.62 114.26 1dth n SER 122 Ca 0.20 -2.98 -0.23 0.00 -1.33 0.00 0.00 58.87 54.53 1dth n SER 122 Cb 0.54 -1.44 -0.08 0.00 -0.75 0.00 0.00 64.21 62.48 1dth n SER 122 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 1dth s ILE 123 N 0.09 0.41 -0.01 2.46 -4.36 -1.26 -2.58 121.20 115.95 1dth s ILE 123 Ca 0.56 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.66 1dth s ILE 123 Cb 0.17 -2.41 0.10 0.00 1.25 0.00 0.00 42.46 41.57 1dth s ILE 123 CO -0.07 0.00 0.88 -0.83 0.24 0.00 0.00 174.94 175.15 1dth s GLY 124 N -3.51 -0.46 -0.06 6.27 0.00 -1.04 -4.11 107.32 104.41 1dth s GLY 124 Ca 0.30 1.08 0.06 0.00 0.00 0.00 0.00 44.72 46.15 1dth s GLY 124 CO 0.18 0.40 -0.25 -0.42 0.00 0.00 0.00 173.10 173.02 1dth s ILE 125 N -2.93 2.03 -0.06 0.90 1.01 0.24 -1.46 121.20 120.92 1dth s ILE 125 Ca 0.04 -1.04 -0.00 0.00 0.00 0.00 0.00 60.65 59.64 1dth s ILE 125 Cb -0.01 -1.73 0.02 0.00 0.01 0.00 0.00 42.46 40.76 1dth s ILE 125 CO -0.08 0.56 -0.03 -0.69 0.00 0.00 0.00 174.94 174.71 1dth s VAL 126 N -0.06 0.50 -0.02 2.92 1.01 -0.08 -1.98 120.40 122.68 1dth s VAL 126 Ca -0.06 -0.03 -0.15 0.00 0.00 0.00 0.00 61.98 61.74 1dth s VAL 126 Cb -0.14 -0.58 -0.05 0.00 0.00 0.00 0.00 36.38 35.60 1dth s VAL 126 CO 0.05 0.25 0.41 -1.58 0.00 0.00 0.00 175.10 174.23 1dth s GLN 127 N 1.42 4.00 -1.08 2.72 0.74 -0.53 -0.99 119.66 125.93 1dth s GLN 127 Ca -0.03 0.40 -0.22 0.00 0.05 0.00 0.00 55.36 55.56 1dth s GLN 127 Cb -0.13 -3.26 0.03 0.00 1.10 0.00 0.00 33.01 30.75 1dth s GLN 127 CO -0.03 0.60 1.62 0.34 -0.55 0.00 0.00 175.29 177.27 1dth s ASP 128 N -0.77 6.28 -0.01 6.67 2.15 0.11 -4.69 116.67 126.41 1dth s ASP 128 Ca 0.24 -1.58 0.11 0.00 0.43 0.00 0.00 52.55 51.75 1dth s ASP 128 Cb -0.16 -2.57 -0.14 0.00 -0.30 0.00 0.00 42.92 39.74 1dth s ASP 128 CO 0.13 -1.72 0.34 0.00 -0.17 0.00 0.00 175.17 173.74 1dth n HIS 129 N 9.91 0.00 -4.34 -5.34 1.44 -1.26 -4.90 115.22 110.73 1dth n HIS 129 Ca 0.39 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.90 1dth n HIS 129 Cb 0.49 -0.13 -0.15 0.00 0.12 0.00 0.00 29.99 30.32 1dth n HIS 129 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1dth s SER 130 N -2.66 1.10 0.00 4.39 0.15 -1.26 -5.00 113.70 110.42 1dth s SER 130 Ca -0.00 -0.17 0.29 0.00 0.70 0.00 0.00 55.95 56.77 1dth s SER 130 Cb 0.08 -0.27 1.71 0.00 -1.71 0.00 0.00 66.02 65.83 1dth s SER 130 CO 0.45 0.06 2.10 -0.81 1.20 0.00 0.00 173.24 176.24 1dth n PRO 131 N 3.24 1.05 -3.37 5.44 -0.04 -1.26 -4.64 135.00 135.41 1dth n PRO 131 Ca -0.17 -0.07 -0.41 0.00 -0.04 0.00 0.00 63.50 62.81 1dth n PRO 131 Cb 0.55 -1.46 -0.09 0.00 -0.04 0.00 0.00 33.50 32.46 1dth n PRO 131 