#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gp3 s TYR 2 N 0.00 2.19 -0.04 1.12 2.02 0.09 -4.97 117.35 117.77 3gp3 s TYR 2 Ca 0.00 -0.38 0.07 0.00 -0.37 0.00 0.00 57.07 56.39 3gp3 s TYR 2 Cb 0.00 -1.07 -0.02 0.00 -0.40 0.00 0.00 41.96 40.47 3gp3 s TYR 2 CO 0.00 0.49 -0.24 0.15 -1.57 0.00 0.00 175.55 174.38 3gp3 s LYS 3 N -2.80 2.31 -0.06 -0.62 1.02 -1.26 -0.37 119.74 117.95 3gp3 s LYS 3 Ca 0.21 -0.89 0.03 0.00 0.02 0.00 0.00 55.97 55.34 3gp3 s LYS 3 Cb -0.07 -2.13 0.01 0.00 -0.52 0.00 0.00 37.83 35.11 3gp3 s LYS 3 CO 0.10 0.52 -0.16 -1.17 -0.92 0.00 0.00 175.35 173.71 3gp3 s LEU 4 N -0.49 1.83 -0.11 3.17 2.96 -0.07 -4.44 118.68 121.52 3gp3 s LEU 4 Ca 0.06 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 3gp3 s LEU 4 Cb -0.11 -0.99 -0.02 0.00 0.50 0.00 0.00 46.19 45.57 3gp3 s LEU 4 CO 0.01 0.10 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.32 3gp3 s VAL 5 N 0.39 3.16 0.12 1.68 1.01 -0.86 -0.84 120.40 125.07 3gp3 s VAL 5 Ca -0.12 -0.64 0.09 0.00 0.00 0.00 0.00 61.98 61.32 3gp3 s VAL 5 Cb -0.15 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 3gp3 s VAL 5 CO 0.04 0.54 -0.18 -0.76 0.00 0.00 0.00 175.10 174.74 3gp3 s LEU 6 N 0.08 2.68 -0.16 3.92 1.43 0.10 -1.09 118.68 125.64 3gp3 s LEU 6 Ca -0.05 -0.58 -0.09 0.00 -1.03 0.00 0.00 54.13 52.38 3gp3 s LEU 6 Cb -0.14 -1.52 0.05 0.00 0.03 0.00 0.00 46.19 44.61 3gp3 s LEU 6 CO 0.04 0.17 0.39 -0.51 0.23 0.00 0.00 176.35 176.67 3gp3 s ILE 7 N -1.18 -0.02 0.24 -0.59 2.07 0.76 -0.76 121.20 121.72 3gp3 s ILE 7 Ca 0.18 0.09 -0.30 0.00 -1.41 0.00 0.00 60.65 59.21 3gp3 s ILE 7 Cb -0.10 -0.57 -0.09 0.00 0.13 0.00 0.00 42.46 41.82 3gp3 s ILE 7 CO 0.10 0.04 0.99 -0.60 -1.91 0.00 0.00 174.94 173.56 3gp3 s ARG 8 N 1.20 4.78 0.69 3.50 3.52 -1.26 -0.45 118.95 130.93 3gp3 s ARG 8 Ca -0.08 1.59 -0.16 0.00 -0.13 0.00 0.00 55.73 56.94 3gp3 s ARG 8 Cb -0.08 -3.26 -0.02 0.00 -1.56 0.00 0.00 34.95 30.03 3gp3 s ARG 8 CO -0.10 0.40 0.81 -2.39 -0.81 0.00 0.00 175.30 173.20 3gp3 n HIS 9 N 1.51 0.17 -0.56 5.12 1.44 -0.46 -0.88 115.22 121.56 3gp3 n HIS 9 Ca -0.01 0.39 -0.30 0.00 -2.01 0.00 0.00 57.72 55.79 3gp3 n HIS 9 Cb 0.46 -2.03 0.22 0.00 0.12 0.00 0.00 29.99 28.76 3gp3 n HIS 9 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3gp3 n GLY 10 N 1.34 -1.54 3.61 -1.39 0.00 -1.26 -3.33 105.19 102.62 3gp3 n GLY 10 Ca 0.12 -0.99 -0.55 0.00 0.00 0.00 0.00 46.02 44.60 3gp3 n GLY 10 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3gp3 n GLU 11 N -4.42 0.95 -3.16 1.61 2.13 -1.26 -4.85 120.64 111.63 3gp3 n GLU 11 Ca 0.06 0.34 -0.18 0.00 0.66 0.00 0.00 57.16 58.05 3gp3 n GLU 11 Cb 0.54 -1.97 0.01 0.00 0.27 0.00 0.00 31.44 30.28 3gp3 n GLU 11 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 3gp3 s SER 12 N 1.24 5.76 0.22 4.31 1.04 -1.26 -1.64 113.70 123.38 3gp3 s SER 12 Ca 0.89 -0.34 -0.09 0.00 0.48 0.00 0.00 55.95 56.90 3gp3 s SER 12 Cb -1.05 -0.85 0.20 0.00 0.10 0.00 0.00 66.02 64.42 3gp3 s SER 12 CO 0.54 -0.65 1.89 0.71 0.98 0.00 0.00 173.24 176.71 3gp3 h THR 13 N 0.72 1.20 0.00 2.02 1.35 -1.34 -1.97 112.91 114.90 3gp3 h THR 13 Ca -0.42 -0.39 -0.05 0.00 -0.55 0.00 0.00 66.41 65.00 3gp3 h THR 13 Cb 1.27 -0.02 -0.01 0.00 -1.73 0.00 0.00 68.15 67.66 3gp3 h THR 13 CO 0.48 0.21 -0.24 -0.50 -0.25 0.00 0.00 175.52 175.21 3gp3 h TRP 14 N 1.13 0.00 -0.36 4.73 4.06 -1.91 -0.90 115.95 122.69 3gp3 h TRP 14 Ca 0.31 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.23 3gp3 h TRP 14 Cb -0.11 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.03 3gp3 h TRP 14 CO -0.01 0.24 0.09 -0.91 -3.56 0.00 0.00 178.44 174.29 3gp3 h ASN 15 N 0.00 0.54 -0.52 -3.49 -0.26 -1.67 -0.76 115.58 109.43 3gp3 h ASN 15 Ca -0.00 -0.23 -0.01 0.00 -0.56 0.00 0.00 56.30 55.49 3gp3 h ASN 15 Cb 0.93 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 38.02 3gp3 h ASN 15 CO 0.03 0.63 0.26 0.50 -1.06 0.00 0.00 177.43 177.80 3gp3 h LYS 16 N 0.43 0.73 0.00 0.81 3.64 -1.05 -2.27 116.57 118.86 3gp3 h LYS 16 Ca 0.11 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3gp3 h LYS 16 Cb 0.30 