#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qym n VAL 5 N 0.00 0.01 -4.31 0.00 0.31 -1.26 -4.92 118.33 108.17 1qym n VAL 5 Ca 0.00 -0.01 -0.16 0.00 -0.01 0.00 0.00 64.34 64.15 1qym n VAL 5 Cb 0.00 0.41 -0.10 0.00 -0.91 0.00 0.00 33.84 33.23 1qym n VAL 5 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1qym s SER 6 N -3.06 1.46 0.15 4.52 0.15 -1.26 -5.04 113.70 110.62 1qym s SER 6 Ca 0.10 -1.28 0.23 0.00 0.70 0.00 0.00 55.95 55.70 1qym s SER 6 Cb 0.17 0.09 0.02 0.00 -1.71 0.00 0.00 66.02 64.59 1qym s SER 6 CO 0.74 -0.61 1.02 -0.46 1.20 0.00 0.00 173.24 175.13 1qym n ASN 7 N -0.40 0.71 -4.74 5.45 6.94 -1.26 -4.86 115.26 117.10 1qym n ASN 7 Ca -0.03 0.19 -0.38 0.00 -0.02 0.00 0.00 54.58 54.34 1qym n ASN 7 Cb 0.65 0.61 -0.06 0.00 -2.36 0.00 0.00 39.78 38.62 1qym n ASN 7 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1qym s LEU 8 N -4.93 4.31 0.09 -4.53 1.43 -1.26 -5.01 118.68 108.78 1qym s LEU 8 Ca 0.00 0.81 -0.20 0.00 -1.03 0.00 0.00 54.13 53.72 1qym s LEU 8 Cb 0.11 -2.64 -0.09 0.00 0.03 0.00 0.00 46.19 43.61 1qym s LEU 8 CO 0.79 0.08 1.58 -0.03 0.23 0.00 0.00 176.35 179.00 1qym h MET 9 N 6.31 0.34 -0.98 1.70 1.85 -2.00 -2.49 114.93 119.67 1qym h MET 9 Ca -0.43 -0.08 0.33 0.00 -0.61 0.00 0.00 59.70 58.91 1qym h MET 9 Cb 1.18 -0.05 -0.16 0.00 0.43 0.00 0.00 31.60 33.01 1qym h MET 9 CO 0.73 0.45 0.41 0.28 -0.40 0.00 0.00 176.91 178.38 1qym h VAL 10 N 0.16 0.16 -0.08 -5.77 2.07 -1.94 -0.41 116.25 110.43 1qym h VAL 10 Ca 0.07 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 1qym h VAL 10 Cb 0.26 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1qym h VAL 10 CO 0.00 0.03 -0.02 0.00 0.02 0.00 0.00 177.57 177.60 1qym h ASN 12 N -0.16 0.78 -0.20 0.00 2.35 -1.06 -0.72 115.58 116.58 1qym h ASN 12 Ca 0.02 0.04 -0.09 0.00 -0.55 0.00 0.00 56.30 55.71 1qym h ASN 12 Cb 0.41 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1qym h ASN 12 CO 0.01 0.43 -0.18 -0.07 -1.65 0.00 0.00 177.43 175.96 1qym h LEU 13 N 0.85 0.62 -0.32 1.61 3.38 -0.93 0.75 115.31 121.27 1qym h LEU 13 Ca 0.45 -0.20 -0.17 0.00 0.09 0.00 0.00 57.88 58.06 1qym h LEU 13 Cb 0.54 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1qym h LEU 13 CO -0.21 0.81 -0.45 0.00 0.09 0.00 0.00 178.44 178.68 1qym h ALA 14 N 1.25 0.48 -0.38 1.53 0.00 -0.36 -1.76 119.26 120.01 1qym h ALA 14 Ca 0.09 -0.48 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 1qym h ALA 14 Cb 0.62 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1qym h ALA 14 CO 0.04 0.63 0.01 -0.92 0.00 0.00 0.00 179.25 179.01 1qym h TYR 15 N 0.65 0.73 0.00 0.00 3.20 -0.91 -3.00 116.97 117.64 1qym h TYR 15 Ca 0.03 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.77 1qym h TYR 15 Cb 1.05 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 39.13 1qym h TYR 15 CO 0.07 0.75 -0.06 0.77 -1.64 0.00 0.00 178.16 178.05 1qym h SER 16 N 0.50 0.00 0.00 -2.11 0.02 -0.87 -3.46 113.55 107.63 1qym h SER 16 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1qym h SER 16 Cb 0.46 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.00 1qym h SER 16 CO 0.02 0.06 0.00 0.61 -1.14 0.00 0.00 176.83 176.38 1qym n GLY 17 N -1.26 0.72 3.02 -3.77 0.00 -0.92 -4.99 105.19 98.00 1qym n GLY 17 Ca -0.03 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1qym n GLY 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qym n LYS 18 N -2.52 2.71 0.12 1.61 5.02 -0.71 -4.78 118.16 119.60 1qym n LYS 18 Ca 0.00 -2.66 0.08 0.00 -2.02 0.00 0.00 58.31 53.70 1qym n LYS 18 Cb 0.00 -3.32 0.55 0.00 -0.02 0.00 0.00 35.03 32.25 1qym n LYS 18 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1qym h LEU 19 N 11.47 0.20 0.23 -0.35 5.85 -1.94 -2.11 115.31 128.67 1qym h LEU 19 Ca 0.51 -0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.89 1qym h LEU 19 Cb 0.71 -0.05 0.03 0.00 0.37 0.00 0.00 40.66 41.73 1qym h LEU 19 CO 1.76 0.14 -1.50 -0.33 -0.34 0.00 0.00 178.44 178.18 1qym h GLU 20 N 0.24 0.49 0.00 1.25 4.39 -1.97 -2.25 114.58 116.73 1qym h GLU 20 Ca 0.09 -0.84 0.00 0.00 0.34 0.00 0.00 59.36 58.95 1qym h GLU 20 Cb 0.08 0.31 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1qym h GLU 20 CO -0.02 1.40 0.00 1.05 -1.16 0.00 0.00 179.01 180.28 1qym h GLU 21 N 0.13 0.00 -0.27 2.33 4.11 -1.97 -2.53 114.58 116.40 1qym h GLU 21 Ca -0.26 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.11 1qym h GLU 21 Cb 2.14 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.38 1qym h GLU 21 CO 0.25 0.00 -0.07 1.25 0.07 0.00 0.00 179.01 180.51 1qym h LEU 22 N 0.00 0.52 -1.20 3.06 5.85 -1.32 -0.88 115.31 121.35 1qym h LEU 22 Ca 0.00 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 1qym h LEU 22 Cb 0.82 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 1qym h LEU 22 CO 0.00 0.78 0.19 0.11 -0.34 0.00 0.00 178.44 179.17 1qym h LYS 23 N 0.27 0.74 -0.34 1.25 1.57 -1.37 -2.82 116.57 115.88 1qym h LYS 23 Ca 0.07 -0.12 -0.15 0.00 -1.87 0.00 0.00 60.65 58.58 1qym h LYS 23 Cb 0.55 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1qym h LYS 23 CO 0.03 0.63 -0.38 1.49 -0.57 0.00 0.00 179.45 180.65 1qym h GLU 24 N 0.73 0.80 -0.26 3.15 4.81 -1.26 -1.61 114.58 120.94 1qym h GLU 24 Ca 0.17 -0.41 -0.07 0.00 -0.13 0.00 0.00 59.36 58.92 1qym h GLU 24 Cb 0.18 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1qym h GLU 24 CO -0.01 1.04 -0.15 0.77 -0.73 0.00 0.00 179.01 179.93 1qym h SER 25 N 0.66 0.44 0.79 1.04 0.02 -1.04 -3.18 113.55 112.28 1qym h SER 25 Ca 0.06 -0.12 -0.09 0.00 -0.84 0.00 0.00 61.79 60.80 1qym h SER 25 Cb 0.94 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.35 1qym h SER 25 CO 0.09 0.62 -1.27 -0.38 -1.14 0.00 0.00 176.83 174.74 1qym n ILE 26 N -4.19 0.89 -0.10 3.27 5.41 -1.03 -1.73 119.36 121.87 1qym n ILE 26 Ca 0.00 -0.62 -0.10 0.00 1.00 0.00 0.00 62.75 63.03 1qym n ILE 26 Cb 0.33 -0.53 0.04 0.00 -0.71 0.00 0.00 39.64 38.77 1qym n ILE 26 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1qym h LEU 27 N 0.00 0.87 -0.68 1.39 3.38 -1.39 -2.39 115.31 116.49 1qym h LEU 27 Ca -0.09 -0.35 -0.09 0.00 0.09 0.00 0.00 57.88 57.44 1qym h LEU 27 Cb 1.31 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1qym h LEU 27 CO 0.02 1.10 0.03 0.00 0.09 0.00 0.00 178.44 179.69 1qym h ALA 28 N 0.95 0.89 -2.36 1.53 0.00 -1.52 -3.40 119.26 115.36 1qym h ALA 28 Ca 0.08 -0.30 -0.46 0.00 0.00 0.00 0.00 54.91 54.23 1qym h ALA 28 Cb 0.84 -0.23 -0.36 0.00 0.00 0.00 0.00 17.79 18.04 1qym h ALA 28 CO 0.07 0.66 -0.75 0.34 0.00 0.00 0.00 179.25 179.57 1qym s ASP 29 N -6.57 2.31 0.31 0.00 2.15 -0.71 -5.02 116.67 109.15 1qym s ASP 29 Ca -0.11 -1.59 0.07 0.00 0.43 0.00 0.00 52.55 51.35 1qym s ASP 29 Cb 0.14 0.05 0.81 0.00 -0.30 0.00 0.00 42.92 43.63 1qym s ASP 29 CO 0.85 -0.33 1.73 0.07 -0.17 0.00 0.00 175.17 177.32 1qym h LYS 30 N 7.51 0.57 -0.80 4.34 2.10 -1.66 -1.42 116.57 127.21 1qym h LYS 30 Ca -0.02 -0.03 0.23 0.00 -2.00 0.00 0.00 60.65 58.82 1qym h LYS 30 Cb 1.02 -0.13 -0.03 0.00 -0.90 0.00 0.00 32.23 32.19 1qym h LYS 30 CO 0.29 0.38 0.57 0.66 -2.00 0.00 0.00 179.45 179.35 1qym h SER 31 N 0.59 0.03 0.15 7.07 4.64 -1.95 -2.80 113.55 121.27 1qym h SER 31 Ca 0.61 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.91 1qym h SER 31 Cb 1.11 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1qym h SER 31 CO -0.46 0.01 -0.09 -0.07 -0.87 0.00 0.00 176.83 175.35 1qym h LEU 32 N 0.03 0.00 -1.57 5.97 3.38 -1.60 -2.35 115.31 119.16 1qym h LEU 32 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 1qym h LEU 32 Cb 1.