#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pd5 s ILE 5 N 0.00 5.37 -0.05 3.15 1.09 -1.26 -5.05 121.20 124.44 1pd5 s ILE 5 Ca 0.00 -0.34 -0.12 0.00 -1.10 0.00 0.00 60.65 59.09 1pd5 s ILE 5 Cb 0.00 -3.63 -0.05 0.00 -1.06 0.00 0.00 42.46 37.72 1pd5 s ILE 5 CO 0.00 0.13 0.31 0.28 -0.10 0.00 0.00 174.94 175.56 1pd5 s THR 6 N -1.52 5.21 0.52 2.92 -1.32 -1.26 -5.06 115.64 115.13 1pd5 s THR 6 Ca 0.35 0.60 -0.19 0.00 -1.21 0.00 0.00 61.69 61.25 1pd5 s THR 6 Cb -0.13 -3.60 -0.07 0.00 -1.51 0.00 0.00 72.50 67.19 1pd5 s THR 6 CO 0.27 0.58 1.06 -0.83 -2.21 0.00 0.00 174.62 173.49 1pd5 s GLY 7 N -0.95 2.43 -0.06 6.08 0.00 -1.26 -4.94 107.32 108.61 1pd5 s GLY 7 Ca 0.20 0.58 -0.02 0.00 0.00 0.00 0.00 44.72 45.49 1pd5 s GLY 7 CO 0.10 0.91 0.05 -2.52 0.00 0.00 0.00 173.10 171.63 1pd5 s TYR 8 N -2.07 0.21 0.39 1.90 -0.85 -1.26 -0.76 117.35 114.91 1pd5 s TYR 8 Ca 0.67 0.10 -0.21 0.00 -0.52 0.00 0.00 57.07 57.11 1pd5 s TYR 8 Cb -0.17 -0.58 -0.10 0.00 0.38 0.00 0.00 41.96 41.49 1pd5 s TYR 8 CO 0.25 -0.26 0.92 0.95 -1.52 0.00 0.00 175.55 175.89 1pd5 s THR 9 N 2.12 4.40 -0.30 -3.49 -4.23 -1.22 -4.96 115.64 107.96 1pd5 s THR 9 Ca 0.05 1.47 -0.01 0.00 -1.18 0.00 0.00 61.69 62.02 1pd5 s THR 9 Cb -0.13 -3.67 0.05 0.00 1.34 0.00 0.00 72.50 70.10 1pd5 s THR 9 CO -0.04 -0.22 -0.01 -0.89 -0.54 0.00 0.00 174.62 172.92 1pd5 s THR 10 N -2.05 2.86 -0.30 3.99 2.01 -1.26 -2.28 115.64 118.61 1pd5 s THR 10 Ca 0.59 -1.47 -0.41 0.00 0.31 0.00 0.00 61.69 60.71 1pd5 s THR 10 Cb -0.11 -2.67 -0.16 0.00 0.01 0.00 0.00 72.50 69.57 1pd5 s THR 10 CO 0.15 -0.12 1.73 0.52 -0.69 0.00 0.00 174.62 176.21 1pd5 n VAL 11 N 4.58 0.28 -2.25 3.82 0.31 -1.11 -4.97 118.33 119.00 1pd5 n VAL 11 Ca -0.13 -0.05 -0.36 0.00 -0.01 0.00 0.00 64.34 63.79 1pd5 n VAL 11 Cb 0.43 -1.16 -0.04 0.00 -0.91 0.00 0.00 33.84 32.16 1pd5 n VAL 11 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1pd5 s ASP 12 N 3.49 5.65 0.64 4.52 1.11 -1.26 -4.83 116.67 125.98 1pd5 s ASP 12 Ca 0.99 -0.41 0.34 0.00 0.18 0.00 0.00 52.55 53.65 1pd5 s ASP 12 Cb -1.11 -2.55 1.86 0.00 1.07 0.00 0.00 42.92 42.19 1pd5 s ASP 12 CO 0.67 -2.20 2.11 0.40 1.18 0.00 0.00 175.17 177.33 1pd5 h ILE 13 N 6.77 0.19 0.02 0.77 2.04 -1.95 -3.09 117.51 122.26 1pd5 h ILE 13 Ca -0.09 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.59 1pd5 h ILE 13 Cb 1.07 0.82 0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1pd5 h ILE 13 CO 1.27 0.00 -0.68 0.28 0.00 0.00 0.00 178.15 179.02 1pd5 h SER 14 N 0.00 0.56 1.65 1.72 0.02 -1.99 -3.24 113.55 112.27 1pd5 h SER 14 Ca 0.04 -0.78 0.00 0.00 -0.84 0.00 0.00 61.79 60.21 1pd5 h SER 14 Cb 0.43 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1pd5 h SER 14 CO -0.00 1.28 0.00 1.56 -1.14 0.00 0.00 176.83 178.53 1pd5 h GLN 15 N -0.09 0.00 -6.60 3.45 1.08 -1.99 -3.46 115.11 107.50 1pd5 h GLN 15 Ca -0.09 0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 56.52 1pd5 h GLN 15 Cb 1.40 0.00 0.09 0.00 -0.05 0.00 0.00 27.48 28.92 1pd5 h GLN 15 CO 0.13 0.00 0.49 1.87 -0.95 0.00 0.00 178.83 180.38 1pd5 n TRP 16 N -3.09 2.02 0.15 2.96 -0.00 -1.17 -4.96 117.44 113.35 1pd5 n TRP 16 Ca 0.03 0.52 0.04 0.00 -0.00 0.00 0.00 57.50 58.09 1pd5 n TRP 16 Cb 0.45 -2.41 0.09 0.00 -0.00 0.00 0.00 31.31 29.44 1pd5 n TRP 16 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1pd5 h HIS 17 N 3.36 0.00 -0.21 5.87 3.86 -1.89 -3.08 115.15 123.05 1pd5 h HIS 17 Ca -0.44 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.77 1pd5 h HIS 17 Cb 1.29 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.76 1pd5 h HIS 17 CO 0.53 0.45 0.00 0.54 0.86 0.00 0.00 177.93 180.31 1pd5 n ARG 18 N -3.26 2.34 0.08 2.45 1.74 -1.26 -4.50 116.66 114.25 1pd5 n ARG 18 Ca 0.02 -1.12 -0.12 0.00 -0.77 0.00 0.00 57.85 55.86 1pd5 n ARG 18 Cb 0.69 -1.73 -0.05 0.00 -1.02 0.00 0.00 32.46 30.35 1pd5 n ARG 18 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1pd5 h LYS 19 N 1.45 -0.45 -0.18 5.56 1.63 -1.76 0.53 116.57 123.35 1pd5 h LYS 19 Ca 0.00 0.03 -0.07 0.00 -0.85 0.00 0.00 60.65 59.76 1pd5 h LYS 19 Cb 0.97 0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 32.70 1pd5 h LYS 19 CO 0.16 -0.30 -0.15 0.93 -3.45 0.00 0.00 179.45 176.64 1pd5 h GLU 20 N -0.47 0.42 0.02 1.90 5.08 -1.88 -0.22 114.58 119.42 1pd5 h GLU 20 Ca 0.05 -0.21 0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1pd5 h GLU 20 Cb 0.54 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.73 1pd5 h GLU 20 CO -0.23 0.76 -0.50 0.45 -1.00 0.00 0.00 179.01 178.50 1pd5 h HIS 21 N 0.08 -1.45 -0.49 4.33 3.86 -1.85 0.91 115.15 120.53 1pd5 h HIS 21 Ca 0.03 0.05 0.10 0.00 -1.16 0.00 0.00 60.37 59.39 1pd5 h HIS 21 Cb 0.67 0.63 -0.09 0.00 1.06 0.00 0.00 27.41 29.69 1pd5 h HIS 21 CO 0.08 -0.56 -0.05 0.35 0.86 0.00 0.00 177.93 178.61 1pd5 h PHE 22 N -0.66 -0.12 -0.41 2.45 3.04 0.14 -1.99 116.94 119.39 1pd5 h PHE 22 Ca 0.02 0.04 0.06 0.00 3.98 0.00 0.00 57.97 62.07 1pd5 h PHE 22 Cb 0.71 0.13 -0.05 0.00 2.56 0.00 0.00 35.95 39.30 1pd5 h PHE 22 CO -0.48 -0.16 0.12 1.49 -2.02 0.00 0.00 178.31 177.26 1pd5 h GLU 23 N 0.07 0.25 0.96 1.11 4.57 -0.22 -1.67 114.58 119.65 1pd5 h GLU 23 Ca 0.25 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.36 1pd5 h GLU 23 Cb 0.38 -0.06 0.01 0.00 -0.16 0.00 0.00 28.75 28.92 1pd5 h GLU 23 CO -0.45 0.17 -0.47 0.00 -1.18 0.00 0.00 179.01 177.07 1pd5 h ALA 24 N 1.29 -1.31 0.00 2.92 0.00 -0.57 -3.19 119.26 118.39 1pd5 h ALA 24 Ca 0.19 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1pd5 h ALA 24 Cb 0.21 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1pd5 h ALA 24 CO -0.22 -1.24 0.00 1.19 0.00 0.00 0.00 179.25 178.98 1pd5 n PHE 25 N -5.65 0.00 0.21 0.00 3.01 -0.77 -0.80 117.46 113.46 1pd5 n PHE 25 Ca -0.16 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.40 1pd5 n PHE 25 Cb 0.52 -0.42 0.26 0.00 -0.01 0.00 0.00 39.48 39.83 1pd5 n PHE 25 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1pd5 h GLN 26 N 0.00 0.00 0.00 -1.08 1.08 -1.29 -3.36 115.11 110.46 1pd5 h GLN 26 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1pd5 h GLN 26 Cb 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1pd5 h GLN 26 CO 0.00 0.14 0.00 -1.13 -0.95 0.00 0.00 178.83 176.89 1pd5 n SER 27 N -3.16 0.00 0.18 1.46 3.41 0.02 -4.88 113.62 110.64 1pd5 n SER 27 Ca 0.02 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.55 1pd5 n SER 27 Cb 0.53 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.44 1pd5 n SER 27 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 1pd5 h VAL 28 N 0.00 0.00 0.00 -3.33 -1.51 -1.74 -3.03 116.25 106.64 1pd5 h VAL 28 Ca 0.00 -0.55 0.00 0.00 -1.23 0.00 0.00 66.70 64.92 1pd5 h VAL 28 Cb 0.00 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.16 1pd5 h VAL 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.34 1pd5 n ALA 29 N -2.69 1.66 -1.74 5.19 0.00 -1.24 -4.94 120.51 116.76 1pd5 n ALA 29 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.95 1pd5 n ALA 29 Cb 0.21 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 1pd5 n ALA 29 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1pd5 s GLN 30 N -0.22 4.14 0.11 0.00 0.74 -1.15 -4.69 119.66 118.60 1pd5 s GLN 30 Ca 0.00 2.57 -0.11 0.00 0.05 0.00 0.00 55.36 57.87 