#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dnp n GLN 4 N 0.00 3.99 -4.16 1.97 6.02 -0.02 -4.90 117.38 120.28 3dnp n GLN 4 Ca 0.00 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.81 3dnp n GLN 4 Cb 0.00 -0.40 -0.15 0.00 1.02 0.00 0.00 30.24 30.71 3dnp n GLN 4 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3dnp s LEU 5 N -1.35 1.70 -0.21 1.08 0.20 -0.94 -1.29 118.68 117.87 3dnp s LEU 5 Ca 0.00 -0.11 -0.00 0.00 0.69 0.00 0.00 54.13 54.71 3dnp s LEU 5 Cb 0.00 -0.34 0.02 0.00 -0.43 0.00 0.00 46.19 45.43 3dnp s LEU 5 CO 0.00 0.01 -0.14 -0.22 -0.29 0.00 0.00 176.35 175.72 3dnp s LEU 6 N 0.32 2.56 -0.17 -0.68 2.96 0.50 -0.53 118.68 123.64 3dnp s LEU 6 Ca -0.04 -0.67 -0.01 0.00 -0.22 0.00 0.00 54.13 53.19 3dnp s LEU 6 Cb -0.08 -1.57 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 3dnp s LEU 6 CO -0.00 -0.04 -0.11 0.00 -1.32 0.00 0.00 176.35 174.88 3dnp s ALA 7 N 1.33 2.65 -0.04 5.97 0.00 0.29 -1.05 121.76 130.91 3dnp s ALA 7 Ca 0.04 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 51.03 3dnp s ALA 7 Cb -0.14 -1.39 -0.01 0.00 0.00 0.00 0.00 23.12 21.58 3dnp s ALA 7 CO -0.09 -0.07 -0.24 -0.51 0.00 0.00 0.00 175.76 174.85 3dnp s LEU 8 N 0.87 2.04 0.75 0.00 1.02 -0.76 -0.99 118.68 121.61 3dnp s LEU 8 Ca -0.03 -0.47 -0.14 0.00 0.02 0.00 0.00 54.13 53.51 3dnp s LEU 8 Cb -0.15 -1.28 0.05 0.00 0.02 0.00 0.00 46.19 44.83 3dnp s LEU 8 CO 0.00 0.25 1.17 0.20 0.02 0.00 0.00 176.35 178.00 3dnp s ASN 9 N -0.28 4.19 0.00 2.29 0.02 -0.88 -0.97 114.94 119.30 3dnp s ASN 9 Ca 0.01 2.22 0.00 0.00 -1.02 0.00 0.00 52.86 54.07 3dnp s ASN 9 Cb -0.12 -2.57 0.00 0.00 0.02 0.00 0.00 41.25 38.58 3dnp s ASN 9 CO 0.02 -2.26 0.00 -0.38 0.02 0.00 0.00 177.10 174.50 3dnp n ILE 10 N -2.96 0.00 -1.93 0.60 5.41 -1.26 -2.46 119.36 116.76 3dnp n ILE 10 Ca 0.12 0.44 -0.41 0.00 1.00 0.00 0.00 62.75 63.90 3dnp n ILE 10 Cb 0.51 -1.36 -0.01 0.00 -0.71 0.00 0.00 39.64 38.07 3dnp n ILE 10 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 3dnp s ASP 11 N -3.10 6.53 0.00 4.38 1.01 -1.26 -1.51 116.67 122.73 3dnp s ASP 11 Ca 0.00 2.85 0.00 0.00 0.71 0.00 0.00 52.55 56.11 3dnp s ASP 11 Cb 0.00 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.28 3dnp s ASP 11 CO 0.00 -0.75 0.00 0.61 0.21 0.00 0.00 175.17 175.24 3dnp n GLY 12 N 1.21 0.51 0.92 0.21 0.00 -1.26 -4.73 105.19 102.06 3dnp n GLY 12 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3dnp n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dnp n ALA 13 N 1.00 2.45 -0.13 4.61 0.00 -1.06 -4.48 120.51 122.89 3dnp n ALA 13 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3dnp n ALA 13 Cb 0.06 0.00 0.22 0.00 0.00 0.00 0.00 19.45 19.73 3dnp n ALA 13 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3dnp h LEU 14 N 0.00 0.75 -9.56 0.00 3.38 -1.11 -3.42 115.31 105.35 3dnp h LEU 14 Ca 0.00 -0.11 -0.66 0.00 0.09 0.00 0.00 57.88 57.20 3dnp h LEU 14 Cb 0.00 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 40.47 3dnp h LEU 14 CO 0.00 0.70 -0.49 -0.76 0.09 0.00 0.00 178.44 177.97 3dnp s LEU 15 N -9.43 4.30 1.07 1.67 1.43 -0.57 -4.57 118.68 112.58 3dnp s LEU 15 Ca -0.10 0.41 -0.12 0.00 -1.03 0.00 0.00 54.13 53.29 3dnp s LEU 15 Cb 0.16 -2.05 0.23 0.00 0.03 0.00 0.00 46.19 44.56 3dnp s LEU 15 CO 0.79 0.38 1.06 -0.13 0.23 0.00 0.00 176.35 178.68 3dnp s ARG 16 N -0.85 -0.16 0.54 1.70 0.52 -0.23 -4.03 118.95 116.45 3dnp s ARG 16 Ca 0.14 0.84 0.35 0.00 -0.52 0.00 0.00 55.73 56.54 3dnp s ARG 16 Cb -0.12 -1.64 1.61 0.00 0.52 0.00 0.00 34.95 35.31 3dnp s ARG 16 CO 0.03 -3.21 2.05 0.77 0.02 0.00 0.00 175.30 174.96 3dnp h SER 17 N -2.25 0.00 -0.20 0.23 0.02 -1.88 -0.41 113.55 109.05 3dnp h SER 17 Ca -0.57 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.38 3dnp h SER 17 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 3dnp h SER 17 CO 0.52 0.00 0.00 -0.46 -1.14 0.00 0.00 176.83 175.75 3dnp n ASN 18 N -2.97 1.70 0.00 3.07 0.23 -1.26 -4.93 115.26 111.09 3dnp n ASN 18 Ca -0.00 -1.76 0.00 0.00 -0.53 0.00 0.00 54.58 52.29 3dnp n ASN 18 Cb 0.23 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 37.80 3dnp n ASN 18 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3dnp n GLY 19 N 1.12 1.02 3.82 4.83 0.00 -0.16 -5.04 105.19 110.77 3dnp n GLY 19 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 3dnp n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dnp s LYS 20 N -0.36 4.24 -0.31 1.61 1.02 -1.26 -4.75 119.74 119.93 3dnp s LYS 20 Ca 0.00 1.02 -0.16 0.00 0.02 0.00 0.00 55.97 56.86 3dnp s LYS 20 Cb 0.00 -2.42 -0.02 0.00 -0.52 0.00 0.00 37.83 34.87 3dnp s LYS 20 CO 0.00 0.11 0.39 0.42 -0.92 0.00 0.00 175.35 175.36 3dnp s ILE 21 N -1.97 5.14 0.43 2.17 1.01 -1.26 -1.06 121.20 125.66 3dnp s ILE 21 Ca 0.56 0.32 -0.25 0.00 0.00 0.00 0.00 60.65 61.28 3dnp s ILE 21 Cb -0.12 -3.79 -0.08 0.00 0.01 0.00 0.00 42.46 38.48 3dnp s ILE 21 CO 0.17 -0.01 1.29 -2.28 0.00 0.00 0.00 174.94 174.10 3dnp s HIS 22 N 2.11 2.77 0.36 3.97 5.65 -1.26 -4.90 115.29 123.98 3dnp s HIS 22 Ca 0.14 1.43 0.10 0.00 0.25 0.00 0.00 55.06 56.98 3dnp s HIS 22 Cb -0.16 -3.63 0.85 0.00 -1.18 0.00 0.00 32.58 28.46 3dnp s HIS 22 CO 0.11 -2.08 1.86 0.37 -0.65 0.00 0.00 174.74 174.35 3dnp h GLN 23 N 2.43 0.63 -0.26 2.88 5.75 -2.00 -1.18 115.11 123.36 3dnp h GLN 23 Ca -0.50 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 57.96 3dnp h GLN 23 Cb 1.25 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.65 3dnp h GLN 23 CO 0.62 0.42 0.13 0.00 -2.65 0.00 0.00 178.83 177.34 3dnp h ALA 24 N 1.60 1.73 -0.17 3.38 0.00 -1.99 0.05 119.26 123.87 3dnp h ALA 24 Ca 0.47 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.22 3dnp h ALA 24 Cb 0.81 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 3dnp h ALA 24 CO -0.22 0.23 -0.25 1.15 0.00 0.00 0.00 179.25 180.16 3dnp h THR 25 N 0.36 1.35 -0.45 0.00 2.02 -1.59 0.22 112.91 114.83 3dnp h THR 25 Ca 0.09 -1.47 0.03 0.00 0.77 0.00 0.00 66.41 65.84 3dnp h THR 25 Cb 0.04 1.89 -0.04 0.00 -1.74 0.00 0.00 68.15 68.31 3dnp h THR 25 CO -0.01 0.44 0.24 0.11 0.37 0.00 0.00 175.52 176.67 3dnp h LYS 26 N 0.11 0.46 -0.65 6.66 1.57 -1.11 -0.82 116.57 122.80 3dnp h LYS 26 Ca 0.02 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 3dnp h LYS 26 Cb 0.83 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.01 3dnp h LYS 26 CO 0.06 0.30 0.18 -0.44 -0.57 0.00 0.00 179.45 178.98 3dnp h ASP 27 N 0.47 0.96 -0.47 0.86 3.32 -0.88 -1.38 116.42 119.30 3dnp h ASP 27 Ca 0.19 -0.22 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 3dnp h ASP 27 Cb 0.07 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 3dnp h ASP 27 CO -0.12 0.93 0.16 0.00 -1.72 0.00 0.00 179.24 178.49 3dnp h ALA 28 N 1.07 0.62 -0.56 3.45 0.00 -0.66 -1.69 119.26 121.50 3dnp h ALA 28 Ca 0.21 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3dnp h ALA 28 Cb 0.33 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3dnp h ALA 28 CO -0.00 0.26 0.04 0.82 0.00 0.00 0.00 179.25 180.37 3dnp h ILE 29 N 0.63 1.26 -0.54 0.00 2.04 -0.96 -1.02 117.51 118.92 3dnp h ILE 29 Ca 0.15 -1.06 0.03 0.00 1.00 0.00 0.00 64.86 64.99 3dnp h ILE 29 Cb 0.25 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 3dnp h ILE 29 CO -0.01 0.38 0.31 -0.08 0.00 0.00 0.00 178.15 178.75 3dnp h GLU 30 N 0.84 0.59 -0.25 2.37 4.81 -1.16 -1.52 114.58 120.26 3dnp h GLU 30 Ca 0.16 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3dnp h GLU 30 Cb 0.49 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 3dnp h GLU 30 CO 0.02 0.39 0.14 -0.92 -0.73 0.00 0.00 179.01 177.91 3dnp h TYR 31 N 0.60 0.34 -0.32 0.92 3.20 -0.99 -1.45 116.97 119.28 3dnp h TYR 31 Ca 0.22 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.15 3dnp h TYR 31 Cb 0.07 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.17 3dnp h TYR 31 CO -0.07 0.29 -0.04 0.28 -1.64 0.00 0.00 178.16 176.98 3dnp h VAL 32 N 0.30 0.72 -0.91 1.81 2.07 -0.86 -1.50 116.25 117.87 3dnp h VAL 32 Ca 0.09 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 3dnp h VAL 32 Cb 0.06 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 3dnp h VAL 32 CO -0.01 0.01 0.55 0.11 0.02 0.00 0.00 177.57 178.24 3dnp h LYS 33 N 0.05 1.24 0.00 1.57 1.57 -1.19 -2.25 116.57 117.56 3dnp h LYS 33 Ca 0.16 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 3dnp h LYS 33 Cb 0.23 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3dnp h LYS 33 CO -0.29 0.87 -0.24 -0.22 -0.57 0.00 0.00 179.45 179.00 3dnp h LYS 34 N 1.26 0.00 -0.01 3.15 3.64 -0.56 -1.52 116.57 122.54 3dnp h LYS 34 Ca 0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 3dnp h LYS 34 Cb -0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3dnp h LYS 34 CO -0.06 0.24 0.00 1.63 -2.27 0.00 0.00 179.45 178.99 3dnp n LYS 35 N -4.19 1.17 -0.45 1.90 4.76 -0.63 -4.91 118.16 115.81 3dnp n LYS 35 Ca -0.02 -0.25 0.00 0.00 -2.87 0.00 0.00 58.31 55.17 3dnp n LYS 35 Cb 0.30 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 3dnp n LYS 35 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dnp n GLY 36 N 1.03 0.76 3.73 0.72 0.00 -0.57 -5.06 105.19 105.81 3dnp n GLY 36 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 3dnp n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dnp s ILE 37 N -2.26 4.79 -0.03 -0.61 1.01 -0.98 -5.00 121.20 118.13 3dnp s ILE 37 Ca 0.00 1.68 -0.30 0.00 0.00 0.00 0.00 60.65 62.03 3dnp s ILE 37 Cb 0.00 