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1qym h LEU 32 CO -0.02 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.60 1qym h ALA 33 N 1.91 1.00 0.00 1.53 0.00 -1.70 -2.96 119.26 119.05 1qym h ALA 33 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1qym h ALA 33 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1qym h ALA 33 CO 0.01 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.51 1qym n THR 34 N -2.71 0.27 -2.30 0.00 -2.24 -0.92 -4.53 114.28 101.85 1qym n THR 34 Ca -0.00 -0.60 -0.41 0.00 -2.27 0.00 0.00 64.05 60.77 1qym n THR 34 Cb 0.19 0.92 -0.03 0.00 -2.10 0.00 0.00 70.33 69.31 1qym n THR 34 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1qym s ARG 35 N -0.27 4.42 0.06 -0.78 3.52 -0.99 -4.89 118.95 120.02 1qym s ARG 35 Ca 0.00 1.96 -0.14 0.00 -0.13 0.00 0.00 55.73 57.41 1qym s ARG 35 Cb 0.00 -3.24 -0.06 0.00 -1.56 0.00 0.00 34.95 30.09 1qym s ARG 35 CO 0.00 -0.21 0.46 0.95 -0.81 0.00 0.00 175.30 175.69 1qym s THR 36 N 0.27 4.96 0.00 4.11 -4.23 -1.26 -4.43 115.64 115.06 1qym s THR 36 Ca 0.56 0.82 0.00 0.00 -1.18 0.00 0.00 61.69 61.89 1qym s THR 36 Cb -0.34 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 69.77 1qym s THR 36 CO 0.36 0.45 0.00 -0.90 -0.54 0.00 0.00 174.62 173.98 1qym n ASP 37 N 1.40 0.00 0.12 3.99 5.68 -0.08 -4.86 116.55 122.80 1qym n ASP 37 Ca -0.10 0.00 -0.00 0.00 -0.50 0.00 0.00 54.79 54.18 1qym n ASP 37 Cb 0.52 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.53 1qym n ASP 37 CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 1qym h GLN 38 N 0.00 0.00 -0.39 0.11 3.07 -1.98 -2.46 115.11 113.46 1qym h GLN 38 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1qym h GLN 38 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 1qym h GLN 38 CO 0.00 0.66 0.00 -0.25 0.09 0.00 0.00 178.83 179.33 1qym n ASP 39 N -3.35 1.56 -3.00 0.06 8.00 -1.26 -4.91 116.55 113.65 1qym n ASP 39 Ca 0.01 -2.07 -0.22 0.00 0.71 0.00 0.00 54.79 53.21 1qym n ASP 39 Cb 0.76 -0.26 0.03 0.00 -0.02 0.00 0.00 41.12 41.64 1qym n ASP 39 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1qym n SER 40 N 0.19 -5.99 -4.67 -2.24 7.64 -0.92 -1.12 113.62 106.51 1qym n SER 40 Ca 0.08 -0.28 -0.31 0.00 1.01 0.00 0.00 58.87 59.37 1qym n SER 40 Cb 0.28 -4.86 -0.09 0.00 -1.01 0.00 0.00 64.21 58.54 1qym n SER 40 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1qym s ARG 41 N -5.68 2.63 0.55 1.43 0.52 -1.26 -4.19 118.95 112.94 1qym s ARG 41 Ca 0.29 -0.74 0.07 0.00 -0.52 0.00 0.00 55.73 54.84 1qym s ARG 41 Cb -0.13 -2.58 0.06 0.00 0.52 0.00 0.00 34.95 32.82 1qym s ARG 41 CO 0.36 0.58 0.56 0.95 0.02 0.00 0.00 175.30 177.78 1qym s THR 42 N -1.17 1.91 0.41 0.02 -4.23 -1.26 -0.90 115.64 110.42 1qym s THR 42 Ca 0.22 -1.28 0.19 0.00 -1.18 0.00 0.00 61.69 59.64 1qym s THR 42 Cb -0.11 -2.19 0.40 0.00 1.34 0.00 0.00 72.50 71.93 1qym s THR 42 CO 0.13 0.00 1.80 0.00 -0.54 0.00 0.00 174.62 176.01 1qym h ALA 43 N 0.53 2.28 -0.32 3.99 0.00 -1.80 -2.14 119.26 121.80 1qym h ALA 43 Ca -0.34 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1qym h ALA 43 Cb 1.30 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1qym h ALA 43 CO 0.50 -0.64 0.16 1.25 0.00 0.00 0.00 179.25 180.53 1qym h LEU 44 N 0.37 0.41 -0.54 0.00 5.85 -1.94 -1.20 115.31 118.27 1qym h LEU 44 Ca 0.55 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 59.23 1qym h LEU 44 Cb 1.44 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.30 1qym h LEU 44 CO -0.23 0.41 0.22 0.45 -0.34 0.00 0.00 178.44 178.94 1qym h HIS 45 N 0.39 0.38 -0.03 1.25 3.86 -1.77 -1.35 115.15 117.88 1qym h HIS 45 Ca 0.11 0.03 -0.18 0.00 -1.16 0.00 0.00 60.37 59.17 1qym h HIS 45 Cb 0.09 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1qym h HIS 45 CO -0.02 0.14 -0.76 -1.49 0.86 0.00 0.00 177.93 176.65 1qym h TRP 46 N 0.41 0.32 -0.26 2.45 4.06 -1.39 -0.77 115.95 120.78 1qym h TRP 46 Ca 0.26 -0.15 -0.12 0.00 2.06 0.00 0.00 58.89 60.94 1qym h TRP 46 Cb 0.26 -0.05 -0.01 0.00 -1.00 0.00 0.00 29.16 28.37 1qym h TRP 46 CO -0.15 0.91 -0.34 0.00 -3.56 0.00 0.00 178.44 175.30 1qym h ALA 47 N 1.05 0.93 -0.49 1.49 0.00 -1.01 -2.21 119.26 119.02 1qym h ALA 47 Ca -0.03 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1qym h ALA 47 Cb 1.34 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1qym h ALA 47 CO 0.12 0.62 0.26 0.00 0.00 0.00 0.00 179.25 180.24 1qym h SER 49 N 0.64 1.09 0.75 0.00 0.87 -0.74 -2.00 113.55 114.17 1qym h SER 49 Ca 0.17 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1qym h SER 49 Cb 0.07 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 1qym h SER 49 CO -0.03 0.94 -0.46 0.00 -0.53 0.00 0.00 176.83 176.76 1qym n ALA 50 N -2.43 3.09 -2.29 6.23 0.00 -0.87 -4.94 120.51 119.29 1qym n ALA 50 Ca 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 53.44 53.22 1qym n ALA 50 Cb 0.16 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1qym n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qym n GLY 51 N 1.43 0.45 3.44 0.00 0.00 -0.45 -4.99 105.19 105.07 1qym n GLY 51 Ca 0.05 -0.68 -0.44 0.00 0.00 0.00 0.00 46.02 44.95 1qym n GLY 51 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1qym s HIS 52 N -2.51 3.40 0.23 1.61 4.02 -0.23 -4.89 115.29 116.92 1qym s HIS 52 Ca 0.03 -1.84 -0.06 0.00 1.02 0.00 0.00 55.06 54.21 1qym s HIS 52 Cb -0.01 -4.24 0.33 0.00 -1.02 0.00 0.00 32.58 27.64 1qym s HIS 52 CO 0.04 -1.38 1.81 1.15 1.02 0.00 0.00 174.74 177.38 1qym h THR 53 N 5.12 0.94 -0.34 1.30 2.02 -1.94 -1.94 112.91 118.06 1qym h THR 53 Ca 0.22 -0.26 -0.05 0.00 0.77 0.00 0.00 66.41 67.09 1qym h THR 53 Cb 0.95 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 1qym h THR 53 CO 1.14 0.14 -0.02 -0.08 0.37 0.00 0.00 175.52 177.06 1qym h GLU 54 N 0.75 0.54 -0.06 6.66 4.81 -1.98 0.87 114.58 126.17 1qym h GLU 54 Ca 0.35 -0.12 -0.24 0.00 -0.13 0.00 0.00 59.36 59.22 1qym h GLU 54 Cb 0.28 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.60 1qym h GLU 54 CO -0.22 0.58 -0.91 0.82 -0.73 0.00 0.00 179.01 178.56 1qym h ILE 55 N 0.52 1.31 0.52 2.32 2.04 -1.80 -1.61 117.51 120.80 1qym h ILE 55 Ca 0.11 -2.17 -0.03 0.00 1.00 0.00 0.00 64.86 63.77 1qym h ILE 55 Cb 0.36 2.22 0.01 0.00 -0.74 0.00 0.00 36.82 38.67 1qym h ILE 55 CO 0.01 0.67 -0.25 0.58 0.00 0.00 0.00 178.15 179.17 1qym h VAL 56 N 0.41 0.49 -0.85 1.67 2.07 -1.19 -2.05 116.25 116.80 1qym h VAL 56 Ca -0.09 -0.05 0.20 0.00 0.82 0.00 0.00 66.70 67.58 1qym h VAL 56 Cb 1.54 0.51 -0.06 0.00 -1.52 0.00 0.00 31.29 31.76 1qym h VAL 56 CO 0.18 0.01 0.57 -0.33 0.02 0.00 0.00 177.57 178.02 1qym h GLU 57 N -0.73 0.34 -0.04 1.57 5.08 -0.81 -0.83 114.58 119.17 1qym h GLU 57 Ca -0.07 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1qym h GLU 57 Cb 0.55 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 1qym h GLU 57 CO 0.12 0.22 -0.03 0.35 -1.00 0.00 0.00 179.01 178.67 1qym h PHE 58 N 0.35 0.11 -0.66 4.33 3.57 -1.08 -2.67 116.94 120.89 1qym h PHE 58 Ca 0.43 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.86 1qym h PHE 58 Cb 1.15 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.84 1qym h PHE 58 CO -0.00 0.52 0.23 -0.07 -2.23 0.00 0.00 178.31 176.76 1qym h LEU 59 N -0.33 0.93 -0.58 0.59 3.38 -0.59 -2.63 115.31 116.08 1qym h LEU 59 Ca 0.01 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1qym h LEU 59 Cb 0.50 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1qym h LEU 59 CO 0.01 0.86 0.17 -0.07 0.09 0.00 0.00 178.44 179.49 1qym h LEU 60 N 0.97 0.85 -1.22 1.67 3.38 -1.17 -2.20 115.31 117.60 1qym h LEU 60 Ca 0.22 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1qym h LEU 60 Cb 0.25 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.72 1qym h LEU 60 CO -0.01 0.84 0.55 -0.61 0.09 0.00 0.00 178.44 179.30 1qym h GLN 61 N 0.82 0.93 -0.02 1.13 4.15 -1.33 -2.42 115.11 118.37 1qym h GLN 61 Ca 0.19 -0.06 0.01 0.00 0.77 0.00 0.00 58.65 59.55 1qym h GLN 61 Cb 0.30 -0.21 -0.00 0.00 0.21 0.00 0.00 27.48 27.78 1qym h GLN 61 CO -0.00 0.61 0.03 1.25 -1.93 0.00 0.00 178.83 178.80 1qym h LEU 62 N 0.96 0.00 0.00 -2.39 5.85 -1.02 -3.46 115.31 115.25 1qym h LEU 62 Ca 0.36 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.08 1qym h LEU 62 Cb 0.