1pd5 s GLN 30 Cb 0.00 -3.55 0.01 0.00 1.10 0.00 0.00 33.01 30.57 1pd5 s GLN 30 CO 0.00 -0.82 0.26 0.00 -0.55 0.00 0.00 175.29 174.17 1pd5 s THR 32 N -3.86 2.82 -0.01 0.00 2.01 -1.26 -0.54 115.64 114.81 1pd5 s THR 32 Ca 0.06 -1.83 -0.15 0.00 0.31 0.00 0.00 61.69 60.08 1pd5 s THR 32 Cb 0.04 -2.38 0.02 0.00 0.01 0.00 0.00 72.50 70.19 1pd5 s THR 32 CO -0.10 -0.12 0.31 -0.72 -0.69 0.00 0.00 174.62 173.29 1pd5 s TYR 33 N -1.71 -0.16 0.03 4.92 -0.85 -0.37 -4.88 117.35 114.32 1pd5 s TYR 33 Ca 0.23 0.22 0.08 0.00 -0.52 0.00 0.00 57.07 57.08 1pd5 s TYR 33 Cb -0.08 0.09 -0.02 0.00 0.38 0.00 0.00 41.96 42.33 1pd5 s TYR 33 CO 0.13 -0.40 -0.23 -0.80 -1.52 0.00 0.00 175.55 172.73 1pd5 s ASN 34 N -1.43 2.72 -0.02 -0.18 0.02 -1.26 -1.33 114.94 113.45 1pd5 s ASN 34 Ca -0.12 -0.51 -0.15 0.00 -1.02 0.00 0.00 52.86 51.06 1pd5 s ASN 34 Cb -0.05 -0.26 0.03 0.00 0.02 0.00 0.00 41.25 40.99 1pd5 s ASN 34 CO 0.03 0.22 0.33 0.00 0.02 0.00 0.00 177.10 177.70 1pd5 s GLN 35 N -0.99 0.66 0.23 -0.60 -2.07 -0.28 -4.97 119.66 111.63 1pd5 s GLN 35 Ca 0.09 -0.13 0.10 0.00 -1.82 0.00 0.00 55.36 53.61 1pd5 s GLN 35 Cb -0.09 0.30 -0.04 0.00 -1.09 0.00 0.00 33.01 32.08 1pd5 s GLN 35 CO 0.01 -0.18 -0.12 0.99 -1.32 0.00 0.00 175.29 174.67 1pd5 s THR 36 N -1.21 2.94 -0.13 3.63 2.01 -1.26 -1.37 115.64 120.24 1pd5 s THR 36 Ca -0.12 -1.99 -0.09 0.00 0.31 0.00 0.00 61.69 59.79 1pd5 s THR 36 Cb -0.05 -2.50 0.04 0.00 0.01 0.00 0.00 72.50 70.00 1pd5 s THR 36 CO 0.04 -0.26 0.34 0.54 -0.69 0.00 0.00 174.62 174.59 1pd5 s VAL 37 N -2.09 -0.02 -1.30 3.82 0.11 -0.58 -5.01 120.40 115.33 1pd5 s VAL 37 Ca 0.27 0.06 -0.18 0.00 -2.93 0.00 0.00 61.98 59.20 1pd5 s VAL 37 Cb -0.07 -0.49 0.06 0.00 -1.53 0.00 0.00 36.38 34.35 1pd5 s VAL 37 CO 0.16 0.03 1.79 0.00 -3.33 0.00 0.00 175.10 173.74 1pd5 n GLN 38 N 3.60 3.07 -1.68 1.54 1.13 -1.26 -0.74 117.38 123.04 1pd5 n GLN 38 Ca -0.19 -3.18 -0.43 0.00 -1.94 0.00 0.00 57.00 51.26 1pd5 n GLN 38 Cb 0.56 -3.50 -0.03 0.00 0.11 0.00 0.00 30.24 27.38 1pd5 n GLN 38 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1pd5 n LEU 39 N 8.59 3.96 -4.63 1.08 0.00 0.08 -4.62 117.00 121.47 1pd5 n LEU 39 Ca 0.49 0.97 -0.43 0.00 0.00 0.00 0.00 56.01 57.04 1pd5 n LEU 39 Cb 0.46 -1.52 -0.02 0.00 0.00 0.00 0.00 43.42 42.34 1pd5 n LEU 39 CO 0.77 0.14 1.08 -0.62 0.00 0.00 0.00 177.39 178.76 1pd5 s ASP 40 N 3.14 6.77 0.00 1.96 3.68 -1.26 0.07 116.67 131.03 1pd5 s ASP 40 Ca 0.84 1.19 0.00 0.00 2.13 0.00 0.00 52.55 56.71 1pd5 s ASP 40 Cb -0.50 -2.54 0.00 0.00 -1.45 0.00 0.00 42.92 38.43 1pd5 s ASP 40 CO 0.40 -1.00 0.64 2.30 0.13 0.00 0.00 175.17 177.64 1pd5 n ILE 41 N 6.05 0.32 -0.32 4.11 -5.35 0.78 -4.78 119.36 120.16 1pd5 n ILE 41 Ca 0.14 -0.63 -0.01 0.00 -0.27 0.00 0.00 62.75 61.98 1pd5 n ILE 41 Cb 0.47 0.88 0.05 0.00 -1.74 0.00 0.00 39.64 39.29 1pd5 n ILE 41 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1pd5 h THR 42 N 0.09 0.06 0.01 7.28 2.02 -1.82 1.12 112.91 121.69 1pd5 h THR 42 Ca 0.00 0.00 -0.21 0.00 0.77 0.00 0.00 66.41 66.97 1pd5 h THR 42 Cb 0.20 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 1pd5 h THR 42 CO 0.00 0.00 -0.94 0.00 0.37 0.00 0.00 175.52 174.95 1pd5 h ALA 43 N 1.40 0.42 0.62 6.16 0.00 -1.86 -2.92 119.26 123.08 1pd5 h ALA 43 Ca 0.34 -0.74 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1pd5 h ALA 43 Cb 0.60 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1pd5 h ALA 43 CO -0.90 0.90 -0.47 0.35 0.00 0.00 0.00 179.25 179.13 1pd5 h PHE 44 N 0.14 -1.28 -0.50 0.00 3.57 -0.96 -2.94 116.94 114.97 1pd5 h PHE 44 Ca -0.06 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.50 1pd5 h PHE 44 Cb 1.58 0.48 -0.03 0.00 2.79 0.00 0.00 35.95 40.77 1pd5 h PHE 44 CO 0.04 -0.67 0.34 1.25 -2.23 0.00 0.00 178.31 177.04 1pd5 h LEU 45 N -1.05 0.37 -0.51 0.59 6.46 0.11 -0.65 115.31 120.63 1pd5 h LEU 45 Ca -0.08 0.00 -0.11 0.00 -0.12 0.00 0.00 57.88 57.57 1pd5 h LEU 45 Cb 0.87 -0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 40.71 1pd5 h LEU 45 CO 0.03 0.24 -0.12 0.11 -0.62 0.00 0.00 178.44 178.07 1pd5 h LYS 46 N 0.42 0.98 0.00 1.25 1.79 -1.54 -2.56 116.57 116.91 1pd5 h LYS 46 Ca 0.22 -0.38 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 1pd5 h LYS 46 Cb 0.33 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 1pd5 h LYS 46 CO -0.06 1.05 0.00 2.41 -1.08 0.00 0.00 179.45 181.77 1pd5 n THR 47 N -4.18 0.00 0.00 -0.16 -1.04 -0.87 -2.32 114.28 105.71 1pd5 n THR 47 Ca 0.01 0.73 0.00 0.00 -2.04 0.00 0.00 64.05 62.75 1pd5 n THR 47 Cb 0.40 -1.49 0.00 0.00 -1.82 0.00 0.00 70.33 67.42 1pd5 n THR 47 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1pd5 n VAL 48 N -0.45 0.00 0.02 12.58 0.31 -0.31 0.27 118.33 130.76 1pd5 n VAL 48 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.37 1pd5 n VAL 48 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 1pd5 n VAL 48 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1pd5 n LYS 49 N -1.96 0.63 -0.04 5.55 5.02 -0.97 0.24 118.16 126.63 1pd5 n LYS 49 Ca 0.00 0.08 -0.06 0.00 -2.02 0.00 0.00 58.31 56.32 1pd5 n LYS 49 Cb 0.00 -1.72 -0.14 0.00 -0.02 0.00 0.00 35.03 33.15 1pd5 n LYS 49 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1pd5 n LYS 50 N -2.69 0.65 -1.26 1.97 4.81 0.14 -4.42 118.16 117.37 1pd5 n LYS 50 Ca -0.09 0.12 -0.29 0.00 -0.87 0.00 0.00 58.31 57.18 1pd5 n LYS 50 Cb 0.75 -1.67 0.20 0.00 0.02 0.00 0.00 35.03 34.33 1pd5 n LYS 50 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1pd5 s ASN 51 N -5.65 2.14 -0.68 3.14 0.01 -1.20 -4.99 114.94 107.71 1pd5 s ASN 51 Ca -0.07 0.85 0.05 0.00 -0.71 0.00 0.00 52.86 52.99 1pd5 s ASN 51 Cb 0.08 -1.29 0.20 0.00 0.41 0.00 0.00 41.25 40.64 1pd5 s ASN 51 CO 0.83 -3.39 0.57 0.29 -1.51 0.00 0.00 177.10 173.89 1pd5 n LYS 52 N -4.30 2.01 -4.14 -0.60 4.01 -1.26 -4.83 118.16 109.05 1pd5 n LYS 52 Ca 0.09 -4.51 -0.34 0.00 -0.51 0.00 0.00 58.31 53.04 1pd5 n LYS 52 Cb 0.59 -2.25 -0.08 0.00 -0.51 0.00 0.00 35.03 32.78 1pd5 n LYS 52 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 1pd5 s HIS 53 N -1.76 3.29 -0.04 2.13 3.76 0.14 -5.03 115.29 117.78 1pd5 s HIS 53 Ca 0.30 0.25 -0.30 0.00 -0.15 0.00 0.00 55.06 55.16 1pd5 s HIS 53 Cb 0.02 -1.78 -0.05 0.00 1.11 0.00 0.00 32.58 31.89 1pd5 s HIS 53 CO -0.12 0.55 1.42 0.15 -0.85 0.00 0.00 174.74 175.89 1pd5 s LYS 54 N -1.42 4.26 0.09 1.40 3.01 -1.26 -4.63 119.74 121.19 1pd5 s LYS 54 Ca 0.19 1.94 -0.24 0.00 -1.01 0.00 0.00 55.97 56.85 1pd5 s LYS 54 Cb -0.12 -3.69 -0.08 0.00 -1.01 0.00 0.00 37.83 32.93 1pd5 s LYS 54 CO 0.10 -0.65 1.39 0.35 0.51 0.00 0.00 175.35 177.05 1pd5 h PHE 55 N 8.22 -1.23 -0.57 3.18 3.57 -1.99 -3.14 116.94 124.99 1pd5 h PHE 55 Ca -0.36 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.25 1pd5 h PHE 55 Cb 1.16 0.57 -0.07 0.00 2.79 0.00 0.00 35.95 40.41 1pd5 h PHE 55 CO 0.79 -0.36 -0.34 0.98 -2.23 0.00 0.00 178.31 177.15 1pd5 n TYR 56 N -4.62 -0.25 0.17 0.41 9.36 -1.26 -0.29 117.16 120.68 1pd5 n TYR 56 Ca -0.03 0.72 0.02 0.00 3.32 0.00 0.00 57.90 61.92 1pd5 n TYR 56 Cb 0.25 -0.52 0.30 0.00 -0.63 0.00 0.00 39.34 38.74 1pd5 n TYR 56 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1pd5 h PRO 57 N 0.00 0.00 -0.44 2.98 0.13 -2.00 0.93 132.00 133.60 1pd5 h PRO 57 