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1dth s ILE 132 N -2.00 5.14 0.57 0.52 1.01 -1.26 -4.96 121.20 120.22 1dth s ILE 132 Ca 0.44 -0.01 0.27 0.00 0.00 0.00 0.00 60.65 61.34 1dth s ILE 132 Cb 0.20 -3.88 0.36 0.00 0.01 0.00 0.00 42.46 39.15 1dth s ILE 132 CO 0.34 -0.17 2.08 0.78 0.00 0.00 0.00 174.94 177.97 1dth h ASN 133 N 8.52 0.00 0.20 3.58 2.35 -1.95 -2.73 115.58 125.54 1dth h ASN 133 Ca -0.29 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.45 1dth h ASN 133 Cb 1.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.51 1dth h ASN 133 CO 0.72 0.00 -0.09 0.25 -1.65 0.00 0.00 177.43 176.66 1dth h LEU 134 N 0.00 -0.22 -1.28 1.61 5.85 -1.93 0.82 115.31 120.15 1dth h LEU 134 Ca 0.11 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 1dth h LEU 134 Cb 0.54 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1dth h LEU 134 CO -0.00 0.07 0.08 -0.07 -0.34 0.00 0.00 178.44 178.18 1dth h LEU 135 N -0.52 0.53 -1.23 2.25 3.38 -1.87 -0.22 115.31 117.63 1dth h LEU 135 Ca -0.03 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1dth h LEU 135 Cb 0.39 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1dth h LEU 135 CO 0.04 0.54 -0.36 0.24 0.09 0.00 0.00 178.44 178.99 1dth h MET 136 N 0.56 0.00 -0.02 1.13 2.86 -1.37 -1.77 114.93 116.31 1dth h MET 136 Ca 0.13 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.55 1dth h MET 136 Cb 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1dth h MET 136 CO -0.00 0.36 -0.89 0.78 1.06 0.00 0.00 176.91 178.22 1dth h GLY 137 N 1.37 0.47 1.23 8.32 0.00 0.89 -2.62 103.07 112.73 1dth h GLY 137 Ca -0.00 -0.79 -0.18 0.00 0.00 0.00 0.00 47.33 46.36 1dth h GLY 137 CO 0.05 0.70 -0.55 -0.39 0.00 0.00 0.00 176.54 176.35 1dth h VAL 138 N 0.25 1.28 -0.48 4.60 -1.51 -1.00 -1.14 116.25 118.26 1dth h VAL 138 Ca -0.07 -1.74 -0.01 0.00 -1.23 0.00 0.00 66.70 63.65 1dth h VAL 138 Cb 1.51 1.66 -0.02 0.00 -2.13 0.00 0.00 31.29 32.31 1dth h VAL 138 CO 0.16 0.56 0.27 0.74 -1.23 0.00 0.00 177.57 178.07 1dth h THR 139 N 0.62 1.17 -0.01 7.19 2.02 -1.33 0.31 112.91 122.88 1dth h THR 139 Ca 0.01 -0.42 -0.16 0.00 0.77 0.00 0.00 66.41 66.62 1dth h THR 139 Cb 1.14 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 1dth h THR 139 CO 0.12 0.17 -0.73 -0.03 0.37 0.00 0.00 175.52 175.42 1dth h MET 140 N 0.64 0.05 -0.03 6.66 -1.53 -1.44 -2.89 114.93 116.39 1dth h MET 140 Ca 0.17 -0.05 -0.16 0.00 -3.44 0.00 0.00 59.70 56.22 1dth h MET 140 Cb 0.04 0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 31.09 1dth h MET 140 CO -0.03 0.76 -0.72 0.00 0.14 0.00 0.00 176.91 177.06 1dth h ALA 141 N 1.23 0.73 -0.24 0.39 0.00 -0.78 -2.21 119.26 118.37 1dth h ALA 141 Ca -0.01 -0.63 -0.02 0.00 0.00 0.00 0.00 54.91 54.24 1dth h ALA 141 Cb 1.30 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1dth h ALA 141 CO 0.10 0.83 0.05 1.25 0.00 0.00 0.00 179.25 181.48 1dth h HIS 142 N 0.11 0.40 0.00 0.00 6.17 -0.31 -1.52 115.15 120.00 1dth h HIS 142 Ca -0.02 -0.05 -0.09 0.00 0.71 0.00 0.00 60.37 60.92 1dth h HIS 142 Cb 1.28 -0.11 -0.01 0.00 2.52 0.00 0.00 27.41 31.09 1dth h HIS 142 CO 0.02 0.48 -0.44 0.93 0.71 0.00 0.00 177.93 179.63 1dth h GLU 143 N 0.20 0.00 0.00 5.26 4.39 -1.49 -1.98 114.58 120.96 1dth h GLU 143 Ca 0.07 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.67 1dth h GLU 143 Cb 0.29 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 1dth h GLU 143 CO 0.00 0.44 -0.51 -0.07 -1.16 0.00 0.00 179.01 177.71 1dth h LEU 144 N 0.00 0.00 -0.43 1.33 3.38 -1.28 -2.73 115.31 115.58 1dth h LEU 144 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1dth h LEU 144 Cb 0.87 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1dth h LEU 144 CO 0.06 0.51 -0.12 1.23 0.09 0.00 0.00 178.44 180.21 1dth h GLY 145 N 2.50 0.92 1.00 0.83 0.00 -0.58 -1.88 103.07 105.86 1dth h GLY 145 Ca -0.01 -0.76 -0.01 0.00 0.00 0.00 0.00 47.33 46.55 1dth h GLY 145 CO 0.07 0.70 0.41 0.45 0.00 0.00 0.00 176.54 178.17 1dth h HIS 146 N 0.67 0.95 0.00 5.60 3.86 -1.28 -0.13 115.15 124.82 1dth h HIS 146 Ca 0.11 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 1dth h HIS 146 Cb 0.66 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 1dth h HIS 146 CO 0.05 0.66 -0.03 -0.91 0.86 0.00 0.00 177.93 178.55 1dth h ASN 147 N 0.97 0.00 -0.55 2.45 -0.26 -1.22 -0.60 115.58 116.37 1dth h ASN 147 Ca 0.25 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.84 1dth h ASN 147 Cb -0.00 0.00 -0.09 0.00 -1.06 0.00 0.00 38.32 37.17 1dth h ASN 147 CO -0.04 0.03 0.19 0.18 -1.06 0.00 0.00 177.43 176.73 1dth n LEU 148 N -4.20 5.02 -0.08 1.61 4.77 -0.63 -1.60 117.00 121.89 1dth n LEU 148 Ca -0.03 -2.60 -0.01 0.00 -0.03 0.00 0.00 56.01 53.34 1dth n LEU 148 Cb 0.12 -0.68 -0.00 0.00 -2.33 0.00 0.00 43.42 40.52 1dth n LEU 148 CO 0.32 0.68 -0.01 0.61 -1.33 0.00 0.00 177.39 177.65 1dth n GLY 149 N 0.00 0.49 3.73 -0.72 0.00 -0.43 -4.07 105.19 104.18 1dth n GLY 149 Ca 0.30 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1dth n GLY 149 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dth s MET 150 N -0.93 4.44 0.43 1.61 -1.94 -0.16 -4.63 119.30 118.13 1dth s MET 150 Ca 0.00 0.92 0.08 0.00 -1.71 0.00 0.00 55.69 54.98 1dth s MET 150 Cb 0.00 -3.42 -0.00 0.00 2.01 0.00 0.00 34.83 33.41 1dth s MET 150 CO 0.00 0.12 0.46 -1.21 -0.01 0.00 0.00 175.02 174.38 1dth s GLU 151 N 0.57 