#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qmd s ASP 2 N 0.00 5.91 -0.09 -0.99 -1.08 -1.26 -4.86 116.67 114.30 1qmd s ASP 2 Ca 0.00 1.47 -0.32 0.00 -0.52 0.00 0.00 52.55 53.18 1qmd s ASP 2 Cb 0.00 -2.45 0.12 0.00 -1.46 0.00 0.00 42.92 39.13 1qmd s ASP 2 CO 0.00 -1.08 1.07 -0.83 0.52 0.00 0.00 175.17 174.85 1qmd s GLY 3 N -4.07 -0.37 0.10 2.66 0.00 -1.26 -2.02 107.32 102.36 1qmd s GLY 3 Ca 0.56 1.24 0.09 0.00 0.00 0.00 0.00 44.72 46.61 1qmd s GLY 3 CO 0.54 0.41 -0.22 0.54 0.00 0.00 0.00 173.10 174.36 1qmd s LYS 4 N -2.75 1.25 0.55 2.90 -0.14 0.23 -4.97 119.74 116.82 1qmd s LYS 4 Ca 0.08 -1.16 0.25 0.00 -1.36 0.00 0.00 55.97 53.78 1qmd s LYS 4 Cb -0.01 -1.53 1.48 0.00 -1.68 0.00 0.00 37.83 36.09 1qmd s LYS 4 CO -0.06 0.37 2.07 0.97 -0.76 0.00 0.00 175.35 177.94 1qmd h ILE 5 N 4.09 0.68 -0.01 2.17 2.10 -1.86 -1.93 117.51 122.74 1qmd h ILE 5 Ca -0.47 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.47 1qmd h ILE 5 Cb 1.17 0.83 0.00 0.00 -1.09 0.00 0.00 36.82 37.74 1qmd h ILE 5 CO 0.40 0.00 0.00 -0.90 -1.08 0.00 0.00 178.15 176.57 1qmd n ASP 6 N -4.16 0.95 -0.96 2.19 5.75 -1.26 -4.82 116.55 114.23 1qmd n ASP 6 Ca 0.04 -2.01 -0.07 0.00 -0.01 0.00 0.00 54.79 52.74 1qmd n ASP 6 Cb 0.38 -0.45 0.01 0.00 -1.03 0.00 0.00 41.12 40.03 1qmd n ASP 6 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qmd n GLY 7 N 0.07 0.23 3.48 6.12 0.00 -0.73 -4.88 105.19 109.48 1qmd n GLY 7 Ca 0.00 -0.55 -0.23 0.00 0.00 0.00 0.00 46.02 45.25 1qmd n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qmd s THR 8 N -2.57 1.36 0.00 2.61 -4.23 -1.20 -4.59 115.64 107.01 1qmd s THR 8 Ca 0.06 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 1qmd s THR 8 Cb -0.03 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 71.00 1qmd s THR 8 CO 0.07 -0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.74 1qmd n GLY 9 N -0.73 -2.45 0.22 3.99 0.00 -1.26 -0.60 105.19 104.36 1qmd n GLY 9 Ca -0.03 -2.14 -0.02 0.00 0.00 0.00 0.00 46.02 43.83 1qmd n GLY 9 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1qmd h THR 10 N 0.00 0.44 -0.88 2.61 2.02 -1.87 -1.23 112.91 113.99 1qmd h THR 10 Ca 0.00 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.28 1qmd h THR 10 Cb 0.00 0.44 -0.06 0.00 -1.74 0.00 0.00 68.15 66.78 1qmd h THR 10 CO 0.00 0.00 0.57 0.45 0.37 0.00 0.00 175.52 176.91 1qmd h HIS 11 N -0.01 0.94 -0.16 3.16 -0.00 -1.69 -1.19 115.15 116.20 1qmd h HIS 11 Ca 0.26 0.03 -0.16 0.00 -0.00 0.00 0.00 60.37 60.50 1qmd h HIS 11 Cb 0.41 -0.31 0.00 0.00 -0.00 0.00 0.00 27.41 27.52 1qmd h HIS 11 CO -0.47 0.44 -0.51 0.00 -0.00 0.00 0.00 177.93 177.39 1qmd h ALA 12 N 1.56 0.28 -0.91 2.45 0.00 -1.50 -3.03 119.26 118.11 1qmd h ALA 12 Ca 0.41 -0.50 0.07 0.00 0.00 0.00 0.00 54.91 54.89 1qmd h ALA 12 Cb 0.40 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 1qmd h ALA 12 CO -0.17 0.47 0.57 1.98 0.00 0.00 0.00 179.25 182.10 1qmd h MET 13 N 0.31 0.98 -0.27 0.00 4.05 -0.75 -0.32 114.93 118.92 1qmd h MET 13 Ca -0.02 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1qmd h MET 13 Cb 1.14 -0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 31.70 1qmd h MET 13 CO 0.11 0.65 0.15 0.82 0.23 0.00 0.00 176.91 178.87 1qmd h ILE 14 N 1.01 1.12 -0.23 1.77 2.04 -1.18 0.61 117.51 122.64 1qmd h ILE 14 Ca 0.41 -0.30 -0.20 0.00 1.00 0.00 0.00 64.86 65.77 1qmd h ILE 14 Cb 0.23 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1qmd h ILE 14 CO -0.19 0.11 -0.64 -0.37 0.00 0.00 0.00 178.15 177.06 1qmd h VAL 15 N 0.33 1.28 -0.30 1.67 -1.51 -1.36 -0.59 116.25 115.76 1qmd h VAL 15 Ca 0.10 -1.84 0.02 0.00 -1.23 0.00 0.00 66.70 63.75 1qmd h VAL 15 Cb 0.05 1.78 -0.02 0.00 -2.13 0.00 0.00 31.29 30.97 1qmd h VAL 15 CO -0.02 0.59 0.15 0.74 -1.23 0.00 0.00 177.57 177.80 1qmd h THR 16 N 0.60 0.99 0.00 7.19 2.02 -0.93 0.37 112.91 123.14 1qmd h THR 16 Ca -0.01 -0.11 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 1qmd h THR 16 Cb 1.25 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 1qmd h THR 16 CO 0.14 0.06 -0.29 1.56 0.37 0.00 0.00 175.52 177.35 1qmd h GLN 17 N 0.31 0.00 -0.69 6.66 1.08 -0.87 -2.19 115.11 119.41 1qmd h GLN 17 Ca 0.12 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.33 1qmd h GLN 17 Cb 0.04 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 1qmd h GLN 17 CO -0.09 0.29 0.46 0.78 -0.95 0.00 0.00 178.83 179.33 1qmd h GLY 18 N 1.21 0.98 0.89 3.46 0.00 0.68 0.76 103.07 111.04 1qmd h GLY 18 Ca -0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 46.88 1qmd h GLY 18 CO 0.04 0.35 -0.18 -2.08 0.00 0.00 0.00 176.54 174.67 1qmd h VAL 19 N 0.94 1.31 -0.88 4.60 2.07 -0.62 -2.73 116.25 120.94 1qmd h VAL 19 Ca 0.26 -1.30 0.01 0.00 0.82 0.00 0.00 66.70 66.49 1qmd h VAL 19 Cb -0.10 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 1qmd h VAL 19 CO -0.06 0.41 0.58 0.28 0.02 0.00 0.00 177.57 178.80 1qmd h SER 20 N 0.29 1.00 -0.56 0.57 0.02 -1.12 -0.69 113.55 113.06 1qmd h SER 20 Ca 0.05 -0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.03 1qmd h SER 20 Cb 0.71 -0.25 -0.05 0.00 0.14 0.00 0.00 62.40 62.95 1qmd h SER 20 CO 0.05 0.72 0.28 0.40 -1.14 0.00 0.00 176.83 177.14 1qmd h ILE 21 N 1.18 0.94 -0.46 3.27 2.04 -0.79 -1.13 117.51 122.56 1qmd h ILE 21 Ca 0.32 -0.18 -0.12 0.00 1.00 0.00 0.00 64.86 65.88 1qmd h ILE 21 Cb -0.12 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.30 1qmd h ILE 21 CO -0.07 0.10 -0.18 -0.07 0.00 0.00 0.00 178.15 177.92 1qmd h LEU 22 N 0.53 0.90 -1.04 1.44 3.38 -1.02 -0.32 115.31 119.19 1qmd h LEU 22 Ca 0.25 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 57.97 1qmd h LEU 22 Cb 0.18 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.61 1qmd h LEU 22 CO -0.18 1.07 0.64 -0.33 0.09 0.00 0.00 178.44 179.72 1qmd h GLU 23 N 0.79 1.11 0.21 1.13 4.39 -0.47 0.11 114.58 121.84 1qmd h GLU 23 Ca 0.11 -0.07 -0.33 0.00 0.34 0.00 0.00 59.36 59.42 1qmd h GLU 23 Cb 0.72 -0.25 0.03 0.00 -0.10 0.00 0.00 28.75 29.14 1qmd h GLU 23 CO 0.06 0.73 -1.47 -0.91 -1.16 0.00 0.00 179.01 176.25 1qmd h ASN 24 N 1.14 0.70 1.29 1.42 2.35 -1.00 -3.37 115.58 118.12 1qmd h ASN 24 Ca 0.43 -0.80 -0.10 0.00 -0.55 0.00 0.00 56.30 55.28 1qmd h ASN 24 Cb 0.19 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 1qmd h ASN 24 CO -0.17 1.63 -0.74 0.44 -1.65 0.00 0.00 177.43 176.94 1qmd h ASP 25 N 0.12 0.00 -1.70 5.81 3.32 -0.83 -3.47 116.42 119.67 1qmd h ASP 25 Ca -0.24 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.14 1qmd h ASP 25 Cb 2.11 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.67 1qmd h ASP 25 CO 0.24 0.41 1.09 -0.11 -1.72 0.00 0.00 179.24 179.15 1qmd n LEU 26 N -3.06 2.87 -4.79 1.55 7.94 0.37 -1.10 117.00 120.77 1qmd n LEU 26 Ca -0.01 0.90 -0.31 0.00 -1.11 0.00 0.00 56.01 55.48 1qmd n LEU 26 Cb 0.72 -1.27 0.06 0.00 0.53 0.00 0.00 43.42 43.45 1qmd n LEU 26 CO 0.40 -0.30 0.71 -0.94 -1.11 0.00 0.00 177.39 176.15 1qmd s SER 27 N 4.52 5.11 0.19 1.96 1.04 -1.26 -4.84 113.70 120.42 1qmd s SER 27 Ca 0.98 1.76 -0.12 0.00 0.48 0.00 0.00 55.95 59.05 1qmd s SER 27 Cb -0.85 -2.52 0.19 0.00 0.10 0.00 0.00 66.02 62.95 1qmd s SER 27 CO 0.56 -1.62 1.78 0.50 0.98 0.00 0.00 173.24 175.43 1qmd h LYS 28 N -0.61 0.49 0.00 4.02 1.63 -2.01 -2.67 116.57 117.42 1qmd h LYS 28 Ca -0.44 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.33 1qmd h LYS 28 Cb 1.22 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.74 1qmd h LYS 28 CO 0.55 0.32 0.00 0.27 -3.45 0.00 0.00 179.45 177.14 1qmd n ASN 29 N -4.90 0.00 -4.76 4.20 2.04 -1.26 -4.89 115.26 105.69 1qmd n ASN 29 Ca 0.06 -1.62 -0.39 0.00 -0.44 0.00 0.00 54.58 52.19 1qmd n ASN 29 Cb 0.18 0.00 0.02 0.00 -2.53 0.00 0.00 39.78 37.45 1qmd n ASN 29 CO 0.00 0.00 0.00 -1.61 -0.44 0.00 0.00 177.26 175.21 1qmd s GLU 30 N -2.00 3.51 0.40 -3.83 0.41 -1.01 -4.92 118.70 111.26 1qmd s GLU 30 Ca 0.07 2.19 -0.26 0.00 -0.41 0.00 0.00 54.97 56.57 1qmd s GLU 30 Cb 0.03 -2.46 -0.11 0.00 -1.78 0.00 0.00 34.13 29.82 1qmd s GLU 30 CO 0.05 -0.88 1.18 -2.30 -0.49 0.00 0.00 175.26 172.82 1qmd n PRO 31 N -0.55 1.74 -0.04 0.39 -0.02 -1.26 -4.86 135.00 130.40 1qmd n PRO 31 Ca 0.07 0.62 0.06 0.00 -2.02 0.00 0.00 63.50 62.23 1qmd n PRO 31 Cb 0.44 -2.24 0.43 0.00 -0.02 0.00 0.00 33.50 32.12 1qmd n PRO 31 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1qmd h GLU 32 N 1.98 0.54 -0.68 -0.52 4.81 -1.96 -1.92 114.58 116.83 1qmd h GLU 32 Ca -0.46 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.71 1qmd h GLU 32 Cb 1.31 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 1qmd h GLU 32 CO 0.59 0.36 0.33 0.66 -0.73 0.00 0.00 179.01 180.22 1qmd h SER 33 N 0.56 0.88 0.48 1.04 4.64 -1.96 0.24 113.55 119.42 1qmd h SER 33 Ca 0.19 -0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 61.36 1qmd h SER 33 Cb 0.09 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 1qmd h SER 33 CO -0.05 0.76 -0.23 0.58 -0.87 0.00 0.00 176.83 177.03 1qmd h VAL 34 N 0.94 0.53 0.00 0.95 2.07 -1.65 0.34 116.25 119.43 1qmd h VAL 34 Ca 0.23 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.64 1qmd h VAL 34 Cb 0.11 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1qmd h VAL 34 CO -0.03 0.01 -0.19 0.08 0.02 0.00 0.00 177.57 177.46 1qmd h ARG 35 N -0.68 0.00 -0.07 1.57 0.11 -1.42 -0.46 114.38 113.42 1qmd h ARG 35 Ca -0.07 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.83 1qmd h ARG 35 Cb 0.51 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.60 1qmd h ARG 35 CO 0.11 0.19 -0.66 -0.22 0.10 0.00 0.00 179.97 179.49 1qmd h LYS 36 N 0.00 0.57 0.00 0.08 3.64 -0.61 -2.75 116.57 117.50 1qmd h LYS 36 Ca -0.00 -0.52 -0.07 0.00 -1.27 0.00 0.00 60.65 58.79 1qmd h LYS 36 Cb 0.42 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1qmd h LYS 36 CO 0.02 1.15 -0.33 -0.91 -2.27 0.00 0.00 179.45 177.11 1qmd h ASN 37 N 0.18 0.00 -0.45 4.20 2.35 0.21 -2.36 115.58 119.72 1qmd h ASN 37 Ca -0.06 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.59 1qmd h ASN 37 Cb 1.32 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.68 1qmd h ASN 37 CO 0.13 0.33 -0.09 0.25 -1.65 0.00 0.00 177.43 176.40 1qmd h LEU 38 N 0.00 0.90 -0.79 1.61 5.85 -1.03 -1.39 115.31 120.46 1qmd h LEU 38 Ca -0.00 -0.28 -0.06 0.00 0.84 0.00 0.00 57.88 58.38 1qmd h LEU 38 Cb 0.60 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 1qmd h LEU 38 CO 0.04 1.01 0.23 -0.08 -0.34 0.00 0.00 178.44 179.31 1qmd h GLU 39 N 0.82 1.14 -0.46 1.25 4.22 -1.13 0.35 114.58 120.77 1qmd h GLU 39 Ca 0.14 -0.24 -0.02 0.00 0.08 0.00 0.00 59.36 59.31 1qmd h GLU 39 Cb 0.62 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1qmd h GLU 39 CO 0.04 0.97 0.20 0.82 -2.18 0.00 0.00 179.01 178.85 1qmd h ILE 40 N 1.10 1.20 -0.22 2.32 2.04 -1.16 0.12 117.51 122.91 1qmd h ILE 40 Ca 0.24 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.50 1qmd h ILE 40 Cb 0.30 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1qmd h ILE 40 CO -0.01 0.22 0.15 0.25 0.00 0.00 0.00 178.15 178.76 1qmd h LEU 41 N 0.60 0.25 -1.63 1.44 5.85 -0.67 -0.39 115.31 120.75 1qmd h LEU 41 Ca 0.15 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.89 1qmd h LEU 41 Cb 0.17 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1qmd h LEU 41 CO -0.02 0.18 0.28 0.50 -0.34 0.00 0.00 178.44 179.05 1qmd h LYS 42 N 0.30 0.48 0.00 1.25 3.64 0.10 0.95 116.57 123.28 1qmd h LYS 42 Ca 0.08 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.36 1qmd h LYS 42 Cb -0.03 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1qmd h LYS 42 CO -0.02 0.31 -0.34 0.93 -2.27 0.00 0.00 179.45 178.07 1qmd h GLU 43 N 0.49 0.00 -0.77 1.90 5.08 0.26 -2.93 114.58 118.62 1qmd h GLU 43 Ca 0.17 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.15 1qmd h GLU 43 Cb 0.07 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 29.10 1qmd h GLU 43 CO -0.04 0.34 0.38 0.09 -1.00 0.00 0.00 179.01 178.78 1qmd n ASN 44 N -3.47 3.52 -0.25 1.42 3.02 0.28 -4.74 115.26 115.04 1qmd n ASN 44 Ca 0.00 -3.60 0.05 0.00 -0.03 0.00 0.00 54.58 51.00 1qmd n ASN 44 Cb 0.50 -0.76 0.19 0.00 -0.61 0.00 0.00 39.78 39.09 1qmd n ASN 44 CO 0.00 0.00 0.00 -0.03 -2.62 0.00 0.00 177.26 174.61 1qmd h MET 45 N 1.22 0.36 -0.34 3.52 1.85 -1.23 -0.69 114.93 119.63 1qmd h MET 45 Ca 0.46 -0.02 -0.04 0.00 -0.61 0.00 0.00 59.70 59.49 1qmd h MET 45 Cb 2.43 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 34.36 1qmd h MET 45 CO 0.84 0.24 0.05 1.25 -0.40 0.00 0.00 176.91 178.88 1qmd h HIS 46 N 0.37 0.51 -0.13 1.39 -0.00 -1.88 -0.07 115.15 115.34 1qmd h HIS 46 Ca 0.41 -0.04 -0.16 0.00 -0.00 0.00 0.00 60.37 60.59 1qmd h HIS 46 Cb 0.66 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.91 1qmd h HIS 46 CO -0.20 0.47 -0.61 1.49 -0.00 0.00 0.00 177.93 179.08 1qmd h GLU 47 N 0.49 0.43 -0.47 5.26 4.57 -1.54 0.08 114.58 123.39 1qmd h GLU 47 Ca 0.11 -0.30 -0.06 0.00 -1.18 0.00 0.00 59.36 57.93 1qmd h GLU 47 Cb 0.25 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.86 1qmd h GLU 47 CO 