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1pd5 h PRO 57 Cb 0.23 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.34 1pd5 h PRO 57 CO -0.54 0.44 0.28 0.00 -0.23 0.00 0.00 178.00 177.96 1pd5 h ALA 58 N 1.56 0.57 -0.06 -0.56 0.00 -0.84 -1.38 119.26 118.54 1pd5 h ALA 58 Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1pd5 h ALA 58 Cb 0.80 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1pd5 h ALA 58 CO 0.06 0.04 0.02 0.35 0.00 0.00 0.00 179.25 179.71 1pd5 h PHE 59 N 0.60 0.09 -0.48 0.00 3.57 -0.30 -2.65 116.94 117.77 1pd5 h PHE 59 Ca 0.16 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.75 1pd5 h PHE 59 Cb -0.03 -0.03 -0.09 0.00 2.79 0.00 0.00 35.95 38.59 1pd5 h PHE 59 CO -0.04 0.26 -0.11 0.82 -2.23 0.00 0.00 178.31 177.02 1pd5 h ILE 60 N -0.10 0.53 -0.74 1.41 2.04 -0.69 -0.85 117.51 119.11 1pd5 h ILE 60 Ca 0.02 -0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.93 1pd5 h ILE 60 Cb 0.21 0.51 -0.06 0.00 -0.74 0.00 0.00 36.82 36.75 1pd5 h ILE 60 CO -0.00 0.00 0.44 -0.74 0.00 0.00 0.00 178.15 177.86 1pd5 h HIS 61 N 0.01 0.82 -0.02 1.37 2.76 -1.17 0.50 115.15 119.42 1pd5 h HIS 61 Ca 0.23 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.45 1pd5 h HIS 61 Cb 0.36 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.03 1pd5 h HIS 61 CO -0.40 0.42 -0.10 0.82 -1.30 0.00 0.00 177.93 177.36 1pd5 h ILE 62 N 0.82 0.73 -0.36 6.26 1.08 -0.85 -0.71 117.51 124.48 1pd5 h ILE 62 Ca 0.32 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.84 1pd5 h ILE 62 Cb 0.15 0.73 -0.04 0.00 -3.07 0.00 0.00 36.82 34.59 1pd5 h ILE 62 CO -0.17 0.00 0.11 -0.07 -0.69 0.00 0.00 178.15 177.34 1pd5 h LEU 63 N -0.17 0.11 -2.20 1.44 3.38 0.45 -0.43 115.31 117.90 1pd5 h LEU 63 Ca 0.05 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1pd5 h LEU 63 Cb 0.23 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1pd5 h LEU 63 CO -0.12 0.10 0.00 0.00 0.09 0.00 0.00 178.44 178.51 1pd5 h ALA 64 N 1.24 1.00 0.02 1.53 0.00 0.28 0.28 119.26 123.61 1pd5 h ALA 64 Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1pd5 h ALA 64 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1pd5 h ALA 64 CO -0.18 0.00 -0.01 0.00 0.00 0.00 0.00 179.25 179.06 1pd5 h ARG 65 N 0.00 -0.03 -0.62 0.00 3.08 0.41 -2.56 114.38 114.66 1pd5 h ARG 65 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.17 1pd5 h ARG 65 Cb 0.10 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.07 1pd5 h ARG 65 CO 0.00 0.70 0.16 -0.07 -1.07 0.00 0.00 179.97 179.69 1pd5 h LEU 66 N -0.94 0.06 -1.48 3.04 3.38 -0.09 0.04 115.31 119.32 1pd5 h LEU 66 Ca -0.00 0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1pd5 h LEU 66 Cb 0.73 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1pd5 h LEU 66 CO 0.00 0.03 -0.21 0.24 0.09 0.00 0.00 178.44 178.60 1pd5 h MET 67 N 0.30 0.07 -0.70 1.13 2.86 -0.53 -2.71 114.93 115.35 1pd5 h MET 67 Ca 0.33 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.95 1pd5 h MET 67 Cb 0.48 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1pd5 h MET 67 CO -0.39 0.28 0.00 0.09 1.06 0.00 0.00 176.91 177.95 1pd5 n ASN 68 N -4.26 4.37 -0.03 1.22 3.02 -0.37 -3.82 115.26 115.38 1pd5 n ASN 68 Ca -0.02 -2.23 -0.00 0.00 -0.03 0.00 0.00 54.58 52.30 1pd5 n ASN 68 Cb 0.29 -0.54 -0.13 0.00 -0.61 0.00 0.00 39.78 38.78 1pd5 n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pd5 n ALA 69 N 1.39 2.03 -3.65 5.41 0.00 -0.14 -4.97 120.51 120.58 1pd5 n ALA 69 Ca 0.25 -0.82 -0.20 0.00 0.00 0.00 0.00 53.44 52.67 1pd5 n ALA 69 Cb 0.76 -0.62 -0.16 0.00 0.00 0.00 0.00 19.45 19.42 1pd5 n ALA 69 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1pd5 s HIS 70 N -2.94 0.74 0.29 0.00 3.76 -1.22 -5.04 115.29 110.87 1pd5 s HIS 70 Ca -0.07 -0.21 0.09 0.00 -0.15 0.00 0.00 55.06 54.73 1pd5 s HIS 70 Cb 0.09 -0.68 0.43 0.00 1.11 0.00 0.00 32.58 33.53 1pd5 s HIS 70 CO 0.85 -0.21 1.66 -1.00 -0.85 0.00 0.00 174.74 175.19 1pd5 h PRO 71 N 7.33 0.09 -1.28 8.40 0.13 -1.93 -2.89 132.00 141.84 1pd5 h PRO 71 Ca -0.36 -0.05 0.40 0.00 -0.87 0.00 0.00 66.00 65.12 1pd5 h PRO 71 Cb 1.15 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.17 1pd5 h PRO 71 CO 0.45 0.59 0.84 1.05 -0.23 0.00 0.00 178.00 180.70 1pd5 h GLU 72 N 0.07 0.14 0.00 0.86 4.11 -1.95 0.55 114.58 118.36 1pd5 h GLU 72 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1pd5 h GLU 72 Cb 0.95 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1pd5 h GLU 72 CO 0.07 0.10 0.00 1.19 0.07 0.00 0.00 179.01 180.44 1pd5 n PHE 73 N -4.60 0.00 -1.78 2.06 0.99 -1.09 -3.98 117.46 109.06 1pd5 n PHE 73 Ca 0.34 0.00 0.05 0.00 -0.00 0.00 0.00 57.45 57.84 1pd5 n PHE 73 Cb 1.32 -0.05 0.09 0.00 -1.00 0.00 0.00 39.48 39.84 1pd5 n PHE 73 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1pd5 n ARG 74 N -1.05 0.74 -2.73 -1.08 1.74 0.19 -4.62 116.66 109.85 1pd5 n ARG 74 Ca 0.19 -2.24 -0.29 0.00 -0.77 0.00 0.00 57.85 54.73 1pd5 n ARG 74 Cb 0.11 -0.93 -0.02 0.00 -1.02 0.00 0.00 32.46 30.60 1pd5 n ARG 74 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1pd5 s MET 75 N -1.58 3.70 0.08 5.56 -1.94 -1.21 -2.29 119.30 121.61 1pd5 s MET 75 Ca 0.26 0.41 -0.26 0.00 -1.71 0.00 0.00 55.69 54.38 1pd5 s MET 75 Cb 0.26 -2.37 0.08 0.00 2.01 0.00 0.00 34.83 34.82 1pd5 s MET 75 CO -0.05 -0.12 0.85 0.00 -0.01 0.00 0.00 175.02 175.68 1pd5 s ALA 76 N -2.53 -1.71 -0.45 3.03 0.00 -0.16 -4.50 121.76 115.44 1pd5 s ALA 76 Ca 0.50 0.64 -0.16 0.00 0.00 0.00 0.00 51.96 52.94 1pd5 s ALA 76 Cb -0.10 0.58 0.05 0.00 0.00 0.00 0.00 23.12 23.64 1pd5 s ALA 76 CO 0.37 -0.81 0.40 1.41 0.00 0.00 0.00 175.76 177.13 1pd5 s MET 77 N -3.31 3.01 -0.24 0.00 1.75 -1.26 -1.27 119.30 117.96 1pd5 s MET 77 Ca 0.06 -1.14 -0.04 0.00 -1.25 0.00 0.00 55.69 53.32 1pd5 s MET 77 Cb -0.01 -4.07 -0.00 0.00 2.84 0.00 0.00 34.83 33.59 1pd5 s MET 77 CO -0.06 -0.96 -0.01 0.21 -0.65 0.00 0.00 175.02 173.55 1pd5 s LYS 78 N 1.83 3.25 0.00 4.11 2.20 -0.60 -4.66 119.74 125.86 1pd5 s LYS 78 Ca 0.07 -0.72 0.00 0.00 -0.36 0.00 0.00 55.97 54.95 1pd5 s LYS 78 Cb -0.21 -3.11 0.00 0.00 -1.51 0.00 0.00 37.83 33.00 1pd5 s LYS 78 CO 0.09 -0.28 0.00 -0.25 -0.36 0.00 0.00 175.35 174.55 1pd5 n ASP 79 N 4.80 -0.97 0.00 1.43 10.43 -1.26 -1.79 116.55 129.19 1pd5 n ASP 79 Ca -0.17 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.19 1pd5 n ASP 79 Cb 0.50 -1.94 0.00 0.00 1.84 0.00 0.00 41.12 41.51 1pd5 n ASP 79 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1pd5 n GLY 80 N -1.65 0.87 3.43 0.44 0.00 -1.26 -5.13 105.19 101.89 1pd5 n GLY 80 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1pd5 n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pd5 s GLU 81 N -0.51 1.54 -0.57 1.61 0.41 -0.74 -5.10 118.70 115.34 1pd5 s GLU 81 Ca 0.00 -1.53 -0.28 0.00 -0.41 0.00 0.00 54.97 52.75 1pd5 s GLU 81 Cb 0.00 -1.85 0.01 0.00 -1.78 0.00 0.00 34.13 30.51 1pd5 s GLU 81 CO 0.00 0.40 1.50 -1.17 -0.49 0.00 0.00 175.26 175.50 1pd5 s LEU 82 N -2.71 3.37 -0.09 1.80 2.96 -1.26 -1.56 118.68 121.20 1pd5 s LEU 82 Ca 0.21 0.29 0.01 0.00 -0.22 0.00 0.00 54.13 54.42 1pd5 s LEU 82 Cb -0.08 -2.96 -0.03 0.00 0.50 0.00 0.00 46.19 43.63 1pd5 s LEU 82 CO 0.10 -1.83 -0.09 0.54 -1.32 0.00 0.00 176.35 173.75 1pd5 s VAL 83 N 6.56 3.46 -0.67 1.68 0.11 -0.40 -2.74 120.40 128.40 1pd5 s VAL 83 Ca 0.55 -0.55 -0.20 0.00 -2.93 0.00 0.00 61.98 58.85 1pd5 s VAL 83 Cb -0.12 -2.43 0.10 0.00 -1.53 0.00 0.00 36.38 32.41 1pd5 s VAL 83 CO 0.24 0.57 0.86 -0.63 -3.33 0.00 0.00 175.10 172.81 1pd5 s ILE 84 N -0.41 4.65 0.33 7.04 1.01 -0.97 -0.99 121.20 131.87 1pd5 s ILE 84 Ca 0.06 -0.89 -0.27 0.00 0.00 0.00 0.00 60.65 59.55 1pd5 s ILE 84 Cb -0.12 -4.60 -0.13 0.00 0.01 0.00 0.00 42.46 37.62 1pd5 s ILE 84 CO 0.02 -1.30 1.06 0.79 0.00 0.00 0.00 174.94 175.51 1pd5 n TRP 85 N 6.80 1.45 0.21 3.97 7.02 -0.97 -3.40 117.44 132.51 1pd5 n TRP 85 Ca -0.02 0.63 0.04 0.00 -1.02 0.00 0.00 57.50 57.14 1pd5 n TRP 85 Cb 0.45 -2.28 0.44 0.00 -2.42 0.00 0.00 31.31 27.50 1pd5 n TRP 85 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1pd5 h ASP 86 N 1.99 0.00 -3.70 -0.99 3.45 -1.30 -3.44 116.42 112.43 1pd5 h ASP 86 Ca -0.42 0.00 -0.21 0.00 0.43 0.00 0.00 57.03 56.83 1pd5 h ASP 86 Cb 1.33 0.00 -0.28 0.00 -0.56 0.00 0.00 39.33 39.82 1pd5 h ASP 86 CO 0.60 0.27 -0.60 -0.44 -1.57 0.00 0.00 179.24 177.50 1pd5 s SER 87 N -6.97 -0.11 0.03 6.45 0.01 -1.26 -5.03 113.70 106.83 1pd5 s SER 87 Ca -0.03 0.23 0.07 0.00 1.31 0.00 0.00 55.95 57.53 1pd5 s SER 87 Cb 0.15 0.21 -0.03 0.00 0.21 0.00 0.00 66.02 66.56 1pd5 s SER 87 CO 0.71 -0.06 -0.20 0.68 0.41 0.00 0.00 173.24 174.78 1pd5 s VAL 88 N 0.31 2.64 0.05 3.43 -7.23 -1.26 -4.88 120.40 113.46 1pd5 s VAL 88 Ca -0.02 -1.20 0.07 0.00 -1.81 0.00 0.00 61.98 59.02 1pd5 s VAL 88 Cb -0.03 -2.08 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 1pd5 s VAL 88 CO -0.01 0.37 -0.17 -1.00 -0.31 0.00 0.00 175.10 173.98 1pd5 s HIS 89 N -0.87 2.57 0.35 2.82 3.76 0.49 -4.73 115.29 119.68 1pd5 s HIS 89 Ca 0.14 -0.24 -0.25 0.00 -0.15 0.00 0.00 55.06 54.55 1pd5 s HIS 89 Cb -0.10 -1.45 -0.10 0.00 1.11 0.00 0.00 32.58 32.04 1pd5 s HIS 89 CO 0.04 0.28 0.97 -1.25 -0.85 0.00 0.00 174.74 173.94 1pd5 s PRO 90 N -1.56 4.45 -0.25 8.40 0.04 -1.22 -2.55 135.00 142.32 1pd5 s PRO 90 Ca 0.15 1.37 -0.02 0.00 0.04 0.00 0.00 61.00 62.54 1pd5 s PRO 90 Cb -0.11 -2.69 0.08 0.00 0.04 0.00 0.00 34.50 31.83 1pd5 s PRO 90 CO 0.06 0.15 0.08 0.00 0.04 0.00 0.00 177.00 177.33 1pd5 s TYR 92 N 1.84 2.31 -0.06 0.00 -0.85 -0.05 -1.66 117.35 118.87 1pd5 s TYR 92 Ca 0.05 -0.62 -0.05 0.00 -0.52 0.00 0.00 57.07 55.94 1pd5 s TYR 92 Cb -0.17 -1.42 -0.04 0.00 0.38 0.00 0.00 41.96 40.71 1pd5 s TYR 92 CO -0.20 0.44 0.15 0.95 -1.52 0.00 0.00 175.55 175.37 1pd5 s THR 93 N -2.77 5.39 -0.08 -3.49 -4.23 -1.00 -1.35 115.64 108.12 1pd5 s THR 93 Ca 0.33 -0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.85 1pd5 s THR 93 Cb 0.05 -3.43 -0.02 0.00 1.34 0.00 0.00 72.50 70.44 1pd5 s THR 93 CO 0.16 0.47 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.90 1pd5 s VAL 94 N -1.17 3.22 -0.14 2.29 1.01 -0.23 -4.72 120.40 120.66 1pd5 s VAL 94 Ca 0.21 -0.65 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 1pd5 s VAL 94 Cb -0.12 -2.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1pd5 s VAL 94 CO 0.11 0.57 0.11 0.12 0.00 0.00 0.00 175.10 176.02 1pd5 s PHE 95 N -0.46 3.47 -0.37 5.22 5.36 -1.26 0.69 117.98 130.63 1pd5 s PHE 95 Ca 0.06 0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.44 1pd5 s PHE 95 Cb -0.12 -1.99 0.10 0.00 -0.34 0.00 0.00 43.02 40.68 1pd5 s PHE 95 CO 0.02 0.55 0.12 -1.01 -1.46 0.00 0.00 175.22 173.44 1pd5 s HIS 96 N -0.56 3.66 0.26 10.12 3.76 0.08 -4.95 115.29 127.66 1pd5 s HIS 96 Ca 0.12 -2.68 -0.02 0.00 -0.15 0.00 0.00 55.06 52.32 1pd5 s HIS 96 Cb -0.12 -3.04 0.44 0.00 1.11 0.00 0.00 32.58 30.97 1pd5 s HIS 96 CO 0.02 -0.96 1.83 0.93 -0.85 0.00 0.00 174.74 175.72 1pd5 h GLU 97 N 7.84 0.91 -1.00 1.40 5.08 -1.97 -0.76 114.58 126.07 1pd5 h GLU 97 Ca -0.09 -0.05 0.23 0.00 -1.00 0.00 0.00 59.36 58.44 1pd5 h GLU 97 Cb 1.03 -0.20 -0.10 0.00 0.50 0.00 0.00 28.75 29.98 1pd5 h GLU 97 CO 0.61 0.60 0.62 1.96 -1.00 0.00 0.00 179.01 181.80 1pd5 h GLN 98 N 0.94 0.56 0.00 2.33 4.20 -1.97 -3.25 115.11 117.92 1pd5 h GLN 98 Ca 0.43 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.11 1pd5 h GLN 98 Cb 0.35 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1pd5 h GLN 98 CO -0.23 0.37 0.00 0.25 -0.67 0.00 0.00 178.83 178.55 1pd5 n THR 99 N -4.73 0.05 -2.42 -0.54 -2.24 -1.06 -5.03 114.28 98.31 1pd5 n THR 99 Ca 0.24 -0.31 -0.15 0.00 -2.27 0.00 0.00 64.05 61.57 1pd5 n THR 99 Cb 0.71 1.37 0.00 0.00 -2.10 0.00 0.00 70.33 70.32 1pd5 n THR 99 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pd5 n GLU 100 N -0.02 -1.79 -4.65 -0.78 1.02 -0.32 -5.00 120.64 109.09 1pd5 n GLU 100 Ca 0.00 0.70 -0.29 0.00 -0.02 0.00 0.00 57.16 57.55 1pd5 n GLU 100 Cb 0.13 -5.02 -0.09 0.00 -0.02 0.00 0.00 31.44 26.44 1pd5 n GLU 100 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1pd5 s THR 101 N -2.81 1.25 0.08 2.62 -4.23 -1.13 -4.98 115.64 106.46 1pd5 s THR 101 Ca 0.06 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.60 1pd5 s THR 101 Cb -0.03 -2.45 -0.03 0.00 1.34 0.00 0.00 72.50 71.33 1pd5 s THR 101 CO 0.07 0.00 -0.09 0.72 -0.54 0.00 0.00 174.62 174.78 1pd5 s PHE 102 N -2.94 0.93 0.43 3.99 -0.12 -1.26 -0.75 117.98 118.26 1pd5 s PHE 102 Ca 0.19 -0.67 0.04 0.00 -0.05 0.00 0.00 56.93 56.44 1pd5 s PHE 102 Cb 0.04 -0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 41.87 1pd5 s PHE 102 CO 0.10 -0.05 0.04 -1.12 -0.05 0.00 0.00 175.22 174.14 1pd5 s SER 103 N -2.35 3.50 -0.07 1.98 0.01 0.22 -4.77 113.70 112.22 1pd5 s SER 103 Ca 0.03 -1.53 0.05 0.00 1.31 0.00 0.00 55.95 55.80 1pd5 s SER 103 Cb -0.03 0.16 -0.00 0.00 0.21 0.00 0.00 66.02 66.36 1pd5 s SER 103 CO -0.01 -0.72 -0.23 -0.44 0.41 0.00 0.00 173.24 172.26 1pd5 s SER 104 N -3.71 2.85 -0.03 2.44 0.01 0.12 -1.07 113.70 114.31 1pd5 s SER 104 Ca 0.22 -0.49 0.04 0.00 1.31 0.00 0.00 55.95 57.03 1pd5 s SER 104 Cb 0.05 -1.01 -0.00 0.00 0.21 0.00 0.00 66.02 65.27 1pd5 s SER 104 CO 0.11 0.19 -0.14 -0.22 0.41 0.00 0.00 173.24 173.59 1pd5 s LEU 105 N 0.10 1.91 0.20 2.44 0.20 -0.46 -3.76 118.68 119.32 1pd5 s LEU 105 Ca -0.10 -0.28 0.09 0.00 0.69 0.00 0.00 54.13 54.54 1pd5 s LEU 105 Cb -0.15 -0.78 -0.04 0.00 -0.43 0.00 0.00 46.19 44.79 1pd5 s LEU 105 CO 0.05 0.14 -0.11 -1.66 -0.29 0.00 0.00 176.35 174.48 1pd5 s TRP 106 N -0.04 2.58 -0.05 5.38 1.48 -1.26 -0.87 118.94 126.15 1pd5 s TRP 106 Ca -0.01 -0.25 -0.02 0.00 -1.06 0.00 0.00 56.10 54.77 1pd5 s TRP 106 Cb -0.09 -1.24 0.04 0.00 -1.16 0.00 0.00 33.47 31.02 1pd5 s TRP 106 CO 0.01 0.53 0.10 -1.12 -4.06 0.00 0.00 176.95 172.41 1pd5 s SER 107 N -2.94 0.58 0.01 -2.66 0.01 -0.69 -5.01 113.70 103.00 1pd5 s SER 107 Ca 0.25 0.19 -0.36 0.00 1.31 0.00 0.00 55.95 57.34 1pd5 s SER 107 Cb -0.08 0.06 -0.15 0.00 0.21 0.00 0.00 66.02 66.06 1pd5 s SER 107 CO 0.15 -0.21 1.55 1.21 0.41 0.00 0.00 173.24 176.35 1pd5 n GLU 108 N 4.89 1.51 -1.98 12.44 2.13 -1.26 -3.40 120.64 134.96 1pd5 n GLU 108 Ca -0.13 0.55 -0.35 0.00 0.66 0.00 0.00 57.16 57.89 1pd5 n GLU 108 Cb 0.50 -2.25 0.03 0.00 0.27 0.00 0.00 31.44 29.99 1pd5 n GLU 108 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1pd5 s TYR 109 N 1.66 2.42 -0.00 4.31 5.04 -1.26 -4.90 117.35 124.62 1pd5 s TYR 109 Ca 0.87 1.53 -0.08 0.00 -2.44 0.00 0.00 57.07 56.95 1pd5 s TYR 109 Cb -0.88 -3.43 