#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qfl h HIS 2 N 0.00 0.00 -0.52 1.12 3.86 -1.98 2.34 115.15 119.98 2qfl h HIS 2 Ca 0.00 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.09 2qfl h HIS 2 Cb 0.00 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 2qfl h HIS 2 CO 0.00 0.73 -0.13 -1.00 0.86 0.00 0.00 177.93 178.39 2qfl h PRO 3 N 0.00 1.01 -0.70 2.45 0.13 -2.05 -0.59 132.00 132.24 2qfl h PRO 3 Ca -0.01 -0.39 -0.02 0.00 -0.87 0.00 0.00 66.00 64.71 2qfl h PRO 3 Cb 1.51 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.56 2qfl h PRO 3 CO 0.10 1.07 0.34 0.52 -0.23 0.00 0.00 178.00 179.80 2qfl h MET 4 N 0.87 1.01 -0.88 0.86 2.86 -1.92 -2.15 114.93 115.58 2qfl h MET 4 Ca 0.13 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2qfl h MET 4 Cb 0.71 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 32.14 2qfl h MET 4 CO 0.05 0.79 0.57 1.25 1.06 0.00 0.00 176.91 180.63 2qfl h LEU 5 N 0.98 1.03 -0.92 1.22 5.85 0.39 0.15 115.31 124.01 2qfl h LEU 5 Ca 0.24 -0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.82 2qfl h LEU 5 Cb 0.11 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 2qfl h LEU 5 CO -0.03 0.76 -0.27 -1.13 -0.34 0.00 0.00 178.44 177.43 2qfl h ASN 6 N 1.20 0.48 0.28 1.25 -1.24 -0.86 0.46 115.58 117.16 2qfl h ASN 6 Ca 0.32 -0.17 -0.24 0.00 0.71 0.00 0.00 56.30 56.92 2qfl h ASN 6 Cb -0.11 -0.13 0.01 0.00 0.73 0.00 0.00 38.32 38.82 2qfl h ASN 6 CO -0.07 0.74 -1.02 0.40 -1.29 0.00 0.00 177.43 176.20 2qfl h ILE 7 N 0.42 1.38 -0.55 2.57 1.08 -0.83 -2.06 117.51 119.51 2qfl h ILE 7 Ca 0.06 -2.47 0.02 0.00 -0.39 0.00 0.00 64.86 62.09 2qfl h ILE 7 Cb 0.69 2.48 -0.04 0.00 -3.07 0.00 0.00 36.82 36.89 2qfl h ILE 7 CO 0.05 0.74 0.34 0.00 -0.69 0.00 0.00 178.15 178.59 2qfl h ALA 8 N 0.62 0.71 -0.26 1.87 0.00 -0.30 0.76 119.26 122.67 2qfl h ALA 8 Ca -0.10 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2qfl h ALA 8 Cb 1.67 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 2qfl h ALA 8 CO 0.18 0.06 0.01 0.28 0.00 0.00 0.00 179.25 179.78 2qfl h VAL 9 N 0.67 1.25 -0.22 0.00 2.07 -0.95 0.17 116.25 119.24 2qfl h VAL 9 Ca 0.22 -0.89 0.05 0.00 0.82 0.00 0.00 66.70 66.91 2qfl h VAL 9 Cb 0.01 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 2qfl h VAL 9 CO -0.09 0.28 -0.12 -0.09 0.02 0.00 0.00 177.57 177.57 2qfl h ARG 10 N 0.23 -0.10 -0.46 1.57 2.43 -1.19 -0.27 114.38 116.60 2qfl h ARG 10 Ca 0.07 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2qfl h ARG 10 Cb 0.40 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 2qfl h ARG 10 CO 0.01 -0.06 0.28 0.00 -1.51 0.00 0.00 179.97 178.69 2qfl h ALA 11 N 1.08 0.59 -0.51 2.80 0.00 -0.66 -1.93 119.26 120.62 2qfl h ALA 11 Ca 0.12 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2qfl h ALA 11 Cb 0.28 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2qfl h ALA 11 CO -0.28 0.07 -0.01 0.00 0.00 0.00 0.00 179.25 179.03 2qfl h ALA 12 N 1.14 0.69 -0.46 0.00 0.00 -0.61 -0.28 119.26 119.73 2qfl h ALA 12 Ca 0.17 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2qfl h ALA 12 Cb -0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2qfl h ALA 12 CO -0.03 0.51 0.14 0.00 0.00 0.00 0.00 179.25 179.86 2qfl h ARG 13 N 0.77 0.73 -0.55 0.00 3.08 -1.07 0.33 114.38 117.67 2qfl h ARG 13 Ca 0.14 -0.16 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 2qfl h ARG 13 Cb 0.53 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 2qfl h ARG 13 CO 0.03 0.70 0.03 0.87 -1.07 0.00 0.00 179.97 180.52 2qfl h LYS 14 N 0.61 0.91 -0.51 0.04 1.57 -1.24 0.81 116.57 118.77 2qfl h LYS 14 Ca 0.15 -0.25 -0.09 0.00 -1.87 0.00 0.00 60.65 58.59 2qfl h LYS 14 Cb 0.28 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 2qfl h LYS 14 CO -0.00 0.89 -0.03 0.00 -0.57 0.00 0.00 179.45 179.73 2qfl h ALA 15 N 1.17 0.69 -0.49 3.86 0.00 -0.95 -2.74 119.26 120.80 2qfl h ALA 15 Ca 0.16 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2qfl h ALA 15 Cb 0.46 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2qfl h ALA 15 CO 0.02 0.54 0.17 0.78 0.00 0.00 0.00 179.25 180.75 2qfl h GLY 16 N 0.79 0.82 1.46 0.00 0.00 0.32 -0.64 103.07 105.81 2qfl h GLY 16 Ca 0.14 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.97 2qfl h GLY 16 CO 0.03 0.44 0.17 3.43 0.00 0.00 0.00 176.54 180.62 2qfl h ASN 17 N 0.67 0.63 -0.32 0.19 -0.26 0.62 0.21 115.58 117.33 2qfl h ASN 17 Ca 0.16 -0.08 -0.16 0.00 -0.56 0.00 0.00 56.30 55.67 2qfl h ASN 17 Cb 0.25 -0.16 -0.00 0.00 -1.06 0.00 0.00 38.32 37.35 2qfl h ASN 17 CO -0.01 0.59 -0.41 0.25 -1.06 0.00 0.00 177.43 176.79 2qfl h LEU 18 N 0.69 0.91 -0.41 1.61 6.46 -1.14 -2.06 115.31 121.37 2qfl h LEU 18 Ca 0.16 -0.50 -0.07 0.00 -0.12 0.00 0.00 57.88 57.36 2qfl h LEU 18 Cb 0.17 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.83 2qfl h LEU 18 CO -0.01 1.22 -0.02 0.40 -0.62 0.00 0.00 178.44 179.41 2qfl h ILE 19 N 0.61 1.26 -0.99 4.05 2.04 -0.82 -2.54 117.51 121.13 2qfl h ILE 19 Ca 0.04 -1.06 0.07 0.00 1.00 0.00 0.00 64.86 64.90 2qfl h ILE 19 Cb 1.00 1.13 -0.07 0.00 -0.74 0.00 0.00 36.82 38.15 2qfl h ILE 19 CO 0.10 0.36 0.64 0.00 0.00 0.00 0.00 178.15 179.24 2qfl h ALA 20 N 0.88 1.38 -0.52 1.87 0.00 -0.92 -1.76 119.26 120.18 2qfl h ALA 20 Ca 0.11 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2qfl h ALA 20 Cb 0.52 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2qfl h ALA 20 CO 0.03 0.42 -0.13 -0.22 0.00 0.00 0.00 179.25 179.34 2qfl h LYS 21 N 1.15 1.01 0.00 0.00 3.64 -1.27 -2.92 116.57 118.19 2qfl h LYS 21 Ca 0.43 -0.39 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2qfl h LYS 21 Cb 0.18 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2qfl h LYS 21 CO -0.18 1.07 -0.05 -0.91 -2.27 0.00 0.00 179.45 177.12 2qfl h ASN 22 N 0.88 0.00 -0.30 4.20 2.35 -1.27 -3.19 115.58 118.26 2qfl h ASN 22 Ca 0.13 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 2qfl h ASN 22 Cb 0.70 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.06 2qfl h ASN 22 CO 0.05 0.00 0.13 0.22 -1.65 0.00 0.00 177.43 176.18 2qfl h TYR 23 N 0.00 0.50 0.00 1.19 3.20 -1.12 -2.43 116.97 118.30 2qfl h TYR 23 Ca 0.00 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 2qfl h TYR 23 Cb 0.94 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.06 2qfl h TYR 23 CO 0.00 0.41 0.00 0.39 -1.64 0.00 0.00 178.16 177.32 2qfl n GLU 24 N -4.38 0.14 -3.35 1.82 4.71 -1.21 -4.75 120.64 113.63 2qfl n GLU 24 Ca 0.02 0.06 -0.21 0.00 -0.01 0.00 0.00 57.16 57.02 2qfl n GLU 24 Cb 0.15 -1.50 -0.00 0.00 -1.01 0.00 0.00 31.44 29.08 2qfl n GLU 24 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 2qfl s THR 25 N -2.83 4.18 -0.16 2.62 2.01 -0.92 -5.06 115.64 115.48 2qfl s THR 25 Ca 0.17 -0.82 0.17 0.00 0.31 0.00 0.00 61.69 61.52 2qfl s THR 25 Cb 0.17 -3.48 -0.23 0.00 0.01 0.00 0.00 72.50 68.96 2qfl s THR 25 CO 0.44 -0.24 0.11 -0.81 -0.69 0.00 0.00 174.62 173.42 2qfl n PRO 26 N -1.77 0.97 0.00 4.92 -0.04 -1.26 -4.99 135.00 132.83 2qfl n PRO 26 Ca -0.01 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 2qfl n PRO 26 Cb 0.58 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 2qfl n PRO 26 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2qfl n ASP 27 N -2.62 0.00 -0.35 3.54 2.03 -1.26 -3.56 116.55 114.33 2qfl n ASP 27 Ca -0.27 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.00 2qfl n ASP 27 Cb 1.03 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 41.41 2qfl n ASP 27 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qfl n ALA 28 N 0.00 -0.07 -1.53 -1.67 0.00 -1.26 -4.69 120.51 111.28 2qfl n ALA 28 Ca 0.00 0.07 -0.34 0.00 0.00 0.00 0.00 53.44 53.18 2qfl n ALA 28 Cb 0.00 -1.08 -0.09 0.00 0.00 0.00 0.00 19.45 18.29 2qfl n ALA 28 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qfl n VAL 29 N -2.51 -0.05 -3.53 0.00 0.31 -1.23 -4.33 118.33 107.00 2qfl n VAL 29 Ca -0.05 -0.51 -0.27 0.00 -0.01 0.00 0.00 64.34 63.51 2qfl n VAL 29 Cb 0.33 -1.82 -0.10 0.00 -0.91 0.00 0.00 33.84 31.34 2qfl n VAL 29 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2qfl n GLU 30 N 8.58 1.02 -3.64 5.55 4.07 -1.26 -4.95 120.64 130.02 2qfl n GLU 30 Ca 0.49 -3.75 -0.02 0.00 -0.06 0.00 0.00 57.16 53.82 2qfl n GLU 30 Cb 0.35 -1.86 -0.03 0.00 -0.06 0.00 0.00 31.44 29.83 2qfl n GLU 30 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2qfl s ALA 31 N -0.86 -2.14 0.00 4.31 0.00 -1.26 -3.68 121.76 118.12 2qfl s ALA 31 Ca 0.31 1.88 0.00 0.00 0.00 0.00 0.00 51.96 54.16 2qfl s ALA 31 Cb 0.04 -1.12 0.00 0.00 0.00 0.00 0.00 23.12 22.05 2qfl s ALA 31 CO -0.16 -0.35 0.00 0.43 0.00 0.00 0.00 175.76 175.68 2qfl n SER 32 N 0.33 0.00 -0.59 0.00 7.64 -1.26 -4.57 113.62 115.17 2qfl n SER 32 Ca 0.02 0.00 0.44 0.00 1.01 0.00 0.00 58.87 60.34 2qfl n SER 32 Cb 0.58 0.00 0.68 0.00 -1.01 0.00 0.00 64.21 64.46 2qfl n SER 32 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2qfl n GLN 33 N -0.71 -0.00 0.02 1.43 7.27 -1.26 -3.27 117.38 120.86 2qfl n GLN 33 Ca 0.00 0.90 0.00 0.00 0.07 0.00 0.00 57.00 57.97 2qfl n GLN 33 Cb 0.00 -2.08 0.00 0.00 2.41 