0.00 0.91 0.04 1.25 -1.18 0.00 0.00 179.01 180.04 1qmd h LEU 48 N 0.32 0.78 -0.45 1.64 5.85 -0.58 -1.18 115.31 121.68 1qmd h LEU 48 Ca -0.01 -0.28 -0.06 0.00 0.84 0.00 0.00 57.88 58.38 1qmd h LEU 48 Cb 1.15 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1qmd h LEU 48 CO 0.11 0.86 0.07 1.56 -0.34 0.00 0.00 178.44 180.70 1qmd h GLN 49 N 0.66 0.76 -0.52 1.25 4.20 -0.83 -1.26 115.11 119.37 1qmd h GLN 49 Ca 0.14 -0.21 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 1qmd h GLN 49 Cb 0.44 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 1qmd h GLN 49 CO 0.02 0.78 0.14 -0.07 -0.67 0.00 0.00 178.83 179.03 1qmd h LEU 50 N 0.62 0.78 -1.18 1.46 3.38 -0.87 -2.54 115.31 116.95 1qmd h LEU 50 Ca 0.14 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1qmd h LEU 50 Cb 0.40 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1qmd h LEU 50 CO 0.01 0.79 -0.18 1.23 0.09 0.00 0.00 178.44 180.38 1qmd h GLY 51 N 0.72 0.37 2.00 0.83 0.00 -1.07 -0.43 103.07 105.50 1qmd h GLY 51 Ca 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1qmd h GLY 51 CO -0.00 0.24 0.00 1.48 0.00 0.00 0.00 176.54 178.26 1qmd h SER 52 N 0.32 0.00 0.00 0.19 4.64 -0.81 -2.85 113.55 115.04 1qmd h SER 52 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1qmd h SER 52 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1qmd h SER 52 CO 0.03 0.00 -1.09 0.35 -0.87 0.00 0.00 176.83 175.25 1qmd n THR 53 N -2.60 0.00 -0.34 2.95 -2.24 -0.98 -4.50 114.28 106.58 1qmd n THR 53 Ca 0.01 -0.15 0.06 0.00 -2.27 0.00 0.00 64.05 61.70 1qmd n THR 53 Cb 0.25 0.47 0.21 0.00 -2.10 0.00 0.00 70.33 69.16 1qmd n THR 53 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1qmd h TYR 54 N 0.00 1.03 0.00 4.78 3.20 -1.07 -2.92 116.97 121.98 1qmd h TYR 54 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1qmd h TYR 54 Cb 0.21 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.16 1qmd h TYR 54 CO 0.00 0.40 0.17 -1.35 -1.64 0.00 0.00 178.16 175.74 1qmd h PRO 55 N 0.91 0.00 0.00 1.82 0.11 -1.87 0.15 132.00 133.12 1qmd h PRO 55 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 1qmd h PRO 55 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.57 1qmd h PRO 55 CO -0.27 0.00 -0.39 -0.25 -0.21 0.00 0.00 178.00 176.88 1qmd n ASP 56 N -2.68 0.41 0.00 -2.05 8.00 -1.10 -4.07 116.55 115.06 1qmd n ASP 56 Ca -0.02 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.45 1qmd n ASP 56 Cb 0.21 0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1qmd n ASP 56 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1qmd n TYR 57 N -1.57 0.00 -1.68 1.24 4.01 0.34 -4.75 117.16 114.75 1qmd n TYR 57 Ca 0.06 -0.07 -0.49 0.00 -0.16 0.00 0.00 57.90 57.24 1qmd n TYR 57 Cb 0.35 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.32 1qmd n TYR 57 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1qmd n ASP 58 N -0.07 3.33 -0.75 7.72 -0.08 -0.15 -4.85 116.55 121.71 1qmd n ASP 58 Ca 0.00 0.96 0.09 0.00 -1.51 0.00 0.00 54.79 54.33 1qmd n ASP 58 Cb 0.11 -1.35 0.09 0.00 2.34 0.00 0.00 41.12 42.31 1qmd n ASP 58 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1qmd n LYS 59 N 6.62 1.61 -2.12 -0.67 5.02 -1.26 -4.51 118.16 122.85 1qmd n LYS 59 Ca 0.23 -1.64 -0.37 0.00 -2.02 0.00 0.00 58.31 54.52 1qmd n LYS 59 Cb 0.28 -1.36 0.03 0.00 -0.02 0.00 0.00 35.03 33.96 1qmd n LYS 59 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1qmd n ASN 60 N 1.04 6.93 0.00 4.39 3.02 -1.26 -4.89 115.26 124.48 1qmd n ASN 60 Ca 0.11 -3.80 0.00 0.00 -0.03 0.00 0.00 54.58 50.86 1qmd n ASN 60 Cb 0.46 -0.96 0.00 0.00 -0.61 0.00 0.00 39.78 38.68 1qmd n ASN 60 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qmd n ALA 61 N -0.47 0.00 -0.73 5.41 0.00 -1.26 -1.72 120.51 121.74 1qmd n ALA 61 Ca 0.50 0.00 0.08 0.00 0.00 0.00 0.00 53.44 54.02 1qmd n ALA 61 Cb 0.32 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.01 1qmd n ALA 61 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1qmd n TYR 62 N 0.00 0.90 -4.03 0.00 4.02 -1.26 -4.66 117.16 112.13 1qmd n TYR 62 Ca 0.00 -0.75 -0.38 0.00 -0.01 0.00 0.00 57.90 56.76 1qmd n TYR 62 Cb 0.00 -0.24 -0.00 0.00 -0.02 0.00 0.00 39.34 39.08 1qmd n TYR 62 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1qmd n ASP 63 N -0.06 -2.92 -4.40 7.72 5.75 -1.26 -2.51 116.55 118.87 1qmd n ASP 63 Ca 0.19 -1.20 -0.28 0.00 -0.01 0.00 0.00 54.79 53.49 1qmd n ASP 63 Cb 0.78 -2.18 -0.13 0.00 -1.03 0.00 0.00 41.12 38.56 1qmd n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1qmd s LEU 64 N -7.19 2.36 0.18 -2.12 1.43 -1.26 -4.87 118.68 107.21 1qmd s LEU 64 Ca 0.34 -0.79 -0.31 0.00 -1.03 0.00 0.00 54.13 52.34 1qmd s LEU 64 Cb -0.17 -1.19 -0.10 0.00 0.03 0.00 0.00 46.19 44.76 1qmd s LEU 64 CO 0.95 0.16 1.50 -0.47 0.23 0.00 0.00 176.35 178.72 1qmd s TYR 65 N -1.26 3.08 0.18 0.29 5.04 -1.26 -4.94 117.35 118.48 1qmd s TYR 65 Ca 0.16 0.79 -0.30 0.00 -2.44 0.00 0.00 57.07 55.28 1qmd s TYR 65 Cb -0.09 -3.86 -0.08 0.00 0.35 0.00 0.00 41.96 38.28 1qmd s TYR 65 CO 0.07 -3.05 1.21 -0.65 -1.34 0.00 0.00 175.55 171.79 1qmd s GLN 66 N 0.70 4.48 -0.21 4.97 -1.52 -1.26 -5.02 119.66 121.79 1qmd s GLN 66 Ca 0.66 1.89 -0.04 0.00 -1.95 0.00 0.00 55.36 55.93 1qmd s GLN 66 Cb -0.42 -3.24 0.11 0.00 -0.22 0.00 0.00 33.01 29.24 1qmd s GLN 66 CO 0.34 -0.11 0.27 0.34 -0.25 0.00 0.00 175.29 175.89 1qmd s ASP 67 N 0.19 0.97 -0.47 5.90 -1.08 -1.26 -4.21 116.67 116.70 1qmd s ASP 67 Ca 0.53 -0.05 0.04 0.00 -0.52 0.00 0.00 52.55 52.55 1qmd s ASP 67 Cb -0.33 0.64 0.43 0.00 -1.46 0.00 0.00 42.92 42.20 1qmd s ASP 67 CO 0.37 -0.32 1.45 1.41 0.52 0.00 0.00 175.17 178.60 1qmd n HIS 68 N 5.33 3.04 -4.08 -5.34 8.25 -1.26 -4.94 115.22 116.23 1qmd n HIS 68 Ca -0.05 -2.62 -0.32 0.00 -0.26 0.00 0.00 57.72 54.47 1qmd n HIS 68 Cb 0.50 -0.62 -0.16 0.00 1.12 0.00 0.00 29.99 30.83 1qmd n HIS 68 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1qmd s PHE 69 N -3.69 2.81 0.09 4.41 0.08 -1.26 -4.67 117.98 115.75 1qmd s PHE 69 Ca 0.53 -1.80 0.07 0.00 0.12 0.00 0.00 56.93 55.85 1qmd s PHE 69 Cb 0.43 -1.85 -0.03 0.00 -0.57 0.00 0.00 43.02 41.00 1qmd s PHE 69 CO -0.08 -0.81 -0.19 -1.58 -0.10 0.00 0.00 175.22 172.46 1qmd s TRP 70 N 1.27 1.62 0.23 0.36 0.51 -1.26 -5.11 118.94 116.56 1qmd s TRP 70 Ca -0.00 -0.42 -0.30 0.00 -2.12 0.00 0.00 56.10 53.26 1qmd s TRP 70 Cb -0.16 -0.90 -0.09 0.00 -0.81 0.00 0.00 33.47 31.52 1qmd s TRP 70 CO -0.10 0.15 1.22 0.34 -0.51 0.00 0.00 176.95 178.06 1qmd s ASP 71 N -1.80 7.03 0.55 2.95 2.15 -1.26 -4.91 116.67 121.38 1qmd s ASP 71 Ca 0.04 2.34 0.31 0.00 0.43 0.00 0.00 52.55 55.68 1qmd s ASP 71 Cb -0.10 -2.62 1.48 0.00 -0.30 0.00 0.00 42.92 41.38 1qmd s ASP 71 CO 0.03 -0.39 1.88 -0.65 -0.17 0.00 0.00 175.17 175.87 1qmd h PRO 72 N 4.75 0.00 -0.11 4.34 0.11 -1.96 -1.63 132.00 137.50 1qmd h PRO 72 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1qmd h PRO 72 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1qmd h PRO 72 CO 0.72 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.26 1qmd n ASP 73 N -4.16 1.33 0.05 -2.05 8.00 -1.26 -4.46 116.55 114.00 1qmd n ASP 73 Ca 0.17 -1.60 -0.11 0.00 0.71 0.00 0.00 54.79 53.96 1qmd n ASP 73 Cb 0.94 -0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.93 1qmd n ASP 73 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1qmd h THR 74 N 1.83 0.42 -0.48 -3.53 2.02 -1.68 0.02 112.91 111.51 1qmd h THR 74 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1qmd h THR 74 Cb 0.40 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 1qmd h THR 74 CO 0.00 0.00 0.31 -0.78 0.37 0.00 0.00 175.52 175.42 1qmd h ASP 75 N -0.38 0.56 -0.75 4.18 3.58 -1.83 -1.10 116.42 120.68 1qmd h ASP 75 Ca 0.07 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 1qmd h ASP 75 Cb 0.47 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.35 1qmd h ASP 75 CO -0.23 0.42 0.38 -1.13 -2.88 0.00 0.00 179.24 175.80 1qmd h ASN 76 N 0.65 0.97 -0.52 2.28 -0.73 -1.78 -1.22 115.58 115.22 1qmd h ASN 76 Ca 0.17 -0.12 -0.03 0.00 1.87 0.00 0.00 56.30 58.19 1qmd h ASN 76 Cb -0.05 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.27 1qmd h ASN 76 CO -0.04 0.81 0.19 0.78 -0.37 0.00 0.00 177.43 178.81 1qmd h ASN 77 N 1.05 0.73 -0.06 1.15 -0.26 -0.61 -2.60 115.58 114.98 1qmd h ASN 77 Ca 0.26 -0.18 -0.06 0.00 -0.56 0.00 0.00 56.30 55.76 1qmd h ASN 77 Cb 0.08 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.14 1qmd h ASN 77 CO -0.04 0.72 -0.12 -0.26 -1.06 0.00 0.00 177.43 176.67 1qmd h PHE 78 N 0.71 0.39 0.00 1.19 0.04 -0.91 -2.85 116.94 115.51 1qmd h PHE 78 Ca 0.17 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.89 1qmd h PHE 78 Cb 0.22 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.26 1qmd h PHE 78 CO 0.01 0.49 0.00 -1.13 -0.60 0.00 0.00 178.31 177.08 1qmd n SER 79 N -4.24 0.23 -4.78 2.17 3.41 -0.49 -4.84 113.62 105.09 1qmd n SER 79 Ca 0.00 0.53 -0.38 0.00 -0.26 0.00 0.00 58.87 58.77 1qmd n SER 79 Cb 0.29 -0.59 -0.05 0.00 -0.26 0.00 0.00 64.21 63.61 1qmd n SER 79 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1qmd s LYS 80 N -3.06 4.40 0.65 4.33 1.02 -1.08 -5.02 119.74 120.98 1qmd s LYS 80 Ca 0.10 1.53 -0.16 0.00 0.02 0.00 0.00 55.97 57.46 1qmd s LYS 80 Cb 0.14 -2.77 -0.01 0.00 -0.52 0.00 0.00 37.83 34.67 1qmd s LYS 80 CO 0.45 0.07 1.15 -0.51 -0.92 0.00 0.00 175.35 175.59 1qmd s ASP 81 N -1.42 5.00 0.00 2.83 1.01 -1.26 -3.94 116.67 118.88 1qmd s ASP 81 Ca 0.52 2.17 0.00 0.00 0.71 0.00 0.00 52.55 55.95 1qmd s ASP 81 Cb -0.23 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.12 1qmd s ASP 81 CO 0.30 -1.71 0.00 0.59 0.21 0.00 0.00 175.17 174.55 1qmd n ASN 82 N -2.19 0.00 -0.96 0.27 3.02 -1.26 -4.83 115.26 109.31 1qmd n ASN 82 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 1qmd n ASN 82 Cb 0.51 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.68 1qmd n ASN 82 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1qmd n SER 83 N 1.23 2.11 -3.66 6.41 3.41 -1.25 -4.73 113.62 117.14 1qmd n SER 83 Ca 0.00 -1.48 -0.11 0.00 -0.26 0.00 0.00 58.87 57.02 1qmd n SER 83 Cb 0.00 -0.37 -0.08 0.00 -0.26 0.00 0.00 64.21 63.50 1qmd n SER 83 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 1qmd s TRP 84 N 0.16 -0.80 -0.62 7.33 -0.11 -1.26 -4.98 118.94 118.66 1qmd s TRP 84 Ca 0.00 1.77 -0.27 0.00 1.22 0.00 0.00 56.10 58.82 1qmd s TRP 84 Cb 0.00 0.38 -0.01 0.00 -1.50 0.00 0.00 33.47 32.34 1qmd s TRP 84 CO 0.00 -0.40 1.70 -0.47 -4.62 0.00 0.00 176.95 173.16 1qmd s TYR 85 N 0.95 1.85 0.55 5.86 5.04 -1.26 -4.87 117.35 125.47 1qmd s TYR 85 Ca -0.05 0.59 0.33 0.00 -2.44 0.00 0.00 57.07 55.50 1qmd s TYR 85 Cb -0.05 -4.23 1.49 0.00 0.35 0.00 0.00 41.96 39.52 1qmd s TYR 85 CO -0.08 -2.26 1.83 -0.07 -1.34 0.00 0.00 175.55 173.62 1qmd h LEU 86 N 15.32 0.00 -2.14 6.97 3.38 -1.95 -0.72 115.31 136.17 1qmd h LEU 86 Ca -0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1qmd h LEU 86 Cb 1.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 1qmd h LEU 86 CO 1.22 0.00 -0.07 0.00 0.09 0.00 0.00 178.44 179.68 1qmd h ALA 87 N 1.43 1.22 -2.76 1.53 0.00 -1.89 -3.42 119.26 115.36 1qmd h ALA 87 Ca 0.46 -0.06 -0.62 0.00 0.00 0.00 0.00 54.91 54.69 1qmd h ALA 87 Cb 1.93 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.65 1qmd h ALA 87 CO -0.00 0.08 -0.28 0.71 0.00 0.00 0.00 179.25 179.76 1qmd s TYR 88 N -4.17 3.64 0.65 0.00 2.02 -0.28 -0.59 117.35 118.63 1qmd s TYR 88 Ca -0.03 0.82 -0.16 0.00 -0.37 0.00 0.00 57.07 57.33 1qmd s TYR 88 Cb 0.13 -2.24 -0.00 0.00 -0.40 0.00 0.00 41.96 39.44 1qmd s TYR 88 CO 0.54 0.56 1.17 -1.54 -1.57 0.00 0.00 175.55 174.71 1qmd s SER 89 N -0.69 4.92 -0.01 2.29 1.04 -1.13 -4.83 113.70 115.29 1qmd s SER 89 Ca 0.21 2.23 -0.22 0.00 0.48 0.00 0.00 55.95 58.64 1qmd s SER 89 Cb -0.15 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.34 1qmd s SER 89 CO 0.10 -1.76 0.65 -0.63 0.98 0.00 0.00 173.24 172.57 1qmd s ILE 90 N -1.98 4.91 0.50 -1.02 1.01 0.12 -4.92 121.20 119.83 1qmd s ILE 90 Ca 0.72 1.36 -0.23 0.00 0.00 0.00 0.00 60.65 62.50 1qmd s ILE 90 Cb -0.26 -3.99 -0.07 0.00 0.01 0.00 0.00 42.46 38.15 1qmd s ILE 90 CO 0.39 0.36 1.30 -2.65 0.00 0.00 0.00 174.94 174.34 1qmd n PRO 91 N 3.03 1.75 -2.57 2.79 -0.02 -1.26 -3.70 135.00 135.01 1qmd n PRO 91 Ca -0.05 0.64 -0.40 0.00 -2.02 0.00 0.00 63.50 61.67 1qmd n PRO 91 Cb 0.51 -2.47 -0.05 0.00 -0.02 0.00 0.00 33.50 31.47 1qmd n PRO 91 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1qmd s ASP 92 N -0.77 7.38 0.42 2.55 1.01 -1.26 -4.98 116.67 121.03 1qmd s ASP 92 Ca 0.67 2.16 0.04 0.00 0.71 0.00 0.00 52.55 56.13 1qmd s ASP 92 Cb -0.45 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 40.81 1qmd s ASP 92 CO 0.53 -0.05 0.03 0.42 0.21 0.00 0.00 175.17 176.31 1qmd s THR 93 N -1.19 1.45 0.20 -1.27 -4.23 -1.26 -5.00 115.64 104.34 1qmd s THR 93 Ca 0.44 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.84 1qmd s THR 93 Cb -0.30 -2.65 0.14 0.00 1.34 0.00 0.00 72.50 71.03 1qmd s THR 93 CO 0.38 0.00 