0.01 0.00 0.35 0.00 0.00 41.96 38.00 1pd5 s TYR 109 CO 0.49 -2.11 0.17 -1.01 -1.34 0.00 0.00 175.55 171.74 1pd5 s HIS 110 N -1.71 -0.00 0.42 4.97 3.76 -1.26 -5.01 115.29 116.46 1pd5 s HIS 110 Ca 0.76 -0.04 0.13 0.00 -0.15 0.00 0.00 55.06 55.75 1pd5 s HIS 110 Cb -0.29 -0.02 0.98 0.00 1.11 0.00 0.00 32.58 34.36 1pd5 s HIS 110 CO 0.34 -0.29 1.95 -0.44 -0.85 0.00 0.00 174.74 175.44 1pd5 h ASP 111 N 4.29 0.44 -3.06 1.40 3.32 -1.98 -3.42 116.42 117.41 1pd5 h ASP 111 Ca -0.30 0.01 -0.58 0.00 0.02 0.00 0.00 57.03 56.18 1pd5 h ASP 111 Cb 1.19 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 40.61 1pd5 h ASP 111 CO 0.40 0.26 0.84 -0.62 -1.72 0.00 0.00 179.24 178.40 1pd5 s ASP 112 N -6.12 7.02 0.16 6.45 2.15 -1.26 -4.92 116.67 120.14 1pd5 s ASP 112 Ca -0.08 1.42 -0.16 0.00 0.43 0.00 0.00 52.55 54.16 1pd5 s ASP 112 Cb 0.20 -2.54 0.10 0.00 -0.30 0.00 0.00 42.92 40.38 1pd5 s ASP 112 CO 0.76 -0.74 1.71 0.15 -0.17 0.00 0.00 175.17 176.88 1pd5 h PHE 113 N 7.82 0.05 -0.04 -5.34 3.57 -2.01 -1.76 116.94 119.23 1pd5 h PHE 113 Ca -0.22 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.17 1pd5 h PHE 113 Cb 1.07 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.83 1pd5 h PHE 113 CO 0.78 -0.03 -0.61 -0.09 -2.23 0.00 0.00 178.31 176.12 1pd5 h ARG 114 N 0.15 0.15 -0.40 1.11 2.43 -1.95 0.14 114.38 116.01 1pd5 h ARG 114 Ca 0.19 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1pd5 h ARG 114 Cb 0.24 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1pd5 h ARG 114 CO -0.28 0.72 0.19 0.37 -1.51 0.00 0.00 179.97 179.46 1pd5 h GLN 115 N 0.11 0.59 -0.71 0.20 4.15 -1.73 -2.88 115.11 114.84 1pd5 h GLN 115 Ca -0.01 -0.09 -0.07 0.00 0.77 0.00 0.00 58.65 59.25 1pd5 h GLN 115 Cb 1.11 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.67 1pd5 h GLN 115 CO 0.09 0.52 0.16 0.35 -1.93 0.00 0.00 178.83 178.02 1pd5 h PHE 116 N 0.51 1.20 0.00 3.99 3.57 -1.08 -1.27 116.94 123.87 1pd5 h PHE 116 Ca 0.14 -0.15 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1pd5 h PHE 116 Cb 0.14 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.54 1pd5 h PHE 116 CO -0.01 0.98 -0.00 1.25 -2.23 0.00 0.00 178.31 178.30 1pd5 h LEU 117 N 1.08 0.00 0.20 0.59 6.46 -0.82 1.05 115.31 123.86 1pd5 h LEU 117 Ca 0.22 0.00 -0.35 0.00 -0.12 0.00 0.00 57.88 57.63 1pd5 h LEU 117 Cb 0.40 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.34 1pd5 h LEU 117 CO 0.01 0.00 -1.72 0.45 -0.62 0.00 0.00 178.44 176.56 1pd5 h HIS 118 N 0.00 0.75 -0.45 1.25 3.86 -1.05 -2.91 115.15 116.60 1pd5 h HIS 118 Ca -0.00 -0.55 -0.10 0.00 -1.16 0.00 0.00 60.37 58.56 1pd5 h HIS 118 Cb 0.03 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1pd5 h HIS 118 CO 0.00 1.66 -0.11 0.82 0.86 0.00 0.00 177.93 181.17 1pd5 h ILE 119 N 0.11 1.27 -0.68 2.45 1.08 0.42 -2.88 117.51 119.29 1pd5 h ILE 119 Ca -0.33 -1.22 0.12 0.00 -0.39 0.00 0.00 64.86 63.04 1pd5 h ILE 119 Cb 2.11 1.14 -0.09 0.00 -3.07 0.00 0.00 36.82 36.91 1pd5 h ILE 119 CO 0.19 0.42 0.24 0.22 -0.69 0.00 0.00 178.15 178.53 1pd5 h TYR 120 N 0.70 0.40 -0.19 1.37 3.20 0.81 -1.60 116.97 121.66 1pd5 h TYR 120 Ca 0.11 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.85 1pd5 h TYR 120 Cb 0.65 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.85 1pd5 h TYR 120 CO 0.05 0.05 -0.55 0.77 -1.64 0.00 0.00 178.16 176.84 1pd5 h SER 121 N 0.39 0.81 0.21 -2.11 0.02 -1.48 0.32 113.55 111.71 1pd5 h SER 121 Ca 0.36 -0.58 -0.03 0.00 -0.84 0.00 0.00 61.79 60.70 1pd5 h SER 121 Cb 0.53 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.83 1pd5 h SER 121 CO -0.38 1.25 -0.13 -0.61 -1.14 0.00 0.00 176.83 175.82 1pd5 h GLN 122 N 0.41 0.00 0.10 3.45 4.15 -1.27 0.25 115.11 122.21 1pd5 h GLN 122 Ca -0.01 0.00 -0.23 0.00 0.77 0.00 0.00 58.65 59.17 1pd5 h GLN 122 Cb 1.17 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.86 1pd5 h GLN 122 CO 0.12 0.13 -1.17 -0.44 -1.93 0.00 0.00 178.83 175.54 1pd5 h ASP 123 N 0.00 0.34 -0.81 -0.69 3.32 -1.13 -2.86 116.42 114.59 1pd5 h ASP 123 Ca -0.00 -0.86 -0.02 0.00 0.02 0.00 0.00 57.03 56.17 1pd5 h ASP 123 Cb 0.28 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.68 1pd5 h ASP 123 CO 0.02 1.52 0.44 0.58 -1.72 0.00 0.00 179.24 180.07 1pd5 h VAL 124 N -0.42 1.24 0.07 -1.35 2.07 -0.15 -0.79 116.25 116.92 1pd5 h VAL 124 Ca -0.25 -0.61 0.02 0.00 0.82 0.00 0.00 66.70 66.69 1pd5 h VAL 124 Cb 1.65 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 1pd5 h VAL 124 CO 0.05 0.27 -0.30 0.00 0.02 0.00 0.00 177.57 177.62 1pd5 h ALA 125 N 1.34 -0.48 0.00 1.67 0.00 -0.62 -1.20 119.26 119.96 1pd5 h ALA 125 Ca 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1pd5 h ALA 125 Cb 0.04 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1pd5 h ALA 125 CO -0.05 -0.83 -1.23 0.00 0.00 0.00 0.00 179.25 177.14 1pd5 n TYR 127 N -2.41 0.00 0.60 0.00 4.01 -0.32 -4.89 117.16 114.15 1pd5 n TYR 127 Ca -0.00 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.76 1pd5 n TYR 127 Cb 0.53 -0.13 0.15 0.00 -0.31 0.00 0.00 39.34 39.58 1pd5 n TYR 127 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pd5 n GLY 128 N 2.75 -0.30 0.00 2.72 0.00 -0.45 -0.15 105.19 109.75 1pd5 n GLY 128 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1pd5 n GLY 128 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1pd5 n GLU 129 N -0.76 1.19 -2.32 1.61 0.28 -1.26 -4.91 120.64 114.47 1pd5 n GLU 129 Ca 0.04 -0.99 -0.42 0.00 -0.16 0.00 0.00 57.16 55.63 1pd5 n GLU 129 Cb 0.02 -0.93 -0.02 0.00 1.43 0.00 0.00 31.44 31.93 1pd5 n GLU 129 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1pd5 s ASN 130 N -0.51 6.17 0.01 -1.84 3.84 0.78 -4.89 114.94 118.49 1pd5 s ASN 130 Ca 0.00 0.66 0.06 0.00 0.21 0.00 0.00 52.86 53.78 1pd5 s ASN 130 Cb 0.00 -2.54 0.25 0.00 -0.55 0.00 0.00 41.25 38.41 1pd5 s ASN 130 CO 0.00 -1.60 1.19 0.18 -2.79 0.00 0.00 177.10 174.08 1pd5 n LEU 131 N 9.41 0.01 -4.31 3.21 4.77 -1.26 -4.77 117.00 124.06 1pd5 n LEU 131 Ca 0.16 0.50 -0.38 0.00 -0.03 0.00 0.00 56.01 56.26 1pd5 n LEU 131 Cb 0.49 -0.50 0.02 0.00 -2.33 0.00 0.00 43.42 41.09 1pd5 n LEU 131 CO 0.71 -0.41 -0.44 0.00 -1.33 0.00 0.00 177.39 175.91 1pd5 n ALA 132 N -1.51 -2.59 0.02 -1.18 0.00 -1.26 -4.94 120.51 109.05 1pd5 n ALA 132 Ca 0.01 -0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.23 1pd5 n ALA 132 Cb 0.07 -1.54 -0.09 0.00 0.00 0.00 0.00 19.45 17.88 1pd5 n ALA 132 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1pd5 h TYR 133 N -0.04 -0.09 -3.22 0.00 3.20 -1.86 -3.39 116.97 111.57 1pd5 h TYR 133 Ca -0.43 -0.00 -0.63 0.00 3.14 0.00 0.00 58.73 60.81 1pd5 h TYR 133 Cb 1.42 0.03 -0.41 0.00 1.54 0.00 0.00 36.73 39.31 1pd5 h TYR 133 CO 0.26 0.42 -0.65 -0.06 -1.64 0.00 0.00 178.16 176.48 1pd5 s PHE 134 N -3.84 2.92 -0.70 -3.82 0.40 -1.26 -0.70 117.98 110.98 1pd5 s PHE 134 Ca -0.15 -3.01 0.22 0.00 -0.60 0.00 0.00 56.93 53.39 1pd5 s PHE 134 Cb 0.01 -2.54 0.89 0.00 0.51 0.00 0.00 43.02 41.88 1pd5 s PHE 134 CO 0.61 -0.72 1.68 -2.30 0.70 0.00 0.00 175.22 175.19 1pd5 n PRO 135 N 3.03 0.14 -1.94 0.24 -0.02 -1.25 -1.06 135.00 134.13 1pd5 n PRO 135 Ca 0.09 0.31 -0.05 0.00 -2.02 0.00 0.00 63.50 61.82 1pd5 n PRO 135 Cb 0.33 -1.74 0.06 0.00 -0.02 0.00 0.00 33.50 32.14 1pd5 n PRO 135 