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1qym h LEU 62 CO -0.13 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.58 1qym n GLY 63 N -1.23 0.96 3.74 3.75 0.00 -0.91 -5.08 105.19 106.42 1qym n GLY 63 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1qym n GLY 63 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qym s VAL 64 N -2.00 2.79 0.39 1.61 -7.23 -1.19 -4.93 120.40 109.85 1qym s VAL 64 Ca 0.00 0.32 -0.27 0.00 -1.81 0.00 0.00 61.98 60.23 1qym s VAL 64 Cb 0.00 -2.75 -0.11 0.00 0.56 0.00 0.00 36.38 34.08 1qym s VAL 64 CO 0.00 -0.27 1.33 -2.65 -0.31 0.00 0.00 175.10 173.20 1qym n PRO 65 N -3.12 2.15 -0.04 4.82 -0.02 -1.26 -4.89 135.00 132.64 1qym n PRO 65 Ca 0.11 0.76 0.02 0.00 -2.02 0.00 0.00 63.50 62.37 1qym n PRO 65 Cb 0.52 -2.44 -0.13 0.00 -0.02 0.00 0.00 33.50 31.42 1qym n PRO 65 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1qym n VAL 66 N 0.06 0.47 -0.07 -1.45 0.31 -1.26 -4.74 118.33 111.66 1qym n VAL 66 Ca 0.05 -0.52 0.05 0.00 -0.01 0.00 0.00 64.34 63.90 1qym n VAL 66 Cb 0.39 -0.18 0.11 0.00 -0.91 0.00 0.00 33.84 33.24 1qym n VAL 66 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1qym n ASN 67 N -2.32 2.61 -4.73 4.52 5.03 -1.26 -4.30 115.26 114.82 1qym n ASN 67 Ca -0.13 -1.91 -0.42 0.00 0.87 0.00 0.00 54.58 53.00 1qym n ASN 67 Cb 0.70 -0.16 -0.03 0.00 -1.02 0.00 0.00 39.78 39.27 1qym n ASN 67 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1qym s ASP 68 N -0.96 6.92 0.13 6.41 1.01 -1.26 -4.81 116.67 124.10 1qym s ASP 68 Ca 0.18 2.32 -0.13 0.00 0.71 0.00 0.00 52.55 55.63 1qym s ASP 68 Cb 0.09 -2.60 -0.07 0.00 1.01 0.00 0.00 42.92 41.36 1qym s ASP 68 CO 0.13 -0.54 0.50 -0.54 0.21 0.00 0.00 175.17 174.93 1qym s LYS 69 N 0.33 3.91 0.69 8.23 1.02 -1.26 -4.22 119.74 128.44 1qym s LYS 69 Ca 0.59 0.39 -0.10 0.00 0.02 0.00 0.00 55.97 56.86 1qym s LYS 69 Cb -0.35 -2.94 0.16 0.00 -0.52 0.00 0.00 37.83 34.17 1qym s LYS 69 CO 0.35 0.50 0.94 -0.40 -0.92 0.00 0.00 175.35 175.82 1qym n ASP 70 N 0.80 0.26 -0.37 2.83 5.68 -0.12 -4.81 116.55 120.81 1qym n ASP 70 Ca -0.06 -1.45 0.31 0.00 -0.50 0.00 0.00 54.79 53.09 1qym n ASP 70 Cb 0.52 -0.70 0.57 0.00 -1.14 0.00 0.00 41.12 40.37 1qym n ASP 70 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1qym h ASP 71 N -1.14 0.36 -0.06 -1.12 5.19 -1.35 0.26 116.42 118.56 1qym h ASP 71 Ca -0.31 0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.29 1qym h ASP 71 Cb 0.89 0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.57 1qym h ASP 71 CO 0.23 -0.24 0.00 0.00 -3.12 0.00 0.00 179.24 176.12 1qym n ALA 72 N -2.37 2.55 -0.67 3.45 0.00 -1.26 -4.94 120.51 117.27 1qym n ALA 72 Ca 0.35 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1qym n ALA 72 Cb 1.23 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1qym n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qym n GLY 73 N 1.18 0.64 3.70 0.00 0.00 0.90 -2.59 105.19 109.02 1qym n GLY 73 Ca 0.18 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 1qym n GLY 73 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qym s TRP 74 N -2.00 3.53 0.62 1.61 0.52 -1.26 -3.71 118.94 118.25 1qym s TRP 74 Ca 0.00 1.38 -0.06 0.00 0.02 0.00 0.00 56.10 57.43 1qym s TRP 74 Cb 0.00 -2.98 0.02 0.00 -1.15 0.00 0.00 33.47 29.36 1qym s TRP 74 CO 0.00 -0.08 0.94 -1.54 0.02 0.00 0.00 176.95 176.28 1qym s SER 75 N 1.00 5.39 0.24 2.95 1.04 -1.26 -0.95 113.70 122.11 1qym s SER 75 Ca 0.42 0.66 -0.06 0.00 0.48 0.00 0.00 55.95 57.45 1qym s SER 75 Cb -0.18 -1.55 0.44 0.00 0.10 0.00 0.00 66.02 64.82 1qym s SER 75 CO 0.18 -1.21 1.70 -0.65 0.98 0.00 0.00 173.24 174.23 1qym h PRO 76 N -0.30 0.29 -0.83 4.02 0.11 -1.75 -2.15 132.00 131.39 1qym h PRO 76 Ca -0.45 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.68 1qym h PRO 76 Cb 1.27 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.26 1qym h PRO 76 CO 0.61 0.19 0.53 1.25 -0.21 0.00 0.00 178.00 180.37 1qym h LEU 77 N 0.30 0.86 -0.33 2.35 5.85 -1.93 -0.03 115.31 122.39 1qym h LEU 77 Ca 0.40 0.00 0.04 0.00 0.84 0.00 0.00 57.88 59.16 1qym h LEU 77 Cb 0.66 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 1qym h LEU 77 CO -0.47 0.58 0.09 0.45 -0.34 0.00 0.00 178.44 178.75 1qym h HIS 78 N 1.01 0.17 -0.65 1.25 3.86 -1.78 -0.17 115.15 118.84 1qym h HIS 78 Ca 0.34 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.54 1qym h HIS 78 Cb 0.05 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.46 1qym h HIS 78 CO -0.03 0.06 0.31 0.82 0.86 0.00 0.00 177.93 179.95 1qym h ILE 79 N 0.22 1.22 -0.02 2.45 2.04 -0.83 -1.42 117.51 121.19 1qym h ILE 79 Ca 0.15 -0.63 -0.20 0.00 1.00 0.00 0.00 64.86 65.18 1qym h ILE 79 Cb 0.14 0.44 0.02 0.00 -0.74 0.00 0.00 36.82 36.68 1qym h ILE 79 CO -0.17 0.26 -0.77 0.00 0.00 0.00 0.00 178.15 177.47 1qym h ALA 80 N 1.14 0.12 -0.17 1.87 0.00 -0.79 -1.31 119.26 120.11 1qym h ALA 80 Ca 0.22 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1qym h ALA 80 Cb 0.12 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1qym h ALA 80 CO -0.03 0.50 0.11 0.00 0.00 0.00 0.00 179.25 179.83 1qym h ALA 81 N 0.37 0.22 -0.43 0.00 0.00 -0.99 -0.60 119.26 117.83 1qym h ALA 81 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1qym h ALA 81 Cb 1.45 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1qym h ALA 81 CO 0.15 -0.29 0.27 1.03 0.00 0.00 0.00 179.25 180.41 1qym h SER 82 N 0.22 0.50 0.98 0.00 0.87 -1.23 -2.88 113.55 112.02 1qym h SER 82 Ca 0.06 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1qym h SER 82 Cb -0.01 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1qym h SER 82 CO -0.01 0.39 0.00 0.00 -0.53 0.00 0.00 176.83 176.68 1qym n ALA 83 N -2.23 2.12 -1.58 6.23 0.00 -0.50 -4.91 120.51 119.65 1qym n ALA 83 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1qym n ALA 83 Cb 0.04 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.08 1qym n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qym n GLY 84 N 1.01 0.88 3.46 0.00 0.00 -0.65 -5.01 105.19 104.88 1qym n GLY 84 Ca 0.05 -0.59 -0.44 0.00 0.00 0.00 0.00 46.02 45.05 1qym n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qym s ARG 85 N -3.33 4.03 0.17 1.61 1.81 -0.33 -4.91 118.95 118.01 1qym s ARG 85 Ca 0.00 -2.50 -0.21 0.00 -1.72 0.00 0.00 55.73 51.30 1qym s ARG 85 Cb 0.00 -5.03 0.09 0.00 -0.45 0.00 0.00 34.95 29.56 1qym s ARG 85 CO 0.00 -1.75 1.61 -0.44 -0.68 0.00 0.00 175.30 174.04 1qym h ASP 86 N 7.34 -0.89 0.51 0.23 5.19 -1.95 -1.21 116.42 125.65 1qym h ASP 86 Ca 0.29 0.18 -0.15 0.00 -0.62 0.00 0.00 57.03 56.73 1qym h ASP 86 Cb 0.89 0.44 -0.01 0.00 0.18 0.00 0.00 39.33 40.83 1qym h ASP 86 CO 1.22 -0.28 -0.66 -0.33 -3.12 0.00 0.00 179.24 176.07 1qym h GLU 87 N -0.18 0.13 -0.39 3.56 5.08 -1.99 -2.40 114.58 118.39 1qym h GLU 87 Ca 0.19 -0.10 -0.11 0.00 -1.00 0.00 0.00 59.36 58.34 1qym h GLU 87 Cb 0.49 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1qym h GLU 87 CO -0.53 0.74 -0.18 0.82 -1.00 0.00 0.00 179.01 178.86 1qym h ILE 88 N 0.09 1.28 -0.59 3.13 2.04 -1.83 -1.10 117.51 120.54 1qym h ILE 88 Ca -0.01 -1.31 0.07 0.00 1.00 0.00 0.00 64.86 64.60 1qym h ILE 88 Cb 1.17 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 38.50 1qym h ILE 88 CO 0.09 0.44 0.28 