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.30 3dnp s ILE 37 CO 0.00 0.31 1.07 -0.47 0.00 0.00 0.00 174.94 175.85 3dnp s TYR 38 N 0.24 3.49 -0.17 3.97 5.04 -0.41 -4.14 117.35 125.37 3dnp s TYR 38 Ca 0.41 1.51 -0.01 0.00 -2.44 0.00 0.00 57.07 56.54 3dnp s TYR 38 Cb -0.20 -3.25 -0.01 0.00 0.35 0.00 0.00 41.96 38.86 3dnp s TYR 38 CO 0.23 -0.53 -0.12 0.08 -1.34 0.00 0.00 175.55 173.88 3dnp s VAL 39 N 1.53 2.93 0.26 3.14 1.01 -1.26 -0.37 120.40 127.64 3dnp s VAL 39 Ca 0.53 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.85 3dnp s VAL 39 Cb -0.22 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 33.84 3dnp s VAL 39 CO 0.24 0.49 0.10 0.28 0.00 0.00 0.00 175.10 176.22 3dnp s THR 40 N 0.90 0.50 -0.07 3.92 -1.32 -0.22 -4.73 115.64 114.62 3dnp s THR 40 Ca -0.03 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.45 3dnp s THR 40 Cb -0.15 -2.62 -0.03 0.00 -1.51 0.00 0.00 72.50 68.19 3dnp s THR 40 CO -0.00 0.00 -0.06 -0.76 -2.21 0.00 0.00 174.62 171.59 3dnp s LEU 41 N -3.30 3.24 -0.18 9.08 1.43 -1.26 -1.83 118.68 125.85 3dnp s LEU 41 Ca 0.38 0.00 -0.00 0.00 -1.03 0.00 0.00 54.13 53.48 3dnp s LEU 41 Cb 0.08 -1.71 0.05 0.00 0.03 0.00 0.00 46.19 44.63 3dnp s LEU 41 CO 0.14 0.36 -0.06 -0.69 0.23 0.00 0.00 176.35 176.32 3dnp s VAL 42 N -0.79 1.28 0.02 -1.59 1.01 -0.14 -0.78 120.40 119.41 3dnp s VAL 42 Ca 0.12 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.17 3dnp s VAL 42 Cb -0.11 -1.45 0.02 0.00 0.00 0.00 0.00 36.38 34.83 3dnp s VAL 42 CO 0.02 0.09 0.28 0.28 0.00 0.00 0.00 175.10 175.77 3dnp s THR 43 N 1.55 0.08 -0.82 3.92 -1.32 -0.14 -3.78 115.64 115.13 3dnp s THR 43 Ca -0.01 -0.64 0.26 0.00 -1.21 0.00 0.00 61.69 60.10 3dnp s THR 43 Cb -0.16 -0.79 0.26 0.00 -1.51 0.00 0.00 72.50 70.29 3dnp s THR 43 CO -0.08 -0.35 1.80 0.59 -2.21 0.00 0.00 174.62 174.37 3dnp n ASN 44 N 0.89 0.46 -4.73 8.08 3.02 -1.26 -1.55 115.26 120.17 3dnp n ASN 44 Ca -0.20 0.55 -0.33 0.00 -0.03 0.00 0.00 54.58 54.57 3dnp n ASN 44 Cb 0.58 -0.67 0.09 0.00 -0.61 0.00 0.00 39.78 39.16 3dnp n ASN 44 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3dnp s ARG 45 N -3.08 2.20 0.74 3.52 0.52 -1.26 -4.18 118.95 117.41 3dnp s ARG 45 Ca 0.11 1.63 -0.12 0.00 -0.52 0.00 0.00 55.73 56.82 3dnp s ARG 45 Cb 0.14 -1.85 0.04 0.00 0.52 0.00 0.00 34.95 33.80 3dnp s ARG 45 CO 0.53 -1.76 1.10 -3.38 0.02 0.00 0.00 175.30 171.81 3dnp s HIS 46 N -2.17 2.55 0.15 -0.53 -3.43 -1.26 -1.61 115.29 109.00 3dnp s HIS 46 Ca 0.71 1.56 -0.16 0.00 -0.80 0.00 0.00 55.06 56.37 3dnp s HIS 46 Cb -0.26 -3.10 0.05 0.00 -1.43 0.00 0.00 32.58 27.84 3dnp s HIS 46 CO 0.46 -1.81 1.76 0.35 -2.00 0.00 0.00 174.74 173.51 3dnp h PHE 47 N -0.75 0.28 -0.45 0.38 3.57 -1.89 -2.36 116.94 115.72 3dnp h PHE 47 Ca -0.45 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.12 3dnp h PHE 47 Cb 1.24 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.86 3dnp h PHE 47 CO 0.56 0.14 0.20 -0.09 -2.23 0.00 0.00 178.31 176.89 3dnp h ARG 48 N 0.33 0.39 -0.23 1.11 2.43 -1.92 0.19 114.38 116.67 3dnp h ARG 48 Ca 0.16 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3dnp h ARG 48 Cb 0.10 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 3dnp h ARG 48 CO -0.13 0.26 0.15 1.03 -1.51 0.00 0.00 179.97 179.76 3dnp h SER 49 N 0.40 0.27 -0.76 -3.80 0.87 -1.87 -1.75 113.55 106.90 3dnp h SER 49 Ca 0.20 -0.01 0.07 0.00 -1.23 0.00 0.00 61.79 60.81 3dnp h SER 49 Cb 0.15 -0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 61.98 3dnp h SER 49 CO -0.17 0.20 0.44 0.00 -0.53 0.00 0.00 176.83 176.77 3dnp h ALA 50 N 1.08 1.04 -0.42 6.23 0.00 -0.89 -2.49 119.26 123.80 3dnp h ALA 50 Ca 0.08 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 3dnp h ALA 50 Cb -0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3dnp h ALA 50 CO -0.02 0.14 -0.22 0.37 0.00 0.00 0.00 179.25 179.53 3dnp h GLN 51 N 0.80 0.84 -0.73 0.00 -0.00 -0.33 0.67 115.11 116.37 3dnp h GLN 51 Ca 0.34 -0.34 -0.05 0.00 -0.00 0.00 0.00 58.65 58.60 3dnp h GLN 51 Cb 0.21 -0.04 -0.03 0.00 0.00 0.00 0.00 27.48 27.62 3dnp h GLN 51 CO -0.19 0.98 0.26 0.87 0.00 0.00 0.00 178.83 180.75 3dnp h LYS 52 N 0.73 1.10 -0.11 1.69 1.79 -1.03 0.15 116.57 120.89 3dnp h LYS 52 Ca 0.10 -0.21 -0.01 0.00 -2.18 0.00 0.00 60.65 58.35 3dnp h LYS 52 Cb 0.75 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 31.22 3dnp h LYS 52 CO 0.06 0.91 0.03 0.82 -1.08 0.00 0.00 179.45 180.19 3dnp h ILE 53 N 1.06 1.18 -0.98 1.86 2.04 -1.15 -1.95 117.51 119.58 3dnp h ILE 53 Ca 0.24 -0.57 0.12 0.00 1.00 0.00 0.00 64.86 65.65 3dnp h ILE 53 Cb 0.24 1.35 -0.09 0.00 -0.74 0.00 0.00 36.82 37.59 3dnp h ILE 53 CO -0.02 0.17 0.61 0.00 0.00 0.00 0.00 178.15 178.91 3dnp h ALA 54 N 0.84 1.48 -0.78 1.87 0.00 -0.59 -1.68 119.26 120.41 3dnp h ALA 54 Ca 0.04 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3dnp h ALA 54 Cb 0.23 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3dnp h ALA 54 CO -0.00 0.19 0.44 -0.22 0.00 0.00 0.00 179.25 179.65 3dnp h LYS 55 N 0.95 1.08 0.00 0.00 3.64 -0.37 0.07 116.57 121.94 3dnp h LYS 55 Ca 0.49 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.69 3dnp h LYS 55 Cb 0.51 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 3dnp h LYS 55 CO -0.28 0.79 -0.28 0.66 -2.27 0.00 0.00 179.45 178.08 3dnp h SER 56 N 1.08 0.00 -0.15 4.20 4.64 -0.55 -1.88 113.55 120.89 3dnp h SER 56 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 3dnp h SER 56 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3dnp h SER 56 CO -0.05 0.28 0.00 0.18 -0.87 0.00 0.00 176.83 176.37 3dnp n LEU 57 N -4.08 2.16 -3.94 5.97 4.77 -0.84 -4.97 117.00 116.07 3dnp n LEU 57 Ca -0.02 -0.84 -0.29 0.00 -0.03 0.00 0.00 56.01 54.83 3dnp n LEU 57 Cb 0.34 -0.09 0.01 0.00 -2.33 0.00 0.00 43.42 41.35 3dnp n LEU 57 CO 0.37 0.42 -0.01 0.29 -1.33 0.00 0.00 177.39 177.13 3dnp n LYS 58 N 0.66 -4.61 -0.06 3.23 5.02 -0.12 -4.88 118.16 117.39 3dnp n LYS 58 Ca 0.17 0.53 -0.15 0.00 -2.02 0.00 0.00 58.31 56.84 3dnp n LYS 58 Cb 0.43 -5.20 -0.05 0.00 -0.02 0.00 0.00 35.03 30.18 3dnp n LYS 58 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3dnp h LEU 59 N -1.90 0.91 -3.70 -0.35 3.38 -1.48 -3.48 115.31 108.69 3dnp h LEU 59 Ca -0.60 -0.56 -0.59 0.00 0.09 0.00 0.00 57.88 56.22 3dnp h LEU 59 Cb 1.37 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.82 3dnp h LEU 59 CO 0.66 1.30 -0.98 0.47 0.09 0.00 0.00 178.44 179.98 3dnp n ASP 60 N -4.05 -3.29 -4.22 -0.43 8.00 -1.26 -4.91 116.55 106.39 3dnp n ASP 60 Ca -0.05 -1.28 -0.13 0.00 0.71 0.00 0.00 54.79 54.04 3dnp n ASP 60 Cb 0.63 -1.53 -0.10 0.00 -0.02 0.00 0.00 41.12 40.10 3dnp n ASP 60 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dnp s ALA 61 N -3.68 1.24 -0.09 2.24 0.00 -1.26 -5.09 121.76 115.12 3dnp s ALA 61 Ca 0.42 -1.50 -0.30 0.00 0.00 0.00 0.00 51.96 50.58 3dnp s ALA 61 Cb -0.23 0.36 -0.03 0.00 0.00 0.00 0.00 23.12 23.22 3dnp s ALA 61 CO 0.95 -0.27 1.37 0.15 0.00 0.00 0.00 175.76 177.96 3dnp s LYS 62 N -3.87 4.25 -0.07 0.00 1.02 -1.26 -4.41 119.74 115.39 3dnp s LYS 62 Ca 0.19 1.84 -0.04 0.00 0.02 0.00 0.00 55.97 57.98 3dnp s LYS 62 Cb 0.05 -3.74 -0.04 0.00 -0.52 0.00 0.00 37.83 33.59 3dnp s LYS 62 CO 0.01 -0.67 0.12 -0.51 -0.92 0.00 0.00 175.35 173.37 3dnp s LEU 63 N 3.19 4.17 -0.43 3.17 1.43 0.01 -4.60 118.68 125.63 3dnp s LEU 63 Ca 0.61 0.34 -0.13 0.00 -1.03 0.00 0.00 54.13 53.91 3dnp s LEU 63 Cb -0.27 -2.17 0.05 0.00 0.03 0.00 0.00 46.19 43.84 3dnp s LEU 63 CO 0.21 0.35 0.31 -0.63 0.23 0.00 0.00 176.35 176.83 3dnp s ILE 64 N -1.09 4.92 0.37 -0.59 1.01 0.04 -1.96 121.20 123.91 3dnp s ILE 64 Ca 0.18 -1.01 0.04 0.00 0.00 0.00 0.00 60.65 59.86 3dnp s ILE 64 Cb -0.12 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 3dnp s ILE 64 CO 0.08 -0.45 0.09 0.42 0.00 0.00 0.00 174.94 175.08 3dnp s THR 65 N 1.59 0.92 -1.48 2.92 -4.23 -0.18 -0.96 115.64 114.22 3dnp s THR 65 Ca 0.04 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.47 3dnp s THR 65 Cb -0.22 -2.55 0.06 0.00 1.34 0.00 0.00 72.50 71.12 3dnp s THR 65 CO 0.06 0.00 0.71 1.41 -0.54 0.00 0.00 174.62 176.27 3dnp n HIS 66 N -0.82 -1.91 -1.92 3.99 8.25 -0.63 -1.31 115.22 120.86 3dnp n HIS 66 Ca -0.05 0.82 -0.19 0.00 -0.26 0.00 0.00 57.72 58.04 3dnp n HIS 66 Cb 0.66 -3.81 -0.05 0.00 1.12 0.00 0.00 29.99 27.91 3dnp n HIS 66 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3dnp n SER 67 N -2.90 -5.37 0.00 0.41 7.64 -0.60 -1.84 113.62 110.97 3dnp n SER 67 Ca -0.13 0.24 0.00 0.00 1.01 0.00 0.00 58.87 59.99 3dnp n SER 67 Cb 0.60 -4.48 0.00 0.00 -1.01 0.00 0.00 64.21 59.32 3dnp n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dnp n GLY 68 N -0.82 0.30 0.09 0.23 0.00 -0.43 -2.48 105.19 102.08 3dnp n GLY 68 Ca -0.21 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.94 3dnp n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dnp n ALA 69 N -1.92 2.45 -3.58 4.61 0.00 -0.77 -4.59 120.51 116.71 3dnp n ALA 69 Ca 0.00 -0.08 -0.24 0.00 0.00 0.00 0.00 53.44 53.12 3dnp n ALA 69 Cb 0.00 -1.40 -0.16 0.00 0.00 0.00 0.00 19.45 17.89 3dnp n ALA 69 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3dnp s TYR 70 N -3.11 0.07 -0.14 0.00 5.04 -0.92 -1.37 117.35 116.92 3dnp s TYR 70 Ca 0.10 -0.17 0.01 0.00 -2.44 0.00 0.00 57.07 54.56 3dnp s TYR 70 Cb 0.13 -0.60 0.02 0.00 0.35 0.00 0.00 41.96 41.86 3dnp s TYR 70 CO 0.62 -0.54 -0.15 0.42 -1.34 0.00 0.00 175.55 174.57 3dnp s ILE 71 N 2.19 1.57 0.03 3.14 1.01 0.29 -1.01 121.20 128.43 3dnp s ILE 71 Ca 0.03 -0.64 -0.27 0.00 0.00 0.00 0.00 60.65 59.77 3dnp s ILE 71 Cb -0.16 -1.46 0.09 0.00 0.01 0.00 0.00 42.46 40.94 3dnp s ILE 71 CO -0.10 0.46 0.81 0.00 0.00 0.00 0.00 174.94 176.11 3dnp s ALA 72 N 1.37 -1.76 -0.24 9.38 0.00 -0.83 -0.45 121.76 129.23 3dnp s ALA 72 Ca 0.02 0.90 0.06 0.00 0.00 0.00 0.00 51.96 52.94 3dnp s ALA 72 Cb -0.13 0.50 -0.19 0.00 0.00 0.00 0.00 23.12 23.29 3dnp s ALA 72 CO -0.09 -0.69 -0.12 0.39 0.00 0.00 0.00 175.76 175.25 3dnp n GLU 73 N -0.23 0.66 -4.44 0.00 1.02 -1.26 -0.80 120.64 115.59 3dnp n GLU 73 Ca -0.11 0.12 -0.21 0.00 -0.02 0.00 0.00 57.16 56.94 3dnp n GLU 73 Cb 0.62 -1.53 -0.15 0.00 -0.02 0.00 0.00 31.44 30.36 3dnp n GLU 73 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3dnp s LYS 74 N -2.52 1.03 0.27 3.49 1.02 -1.26 -4.98 119.74 116.79 3dnp s LYS 74 Ca -0.28 -0.35 -0.00 0.00 0.02 0.00 0.00 55.97 55.36 3dnp s LYS 74 Cb 0.08 -0.95 0.53 0.00 -0.52 0.00 0.00 37.83 36.96 3dnp s LYS 74 CO 0.67 0.14 1.81 0.97 -0.92 0.00 0.00 175.35 178.02 3dnp h ILE 75 N 5.30 0.86 0.00 2.17 2.10 -1.98 -2.41 117.51 123.54 3dnp h ILE 75 Ca -0.33 -0.29 0.00 0.00 1.08 0.00 0.00 64.86 65.32 3dnp h ILE 75 Cb 1.17 -0.