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1pd5 n LYS 136 N -2.00 1.94 0.00 -0.52 2.85 -1.26 -5.07 118.16 114.10 1pd5 n LYS 136 Ca 0.03 -3.38 0.00 0.00 -1.05 0.00 0.00 58.31 53.91 1pd5 n LYS 136 Cb 0.26 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.14 1pd5 n LYS 136 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1pd5 n GLY 137 N -0.51 0.69 3.28 2.58 0.00 -0.23 -4.93 105.19 106.07 1pd5 n GLY 137 Ca 0.20 -0.84 -0.19 0.00 0.00 0.00 0.00 46.02 45.19 1pd5 n GLY 137 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pd5 s PHE 138 N 0.00 1.71 0.06 1.61 -0.12 -1.26 -4.79 117.98 115.19 1pd5 s PHE 138 Ca 0.00 -1.63 -0.09 0.00 -0.05 0.00 0.00 56.93 55.15 1pd5 s PHE 138 Cb 0.00 -0.71 0.00 0.00 -0.63 0.00 0.00 43.02 41.68 1pd5 s PHE 138 CO 0.00 -0.84 0.20 0.96 -0.05 0.00 0.00 175.22 175.49 1pd5 s ILE 139 N -3.51 0.12 -2.20 -4.49 -4.36 -1.26 -5.05 121.20 100.45 1pd5 s ILE 139 Ca 0.40 -1.00 0.23 0.00 -0.26 0.00 0.00 60.65 60.03 1pd5 s ILE 139 Cb 0.03 -1.10 0.55 0.00 1.25 0.00 0.00 42.46 43.20 1pd5 s ILE 139 CO 0.26 -0.55 1.72 -1.84 0.24 0.00 0.00 174.94 174.77 1pd5 n GLU 140 N 0.35 1.41 -3.22 0.37 0.28 -1.26 -3.98 120.64 114.60 1pd5 n GLU 140 Ca -0.17 -0.61 -0.25 0.00 -0.16 0.00 0.00 57.16 55.97 1pd5 n GLU 140 Cb 0.60 -1.39 -0.06 0.00 1.43 0.00 0.00 31.44 32.02 1pd5 n GLU 140 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1pd5 n ASN 141 N -0.21 2.99 -4.44 -1.84 6.94 -1.26 -5.02 115.26 112.42 1pd5 n ASN 141 Ca 0.17 -3.33 -0.22 0.00 -0.02 0.00 0.00 54.58 51.18 1pd5 n ASN 141 Cb 0.23 -0.63 -0.10 0.00 -2.36 0.00 0.00 39.78 36.92 1pd5 n ASN 141 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1pd5 s MET 142 N -2.53 1.58 0.26 -3.83 1.00 -1.26 -0.38 119.30 114.15 1pd5 s MET 142 Ca 0.42 -1.78 0.07 0.00 0.00 0.00 0.00 55.69 54.40 1pd5 s MET 142 Cb 0.21 -1.35 -0.05 0.00 0.00 0.00 0.00 34.83 33.64 1pd5 s MET 142 CO -0.07 0.13 -0.09 -0.59 0.00 0.00 0.00 175.02 174.40 1pd5 s PHE 143 N -2.85 1.91 0.11 -0.03 -0.12 -1.06 -4.71 117.98 111.23 1pd5 s PHE 143 Ca 0.29 -0.65 0.08 0.00 -0.05 0.00 0.00 56.93 56.60 1pd5 s PHE 143 Cb 0.01 -1.03 -0.04 0.00 -0.63 0.00 0.00 43.02 41.33 1pd5 s PHE 143 CO 0.12 0.32 -0.16 -0.06 -0.05 0.00 0.00 175.22 175.39 1pd5 s PHE 144 N -2.98 2.59 -0.08 3.49 0.40 -0.45 -1.61 117.98 119.34 1pd5 s PHE 144 Ca 0.28 -0.23 -0.03 0.00 -0.60 0.00 0.00 56.93 56.35 1pd5 s PHE 144 Cb 0.02 -1.37 0.04 0.00 0.51 0.00 0.00 43.02 42.22 1pd5 s PHE 144 CO 0.11 0.39 0.09 0.08 0.70 0.00 0.00 175.22 176.59 1pd5 s VAL 145 N -1.16 -0.13 -0.17 -0.44 1.01 -0.67 -0.22 120.40 118.63 1pd5 s VAL 145 Ca 0.19 0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.42 1pd5 s VAL 145 Cb -0.11 -0.29 -0.00 0.00 0.00 0.00 0.00 36.38 35.98 1pd5 s VAL 145 CO 0.11 0.05 -0.13 -0.44 0.00 0.00 0.00 175.10 174.68 1pd5 s SER 146 N 2.18 3.77 0.20 3.32 0.01 -0.63 -2.37 113.70 120.18 1pd5 s SER 146 Ca 0.04 -0.46 -0.30 0.00 1.31 0.00 0.00 55.95 56.54 1pd5 s SER 146 Cb -0.13 -1.59 -0.08 0.00 0.21 0.00 0.00 66.02 64.42 1pd5 s SER 146 CO -0.05 0.06 1.25 0.00 0.41 0.00 0.00 173.24 174.92 1pd5 s ALA 147 N 0.94 3.48 -0.41 1.44 0.00 -1.26 -1.28 121.76 124.67 1pd5 s ALA 147 Ca -0.02 1.03 0.06 0.00 0.00 0.00 0.00 51.96 53.03 1pd5 s ALA 147 Cb -0.15 -3.45 0.21 0.00 0.00 0.00 0.00 23.12 19.73 1pd5 s ALA 147 CO -0.02 -0.46 0.48 -1.71 0.00 0.00 0.00 175.76 174.05 1pd5 n ASN 148 N 2.52 -0.57 -0.02 0.00 4.05 0.60 -4.88 115.26 116.97 1pd5 n ASN 148 Ca 0.05 -2.60 0.01 0.00 0.45 0.00 0.00 54.58 52.49 1pd5 n ASN 148 Cb 0.44 -0.28 0.08 0.00 1.23 0.00 0.00 39.78 41.25 1pd5 n ASN 148 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1pd5 n PRO 149 N 2.17 1.02 0.09 1.20 -0.04 -1.26 -3.03 135.00 135.15 1pd5 n PRO 149 Ca 0.24 -0.04 0.12 0.00 -0.04 0.00 0.00 63.50 63.79 1pd5 n PRO 149 Cb 0.52 -1.05 0.19 0.00 -0.04 0.00 0.00 33.50 33.12 1pd5 n PRO 149 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1pd5 h TRP 150 N 0.06 0.00 -2.52 0.54 6.55 -1.92 -3.42 115.95 115.24 1pd5 h TRP 150 Ca 0.00 0.00 -0.09 0.00 0.95 0.00 0.00 58.89 59.75 1pd5 h TRP 150 Cb 0.01 0.00 -0.21 0.00 -0.86 0.00 0.00 29.16 28.10 1pd5 h TRP 150 CO 0.01 0.00 -0.09 0.54 -1.05 0.00 0.00 178.44 177.85 1pd5 s VAL 151 N -3.18 0.01 -1.19 1.49 0.11 -1.24 -4.93 120.40 111.46 1pd5 s VAL 151 Ca 0.06 -0.11 -0.05 0.00 -2.93 0.00 0.00 61.98 58.95 1pd5 s VAL 151 Cb 0.12 -0.75 0.21 0.00 -1.53 0.00 0.00 36.38 34.43 1pd5 s VAL 151 CO 0.70 -0.06 2.00 -1.20 -3.33 0.00 0.00 175.10 173.20 1pd5 n SER 152 N 2.04 7.07 -4.68 3.54 7.64 -1.26 -1.29 113.62 126.68 1pd5 n SER 152 Ca -0.17 -3.34 -0.38 0.00 1.01 0.00 0.00 58.87 56.00 1pd5 n SER 152 Cb 0.56 -1.31 0.06 0.00 -1.01 0.00 0.00 64.21 62.51 1pd5 n SER 152 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 1pd5 n PHE 153 N 1.53 1.52 0.04 1.43 1.16 -1.26 -4.93 117.46 116.95 1pd5 n PHE 153 Ca 0.48 0.43 -0.01 0.00 -1.87 0.00 0.00 57.45 56.48 1pd5 n PHE 153 Cb 0.28 -2.23 -0.08 0.00 -1.61 0.00 0.00 39.48 35.85 1pd5 n PHE 153 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1pd5 h THR 154 N 0.64 0.68 -3.34 1.97 1.03 -1.99 -3.44 112.91 108.47 1pd5 h THR 154 Ca -0.50 -2.21 -0.16 0.00 -0.01 0.00 0.00 66.41 63.53 1pd5 h THR 154 Cb 1.35 2.20 -0.23 0.00 -1.07 0.00 0.00 68.15 70.39 1pd5 h THR 154 CO 0.53 0.39 -0.47 -0.55 -0.01 0.00 0.00 175.52 175.40 1pd5 s SER 155 N -5.99 -0.12 -0.15 0.00 0.15 -1.26 -4.74 113.70 101.60 1pd5 s SER 155 Ca -0.02 0.14 -0.04 0.00 0.70 0.00 0.00 55.95 56.73 1pd5 s SER 155 Cb 0.08 0.32 0.06 0.00 -1.71 0.00 0.00 66.02 64.78 1pd5 s SER 155 CO 0.80 -0.22 0.15 0.12 1.20 0.00 0.00 173.24 175.30 1pd5 s PHE 156 N -0.59 -0.07 0.04 3.44 5.36 -1.26 -5.11 117.98 119.79 1pd5 s PHE 156 Ca -0.07 0.16 0.05 0.00 -0.96 0.00 0.00 56.93 56.11 1pd5 s PHE 156 Cb -0.04 -0.45 -0.02 0.00 -0.34 0.00 0.00 43.02 42.17 1pd5 s PHE 156 CO 0.01 -0.45 -0.13 -0.51 -1.46 0.00 0.00 175.22 172.68 1pd5 s ASP 157 N 2.24 1.59 -0.26 6.13 1.01 -1.26 -4.70 116.67 121.42 1pd5 s ASP 157 Ca 0.04 -0.46 -0.06 0.00 0.71 0.00 0.00 52.55 52.79 1pd5 s ASP 157 Cb -0.14 -0.09 -0.00 0.00 1.01 0.00 0.00 42.92 43.69 1pd5 s ASP 157 CO -0.09 0.02 0.03 -0.22 0.21 0.00 0.00 175.17 175.12 1pd5 s LEU 158 N -1.16 3.45 -0.58 1.23 0.20 -1.26 -5.04 118.68 115.53 1pd5 s LEU 158 Ca 0.01 -0.56 -0.01 0.00 0.69 0.00 0.00 54.13 54.26 1pd5 s LEU 158 Cb -0.08 -1.83 0.15 0.00 -0.43 0.00 0.00 46.19 44.00 1pd5 s LEU 158 CO 0.01 -0.11 0.38 0.21 -0.29 0.00 0.00 176.35 176.55 1pd5 s ASN 159 N 1.50 5.03 -0.03 3.68 3.04 -1.26 -4.95 114.94 121.94 1pd5 s ASN 159 Ca 0.04 -2.82 -0.30 0.00 0.04 0.00 0.00 52.86 49.82 1pd5 s ASN 159 Cb -0.16 -1.80 -0.03 0.00 -1.54 0.00 0.00 41.25 37.72 1pd5 s ASN 159 CO 0.00 -0.35 1.00 0.54 -3.04 0.00 0.00 177.10 175.26 1pd5 s VAL 160 N -0.02 4.79 0.46 -5.21 0.11 -1.26 -4.95 120.40 114.33 1pd5 s VAL 160 Ca 0.16 2.02 0.13 0.00 -2.93 0.00 0.00 61.98 61.36 1pd5 s VAL 160 Cb -0.22 -4.29 0.29 0.00 -1.53 0.00 0.00 36.38 30.63 1pd5 s VAL 160 CO -0.03 0.11 2.07 0.00 -3.33 0.00 0.00 175.10 173.91 1pd5 h ALA 161 N 6.91 1.94 -2.94 1.54 0.00 -2.06 -3.42 119.26 121.23 1pd5 h ALA 161 Ca -0.38 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.20 1pd5 h ALA 161 Cb 1.20 -0.08 -0.36 0.00 0.00 0.00 0.00 