0.58 0.00 0.00 0.00 178.15 179.54 1qym h VAL 89 N 0.61 0.89 -0.49 1.67 2.07 -1.17 0.22 116.25 120.05 1qym h VAL 89 Ca 0.09 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.44 1qym h VAL 89 Cb 0.73 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1qym h VAL 89 CO 0.06 0.09 0.32 0.50 0.02 0.00 0.00 177.57 178.56 1qym h LYS 90 N 0.52 0.63 -0.42 1.57 3.64 -1.10 -0.31 116.57 121.10 1qym h LYS 90 Ca 0.27 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.57 1qym h LYS 90 Cb 0.24 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1qym h LYS 90 CO -0.22 0.42 0.07 0.00 -2.27 0.00 0.00 179.45 177.45 1qym h ALA 91 N 1.19 0.55 0.14 5.00 0.00 -0.87 -1.88 119.26 123.39 1qym h ALA 91 Ca 0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1qym h ALA 91 Cb -0.06 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1qym h ALA 91 CO -0.05 0.27 -0.07 -0.07 0.00 0.00 0.00 179.25 179.33 1qym h LEU 92 N 0.55 -0.16 -0.64 0.00 4.07 -0.11 -1.02 115.31 117.99 1qym h LEU 92 Ca 0.13 -0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.09 1qym h LEU 92 Cb 0.37 0.04 -0.03 0.00 1.08 0.00 0.00 40.66 42.12 1qym h LEU 92 CO 0.01 -0.11 0.42 -0.07 -1.08 0.00 0.00 178.44 177.61 1qym h LEU 93 N -0.20 0.72 -1.60 1.67 3.38 -1.07 -1.35 115.31 116.87 1qym h LEU 93 Ca -0.02 -0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.04 1qym h LEU 93 Cb 0.16 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1qym h LEU 93 CO 0.03 0.52 0.44 1.23 0.09 0.00 0.00 178.44 180.75 1qym h GLY 94 N 0.85 0.65 -2.83 0.83 0.00 -0.92 -2.27 103.07 99.38 1qym h GLY 94 Ca 0.24 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1qym h GLY 94 CO -0.06 0.10 0.00 0.28 0.00 0.00 0.00 176.54 176.86 1qym n LYS 95 N -4.47 3.80 -0.41 4.80 4.76 -0.42 -4.90 118.16 121.31 1qym n LYS 95 Ca 0.11 -2.27 0.00 0.00 -2.87 0.00 0.00 58.31 53.28 1qym n LYS 95 Cb 0.41 -2.05 0.00 0.00 -1.84 0.00 0.00 35.03 31.55 1qym n LYS 95 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1qym n GLY 96 N 0.47 0.77 3.76 0.72 0.00 -0.85 -4.93 105.19 105.12 1qym n GLY 96 Ca 0.20 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 1qym n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qym n ALA 97 N -0.77 2.12 -2.66 4.61 0.00 -0.72 -4.90 120.51 118.18 1qym n ALA 97 Ca 0.00 0.33 -0.42 0.00 0.00 0.00 0.00 53.44 53.34 1qym n ALA 97 Cb 0.00 -2.38 -0.03 0.00 0.00 0.00 0.00 19.45 17.04 1qym n ALA 97 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1qym s GLN 98 N -2.12 4.26 0.23 0.00 2.00 -1.26 -4.76 119.66 118.00 1qym s GLN 98 Ca 0.55 1.19 0.22 0.00 -2.00 0.00 0.00 55.36 55.32 1qym s GLN 98 Cb -0.49 -3.62 0.04 0.00 0.80 0.00 0.00 33.01 29.74 1qym s GLN 98 CO 0.63 -0.53 1.11 -0.24 -0.50 0.00 0.00 175.29 175.76 1qym h VAL 99 N 5.38 0.04 -0.40 1.34 3.04 -1.91 -3.21 116.25 120.53 1qym h VAL 99 Ca -0.23 -1.07 -0.16 0.00 -1.01 0.00 0.00 66.70 64.24 1qym h VAL 99 Cb 1.09 1.61 -0.09 0.00 -2.01 0.00 0.00 31.29 31.88 1qym h VAL 99 CO 0.92 0.02 0.03 0.59 -1.01 0.00 0.00 177.57 178.12 1qym n ASN 100 N -2.75 3.17 -4.76 3.17 3.02 -1.26 -4.52 115.26 111.32 1qym n ASN 100 Ca -0.00 -3.49 -0.36 0.00 -0.03 0.00 0.00 54.58 50.70 1qym n ASN 100 Cb 0.57 -0.63 0.01 0.00 -0.61 0.00 0.00 39.78 39.12 1qym n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qym s ALA 101 N -3.11 2.73 -0.04 5.41 0.00 -1.21 -4.95 121.76 120.60 1qym s ALA 101 Ca 0.46 0.96 0.05 0.00 0.00 0.00 0.00 51.96 53.43 1qym s ALA 101 Cb 0.39 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 20.09 1qym s ALA 101 CO 0.04 -0.92 -0.20 0.14 0.00 0.00 0.00 175.76 174.82 1qym s VAL 102 N -1.61 1.62 0.13 0.00 -7.23 -1.26 -3.85 120.40 108.21 1qym s VAL 102 Ca 0.72 -0.84 -0.01 0.00 -1.81 0.00 0.00 61.98 60.04 1qym s VAL 102 Cb -0.29 -1.37 0.03 0.00 0.56 0.00 0.00 36.38 35.31 1qym s VAL 102 CO 0.33 0.46 0.18 -0.46 -0.31 0.00 0.00 175.10 175.30 1qym n ASN 103 N 2.94 0.18 0.09 4.85 0.23 -0.76 -4.88 115.26 117.91 1qym n ASN 103 Ca -0.17 -1.17 0.12 0.00 -0.53 0.00 0.00 54.58 52.83 1qym n ASN 103 Cb 0.53 -0.12 0.45 0.00 -2.08 0.00 0.00 39.78 38.56 1qym n ASN 103 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1qym n GLN 104 N -1.34 0.16 0.00 -3.83 6.02 -1.07 -0.87 117.38 116.46 1qym n GLN 104 Ca 0.03 0.28 0.13 0.00 -0.01 0.00 0.00 57.00 57.42 1qym n GLN 104 Cb 0.10 -1.75 0.36 0.00 1.02 0.00 0.00 30.24 29.97 1qym n GLN 104 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1qym n ASN 105 N -2.04 1.07 0.00 1.08 3.02 -1.26 -4.97 115.26 112.15 1qym n ASN 105 Ca 0.04 -0.91 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1qym n ASN 105 Cb 0.30 0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.62 1qym n ASN 105 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qym n GLY 106 N 1.34 0.75 3.70 7.41 0.00 -0.05 -1.59 105.19 116.76 1qym n GLY 106 Ca 0.12 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1qym n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qym s THR 108 N 1.13 3.88 0.39 0.00 -4.23 -1.25 -1.82 115.64 113.74 1qym s THR 108 Ca 0.40 0.61 0.16 0.00 -1.18 0.00 0.00 61.69 61.68 1qym s THR 108 Cb -0.18 -3.49 0.37 0.00 1.34 0.00 0.00 72.50 70.54 1qym s THR 108 CO 0.19 -0.80 1.80 -0.65 -0.54 0.00 0.00 174.62 174.62 1qym h PRO 109 N -0.66 0.44 -0.15 3.99 0.11 -1.80 -2.23 132.00 131.71 1qym h PRO 109 Ca -0.45 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 1qym h PRO 109 Cb 1.23 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1qym h PRO 109 CO 0.61 0.29 -0.29 1.25 -0.21 0.00 0.00 178.00 179.65 1qym h LEU 110 N 0.46 0.28 -0.53 2.35 5.85 -1.94 -0.92 115.31 120.87 1qym h LEU 110 Ca 0.56 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 59.25 1qym h LEU 110 Cb 1.31 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 42.21 1qym h LEU 110 CO -0.28 0.57 0.22 0.45 -0.34 0.00 0.00 178.44 179.07 1qym h HIS 111 N 0.25 0.40 -0.00 1.25 3.86 -1.78 0.10 115.15 119.23 1qym h HIS 111 Ca 0.04 0.02 -0.17 0.00 -1.16 0.00 0.00 60.37 59.10 1qym h HIS 111 Cb 0.65 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 1qym h HIS 111 CO 0.01 0.16 -0.80 1.88 0.86 0.00 0.00 177.93 180.05 1qym h TYR 112 N 0.43 0.12 -0.25 2.45 -1.99 -1.39 -1.62 116.97 114.73 1qym h TYR 112 Ca 0.25 -0.07 -0.04 0.00 2.00 0.00 0.00 58.73 60.87 1qym h TYR 112 Cb 0.23 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 38.93 1qym h TYR 112 CO -0.14 0.84 -0.01 0.00 -0.00 0.00 0.00 178.16 178.86 1qym h ALA 113 N 1.14 0.34 -0.80 3.88 0.00 -0.88 -1.45 119.26 121.49 1qym h ALA 113 Ca -0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1qym h ALA 113 Cb 1.40 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 1qym h ALA 113 CO 0.11 0.09 0.43 0.00 0.00 0.00 0.00 179.25 179.88 1qym h ALA 114 N 0.80 1.02 -0.20 0.00 0.00 -0.74 0.17 119.26 120.32 1qym h ALA 114 Ca 0.07 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.67 1qym h ALA 114 Cb 0.44 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1qym h ALA 114 CO 0.02 0.54 -0.59 1.03 0.00 0.00 0.00 179.25 180.24 1qym h SER 115 N 1.11 0.86 -0.41 0.00 0.87 -1.15 -3.06 113.55 111.76 1qym h SER 115 Ca 0.28 -0.59 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 1qym h SER 115 Cb 0.05 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 61.76 1qym h SER 115 CO -0.04 1.30 0.00 0.29 -0.53 0.00 0.00 176.83 177.84 1qym n LYS 116 N -4.07 2.10 -2.77 2.24 5.02 -0.56 -4.95 118.16 115.18 1qym n LYS 116 Ca -0.06 -1.70 -0.12 0.00 -2.02 0.00 0.00 58.31 54.40 1qym n LYS 116 Cb 0.65 -1.40 0.03 0.00 -0.02 0.00 0.00 35.03 34.28 1qym n LYS 116 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1qym n ASN 117 N 0.89 -4.12 -4.48 4.39 2.85 -0.29 -4.95 115.26 109.54 1qym n ASN 117 Ca 0.17 -0.19 -0.43 0.00 -0.11 0.00 0.00 54.58 54.02 1qym n ASN 117 Cb 0.42 -2.94 -0.01 0.00 1.24 0.00 0.00 39.78 38.49 1qym n ASN 117 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 1qym s ARG 118 N -5.29 3.85 0.25 1.20 1.81 0.45 -4.87 118.95 116.35 1qym s ARG 118 Ca 0.20 -2.07 -0.05 0.00 -1.72 0.00 0.00 55.73 52.10 1qym s ARG 118 Cb -0.09 -5.10 0.27 0.00 -0.45 0.00 0.00 34.95 29.58 1qym s ARG 118 CO 0.25 -1.88 1.83 0.45 -0.68 0.00 0.00 175.30 175.27 1qym h HIS 119 N 8.08 1.10 0.00 -0.53 3.86 -1.93 -0.64 115.15 125.10 1qym h HIS 119 Ca 0.26 -0.07 -0.22 0.00 -1.16 0.00 0.00 60.37 59.18 1qym h HIS 119 Cb 0.94 -0.34 -0.04 0.00 1.06 0.00 0.00 27.41 29.04 1qym h HIS 119 CO 1.18 0.82 -1.57 0.39 0.86 0.00 0.00 177.93 179.61 1qym n GLU 120 N -4.30 0.63 -0.03 2.45 1.02 -1.26 -2.10 120.64 117.04 1qym n GLU 120 Ca 0.07 0.24 -0.13 0.00 -0.02 0.00 0.00 57.16 57.32 1qym n GLU 120 Cb 0.17 -1.79 -0.01 0.00 -0.02 0.00 0.00 31.44 29.79 1qym n GLU 120 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1qym h ILE 121 N 0.00 1.30 -0.38 -3.67 2.04 -1.92 -1.77 117.51 113.11 1qym h ILE 121 Ca -0.22 -1.81 -0.01 0.00 1.00 0.00 0.00 64.86 63.81 1qym h ILE 121 Cb 1.78 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 39.59 1qym h ILE 121 CO 0.06 0.58 0.19 0.00 0.00 0.00 0.00 178.15 178.98 1qym h ALA 122 N 0.78 0.49 -0.30 1.87 0.00 -0.98 -0.36 119.26 120.77 1qym h ALA 122 Ca 0.00 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1qym h ALA 122 Cb 1.18 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1qym h ALA 122 CO 0.12 0.04 0.15 0.28 0.00 0.00 0.00 179.25 179.84 1qym h VAL 123 N 0.48 0.99 -0.70 0.00 2.07 -1.38 -0.20 116.25 117.51 1qym h VAL 123 Ca 0.13 -0.11 0.04 0.00 0.82 0.00 0.00 66.70 67.58 1qym h VAL 123 Cb 0.10 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.47 1qym h VAL 123 CO -0.02 0.06 0.43 0.24 0.02 0.00 0.00 177.57 178.30 1qym h MET 124 N 0.31 0.80 -0.14 1.57 2.07 -0.80 0.12 114.93 118.87 1qym h MET 124 Ca 0.12 -0.05 -0.03 0.00 -2.07 0.00 0.00 59.70 57.67 1qym h MET 124 Cb 0.04 -0.18 -0.00 0.00 -1.87 0.00 0.00 31.60 29.58 1qym h MET 124 CO -0.08 0.53 -0.03 -0.07 1.07 0.00 0.00 176.91 178.33 1qym h LEU 125 N 0.83 0.27 -0.39 1.22 3.38 -0.72 0.49 115.31 120.38 1qym h LEU 125 Ca 0.29 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1qym h LEU 125 Cb 0.07 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1qym h LEU 125 CO -0.13 0.57 0.05 -0.07 0.09 0.00 0.00 178.44 178.95 1qym h LEU 126 N -0.04 0.63 -1.50 1.67 3.38 -0.80 -1.07 115.31 117.57 1qym h LEU 126 Ca 0.04 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 1qym h LEU 126 Cb 0.45 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1qym h LEU 126 CO 0.01 0.74 -0.08 -0.08 0.09 0.00 0.00 178.44 179.13 1qym h GLU 127 N 0.49 0.00 -0.34 1.13 4.22 -0.74 -2.26 114.58 117.09 1qym h GLU 127 Ca 0.12 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.56 1qym h GLU 127 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1qym h GLU 127 CO 0.01 0.08 0.00 0.41 -2.18 0.00 0.00 179.01 177.33 1qym n GLY 128 N -0.08 0.80 0.00 1.92 0.00 0.16 -4.91 105.19 103.08 1qym n GLY 128 Ca -0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1qym n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qym n GLY 129 N 1.18 1.23 3.76 -0.02 0.00 -0.81 -4.91 105.19 105.62 1qym n GLY 129 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1qym n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qym s ALA 130 N -2.00 3.46 -0.31 4.61 0.00 -0.50 -4.88 121.76 122.14 1qym s ALA 130 Ca 0.00 1.07 -0.29 0.00 0.00 0.00 0.00 51.96 52.74 1qym s ALA 130 Cb 0.00 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.72 1qym s ALA 130 CO 0.00 -0.42 1.11 1.21 0.00 0.00 0.00 175.76 177.67 1qym s ASN 131 N -0.49 6.91 0.50 0.00 2.47 -1.26 -4.71 114.94 118.36 1qym s ASN 131 Ca 0.48 1.12 0.29 0.00 0.42 0.00 0.00 52.86 55.17 1qym s ASN 131 Cb -0.36 -2.54 1.03 0.00 -1.45 0.00 0.00 41.25 37.93 1qym s ASN 131 CO 0.45 -0.89 1.86 1.55 -3.72 0.00 0.00 177.10 176.35 1qym h PRO 132 N 8.22 0.00 -0.25 0.43 0.13 -1.92 -3.00 132.00 135.61 1qym h PRO 132 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1qym h PRO 132 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1qym h PRO 132 CO 1.03 0.05 0.00 -0.25 -0.23 0.00 0.00 178.00 178.60 1qym n ASP 133 N -3.15 2.37 -4.62 1.44 8.00 -1.26 -4.34 116.55 114.99 1qym n ASP 133 Ca 0.01 -1.83 -0.55 0.00 0.71 0.00 0.00 54.79 53.14 1qym n ASP 133 Cb 0.39 -0.16 -0.07 0.00 -0.02 0.00 0.00 41.12 41.27 1qym n ASP 133 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qym n ALA 134 N 0.79 -1.03 -2.66 2.24 0.00 -1.14 -4.91 120.51 113.79 1qym n ALA 134 Ca 0.17 0.49 -0.34 0.00 0.00 0.00 0.00 53.44 53.76 1qym n ALA 134 Cb 0.44 -2.08 -0.10 0.00 0.00 0.00 0.00 19.45 17.71 1qym n ALA 134 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1qym s LYS 135 N 1.35 2.87 0.00 0.00 1.02 -1.26 -4.29 119.74 119.44 1qym s LYS 135 Ca 0.90 -0.50 0.00 0.00 0.02 0.00 0.00 55.97 56.39 1qym s LYS 135 Cb -1.04 -2.71 0.00 0.00 -0.52 0.00 0.00 37.83 33.56 1qym s LYS 135 CO 0.54 0.67 0.00 -0.40 -0.92 0.00 0.00 175.35 175.24 1qym n ASP 136 N 1.94 0.00 0.19 2.83 3.85 -0.73 -4.84 116.55 119.79 1qym n ASP 136 Ca -0.17 -0.28 0.13 0.00 -0.71 0.00 0.00 54.79 53.76 1qym n ASP 136 Cb 0.53 0.00 0.40 0.00 -1.35 0.00 0.00 41.12 40.70 1qym n ASP 136 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.20 176.64 1qym h HIS 137 N -0.19 0.00 -0.59 2.11 3.86 -1.53 -1.97 115.15 116.84 1qym h HIS 137 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1qym h HIS 137 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1qym h HIS 137 CO 0.00 0.00 0.00 0.66 0.86 0.00 0.00 177.93 179.45 1qym n TYR 138 N -2.74 1.31 -2.66 2.45 4.01 -1.26 -4.96 117.16 113.31 1qym n TYR 138 Ca 0.03 -0.53 -0.21 0.00 -0.16 0.00 0.00 57.90 57.04 1qym n TYR 138 Cb 0.41 -0.21 0.01 0.00 -0.31 0.00 0.00 39.34 39.23 1qym n TYR 138 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1qym n GLU 139 N 1.02 -2.93 -4.01 -0.72 1.02 -0.74 -1.61 120.64 112.68 1qym n GLU 139 Ca 0.23 0.91 -0.31 0.00 -0.02 0.00 0.00 57.16 57.97 1qym n GLU 139 Cb 0.79 -5.65 -0.06 0.00 -0.02 0.00 0.00 31.44 26.51 1qym n GLU 139 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1qym s ALA 140 N -3.04 3.71 0.48 0.62 0.00 -1.26 -3.89 121.76 118.38 1qym s ALA 140 Ca 0.12 -0.95 0.08 0.00 0.00 0.00 0.00 51.96 51.21 1qym s ALA 140 Cb -0.06 -1.57 0.02 0.00 0.00 0.00 0.00 23.12 21.51 1qym s ALA 140 CO 0.15 0.77 0.51 0.95 0.00 0.00 0.00 175.76 178.15 1qym s THR 141 N -1.41 2.35 0.34 0.00 -4.23 -1.26 -1.77 115.64 109.66 1qym s THR 141 Ca 0.31 -1.24 0.06 0.00 -1.18 0.00 0.00 61.69 59.63 1qym s THR 141 Cb -0.12 -2.60 0.30 0.00 1.34 0.00 0.00 72.50 71.42 1qym s THR 141 CO 0.23 0.00 1.90 0.00 -0.54 0.00 0.00 174.62 176.21 1qym h ALA 142 N 0.70 1.70 -0.05 3.99 0.00 -1.76 -2.44 119.26 121.40 1qym h ALA 142 Ca -0.37 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 1qym h ALA 142 Cb 1.28 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1qym h ALA 142 CO 0.51 0.12 -0.44 1.98 0.00 0.00 0.00 179.25 181.42 1qym h MET 143 N 0.81 0.12 -0.50 0.00 1.85 -1.91 -0.58 114.93 114.73 1qym h MET 143 Ca 0.40 -0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 59.43 1qym h MET 143 Cb 0.46 -0.00 -0.02 0.00 0.43 0.00 0.00 31.60 32.46 1qym h MET 143 CO -0.17 0.55 0.29 0.45 -0.40 0.00 0.00 176.91 177.63 1qym h HIS 144 N 0.10 0.68 -0.26 1.39 -0.00 -1.82 -1.62 115.15 113.63 1qym h HIS 144 Ca 0.01 -0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 60.28 