0.00 0.00 30.24 30.57 2qfl n GLN 33 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 2qfl n LYS 34 N -3.61 0.00 0.00 3.69 5.02 -1.26 -5.12 118.16 116.87 2qfl n LYS 34 Ca 0.37 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 2qfl n LYS 34 Cb 1.68 -0.10 0.00 0.00 -0.02 0.00 0.00 35.03 36.59 2qfl n LYS 34 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qfl n GLY 35 N 1.81 -1.44 3.53 0.72 0.00 -1.20 -5.12 105.19 103.49 2qfl n GLY 35 Ca 0.00 0.52 -0.40 0.00 0.00 0.00 0.00 46.02 46.14 2qfl n GLY 35 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2qfl n SER 36 N 0.00 1.93 -4.83 1.61 2.88 -1.26 -4.32 113.62 109.63 2qfl n SER 36 Ca 0.00 -0.14 -0.26 0.00 -1.33 0.00 0.00 58.87 57.13 2qfl n SER 36 Cb 0.00 -1.39 0.08 0.00 -0.75 0.00 0.00 64.21 62.16 2qfl n SER 36 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2qfl s ASN 37 N 10.38 4.59 0.29 -3.46 4.22 -1.26 -4.78 114.94 124.91 2qfl s ASN 37 Ca 1.09 0.41 0.04 0.00 -2.14 0.00 0.00 52.86 52.25 2qfl s ASN 37 Cb -0.54 -0.97 0.67 0.00 1.28 0.00 0.00 41.25 41.69 2qfl s ASN 37 CO 0.36 -1.76 1.79 0.44 -2.04 0.00 0.00 177.10 175.90 2qfl h ASP 38 N -0.74 0.82 0.05 3.54 5.19 -1.83 -3.13 116.42 120.32 2qfl h ASP 38 Ca -0.44 0.08 -0.00 0.00 -0.62 0.00 0.00 57.03 56.05 2qfl h ASP 38 Cb 1.31 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2qfl h ASP 38 CO 0.57 0.34 -0.02 0.15 -3.12 0.00 0.00 179.24 177.16 2qfl h PHE 39 N 0.83 -0.06 -0.88 4.55 3.57 -1.84 0.22 116.94 123.33 2qfl h PHE 39 Ca 0.55 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 62.08 2qfl h PHE 39 Cb 0.76 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.47 2qfl h PHE 39 CO -0.01 0.22 0.58 -0.24 -2.23 0.00 0.00 178.31 176.63 2qfl h VAL 40 N -0.34 1.16 -0.24 1.41 3.04 -1.92 0.28 116.25 119.63 2qfl h VAL 40 Ca -0.01 -0.38 -0.13 0.00 -1.01 0.00 0.00 66.70 65.18 2qfl h VAL 40 Cb 0.31 -0.05 -0.00 0.00 -2.01 0.00 0.00 31.29 29.54 2qfl h VAL 40 CO 0.01 0.20 -0.34 0.74 -1.01 0.00 0.00 177.57 177.17 2qfl h THR 41 N 1.11 1.32 -0.95 3.17 2.02 -1.47 0.29 112.91 118.40 2qfl h THR 41 Ca 0.34 -1.54 0.01 0.00 0.77 0.00 0.00 66.41 65.99 2qfl h THR 41 Cb 0.00 1.74 -0.05 0.00 -1.74 0.00 0.00 68.15 68.10 2qfl h THR 41 CO -0.10 0.48 0.62 0.78 0.37 0.00 0.00 175.52 177.67 2qfl h ASN 42 N 0.36 1.11 -0.37 4.18 2.35 -0.21 0.75 115.58 123.74 2qfl h ASN 42 Ca 0.02 -0.04 -0.14 0.00 -0.55 0.00 0.00 56.30 55.59 2qfl h ASN 42 Cb 0.93 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 2qfl h ASN 42 CO 0.08 0.81 -0.32 0.58 -1.65 0.00 0.00 177.43 176.94 2qfl h VAL 43 N 1.30 1.27 -0.23 2.81 2.07 -0.15 -2.38 116.25 120.93 2qfl h VAL 43 Ca 0.35 -1.48 -0.07 0.00 0.82 0.00 0.00 66.70 66.31 2qfl h VAL 43 Cb -0.13 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2qfl h VAL 43 CO -0.07 0.50 -0.14 -0.78 0.02 0.00 0.00 177.57 177.10 2qfl h ASP 44 N 0.76 0.53 -0.35 0.57 1.82 -0.24 -1.16 116.42 118.35 2qfl h ASP 44 Ca 0.08 -0.42 -0.01 0.00 -0.39 0.00 0.00 57.03 56.28 2qfl h ASP 44 Cb 0.89 -0.15 -0.02 0.00 0.68 0.00 0.00 39.33 40.74 2qfl h ASP 44 CO 0.08 0.84 0.17 0.11 -1.61 0.00 0.00 179.24 178.83 2qfl h LYS 45 N 0.22 0.50 -0.72 0.28 1.57 -0.89 -0.80 116.57 116.72 2qfl h LYS 45 Ca 0.05 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2qfl h LYS 45 Cb 0.65 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.83 2qfl h LYS 45 CO 0.04 0.45 0.44 0.00 -0.57 0.00 0.00 179.45 179.80 2qfl h ALA 46 N 1.03 1.40 -0.02 3.86 0.00 -1.43 -0.86 119.26 123.24 2qfl h ALA 46 Ca 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2qfl h ALA 46 Cb 0.11 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2qfl h ALA 46 CO -0.02 0.51 0.01 0.00 0.00 0.00 0.00 179.25 179.76 2qfl h ALA 47 N 1.48 0.02 -0.29 0.00 0.00 -0.91 -2.60 119.26 116.97 2qfl h ALA 47 Ca 0.26 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.16 2qfl h ALA 47 Cb -0.04 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.66 2qfl h ALA 47 CO -0.05 -0.41 -0.34 1.49 0.00 0.00 0.00 179.25 179.95 2qfl h GLU 48 N -0.12 -0.31 -0.75 0.00 4.81 -0.95 -1.54 114.58 115.73 2qfl h GLU 48 Ca 0.01 0.02 0.16 0.00 -0.13 0.00 0.00 59.36 59.42 2qfl h GLU 48 Cb 0.14 0.07 -0.11 0.00 0.63 0.00 0.00 28.75 29.49 2qfl h GLU 48 CO -0.00 -0.20 0.23 0.00 -0.73 0.00 0.00 179.01 178.30 2qfl h ALA 49 N 0.58 1.02 -0.54 2.92 0.00 -1.20 -0.11 119.26 121.94 2qfl h ALA 49 Ca 0.14 0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 2qfl h ALA 49 Cb 0.55 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2qfl h ALA 49 CO -0.47 -0.31 0.06 0.28 0.00 0.00 0.00 179.25 178.82 2qfl h VAL 50 N 0.33 1.24 -0.01 0.00 2.07 -1.26 0.16 116.25 118.78 2qfl h VAL 50 Ca 0.43 -0.96 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 2qfl h VAL 50 Cb 0.72 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 2qfl h VAL 50 CO -0.48 0.35 -0.03 0.40 0.02 0.00 0.00 177.57 177.83 2qfl h ILE 51 N 0.82 1.46 0.07 4.57 2.04 -0.22 -1.41 117.51 124.84 2qfl h ILE 51 Ca 0.17 -1.39 0.02 0.00 1.00 0.00 0.00 64.86 64.66 2qfl h ILE 51 Cb 0.40 2.37 -0.05 0.00 -0.74 0.00 0.00 36.82 38.80 2qfl h ILE 51 CO 0.01 0.37 -0.39 0.40 0.00 0.00 0.00 178.15 178.53 2qfl h ILE 52 N -0.52 0.19 -0.57 -0.67 2.04 -1.01 0.72 117.51 117.69 2qfl h ILE 52 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.97 2qfl h ILE 52 Cb 0.61 0.19 -0.09 0.00 -0.74 0.00 0.00 36.82 36.80 2qfl h ILE 52 CO 0.01 0.00 0.07 -0.78 0.00 0.00 0.00 178.15 177.44 2qfl h ASP 53 N -0.59 -0.11 -0.63 1.72 -0.00 -0.72 -0.05 116.42 116.03 2qfl h ASP 53 Ca 0.04 0.12 -0.04 0.00 -0.00 0.00 0.00 57.03 57.14 2qfl h ASP 53 Cb 0.65 0.19 -0.03 0.00 -0.00 0.00 0.00 39.33 40.14 2qfl h ASP 53 CO -0.26 -0.04 0.22 0.74 -0.00 0.00 0.00 179.24 179.90 2qfl h THR 54 N 0.19 1.24 -0.45 2.25 2.02 -1.03 -2.67 112.91 114.46 2qfl h THR 54 Ca 0.29 -0.79 -0.12 0.00 0.77 0.00 0.00 66.41 66.56 2qfl h THR 54 Cb 0.45 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2qfl h THR 54 CO -0.43 0.31 -0.19 0.40 0.37 0.00 0.00 175.52 175.98 2qfl h ILE 55 N 0.89 1.27 0.00 3.11 2.04 0.22 -3.18 117.51 121.86 2qfl h ILE 55 Ca 0.21 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.73 2qfl h ILE 55 Cb 0.25 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 2qfl h ILE 55 CO -0.01 0.46 0.00 0.54 0.00 0.00 0.00 178.15 179.13 2qfl n ARG 56 N -4.18 0.18 0.24 2.37 1.74 -0.14 -0.78 116.66 116.09 2qfl n ARG 56 Ca -0.01 0.31 0.14 0.00 -0.77 0.00 0.00 57.85 57.52 2qfl n ARG 56 Cb 0.43 -1.78 0.41 0.00 -1.02 0.00 0.00 32.46 30.50 2qfl n ARG 56 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2qfl h LYS 57 N 0.00 0.00 0.00 5.56 1.57 -1.45 -3.07 116.57 119.17 2qfl h LYS 57 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2qfl h LYS 57 Cb 0.48 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 2qfl h LYS 57 CO 0.00 0.05 -1.14 0.43 -0.57 0.00 0.00 179.45 178.22 2qfl n SER 58 N -3.13 4.43 -3.19 0.86 7.64 -0.91 -4.86 113.62 114.46 2qfl n SER 58 Ca 0.02 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.71 2qfl n SER 58 Cb 0.43 0.81 -0.04 0.00 -1.01 0.00 0.00 64.21 64.41 2qfl n SER 58 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2qfl n TYR 59 N -1.86 0.09 0.39 1.43 4.01 0.04 -4.93 117.16 116.33 2qfl n TYR 59 Ca -0.02 -3.77 0.10 0.00 -0.16 0.00 0.00 57.90 54.04 2qfl n TYR 59 Cb 0.34 -0.41 0.41 0.00 -0.31 0.00 0.00 39.34 39.38 2qfl n TYR 59 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2qfl n PRO 60 N 0.51 0.12 0.17 -0.72 -0.04 -1.16 -2.40 135.00 131.47 2qfl n PRO 60 Ca 0.24 0.39 0.13 0.00 -0.04 0.00 0.00 63.50 64.22 2qfl n PRO 60 Cb 0.63 -1.74 0.32 0.00 -0.04 0.00 0.00 33.50 32.68 2qfl n PRO 60 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2qfl h GLN 61 N 0.00 0.00 -7.16 0.54 7.50 -1.92 -3.44 115.11 110.64 2qfl h GLN 61 Ca 0.00 0.00 -0.48 0.00 0.50 0.00 0.00 58.65 58.67 2qfl h GLN 61 Cb 0.28 0.00 0.02 0.00 0.05 0.00 0.00 27.48 27.83 2qfl h GLN 61 CO 0.00 0.00 0.33 -1.01 -1.50 0.00 0.00 178.83 176.65 2qfl s HIS 62 N -3.20 3.49 0.24 2.96 3.76 -1.01 0.19 115.29 121.72 2qfl s HIS 62 Ca 0.08 1.35 -0.29 0.00 -0.15 0.00 0.00 55.06 56.04 2qfl s HIS 62 Cb 0.09 -2.71 -0.09 0.00 1.11 0.00 0.00 32.58 30.98 2qfl s HIS 62 CO 0.61 -0.38 0.92 0.99 -0.85 0.00 0.00 174.74 176.03 2qfl s THR 63 N -2.69 4.12 -0.06 1.30 2.01 -0.64 -3.84 115.64 115.84 2qfl s THR 63 Ca 0.57 2.02 0.04 0.00 0.31 0.00 0.00 61.69 64.62 2qfl s THR 63 Cb -0.10 -4.28 0.00 0.00 0.01 0.00 0.00 72.50 68.13 2qfl s THR 63 CO 0.36 0.47 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.95 2qfl s ILE 64 N -1.21 1.57 -0.15 1.82 1.01 -0.93 -1.15 121.20 122.16 2qfl s ILE 64 Ca 0.41 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 60.31 2qfl s ILE 64 Cb -0.25 -1.36 0.02 0.00 0.01 0.00 0.00 42.46 40.88 2qfl s ILE 64 CO 0.31 0.45 -0.16 -0.63 0.00 0.00 0.00 174.94 174.90 2qfl s ILE 65 N 0.25 1.70 0.19 2.92 1.01 0.11 -0.54 121.20 126.84 2qfl s ILE 65 Ca -0.10 -0.73 0.11 0.00 0.00 0.00 0.00 60.65 59.93 2qfl s ILE 65 Cb -0.14 -1.57 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 2qfl s ILE 