17.79 18.54 1pd5 h ALA 161 CO 0.79 0.01 -0.64 -0.80 0.00 0.00 0.00 179.25 178.61 1pd5 s ASN 162 N -6.67 1.08 -0.01 0.00 0.01 -1.26 -5.03 114.94 103.06 1pd5 s ASN 162 Ca -0.07 0.09 0.02 0.00 -0.71 0.00 0.00 52.86 52.20 1pd5 s ASN 162 Cb 0.18 0.25 0.03 0.00 0.41 0.00 0.00 41.25 42.12 1pd5 s ASN 162 CO 0.72 -0.28 0.83 1.15 -1.51 0.00 0.00 177.10 178.01 1pd5 n MET 163 N 5.32 1.44 -1.68 -0.60 0.00 -1.26 -4.87 117.12 115.47 1pd5 n MET 163 Ca -0.05 -1.21 -0.48 0.00 0.00 0.00 0.00 57.70 55.97 1pd5 n MET 163 Cb 0.50 -0.83 -0.05 0.00 0.00 0.00 0.00 33.22 32.85 1pd5 n MET 163 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1pd5 n ASP 164 N -0.37 3.38 0.00 3.17 8.00 -1.26 -2.56 116.55 126.91 1pd5 n ASP 164 Ca 0.02 1.00 0.00 0.00 0.71 0.00 0.00 54.79 56.52 1pd5 n ASP 164 Cb 0.43 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.14 1pd5 n ASP 164 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1pd5 n ASN 165 N 5.85 0.00 -4.50 -2.24 3.02 -1.26 -4.84 115.26 111.29 1pd5 n ASN 165 Ca 0.21 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.64 1pd5 n ASN 165 Cb 0.30 -1.51 -0.10 0.00 -0.61 0.00 0.00 39.78 37.85 1pd5 n ASN 165 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1pd5 n PHE 166 N -1.59 0.81 0.73 3.10 7.35 -1.06 -4.64 117.46 122.18 1pd5 n PHE 166 Ca 0.00 -0.11 0.08 0.00 -0.76 0.00 0.00 57.45 56.66 1pd5 n PHE 166 Cb 0.00 -2.29 -0.09 0.00 0.35 0.00 0.00 39.48 37.44 1pd5 n PHE 166 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1pd5 n PHE 167 N 17.51 0.00 -2.06 -5.13 3.72 -1.26 -4.59 117.46 125.65 1pd5 n PHE 167 Ca 0.38 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.36 1pd5 n PHE 167 Cb 0.45 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.95 1pd5 n PHE 167 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1pd5 s ALA 168 N -2.57 3.43 0.58 4.37 0.00 -1.26 -4.71 121.76 121.60 1pd5 s ALA 168 Ca 0.06 0.69 -0.20 0.00 0.00 0.00 0.00 51.96 52.51 1pd5 s ALA 168 Cb 0.12 -3.80 -0.04 0.00 0.00 0.00 0.00 23.12 19.40 1pd5 s ALA 168 CO 0.67 -1.70 1.25 -2.14 0.00 0.00 0.00 175.76 173.85 1pd5 s PRO 169 N 4.40 2.98 -0.18 0.00 0.02 -1.26 -4.82 135.00 136.13 1pd5 s PRO 169 Ca 0.73 1.95 0.01 0.00 0.02 0.00 0.00 61.00 63.71 1pd5 s PRO 169 Cb -0.29 -2.01 0.03 0.00 0.02 0.00 0.00 34.50 32.25 1pd5 s PRO 169 CO 0.29 -1.24 -0.16 0.08 -0.33 0.00 0.00 177.00 175.64 1pd5 s VAL 170 N -1.49 1.86 -0.06 3.83 1.01 -0.81 -1.34 120.40 123.41 1pd5 s VAL 170 Ca 0.76 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 61.74 1pd5 s VAL 170 Cb -0.34 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1pd5 s VAL 170 CO 0.37 0.41 0.21 -0.36 0.00 0.00 0.00 175.10 175.73 1pd5 s PHE 171 N 1.35 3.61 -0.04 5.22 0.40 0.70 -0.39 117.98 128.82 1pd5 s PHE 171 Ca 0.03 0.58 0.05 0.00 -0.60 0.00 0.00 56.93 56.98 1pd5 s PHE 171 Cb -0.14 -1.98 -0.01 0.00 0.51 0.00 0.00 43.02 41.40 1pd5 s PHE 171 CO -0.11 0.69 -0.18 0.99 0.70 0.00 0.00 175.22 177.31 1pd5 s THR 172 N -1.13 1.52 -0.19 0.64 2.01 -0.34 -1.60 115.64 116.56 1pd5 s THR 172 Ca 0.20 -0.77 -0.02 0.00 0.31 0.00 0.00 61.69 61.41 1pd5 s THR 172 Cb -0.13 -1.30 -0.00 0.00 0.01 0.00 0.00 72.50 71.08 1pd5 s THR 172 CO 0.10 0.43 -0.09 -0.04 -0.69 0.00 0.00 174.62 174.33 1pd5 s MET 173 N -0.04 3.31 0.49 4.92 1.00 -0.41 0.07 119.30 128.64 1pd5 s MET 173 Ca -0.02 -0.68 -0.05 0.00 0.00 0.00 0.00 55.69 54.94 1pd5 s MET 173 Cb -0.11 -2.84 0.11 0.00 0.00 0.00 0.00 34.83 31.98 1pd5 s MET 173 CO 0.02 -0.10 0.66 0.41 0.00 0.00 0.00 175.02 176.02 1pd5 n GLY 174 N 4.45 -0.34 3.63 -0.03 0.00 -0.22 -0.29 105.19 112.39 1pd5 n GLY 174 Ca -0.19 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 1pd5 n GLY 174 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pd5 s LYS 175 N -4.29 4.03 0.54 1.61 2.20 -0.42 -4.61 119.74 118.80 1pd5 s LYS 175 Ca 0.40 0.86 -0.21 0.00 -0.36 0.00 0.00 55.97 56.67 1pd5 s LYS 175 Cb -0.02 -3.73 -0.05 0.00 -1.51 0.00 0.00 37.83 32.53 1pd5 s LYS 175 CO 0.28 -0.78 1.23 1.52 -0.36 0.00 0.00 175.35 177.23 1pd5 s TYR 176 N 3.29 2.51 0.21 4.03 -0.85 -1.26 -4.05 117.35 121.23 1pd5 s TYR 176 Ca 0.39 1.49 -0.09 0.00 -0.52 0.00 0.00 57.07 58.34 1pd5 s TYR 176 Cb -0.13 -3.52 -0.01 0.00 0.38 0.00 0.00 41.96 38.68 1pd5 s TYR 176 CO 0.13 -2.15 0.35 1.52 -1.52 0.00 0.00 175.55 173.89 1pd5 s TYR 177 N -1.52 0.53 -0.42 -3.49 -0.85 -0.20 -4.95 117.35 106.44 1pd5 s TYR 177 Ca 0.72 -0.87 -0.18 0.00 -0.52 0.00 0.00 57.07 56.22 1pd5 s TYR 177 Cb -0.32 -0.04 0.02 0.00 0.38 0.00 0.00 41.96 42.01 1pd5 s TYR 177 CO 0.36 -0.84 0.50 0.99 -1.52 0.00 0.00 175.55 175.04 1pd5 s THR 178 N -4.03 5.01 -0.40 -3.49 2.01 -1.26 -1.34 115.64 112.14 1pd5 s THR 178 Ca 0.24 -0.18 -0.11 0.00 0.31 0.00 0.00 61.69 61.95 1pd5 s THR 178 Cb 0.02 -4.08 0.04 0.00 0.01 0.00 0.00 72.50 68.49 1pd5 s THR 178 CO 0.07 -0.46 0.24 -1.58 -0.69 0.00 0.00 174.62 172.20 1pd5 s GLN 179 N 2.34 2.79 7.54 4.92 0.74 -0.86 -5.01 119.66 132.13 1pd5 s GLN 179 Ca 0.15 -1.19 0.00 0.00 0.05 0.00 0.00 55.36 54.37 1pd5 s GLN 179 Cb -0.16 -3.79 0.00 0.00 1.10 0.00 0.00 33.01 30.15 1pd5 s GLN 179 CO 0.15 -0.79 0.00 0.41 -0.55 0.00 0.00 175.29 174.51 1pd5 n GLY 180 N 5.01 2.27 0.33 2.59 0.00 -1.26 -2.48 105.19 111.65 1pd5 n GLY 180 Ca -0.11 -0.36 0.03 0.00 0.00 0.00 0.00 46.02 45.58 1pd5 n GLY 180 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1pd5 n ASP 181 N 9.28 2.40 -4.75 1.61 5.68 -1.26 -5.01 116.55 124.50 1pd5 n ASP 181 Ca 0.00 -1.93 -0.40 0.00 -0.50 0.00 0.00 54.79 51.96 1pd5 n ASP 181 Cb 0.00 -0.11 -0.05 0.00 -1.14 0.00 0.00 41.12 39.82 1pd5 n ASP 181 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1pd5 s LYS 182 N -0.95 4.69 -0.22 0.11 1.02 -1.03 -5.02 119.74 118.33 1pd5 s LYS 182 Ca 0.12 1.69 -0.07 0.00 0.02 0.00 0.00 55.97 57.73 1pd5 s LYS 182 Cb 0.06 -3.24 -0.03 0.00 -0.52 0.00 0.00 37.83 34.10 1pd5 s LYS 182 CO 0.08 0.25 0.06 0.08 -0.92 0.00 0.00 175.35 174.91 1pd5 s VAL 183 N -0.88 4.40 -0.11 3.17 1.01 -1.26 -2.02 120.40 124.71 1pd5 s VAL 183 Ca 0.45 -0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.26 1pd5 s VAL 183 Cb -0.29 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 1pd5 s VAL 183 CO 0.37 0.38 -0.04 -0.76 0.00 0.00 0.00 175.10 175.05 1pd5 s LEU 184 N 1.18 3.28 -0.12 3.92 1.43 -0.45 -0.15 118.68 127.77 1pd5 s LEU 184 Ca 0.04 -0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.12 1pd5 s LEU 184 Cb -0.14 -1.75 0.02 0.00 0.03 0.00 0.00 46.19 44.34 1pd5 s LEU 184 CO 0.03 0.28 -0.16 -0.32 0.23 0.00 0.00 176.35 176.42 1pd5 s MET 185 N -0.31 2.32 0.03 1.70 1.75 0.11 -1.04 119.30 123.87 1pd5 s MET 185 Ca 0.05 -0.59 -0.30 0.00 -1.25 0.00 0.00 55.69 53.60 1pd5 s MET 185 Cb -0.12 -2.01 -0.06 0.00 2.84 0.00 0.00 34.83 35.48 1pd5 s MET 185 CO 0.02 -0.11 1.41 -2.14 -0.65 0.00 0.00 175.02 173.56 1pd5 s PRO 186 N 1.12 4.29 -0.13 4.11 0.02 -1.26 -0.74 135.00 142.41 1pd5 s PRO 186 Ca -0.03 2.01 0.01 0.00 0.02 0.00 0.00 61.00 63.00 1pd5 s PRO 186 Cb -0.14 -3.51 0.02 0.00 0.02 0.00 0.00 34.50 30.89 1pd5 s PRO 186 CO -0.04 -0.55 -0.13 -1.17 -0.33 0.00 0.00 177.00 174.78 1pd5 s LEU 187 N 2.13 1.58 -0.00 -5.54 2.96 0.08 -1.06 118.68 118.83 1pd5 s LEU 187 Ca 0.65 -0.42 0.00 0.00 -0.22 0.00 0.00 54.13 54.14 1pd5 s LEU 187 