#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e1b n ARG 2 N 0.00 0.00 -2.00 0.03 3.00 -1.26 -4.79 116.66 111.64 3e1b n ARG 2 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.85 57.60 3e1b n ARG 2 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.40 3e1b n ARG 2 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 3e1b s HIS 3 N 1.36 1.76 -0.31 -0.14 2.46 -1.26 -4.87 115.29 114.30 3e1b s HIS 3 Ca 0.00 0.76 0.03 0.00 0.47 0.00 0.00 55.06 56.32 3e1b s HIS 3 Cb 0.00 -3.96 0.16 0.00 -0.13 0.00 0.00 32.58 28.65 3e1b s HIS 3 CO 0.00 -1.59 0.44 0.50 -2.47 0.00 0.00 174.74 171.62 3e1b s ARG 4 N 7.10 0.48 0.31 2.88 6.06 -1.26 -5.17 118.95 129.35 3e1b s ARG 4 Ca 0.72 0.04 0.00 0.00 -2.50 0.00 0.00 55.73 53.99 3e1b s ARG 4 Cb -0.06 -0.28 0.00 0.00 0.06 0.00 0.00 34.95 34.68 3e1b s ARG 4 CO 0.03 -1.06 0.00 1.63 -2.50 0.00 0.00 175.30 173.40 3e1b n LYS 5 N 5.19 -2.59 0.18 5.12 5.02 -1.26 -4.68 118.16 125.14 3e1b n LYS 5 Ca 0.03 1.73 -0.13 0.00 -2.02 0.00 0.00 58.31 57.91 3e1b n LYS 5 Cb 0.50 -3.15 -0.08 0.00 -0.02 0.00 0.00 35.03 32.28 3e1b n LYS 5 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3e1b h SER 6 N -1.18 -0.39 -0.38 4.39 0.87 -2.02 -3.47 113.55 111.37 3e1b h SER 6 Ca 0.02 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 3e1b h SER 6 Cb 1.16 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 3e1b h SER 6 CO 0.01 -0.04 0.00 0.61 -0.53 0.00 0.00 176.83 176.88 3e1b n GLY 7 N -0.41 0.22 0.00 5.77 0.00 -1.26 -4.07 105.19 105.45 3e1b n GLY 7 Ca -0.10 -0.88 0.13 0.00 0.00 0.00 0.00 46.02 45.17 3e1b n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3e1b n ARG 8 N -0.75 1.01 -2.80 1.61 1.74 -1.26 -4.80 116.66 111.41 3e1b n ARG 8 Ca 0.00 -0.01 -0.41 0.00 -0.77 0.00 0.00 57.85 56.66 3e1b n ARG 8 Cb 0.00 -1.41 -0.03 0.00 -1.02 0.00 0.00 32.46 30.00 3e1b n ARG 8 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3e1b s GLN 9 N -2.00 4.50 -0.44 5.56 -0.21 -1.26 -5.02 119.66 120.80 3e1b s GLN 9 Ca 0.39 1.26 0.08 0.00 0.02 0.00 0.00 55.36 57.11 3e1b s GLN 9 Cb 0.18 -3.47 0.28 0.00 1.00 0.00 0.00 33.01 31.00 3e1b s GLN 9 CO 0.30 -0.06 0.82 1.28 -2.12 0.00 0.00 175.29 175.51 3e1b n LEU 10 N 4.05 -1.35 0.00 2.90 4.32 -1.26 -4.94 117.00 120.72 3e1b n LEU 10 Ca 0.04 -4.05 0.00 0.00 -0.02 0.00 0.00 56.01 51.99 3e1b n LEU 10 Cb 0.51 0.79 0.00 0.00 -1.62 0.00 0.00 43.42 43.10 3e1b n LEU 10 CO 0.51 2.09 0.00 -3.20 -1.22 0.00 0.00 177.39 175.56 3e1b n ASN 11 N 1.05 0.00 -4.56 -1.43 4.05 -1.26 -4.83 115.26 108.27 3e1b n ASN 11 Ca 0.14 0.00 -0.31 0.00 0.45 0.00 0.00 54.58 54.86 3e1b n ASN 11 Cb 0.63 0.00 0.18 0.00 1.23 0.00 0.00 39.78 41.81 3e1b n ASN 11 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 3e1b n ARG 12 N 0.00 -0.89 -1.52 1.20 1.74 -1.26 -4.95 116.66 110.99 3e1b n ARG 12 Ca 0.00 -0.21 -0.42 0.00 -0.77 0.00 0.00 57.85 56.46 3e1b n ARG 12 Cb 0.00 -2.21 -0.06 0.00 -1.02 0.00 0.00 32.46 29.17 3e1b n ARG 12 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3e1b n ASN 13 N -3.72 1.98 -0.25 0.55 4.13 -1.26 -4.83 115.26 111.86 3e1b n ASN 13 Ca 0.09 -0.07 0.05 0.00 1.68 0.00 0.00 54.58 56.34 3e1b n ASN 13 Cb 0.53 -1.37 0.17 0.00 -1.54 0.00 0.00 39.78 37.57 3e1b n ASN 13 CO 0.00 0.00 0.00 -1.28 0.28 0.00 0.00 177.26 176.26 3e1b h SER 14 N 15.82 -0.13 -0.04 6.41 0.87 -1.93 0.10 113.55 134.65 3e1b h SER 14 Ca -0.23 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 3e1b h SER 14 Cb 1.29 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 63.50 3e1b h SER 14 CO 1.15 -0.10 0.00 -1.54 -0.53 0.00 0.00 176.83 175.80 3e1b n SER 15 N -5.24 0.37 -0.11 6.23 3.41 -1.26 -1.34 113.62 115.68 3e1b n SER 15 Ca 0.14 -1.56 0.02 0.00 -0.26 0.00 0.00 58.87 57.21 3e1b n SER 15 Cb 0.47 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 3e1b n SER 15 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3e1b n HIS 16 N -0.51 0.00 -0.10 7.33 -0.00 0.20 -4.77 115.22 117.37 3e1b n HIS 16 Ca 0.13 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.74 3e1b n HIS 16 Cb 0.11 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 29.97 3e1b n HIS 16 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.34 179.23 3e1b n ARG 17 N -0.22 0.93 0.00 -0.41 1.85 -0.31 -4.67 116.66 113.83 3e1b n ARG 17 Ca 0.02 0.02 0.00 0.00 -1.00 0.00 0.00 57.85 56.89 3e1b n ARG 