2.59 0.77 2.03 2.02 -1.26 -4.05 118.70 121.37 1dth s GLU 151 Ca 0.38 -1.48 -0.13 0.00 0.02 0.00 0.00 54.97 53.75 1dth s GLU 151 Cb -0.18 -2.49 0.06 0.00 0.10 0.00 0.00 34.13 31.62 1dth s GLU 151 CO 0.19 -0.28 1.16 -1.01 0.02 0.00 0.00 175.26 175.35 1dth s HIS 152 N -2.46 2.11 0.41 1.61 3.76 -1.26 -4.87 115.29 114.58 1dth s HIS 152 Ca 0.50 1.64 0.07 0.00 -0.15 0.00 0.00 55.06 57.12 1dth s HIS 152 Cb -0.05 -3.33 0.07 0.00 1.11 0.00 0.00 32.58 30.38 1dth s HIS 152 CO 0.30 -2.40 0.57 -0.25 -0.85 0.00 0.00 174.74 172.11 1dth n ASP 153 N -3.18 1.50 -4.70 1.40 8.00 0.22 -5.01 116.55 114.78 1dth n ASP 153 Ca 0.12 -2.09 -0.30 0.00 0.71 0.00 0.00 54.79 53.22 1dth n ASP 153 Cb 0.51 -0.30 0.14 0.00 -0.02 0.00 0.00 41.12 41.46 1dth n ASP 153 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1dth s GLY 154 N -3.86 1.64 0.19 0.44 0.00 -1.26 -4.42 107.32 100.05 1dth s GLY 154 Ca 0.43 0.16 -0.14 0.00 0.00 0.00 0.00 44.72 45.17 1dth s GLY 154 CO 0.27 0.62 1.68 1.70 0.00 0.00 0.00 173.10 177.37 1dth h LYS 155 N -1.61 0.11 -2.66 2.90 3.64 -1.99 -3.01 116.57 113.96 1dth h LYS 155 Ca -0.48 -0.01 -0.65 0.00 -1.27 0.00 0.00 60.65 58.25 1dth h LYS 155 Cb 1.27 -0.02 -0.39 0.00 -0.41 0.00 0.00 32.23 32.67 1dth h LYS 155 CO 0.50 0.07 -0.33 -0.25 -2.27 0.00 0.00 179.45 177.18 1dth n ASP 156 N -5.24 4.02 -4.70 4.20 9.92 -1.26 -4.83 116.55 118.66 1dth n ASP 156 Ca 0.06 -3.34 -0.38 0.00 -0.53 0.00 0.00 54.79 50.59 1dth n ASP 156 Cb 0.27 -0.83 -0.06 0.00 -0.64 0.00 0.00 41.12 39.86 1dth n ASP 156 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1dth s LEU 158 N 0.94 1.34 -0.76 0.00 1.43 -1.26 -2.56 118.68 117.82 1dth s LEU 158 Ca 0.26 -0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 53.31 1dth s LEU 158 Cb -0.15 -0.23 0.19 0.00 0.03 0.00 0.00 46.19 46.02 1dth s LEU 158 CO 0.10 -0.07 0.59 -0.60 0.23 0.00 0.00 176.35 176.61 1dth s ARG 159 N 0.80 2.84 4.97 1.70 3.52 -0.46 -4.96 118.95 127.36 1dth s ARG 159 Ca -0.08 -3.02 0.00 0.00 -0.13 0.00 0.00 55.73 52.49 1dth s ARG 159 Cb -0.12 -3.76 0.00 0.00 -1.56 0.00 0.00 34.95 29.52 1dth s ARG 159 CO -0.01 -1.23 0.00 0.41 -0.81 0.00 0.00 175.30 173.66 1dth n GLY 160 N 2.67 0.35 0.02 8.12 0.00 -1.26 -2.77 105.19 112.31 1dth n GLY 160 Ca 0.16 -0.83 0.13 0.00 0.00 0.00 0.00 46.02 45.48 1dth n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dth n ALA 161 N 8.81 2.92 -2.11 4.61 0.00 -1.26 -4.88 120.51 128.60 1dth n ALA 161 Ca 0.00 -0.22 -0.39 0.00 0.00 0.00 0.00 53.44 52.83 1dth n ALA 161 Cb 0.00 -1.28 -0.06 0.00 0.00 0.00 0.00 19.45 18.11 1dth n ALA 161 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1dth s SER 162 N -3.30 7.22 0.08 