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.84 3dnp h ILE 75 CO 0.49 0.15 0.00 0.47 -1.08 0.00 0.00 178.15 178.18 3dnp n ASP 76 N -4.72 0.24 -3.25 2.19 8.00 -1.26 -4.27 116.55 113.49 3dnp n ASP 76 Ca 0.18 0.54 -0.25 0.00 0.71 0.00 0.00 54.79 55.97 3dnp n ASP 76 Cb 0.37 -0.60 -0.07 0.00 -0.02 0.00 0.00 41.12 40.80 3dnp n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dnp n ALA 77 N -1.59 2.99 -1.78 2.24 0.00 -0.91 -5.11 120.51 116.35 3dnp n ALA 77 Ca 0.05 -3.88 -0.35 0.00 0.00 0.00 0.00 53.44 49.26 3dnp n ALA 77 Cb 0.27 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 18.87 3dnp n ALA 77 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3dnp s PRO 78 N -1.77 3.52 0.09 0.00 0.04 -1.26 -4.62 135.00 131.00 3dnp s PRO 78 Ca 0.37 1.59 -0.15 0.00 0.04 0.00 0.00 61.00 62.86 3dnp s PRO 78 Cb 0.18 -2.11 -0.13 0.00 0.04 0.00 0.00 34.50 32.49 3dnp s PRO 78 CO -0.08 -0.71 1.33 0.35 0.04 0.00 0.00 177.00 177.94 3dnp h PHE 79 N 1.45 0.89 -3.34 0.56 3.57 -1.12 -3.45 116.94 115.50 3dnp h PHE 79 Ca -0.50 -0.34 -0.25 0.00 3.53 0.00 0.00 57.97 60.41 3dnp h PHE 79 Cb 1.25 -0.16 -0.31 0.00 2.79 0.00 0.00 35.95 39.52 3dnp h PHE 79 CO 0.53 1.13 -0.62 0.12 -2.23 0.00 0.00 178.31 177.23 3dnp s PHE 80 N -3.98 -0.12 -0.01 0.41 5.36 -0.83 -5.01 117.98 113.80 3dnp s PHE 80 Ca -0.12 0.39 -0.01 0.00 -0.96 0.00 0.00 56.93 56.22 3dnp s PHE 80 Cb 0.08 -0.09 0.00 0.00 -0.34 0.00 0.00 43.02 42.67 3dnp s PHE 80 CO 0.85 -0.14 0.03 -1.83 -1.46 0.00 0.00 175.22 172.68 3dnp s GLU 81 N 0.98 0.10 -0.03 10.12 -1.05 -1.26 -0.55 118.70 127.02 3dnp s GLU 81 Ca -0.08 -0.06 -0.04 0.00 -0.15 0.00 0.00 54.97 54.65 3dnp s GLU 81 Cb -0.10 0.04 0.01 0.00 -0.44 0.00 0.00 34.13 33.64 3dnp s GLU 81 CO -0.04 -0.02 0.10 0.21 0.95 0.00 0.00 175.26 176.45 3dnp s LYS 82 N -0.26 0.17 0.05 -4.83 2.47 -0.47 -5.02 119.74 111.85 3dnp s LYS 82 Ca -0.03 0.03 -0.04 0.00 -1.56 0.00 0.00 55.97 54.38 3dnp s LYS 82 Cb -0.02 0.08 -0.02 0.00 -1.46 0.00 0.00 37.83 36.40 3dnp s LYS 82 CO -0.00 -0.03 0.05 -0.98 0.16 0.00 0.00 175.35 174.55 3dnp s ARG 83 N -0.19 0.62 0.15 4.03 1.70 -1.26 -4.56 118.95 119.43 3dnp s ARG 83 Ca -0.03 -0.97 -0.30 0.00 -0.47 0.00 0.00 55.73 53.96 3dnp s ARG 83 Cb -0.02 0.23 -0.07 0.00 -0.57 0.00 0.00 34.95 34.52 3dnp s ARG 83 CO 0.00 -0.14 1.14 0.42 -1.08 0.00 0.00 175.30 175.63 3dnp s ILE 84 N -3.28 3.88 0.85 4.99 1.01 0.08 -4.88 121.20 123.85 3dnp s ILE 84 Ca 0.01 1.54 -0.13 0.00 0.00 0.00 0.00 60.65 62.07 3dnp s ILE 84 Cb 0.03 -3.98 0.07 0.00 0.01 0.00 0.00 42.46 38.59 3dnp s ILE 84 CO -0.08 0.23 0.94 -1.54 0.00 0.00 0.00 174.94 174.49 3dnp n SER 85 N 2.78 -0.05 -0.26 3.58 3.41 -1.26 -3.10 113.62 118.73 3dnp n SER 85 Ca 0.04 0.50 -0.02 0.00 -0.26 0.00 0.00 58.87 59.13 3dnp n SER 85 Cb 0.46 -1.40 0.17 0.00 -0.26 0.00 0.00 64.21 63.17 3dnp n SER 85 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3dnp h ASP 86 N -1.21 0.97 -0.03 4.04 3.04 -1.94 0.46 116.42 121.75 3dnp h ASP 86 Ca -0.45 -0.07 -0.00 0.00 -3.24 0.00 0.00 57.03 53.27 3dnp h ASP 86 Cb 1.29 -0.25 -0.00 0.00 -1.04 0.00 0.00 39.33 39.34 3dnp h ASP 86 CO 0.42 0.77 0.01 -0.78 -2.04 0.00 0.00 179.24 177.62 3dnp h ASP 87 N 1.09 0.04 -0.74 4.15 1.82 -1.90 -0.98 116.42 119.90 3dnp h ASP 87 Ca 0.28 -0.15 -0.05 0.00 -0.39 0.00 0.00 57.03 56.72 3dnp h ASP 87 Cb 0.01 -0.01 -0.03 0.00 0.68 0.00 0.00 39.33 39.98 3dnp h ASP 87 CO -0.05 0.18 0.26 0.45 -1.61 0.00 0.00 179.24 178.48 3dnp h HIS 88 N -0.11 1.15 -0.36 0.28 3.86 -1.89 -1.43 115.15 116.66 3dnp h HIS 88 Ca 0.01 -0.10 0.04 0.00 -1.16 0.00 0.00 60.37 59.16 3dnp h HIS 88 Cb 0.15 -0.34 -0.04 0.00 1.06 0.00 0.00 27.41 28.24 3dnp h HIS 88 CO -0.02 0.90 0.14 1.15 0.86 0.00 0.00 177.93 180.95 3dnp h THR 89 N 1.08 0.91 -0.24 2.45 2.02 -0.74 0.97 112.91 119.36 3dnp h THR 89 Ca 0.24 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.33 3dnp h THR 89 Cb 0.26 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 3dnp h THR 89 CO -0.01 0.05 0.14 0.15 0.37 0.00 0.00 175.52 176.22 3dnp h PHE 90 N 0.30 0.26 -0.70 3.16 3.57 -0.91 -0.33 116.94 122.30 3dnp h PHE 90 Ca 0.16 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 3dnp h PHE 90 Cb 0.13 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 3dnp h PHE 90 CO -0.13 0.16 0.17 -0.91 -2.23 0.00 0.00 178.31 175.37 3dnp h ASN 91 N 0.29 1.06 -0.33 0.41 2.35 -0.97 -1.10 115.58 117.29 3dnp h ASN 91 Ca 0.10 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.59 3dnp h ASN 91 Cb -0.00 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.08 3dnp h ASN 91 CO -0.05 1.01 0.08 0.40 -1.65 0.00 0.00 177.43 177.23 3dnp h ILE 92 N 1.06 1.22 -0.73 2.81 2.04 -0.62 -2.55 117.51 120.75 3dnp h ILE 92 Ca 0.22 -0.73 0.05 0.00 1.00 0.00 0.00 64.86 65.40 3dnp h ILE 92 Cb 0.37 1.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.46 3dnp h ILE 92 CO 0.00 0.25 0.44 0.58 0.00 0.00 0.00 178.15 179.41 3dnp h VAL 93 N 0.38 1.03 -0.57 1.67 2.07 -0.77 -1.40 116.25 118.66 3dnp h VAL 93 Ca 0.10 -0.28 0.04 0.00 0.82 0.00 0.00 66.70 67.38 3dnp h VAL 93 Cb 0.29 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 3dnp h VAL 93 CO 0.00 0.15 0.32 1.56 0.02 0.00 0.00 177.57 179.62 3dnp h GLN 94 N 0.82 0.61 -0.03 1.57 4.20 -1.03 0.14 115.11 121.38 3dnp h GLN 94 Ca 0.31 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.99 3dnp h GLN 94 Cb 0.12 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 3dnp h GLN 94 CO -0.15 0.40 0.02 0.28 -0.67 0.00 0.00 178.83 178.71 3dnp h VAL 95 N 0.63 1.03 -0.20 -0.54 2.07 -1.03 -2.97 116.25 115.24 3dnp h VAL 95 Ca 0.24 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.66 3dnp h VAL 95 Cb 0.08 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 3dnp h VAL 95 CO -0.13 0.03 0.07 -0.07 0.02 0.00 0.00 177.57 177.49 3dnp h LEU 96 N 0.02 0.25 -2.51 2.57 3.38 -1.03 -1.92 115.31 116.06 3dnp h LEU 96 Ca 0.01 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3dnp h LEU 96 Cb 0.02 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3dnp h LEU 96 CO -0.00 0.24 -0.02 -0.33 0.09 0.00 0.00 178.44 178.42 3dnp h GLU 97 N 0.28 0.00 0.00 1.13 5.08 -0.80 -1.67 114.58 118.60 3dnp h GLU 97 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3dnp h GLU 97 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3dnp h GLU 97 CO -0.01 0.02 0.00 -1.13 -1.00 0.00 0.00 179.01 176.89 3dnp n SER 98 N -3.35 0.00 -4.77 1.42 3.41 -0.72 -4.84 113.62 104.77 3dnp n SER 98 Ca -0.02 0.22 -0.23 0.00 -0.26 0.00 0.00 58.87 58.58 3dnp n SER 98 Cb 0.13 -0.41 -0.05 0.00 -0.26 0.00 0.00 64.21 63.62 3dnp n SER 98 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3dnp s TYR 99 N -2.82 3.00 -1.18 7.33 2.02 -0.63 -5.04 117.35 120.03 3dnp s TYR 99 Ca 0.20 -0.13 -0.20 0.00 -0.37 0.00 0.00 57.07 56.57 3dnp s TYR 99 Cb 0.19 -1.36 0.03 0.00 -0.40 0.00 0.00 41.96 40.43 3dnp s TYR 99 CO 0.50 0.55 1.72 -1.14 -1.57 0.00 0.00 175.55 175.60 3dnp s GLN 100 N -3.69 3.53 -0.04 -0.62 2.00 -1.26 -4.90 119.66 114.68 3dnp s GLN 100 Ca 0.32 -1.52 -0.12 0.00 -2.00 0.00 0.00 55.36 52.04 3dnp s GLN 100 Cb -0.08 -5.41 0.02 0.00 0.80 0.00 0.00 33.01 28.34 3dnp s GLN 100 CO 0.23 -2.63 0.27 0.00 -0.50 0.00 0.00 175.29 172.67 3dnp s ASN 102 N -0.96 6.61 -0.09 0.00 3.84 -0.37 -4.72 114.94 119.26 3dnp s ASN 102 Ca -0.10 0.73 0.03 0.00 0.21 0.00 0.00 52.86 53.72 3dnp s ASN 102 Cb -0.05 -2.27 -0.02 0.00 -0.55 0.00 0.00 41.25 38.37 3dnp s ASN 102 CO 0.03 -0.01 -0.17 -0.63 -2.79 0.00 0.00 177.10 173.53 3dnp s ILE 103 N 0.76 2.78 -0.05 -5.21 1.01 -1.26 -1.02 121.20 118.22 3dnp s ILE 103 Ca 0.24 -0.79 0.03 0.00 0.00 0.00 0.00 60.65 60.13 3dnp s ILE 103 Cb -0.15 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.22 3dnp s ILE 103 CO 0.09 0.56 -0.13 -0.13 0.00 0.00 0.00 174.94 175.33 3dnp s ARG 104 N -0.13 1.55 -0.42 2.79 1.81 -0.24 -1.98 118.95 122.34 3dnp s ARG 104 Ca -0.02 -0.46 -0.20 0.00 -1.72 0.00 0.00 55.73 53.33 3dnp s ARG 104 Cb -0.14 -1.33 0.02 0.00 -0.45 0.00 0.00 34.95 33.05 3dnp s ARG 104 CO 0.04 0.13 0.61 -0.51 -0.68 0.00 0.00 175.30 174.88 3dnp s LEU 105 N 0.33 4.51 -1.13 2.53 1.43 0.31 -0.53 118.68 126.13 3dnp s LEU 105 Ca -0.08 -0.32 -0.09 0.00 -1.03 0.00 0.00 54.13 52.61 3dnp s LEU 105 Cb -0.12 -2.68 0.27 0.00 0.03 0.00 0.00 46.19 43.69 3dnp s LEU 105 CO 0.02 -0.71 1.15 -0.11 0.23 0.00 0.00 176.35 176.93 3dnp n LEU 106 N 6.12 5.52 -4.87 1.79 7.94 -0.37 -2.46 117.00 130.67 3dnp n LEU 106 Ca -0.03 -4.99 -0.31 0.00 -1.11 0.00 0.00 56.01 49.57 3dnp n LEU 106 Cb 0.48 -1.49 0.01 0.00 0.53 0.00 0.00 43.42 42.95 3dnp n LEU 106 CO 0.52 1.30 0.70 -2.28 -1.11 0.00 0.00 177.39 176.51 3dnp s HIS 107 N -1.08 3.61 -0.99 1.96 5.65 -0.75 -3.87 115.29 119.83 3dnp s HIS 107 Ca 0.32 1.27 0.22 0.00 0.25 0.00 0.00 55.06 57.12 3dnp s HIS 107 Cb -0.09 -2.69 0.94 0.00 -1.18 0.00 0.00 32.58 29.55 3dnp s HIS 107 CO -0.07 -0.64 1.71 -0.85 -0.65 0.00 0.00 174.74 174.24 3dnp n GLU 108 N -2.63 0.01 0.00 2.88 0.00 -1.26 -3.63 120.64 116.01 3dnp n GLU 108 Ca 0.06 0.13 0.00 0.00 0.00 0.00 0.00 57.16 57.34 3dnp n GLU 108 Cb 0.54 -1.51 0.00 0.00 0.00 0.00 0.00 31.44 30.47 3dnp n GLU 108 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3dnp n LYS 109 N -1.52 2.09 -3.66 3.44 5.02 -1.26 -4.62 118.16 117.65 3dnp n LYS 109 Ca 0.05 -0.31 -0.02 0.00 -2.02 0.00 0.00 58.31 56.01 3dnp n LYS 109 Cb 0.26 -0.81 -0.01 0.00 -0.02 0.00 0.00 35.03 34.45 3dnp n LYS 109 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 3dnp s TYR 110 N -0.40 -0.11 0.00 2.13 -0.85 -1.24 -4.05 117.35 112.83 3dnp s TYR 110 Ca 0.00 -0.07 0.03 0.00 -0.52 0.00 0.00 57.07 56.51 3dnp s TYR 110 Cb 0.00 0.58 -0.01 0.00 0.38 0.00 0.00 41.96 42.91 3dnp s TYR 110 CO 0.00 -0.50 -0.10 0.45 -1.52 0.00 0.00 175.55 173.88 3dnp s SER 111 N -2.84 1.14 -0.03 -0.18 0.15 -0.51 -1.80 113.70 109.63 3dnp s SER 111 Ca 0.12 -0.22 0.01 0.00 0.70 0.00 0.00 55.95 56.57 3dnp s SER 111 Cb 0.01 -0.11 0.01 0.00 -1.71 0.00 0.00 66.02 64.23 3dnp s SER 111 CO -0.02 0.09 -0.05 -0.63 1.20 0.00 0.00 173.24 173.82 3dnp s ILE 112 N -0.35 0.54 0.32 6.45 1.01 -1.03 -1.78 121.20 126.37 3dnp s ILE 112 Ca 0.03 -0.19 0.03 0.00 0.00 0.00 0.00 60.65 60.52 3dnp s ILE 112 Cb -0.04 -0.53 -0.05 0.00 0.01 0.00 0.00 42.46 41.85 3dnp s ILE 112 CO -0.00 0.20 0.10 -0.83 0.00 0.00 0.00 174.94 174.41 3dnp s GLY 113 N 0.51 2.08 0.30 6.18 0.00 -0.39 -0.53 107.32 115.46 3dnp s GLY 113 Ca -0.07 -1.78 -0.01 0.00 0.00 0.00 0.00 44.72 42.86 3dnp s GLY 113 CO 0.00 -1.71 0.40 1.16 0.00 0.00 0.00 173.10 172.95 3dnp n ASN 114 N -0.79 0.43 -0.31 1.64 6.94 -0.84 -0.72 115.26 121.62 3dnp n ASN 114 Ca -0.02 -1.39 0.05 0.00 -0.02 0.00 0.00 54.58 53.20 3dnp n ASN 114 Cb 0.66 -0.27 0.11 0.00 -2.36 0.00 0.00 39.78 37.91 3dnp n ASN 114 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3dnp n LYS 115 N -1.77 2.58 -2.15 -3.83 5.02 -1.07 -4.57 118.16 112.36 3dnp n LYS 115 Ca 0.06 -2.08 -0.42 0.00 -2.02 0.00 0.00 58.31 53.86 3dnp n LYS 115 Cb 0.23 -1.30 -0.03 0.00 -0.02 0.00 0.00 35.03 33.90 3dnp n LYS 115 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3dnp s LYS 116 N -1.69 4.32 -0.01 1.97 1.02 -1.26 -4.99 119.74 119.11 3dnp s LYS 116 Ca 0.19 2.11 -0.24 0.00 0.02 0.00 0.00 55.97 58.05 3dnp s LYS 116 Cb 0.14 -3.22 -0.05 0.00 -0.52 0.00 0.00 37.83 34.19 3dnp s LYS 116 CO 0.06 -0.41 0.72 0.15 -0.92 0.00 0.00 175.35 174.95 3dnp s LYS 117 N 0.76 4.45 0.08 1.68 1.02 -1.26 -4.47 119.74 121.99 3dnp s LYS 117 Ca 0.63 0.96 0.08 0.00 0.02 0.00 0.00 55.97 57.66 3dnp s LYS 117 Cb -0.38 -3.40 -0.03 0.00 -0.52 0.00 0.00 37.83 33.51 3dnp s LYS 117 CO 0.33 0.20 -0.22 0.14 -0.92 0.00 0.00 175.35 174.88 3dnp s VAL 118 N 0.29 1.80 -1.21 3.17 -7.23 -1.26 -4.89 120.40 111.07 3dnp s VAL 118 Ca 0.38 -1.41 -0.21 0.00 -1.81 0.00 0.00 61.98 58.92 3dnp s VAL 118 Cb -0.19 -1.59 -0.03 0.00 0.56 0.00 0.00 36.38 35.12 3dnp s VAL 118 CO 0.20 0.11 1.86 0.20 -0.31 0.00 0.00 175.10 177.17 3dnp s ASN 119 N -1.56 5.63 -0.15 4.85 0.01 -1.26 -4.86 114.94 117.59 3dnp s ASN 119 Ca 0.08 -1.87 -0.04 0.00 -0.71 0.00 0.00 52.86 50.33 3dnp s ASN 119 Cb -0.09 -2.58 0.05 0.00 0.41 0.00 0.00 41.25 39.03 3dnp s ASN 119 CO 0.03 -2.44 0.07 -0.55 -1.51 0.00 0.00 177.10 172.70 3dnp s SER 120 N 5.81 2.27 0.31 -1.22 0.15 -1.26 -4.30 113.70 115.45 3dnp s SER 120 Ca 0.63 -0.54 0.14 0.00 0.70 0.00 0.00 55.95 56.88 3dnp s SER 120 Cb 0.01 -0.32 0.44 0.00 -1.71 0.00 0.00 66.02 64.44 3dnp s SER 120 CO 0.11 -0.32 1.64 0.78 1.20 0.00 0.00 173.24 176.64 3dnp h ASN 121 N 8.38 0.00 0.62 5.45 2.35 -1.95 -2.91 115.58 127.52 3dnp h ASN 121 Ca -0.15 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.48 3dnp h ASN 121 Cb 1.14 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.49 3dnp h ASN 121 CO 0.28 0.54 -0.54 -0.07 -1.65 0.00 0.00 177.43 175.98 3dnp h LEU 122 N 0.00 0.00 -0.37 1.61 3.38 -1.98 0.10 115.31 118.06 3dnp h LEU 122 Ca -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3dnp h LEU 122 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 3dnp h LEU 122 CO 0.07 0.54 0.05 0.25 0.09 0.00 0.00 178.44 179.44 3dnp h LEU 123 N 0.00 0.59 -1.43 1.67 5.85 -1.92 -1.31 115.31 118.77 3dnp h LEU 123 Ca -0.01 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 3dnp h LEU 123 Cb 1.00 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 3dnp h LEU 123 CO 0.07 0.71 0.02 1.23 -0.34 0.00 0.00 178.44 180.14 3dnp h GLY 124 N 0.45 0.43 1.74 3.75 0.00 -1.25 -3.15 103.07 105.03 3dnp h GLY 124 Ca 0.11 -0.22 -0.24 0.00 0.00 0.00 0.00 47.33 46.98 3dnp h GLY 124 CO 0.01 0.21 -1.18 0.07 0.00 0.00 0.00 176.54 175.65 3dnp h LYS 125 N 0.39 0.05 -6.50 4.80 5.09 -0.70 -3.47 116.57 116.24 3dnp h LYS 125 Ca 0.09 -0.09 -0.58 0.00 0.09 0.00 0.00 60.65 60.17 3dnp h LYS 125 Cb 0.23 0.03 0.05 0.00 0.10 0.00 0.00 32.23 32.64 3dnp h LYS 125 CO 0.00 0.95 0.85 0.00 -2.09 0.00 0.00 179.45 179.17 3dnp n ALA 126 N -2.43 1.47 -1.79 0.07 0.00 -0.50 -4.89 120.51 112.43 3dnp n ALA 126 Ca -0.05 0.42 -0.42 0.00 0.00 0.00 0.00 53.44 53.40 3dnp n ALA 126 Cb 0.98 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.01 3dnp n ALA 126 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3dnp s LEU 127 N 1.25 4.38 -0.04 0.00 1.43 -1.26 -5.00 118.68 119.44 3dnp s LEU 127 Ca 0.80 2.69 -0.19 0.00 -1.03 0.00 0.00 54.13 56.39 3dnp s LEU 127 Cb -0.66 -3.57 -0.05 0.00 0.03 0.00 0.00 46.19 41.94 3dnp s LEU 127 CO 0.39 -0.95 0.55 -0.63 0.23 0.00 0.00 176.35 175.93 3dnp s ILE 128 N 2.35 5.01 0.20 -0.59 1.01 -1.26 -5.09 121.20 122.82 3dnp s ILE 128 Ca 0.77 1.13 0.10 0.00 0.00 0.00 0.00 60.65 62.65 3dnp s ILE 128 Cb -0.45 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 3dnp s ILE 128 CO 0.34 0.40 -0.19 -1.38 0.00 0.00 0.00 174.94 174.11 3dnp s HIS 129 N 0.02 1.99 0.52 3.97 -3.43 -1.26 -5.11 115.29 111.98 3dnp s HIS 129 Ca 0.29 -0.44 -0.23 0.00 -0.80 0.00 0.00 55.06 53.89 3dnp s HIS 129 Cb -0.17 -0.95 -0.06 0.00 -1.43 0.00 0.00 32.58 29.97 3dnp s HIS 129 CO 0.15 0.44 1.35 -2.14 -2.00 0.00 0.00 174.74 172.55 3dnp s PRO 130 N -3.04 3.32 0.83 -0.38 0.02 -1.26 -5.03 135.00 129.46 3dnp s PRO 130 Ca 0.20 2.23 -0.10 0.00 0.02 0.00 0.00 61.00 63.35 3dnp s PRO 130 Cb -0.05 -2.36 0.13 0.00 0.02 0.00 0.00 34.50 32.24 3dnp s PRO 130 CO 0.09 -1.04 1.16 -1.54 -0.33 0.00 0.00 177.00 175.34 3dnp s SER 131 N -0.89 3.98 -0.03 2.53 1.04 -1.26 -5.03 113.70 114.04 3dnp s SER 131 Ca 0.68 0.28 0.00 0.00 0.48 0.00 0.00 55.95 57.40 3dnp s SER 131 Cb -0.40 -0.61 0.03 0.00 0.10 0.00 0.00 66.02 65.14 3dnp s SER 131 CO 0.48 -2.16 0.00 -0.62 0.98 0.00 0.00 173.24 171.92 3dnp s ASP 132 N -4.72 0.50 0.62 7.02 2.15 -0.41 -4.94 116.67 116.89 3dnp s ASP 132 Ca 0.67 -0.03 0.39 0.00 0.43 0.00 0.00 52.55 54.02 3dnp s ASP 132 Cb -0.07 -0.23 2.09 0.00 -0.30 0.00 0.00 42.92 44.41 3dnp s ASP 132 CO 0.49 -0.11 2.27 1.55 -0.17 0.00 0.00 175.17 179.20 3dnp h PRO 133 N 7.34 0.00 0.00 4.34 0.13 -1.99 0.70 132.00 142.52 3dnp h PRO 133 Ca -0.41 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.57 3dnp h PRO 133 Cb 1.13 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 3dnp h PRO 133 CO 0.45 0.01 -1.22 -0.89 -0.23 0.00 0.00 178.00 176.13 3dnp n ILE 134 N -3.25 1.49 0.10 -3.56 5.41 -1.26 -4.61 119.36 113.68 3dnp n ILE 134 Ca -0.02 0.02 0.07 0.00 1.00 0.00 0.00 62.75 63.82 3dnp n ILE 134 Cb 0.13 -2.19 -0.00 0.00 -0.71 0.00 0.00 39.64 36.86 3dnp n ILE 134 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 3dnp h PHE 135 N -1.00 0.00 -0.42 1.39 0.04 -1.89 -3.42 116.94 111.64 3dnp h PHE 135 Ca -0.23 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.26 3dnp h PHE 135 Cb 1.04 0.00 -0.19 0.00 2.20 0.00 0.00 35.95 39.00 3dnp h PHE 135 CO -0.16 0.23 -0.61 0.98 -0.60 0.00 0.00 178.31 178.15 3dnp n TYR 136 N -2.86 -2.82 -2.03 -0.55 4.19 0.18 -4.67 117.16 108.60 3dnp n TYR 136 Ca -0.02 -2.07 -0.40 0.00 3.31 0.00 0.00 57.90 58.71 3dnp n TYR 136 Cb 0.66 1.21 -0.01 0.00 0.49 0.00 0.00 39.34 41.68 3dnp n TYR 136 CO 0.00 0.00 0.00 -2.14 0.91 0.00 0.00 176.86 175.63 3dnp s PRO 137 N 0.36 4.19 -0.14 2.98 0.02 -0.83 -1.28 135.00 140.30 3dnp s PRO 137 Ca 0.32 2.27 0.00 0.00 0.02 0.00 0.00 61.00 63.62 3dnp s PRO 137 Cb 0.21 -2.96 0.02 0.00 0.02 0.00 0.00 34.50 31.79 3dnp s PRO 137 CO -0.22 -0.35 -0.13 0.08 -0.33 0.00 0.00 177.00 176.05 3dnp s VAL 138 N -1.17 1.49 0.07 3.83 1.01 -1.26 -1.42 120.40 122.95 3dnp s VAL 138 Ca 0.52 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.95 3dnp s VAL 138 Cb -0.41 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 