17 Cb 0.09 -1.47 0.00 0.00 -1.05 0.00 0.00 32.46 30.03 3e1b n ARG 17 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 3e1b n GLN 18 N -2.79 0.00 0.00 2.89 1.13 -0.45 -4.62 117.38 113.54 3e1b n GLN 18 Ca -0.32 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.74 3e1b n GLN 18 Cb 1.06 -1.22 0.00 0.00 0.11 0.00 0.00 30.24 30.19 3e1b n GLN 18 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3e1b n ALA 19 N -0.64 0.52 -0.09 -1.58 0.00 -1.26 -4.21 120.51 113.23 3e1b n ALA 19 Ca 0.00 0.00 0.24 0.00 0.00 0.00 0.00 53.44 53.68 3e1b n ALA 19 Cb 0.00 -0.38 0.70 0.00 0.00 0.00 0.00 19.45 19.76 3e1b n ALA 19 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3e1b h MET 20 N 0.00 0.02 -0.28 0.00 2.86 -1.98 -3.24 114.93 112.31 3e1b h MET 20 Ca 0.00 -0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 3e1b h MET 20 Cb 0.18 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 3e1b h MET 20 CO 0.00 0.02 -0.06 0.74 1.06 0.00 0.00 176.91 178.66 3e1b h PHE 21 N 0.02 0.47 0.00 -0.22 -1.00 -1.97 -0.50 116.94 113.74 3e1b h PHE 21 Ca 0.34 -0.05 0.00 0.00 2.81 0.00 0.00 57.97 61.07 3e1b h PHE 21 Cb 1.33 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 40.76 3e1b h PHE 21 CO -0.00 0.51 -0.03 -2.13 -1.61 0.00 0.00 178.31 175.05 3e1b n ARG 22 N -4.26 0.00 -0.00 1.51 0.63 -1.25 -4.40 116.66 108.89 3e1b n ARG 22 Ca 0.01 -0.52 -0.00 0.00 -0.92 0.00 0.00 57.85 56.42 3e1b n ARG 22 Cb 0.27 -0.49 -0.00 0.00 0.45 0.00 0.00 32.46 32.69 3e1b n ARG 22 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3e1b n ASN 23 N 0.00 0.06 0.24 6.15 4.13 -1.22 -4.44 115.26 120.17 3e1b n ASN 23 Ca 0.00 0.17 -0.10 0.00 1.68 0.00 0.00 54.58 56.33 3e1b n ASN 23 Cb 0.51 -0.51 -0.05 0.00 -1.54 0.00 0.00 39.78 38.19 3e1b n ASN 23 CO 0.00 0.00 0.00 0.24 0.28 0.00 0.00 177.26 177.78 3e1b h MET 24 N -0.03 -0.64 0.00 3.52 2.86 -1.62 -3.27 114.93 115.75 3e1b h MET 24 Ca 0.00 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 3e1b h MET 24 Cb 0.02 0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.83 3e1b h MET 24 CO 0.00 -0.42 0.00 0.00 1.06 0.00 0.00 176.91 177.55 3e1b n ALA 25 N -2.73 1.97 0.06 6.32 0.00 -0.25 -1.70 120.51 124.19 3e1b n ALA 25 Ca -0.08 -0.06 -0.03 0.00 0.00 0.00 0.00 53.44 53.26 3e1b n ALA 25 Cb 0.27 -1.16 -0.07 0.00 0.00 0.00 0.00 19.45 18.48 3e1b n ALA 25 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3e1b h GLY 26 N 2.15 0.00 0.79 0.00 0.00 -1.77 -3.40 103.07 100.83 3e1b h GLY 26 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 3e1b h GLY 26 CO 0.00 0.00 -0.08 1.76 0.00 0.00 0.00 176.54 178.22 3e1b h SER 27 N 0.00 0.40 0.00 0.19 0.02 -1.47 -3.45 113.55 109.23 3e1b h SER 27 Ca -0.09 -0.40 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 3e1b h SER 27 Cb 1.67 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 64.10 3e1b h SER 27 CO 0.09 0.70 0.00 0.18 -1.14 0.00 0.00 176.83 176.66 3e1b n LEU 28 N -4.60 0.00 -0.00 5.07 4.77 -1.26 -1.35 117.00 119.63 3e1b n LEU 28 Ca -0.05 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 55.95 3e1b n LEU 28 Cb 0.30 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 3e1b n LEU 28 CO 0.38 0.00 -0.50 0.52 -1.33 0.00 0.00 177.39 176.47 3e1b n VAL 29 N 0.00 0.00 -0.33 4.08 0.31 -1.26 -4.40 118.33 116.73 3e1b n VAL 29 Ca 0.00 -0.11 -0.03 0.00 -0.01 0.00 0.00 64.34 64.18 3e1b n VAL 29 Cb 0.00 0.46 0.01 0.00 -0.91 0.00 0.00 33.84 33.41 3e1b n VAL 29 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 3e1b h ARG 30 N 0.00 -0.05 -1.43 5.55 3.08 -1.55 -3.38 114.38 116.60 3e1b h ARG 30 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 3e1b h ARG 30 Cb 0.16 0.01 -0.25 0.00 0.08 0.00 0.00 29.97 29.97 3e1b h ARG 30 CO 0.00 -0.04 -0.43 -3.38 -1.07 0.00 0.00 179.97 175.05 3e1b s HIS 31 N -5.91 -1.30 -1.51 3.04 -3.43 -1.26 -5.09 115.29 99.84 3e1b s HIS 31 Ca -0.14 0.92 0.09 0.00 -0.80 0.00 0.00 55.06 55.13 3e1b s HIS 31 Cb 0.18 0.15 0.46 0.00 -1.43 0.00 0.00 32.58 31.95 3e1b s HIS 31 CO 0.70 -0.93 1.14 -0.85 -2.00 0.00 0.00 174.74 172.80 3e1b n GLU 32 N 5.39 0.15 -2.24 -0.38 0.00 -1.26 -4.64 120.64 117.65 3e1b n GLU 32 Ca 0.00 0.17 -0.32 0.00 0.00 0.00 0.00 57.16 57.02 3e1b n GLU 32 Cb 0.51 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 30.41 3e1b n GLU 32 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 