0.00 0.01 -1.12 -4.94 113.70 111.66 1dth s SER 162 Ca 0.11 1.47 -0.28 0.00 1.31 0.00 0.00 55.95 58.56 1dth s SER 162 Cb 0.17 -2.43 -0.06 0.00 0.21 0.00 0.00 66.02 63.91 1dth s SER 162 CO 0.63 0.22 0.87 -0.76 0.41 0.00 0.00 173.24 174.61 1dth s LEU 163 N -1.23 4.47 0.24 2.44 1.02 -1.16 -1.36 118.68 123.10 1dth s LEU 163 Ca 0.34 1.62 -0.30 0.00 0.02 0.00 0.00 54.13 55.81 1dth s LEU 163 Cb -0.21 -3.42 -0.10 0.00 0.02 0.00 0.00 46.19 42.49 1dth s LEU 163 CO 0.23 -0.03 1.42 0.00 0.02 0.00 0.00 176.35 177.98 1dth h ILE 165 N 3.56 1.21 -0.34 0.00 2.04 -1.38 -3.18 117.51 119.42 1dth h ILE 165 Ca -0.46 -1.36 -0.12 0.00 1.00 0.00 0.00 64.86 63.92 1dth h ILE 165 Cb 1.22 1.75 -0.07 0.00 -0.74 0.00 0.00 36.82 38.97 1dth h ILE 165 CO 0.77 0.38 0.15 0.23 0.00 0.00 0.00 178.15 179.69 1dth n MET 166 N -3.98 2.04 -2.21 2.37 2.81 -1.26 -4.76 117.12 112.13 1dth n MET 166 Ca -0.02 -1.30 -0.34 0.00 -1.81 0.00 0.00 57.70 54.23 1dth n MET 166 Cb 0.43 -1.65 0.00 0.00 -0.71 0.00 0.00 33.22 31.30 1dth n MET 166 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1dth s ARG 167 N -1.55 3.36 0.00 0.03 0.52 -1.21 -0.61 118.95 119.49 1dth s ARG 167 Ca 0.24 1.48 0.14 0.00 -0.52 0.00 0.00 55.73 57.06 1dth s ARG 167 Cb 0.19 -2.02 0.70 0.00 0.52 0.00 0.00 34.95 34.34 1dth s ARG 167 CO 0.06 -0.82 1.37 -0.35 0.02 0.00 0.00 175.30 175.57 1dth n PRO 168 N -1.49 0.20 -3.68 3.54 -0.04 -1.26 -4.75 135.00 127.52 1dth n PRO 168 Ca 0.11 0.15 -0.14 0.00 -0.04 0.00 0.00 63.50 63.57 1dth n PRO 168 Cb 0.52 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.39 1dth n PRO 168 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1dth s GLY 169 N -2.56 -0.36 -0.27 0.55 0.00 -1.26 -5.15 107.32 98.28 1dth s GLY 169 Ca 0.13 1.06 -0.27 0.00 0.00 0.00 0.00 44.72 45.63 1dth s GLY 169 CO 0.21 0.82 0.98 -2.27 0.00 0.00 0.00 173.10 172.83 1dth s LEU 170 N -0.59 4.05 -0.20 0.66 2.96 -1.26 -5.03 118.68 119.26 1dth s LEU 170 Ca -0.07 1.12 -0.06 0.00 -0.22 0.00 0.00 54.13 54.90 1dth s LEU 170 Cb -0.03 -3.41 -0.03 0.00 0.50 0.00 0.00 46.19 43.22 1dth s LEU 170 CO 0.04 -0.69 0.03 -0.89 -1.32 0.00 0.00 176.35 173.52 1dth s THR 171 N 3.23 4.24 -0.00 3.68 2.01 -1.26 -5.06 115.64 122.47 1dth s THR 171 Ca 0.41 -0.22 -0.30 0.00 0.31 0.00 0.00 61.69 61.90 1dth s THR 171 Cb -0.14 -2.93 -0.07 0.00 0.01 0.00 0.00 72.50 69.37 1dth s THR 171 CO 0.10 0.42 1.82 -1.59 -0.69 0.00 0.00 174.62 174.68 1dth s LYS 172 N 0.95 4.16 0.15 4.92 0.00 -1.26 -4.98 119.74 123.68 1dth s LYS 172 Ca 0.02 2.42 0.01 0.00 0.00 0.00 0.00 55.97 58.43 1dth s LYS 172 Cb -0.14 -4.08 -0.00 0.00 0.00 0.00 0.00 37.83 33.60 1dth s LYS 172 CO 0.02 -0.90 0.17 0.41 