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 3gp3 h LYS 16 CO 0.00 0.59 0.00 0.39 -2.27 0.00 0.00 179.45 178.16 3gp3 n GLU 17 N -4.61 0.98 -3.65 1.90 1.02 -0.37 -4.94 120.64 110.97 3gp3 n GLU 17 Ca 0.02 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.95 3gp3 n GLU 17 Cb 0.10 -1.39 0.05 0.00 -0.02 0.00 0.00 31.44 30.18 3gp3 n GLU 17 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3gp3 n ASN 18 N -0.89 -1.87 -4.52 1.62 5.15 -0.42 -4.84 115.26 109.49 3gp3 n ASN 18 Ca 0.18 -0.76 -0.29 0.00 -0.60 0.00 0.00 54.58 53.12 3gp3 n ASN 18 Cb 0.08 -4.35 -0.11 0.00 -0.53 0.00 0.00 39.78 34.88 3gp3 n ASN 18 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3gp3 s ARG 19 N -5.89 1.91 0.09 1.20 0.52 -0.47 -0.41 118.95 115.91 3gp3 s ARG 19 Ca 0.08 -1.18 -0.31 0.00 -0.52 0.00 0.00 55.73 53.80 3gp3 s ARG 19 Cb -0.04 -2.16 -0.07 0.00 0.52 0.00 0.00 34.95 33.21 3gp3 s ARG 19 CO 0.79 0.47 1.31 -0.06 0.02 0.00 0.00 175.30 177.83 3gp3 s PHE 20 N -1.31 3.33 -0.10 -0.53 0.08 -0.64 -4.60 117.98 114.20 3gp3 s PHE 20 Ca 0.20 1.10 -0.12 0.00 0.12 0.00 0.00 56.93 58.23 3gp3 s PHE 20 Cb -0.10 -3.57 -0.04 0.00 -0.57 0.00 0.00 43.02 38.74 3gp3 s PHE 20 CO 0.12 -1.91 -0.24 2.41 -0.10 0.00 0.00 175.22 175.50 3gp3 n THR 21 N 3.93 1.41 0.00 0.64 -1.04 -1.26 0.31 114.28 118.27 3gp3 n THR 21 Ca 0.10 0.21 0.00 0.00 -2.04 0.00 0.00 64.05 62.32 3gp3 n THR 21 Cb 0.44 -2.11 0.00 0.00 -1.82 0.00 0.00 70.33 66.84 3gp3 n THR 21 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3gp3 n GLY 22 N 2.08 3.37 0.30 3.41 0.00 -1.26 -2.13 105.19 110.95 3gp3 n GLY 22 Ca -0.11 -0.12 0.14 0.00 0.00 0.00 0.00 46.02 45.93 3gp3 n GLY 22 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3gp3 n TRP 23 N 13.67 0.03 -2.20 1.61 7.02 -1.26 -4.66 117.44 131.65 3gp3 n TRP 23 Ca 0.00 -0.01 -0.42 0.00 -1.02 0.00 0.00 57.50 56.05 3gp3 n TRP 23 Cb 0.00 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 28.86 3gp3 n TRP 23 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 3gp3 s VAL 24 N -1.97 3.24 -1.34 -0.99 1.01 -0.90 -4.89 120.40 114.55 3gp3 s VAL 24 Ca 0.40 0.97 -0.08 0.00 0.00 0.00 0.00 61.98 63.27 3gp3 s VAL 24 Cb 0.20 -3.62 0.11 0.00 0.00 0.00 0.00 36.38 33.08 3gp3 s VAL 24 CO 0.33 0.12 2.26 -0.67 0.00 0.00 0.00 175.10 177.13 3gp3 n ASP 25 N 3.11 6.92 -4.88 3.32 2.03 -1.26 -4.97 116.55 120.81 3gp3 n ASP 25 Ca 0.08 -3.06 -0.30 0.00 0.52 0.00 0.00 54.79 52.02 3gp3 n ASP 25 Cb 0.43 -1.43 0.02 0.00 -0.72 0.00 0.00 41.12 39.42 3gp3 n ASP 25 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3gp3 s VAL 26 N -0.13 4.19 0.47 5.18 -7.23 -1.26 -4.79 120.40 116.82 3gp3 s VAL 26 Ca 0.50 0.64 0.07 0.00 -1.81 0.00 0.00 61.98 61.38 3gp3 s VAL 26 Cb 0.15 -3.69 -0.01 0.00 0.56 0.00 0.00 36.38 33.39 3gp3 s VAL 26 CO -0.06 -0.90 0.33 -0.62 -0.31 0.00 0.00 175.10 173.55 3gp3 s ASP 27 N -4.25 4.71 0.50 4.85 -1.08 -1.26 -3.58 116.67 116.55 3gp3 s ASP 27 Ca 0.56 -1.04 -0.21 0.00 -0.52 0.00 0.00 52.55 51.34 3gp3 s ASP 27 Cb -0.11 -0.16 -0.07 0.00 -1.46 0.00 0.00 42.92 41.12 3gp3 s ASP 27 CO 0.52 -0.80 1.12 -0.76 0.52 0.00 0.00 175.17 175.78 3gp3 s LEU 28 N -4.12 3.86 0.92 -1.34 1.43 -1.26 -0.99 118.68 117.18 3gp3 s LEU 28 Ca 0.40 2.17 -0.15 0.00 -1.03 0.00 0.00 54.13 55.53 3gp3 s LEU 28 Cb -0.01 -4.45 0.16 0.00 0.03 0.00 0.00 46.19 41.92 3gp3 s LEU 28 CO 0.24 -1.03 1.27 0.42 0.23 0.00 0.00 176.35 177.48 3gp3 s THR 29 N -1.73 1.99 0.18 5.49 -4.23 -0.65 -4.68 115.64 112.01 3gp3 s THR 29 Ca 0.68 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 61.10 3gp3 s THR 29 Cb -0.24 -2.99 0.06 0.00 1.34 0.00 0.00 72.50 70.66 3gp3 s THR 29 CO 0.28 0.00 1.63 -0.08 -0.54 0.00 0.00 174.62 175.91 3gp3 h GLU 30 N -1.47 1.06 -0.32 3.99 4.57 -1.98 -0.25 114.58 120.18 3gp3 h GLU 30 Ca -0.45 -0.35 0.06 0.00 -1.18 0.00 0.00 59.36 57.44 3gp3 h GLU 30 Cb 1.27 -0.09 -0.06 0.00 -0.16 0.00 0.00 28.75 29.71 3gp3 h GLU 30 CO 0.47 1.05 -0.06 0.37 -1.18 0.00 0.00 179.01 179.65 3gp3 h GLN 31 N 0.95 0.02 -0.99 1.92 4.15 -1.94 -0.88 115.11 118.33 3gp3 h GLN 31 Ca 0.16 -0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.62 3gp3 h GLN 31 Cb 0.58 -0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.21 3gp3 h GLN 31 CO 0.03 0.01 0.65 0.78 -1.93 0.00 0.00 178.83 178.37 3gp3 h GLY 32 N 0.02 1.44 0.99 2.39 0.00 -1.40 0.42 103.07 106.93 3gp3 h GLY 32 Ca 0.15 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 46.99 3gp3 h GLY 32 CO -0.31 0.42 0.27 3.43 0.00 0.00 0.00 176.54 180.36 3gp3 h ASN 33 N 1.25 0.51 -0.74 0.19 2.35 -0.61 -1.71 115.58 116.82 3gp3 h ASN 33 Ca 0.39 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 56.08 3gp3 h ASN 33 Cb -0.00 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 3gp3 h ASN 33 CO -0.12 0.39 0.34 -0.09 -1.65 0.00 0.00 177.43 176.30 3gp3 h ARG 34 N 0.58 1.07 -0.62 0.81 1.12 -0.78 -1.21 114.38 115.35 3gp3 h ARG 34 Ca 0.16 -0.17 -0.00 0.00 -1.11 0.00 0.00 59.98 58.86 3gp3 h ARG 34 Cb -0.04 -0.19 -0.03 0.00 -0.01 0.00 0.00 29.97 29.71 3gp3 h ARG 34 CO -0.03 0.85 0.37 0.93 -3.11 0.00 0.00 179.97 178.98 3gp3 h GLU 35 N 1.04 0.85 -0.16 0.20 5.08 -0.75 0.79 114.58 121.62 3gp3 h GLU 35 Ca 0.25 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3gp3 h GLU 35 Cb 0.14 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3gp3 h GLU 35 CO -0.03 0.61 0.08 0.00 -1.00 0.00 0.00 179.01 178.67 3gp3 h ALA 36 N 1.19 0.20 -0.63 3.43 0.00 -0.95 -0.99 119.26 121.50 3gp3 h ALA 36 Ca 0.22 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3gp3 h ALA 36 Cb -0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3gp3 h ALA 36 CO -0.04 -0.25 0.38 0.00 0.00 0.00 0.00 179.25 179.34 3gp3 h ARG 37 N 0.15 0.86 -0.53 0.00 3.08 -0.88 -1.66 114.38 115.39 3gp3 h ARG 37 Ca 0.06 -0.08 0.04 0.00 0.07 0.00 0.00 59.98 60.07 3gp3 h ARG 37 Cb 0.09 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 29.92 3gp3 h ARG 37 CO -0.01 0.62 0.29 1.96 -1.07 0.00 0.00 179.97 181.76 3gp3 h GLN 38 N 0.86 0.55 -0.46 0.04 1.08 -0.60 -1.03 115.11 115.55 3gp3 h GLN 38 Ca 0.23 -0.03 0.03 0.00 -1.45 0.00 0.00 58.65 57.42 3gp3 h GLN 38 Cb -0.02 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.25 3gp3 h GLN 38 CO -0.04 0.36 0.26 0.00 -0.95 0.00 0.00 178.83 178.46 3gp3 h ALA 39 N 1.27 0.59 -0.73 3.87 0.00 -0.80 -0.13 119.26 123.32 3gp3 h ALA 39 Ca 0.23 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.15 3gp3 h ALA 39 Cb 0.10 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3gp3 h ALA 39 CO -0.14 -0.06 0.48 0.78 0.00 0.00 0.00 179.25 180.31 3gp3 h GLY 40 N 0.52 1.03 1.02 0.00 0.00 -0.72 -1.65 103.07 103.27 3gp3 h GLY 40 Ca 0.19 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 3gp3 h GLY 40 CO -0.10 0.36 0.25 1.46 0.00 0.00 0.00 176.54 178.51 3gp3 h GLN 41 N 0.97 1.03 -0.62 4.80 1.08 -0.63 -0.48 115.11 121.26 3gp3 h GLN 41 Ca 0.27 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 57.26 3gp3 h GLN 41 Cb -0.08 -0.16 -0.03 0.00 -0.05 0.00 0.00 27.48 27.16 3gp3 h GLN 41 CO -0.07 0.87 0.33 1.25 -0.95 0.00 0.00 178.83 180.26 3gp3 h LEU 42 N 0.97 0.78 -0.39 1.46 5.85 -0.73 0.46 115.31 123.71 3gp3 h LEU 42 Ca 0.22 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 3gp3 h LEU 42 Cb 0.24 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3gp3 h LEU 42 CO -0.02 0.65 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.42 3gp3 h LEU 43 N 0.84 0.89 -0.36 2.25 3.38 -1.03 -1.91 115.31 119.36 3gp3 h LEU 43 Ca 0.22 -0.43 -0.06 0.00 0.09 0.00 0.00 57.88 57.70 3gp3 h LEU 43 Cb 0.05 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3gp3 h LEU 43 CO -0.03 1.12 -0.01 0.50 0.09 0.00 0.00 178.44 180.11 3gp3 h LYS 44 N 0.66 0.65 -0.17 1.13 3.64 -0.75 -1.93 116.57 119.80 3gp3 h LYS 44 Ca 0.08 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 3gp3 h LYS 44 Cb 0.82 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 3gp3 h LYS 44 CO 0.07 0.76 -0.04 0.93 -2.27 0.00 0.00 179.45 178.90 3gp3 h GLU 45 N 0.46 0.24 -0.00 1.90 5.08 -0.81 -1.20 114.58 120.25 3gp3 h GLU 45 Ca 0.10 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3gp3 h GLU 45 Cb 0.48 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3gp3 