3e1b s ILE 33 N -2.49 3.63 -0.15 3.84 1.01 -1.26 -4.74 121.20 121.03 3e1b s ILE 33 Ca 0.09 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.22 3e1b s ILE 33 Cb 0.06 -4.40 0.03 0.00 0.01 0.00 0.00 42.46 38.16 3e1b s ILE 33 CO 0.13 -1.32 -0.12 -0.63 0.00 0.00 0.00 174.94 173.01 3e1b s ILE 34 N 8.18 1.46 -0.01 2.92 1.09 -1.26 -5.00 121.20 128.58 3e1b s ILE 34 Ca 0.61 -0.64 0.01 0.00 -1.10 0.00 0.00 60.65 59.54 3e1b s ILE 34 Cb -0.04 -1.43 0.02 0.00 -1.06 0.00 0.00 42.46 39.95 3e1b s ILE 34 CO -0.04 0.37 0.75 2.29 -0.10 0.00 0.00 174.94 178.21 3e1b n LYS 35 N 4.79 0.54 -0.55 2.79 2.85 -1.26 -3.95 118.16 123.38 3e1b n LYS 35 Ca -0.15 -0.94 -0.30 0.00 -1.05 0.00 0.00 58.31 55.87 3e1b n LYS 35 Cb 0.49 -0.65 0.22 0.00 -0.65 0.00 0.00 35.03 34.45 3e1b n LYS 35 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 3e1b n THR 36 N -0.18 0.00 -1.83 0.58 5.66 -1.26 -3.31 114.28 113.93 3e1b n THR 36 Ca 0.01 -0.38 -0.41 0.00 -3.05 0.00 0.00 64.05 60.22 3e1b n THR 36 Cb 0.53 -0.80 -0.01 0.00 -1.55 0.00 0.00 70.33 68.49 3e1b n THR 36 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 3e1b s THR 37 N -2.29 2.15 0.27 1.09 -1.32 -1.26 -1.33 115.64 112.94 3e1b s THR 37 Ca 0.62 0.14 -0.03 0.00 -1.21 0.00 0.00 61.69 61.21 3e1b s THR 37 Cb -0.18 -3.09 0.15 0.00 -1.51 0.00 0.00 72.50 67.87 3e1b s THR 37 CO 0.65 0.03 1.81 0.25 -2.21 0.00 0.00 174.62 175.15 3e1b h LEU 38 N 3.99 0.84 -1.57 9.08 5.85 -0.94 -2.45 115.31 130.12 3e1b h LEU 38 Ca -0.49 -0.15 0.26 0.00 0.84 0.00 0.00 57.88 58.35 3e1b h LEU 38 Cb 1.23 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 3e1b h LEU 38 CO 0.72 0.81 0.92 -0.65 -0.34 0.00 0.00 178.44 179.90 3e1b h PRO 39 N 0.87 0.00 0.00 5.25 0.11 -1.93 -3.08 132.00 133.22 3e1b h PRO 39 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3e1b h PRO 39 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 3e1b h PRO 39 CO -0.00 0.00 -0.84 0.36 -0.21 0.00 0.00 178.00 177.30 3e1b n LYS 40 N -3.57 1.80 -0.33 1.05 2.85 -1.18 -4.76 118.16 114.03 3e1b n LYS 40 Ca 0.20 0.00 0.18 0.00 -1.05 0.00 0.00 58.31 57.64 3e1b n LYS 40 Cb 1.22 -0.92 0.35 0.00 -0.65 0.00 0.00 35.03 35.03 3e1b n LYS 40 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3e1b n ALA 41 N -2.04 0.61 -0.13 0.58 0.00 -0.93 -1.72 120.51 116.89 3e1b n ALA 41 Ca 0.00 1.02 0.22 0.00 0.00 0.00 0.00 53.44 54.68 3e1b n ALA 41 Cb 0.42 -0.81 0.65 0.00 0.00 0.00 0.00 19.45 19.71 3e1b n ALA 41 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3e1b h LYS 42 N 0.00 0.12 -0.27 0.00 2.10 -1.83 -0.42 116.57 116.26 3e1b h LYS 42 Ca 0.64 -0.01 -0.11 0.00 -2.00 0.00 0.00 60.65 59.17 3e1b h LYS 42 Cb 1.44 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 32.73 3e1b h LYS 42 CO -0.86 0.08 -0.31 1.49 -2.00 0.00 0.00 179.45 177.85 3e1b h GLU 43 N 0.12 0.56 0.03 0.07 4.81 -1.65 -3.37 114.58 115.15 3e1b h GLU 43 Ca 0.37 -0.24 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 3e1b h GLU 43 Cb 1.28 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.60 3e1b h GLU 43 CO -0.05 0.80 -0.24 1.25 -0.73 0.00 0.00 179.01 180.05 3e1b h LEU 44 N 0.48 -0.70 -1.35 1.64 7.12 -1.20 -3.21 115.31 118.09 3e1b h LEU 44 Ca 0.06 0.09 0.16 0.00 0.13 0.00 0.00 57.88 58.33 3e1b h LEU 44 Cb 0.77 0.28 -0.02 0.00 -0.53 0.00 0.00 40.66 41.16 3e1b h LEU 44 CO 0.06 -0.31 0.82 0.08 -0.13 0.00 0.00 178.44 178.96 3e1b h ARG 45 N -0.39 0.00 0.00 1.25 0.11 -1.73 -2.71 114.38 110.90 3e1b h ARG 45 Ca 0.05 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.13 3e1b h ARG 45 Cb 0.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 3e1b h ARG 45 CO -0.19 0.00 0.00 0.54 0.10 0.00 0.00 179.97 180.42 3e1b n ARG 46 N -3.26 0.06 -0.36 0.08 5.12 -1.21 -1.86 116.66 115.23 3e1b n ARG 46 Ca 0.12 0.15 0.08 0.00 -1.93 0.00 0.00 57.85 56.26 3e1b n ARG 46 Cb 1.01 -1.58 0.25 0.00 -1.16 0.00 0.00 32.46 30.98 3e1b n ARG 46 CO 0.00 0.00 0.00 1.55 -1.93 0.00 0.00 177.63 177.25 3e1b n VAL 47 N -1.69 1.43 0.04 1.55 3.14 -1.02 -4.65 118.33 117.12 3e1b n VAL 47 Ca 0.05 -1.20 0.00 0.00 -2.96 0.00 0.00 64.34 60.23 3e1b n VAL 47 Cb 0.30 0.28 0.00 0.00 -1.06 0.00 0.00 33.84 33.36 3e1b n VAL 47 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 3e1b n VAL 48 N 0.65 0.19 -0.15 1.55 0.31 -1.04 -4.93 118.33 114.91 3e1b n VAL 48 Ca 0.19 0.06 -0.05 0.00 -0.01 0.00 0.00 64.34 64.53 3e1b n VAL 48 Cb 0.65 -0.60 0.02 0.00 -0.91 0.00 0.00 33.84 32.99 3e1b n VAL 48 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3e1b h GLU 49 N 0.00 -0.13 0.00 5.55 5.08 -1.68 -1.72 114.58 121.67 3e1b h GLU 49 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3e1b h GLU 49 Cb 0.00 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3e1b h GLU 49 CO 0.00 -0.09 0.00 -0.35 -1.00 0.00 0.00 179.01 177.57 3e1b n PRO 50 N -5.41 0.14 0.00 2.33 -0.04 -1.21 -3.76 135.00 127.05 3e1b n PRO 50 Ca 0.03 0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 3e1b n PRO 50 Cb 0.32 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 3e1b n PRO 50 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 3e1b n LEU 51 N -1.37 0.00 0.18 1.53 -0.00 -1.04 -4.74 117.00 111.55 3e1b n LEU 51 Ca 0.06 -0.11 0.02 0.00 -0.00 0.00 0.00 56.01 55.97 3e1b n LEU 51 Cb 0.14 0.00 0.33 0.00 -0.00 0.00 0.00 43.42 43.89 3e1b n LEU 51 CO 0.13 0.00 0.69 -0.29 -0.00 0.00 0.00 177.39 177.92 3e1b h ILE 52 N 0.00 1.29 -0.01 1.47 -0.00 -1.41 -3.11 117.51 115.74 3e1b h ILE 52 Ca 0.00 -1.40 0.00 0.00 -0.00 0.00 0.00 64.86 63.46 3e1b h ILE 52 Cb 0.00 1.75 -0.00 0.00 -0.00 0.00 0.00 36.82 38.57 3e1b h ILE 52 CO 0.00 0.40 0.01 0.74 -0.00 0.00 0.00 178.15 179.31 3e1b h THR 53 N 0.01 0.32 0.00 2.19 2.02 -1.84 -3.18 112.91 112.42 3e1b h THR 53 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3e1b h THR 53 Cb 0.72 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 3e1b h THR 53 CO 0.05 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.12 3e1b n LEU 54 N -3.54 0.00 0.00 2.58 4.32 -1.18 -4.23 117.00 114.95 3e1b n LEU 54 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.97 3e1b n LEU 54 Cb 0.09 -0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.89 3e1b n LEU 54 CO 0.24 -0.00 0.24 0.00 -1.22 0.00 0.00 177.39 176.65 3e1b n ALA 55 N -1.00 1.42 0.19 -1.18 0.00 -1.21 -4.07 120.51 114.67 3e1b n ALA 55 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.64 3e1b n ALA 55 Cb 0.04 -0.95 0.60 0.00 0.00 0.00 0.00 19.45 19.14 3e1b n ALA 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3e1b n LYS 56 N -0.97 0.15 -4.03 0.00 5.02 -1.26 -4.23 118.16 112.83 3e1b n LYS 56 Ca 0.00 0.62 -0.08 0.00 -2.02 0.00 0.00 58.31 56.83 3e1b n LYS 56 Cb 0.00 -1.96 -0.11 0.00 -0.02 0.00 0.00 35.03 32.94 3e1b n LYS 56 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3e1b s THR 57 N -3.54 0.18 0.45 -0.18 -1.32 -1.26 -5.12 115.64 104.85 3e1b s THR 57 Ca -0.02 -1.31 0.06 0.00 -1.21 0.00 0.00 61.69 59.21 3e1b s THR 57 Cb 0.07 -0.83 0.02 0.00 -1.51 0.00 0.00 72.50 70.24 3e1b s THR 57 CO 0.22 -0.71 0.62 -0.62 -2.21 0.00 0.00 174.62 171.92 3e1b s ASP 58 N -2.11 5.57 0.00 8.08 2.15 -1.26 -4.73 116.67 124.37 3e1b s ASP 58 Ca -0.06 -0.33 0.00 0.00 0.43 0.00 0.00 52.55 52.60 3e1b s ASP 58 Cb -0.02 -0.71 0.00 0.00 -0.30 0.00 0.00 42.92 41.89 3e1b s ASP 58 CO -0.05 -0.85 0.00 -0.24 -0.17 0.00 0.00 175.17 173.86 3e1b n SER 59 N -1.96 0.00 -4.23 -0.34 2.88 -1.26 -4.84 113.62 103.87 3e1b n SER 59 Ca 0.08 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.49 3e1b n SER 59 Cb 0.59 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.95 3e1b n SER 59 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3e1b s VAL 60 N 0.00 0.56 0.00 2.46 -7.23 -1.26 -5.04 120.40 109.90 3e1b s VAL 60 Ca 0.00 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 3e1b s VAL 60 Cb 0.00 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.80 3e1b s VAL 60 CO 0.00 -0.44 0.00 0.00 -0.31 0.00 0.00 175.10 174.35 3e1b n ALA 61 N -0.23 0.00 0.16 1.32 0.00 -1.26 -4.14 120.51 116.36 3e1b n ALA 61 Ca -0.06 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.47 3e1b n ALA 61 Cb 0.63 0.00 0.50 0.00 0.00 0.00 0.00 19.45 20.58 3e1b n ALA 61 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3e1b n ASN 62 N 0.00 0.47 0.25 0.00 0.23 -1.26 -1.62 115.26 113.33 3e1b n ASN 62 Ca 0.00 0.68 0.18 0.00 -0.53 0.00 0.00 54.58 54.91 3e1b n ASN 62 Cb 0.00 -0.70 0.83 0.00 -2.08 0.00 0.00 39.78 37.82 3e1b n ASN 62 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 3e1b h ARG 63 N 0.00 0.00 0.00 -3.83 -0.00 -1.95 -2.40 114.38 106.19 3e1b h ARG 63 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 3e1b h ARG 63 