1.85 1.23 -0.54 0.00 0.00 174.62 177.54 1qmd h GLY 94 N 1.71 1.03 0.91 3.99 0.00 -1.95 -1.11 103.07 107.65 1qmd h GLY 94 Ca -0.42 -0.41 0.02 0.00 0.00 0.00 0.00 47.33 46.51 1qmd h GLY 94 CO 0.74 0.40 0.19 0.83 0.00 0.00 0.00 176.54 178.71 1qmd h GLU 95 N 0.97 0.39 -0.07 4.80 4.39 -1.96 -2.59 114.58 120.51 1qmd h GLU 95 Ca 0.26 -0.02 -0.17 0.00 0.34 0.00 0.00 59.36 59.77 1qmd h GLU 95 Cb -0.06 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 1qmd h GLU 95 CO -0.05 0.26 -0.69 0.66 -1.16 0.00 0.00 179.01 178.02 1qmd h SER 96 N 0.40 0.37 -0.41 1.42 4.64 -1.91 -3.09 113.55 114.97 1qmd h SER 96 Ca 0.13 -0.24 -0.03 0.00 -0.47 0.00 0.00 61.79 61.19 1qmd h SER 96 Cb 0.01 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 61.97 1qmd h SER 96 CO -0.07 0.95 0.16 1.56 -0.87 0.00 0.00 176.83 178.57 1qmd h GLN 97 N 0.22 0.68 -0.10 4.77 1.08 -1.07 0.30 115.11 120.99 1qmd h GLN 97 Ca -0.02 -0.10 -0.00 0.00 -1.45 0.00 0.00 58.65 57.07 1qmd h GLN 97 Cb 1.24 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 28.55 1qmd h GLN 97 CO 0.11 0.58 0.06 0.82 -0.95 0.00 0.00 178.83 179.45 1qmd h ILE 98 N 0.67 1.07 -0.62 2.54 2.04 -1.39 -0.96 117.51 120.86 1qmd h ILE 98 Ca 0.16 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.79 1qmd h ILE 98 Cb 0.18 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 1qmd h ILE 98 CO -0.01 0.06 0.18 0.03 0.00 0.00 0.00 178.15 178.41 1qmd h ARG 99 N 0.09 0.97 0.25 2.37 3.08 -1.39 -1.52 114.38 118.23 1qmd h ARG 99 Ca 0.04 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 1qmd h ARG 99 Cb 0.05 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1qmd h ARG 99 CO -0.01 0.87 -0.12 -0.22 -1.07 0.00 0.00 179.97 179.42 1qmd h LYS 100 N 0.90 -0.33 0.00 0.04 3.64 -0.82 -1.62 116.57 118.38 1qmd h LYS 100 Ca 0.20 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.56 1qmd h LYS 100 Cb 0.31 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1qmd h LYS 100 CO -0.00 -0.09 -0.22 0.74 -2.27 0.00 0.00 179.45 177.61 1qmd h PHE 101 N -0.53 0.00 -0.13 1.91 0.04 -1.19 -1.77 116.94 115.27 1qmd h PHE 101 Ca -0.03 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.55 1qmd h PHE 101 Cb 0.39 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.54 1qmd h PHE 101 CO -0.01 0.22 -0.68 0.77 -0.60 0.00 0.00 178.31 178.00 1qmd h SER 102 N 0.00 0.64 -0.13 2.17 0.02 -1.12 -0.97 113.55 114.16 1qmd h SER 102 Ca -0.00 -0.40 -0.02 0.00 -0.84 0.00 0.00 61.79 60.53 1qmd h SER 102 Cb 0.56 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 1qmd h SER 102 CO 0.03 1.14 0.01 0.00 -1.14 0.00 0.00 176.83 176.87 1qmd h ALA 103 N 0.85 0.17 -0.92 3.77 0.00 -0.90 -1.82 119.26 120.42 1qmd h ALA 103 Ca -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1qmd h ALA 103 Cb 1.26 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1qmd h ALA 103 CO 0.13 -0.15 0.52 -0.07 0.00 0.00 0.00 179.25 179.68 1qmd h LEU 104 N -0.03 1.14 -0.20 0.00 3.38 -1.31 -1.82 115.31 116.46 1qmd h LEU 104 Ca 0.04 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1qmd h LEU 104 Cb 0.33 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1qmd h LEU 104 CO 0.00 0.90 0.07 0.00 0.09 0.00 0.00 178.44 179.50 1qmd h ALA 105 N 1.29 0.27 -0.75 1.53 0.00 -1.02 -1.42 119.26 119.15 1qmd h ALA 105 Ca 0.33 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1qmd h ALA 105 Cb -0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1qmd h ALA 105 CO -0.06 -0.11 0.41 0.00 0.00 0.00 0.00 179.25 179.49 1qmd h ARG 106 N 0.16 1.05 -0.68 0.00 3.08 -1.18 -0.94 114.38 115.86 1qmd h ARG 106 Ca 0.07 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1qmd h ARG 106 Cb 0.22 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 1qmd h ARG 106 CO -0.00 0.78 0.33 -0.92 -1.07 0.00 0.00 179.97 179.09 1qmd h TYR 107 N 1.03 0.98 -0.04 3.04 3.20 -1.20 -1.56 116.97 122.43 1qmd h TYR 107 Ca 0.26 -0.05 -0.15 0.00 3.14 0.00 0.00 58.73 61.94 1qmd h TYR 107 Cb 0.04 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 1qmd h TYR 107 CO 0.00 0.73 -0.63 0.93 -1.64 0.00 0.00 178.16 177.54 1qmd h GLU 108 N 0.95 0.16 -0.11 1.82 4.39 -1.00 -3.25 114.58 117.53 1qmd h GLU 108 Ca 0.23 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 1qmd h GLU 108 Cb 0.11 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1qmd h GLU 108 CO -0.03 0.74 -0.04 2.35 -1.16 0.00 0.00 179.01 180.87 1qmd h TRP 109 N 0.11 0.26 0.00 4.33 2.91 -0.85 -0.77 115.95 121.94 1qmd h TRP 109 Ca -0.01 -0.06 0.00 0.00 1.13 0.00 0.00 58.89 59.95 1qmd h TRP 109 Cb 1.14 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 29.73 1qmd h TRP 109 CO 0.01 0.55 0.05 -0.56 -1.03 0.00 0.00 178.44 177.47 1qmd h GLN 110 N -0.11 0.00 -0.47 2.65 -0.00 -1.33 -0.83 115.11 115.02 1qmd h GLN 110 Ca 0.03 0.00 -0.17 0.00 -0.00 0.00 0.00 58.65 58.50 1qmd h GLN 110 Cb 0.48 0.00 -0.10 0.00 -0.00 0.00 0.00 27.48 27.85 1qmd h GLN 110 CO 0.01 0.00 0.09 2.89 -0.00 0.00 0.00 178.83 181.83 1qmd n ARG 111 N -3.01 2.56 -0.89 0.06 1.85 -1.15 -4.96 116.66 111.12 1qmd n ARG 111 Ca -0.03 -3.05 0.00 0.00 -1.00 0.00 0.00 57.85 53.77 1qmd n ARG 111 Cb 0.12 -1.94 0.00 0.00 -1.05 0.00 0.00 32.46 29.59 1qmd n ARG 111 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1qmd n GLY 112 N -0.77 0.34 3.28 2.89 0.00 -0.32 -4.93 105.19 105.67 1qmd n GLY 112 Ca 0.34 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 1qmd n GLY 112 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qmd n ASN 113 N -0.30 5.14 0.13 1.61 3.02 -0.31 -4.82 115.26 119.74 1qmd n ASN 113 Ca 0.00 -3.01 0.01 0.00 -0.03 0.00 0.00 54.58 51.55 1qmd n ASN 113 Cb 0.15 -1.55 0.33 0.00 -0.61 0.00 0.00 39.78 38.10 1qmd n ASN 113 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1qmd h TYR 114 N 6.71 0.18 -0.12 3.10 0.05 -1.88 -1.95 116.97 123.05 1qmd h TYR 114 Ca 0.35 -0.03 -0.07 0.00 0.05 0.00 0.00 58.73 59.03 1qmd h TYR 114 Cb 0.79 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 38.49 1qmd h TYR 114 CO 1.17 0.44 -0.21 0.87 -1.05 0.00 0.00 178.16 179.39 1qmd h LYS 115 N 0.15 0.36 -0.45 4.88 1.57 -1.96 -2.13 116.57 118.99 1qmd h LYS 115 Ca 0.02 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.49 1qmd h LYS 115 Cb 0.59 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1qmd h LYS 115 CO 0.04 0.81 -0.07 0.37 -0.57 0.00 0.00 179.45 180.03 1qmd h GLN 116 N -0.06 0.85 -0.35 3.15 5.75 -1.95 -2.02 115.11 120.48 1qmd h GLN 116 Ca 0.01 -0.31 0.01 0.00 -0.15 0.00 0.00 58.65 58.21 1qmd h GLN 116 Cb 0.78 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.25 1qmd h GLN 116 CO 0.05 0.93 0.21 0.00 -2.65 0.00 0.00 178.83 177.37 1qmd h ALA 117 N 0.88 0.43 -0.67 3.38 0.00 -1.40 -0.20 119.26 121.68 1qmd h ALA 117 Ca 0.12 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1qmd h ALA 117 Cb 0.60 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1qmd h ALA 117 CO 0.04 -0.13 0.17 1.15 0.00 0.00 0.00 179.25 180.48 1qmd h THR 118 N 0.44 1.25 0.33 0.00 2.02 -1.32 0.09 112.91 115.73 1qmd h THR 118 Ca 0.13 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.37 1qmd h THR 118 Cb -0.02 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 1qmd h THR 118 CO -0.05 0.36 -0.16 0.15 0.37 0.00 0.00 175.52 176.19 1qmd h PHE 119 N 1.01 -0.41 -0.77 3.16 3.57 -0.95 -0.74 116.94 121.80 1qmd h PHE 119 Ca 0.21 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.81 1qmd h PHE 119 Cb 0.35 0.14 -0.08 0.00 2.79 0.00 0.00 35.95 39.15 1qmd h PHE 119 CO 0.03 -0.19 0.40 1.88 -2.23 0.00 0.00 178.31 178.20 1qmd h TYR 120 N -0.56 0.72 -0.80 0.41 0.05 -0.83 0.08 116.97 116.04 1qmd h TYR 120 Ca -0.05 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 1qmd h TYR 120 Cb 0.41 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 37.91 1qmd h TYR 120 CO -0.03 0.25 0.46 1.25 -1.05 0.00 0.00 178.16 179.04 1qmd h LEU 121 N 0.65 0.97 -0.82 3.88 5.85 -0.73 -1.21 115.31 123.90 1qmd h LEU 121 Ca 0.39 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.98 1qmd h LEU 121 Cb 0.43 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 1qmd h LEU 121 CO -0.28 0.76 0.18 1.23 -0.34 0.00 0.00 178.44 179.99 1qmd h GLY 122 N 1.13 1.14 1.43 3.75 0.00 0.50 -1.58 103.07 109.45 1qmd h GLY 122 Ca 0.28 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.86 1qmd h GLY 122 CO -0.05 0.64 -0.04 0.83 0.00 0.00 0.00 176.54 177.92 1qmd h GLU 123 N 1.02 0.69 -0.50 4.80 5.08 -0.39 -0.08 114.58 125.19 1qmd h GLU 123 Ca 0.22 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 1qmd h GLU 123 Cb 0.33 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1qmd h GLU 123 CO -0.00 0.73 0.08 0.00 -1.00 0.00 0.00 179.01 178.82 1qmd h ALA 124 N 1.32 0.67 0.00 3.43 0.00 -0.79 -2.25 119.26 121.63 1qmd h ALA 124 Ca 0.12 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1qmd h ALA 124 Cb 0.46 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1qmd h ALA 124 CO 0.02 0.40 -0.33 0.52 0.00 0.00 0.00 179.25 179.86 1qmd h MET 125 N 0.71 0.00 -0.15 0.00 2.86 -0.89 -2.21 114.93 115.25 1qmd h MET 125 Ca 0.15 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.80 1qmd h MET 125 Cb 0.40 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1qmd h MET 125 CO 0.01 0.33 0.08 1.25 1.06 0.00 0.00 176.91 179.64 1qmd h HIS 126 N 0.00 0.14 -0.31 -0.22 6.17 -0.41 -0.86 115.15 119.66 1qmd h HIS 126 Ca -0.00 0.01 -0.11 0.00 0.71 0.00 0.00 60.37 60.97 1qmd h HIS 126 Cb 0.63 -0.04 -0.01 0.00 2.52 0.00 0.00 27.41 30.51 1qmd h HIS 126 CO 0.00 0.08 -0.27 1.88 0.71 0.00 0.00 177.93 180.34 1qmd h TYR 127 N 0.17 0.71 -0.62 5.26 0.05 -1.29 -1.91 116.97 119.34 1qmd h TYR 127 Ca 0.06 -0.17 -0.07 0.00 0.05 0.00 0.00 58.73 58.60 1qmd h TYR 127 Cb 0.01 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 37.55 1qmd h TYR 127 CO -0.09 0.83 0.09 0.35 -1.05 0.00 0.00 178.16 178.30 1qmd h PHE 128 N 0.54 1.07 -0.74 4.88 3.57 -1.12 -1.97 116.94 123.17 1qmd h PHE 128 Ca 0.07 -0.14 -0.03 0.00 3.53 0.00 0.00 57.97 61.40 1qmd h PHE 128 Cb 0.74 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 1qmd h PHE 128 CO 0.03 0.91 0.35 0.78 -2.23 0.00 0.00 178.31 178.15 1qmd h GLY 129 N 1.03 1.14 0.93 2.40 0.00 -0.85 -2.30 103.07 105.42 1qmd h GLY 129 Ca 0.19 -0.56 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 1qmd h GLY 129 CO 0.01 0.54 0.06 -0.55 0.00 0.00 0.00 176.54 176.59 1qmd h ASP 130 N 1.03 0.13 0.43 0.19 3.32 -1.00 -1.85 116.42 118.67 1qmd h ASP 130 Ca 0.25 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1qmd h ASP 130 Cb 0.12 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1qmd h ASP 130 CO -0.03 0.18 0.00 0.16 -1.72 0.00 0.00 179.24 177.83 1qmd h ILE 131 N 0.07 0.00 -0.14 0.35 3.07 -1.24 0.15 117.51 119.77 1qmd h ILE 131 Ca 0.04 -0.20 0.00 0.00 1.55 0.00 0.00 64.86 66.24 1qmd h ILE 131 Cb 0.08 1.11 0.00 0.00 -0.27 0.00 0.00 36.82 37.74 1qmd h ILE 131 CO -0.01 0.00 0.00 -0.67 -1.05 0.00 0.00 178.15 176.42 1qmd n ASP 132 N -2.90 2.12 -4.64 2.16 -0.08 -0.85 -4.14 116.55 108.22 1qmd n ASP 132 Ca -0.01 -1.74 -0.42 0.00 -1.51 0.00 0.00 54.79 51.11 1qmd n ASP 132 Cb 0.16 -0.09 -0.05 0.00 2.34 0.00 0.00 41.12 43.49 1qmd n ASP 132 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1qmd s THR 133 N -1.83 4.85 -1.04 5.18 2.01 0.53 -4.83 115.64 120.52 1qmd s THR 133 Ca 0.34 1.46 -0.18 0.00 0.31 0.00 0.00 61.69 63.62 1qmd s THR 133 Cb 0.20 -4.09 -0.08 0.00 0.01 0.00 0.00 72.50 68.53 1qmd s THR 133 CO 0.30 -0.08 2.06 -0.81 -0.69 0.00 0.00 174.62 175.40 1qmd n PRO 134 N 5.99 2.05 -3.52 4.92 -0.04 -1.26 -4.76 135.00 138.38 1qmd n PRO 134 Ca 0.04 -2.11 -0.23 0.00 -0.04 0.00 0.00 63.50 61.16 1qmd n PRO 134 Cb 0.48 -3.04 -0.14 0.00 -0.04 0.00 0.00 33.50 30.76 1qmd n PRO 134 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1qmd s TYR 135 N 4.25 -0.03 -0.30 0.54 5.04 -1.26 -4.47 117.35 121.11 1qmd s TYR 135 Ca 0.53 -0.29 0.18 0.00 -2.44 0.00 0.00 57.07 55.05 1qmd s TYR 135 Cb 0.14 -0.61 0.48 0.00 0.35 0.00 0.00 41.96 42.32 1qmd s TYR 135 CO 0.03 -0.71 1.04 0.72 -1.34 0.00 0.00 175.55 175.30 1qmd n HIS 136 N 5.29 1.45 -1.94 4.97 8.25 -1.26 -4.81 115.22 127.17 1qmd n HIS 136 Ca -0.05 -2.53 -0.31 0.00 -0.26 0.00 0.00 57.72 54.57 1qmd n HIS 136 Cb 0.47 -0.30 0.01 0.00 1.12 0.00 0.00 29.99 31.29 1qmd n HIS 136 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1qmd s PRO 137 N -3.45 3.56 0.15 -0.41 0.04 -1.26 -4.95 135.00 128.68 1qmd s PRO 137 Ca 0.30 0.84 -0.13 0.00 0.04 0.00 0.00 61.00 62.05 1qmd s PRO 137 Cb 0.40 -2.08 0.02 0.00 0.04 0.00 0.00 34.50 32.88 1qmd s PRO 137 CO -0.01 -0.60 1.60 0.00 0.04 0.00 0.00 177.00 178.04 1qmd h ALA 138 N -0.10 0.65 -3.20 8.56 0.00 -2.03 -3.41 119.26 119.74 1qmd h ALA 138 Ca -0.45 -0.27 -0.67 0.00 0.00 0.00 0.00 54.91 53.52 1qmd h ALA 138 Cb 1.19 -0.18 -0.31 0.00 0.00 0.00 0.00 17.79 18.50 1qmd h ALA 138 CO 0.61 0.44 -0.73 -0.80 0.00 0.00 0.00 179.25 178.77 1qmd s ASN 139 N -6.32 4.38 0.32 0.00 0.01 -1.26 -5.10 114.94 106.95 1qmd s ASN 139 