65 CO 0.04 0.48 -0.22 0.42 0.00 0.00 0.00 174.94 175.66 2qfl s THR 66 N 1.29 2.22 0.36 2.92 -4.23 -0.74 -1.13 115.64 116.34 2qfl s THR 66 Ca 0.02 -2.03 0.09 0.00 -1.18 0.00 0.00 61.69 58.59 2qfl s THR 66 Cb -0.13 -2.06 0.32 0.00 1.34 0.00 0.00 72.50 71.97 2qfl s THR 66 CO -0.09 -0.19 1.88 -0.08 -0.54 0.00 0.00 174.62 175.60 2qfl h GLU 67 N 3.14 0.66 0.00 3.99 4.22 -1.71 -1.12 114.58 123.77 2qfl h GLU 67 Ca -0.45 -0.04 -0.13 0.00 0.08 0.00 0.00 59.36 58.83 2qfl h GLU 67 Cb 1.21 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2qfl h GLU 67 CO 0.50 0.44 -1.15 1.05 -2.18 0.00 0.00 179.01 177.66 2qfl h GLU 68 N 0.68 0.00 -0.00 1.92 9.09 -1.96 -3.40 114.58 120.92 2qfl h GLU 68 Ca 0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.84 2qfl h GLU 68 Cb 0.68 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.78 2qfl h GLU 68 CO -0.19 0.27 -0.08 0.43 0.05 0.00 0.00 179.01 179.50 2qfl n SER 69 N -2.92 0.63 0.00 3.06 7.64 -1.16 -5.11 113.62 115.76 2qfl n SER 69 Ca -0.06 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 59.01 2qfl n SER 69 Cb 0.77 0.57 0.00 0.00 -1.01 0.00 0.00 64.21 64.54 2qfl n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qfl n GLY 70 N 0.69 0.99 3.65 0.23 0.00 -0.43 -4.73 105.19 105.58 2qfl n GLY 70 Ca 0.01 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 2qfl n GLY 70 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qfl s GLU 71 N 0.00 4.16 -0.60 1.61 2.12 -1.26 -1.79 118.70 122.94 2qfl s GLU 71 Ca 0.00 0.50 -0.08 0.00 0.36 0.00 0.00 54.97 55.75 2qfl s GLU 71 Cb 0.00 -3.60 0.16 0.00 0.26 0.00 0.00 34.13 30.95 2qfl s GLU 71 CO 0.00 -0.27 0.47 -0.51 -0.54 0.00 0.00 175.26 174.41 2qfl s LEU 72 N 2.03 5.79 0.32 2.70 1.43 0.29 -5.01 118.68 126.23 2qfl s LEU 72 Ca 0.26 -2.40 -0.29 0.00 -1.03 0.00 0.00 54.13 50.66 2qfl s LEU 72 Cb -0.16 -2.00 -0.12 0.00 0.03 0.00 0.00 46.19 43.95 2qfl s LEU 72 CO 0.09 -0.56 1.55 -0.62 0.23 0.00 0.00 176.35 177.04 2qfl n GLU 73 N 4.22 2.65 -3.64 1.70 1.02 -1.26 -2.18 120.64 123.15 2qfl n GLU 73 Ca 0.02 0.94 -0.22 0.00 -0.02 0.00 0.00 57.16 57.88 2qfl n GLU 73 Cb 0.41 -2.69 -0.03 0.00 -0.02 0.00 0.00 31.44 29.11 2qfl n GLU 73 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2qfl s GLY 74 N 0.28 2.17 0.33 0.62 0.00 -1.25 -4.85 107.32 104.61 2qfl s GLY 74 Ca 0.61 -1.86 0.12 0.00 0.00 0.00 0.00 44.72 43.59 2qfl s GLY 74 CO 0.53 -1.74 1.72 -0.91 0.00 0.00 0.00 173.10 172.70 2qfl h THR 75 N 1.02 1.33 -3.14 0.90 1.35 -1.67 -3.37 112.91 109.33 2qfl h THR 75 Ca -0.41 -1.68 -0.75 0.00 -0.55 0.00 0.00 66.41 63.02 2qfl h THR 75 Cb 1.27 1.91 -0.24 0.00 -1.73 0.00 0.00 68.15 69.36 2qfl h THR 75 CO 0.58 0.48 -0.25 -0.62 -0.25 0.00 0.00 175.52 175.46 2qfl s ASP 76 N -6.87 6.17 0.00 5.36 3.68 0.13 -4.91 116.67 120.23 2qfl s ASP 76 Ca -0.02 -1.69 0.30 0.00 2.13 0.00 0.00 52.55 53.27 2qfl s ASP 76 Cb 0.13 -2.20 1.57 0.00 -1.45 0.00 0.00 42.92 40.97 2qfl s ASP 76 CO 0.74 -0.81 2.06 0.00 0.13 0.00 0.00 175.17 177.29 2qfl n GLN 77 N 5.23 0.55 0.04 4.34 1.13 -1.26 -3.66 117.38 123.75 2qfl n GLN 77 Ca -0.14 0.01 0.13 0.00 -1.94 0.00 0.00 57.00 55.06 2qfl n GLN 77 Cb 0.41 -1.50 0.33 0.00 0.11 0.00 0.00 30.24 29.58 2qfl n GLN 77 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2qfl n ASP 78 N -1.22 0.51 -4.18 1.08 10.43 -1.26 -4.68 116.55 117.23 2qfl n ASP 78 Ca 0.16 0.16 -0.33 0.00 2.57 0.00 0.00 54.79 57.36 2qfl n ASP 78 Cb 0.21 -0.10 -0.16 0.00 1.84 0.00 0.00 41.12 42.90 2qfl n ASP 78 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2qfl s VAL 79 N -3.07 2.20 -0.04 2.53 1.01 -1.24 0.46 120.40 122.25 2qfl s VAL 79 Ca 0.10 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 61.21 2qfl s VAL 79 Cb 0.16 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 2qfl s VAL 79 CO 0.65 0.54 -0.22 -1.10 0.00 0.00 0.00 175.10 174.97 2qfl s GLN 80 N 0.90 2.17 -0.24 2.72 -0.21 -0.29 -1.62 119.66 123.10 2qfl s GLN 80 Ca -0.05 -0.81 -0.11 0.00 0.02 0.00 0.00 55.36 54.42 2qfl s GLN 80 Cb -0.15 -1.91 -0.05 0.00 1.00 0.00 0.00 33.01 31.90 2qfl s GLN 80 CO -0.03 0.37 0.17 -1.58 -2.12 0.00 0.00 175.29 172.10 2qfl s TRP 81 N -0.21 3.30 -0.22 0.91 0.52 -0.30 -0.09 118.94 122.86 2qfl s TRP 81 Ca -0.00 0.22 -0.00 0.00 0.02 0.00 0.00 56.10 56.34 2qfl s TRP 81 Cb -0.12 -2.29 0.02 0.00 -1.15 0.00 0.00 33.47 29.93 2qfl s TRP 81 CO 0.02 0.03 -0.12 0.08 0.02 0.00 0.00 176.95 176.98 2qfl s VAL 82 N 1.17 2.53 -0.04 4.03 1.01 0.13 0.06 120.40 129.29 2qfl s VAL 82 Ca 0.08 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.08 2qfl s VAL 82 Cb -0.14 -2.20 0.02 0.00 0.00 0.00 0.00 36.38 34.06 2qfl s VAL 82 CO 0.05 0.34 -0.05 -0.63 0.00 0.00 0.00 175.10 174.82 2qfl s ILE 83 N 1.31 0.53 -0.31 2.22 1.01 -0.28 -0.88 121.20 124.80 2qfl s ILE 83 Ca 0.02 -0.13 -0.07 0.00 0.00 0.00 0.00 60.65 60.47 2qfl s ILE 83 Cb -0.15 -0.55 0.02 0.00 0.01 0.00 0.00 42.46 41.79 2qfl s ILE 83 CO -0.08 0.22 0.09 -0.62 0.00 0.00 0.00 174.94 174.55 2qfl s ASP 84 N 0.85 5.19 0.62 3.58 -1.08 -0.42 -1.93 116.67 123.47 2qfl s ASP 84 Ca -0.11 -0.89 0.40 0.00 -0.52 0.00 0.00 52.55 51.42 2qfl s ASP 84 Cb -0.14 -1.87 2.03 0.00 -1.46 0.00 0.00 42.92 41.48 2qfl s ASP 84 CO 0.00 -0.25 2.24 -0.65 0.52 0.00 0.00 175.17 177.03 2qfl h PRO 85 N 8.23 0.00 -0.95 4.34 0.11 -1.89 -0.48 132.00 141.35 2qfl h PRO 85 Ca -0.28 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.75 2qfl h PRO 85 Cb 1.11 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.04 2qfl h PRO 85 CO 0.60 0.01 -0.45 -1.17 -0.21 0.00 0.00 178.00 176.79 2qfl s LEU 86 N -6.32 -1.44 -0.39 2.35 2.96 -1.26 -4.47 118.68 110.11 2qfl s LEU 86 Ca -0.03 -1.09 -0.28 0.00 -0.22 0.00 0.00 54.13 52.51 2qfl s LEU 86 Cb 0.12 1.86 0.02 0.00 0.50 0.00 0.00 46.19 48.69 2qfl s LEU 86 CO 0.47 -0.12 1.03 -0.62 -1.32 0.00 0.00 176.35 175.79 2qfl s ASP 87 N 1.49 6.73 0.00 3.68 2.15 0.10 -3.94 116.67 126.88 2qfl s ASP 87 Ca 0.21 0.67 0.00 0.00 0.43 0.00 0.00 52.55 53.86 2qfl s ASP 87 Cb -0.02 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 2qfl s ASP 87 CO -0.07 -0.98 0.00 0.61 -0.17 0.00 0.00 175.17 174.56 2qfl n GLY 88 N 4.38 1.29 0.32 2.66 0.00 -1.26 -1.77 105.19 110.82 2qfl n GLY 88 Ca 0.10 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.08 2qfl n GLY 88 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2qfl h THR 89 N 0.00 0.21 -0.62 2.61 2.02 -1.84 -0.90 112.91 114.39 2qfl h THR 89 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2qfl h THR 89 Cb 0.00 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 66.59 2qfl h THR 89 CO 0.00 0.00 0.40 0.74 0.37 0.00 0.00 175.52 177.03 2qfl h THR 90 N -0.12 1.17 -0.54 3.16 2.02 -1.96 -1.50 112.91 115.14 2qfl h THR 90 Ca 0.26 -0.33 0.10 0.00 0.77 0.00 0.00 66.41 67.22 2qfl h THR 90 Cb 0.54 0.27 -0.09 0.00 -1.74 0.00 0.00 68.15 67.13 2qfl h THR 90 CO -0.68 0.17 0.04 0.78 0.37 0.00 0.00 175.52 176.19 2qfl h ASN 91 N 0.84 -0.15 -0.35 4.18 2.35 -1.72 -0.88 115.58 119.86 2qfl h ASN 91 Ca 0.23 0.12 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 2qfl h ASN 91 Cb -0.07 0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 2qfl h ASN 91 CO -0.05 -0.05 0.22 0.15 -1.65 0.00 0.00 177.43 176.05 2qfl h PHE 92 N 0.16 0.45 -0.83 1.19 3.57 -0.52 0.41 116.94 121.37 2qfl h PHE 92 Ca 0.28 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.75 2qfl h PHE 92 Cb 0.42 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 2qfl h PHE 92 CO -0.30 0.30 0.38 0.82 -2.23 0.00 0.00 178.31 177.29 2qfl h ILE 93 N 0.46 1.26 0.00 1.41 2.04 -0.91 -1.26 117.51 120.51 2qfl h ILE 93 Ca 0.13 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.23 2qfl h ILE 93 Cb -0.02 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 2qfl h ILE 93 CO -0.03 0.32 0.00 0.29 0.00 0.00 0.00 178.15 178.73 2qfl n LYS 94 N -4.31 0.07 -2.50 2.37 4.76 -0.37 -4.92 118.16 113.27 2qfl n LYS 94 Ca 0.08 0.03 -0.16 0.00 -2.87 0.00 0.00 58.31 55.39 2qfl n LYS 94 Cb 0.15 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.85 2qfl n LYS 94 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2qfl n ARG 95 N -1.46 -2.17 -2.42 1.97 5.12 0.20 -5.01 116.66 112.89 2qfl n ARG 95 Ca 0.08 0.74 -0.43 0.00 -1.93 0.00 0.00 57.85 56.31 2qfl n ARG 95 Cb 0.30 -5.13 -0.02 0.00 -1.16 0.00 0.00 32.46 26.45 2qfl n ARG 95 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2qfl s LEU 96 N -4.78 4.12 -0.42 0.55 1.43 0.12 -4.95 118.68 114.75 2qfl s LEU 96 Ca 0.08 1.60 -0.07 0.00 -1.03 0.00 0.00 54.13 54.72 2qfl s LEU 96 Cb -0.04 -3.54 -0.19 0.00 0.03 0.00 0.00 46.19 42.46 2qfl s LEU 96 CO 0.10 -0.83 3.37 -0.81 0.23 0.00 0.00 176.35 178.42 2qfl n PRO 97 N 6.75 2.48 -3.64 1.29 -0.04 -1.26 -4.27 135.00 136.31 2qfl n PRO 97 Ca 0.14 -1.46 -0.29 0.00 -0.04 0.00 0.00 63.50 61.84 2qfl n PRO 97 Cb 0.45 -2.20 -0.14 0.00 -0.04 0.00 0.00 33.50 31.57 2qfl n PRO 97 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2qfl s HIS 98 N 0.90 1.33 0.21 0.54 2.46 -1.26 -4.87 115.29 114.59 2qfl s HIS 98 Ca 0.66 -1.75 -0.22 0.00 0.47 0.00 0.00 55.06 54.23 2qfl s