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.20 3e1b h ARG 63 CO 0.00 0.00 0.45 -0.09 0.00 0.00 0.00 179.97 180.33 3e1b h ARG 64 N 0.00 0.00 0.00 0.04 2.43 -1.68 0.60 114.38 115.77 3e1b h ARG 64 Ca 0.07 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 3e1b h ARG 64 Cb 0.72 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.26 3e1b h ARG 64 CO -0.00 0.00 -0.09 1.25 -1.51 0.00 0.00 179.97 179.62 3e1b h LEU 65 N 0.00 0.00 -0.15 3.80 5.85 -1.71 -3.33 115.31 119.77 3e1b h LEU 65 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3e1b h LEU 65 Cb 0.89 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.92 3e1b h LEU 65 CO 0.00 0.09 0.00 0.00 -0.34 0.00 0.00 178.44 178.19 3e1b n ALA 66 N -2.28 1.41 -1.51 1.25 0.00 0.16 -4.97 120.51 114.57 3e1b n ALA 66 Ca -0.02 -0.08 -0.52 0.00 0.00 0.00 0.00 53.44 52.82 3e1b n ALA 66 Cb 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.59 3e1b n ALA 66 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3e1b n PHE 67 N -0.52 1.74 0.00 0.00 0.99 -0.95 -1.92 117.46 116.80 3e1b n PHE 67 Ca 0.00 0.31 0.00 0.00 -0.00 0.00 0.00 57.45 57.76 3e1b n PHE 67 Cb 0.02 -2.52 0.00 0.00 -1.00 0.00 0.00 39.48 35.98 3e1b n PHE 67 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3e1b n ALA 68 N 8.65 0.00 -0.07 4.37 0.00 -1.26 -4.76 120.51 127.44 3e1b n ALA 68 Ca 0.37 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.78 3e1b n ALA 68 Cb 0.21 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.86 3e1b n ALA 68 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3e1b h ARG 69 N 0.03 0.69 -3.73 0.00 2.43 -1.76 -3.45 114.38 108.60 3e1b h ARG 69 Ca 0.00 -0.18 -0.19 0.00 -0.81 0.00 0.00 59.98 58.81 3e1b h ARG 69 Cb 0.00 -0.09 -0.24 0.00 -0.42 0.00 0.00 29.97 29.22 3e1b h ARG 69 CO 0.00 0.72 -0.64 -0.08 -1.51 0.00 0.00 179.97 178.45 3e1b s THR 70 N -4.96 0.05 0.46 0.20 -1.32 -1.20 -4.95 115.64 103.92 3e1b s THR 70 Ca -0.09 -0.45 0.13 0.00 -1.21 0.00 0.00 61.69 60.08 3e1b s THR 70 Cb 0.15 -0.21 0.30 0.00 -1.51 0.00 0.00 72.50 71.23 3e1b s THR 70 CO 0.79 -0.25 2.06 -0.09 -2.21 0.00 0.00 174.62 174.92 3e1b h ARG 71 N 5.24 0.28 -0.79 7.08 2.43 -1.92 -3.33 114.38 123.38 3e1b h ARG 71 Ca -0.28 -0.02 -0.49 0.00 -0.81 0.00 0.00 59.98 58.38 3e1b h ARG 71 Cb 1.21 -0.06 -0.27 0.00 -0.42 0.00 0.00 29.97 30.42 3e1b h ARG 71 CO 0.44 0.19 0.31 -0.25 -1.51 0.00 0.00 179.97 179.15 3e1b n ASP 72 N -4.48 4.88 0.19 -3.80 10.43 -1.26 -4.81 116.55 117.71 3e1b n ASP 72 Ca 0.04 -3.74 0.05 0.00 2.57 0.00 0.00 54.79 53.71 3e1b n ASP 72 Cb 0.21 -0.76 0.27 0.00 1.84 0.00 0.00 41.12 42.69 3e1b n ASP 72 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 3e1b h ASN 73 N 1.51 0.00 0.00 -2.24 7.08 -1.95 -2.82 115.58 117.16 3e1b h ASN 73 Ca 0.48 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.70 3e1b h ASN 73 Cb 1.69 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.93 3e1b h ASN 73 CO 1.03 0.00 0.31 -1.84 -2.08 0.00 0.00 177.43 174.85 3e1b n GLU 74 N -2.08 0.02 0.00 4.14 0.28 -1.26 -1.32 120.64 120.42 3e1b n GLU 74 Ca -0.01 0.32 0.00 0.00 -0.16 0.00 0.00 57.16 57.31 3e1b n GLU 74 Cb 0.51 -1.88 0.00 0.00 1.43 0.00 0.00 31.44 31.50 3e1b n GLU 74 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 177.13 177.41 3e1b n ILE 75 N -1.45 1.17 -0.32 3.84 -5.35 -1.07 -2.32 119.36 113.86 3e1b n ILE 75 Ca -0.00 0.43 0.02 0.00 -0.27 0.00 0.00 62.75 62.92 3e1b n ILE 75 Cb 0.32 -1.43 0.20 0.00 -1.74 0.00 0.00 39.64 36.98 3e1b n ILE 75 CO 0.00 0.00 0.00 1.62 -1.76 0.00 0.00 176.55 176.41 3e1b h VAL 76 N 0.00 1.14 -0.71 7.28 3.04 -1.53 -3.40 116.25 122.06 3e1b h VAL 76 Ca 0.00 -0.39 -0.02 0.00 -1.01 0.00 0.00 66.70 65.28 3e1b h VAL 76 Cb 0.27 -0.10 -0.03 0.00 -2.01 0.00 0.00 31.29 29.42 3e1b h VAL 76 CO 0.00 0.21 0.36 0.00 -1.01 0.00 0.00 177.57 177.13 3e1b h ALA 77 N 1.47 0.92 0.00 3.17 0.00 -1.76 -1.77 119.26 121.29 3e1b h ALA 77 Ca 0.37 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3e1b h ALA 77 Cb 0.05 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3e1b h ALA 77 CO -0.12 0.47 0.00 0.87 0.00 0.00 0.00 179.25 180.47 3e1b h LYS 78 N 0.99 0.00 0.76 0.00 1.57 -1.85 -3.34 116.57 114.70 3e1b h LYS 78 Ca 0.25 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.99 3e1b h LYS 78 Cb 0.10 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.41 3e1b h LYS 78 