#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dt3 s VAL 2 N 0.00 0.80 0.70 2.62 -7.23 -1.16 -4.66 120.40 111.46 1dt3 s VAL 2 Ca 0.00 -1.86 -0.11 0.00 -1.81 0.00 0.00 61.98 58.21 1dt3 s VAL 2 Cb 0.00 -1.59 0.01 0.00 0.56 0.00 0.00 36.38 35.36 1dt3 s VAL 2 CO 0.00 -0.78 1.06 -0.94 -0.31 0.00 0.00 175.10 174.14 1dt3 s SER 3 N -2.88 5.41 0.18 4.85 1.04 -1.26 -4.77 113.70 116.27 1dt3 s SER 3 Ca 0.10 1.52 -0.12 0.00 0.48 0.00 0.00 55.95 57.93 1dt3 s SER 3 Cb 0.03 -2.40 0.16 0.00 0.10 0.00 0.00 66.02 63.90 1dt3 s SER 3 CO -0.03 -1.41 1.78 -0.61 0.98 0.00 0.00 173.24 173.95 1dt3 h GLN 4 N -0.70 0.49 0.38 4.02 5.75 -1.98 0.36 115.11 123.43 1dt3 h GLN 4 Ca -0.44 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.02 1dt3 h GLN 4 Cb 1.22 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 29.63 1dt3 h GLN 4 CO 0.58 0.33 -0.37 0.22 -2.65 0.00 0.00 178.83 176.94 1dt3 h ASP 5 N 0.51 -1.00 -0.78 -0.69 3.58 -2.00 0.20 116.42 116.24 1dt3 h ASP 5 Ca 0.24 0.08 0.02 0.00 0.42 0.00 0.00 57.03 57.79 1dt3 h ASP 5 Cb 0.16 0.33 -0.04 0.00 1.72 0.00 0.00 39.33 41.50 1dt3 h ASP 5 CO -0.17 -0.52 0.51 0.25 -2.88 0.00 0.00 179.24 176.44 1dt3 h LEU 6 N -0.77 0.86 -0.47 2.28 5.85 -1.82 -1.48 115.31 119.76 1dt3 h LEU 6 Ca -0.03 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1dt3 h LEU 6 Cb 0.69 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1dt3 h LEU 6 CO -0.06 0.61 0.26 0.15 -0.34 0.00 0.00 178.44 179.06 1dt3 h PHE 7 N 1.01 0.65 -0.65 1.25 3.57 0.15 0.18 116.94 123.10 1dt3 h PHE 7 Ca 0.30 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.89 1dt3 h PHE 7 Cb -0.05 -0.21 -0.08 0.00 2.79 0.00 0.00 35.95 38.40 1dt3 h PHE 7 CO -0.00 0.49 0.24 -0.91 -2.23 0.00 0.00 178.31 175.89 1dt3 h ASN 8 N 0.62 0.22 0.25 0.41 2.35 0.06 -0.17 115.58 119.32 1dt3 h ASN 8 Ca 0.17 0.09 -0.20 0.00 -0.55 0.00 0.00 56.30 55.81 1dt3 h ASN 8 Cb 0.05 0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1dt3 h ASN 8 CO -0.03 0.12 -0.78 1.56 -1.65 0.00 0.00 177.43 176.65 1dt3 h GLN 9 N 0.41 0.43 -0.52 0.81 4.20 -0.93 -1.77 115.11 117.74 1dt3 h GLN 9 Ca 0.34 -0.37 0.03 0.00 0.06 0.00 0.00 58.65 58.70 1dt3 h GLN 9 Cb 0.45 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 1dt3 h GLN 9 CO -0.34 1.02 0.30 0.74 -0.67 0.00 0.00 178.83 179.88 1dt3 h PHE 10 N 0.28 0.56 -0.39 2.96 -1.00 0.07 -1.59 116.94 117.84 1dt3 h PHE 10 Ca -0.04 0.02 -0.06 0.00 2.81 0.00 0.00 57.97 60.69 1dt3 h PHE 10 Cb 1.38 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 40.74 1dt3 h PHE 10 CO 0.05 0.31 -0.03 -0.97 -1.61 0.00 0.00 178.31 176.06 1dt3 h ASN 11 N 0.59 0.60 0.95 2.17 -1.24 -0.79 -1.54 115.58 116.33 1dt3 h ASN 11 Ca 0.21 -0.14 -0.14 0.00 0.71 0.00 0.00 56.30 56.95 1dt3 h ASN 11 Cb 0.04 -0.16 -0.02 0.00 0.73 0.00 0.00 38.32 38.92 1dt3 h ASN 11 CO -0.11 0.69 -0.65 0.25 -1.29 0.00 0.00 177.43 176.33 1dt3 h LEU 12 N 0.59 0.00 0.00 0.34 5.85 -1.14 -2.43 115.31 118.52 1dt3 h LEU 12 Ca 0.12 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1dt3 h LEU 12 Cb 0.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1dt3 h LEU 12 CO 0.02 0.65 -0.55 0.49 -0.34 0.00 0.00 178.44 178.70 1dt3 n PHE 13 N -3.50 0.62 0.08 1.25 3.72 -0.61 -1.77 117.46 117.25 1dt3 n PHE 13 Ca 0.00 0.18 -0.07 0.00 -0.05 0.00 0.00 57.45 57.51 1dt3 n PHE 13 Cb 0.71 -0.70 0.06 0.00 -0.94 0.00 0.00 39.48 38.60 1dt3 n PHE 13 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1dt3 h ALA 14 N 2.50 0.69 0.12 4.37 0.00 -1.13 0.13 119.26 125.95 1dt3 h ALA 14 Ca 0.00 -0.62 -0.27 0.00 0.00 0.00 0.00 54.91 54.01 1dt3 h ALA 14 Cb 0.75 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1dt3 h ALA 14 CO 0.00 0.81 -1.22 1.96 0.00 0.00 0.00 179.25 180.80 1dt3 h GLN 15 N 0.16 0.32 -0.59 0.00 4.20 -1.13 0.42 115.11 118.48 1dt3 h GLN 15 Ca -0.02 -0.51 -0.05 0.00 0.06 0.00 0.00 58.65 58.12 1dt3 h GLN 15 Cb 1.29 0.18 -0.03 0.00 0.30 0.00 0.00 27.48 29.22 1dt3 h GLN 15 CO 0.11 1.22 0.15 1.88 -0.67 0.00 0.00 178.83 181.53 1dt3 h TYR 16 N 0.11 0.94 -0.16 2.96 0.05 -1.27 0.54 116.97 120.14 1dt3 h TYR 16 Ca -0.14 -0.09 -0.12 0.00 0.05 0.00 0.00 58.73 58.43 1dt3 h TYR 16 Cb 1.92 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 39.38 1dt3 h TYR 16 CO 0.07 0.78 -0.43 0.77 -1.05 0.00 0.00 178.16 178.30 1dt3 h SER 17 N 0.88 0.39 -0.48 3.88 0.02 -0.39 -2.77 113.55 115.08 1dt3 h SER 17 Ca 0.19 -0.17 -0.13 0.00 -0.84 0.00 0.00 61.79 60.84 1dt3 h SER 17 Cb 0.30 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1dt3 h SER 17 CO -0.00 0.77 -0.19 0.00 -1.14 0.00 0.00 176.83 176.27 1dt3 h ALA 18 N 1.25 0.73 -0.07 3.77 0.00 0.64 -1.26 119.26 124.32 1dt3 h ALA 18 Ca 0.02 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.57 1dt3 h ALA 18 Cb 0.88 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1dt3 h ALA 18 CO 0.07 0.67 0.07 0.00 0.00 0.00 0.00 179.25 180.06 1dt3 h ALA 19 N 0.91 1.72 -0.09 0.00 0.00 0.33 0.26 119.26 122.40 1dt3 h ALA 19 Ca 0.12 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1dt3 h ALA 19 Cb 0.76 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1dt3 h ALA 19 CO 0.06 -0.10 -0.11 0.00 0.00 0.00 0.00 179.25 179.10 1dt3 h ALA 20 N 1.93 1.65 0.01 0.00 0.00 -1.07 -3.01 119.26 118.76 1dt3 h ALA 20 Ca 0.03 -0.16 -0.32 0.00 0.00 0.00 0.00 54.91 54.47 1dt3 h ALA 20 Cb 0.16 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 1dt3 h ALA 20 CO -0.00 0.26 -1.91 0.66 0.00 0.00 0.00 179.25 178.26 1dt3 n TYR 21 N -4.33 0.76 -2.41 0.00 4.01 0.88 -4.75 117.16 111.31 1dt3 n TYR 21 Ca -0.01 0.26 -0.27 0.00 -0.16 0.00 0.00 57.90 57.72 1dt3 n TYR 21 Cb 0.23 -1.14 0.00 0.00 -0.31 0.00 0.00 39.34 38.12 1dt3 n TYR 21 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dt3 n GLY 23 N -0.51 -1.64 4.84 0.00 0.00 -1.24 0.16 105.19 106.79 1dt3 n GLY 23 Ca 0.40 0.90 0.00 0.00 0.00 0.00 0.00 46.02 47.32 1dt3 n GLY 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dt3 n LYS 24 N 0.00 0.00 -0.19 1.61 4.01 -1.26 -4.55 118.16 117.78 1dt3 n LYS 24 Ca 0.00 0.00 -0.05 0.00 -0.51 0.00 0.00 58.31 57.75 1dt3 n LYS 24 Cb 0.00 -3.78 -0.04 0.00 -0.51 0.00 0.00 35.03 30.69 1dt3 n LYS 24 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1dt3 n ASN 25 N 0.00 -0.47 -0.15 4.39 5.15 -1.26 -1.68 115.26 121.23 1dt3 n ASN 25 Ca 0.00 1.12 -0.09 0.00 -0.60 0.00 0.00 54.58 55.00 1dt3 n ASN 25 Cb 0.00 -0.26 -0.04 0.00 -0.53 0.00 0.00 39.78 38.95 1dt3 n ASN 25 CO 0.00 0.00 0.00 0.78 1.40 0.00 0.00 177.26 179.44 1dt3 h ASN 26 N 0.00 -1.41 -0.19 1.20 2.35 -1.86 -3.36 115.58 112.31 1dt3 h ASN 26 Ca 0.07 0.22 -0.21 0.00 -0.55 0.00 0.00 56.30 55.84 1dt3 h ASN 26 Cb 0.18 0.63 -0.24 0.00 0.05 0.00 0.00 38.32 38.94 1dt3 h ASN 26 CO -0.42 -0.35 -0.60 0.47 -1.65 0.00 0.00 177.43 174.88 1dt3 n ASP 27 N -5.41 -0.37 -4.70 5.81 9.92 -1.21 -3.99 116.55 116.60 1dt3 n ASP 27 Ca 0.00 -2.20 -0.31 0.00 -0.53 0.00 0.00 54.79 51.76 1dt3 n ASP 27 Cb 0.35 0.27 0.14 0.00 -0.64 0.00 0.00 41.12 41.25 1dt3 n ASP 27 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1dt3 s ALA 28 N -1.31 1.63 0.41 2.24 0.00 -0.68 -4.98 121.76 119.07 1dt3 s ALA 28 Ca 0.17 0.35 -0.24 0.00 0.00 0.00 0.00 51.96 52.23 1dt3 s ALA 28 Cb 0.40 -3.34 -0.08 0.00 0.00 0.00 0.00 23.12 20.10 1dt3 s ALA 28 CO -0.09 -2.43 1.14 -1.25 0.00 0.00 0.00 175.76 173.13 1dt3 s PRO 29 N -4.76 4.03 0.15 0.00 0.04 -1.26 -4.83 135.00 128.36 1dt3 s PRO 29 Ca 0.64 1.75 -0.31 0.00 0.04 0.00 0.00 61.00 63.12 1dt3 s PRO 29 Cb -0.20 -2.60 -0.09 0.00 0.04 0.00 0.00 34.50 31.65 1dt3 s PRO 29 CO 0.58 -0.32 1.46 0.00 0.04 0.00 0.00 177.00 178.76 1dt3 s ALA 30 N -1.49 3.66 0.00 8.56 0.00 -1.26 -2.64 121.76 128.58 1dt3 s ALA 30 Ca 0.58 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.78 1dt3 s ALA 30 Cb -0.28 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.27 1dt3 s ALA 30 CO 0.35 -0.68 0.00 0.41 0.00 0.00 0.00 175.76 175.84 1dt3 n GLY 31 N 3.42 0.39 3.80 0.00 0.00 -0.53 -5.02 105.19 107.25 1dt3 n GLY 31 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1dt3 n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dt3 s THR 32 N -2.00 3.78 0.00 2.61 2.01 -1.08 -4.71 115.64 116.25 1dt3 s THR 32 Ca 0.00 1.13 -0.30 0.00 0.31 0.00 0.00 61.69 62.83 1dt3 s THR 32 Cb 0.00 -3.47 -0.07 0.00 0.01 0.00 0.00 72.50 68.98 1dt3 s THR 32 CO 0.00 -0.22 1.62 0.20 -0.69 0.00 0.00 174.62 175.53 1dt3 s ASN 33 N -1.94 6.67 -0.22 3.53 -0.87 -1.26 -0.83 114.94 120.01 1dt3 s ASN 33 Ca 0.67 2.32 -0.29 0.00 -1.57 0.00 0.00 52.86 53.98 1dt3 s ASN 33 Cb -0.17 -2.55 -0.02 0.00 -0.02 0.00 0.00 41.25 38.49 1dt3 s ASN 33 CO 0.20 -0.88 1.48 -0.63 -2.57 0.00 0.00 177.10 174.70 1dt3 s ILE 34 N 3.30 3.89 0.10 0.60 1.01 0.05 -4.89 121.20 125.27 1dt3 s ILE 34 Ca 0.72 1.03 0.04 0.00 0.00 0.00 0.00 60.65 62.44 1dt3 s ILE 34 Cb -0.35 -3.85 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 1dt3 s ILE 34 CO 0.30 -0.30 -0.10 0.42 0.00 0.00 0.00 174.94 175.27 1dt3 s THR 35 N 4.60 0.95 0.43 2.92 -4.23 -1.26 -4.52 115.64 114.53 1dt3 s THR 35 Ca 0.65 -1.71 0.06 0.00 -1.18 0.00 0.00 