1qym h HIS 144 Cb 0.82 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 28.01 1qym h HIS 144 CO 0.01 0.49 -0.20 0.00 -0.00 0.00 0.00 177.93 178.23 1qym h ARG 145 N 0.67 0.58 -0.42 2.45 2.47 -1.12 -2.25 114.38 116.78 1qym h ARG 145 Ca 0.18 -0.29 -0.06 0.00 -1.26 0.00 0.00 59.98 58.55 1qym h ARG 145 Cb 0.02 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.33 1qym h ARG 145 CO -0.03 0.87 0.02 0.00 0.56 0.00 0.00 179.97 181.39 1qym h ALA 146 N 0.70 0.56 -0.73 0.04 0.00 -1.14 -1.87 119.26 116.82 1qym h ALA 146 Ca 0.05 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1qym h ALA 146 Cb 0.74 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1qym h ALA 146 CO 0.05 0.32 0.41 0.00 0.00 0.00 0.00 179.25 180.03 1qym h ALA 147 N 0.90 0.94 -0.18 0.00 0.00 -1.27 -0.59 119.26 119.07 1qym h ALA 147 Ca 0.12 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1qym h ALA 147 Cb 0.45 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1qym h ALA 147 CO 0.02 0.44 -0.66 0.00 0.00 0.00 0.00 179.25 179.05 1qym h ALA 148 N 1.21 0.50 0.00 0.00 0.00 -1.27 -3.01 119.26 116.68 1qym h ALA 148 Ca 0.26 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1qym h ALA 148 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1qym h ALA 148 CO -0.04 0.70 0.00 0.87 0.00 0.00 0.00 179.25 180.78 1qym h LYS 149 N 0.50 0.00 -3.38 0.00 1.79 -1.21 -3.47 116.57 110.80 1qym h LYS 149 Ca -0.02 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.40 1qym h LYS 149 Cb 1.25 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.94 1qym h LYS 149 CO 0.13 0.00 -0.17 0.41 -1.08 0.00 0.00 179.45 178.74 1qym n GLY 150 N 0.98 0.47 3.06 3.86 0.00 -0.52 -5.02 105.19 108.02 1qym n GLY 150 Ca 0.04 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 1qym n GLY 150 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qym n ASN 151 N -1.78 4.25 0.05 1.61 5.03 -0.34 -4.94 115.26 119.14 1qym n ASN 151 Ca -0.02 -3.16 -0.11 0.00 0.87 0.00 0.00 54.58 52.15 1qym n ASN 151 Cb 0.53 -1.03 -0.05 0.00 -1.02 0.00 0.00 39.78 38.20 1qym n ASN 151 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 1qym h LEU 152 N 5.84 -0.31 -1.18 3.41 5.85 -1.96 -1.63 115.31 125.34 1qym h LEU 152 Ca 0.17 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1qym h LEU 152 Cb 0.79 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 1qym h LEU 152 CO 0.88 -0.15 0.27 0.50 -0.34 0.00 0.00 178.44 179.59 1qym h LYS 153 N -0.18 0.85 -0.25 1.25 3.64 -1.99 -1.90 116.57 117.99 1qym h LYS 153 Ca 0.04 -0.11 -0.05 0.00 -1.27 0.00 0.00 60.65 59.25 1qym h LYS 153 Cb 0.23 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1qym h LYS 153 CO -0.11 0.67 -0.08 1.98 -2.27 0.00 0.00 179.45 179.64 1qym h MET 154 N 0.84 0.39 -0.42 1.90 4.05 -1.83 -2.25 114.93 117.62 1qym h MET 154 Ca 0.21 -0.09 -0.14 0.00 -0.28 0.00 0.00 59.70 59.39 1qym h MET 154 Cb 0.11 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.85 1qym h MET 154 CO -0.03 0.49 -0.29 0.82 0.23 0.00 0.00 176.91 178.14 1qym h ILE 155 N 0.37 1.27 -0.86 1.77 2.04 -0.52 -1.22 117.51 120.37 1qym h ILE 155 Ca 0.08 -1.45 0.02 0.00 1.00 0.00 0.00 64.86 64.50 1qym h ILE 155 Cb 0.39 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 1qym h ILE 155 CO 0.02 0.49 0.57 0.45 0.00 0.00 0.00 178.15 179.68 1qym h HIS 156 N 0.77 1.07 0.22 1.37 3.86 -1.04 -0.37 115.15 121.02 1qym h HIS 156 Ca 0.09 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.31 1qym h HIS 156 Cb 0.86 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.97 1qym h HIS 156 CO 0.05 0.66 -0.10 0.82 0.86 0.00 0.00 177.93 180.22 1qym h ILE 157 N 1.14 0.84 -0.54 2.45 2.04 -1.11 -0.96 117.51 121.38 1qym h ILE 157 Ca 0.32 -0.32 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1qym h ILE 157 Cb -0.10 1.03 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 1qym h ILE 157 CO -0.08 0.07 0.27 -0.07 0.00 0.00 0.00 178.15 178.34 1qym h LEU 158 N -0.45 0.39 -1.07 1.44 3.38 -0.99 -1.89 115.31 116.12 1qym h LEU 158 Ca -0.03 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1qym h LEU 158 Cb 0.34 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1qym h LEU 158 CO 0.05 0.26 -0.01 -0.07 0.09 0.00 0.00 178.44 178.76 1qym h LEU 159 N 0.52 0.62 -0.87 1.67 3.38 -0.96 -1.13 115.31 118.54 1qym h LEU 159 Ca 0.24 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 1qym h LEU 159 Cb 0.15 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1qym h LEU 159 CO -0.17 0.69 -0.18 0.22 0.09 0.00 0.00 178.44 179.10 1qym h TYR 160 N 0.61 0.71 -0.25 1.13 3.20 -0.40 -1.99 116.97 119.97 1qym h TYR 160 Ca 0.12 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1qym h TYR 160 Cb 0.40 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.49 1qym h TYR 160 CO 0.02 0.77 0.00 0.66 -1.64 0.00 0.00 178.16 177.97 1qym n TYR 161 N -4.15 0.78 -2.47 -3.82 4.02 -0.87 -4.90 117.16 105.75 1qym n TYR 161 Ca 0.00 -0.28 -0.04 0.00 -0.01 0.00 0.00 57.90 57.57 1qym n TYR 161 Cb 0.38 -0.22 0.01 0.00 -0.02 0.00 0.00 39.34 39.49 1qym n TYR 161 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1qym n LYS 162 N 0.29 -0.96 -2.18 -0.72 4.76 -0.75 -4.80 118.16 113.80 1qym n LYS 162 Ca 0.11 0.15 -0.37 0.00 -2.87 0.00 0.00 58.31 55.32 1qym n LYS 162 Cb 0.57 -3.32 -0.00 0.00 -1.84 0.00 0.00 35.03 30.43 1qym n LYS 162 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1qym s ALA 163 N -2.76 2.99 0.30 7.82 0.00 -0.46 -4.89 121.76 124.75 1qym s ALA 163 Ca 0.06 1.01 -0.20 0.00 0.00 0.00 0.00 51.96 52.84 1qym s ALA 163 Cb -0.03 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.58 1qym s ALA 163 CO 0.08 -0.76 0.80 -1.12 0.00 0.00 0.00 175.76 174.76 1qym s SER 164 N -1.24 7.02 -0.01 0.00 0.01 -1.26 -4.75 113.70 113.47 1qym s SER 164 Ca 0.64 1.50 0.19 0.00 1.31 0.00 0.00 55.95 59.59 1qym s SER 164 Cb -0.31 -2.45 -0.24 0.00 0.21 0.00 0.00 66.02 63.23 1qym s SER 164 CO 0.38 -0.10 0.69 0.35 0.41 0.00 0.00 173.24 174.97 1qym n THR 165 N 0.22 0.00 -0.58 1.44 -2.24 -1.26 -4.61 114.28 107.25 1qym n THR 165 Ca 0.01 -0.18 0.06 0.00 -2.27 0.00 0.00 64.05 61.67 1qym n THR 165 Cb 0.52 0.70 0.09 0.00 -2.10 0.00 0.00 70.33 69.54 1qym n THR 165 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1qym n ASN 166 N -1.69 2.37 -4.77 3.42 3.02 -1.26 -4.11 115.26 112.24 1qym n ASN 166 Ca 0.01 -2.58 -0.39 0.00 -0.03 0.00 0.00 54.58 51.60 1qym n ASN 166 Cb 0.37 -0.25 -0.01 0.00 -0.61 0.00 0.00 39.78 39.27 1qym n ASN 166 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1qym s ILE 167 N -2.00 2.94 -0.09 2.41 1.01 -1.26 -4.93 121.20 119.28 1qym s ILE 167 Ca 0.19 0.83 0.01 0.00 0.00 0.00 0.00 60.65 61.68 1qym s ILE 167 Cb 0.16 -3.48 -0.02 0.00 0.01 0.00 0.00 42.46 39.13 1qym s ILE 167 CO 0.03 0.11 -0.12 -1.10 0.00 0.00 0.00 174.94 173.86 1qym s GLN 168 N -2.21 2.98 0.50 2.79 -0.21 -1.26 -4.18 119.66 118.06 1qym s GLN 168 Ca 0.56 -0.66 -0.07 0.00 0.02 0.00 0.00 55.36 55.21 1qym s GLN 168 Cb -0.34 -2.55 0.11 0.00 1.00 0.00 0.00 33.01 31.23 1qym s GLN 168 CO 0.43 0.44 0.68 -0.40 -2.12 0.00 0.00 175.29 174.32 1qym n ASP 169 N 2.87 0.20 0.28 5.90 5.68 -0.11 -4.82 116.55 126.55 1qym n ASP 169 Ca -0.18 -1.34 0.14 0.00 -0.50 0.00 0.00 54.79 52.92 1qym n ASP 169 Cb 0.53 -0.50 0.83 0.00 -1.14 0.00 0.00 41.12 40.84 1qym n ASP 169 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1qym h THR 170 N -1.21 0.49 -0.01 2.12 1.35 -1.56 -0.26 112.91 113.83 1qym h THR 170 Ca -0.22 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 1qym h THR 170 Cb 0.64 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 1qym h THR 170 CO 0.17 0.06 -0.10 -0.62 -0.25 0.00 0.00 175.52 174.79 1qym