CO -0.03 0.00 -0.37 -0.07 -0.57 0.00 0.00 179.45 178.41 3e1b h LEU 79 N 0.00 -0.86 -1.94 2.94 3.38 -1.55 0.26 115.31 117.53 3e1b h LEU 79 Ca 0.00 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3e1b h LEU 79 Cb 0.40 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 3e1b h LEU 79 CO 0.00 -0.50 -0.11 2.19 0.09 0.00 0.00 178.44 180.11 3e1b h PHE 80 N -1.26 0.00 0.00 1.13 -5.15 -1.73 -3.36 116.94 106.57 3e1b h PHE 80 Ca -0.10 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.64 3e1b h PHE 80 Cb 0.78 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.95 3e1b h PHE 80 CO 0.00 0.11 -0.58 -0.91 -2.00 0.00 0.00 178.31 174.94 3e1b h ASN 81 N 0.00 0.00 0.00 -0.68 2.35 -1.67 -3.44 115.58 112.14 3e1b h ASN 81 Ca -0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3e1b h ASN 81 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 3e1b h ASN 81 CO 0.01 0.83 0.00 -1.84 -1.65 0.00 0.00 177.43 174.78 3e1b n GLU 82 N -4.60 0.00 0.14 0.81 0.28 0.60 -4.55 120.64 113.32 3e1b n GLU 82 Ca -0.10 -0.01 -0.07 0.00 -0.16 0.00 0.00 57.16 56.83 3e1b n GLU 82 Cb 0.30 -0.15 -0.04 0.00 1.43 0.00 0.00 31.44 32.99 3e1b n GLU 82 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 3e1b h LEU 83 N 0.00 -0.51 0.00 -1.84 6.46 -0.90 -3.44 115.31 115.09 3e1b h LEU 83 Ca 0.00 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 3e1b h LEU 83 Cb 0.52 0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.61 3e1b h LEU 83 CO 0.00 -0.27 0.00 0.61 -0.62 0.00 0.00 178.44 178.16 3e1b n GLY 84 N -1.23 0.67 0.00 3.75 0.00 -1.26 -4.94 105.19 102.18 3e1b n GLY 84 Ca -0.05 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.84 3e1b n GLY 84 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3e1b n PRO 85 N 0.00 0.00 0.25 1.61 -0.02 -1.26 -2.41 135.00 133.18 3e1b n PRO 85 Ca 0.00 0.33 0.17 0.00 -2.02 0.00 0.00 63.50 61.97 3e1b n PRO 85 Cb 0.00 -1.54 0.69 0.00 -0.02 0.00 0.00 33.50 32.64 3e1b n PRO 85 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3e1b h ARG 86 N 0.00 0.00 0.00 -0.52 3.08 -1.84 -3.39 114.38 111.71 3e1b h ARG 86 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3e1b h ARG 86 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 3e1b h ARG 86 CO 0.00 0.00 0.00 0.34 -1.07 0.00 0.00 179.97 179.24 3e1b n PHE 87 N -2.91 0.00 -0.62 3.04 7.35 -1.07 -5.02 117.46 118.23 3e1b n PHE 87 Ca 0.01 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.69 3e1b n PHE 87 Cb 0.27 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 40.10 3e1b n PHE 87 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3e1b n ALA 88 N -1.53 -0.00 1.62 3.13 0.00 -1.01 -4.89 120.51 117.82 3e1b n ALA 88 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 3e1b n ALA 88 Cb 0.00 -0.93 0.17 0.00 0.00 0.00 0.00 19.45 18.69 3e1b n ALA 88 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3e1b n SER 89 N 0.52 0.67 -4.21 0.00 2.88 -1.26 -4.75 113.62 107.47 3e1b n SER 89 Ca -0.00 -1.88 -0.22 0.00 -1.33 0.00 0.00 58.87 55.44 3e1b n SER 89 Cb 0.31 -0.07 -0.13 0.00 -0.75 0.00 0.00 64.21 63.57 3e1b n SER 89 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 3e1b s ARG 90 N -1.85 1.07 -0.12 -1.46 0.52 -1.26 -5.11 118.95 110.74 3e1b s ARG 90 Ca 0.14 -0.92 -0.08 0.00 -0.52 0.00 0.00 55.73 54.35 3e1b s ARG 90 Cb 0.07 -1.16 -0.07 0.00 0.52 0.00 0.00 34.95 34.31 3e1b s ARG 90 CO 0.10 0.28 0.17 0.00 0.02 0.00 0.00 175.30 175.88 3e1b h ALA 91 N 4.64 0.01 -0.33 2.13 0.00 -1.97 -3.40 119.26 120.34 3e1b h ALA 91 Ca -0.41 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3e1b h ALA 91 Cb 1.18 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3e1b h ALA 91 CO 0.42 0.07 0.00 0.41 0.00 0.00 0.00 179.25 180.15 3e1b n GLY 92 N 1.72 1.60 3.28 0.00 0.00 -1.26 -4.72 105.19 105.80 3e1b n GLY 92 Ca -0.04 -0.61 -0.15 0.00 0.00 0.00 0.00 46.02 45.22 3e1b n GLY 92 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3e1b s GLY 93 N -1.30 1.47 0.00 -0.02 0.00 -1.26 -3.28 107.32 102.92 3e1b s GLY 93 Ca 0.32 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 43.32 3e1b s GLY 93 CO 0.26 -1.57 0.00 2.98 0.00 0.00 0.00 173.10 174.77 3e1b n TYR 94 N -0.35 0.00 -3.94 1.90 4.19 -1.26 -4.58 117.16 113.12 3e1b n TYR 94 Ca -0.04 0.00 -0.09 0.00 3.31 0.00 0.00 57.90 61.08 3e1b n TYR 94 Cb 0.65 0.00 -0.07 0.00 0.49 0.00 