Ca -0.12 -0.79 -0.26 0.00 -0.71 0.00 0.00 52.86 50.97 1qmd s ASN 139 Cb 0.11 -1.69 -0.10 0.00 0.41 0.00 0.00 41.25 39.98 1qmd s ASN 139 CO 0.82 -0.12 0.95 -0.69 -1.51 0.00 0.00 177.10 176.55 1qmd s VAL 140 N 1.36 4.15 -0.43 1.60 1.01 -1.26 -5.05 120.40 121.79 1qmd s VAL 140 Ca 0.01 1.83 0.04 0.00 0.00 0.00 0.00 61.98 63.86 1qmd s VAL 140 Cb -0.16 -4.03 0.12 0.00 0.00 0.00 0.00 36.38 32.30 1qmd s VAL 140 CO -0.04 0.18 0.16 -0.89 0.00 0.00 0.00 175.10 174.51 1qmd s THR 141 N -1.56 2.36 0.32 3.92 2.01 -1.26 -5.10 115.64 116.34 1qmd s THR 141 Ca 0.49 -2.80 -0.25 0.00 0.31 0.00 0.00 61.69 59.44 1qmd s THR 141 Cb -0.20 -2.69 -0.10 0.00 0.01 0.00 0.00 72.50 69.52 1qmd s THR 141 CO 0.25 -0.71 0.93 0.00 -0.69 0.00 0.00 174.62 174.41 1qmd s ALA 142 N 0.32 3.21 -0.05 7.40 0.00 -1.26 -4.42 121.76 126.96 1qmd s ALA 142 Ca 0.14 0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.60 1qmd s ALA 142 Cb -0.23 -3.16 -0.00 0.00 0.00 0.00 0.00 23.12 19.73 1qmd s ALA 142 CO -0.04 0.18 0.22 1.33 0.00 0.00 0.00 175.76 177.44 1qmd n VAL 143 N 0.48 0.00 -4.29 0.00 0.24 0.11 -5.00 118.33 109.88 1qmd n VAL 143 Ca 0.02 -0.49 -0.18 0.00 -2.04 0.00 0.00 64.34 61.65 1qmd n VAL 143 Cb 0.50 1.01 -0.09 0.00 -1.47 0.00 0.00 33.84 33.79 1qmd n VAL 143 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1qmd s ASP 144 N -0.67 1.38 0.26 -1.34 1.47 -1.25 -5.01 116.67 111.51 1qmd s ASP 144 Ca 0.00 -1.63 0.25 0.00 1.18 0.00 0.00 52.55 52.35 1qmd s ASP 144 Cb 0.00 0.48 0.94 0.00 -0.34 0.00 0.00 42.92 44.00 1qmd s ASP 144 CO 0.02 -0.97 1.74 -1.54 0.68 0.00 0.00 175.17 175.10 1qmd n SER 145 N -1.12 0.75 -0.81 2.11 3.41 -1.26 -2.56 113.62 114.13 1qmd n SER 145 Ca 0.04 0.65 0.09 0.00 -0.26 0.00 0.00 58.87 59.39 1qmd n SER 145 Cb 0.64 -0.82 0.27 0.00 -0.26 0.00 0.00 64.21 64.04 1qmd n SER 145 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1qmd n ALA 146 N -1.79 2.46 -1.06 7.33 0.00 -1.26 -4.80 120.51 121.38 1qmd n ALA 146 Ca 0.03 -0.75 -0.02 0.00 0.00 0.00 0.00 53.44 52.70 1qmd n ALA 146 Cb 0.29 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.74 1qmd n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qmd n GLY 147 N 1.26 0.55 3.88 0.00 0.00 -1.06 -4.64 105.19 105.17 1qmd n GLY 147 Ca 0.17 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.96 1qmd n GLY 147 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1qmd s HIS 148 N -2.07 3.54 0.41 1.61 3.76 -1.26 -4.75 115.29 116.53 1qmd s HIS 148 Ca 0.00 1.20 0.07 0.00 -0.15 0.00 0.00 55.06 56.18 1qmd s HIS 148 Cb 0.00 -2.80 -0.07 0.00 1.11 0.00 0.00 32.58 30.83 1qmd s HIS 148 CO 0.00 -0.80 0.08 0.14 -0.85 0.00 0.00 174.74 173.31 1qmd s VAL 149 N -3.21 2.12 0.41 -0.90 -7.23 -1.26 -0.71 120.40 109.63 1qmd s VAL 149 Ca 0.56 -1.87 0.09 0.00 -1.81 0.00 0.00 61.98 58.94 1qmd s VAL 149 Cb -0.11 -3.00 0.29 0.00 0.56 0.00 0.00 36.38 34.12 1qmd s VAL 149 CO 0.53 0.00 2.02 0.11 -0.31 0.00 0.00 175.10 177.45 1qmd h LYS 150 N 1.63 0.51 -0.34 4.82 1.57 -1.96 -1.55 116.57 121.25 1qmd h LYS 150 Ca -0.43 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.22 1qmd h LYS 150 Cb 1.25 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.42 1qmd h LYS 150 CO 0.76 0.34 -0.16 0.35 -0.57 0.00 0.00 179.45 180.18 1qmd h PHE 151 N 0.53 0.68 -0.18 -1.35 3.57 -1.96 -0.94 116.94 117.29 1qmd h PHE 151 Ca 0.21 -0.13 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1qmd h PHE 151 Cb 0.17 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.73 1qmd h PHE 151 CO -0.00 0.75 -0.13 0.93 -2.23 0.00 0.00 178.31 177.62 1qmd h GLU 152 N 0.56 0.40 0.00 1.11 5.08 -1.72 -1.82 114.58 118.19 1qmd h GLU 152 Ca 0.09 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 1qmd h GLU 152 Cb 0.60 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1qmd h GLU 152 CO 0.04 0.74 -0.30 1.79 -1.00 0.00 0.00 179.01 180.28 1qmd h THR 153 N 0.07 1.11 -0.24 1.13 1.35 -1.31 -0.30 112.91 114.72 1qmd h THR 153 Ca 0.03 -1.08 -0.08 0.00 -0.55 0.00 0.00 66.41 64.74 1qmd h THR 153 Cb 0.64 1.60 -0.01 0.00 -1.73 0.00 0.00 68.15 68.66 1qmd h THR 153 CO 0.03 0.30 -0.16 0.15 -0.25 0.00 0.00 175.52 175.60 1qmd h PHE 154 N 0.00 0.63 -0.60 4.73 3.04 -1.08 -2.71 116.94 120.94 1qmd h PHE 154 Ca -0.00 -0.17 -0.06 0.00 3.98 0.00 0.00 57.97 61.72 1qmd h PHE 154 Cb 0.57 -0.14 -0.03 0.00 2.56 0.00 0.00 35.95 38.92 1qmd h PHE 154 CO 0.00 0.82 0.15 0.00 -2.02 0.00 0.00 178.31 177.26 1qmd h ALA 155 N 0.70 1.13 -0.56 2.41 0.00 -0.89 -2.93 119.26 119.12 1qmd h ALA 155 Ca 0.05 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.81 1qmd h ALA 155 Cb 0.68 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1qmd h ALA 155 CO 0.04 0.59 0.24 1.49 0.00 0.00 0.00 179.25 181.61 1qmd h GLU 156 N 0.90 0.43 0.00 0.00 4.57 -0.95 0.19 114.58 119.73 1qmd h GLU 156 Ca 0.19 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.34 1qmd h GLU 156 Cb 0.32 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.81 1qmd h GLU 156 CO -0.00 0.29 -0.05 0.93 -1.18 0.00 0.00 179.01 179.00 1qmd h GLU 157 N 0.45 0.00 0.00 1.92 5.08 -1.29 -3.11 114.58 117.63 1qmd h GLU 157 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1qmd h GLU 157 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1qmd h GLU 157 CO -0.24 0.05 -0.00 0.54 -1.00 0.00 0.00 179.01 178.35 1qmd n ARG 158 N -3.61 2.97 -0.35 2.33 1.74 -0.44 -4.85 116.66 114.45 1qmd n ARG 158 Ca -0.02 -1.52 0.25 0.00 -0.77 0.00 0.00 57.85 55.79 1qmd n ARG 158 Cb 0.15 -1.01 0.50 0.00 -1.02 0.00 0.00 32.46 31.08 1qmd n ARG 158 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1qmd h LYS 159 N 0.00 0.31 0.00 5.56 2.10 -0.60 -1.30 116.57 122.64 1qmd h LYS 159 Ca 0.00 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.62 1qmd h LYS 159 Cb 0.51 -0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 31.77 1qmd h LYS 159 CO 0.00 0.20 -0.05 0.93 -2.00 0.00 0.00 179.45 178.54 1qmd h GLU 160 N 0.32 0.00 0.00 0.07 4.39 -1.88 -1.90 114.58 115.58 1qmd h GLU 160 Ca 0.73 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.43 1qmd h GLU 160 Cb 1.75 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.40 1qmd h GLU 160 CO -0.54 0.05 0.00 1.04 -1.16 0.00 0.00 179.01 178.40 1qmd n GLN 161 N -3.92 0.23 -0.29 2.33 6.02 -0.49 -3.57 117.38 117.70 1qmd n GLN 161 Ca -0.03 0.25 0.09 0.00 -0.01 0.00 0.00 57.00 57.30 1qmd n GLN 161 Cb 0.14 -1.80 0.25 0.00 1.02 0.00 0.00 30.24 29.85 1qmd n GLN 161 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1qmd n TYR 162 N -2.20 0.75 -2.27 1.08 4.01 -0.72 -5.00 117.16 112.81 1qmd n TYR 162 Ca 0.05 -0.50 -0.39 0.00 -0.16 0.00 0.00 57.90 56.90 1qmd n TYR 162 Cb 0.38 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.37 1qmd n TYR 162 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1qmd s LYS 163 N -1.00 4.18 0.08 -0.72 1.02 -1.23 -4.47 119.74 117.58 1qmd s LYS 163 Ca 0.38 1.92 0.05 0.00 0.02 0.00 0.00 55.97 58.34 1qmd s LYS 163 Cb 0.20 -2.82 -0.03 0.00 -0.52 0.00 0.00 37.83 34.66 1qmd s LYS 163 CO 0.26 -0.24 -0.13 0.96 -0.92 0.00 0.00 175.35 175.28 1qmd s ILE 164 N -1.32 1.05 -0.06 2.17 -4.36 -1.26 -5.07 121.20 112.35 1qmd s ILE 164 Ca 0.54 -1.35 0.09 0.00 -0.26 0.00 0.00 60.65 59.67 1qmd s ILE 164 Cb -0.33 -1.09 0.14 0.00 1.25 0.00 0.00 42.46 42.43 1qmd s ILE 164 CO 0.42 -0.30 1.04 0.59 0.24 0.00 0.00 174.94 176.94 1qmd n ASN 165 N 1.16 1.94 -3.60 4.36 3.02 -1.26 -4.78 115.26 116.10 1qmd n ASN 165 Ca -0.20 -2.46 -0.15 0.00 -0.03 0.00 0.00 54.58 51.74 1qmd n ASN 165 Cb 0.55 -0.21 -0.06 0.00 -0.61 0.00 0.00 39.78 39.44 1qmd n ASN 165 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1qmd s THR 166 N -1.77 0.03 -0.90 3.41 -1.32 -1.26 -4.09 115.64 109.74 1qmd s THR 166 Ca 0.15 -0.23 0.26 0.00 -1.21 0.00 0.00 61.69 60.67 1qmd s THR 166 Cb 0.13 -0.92 0.12 0.00 -1.51 0.00 0.00 72.50 70.33 1qmd s THR 166 CO 0.01 -0.12 1.60 0.00 -2.21 0.00 0.00 174.62 173.90 1qmd n ALA 167 N 0.71 2.89 0.00 11.08 0.00 -1.26 -4.91 120.51 129.03 1qmd n ALA 167 Ca -0.19 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1qmd n ALA 167 Cb 0.59 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1qmd n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qmd n GLY 168 N 1.45 0.76 3.83 0.00 0.00 -1.26 -5.08 105.19 104.89 1qmd n GLY 168 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.00 1qmd n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qmd s LYS 170 N -2.83 3.48 0.23 0.00 -0.14 -1.26 -4.71 119.74 114.50 1qmd s LYS 170 Ca 0.14 -0.09 0.17 0.00 -1.36 0.00 0.00 55.97 54.83 1qmd s LYS 170 Cb -0.05 -2.51 0.86 0.00 -1.68 0.00 0.00 37.83 34.45 1qmd s LYS 170 CO 0.10 -0.06 1.52 0.25 -0.76 0.00 0.00 175.35 176.40 1qmd n THR 171 N -2.04 1.20 0.85 2.17 -2.24 -0.26 -0.77 114.28 113.19 1qmd n THR 171 Ca -0.02 0.58 0.08 0.00 -2.27 0.00 0.00 64.05 62.42 1qmd n THR 171 Cb 0.56 -1.55 0.25 0.00 -2.10 0.00 0.00 70.33 67.49 1qmd n THR 171 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1qmd n ASN 172 N -2.05 2.10 -4.91 3.42 6.94 -1.26 -4.05 115.26 115.45 1qmd n ASN 172 Ca -0.00 -1.90 -0.20 0.00 -0.02 0.00 0.00 54.58 52.45 1qmd n ASN 172 Cb 0.07 -0.22 -0.02 0.00 -2.36 0.00 0.00 39.78 37.25 1qmd n ASN 172 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1qmd s GLU 173 N -1.57 2.94 0.18 -3.83 2.02 0.05 -4.88 118.70 113.62 1qmd s GLU 173 Ca 0.30 -1.13 -0.14 0.00 0.02 0.00 0.00 54.97 54.03 1qmd s GLU 173 Cb 0.16 -2.64 0.19 0.00 0.10 0.00 0.00 34.13 31.94 1qmd s GLU 173 CO 0.22 0.14 1.22 0.00 0.02 0.00 0.00 175.26 176.86 1qmd n ALA 174 N -1.45 -0.10 -0.00 5.21 0.00 -1.26 -1.28 120.51 121.62 1qmd n ALA 174 Ca -0.02 0.78 -0.10 0.00 0.00 0.00 0.00 53.44 54.09 1qmd n ALA 174 Cb 0.59 -0.35 -0.04 0.00 0.00 0.00 0.00 19.45 19.65 1qmd n ALA 174 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1qmd h PHE 175 N 0.00 -0.87 -0.18 0.00 3.57 -1.95 0.58 116.94 118.08 1qmd h PHE 175 Ca 0.27 0.04 -0.16 0.00 3.53 0.00 0.00 57.97 61.65 1qmd h PHE 175 Cb 0.47 0.40 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 1qmd h PHE 175 CO -0.69 -0.39 -0.55 1.88 -2.23 0.00 0.00 178.31 176.33 1qmd h TYR 176 N -0.38 0.69 -0.18 0.41 0.05 -1.67 -3.22 116.97 112.67 1qmd h TYR 176 Ca 0.10 -0.24 -0.16 0.00 0.05 0.00 0.00 58.73 58.48 1qmd h TYR 176 Cb 0.54 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 1qmd h TYR 176 CO -0.41 0.97 -0.54 1.79 -1.05 0.00 0.00 178.16 178.92 1qmd h THR 177 N 0.42 1.32 0.00 -2.88 1.35 -0.91 -2.92 112.91 109.30 1qmd h THR 177 Ca 0.01 -1.79 -0.04 0.00 -0.55 0.00 0.00 66.41 64.04 1qmd h THR 177 Cb 1.09 1.77 -0.01 0.00 -1.73 0.00 0.00 68.15 69.28 1qmd h THR 177 CO 0.10 0.56 -0.18 0.44 -0.25 0.00 0.00 175.52 176.19 1qmd h ASP 178 N 0.41 0.00 -0.16 5.36 3.32 -0.93 -2.39 116.42 122.03 1qmd h ASP 178 Ca 0.01 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 1qmd h ASP 178 Cb 1.08 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 1qmd h ASP 178 CO 0.10 0.18 -0.19 0.40 -1.72 0.00 0.00 179.24 178.01 1qmd h ILE 179 N 0.00 1.26 0.00 0.35 2.04 -1.52 -3.05 117.51 116.59 1qmd h ILE 179 Ca -0.00 -1.19 -0.01 0.00 1.00 0.00 0.00 64.86 64.66 1qmd h ILE 179 Cb 0.40 1.22 -0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1qmd h ILE 179 CO 0.02 0.39 -0.56 -0.07 0.00 0.00 0.00 178.15 177.93 1qmd h LEU 180 N 0.52 0.00 -0.64 1.44 3.38 -1.47 -3.37 115.31 115.17 1qmd h LEU 180 Ca 0.08 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.11 1qmd h LEU 180 Cb 0.61 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 1qmd h LEU 180 CO 0.04 0.02 0.35 0.50 0.09 0.00 0.00 178.44 179.44 1qmd h LYS 181 N 0.00 0.63 -6.22 1.13 3.64 -1.36 -3.38 116.57 111.01 1qmd h LYS 181 Ca -0.00 -0.04 -0.58 0.00 -1.27 0.00 0.00 60.65 58.75 1qmd h LYS 181 Cb 1.02 -0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 32.60 1qmd h LYS 181 CO 0.00 0.41 0.74 1.21 -2.27 0.00 0.00 179.45 179.55 1qmd s ASN 182 N -5.57 6.42 0.38 4.20 3.84 -1.26 -4.89 114.94 118.05 1qmd s ASN 182 Ca -0.13 -0.07 0.28 0.00 0.21 0.00 0.00 52.86 53.15 1qmd s ASN 182 Cb 0.16 -2.49 1.10 0.00 -0.55 0.00 0.00 41.25 39.47 1qmd s ASN 182 CO 0.76 -1.30 1.82 0.11 -2.79 0.00 0.00 177.10 175.70 1qmd h LYS 183 N 9.36 0.00 -5.21 0.43 1.57 -1.92 -3.39 116.57 117.41 1qmd h LYS 183 Ca -0.25 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 57.87 1qmd h LYS 183 Cb 1.07 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 33.22 1qmd h LYS 183 CO 1.12 0.00 0.54 0.34 -0.57 0.00 0.00 179.45 180.88 1qmd s ASP 184 N -4.91 6.29 0.23 0.86 -1.08 -1.26 -4.90 116.67 111.91 1qmd s ASP 184 Ca 0.03 -1.33 -0.06 0.00 -0.52 0.00 0.00 52.55 50.67 1qmd s ASP 184 Cb 0.09 -2.39 0.32 0.00 -1.46 0.00 0.00 42.92 39.47 1qmd s ASP 184 CO 0.47 -1.29 1.83 0.15 0.52 0.00 0.00 175.17 176.85 1qmd h PHE 185 N 9.32 0.85 -0.33 -5.34 3.04 -1.86 -1.23 116.94 121.40 1qmd h PHE 185 Ca -0.18 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.79 1qmd h PHE 185 Cb 1.06 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 39.29 