n GLU 171 N -3.66 1.16 -0.54 4.72 1.02 -1.26 -4.93 120.64 117.15 1qym n GLU 171 Ca -0.02 -0.58 0.00 0.00 -0.02 0.00 0.00 57.16 56.53 1qym n GLU 171 Cb 0.17 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 1qym n GLU 171 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qym n GLY 172 N 1.23 0.77 3.74 0.62 0.00 -0.11 -1.43 105.19 110.01 1qym n GLY 172 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1qym n GLY 172 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qym s ASN 173 N -3.00 7.56 0.53 1.61 -0.87 -1.26 -3.80 114.94 115.71 1qym s ASN 173 Ca 0.00 1.89 -0.01 0.00 -1.57 0.00 0.00 52.86 53.16 1qym s ASN 173 Cb 0.00 -2.60 0.01 0.00 -0.02 0.00 0.00 41.25 38.64 1qym s ASN 173 CO 0.00 0.04 0.78 0.42 -2.57 0.00 0.00 177.10 175.77 1qym s THR 174 N -0.60 3.46 0.31 1.60 -4.23 -1.26 -0.94 115.64 113.98 1qym s THR 174 Ca 0.44 -0.40 0.07 0.00 -1.18 0.00 0.00 61.69 60.62 1qym s THR 174 Cb -0.25 -3.32 0.30 0.00 1.34 0.00 0.00 72.50 70.58 1qym s THR 174 CO 0.31 -0.26 1.75 -0.65 -0.54 0.00 0.00 174.62 175.24 1qym h PRO 175 N 0.10 0.65 -0.52 3.99 0.11 -1.75 -1.48 132.00 133.11 1qym h PRO 175 Ca -0.45 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.65 1qym h PRO 175 Cb 1.27 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 1qym h PRO 175 CO 0.57 0.43 0.30 1.25 -0.21 0.00 0.00 178.00 180.35 1qym h LEU 176 N 0.67 0.49 -0.48 2.35 5.85 -1.93 0.13 115.31 122.38 1qym h LEU 176 Ca 0.61 0.01 0.10 0.00 0.84 0.00 0.00 57.88 59.43 1qym h LEU 176 Cb 1.04 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.89 1qym h LEU 176 CO -0.43 0.34 -0.12 0.45 -0.34 0.00 0.00 178.44 178.35 1qym h HIS 177 N 0.60 -0.25 -0.49 1.25 3.86 -1.63 -1.32 115.15 117.17 1qym h HIS 177 Ca 0.21 0.04 -0.11 0.00 -1.16 0.00 0.00 60.37 59.36 1qym h HIS 177 Cb 0.04 0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.68 1qym h HIS 177 CO -0.07 -0.20 -0.11 -0.07 0.86 0.00 0.00 177.93 178.34 1qym h LEU 178 N 0.00 0.95 -0.35 2.43 3.38 -0.88 -0.96 115.31 119.88 1qym h LEU 178 Ca 0.23 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1qym h LEU 178 Cb 0.35 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1qym h LEU 178 CO -0.49 1.09 0.23 0.00 0.09 0.00 0.00 178.44 179.36 1qym h ALA 179 N 0.89 0.45 -0.67 1.53 0.00 -0.68 -1.76 119.26 119.03 1qym h ALA 179 Ca 0.13 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1qym h ALA 179 Cb 0.67 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1qym h ALA 179 CO 0.05 -0.09 0.24 0.00 0.00 0.00 0.00 179.25 179.45 1qym h ASP 181 N 0.97 0.11 -0.68 0.00 -0.00 -0.79 -2.77 116.42 113.27 1qym h ASP 181 Ca 0.22 -0.05 0.00 0.00 -0.00 0.00 0.00 57.03 57.20 1qym h ASP 181 Cb 0.23 -0.03 0.00 0.00 -0.00 0.00 0.00 39.33 39.52 1qym h ASP 181 CO -0.02 0.60 0.00 -0.62 -0.00 0.00 0.00 179.24 179.20 1qym n GLU 182 N -3.94 2.61 -3.64 0.28 -0.58 -0.70 -4.95 120.64 109.72 1qym n GLU 182 Ca -0.02 -2.49 -0.22 0.00 -0.42 0.00 0.00 57.16 54.01 1qym n GLU 182 Cb 0.53 -1.54 0.06 0.00 -0.57 0.00 0.00 31.44 29.92 1qym n GLU 182 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1qym n GLU 183 N 1.54 -6.11 -3.23 3.49 1.02 -0.83 -4.92 120.64 111.61 1qym n GLU 183 Ca 0.23 0.72 -0.45 0.00 -0.02 0.00 0.00 57.16 57.64 1qym n GLU 183 Cb 0.59 -5.57 -0.01 0.00 -0.02 0.00 0.00 31.44 26.43 1qym n GLU 183 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1qym s ARG 184 N -5.97 4.01 0.01 3.49 3.00 -0.19 -4.94 118.95 118.37 1qym s ARG 184 Ca 0.23 -2.84 -0.21 0.00 0.00 0.00 0.00 55.73 52.91 1qym s ARG 184 Cb -0.11 -4.65 -0.12 0.00 0.00 0.00 0.00 34.95 30.07 1qym s ARG 184 CO 0.78 -1.39 1.04 0.28 0.00 0.00 0.00 175.30 176.01 1qym h VAL 185 N 4.25 0.00 -0.14 3.52 2.07 -1.91 -1.80 116.25 122.24 1qym h VAL 185 Ca 0.19 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1qym h VAL 185 Cb 0.92 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1qym h VAL 185 CO 1.01 0.00 0.09 -0.33 0.02 0.00 0.00 177.57 178.36 1qym h GLU 186 N -0.99 0.17 -0.21 1.57 4.39 -1.99 -1.70 114.58 115.82 1qym h GLU 186 Ca -0.08 -0.01 -0.14 0.00 0.34 0.00 0.00 59.36 59.47 1qym h GLU 186 Cb 0.59 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 1qym h GLU 186 CO 0.13 0.11 -0.47 0.93 -1.16 0.00 0.00 179.01 178.55 1qym h GLU 187 N 0.18 0.55 -0.22 2.33 3.07 -1.95 -1.74 114.58 116.81 1qym h GLU 187 Ca 0.05 -0.31 -0.19 0.00 -0.50 0.00 0.00 59.36 58.41 1qym h GLU 187 Cb -0.01 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1qym h GLU 187 CO -0.01 0.91 -0.61 0.00 -1.40 0.00 0.00 179.01 177.90 1qym h ALA 188 N 1.04 0.52 -0.50 3.43 0.00 -0.46 -1.96 119.26 121.33 1qym h ALA 188 Ca 0.03 -0.54 -0.11 0.00 0.00 0.00 0.00 54.91 54.28 1qym h ALA 188 Cb 0.99 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1qym h ALA 188 CO 0.09 0.69 -0.14 0.87 0.00 0.00 0.00 179.25 180.76 1qym h LYS 189 N 0.54 0.96 -0.01 0.00 1.57 -1.26 -1.67 116.57 116.69 1qym h LYS 189 Ca -0.00 -0.36 -0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1qym h LYS 189 Cb 1.20 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 1qym h LYS 189 CO 0.12 1.03 0.01 1.25 -0.57 0.00 0.00 179.45 181.29 1qym h LEU 190 N 0.85 0.02 -0.19 2.94 5.85 -1.22 -1.05 115.31 122.50 1qym h LEU 190 Ca 0.13 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.78 1qym h LEU 190 Cb 0.69 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.65 1qym h LEU 190 CO 0.05 0.13 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.03 1qym h LEU 191 N -0.10 -0.58 -1.35 2.25 3.38 -1.25 -2.59 115.31 115.07 1qym h LEU 191 Ca 0.01 0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1qym h LEU 191 Cb 0.12 0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1qym h LEU 191 CO -0.00 -0.23 0.05 0.58 0.09 0.00 0.00 178.44 178.93 1qym h VAL 192 N -0.20 1.17 0.00 1.22 2.07 -1.04 -1.82 116.25 117.65 1qym h VAL 192 Ca 0.12 -0.63 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 1qym h VAL 192 Cb 0.38 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1qym h VAL 192 CO -0.31 0.22 -0.24 0.77 0.02 0.00 0.00 177.57 178.03 1qym h SER 193 N 0.48 0.00 -0.69 0.57 4.64 -0.82 -2.55 113.55 115.18 1qym h SER 193 Ca 0.11 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.06 1qym h SER 193 Cb 0.23 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.11 1qym h SER 193 CO 0.00 0.24 0.28 0.00 -0.87 0.00 0.00 176.83 176.48 1qym n GLN 194 N -3.56 2.10 -0.24 4.77 1.13 -0.85 -4.96 117.38 115.77 1qym n GLN 194 Ca -0.01 -3.14 0.00 0.00 -1.94 0.00 0.00 57.00 51.91 1qym n GLN 194 Cb 0.38 -2.02 0.00 0.00 0.11 0.00 0.00 30.24 28.71 1qym n GLN 194 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1qym n GLY 195 N -1.12 0.62 3.69 1.08 0.00 -0.96 -4.95 105.19 103.56 1qym n GLY 195 Ca 0.47 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.05 1qym n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qym n ALA 196 N -1.27 1.54 -2.38 4.61 0.00 -0.74 -4.92 120.51 117.34 1qym n ALA 196 Ca 0.00 0.40 -0.40 0.00 0.00 0.00 0.00 53.44 53.44 1qym n ALA 196 Cb 0.00 -2.33 -0.05 0.00 0.00 0.00 0.00 19.45 17.07 1qym n ALA 196 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1qym s SER 197 N 0.36 7.17 0.00 0.00 0.15 -1.26 -4.51 113.70 115.60 1qym s SER 197 Ca 0.67 1.39 0.25 0.00 0.70 0.00 0.00 55.95 58.96 1qym s SER 197 Cb -0.60 -2.44 0.76 0.00 -1.71 0.00 0.00 66.02 62.02 1qym s SER 197 CO 0.49 0.06 1.57 2.30 1.20 0.00 0.00 173.24 178.86 1qym n ILE 198 N 2.66 0.11 -0.07 6.45 -5.35 -1.26 -4.26 119.36 117.64 1qym n ILE 198 Ca -0.04 -0.37 -0.03 0.00 -0.27 0.00 0.00 62.75 62.04 1qym n ILE 198 Cb 0.50 0.67 -0.15 0.00 -1.74 0.00 0.00 39.64 38.93 1qym n ILE 198 