3dnp s VAL 138 CO 0.54 0.44 -0.09 -1.10 0.00 0.00 0.00 175.10 174.90 3dnp s GLN 139 N 1.51 0.71 0.05 2.72 -0.21 -0.73 -5.01 119.66 118.70 3dnp s GLN 139 Ca 0.05 -1.02 0.09 0.00 0.02 0.00 0.00 55.36 54.50 3dnp s GLN 139 Cb -0.13 -0.38 -0.03 0.00 1.00 0.00 0.00 33.01 33.47 3dnp s GLN 139 CO -0.10 0.05 -0.26 -0.06 -2.12 0.00 0.00 175.29 172.81 3dnp s PHE 140 N -2.20 2.35 0.12 0.91 0.08 -1.26 -1.27 117.98 116.71 3dnp s PHE 140 Ca 0.00 -0.39 0.04 0.00 0.12 0.00 0.00 56.93 56.70 3dnp s PHE 140 Cb -0.04 -1.38 -0.04 0.00 -0.57 0.00 0.00 43.02 40.98 3dnp s PHE 140 CO -0.01 0.16 -0.11 0.14 -0.10 0.00 0.00 175.22 175.31 3dnp s VAL 141 N -0.85 1.08 0.15 -0.44 -7.23 0.10 -4.94 120.40 108.28 3dnp s VAL 141 Ca 0.12 -1.84 -0.11 0.00 -1.81 0.00 0.00 61.98 58.34 3dnp s VAL 141 Cb -0.10 -1.60 0.01 0.00 0.56 0.00 0.00 36.38 35.25 3dnp s VAL 141 CO 0.03 -0.63 1.57 -0.33 -0.31 0.00 0.00 175.10 175.43 3dnp h GLU 142 N 3.20 0.95 -4.13 4.82 5.08 -1.92 -2.84 114.58 119.73 3dnp h GLU 142 Ca -0.37 -0.35 -0.61 0.00 -1.00 0.00 0.00 59.36 57.02 3dnp h GLU 142 Cb 1.19 -0.06 -0.39 0.00 0.50 0.00 0.00 28.75 29.99 3dnp h GLU 142 CO 0.57 1.02 -0.75 0.45 -1.00 0.00 0.00 179.01 179.30 3dnp s SER 143 N -6.55 4.18 0.11 1.42 0.15 -1.26 -4.56 113.70 107.19 3dnp s SER 143 Ca -0.12 -1.65 -0.18 0.00 0.70 0.00 0.00 55.95 54.70 3dnp s SER 143 Cb 0.12 -1.18 -0.05 0.00 -1.71 0.00 0.00 66.02 63.19 3dnp s SER 143 CO 0.85 -0.35 1.61 -0.07 1.20 0.00 0.00 173.24 176.48 3dnp h LEU 144 N 7.91 0.44 -1.15 3.45 3.38 -1.90 -2.64 115.31 124.80 3dnp h LEU 144 Ca -0.12 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.60 3dnp h LEU 144 Cb 1.03 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 3dnp h LEU 144 CO 0.47 0.54 0.13 0.77 0.09 0.00 0.00 178.44 180.43 3dnp h SER 145 N 0.32 0.67 -0.65 -0.43 4.64 -1.93 -0.88 113.55 115.28 3dnp h SER 145 Ca 0.09 -0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 3dnp h SER 145 Cb 0.26 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 3dnp h SER 145 CO -0.00 0.66 0.31 0.44 -0.87 0.00 0.00 176.83 177.37 3dnp h ASP 146 N 0.71 0.85 -0.31 4.97 3.32 -1.96 -2.87 116.42 121.13 3dnp h ASP 146 Ca 0.16 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3dnp h ASP 146 Cb 0.24 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 3dnp h ASP 146 CO -0.01 0.75 0.20 0.25 -1.72 0.00 0.00 179.24 178.71 3dnp h LEU 147 N 0.90 0.37 -5.11 1.55 5.85 -1.00 -3.37 115.31 114.50 3dnp h LEU 147 Ca 0.22 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 3dnp h LEU 147 Cb 0.12 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3dnp h LEU 147 CO -0.03 0.29 0.62 0.18 -0.34 0.00 0.00 178.44 179.16 3dnp n LEU 148 N -4.85 0.78 0.00 2.25 4.77 -0.40 -1.24 117.00 118.30 3dnp n LEU 148 Ca -0.01 -0.98 0.00 0.00 -0.03 0.00 0.00 56.01 54.99 3dnp n LEU 148 Cb 0.04 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 3dnp n LEU 148 CO 0.34 -0.36 0.00 0.47 -1.33 0.00 0.00 177.39 176.51 3dnp n ASP 150 N 3.38 0.00 -3.64 -1.43 8.00 -1.26 -2.99 116.55 118.61 3dnp n ASP 150 Ca 0.07 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.29 3dnp n ASP 150 Cb 0.10 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.09 3dnp n ASP 150 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3dnp s GLU 151 N -0.44 1.67 0.56 -1.24 0.41 -0.37 -5.11 118.70 114.17 3dnp s GLU 151 Ca 0.00 -2.72 -0.21 0.00 -0.41 0.00 0.00 54.97 51.63 3dnp s GLU 151 Cb 0.00 -2.40 -0.04 0.00 -1.78 0.00 0.00 34.13 29.91 3dnp s GLU 151 CO 0.00 -1.34 1.36 -2.30 -0.49 0.00 0.00 175.26 172.49 3dnp n PRO 152 N 2.42 1.64 -4.69 0.39 -0.02 -1.16 -5.00 135.00 128.57 3dnp n PRO 152 Ca 0.25 0.61 -0.25 0.00 -2.02 0.00 0.00 63.50 62.09 3dnp n PRO 152 Cb 0.41 -2.58 -0.16 0.00 -0.02 0.00 0.00 33.50 31.15 3dnp n PRO 152 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3dnp s VAL 153 N -1.30 1.24 -0.46 -1.45 1.01 -1.26 -5.06 120.40 113.12 3dnp s VAL 153 Ca 0.73 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 62.07 3dnp s VAL 153 Cb -0.41 -1.09 0.12 0.00 0.00 0.00 0.00 36.38 35.00 3dnp s VAL 153 CO 0.48 0.37 0.29 -0.55 0.00 0.00 0.00 175.10 175.69 3dnp s SER 154 N 0.24 5.41 -0.16 3.32 0.15 -1.26 -4.15 113.70 117.25 3dnp s SER 154 Ca -0.07 -2.13 -0.22 0.00 0.70 0.00 0.00 55.95 54.23 3dnp s SER 154 Cb -0.12 -1.89 -0.03 0.00 -1.71 0.00 0.00 66.02 62.27 3dnp s SER 154 CO 0.02 -0.56 0.69 0.00 1.20 0.00 0.00 173.24 174.59 3dnp s ALA 155 N 1.02 3.48 0.39 5.45 0.00 -1.18 -4.75 121.76 126.17 3dnp s ALA 155 Ca 0.09 -0.10 0.08 0.00 0.00 0.00 0.00 51.96 52.04 3dnp s ALA 155 Cb -0.23 -3.02 0.80 0.00 0.00 0.00 0.00 23.12 20.67 3dnp s ALA 155 CO -0.03 -0.44 1.96 -1.35 0.00 0.00 0.00 175.76 175.89 3dnp h PRO 156 N 7.23 0.34 -3.04 0.00 0.11 -1.80 0.26 132.00 135.10 3dnp h PRO 156 Ca -0.34 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 65.58 3dnp h PRO 156 Cb 1.15 -0.06 -0.23 0.00 0.11 0.00 0.00 31.00 31.98 3dnp h PRO 156 CO 0.78 0.38 -0.33 0.54 -0.21 0.00 0.00 178.00 179.16 3dnp s VAL 157 N -4.97 0.03 -0.19 3.15 0.11 -1.25 -4.25 120.40 113.02 3dnp s VAL 157 Ca -0.06 -0.25 -0.02 0.00 -2.93 0.00 0.00 61.98 58.72 3dnp s VAL 157 Cb 0.16 -0.51 -0.00 0.00 -1.53 0.00 0.00 36.38 34.50 3dnp s VAL 157 CO 0.73 -0.14 -0.10 -0.63 -3.33 0.00 0.00 175.10 171.64 3dnp s ILE 158 N -0.56 2.98 -0.11 7.04 1.01 -0.39 -1.23 121.20 129.94 3dnp s ILE 158 Ca -0.07 -0.64 -0.12 0.00 0.00 0.00 0.00 60.65 59.83 3dnp s ILE 158 Cb -0.04 -2.32 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 3dnp s ILE 158 CO 0.02 0.47 0.26 -1.61 0.00 0.00 0.00 174.94 174.08 3dnp s GLU 159 N 1.24 3.89 -0.15 2.79 2.02 0.31 -0.32 118.70 128.49 3dnp s GLU 159 Ca 0.03 0.08 -0.01 0.00 0.02 0.00 0.00 54.97 55.09 3dnp s GLU 159 Cb -0.14 -3.29 0.04 0.00 0.10 0.00 0.00 34.13 30.83 3dnp s GLU 159 CO -0.04 0.54 -0.05 0.08 0.02 0.00 0.00 175.26 175.82 3dnp s VAL 160 N -0.45 0.99 -0.13 2.63 1.01 0.19 -1.07 120.40 123.56 3dnp s VAL 160 Ca 0.17 -0.49 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 3dnp s VAL 160 Cb -0.13 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 3dnp s VAL 160 CO 0.06 0.17 -0.02 -0.31 0.00 0.00 0.00 175.10 175.00 3dnp s TYR 161 N 1.69 3.08 0.23 5.22 2.02 -0.19 -1.05 117.35 128.36 3dnp s TYR 161 Ca 0.02 -0.09 -0.09 0.00 -0.37 0.00 0.00 57.07 56.54 3dnp s TYR 161 Cb -0.15 -1.91 -0.02 0.00 -0.40 0.00 0.00 41.96 39.49 3dnp s TYR 161 CO -0.08 0.15 0.35 0.95 -1.57 0.00 0.00 175.55 175.36 3dnp s THR 162 N -0.05 0.00 0.72 -0.71 -4.23 -0.51 -1.23 115.64 109.63 3dnp s THR 162 Ca 0.03 -1.61 -0.15 0.00 -1.18 0.00 0.00 61.69 58.77 3dnp s THR 162 Cb -0.13 -2.30 0.03 0.00 1.34 0.00 0.00 72.50 71.44 3dnp s THR 162 CO 0.02 -0.01 1.20 -1.61 -0.54 0.00 0.00 174.62 173.69 3dnp s GLU 163 N -4.07 2.22 0.40 3.99 2.02 -1.26 -4.45 118.70 117.55 3dnp s GLU 163 Ca 0.28 1.73 0.09 0.00 0.02 0.00 0.00 54.97 57.09 3dnp s GLU 163 Cb 0.02 -1.85 0.83 0.00 0.10 0.00 0.00 34.13 33.24 3dnp s GLU 163 CO 0.10 -1.77 1.97 1.25 0.02 0.00 0.00 175.26 176.83 3dnp h HIS 164 N -0.23 0.32 -0.27 1.61 -0.00 -1.88 -3.21 115.15 111.49 3dnp h HIS 164 Ca -0.48 -0.02 0.08 0.00 -0.00 0.00 0.00 60.37 59.95 3dnp h HIS 164 Cb 1.29 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 28.59 3dnp h HIS 164 CO 0.48 0.34 0.24 0.38 -0.00 0.00 0.00 177.93 179.36 3dnp h ASP 165 N 0.31 0.00 -0.04 3.26 2.03 -1.92 -2.49 116.42 117.57 3dnp h ASP 165 Ca 0.07 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.37 3dnp h ASP 165 Cb 0.22 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.72 3dnp h ASP 165 CO 0.01 0.00 0.00 2.30 -1.03 0.00 0.00 179.24 180.52 3dnp n ILE 166 N -4.07 0.04 -0.23 4.15 -5.35 -1.21 -4.62 119.36 108.07 3dnp n ILE 166 Ca 0.04 -0.52 -0.05 0.00 -0.27 0.00 0.00 62.75 61.95 3dnp n ILE 166 Cb 0.39 1.33 0.06 0.00 -1.74 0.00 0.00 39.64 39.68 3dnp n ILE 166 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 3dnp h GLN 167 N 3.40 0.82 -0.48 6.28 4.20 -1.59 -1.14 115.11 126.61 3dnp h GLN 167 Ca 0.00 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 3dnp h GLN 167 Cb 0.73 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 3dnp h GLN 167 CO 0.00 0.54 0.24 1.25 -0.67 0.00 0.00 178.83 180.19 3dnp h HIS 168 N 0.84 0.68 -0.17 2.96 2.76 -1.82 0.10 115.15 120.50 3dnp h HIS 168 Ca 0.26 -0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.40 3dnp h HIS 168 Cb -0.03 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.71 3dnp h HIS 168 CO -0.04 0.53 0.10 -0.44 -1.30 0.00 0.00 177.93 176.78 3dnp h ASP 169 N 0.63 0.20 -0.41 3.26 3.32 -1.80 0.36 116.42 121.98 3dnp h ASP 169 Ca 0.16 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 3dnp h ASP 169 Cb 0.10 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 3dnp h ASP 169 CO -0.02 0.19 0.24 0.40 -1.72 0.00 0.00 179.24 178.32 3dnp h ILE 170 N 0.20 1.14 -0.41 0.35 2.04 -1.08 0.20 117.51 119.94 3dnp h ILE 170 Ca 0.06 -0.33 0.03 0.00 1.00 0.00 0.00 64.86 65.61 3dnp h ILE 170 Cb 0.03 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 3dnp h ILE 170 CO -0.01 0.14 0.22 0.74 0.00 0.00 0.00 178.15 179.24 3dnp h THR 171 N 0.53 1.00 -0.18 -0.27 2.02 -0.74 -0.35 112.91 114.92 3dnp h THR 171 Ca 0.14 -0.15 -0.13 0.00 0.77 0.00 0.00 66.41 67.04 3dnp h THR 171 Cb 0.02 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 3dnp h THR 171 CO -0.03 0.08 -0.45 -0.33 0.37 0.00 0.00 175.52 175.17 3dnp h