0.00 0.00 0.00 175.35 175.05 1dth n GLY 173 N 4.35 3.11 0.06 0.59 0.00 -1.26 -5.09 105.19 106.95 1dth n GLY 173 Ca 0.19 -1.63 0.02 0.00 0.00 0.00 0.00 46.02 44.60 1dth n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dth n ARG 174 N -0.27 3.70 -3.79 1.61 1.74 -1.26 -4.97 116.66 113.41 1dth n ARG 174 Ca 0.02 -0.25 -0.13 0.00 -0.77 0.00 0.00 57.85 56.71 1dth n ARG 174 Cb 0.27 -0.81 -0.14 0.00 -1.02 0.00 0.00 32.46 30.75 1dth n ARG 174 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1dth s SER 175 N -1.03 -0.06 0.04 0.55 0.15 -1.26 -5.16 113.70 106.93 1dth s SER 175 Ca 0.03 0.18 0.03 0.00 0.70 0.00 0.00 55.95 56.88 1dth s SER 175 Cb 0.03 0.12 -0.02 0.00 -1.71 0.00 0.00 66.02 64.44 1dth s SER 175 CO 0.12 -0.09 -0.09 -0.31 1.20 0.00 0.00 173.24 174.07 1dth s TYR 176 N 0.67 0.80 0.10 3.44 1.51 -1.26 -3.00 117.35 119.60 1dth s TYR 176 Ca -0.05 -0.40 -0.04 0.00 -1.01 0.00 0.00 57.07 55.56 1dth s TYR 176 Cb -0.07 -0.47 -0.02 0.00 -0.11 0.00 0.00 41.96 41.28 1dth s TYR 176 CO -0.03 -0.03 0.10 -1.21 -1.11 0.00 0.00 175.55 173.27 1dth s GLU 177 N -1.29 0.83 -0.04 -0.62 2.02 -0.95 -4.90 118.70 113.75 1dth s GLU 177 Ca -0.05 -1.19 -0.17 0.00 0.02 0.00 0.00 54.97 53.58 1dth s GLU 177 Cb -0.08 0.28 -0.05 0.00 0.10 0.00 0.00 34.13 34.37 1dth s GLU 177 CO 0.01 -0.24 0.45 -0.06 0.02 0.00 0.00 175.26 175.44 1dth s PHE 178 N -3.94 3.65 0.89 1.61 0.08 -1.26 -0.87 117.98 118.14 1dth s PHE 178 Ca 0.12 0.98 -0.14 0.00 0.12 0.00 0.00 56.93 58.01 1dth s PHE 178 Cb 0.06 -2.42 0.14 0.00 -0.57 0.00 0.00 43.02 40.23 1dth s PHE 178 CO -0.06 0.44 1.22 -1.54 -0.10 0.00 0.00 175.22 175.18 1dth s SER 179 N -0.38 3.73 0.17 1.36 1.04 -1.26 -4.91 113.70 113.45 1dth s SER 179 Ca 0.25 0.62 -0.14 0.00 0.48 0.00 0.00 55.95 57.17 1dth s SER 179 Cb -0.16 -0.96 0.07 0.00 0.10 0.00 0.00 66.02 65.06 1dth s SER 179 CO 0.13 -2.38 1.82 0.44 0.98 0.00 0.00 173.24 174.23 1dth h ASP 180 N -1.39 0.63 -0.27 7.02 3.32 -1.99 -2.31 116.42 121.43 1dth h ASP 180 Ca -0.46 -0.04 0.05 0.00 0.02 0.00 0.00 57.03 56.60 1dth h ASP 180 Cb 1.30 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.64 1dth h ASP 180 CO 0.54 0.48 0.01 0.44 -1.72 0.00 0.00 179.24 178.99 1dth h ASP 181 N 0.73 -0.10 -0.25 6.45 3.32 -1.99 -0.16 116.42 124.42 1dth h ASP 181 Ca 0.20 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.32 1dth h ASP 181 Cb -0.05 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1dth h ASP 181 CO -0.04 -0.02 0.16 0.28 -1.72 0.00 0.00 179.24 177.91 1dth h SER 182 N 0.09 0.23 0.34 6.45 0.02 -1.84 0.11 113.55 118.95 1dth h SER 182 Ca 0.13 -0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.92 1dth h SER 