h GLU 45 CO 0.02 0.30 -0.07 0.00 -1.00 0.00 0.00 179.01 178.27 3gp3 n ALA 46 N -2.50 2.67 -0.92 3.43 0.00 -0.73 -4.91 120.51 117.54 3gp3 n ALA 46 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3gp3 n ALA 46 Cb 0.20 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.25 3gp3 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gp3 n GLY 47 N 1.26 0.53 3.77 0.00 0.00 -0.45 -5.03 105.19 105.26 3gp3 n GLY 47 Ca 0.15 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 3gp3 n GLY 47 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gp3 s TYR 48 N -2.00 2.92 0.23 1.61 2.02 -0.75 -5.03 117.35 116.35 3gp3 s TYR 48 Ca 0.00 1.51 0.01 0.00 -0.37 0.00 0.00 57.07 58.22 3gp3 s TYR 48 Cb 0.00 -3.46 -0.05 0.00 -0.40 0.00 0.00 41.96 38.05 3gp3 s TYR 48 CO 0.00 -1.60 0.09 -0.08 -1.57 0.00 0.00 175.55 172.39 3gp3 s THR 49 N -1.43 0.47 0.02 -0.71 -1.32 -1.26 -4.61 115.64 106.80 3gp3 s THR 49 Ca 0.60 -1.99 0.02 0.00 -1.21 0.00 0.00 61.69 59.10 3gp3 s THR 49 Cb -0.32 -2.53 -0.02 0.00 -1.51 0.00 0.00 72.50 68.13 3gp3 s THR 49 CO 0.39 -0.08 -0.06 -0.36 -2.21 0.00 0.00 174.62 172.30 3gp3 s PHE 50 N -3.82 0.56 -0.13 9.09 0.08 -1.26 -4.81 117.98 117.70 3gp3 s PHE 50 Ca 0.36 -0.36 0.19 0.00 0.12 0.00 0.00 56.93 57.24 3gp3 s PHE 50 Cb 0.07 -0.34 -0.25 0.00 -0.57 0.00 0.00 43.02 41.93 3gp3 s PHE 50 CO 0.12 -0.06 0.38 -0.25 -0.10 0.00 0.00 175.22 175.30 3gp3 n ASP 51 N 1.99 0.21 -3.68 1.36 8.00 0.26 -4.96 116.55 119.73 3gp3 n ASP 51 Ca -0.19 0.09 -0.13 0.00 0.71 0.00 0.00 54.79 55.27 3gp3 n ASP 51 Cb 0.56 1.12 -0.07 0.00 -0.02 0.00 0.00 41.12 42.71 3gp3 n ASP 51 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3gp3 s ILE 52 N -2.92 0.06 0.07 0.53 2.07 -1.19 -4.09 121.20 115.72 3gp3 s ILE 52 Ca -0.08 -0.49 0.03 0.00 -1.41 0.00 0.00 60.65 58.70 3gp3 s ILE 52 Cb 0.09 -0.94 -0.03 0.00 0.13 0.00 0.00 42.46 41.71 3gp3 s ILE 52 CO 0.85 -0.27 -0.09 0.00 -1.91 0.00 0.00 174.94 173.52 3gp3 s ALA 53 N -2.44 0.81 -0.01 1.50 0.00 -0.37 -2.61 121.76 118.65 3gp3 s ALA 53 Ca -0.06 -0.98 0.08 0.00 0.00 0.00 0.00 51.96 51.00 3gp3 s ALA 53 Cb -0.01 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.14 3gp3 s ALA 53 CO -0.02 -0.05 -0.25 0.71 0.00 0.00 0.00 175.76 176.15 3gp3 s TYR 54 N -2.02 2.22 0.26 0.00 2.02 0.07 -0.78 117.35 119.13 3gp3 s TYR 54 Ca -0.02 -0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 56.26 3gp3 s TYR 54 Cb -0.06 -1.42 0.00 0.00 -0.40 0.00 0.00 41.96 40.09 3gp3 s TYR 54 CO -0.01 -0.02 0.36 -2.37 -1.57 0.00 0.00 175.55 171.94 3gp3 n THR 55 N 2.41 0.00 -1.73 -0.71 5.66 -0.20 -1.14 114.28 118.57 3gp3 n THR 55 Ca -0.16 -1.40 0.00 0.00 -3.05 0.00 0.00 64.05 59.44 3gp3 n THR 55 Cb 0.51 0.84 0.00 0.00 -1.55 0.00 0.00 70.33 70.14 3gp3 n THR 55 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 3gp3 n SER 56 N -1.78 0.00 -1.41 1.09 3.41 -1.25 -1.14 113.62 112.55 3gp3 n SER 56 Ca 0.01 -0.74 0.11 0.00 -0.26 0.00 0.00 58.87 57.99 3gp3 n SER 56 Cb 0.45 0.00 0.33 0.00 -0.26 0.00 0.00 64.21 64.73 3gp3 n SER 56 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3gp3 n VAL 57 N -1.11 1.23 -3.92 -3.33 0.24 -1.24 -4.06 118.33 106.14 3gp3 n VAL 57 Ca 0.00 -1.02 -0.35 0.00 -2.04 0.00 0.00 64.34 60.93 3gp3 n VAL 57 Cb 0.00 0.36 -0.09 0.00 -1.47 0.00 0.00 33.84 32.64 3gp3 n VAL 57 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3gp3 s LEU 58 N -1.26 3.94 0.51 1.34 1.43 -1.26 -5.00 118.68 118.39 3gp3 s LEU 58 Ca 0.49 0.13 0.27 0.00 -1.03 0.00 0.00 54.13 53.98 3gp3 s LEU 58 Cb 0.27 -2.00 1.38 0.00 0.03 0.00 0.00 46.19 45.87 3gp3 s LEU 58 CO 0.30 0.18 2.04 0.07 0.23 0.00 0.00 176.35 179.17 3gp3 h LYS 59 N 6.69 0.00 -0.52 1.70 2.10 -1.87 -1.51 116.57 123.16 3gp3 h LYS 59 Ca -0.38 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.20 3gp3 h LYS 59 Cb 1.16 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.47 3gp3 h LYS 59 CO 0.72 0.13 0.03 0.07 -2.00 0.00 0.00 179.45 178.41 3gp3 h ARG 60 N 0.00 0.85 -0.03 0.07 0.11 -1.91 0.79 114.38 114.26 3gp3 h ARG 60 Ca -0.00 -0.22 -0.11 0.00 0.10 0.00 0.00 59.98 