GLU 172 N 0.45 0.45 -0.14 6.66 5.08 -0.71 -1.43 114.58 124.94 3dnp h GLU 172 Ca 0.17 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 3dnp h GLU 172 Cb 0.06 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 3dnp h GLU 172 CO -0.11 0.81 -0.06 1.15 -1.00 0.00 0.00 179.01 179.81 3dnp h THR 173 N 0.37 1.31 -0.04 1.13 2.02 -0.54 -2.40 112.91 114.75 3dnp h THR 173 Ca 0.03 -1.07 -0.00 0.00 0.77 0.00 0.00 66.41 66.13 3dnp h THR 173 Cb 0.93 1.72 -0.00 0.00 -1.74 0.00 0.00 68.15 69.06 3dnp h THR 173 CO 0.08 0.31 0.01 0.40 0.37 0.00 0.00 175.52 176.69 3dnp h ILE 174 N -0.04 1.20 -0.46 3.11 1.08 -1.09 -1.75 117.51 119.56 3dnp h ILE 174 Ca 0.03 -0.61 0.06 0.00 -0.39 0.00 0.00 64.86 63.95 3dnp h ILE 174 Cb 0.52 1.54 -0.05 0.00 -3.07 0.00 0.00 36.82 35.75 3dnp h ILE 174 CO 0.02 0.17 0.17 0.74 -0.69 0.00 0.00 178.15 178.55 3dnp h THR 175 N -0.17 0.85 -0.46 -0.27 2.02 -1.32 -0.59 112.91 112.98 3dnp h THR 175 Ca 0.01 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 3dnp h THR 175 Cb 0.26 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 3dnp h THR 175 CO 0.00 0.06 0.13 0.50 0.37 0.00 0.00 175.52 176.58 3dnp h LYS 176 N 0.34 0.72 0.00 6.66 3.64 -1.45 -3.28 116.57 123.21 3dnp h LYS 176 Ca 0.22 -0.17 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 3dnp h LYS 176 Cb 0.22 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3dnp h LYS 176 CO -0.22 0.71 -0.26 0.00 -2.27 0.00 0.00 179.45 177.41 3dnp h ALA 177 N 0.98 0.86 -2.71 5.00 0.00 -0.97 -3.41 119.26 119.00 3dnp h ALA 177 Ca 0.15 -0.17 -0.60 0.00 0.00 0.00 0.00 54.91 54.29 3dnp h ALA 177 Cb 0.30 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 17.67 3dnp h ALA 177 CO -0.00 0.22 -0.80 -0.06 0.00 0.00 0.00 179.25 178.61 3dnp s PHE 178 N -3.13 2.06 0.27 0.00 0.08 -0.26 -4.96 117.98 112.04 3dnp s PHE 178 Ca 0.05 -2.66 0.35 0.00 0.12 0.00 0.00 56.93 54.79 3dnp s PHE 178 Cb 0.06 -1.68 1.85 0.00 -0.57 0.00 0.00 43.02 42.68 3dnp s PHE 178 CO 0.70 -0.72 2.06 -1.35 -0.10 0.00 0.00 175.22 175.81 3dnp h PRO 179 N 5.77 0.00 0.00 0.24 0.11 -1.82 -2.10 132.00 134.21 3dnp h PRO 179 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 3dnp h PRO 179 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 3dnp h PRO 179 CO 0.50 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.29 3dnp n ALA 180 N -1.96 2.43 -2.37 -0.75 0.00 -1.26 -4.85 120.51 111.75 3dnp n ALA 180 Ca -0.02 -0.14 -0.19 0.00 0.00 0.00 0.00 53.44 53.09 3dnp n ALA 180 Cb 0.08 -1.47 -0.10 0.00 0.00 0.00 0.00 19.45 17.96 3dnp n ALA 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3dnp s VAL 181 N -2.59 1.71 0.17 0.00 -7.23 -0.79 -1.06 120.40 110.62 3dnp s VAL 181 Ca 0.27 -2.19 0.10 0.00 -1.81 0.00 0.00 61.98 58.36 3dnp s VAL 181 Cb 0.20 -2.18 -0.04 0.00 0.56 0.00 0.00 36.38 34.92 3dnp s VAL 181 CO 0.45 -0.50 -0.20 -1.81 -0.31 0.00 0.00 175.10 172.73 3dnp s ASP 182 N -3.36 3.69 -0.19 4.85 1.01 0.22 -4.62 116.67 118.28 3dnp s ASP 182 Ca 0.25 -0.73 -0.04 0.00 0.71 0.00 0.00 52.55 52.73 3dnp s ASP 182 Cb 0.01 -0.41 -0.02 0.00 1.01 0.00 0.00 42.92 43.50 3dnp s ASP 182 CO 0.09 0.13 -0.02 -0.69 0.21 0.00 0.00 175.17 174.89 3dnp s VAL 183 N -1.52 3.84 -0.22 -1.27 1.01 -1.26 -1.12 120.40 119.85 3dnp s VAL 183 Ca 0.21 -0.35 -0.05 0.00 0.00 0.00 0.00 61.98 61.78 3dnp s VAL 183 Cb -0.09 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.55 3dnp s VAL 183 CO 0.11 0.44 0.00 -0.63 0.00 0.00 0.00 175.10 175.02 3dnp s ILE 184 N 0.90 3.80 -0.25 2.22 1.01 0.12 -4.97 121.20 124.02 3dnp s ILE 184 Ca 0.00 -0.35 -0.28 0.00 0.00 0.00 0.00 60.65 60.02 3dnp s ILE 184 Cb -0.14 -2.74 0.01 0.00 0.01 0.00 0.00 42.46 39.59 3dnp s ILE 184 CO 0.02 0.40 1.02 -0.60 0.00 0.00 0.00 174.94 175.77 3dnp s ARG 185 N 1.40 4.20 -0.19 2.79 3.52 -1.26 -0.81 118.95 128.60 3dnp s ARG 185 Ca 0.05 1.23 -0.20 0.00 -0.13 0.00 0.00 55.73 56.67 3dnp s ARG 185 Cb -0.15 -3.66 -0.20 0.00 -1.56 0.00 0.00 34.95 29.38 3dnp s ARG 185 CO 0.00 -0.68 0.26 0.28 -0.81 0.00 0.00 175.30 174.36 3dnp h VAL 186 N 5.51 0.93 -2.23 7.11 2.07 -1.56 -3.17 116.25 124.91 3dnp h VAL 186 Ca -0.20 -2.21 -0.02 0.00 0.82 0.00 0.00 66.70 65.10 3dnp h VAL 186 Cb 1.06 2.31 -0.00 0.00 -1.52 0.00 0.00 31.29 33.14 3dnp h VAL 186 CO 0.98 0.39 0.03 -0.46 0.02 0.00 0.00 177.57 178.52 3dnp n ASN 187 N -4.34 -0.37 0.17 0.57 0.23 -1.06 -1.99 115.26 108.47 3dnp n ASN 187 Ca -0.31 -1.30 0.13 0.00 -0.53 0.00 0.00 54.58 52.57 3dnp n ASN 187 Cb 0.71 0.62 0.61 0.00 -2.08 0.00 0.00 39.78 39.64 3dnp n ASN 187 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3dnp h ASP 188 N 0.35 0.00 0.00 0.53 3.32 -1.97 -3.02 116.42 115.63 3dnp h ASP 188 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 3dnp h ASP 188 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3dnp h ASP 188 CO 0.07 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 176.97 3dnp n GLU 189 N -2.39 -0.69 -4.23 3.56 1.02 -1.26 -3.73 120.64 112.92 3dnp n GLU 189 Ca 0.00 -0.41 -0.20 0.00 -0.02 0.00 0.00 57.16 56.53 3dnp n GLU 189 Cb 0.15 -0.88 -0.16 0.00 -0.02 0.00 0.00 31.44 30.52 3dnp n GLU 189 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3dnp s LYS 190 N -0.02 0.93 0.06 3.49 2.20 -1.14 -1.43 119.74 123.83 3dnp s LYS 190 Ca 0.00 -0.16 0.09 0.00 -0.36 0.00 0.00 55.97 55.54 3dnp s LYS 190 Cb 0.00 -0.89 -0.03 0.00 -1.51 0.00 0.00 37.83 35.40 3dnp s LYS 190 CO 0.00 -0.05 -0.23 -0.51 -0.36 0.00 0.00 175.35 174.20 3dnp s LEU 191 N 0.79 2.39 -0.13 5.43 1.43 -0.21 -1.31 118.68 127.07 3dnp s LEU 191 Ca -0.11 -0.55 -0.03 0.00 -1.03 0.00 0.00 54.13 52.41 3dnp s LEU 191 Cb -0.14 -1.38 -0.03 0.00 0.03 0.00 0.00 46.19 44.67 3dnp s LEU 191 CO 0.01 0.24 -0.04 0.20 0.23 0.00 0.00 176.35 176.99 3dnp s ASN 192 N -1.49 4.80 -0.22 2.29 0.01 0.01 -0.63 114.94 119.71 3dnp s ASN 192 Ca 0.14 -0.09 -0.08 0.00 -0.71 0.00 0.00 52.86 52.12 3dnp s ASN 192 Cb -0.10 -1.64 -0.04 0.00 0.41 0.00 0.00 41.25 39.88 3dnp s ASN 192 CO 0.04 0.22 0.09 -0.63 -1.51 0.00 0.00 177.10 175.31 3dnp s ILE 193 N 0.03 4.70 0.18 0.60 1.01 0.56 0.11 121.20 128.39 3dnp s ILE 193 Ca 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 60.65 60.63 3dnp s ILE 193 Cb -0.13 -3.17 -0.05 0.00 0.01 0.00 0.00 42.46 39.12 3dnp s ILE 193 CO 0.03 0.38 -0.03 0.68 0.00 0.00 0.00 174.94 175.99 3dnp s VAL 194 N 1.06 0.93 0.71 2.92 -7.23 -0.28 -1.26 120.40 117.26 3dnp s VAL 194 Ca 0.05 -2.02 -0.16 0.00 -1.81 0.00 0.00 61.98 58.04 3dnp s VAL 194 Cb -0.14 -2.08 0.02 0.00 0.56 0.00 0.00 36.38 34.74 3dnp s VAL 194 CO 0.03 -0.53 1.20 -2.65 -0.31 0.00 0.00 175.10 172.84 3dnp n PRO 195 N -0.27 0.71 -1.71 4.82 -0.02 -1.26 -0.61 135.00 136.66 3dnp n PRO 195 Ca -0.07 0.31 -0.43 0.00 -2.02 0.00 0.00 63.50 61.28 3dnp n PRO 195 Cb 0.62 -2.44 -0.02 0.00 -0.02 0.00 0.00 33.50 31.64 3dnp n PRO 195 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3dnp n LYS 196 N -2.31 2.41 -0.09 -0.52 4.81 -0.22 -1.56 118.16 120.68 3dnp n LYS 196 Ca 0.15 0.86 0.00 0.00 -0.87 0.00 0.00 58.31 58.45 3dnp n LYS 196 Cb 0.49 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 32.94 3dnp n LYS 196 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dnp n GLY 197 N 2.43 1.60 3.76 3.14 0.00 -1.26 -4.96 105.19 109.90 3dnp n GLY 197 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3dnp n GLY 197 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dnp s VAL 198 N -2.68 4.47 0.05 1.61 1.01 -0.60 -4.85 120.40 119.41 3dnp s VAL 198 Ca 0.00 1.76 -0.28 0.00 0.00 0.00 0.00 61.98 63.46 3dnp s VAL 198 Cb 0.00 -4.17 0.09 0.00 0.00 0.00 0.00 36.38 32.30 3dnp s VAL 198 CO 0.00 0.45 1.04 -0.94 0.00 0.00 0.00 175.10 175.64 3dnp s SER 199 N -0.66 -0.19 0.19 3.32 1.04 -1.23 -4.90 113.70 111.27 3dnp s SER 199 Ca 0.38 -0.21 -0.11 0.00 0.48 0.00 0.00 55.95 56.49 3dnp s SER 199 Cb -0.23 0.36 0.20 0.00 0.10 0.00 0.00 66.02 66.45 3dnp s SER 199 CO 0.26 -0.64 1.78 0.11 0.98 0.00 0.00 173.24 175.73 3dnp h LYS 200 N 2.00 0.49 -0.27 4.02 1.57 -1.80 -0.66 116.57 121.93 3dnp h LYS 200 Ca -0.23 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.39 3dnp h LYS 200 Cb 1.22 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 3dnp h LYS 200 CO 0.27 0.32 -0.38 1.05 -0.57 0.00 0.00 179.45 180.15 3dnp h GLU 201 N 0.51 0.61 -0.50 3.15 9.09 -1.91 -0.79 114.58 124.74 3dnp h GLU 201 Ca 0.26 -0.30 -0.12 0.00 0.05 0.00 0.00 59.36 59.25 3dnp h GLU 201 Cb 0.22 -0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.30 3dnp h GLU 201 CO -0.21 0.89 -0.16 0.00 0.05 0.00 0.00 179.01 179.59 3dnp h ALA 202 N 1.08 0.76 -0.20 1.06 0.00 -1.83 -0.96 119.26 119.17 3dnp h ALA 202 Ca 0.05 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 3dnp h ALA 202 Cb 0.88 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3dnp h ALA 202 CO 0.08 0.67 -0.02 0.78 0.00 0.00 0.00 179.25 180.75 3dnp h GLY 203 N 0.92 0.40 0.69 0.00 0.00 -0.89 -1.59 103.07 102.59 3dnp h GLY 203 Ca 0.13 -0.31 0.05 0.00 0.00 0.00 0.00 47.33 47.20 3dnp h GLY 203 CO 0.06 0.28 0.27 -2.00 0.00 0.00 0.00 176.54 175.15 3dnp h LEU 204 N 0.11 0.38 -1.05 3.11 5.85 -1.14 -1.27 115.31 121.30 3dnp h LEU 204 Ca 0.05 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3dnp h LEU 204 Cb 0.44 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 3dnp h LEU 204 CO 0.01 0.26 0.64 0.00 -0.34 0.00 0.00 178.44 179.01 3dnp h ALA 205 N 1.30 1.40 -0.60 1.25 0.00 -0.96 -0.61 119.26 121.03 3dnp h ALA 205 Ca 0.24 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 3dnp h ALA 205 Cb 0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3dnp h ALA 205 CO -0.17 0.49 -0.02 1.25 0.00 0.00 0.00 179.25 180.80 3dnp h LEU 206 N 1.19 1.06 -0.29 0.00 5.85 -0.56 -0.89 115.31 121.67 3dnp h LEU 206 Ca 0.40 -0.31 -0.10 0.00 0.84 0.00 0.00 57.88 58.71 3dnp h LEU 206 Cb 0.08 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 3dnp h LEU 206 CO -0.14 1.11 -0.22 0.58 -0.34 0.00 0.00 178.44 179.44 3dnp h VAL 207 N 0.98 1.30 -0.37 1.05 2.07 -0.85 -1.51 116.25 118.91 3dnp h VAL 207 Ca 0.17 -1.