HIS 98 Cb 0.29 -1.45 0.05 0.00 -0.13 0.00 0.00 32.58 31.34 2qfl s HIS 98 CO -0.04 -0.84 0.64 -0.59 -2.47 0.00 0.00 174.74 171.45 2qfl s PHE 99 N 1.25 -0.38 0.06 3.88 -0.71 -1.26 -4.67 117.98 116.15 2qfl s PHE 99 Ca 0.14 0.06 -0.18 0.00 -1.04 0.00 0.00 56.93 55.91 2qfl s PHE 99 Cb -0.20 0.60 0.04 0.00 -1.21 0.00 0.00 43.02 42.25 2qfl s PHE 99 CO -0.15 -1.00 0.42 0.00 -1.34 0.00 0.00 175.22 173.16 2qfl s ALA 100 N -3.82 -1.03 -0.11 1.99 0.00 -0.73 -4.25 121.76 113.80 2qfl s ALA 100 Ca 0.05 0.28 -0.21 0.00 0.00 0.00 0.00 51.96 52.09 2qfl s ALA 100 Cb -0.03 0.41 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 2qfl s ALA 100 CO -0.05 -0.49 0.60 0.08 0.00 0.00 0.00 175.76 175.90 2qfl s VAL 101 N -2.69 5.10 -0.12 0.00 1.01 -0.76 0.01 120.40 122.94 2qfl s VAL 101 Ca -0.04 1.19 0.02 0.00 0.00 0.00 0.00 61.98 63.15 2qfl s VAL 101 Cb -0.00 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2qfl s VAL 101 CO -0.04 0.25 -0.18 -0.55 0.00 0.00 0.00 175.10 174.59 2qfl s SER 102 N 0.82 3.62 -0.13 3.32 0.15 -0.19 -1.31 113.70 119.97 2qfl s SER 102 Ca 0.31 -0.43 -0.04 0.00 0.70 0.00 0.00 55.95 56.49 2qfl s SER 102 Cb -0.16 -1.53 0.06 0.00 -1.71 0.00 0.00 66.02 62.68 2qfl s SER 102 CO 0.13 0.15 0.13 -0.63 1.20 0.00 0.00 173.24 174.23 2qfl s ILE 103 N 0.40 -0.19 0.00 6.45 1.01 -0.61 -1.31 121.20 126.95 2qfl s ILE 103 Ca -0.13 0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.66 2qfl s ILE 103 Cb -0.17 -0.43 -0.03 0.00 0.01 0.00 0.00 42.46 41.84 2qfl s ILE 103 CO 0.06 -0.05 -0.09 0.00 0.00 0.00 0.00 174.94 174.86 2qfl s ALA 104 N 2.23 2.92 -0.22 9.38 0.00 -0.06 -1.30 121.76 134.71 2qfl s ALA 104 Ca 0.04 -1.04 -0.06 0.00 0.00 0.00 0.00 51.96 50.90 2qfl s ALA 104 Cb -0.14 -1.05 -0.03 0.00 0.00 0.00 0.00 23.12 21.90 2qfl s ALA 104 CO -0.08 0.60 0.03 0.08 0.00 0.00 0.00 175.76 176.39 2qfl s VAL 105 N -0.96 4.08 -0.17 0.00 1.01 -0.36 0.22 120.40 124.22 2qfl s VAL 105 Ca 0.16 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 61.82 2qfl s VAL 105 Cb -0.11 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 2qfl s VAL 105 CO 0.06 0.40 0.02 -0.13 0.00 0.00 0.00 175.10 175.45 2qfl s ARG 106 N 1.24 3.85 -0.23 2.72 0.52 0.87 -0.91 118.95 127.02 2qfl s ARG 106 Ca 0.04 -0.42 -0.03 0.00 -0.52 0.00 0.00 55.73 54.80 2qfl s ARG 106 Cb -0.15 -3.10 0.00 0.00 0.52 0.00 0.00 34.95 32.23 2qfl s ARG 106 CO 0.02 0.26 -0.05 0.42 0.02 0.00 0.00 175.30 175.96 2qfl s ILE 107 N 0.38 3.16 -1.30 1.52 1.01 0.10 -1.13 121.20 124.95 2qfl s ILE 107 Ca 0.00 -0.68 -0.19 0.00 0.00 0.00 0.00 60.65 59.78 2qfl s ILE 107 Cb -0.13 -2.48 0.02 0.00 0.01 0.00 0.00 42.46 39.87 2qfl s ILE 107 CO 0.01 0.36 0.53 0.29 0.00 0.00 0.00 174.94 176.13 2qfl n LYS 108 N 4.75 -1.09 -0.89 2.79 5.02 0.17 -1.51 118.16 127.41 2qfl n LYS 108 Ca -0.18 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2qfl n LYS 108 Cb 0.50 -3.41 0.00 0.00 -0.02 0.00 0.00 35.03 32.10 2qfl n LYS 108 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qfl n GLY 109 N -2.08 0.33 3.31 0.72 0.00 -1.26 -5.01 105.19 101.19 2qfl n GLY 109 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 2qfl n GLY 109 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qfl s ARG 110 N -0.84 3.31 0.09 1.61 3.52 -0.57 -5.07 118.95 120.99 2qfl s ARG 110 Ca 0.00 -0.70 -0.31 0.00 -0.13 0.00 0.00 55.73 54.59 2qfl s ARG 110 Cb 0.00 -2.72 -0.09 0.00 -1.56 0.00 0.00 34.95 30.58 2qfl s ARG 110 CO 0.00 0.02 1.66 0.99 -0.81 0.00 0.00 175.30 177.16 2qfl s THR 111 N 0.84 2.91 -0.01 4.11 2.01 -1.26 0.02 115.64 124.26 2qfl s THR 111 Ca -0.04 0.43 0.02 0.00 0.31 0.00 0.00 61.69 62.41 2qfl s THR 111 Cb -0.15 -3.27 -0.03 0.00 0.01 0.00 0.00 72.50 69.06 2qfl s THR 111 CO 0.00 0.00 0.03 -0.62 -0.69 0.00 0.00 174.62 173.34 2qfl n GLU 112 N 5.35 1.57 -4.17 4.92 -0.58 -0.08 -4.70 120.64 122.95 2qfl n GLU 112 Ca 0.16 -0.01 -0.16 0.00 -0.42 0.00 0.00 57.16 56.73 2qfl n GLU 112 Cb 0.40 -1.04 -0.14 0.00 -0.57 0.00 0.00 31.44 30.09 2qfl n GLU 112 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2qfl s VAL 113 N -2.09 0.51 -0.16 2.62 1.01 -1.17 -0.61 120.40 120.50 2qfl s VAL 113 Ca -0.01 -0.49 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 2qfl s VAL 113 Cb 0.01 -0.47 0.06 0.00 0.00 0.00 0.00 36.38 35.97 2qfl s VAL 113 CO 0.07 -0.00 0.39 0.00 0.00 0.00 0.00 175.10 175.57 2qfl s ALA 114 N -0.47 -1.00 -0.06 5.51 0.00 -0.49 -1.22 121.76 124.03 2qfl s ALA 114 Ca -0.01 1.43 0.01 0.00 0.00 0.00 0.00 51.96 53.40 2qfl s ALA 114 Cb -0.04 -0.87 0.02 0.00 0.00 0.00 0.00 23.12 22.23 2qfl s ALA 114 CO -0.00 -0.25 -0.06 0.08 0.00 0.00 0.00 175.76 175.53 2qfl s VAL 115 N 1.24 0.72 -0.08 0.00 1.01 -0.42 -1.11 120.40 121.76 2qfl s VAL 115 Ca -0.08 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.72 2qfl s VAL 115 Cb -0.08 -0.73 0.01 0.00 0.00 0.00 0.00 36.38 35.58 2qfl s VAL 115 CO -0.11 0.27 -0.17 -0.69 0.00 0.00 0.00 175.10 174.41 2qfl s VAL 116 N 1.01 1.51 -0.08 2.92 1.01 -0.04 -1.57 120.40 125.15 2qfl s VAL 116 Ca -0.09 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 2qfl s VAL 116 Cb -0.14 -1.34 0.03 0.00 0.00 0.00 0.00 36.38 34.92 2qfl s VAL 116 CO -0.00 0.44 -0.03 -0.47 0.00 0.00 0.00 175.10 175.04 2qfl s TYR 117 N 0.52 0.93 -0.40 5.22 5.04 -0.43 -0.05 117.35 128.18 2qfl s TYR 117 Ca -0.16 -0.34 -0.17 0.00 -2.44 0.00 0.00 57.07 53.96 2qfl s TYR 117 Cb -0.17 -0.92 0.01 0.00 0.35 0.00 0.00 41.96 41.24 2qfl s TYR 117 CO 0.06 -0.37 0.41 0.34 -1.34 0.00 0.00 175.55 174.65 2qfl s ASP 118 N 1.78 6.19 0.19 4.32 3.68 0.13 -1.84 116.67 131.11 2qfl s ASP 118 Ca 0.03 -0.55 0.25 0.00 2.13 0.00 0.00 52.55 54.41 2qfl s ASP 118 Cb -0.13 -2.21 0.48 0.00 -1.45 0.00 0.00 42.92 39.61 2qfl s ASP 118 CO -0.05 -0.50 1.49 1.55 0.13 0.00 0.00 175.17 177.78 2qfl h PRO 119 N 8.64 0.00 -0.12 4.34 0.13 -1.85 -0.13 132.00 143.01 2qfl h PRO 119 Ca -0.27 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.77 2qfl h PRO 119 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2qfl h PRO 119 CO 0.76 0.00 -0.26 0.52 -0.23 0.00 0.00 178.00 178.79 2qfl h MET 120 N 0.00 0.38 -0.00 0.86 2.86 -1.90 -3.21 114.93 113.92 2qfl h MET 120 Ca 0.00 -0.25 0.00 0.00 -2.06 0.00 0.00 59.70 57.39 2qfl h MET 120 Cb 0.79 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.48 2qfl h MET 120 CO 0.00 0.86 -0.21 0.54 1.06 0.00 0.00 176.91 179.15 2qfl n ARG 121 N -4.45 0.42 -3.89 1.72 1.74 -1.23 -4.94 116.66 106.02 2qfl n ARG 121 Ca -0.07 -0.18 -0.26 0.00 -0.77 0.00 0.00 57.85 56.57 2qfl n ARG 121 Cb 0.45 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.39 2qfl n ARG 121 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2qfl n ASN 122 N -1.13 -1.30 -4.36 0.55 5.15 -0.17 -4.98 115.26 109.03 2qfl n ASN 122 Ca 0.11 -1.00 -0.34 0.00 -0.60 0.00 0.00 54.58 52.74 2qfl n ASN 122 Cb 0.31 -3.16 -0.14 0.00 -0.53 0.00 0.00 39.78 36.27 2qfl n ASN 122 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2qfl s GLU 123 N -6.43 3.44 -0.31 1.20 2.02 -0.57 -4.97 118.70 113.09 2qfl s GLU 123 Ca 0.09 -0.61 -0.05 0.00 0.02 0.00 0.00 54.97 54.42 2qfl s GLU 123 Cb -0.04 -2.93 0.03 0.00 0.10 0.00 0.00 34.13 31.30 2qfl s GLU 123 CO 0.88 -0.04 0.05 -1.17 0.02 0.00 0.00 175.26 175.01 2qfl s LEU 124 N 1.06 3.95 -0.14 1.80 2.96 -1.26 0.17 118.68 127.22 2qfl s LEU 124 Ca 0.01 -1.02 -0.07 0.00 -0.22 0.00 0.00 54.13 52.83 2qfl s LEU 124 Cb -0.15 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2qfl s LEU 124 CO -0.00 -0.25 0.12 -0.36 -1.32 0.00 0.00 176.35 174.54 2qfl s PHE 125 N 1.39 3.50 0.08 5.38 0.08 0.93 -1.16 117.98 128.18 2qfl s PHE 125 Ca -0.01 0.43 -0.02 0.00 0.12 0.00 0.00 56.93 57.45 2qfl s PHE 125 Cb -0.19 -1.98 -0.03 0.00 -0.57 0.00 0.00 43.02 40.25 2qfl s PHE 125 CO 0.01 0.59 0.03 0.95 -0.10 0.00 0.00 175.22 176.71 2qfl s THR 126 N -0.66 0.17 -0.09 0.64 -4.23 -0.27 -0.86 115.64 110.33 2qfl s THR 126 Ca 0.13 -1.75 -0.30 0.00 -1.18 0.00 0.00 61.69 58.59 2qfl s THR 126 Cb -0.12 -1.67 0.07 0.00 1.34 0.00 0.00 72.50 72.12 2qfl s THR 126 CO 0.02 -0.77 0.68 0.00 -0.54 0.00 0.00 174.62 174.01 2qfl s ALA 127 N -3.95 -1.76 0.09 3.99 0.00 -0.26 -1.24 121.76 118.61 2qfl s ALA 127 Ca 0.12 1.44 0.06 0.00 0.00 0.00 0.00 51.96 53.58 2qfl s ALA 127 Cb 0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 2qfl s ALA 127 CO -0.06 -0.36 -0.17 0.95 0.00 0.00 0.00 175.76 176.12 2qfl s THR 128 N -0.91 1.34 0.30 0.00 -4.23 -1.23 -1.39 115.64 109.53 2qfl s THR 128 Ca -0.09 -1.43 -0.29 0.00 -1.18 0.00 0.00 61.69 58.70 2qfl s THR 128 Cb -0.01 -1.28 -0.10 0.00 1.34 0.00 0.00 72.50 72.45 2qfl s THR 128 CO 0.08 -0.18 1.36 -0.60 -0.54 0.00 0.00 174.62 174.74 2qfl s ARG 129 N -1.88 4.31 0.00 3.99 3.52 0.21 -1.58 118.95 127.53 2qfl s ARG 129 Ca 0.02 2.26 0.00 0.00 -0.13 0.00 0.00 55.73 57.88 2qfl s ARG 129 Cb -0.10 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.21 2qfl s ARG 129 CO 0.03 -0.28 0.00 0.41 -0.81 0.00 0.00 175.30 174.65 2qfl n GLY 130 N 1.27 1.48 0.28 8.12 0.00 -1.26 -4.83 105.19 110.25 2qfl n GLY 130 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.07 