61.69 59.51 1dt3 s THR 35 Cb -0.23 -1.44 -0.07 0.00 1.34 0.00 0.00 72.50 72.10 1dt3 s THR 35 CO 0.25 -0.60 0.01 0.00 -0.54 0.00 0.00 174.62 173.74 1dt3 s THR 37 N -2.76 3.08 -1.19 0.00 -4.23 0.12 -4.53 115.64 106.13 1dt3 s THR 37 Ca 0.30 -0.67 -0.08 0.00 -1.18 0.00 0.00 61.69 60.06 1dt3 s THR 37 Cb 0.08 -3.14 0.07 0.00 1.34 0.00 0.00 72.50 70.86 1dt3 s THR 37 CO 0.15 -0.09 0.40 0.61 -0.54 0.00 0.00 174.62 175.16 1dt3 n GLY 38 N -2.20 -0.48 2.62 3.99 0.00 -1.26 -2.44 105.19 105.42 1dt3 n GLY 38 Ca 0.06 0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 1dt3 n GLY 38 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dt3 n ASN 39 N -2.19 -5.42 0.24 1.61 5.15 -1.26 -4.82 115.26 108.57 1dt3 n ASN 39 Ca -0.02 -0.06 0.13 0.00 -0.60 0.00 0.00 54.58 54.03 1dt3 n ASN 39 Cb 0.54 -4.48 0.40 0.00 -0.53 0.00 0.00 39.78 35.71 1dt3 n ASN 39 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1dt3 h ALA 40 N 1.00 0.98 -0.93 5.20 0.00 -1.77 -3.40 119.26 120.35 1dt3 h ALA 40 Ca -0.46 -0.06 -0.37 0.00 0.00 0.00 0.00 54.91 54.02 1dt3 h ALA 40 Cb 1.33 -0.01 -0.26 0.00 0.00 0.00 0.00 17.79 18.85 1dt3 h ALA 40 CO 0.53 0.08 -0.78 0.00 0.00 0.00 0.00 179.25 179.08 1dt3 h PRO 42 N 3.66 0.76 -0.25 0.00 0.13 -1.96 0.45 132.00 134.79 1dt3 h PRO 42 Ca -0.03 -0.21 -0.06 0.00 -0.87 0.00 0.00 66.00 64.83 1dt3 h PRO 42 Cb 0.99 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1dt3 h PRO 42 CO 0.36 0.79 -0.10 0.93 -0.23 0.00 0.00 178.00 179.75 1dt3 h GLU 43 N 0.62 0.40 -0.11 0.86 4.39 -1.95 0.11 114.58 118.89 1dt3 h GLU 43 Ca 0.14 -0.10 -0.14 0.00 0.34 0.00 0.00 59.36 59.60 1dt3 h GLU 43 Cb 0.41 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1dt3 h GLU 43 CO 0.01 0.51 -0.53 0.28 -1.16 0.00 0.00 179.01 178.12 1dt3 h VAL 44 N 0.38 1.35 0.00 3.13 2.07 -1.76 -3.03 116.25 118.39 1dt3 h VAL 44 Ca 0.07 -1.81 -0.02 0.00 0.82 0.00 0.00 66.70 65.77 1dt3 h VAL 44 Cb 0.41 1.85 -0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1dt3 h VAL 44 CO 0.02 0.54 -0.10 -0.33 0.02 0.00 0.00 177.57 177.73 1dt3 h GLU 45 N 0.25 0.00 -0.00 1.57 5.08 0.13 -2.34 114.58 119.27 1dt3 h GLU 45 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1dt3 h GLU 45 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1dt3 h GLU 45 CO 0.09 0.10 -0.50 1.17 -1.00 0.00 0.00 179.01 178.87 1dt3 n LYS 46 N -3.23 0.15 -3.82 2.33 4.81 -0.08 -4.86 118.16 113.46 1dt3 n LYS 46 Ca 0.01 -0.09 -0.28 0.00 -0.87 0.00 0.00 58.31 57.07 1dt3 n LYS 46 Cb 0.37 -1.50 -0.03 0.00 0.02 0.00 0.00 35.03 33.89 1dt3 n LYS 46 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1dt3 s ALA 47 N -2.91 3.91 -1.10 3.14 0.00 -0.88 -4.97 121.76 118.95 1dt3 s ALA 47 Ca 0.13 -0.87 -0.23 0.00 0.00 0.00 0.00 51.96 50.99 1dt3 s ALA 47 Cb 0.18 -1.90 -0.06 0.00 0.00 0.00 0.00 23.12 21.34 1dt3 s ALA 47 CO 0.68 0.58 1.90 0.34 0.00 0.00 0.00 175.76 179.26 1dt3 s ASP 48 N -2.97 5.29 -0.17 0.00 2.15 -1.26 -4.86 116.67 114.85 1dt3 s ASP 48 Ca 0.37 -1.43 -0.01 0.00 0.43 0.00 0.00 52.55 51.90 1dt3 s ASP 48 Cb -0.12 -2.58 0.05 0.00 -0.30 0.00 0.00 42.92 39.97 1dt3 s ASP 48 CO 0.28 -2.74 -0.01 0.00 -0.17 0.00 0.00 175.17 172.53 1dt3 s ALA 49 N 9.88 1.21 0.18 3.66 0.00 -1.26 -0.85 121.76 134.58 1dt3 s ALA 49 Ca 0.67 -0.71 0.07 0.00 0.00 0.00 0.00 51.96 51.98 1dt3 s ALA 49 Cb -0.02 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 21.94 1dt3 s ALA 49 CO 0.08 -0.92 -0.15 0.95 0.00 0.00 0.00 175.76 175.72 1dt3 s THR 50 N 1.75 1.64 0.27 0.00 -4.23 -0.32 -0.77 115.64 113.98 1dt3 s THR 50 Ca 0.00 -2.07 -0.29 0.00 -1.18 0.00 0.00 61.69 58.14 1dt3 s THR 50 Cb -0.16 -1.92 -0.10 0.00 1.34 0.00 0.00 72.50 71.67 1dt3 s THR 50 CO -0.07 -0.53 1.25 -0.36 -0.54 0.00 0.00 174.62 174.36 1dt3 s PHE 51 N -2.72 3.27 -0.13 3.99 0.08 -0.01 -0.40 117.98 122.05 1dt3 s PHE 51 Ca 0.19 1.42 0.03 0.00 0.12 0.00 0.00 56.93 58.69 1dt3 s PHE 51 Cb -0.02 -3.54 -0.10 0.00 -0.57 0.00 0.00 43.02 38.79 1dt3 s PHE 51 CO 0.06 -1.51 -0.08 1.28 -0.10 0.00 0.00 175.22 174.87 1dt3 n LEU 52 N 1.57 2.22 -3.69 -0.37 4.77 0.86 -1.45 117.00 120.91 1dt3 n LEU 52 Ca 0.02 -0.05 -0.14 0.00 -0.03 0.00 0.00 56.01 55.81 1dt3 n LEU 52 Cb 0.43 -0.29 -0.09 0.00 -2.33 0.00 0.00 43.42 41.15 1dt3 n LEU 52 CO 0.57 0.61 0.20 -0.47 -1.33 0.00 0.00 177.39 176.98 1dt3 s TYR 53 N -2.27 -0.53 -0.03 -1.77 5.04 -0.92 -4.83 117.35 112.05 1dt3 s TYR 53 Ca -0.15 1.23 0.07 0.00 -2.44 0.00 0.00 57.07 55.78 1dt3 s TYR 53 Cb 0.04 0.20 -0.02 0.00 0.35 0.00 0.00 41.96 42.54 1dt3 s TYR 53 CO 0.35 -0.32 -0.23 -1.12 -1.34 0.00 0.00 175.55 172.89 1dt3 s SER 54 N -0.05 2.71 0.10 4.32 0.01 -1.26 -1.10 113.70 118.43 1dt3 s SER 54 Ca -0.03 -0.43 0.04 0.00 1.31 0.00 0.00 55.95 56.85 1dt3 s SER 54 Cb -0.03 -0.41 -0.04 0.00 0.21 0.00 0.00 66.02 65.75 1dt3 s SER 54 CO 0.02 0.27 -0.12 0.72 0.41 0.00 0.00 173.24 174.54 1dt3 s PHE 55 N -0.43 1.18 -0.25 2.43 -0.12 0.12 -4.93 117.98 115.98 1dt3 s PHE 55 Ca 0.06 -0.60 -0.02 0.00 -0.05 0.00 0.00 56.93 56.31 1dt3 s PHE 55 Cb -0.10 -0.63 0.14 0.00 -0.63 0.00 0.00 43.02 41.79 1dt3 s PHE 55 CO 0.00 0.05 0.38 -2.00 -0.05 0.00 0.00 175.22 173.60 1dt3 s GLU 56 N -2.65 0.36 -0.82 1.99 2.12 -1.25 -1.67 118.70 116.79 1dt3 s GLU 56 Ca 0.06 0.50 -0.05 0.00 0.36 0.00 0.00 54.97 55.84 1dt3 s GLU 56 Cb -0.04 -0.45 0.01 0.00 0.26 0.00 0.00 34.13 33.90 1dt3 s GLU 56 CO 0.01 -0.68 0.67 -0.25 -0.54 0.00 0.00 175.26 174.47 1dt3 n ASP 57 N 5.36 -4.57 -4.72 -1.70 8.00 -0.90 -4.92 116.55 113.10 1dt3 n ASP 57 Ca -0.03 -0.30 -0.39 0.00 0.71 0.00 0.00 54.79 54.78 1dt3 n ASP 57 Cb 0.50 -3.17 -0.05 0.00 -0.02 0.00 0.00 41.12 38.37 1dt3 n ASP 57 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1dt3 s SER 58 N -3.15 6.80 0.46 -2.24 0.15 -0.37 -4.58 113.70 110.77 1dt3 s SER 58 Ca 0.33 0.96 0.00 0.00 0.70 0.00 0.00 55.95 57.94 1dt3 s SER 58 Cb -0.15 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.83 1dt3 s SER 58 CO 0.41 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.42 1dt3 n GLY 59 N 3.17 -0.79 0.35 9.45 0.00 -1.26 -2.32 105.19 113.78 1dt3 n GLY 59 Ca -0.05 -1.14 -0.03 0.00 0.00 0.00 0.00 46.02 44.80 1dt3 n GLY 59 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1dt3 h VAL 60 N 0.00 1.24 -0.51 1.61 2.07 -1.88 -3.07 116.25 115.71 1dt3 h VAL 60 Ca 0.00 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.05 1dt3 h VAL 60 Cb 0.00 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.69 1dt3 h VAL 60 CO 0.00 0.24 0.00 0.61 0.02 0.00 0.00 177.57 178.44 1dt3 n GLY 61 N -1.31 3.20 3.53 2.17 0.00 -1.26 -4.96 105.19 106.55 1dt3 n GLY 61 Ca 0.10 -0.92 -0.21 0.00 0.00 0.00 0.00 46.02 44.99 1dt3 n GLY 61 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dt3 n ASP 62 N 0.45 -5.78 -4.67 1.61 9.92 -1.16 -4.96 116.55 111.95 1dt3 n ASP 62 Ca 0.25 -0.54 -0.39 0.00 -0.53 0.00 0.00 54.79 53.58 1dt3 n ASP 62 Cb 1.03 -2.67 -0.06 0.00 -0.64 0.00 0.00 41.12 38.77 1dt3 n ASP 62 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1dt3 s VAL 63 N -2.70 5.11 0.05 2.53 1.01 -0.98 -4.51 120.40 120.91 1dt3 s VAL 63 Ca 0.09 0.99 0.04 0.00 0.00 0.00 0.00 61.98 63.10 1dt3 s VAL 63 Cb -0.01 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 1dt3 s VAL 63 CO 0.85 0.19 -0.13 -0.89 0.00 0.00 0.00 175.10 175.13 1dt3 s THR 64 N 1.49 0.98 -5.00 3.92 2.01 -1.26 -1.24 115.64 116.54 1dt3 s THR 64 Ca 0.25 -1.14 0.00 0.00 0.31 0.00 0.00 61.69 61.12 1dt3 s THR 64 Cb -0.15 -0.94 0.00 0.00 0.01 0.00 0.00 72.50 71.42 1dt3 s THR 64 CO 0.10 -0.18 0.00 0.61 -0.69 0.00 0.00 174.62 174.46 1dt3 n GLY 65 N 1.55 -0.18 3.43 4.40 0.00 -0.67 -0.47 105.19 113.26 1dt3 n GLY 65 Ca -0.20 -1.14 -0.10 0.00 0.00 0.00 0.00 46.02 44.58 1dt3 n GLY 65 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1dt3 s PHE 66 N -3.48 0.68 -0.15 1.61 -0.12 -0.18 -0.70 117.98 115.63 1dt3 s PHE 66 Ca 0.00 -0.99 0.01 0.00 -0.05 0.00 0.00 56.93 55.90 1dt3 s PHE 66 Cb 0.00 -0.11 0.02 0.00 -0.63 0.00 0.00 43.02 42.30 1dt3 s PHE 66 CO 0.00 -0.85 -0.17 -1.17 -0.05 0.00 0.00 175.22 172.98 1dt3 s LEU 67 N -3.07 1.86 0.24 -1.99 2.96 -0.26 0.67 118.68 119.10 1dt3 s LEU 67 Ca 0.29 -0.54 0.10 0.00 -0.22 0.00 0.00 54.13 53.76 1dt3 s LEU 67 Cb 0.02 -1.28 -0.05 0.00 0.50 0.00 0.00 46.19 45.39 1dt3 s LEU 67 CO 0.10 -0.01 -0.16 0.00 -1.32 0.00 0.00 176.35 174.96 1dt3 s ALA 68 N 1.27 2.37 -0.19 5.97 0.00 0.35 -0.10 121.76 131.43 1dt3 s ALA 68 Ca 0.02 -1.78 -0.02 0.00 0.00 0.00 0.00 51.96 50.18 1dt3 s ALA 68 Cb -0.14 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 1dt3 s ALA 68 CO -0.09 0.15 -0.10 -1.17 0.00 0.00 0.00 175.76 174.55 1dt3 s LEU 69 N -3.41 2.66 -0.35 0.00 2.96 0.46 -1.70 118.68 119.30 1dt3 s LEU 69 Ca 0.26 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.75 1dt3 s LEU 69 Cb -0.02 -1.65 0.10 0.00 0.50 0.00 0.00 46.19 45.12 1dt3 s LEU 69 CO 0.11 0.02 0.07 -0.62 -1.32 0.00 0.00 176.35 174.61 1dt3 s ASP 70 N 1.22 4.86 0.49 3.68 -1.08 -0.19 -1.17 116.67 124.49 1dt3 s ASP 70 Ca 0.02 -2.09 0.28 0.00 -0.52 0.00 0.00 52.55 50.25 1dt3 s ASP 70 Cb -0.14 -1.67 0.84 0.00 -1.46 0.00 0.00 42.92 40.49 1dt3 s ASP 70 CO -0.04 -0.40 1.79 0.78 0.52 0.00 0.00 175.17 177.82 1dt3 h ASN 71 N 7.71 0.00 0.06 -0.34 2.35 -1.26 0.27 115.58 124.37 1dt3 h ASN 71 Ca -0.07 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1dt3 h ASN 71 Cb 1.