59.75 3gp3 h ARG 60 Cb 0.38 -0.10 0.01 0.00 1.11 0.00 0.00 29.97 31.36 3gp3 h ARG 60 CO 0.02 0.83 -0.39 0.00 0.10 0.00 0.00 179.97 180.53 3gp3 h ALA 61 N 1.23 0.09 -0.73 0.08 0.00 -1.60 -2.92 119.26 115.42 3gp3 h ALA 61 Ca 0.16 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 3gp3 h ALA 61 Cb 0.43 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 3gp3 h ALA 61 CO 0.02 0.22 0.43 0.82 0.00 0.00 0.00 179.25 180.73 3gp3 h ILE 62 N -0.22 1.21 -0.01 0.00 2.04 -1.34 -1.25 117.51 117.94 3gp3 h ILE 62 Ca -0.04 -0.47 -0.13 0.00 1.00 0.00 0.00 64.86 65.22 3gp3 h ILE 62 Cb 1.09 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3gp3 h ILE 62 CO 0.08 0.22 -0.62 -0.09 0.00 0.00 0.00 178.15 177.74 3gp3 h ARG 63 N 0.99 0.03 -0.30 2.37 2.43 -0.94 0.10 114.38 119.06 3gp3 h ARG 63 Ca 0.26 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3gp3 h ARG 63 Cb -0.02 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 3gp3 h ARG 63 CO -0.05 0.64 0.17 1.15 -1.51 0.00 0.00 179.97 180.37 3gp3 h THR 64 N 0.02 1.12 -0.46 0.20 2.02 -1.24 -1.72 112.91 112.85 3gp3 h THR 64 Ca -0.01 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.87 3gp3 h THR 64 Cb 1.10 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 3gp3 h THR 64 CO 0.08 0.12 0.29 0.25 0.37 0.00 0.00 175.52 176.63 3gp3 h LEU 65 N 0.37 0.53 -0.49 2.58 5.85 -0.74 -2.00 115.31 121.42 3gp3 h LEU 65 Ca 0.11 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.88 3gp3 h LEU 65 Cb 0.05 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 40.87 3gp3 h LEU 65 CO -0.02 0.41 0.09 -0.50 -0.34 0.00 0.00 178.44 178.08 3gp3 h TRP 66 N 0.61 0.14 -0.91 1.25 6.55 -0.68 0.25 115.95 123.16 3gp3 h TRP 66 Ca 0.17 0.03 -0.01 0.00 0.95 0.00 0.00 58.89 60.03 3gp3 h TRP 66 Cb -0.04 0.01 -0.04 0.00 -0.86 0.00 0.00 29.16 28.22 3gp3 h TRP 66 CO -0.04 -0.01 0.55 0.45 -1.05 0.00 0.00 178.44 178.34 3gp3 h HIS 67 N 0.22 1.21 -0.04 0.49 3.86 -0.96 -0.35 115.15 119.58 3gp3 h HIS 67 Ca 0.25 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.45 3gp3 h HIS 67 Cb 0.33 -0.40 -0.00 0.00 1.06 0.00 0.00 27.41 28.40 3gp3 h HIS 67 CO -0.23 0.80 0.02 0.28 0.86 0.00 0.00 177.93 179.66 3gp3 h VAL 68 N 1.26 1.13 -0.71 2.45 2.07 -0.85 -1.39 116.25 120.21 3gp3 h VAL 68 Ca 0.33 -0.38 0.05 0.00 0.82 0.00 0.00 66.70 67.51 3gp3 h VAL 68 Cb -0.05 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 3gp3 h VAL 68 CO -0.06 0.11 0.47 1.56 0.02 0.00 0.00 177.57 179.66 3gp3 h GLN 69 N -0.08 0.78 -0.07 1.57 4.20 -0.11 -1.05 115.11 120.34 3gp3 h GLN 69 Ca 0.01 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 3gp3 h GLN 69 Cb 0.15 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 3gp3 h GLN 69 CO -0.00 0.52 -0.12 0.22 -0.67 0.00 0.00 178.83 178.78 3gp3 h ASP 70 N 0.80 0.23 0.35 1.46 3.58 -0.81 0.10 116.42 122.13 3gp3 h ASP 70 Ca 0.29 -0.54 -0.09 0.00 0.42 0.00 0.00 57.03 57.12 3gp3 h ASP 70 Cb 0.14 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 3gp3 h ASP 70 CO -0.09 0.72 -0.38 1.56 -2.88 0.00 0.00 179.24 178.17 3gp3 h GLN 71 N -0.26 0.06 -0.01 0.28 1.08 -1.02 -2.72 115.11 112.52 3gp3 h GLN 71 Ca 0.01 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 3gp3 h GLN 71 Cb 0.67 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.10 3gp3 h GLN 71 CO 0.03 0.44 -0.16 -1.33 -0.95 0.00 0.00 178.83 176.85 3gp3 n MET 72 N -4.07 1.13 -3.59 1.46 2.81 -0.42 -4.81 117.12 109.63 3gp3 n MET 72 Ca -0.02 -0.66 -0.20 0.00 -1.81 0.00 0.00 57.70 55.02 3gp3 n MET 72 Cb 0.43 -1.49 0.06 0.00 -0.71 0.00 0.00 33.22 31.51 3gp3 n MET 72 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3gp3 n ASP 73 N -0.36 -1.53 -1.93 7.83 2.03 -0.60 -4.94 116.55 117.05 3gp3 n ASP 73 Ca 0.15 -0.74 -0.10 0.00 0.52 0.00 0.00 54.79 54.62 3gp3 n ASP 73 Cb 0.35 -4.48 0.06 0.00 -0.72 0.00 0.00 41.12 36.33 3gp3 n ASP 73 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3gp3 n LEU 74 N -4.22 3.27 0.22 -2.67 4.77 0.26 -4.85 117.00 113.78 3gp3 n LEU 74 Ca -0.29 -3.88 0.15 0.00 -0.03 0.00 0.00 56.01 51.96 3gp3 n LEU 74 Cb 0.67 -0.13 0.66 0.00 -2.33 0.00 0.00 43.42 42.30 3gp3 n LEU 74 CO 0.65 1.55 0.95 0.24 -1.33 0.00 0.00 177.39 179.45 3gp3 h MET 75 N 1.96 0.00 -0.01 3.23 2.86 -1.93 -3.00 114.93 118.05 3gp3 h MET 75 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3gp3 h MET 75 Cb 1.