1qmd h PHE 185 CO 1.00 0.40 0.15 -0.91 -2.02 0.00 0.00 178.31 176.93 1qmd h ASN 186 N 0.83 0.43 -0.38 0.41 -0.26 -1.91 -0.45 115.58 114.26 1qmd h ASN 186 Ca 0.35 -0.13 -0.12 0.00 -0.56 0.00 0.00 56.30 55.84 1qmd h ASN 186 Cb 0.22 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.35 1qmd h ASN 186 CO -0.19 0.45 -0.21 0.00 -1.06 0.00 0.00 177.43 176.42 1qmd h ALA 187 N 1.01 0.81 -0.45 -0.83 0.00 -1.93 -2.20 119.26 115.67 1qmd h ALA 187 Ca 0.11 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1qmd h ALA 187 Cb 0.13 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1qmd h ALA 187 CO -0.01 0.65 0.20 2.35 0.00 0.00 0.00 179.25 182.44 1qmd h TRP 188 N 0.76 0.66 -0.46 0.00 7.01 -1.12 -2.93 115.95 119.87 1qmd h TRP 188 Ca 0.10 -0.04 -0.00 0.00 2.11 0.00 0.00 58.89 61.06 1qmd h TRP 188 Cb 0.75 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 27.58 1qmd h TRP 188 CO 0.04 0.55 0.28 1.03 -2.79 0.00 0.00 178.44 177.55 1qmd h SER 189 N 0.58 0.54 -0.14 2.65 0.87 -0.90 -0.57 113.55 116.58 1qmd h SER 189 Ca 0.15 -0.05 0.04 0.00 -1.23 0.00 0.00 61.79 60.71 1qmd h SER 189 Cb 0.15 -0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 61.92 1qmd h SER 189 CO -0.02 0.43 -0.16 0.11 -0.53 0.00 0.00 176.83 176.67 1qmd h LYS 190 N 0.61 -0.18 -0.31 2.24 1.57 -1.32 -0.46 116.57 118.72 1qmd h LYS 190 Ca 0.16 0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.83 1qmd h LYS 190 Cb -0.02 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1qmd h LYS 190 CO -0.03 -0.12 -0.29 1.49 -0.57 0.00 0.00 179.45 179.93 1qmd h GLU 191 N -0.19 0.74 0.32 3.15 4.81 -1.39 -2.33 114.58 119.69 1qmd h GLU 191 Ca 0.10 -0.38 -0.02 0.00 -0.13 0.00 0.00 59.36 58.93 1qmd h GLU 191 Cb 0.34 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1qmd h GLU 191 CO -0.26 1.01 -0.15 -0.92 -0.73 0.00 0.00 179.01 177.95 1qmd h TYR 192 N 0.50 -0.40 -0.64 0.92 3.20 -0.91 -2.80 116.97 116.84 1qmd h TYR 192 Ca 0.05 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.82 1qmd h TYR 192 Cb 0.86 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.24 1qmd h TYR 192 CO 0.07 -0.20 0.06 0.00 -1.64 0.00 0.00 178.16 176.45 1qmd h ALA 193 N 0.15 0.85 -0.87 1.82 0.00 -1.17 -3.01 119.26 117.02 1qmd h ALA 193 Ca -0.04 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 54.64 1qmd h ALA 193 Cb 0.38 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 1qmd h ALA 193 CO 0.07 0.66 0.54 -0.09 0.00 0.00 0.00 179.25 180.43 1qmd h ARG 194 N 1.00 0.96 -0.90 0.00 2.43 -1.41 0.38 114.38 116.84 1qmd h ARG 194 Ca 0.19 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1qmd h ARG 194 Cb 0.50 -0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 29.79 1qmd h ARG 194 CO 0.02 0.64 0.58 0.78 -1.51 0.00 0.00 179.97 180.48 1qmd h GLY 195 N 0.99 1.29 1.19 2.80 0.00 -1.36 0.11 103.07 108.09 1qmd h GLY 195 Ca 0.38 -0.50 -0.19 0.00 0.00 0.00 0.00 47.33 47.02 1qmd h GLY 195 CO -0.17 0.49 -0.57 0.74 0.00 0.00 0.00 176.54 177.03 1qmd h PHE 196 N 1.23 1.07 -0.64 5.60 0.04 -1.32 -2.78 116.94 120.14 1qmd h PHE 196 Ca 0.33 -0.39 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 1qmd h PHE 196 Cb -0.10 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 37.82 1qmd h PHE 196 CO -0.00 1.22 0.22 0.00 -0.60 0.00 0.00 178.31 179.14 1qmd h ALA 197 N 0.70 0.84 -0.39 2.45 0.00 -0.43 -1.46 119.26 120.97 1qmd h ALA 197 Ca 0.01 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 1qmd h ALA 197 Cb 1.18 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1qmd h ALA 197 CO 0.13 0.49 -0.28 0.87 0.00 0.00 0.00 179.25 180.46 1qmd h LYS 198 N 0.92 0.87 -0.50 0.00 1.57 -0.83 -1.45 116.57 117.14 1qmd h LYS 198 Ca 0.21 -0.42 -0.03 0.00 -1.87 0.00 0.00 60.65 58.54 1qmd h LYS 198 Cb 0.27 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1qmd h LYS 198 CO -0.01 1.07 0.19 1.15 -0.57 0.00 0.00 179.45 181.28 1qmd h THR 199 N 0.68 1.19 -0.60 -0.16 2.02 -1.39 -0.43 112.91 114.23 1qmd h THR 199 Ca 0.07 -0.61 -0.07 0.00 0.77 0.00 0.00 66.41 66.57 1qmd h THR 199 Cb 0.86 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.85 1qmd h THR 199 CO 0.08 0.24 0.09 1.23 0.37 0.00 0.00 175.52 177.53 1qmd h GLY 200 N 0.87 1.04 1.12 2.16 0.00 -0.86 -0.65 103.07 106.75 1qmd h GLY 200 Ca 0.17 -0.66 -0.12 0.00 0.00 0.00 0.00 47.33 46.72 1qmd h GLY 200 CO -0.01 0.62 -0.12 1.70 0.00 0.00 0.00 176.54 178.72 1qmd h LYS 201 N 0.91 1.02 -0.53 4.80 3.64 -0.16 -0.55 116.57 125.70 1qmd h LYS 201 Ca 0.18 -0.38 -0.04 0.00 -1.27 0.00 0.00 60.65 59.14 1qmd h LYS 201 Cb 0.40 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 1qmd h LYS 201 CO 0.01 1.07 0.17 0.77 -2.27 0.00 0.00 179.45 179.19 1qmd h SER 202 N 0.90 0.77 -0.31 4.20 0.02 -0.75 -2.37 113.55 116.00 1qmd h SER 202 Ca 0.14 -0.21 -0.05 0.00 -0.84 0.00 0.00 61.79 60.83 1qmd h SER 202 Cb 0.69 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1qmd h SER 202 CO 0.05 0.77 0.03 0.40 -1.14 0.00 0.00 176.83 176.94 1qmd h ILE 203 N 0.73 1.21 -0.06 3.27 1.08 -0.92 -0.49 117.51 122.33 1qmd h ILE 203 Ca 0.17 -0.82 -0.00 0.00 -0.39 0.00 0.00 64.86 63.82 1qmd h ILE 203 Cb 0.28 0.87 -0.00 0.00 -3.07 0.00 0.00 36.82 34.89 1qmd h ILE 203 CO -0.01 0.29 0.04 0.22 -0.69 0.00 0.00 178.15 178.00 1qmd h TYR 204 N 0.61 0.07 -0.39 1.37 3.20 -0.77 0.46 116.97 121.52 1qmd h TYR 204 Ca 0.13 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.90 1qmd h TYR 204 Cb 0.34 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1qmd h TYR 204 CO 0.01 0.08 -0.17 1.88 -1.64 0.00 0.00 178.16 178.32 1qmd h TYR 205 N 0.05 0.82 0.00 -3.82 0.05 -1.00 -1.13 116.97 111.94 1qmd h TYR 205 Ca 0.02 -0.17 0.00 0.00 0.05 0.00 0.00 58.73 58.63 1qmd h TYR 205 Cb 0.02 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 37.56 1qmd h TYR 205 CO -0.06 0.86 -0.95 0.66 -1.05 0.00 0.00 178.16 177.61 1qmd h SER 206 N 0.66 0.00 0.00 3.88 4.64 -0.89 -3.46 113.55 118.39 1qmd h SER 206 Ca 0.10 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1qmd h SER 206 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 1qmd h SER 206 CO 0.05 0.01 0.00 1.41 -0.87 0.00 0.00 176.83 177.43 1qmd n HIS 207 N -2.65 0.00 0.39 4.77 8.25 0.15 -4.99 115.22 121.15 1qmd n HIS 207 Ca 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.57 1qmd n HIS 207 Cb 0.54 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.58 1qmd n HIS 207 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1qmd n ALA 208 N -0.43 3.34 -0.72 -1.41 0.00 -0.64 -3.41 120.51 117.23 1qmd n ALA 208 Ca 0.00 -0.46 -0.31 0.00 0.00 0.00 0.00 53.44 52.66 1qmd n ALA 208 Cb 0.00 -0.87 0.17 0.00 0.00 0.00 0.00 19.45 18.75 1qmd n ALA 208 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1qmd s SER 209 N -4.12 2.93 0.52 0.00 1.04 -0.44 -4.87 113.70 108.75 1qmd s SER 209 Ca -0.00 2.22 0.27 0.00 0.48 0.00 0.00 55.95 58.92 1qmd s SER 209 Cb 0.14 -2.57 1.39 0.00 0.10 0.00 0.00 66.02 65.08 1qmd s SER 209 CO 0.85 -3.10 1.93 -0.03 0.98 0.00 0.00 173.24 173.86 1qmd h MET 210 N -1.81 0.06 0.00 4.02 1.85 -1.94 -1.71 114.93 115.40 1qmd h MET 210 Ca -0.43 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.65 1qmd h MET 210 Cb 1.27 -0.01 0.00 0.00 0.43 0.00 0.00 31.60 33.29 1qmd h MET 210 CO 0.42 0.04 0.00 0.66 -0.40 0.00 0.00 176.91 177.63 1qmd h SER 211 N 0.06 0.00 -4.22 1.39 4.64 -1.97 -3.45 113.55 110.00 1qmd h SER 211 Ca 0.37 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 61.19 1qmd h SER 211 Cb 1.37 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 63.51 1qmd h SER 211 CO -0.03 0.00 0.38 -1.00 -0.87 0.00 0.00 176.83 175.31 1qmd s HIS 212 N -3.33 3.15 0.97 4.77 3.76 -0.65 -5.05 115.29 118.92 1qmd s HIS 212 Ca 0.06 1.48 -0.12 0.00 -0.15 0.00 0.00 55.06 56.32 1qmd s HIS 212 Cb 0.09 -2.92 0.17 0.00 1.11 0.00 0.00 32.58 31.03 1qmd s HIS 212 CO 0.54 -0.93 1.09 -1.54 -0.85 0.00 0.00 174.74 173.06 1qmd s SER 213 N -3.06 2.86 0.21 1.40 1.04 -1.26 -4.81 113.70 110.08 1qmd s SER 213 Ca 0.61 1.25 -0.09 0.00 0.48 0.00 0.00 55.95 58.21 1qmd s SER 213 Cb -0.14 -1.92 0.16 0.00 0.10 0.00 0.00 66.02 64.22 1qmd s SER 213 CO 0.39 -2.99 1.81 -0.50 0.98 0.00 0.00 173.24 172.93 1qmd h TRP 214 N -1.80 1.11 -0.62 5.02 4.06 -1.96 -0.53 115.95 121.24 1qmd h TRP 214 Ca -0.53 -0.05 0.01 0.00 2.06 0.00 0.00 58.89 60.38 1qmd h TRP 214 Cb 1.32 -0.35 -0.03 0.00 -1.00 0.00 0.00 29.16 29.10 1qmd h TRP 214 CO 0.32 0.80 0.41 -0.44 -3.56 0.00 0.00 178.44 175.98 1qmd h ASP 215 N 1.10 0.72 -0.60 -3.49 3.32 -1.98 0.13 116.42 115.62 1qmd h ASP 215 Ca 0.27 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 1qmd h ASP 215 Cb 0.09 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1qmd h ASP 215 CO -0.04 0.52 0.32 0.44 -1.72 0.00 0.00 179.24 178.76 1qmd h ASP 216 N 0.84 0.76 -0.47 6.45 3.32 -1.66 -0.92 116.42 124.75 1qmd h ASP 216 Ca 0.23 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1qmd h ASP 216 Cb -0.10 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.24 1qmd h ASP 216 CO -0.05 0.65 0.23 -0.50 -1.72 0.00 0.00 179.24 177.85 1qmd h TRP 217 N 0.82 0.68 -0.21 4.55 4.06 -0.51 0.84 115.95 126.18 1qmd h TRP 217 Ca 0.21 -0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.15 1qmd h TRP 217 Cb 0.07 -0.21 -0.02 0.00 -1.00 0.00 0.00 29.16 27.99 1qmd h TRP 217 CO -0.01 0.54 0.08 0.22 -3.56 0.00 0.00 178.44 175.71 1qmd h ASP 218 N 0.62 0.09 -0.78 -3.49 3.58 -0.49 -0.67 116.42 115.29 1qmd h ASP 218 Ca 0.16 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.62 1qmd h ASP 218 Cb 0.12 0.01 -0.04 0.00 1.72 0.00 0.00 39.33 41.14 1qmd h ASP 218 CO -0.02 0.08 0.45 0.22 -2.88 0.00 0.00 179.24 177.09 1qmd h TYR 219 N 0.18 1.04 -0.81 0.28 3.20 -0.86 -0.99 116.97 119.00 1qmd h TYR 219 Ca 0.09 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 1qmd h TYR 219 Cb 0.06 -0.34 -0.04 0.00 1.54 0.00 0.00 36.73 37.95 1qmd h TYR 219 CO -0.12 0.71 0.34 0.00 -1.64 0.00 0.00 178.16 177.46 1qmd h ALA 220 N 1.24 1.07 -0.35 1.82 0.00 -0.39 -1.65 119.26 121.00 1qmd h ALA 220 Ca 0.28 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1qmd h ALA 220 Cb -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1qmd h ALA 220 CO -0.05 0.67 0.10 0.00 0.00 0.00 0.00 179.25 179.97 1qmd h ALA 221 N 1.19 0.46 0.20 0.00 0.00 -0.62 -1.40 119.26 119.08 1qmd h ALA 221 Ca 0.27 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1qmd h ALA 221 Cb 0.19 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1qmd h ALA 221 CO -0.03 0.11 -0.22 -0.22 0.00 0.00 0.00 179.25 178.89 1qmd h LYS 222 N 0.41 -0.45 -0.08 0.00 3.64 -0.87 0.76 116.57 119.98 1qmd h LYS 222 Ca 0.11 0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.38 1qmd h LYS 222 Cb 0.27 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1qmd h LYS 222 CO -0.00 -0.30 -0.60 -0.39 -2.27 0.00 0.00 179.45 175.89 1qmd h VAL 223 N -0.47 1.38 0.00 2.00 -1.51 -1.29 -2.33 116.25 114.03 1qmd h VAL 223 Ca 0.01 -1.96 -0.21 0.00 -1.23 0.00 0.00 66.70 63.30 1qmd h VAL 223 Cb 0.45 1.98 -0.03 0.00 -2.13 0.00 0.00 31.29 31.56 1qmd h VAL 223 CO -0.07 0.58 -1.08 0.71 -1.23 0.00 0.00 177.57 176.48 1qmd h THR 224 N 0.19 1.45 -0.21 7.19 1.35 -1.18 -2.52 112.91 119.17 1qmd h THR 224 Ca -0.01 -3.14 -0.17 0.00 -0.55 0.00 0.00 66.41 62.55 1qmd h THR 224 Cb 1.10 2.71 -0.00 0.00 -1.73 0.00 0.00 68.15 70.23 1qmd h THR 224 CO 0.09 0.83 -0.55 -0.07 -0.25 0.00 0.00 175.52 175.56 1qmd h LEU 225 N 0.00 0.70 -0.17 3.87 3.38 -0.85 0.55 115.31 122.79 1qmd h LEU 225 Ca -0.06 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 1qmd h LEU 225 Cb 1.77 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.31 1qmd h LEU 225 CO 0.11 1.11 0.06 0.00 0.09 0.00 0.00 178.44 179.82 1qmd h ALA 226 N 0.90 0.22 -0.92 1.53 0.00 -1.46 -0.12 119.26 119.41 1qmd h ALA 226 Ca 0.01 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1qmd h ALA 226 Cb 1.11 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1qmd h ALA 226 CO 0.11 -0.18 0.59 -0.91 0.00 0.00 0.00 179.25 178.86 1qmd h ASN 227 N 0.11 0.97 -0.16 0.00 2.35 -1.36 0.12 115.58 117.62 1qmd h ASN 227 Ca 0.06 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1qmd h ASN 227 Cb 0.19 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1qmd h ASN 227 CO -0.00 0.65 0.08 0.28 -1.65 0.00 0.00 177.43 176.79 1qmd h SER 228 N 1.13 0.21 0.05 5.81 0.02 -0.51 0.18 113.55 120.44 1qmd h SER 228 Ca 0.38 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1qmd h SER 228 Cb 0.06 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1qmd h SER 228 CO -0.14 0.27 -0.03 1.56 -1.14 0.00 0.00 176.83 177.36 1qmd h GLN 229 N 0.14 -0.07 -0.23 3.45 4.20 -0.54 -0.69 115.11 121.37 1qmd h GLN 229 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1qmd h GLN 229 Cb 0.11 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1qmd h GLN 229 CO -0.01 0.09 0.15 -0.22 -0.67 0.00 0.00 178.83 178.17 1qmd h LYS 230 N -0.22 0.30 -0.93 1.46 3.64 -0.76 -0.55 116.57 119.52 1qmd h LYS 230 Ca -0.01 