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.40 1dt3 h ASN 71 CO 0.55 0.00 -0.03 0.74 -1.65 0.00 0.00 177.43 177.04 1dt3 h THR 72 N 0.00 1.24 -0.01 2.81 2.02 -1.93 -3.34 112.91 113.70 1dt3 h THR 72 Ca 0.00 -1.48 0.00 0.00 0.77 0.00 0.00 66.41 65.70 1dt3 h THR 72 Cb 0.76 2.14 0.00 0.00 -1.74 0.00 0.00 68.15 69.31 1dt3 h THR 72 CO 0.00 0.34 -0.11 0.59 0.37 0.00 0.00 175.52 176.71 1dt3 n ASN 73 N -4.81 1.12 -2.14 4.18 3.02 -1.21 -4.95 115.26 110.47 1dt3 n ASN 73 Ca -0.08 -1.13 -0.13 0.00 -0.03 0.00 0.00 54.58 53.21 1dt3 n ASN 73 Cb 0.31 0.04 0.04 0.00 -0.61 0.00 0.00 39.78 39.57 1dt3 n ASN 73 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1dt3 n LYS 74 N -0.33 -4.20 -4.31 3.52 4.76 0.78 -4.94 118.16 113.43 1dt3 n LYS 74 Ca 0.16 0.44 -0.23 0.00 -2.87 0.00 0.00 58.31 55.81 1dt3 n LYS 74 Cb 0.33 -4.29 -0.08 0.00 -1.84 0.00 0.00 35.03 29.16 1dt3 n LYS 74 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1dt3 s LEU 75 N -4.33 3.12 -0.24 -0.35 1.43 -0.19 -2.20 118.68 115.91 1dt3 s LEU 75 Ca 0.30 -0.68 0.02 0.00 -1.03 0.00 0.00 54.13 52.73 1dt3 s LEU 75 Cb -0.13 -1.64 0.06 0.00 0.03 0.00 0.00 46.19 44.50 1dt3 s LEU 75 CO 0.39 0.01 -0.10 -0.63 0.23 0.00 0.00 176.35 176.25 1dt3 s ILE 76 N -2.31 1.87 -0.09 -0.59 1.01 -0.22 -1.02 121.20 119.85 1dt3 s ILE 76 Ca 0.31 -1.37 0.02 0.00 0.00 0.00 0.00 60.65 59.61 1dt3 s ILE 76 Cb -0.06 -2.01 -0.02 0.00 0.01 0.00 0.00 42.46 40.38 1dt3 s ILE 76 CO 0.19 0.01 -0.16 -0.69 0.00 0.00 0.00 174.94 174.29 1dt3 s VAL 77 N 1.25 2.86 -0.34 2.92 1.01 -0.69 -0.82 120.40 126.60 1dt3 s VAL 77 Ca -0.06 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 1dt3 s VAL 77 Cb -0.19 -2.15 0.08 0.00 0.00 0.00 0.00 36.38 34.12 1dt3 s VAL 77 CO -0.06 0.55 0.07 -0.22 0.00 0.00 0.00 175.10 175.44 1dt3 s LEU 78 N -0.06 4.49 -0.25 3.92 2.96 -0.54 0.13 118.68 129.34 1dt3 s LEU 78 Ca -0.04 -1.70 -0.08 0.00 -0.22 0.00 0.00 54.13 52.09 1dt3 s LEU 78 Cb -0.14 -1.73 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 1dt3 s LEU 78 CO 0.04 -0.37 0.11 -0.55 -1.32 0.00 0.00 176.35 174.25 1dt3 s SER 79 N 1.38 5.44 -0.22 3.68 0.15 0.21 -1.31 113.70 123.02 1dt3 s SER 79 Ca 0.02 -0.12 -0.14 0.00 0.70 0.00 0.00 55.95 56.41 1dt3 s SER 79 Cb -0.21 -1.99 -0.04 0.00 -1.71 0.00 0.00 66.02 62.07 1dt3 s SER 79 CO -0.04 -0.02 0.31 -0.36 1.20 0.00 0.00 173.24 174.33 1dt3 s PHE 80 N 1.56 3.34 0.30 3.44 0.08 -0.02 -1.01 117.98 125.66 1dt3 s PHE 80 Ca 0.06 0.45 -0.28 0.00 0.12 0.00 0.00 56.93 57.29 1dt3 s PHE 80 Cb -0.15 -2.44 -0.09 0.00 -0.57 0.00 0.00 43.02 39.76 1dt3 s PHE 80 CO 0.06 -0.01 1.00 0.50 -0.10 0.00 0.00 175.22 176.67 1dt3 s ARG 81 N 1.32 4.60 0.00 0.44 3.52 0.38 -3.96 118.95 125.26 1dt3 s ARG 81 Ca 0.14 1.53 0.00 0.00 -0.13 0.00 0.00 55.73 57.28 1dt3 s ARG 81 Cb -0.14 -2.99 0.00 0.00 -1.56 0.00 0.00 34.95 30.25 1dt3 s ARG 81 CO 0.07 0.26 0.00 0.41 -0.81 0.00 0.00 175.30 175.23 1dt3 n GLY 82 N 0.95 -0.82 3.78 8.12 0.00 -1.25 -3.84 105.19 112.13 1dt3 n GLY 82 Ca 0.01 -1.64 -0.37 0.00 0.00 0.00 0.00 46.02 44.01 1dt3 n GLY 82 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dt3 s SER 83 N -1.00 6.72 0.55 1.61 0.15 -1.26 -4.83 113.70 115.64 1dt3 s SER 83 Ca 0.00 2.10 0.30 0.00 0.70 0.00 0.00 55.95 59.05 1dt3 s SER 83 Cb 0.00 -2.59 1.62 0.00 -1.71 0.00 0.00 66.02 63.34 1dt3 s SER 83 CO 0.00 -0.52 2.14 -0.09 1.20 0.00 0.00 173.24 175.97 1dt3 h ARG 84 N 2.55 0.00 -3.27 5.44 2.43 -1.96 -3.34 114.38 116.23 1dt3 h ARG 84 Ca -0.48 0.00 -0.59 0.00 -0.81 0.00 0.00 59.98 58.10 1dt3 h ARG 84 Cb 1.22 0.00 -0.40 0.00 -0.42 0.00 0.00 29.97 30.37 1dt3 h ARG 84 CO 0.62 0.08 -0.76 -1.12 -1.51 0.00 0.00 179.97 177.28 1dt3 s SER 85 N -6.04 3.80 0.20 -3.80 0.01 -1.26 -5.03 113.70 101.58 1dt3 s SER 85 Ca -0.03 -1.92 -0.06 0.00 1.31 0.00 0.00 55.95 55.24 1dt3 s SER 85 Cb 0.13 -0.83 0.15 0.00 0.21 0.00 0.00 66.02 65.68 1dt3 s SER 85 CO 0.56 -0.37 1.63 0.40 0.41 0.00 0.00 173.24 175.87 1dt3 h ILE 86 N 6.03 1.27 -0.19 1.44 2.04 -1.91 -2.50 117.51 123.69 1dt3 h ILE 86 Ca -0.09 -1.26 0.05 0.00 1.00 0.00 0.00 64.86 64.56 1dt3 h ILE 86 Cb 0.99 1.05 -0.06 0.00 -0.74 0.00 0.00 36.82 38.07 1dt3 h ILE 86 CO 0.45 0.43 -0.18 1.05 0.00 0.00 0.00 178.15 179.91 1dt3 h GLU 87 N 0.79 -0.19 0.00 2.37 9.09 -1.96 -1.83 114.58 122.85 1dt3 h GLU 87 Ca 0.12 0.01 -0.02 0.00 0.05 0.00 0.00 59.36 59.53 1dt3 h GLU 87 Cb 0.67 0.04 -0.00 0.00 -1.65 0.00 0.00 28.75 27.81 1dt3 h GLU 87 CO 0.05 -0.13 -0.25 -0.91 0.05 0.00 0.00 179.01 177.82 1dt3 h ASN 88 N -0.20 0.00 -0.52 3.06 4.21 -1.99 -2.96 115.58 117.18 1dt3 h ASN 88 Ca 0.12 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.52 1dt3 h ASN 88 Cb 0.38 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.56 1dt3 h ASN 88 CO -0.31 0.08 -0.06 -0.25 -1.29 0.00 0.00 177.43 175.60 1dt3 h TRP 89 N 0.00 1.09 -0.19 1.19 7.01 -1.18 -2.05 115.95 121.82 1dt3 h TRP 89 Ca -0.00 -0.20 -0.01 0.00 2.11 0.00 0.00 58.89 60.79 1dt3 h TRP 89 Cb 1.06 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 27.84 1dt3 h TRP 89 CO 0.00 1.00 0.09 0.82 -2.79 0.00 0.00 178.44 177.56 1dt3 h ILE 90 N 0.89 1.14 0.00 2.65 2.04 -1.17 -3.12 117.51 119.94 1dt3 h ILE 90 Ca 0.15 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1dt3 h ILE 90 Cb 0.61 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 1dt3 h ILE 90 CO 0.04 0.13 -0.18 0.61 0.00 0.00 0.00 178.15 178.75 1dt3 n GLY 91 N -0.81 -1.54 1.19 5.37 0.00 -1.19 -3.29 105.19 104.92 1dt3 n GLY 91 Ca -0.04 -0.12 0.08 0.00 0.00 0.00 0.00 46.02 45.94 1dt3 n GLY 91 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1dt3 n ASN 92 N -1.93 4.26 -4.66 1.61 3.02 -0.78 -4.99 115.26 111.80 1dt3 n ASN 92 Ca 0.06 -2.70 -0.41 0.00 -0.03 0.00 0.00 54.58 51.49 1dt3 n ASN 92 Cb 0.40 -0.52 -0.04 0.00 -0.61 0.00 0.00 39.78 39.00 1dt3 n ASN 92 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1dt3 s LEU 93 N -2.28 4.13 -0.59 3.41 2.96 -1.19 -5.02 118.68 120.10 1dt3 s LEU 93 Ca 0.43 1.07 -0.24 0.00 -0.22 0.00 0.00 54.13 55.17 1dt3 s LEU 93 Cb 0.31 -3.17 0.05 0.00 0.50 0.00 0.00 46.19 43.88 1dt3 s LEU 93 CO 0.15 -0.44 0.96 0.21 -1.32 0.00 0.00 176.35 175.91 1dt3 s ASN 94 N 1.25 6.29 0.00 3.68 2.47 -1.26 -4.96 114.94 122.41 1dt3 s ASN 94 Ca 0.35 -0.51 0.00 0.00 0.42 0.00 0.00 52.86 53.13 1dt3 s ASN 94 Cb -0.16 -2.44 0.00 0.00 -1.45 0.00 0.00 41.25 37.20 1dt3 s ASN 94 CO 0.10 -1.31 0.53 0.49 -3.72 0.00 0.00 177.10 173.19 1dt3 n PHE 95 N 7.62 0.00 -1.67 0.43 3.72 -1.26 -4.79 117.46 121.51 1dt3 n PHE 95 Ca 0.00 0.00 -0.46 0.00 -0.05 0.00 0.00 57.45 56.95 1dt3 n PHE 95 Cb 0.47 -0.12 -0.04 0.00 -0.94 0.00 0.00 39.48 38.85 1dt3 n PHE 95 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1dt3 n ASP 96 N -1.03 2.92 -4.99 4.37 8.00 -1.26 -4.88 116.55 119.68 1dt3 n ASP 96 Ca 0.00 1.11 -0.19 0.00 0.71 0.00 0.00 54.79 56.42 1dt3 n ASP 96 Cb 0.05 -1.42 0.02 0.00 -0.02 0.00 0.00 41.12 39.75 1dt3 n ASP 96 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1dt3 s LEU 97 N 0.57 3.55 -0.20 0.64 1.43 -1.26 -1.54 118.68 121.87 1dt3 s LEU 97 Ca 0.75 -0.19 -0.30 0.00 -1.03 0.00 0.00 54.13 53.36 1dt3 s LEU 97 Cb -0.68 -2.79 0.15 0.00 0.03 0.00 0.00 46.19 42.90 1dt3 s LEU 97 CO 0.43 -0.86 1.14 -0.75 0.23 0.00 0.00 176.35 176.54 1dt3 s LYS 98 N -4.50 0.39 -0.01 1.70 2.20 -0.67 -4.76 119.74 114.10 1dt3 s LYS 98 Ca 0.54 0.04 -0.33 0.00 -0.36 0.00 0.00 55.97 55.86 1dt3 s LYS 98 Cb -0.10 0.19 -0.12 0.00 -1.51 0.00 0.00 37.83 36.29 1dt3 s LYS 98 CO 0.35 -0.13 1.85 -0.85 -0.36 0.00 0.00 175.35 176.21 1dt3 n GLU 99 N 0.49 2.34 -2.68 4.03 -0.00 -1.26 -0.33 120.64 123.23 1dt3 n GLU 99 Ca -0.05 0.86 -0.21 0.00 -0.00 0.00 0.00 57.16 57.76 1dt3 n GLU 99 Cb 0.58 -2.71 -0.00 0.00 -0.00 0.00 0.00 31.44 29.31 1dt3 n GLU 99 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 1dt3 n ILE 100 N 4.92 1.80 -0.31 3.84 -5.35 0.38 -4.80 119.36 119.84 1dt3 n ILE 100 Ca 0.21 -4.43 -0.03 0.00 -0.27 0.00 0.00 62.75 58.23 1dt3 n ILE 100 Cb 0.32 -0.60 0.12 0.00 -1.74 0.00 0.00 39.64 37.74 1dt3 n ILE 100 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 1dt3 h ASN 101 N 2.81 1.08 -1.47 7.28 2.35 -1.65 0.34 115.58 126.32 1dt3 h ASN 101 Ca 0.13 -0.08 0.49 0.00 -0.55 0.00 0.00 56.30 56.29 1dt3 h ASN 101 Cb 0.94 -0.27 -0.13 0.00 0.05 0.00 0.00 38.32 38.90 1dt3 h ASN 101 CO 0.70 0.85 0.96 -0.90 -1.65 0.00 0.00 177.43 177.40 1dt3 n ASP 102 N -4.34 0.18 -0.00 5.81 5.75 -1.26 -0.81 116.55 121.88 1dt3 n ASP 102 Ca 0.09 1.34 0.03 0.00 -0.01 0.00 0.00 54.79 56.24 1dt3 n ASP 102 Cb 0.09 -0.66 -0.04 0.00 -1.03 0.00 0.00 41.12 39.48 1dt3 n ASP 102 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 1dt3 n ILE 103 N -4.62 0.00 -3.62 2.12 -0.00 0.05 -5.07 119.36 108.22 1dt3 n ILE 103 Ca 0.41 -0.25 -0.01 0.00 -0.00 0.00 0.00 