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1qym n TYR 199 N 0.54 0.00 -1.72 4.28 4.02 -1.26 -4.32 117.16 118.71 1qym n TYR 199 Ca 0.17 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.64 1qym n TYR 199 Cb 0.41 -0.76 -0.03 0.00 -0.02 0.00 0.00 39.34 38.95 1qym n TYR 199 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1qym n ILE 200 N -2.52 0.12 -3.58 -0.72 5.41 -1.26 -4.80 119.36 112.01 1qym n ILE 200 Ca -0.22 -0.03 -0.36 0.00 1.00 0.00 0.00 62.75 63.14 1qym n ILE 200 Cb 0.91 -1.95 -0.07 0.00 -0.71 0.00 0.00 39.64 37.83 1qym n ILE 200 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1qym s GLU 201 N 0.95 4.17 1.06 0.38 2.02 -1.26 -4.13 118.70 121.88 1qym s GLU 201 Ca 0.74 0.07 -0.15 0.00 0.02 0.00 0.00 54.97 55.65 1qym s GLU 201 Cb -0.52 -3.39 0.22 0.00 0.10 0.00 0.00 34.13 30.54 1qym s GLU 201 CO 0.35 0.31 1.11 0.54 0.02 0.00 0.00 175.26 177.59 1qym s ASN 202 N 0.25 2.14 0.00 -0.19 2.20 -0.49 -4.82 114.94 114.03 1qym s ASN 202 Ca 0.16 0.96 0.02 0.00 -0.94 0.00 0.00 52.86 53.06 1qym s ASN 202 Cb -0.13 -1.47 0.08 0.00 -2.00 0.00 0.00 41.25 37.73 1qym s ASN 202 CO 0.04 -3.40 1.06 0.29 -2.94 0.00 0.00 177.10 172.15 1qym n LYS 203 N -4.32 0.00 -0.22 3.55 5.02 -0.51 0.21 118.16 121.89 1qym n LYS 203 Ca 0.08 0.47 0.08 0.00 -2.02 0.00 0.00 58.31 56.91 1qym n LYS 203 Cb 0.58 -1.50 0.22 0.00 -0.02 0.00 0.00 35.03 34.31 1qym n LYS 203 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1qym n GLU 204 N -1.50 2.04 -1.85 1.97 1.02 -1.26 -4.96 120.64 116.11 1qym n GLU 204 Ca 0.00 -1.61 -0.18 0.00 -0.02 0.00 0.00 57.16 55.35 1qym n GLU 204 Cb 0.02 -1.36 -0.05 0.00 -0.02 0.00 0.00 31.44 30.03 1qym n GLU 204 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1qym n GLU 205 N 0.81 -1.34 -4.22 3.49 1.02 0.13 -5.02 120.64 115.52 1qym n GLU 205 Ca 0.15 1.04 -0.36 0.00 -0.02 0.00 0.00 57.16 57.98 1qym n GLU 205 Cb 0.39 -5.41 -0.08 0.00 -0.02 0.00 0.00 31.44 26.32 1qym n GLU 205 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1qym s LYS 206 N -4.08 3.15 0.58 3.49 1.02 -1.25 -4.84 119.74 117.81 1qym s LYS 206 Ca 0.00 -0.32 -0.05 0.00 0.02 0.00 0.00 55.97 55.61 1qym s LYS 206 Cb 0.00 -2.92 0.01 0.00 -0.52 0.00 0.00 37.83 34.40 1qym s LYS 206 CO 0.00 0.71 0.88 0.95 -0.92 0.00 0.00 175.35 176.97 1qym s THR 207 N -0.88 3.60 0.46 2.17 -4.23 -1.26 -1.40 115.64 114.09 1qym s THR 207 Ca 0.13 -0.07 0.21 0.00 -1.18 0.00 0.00 61.69 60.78 1qym s THR 207 Cb -0.12 -3.42 0.40 0.00 1.34 0.00 0.00 72.50 70.70 1qym s THR 207 CO 0.03 -0.42 1.89 -0.65 -0.54 0.00 0.00 174.62 174.93 1qym h PRO 208 N -0.14 0.27 -0.65 3.99 0.11 -1.75 -0.16 132.00 133.67 1qym h PRO 208 Ca -0.45 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 1qym h PRO 208 Cb 1.26 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1qym h PRO 208 CO 0.60 0.18 0.18 -0.07 -0.21 0.00 0.00 178.00 178.68 1qym h LEU 209 N 0.28 0.97 -0.91 2.35 3.38 -1.93 -1.46 115.31 117.99 1qym h LEU 209 Ca 0.41 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 58.06 1qym h LEU 209 Cb 1.19 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 1qym h LEU 209 CO -0.11 0.93 -0.51 1.56 0.09 0.00 0.00 178.44 180.40 1qym h GLN 210 N 0.96 0.00 0.00 1.13 4.20 -1.41 -2.10 115.11 117.88 1qym h GLN 210 Ca 0.21 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.86 1qym h GLN 210 Cb 0.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1qym h GLN 210 CO -0.00 0.51 -0.27 0.28 -0.67 0.00 0.00 178.83 178.68 1qym h VAL 211 N 0.00 0.51 -4.06 -0.54 2.07 -1.27 -3.47 116.25 109.50 1qym h VAL 211 Ca -0.01 -1.54 -0.48 0.00 0.82 0.00 0.00 66.70 65.50 1qym h VAL 211 Cb 0.96 2.11 0.03 0.00 -1.52 0.00 0.00 31.29 32.87 1qym h VAL 211 CO 0.07 0.27 0.40 0.00 0.02 0.00 0.00 177.57 178.32 1qym s ALA 212 N -3.23 2.87 0.51 1.67 0.00 -0.56 -4.43 121.76 118.59 1qym s ALA 212 Ca 0.04 0.67 0.02 0.00 0.00 0.00 0.00 51.96 52.69 1qym s ALA 212 Cb 0.08 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 1qym s ALA 212 CO 0.69 -0.39 0.03 0.15 0.00 0.00 0.00 175.76 176.24 1qym s LYS 213 N -3.12 2.19 -1.02 0.00 -0.14 -1.26 -4.77 119.74 111.62 1qym s LYS 213 Ca 0.67 -2.36 -0.11 0.00 -1.36 0.00 0.00 55.97 52.81 1qym s LYS 213 Cb -0.19 -1.58 0.10 0.00 -1.68 0.00 0.00 37.83 34.48 1qym s LYS 213 CO 0.23 -0.37 0.34 0.41 -0.76 0.00 0.00 175.35 175.20 1qym n GLY 214 N -1.29 -0.46 3.22 -3.33 0.00 -1.26 -0.83 105.19 101.24 1qym n GLY 214 Ca -0.17 0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 1qym n GLY 214 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qym n GLY 215 N -0.88 -0.50 0.26 -0.02 0.00 -1.26 -4.84 105.19 97.94 1qym n GLY 215 Ca 0.03 0.10 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 1qym n GLY 215 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1qym h LEU 216 N -1.08 0.94 -1.51 0.99 6.46 -1.32 -3.09 115.31 116.70 1qym h LEU 216 Ca -0.46 -0.44 0.14 0.00 -0.12 0.00 0.00 57.88 57.01 1qym h LEU 216 Cb 1.31 -0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 40.92 1qym h LEU 216 CO 0.54 1.18 0.52 1.23 -0.62 0.00 0.00 178.44 181.29 1qym h GLY 217 N 0.70 0.82 0.90 3.75 0.00 -1.84 -0.07 103.07 107.34 1qym h GLY 217 Ca 0.07 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1qym h GLY 217 CO 0.08 0.07 0.10 -2.00 0.00 0.00 0.00 176.54 174.79 1qym h LEU 218 N 0.49 0.33 -0.02 3.11 5.85 -1.91 0.03 115.31 123.19 1qym h LEU 218 Ca 0.38 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.97 1qym h LEU 218 Cb 0.80 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1qym h LEU 218 CO -0.14 0.41 -0.18 0.40 -0.34 0.00 0.00 178.44 178.59 1qym h ILE 219 N 0.24 0.57 -0.78 4.05 2.04 -1.02 -1.70 117.51 120.92 1qym h ILE 219 Ca 0.08 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.98 1qym h ILE 219 Cb 0.18 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 36.78 1qym h ILE 219 CO -0.01 0.00 0.49 -0.07 0.00 0.00 0.00 178.15 178.56 1qym h LEU 220 N -0.27 0.79 -1.32 1.44 4.07 -1.22 -2.15 115.31 116.64 1qym h LEU 220 Ca 0.06 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 1qym h LEU 220 Cb 0.36 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.90 1qym h LEU 220 CO -0.18 0.54 0.38 0.50 -1.08 0.00 0.00 178.44 178.60 1qym h LYS 221 N 0.94 0.84 0.00 1.13 3.64 -0.56 -2.58 116.57 119.98 1qym h LYS 221 Ca 0.32 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.48 1qym h LYS 221 Cb 0.06 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1qym h LYS 221 CO -0.13 0.59 -0.74 0.00 -2.27 0.00 0.00 179.45 176.90 1qym h ARG 222 N 0.86 0.00 -0.85 1.90 2.47 -1.01 0.61 114.38 118.36 1qym h ARG 222 Ca 0.23 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.92 1qym h ARG 222 Cb -0.05 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.23 1qym h ARG 222 CO -0.04 0.74 0.44 0.52 0.56 0.00 0.00 179.97 182.19 1qym h MET 223 N 0.00 1.20 0.05 0.04 2.86 -1.01 -2.78 114.93 115.29 1qym h MET 223 Ca -0.01 -0.16 -0.35 0.00 -2.06 0.00 0.00 59.70 57.13 1qym h MET 223 Cb 1.55 -0.23 -0.04 0.00 0.06 0.00 0.00 31.60 32.94 1qym h MET 223 CO 0.10 0.90 -2.04 0.28 1.06 0.00 0.00 176.91 177.20 1qym n VAL 224 N -4.32 1.63 0.48 -2.22 0.31 -1.05 -4.58 118.33 108.59 1qym n VAL 224 Ca 0.09 -0.71 0.06 0.00 -0.01 0.00 0.00 64.34 63.76 1qym n VAL 224 Cb 0.12 -1.31 0.02 0.00 -0.91 0.00 0.00 33.84 31.77 1qym n VAL 224 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1qym n GLU 225 N -3.22 1.29 0.00 5.55 1.02 0.19 -5.12 120.64 120.36 1qym n GLU 225 Ca -0.30 -0.92 0.00 0.00 -0.02 0.00 0.00 57.16 55.92 1qym n GLU 225 Cb 1.05 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 31.31 1qym n GLU 225 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72