0.00 39.34 40.41 3e1b n TYR 94 CO 0.00 0.00 0.00 -0.08 0.91 0.00 0.00 176.86 177.69 3e1b s THR 95 N 0.00 0.07 0.05 2.97 -1.32 -1.26 -2.14 115.64 114.01 3e1b s THR 95 Ca 0.00 -1.34 0.04 0.00 -1.21 0.00 0.00 61.69 59.18 3e1b s THR 95 Cb 0.00 -1.78 -0.02 0.00 -1.51 0.00 0.00 72.50 69.19 3e1b s THR 95 CO 0.00 -0.32 -0.11 -0.13 -2.21 0.00 0.00 174.62 171.84 3e1b s ARG 96 N -3.95 0.71 0.12 7.08 0.52 -0.15 -4.93 118.95 118.35 3e1b s ARG 96 Ca 0.16 -0.78 0.04 0.00 -0.52 0.00 0.00 55.73 54.63 3e1b s ARG 96 Cb 0.03 -0.64 -0.20 0.00 0.52 0.00 0.00 34.95 34.66 3e1b s ARG 96 CO -0.01 0.14 1.26 0.82 0.02 0.00 0.00 175.30 177.53 3e1b h ILE 97 N 4.47 1.65 -1.40 1.52 2.04 -1.87 -1.74 117.51 122.18 3e1b h ILE 97 Ca -0.37 -3.27 -0.07 0.00 1.00 0.00 0.00 64.86 62.15 3e1b h ILE 97 Cb 1.19 2.83 -0.03 0.00 -0.74 0.00 0.00 36.82 40.08 3e1b h ILE 97 CO 0.42 0.94 -0.06 0.18 0.00 0.00 0.00 178.15 179.63 3e1b n LEU 98 N -3.42 -0.20 -3.53 1.44 7.99 -1.26 -1.70 117.00 116.32 3e1b n LEU 98 Ca -0.02 0.08 -0.21 0.00 -0.01 0.00 0.00 56.01 55.85 3e1b n LEU 98 Cb 0.94 -0.96 -0.17 0.00 -0.11 0.00 0.00 43.42 43.12 3e1b n LEU 98 CO 0.49 -0.22 1.66 1.17 -1.51 0.00 0.00 177.39 178.98 3e1b n LYS 99 N -0.95 0.00 0.04 3.23 0.00 -1.26 -4.89 118.16 114.32 3e1b n LYS 99 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 58.31 58.26 3e1b n LYS 99 Cb 0.13 -0.88 -0.01 0.00 0.00 0.00 0.00 35.03 34.27 3e1b n LYS 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3e1b n GLY 101 N 0.33 1.48 3.65 0.00 0.00 -1.26 -4.95 105.19 104.44 3e1b n GLY 101 Ca -0.01 -0.80 -0.58 0.00 0.00 0.00 0.00 46.02 44.62 3e1b n GLY 101 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3e1b n PHE 102 N -0.41 1.91 -1.55 1.61 3.72 -1.26 -1.01 117.46 120.47 3e1b n PHE 102 Ca 0.00 0.59 -0.45 0.00 -0.05 0.00 0.00 57.45 57.53 3e1b n PHE 102 Cb 0.00 -2.43 -0.04 0.00 -0.94 0.00 0.00 39.48 36.06 3e1b n PHE 102 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 3e1b n ARG 103 N 5.77 1.63 0.00 -1.08 0.63 -1.17 -4.28 116.66 118.15 3e1b n ARG 103 Ca 0.31 0.43 0.00 0.00 -0.92 0.00 0.00 57.85 57.67 3e1b n ARG 103 Cb 0.11 -2.99 0.00 0.00 0.45 0.00 0.00 32.46 30.03 3e1b n ARG 103 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3e1b n ALA 104 N 11.28 0.00 0.00 5.13 0.00 -1.26 -2.33 120.51 133.32 3e1b n ALA 104 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.78 3e1b n ALA 104 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 3e1b n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3e1b n GLY 105 N 0.00 1.08 0.18 0.00 0.00 -1.26 -5.08 105.19 100.11 3e1b n GLY 105 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3e1b n GLY 105 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3e1b h ASP 106 N 0.00 -0.31 0.00 1.61 1.82 -1.83 -3.47 116.42 114.25 3e1b h ASP 106 Ca 0.00 -0.22 0.00 0.00 -0.39 0.00 0.00 57.03 56.42 3e1b h ASP 106 Cb 0.00 0.08 0.00 0.00 0.68 0.00 0.00 39.33 40.09 3e1b h ASP 106 CO 0.00 0.10 0.00 -0.46 -1.61 0.00 0.00 179.24 177.27 3e1b n ASN 107 N -5.08 0.00 -3.28 2.28 0.23 -1.26 -5.16 115.26 103.00 3e1b n ASN 107 Ca -0.09 0.00 -0.12 0.00 -0.53 0.00 0.00 54.58 53.84 3e1b n ASN 107 Cb 0.26 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.94 3e1b n ASN 107 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3e1b s ALA 108 N -2.00 0.14 0.40 -2.53 0.00 -1.26 -5.08 121.76 111.42 3e1b s ALA 108 Ca 0.00 -1.17 -0.21 0.00 0.00 0.00 0.00 51.96 50.58 3e1b s ALA 108 Cb 0.00 1.00 -0.11 0.00 0.00 0.00 0.00 23.12 24.01 3e1b s ALA 108 CO 0.00 -0.86 0.92 -1.25 0.00 0.00 0.00 175.76 174.56 3e1b s PRO 109 N -3.00 4.24 0.47 0.00 0.04 -1.26 -3.05 135.00 132.44 3e1b s PRO 109 Ca 0.24 1.08 -0.24 0.00 0.04 0.00 0.00 61.00 62.12 3e1b s PRO 109 Cb -0.02 -2.30 -0.07 0.00 0.04 0.00 0.00 34.50 32.14 3e1b s PRO 109 CO 0.16 0.04 1.36 -1.64 0.04 0.00 0.00 177.00 176.96 3e1b s MET 110 N -2.99 3.60 0.20 4.56 -1.94 -0.18 -0.27 119.30 122.28 3e1b s MET 110 Ca 0.59 2.25 0.03 0.00 -1.71 0.00 0.00 55.69 56.86 3e1b s MET 110 Cb -0.10 -2.54 0.03 0.00 2.01 0.00 0.00 34.83 34.22 3e1b s MET 110 CO 0.15 -0.83 0.27 0.00 -0.01 0.00 0.00 175.02 174.60 3e1b n ALA 111 N -0.38 0.43 -3.84 3.03 0.00 -0.44 -2.43 120.51 116.87 3e1b n ALA 111 Ca 0.06 -0.74 -0.05 0.00 0.00 0.00 0.00 53.44 52.71 3e1b n ALA 111 Cb 0.44 0.21 0.01 0.00 0.00 0.00 0.00 19.45 