62.75 62.90 1dt3 n ILE 103 Cb 1.64 0.69 -0.01 0.00 -0.00 0.00 0.00 39.64 41.96 1dt3 n ILE 103 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1dt3 s SER 105 N -2.75 5.58 -0.10 0.00 0.01 -1.26 -3.35 113.70 111.83 1dt3 s SER 105 Ca 0.12 0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.45 1dt3 s SER 105 Cb 0.03 -1.95 0.00 0.00 0.21 0.00 0.00 66.02 64.30 1dt3 s SER 105 CO -0.04 0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.39 1dt3 n GLY 106 N 3.56 0.44 3.80 3.44 0.00 -1.26 -4.99 105.19 110.18 1dt3 n GLY 106 Ca -0.17 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 1dt3 n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dt3 s ARG 108 N -1.90 1.12 0.26 0.00 0.52 -1.26 -0.47 118.95 117.22 1dt3 s ARG 108 Ca 0.45 -0.37 0.11 0.00 -0.52 0.00 0.00 55.73 55.40 1dt3 s ARG 108 Cb -0.18 -1.02 -0.05 0.00 0.52 0.00 0.00 34.95 34.22 1dt3 s ARG 108 CO 0.23 0.15 -0.19 0.20 0.02 0.00 0.00 175.30 175.70 1dt3 s GLY 109 N 0.14 1.80 0.42 -3.53 0.00 0.55 0.56 107.32 107.26 1dt3 s GLY 109 Ca -0.03 -1.83 -0.23 0.00 0.00 0.00 0.00 44.72 42.63 1dt3 s GLY 109 CO 0.01 -1.92 0.62 1.57 0.00 0.00 0.00 173.10 173.37 1dt3 n HIS 110 N -0.55 -0.25 -0.04 1.90 -0.00 0.33 -1.67 115.22 114.94 1dt3 n HIS 110 Ca -0.06 0.60 -0.06 0.00 0.46 0.00 0.00 57.72 58.66 1dt3 n HIS 110 Cb 0.60 -2.02 -0.14 0.00 -0.12 0.00 0.00 29.99 28.31 1dt3 n HIS 110 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 1dt3 n ASP 111 N 1.15 0.52 -0.04 0.26 2.03 -0.59 -2.33 116.55 117.55 1dt3 n ASP 111 Ca 0.11 0.24 -0.15 0.00 0.52 0.00 0.00 54.79 55.52 1dt3 n ASP 111 Cb 0.39 0.46 -0.09 0.00 -0.72 0.00 0.00 41.12 41.17 1dt3 n ASP 111 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1dt3 h GLY 112 N 3.75 0.43 0.75 0.27 0.00 -1.89 -1.72 103.07 104.66 1dt3 h GLY 112 Ca -0.34 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.40 1dt3 h GLY 112 CO 0.05 0.50 -0.49 0.74 0.00 0.00 0.00 176.54 177.34 1dt3 h PHE 113 N -0.06 -1.31 -0.53 5.60 0.04 -1.95 0.29 116.94 119.03 1dt3 h PHE 113 Ca -0.01 -0.01 0.10 0.00 2.80 0.00 0.00 57.97 60.85 1dt3 h PHE 113 Cb 0.95 0.47 -0.11 0.00 2.20 0.00 0.00 35.95 39.47 1dt3 h PHE 113 CO 0.12 -0.72 -0.23 1.15 -0.60 0.00 0.00 178.31 178.02 1dt3 h THR 114 N -1.17 0.31 -0.60 -1.55 2.02 -1.54 -0.15 112.91 110.23 1dt3 h THR 114 Ca -0.10 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.03 1dt3 h THR 114 Cb 0.95 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.64 1dt3 h THR 114 CO 0.09 0.00 0.17 0.28 0.37 0.00 0.00 175.52 176.42 1dt3 h SER 115 N -0.11 0.85 0.09 4.18 0.02 -1.18 -1.43 113.55 115.97 1dt3 h SER 115 Ca 0.24 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1dt3 h SER 115 Cb 0.49 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1dt3 h SER 115 CO -0.60 0.81 -0.04 0.28 -1.14 0.00 0.00 176.83 176.14 1dt3 h SER 116 N 0.88 -0.11 0.10 3.07 0.02 0.99 -2.00 113.55 116.51 1dt3 h SER 116 Ca 0.19 -0.20 0.02 0.00 -0.84 0.00 0.00 61.79 60.96 1dt3 h SER 116 Cb 0.28 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.81 1dt3 h SER 116 CO -0.00 0.15 -0.31 -0.25 -1.14 0.00 0.00 176.83 175.28 1dt3 h TRP 117 N -0.36 -0.83 -1.02 3.45 -0.00 -0.99 -2.53 115.95 113.67 1dt3 h TRP 117 Ca -0.01 0.02 0.25 0.00 -0.00 0.00 0.00 58.89 59.15 1dt3 h TRP 117 Cb 0.30 0.35 -0.10 0.00 -0.00 0.00 0.00 29.16 29.72 1dt3 h TRP 117 CO 0.00 -0.41 0.64 -0.09 -0.00 0.00 0.00 178.44 178.59 1dt3 h ARG 118 N -0.52 0.46 0.00 2.65 9.65 -1.25 0.74 114.38 126.11 1dt3 h ARG 118 Ca 0.04 -0.03 -0.07 0.00 -1.10 0.00 0.00 59.98 58.82 1dt3 h ARG 118 Cb 0.56 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 1dt3 h ARG 118 CO -0.19 0.31 -0.34 1.03 2.80 0.00 0.00 179.97 183.58 1dt3 h SER 119 N 0.48 0.00 -0.03 -3.80 0.87 -0.92 -2.78 113.55 107.37 1dt3 h SER 119 Ca 0.60 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.16 1dt3 h SER 119 Cb 1.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.33 1dt3 h SER 119 CO -0.34 0.34 0.00 1.33 -0.53 0.00 0.00 176.83 177.63 1dt3 n VAL 120 N -3.85 0.06 0.00 2.23 0.24 0.64 -4.83 118.33 112.82 1dt3 n VAL 120 Ca -0.01 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.76 1dt3 n VAL 120 Cb 0.41 1.17 0.00 0.00 -1.47 0.00 0.00 33.84 33.95 1dt3 n VAL 120 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1dt3 n ALA 121 N 0.56 0.00 -0.26 2.33 0.00 0.23 -2.03 120.51 121.33 1dt3 n ALA 121 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.49 1dt3 n ALA 121 Cb 0.26 0.08 0.02 0.00 0.00 0.00 0.00 19.45 19.82 1dt3 n ALA 121 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1dt3 n ASP 122 N -0.54 -0.45 0.07 0.00 8.00 -1.26 -1.19 116.55 121.18 1dt3 n ASP 122 Ca 0.00 1.19 -0.11 0.00 0.71 0.00 0.00 54.79 56.57 1dt3 n ASP 122 Cb 0.00 -0.27 -0.05 0.00 -0.02 0.00 0.00 41.12 40.78 1dt3 n ASP 122 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1dt3 h THR 123 N 0.00 0.62 -0.42 -3.53 2.02 -1.91 -2.13 112.91 107.56 1dt3 h THR 123 Ca 0.23 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.41 1dt3 h THR 123 Cb 0.40 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1dt3 h THR 123 CO -0.67 0.00 0.24 -0.07 0.37 0.00 0.00 175.52 175.38 1dt3 h LEU 124 N -0.28 0.52 -2.00 2.58 3.38 -0.53 -1.00 115.31 117.96 1dt3 h LEU 124 Ca 0.04 -0.08 0.09 0.00 0.09 0.00 0.00 57.88 58.03 1dt3 h LEU 124 Cb 0.33 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1dt3 h LEU 124 CO -0.13 0.45 0.23 0.08 0.09 0.00 0.00 178.44 179.15 1dt3 h ARG 125 N 0.54 0.00 -0.39 1.13 -0.00 -1.52 0.54 114.38 114.69 1dt3 h ARG 125 Ca 0.15 0.00 -0.13 0.00 -0.00 0.00 0.00 59.98 60.00 1dt3 h ARG 125 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.00 1dt3 h ARG 125 CO -0.02 0.00 -0.27 0.37 -0.00 0.00 0.00 179.97 180.04 1dt3 h GLN 126 N 0.00 0.87 -0.11 0.08 -0.00 -0.57 0.17 115.11 115.55 1dt3 h GLN 126 Ca 0.15 -0.42 -0.18 0.00 -0.00 0.00 0.00 58.65 58.20 1dt3 h GLN 126 Cb 0.61 -0.01 -0.00 0.00 0.00 0.00 0.00 27.48 28.08 1dt3 h GLN 126 CO -0.00 1.06 -0.69 0.87 0.00 0.00 0.00 178.83 180.07 1dt3 h LYS 127 N 0.68 0.49 -0.02 1.69 6.56 0.12 -1.75 116.57 124.34 1dt3 h LYS 127 Ca 0.08 -0.37 -0.01 0.00 -1.06 0.00 0.00 60.65 59.29 1dt3 h LYS 127 Cb 0.85 0.07 -0.00 0.00 -0.57 0.00 0.00 32.23 32.57 1dt3 h LYS 127 CO 0.07 1.00 -0.01 0.28 -2.06 0.00 0.00 179.45 178.73 1dt3 h VAL 128 N 0.35 1.30 -0.73 0.50 2.07 -0.70 -1.08 116.25 117.95 1dt3 h VAL 128 Ca -0.02 -0.90 0.15 0.00 0.82 0.00 0.00 66.70 66.75 1dt3 h VAL 128 Cb 1.26 1.86 -0.10 0.00 -1.52 0.00 0.00 31.29 32.78 1dt3 h VAL 128 CO 0.12 0.24 0.21 -0.33 0.02 0.00 0.00 177.57 177.83 1dt3 h GLU 129 N -0.31 0.30 0.00 1.57 5.08 -0.45 0.18 114.58 120.95 1dt3 h GLU 129 Ca 0.01 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 1dt3 h GLU 129 Cb 0.39 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1dt3 h GLU 129 CO 0.00 0.20 -0.28 -0.44 -1.00 0.00 0.00 179.01 177.49 1dt3 h ASP 130 N 0.31 0.00 0.12 1.42 3.32 -0.64 -0.81 116.42 120.15 1dt3 h ASP 130 Ca 0.41 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.19 1dt3 h ASP 130 Cb 0.67 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.24 1dt3 h ASP 130 CO -0.47 0.28 -1.09 0.00 -1.72 0.00 0.00 179.24 176.24 1dt3 h ALA 131 N 1.72 0.13 -0.38 3.45 0.00 -0.59 -2.86 119.26 120.73 1dt3 h ALA 131 Ca -0.00 -0.73 -0.03 0.00 0.00 0.00 0.00 54.91 54.15 1dt3 h ALA 131 Cb 0.51 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1dt3 h ALA 131 CO 0.04 0.72 0.12 0.28 0.00 0.00 0.00 179.25 180.41 1dt3 h VAL 132 N 0.32 1.16 0.33 0.00 2.07 0.13 -1.32 116.25 118.95 1dt3 h VAL 132 Ca -0.14 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 1dt3 h VAL 132 Cb 1.75 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 1dt3 h VAL 132 CO 0.21 0.20 -0.16 -0.09 0.02 0.00 0.00 177.57 177.75 1dt3 h ARG 133 N 0.54 -0.43 -0.73 1.57 2.43 -1.15 -2.18 114.38 114.43 1dt3 h ARG 133 Ca 0.13 0.03 0.15 0.00 -0.81 0.00 0.00 59.98 59.48 1dt3 h ARG 133 Cb 0.17 0.10 -0.14 0.00 -0.42 0.00 0.00 29.97 29.68 1dt3 h ARG 133 CO -0.01 -0.18 -0.14 0.93 -1.51 0.00 0.00 179.97 179.06 1dt3 h GLU 134 N -1.05 0.02 -2.28 0.20 3.07 -1.51 -3.29 114.58 109.73 1dt3 h GLU 134 Ca -0.05 -0.00 -0.60 0.00 -0.50 0.00 0.00 59.36 58.21 1dt3 h GLU 134 Cb 0.46 -0.00 -0.42 0.00 -0.84 0.00 0.00 28.75 27.94 1dt3 h GLU 134 CO 0.08 0.01 -0.62 0.72 -1.40 0.00 0.00 179.01 177.80 1dt3 n HIS 135 N -5.46 3.36 -0.23 4.33 8.25 -0.50 -4.93 115.22 120.04 1dt3 n HIS 135 Ca 0.10 -4.14 0.04 0.00 -0.26 0.00 0.00 57.72 53.47 1dt3 n HIS 135 Cb 0.39 -0.55 0.29 0.00 1.12 0.00 0.00 29.99 31.24 1dt3 n HIS 135 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1dt3 h PRO 136 N 4.31 0.89 -0.13 -0.41 0.13 -1.47 -2.81 132.00 132.51 1dt3 h PRO 136 Ca 0.19 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1dt3 h PRO 136 Cb 0.69 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.61 1dt3 h PRO 136 CO 0.80 0.59 0.06 0.38 -0.23 0.00 0.00 178.00 179.60 1dt3 h ASP 137 N 0.91 0.17 -3.52 1.44 2.03 -1.92 -3.46 116.42 112.08 1dt3 h ASP 137 Ca 0.33 -0.12 -0.53 0.00 -0.73 0.00 0.00 57.03 55.97 