2qfl n GLY 130 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qfl n GLN 131 N -2.00 2.15 0.00 1.61 6.02 -0.61 -5.12 117.38 119.43 2qfl n GLN 131 Ca 0.00 -1.53 0.00 0.00 -0.01 0.00 0.00 57.00 55.46 2qfl n GLN 131 Cb 0.00 -1.12 0.00 0.00 1.02 0.00 0.00 30.24 30.14 2qfl n GLN 131 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qfl n GLY 132 N 0.06 -1.11 3.57 1.08 0.00 -1.22 -4.83 105.19 102.75 2qfl n GLY 132 Ca 0.05 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.14 2qfl n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qfl s ALA 133 N -1.43 2.93 0.06 4.61 0.00 -1.17 -3.46 121.76 123.30 2qfl s ALA 133 Ca 0.00 -1.21 0.02 0.00 0.00 0.00 0.00 51.96 50.77 2qfl s ALA 133 Cb 0.00 -0.91 -0.03 0.00 0.00 0.00 0.00 23.12 22.18 2qfl s ALA 133 CO 0.00 0.63 -0.07 -0.65 0.00 0.00 0.00 175.76 175.68 2qfl s GLN 134 N -2.02 0.60 -0.14 0.00 -0.21 -0.38 -1.03 119.66 116.48 2qfl s GLN 134 Ca 0.20 -0.95 0.02 0.00 0.02 0.00 0.00 55.36 54.66 2qfl s GLN 134 Cb -0.11 -0.19 0.01 0.00 1.00 0.00 0.00 33.01 33.72 2qfl s GLN 134 CO 0.12 0.01 -0.20 -1.17 -2.12 0.00 0.00 175.29 171.93 2qfl s LEU 135 N -2.09 2.01 -1.63 2.90 2.96 -0.03 -1.11 118.68 121.68 2qfl s LEU 135 Ca -0.03 -0.56 -0.17 0.00 -0.22 0.00 0.00 54.13 53.15 2qfl s LEU 135 Cb -0.04 -1.36 0.17 0.00 0.50 0.00 0.00 46.19 45.46 2qfl s LEU 135 CO -0.02 0.05 0.42 0.59 -1.32 0.00 0.00 176.35 176.08 2qfl n ASN 136 N 4.16 -1.11 0.00 3.68 3.02 -0.31 -0.90 115.26 123.80 2qfl n ASN 136 Ca -0.20 -1.13 0.00 0.00 -0.03 0.00 0.00 54.58 53.22 2qfl n ASN 136 Cb 0.51 -1.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.25 2qfl n ASN 136 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qfl n GLY 137 N -1.30 1.02 3.58 7.41 0.00 -1.26 -5.04 105.19 109.60 2qfl n GLY 137 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 2qfl n GLY 137 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qfl s TYR 138 N -2.51 3.15 0.33 1.61 4.12 -0.08 -5.00 117.35 118.97 2qfl s TYR 138 Ca 0.00 -0.08 -0.29 0.00 0.02 0.00 0.00 57.07 56.73 2qfl s TYR 138 Cb 0.00 -2.00 -0.12 0.00 -1.52 0.00 0.00 41.96 38.32 2qfl s TYR 138 CO 0.00 0.10 1.36 -2.13 0.02 0.00 0.00 175.55 174.90 2qfl n ARG 139 N 3.41 2.25 -4.24 -0.62 3.00 -1.26 -0.85 116.66 118.36 2qfl n ARG 139 Ca -0.17 0.79 -0.33 0.00 -0.00 0.00 0.00 57.85 58.14 2qfl n ARG 139 Cb 0.52 -2.42 -0.08 0.00 0.00 0.00 0.00 32.46 30.48 2qfl n ARG 139 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2qfl s LEU 140 N -1.02 3.64 0.13 6.15 1.43 -0.20 -4.83 118.68 123.98 2qfl s LEU 140 Ca 0.57 0.06 0.05 0.00 -1.03 0.00 0.00 54.13 53.78 2qfl s LEU 140 Cb -0.56 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 2qfl s LEU 140 CO 0.60 0.29 -0.12 -0.13 0.23 0.00 0.00 176.35 177.22 2qfl s ARG 141 N -1.52 1.01 0.00 1.70 3.00 -1.24 -4.57 118.95 117.33 2qfl s ARG 141 Ca 0.20 -1.29 0.00 0.00 0.00 0.00 0.00 55.73 54.63 2qfl s ARG 141 Cb -0.12 -0.77 0.00 0.00 0.00 0.00 0.00 34.95 34.06 2qfl s ARG 141 CO 0.10 0.13 0.00 0.41 0.00 0.00 0.00 175.30 175.94 2qfl n GLY 142 N 0.31 -1.55 3.93 -3.53 0.00 -0.25 -3.81 105.19 100.28 2qfl n GLY 142 Ca -0.14 -1.15 -0.25 0.00 0.00 0.00 0.00 46.02 44.48 2qfl n GLY 142 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qfl s SER 143 N -1.59 6.33 -0.31 1.61 1.04 -1.26 -3.90 113.70 115.62 2qfl s SER 143 Ca 0.00 0.51 0.10 0.00 0.48 0.00 0.00 55.95 57.04 2qfl s SER 143 Cb 0.00 -2.06 0.75 0.00 0.10 0.00 0.00 66.02 64.81 2qfl s SER 143 CO 0.00 -0.26 1.80 0.35 0.98 0.00 0.00 173.24 176.11 2qfl n THR 144 N -1.54 2.90 -2.35 2.02 -2.24 -1.26 -4.81 114.28 107.01 2qfl n THR 144 Ca -0.04 -1.57 -0.34 0.00 -2.27 0.00 0.00 64.05 59.83 2qfl n THR 144 Cb 0.55 -0.36 -0.02 0.00 -2.10 0.00 0.00 70.33 68.41 2qfl n THR 144 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qfl s ALA 145 N -2.93 2.81 0.00 6.98 0.00 -1.26 -4.98 121.76 122.38 2qfl s ALA 145 Ca 0.55 0.55 0.00 0.00 0.00 0.00 0.00 51.96 53.05 2qfl s ALA 145 Cb 0.43 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 20.30 2qfl s ALA 145 CO 0.14 -0.52 0.00 0.54 0.00 0.00 0.00 175.76 175.92 2qfl n ARG 146 N -1.37 5.73 -2.65 0.00 1.74 -1.26 -4.47 116.66 114.38 2qfl n ARG 146 Ca 0.09 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.13 2qfl n ARG 146 Cb 0.52 -0.51 0.02 0.00 -1.02 0.00 0.00 32.46 31.48 2qfl n ARG 146 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2qfl n ASP 147 N -0.95 -1.27 -0.41 0.55 5.75 -1.26 -4.71 116.55 114.24 2qfl n ASP 147 Ca 0.00 -1.85 0.13 0.00 -0.01 0.00 0.00 54.79 53.07 2qfl n ASP 147 Cb 0.00 2.11 0.55 0.00 -1.03 0.00 0.00 41.12 42.75 2qfl n ASP 147 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2qfl n LEU 148 N 0.00 1.26 -4.56 -2.12 4.77 -1.26 -4.69 117.00 110.40 2qfl n LEU 148 Ca -0.04 -0.45 -0.43 0.00 -0.03 0.00 0.00 56.01 55.06 2qfl n LEU 148 Cb 0.34 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.37 2qfl n LEU 148 CO 0.15 0.23 0.71 -0.62 -1.33 0.00 0.00 177.39 176.53 2qfl s ASP 149 N -1.89 6.48 0.00 -1.43 2.15 -1.24 -2.13 116.67 118.61 2qfl s ASP 149 Ca 0.38 0.07 0.00 0.00 0.43 0.00 0.00 52.55 53.43 2qfl s ASP 149 Cb 0.20 -2.44 0.00 0.00 -0.30 0.00 0.00 42.92 40.38 2qfl s ASP 149 CO 0.32 -1.03 0.00 0.61 -0.17 0.00 0.00 175.17 174.90 2qfl n GLY 150 N 4.94 0.57 3.88 2.66 0.00 0.11 -4.99 105.19 112.36 2qfl n GLY 150 Ca 0.05 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 2qfl n GLY 150 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qfl s THR 151 N -2.00 4.75 -0.19 2.61 -4.23 -1.19 -4.96 115.64 110.44 2qfl s THR 151 Ca 0.00 0.68 -0.01 0.00 -1.18 0.00 0.00 61.69 61.18 2qfl s THR 151 Cb 0.00 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 70.05 2qfl s THR 151 CO 0.00 -0.75 -0.12 -0.63 -0.54 0.00 0.00 174.62 172.57 2qfl s ILE 152 N -2.66 2.78 -0.23 2.99 -1.09 -1.26 -1.02 121.20 120.70 2qfl s ILE 152 Ca 0.52 -0.71 -0.03 0.00 -2.23 0.00 0.00 60.65 58.21 2qfl s ILE 152 Cb -0.10 -2.21 0.01 0.00 -1.58 0.00 0.00 42.46 38.57 2qfl s ILE 152 CO 0.39 0.49 -0.06 -0.76 -1.23 0.00 0.00 174.94 173.77 2qfl s LEU 153 N 1.19 2.99 0.37 2.97 1.43 0.13 -0.38 118.68 127.38 2qfl s LEU 153 Ca 0.02 -0.62 -0.26 0.00 -1.03 0.00 0.00 54.13 52.24 2qfl s LEU 153 Cb -0.14 -1.69 -0.09 0.00 0.03 0.00 0.00 46.19 44.30 2qfl s LEU 153 CO -0.05 -0.07 1.14 0.00 0.23 0.00 0.00 176.35 177.60 2qfl s ALA 154 N 1.40 3.21 0.27 4.21 0.00 0.64 -1.30 121.76 130.20 2qfl s ALA 154 Ca 0.03 0.92 -0.19 0.00 0.00 0.00 0.00 51.96 52.72 2qfl s ALA 154 Cb -0.15 -3.35 0.07 0.00 0.00 0.00 0.00 23.12 19.68 2qfl s ALA 154 CO -0.04 -0.40 0.93 -0.08 0.00 0.00 0.00 175.76 176.17 2qfl s THR 155 N -1.40 0.00 0.02 0.00 -1.32 0.21 -2.41 115.64 110.73 2qfl s THR 155 Ca 0.54 -0.77 -0.14 0.00 -1.21 0.00 0.00 61.69 60.11 2qfl s THR 155 Cb -0.30 -2.87 0.02 0.00 -1.51 0.00 0.00 72.50 67.84 2qfl s THR 155 CO 0.38 0.00 0.30 -0.83 -2.21 0.00 0.00 174.62 172.26 2qfl s GLY 156 N -3.26 -0.13 0.46 6.08 0.00 -1.26 -4.12 107.32 105.10 2qfl s GLY 156 Ca 0.19 0.14 -0.20 0.00 0.00 0.00 0.00 44.72 44.86 2qfl s GLY 156 CO 0.08 -0.07 0.97 -1.36 0.00 0.00 0.00 173.10 172.72 2qfl s PHE 157 N -1.98 3.30 -1.38 1.90 0.40 -1.26 -4.70 117.98 114.26 2qfl s PHE 157 Ca -0.09 1.57 -0.09 0.00 -0.60 0.00 0.00 56.93 57.72 2qfl s PHE 157 Cb -0.03 -2.86 -0.08 0.00 0.51 0.00 0.00 43.02 40.56 2qfl s PHE 157 CO 0.00 -0.28 2.97 -0.35 0.70 0.00 0.00 175.22 178.25 2qfl n PRO 158 N -0.97 3.61 -0.33 0.24 -0.04 -1.26 -4.64 135.00 131.61 2qfl n PRO 158 Ca 0.07 -2.23 0.11 0.00 -0.04 0.00 0.00 63.50 61.42 2qfl n PRO 158 Cb 0.54 -2.68 0.32 0.00 -0.04 0.00 0.00 33.50 31.64 2qfl n PRO 158 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2qfl h PHE 159 N 4.68 1.01 -0.30 0.54 3.57 -1.95 0.11 116.94 124.61 2qfl h PHE 159 Ca 0.77 0.03 0.00 0.00 3.53 0.00 0.00 57.97 62.30 2qfl h PHE 159 Cb 0.43 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.86 2qfl h PHE 159 CO 1.83 0.31 0.00 1.63 -2.23 0.00 0.00 178.31 179.86 2qfl n LYS 160 N -4.66 1.87 -2.84 1.11 5.02 -1.26 -4.39 118.16 113.01 2qfl n LYS 160 Ca 0.21 -1.33 -0.11 0.00 -2.02 0.00 0.00 58.31 55.05 2qfl n LYS 160 Cb 0.49 -1.35 0.06 0.00 -0.02 0.00 0.00 35.03 34.21 2qfl n LYS 160 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qfl n ALA 161 N 0.56 0.27 0.25 7.82 0.00 0.33 -5.01 120.51 124.72 2qfl n ALA 161 Ca 0.15 -2.00 0.11 0.00 0.00 0.00 0.00 53.44 51.69 2qfl n ALA 161 Cb 0.35 -1.08 0.67 0.00 0.00 0.00 0.00 19.45 19.39 2qfl n ALA 161 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qfl h LYS 162 N 2.91 0.00 0.00 0.00 1.57 -1.62 -1.11 116.57 118.32 2qfl h LYS 162 Ca -0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2qfl h LYS 162 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 2qfl h LYS 162 CO 0.22 0.14 0.00 -0.56 -0.57 0.00 0.00 179.45 178.68 2qfl h GLN 163 N 0.00 0.00 -0.36 3.15 -0.00 -1.95 0.25 115.11 116.19 2qfl h GLN 163 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2qfl h GLN 163 Cb 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.80 2qfl h GLN 163 CO 0.02 0.00 0.00 0.66 -0.00 0.00 0.00 178.83 179.51 2qfl n TYR 164 N -2.50 0.46 -0.33 0.06 4.02 -0.42 -4.66 117.16 113.79 2qfl n TYR 164 Ca -0.01 -0.23 -0.06 0.00 -0.01 0.00 0.00 57.90 57.58 2qfl n TYR 164 Cb 0.07 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.37 2qfl n TYR 164 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2qfl h ALA 165 N 4.38 -0.21 -0.08 -0.72 0.00 -0.66 -0.27 119.26 121.70 2qfl h ALA 165 Ca 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2qfl h ALA 165 Cb 0.86 1.