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.32 3dnp h VAL 207 Cb 0.58 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 3dnp h VAL 207 CO 0.03 0.43 0.21 0.00 0.02 0.00 0.00 177.57 178.27 3dnp h ALA 208 N 0.72 0.48 -0.63 1.67 0.00 -1.01 -2.03 119.26 118.46 3dnp h ALA 208 Ca 0.06 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.93 3dnp h ALA 208 Cb 0.77 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 3dnp h ALA 208 CO 0.06 0.00 0.37 0.66 0.00 0.00 0.00 179.25 180.34 3dnp h SER 209 N 0.48 0.57 -0.51 0.00 4.64 -1.11 0.69 113.55 118.32 3dnp h SER 209 Ca 0.13 0.02 0.05 0.00 -0.47 0.00 0.00 61.79 61.51 3dnp h SER 209 Cb 0.05 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 3dnp h SER 209 CO -0.02 0.39 0.34 -0.08 -0.87 0.00 0.00 176.83 176.59 3dnp h GLU 210 N 0.71 0.50 -0.08 4.77 4.57 -0.86 -1.29 114.58 122.90 3dnp h GLU 210 Ca 0.27 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.42 3dnp h GLU 210 Cb 0.10 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 3dnp h GLU 210 CO -0.14 0.33 0.00 1.28 -1.18 0.00 0.00 179.01 179.30 3dnp n LEU 211 N -4.47 1.10 -0.34 1.64 4.77 -0.65 -4.91 117.00 114.13 3dnp n LEU 211 Ca 0.06 -0.43 -0.04 0.00 -0.03 0.00 0.00 56.01 55.57 3dnp n LEU 211 Cb 0.19 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 3dnp n LEU 211 CO 0.35 0.22 -0.04 0.61 -1.33 0.00 0.00 177.39 177.19 3dnp n GLY 212 N 1.06 0.73 3.74 -0.72 0.00 -0.49 -5.04 105.19 104.47 3dnp n GLY 212 Ca 0.17 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 45.11 3dnp n GLY 212 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dnp s LEU 213 N -1.02 3.46 0.00 0.99 1.43 0.14 -5.00 118.68 118.69 3dnp s LEU 213 Ca 0.00 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.59 3dnp s LEU 213 Cb 0.00 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.23 3dnp s LEU 213 CO 0.00 -0.09 0.00 -1.54 0.23 0.00 0.00 176.35 174.95 3dnp n SER 214 N -1.08 0.00 0.00 2.29 3.41 -1.26 -3.49 113.62 113.49 3dnp n SER 214 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 3dnp n SER 214 Cb 0.59 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 3dnp n SER 214 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3dnp n ASP 216 N 0.00 0.00 -0.61 4.04 2.03 -1.26 -3.92 116.55 116.83 3dnp n ASP 216 Ca 0.00 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.42 3dnp n ASP 216 Cb 0.00 -0.01 0.36 0.00 -0.72 0.00 0.00 41.12 40.75 3dnp n ASP 216 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3dnp n ASP 217 N 0.00 1.84 -4.63 1.67 8.00 -1.26 -4.04 116.55 118.12 3dnp n ASP 217 Ca 0.00 -1.73 -0.35 0.00 0.71 0.00 0.00 54.79 53.42 3dnp n ASP 217 Cb 0.00 -0.11 -0.10 0.00 -0.02 0.00 0.00 41.12 40.89 3dnp n ASP 217 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3dnp s VAL 218 N -1.77 4.39 -0.24 2.53 1.01 -1.25 -0.84 120.40 124.22 3dnp s VAL 218 Ca 0.33 -0.20 -0.10 0.00 0.00 0.00 0.00 61.98 62.01 3dnp s VAL 218 Cb 0.18 -2.90 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 3dnp s VAL 218 CO 0.27 0.54 0.14 -0.69 0.00 0.00 0.00 175.10 175.36 3dnp s VAL 219 N -0.26 5.09 -0.09 2.92 1.01 0.31 -1.57 120.40 127.81 3dnp s VAL 219 Ca 0.06 0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.17 3dnp s VAL 219 Cb -0.12 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.88 3dnp s VAL 219 CO 0.02 0.34 -0.23 0.00 0.00 0.00 0.00 175.10 175.23 3dnp s ALA 220 N 1.21 2.08 -0.22 5.51 0.00 -0.18 -0.54 121.76 129.61 3dnp s ALA 220 Ca 0.06 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.11 3dnp s ALA 220 Cb -0.14 -0.77 0.03 0.00 0.00 0.00 0.00 23.12 22.24 3dnp s ALA 220 CO 0.05 0.28 -0.13 0.42 0.00 0.00 0.00 175.76 176.38 3dnp s ILE 221 N 0.33 2.34 0.39 0.00 1.01 -0.16 -0.76 121.20 124.35 3dnp s ILE 221 Ca -0.17 -1.16 0.04 0.00 0.00 0.00 0.00 60.65 59.36 3dnp s ILE 221 Cb -0.17 -2.16 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 3dnp s ILE 221 CO 0.08 0.28 0.14 -0.83 0.00 0.00 0.00 174.94 174.61 3dnp s GLY 222 N 1.25 2.53 0.00 6.18 0.00 -0.65 -2.08 107.32 114.54 3dnp s GLY 222 Ca -0.00 -1.36 0.00 0.00 0.00 0.00 0.00 44.72 43.35 3dnp s GLY 222 CO -0.08 -1.79 0.00 -2.39 0.00 0.00 0.00 173.10 168.84 3dnp n HIS 223 N -0.86 0.00 -4.63 1.90 1.44 -1.26 -4.37 115.22 107.43 3dnp n HIS 223 Ca -0.05 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.37 3dnp n HIS 223 Cb 0.65 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.68 3dnp n HIS 223 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 3dnp s GLN 224 N 0.00 2.07 0.38 -1.40 -0.21 -1.26 -4.29 119.66 114.95 3dnp s GLN 224 Ca 0.00 -2.30 0.07 0.00 0.02 0.00 0.00 55.36 53.15 3dnp s GLN 224 Cb 0.00 -1.02 0.79 0.00 1.00 0.00 0.00 33.01 33.78 3dnp s GLN 224 CO 0.00 -0.44 2.00 1.88 -2.12 0.00 0.00 175.29 176.60 3dnp h TYR 225 N 1.57 0.66 0.00 0.91 0.05 -1.66 -0.82 116.97 117.69 3dnp h TYR 225 Ca -0.39 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.41 3dnp h TYR 225 Cb 1.29 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 38.81 3dnp h TYR 225 CO 1.57 0.38 0.00 -0.40 -1.05 0.00 0.00 178.16 178.65 3dnp n ASP 226 N -4.47 0.56 0.03 3.88 5.75 -1.20 -1.59 116.55 119.52 3dnp n ASP 226 Ca 0.08 0.61 0.12 0.00 -0.01 0.00 0.00 54.79 55.60 3dnp n ASP 226 Cb 0.17 -0.74 0.31 0.00 -1.03 0.00 0.00 41.12 39.83 3dnp n ASP 226 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3dnp n ASP 227 N -2.09 0.49 -0.16 -1.12 8.00 -0.32 -4.45 116.55 116.90 3dnp n ASP 227 Ca 0.03 0.08 -0.04 0.00 0.71 0.00 0.00 54.79 55.57 3dnp n ASP 227 Cb 0.27 -0.01 0.05 0.00 -0.02 0.00 0.00 41.12 41.42 3dnp n ASP 227 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3dnp h LEU 228 N 0.00 0.35 -1.56 0.64 3.38 -1.28 -1.58 115.31 115.25 3dnp h LEU 228 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3dnp h LEU 228 Cb 0.60 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3dnp h LEU 228 CO 0.00 0.24 0.00 -2.65 0.09 0.00 0.00 178.44 176.12 3dnp n PRO 229 N -4.89 0.00 0.00 1.13 -0.02 -1.26 -0.67 135.00 129.28 3dnp n PRO 229 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 3dnp n PRO 229 Cb 0.14 -1.21 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 3dnp n PRO 229 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3dnp n ILE 231 N 0.73 0.00 -0.09 4.25 5.41 -0.60 -0.68 119.36 128.38 3dnp n ILE 231 Ca 0.00 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.62 3dnp n ILE 231 Cb 0.00 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 38.92 3dnp n ILE 231 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 3dnp h GLU 232 N 0.00 0.85 0.00 0.38 4.81 -1.16 -3.32 114.58 116.14 3dnp h GLU 232 Ca 0.00 -0.48 -0.20 0.00 -0.13 0.00 0.00 59.36 58.55 3dnp h GLU 232 Cb 0.00 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 3dnp h GLU 232 CO 0.00 1.12 -1.13 -0.07 -0.73 0.00 0.00 179.01 178.20 3dnp h LEU 233 N 0.68 0.00-10.12 1.64 3.38 -1.15 -3.47 115.31 106.28 3dnp h LEU 233 Ca 0.04 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.49 3dnp h LEU 233 Cb 1.03 0.00 0.11 0.00 0.09 0.00 0.00 40.66 41.90 3dnp h LEU 233 CO 0.10 0.84 0.45 0.00 0.09 0.00 0.00 178.44 179.92 3dnp s ALA 234 N -2.76 2.49 0.27 1.53 0.00 -1.25 -4.56 121.76 117.47 3dnp s ALA 234 Ca -0.00 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.88 3dnp s ALA 234 Cb 0.09 -3.43 0.56 0.00 0.00 0.00 0.00 23.12 20.34 3dnp s ALA 234 CO 0.81 -1.23 1.79 0.78 0.00 0.00 0.00 175.76 177.90 3dnp h GLY 235 N 0.66 1.51 -7.15 0.00 0.00 -1.46 -3.37 103.07 93.26 3dnp h GLY 235 Ca -0.50 -0.33 -0.52 0.00 0.00 0.00 0.00 47.33 45.99 3dnp h GLY 235 CO 0.54 0.03 -0.78 -2.27 0.00 0.00 0.00 176.54 174.07 3dnp s LEU 236 N -10.30 1.30 -0.21 3.11 2.96 -0.61 -5.01 118.68 109.92 3dnp s LEU 236 Ca -0.12 -0.64 -0.05 0.00 -0.22 0.00 0.00 54.13 53.10 3dnp s LEU 236 Cb 0.22 -0.72 -0.02 0.00 0.50 0.00 0.00 46.19 46.17 3dnp s LEU 236 CO 0.79 -0.23 0.01 -0.83 -1.32 0.00 0.00 176.35 174.76 3dnp s GLY 237 N 1.77 1.72 -0.10 7.98 0.00 -1.25 -1.01 107.32 116.43 3dnp s GLY 237 Ca 0.01 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 43.74 3dnp s GLY 237 CO -0.07 0.29 -0.21 0.14 0.00 0.00 0.00 173.10 173.25 3dnp s VAL 238 N 1.12 2.36 0.00 1.40 1.01 0.06 -0.94 120.40 125.41 3dnp s VAL 238 Ca 0.03 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.08 3dnp s VAL 238 Cb -0.14 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.32 3dnp s VAL 238 CO 0.02 0.56 0.00 0.00 0.00 0.00 0.00 175.10 175.67 3dnp n ALA 239 N 3.33 0.00 -0.07 5.51 0.00 -0.30 -1.64 120.51 127.33 3dnp n ALA 239 Ca -0.18 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.20 3dnp n ALA 239 Cb 0.53 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.82 3dnp n ALA 239 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dnp n GLY 241 N 5.00 -1.01 0.16 0.00 