1dt3 h ASP 137 Cb 0.14 -0.04 0.09 0.00 -0.83 0.00 0.00 39.33 38.69 1dt3 h ASP 137 CO -0.11 0.25 0.86 -0.31 -1.03 0.00 0.00 179.24 178.90 1dt3 s TYR 138 N -5.71 2.70 -0.10 4.15 1.51 -1.06 -5.02 117.35 113.81 1dt3 s TYR 138 Ca -0.14 0.89 -0.30 0.00 -1.01 0.00 0.00 57.07 56.52 1dt3 s TYR 138 Cb 0.07 -4.06 -0.02 0.00 -0.11 0.00 0.00 41.96 37.84 1dt3 s TYR 138 CO 0.69 -3.43 1.13 0.50 -1.11 0.00 0.00 175.55 173.33 1dt3 s ARG 139 N -0.99 4.35 -0.09 -0.62 3.52 -0.94 -4.78 118.95 119.41 1dt3 s ARG 139 Ca 0.60 1.55 -0.30 0.00 -0.13 0.00 0.00 55.73 57.45 1dt3 s ARG 139 Cb -0.47 -3.59 -0.02 0.00 -1.56 0.00 0.00 34.95 29.31 1dt3 s ARG 139 CO 0.53 -0.46 1.03 0.08 -0.81 0.00 0.00 175.30 175.66 1dt3 s VAL 140 N 2.42 4.73 -0.10 7.11 1.01 -1.26 -1.06 120.40 133.26 1dt3 s VAL 140 Ca 0.52 2.00 0.01 0.00 0.00 0.00 0.00 61.98 64.50 1dt3 s VAL 140 Cb -0.21 -4.28 0.02 0.00 0.00 0.00 0.00 36.38 31.91 1dt3 s VAL 140 CO 0.18 0.02 -0.10 -0.69 0.00 0.00 0.00 175.10 174.51 1dt3 s VAL 141 N 1.91 1.14 -0.14 2.92 1.01 0.00 -1.78 120.40 125.47 1dt3 s VAL 141 Ca 0.50 -0.41 -0.07 0.00 0.00 0.00 0.00 61.98 61.99 1dt3 s VAL 141 Cb -0.19 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1dt3 s VAL 141 CO 0.20 0.38 0.11 -0.36 0.00 0.00 0.00 175.10 175.42 1dt3 s PHE 142 N 1.26 3.46 0.15 5.22 0.08 0.77 -1.46 117.98 127.46 1dt3 s PHE 142 Ca -0.03 0.38 -0.05 0.00 0.12 0.00 0.00 56.93 57.36 1dt3 s PHE 142 Cb -0.14 -2.00 -0.02 0.00 -0.57 0.00 0.00 43.02 40.29 1dt3 s PHE 142 CO -0.04 0.52 0.17 -0.08 -0.10 0.00 0.00 175.22 175.70 1dt3 s THR 143 N -0.48 0.08 0.00 0.64 -1.32 -0.43 -1.00 115.64 113.14 1dt3 s THR 143 Ca 0.11 -1.66 0.00 0.00 -1.21 0.00 0.00 61.69 58.93 1dt3 s THR 143 Cb -0.12 -1.97 0.00 0.00 -1.51 0.00 0.00 72.50 68.90 1dt3 s THR 143 CO 0.02 -0.36 0.00 0.61 -2.21 0.00 0.00 174.62 172.68 1dt3 n GLY 144 N -0.16 1.38 3.49 6.08 0.00 -0.99 -0.84 105.19 114.14 1dt3 n GLY 144 Ca -0.06 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 44.93 1dt3 n GLY 144 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1dt3 s HIS 145 N -2.00 2.62 0.00 1.61 5.65 -1.25 0.14 115.29 122.05 1dt3 s HIS 145 Ca 0.00 -0.22 0.00 0.00 0.25 0.00 0.00 55.06 55.09 1dt3 s HIS 145 Cb 0.00 -1.47 0.00 0.00 -1.18 0.00 0.00 32.58 29.93 1dt3 s HIS 145 CO 0.00 0.30 0.00 0.45 -0.65 0.00 0.00 174.74 174.84 1dt3 n SER 146 N 1.38 0.00 -0.32 9.88 2.88 0.13 -1.65 113.62 125.93 1dt3 n SER 146 Ca -0.16 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.55 1dt3 n SER 146 Cb 0.52 0.00 0.36 0.00 -0.75 0.00 0.00 64.21 64.34 1dt3 n SER 146 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1dt3 h LEU 147 N 0.00 0.33 -1.28 2.46 5.85 -1.90 -1.85 115.31 118.93 1dt3 h LEU 147 Ca 0.00 0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.93 1dt3 h LEU 147 Cb 0.00 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1dt3 h LEU 147 CO 0.00 -0.07 0.51 1.23 -0.34 0.00 0.00 178.44 179.77 1dt3 h GLY 148 N 0.35 1.07 1.61 3.75 0.00 -1.42 0.73 103.07 109.16 1dt3 h GLY 148 Ca 0.62 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 1dt3 h GLY 148 CO -0.58 0.31 0.03 -1.33 0.00 0.00 0.00 176.54 174.98 1dt3 h GLY 149 N 0.92 0.53 1.45 4.60 0.00 -0.96 0.39 103.07 110.01 1dt3 h GLY 149 Ca 0.31 -0.29 -0.18 0.00 0.00 0.00 0.00 47.33 47.17 1dt3 h GLY 149 CO -0.09 0.27 -0.64 0.00 0.00 0.00 0.00 176.54 176.08 1dt3 h ALA 150 N 1.56 0.60 -0.17 3.60 0.00 0.84 -1.75 119.26 123.94 1dt3 h ALA 150 Ca 0.11 -0.56 -0.18 0.00 0.00 0.00 0.00 54.91 54.28 1dt3 h ALA 150 Cb 0.26 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1dt3 h ALA 150 CO 0.00 0.71 -0.59 -0.07 0.00 0.00 0.00 179.25 179.31 1dt3 h LEU 151 N 0.41 0.81 -0.57 0.00 3.38 0.48 -1.54 115.31 118.28 1dt3 h LEU 151 Ca -0.01 -0.60 0.08 0.00 0.09 0.00 0.00 57.88 57.43 1dt3 h LEU 151 Cb 1.21 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.66 1dt3 h LEU 151 CO 0.12 1.28 0.23 0.00 0.09 0.00 0.00 178.44 180.15 1dt3 h ALA 152 N 0.56 0.72 -0.15 1.53 0.00 -0.18 -0.68 119.26 121.06 1dt3 h ALA 152 Ca -0.03 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1dt3 h ALA 152 Cb 1.22 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1dt3 h ALA 152 CO 0.12 -0.17 0.06 1.15 0.00 0.00 0.00 179.25 180.41 1dt3 h THR 153 N 0.42 1.17 0.25 0.00 2.02 -1.07 0.54 112.91 116.24 1dt3 h THR 153 Ca 0.28 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 66.94 1dt3 h THR 153 Cb 0.30 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1dt3 h THR 153 CO -0.26 0.16 -0.12 0.58 0.37 0.00 0.00 175.52 176.24 1dt3 h VAL 154 N 0.08 0.79 -0.69 3.16 2.07 -0.56 -1.29 116.25 119.82 1dt3 h VAL 154 Ca 0.05 -0.29 0.12 0.00 0.82 0.00 0.00 66.70 67.41 1dt3 h VAL 154 Cb 0.19 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1dt3 h VAL 154 CO -0.00 0.06 0.46 0.00 0.02 0.00 0.00 177.57 178.11 1dt3 h ALA 155 N 0.23 2.04 0.02 1.67 0.00 -1.14 0.23 119.26 122.30 1dt3 h ALA 155 Ca -0.03 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 1dt3 h ALA 155 Cb 0.36 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1dt3 h ALA 155 CO 0.06 -0.21 -0.93 0.78 0.00 0.00 0.00 179.25 178.94 1dt3 h GLY 156 N 0.43 0.15 1.01 0.00 0.00 -0.61 -1.56 103.07 102.50 1dt3 h GLY 156 Ca 0.33 -0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 1dt3 h GLY 156 CO -0.10 0.27 0.17 0.00 0.00 0.00 0.00 176.54 176.88 1dt3 h ALA 157 N 0.97 0.77 -0.04 3.60 0.00 0.06 -3.09 119.26 121.52 1dt3 h ALA 157 Ca -0.04 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1dt3 h ALA 157 Cb 1.60 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1dt3 h ALA 157 CO 0.14 0.45 -0.54 0.22 0.00 0.00 0.00 179.25 179.52 1dt3 h ASP 158 N 0.84 0.11 0.00 0.00 3.58 -0.71 -3.39 116.42 116.85 1dt3 h ASP 158 Ca 0.19 -0.06 -0.05 0.00 0.42 0.00 0.00 57.03 57.53 1dt3 h ASP 158 Cb 0.31 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.32 1dt3 h ASP 158 CO -0.00 0.63 -1.96 0.18 -2.88 0.00 0.00 179.24 175.21 1dt3 n LEU 159 N -3.91 0.00 -4.32 2.28 4.77 -0.62 -4.98 117.00 110.23 1dt3 n LEU 159 Ca -0.02 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.62 1dt3 n LEU 159 Cb 0.56 0.07 0.09 0.00 -2.33 0.00 0.00 43.42 41.81 1dt3 n LEU 159 CO 0.42 0.07 -0.39 0.54 -1.33 0.00 0.00 177.39 176.70 1dt3 n ARG 160 N -2.26 -0.16 -0.95 3.23 1.74 -1.18 -3.52 116.66 113.57 1dt3 n ARG 160 Ca -0.08 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1dt3 n ARG 160 Cb 0.60 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 1dt3 n ARG 160 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dt3 n GLY 161 N 2.02 0.75 2.02 -0.13 0.00 -1.26 -4.93 105.19 103.66 1dt3 n GLY 161 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 1dt3 n GLY 161 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1dt3 n ASN 162 N -0.03 4.87 0.00 1.61 5.03 -1.23 -4.95 115.26 120.56 1dt3 n ASN 162 Ca 0.00 -3.23 0.00 0.00 0.87 0.00 0.00 54.58 52.22 1dt3 n ASN 162 Cb 0.02 -0.75 0.00 0.00 -1.02 0.00 0.00 39.78 38.03 1dt3 n ASN 162 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1dt3 n GLY 163 N -0.16 1.83 3.15 7.41 0.00 -1.26 -5.06 105.19 111.09 1dt3 n GLY 163 Ca 0.41 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.16 1dt3 n GLY 163 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1dt3 s TYR 164 N -2.31 1.88 0.47 1.61 1.13 -1.26 -5.13 117.35 113.74 1dt3 s TYR 164 Ca 0.00 -0.60 -0.24 0.00 -1.41 0.00 0.00 57.07 54.82 1dt3 s TYR 164 Cb 0.00 -1.27 -0.07 0.00 -1.10 0.00 0.00 41.96 39.51 1dt3 s TYR 164 CO 0.00 -0.22 1.41 -0.51 -2.51 0.00 0.00 175.55 173.72 1dt3 s ASP 165 N 0.14 5.72 -0.16 -0.18 1.01 -1.26 -4.56 116.67 117.38 1dt3 s ASP 165 Ca -0.07 2.89 -0.00 0.00 0.71 0.00 0.00 52.55 56.07 1dt3 s ASP 165 Cb -0.13 -2.65 0.04 0.00 1.01 0.00 0.00 42.92 41.19 1dt3 s ASP 165 CO 0.03 -1.28 -0.06 -0.63 0.21 0.00 0.00 175.17 173.44 1dt3 s ILE 166 N -1.22 1.15 0.13 0.77 1.01 -0.72 -4.21 121.20 118.11 1dt3 s ILE 166 Ca 0.64 -0.60 -0.08 0.00 0.00 0.00 0.00 60.65 60.61 1dt3 s ILE 166 Cb -0.43 -1.28 -0.06 0.00 0.01 0.00 0.00 42.46 40.70 1dt3 s ILE 166 CO 0.54 0.19 0.42 -1.81 0.00 0.00 0.00 174.94 174.28 1dt3 s ASP 167 N 1.62 6.58 -0.10 3.58 1.01 -0.73 -3.84 116.67 124.79 1dt3 s ASP 167 Ca 0.01 0.74 0.03 0.00 0.71 0.00 0.00 52.55 54.05 1dt3 s ASP 167 Cb -0.15 -2.15 0.00 0.00 1.01 0.00 0.00 42.92 41.63 1dt3 s ASP 167 CO -0.08 0.08 -0.21 -0.69 0.21 0.00 0.00 175.17 174.48 1dt3 s VAL 168 N -1.58 1.89 -0.24 -1.27 1.01 -0.34 -0.16 120.40 119.71 1dt3 s VAL 168 Ca 0.39 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.47 1dt3 s VAL 168 Cb -0.13 -1.65 0.06 0.00 0.00 0.00 0.00 36.38 34.67 1dt3 s VAL 168 CO 0.21 0.52 -0.05 -0.36 0.00 0.00 0.00 175.10 175.42 1dt3 s PHE 169 N 0.49 2.43 -0.08 5.22 0.40 -0.17 0.22 117.98 126.49 1dt3 s PHE 169 Ca -0.16 -1.79 0.03 0.00 -0.60 0.00 0.00 56.93 54.41 1dt3 s PHE 169 Cb -0.17 -1.61 -0.02 0.00 0.51 0.00 0.00 43.02 41.73 1dt3 s PHE 169 CO 0.06 -0.78 -0.14 -1.54 0.70 0.00 0.00 175.22 173.52 1dt3 s SER 170 N 1.38 3.97 -0.19 1.36 1.04 0.13 -2.35 113.70 119.04 1dt3 s SER 170 Ca -0.06 -0.25 