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1qmd h LYS 230 Cb 0.19 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.89 1qmd h LYS 230 CO 0.01 0.20 0.61 0.78 -2.27 0.00 0.00 179.45 178.78 1qmd h GLY 231 N 0.31 1.34 0.89 5.01 0.00 -0.58 -1.41 103.07 108.64 1qmd h GLY 231 Ca 0.09 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 1qmd h GLY 231 CO -0.02 0.41 0.08 -0.84 0.00 0.00 0.00 176.54 176.17 1qmd h THR 232 N 1.19 1.21 -0.86 4.70 2.02 -0.75 -1.46 112.91 118.96 1qmd h THR 232 Ca 0.36 -0.70 0.07 0.00 0.77 0.00 0.00 66.41 66.91 1qmd h THR 232 Cb -0.03 1.11 -0.06 0.00 -1.74 0.00 0.00 68.15 67.43 1qmd h THR 232 CO -0.11 0.23 0.53 0.00 0.37 0.00 0.00 175.52 176.54 1qmd h ALA 233 N 0.91 1.19 -0.35 6.16 0.00 -0.69 -0.03 119.26 126.45 1qmd h ALA 233 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1qmd h ALA 233 Cb 0.28 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1qmd h ALA 233 CO -0.00 0.25 0.23 0.78 0.00 0.00 0.00 179.25 180.52 1qmd h GLY 234 N 0.95 0.50 0.99 0.00 0.00 -0.73 -0.16 103.07 104.62 1qmd h GLY 234 Ca 0.38 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1qmd h GLY 234 CO -0.19 0.19 0.29 -0.97 0.00 0.00 0.00 176.54 175.86 1qmd h TYR 235 N 0.48 0.61 -0.51 5.60 0.05 -0.24 -1.71 116.97 121.24 1qmd h TYR 235 Ca 0.13 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.87 1qmd h TYR 235 Cb -0.05 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.47 1qmd h TYR 235 CO -0.05 0.41 0.13 0.82 -1.05 0.00 0.00 178.16 178.42 1qmd h ILE 236 N 0.63 1.21 0.04 -2.88 2.04 -0.74 -0.83 117.51 116.97 1qmd h ILE 236 Ca 0.17 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 1qmd h ILE 236 Cb -0.03 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1qmd h ILE 236 CO -0.03 0.28 -0.02 0.22 0.00 0.00 0.00 178.15 178.60 1qmd h TYR 237 N 0.75 -0.05 -0.99 1.37 3.20 -0.66 -1.12 116.97 119.46 1qmd h TYR 237 Ca 0.17 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.06 1qmd h TYR 237 Cb 0.26 0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.50 1qmd h TYR 237 CO 0.01 0.10 0.65 -0.09 -1.64 0.00 0.00 178.16 177.20 1qmd h ARG 238 N -0.19 1.27 0.25 1.82 9.65 -1.07 -2.16 114.38 123.95 1qmd h ARG 238 Ca -0.01 -0.08 -0.01 0.00 -1.10 0.00 0.00 59.98 58.79 1qmd h ARG 238 Cb 0.18 -0.29 0.00 0.00 -1.39 0.00 0.00 29.97 28.47 1qmd h ARG 238 CO 0.01 0.84 -0.12 0.35 2.80 0.00 0.00 179.97 183.85 1qmd h PHE 239 N 1.31 -0.31 -0.88 2.20 3.57 -0.82 0.12 116.94 122.13 1qmd h PHE 239 Ca 0.38 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.96 1qmd h PHE 239 Cb -0.09 0.10 -0.07 0.00 2.79 0.00 0.00 35.95 38.68 1qmd h PHE 239 CO -0.00 -0.15 0.53 -0.07 -2.23 0.00 0.00 178.31 176.39 1qmd h LEU 240 N -0.40 0.79 -0.57 0.59 3.38 -1.01 0.64 115.31 118.74 1qmd h LEU 240 Ca -0.03 0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1qmd h LEU 240 Cb 0.30 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1qmd h LEU 240 CO 0.06 0.46 -0.39 0.45 0.09 0.00 0.00 178.44 179.11 1qmd h HIS 241 N 0.90 0.85 -0.42 1.13 3.86 -1.19 -1.64 115.15 118.64 1qmd h HIS 241 Ca 0.41 -0.25 -0.10 0.00 -1.16 0.00 0.00 60.37 59.28 1qmd h HIS 241 Cb 0.32 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.59 1qmd h HIS 241 CO -0.04 0.99 -0.13 -0.44 0.86 0.00 0.00 177.93 179.17 1qmd h ASP 242 N 0.59 0.76 0.57 2.45 3.32 0.58 -0.60 116.42 124.09 1qmd h ASP 242 Ca 0.05 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1qmd h ASP 242 Cb 0.92 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1qmd h ASP 242 CO 0.08 0.91 -0.38 1.33 -1.72 0.00 0.00 179.24 179.47 1qmd n VAL 243 N -4.15 0.00 -0.11 -1.35 0.24 0.09 -2.20 118.33 110.85 1qmd n VAL 243 Ca 0.01 -0.01 -0.25 0.00 -2.04 0.00 0.00 64.34 62.05 1qmd n VAL 243 Cb 0.38 0.11 -0.11 0.00 -1.47 0.00 0.00 33.84 32.75 1qmd n VAL 243 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1qmd n SER 244 N -1.42 1.95 -0.19 -1.34 7.64 -0.62 -4.32 113.62 115.32 1qmd n SER 244 Ca 0.07 0.30 0.07 0.00 1.01 0.00 0.00 58.87 60.31 1qmd n SER 244 Cb 0.33 -0.83 0.32 0.00 -1.01 0.00 0.00 64.21 63.02 1qmd n SER 244 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1qmd n GLU 245 N -4.11 1.24 -3.52 1.43 1.02 -0.25 -4.90 120.64 111.55 1qmd n GLU 245 Ca -0.43 -0.37 -0.26 0.00 -0.02 0.00 0.00 57.16 56.09 1qmd n GLU 245 Cb 0.84 -1.23 0.02 0.00 -0.02 0.00 0.00 31.44 31.05 1qmd n GLU 245 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qmd n GLY 246 N 0.81 -0.50 3.68 0.62 0.00 -1.20 -4.89 105.19 103.71 1qmd n GLY 246 Ca 0.10 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 1qmd n GLY 246 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qmd s ASN 247 N -2.97 6.58 -0.27 1.61 0.01 -0.93 -4.98 114.94 114.00 1qmd s ASN 247 Ca 0.49 2.48 -0.23 0.00 -0.71 0.00 0.00 52.86 54.89 1qmd s ASN 247 Cb -0.25 -2.55 -0.01 0.00 0.41 0.00 0.00 41.25 38.86 1qmd s ASN 247 CO 0.61 -0.92 0.77 -0.62 -1.51 0.00 0.00 177.10 175.42 1qmd s ASP 248 N 2.85 6.70 0.15 -1.22 -1.08 -1.26 -4.92 116.67 117.89 1qmd s ASP 248 Ca 0.76 0.80 -0.11 0.00 -0.52 0.00 0.00 52.55 53.48 1qmd s ASP 248 Cb -0.39 -2.40 -0.01 0.00 -1.46 0.00 0.00 42.92 38.66 1qmd s ASP 248 CO 0.33 -0.52 1.53 -0.65 0.52 0.00 0.00 175.17 176.38 1qmd h PRO 249 N 7.92 0.97 0.37 4.34 0.11 -1.86 -3.37 132.00 140.47 1qmd h PRO 249 Ca -0.24 -0.43 -0.02 0.00 0.11 0.00 0.00 66.00 65.41 1qmd h PRO 249 Cb 1.10 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1qmd h PRO 249 CO 0.85 1.10 -0.18 0.66 -0.21 0.00 0.00 178.00 180.23 1qmd h SER 250 N 0.82 -0.42 -4.79 -2.05 4.64 -1.78 -3.44 113.55 106.52 1qmd h SER 250 Ca 0.10 0.01 -0.23 0.00 -0.47 0.00 0.00 61.79 61.21 1qmd h SER 250 Cb 0.82 0.11 0.01 0.00 -0.31 0.00 0.00 62.40 63.03 1qmd h SER 250 CO 0.07 -0.04 -0.65 1.33 -0.87 0.00 0.00 176.83 176.68 1qmd n VAL 251 N -4.84 -1.98 -3.93 0.95 0.24 -1.26 -2.71 118.33 104.80 1qmd n VAL 251 Ca -0.06 0.03 -0.32 0.00 -2.04 0.00 0.00 64.34 61.95 1qmd n VAL 251 Cb 0.20 -1.81 -0.01 0.00 -1.47 0.00 0.00 33.84 30.75 1qmd n VAL 251 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1qmd n GLY 252 N -0.32 -0.47 3.75 7.63 0.00 -1.26 -4.98 105.19 109.53 1qmd n GLY 252 Ca -0.08 0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1qmd n GLY 252 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1qmd s LYS 253 N -6.62 2.83 0.39 1.61 2.20 -1.10 -5.06 119.74 113.99 1qmd s LYS 253 Ca 0.64 -0.68 -0.26 0.00 -0.36 0.00 0.00 55.97 55.31 1qmd s LYS 253 Cb -0.34 -2.70 -0.11 0.00 -1.51 0.00 0.00 37.83 33.17 1qmd s LYS 253 CO 0.79 0.58 1.27 0.09 -0.36 0.00 0.00 175.35 177.72 1qmd n ASN 254 N 0.71 2.61 -4.30 1.43 3.02 -1.26 -4.53 115.26 112.94 1qmd n ASN 254 Ca -0.10 1.14 -0.45 0.00 -0.03 0.00 0.00 54.58 55.13 1qmd n ASN 254 Cb 0.52 -1.49 -0.05 0.00 -0.61 0.00 0.00 39.78 38.14 1qmd n ASN 254 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1qmd s VAL 255 N -1.17 5.10 -0.24 2.41 1.01 0.38 -4.88 120.40 123.01 1qmd s VAL 255 Ca 0.59 -1.70 0.21 0.00 0.00 0.00 0.00 61.98 61.09 1qmd s VAL 255 Cb -0.53 -4.26 0.02 0.00 0.00 0.00 0.00 36.38 31.61 1qmd s VAL 255 CO 0.60 -0.88 1.09 0.11 0.00 0.00 0.00 175.10 176.02 1qmd h LYS 256 N 8.65 0.00 -3.56 2.72 1.57 -1.87 -3.43 116.57 120.65 1qmd h LYS 256 Ca -0.23 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.44 1qmd h LYS 256 Cb 1.09 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.22 1qmd h LYS 256 CO 0.97 0.06 -0.38 -1.21 -0.57 0.00 0.00 179.45 178.32 1qmd s GLU 257 N -3.27 0.71 0.04 3.15 2.02 -1.26 -1.63 118.70 118.47 1qmd s GLU 257 Ca 0.00 -0.64 0.06 0.00 0.02 0.00 0.00 54.97 54.41 1qmd s GLU 257 Cb 0.09 0.29 -0.02 0.00 0.10 0.00 0.00 34.13 34.59 1qmd s GLU 257 CO 0.78 -0.21 -0.17 -0.51 0.02 0.00 0.00 175.26 175.17 1qmd s LEU 258 N -2.13 2.18 -0.06 1.80 1.02 0.12 -4.53 118.68 117.07 1qmd s LEU 258 Ca -0.04 -0.49 0.03 0.00 0.02 0.00 0.00 54.13 53.64 1qmd s LEU 258 Cb -0.01 -0.75 0.01 0.00 0.02 0.00 0.00 46.19 45.45 1qmd s LEU 258 CO -0.04 0.08 -0.15 -0.69 0.02 0.00 0.00 176.35 175.57 1qmd s VAL 259 N -0.85 1.33 -0.15 -1.59 1.01 -0.65 -0.37 120.40 119.14 1qmd s VAL 259 Ca 0.04 -0.62 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 1qmd s VAL 259 Cb -0.08 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 1qmd s VAL 259 CO 0.02 0.39 -0.10 0.00 0.00 0.00 0.00 175.10 175.41 1qmd s ALA 260 N 0.38 2.73 -0.38 5.51 0.00 -0.20 -0.42 121.76 129.37 1qmd s ALA 260 Ca -0.11 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 50.93 1qmd s ALA 260 Cb -0.14 -1.36 0.10 0.00 0.00 0.00 0.00 23.12 21.72 1qmd s ALA 260 CO 0.04 0.13 0.14 -0.47 0.00 0.00 0.00 175.76 175.60 1qmd s TYR 261 N 0.53 3.61 -0.27 0.00 5.04 -0.63 -1.10 117.35 124.53 1qmd s TYR 261 Ca -0.07 -2.53 -0.09 0.00 -2.44 0.00 0.00 57.07 51.94 1qmd s TYR 261 Cb -0.15 -3.04 -0.04 0.00 0.35 0.00 0.00 41.96 39.08 1qmd s TYR 261 CO 0.03 -0.95 0.14 0.42 -1.34 0.00 0.00 175.55 173.85 1qmd s ILE 262 N 1.09 4.86 -0.42 3.14 1.01 0.46 -2.01 121.20 129.33 1qmd s ILE 262 Ca 0.08 -0.01 -0.15 0.00 0.00 0.00 0.00 60.65 60.57 1qmd s ILE 262 Cb -0.21 -3.31 0.03 0.00 0.01 0.00 0.00 42.46 38.97 1qmd s ILE 262 CO -0.05 0.27 0.32 -0.44 0.00 0.00 0.00 174.94 175.04 1qmd s SER 263 N 1.69 6.12 0.25 3.58 0.01 0.11 -0.75 113.70 124.71 1qmd s SER 263 Ca 0.07 -0.92 -0.24 0.00 1.31 0.00 0.00 55.95 56.16 1qmd s SER 263 Cb -0.16 -2.17 -0.09 0.00 0.21 0.00 0.00 66.02 63.82 1qmd s SER 263 CO 0.08 -0.48 0.84 -0.89 0.41 0.00 0.00 173.24 173.20 1qmd s THR 264 N 1.71 4.33 0.48 1.44 2.01 0.17 -0.86 115.64 124.92 1qmd s THR 264 Ca 0.05 1.67 -0.23 0.00 0.31 0.00 0.00 61.69 63.50 1qmd s THR 264 Cb -0.19 -4.03 -0.08 0.00 0.01 0.00 0.00 72.50 68.20 1qmd s THR 264 CO 0.10 0.29 1.15 -0.24 -0.69 0.00 0.00 174.62 175.23 1qmd n SER 265 N 0.95 1.83 -0.00 3.53 2.88 -0.23 -2.92 113.62 119.66 1qmd n SER 265 Ca -0.01 1.00 0.14 0.00 -1.33 0.00 0.00 58.87 58.67 1qmd n SER 265 Cb 0.50 -1.45 0.63 0.00 -0.75 0.00 0.00 64.21 63.14 1qmd n SER 265 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1qmd n GLY 266 N 1.01 -1.46 3.71 0.46 0.00 -1.26 -0.23 105.19 107.41 1qmd n GLY 266 Ca 0.09 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1qmd n GLY 266 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1qmd n GLU 267 N -1.47 0.65 -1.88 1.61 1.02 -1.26 -4.68 120.64 114.63 1qmd n GLU 267 Ca 0.08 0.29 -0.41 0.00 -0.02 0.00 0.00 57.16 57.09 1qmd n GLU 267 Cb 0.33 -2.48 -0.02 0.00 -0.02 0.00 0.00 31.44 29.25 1qmd n GLU 267 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1qmd s LYS 268 N -3.73 4.18 0.00 3.49 2.47 -1.26 -2.22 119.74 122.66 1qmd s LYS 268 Ca 0.78 2.47 0.00 0.00 -1.56 0.00 0.00 55.97 57.66 1qmd s LYS 268 Cb -0.34 -3.04 0.00 0.00 -1.46 0.00 0.00 37.83 32.99 1qmd s LYS 268 CO 0.46 -0.51 0.00 -0.25 0.16 0.00 0.00 175.35 175.20 1qmd n ASP 269 N 1.77 -4.51 -0.11 1.43 8.00 -1.26 -4.90 116.55 116.97 1qmd n ASP 269 Ca 0.06 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.53 1qmd n ASP 269 Cb 0.39 -2.06 0.21 0.00 -0.02 0.00 0.00 41.12 39.65 1qmd n ASP 269 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qmd h ALA 270 N 0.00 1.26 -2.09 2.24 0.00 -1.72 -3.43 119.26 115.51 1qmd h ALA 270 Ca 0.00 -0.19 -0.42 0.00 0.00 0.00 0.00 54.91 54.30 1qmd h ALA 270 Cb 0.52 -0.21 0.18 0.00 0.00 0.00 0.00 17.79 18.27 1qmd h ALA 270 CO 0.00 0.52 0.17 0.20 0.00 0.00 0.00 179.25 180.14 1qmd s GLY 271 N -3.65 1.59 0.03 0.00 0.00 -1.26 -0.13 107.32 103.90 1qmd s GLY 271 Ca -0.09 -0.85 -0.18 0.00 0.00 0.00 0.00 44.72 43.59 1qmd s GLY 271 CO 0.79 -0.03 0.41 -1.08 0.00 0.00 0.00 173.10 173.19 1qmd s THR 272 N -3.07 0.05 -1.47 0.90 -1.32 -0.58 -4.52 115.64 105.64 1qmd s THR 272 Ca 0.70 -0.44 0.12 0.00 -1.21 0.00 0.00 61.69 60.86 1qmd s THR 272 Cb -0.11 -0.90 0.08 0.00 -1.51 0.00 0.00 72.50 70.06 1qmd s THR 272 CO 0.56 -0.24 0.86 0.47 -2.21 0.00 0.00 174.62 174.05 1qmd n ASP 273 N 0.67 1.90 -4.76 8.08 8.00 -1.26 -4.59 116.55 124.58 1qmd n ASP 273 Ca -0.19 -1.45 -0.30 0.00 0.71 0.00 0.00 54.79 53.56 1qmd n ASP 273 Cb 0.59 0.10 0.12 0.00 -0.02 0.00 0.00 41.12 41.91 1qmd n ASP 273 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1qmd s ASP 274 N -1.16 3.91 0.21 -2.24 1.01 -1.26 -4.78 116.67 112.36 1qmd s ASP 274 Ca 0.14 1.33 -0.30 0.00 0.71 0.00 0.00 52.55 54.42 1qmd s ASP 274 Cb 0.10 -2.02 -0.09 0.00 1.01 0.00 0.00 42.92 41.93 1qmd s ASP 274 CO 0.19 -2.34 1.27 -0.31 0.21 0.00 0.00 175.17 174.19 1qmd s TYR 275 N -3.08 3.30 -0.02 4.23 2.02 -0.40 -4.88 117.35 118.53 1qmd s TYR 275 Ca 0.62 1.31 0.06 0.00 -0.37 0.00 0.00 57.07 58.70 1qmd s TYR 275 Cb -0.16 -3.55 -0.01 0.00 -0.40 0.00 0.00 41.96 37.84 1qmd s TYR 275 CO 0.55 -1.64 -0.21 -1.64 -1.57 0.00 0.00 175.55 171.05 1qmd s MET 276 N -0.34 1.74 0.12 -0.62 -1.94 -1.26 -0.68 119.30 116.32 1qmd s MET 276 Ca 0.54 -0.74 0.02 0.00 -1.71 0.00 0.00 55.69 53.81 1qmd s MET 276 Cb -0.35 -1.65 -0.04 0.00 2.01 0.00 0.00 34.83 34.79 1qmd s MET 276 CO 0.39 0.42 -0.07 0.71 -0.01 0.00 0.00 175.02 176.47 1qmd s TYR 277 N -0.42 1.04 0.03 -0.03 1.51 0.13 -1.07 117.35 118.53 1qmd s TYR 277 Ca 0.06 -0.89 0.05 0.00 -1.01 0.00 0.00 57.07 55.29 1qmd s TYR 277 Cb -0.09 -0.57 -0.02 0.00 -0.11 0.00 0.00 41.96 41.17 1qmd s TYR 277 CO -0.00 -0.09 -0.16 0.12 -1.11 0.00 0.00 175.55 174.31 1qmd s PHE 278 N -3.55 1.38 0.10 2.71 5.36 -0.42 -0.33 117.98 123.24 1qmd s PHE 278 Ca 0.15 -0.33 -0.10 0.00 -0.96 0.00 0.00 56.93 55.70 1qmd s PHE 278 Cb 0.05 -0.84 0.00 0.00 -0.34 0.00 0.00 43.02 41.89 1qmd s PHE 278 CO -0.02 0.03 0.23 0.20 -1.46 0.00 0.00 175.22 174.19 1qmd s GLY 279 N -0.91 0.10 0.06 13.12 0.00 0.05 -0.30 107.32 119.45 1qmd s GLY 279 Ca 0.04 -0.59 0.02 0.00 0.00 0.00 0.00 44.72 44.19 1qmd s GLY 279 CO 0.01 -0.75 -0.07 -0.26 0.00 0.00 0.00 173.10 172.03 1qmd s ILE 280 N -3.87 0.54 -0.04 0.90 -4.36 -0.49 -1.50 121.20 112.38 1qmd s ILE 280 Ca 0.06 -1.41 0.01 0.00 -0.26 0.00 0.00 60.65 59.05 1qmd s ILE 280 Cb 0.04 -1.02 0.02 0.00 1.25 0.00 0.00 42.46 42.76 1qmd s ILE 280 CO -0.10 -0.60 -0.05 -0.75 0.24 0.00 0.00 174.94 173.68 1qmd s LYS 281 N -2.51 0.80 0.72 0.37 2.20 -0.17 -2.07 119.74 119.08 1qmd s LYS 281 Ca -0.02 -0.13 -0.06 0.00 -0.36 0.00 0.00 55.97 55.41 1qmd s LYS 281 Cb -0.04 -0.80 0.09 0.00 -1.51 0.00 0.00 37.83 35.57 1qmd s LYS 281 CO -0.02 -0.04 1.02 0.95 -0.36 0.00 0.00 175.35 176.89 1qmd s THR 282 N 0.74 2.27 0.45 3.43 -4.23 0.41 -0.51 115.64 118.20 1qmd s THR 282 Ca -0.10 -0.35 0.14 0.00 -1.18 0.00 0.00 61.69 60.21 1qmd s THR 282 Cb -0.13 -2.92 0.19 0.00 1.34 0.00 0.00 72.50 70.98 1qmd s THR 282 CO 0.00 0.00 2.01 0.50 -0.54 0.00 0.00 174.62 176.59 1qmd h LYS 283 N -0.62 0.01 -0.02 3.99 3.64 -1.09 -1.18 116.57 121.31 1qmd h LYS 283 Ca -0.43 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1qmd h LYS 283 Cb 1.30 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 1qmd h LYS 283 CO 0.53 0.17 0.00 -0.25 -2.27 0.00 0.00 179.45 177.63 1qmd n ASP 284 N -4.35 0.73 0.00 4.20 8.00 -1.26 -4.92 116.55 118.96 1qmd n ASP 284 Ca -0.02 -1.28 0.00 0.00 0.71 0.00 0.00 54.79 54.20 1qmd n ASP 284 Cb 0.22 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 1qmd n ASP 284 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qmd n GLY 285 N 1.07 0.75 3.75 0.44 0.00 -0.45 -5.05 105.19 105.71 1qmd n GLY 285 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1qmd n GLY 285 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qmd s LYS 286 N -0.46 4.79 0.08 1.61 1.02 -1.26 -4.75 119.74 120.76 1qmd s LYS 286 Ca 0.00 1.59 0.07 0.00 0.02 0.00 0.00 55.97 57.65 1qmd s LYS 286 Cb 0.00 -3.25 -0.03 0.00 -0.52 0.00 0.00 37.83 34.03 1qmd s LYS 286 CO 0.00 0.42 -0.18 0.95 -0.92 0.00 0.00 175.35 175.62 1qmd s THR 287 N -1.16 1.44 -0.06 2.17 -4.23 -1.26 -0.45 115.64 112.10 1qmd s THR 287 Ca 0.42 -1.36 -0.05 0.00 -1.18 0.00 0.00 61.69 59.53 1qmd s THR 287 Cb -0.28 -1.32 0.02 0.00 1.34 0.00 0.00 72.50 72.26 1qmd s THR 287 CO 0.35 -0.07 0.15 -1.58 -0.54 0.00 0.00 174.62 172.93 1qmd s GLN 288 N -1.67 0.16 0.03 3.99 0.74 -0.88 -5.01 119.66 117.02 1qmd s GLN 288 Ca 0.03 0.25 0.05 0.00 0.05 0.00 0.00 55.36 55.74 1qmd s GLN 288 Cb -0.10 0.02 -0.02 0.00 1.10 0.00 0.00 33.01 34.02 1qmd s GLN 288 CO 0.03 -0.06 -0.15 -2.00 -0.55 0.00 0.00 175.29 172.56 1qmd s GLU 289 N 0.34 1.03 0.06 1.67 2.12 -1.26 -1.39 118.70 121.27 1qmd s GLU 289 Ca -0.02 -0.76 0.07 0.00 0.36 0.00 0.00 54.97 54.62 1qmd s GLU 289 Cb -0.03 -1.05 -0.03 0.00 0.26 0.00 0.00 34.13 33.28 1qmd s GLU 289 CO -0.01 0.26 -0.19 -1.58 -0.54 0.00 0.00 175.26 173.20 1qmd s TRP 290 N -0.78 1.69 -0.08 5.30 0.51 0.59 -4.74 118.94 121.42 1qmd s TRP 290 Ca 0.03 -0.38 -0.23 0.00 -2.12 0.00 0.00 56.10 53.40 1qmd s TRP 290 Cb -0.08 -0.98 -0.04 0.00 -0.81 0.00 0.00 33.47 31.57 1qmd s TRP 290 CO 0.01 0.11 0.68 -1.21 -0.51 0.00 0.00 176.95 176.03 1qmd s GLU 291 N -1.37 4.41 -0.60 4.98 2.02 0.25 -1.31 118.70 127.08 1qmd s GLU 291 Ca 0.06 0.84 -0.20 0.00 0.02 0.00 0.00 54.97 55.69 1qmd s GLU 291 Cb -0.09 -3.46 0.09 0.00 0.10 0.00 0.00 34.13 30.77 1qmd s GLU 291 CO 0.02 0.03 0.76 -1.64 0.02 0.00 0.00 175.26 174.46 1qmd s MET 292 N 0.92 3.07 -0.21 1.61 -1.94 -0.23 -2.83 119.30 119.70 1qmd s MET 292 Ca 0.36 -1.16 -0.06 0.00 -1.71 0.00 0.00 55.69 53.13 1qmd s MET 292 Cb -0.17 -4.24 0.10 0.00 2.01 0.00 0.00 34.83 32.53 1qmd s MET 292 CO 0.17 -1.58 0.40 0.34 -0.01 0.00 0.00 175.02 174.34 1qmd s ASP 293 N 3.55 -0.13 0.41 3.03 2.15 -1.26 -4.63 116.67 119.79 1qmd s ASP 293 Ca 0.14 0.80 0.08 0.00 0.43 0.00 0.00 52.55 54.00 1qmd s ASP 293 Cb -0.22 1.27 -0.03 0.00 -0.30 0.00 0.00 42.92 43.64 1qmd s ASP 293 CO 0.08 -0.25 0.29 0.20 -0.17 0.00 0.00 175.17 175.32 1qmd s ASN 294 N 2.59 4.80 0.26 -0.34 0.01 -1.26 -4.64 114.94 116.36 1qmd s ASN 294 Ca 0.02 -0.86 -0.02 0.00 -0.71 0.00 0.00 52.86 51.28 1qmd s ASN 294 Cb -0.13 -0.56 0.51 0.00 0.41 0.00 0.00 41.25 41.49 1qmd s ASN 294 CO -0.13 -0.58 1.74 -0.65 -1.51 0.00 0.00 177.10 175.96 1qmd h PRO 295 N 1.21 0.48 0.00 -0.60 0.11 -2.01 -3.44 132.00 127.75 1qmd h PRO 295 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1qmd h PRO 295 Cb 1.26 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1qmd h PRO 295 CO 0.62 0.32 0.00 0.41 -0.21 0.00 0.00 178.00 179.14 1qmd n GLY 296 N -1.33 0.22 3.55 -0.55 0.00 -1.26 -4.97 105.19 100.85 1qmd n GLY 296 Ca 0.16 -1.53 -0.43 0.00 0.00 0.00 0.00 46.02 44.22 1qmd n GLY 296 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1qmd s ASN 297 N -1.03 6.45 0.54 1.61 3.84 -1.04 -5.04 114.94 120.28 1qmd s ASN 297 Ca 0.00 -0.00 -0.16 0.00 0.21 0.00 0.00 52.86 52.90 1qmd s ASN 297 Cb 0.00 -2.42 -0.07 0.00 -0.55 0.00 0.00 41.25 38.21 1qmd s ASN 297 CO 0.00 -1.01 1.01 -1.81 -2.79 0.00 0.00 177.10 172.49 1qmd s ASP 298 N 2.25 6.38 -1.40 -4.21 1.01 -1.26 -4.39 116.67 115.05 1qmd s ASP 298 Ca 0.34 1.64 -0.02 0.00 0.71 0.00 0.00 52.55 55.21 1qmd s ASP 298 Cb -0.11 -2.51 0.01 0.00 1.01 0.00 0.00 42.92 41.32 1qmd s ASP 298 CO 0.25 -0.75 0.55 0.49 0.21 0.00 0.00 175.17 175.91 1qmd n PHE 299 N -1.73 -1.76 -1.77 4.23 3.72 -1.26 -4.62 117.46 114.27 1qmd n PHE 299 Ca 0.07 0.78 -0.31 0.00 -0.05 0.00 0.00 57.45 57.95 1qmd n PHE 299 Cb 0.54 -3.89 0.03 0.00 -0.94 0.00 0.00 39.48 35.22 1qmd n PHE 299 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1qmd s MET 300 N -6.42 3.14 0.14 -1.08 -1.94 -1.26 -1.52 119.30 110.35 1qmd s MET 300 Ca 0.09 0.73 -0.31 0.00 -1.71 0.00 0.00 55.69 54.48 1qmd s MET 300 Cb -0.04 -2.03 -0.11 0.00 2.01 0.00 0.00 34.83 34.66 1qmd s MET 300 CO 0.87 -0.89 1.83 2.41 -0.01 0.00 0.00 175.02 179.23 1qmd n THR 301 N -2.96 0.33 -0.96 2.05 -1.04 -1.26 -1.73 114.28 108.71 1qmd n THR 301 Ca 0.07 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1qmd n THR 301 Cb 0.55 -2.13 0.00 0.00 -1.82 0.00 0.00 70.33 66.93 1qmd n THR 301 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1qmd n GLY 302 N 4.22 0.61 3.84 3.41 0.00 0.68 -4.90 105.19 113.06 1qmd n GLY 302 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1qmd n GLY 302 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qmd s SER 303 N -2.39 5.49 -0.45 1.61 1.04 -0.70 -4.71 113.70 113.58 1qmd s SER 303 Ca 0.00 1.49 0.02 0.00 0.48 0.00 0.00 55.95 57.94 1qmd s SER 303 Cb 0.00 -2.38 0.14 0.00 0.10 0.00 0.00 66.02 63.88 1qmd s SER 303 CO 0.00 -1.36 0.26 -0.54 0.98 0.00 0.00 173.24 172.58 1qmd s LYS 304 N -5.12 1.32 0.20 4.02 1.02 -0.70 0.44 119.74 120.93 1qmd s LYS 304 Ca 0.58 -2.09 -0.04 0.00 0.02 0.00 0.00 55.97 54.44 1qmd s LYS 304 Cb -0.13 -2.32 -0.05 0.00 -0.52 0.00 0.00 37.83 34.81 1qmd s LYS 304 CO 0.54 -1.19 0.44 -0.51 -0.92 0.00 0.00 175.35 173.72 1qmd s ASP 305 N 0.23 6.46 -0.05 2.83 1.01 0.07 -4.81 116.67 122.42 1qmd s ASP 305 Ca 0.19 0.60 0.06 0.00 0.71 0.00 0.00 52.55 54.12 1qmd s ASP 305 Cb -0.21 -2.09 -0.01 0.00 1.01 0.00 0.00 42.92 41.61 1qmd s ASP 305 CO -0.02 -0.05 -0.25 -0.89 0.21 0.00 0.00 175.17 174.17 1qmd s THR 306 N -1.84 2.00 -0.06 -1.27 2.01 -1.26 -0.41 115.64 114.82 1qmd s THR 306 Ca 0.42 -1.05 0.00 0.00 0.31 0.00 0.00 61.69 61.37 1qmd s THR 306 Cb -0.11 -1.68 0.02 0.00 0.01 0.00 0.00 72.50 70.74 1qmd s THR 306 CO 0.27 0.56 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.41 1qmd s TYR 307 N -0.27 0.78 -0.23 4.92 2.02 -0.25 -4.91 117.35 119.41 1qmd s TYR 307 Ca -0.00 -0.23 -0.08 0.00 -0.37 0.00 0.00 57.07 56.39 1qmd s TYR 307 Cb -0.13 -0.74 -0.04 0.00 -0.40 0.00 0.00 41.96 40.66 1qmd s TYR 307 CO 0.02 -0.25 0.10 0.99 -1.57 0.00 0.00 175.55 174.84 1qmd s THR 308 N 1.23 4.78 -0.17 -0.71 2.01 -1.24 -1.03 115.64 120.50 1qmd s THR 308 Ca -0.06 -0.02 -0.02 0.00 0.31 0.00 0.00 61.69 61.90 1qmd s THR 308 Cb -0.14 -3.21 -0.01 0.00 0.01 0.00 0.00 72.50 69.16 1qmd s THR 308 CO -0.02 0.37 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.82 1qmd s PHE 309 N 1.08 2.87 -0.22 4.92 0.08 0.50 0.13 117.98 127.34 1qmd s PHE 309 Ca 0.05 -0.89 -0.09 0.00 0.12 0.00 0.00 56.93 56.12 1qmd s PHE 309 Cb -0.14 -1.96 -0.04 0.00 -0.57 0.00 0.00 43.02 40.30 1qmd s PHE 309 CO 0.04 -0.42 0.12 0.21 -0.10 0.00 0.00 175.22 175.06 1qmd s LYS 310 N 0.93 3.97 0.36 0.44 2.20 -1.26 -0.71 119.74 125.68 1qmd s LYS 310 Ca -0.02 -0.33 -0.20 0.00 -0.36 0.00 0.00 55.97 55.07 1qmd s LYS 310 Cb -0.15 -3.41 -0.10 0.00 -1.51 0.00 0.00 37.83 32.66 1qmd s LYS 310 CO -0.00 0.08 0.86 -0.51 -0.36 0.00 0.00 175.35 175.42 1qmd s LEU 311 N 0.95 4.08 -0.05 5.43 1.02 -0.64 -4.91 118.68 124.57 1qmd s LEU 311 Ca 0.06 1.56 -0.23 0.00 0.02 0.00 0.00 54.13 55.53 1qmd s LEU 311 Cb -0.13 -4.21 -0.18 0.00 0.02 0.00 0.00 46.19 41.68 1qmd s LEU 311 CO 0.03 -0.22 1.00 0.11 0.02 0.00 0.00 176.35 177.29 1qmd h LYS 312 N 2.38 -0.15 -6.25 1.70 1.57 -1.96 -3.42 116.57 110.44 1qmd h LYS 312 Ca -0.48 0.01 -0.57 0.00 -1.87 0.00 0.00 60.65 57.73 1qmd h LYS 312 Cb 1.18 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.47 1qmd h LYS 312 CO 0.63 0.34 0.85 0.34 -0.57 0.00 0.00 179.45 181.04 1qmd s ASP 313 N -5.57 6.94 -0.07 0.86 -1.08 -1.26 -4.93 116.67 111.58 1qmd s ASP 313 Ca -0.14 1.18 0.20 0.00 -0.52 0.00 0.00 52.55 53.28 1qmd s ASP 313 Cb 0.01 -2.54 0.70 0.00 -1.46 0.00 0.00 42.92 39.62 1qmd s ASP 313 CO 0.55 -0.85 1.60 -0.62 0.52 0.00 0.00 175.17 176.37 1qmd n GLU 314 N 6.77 3.33 -0.61 4.34 1.02 -1.26 -4.37 120.64 129.86 1qmd n GLU 314 Ca 0.12 -2.81 0.05 0.00 -0.02 0.00 0.00 57.16 54.50 1qmd n GLU 314 Cb 0.47 -1.76 0.21 0.00 -0.02 0.00 0.00 31.44 30.33 1qmd n GLU 314 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1qmd n ASN 315 N 1.36 1.87 -4.75 1.62 4.13 -1.26 -4.63 115.26 113.59 1qmd n ASN 315 Ca 0.25 -3.85 -0.36 0.00 1.68 0.00 0.00 54.58 52.31 1qmd n ASN 315 Cb 0.78 -0.54 -0.08 0.00 -1.54 0.00 0.00 39.78 38.40 1qmd n ASN 315 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1qmd s LEU 316 N -3.22 3.94 0.44 3.41 1.43 -1.26 -4.97 118.68 118.45 1qmd s LEU 316 Ca 0.39 0.26 0.01 0.00 -1.03 0.00 0.00 54.13 53.76 1qmd s LEU 316 Cb 0.37 -1.94 -0.00 0.00 0.03 0.00 0.00 46.19 44.65 1qmd s LEU 316 CO -0.05 0.36 0.66 -0.54 0.23 0.00 0.00 176.35 177.00 1qmd s LYS 317 N -0.74 3.07 0.41 1.70 -0.14 -1.26 -0.47 119.74 122.30 1qmd s LYS 317 Ca 0.12 -0.52 0.08 0.00 -1.36 0.00 0.00 55.97 54.30 1qmd s LYS 317 Cb -0.12 -2.57 0.87 0.00 -1.68 0.00 0.00 37.83 34.34 1qmd s LYS 317 CO 0.03 -0.25 2.02 0.97 -0.76 0.00 0.00 175.35 177.35 1qmd h ILE 318 N 0.42 1.04 0.00 2.17 6.09 -1.96 -1.98 117.51 123.29 1qmd h ILE 318 Ca -0.46 -0.19 -0.01 0.00 -1.37 0.00 0.00 64.86 62.83 1qmd h ILE 318 Cb 1.25 0.43 -0.00 0.00 0.47 0.00 0.00 36.82 38.97 1qmd h ILE 318 CO 0.57 0.10 -0.04 0.44 -3.07 0.00 0.00 178.15 176.15 1qmd h ASP 319 N 0.56 0.00 0.82 2.19 3.32 -1.98 -2.74 116.42 118.59 1qmd h ASP 319 Ca 0.21 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 1qmd h ASP 319 Cb 0.13 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1qmd h ASP 319 CO -0.05 0.04 -0.05 0.44 -1.72 0.00 0.00 179.24 177.90 1qmd h ASP 320 N 0.00 0.00 -3.47 6.45 3.32 -1.74 -3.41 116.42 117.57 1qmd h ASP 320 Ca -0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 1qmd h ASP 320 Cb 0.68 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.15 1qmd h ASP 320 CO 0.01 0.05 0.71 -0.63 -1.72 0.00 0.00 179.24 177.65 1qmd s ILE 321 N -3.77 4.51 -0.15 0.35 1.01 -1.04 -0.44 121.20 121.68 1qmd s ILE 321 Ca -0.00 1.34 -0.12 0.00 0.00 0.00 0.00 60.65 61.87 1qmd s ILE 321 Cb 0.10 -4.39 -0.09 0.00 0.01 0.00 0.00 42.46 38.09 1qmd s ILE 321 CO 0.55 -0.59 0.09 -0.61 0.00 0.00 0.00 174.94 174.38 1qmd h GLN 322 N 8.47 0.00 -6.54 2.79 4.15 -1.03 -3.47 115.11 119.49 1qmd h GLN 322 Ca -0.22 0.00 -0.63 0.00 0.77 0.00 0.00 58.65 58.57 1qmd h GLN 322 Cb 1.07 0.00 -0.22 0.00 0.21 0.00 0.00 27.48 28.54 1qmd h GLN 322 CO 1.01 0.36 -0.85 -0.80 -1.93 0.00 0.00 178.83 176.63 1qmd s ASN 323 N -6.00 2.93 0.05 -0.69 0.02 -0.88 -4.93 114.94 105.43 1qmd s ASN 323 Ca -0.15 -0.70 0.03 0.00 -1.02 0.00 0.00 52.86 51.03 1qmd s ASN 323 Cb 0.02 -0.19 -0.02 0.00 0.02 0.00 0.00 41.25 41.07 1qmd s ASN 323 CO 