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.75 2qfl h ALA 165 CO 0.00 -0.79 0.03 1.15 0.00 0.00 0.00 179.25 179.64 2qfl h THR 166 N -0.08 1.16 -0.28 0.00 2.02 -1.83 0.42 112.91 114.33 2qfl h THR 166 Ca 0.24 -0.49 0.02 0.00 0.77 0.00 0.00 66.41 66.96 2qfl h THR 166 Cb 0.53 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 68.25 2qfl h THR 166 CO -0.88 0.14 0.12 0.74 0.37 0.00 0.00 175.52 176.01 2qfl h THR 167 N -0.04 0.96 0.61 3.16 2.02 -1.83 0.15 112.91 117.94 2qfl h THR 167 Ca 0.03 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 2qfl h THR 167 Cb 0.20 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2qfl h THR 167 CO -0.00 0.05 -0.33 0.22 0.37 0.00 0.00 175.52 175.83 2qfl h TYR 168 N 0.26 -0.86 -0.81 3.16 5.03 -0.92 0.02 116.97 122.85 2qfl h TYR 168 Ca 0.12 -0.01 0.14 0.00 2.58 0.00 0.00 58.73 61.55 2qfl h TYR 168 Cb 0.06 0.29 -0.06 0.00 1.55 0.00 0.00 36.73 38.58 2qfl h TYR 168 CO -0.11 -0.52 0.53 0.82 -1.32 0.00 0.00 178.16 177.56 2qfl h ILE 169 N -0.87 0.83 -0.55 1.81 2.04 -0.84 0.12 117.51 120.05 2qfl h ILE 169 Ca -0.08 -0.19 -0.11 0.00 1.00 0.00 0.00 64.86 65.48 2qfl h ILE 169 Cb 0.69 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2qfl h ILE 169 CO 0.11 0.10 -0.10 0.78 0.00 0.00 0.00 178.15 179.04 2qfl h ASN 170 N 0.55 1.03 -0.34 1.72 4.21 -0.52 -1.67 115.58 120.56 2qfl h ASN 170 Ca 0.40 -0.35 -0.03 0.00 1.21 0.00 0.00 56.30 57.53 2qfl h ASN 170 Cb 0.75 -0.28 -0.01 0.00 -1.12 0.00 0.00 38.32 37.66 2qfl h ASN 170 CO -0.15 1.13 0.08 0.40 -1.29 0.00 0.00 177.43 177.60 2qfl h ILE 171 N 0.91 1.22 -0.32 2.81 2.04 0.91 -2.30 117.51 122.78 2qfl h ILE 171 Ca 0.14 -0.76 0.04 0.00 1.00 0.00 0.00 64.86 65.28 2qfl h ILE 171 Cb 0.67 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 2qfl h ILE 171 CO 0.05 0.26 0.07 0.58 0.00 0.00 0.00 178.15 179.11 2qfl h VAL 172 N 0.39 0.86 -0.35 1.67 2.07 -0.84 -2.14 116.25 117.91 2qfl h VAL 172 Ca 0.11 -0.07 0.06 0.00 0.82 0.00 0.00 66.70 67.62 2qfl h VAL 172 Cb 0.31 0.65 -0.08 0.00 -1.52 0.00 0.00 31.29 30.64 2qfl h VAL 172 CO 0.00 0.03 -0.44 1.23 0.02 0.00 0.00 177.57 178.42 2qfl h GLY 173 N 0.19 -0.63 0.73 2.17 0.00 -1.17 -1.42 103.07 102.94 2qfl h GLY 173 Ca 0.15 0.56 0.07 0.00 0.00 0.00 0.00 47.33 48.10 2qfl h GLY 173 CO -0.19 -0.19 0.64 0.50 0.00 0.00 0.00 176.54 177.31 2qfl h LYS 174 N -0.37 1.13 -0.17 4.80 1.57 -1.14 -2.64 116.57 119.74 2qfl h LYS 174 Ca 0.12 -0.07 -0.21 0.00 -1.87 0.00 0.00 60.65 58.63 2qfl h LYS 174 Cb 0.60 -0.25 0.01 0.00 0.08 0.00 0.00 32.23 32.66 2qfl h LYS 174 CO -0.54 0.74 -0.70 -0.07 -0.57 0.00 0.00 179.45 178.32 2qfl h LEU 175 N 1.16 0.91 -1.47 2.94 3.38 -0.90 -2.66 115.31 118.67 2qfl h LEU 175 Ca 0.43 -0.61 0.18 0.00 0.09 0.00 0.00 57.88 57.97 2qfl h LEU 175 Cb 0.18 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.60 2qfl h LEU 175 CO -0.18 1.37 0.57 0.15 0.09 0.00 0.00 178.44 180.44 2qfl h PHE 176 N 0.51 0.59 0.00 1.13 3.04 -1.17 -0.75 116.94 120.29 2qfl h PHE 176 Ca -0.04 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.93 2qfl h PHE 176 Cb 1.32 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 39.65 2qfl h PHE 176 CO 0.09 0.18 0.00 0.09 -2.02 0.00 0.00 178.31 176.65 2qfl n ASN 177 N -4.52 0.00 -1.64 0.41 5.03 -1.00 -1.63 115.26 111.91 2qfl n ASN 177 Ca 0.18 0.17 0.09 0.00 0.87 0.00 0.00 54.58 55.89 2qfl n ASN 177 Cb 0.61 -0.39 0.36 0.00 -1.02 0.00 0.00 39.78 39.35 2qfl n ASN 177 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2qfl n GLU 178 N -1.39 3.92 -2.31 3.52 -0.58 -0.30 -4.94 120.64 118.55 2qfl n GLU 178 Ca 0.10 -2.88 -0.11 0.00 -0.42 0.00 0.00 57.16 53.85 2qfl n GLU 178 Cb 0.27 -1.96 0.00 0.00 -0.57 0.00 0.00 31.44 29.18 2qfl n GLU 178 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qfl s ALA 180 N -2.61 3.49 0.40 0.00 0.00 -0.90 0.05 121.76 122.19 2qfl s ALA 180 Ca 0.04 -0.25 0.07 0.00 0.00 0.00 0.00 51.96 51.82 2qfl s ALA 180 Cb -0.02 -2.53 -0.08 0.00 0.00 0.00 0.00 23.12 20.50 2qfl s ALA 180 CO 0.05 0.33 0.00 0.34 0.00 0.00 0.00 175.76 176.48 2qfl s ASP 181 N -2.64 3.89 0.10 0.00 3.68 -0.19 -4.47 116.67 117.04 2qfl s ASP 181 Ca 0.49 -1.33 0.10 0.00 2.13 0.00 0.00 52.55 53.94 2qfl s ASP 181 Cb -0.11 -0.40 -0.04 0.00 -1.45 0.00 0.00 42.92 40.93 2qfl s ASP 181 CO 0.24 -0.42 -0.25 -0.36 0.13 0.00 0.00 175.17 174.51 2qfl s PHE 182 N -2.69 2.37 0.00 -5.34 0.40 -1.26 -0.69 117.98 110.77 2qfl s PHE 182 Ca 0.35 -0.36 0.05 0.00 -0.60 0.00 0.00 56.93 56.37 2qfl s PHE 182 Cb 0.09 -1.31 -0.03 0.00 0.51 0.00 0.00 43.02 42.27 2qfl s PHE 182 CO 0.18 0.29 -0.14 1.03 0.70 0.00 0.00 175.22 177.28 2qfl s ARG 183 N -1.84 2.32 -0.25 0.44 1.81 -0.42 -4.86 118.95 116.16 2qfl s ARG 183 Ca 0.14 -0.83 -0.02 0.00 -1.72 0.00 0.00 55.73 53.31 2qfl s ARG 183 Cb -0.10 -2.32 0.08 0.00 -0.45 0.00 0.00 34.95 32.16 2qfl s ARG 183 CO 0.06 0.58 0.06 0.00 -0.68 0.00 0.00 175.30 175.32 2qfl s ALA 184 N -0.87 1.27 -0.11 2.13 0.00 -1.26 -0.62 121.76 122.29 2qfl s ALA 184 Ca 0.14 -1.16 0.13 0.00 0.00 0.00 0.00 51.96 51.07 2qfl s ALA 184 Cb -0.11 -1.39 -0.20 0.00 0.00 0.00 0.00 23.12 21.43 2qfl s ALA 184 CO 0.04 -1.40 0.33 0.25 0.00 0.00 0.00 175.76 174.98 2qfl n THR 185 N 4.95 0.00 -0.58 0.00 -2.24 -1.26 -5.02 114.28 110.14 2qfl n THR 185 Ca -0.06 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2qfl n THR 185 Cb 0.45 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 2qfl n THR 185 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qfl n GLY 186 N 1.68 0.70 2.73 3.38 0.00 -1.26 -4.92 105.19 107.50 2qfl n GLY 186 Ca -0.02 -0.12 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 2qfl n GLY 186 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qfl s SER 187 N -2.11 1.60 0.34 1.61 0.15 -1.26 -4.08 113.70 109.95 2qfl s SER 187 Ca 0.00 -1.28 0.02 0.00 0.70 0.00 0.00 55.95 55.38 2qfl s SER 187 Cb 0.00 0.43 0.61 0.00 -1.71 0.00 0.00 66.02 65.35 2qfl s SER 187 CO 0.00 -0.32 1.99 0.00 1.20 0.00 0.00 173.24 176.11 2qfl h ALA 188 N 7.59 1.55 -0.41 5.45 0.00 -1.90 -0.44 119.26 131.10 2qfl h ALA 188 Ca -0.03 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2qfl h ALA 188 Cb 1.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2qfl h ALA 188 CO 0.27 0.40 0.04 0.00 0.00 0.00 0.00 179.25 179.96 2qfl h ALA 189 N 1.58 0.55 -0.97 0.00 0.00 -1.92 -1.06 119.26 117.43 2qfl h ALA 189 Ca 0.27 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qfl h ALA 189 Cb -0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.56 2qfl h ALA 189 CO -0.07 0.30 0.61 -0.07 0.00 0.00 0.00 179.25 180.02 2qfl h LEU 190 N 0.54 1.14 -0.70 0.00 3.38 -1.86 -1.33 115.31 116.49 2qfl h LEU 190 Ca 0.12 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.07 2qfl h LEU 190 Cb 0.42 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2qfl h LEU 190 CO 0.01 0.86 0.44 0.44 0.09 0.00 0.00 178.44 180.28 2qfl h ASP 191 N 1.33 0.72 -0.47 -0.43 3.45 -0.73 0.21 116.42 120.48 2qfl h ASP 191 Ca 0.35 0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.72 2qfl h ASP 191 Cb -0.09 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.51 2qfl h ASP 191 CO -0.07 0.50 -0.07 -0.07 -1.57 0.00 0.00 179.24 177.95 2qfl h LEU 192 N 0.86 0.89 -1.16 1.55 3.38 -1.05 0.36 115.31 120.13 2qfl h LEU 192 Ca 0.28 -0.34 0.09 0.00 0.09 0.00 0.00 57.88 58.01 2qfl h LEU 192 Cb 0.03 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.47 2qfl h LEU 192 CO -0.11 1.02 0.59 0.00 0.09 0.00 0.00 178.44 180.03 2qfl h ALA 193 N 0.90 1.60 -0.02 1.53 0.00 -0.81 -1.59 119.26 120.87 2qfl h ALA 193 Ca 0.13 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 2qfl h ALA 193 Cb 0.61 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2qfl h ALA 193 CO 0.04 0.22 -0.78 1.88 0.00 0.00 0.00 179.25 180.61 2qfl h TYR 194 N 0.93 0.25 -0.18 0.00 0.99 0.18 -1.27 116.97 117.86 2qfl h TYR 194 Ca 0.42 -0.12 0.04 0.00 2.00 0.00 0.00 58.73 61.07 2qfl h TYR 194 Cb 0.38 -0.03 -0.04 0.00 1.00 0.00 0.00 36.73 38.04 2qfl h TYR 194 CO -0.00 0.88 -0.05 0.28 -0.00 0.00 0.00 178.16 179.27 2qfl h VAL 195 N 0.11 0.80 -0.88 -2.88 2.07 -0.66 0.17 116.25 114.99 2qfl h VAL 195 Ca -0.03 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.54 2qfl h VAL 195 Cb 1.37 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 31.89 2qfl h VAL 195 CO 0.12 0.00 0.57 0.00 0.02 0.00 0.00 177.57 178.28 2qfl h ALA 196 N 1.17 1.50 -0.34 1.67 0.00 -0.54 -1.86 119.26 120.85 2qfl h ALA 196 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2qfl h ALA 196 Cb 0.14 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2qfl