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.07 3gp3 h MET 75 CO 0.41 0.00 -0.27 2.48 1.06 0.00 0.00 176.91 180.59 3gp3 n TYR 76 N -2.67 0.00 -2.23 -0.22 0.18 -1.26 -4.98 117.16 105.98 3gp3 n TYR 76 Ca 0.01 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.46 3gp3 n TYR 76 Cb 0.22 -0.11 -0.01 0.00 -0.38 0.00 0.00 39.34 39.06 3gp3 n TYR 76 CO 0.00 0.00 0.00 0.14 -2.08 0.00 0.00 176.86 174.92 3gp3 s VAL 77 N -2.49 3.88 0.38 -3.48 -7.23 -1.14 -4.99 120.40 105.33 3gp3 s VAL 77 Ca 0.24 0.97 -0.27 0.00 -1.81 0.00 0.00 61.98 61.11 3gp3 s VAL 77 Cb 0.19 -3.44 -0.10 0.00 0.56 0.00 0.00 36.38 33.60 3gp3 s VAL 77 CO 0.52 -0.44 1.37 -2.84 -0.31 0.00 0.00 175.10 173.40 3gp3 s PRO 78 N -3.82 4.10 -0.05 4.82 0.02 -1.26 -4.86 135.00 133.94 3gp3 s PRO 78 Ca 0.64 2.33 0.02 0.00 0.02 0.00 0.00 61.00 64.01 3gp3 s PRO 78 Cb -0.15 -2.91 0.02 0.00 0.02 0.00 0.00 34.50 31.47 3gp3 s PRO 78 CO 0.31 -0.44 -0.08 0.08 -0.33 0.00 0.00 177.00 176.54 3gp3 s VAL 79 N -1.17 0.82 -0.25 3.83 1.01 -1.26 -1.23 120.40 122.15 3gp3 s VAL 79 Ca 0.53 -0.29 -0.09 0.00 0.00 0.00 0.00 61.98 62.13 3gp3 s VAL 79 Cb -0.42 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 3gp3 s VAL 79 CO 0.55 0.28 0.12 -0.69 0.00 0.00 0.00 175.10 175.36 3gp3 s VAL 80 N 0.78 4.82 -0.28 2.92 1.01 0.04 -4.98 120.40 124.70 3gp3 s VAL 80 Ca -0.13 -0.00 -0.08 0.00 0.00 0.00 0.00 61.98 61.77 3gp3 s VAL 80 Cb -0.15 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 3gp3 s VAL 80 CO 0.02 0.33 0.10 -1.00 0.00 0.00 0.00 175.10 174.55 3gp3 s HIS 81 N 1.38 3.13 -0.06 5.22 3.76 -1.26 -1.03 115.29 126.43 3gp3 s HIS 81 Ca 0.06 -0.66 0.02 0.00 -0.15 0.00 0.00 55.06 54.34 3gp3 s HIS 81 Cb -0.15 -2.28 0.01 0.00 1.11 0.00 0.00 32.58 31.27 3gp3 s HIS 81 CO 0.05 -0.46 -0.12 0.45 -0.85 0.00 0.00 174.74 173.81 3gp3 s SER 82 N 1.57 1.72 0.64 1.40 0.15 -0.29 -4.83 113.70 114.07 3gp3 s SER 82 Ca 0.05 -0.28 0.38 0.00 0.70 0.00 0.00 55.95 56.79 3gp3 s SER 82 Cb -0.16 -0.72 2.10 0.00 -1.71 0.00 0.00 66.02 65.52 3gp3 s SER 82 CO 0.04 0.05 2.24 4.11 1.20 0.00 0.00 173.24 180.88 3gp3 h TRP 83 N 6.82 0.00 0.00 3.44 5.08 -1.89 -1.24 115.95 128.16 3gp3 h TRP 83 Ca -0.32 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.65 3gp3 h TRP 83 Cb 1.18 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.34 3gp3 h TRP 83 CO 0.48 0.00 0.00 0.00 -1.28 0.00 0.00 178.44 177.64 3gp3 h ARG 84 N 0.00 0.00 -0.02 0.12 3.08 -1.93 -1.75 114.38 113.88 3gp3 h ARG 84 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3gp3 h ARG 84 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 3gp3 h ARG 84 CO -0.00 0.00 -0.22 1.28 -1.07 0.00 0.00 179.97 179.96 3gp3 n LEU 85 N -3.05 1.76 -4.40 3.04 4.77 -0.47 -4.07 117.00 114.59 3gp3 n LEU 85 Ca -0.01 -0.59 -0.37 0.00 -0.03 0.00 0.00 56.01 55.01 3gp3 n LEU 85 Cb 0.19 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.28 3gp3 n LEU 85 CO 0.23 0.31 -0.16 0.59 -1.33 0.00 0.00 177.39 177.04 3gp3 n ASN 86 N 0.06 -1.90 -4.61 -1.43 4.13 -0.66 -4.48 115.26 106.37 3gp3 n ASN 86 Ca 0.13 0.64 -0.37 0.00 1.68 0.00 0.00 54.58 56.66 3gp3 n ASN 86 Cb 0.43 -1.10 0.06 0.00 -1.54 0.00 0.00 39.78 37.63 3gp3 n ASN 86 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 3gp3 n GLU 87 N 0.17 0.75 -1.60 3.52 4.07 -1.26 -4.59 120.64 121.70 3gp3 n GLU 87 Ca 0.10 0.30 -0.46 0.00 -0.06 0.00 0.00 57.16 57.04 3gp3 n GLU 87 Cb 0.49 -2.18 -0.03 0.00 -0.06 0.00 0.00 31.44 29.66 3gp3 n GLU 87 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 3gp3 n ARG 88 N -1.29 1.40 -2.52 5.31 0.00 -1.26 -4.64 116.66 113.66 3gp3 n ARG 88 Ca 0.14 0.50 -0.42 0.00 -0.00 0.00 0.00 57.85 58.06 3gp3 n ARG 88 Cb 0.48 -1.96 -0.03 0.00 0.00 0.00 0.00 32.46 30.95 3gp3 n ARG 88 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 3gp3 s HIS 89 N -0.58 3.33 -2.18 -0.14 5.65 -1.26 -4.15 115.29 115.96 3gp3 s HIS 89 Ca 0.65 1.34 0.18 0.00 0.25 0.00 0.00 55.06 57.49 3gp3 s HIS 89 Cb -0.75 -3.35 0.53 0.00 -1.18 0.00 0.00 32.58 27.83 3gp3 s HIS 89 CO 0.55 -0.99 1.42 0.66 -0.65 0.00 0.00 174.74 175.74 3gp3 n TYR 90 N 4.83 0.45 -4.42 3.88 4.01 -1.26 -1.12 117.16 123.54 3gp3 n TYR 90 Ca 0.10 -0.23 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 3gp3 n TYR 90 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.50 3gp3 n TYR 90 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3gp3 n GLY 91 N 1.24 1.01 0.00 2.72 0.00 -1.25 -1.94 105.19 106.97 3gp3 n GLY 91 Ca 0.16 -0.60 0.03 0.00 0.00 0.00 0.00 46.02 45.61 3gp3 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gp3 n ALA 92 N 4.70 1.45 0.82 4.61 0.00 0.83 -1.80 120.51 131.11 3gp3 n ALA 92 Ca 0.00 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.54 3gp3 n ALA 92 Cb 0.00 -1.10 0.52 0.00 0.00 0.00 0.00 19.45 18.87 3gp3 n ALA 92 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gp3 n LEU 93 N -1.32 0.17 -4.69 0.00 4.77 -0.82 -4.82 117.00 110.29 3gp3 n LEU 93 Ca 0.03 0.52 -0.42 0.00 -0.03 0.00 0.00 56.01 56.11 3gp3 n LEU 93 Cb 0.05 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 40.64 3gp3 n LEU 93 CO 0.05 -0.10 1.23 -0.44 -1.33 0.00 0.00 177.39 176.80 3gp3 s SER 94 N -3.31 6.72 0.00 -1.43 0.01 -0.75 -1.07 113.70 113.87 3gp3 s SER 94 Ca 0.12 2.31 0.00 0.00 1.31 0.00 0.00 55.95 59.69 3gp3 s SER 94 Cb 0.16 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.82 3gp3 s SER 94 CO 0.49 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.94 3gp3 n GLY 95 N 3.83 2.43 3.84 3.44 0.00 0.15 -5.00 105.19 113.87 3gp3 n GLY 95 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 3gp3 n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gp3 s LEU 96 N 0.00 3.87 0.09 0.99 1.43 -0.23 -4.79 118.68 120.03 3gp3 s LEU 96 Ca 0.00 1.53 -0.30 0.00 -1.03 0.00 0.00 54.13 54.33 3gp3 s LEU 96 Cb 0.00 -4.40 -0.05 0.00 0.03 0.00 0.00 46.19 41.76 3gp3 s LEU 96 CO 0.00 -0.40 1.04 0.21 0.23 0.00 0.00 176.35 177.43 3gp3 s ASN 97 N -2.53 7.33 0.24 2.29 3.84 -1.26 -1.63 114.94 123.23 3gp3 s ASN 97 Ca 0.59 1.87 -0.01 0.00 0.21 0.00 0.00 52.86 55.52 3gp3 s ASN 97 Cb -0.10 -2.59 0.28 0.00 -0.55 0.00 0.00 41.25 38.30 3gp3 s ASN 97 CO 0.20 -0.23 1.66 0.11 -2.79 0.00 0.00 177.10 176.06 3gp3 h LYS 98 N 6.00 0.62 -0.10 0.43 1.57 -1.05 -1.20 116.57 122.83 3gp3 h LYS 98 Ca -0.42 -0.25 -0.12 0.00 -1.87 0.00 0.00 60.65 57.98 3gp3 h LYS 98 Cb 1.21 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.50 3gp3 h LYS 98 CO 0.74 0.83 -0.40 0.00 -0.57 0.00 0.00 179.45 180.06 3gp3 h ALA 99 N 1.17 0.18 -0.71 3.86 0.00 -1.92 -1.73 119.26 120.10 3gp3 h ALA 99 Ca 0.07 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.53 3gp3 h ALA 99 Cb 0.74 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 3gp3 h ALA 99 CO 0.06 0.29 0.47 0.93 0.00 0.00 0.00 179.25 181.00 3gp3 h GLU 100 N 0.01 0.90 -0.35 0.00 5.08 -1.92 -0.98 114.58 117.31 3gp3 h GLU 100 Ca -0.02 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 3gp3 h GLU 100 Cb 1.03 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 3gp3 h GLU 100 CO 0.08 0.60 0.05 1.15 -1.00 0.00 0.00 179.01 179.89 3gp3 h THR 101 N 0.93 1.24 -0.48 1.13 2.02 -1.15 -1.98 112.91 114.61 3gp3 h THR 101 Ca 0.27 -0.85 -0.03 0.00 0.77 0.00 0.00 66.41 66.57 3gp3 h THR 101 Cb -0.05 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 3gp3 h THR 101 CO -0.07 0.28 0.17 0.00 0.37 0.00 0.00 175.52 176.28 3gp3 h ALA 102 N 0.90 0.63 -0.45 6.16 0.00 -1.02 0.72 119.26 126.19 3gp3 h ALA 102 Ca 0.11 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.93 3gp3 h ALA 102 Cb 0.36 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 3gp3 h ALA 102 CO 0.01 0.26 0.04 0.00 0.00 0.00 0.00 179.25 179.56 3gp3 h ALA 103 N 1.02 0.46 -0.10 0.00 0.00 -1.12 0.73 119.26 120.25 3gp3 h ALA 103 Ca 0.16 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 3gp3 h ALA 103 Cb 0.24 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3gp3 