Cb -0.33 -1.06 -0.04 0.00 0.50 0.00 0.00 46.19 45.26 1pd5 s LEU 187 CO 0.28 -0.05 0.05 0.00 -1.32 0.00 0.00 176.35 175.31 1pd5 s ALA 188 N 1.37 3.48 -0.02 5.97 0.00 0.11 -1.53 121.76 131.14 1pd5 s ALA 188 Ca 0.01 -0.90 -0.01 0.00 0.00 0.00 0.00 51.96 51.06 1pd5 s ALA 188 Cb -0.13 -1.49 0.02 0.00 0.00 0.00 0.00 23.12 21.51 1pd5 s ALA 188 CO -0.07 0.68 0.04 -1.50 0.00 0.00 0.00 175.76 174.90 1pd5 s ILE 189 N -1.16 -0.04 -0.17 0.00 1.10 -0.47 -1.20 121.20 119.26 1pd5 s ILE 189 Ca 0.22 0.13 -0.00 0.00 -0.51 0.00 0.00 60.65 60.49 1pd5 s ILE 189 Cb -0.12 -0.08 0.00 0.00 0.15 0.00 0.00 42.46 42.42 1pd5 s ILE 189 CO 0.13 0.05 -0.14 -1.58 -2.11 0.00 0.00 174.94 171.29 1pd5 s GLN 190 N 0.69 3.18 0.43 3.50 -0.44 0.48 -1.13 119.66 126.37 1pd5 s GLN 190 Ca -0.06 -0.75 0.04 0.00 -2.50 0.00 0.00 55.36 52.10 1pd5 s GLN 190 Cb -0.08 -2.68 -0.05 0.00 -1.64 0.00 0.00 33.01 28.56 1pd5 s GLN 190 CO -0.02 -0.09 0.03 0.14 0.50 0.00 0.00 175.29 175.85 1pd5 s VAL 191 N 1.08 1.43 -0.11 1.34 -7.23 -0.44 -1.93 120.40 114.53 1pd5 s VAL 191 Ca -0.00 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.19 1pd5 s VAL 191 Cb -0.14 -2.61 -0.01 0.00 0.56 0.00 0.00 36.38 34.18 1pd5 s VAL 191 CO -0.04 0.00 -0.19 -2.28 -0.31 0.00 0.00 175.10 172.27 1pd5 s HIS 192 N -2.92 2.67 0.46 2.82 2.46 -1.26 -1.24 115.29 118.28 1pd5 s HIS 192 Ca 0.24 -0.90 0.13 0.00 0.47 0.00 0.00 55.06 55.00 1pd5 s HIS 192 Cb 0.06 -1.77 1.09 0.00 -0.13 0.00 0.00 32.58 31.83 1pd5 s HIS 192 CO 0.12 -0.35 2.07 1.25 -2.47 0.00 0.00 174.74 175.36 1pd5 h HIS 193 N 6.75 0.27 -0.90 3.88 2.76 -1.00 -0.88 115.15 126.03 1pd5 h HIS 193 Ca -0.22 0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.03 1pd5 h HIS 193 Cb 1.23 -0.09 -0.07 0.00 1.55 0.00 0.00 27.41 30.03 1pd5 h HIS 193 CO 0.48 0.16 0.56 0.00 -1.30 0.00 0.00 177.93 177.83 1pd5 h ALA 194 N 1.82 1.28 0.00 5.26 0.00 -1.80 -2.94 119.26 122.88 1pd5 h ALA 194 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1pd5 h ALA 194 Cb 0.19 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1pd5 h ALA 194 CO -0.03 0.26 -1.22 1.33 0.00 0.00 0.00 179.25 179.59 1pd5 n VAL 195 N -4.63 0.00 -3.92 0.00 0.24 -0.46 -4.39 118.33 105.18 1pd5 n VAL 195 Ca 0.14 -0.15 -0.15 0.00 -2.04 0.00 0.00 64.34 62.14 1pd5 n VAL 195 Cb 0.23 0.73 -0.15 0.00 -1.47 0.00 0.00 33.84 33.18 1pd5 n VAL 195 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pd5 s ASP 197 N 0.55 5.11 0.30 0.00 -0.00 -1.26 -4.30 116.67 117.07 1pd5 s ASP 197 Ca -0.05 -0.79 -0.02 0.00 -0.00 0.00 0.00 52.55 51.69 1pd5 s ASP 197 Cb -0.08 -0.21 0.44 0.00 -0.00 0.00 0.00 42.92 43.07 1pd5 s ASP 197 CO -0.01 -0.91 1.97 1.23 -0.00 0.00 0.00 175.17 177.44 1pd5 h GLY 198 N 0.71 1.17 0.02 0.21 0.00 -1.99 -2.72 103.07 100.47 1pd5 h GLY 198 Ca -0.38 -0.44 0.01 0.00 0.00 0.00 0.00 47.33 46.52 1pd5 h GLY 198 CO 0.51 0.43 -0.17 -2.75 0.00 0.00 0.00 176.54 174.55 1pd5 h PHE 199 N 1.12 -0.50 -0.95 5.60 3.04 -1.97 0.55 116.94 123.84 1pd5 h PHE 199 Ca 0.31 0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.37 1pd5 h PHE 199 Cb -0.13 0.22 -0.12 0.00 2.56 0.00 0.00 35.95 38.48 1pd5 h PHE 199 CO -0.00 -0.19 -0.52 0.72 -2.02 0.00 0.00 178.31 176.30 1pd5 n HIS 200 N -3.43 -0.34 0.02 0.41 8.25 -1.06 -0.49 115.22 118.58 1pd5 n HIS 200 Ca -0.03 1.18 -0.10 0.00 -0.26 0.00 0.00 57.72 58.51 1pd5 n HIS 200 Cb 0.13 -0.63 -0.04 0.00 1.12 0.00 0.00 29.99 30.57 1pd5 n HIS 200 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1pd5 h VAL 201 N 0.00 0.74 -0.85 1.59 2.07 -1.29 0.51 116.25 119.01 1pd5 h VAL 201 Ca 0.18 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.69 1pd5 h VAL 201 Cb 0.42 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 1pd5 h VAL 201 CO -0.90 0.00 0.50 1.23 0.02 0.00 0.00 177.57 178.42 1pd5 h GLY 202 N -0.13 1.25 0.89 2.17 0.00 0.18 0.78 103.07 108.20 1pd5 h GLY 202 Ca 0.06 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 1pd5 h GLY 202 CO -0.15 0.51 -0.15 -0.09 0.00 0.00 0.00 176.54 176.67 1pd5 h ARG 203 N 1.18 -0.35 -0.80 4.80 2.43 -0.67 0.84 114.38 121.81 1pd5 h ARG 203 Ca 0.30 0.02 0.16 0.00 -0.81 0.00 0.00 59.98 59.66 1pd5 h ARG 203 Cb -0.02 0.08 -0.10 0.00 -0.42 0.00 0.00 29.97 29.50 1pd5 h ARG 203 CO -0.05 -0.23 0.33 1.98 -1.51 0.00 0.00 179.97 180.49 1pd5 h MET 204 N -0.36 0.43 -0.19 0.20 4.05 -0.31 -0.03 114.93 118.72 1pd5 h MET 204 Ca -0.01 -0.03 -0.10 0.00 -0.28 0.00 0.00 59.70 59.27 1pd5 h MET 204 Cb 0.31 -0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 31.01 1pd5 h MET 204 CO 0.00 0.29 -0.29 -0.07 0.23 0.00 0.00 176.91 177.07 1pd5 h LEU 205 N 0.45 0.59 -0.81 3.39 3.38 -0.61 0.33 115.31 122.03 1pd5 h LEU 205 Ca 0.46 -0.52 0.07 0.00 0.09 0.00 0.00 57.88 57.98 1pd5 h LEU 205 Cb 0.75 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 41.26 1pd5 h LEU 205 CO -0.44 0.99 0.48 0.78 0.09 0.00 0.00 178.44 180.34 1pd5 h ASN 206 N 0.20 0.72 -0.10 -0.43 2.35 -0.25 -0.61 115.58 117.45 1pd5 h ASN 206 Ca 0.02 0.03 -0.14 0.00 -0.55 0.00 0.00 56.30 55.66 1pd5 h ASN 206 Cb 0.86 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.11 1pd5 h ASN 206 CO 0.07 0.44 -0.43 -0.33 -1.65 0.00 0.00 177.43 175.53 1pd5 h GLU 207 N 0.84 0.64 -0.14 0.81 5.08 -0.92 -2.18 114.58 118.71 1pd5 h GLU 207 Ca 0.37 -0.34 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1pd5 h GLU 207 Cb 0.25 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 1pd5 h GLU 207 CO -0.21 0.95 -0.07 1.25 -1.00 0.00 0.00 179.01 179.93 1pd5 h LEU 208 N 0.52 -0.24 -0.82 1.33 5.85 0.12 0.11 115.31 122.18 1pd5 h LEU 208 Ca 0.04 0.06 0.17 0.00 0.84 0.00 0.00 57.88 58.99 1pd5 h LEU 208 Cb 0.96 0.13 -0.11 0.00 0.37 0.00 0.00 40.66 42.02 1pd5 h LEU 208 CO 0.09 -0.10 0.34 -0.61 -0.34 0.00 0.00 178.44 177.82 1pd5 h GLN 209 N -0.06 0.43 0.03 1.25 5.75 -1.39 -1.18 115.11 119.94 1pd5 h GLN 209 Ca 0.08 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 1pd5 h GLN 209 Cb 0.18 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 28.64 1pd5 h GLN 209 CO -0.18 0.29 -0.02 0.37 -2.65 0.00 0.00 178.83 176.64 1pd5 h GLN 210 N 0.44 -0.04 -0.70 1.69 4.15 -0.42 -1.43 115.11 118.80 1pd5 h GLN 210 Ca 0.47 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.97 1pd5 h GLN 210 Cb 0.78 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.44 1pd5 h GLN 210 CO -0.45 0.49 0.46 1.88 -1.93 0.00 0.00 178.83 179.28 1pd5 h TYR 211 N -0.61 0.71 0.00 3.99 -1.99 -1.09 0.41 116.97 118.39 1pd5 h TYR 211 Ca -0.00 0.02 -0.11 0.00 2.00 0.00 0.00 58.73 60.64 1pd5 h TYR 211 Cb 0.55 -0.23 -0.02 0.00 2.00 0.00 0.00 36.73 39.04 1pd5 h TYR 211 CO 0.11 0.37 -0.51 0.00 -0.00 0.00 0.00 178.16 178.13 1pd5 h ASP 213 N 0.00 0.59 -0.01 0.00 3.32 0.45 -2.99 116.42 117.78 1pd5 h ASP 213 Ca -0.01 -0.39 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1pd5 h ASP 213 Cb 1.01 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.38 1pd5 h ASP 213 CO 0.07 1.15 -0.12 -0.62 -1.72 0.00 0.00 179.24 177.99 1pd5 n GLU 214 N -3.85 1.36 0.00 3.56 1.02 0.11 -4.77 120.64 118.07 1pd5 n GLU 214 Ca -0.05 -0.93 0.16 0.00 -0.02 0.00 0.00 57.16 56.31 1pd5 n GLU 214 Cb 0.73 -1.18 0.86 0.00 -0.02 0.00 0.00 31.44 31.83 1pd5 n GLU 214 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18