h ALA 196 CO -0.19 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.45 2qfl n ALA 197 N -2.40 2.46 -0.73 0.00 0.00 -0.55 -3.47 120.51 115.82 2qfl n ALA 197 Ca 0.12 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.86 2qfl n ALA 197 Cb 0.15 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.61 2qfl n ALA 197 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qfl n GLY 198 N 1.20 0.27 0.27 0.00 0.00 -0.31 -4.84 105.19 101.78 2qfl n GLY 198 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 2qfl n GLY 198 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qfl h ARG 199 N 0.78 0.00 -5.22 1.61 3.08 -0.99 -3.42 114.38 110.22 2qfl h ARG 199 Ca 0.00 0.00 -0.40 0.00 0.07 0.00 0.00 59.98 59.65 2qfl h ARG 199 Cb 0.16 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.06 2qfl h ARG 199 CO 0.00 0.06 -0.68 0.14 -1.07 0.00 0.00 179.97 178.43 2qfl s VAL 200 N -4.62 1.26 -0.41 2.04 -7.23 -1.04 -4.99 120.40 105.41 2qfl s VAL 200 Ca -0.04 -2.07 0.22 0.00 -1.81 0.00 0.00 61.98 58.28 2qfl s VAL 200 Cb 0.15 -2.25 -0.16 0.00 0.56 0.00 0.00 36.38 34.67 2qfl s VAL 200 CO 0.61 -0.42 0.87 0.47 -0.31 0.00 0.00 175.10 176.32 2qfl n ASP 201 N -0.41 0.52 -3.59 4.85 8.00 0.49 -4.35 116.55 122.05 2qfl n ASP 201 Ca -0.06 -0.11 -0.01 0.00 0.71 0.00 0.00 54.79 55.32 2qfl n ASP 201 Cb 0.63 1.08 0.01 0.00 -0.02 0.00 0.00 41.12 42.81 2qfl n ASP 201 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2qfl s GLY 202 N -3.98 -0.11 -0.14 0.44 0.00 -1.18 -4.41 107.32 97.94 2qfl s GLY 202 Ca 0.00 0.04 -0.12 0.00 0.00 0.00 0.00 44.72 44.64 2qfl s GLY 202 CO 0.83 2.44 0.36 -0.12 0.00 0.00 0.00 173.10 176.61 2qfl s PHE 203 N -2.34 -0.41 -0.17 1.90 5.36 -0.62 -0.26 117.98 121.44 2qfl s PHE 203 Ca 0.21 0.99 -0.08 0.00 -0.96 0.00 0.00 56.93 57.09 2qfl s PHE 203 Cb -0.00 0.14 0.07 0.00 -0.34 0.00 0.00 43.02 42.88 2qfl s PHE 203 CO 0.01 -0.20 0.39 -0.59 -1.46 0.00 0.00 175.22 173.37 2qfl s PHE 204 N 0.27 -0.61 0.06 10.12 -0.12 -1.01 -0.90 117.98 125.79 2qfl s PHE 204 Ca -0.01 1.28 -0.12 0.00 -0.05 0.00 0.00 56.93 58.03 2qfl s PHE 204 Cb -0.03 0.24 0.01 0.00 -0.63 0.00 0.00 43.02 42.61 2qfl s PHE 204 CO -0.00 -0.37 0.27 -2.00 -0.05 0.00 0.00 175.22 173.07 2qfl s GLU 205 N 1.74 0.83 -0.14 1.99 2.12 -0.09 -4.10 118.70 121.05 2qfl s GLU 205 Ca -0.07 -0.64 -0.08 0.00 0.36 0.00 0.00 54.97 54.55 2qfl s GLU 205 Cb -0.10 0.35 -0.04 0.00 0.26 0.00 0.00 34.13 34.60 2qfl s GLU 205 CO -0.12 -0.27 0.13 0.42 -0.54 0.00 0.00 175.26 174.88 2qfl s ILE 206 N -2.96 5.45 -0.05 -3.70 1.01 -1.26 -0.40 121.20 119.29 2qfl s ILE 206 Ca -0.02 0.19 -0.00 0.00 0.00 0.00 0.00 60.65 60.82 2qfl s ILE 206 Cb 0.01 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 39.08 2qfl s ILE 206 CO -0.06 0.57 0.00 0.61 0.00 0.00 0.00 174.94 176.07 2qfl n GLY 207 N 2.39 0.41 3.79 6.18 0.00 -0.47 -4.90 105.19 112.60 2qfl n GLY 207 Ca -0.19 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 2qfl n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qfl s LEU 208 N -0.28 3.70 0.21 0.99 1.43 0.34 -4.95 118.68 120.11 2qfl s LEU 208 Ca 0.00 1.96 -0.12 0.00 -1.03 0.00 0.00 54.13 54.94 2qfl s LEU 208 Cb -0.00 -4.56 -0.07 0.00 0.03 0.00 0.00 46.19 41.59 2qfl s LEU 208 CO 0.00 -1.04 0.57 -0.13 0.23 0.00 0.00 176.35 175.99 2qfl s ARG 209 N -3.53 3.90 0.54 1.70 3.00 -1.26 -4.18 118.95 119.11 2qfl s ARG 209 Ca 0.67 0.41 0.20 0.00 0.00 0.00 0.00 55.73 57.02 2qfl s ARG 209 Cb -0.18 -2.74 1.42 0.00 0.00 0.00 0.00 34.95 33.45 2qfl s ARG 209 CO 0.27 0.36 2.17 -1.35 0.00 0.00 0.00 175.30 176.76 2qfl h PRO 210 N 2.92 0.00 0.00 3.54 0.11 -1.96 -0.93 132.00 135.68 2qfl h PRO 210 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2qfl h PRO 210 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2qfl h PRO 210 CO 0.67 0.02 -0.08 0.11 -0.21 0.00 0.00 178.00 178.51 2qfl h TRP 211 N 0.00 0.00 0.00 0.65 0.09 -1.92 -0.91 115.95 113.86 2qfl h TRP 211 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 2qfl h TRP 211 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.27 2qfl h TRP 211 CO 0.00 0.08 -0.66 -0.44 0.09 0.00 0.00 178.44 177.51 2qfl h ASP 212 N 0.00 0.00 -0.00 0.11 3.32 -1.54 -3.35 116.42 114.96 2qfl h ASP 212 Ca -0.00 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2qfl h ASP 212 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 2qfl h ASP 212 CO 0.01 0.02 -0.24 2.22 -1.72 0.00 0.00 179.24 179.53 2qfl n PHE 213 N -2.66 0.00 -0.28 4.55 -1.74 -1.12 -3.66 117.46 112.55 2qfl n PHE 213 Ca 0.02 0.00 -0.03 0.00 -0.56 0.00 0.00 57.45 56.87 2qfl n PHE 213 Cb 0.52 0.00 0.08 0.00 1.52 0.00 0.00 39.48 41.60 2qfl n PHE 213 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2qfl h ALA 214 N 0.71 0.99 0.01 1.98 0.00 -1.34 0.28 119.26 121.89 2qfl h ALA 214 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2qfl h ALA 214 Cb 0.12 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2qfl h ALA 214 CO 0.00 0.33 -0.08 0.00 0.00 0.00 0.00 179.25 179.50 2qfl h ALA 215 N 1.30 0.00 -0.99 0.00 0.00 -1.85 -3.35 119.26 114.38 2qfl h ALA 215 Ca 0.29 -0.46 0.17 0.00 0.00 0.00 0.00 54.91 54.92 2qfl h ALA 215 Cb -0.05 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.65 2qfl h ALA 215 CO -0.09 -0.01 0.60 0.78 0.00 0.00 0.00 179.25 180.53 2qfl h GLY 216 N -0.79 1.72 1.45 0.00 0.00 -1.74 -2.00 103.07 101.70 2qfl h GLY 216 Ca -0.01 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 46.87 2qfl h GLY 216 CO 0.02 -0.01 -0.14 -2.09 0.00 0.00 0.00 176.54 174.31 2qfl h GLU 217 N 0.80 0.65 -0.09 4.80 4.22 -0.58 -2.51 114.58 121.88 2qfl h GLU 217 Ca 0.55 -0.22 -0.24 0.00 0.08 0.00 0.00 59.36 59.54 2qfl h GLU 217 Cb 0.78 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.99 2qfl h GLU 217 CO -0.36 0.77 -0.88 1.25 -2.18 0.00 0.00 179.01 177.62 2qfl h LEU 218 N 0.59 0.88 -0.72 1.64 5.85 -1.52 -2.36 115.31 119.67 2qfl h LEU 218 Ca 0.10 -0.63 0.14 0.00 0.84 0.00 0.00 57.88 58.34 2qfl h LEU 218 Cb 0.58 -0.26 -0.14 0.00 0.37 0.00 0.00 40.66 41.21 2qfl h LEU 218 CO 0.04 1.42 -0.20 -0.07 -0.34 0.00 0.00 178.44 179.29 2qfl h LEU 219 N 0.46 -0.73 -0.23 2.25 3.38 -1.07 -0.34 115.31 119.02 2qfl h LEU 219 Ca -0.08 0.22 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 2qfl h LEU 219 Cb 1.51 0.47 -0.01 0.00 0.09 0.00 0.00 40.66 42.72 2qfl h LEU 219 CO 0.17 -0.25 0.08 0.58 0.09 0.00 0.00 178.44 179.12 2qfl h VAL 220 N -0.02 1.18 0.00 1.22 2.07 -1.34 -2.26 116.25 117.10 2qfl h VAL 220 Ca 0.34 -0.55 -0.08 0.00 0.82 0.00 0.00 66.70 67.23 2qfl h VAL 220 Cb 0.54 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 2qfl h VAL 220 CO -0.75 0.18 -0.37 0.03 0.02 0.00 0.00 177.57 176.68 2qfl h ARG 221 N 0.22 0.00 0.00 1.57 3.08 -1.10 0.13 114.38 118.27 2qfl h ARG 221 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2qfl h ARG 221 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2qfl h ARG 221 CO -0.00 0.37 -0.41 0.39 -1.07 0.00 0.00 179.97 179.24 2qfl n GLU 222 N -3.82 0.07 -0.93 0.04 -0.58 -0.17 -3.37 120.64 111.89 2qfl n GLU 222 Ca -0.01 0.03 -0.08 0.00 -0.42 0.00 0.00 57.16 56.67 2qfl n GLU 222 Cb 0.44 -1.55 0.23 0.00 -0.57 0.00 0.00 31.44 29.99 2qfl n GLU 222 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qfl n ALA 223 N -1.58 4.55 -1.04 0.62 0.00 -0.86 -3.05 120.51 119.16 2qfl n ALA 223 Ca 0.05 -2.75 -0.01 0.00 0.00 0.00 0.00 53.44 50.73 2qfl n ALA 223 Cb 0.36 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 2qfl n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qfl n GLY 224 N -0.79 0.50 0.44 0.00 0.00 -1.12 -1.09 105.19 103.13 2qfl n GLY 224 Ca 0.41 -0.65 -0.02 0.00 0.00 0.00 0.00 46.02 45.75 2qfl n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qfl n GLY 225 N -2.72 2.36 3.11 -0.02 0.00 0.40 -4.72 105.19 103.59 2qfl n GLY 225 Ca -0.01 -2.16 -0.10 0.00 0.00 0.00 0.00 46.02 43.75 2qfl n GLY 225 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qfl s ILE 226 N 0.24 0.47 -0.01 -0.61 -4.36 0.15 -4.12 121.20 112.96 2qfl s ILE 226 Ca 0.06 -1.64 0.04 0.00 -0.26 0.00 0.00 60.65 58.85 2qfl s ILE 226 Cb -0.00 -1.30 -0.01 0.00 1.25 0.00 0.00 42.46 42.40 2qfl s ILE 226 CO 0.04 -0.78 -0.15 0.68 0.24 0.00 0.00 174.94 174.97 2qfl s VAL 227 N -3.08 1.17 0.23 8.37 -7.23 -1.26 -2.39 120.40 116.20 2qfl s VAL 227 Ca 0.04 -0.63 -0.01 0.00 -1.81 0.00 0.00 61.98 59.57 2qfl s VAL 227 Cb 0.02 -0.97 -0.03 0.00 0.56 0.00 0.00 36.38 35.95 2qfl s VAL 227 CO -0.05 0.33 0.20 -0.94 -0.31 0.00 0.00 175.10 174.33 2qfl s SER 228 N -0.32 0.39 0.84 4.85 1.04 -0.16 -4.91 113.70 115.43 2qfl s SER 228 Ca 0.05 -1.41 -0.11 0.00 0.48 0.00 0.00 55.95 54.97 2qfl s SER 228 Cb -0.06 0.44 0.10 0.00 0.10 0.00 0.00 66.02 66.60 2qfl s SER 228 CO -0.00 -0.92 1.10 -0.62 0.98 0.00 0.00 173.24 173.78 2qfl s ASP 229 N -3.18 3.83 0.59 7.02 -1.08 0.10 -1.49 116.67 122.45 2qfl s ASP 229 Ca 0.37 1.81 0.32 0.00 -0.52 0.00 0.00 52.55 54.54 2qfl s ASP 229 Cb 0.05 -2.45 1.82 0.00 -1.46 0.00 0.00 42.92 40.89 2qfl s ASP 229 CO 0.14 -2.47 2.22 -0.26 0.52 0.00 0.00 