0.31 0.13 -0.10 -0.04 0.02 0.00 0.00 177.10 177.42 1qmd s MET 324 N -1.87 0.65 0.28 -0.60 -1.94 -1.26 -1.00 119.30 113.56 1qmd s MET 324 Ca 0.10 -0.77 -0.21 0.00 -1.71 0.00 0.00 55.69 53.10 1qmd s MET 324 Cb -0.10 -0.54 0.02 0.00 2.01 0.00 0.00 34.83 36.22 1qmd s MET 324 CO 0.05 0.12 0.71 1.67 -0.01 0.00 0.00 175.02 177.55 1qmd s TRP 325 N -1.19 -0.18 0.08 -0.03 -2.14 -0.56 -1.60 118.94 113.31 1qmd s TRP 325 Ca -0.05 -0.28 0.08 0.00 2.66 0.00 0.00 56.10 58.51 1qmd s TRP 325 Cb -0.09 0.69 -0.03 0.00 -3.10 0.00 0.00 33.47 30.94 1qmd s TRP 325 CO 0.01 -1.23 -0.21 0.96 -2.66 0.00 0.00 176.95 173.82 1qmd s ILE 326 N -3.92 1.71 -0.01 0.66 -4.36 -0.39 -0.77 121.20 114.11 1qmd s ILE 326 Ca 0.11 -1.40 0.02 0.00 -0.26 0.00 0.00 60.65 59.12 1qmd s ILE 326 Cb -0.06 -1.52 0.00 0.00 1.25 0.00 0.00 42.46 42.13 1qmd s ILE 326 CO 0.07 0.06 -0.05 -0.60 0.24 0.00 0.00 174.94 174.65 1qmd s ARG 327 N -1.60 0.49 -0.06 0.37 3.52 0.56 -0.64 118.95 121.59 1qmd s ARG 327 Ca 0.07 -0.18 0.02 0.00 -0.13 0.00 0.00 55.73 55.51 1qmd s ARG 327 Cb -0.09 -0.49 -0.03 0.00 -1.56 0.00 0.00 34.95 32.78 1qmd s ARG 327 CO 0.03 0.09 -0.11 0.21 -0.81 0.00 0.00 175.30 174.71 1qmd s LYS 328 N 0.03 2.66 -0.06 5.12 2.20 -0.67 0.17 119.74 129.18 1qmd s LYS 328 Ca 0.00 -0.63 0.02 0.00 -0.36 0.00 0.00 55.97 54.99 1qmd s LYS 328 Cb -0.04 -2.48 0.02 0.00 -1.51 0.00 0.00 37.83 33.81 1qmd s LYS 328 CO -0.00 0.62 -0.09 0.50 -0.36 0.00 0.00 175.35 176.02 1qmd s ARG 329 N -0.70 1.34 0.20 4.03 3.52 0.14 -2.88 118.95 124.60 1qmd s ARG 329 Ca 0.11 -0.28 -0.33 0.00 -0.13 0.00 0.00 55.73 55.10 1qmd s ARG 329 Cb -0.11 -1.20 -0.13 0.00 -1.56 0.00 0.00 34.95 31.95 1qmd s ARG 329 CO 0.01 -0.04 1.58 1.63 -0.81 0.00 0.00 175.30 177.66 1qmd n LYS 330 N 4.01 2.30 0.06 5.12 5.02 -1.26 -1.27 118.16 132.14 1qmd n LYS 330 Ca -0.23 0.83 -0.21 0.00 -2.02 0.00 0.00 58.31 56.68 1qmd n LYS 330 Cb 0.51 -2.59 -0.15 0.00 -0.02 0.00 0.00 35.03 32.78 1qmd n LYS 330 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1qmd h TYR 331 N 5.66 0.60 -2.91 2.13 3.20 -1.90 -3.45 116.97 120.30 1qmd h TYR 331 Ca -0.45 -0.44 -0.51 0.00 3.14 0.00 0.00 58.73 60.47 1qmd h TYR 331 Cb 1.24 -0.02 -0.13 0.00 1.54 0.00 0.00 36.73 39.36 1qmd h TYR 331 CO 0.61 1.44 -0.54 0.95 -1.64 0.00 0.00 178.16 178.98 1qmd s THR 332 N -2.48 0.68 0.17 1.81 -4.23 -1.26 -5.04 115.64 105.30 1qmd s THR 332 Ca -0.15 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 58.68 1qmd s THR 332 Cb 0.03 -2.48 0.35 0.00 1.34 0.00 0.00 72.50 71.74 1qmd s THR 332 CO 0.84 0.00 1.98 0.00 -0.54 0.00 0.00 174.62 176.89 1qmd h ALA 333 N 1.94 1.03 -2.65 3.99 0.00 -2.04 -3.44 119.26 118.10 1qmd h ALA 333 Ca -0.36 -0.06 -0.52 0.00 0.00 0.00 0.00 54.91 53.96 1qmd h ALA 333 Cb 1.26 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.06 1qmd h ALA 333 CO 0.59 0.08 0.56 -0.06 0.00 0.00 0.00 179.25 180.42 1qmd s PHE 334 N -3.74 3.42 0.38 0.00 0.40 -1.26 -4.98 117.98 112.20 1qmd s PHE 334 Ca 0.00 1.41 -0.27 0.00 -0.60 0.00 0.00 56.93 57.48 1qmd s PHE 334 Cb 0.10 -3.43 -0.09 0.00 0.51 0.00 0.00 43.02 40.10 1qmd s PHE 334 CO 0.56 -1.23 1.27 -1.54 0.70 0.00 0.00 175.22 174.98 1qmd s SER 335 N 0.19 6.48 -0.46 1.36 1.04 -1.26 -4.89 113.70 116.15 1qmd s SER 335 Ca 0.53 2.59 0.06 0.00 0.48 0.00 0.00 55.95 59.61 1qmd s SER 335 Cb -0.33 -2.64 0.20 0.00 0.10 0.00 0.00 66.02 63.36 1qmd s SER 335 CO 0.36 -0.73 0.59 -0.67 0.98 0.00 0.00 173.24 173.78 1qmd n ASP 336 N 0.29 -1.82 -4.75 7.02 -0.08 -1.26 -5.14 116.55 110.81 1qmd n ASP 336 Ca 0.03 -2.77 -0.36 0.00 -1.51 0.00 0.00 54.79 50.18 1qmd n ASP 336 Cb 0.44 0.63 0.04 0.00 2.34 0.00 0.00 41.12 44.57 1qmd n ASP 336 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1qmd s ALA 337 N 0.25 2.53 -0.06 -1.67 0.00 -1.26 -4.77 121.76 116.78 1qmd s ALA 337 Ca 0.32 1.04 0.05 0.00 0.00 0.00 0.00 51.96 53.37 1qmd s ALA 337 Cb 0.08 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 1qmd s ALA 337 CO -0.14 -1.21 -0.23 -0.47 0.00 0.00 0.00 175.76 173.71 1qmd s TYR 338 N -1.56 2.23 -0.41 0.00 5.04 0.72 -4.58 117.35 118.78 1qmd s TYR 338 Ca 0.78 -0.69 0.03 0.00 -2.44 0.00 0.00 57.07 54.75 1qmd s TYR 338 Cb -0.31 -1.48 0.12 0.00 0.35 0.00 0.00 41.96 40.63 1qmd s TYR 338 CO 0.34 -0.23 0.15 0.21 -1.34 0.00 0.00 175.55 174.69 1qmd s LYS 339 N -0.04 1.53 0.11 4.97 2.20 0.82 0.68 119.74 130.01 1qmd s LYS 339 Ca -0.05 -2.06 -0.29 0.00 -0.36 0.00 0.00 55.97 53.21 1qmd s LYS 339 Cb -0.14 -2.98 -0.06 0.00 -1.51 0.00 0.00 37.83 33.15 1qmd s LYS 339 CO 0.04 -1.03 0.92 -1.25 -0.36 0.00 0.00 175.35 173.67 1qmd s PRO 340 N 0.50 4.68 -0.11 4.03 0.04 -1.26 -1.07 135.00 141.80 1qmd s PRO 340 Ca 0.14 1.38 -0.17 0.00 0.04 0.00 0.00 61.00 62.40 1qmd s PRO 340 Cb -0.22 -3.36 -0.26 0.00 0.04 0.00 0.00 34.50 30.69 1qmd s PRO 340 CO -0.06 0.26 0.53 1.49 0.04 0.00 0.00 177.00 179.26 1qmd h GLU 341 N 5.43 0.21 -2.29 4.56 4.81 -1.26 -0.11 114.58 125.93 1qmd h GLU 341 Ca -0.43 -0.36 -0.07 0.00 -0.13 0.00 0.00 59.36 58.37 1qmd h GLU 341 Cb 1.21 0.13 -0.21 0.00 0.63 0.00 0.00 28.75 30.51 1qmd h GLU 341 CO 0.71 1.17 0.02 1.21 -0.73 0.00 0.00 179.01 181.39 1qmd s ASN 342 N -6.98 -0.58 -0.05 1.04 3.84 -0.81 -1.35 114.94 110.06 1qmd s ASN 342 Ca -0.21 0.90 0.01 0.00 0.21 0.00 0.00 52.86 53.77 1qmd s ASN 342 Cb 0.04 0.89 0.02 0.00 -0.55 0.00 0.00 41.25 41.65 1qmd s ASN 342 CO 0.75 -0.37 -0.03 -0.63 -2.79 0.00 0.00 177.10 174.02 1qmd s ILE 343 N -0.39 0.46 -0.01 -5.21 1.01 -0.25 -0.72 121.20 116.10 1qmd s ILE 343 Ca -0.05 -0.05 0.05 0.00 0.00 0.00 0.00 60.65 60.59 1qmd s ILE 343 Cb -0.03 -0.52 -0.03 0.00 0.01 0.00 0.00 42.46 41.89 1qmd s ILE 343 CO 0.04 0.22 -0.15 -0.54 0.00 0.00 0.00 174.94 174.51 1qmd s LYS 344 N 1.13 2.35 -0.11 2.79 1.02 -0.85 -0.86 119.74 125.20 1qmd s LYS 344 Ca -0.08 -0.80 0.03 0.00 0.02 0.00 0.00 55.97 55.13 1qmd s LYS 344 Cb -0.14 -2.31 -0.01 0.00 -0.52 0.00 0.00 37.83 34.86 1qmd s LYS 344 CO -0.01 0.59 -0.20 0.42 -0.92 0.00 0.00 175.35 175.23 1qmd s ILE 345 N -0.81 2.41 -0.13 2.17 -1.09 -0.26 -1.61 121.20 121.89 1qmd s ILE 345 Ca 0.13 -0.89 -0.01 0.00 -2.23 0.00 0.00 60.65 57.65 1qmd s ILE 345 Cb -0.11 -1.96 -0.02 0.00 -1.58 0.00 0.00 42.46 38.80 1qmd s ILE 345 CO 0.03 0.55 -0.12 -0.63 -1.23 0.00 0.00 174.94 173.54 1qmd s ILE 346 N 0.31 3.16 -0.11 2.92 1.01 0.44 -0.73 121.20 128.19 1qmd s ILE 346 Ca -0.15 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 59.86 1qmd s ILE 346 Cb -0.17 -2.33 0.03 0.00 0.01 0.00 0.00 42.46 40.00 1qmd s ILE 346 CO 0.08 0.52 -0.02 0.00 0.00 0.00 0.00 174.94 175.52 1qmd s ALA 347 N 0.32 0.99 -1.44 9.38 0.00 0.03 -1.64 121.76 129.41 1qmd s ALA 347 Ca -0.10 -0.40 -0.09 0.00 0.00 0.00 0.00 51.96 51.37 1qmd s ALA 347 Cb -0.16 -0.90 0.05 0.00 0.00 0.00 0.00 23.12 22.11 1qmd s ALA 347 CO 0.05 -0.61 0.92 0.09 0.00 0.00 0.00 175.76 176.21 1qmd n ASN 348 N 5.05 -3.78 0.00 0.00 3.02 -1.26 -2.20 115.26 116.09 1qmd n ASN 348 Ca -0.09 -0.76 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 1qmd n ASN 348 Cb 0.49 -4.10 0.00 0.00 -0.61 0.00 0.00 39.78 35.56 1qmd n ASN 348 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qmd n GLY 349 N -1.68 0.60 3.03 7.41 0.00 -1.26 -2.93 105.19 110.37 1qmd n GLY 349 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 1qmd n GLY 349 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1qmd s LYS 350 N -0.11 1.21 -0.52 1.61 2.20 -0.93 -4.61 119.74 118.58 1qmd s LYS 350 Ca 0.00 -0.38 -0.28 0.00 -0.36 0.00 0.00 55.97 54.95 1qmd s LYS 350 Cb 0.00 -1.09 0.01 0.00 -1.51 0.00 0.00 37.83 35.24 1qmd s LYS 350 CO 0.00 0.14 1.44 0.08 -0.36 0.00 0.00 175.35 176.65 1qmd s VAL 351 N 0.19 3.79 -0.75 4.02 1.01 -1.26 -0.79 120.40 126.61 1qmd s VAL 351 Ca -0.04 0.71 0.23 0.00 0.00 0.00 0.00 61.98 62.88 1qmd s VAL 351 Cb -0.10 -4.34 -0.11 0.00 0.00 0.00 0.00 36.38 31.84 1qmd s VAL 351 CO 0.01 -1.04 1.09 1.33 0.00 0.00 0.00 175.10 176.49 1qmd n VAL 352 N 6.95 0.11 -3.76 2.92 0.24 0.09 -4.87 118.33 120.00 1qmd n VAL 352 Ca 0.14 -0.15 -0.14 0.00 -2.04 0.00 0.00 64.34 62.14 1qmd n VAL 352 Cb 0.49 0.34 -0.15 0.00 -1.47 0.00 0.00 33.84 33.05 1qmd n VAL 352 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1qmd s VAL 353 N -3.13 -0.06 -0.39 3.34 1.01 -1.16 -4.96 120.40 115.06 1qmd s VAL 353 Ca 0.06 0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.26 1qmd s VAL 353 Cb 0.15 -0.15 0.15 0.00 0.00 0.00 0.00 36.38 36.54 1qmd s VAL 353 CO 0.79 0.08 0.26 -0.62 0.00 0.00 0.00 175.10 175.62 1qmd s ASP 354 N 1.11 2.56 -0.23 3.32 2.15 -1.26 -1.10 116.67 123.23 1qmd s ASP 354 Ca -0.09 -2.56 -0.04 0.00 0.43 0.00 0.00 52.55 50.30 1qmd s ASP 354 Cb -0.12 -0.50 -0.00 0.00 -0.30 0.00 0.00 42.92 42.00 1qmd s ASP 354 CO -0.04 -0.25 -0.04 -0.75 -0.17 0.00 0.00 175.17 173.91 1qmd s LYS 355 N 0.61 3.26 0.13 4.34 2.20 -0.04 -4.96 119.74 125.28 1qmd s LYS 355 Ca 0.23 -0.70 -0.27 0.00 -0.36 0.00 0.00 55.97 54.87 1qmd s LYS 355 Cb -0.14 -3.02 -0.07 0.00 -1.51 0.00 0.00 37.83 33.09 1qmd s LYS 355 CO -0.06 -0.25 0.84 -0.51 -0.36 0.00 0.00 175.35 175.01 1qmd s ASP 356 N 1.45 7.41 0.00 1.43 1.01 -1.26 -1.09 116.67 125.62 1qmd s ASP 356 Ca 0.05 1.68 0.00 0.00 0.71 0.00 0.00 52.55 54.98 1qmd s ASP 356 Cb -0.15 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1qmd s ASP 356 CO -0.03 0.09 0.00 -0.38 0.21 0.00 0.00 175.17 175.06 1qmd n ILE 357 N 2.15 0.00 -3.86 0.77 5.41 -0.46 -4.96 119.36 118.41 1qmd n ILE 357 Ca -0.03 0.07 -0.26 0.00 1.00 0.00 0.00 62.75 63.54 1qmd n ILE 357 Cb 0.49 -1.04 0.01 0.00 -0.71 0.00 0.00 39.64 38.39 1qmd n ILE 357 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1qmd n ASN 358 N -2.38 -1.98 -4.09 4.38 3.02 -0.05 -4.99 115.26 109.17 1qmd n ASN 358 Ca 0.00 -0.88 -0.15 0.00 -0.03 0.00 0.00 54.58 53.52 1qmd n ASN 358 Cb 0.00 -3.64 -0.12 0.00 -0.61 0.00 0.00 39.78 35.41 1qmd n ASN 358 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1qmd s GLU 359 N -6.36 0.62 -0.03 3.52 2.02 -1.26 -5.05 118.70 112.15 1qmd s GLU 359 Ca 0.22 -0.76 -0.26 0.00 0.02 0.00 0.00 54.97 54.20 1qmd s GLU 359 Cb -0.11 -0.48 -0.04 0.00 0.10 0.00 0.00 34.13 33.61 1qmd s GLU 359 CO 0.85 0.10 0.80 -1.58 0.02 0.00 0.00 175.26 175.45 1qmd s TRP 360 N -1.21 3.62 -0.18 1.61 0.52 -1.26 -4.04 118.94 118.00 1qmd s TRP 360 Ca -0.06 1.43 -0.07 0.00 0.02 0.00 0.00 56.10 57.42 1qmd s TRP 360 Cb -0.09 -2.92 -0.04 0.00 -1.15 0.00 0.00 33.47 29.27 1qmd s TRP 360 CO 0.01 0.07 0.06 0.42 0.02 0.00 0.00 176.95 177.53 1qmd s ILE 361 N 0.78 4.70 0.19 2.03 1.01 0.21 -4.94 121.20 125.18 1qmd s ILE 361 Ca 0.43 -0.07 0.01 0.00 0.00 0.00 0.00 60.65 61.02 1qmd s ILE 361 Cb -0.19 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.12 1qmd s ILE 361 CO 0.22 0.45 0.06 -0.94 0.00 0.00 0.00 174.94 174.73 1qmd s SER 362 N 0.45 0.81 0.54 3.58 1.04 -1.26 -0.20 113.70 118.66 1qmd s SER 362 Ca 0.03 -1.27 0.00 0.00 0.48 0.00 0.00 55.95 55.19 1qmd s SER 362 Cb -0.13 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.21 1qmd s SER 362 CO 0.01 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.14 1qmd n GLY 363 N -0.27 1.91 3.25 7.32 0.00 -1.26 -3.82 105.19 112.33 1qmd n GLY 363 Ca -0.03 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 1qmd n GLY 363 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qmd s ASN 364 N -4.00 5.78 0.22 1.61 0.01 -1.26 -4.33 114.94 112.97 1qmd s ASN 364 Ca 0.00 -1.74 -0.17 0.00 -0.71 0.00 0.00 52.86 50.24 1qmd s ASN 364 Cb 0.00 -2.04 0.02 0.00 0.41 0.00 0.00 41.25 39.64 1qmd s ASN 364 CO 0.00 -0.67 0.54 -0.94 -1.51 0.00 0.00 177.10 174.52 1qmd s SER 365 N 2.64 -0.23 0.04 -1.22 1.04 -1.14 -5.01 113.70 109.82 1qmd s SER 365 Ca 0.04 -0.58 0.06 0.00 0.48 0.00 0.00 55.95 55.96 1qmd s SER 365 Cb -0.26 0.60 -0.03 0.00 0.10 0.00 0.00 66.02 66.43 1qmd s SER 365 CO 0.01 -1.11 -0.15 0.42 0.98 0.00 0.00 173.24 173.39 1qmd s THR 366 N -3.91 3.03 -0.11 2.02 -4.23 -1.26 -1.67 115.64 109.52 1qmd s THR 366 Ca 0.12 -1.12 0.02 0.00 -1.18 0.00 0.00 61.69 59.53 1qmd s THR 366 Cb -0.02 -2.31 0.01 0.00 1.34 0.00 0.00 72.50 71.53 1qmd s THR 366 CO 0.01 0.31 -0.18 -0.47 -0.54 0.00 0.00 174.62 173.75 1qmd s TYR 367 N -0.98 2.15 0.14 3.99 6.14 0.19 -4.98 117.35 123.99 1qmd s TYR 367 Ca 0.16 -0.98 -0.30 0.00 0.64 0.00 0.00 57.07 56.59 1qmd s TYR 367 Cb -0.11 -1.51 -0.06 0.00 0.42 0.00 0.00 41.96 40.70 1qmd s TYR 367 CO 0.07 -0.47 0.98 1.21 0.64 0.00 0.00 175.55 177.98 1qmd s ASN 368 N 0.79 7.48 -0.00 4.32 3.84 -1.26 -1.27 114.94 128.84 1qmd s ASN 368 Ca -0.10 1.86 0.04 0.00 0.21 0.00 0.00 52.86 54.86 1qmd s ASN 368 Cb -0.16 -2.59 -0.05 0.00 -0.55 0.00 0.00 41.25 37.90 1qmd s ASN 368 CO 0.01 -0.06 0.10 2.30 -2.79 0.00 0.00 177.10 176.66 1qmd n ILE 369 N 2.58 0.00 -1.50 -5.21 -5.35 -0.63 -4.97 119.36 104.28 1qmd n ILE 369 Ca 0.02 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.32 1qmd n ILE 369 Cb 0.48 0.59 0.00 0.00 -1.74 0.00 0.00 39.64 38.97 1qmd n ILE 369 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96