182 Cb 0.17 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1dth h SER 182 CO -0.21 0.17 -0.63 -0.03 -1.14 0.00 0.00 176.83 174.98 1dth h MET 183 N 0.27 0.28 0.06 3.45 1.85 -0.64 -2.74 114.93 117.46 1dth h MET 183 Ca 0.10 -0.20 -0.24 0.00 -0.61 0.00 0.00 59.70 58.75 1dth h MET 183 Cb 0.05 0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.11 1dth h MET 183 CO -0.02 0.82 -1.07 0.45 -0.40 0.00 0.00 176.91 176.68 1dth h HIS 184 N 0.20 0.31 -0.51 1.39 -0.00 0.69 -2.74 115.15 114.50 1dth h HIS 184 Ca -0.01 -0.21 -0.01 0.00 -0.00 0.00 0.00 60.37 60.14 1dth h HIS 184 Cb 1.15 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 28.52 1dth h HIS 184 CO 0.03 1.12 0.27 1.88 -0.00 0.00 0.00 177.93 181.23 1dth h TYR 185 N 0.07 0.70 -0.08 2.45 0.05 -0.83 -2.20 116.97 117.13 1dth h TYR 185 Ca -0.07 -0.02 -0.14 0.00 0.05 0.00 0.00 58.73 58.54 1dth h TYR 185 Cb 1.79 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 39.29 1dth h TYR 185 CO 0.04 0.52 -0.58 -0.92 -1.05 0.00 0.00 178.16 176.17 1dth h TYR 186 N 0.67 0.34 0.37 4.88 3.20 -1.55 -2.05 116.97 122.83 1dth h TYR 186 Ca 0.18 -0.12 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1dth h TYR 186 Cb 0.06 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.27 1dth h TYR 186 CO -0.02 0.78 -0.19 0.93 -1.64 0.00 0.00 178.16 178.02 1dth h GLU 187 N 0.20 -0.50 -0.97 1.82 4.39 -1.26 -1.72 114.58 116.54 1dth h GLU 187 Ca -0.00 0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.77 1dth h GLU 187 Cb 1.08 0.11 -0.06 0.00 -0.10 0.00 0.00 28.75 29.78 1dth h GLU 187 CO 0.09 -0.34 0.63 -0.09 -1.16 0.00 0.00 179.01 178.15 1dth h ARG 188 N -0.52 1.16 -0.45 2.33 2.43 -1.36 -2.13 114.38 115.85 1dth h ARG 188 Ca -0.05 -0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1dth h ARG 188 Cb 0.41 -0.26 -0.05 0.00 -0.42 0.00 0.00 29.97 29.65 1dth h ARG 188 CO 0.07 0.77 0.17 0.35 -1.51 0.00 0.00 179.97 179.82 1dth h PHE 189 N 1.20 0.30 -0.37 2.20 3.57 -0.89 -0.09 116.94 122.85 1dth h PHE 189 Ca 0.39 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.90 1dth h PHE 189 Cb 0.04 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 1dth h PHE 189 CO -0.00 0.11 0.19 -0.07 -2.23 0.00 0.00 178.31 176.31 1dth h LEU 190 N 0.34 0.48 -0.92 0.59 3.38 -0.69 -1.81 115.31 116.69 1dth h LEU 190 Ca 0.21 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1dth h LEU 190 Cb 0.20 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1dth h LEU 190 CO -0.21 0.46 -0.15 0.11 0.09 0.00 0.00 178.44 178.74 1dth h LYS 191 N 0.47 0.62 0.17 1.13 1.57 -0.91 -2.01 116.57 117.60 1dth h LYS 191 Ca 0.13 -0.21 -0.25 0.00 -1.87 0.00 0.00 60.65 58.45 1dth