175.17 175.33 2qfl h PHE 230 N -1.43 0.00 -0.63 -5.34 0.05 -1.90 -2.11 116.94 105.58 2qfl h PHE 230 Ca -0.45 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.34 2qfl h PHE 230 Cb 1.25 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.20 2qfl h PHE 230 CO 0.52 0.03 0.00 0.25 -0.18 0.00 0.00 178.31 178.93 2qfl n THR 231 N -3.61 1.22 0.00 -1.55 -2.24 -1.26 -4.73 114.28 102.11 2qfl n THR 231 Ca -0.03 -0.96 0.00 0.00 -2.27 0.00 0.00 64.05 60.79 2qfl n THR 231 Cb 0.13 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 2qfl n THR 231 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qfl n GLY 232 N 1.34 1.18 3.94 3.38 0.00 -0.79 -5.07 105.19 109.17 2qfl n GLY 232 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 2qfl n GLY 232 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qfl s GLY 233 N -2.15 1.77 -0.21 -0.02 0.00 -1.26 -4.60 107.32 100.85 2qfl s GLY 233 Ca 0.00 -1.25 0.11 0.00 0.00 0.00 0.00 44.72 43.58 2qfl s GLY 233 CO 0.00 -0.53 1.55 1.57 0.00 0.00 0.00 173.10 175.69 2qfl n HIS 234 N -3.59 1.79 1.74 1.90 -0.00 -1.26 -0.72 115.22 115.07 2qfl n HIS 234 Ca 0.15 -0.67 0.00 0.00 0.46 0.00 0.00 57.72 57.66 2qfl n HIS 234 Cb 0.60 -0.47 0.01 0.00 -0.12 0.00 0.00 29.99 30.00 2qfl n HIS 234 CO 0.00 0.00 0.00 -1.71 0.46 0.00 0.00 176.34 175.09 2qfl n ASN 235 N 0.42 0.29 0.17 0.26 5.15 -1.26 -4.48 115.26 115.82 2qfl n ASN 235 Ca 0.25 -2.00 0.05 0.00 -0.60 0.00 0.00 54.58 52.27 2qfl n ASN 235 Cb 1.07 -0.12 0.20 0.00 -0.53 0.00 0.00 39.78 40.40 2qfl n ASN 235 CO 0.00 0.00 0.00 0.10 1.40 0.00 0.00 177.26 178.76 2qfl h TYR 236 N 0.08 0.00 -0.47 1.20 -0.00 -1.84 -2.91 116.97 113.02 2qfl h TYR 236 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 58.73 58.76 2qfl h TYR 236 Cb 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 36.82 2qfl h TYR 236 CO 0.01 0.42 0.25 1.98 -0.00 0.00 0.00 178.16 180.82 2qfl h MET 237 N 0.00 0.49 -0.34 0.10 4.05 -1.93 2.23 114.93 119.53 2qfl h MET 237 Ca -0.00 -0.03 -0.05 0.00 -0.28 0.00 0.00 59.70 59.33 2qfl h MET 237 Cb 1.13 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.80 2qfl h MET 237 CO 0.05 0.32 0.01 -0.07 0.23 0.00 0.00 176.91 177.46 2qfl h LEU 238 N 0.50 0.58 0.12 3.39 3.38 -1.89 -3.35 115.31 118.05 2qfl h LEU 238 Ca 0.20 -0.30 -0.18 0.00 0.09 0.00 0.00 57.88 57.69 2qfl h LEU 238 Cb 0.08 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 40.68 2qfl h LEU 238 CO -0.12 0.74 -0.83 0.71 0.09 0.00 0.00 178.44 179.03 2qfl h THR 239 N 0.41 1.46 0.00 0.22 1.35 -1.28 -3.48 112.91 111.59 2qfl h THR 239 Ca 0.10 -2.49 0.00 0.00 -0.55 0.00 0.00 66.41 63.47 2qfl h THR 239 Cb 0.44 3.13 0.00 0.00 -1.73 0.00 0.00 68.15 69.99 2qfl h THR 239 CO 0.02 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.59 2qfl n GLY 240 N 1.67 0.45 3.40 5.82 0.00 0.75 -4.25 105.19 113.04 2qfl n GLY 240 Ca -0.15 -0.54 -0.44 0.00 0.00 0.00 0.00 46.02 44.88 2qfl n GLY 240 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qfl s ASN 241 N -2.49 6.17 -0.07 1.61 0.01 -1.25 0.13 114.94 119.04 2qfl s ASN 241 Ca 0.00 -1.21 0.04 0.00 -0.71 0.00 0.00 52.86 50.98 2qfl s ASN 241 Cb 0.00 -2.21 0.00 0.00 0.41 0.00 0.00 41.25 39.45 2qfl s ASN 241 CO 0.00 -0.71 -0.19 -0.63 -1.51 0.00 0.00 177.10 174.06 2qfl s ILE 242 N 1.92 1.62 -0.08 0.60 -1.09 0.47 -3.65 121.20 120.98 2qfl s ILE 242 Ca 0.07 -0.79 0.02 0.00 -2.23 0.00 0.00 60.65 57.73 2qfl s ILE 242 Cb -0.23 -1.41 0.01 0.00 -1.58 0.00 0.00 42.46 39.26 2qfl s ILE 242 CO 0.08 0.46 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.41 2qfl s VAL 243 N 0.26 1.40 0.06 2.92 1.01 -0.56 -0.91 120.40 124.58 2qfl s VAL 243 Ca -0.11 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.26 2qfl s VAL 243 Cb -0.15 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 2qfl s VAL 243 CO 0.05 0.42 -0.05 0.00 0.00 0.00 0.00 175.10 175.51 2qfl s ALA 244 N 0.73 0.60 0.00 5.51 0.00 -0.08 -0.99 121.76 127.53 2qfl s ALA 244 Ca -0.13 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.78 2qfl s ALA 244 Cb -0.16 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.13 2qfl s ALA 244 CO 0.03 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2qfl n GLY 245 N 0.60 1.28 3.66 0.00 0.00 -1.01 -1.58 105.19 108.14 2qfl n GLY 245 Ca -0.17 -1.94 -0.30 0.00 0.00 0.00 0.00 46.02 43.61 2qfl n GLY 245 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qfl s ASN 246 N 0.00 2.86 0.38 1.61 2.20 -1.26 -0.67 114.94 120.07 2qfl s ASN 246 Ca 0.00 1.96 0.13 0.00 -0.94 0.00 0.00 52.86 54.01 2qfl s ASN 246 Cb 0.00 -2.48 0.94 0.00 -2.00 0.00 0.00 41.25 37.71 2qfl s ASN 246 CO 0.00 -3.10 1.86 -0.65 -2.94 0.00 0.00 177.10 172.27 2qfl h PRO 247 N -1.87 0.54 0.21 3.55 0.11 -1.92 -0.94 132.00 131.68 2qfl h PRO 247 Ca -0.47 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2qfl h PRO 247 Cb 1.28 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2qfl h PRO 247 CO 0.46 0.35 -0.10 0.00 -0.21 0.00 0.00 178.00 178.50 2qfl h ARG 248 N 0.55 -0.27 -0.59 1.05 3.08 -1.90 -2.09 114.38 114.21 2qfl h ARG 248 Ca 0.46 0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.57 2qfl h ARG 248 Cb 0.92 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.99 2qfl h ARG 248 CO -0.20 0.08 0.33 0.28 -1.07 0.00 0.00 179.97 179.40 2qfl h VAL 249 N -0.68 1.00 -0.13 2.04 2.07 -1.71 0.10 116.25 118.94 2qfl h VAL 249 Ca -0.03 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 2qfl h VAL 249 Cb 0.48 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 2qfl h VAL 249 CO 0.05 0.12 0.00 0.58 0.02 0.00 0.00 177.57 178.33 2qfl h VAL 250 N 0.64 1.25 -0.49 2.57 2.07 -1.29 0.12 116.25 121.12 2qfl h VAL 250 Ca 0.25 -0.82 0.08 0.00 0.82 0.00 0.00 66.70 67.03 2qfl h VAL 250 Cb 0.10 1.53 -0.07 0.00 -1.52 0.00 0.00 31.29 31.34 2qfl h VAL 250 CO -0.14 0.24 0.09 0.50 0.02 0.00 0.00 177.57 178.28 2qfl h LYS 251 N -0.03 0.21 -0.68 1.57 3.64 -1.15 0.68 116.57 120.82 2qfl h LYS 251 Ca 0.04 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2qfl h LYS 251 Cb 0.36 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 2qfl h LYS 251 CO 0.01 0.14 0.31 0.00 -2.27 0.00 0.00 179.45 177.64 2qfl h ALA 252 N 1.38 1.27 -0.19 5.00 0.00 -0.58 0.32 119.26 126.47 2qfl h ALA 252 Ca 0.24 -0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.81 2qfl h ALA 252 Cb 0.33 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.85 2qfl h ALA 252 CO -0.33 0.56 -0.65 0.52 0.00 0.00 0.00 179.25 179.35 2qfl h MET 253 N 0.97 0.77 -0.68 0.00 2.86 0.24 -3.16 114.93 115.92 2qfl h MET 253 Ca 0.23 -0.58 -0.07 0.00 -2.06 0.00 0.00 59.70 57.23 2qfl h MET 253 Cb 0.12 0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 2qfl h MET 253 CO -0.03 1.19 0.16 -0.07 1.06 0.00 0.00 176.91 179.22 2qfl h LEU 254 N 0.50 1.02 -0.83 1.22 3.38 0.58 -2.09 115.31 119.08 2qfl h LEU 254 Ca -0.03 -0.21 0.16 0.00 0.09 0.00 0.00 57.88 57.89 2qfl h LEU 254 Cb 1.27 -0.27 -0.15 0.00 0.09 0.00 0.00 40.66 41.60 2qfl h LEU 254 CO 0.14 0.98 -0.25 0.00 0.09 0.00 0.00 178.44 179.40 2qfl h ALA 255 N 1.14 0.43 0.00 1.53 0.00 -0.95 -0.40 119.26 121.01 2qfl h ALA 255 Ca 0.21 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.43 2qfl h ALA 255 Cb 0.37 0.71 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2qfl h ALA 255 CO 0.00 -0.46 0.00 0.09 0.00 0.00 0.00 179.25 178.88 2qfl n ASN 256 N -5.52 0.00 -0.02 0.00 4.13 -0.80 -3.60 115.26 109.45 2qfl n ASN 256 Ca 0.11 -0.64 0.03 0.00 1.68 0.00 0.00 54.58 55.76 2qfl n ASN 256 Cb 0.42 -0.01 -0.09 0.00 -1.54 0.00 0.00 39.78 38.56 2qfl n ASN 256 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 2qfl n MET 257 N -1.01 0.78 -0.18 3.52 2.81 -0.18 -4.68 117.12 118.19 2qfl n MET 257 Ca 0.16 -0.08 -0.06 0.00 -1.81 0.00 0.00 57.70 55.90 2qfl n MET 257 Cb 0.07 -1.27 -0.01 0.00 -0.71 0.00 0.00 33.22 31.31 2qfl n MET 257 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qfl h ARG 258 N 0.00 -0.20 -0.18 0.03 3.08 -1.56 -2.03 114.38 113.53 2qfl h ARG 258 Ca -0.06 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2qfl h ARG 258 Cb 0.77 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.86 2qfl h ARG 258 CO 0.00 -0.13 0.00 -0.25 -1.07 0.00 0.00 179.97 178.52 2qfl n ASP 259 N -5.43 0.18 -4.74 7.04 10.43 -1.26 -4.73 116.55 118.05 2qfl n ASP 259 Ca 0.03 -1.52 -0.31 0.00 2.57 0.00 0.00 54.79 55.55 2qfl n ASP 259 Cb 0.35 -0.09 -0.08 0.00 1.84 0.00 0.00 41.12 43.14 2qfl n ASP 259 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 2qfl s GLU 260 N -1.76 2.15 0.00 -1.24 0.41 -0.76 -5.13 118.70 112.36 2qfl s GLU 260 Ca 0.00 -2.28 0.00 0.00 -0.41 0.00 0.00 54.97 52.28 2qfl s GLU 260 Cb 0.00 -1.63 0.00 0.00 -1.78 0.00 0.00 34.13 30.72 2qfl s GLU 260 CO 0.00 -0.30 0.00 1.28 -0.49 0.00 0.00 175.26 175.75 2qfl n LEU 261 N -1.24 0.00 0.00 1.80 4.77 -1.26 -5.07 117.00 116.00 2qfl n LEU 261 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 2qfl n LEU 261 Cb 0.67 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.76 2qfl n LEU 261 CO 0.41 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.93