20.11 3e1b n ALA 111 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3e1b s TYR 112 N -0.32 0.02 -0.37 0.00 6.04 -0.69 -4.31 117.35 117.71 3e1b s TYR 112 Ca 0.21 -0.47 0.11 0.00 0.04 0.00 0.00 57.07 56.96 3e1b s TYR 112 Cb -0.02 0.72 0.34 0.00 -1.04 0.00 0.00 41.96 41.96 3e1b s TYR 112 CO 0.13 -1.07 0.71 0.44 -1.54 0.00 0.00 175.55 174.22 3e1b n ILE 113 N -0.60 -0.24 -2.61 3.14 -0.00 -1.09 -3.66 119.36 114.31 3e1b n ILE 113 Ca -0.05 -4.45 -0.42 0.00 -0.00 0.00 0.00 62.75 57.83 3e1b n ILE 113 Cb 0.60 -0.46 -0.03 0.00 -0.00 0.00 0.00 39.64 39.76 3e1b n ILE 113 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 3e1b s GLU 114 N -2.21 4.41 0.98 6.28 2.56 -0.67 -4.61 118.70 125.45 3e1b s GLU 114 Ca 0.39 1.50 -0.11 0.00 0.00 0.00 0.00 54.97 56.75 3e1b s GLU 114 Cb 0.32 -3.53 0.17 0.00 2.00 0.00 0.00 34.13 33.09 3e1b s GLU 114 CO -0.08 -0.33 1.01 1.47 -0.56 0.00 0.00 175.26 176.77 3e1b n LEU 115 N 4.91 1.80 -0.82 2.70 -0.00 -1.26 -0.97 117.00 123.35 3e1b n LEU 115 Ca 0.09 0.27 0.10 0.00 -0.00 0.00 0.00 56.01 56.47 3e1b n LEU 115 Cb 0.48 -1.39 0.27 0.00 -0.00 0.00 0.00 43.42 42.78 3e1b n LEU 115 CO 0.53 -2.58 0.72 0.55 -0.00 0.00 0.00 177.39 176.61 3e1b n VAL 116 N -4.36 0.45 0.91 1.47 3.14 -0.91 -3.50 118.33 115.52 3e1b n VAL 116 Ca 0.09 -0.55 0.00 0.00 -2.96 0.00 0.00 64.34 60.92 3e1b n VAL 116 Cb 0.53 0.49 0.00 0.00 -1.06 0.00 0.00 33.84 33.80 3e1b n VAL 116 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 3e1b n ASP 117 N 0.82 0.26 -4.17 6.55 2.03 -1.26 -4.50 116.55 116.27 3e1b n ASP 117 Ca 0.17 -1.17 -0.31 0.00 0.52 0.00 0.00 54.79 54.00 3e1b n ASP 117 Cb 0.42 -0.13 -0.17 0.00 -0.72 0.00 0.00 41.12 40.53 3e1b n ASP 117 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3e1b s ARG 118 N -1.56 2.84 0.33 -0.67 1.81 -1.23 -5.10 118.95 115.37 3e1b s ARG 118 Ca 0.00 -0.80 0.02 0.00 -1.72 0.00 0.00 55.73 53.23 3e1b s ARG 118 Cb 0.00 -2.22 0.06 0.00 -0.45 0.00 0.00 34.95 32.34 3e1b s ARG 118 CO 0.00 0.09 0.45 -1.13 -0.68 0.00 0.00 175.30 174.03 3e1b n SER 119 N 3.77 0.87 -0.33 0.23 3.41 -1.26 -5.01 113.62 115.29 3e1b n SER 119 Ca -0.20 -1.67 0.31 0.00 -0.26 0.00 0.00 58.87 57.05 3e1b n SER 119 Cb 0.52 -0.27 0.66 0.00 -0.26 0.00 0.00 64.21 64.86 3e1b n SER 119 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 3e1b h GLU 120 N 0.00 0.14 -5.54 4.33 4.11 -2.01 -3.43 114.58 112.18 3e1b h GLU 120 Ca -0.15 -0.01 -0.65 0.00 0.07 0.00 0.00 59.36 58.62 3e1b h GLU 120 Cb 0.62 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.75 3e1b h GLU 120 CO 0.19 0.09 -0.48 -1.59 0.07 0.00 0.00 179.01 177.29 3e1b s LYS 121 N -5.16 3.66 0.00 1.06 0.00 -1.26 -5.02 119.74 113.01 3e1b s LYS 121 Ca -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 55.97 55.76 3e1b s LYS 121 Cb 0.24 -3.26 0.00 0.00 0.00 0.00 0.00 37.83 34.82 3e1b s LYS 121 CO 0.81 0.64 0.43 0.00 0.00 0.00 0.00 175.35 177.23 3e1b n ALA 122 N 2.42 1.39 -0.44 0.59 0.00 -1.26 -4.89 120.51 118.32 3e1b n ALA 122 Ca -0.19 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.25 3e1b n ALA 122 Cb 0.54 -0.93 -0.00 0.00 0.00 0.00 0.00 19.45 19.06 3e1b n ALA 122 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3e1b n GLU 123 N -0.93 -1.99 0.30 0.00 0.28 -1.26 -4.81 120.64 112.24 3e1b n GLU 123 Ca 0.00 0.22 0.17 0.00 -0.16 0.00 0.00 57.16 57.39 3e1b n GLU 123 Cb 0.00 -3.59 0.92 0.00 1.43 0.00 0.00 31.44 30.20 3e1b n GLU 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3e1b h ALA 124 N 0.02 1.15 0.00 -1.84 0.00 -2.02 -2.11 119.26 114.47 3e1b h ALA 124 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3e1b h ALA 124 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3e1b h ALA 124 CO 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.10 3e1b n ALA 125 N -1.92 1.44 -0.04 0.00 0.00 -1.26 -3.08 120.51 115.64 3e1b n ALA 125 Ca -0.02 -0.01 -0.12 0.00 0.00 0.00 0.00 53.44 53.29 3e1b n ALA 125 Cb 0.21 -1.03 -0.14 0.00 0.00 0.00 0.00 19.45 18.49 3e1b n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3e1b n ALA 126 N -1.14 1.38 0.00 0.00 0.00 -0.79 -5.30 120.51 114.66 3e1b n ALA 126 Ca 0.01 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.56 3e1b n ALA 126 Cb 0.01 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 18.86 3e1b n ALA 126 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89