0.00 -0.64 -1.18 105.19 107.53 3dnp n GLY 241 Ca 0.00 -0.35 0.15 0.00 0.00 0.00 0.00 46.02 45.82 3dnp n GLY 241 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dnp n ASN 242 N -2.67 0.53 -4.77 1.61 6.94 -1.26 -4.76 115.26 110.88 3dnp n ASN 242 Ca -0.26 -1.04 -0.33 0.00 -0.02 0.00 0.00 54.58 52.93 3dnp n ASN 242 Cb 1.03 -0.02 0.05 0.00 -2.36 0.00 0.00 39.78 38.47 3dnp n ASN 242 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3dnp s ALA 243 N -2.11 2.44 0.67 -2.53 0.00 -1.26 -5.01 121.76 113.95 3dnp s ALA 243 Ca 0.41 0.59 -0.16 0.00 0.00 0.00 0.00 51.96 52.79 3dnp s ALA 243 Cb 0.21 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 20.00 3dnp s ALA 243 CO 0.38 -1.33 1.17 0.14 0.00 0.00 0.00 175.76 176.12 3dnp s VAL 244 N -2.29 2.75 0.32 0.00 -7.23 -1.26 -4.77 120.40 107.91 3dnp s VAL 244 Ca 0.68 0.39 0.10 0.00 -1.81 0.00 0.00 61.98 61.34 3dnp s VAL 244 Cb -0.21 -2.98 0.31 0.00 0.56 0.00 0.00 36.38 34.06 3dnp s VAL 244 CO 0.42 -0.18 1.72 -0.65 -0.31 0.00 0.00 175.10 176.09 3dnp h PRO 245 N 0.16 0.52 -0.60 4.82 0.11 -1.96 -1.68 132.00 133.37 3dnp h PRO 245 Ca -0.48 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.62 3dnp h PRO 245 Cb 1.28 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 3dnp h PRO 245 CO 0.53 0.34 0.38 1.49 -0.21 0.00 0.00 178.00 180.53 3dnp h GLU 246 N 0.53 0.73 -0.60 1.05 4.81 -1.99 0.14 114.58 119.26 3dnp h GLU 246 Ca 0.66 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.78 3dnp h GLU 246 Cb 1.30 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 3dnp h GLU 246 CO -0.50 0.48 0.13 0.82 -0.73 0.00 0.00 179.01 179.21 3dnp h ILE 247 N 0.75 1.25 -0.69 2.32 2.04 -1.69 -2.29 117.51 119.21 3dnp h ILE 247 Ca 0.23 -0.94 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 3dnp h ILE 247 Cb -0.02 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 3dnp h ILE 247 CO -0.08 0.35 0.30 0.11 0.00 0.00 0.00 178.15 178.83 3dnp h LYS 248 N 0.87 1.01 -0.24 2.37 1.57 -0.77 -2.00 116.57 119.38 3dnp h LYS 248 Ca 0.19 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 3dnp h LYS 248 Cb 0.38 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 3dnp h LYS 248 CO 0.01 0.80 -0.14 0.00 -0.57 0.00 0.00 179.45 179.55 3dnp h ARG 249 N 0.99 0.40 0.00 3.15 3.08 -0.53 -3.20 114.38 118.27 3dnp h ARG 249 Ca 0.24 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 3dnp h ARG 249 Cb 0.15 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 3dnp h ARG 249 CO -0.02 0.54 -0.35 0.87 -1.07 0.00 0.00 179.97 179.93 3dnp h LYS 250 N 0.37 0.00 -7.32 0.04 1.57 -0.80 -3.46 116.57 106.97 3dnp h LYS 250 Ca 0.07 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.34 3dnp h LYS 250 Cb 0.47 0.00 0.13 0.00 0.08 0.00 0.00 32.23 32.90 3dnp h LYS 250 CO 0.03 0.13 0.31 0.00 -0.57 0.00 0.00 179.45 179.36 3dnp s ALA 251 N -3.16 2.20 0.04 3.86 0.00 -0.87 -4.86 121.76 118.97 3dnp s ALA 251 Ca 0.05 0.20 0.14 0.00 0.00 0.00 0.00 51.96 52.35 3dnp s ALA 251 Cb 0.07 -3.25 0.24 0.00 0.00 0.00 0.00 23.12 20.18 3dnp s ALA 251 CO 0.71 -1.79 1.52 -0.44 0.00 0.00 0.00 175.76 175.76 3dnp h ASP 252 N -1.15 0.00 -3.48 0.00 3.32 -1.35 -3.46 116.42 110.31 3dnp h ASP 252 Ca -0.44 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.47 3dnp h ASP 252 Cb 1.24 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.52 3dnp h ASP 252 CO 0.52 0.56 -0.33 0.86 -1.72 0.00 0.00 179.24 179.14 3dnp s TRP 253 N -3.18 -0.48 -0.17 4.55 -0.11 -1.11 -5.02 118.94 113.42 3dnp s TRP 253 Ca 0.02 1.09 -0.03 0.00 1.22 0.00 0.00 56.10 58.39 3dnp s TRP 253 Cb 0.10 0.18 -0.02 0.00 -1.50 0.00 0.00 33.47 32.23 3dnp s TRP 253 CO 0.74 -0.27 -0.05 0.08 -4.62 0.00 0.00 176.95 172.83 3dnp s VAL 254 N 0.94 3.58 0.30 5.86 1.01 -1.26 -1.15 120.40 129.68 3dnp s VAL 254 Ca -0.06 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.51 3dnp s VAL 254 Cb -0.07 -2.58 0.04 0.00 0.00 0.00 0.00 36.38 33.77 3dnp s VAL 254 CO -0.07 0.47 0.32 1.07 0.00 0.00 0.00 175.10 176.89 3dnp n THR 255 N 3.95 0.00 -1.30 3.92 5.66 -0.32 -4.97 114.28 121.22 3dnp n THR 255 Ca -0.18 -1.11 -0.29 0.00 -3.05 0.00 0.00 64.05 59.42 3dnp n THR 255 Cb 0.52 -0.47 0.18 0.00 -1.55 0.00 0.00 70.33 69.01 3dnp n THR 255 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 3dnp s ARG 256 N -3.30 0.18 0.94 1.09 0.52 -1.26 -1.99 118.95 115.13 3dnp s ARG 256 Ca 0.24 0.22 -0.13 0.00 -0.52 0.00 0.00 55.73 55.54 3dnp s ARG 256 Cb -0.02 -1.73 0.16 0.00 0.52 0.00 0.00 34.95 33.87 3dnp s ARG 256 CO 0.15 -2.84 1.13 -1.54 0.02 0.00 0.00 175.30 172.23 3dnp s SER 257 N -3.84 3.20 0.33 0.23 1.04 -1.26 -1.62 113.70 111.79 3dnp s SER 257 Ca 0.67 0.96 0.26 0.00 0.48 0.00 0.00 55.95 58.32 3dnp s SER 257 Cb -0.14 -1.52 1.12 0.00 0.10 0.00 0.00 66.02 65.58 3dnp s SER 257 CO 0.56 -2.74 1.77 -0.55 0.98 0.00 0.00 173.24 173.26 3dnp h ASN 258 N -1.63 0.00 -0.27 7.02 -1.07 -1.86 -1.16 115.58 116.62 3dnp h ASN 258 Ca -0.51 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.86 3dnp h ASN 258 Cb 1.33 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.58 3dnp h ASN 258 CO 0.59 0.00 0.00 0.47 0.07 0.00 0.00 177.43 178.56 3dnp n ASP 259 N -2.42 2.54 -1.57 6.14 8.00 -1.26 -4.02 116.55 123.97 3dnp n ASP 259 Ca 0.01 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.66 3dnp n ASP 259 Cb 0.21 -0.17 0.08 0.00 -0.02 0.00 0.00 41.12 41.22 3dnp n ASP 259 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3dnp n GLU 260 N 0.90 1.18 -3.76 -1.24 4.07 -0.55 -5.01 120.64 116.24 3dnp n GLU 260 Ca 0.17 -2.89 -0.22 0.00 -0.06 0.00 0.00 57.16 54.16 3dnp n GLU 260 Cb 0.47 -1.01 0.02 0.00 -0.06 0.00 0.00 31.44 30.86 3dnp n GLU 260 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 3dnp n GLN 261 N -0.29 -4.64 0.12 5.31 3.00 -1.09 -4.61 117.38 115.18 3dnp n GLN 261 Ca 0.14 0.58 0.01 0.00 -0.01 0.00 0.00 57.00 57.72 3dnp n GLN 261 Cb 0.94 -5.08 0.34 0.00 0.00 0.00 0.00 30.24 26.44 3dnp n GLN 261 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 3dnp h GLY 262 N -1.87 0.24 0.90 1.08 0.00 -1.40 -1.20 103.07 100.82 3dnp h GLY 262 Ca -0.61 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 46.53 3dnp h GLY 262 CO 0.58 0.16 -0.19 -2.08 0.00 0.00 0.00 176.54 175.01 3dnp h VAL 263 N 0.20 0.62 -0.94 4.60 2.07 -1.83 -3.09 116.25 117.87 3dnp h VAL 263 Ca 0.03 -0.19 0.07 0.00 0.82 0.00 0.00 66.70 67.43 3dnp h VAL 263 Cb 0.53 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 3dnp h VAL 263 CO 0.04 0.04 0.60 0.00 0.02 0.00 0.00 177.57 178.26 3dnp h ALA 264 N -0.06 1.32 0.00 1.67 0.00 -1.83 -3.42 119.26 116.94 3dnp h ALA 264 Ca -0.05 -0.01 -0.53 0.00 0.00 0.00 0.00 54.91 54.31 3dnp h ALA 264 Cb 0.46 -0.27 0.08 0.00 0.00 0.00 0.00 17.79 18.07 3dnp h ALA 264 CO 0.09 0.36 1.80 0.98 0.00 0.00 0.00 179.25 182.48 3dnp n TYR 265 N -4.56 0.84 0.00 0.00 9.36 -0.47 -4.65 117.16 117.69 3dnp n TYR 265 Ca 0.14 -1.14 0.00 0.00 3.32 0.00 0.00 57.90 60.23 3dnp n TYR 265 Cb 0.19 -1.18 0.00 0.00 -0.63 0.00 0.00 39.34 37.72 3dnp n TYR 265 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 3dnp n LYS 268 N 6.95 0.00 -0.19 2.98 3.00 -1.26 -4.75 118.16 124.89 3dnp n LYS 268 Ca 0.43 0.00 -0.09 0.00 -0.00 0.00 0.00 58.31 58.65 3dnp n LYS 268 Cb 0.34 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.39 3dnp n LYS 268 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 3dnp h GLU 269 N 0.00 0.86 -0.71 1.64 4.57 -1.96 -1.13 114.58 117.85 3dnp h GLU 269 Ca 0.00 -0.20 0.14 0.00 -1.18 0.00 0.00 59.36 58.12 3dnp h GLU 269 Cb 0.00 -0.11 -0.10 0.00 -0.16 0.00 0.00 28.75 28.38 3dnp h GLU 269 CO 0.00 0.81 0.22 -0.92 -1.18 0.00 0.00 179.01 177.94 3dnp h TYR 270 N 0.76 0.36 -0.07 0.92 5.03 -1.96 -2.42 116.97 119.60 3dnp h TYR 270 Ca 0.17 0.04 -0.21 0.00 2.58 0.00 0.00 58.73 61.31 3dnp h TYR 270 Cb 0.33 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.56 3dnp h TYR 270 CO 0.02 -0.01 -0.81 0.74 -1.32 0.00 0.00 178.16 176.78 3dnp h PHE 271 N 0.34 0.68 0.00 -3.82 0.04 -1.92 -1.80 116.94 110.47 3dnp h PHE 271 Ca 0.39 -0.32 0.00 0.00 2.80 0.00 0.00 57.97 60.84 3dnp h PHE 271 Cb 0.62 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.67 3dnp h PHE 271 CO -0.22 1.11 0.00 0.54 -0.60 0.00 0.00 178.31 179.15 3dnp n ARG 272 N -3.83 0.00 0.00 1.51 1.74 -0.45 -0.78 116.66 114.85 3dnp n ARG 272 Ca -0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 3dnp n ARG 272 Cb 0.76 -1.19 0.00 0.00 -1.02 0.00 0.00 32.46 31.00 3dnp n ARG 272 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3dnp n GLN 274 N 0.73 0.00 -0.28 5.56 1.13 -0.68 -1.29 117.38 122.55 3dnp n GLN 274 Ca 0.00 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.01 3dnp n GLN 274 Cb 0.00 0.00 0.06 0.00 0.11 0.00 0.00 30.24 30.41 3dnp n GLN 274 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 3dnp h GLN 275 N 0.00 1.07 -0.30 -1.09 4.15 -1.25 -2.92 115.11 114.77 3dnp h GLN 275 Ca 0.00 -0.12 -0.03 0.00 0.77 0.00 0.00 58.65 59.28 3dnp h GLN 275 Cb 0.00 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.46 3dnp h GLN 275 CO 0.00 0.78 0.08 0.00 -1.93 0.00 0.00 178.83 177.76 3dnp h ARG 276 N 1.06 0.46 0.00 1.69 3.08 -1.45 -3.55 114.38 115.69 3dnp h ARG 276 Ca 0.27 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.22 3dnp h ARG 276 Cb 0.01 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 29.99 3dnp h ARG 276 CO -0.05 0.53 0.00 1.63 -1.07 0.00 0.00 179.97 181.01