h LYS 191 Cb 0.10 -0.05 0.02 0.00 0.08 0.00 0.00 32.23 32.38 1dth h LYS 191 CO -0.02 0.75 -1.17 0.37 -0.57 0.00 0.00 179.45 178.82 1dth h GLN 192 N 0.56 0.36 0.00 3.15 4.15 -0.93 -3.40 115.11 119.00 1dth h GLN 192 Ca 0.09 -0.61 -0.15 0.00 0.77 0.00 0.00 58.65 58.75 1dth h GLN 192 Cb 0.59 0.23 -0.03 0.00 0.21 0.00 0.00 27.48 28.48 1dth h GLN 192 CO 0.04 1.29 -2.07 0.66 -1.93 0.00 0.00 178.83 176.82 1dth n TYR 193 N -3.95 0.11 -3.82 3.99 4.02 -0.69 -5.03 117.16 111.79 1dth n TYR 193 Ca -0.18 0.03 -0.32 0.00 -0.01 0.00 0.00 57.90 57.43 1dth n TYR 193 Cb 0.93 -0.75 0.02 0.00 -0.02 0.00 0.00 39.34 39.52 1dth n TYR 193 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1dth n LYS 194 N -2.51 -1.71 -1.67 -0.72 4.01 -0.76 -4.83 118.16 109.98 1dth n LYS 194 Ca -0.15 0.39 -0.42 0.00 -0.51 0.00 0.00 58.31 57.61 1dth n LYS 194 Cb 0.82 -4.03 -0.03 0.00 -0.51 0.00 0.00 35.03 31.28 1dth n LYS 194 CO 0.00 0.00 0.00 -2.14 -1.11 0.00 0.00 177.40 174.15 1dth s PRO 195 N -6.35 4.14 0.07 1.97 0.02 -1.26 -4.90 135.00 128.68 1dth s PRO 195 Ca 0.33 2.61 -0.10 0.00 0.02 0.00 0.00 61.00 63.86 1dth s PRO 195 Cb -0.13 -4.17 -0.25 0.00 0.02 0.00 0.00 34.50 29.97 1dth s PRO 195 CO 0.89 -0.96 1.15 0.37 -0.33 0.00 0.00 177.00 178.11 1dth h GLN 196 N 10.63 0.49 0.00 5.54 4.15 -1.93 -3.33 115.11 130.66 1dth h GLN 196 Ca -0.50 -0.67 0.00 0.00 0.77 0.00 0.00 58.65 58.25 1dth h GLN 196 Cb 1.24 0.23 0.00 0.00 0.21 0.00 0.00 27.48 29.15 1dth h GLN 196 CO 0.94 1.29 0.07 0.00 -1.93 0.00 0.00 178.83 179.20 1dth n ILE 198 N -2.65 2.83 -0.01 0.00 -5.35 -1.25 -4.43 119.36 108.51 1dth n ILE 198 Ca -0.02 -1.54 0.11 0.00 -0.27 0.00 0.00 62.75 61.03 1dth n ILE 198 Cb 0.12 -0.31 -0.17 0.00 -1.74 0.00 0.00 39.64 37.54 1dth n ILE 198 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1dth n LEU 199 N 0.24 0.01 -4.75 7.28 4.32 -1.05 -0.73 117.00 122.31 1dth n LEU 199 Ca 0.33 0.00 -0.38 0.00 -0.02 0.00 0.00 56.01 55.94 1dth n LEU 199 Cb 1.27 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 43.01 1dth n LEU 199 CO 0.36 -0.00 0.17 0.54 -1.22 0.00 0.00 177.39 177.25 1dth s ASN 200 N -4.53 6.76 -0.15 -1.43 4.22 -1.26 -4.82 114.94 113.72 1dth s ASN 200 Ca -0.08 0.90 -0.29 0.00 -2.14 0.00 0.00 52.86 51.25 1dth s ASN 200 Cb 0.14 -2.29 -0.02 0.00 1.28 0.00 0.00 41.25 40.37 1dth s ASN 200 CO 0.91 0.10 1.25 -0.75 -2.04 0.00 0.00 177.10 176.57 1dth s LYS 201 N 0.09 4.25 0.00 3.55 2.20 -1.26 -4.66 119.74 123.90 1dth s LYS 201 Ca 0.26 1.66 0.15 0.00 -0.36 0.00 0.00 55.97 57.68 1dth s LYS 201 Cb -0.16 -3.74 0.91 0.00 -1.51 0.00 0.00 37.83 33.33 1dth s LYS 201 CO 0.12 -0.67 1.32 -2.30 -0.36 0.00 0.00 175.35 173.46