0.01 0.00 0.48 0.00 0.00 55.95 56.13 1dt3 s SER 170 Cb -0.19 -1.09 0.03 0.00 0.10 0.00 0.00 66.02 64.87 1dt3 s SER 170 CO -0.06 0.28 -0.18 -0.31 0.98 0.00 0.00 173.24 173.95 1dt3 s TYR 171 N -0.36 2.83 -1.59 5.02 1.51 0.12 -2.28 117.35 122.61 1dt3 s TYR 171 Ca 0.03 -1.76 -0.09 0.00 -1.01 0.00 0.00 57.07 54.24 1dt3 s TYR 171 Cb -0.12 -1.90 0.08 0.00 -0.11 0.00 0.00 41.96 39.91 1dt3 s TYR 171 CO 0.02 -0.81 0.50 0.41 -1.11 0.00 0.00 175.55 174.56 1dt3 n GLY 172 N 4.59 -0.31 3.78 0.71 0.00 -0.73 0.17 105.19 113.41 1dt3 n GLY 172 Ca -0.19 0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 1dt3 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dt3 s ALA 173 N -3.71 3.00 0.98 4.61 0.00 -1.26 -3.62 121.76 121.76 1dt3 s ALA 173 Ca 0.37 0.82 -0.15 0.00 0.00 0.00 0.00 51.96 53.00 1dt3 s ALA 173 Cb -0.20 -3.33 0.18 0.00 0.00 0.00 0.00 23.12 19.77 1dt3 s ALA 173 CO 0.94 -0.47 1.20 -1.25 0.00 0.00 0.00 175.76 176.18 1dt3 s PRO 174 N -2.68 0.58 0.30 0.00 0.04 -1.26 -3.59 135.00 128.40 1dt3 s PRO 174 Ca 0.62 -0.03 -0.29 0.00 0.04 0.00 0.00 61.00 61.33 1dt3 s PRO 174 Cb -0.25 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.39 1dt3 s PRO 174 CO 0.31 -2.51 1.26 1.03 0.04 0.00 0.00 177.00 177.13 1dt3 s ARG 175 N -5.54 4.42 0.00 4.56 0.52 0.54 -4.86 118.95 118.60 1dt3 s ARG 175 Ca 0.68 2.11 0.10 0.00 -0.52 0.00 0.00 55.73 58.10 1dt3 s ARG 175 Cb -0.10 -3.11 -0.05 0.00 0.52 0.00 0.00 34.95 32.21 1dt3 s ARG 175 CO 0.53 -0.11 0.52 0.28 0.02 0.00 0.00 175.30 176.54 1dt3 n VAL 176 N 1.15 0.00 -3.21 3.52 0.31 -1.26 -4.33 118.33 114.50 1dt3 n VAL 176 Ca 0.01 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1dt3 n VAL 176 Cb 0.43 1.06 0.00 0.00 -0.91 0.00 0.00 33.84 34.41 1dt3 n VAL 176 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1dt3 n GLY 177 N 1.06 -0.66 0.52 2.92 0.00 -1.26 0.12 105.19 107.89 1dt3 n GLY 177 Ca 0.03 -0.73 -0.04 0.00 0.00 0.00 0.00 46.02 45.28 1dt3 n GLY 177 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1dt3 n ASN 178 N 0.10 -0.39 0.09 1.61 6.94 0.19 -1.21 115.26 122.59 1dt3 n ASN 178 Ca 0.00 -0.90 -0.14 0.00 -0.02 0.00 0.00 54.58 53.52 1dt3 n ASN 178 Cb 0.00 -0.14 -0.10 0.00 -2.36 0.00 0.00 39.78 37.18 1dt3 n ASN 178 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 1dt3 h ARG 179 N 0.00 0.29 -0.60 -3.83 2.43 -1.89 -1.81 114.38 108.97 1dt3 h ARG 179 Ca -0.06 -0.41 0.02 0.00 -0.81 0.00 0.00 59.98 58.73 1dt3 h ARG 179 Cb 0.17 0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.82 1dt3 h ARG 179 CO 0.04 1.14 0.37 0.00 -1.51 0.00 0.00 179.97 180.02 1dt3 h ALA 180 N 0.69 0.78 -0.46 2.80 0.00 -1.93 -1.06 119.26 120.07 1dt3 h ALA 180 Ca -0.10 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1dt3 h ALA 180 Cb 1.79 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1dt3 h ALA 180 CO 0.18 0.12 -0.22 0.35 0.00 0.00 0.00 179.25 179.68 1dt3 h PHE 181 N 0.74 1.08 -0.96 0.00 3.57 -1.86 0.24 116.94 119.75 1dt3 h PHE 181 Ca 0.24 -0.26 0.07 0.00 3.53 0.00 0.00 57.97 61.56 1dt3 h PHE 181 Cb 0.01 -0.25 -0.07 0.00 2.79 0.00 0.00 35.95 38.42 1dt3 h PHE 181 CO -0.05 1.06 0.61 0.00 -2.23 0.00 0.00 178.31 177.70 1dt3 h ALA 182 N 0.93 1.35 -0.26 2.41 0.00 -1.24 0.15 119.26 122.60 1dt3 h ALA 182 Ca 0.11 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 1dt3 h ALA 182 Cb 0.78 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1dt3 h ALA 182 CO 0.06 0.35 -0.51 1.49 0.00 0.00 0.00 179.25 180.64 1dt3 h GLU 183 N 1.08 0.81 0.11 0.00 4.81 -0.29 -2.56 114.58 118.54 1dt3 h GLU 183 Ca 0.43 -0.52 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1dt3 h GLU 183 Cb 0.23 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1dt3 h GLU 183 CO -0.19 1.15 -0.05 0.35 -0.73 0.00 0.00 179.01 179.53 1dt3 h PHE 184 N 0.56 -0.14 -0.12 0.92 3.57 0.46 -2.51 116.94 119.69 1dt3 h PHE 184 Ca 0.01 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.54 1dt3 h PHE 184 Cb 1.12 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.90 1dt3 h PHE 184 CO 0.08 0.08 0.09 -0.07 -2.23 0.00 0.00 178.31 176.25 1dt3 h LEU 185 N -0.35 0.00 -0.31 0.59 3.38 -0.78 -0.03 115.31 117.81 1dt3 h LEU 185 Ca -0.02 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.76 1dt3 h LEU 185 Cb 0.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1dt3 h LEU 185 CO 0.03 0.00 -0.83 0.74 0.09 0.00 0.00 178.44 178.47 1dt3 h THR 186 N 0.00 1.41 -0.01 0.22 2.02 -1.03 -3.37 112.91 112.15 1dt3 h THR 186 Ca 0.06 -2.34 0.00 0.00 0.77 0.00 0.00 66.41 64.90 1dt3 h THR 186 Cb 0.23 2.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.92 1dt3 h THR 186 CO -0.00 0.70 -0.05 1.33 0.37 0.00 0.00 175.52 177.86 1dt3 n VAL 187 N -3.77 0.00 -1.74 3.16 0.24 -0.65 -4.90 118.33 110.67 1dt3 n VAL 187 Ca -0.05 -0.47 -0.37 0.00 -2.04 0.00 0.00 64.34 61.41 1dt3 n VAL 187 Cb 0.77 1.10 0.06 0.00 -1.47 0.00 0.00 33.84 34.30 1dt3 n VAL 187 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1dt3 s GLN 188 N -0.71 2.65 0.54 7.34 0.74 -0.12 -5.02 119.66 125.09 1dt3 s GLN 188 Ca 0.06 2.11 0.04 0.00 0.05 0.00 0.00 55.36 57.62 1dt3 s GLN 188 Cb 0.05 -1.92 0.03 0.00 1.10 0.00 0.00 33.01 32.27 1dt3 s GLN 188 CO 0.11 -1.53 0.29 0.95 -0.55 0.00 0.00 175.29 174.55 1dt3 s THR 189 N -1.37 1.45 0.00 -0.34 -4.23 -1.26 -4.81 115.64 105.09 1dt3 s THR 189 Ca 0.81 -1.64 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1dt3 s THR 189 Cb -0.38 -2.10 0.00 0.00 1.34 0.00 0.00 72.50 71.36 1dt3 s THR 189 CO 0.41 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.10 1dt3 n GLY 190 N -1.64 0.94 0.00 3.99 0.00 -1.26 -4.74 105.19 102.49 1dt3 n GLY 190 Ca -0.07 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1dt3 n GLY 190 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dt3 n GLY 191 N -0.46 4.24 3.49 -0.02 0.00 -1.26 -1.76 105.19 109.42 1dt3 n GLY 191 Ca 0.00 -1.37 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 1dt3 n GLY 191 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dt3 s THR 192 N -1.75 3.04 -0.17 2.61 2.01 -1.25 -4.91 115.64 115.22 1dt3 s THR 192 Ca 0.00 -0.99 -0.05 0.00 0.31 0.00 0.00 61.69 60.95 1dt3 s THR 192 Cb 0.00 -2.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.20 1dt3 s THR 192 CO 0.00 0.40 0.01 -0.22 -0.69 0.00 0.00 174.62 174.12 1dt3 s LEU 193 N -1.29 3.49 -0.38 4.42 2.96 -1.26 -1.20 118.68 125.43 1dt3 s LEU 193 Ca 0.15 -0.05 -0.01 0.00 -0.22 0.00 0.00 54.13 54.00 1dt3 s LEU 193 Cb -0.11 -1.87 0.10 0.00 0.50 0.00 0.00 46.19 44.82 1dt3 s LEU 193 CO 0.05 0.15 0.14 -0.31 -1.32 0.00 0.00 176.35 175.06 1dt3 s TYR 194 N 0.48 3.60 -0.71 5.38 2.02 0.58 -4.81 117.35 123.89 1dt3 s TYR 194 Ca -0.00 -2.51 -0.16 0.00 -0.37 0.00 0.00 57.07 54.02 1dt3 s TYR 194 Cb -0.14 -3.00 0.16 0.00 -0.40 0.00 0.00 41.96 38.58 1dt3 s TYR 194 CO 0.02 -0.95 0.74 0.50 -1.57 0.00 0.00 175.55 174.29 1dt3 s ARG 195 N 1.09 3.31 -0.19 -0.62 3.52 -1.26 -0.69 118.95 124.10 1dt3 s ARG 195 Ca 0.07 -1.88 -0.16 0.00 -0.13 0.00 0.00 55.73 53.63 1dt3 s ARG 195 Cb -0.21 -4.42 -0.04 0.00 -1.56 0.00 0.00 34.95 28.72 1dt3 s ARG 195 CO -0.05 -1.43 0.39 0.42 -0.81 0.00 0.00 175.30 173.81 1dt3 s ILE 196 N 1.52 5.22 0.06 4.11 1.09 -0.96 -0.83 121.20 131.41 1dt3 s ILE 196 Ca 0.15 0.70 0.08 0.00 -1.10 0.00 0.00 60.65 60.48 1dt3 s ILE 196 Cb -0.18 -3.72 -0.03 0.00 -1.06 0.00 0.00 42.46 37.47 1dt3 s ILE 196 CO -0.02 0.28 -0.22 0.42 -0.10 0.00 0.00 174.94 175.30 1dt3 s THR 197 N 1.11 2.55 -0.15 2.92 -4.23 -0.47 -1.77 115.64 115.60 1dt3 s THR 197 Ca 0.19 -1.36 -0.02 0.00 -1.18 0.00 0.00 61.69 59.32 1dt3 s THR 197 Cb -0.14 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.60 1dt3 s THR 197 CO 0.07 0.28 -0.07 -2.28 -0.54 0.00 0.00 174.62 172.09 1dt3 s HIS 198 N -0.94 2.94 0.00 3.99 2.46 -1.26 -1.23 115.29 121.25 1dt3 s HIS 198 Ca 0.14 -0.49 0.00 0.00 0.47 0.00 0.00 55.06 55.18 1dt3 s HIS 198 Cb -0.10 -1.93 0.00 0.00 -0.13 0.00 0.00 32.58 30.42 1dt3 s HIS 198 CO 0.05 -0.15 0.00 0.25 -2.47 0.00 0.00 174.74 172.42 1dt3 n THR 199 N 3.65 0.00 -1.62 0.89 -2.24 -0.58 0.20 114.28 114.58 1dt3 n THR 199 Ca -0.18 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1dt3 n THR 199 Cb 0.52 0.00 0.18 0.00 -2.10 0.00 0.00 70.33 68.94 1dt3 n THR 199 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1dt3 n ASN 200 N 1.67 2.29 -4.34 3.42 6.94 -1.26 -4.23 115.26 119.75 1dt3 n ASN 200 Ca 0.00 -3.87 -0.36 0.00 -0.02 0.00 0.00 54.58 50.33 1dt3 n ASN 200 Cb 0.00 -0.53 0.06 0.00 -2.36 0.00 0.00 39.78 36.94 1dt3 n ASN 200 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 1dt3 n ASP 201 N -1.07 -2.60 -0.03 0.53 2.03 0.54 -1.92 116.55 114.03 1dt3 n ASP 201 Ca 0.25 0.51 -0.08 0.00 0.52 0.00 0.00 54.79 55.99 1dt3 n ASP 201 Cb 0.79 -1.07 -0.14 0.00 -0.72 0.00 0.00 41.12 39.99 1dt3 n ASP 201 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dt3 n ILE 202 N -2.35 1.54 -0.18 5.18 3.06 -0.72 -4.27 119.36 121.62 1dt3 n ILE 202 Ca 0.07 -0.80 -0.02 0.00 -2.50 0.00 0.00 62.75 59.51 1dt3 n ILE 202 Cb 0.51 -0.94 0.19 0.00 0.54 0.00 0.00 39.64 39.94 1dt3 n ILE 202 CO 0.00 0.00 0.00 0.58 -2.50 0.00 0.00 176.55 174.63 1dt3 h VAL 203 N 0.00 1.22 -0.01 9.51 2.07 -1.85 -2.43 116.25 124.75 1dt3 h VAL 203 Ca -0.31 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.55 1dt3 h VAL 203 Cb 2.01 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1dt3 h VAL 203 CO 0.07 0.27 0.00 -2.65 0.02 0.00 0.00 177.57 175.28 1dt3 n PRO 204 N -4.32 1.07 0.00 1.57 -0.02 -1.24 0.03 135.00 132.09 1dt3 n PRO 204 Ca 0.06 -0.10 0.07 0.00 -2.02 0.00 0.00 63.50 61.51 1dt3 n PRO 204 Cb 0.15 -1.32 0.02 0.00 -0.02 0.00 0.00 33.50 32.34 1dt3 n PRO 204 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1dt3 n ARG 205 N -0.71 1.53 -4.16 -0.52 3.00 -0.92 -4.57 116.66 110.32 1dt3 n ARG 205 Ca 0.15 -1.01 -0.17 0.00 -0.00 0.00 0.00 57.85 56.82 1dt3 n ARG 205 Cb 0.09 -1.25 -0.12 0.00 0.00 0.00 0.00 32.46 31.18 1dt3 n ARG 205 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1dt3 s LEU 206 N -1.68 2.30 0.82 6.15 1.43 0.10 -3.86 118.68 123.95 1dt3 s LEU 206 Ca 0.14 -0.65 -0.11 0.00 -1.03 0.00 0.00 54.13 52.48 1dt3 s LEU 206 Cb 0.12 -0.43 0.09 0.00 0.03 0.00 0.00 46.19 46.00 1dt3 s LEU 206 CO 0.30 -0.13 1.09 -2.84 0.23 0.00 0.00 176.35 175.00 1dt3 s PRO 207 N -1.94 1.85 0.74 1.29 0.02 -1.26 -0.34 135.00 135.36 1dt3 s PRO 207 Ca -0.01 0.97 -0.14 0.00 0.02 0.00 0.00 61.00 61.84 1dt3 s PRO 207 Cb -0.09 -1.86 0.05 0.00 0.02 0.00 0.00 34.50 32.61 1dt3 s PRO 207 CO 0.02 -1.87 1.18 -2.14 -0.33 0.00 0.00 177.00 173.85 1dt3 s PRO 208 N -4.94 2.13 0.44 5.54 0.02 -1.25 -4.64 135.00 132.30 1dt3 s PRO 208 Ca 0.62 1.65 0.10 0.00 0.02 0.00 0.00 61.00 63.39 1dt3 s PRO 208 Cb -0.17 -1.84 0.98 0.00 0.02 0.00 0.00 34.50 33.49 1dt3 s PRO 208 CO 0.56 -1.82 2.07 0.00 -0.33 0.00 0.00 177.00 177.48 1dt3 h ARG 209 N -0.45 0.39 -0.18 5.54 2.47 -1.85 -0.59 114.38 119.71 1dt3 h ARG 209 Ca -0.47 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1dt3 h ARG 209 Cb 1.28 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 1dt3 h ARG 209 CO 0.50 0.26 0.00 -0.85 0.56 0.00 0.00 179.97 180.43 1dt3 n GLU 210 N -4.49 1.44 -0.19 0.04 0.00 -1.26 0.25 120.64 116.43 1dt3 n GLU 210 Ca 0.03 -0.69 0.07 0.00 0.00 0.00 0.00 57.16 56.56 1dt3 n GLU 210 Cb 0.11 -1.17 0.17 0.00 0.00 0.00 0.00 31.44 30.55 1dt3 n GLU 210 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1dt3 n PHE 211 N 0.04 0.51 -1.73 -1.84 3.01 -0.23 -4.99 117.46 112.23 1dt3 n PHE 211 Ca 0.08 -0.46 0.00 0.00 1.01 0.00 0.00 57.45 58.07 1dt3 n PHE 211 Cb 0.17 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 1dt3 n PHE 211 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dt3 n GLY 212 N 0.70 0.63 3.45 1.37 0.00 0.14 -4.95 105.19 106.53 1dt3 n GLY 212 Ca 0.13 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 1dt3 n GLY 212 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dt3 s TYR 213 N -2.66 2.30 0.21 1.61 1.51 -1.11 -4.42 117.35 114.79 1dt3 s TYR 213 Ca 0.00 -0.34 -0.03 0.00 -1.01 0.00 0.00 57.07 55.69 1dt3 s TYR 213 Cb 0.00 -1.06 -0.03 0.00 -0.11 0.00 0.00 41.96 40.75 1dt3 s TYR 213 CO 0.00 0.62 0.19 -1.12 -1.11 0.00 0.00 175.55 174.12 1dt3 s SER 214 N -3.12 0.11 0.08 2.29 0.01 -0.35 -4.24 113.70 108.48 1dt3 s SER 214 Ca 0.26 -1.30 0.05 0.00 1.31 0.00 0.00 55.95 56.27 1dt3 s SER 214 Cb -0.06 0.41 -0.04 0.00 0.21 0.00 0.00 66.02 66.54 1dt3 s SER 214 CO 0.13 -0.89 -0.06 -1.00 0.41 0.00 0.00 173.24 171.83 1dt3 s HIS 215 N -4.13 2.86 0.93 2.43 3.76 -1.26 -4.53 115.29 115.34 1dt3 s HIS 215 Ca 0.36 -0.09 -0.12 0.00 -0.15 0.00 0.00 55.06 55.06 1dt3 s HIS 215 Cb 0.06 -1.51 0.15 0.00 1.11 0.00 0.00 32.58 32.39 1dt3 s HIS 215 CO 0.11 0.43 1.11 -1.54 -0.85 0.00 0.00 174.74 174.00 1dt3 s SER 216 N -2.06 3.30 0.10 1.40 1.04 -1.26 -3.28 113.70 112.94 1dt3 s SER 216 Ca 0.22 1.16 0.06 0.00 0.48 0.00 0.00 55.95 57.87 1dt3 s SER 216 Cb -0.11 -1.81 -0.03 0.00 0.10 0.00 0.00 66.02 64.16 1dt3 s SER 216 CO 0.14 -2.70 -0.14 -0.55 0.98 0.00 0.00 173.24 170.96 1dt3 s SER 217 N -3.72 1.87 0.50 7.02 0.15 -1.26 -4.69 113.70 113.58 1dt3 s SER 217 Ca 0.64 -0.75 -0.00 0.00 0.70 0.00 0.00 55.95 56.53 1dt3 s SER 217 Cb -0.17 -0.06 0.04 0.00 -1.71 0.00 0.00 66.02 64.13 1dt3 s SER 217 CO 0.55 -0.13 0.28 -0.81 1.20 0.00 0.00 173.24 174.34 1dt3 n PRO 218 N 0.76 0.38 -4.35 5.44 -0.04 -1.26 -4.52 135.00 131.41 1dt3 n PRO 218 Ca -0.17 -0.75 -0.31 0.00 -0.04 0.00 0.00 63.50 62.23 1dt3 n PRO 218 Cb 0.56 -0.19 -0.16 0.00 -0.04 0.00 0.00 33.50 33.66 1dt3 n PRO 218 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1dt3 s GLU 219 N -3.17 2.63 -0.45 0.54 2.12 -0.48 -4.55 118.70 115.35 1dt3 s GLU 219 Ca 0.19 -0.70 -0.18 0.00 0.36 0.00 0.00 54.97 54.63 1dt3 s GLU 219 Cb -0.01 -2.24 0.03 0.00 0.26 0.00 0.00 34.13 32.18 1dt3 s GLU 219 CO 0.12 -0.12 0.52 0.71 -0.54 0.00 0.00 175.26 175.96 1dt3 s TYR 220 N 1.11 3.12 -0.13 5.30 2.02 -0.01 -0.23 117.35 128.53 1dt3 s TYR 220 Ca -0.02 -0.39 -0.04 0.00 -0.37 0.00 0.00 57.07 56.25 1dt3 s TYR 220 Cb -0.14 -3.16 -0.03 0.00 -0.40 0.00 0.00 41.96 38.22 1dt3 s TYR 220 CO -0.06 -0.83 0.01 -0.46 -1.57 0.00 0.00 175.55 172.64 1dt3 s TRP 221 N 2.36 3.15 -0.27 2.71 -0.00 0.32 -1.37 118.94 125.84 1dt3 s TRP 221 Ca 0.14 0.02 -0.09 0.00 -0.00 0.00 0.00 56.10 56.17 1dt3 s TRP 221 Cb -0.17 -1.91 -0.03 0.00 -0.00 0.00 0.00 33.47 31.35 1dt3 s TRP 221 CO 0.14 0.24 0.13 0.42 -0.00 0.00 0.00 176.95 177.89 1dt3 s ILE 222 N -0.20 4.79 -0.73 5.86 1.01 -0.37 0.10 121.20 131.66 1dt3 s ILE 222 Ca 0.05 -0.06 0.24 0.00 0.00 0.00 0.00 60.65 60.88 1dt3 s ILE 222 Cb -0.12 -3.29 -0.05 0.00 0.01 0.00 0.00 42.46 39.00 1dt3 s ILE 222 CO 0.02 0.26 1.18 0.29 0.00 0.00 0.00 174.94 176.69 1dt3 n LYS 223 N 4.99 0.21 -2.00 2.79 5.02 0.39 -1.53 118.16 128.03 1dt3 n LYS 223 Ca -0.15 0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 55.83 1dt3 n LYS 223 Cb 0.51 -1.59 0.01 0.00 -0.02 0.00 0.00 35.03 33.95 1dt3 n LYS 223 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1dt3 s SER 224 N -3.73 5.74 1.03 4.39 1.04 -1.26 -4.90 113.70 116.01 1dt3 s SER 224 Ca 0.06 1.80 -0.17 0.00 0.48 0.00 0.00 55.95 58.12 1dt3 s SER 224 Cb 0.15 -2.53 0.23 0.00 0.10 0.00 0.00 66.02 63.97 1dt3 s SER 224 CO 0.76 -1.20 1.28 -0.83 0.98 0.00 0.00 173.24 174.24 1dt3 s GLY 225 N -2.86 1.75 0.31 7.32 0.00 -1.26 -4.69 107.32 107.88 1dt3 s GLY 225 Ca 0.63 -1.19 -0.29 0.00 0.00 0.00 0.00 44.72 43.88 1dt3 s GLY 225 CO 0.38 -0.37 1.37 -1.59 0.00 0.00 0.00 173.10 172.90 1dt3 s THR 226 N -3.71 2.62 -1.83 0.90 2.01 -1.26 -2.14 115.64 112.22 1dt3 s THR 226 Ca 0.74 0.58 0.00 0.00 0.31 0.00 0.00 61.69 63.32 1dt3 s THR 226 Cb -0.05 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 69.09 1dt3 s THR 226 CO 0.54 0.12 0.00 0.18 -0.69 0.00 0.00 174.62 174.77 1dt3 n LEU 227 N 1.27 -1.58 -4.26 4.42 4.77 -1.26 -5.00 117.00 115.36 1dt3 n LEU 227 Ca 0.02 0.26 -0.32 0.00 -0.03 0.00 0.00 56.01 55.94 1dt3 n LEU 227 Cb 0.41 -2.66 -0.16 0.00 -2.33 0.00 0.00 43.42 38.67 1dt3 n LEU 227 CO 0.60 -0.65 -0.53 -0.69 -1.33 0.00 0.00 177.39 174.79 1dt3 s VAL 228 N -2.80 2.33 0.54 4.08 1.01 -0.91 -5.09 120.40 119.56 1dt3 s VAL 228 Ca 0.00 -0.92 -0.19 0.00 0.00 0.00 0.00 61.98 60.87 1dt3 s VAL 228 Cb 0.00 -1.92 -0.09 0.00 0.00 0.00 0.00 36.38 34.37 1dt3 s VAL 228 CO 0.00 0.55 0.54 -2.65 0.00 0.00 0.00 175.10 173.54 1dt3 n PRO 229 N 3.53 0.55 -3.59 2.72 -0.02 -1.26 -4.75 135.00 132.18 1dt3 n PRO 229 Ca -0.19 0.21 -0.32 0.00 -2.02 0.00 0.00 63.50 61.18 1dt3 n PRO 229 Cb 0.53 -1.69 -0.05 0.00 -0.02 0.00 0.00 33.50 32.27 1dt3 n PRO 229 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dt3 s VAL 230 N -1.67 5.09 0.41 -1.45 1.01 -1.26 -4.97 120.40 117.56 1dt3 s VAL 230 Ca 0.68 0.24 0.07 0.00 0.00 0.00 0.00 61.98 62.96 1dt3 s VAL 230 Cb -0.47 -3.63 -0.08 0.00 0.00 0.00 0.00 36.38 32.21 1dt3 s VAL 230 CO 0.55 0.07 0.01 0.42 0.00 0.00 0.00 175.10 176.15 1dt3 s THR 231 N -1.63 1.97 -0.63 3.92 -4.23 -1.26 -5.03 115.64 108.75 1dt3 s THR 231 Ca 0.41 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.16 1dt3 s THR 231 Cb -0.12 -2.97 0.26 0.00 1.34 0.00 0.00 72.50 71.01 1dt3 s THR 231 CO 0.22 0.00 1.75 -2.11 -0.54 0.00 0.00 174.62 173.94 1dt3 n ARG 232 N -0.98 0.22 0.18 3.99 1.85 -1.26 -0.81 116.66 119.85 1dt3 n ARG 232 Ca -0.05 0.31 0.03 0.00 -1.00 0.00 0.00 57.85 57.14 1dt3 n ARG 232 Cb 0.67 -1.82 0.33 0.00 -1.05 0.00 0.00 32.46 30.59 1dt3 n ARG 232 CO 0.00 0.00 0.00 -0.91 -0.01 0.00 0.00 177.63 176.71 1dt3 h ASN 233 N 0.00 0.00 0.49 2.89 4.21 -1.96 -3.06 115.58 118.15 1dt3 h ASN 233 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1dt3 h ASN 233 Cb 0.55 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.75 1dt3 h ASN 233 CO 0.00 0.42 0.00 0.47 -1.29 0.00 0.00 177.43 177.03 1dt3 n ASP 234 N -3.80 0.00 -4.67 5.81 8.00 0.01 -4.78 116.55 117.12 1dt3 n ASP 234 Ca -0.01 -0.04 -0.37 0.00 0.71 0.00 0.00 54.79 55.08 1dt3 n ASP 234 Cb 0.48 -0.30 -0.09 0.00 -0.02 0.00 0.00 41.12 41.19 1dt3 n ASP 234 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1dt3 s ILE 235 N -2.59 5.35 -0.10 0.53 1.01 -1.18 -0.46 121.20 123.76 1dt3 s ILE 235 Ca 0.23 0.23 0.02 0.00 0.00 0.00 0.00 60.65 61.12 1dt3 s ILE 235 Cb 0.17 -3.52 -0.02 0.00 0.01 0.00 0.00 42.46 39.10 1dt3 s ILE 235 CO 0.38 0.34 -0.15 -0.69 0.00 0.00 0.00 174.94 174.83 1dt3 s VAL 236 N 1.03 2.94 -0.27 2.92 1.01 0.11 -4.02 120.40 124.13 1dt3 s VAL 236 Ca 0.09 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.19 1dt3 s VAL 236 Cb -0.13 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1dt3 s VAL 236 CO 0.04 0.55 0.39 -0.75 0.00 0.00 0.00 175.10 175.33 1dt3 s LYS 237 N -0.01 4.01 -0.21 2.72 2.20 -1.26 -0.52 119.74 126.67 1dt3 s LYS 237 Ca -0.04 0.06 -0.03 0.00 -0.36 0.00 0.00 55.97 55.60 1dt3 s LYS 237 Cb -0.14 -3.66 -0.01 0.00 -1.51 0.00 0.00 37.83 32.51 1dt3 s LYS 237 CO 0.04 -0.29 -0.06 0.42 -0.36 0.00 0.00 175.35 175.10 1dt3 s ILE 238 N 2.10 3.25 -0.12 5.43 -1.09 0.68 -4.95 121.20 126.50 1dt3 s ILE 238 Ca 0.16 -0.54 -0.05 0.00 -2.23 0.00 0.00 60.65 57.98 1dt3 s ILE 238 Cb -0.16 -2.47 -0.04 0.00 -1.58 0.00 0.00 42.46 38.22 1dt3 s ILE 238 CO 0.10 0.44 0.09 -0.70 -1.23 0.00 0.00 174.94 173.64 1dt3 s GLU 239 N 1.37 3.38 0.00 2.79 2.56 -1.26 -1.38 118.70 126.16 1dt3 s GLU 239 Ca 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 54.97 54.77 1dt3 s GLU 239 Cb -0.14 -3.07 0.00 0.00 2.00 0.00 0.00 34.13 32.92 1dt3 s GLU 239 CO -0.03 0.68 0.00 0.41 -0.56 0.00 0.00 175.26 175.76 1dt3 n GLY 240 N 2.26 3.23 3.73 -1.50 0.00 -1.26 -4.75 105.19 106.90 1dt3 n GLY 240 Ca -0.19 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 43.97 1dt3 n GLY 240 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dt3 s ILE 241 N -0.54 3.05 -1.43 -0.61 1.01 -1.26 -2.31 121.20 119.12 1dt3 s ILE 241 Ca 0.00 0.83 -0.08 0.00 0.00 0.00 0.00 60.65 61.40 1dt3 s ILE 241 Cb 0.00 -3.53 0.04 0.00 0.01 0.00 0.00 42.46 38.98 1dt3 s ILE 241 CO 0.00 0.11 0.62 0.47 0.00 0.00 0.00 174.94 176.14 1dt3 n ASP 242 N 2.99 -4.93 -4.75 3.58 8.00 -1.21 -4.89 116.55 115.34 1dt3 n ASP 242 Ca 0.08 -0.40 -0.38 0.00 0.71 0.00 0.00 54.79 54.80 1dt3 n ASP 242 Cb 0.42 -4.01 0.04 0.00 -0.02 0.00 0.00 41.12 37.55 1dt3 n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dt3 s ALA 243 N -3.09 2.82 0.27 2.24 0.00 -0.98 -5.03 121.76 118.00 1dt3 s ALA 243 Ca 0.40 1.32 0.08 0.00 0.00 0.00 0.00 51.96 53.75 1dt3 s ALA 243 Cb -0.20 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.33 1dt3 s ALA 243 CO 0.49 -1.34 0.15 0.95 0.00 0.00 0.00 175.76 176.00 1dt3 s THR 244 N -1.31 3.99 0.00 0.00 -4.23 -1.26 -4.48 115.64 108.35 1dt3 s THR 244 Ca 0.71 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1dt3 s THR 244 Cb -0.40 -3.20 0.00 0.00 1.34 0.00 0.00 72.50 70.24 1dt3 s THR 244 CO 0.47 -0.33 0.00 0.61 -0.54 0.00 0.00 174.62 174.83 1dt3 n GLY 245 N -1.12 2.15 0.00 3.99 0.00 -1.25 -4.96 105.19 104.00 1dt3 n GLY 245 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1dt3 n GLY 245 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dt3 n GLY 246 N -0.42 2.08 0.20 -0.02 0.00 -1.26 -5.01 105.19 100.76 1dt3 n GLY 246 Ca 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 1dt3 n GLY 246 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1dt3 h ASN 247 N 0.00 0.39 0.00 1.61 -0.73 -1.91 -3.38 115.58 111.56 1dt3 h ASN 247 Ca 0.00 -0.18 -0.68 0.00 1.87 0.00 0.00 56.30 57.31 1dt3 h ASN 247 Cb 0.00 -0.11 -0.00 0.00 0.27 0.00 0.00 38.32 38.48 1dt3 h ASN 247 CO 0.00 0.80 2.83 -3.20 -0.37 0.00 0.00 177.43 177.49 1dt3 n ASN 248 N -3.98 3.57 -4.49 1.15 5.15 -1.26 -4.86 115.26 110.54 1dt3 n ASN 248 Ca -0.02 -2.75 -0.25 0.00 -0.60 0.00 0.00 54.58 50.96 1dt3 n ASN 248 Cb 0.54 -1.42 -0.10 0.00 -0.53 0.00 0.00 39.78 38.26 1dt3 n ASN 248 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1dt3 s GLN 249 N 3.87 1.74 -0.00 1.20 -0.21 -1.26 -3.90 119.66 121.09 1dt3 s GLN 249 Ca 0.52 -1.64 0.06 0.00 0.02 0.00 0.00 55.36 54.32 1dt3 s GLN 249 Cb 0.14 -1.86 0.17 0.00 1.00 0.00 0.00 33.01 32.46 1dt3 s GLN 249 CO -0.01 0.36 1.12 -0.35 -2.12 0.00 0.00 175.29 174.29 1dt3 n PRO 250 N -0.40 1.46 -2.19 2.91 -0.04 -1.26 -4.86 135.00 130.62 1dt3 n PRO 250 Ca -0.07 -0.67 -0.27 0.00 -0.04 0.00 0.00 63.50 62.44 1dt3 n PRO 250 Cb 0.59 -1.17 0.13 0.00 -0.04 0.00 0.00 33.50 33.00 1dt3 n PRO 250 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1dt3 s ASN 251 N -0.96 4.02 0.27 3.54 2.20 -1.26 -5.04 114.94 117.70 1dt3 s ASN 251 Ca 0.12 0.18 -0.29 0.00 -0.94 0.00 0.00 52.86 51.93 1dt3 s ASN 251 Cb 0.07 -0.51 -0.09 0.00 -2.00 0.00 0.00 41.25 38.71 1dt3 s ASN 251 CO 0.08 -2.12 1.01 -0.63 -2.94 0.00 0.00 177.10 172.50 1dt3 s ILE 252 N -3.48 3.81 0.10 0.54 1.01 -1.26 -5.05 121.20 116.86 1dt3 s ILE 252 Ca 0.67 1.80 0.01 0.00 0.00 0.00 0.00 60.65 63.12 1dt3 s ILE 252 Cb -0.07 -4.13 0.02 0.00 0.01 0.00 0.00 42.46 38.29 1dt3 s ILE 252 CO 0.48 0.40 0.14 -0.81 0.00 0.00 0.00 174.94 175.15 1dt3 n PRO 253 N 1.26 0.67 -3.70 2.79 -0.04 -1.26 -5.01 135.00 129.71 1dt3 n PRO 253 Ca -0.01 -0.43 -0.14 0.00 -0.04 0.00 0.00 63.50 62.88 1dt3 n PRO 253 Cb 0.46 -0.08 -0.08 0.00 -0.04 0.00 0.00 33.50 33.76 1dt3 n PRO 253 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1dt3 s ASP 254 N -1.58 -0.36 -0.15 3.54 2.15 -0.81 -4.97 116.67 114.48 1dt3 s ASP 254 Ca 0.10 0.45 -0.09 0.00 0.43 0.00 0.00 52.55 53.43 1dt3 s ASP 254 Cb -0.01 0.53 -0.24 0.00 -0.30 0.00 0.00 42.92 42.91 1dt3 s ASP 254 CO 0.06 -0.39 0.29 -0.38 -0.17 0.00 0.00 175.17 174.58 1dt3 n ILE 255 N 1.67 1.72 0.04 4.11 5.41 -1.26 -1.76 119.36 129.28 1dt3 n ILE 255 Ca -0.19 -0.53 0.18 0.00 1.00 0.00 0.00 62.75 63.22 1dt3 n ILE 255 Cb 0.56 -1.78 0.68 0.00 -0.71 0.00 0.00 39.64 38.40 1dt3 n ILE 255 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1dt3 h PRO 256 N -0.16 0.01 -0.02 0.38 0.11 -1.98 0.23 132.00 130.56 1dt3 h PRO 256 Ca -0.43 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.64 1dt3 h PRO 256 Cb 1.88 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.98 1dt3 h PRO 256 CO 0.01 0.00 -0.21 0.00 -0.21 0.00 0.00 178.00 177.59 1dt3 h ALA 257 N 1.77 1.62 -0.48 -0.75 0.00 -1.93 -1.56 119.26 117.92 1dt3 h ALA 257 Ca 0.21 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1dt3 h ALA 257 Cb 0.85 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1dt3 h ALA 257 CO -0.00 0.29 0.23 1.25 0.00 0.00 0.00 179.25 181.01 1dt3 h HIS 258 N 0.03 0.66 -0.27 0.00 6.17 -0.74 -3.02 115.15 117.98 1dt3 h HIS 258 Ca 0.00 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.07 1dt3 h HIS 258 Cb 0.39 -0.21 0.00 0.00 2.52 0.00 0.00 27.41 30.11 1dt3 h HIS 258 CO 0.00 0.49 0.00 1.28 0.71 0.00 0.00 177.93 180.41 1dt3 n LEU 259 N -4.38 1.92 -3.71 0.26 4.77 -0.59 -4.67 117.00 110.59 1dt3 n LEU 259 Ca 0.04 -0.96 -0.30 0.00 -0.03 0.00 0.00 56.01 54.76 1dt3 n LEU 259 Cb 0.12 -0.30 -0.14 0.00 -2.33 0.00 0.00 43.42 40.78 1dt3 n LEU 259 CO 0.37 0.39 -0.29 0.86 -1.33 0.00 0.00 177.39 177.40 1dt3 s TRP 260 N -1.63 1.85 -0.59 -1.77 -0.11 -1.14 -1.21 118.94 114.34 1dt3 s TRP 260 Ca 0.20 -2.14 0.02 0.00 1.22 0.00 0.00 56.10 55.41 1dt3 s TRP 260 Cb 0.12 -1.79 0.15 0.00 -1.50 0.00 0.00 33.47 30.44 1dt3 s TRP 260 CO 0.11 -0.83 0.36 0.71 -4.62 0.00 0.00 176.95 172.68 1dt3 s TYR 261 N 0.89 3.31 0.00 5.86 1.51 -1.26 -4.84 117.35 122.81 1dt3 s TYR 261 Ca 0.15 -3.09 0.00 0.00 -1.01 0.00 0.00 57.07 53.11 1dt3 s TYR 261 Cb -0.22 -2.91 0.00 0.00 -0.11 0.00 0.00 41.96 38.72 1dt3 s TYR 261 CO -0.09 -0.74 0.00 1.19 -1.11 0.00 0.00 175.55 174.80 1dt3 n PHE 262 N 2.99 0.00 -3.68 2.71 3.72 -1.26 -4.64 117.46 117.31 1dt3 n PHE 262 Ca 0.08 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.42 1dt3 n PHE 262 Cb 0.34 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.90 1dt3 n PHE 262 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1dt3 n GLY 263 N -0.03 1.09 3.74 1.37 0.00 -1.26 -4.60 105.19 105.49 1dt3 n GLY 263 Ca 0.00 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 1dt3 n GLY 263 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1dt3 s LEU 264 N 0.00 4.49 -0.08 0.99 2.96 -1.26 -4.46 118.68 121.32 1dt3 s LEU 264 Ca 0.14 2.13 -0.14 0.00 -0.22 0.00 0.00 54.13 56.04 1dt3 s LEU 264 Cb -0.04 -3.61 0.03 0.00 0.50 0.00 0.00 46.19 43.08 1dt3 s LEU 264 CO 0.09 -0.23 0.34 -0.51 -1.32 0.00 0.00 176.35 174.72 1dt3 s ILE 265 N -0.34 0.02 0.00 6.68 2.07 -0.35 -4.87 121.20 124.42 1dt3 s ILE 265 Ca 0.49 -0.21 0.00 0.00 -1.41 0.00 0.00 60.65 59.52 1dt3 s ILE 265 Cb -0.30 -0.56 0.00 0.00 0.13 0.00 0.00 42.46 41.73 1dt3 s ILE 265 CO 0.36 -0.11 0.00 0.61 -1.91 0.00 0.00 174.94 173.89 1dt3 n GLY 266 N 2.15 0.63 3.64 1.50 0.00 -1.26 -4.39 105.19 107.46 1dt3 n GLY 266 Ca -0.17 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.57 1dt3 n GLY 266 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1dt3 s THR 267 N -2.00 0.00 -0.21 2.61 -1.32 -1.26 -4.90 115.64 108.56 1dt3 s THR 267 Ca 0.00 0.00 -0.04 0.00 -1.21 0.00 0.00 61.69 60.44 1dt3 s THR 267 Cb 0.00 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.98 1dt3 s THR 267 CO 0.00 0.00 -0.03 0.00 -2.21 0.00 0.00 174.62 172.38