h ALA 103 CO -0.01 -0.36 -0.31 -0.22 0.00 0.00 0.00 179.25 178.35 3gp3 h LYS 104 N 0.16 0.39 0.00 0.00 3.64 -1.17 -3.38 116.57 116.21 3gp3 h LYS 104 Ca 0.23 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3gp3 h LYS 104 Cb 0.32 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3gp3 h LYS 104 CO -0.34 0.91 -1.27 0.66 -2.27 0.00 0.00 179.45 177.13 3gp3 n TYR 105 N -4.41 0.00 0.00 1.91 4.01 0.23 -5.10 117.16 113.79 3gp3 n TYR 105 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 3gp3 n TYR 105 Cb 0.49 -0.19 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 3gp3 n TYR 105 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3gp3 n GLY 106 N 1.45 1.93 0.26 2.72 0.00 0.25 -4.59 105.19 107.21 3gp3 n GLY 106 Ca 0.00 -1.69 -0.07 0.00 0.00 0.00 0.00 46.02 44.25 3gp3 n GLY 106 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3gp3 h ASP 107 N 0.00 0.79 0.10 1.61 3.45 -1.93 -2.27 116.42 118.16 3gp3 h ASP 107 Ca 0.00 -0.15 0.01 0.00 0.43 0.00 0.00 57.03 57.31 3gp3 h ASP 107 Cb 0.00 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.55 3gp3 h ASP 107 CO 0.00 0.72 -0.11 -0.33 -1.57 0.00 0.00 179.24 177.96 3gp3 h GLU 108 N 0.80 -0.22 -0.29 3.56 3.07 -1.94 -1.41 114.58 118.16 3gp3 h GLU 108 Ca 0.20 0.02 0.04 0.00 -0.50 0.00 0.00 59.36 59.11 3gp3 h GLU 108 Cb 0.17 0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.09 3gp3 h GLU 108 CO -0.02 -0.15 0.06 0.37 -1.40 0.00 0.00 179.01 177.87 3gp3 h GLN 109 N -0.23 0.16 -0.62 2.33 5.75 -1.77 -1.10 115.11 119.63 3gp3 h GLN 109 Ca 0.01 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3gp3 h GLN 109 Cb 0.23 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 3gp3 h GLN 109 CO -0.04 0.11 0.38 0.28 -2.65 0.00 0.00 178.83 176.91 3gp3 h VAL 110 N 0.17 1.17 -0.16 2.39 2.07 -1.21 -1.90 116.25 118.79 3gp3 h VAL 110 Ca 0.13 -0.35 -0.11 0.00 0.82 0.00 0.00 66.70 67.19 3gp3 h VAL 110 Cb 0.13 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 3gp3 h VAL 110 CO -0.17 0.17 -0.39 0.25 0.02 0.00 0.00 177.57 177.45 3gp3 h LEU 111 N 0.84 0.36 -0.50 2.57 6.46 -0.11 -0.14 115.31 124.78 3gp3 h LEU 111 Ca 0.22 -0.15 -0.06 0.00 -0.12 0.00 0.00 57.88 57.78 3gp3 h LEU 111 Cb -0.06 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 39.75 3gp3 h LEU 111 CO -0.04 0.72 0.08 -0.37 -0.62 0.00 0.00 178.44 178.21 3gp3 h VAL 112 N 0.29 1.25 -0.17 1.05 -1.51 -0.92 1.00 116.25 117.24 3gp3 h VAL 112 Ca 0.03 -0.93 -0.08 0.00 -1.23 0.00 0.00 66.70 64.49 3gp3 h VAL 112 Cb 0.82 0.88 -0.01 0.00 -2.13 0.00 0.00 31.29 30.84 3gp3 h VAL 112 CO 0.07 0.33 -0.26 -0.50 -1.23 0.00 0.00 177.57 175.97 3gp3 h TRP 113 N 0.71 0.34 0.20 5.19 6.55 -1.01 -1.66 115.95 126.28 3gp3 h TRP 113 Ca 0.15 -0.07 -0.33 0.00 0.95 0.00 0.00 58.89 59.60 3gp3 h TRP 113 Cb 0.39 -0.09 0.02 0.00 -0.86 0.00 0.00 29.16 28.63 3gp3 h TRP 113 CO 0.03 0.55 -1.50 0.00 -1.05 0.00 0.00 178.44 176.47 3gp3 h ARG 114 N 0.28 0.43 0.00 0.49 3.08 -0.81 -3.41 114.38 114.44 3gp3 h ARG 114 Ca 0.04 -0.73 0.00 0.00 0.07 0.00 0.00 59.98 59.36 3gp3 h ARG 114 Cb 0.62 0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.94 3gp3 h ARG 114 CO 0.04 1.34 0.00 0.54 -1.07 0.00 0.00 179.97 180.82 3gp3 n ARG 115 N -3.62 0.59 -1.67 0.04 5.12 0.33 -4.99 116.66 112.44 3gp3 n ARG 115 Ca -0.17 -0.09 -0.42 0.00 -1.93 0.00 0.00 57.85 55.24 3gp3 n ARG 115 Cb 1.08 -0.46 -0.03 0.00 -1.16 0.00 0.00 32.46 31.89 3gp3 n ARG 115 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3gp3 s SER 116 N -0.11 6.38 0.39 0.55 0.15 -0.63 -4.68 113.70 115.75 3gp3 s SER 116 Ca 0.00 2.61 0.12 0.00 0.70 0.00 0.00 55.95 59.37 3gp3 s SER 116 Cb 0.00 -2.53 0.91 0.00 -1.71 0.00 0.00 66.02 62.69 3gp3 s SER 116 CO 0.00 -1.12 1.90 0.22 1.20 0.00 0.00 173.24 175.44 3gp3 h TYR 117 N 10.90 0.67 0.00 3.44 3.20 -1.88 -3.30 116.97 130.00 3gp3 h TYR 117 Ca -0.49 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.40 3gp3 h TYR 117 Cb 1.24 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.29 3gp3 h TYR 117 CO 0.95 0.26 -0.02 -0.40 -1.64 0.00 0.00 178.16 177.31 3gp3 n ASP 118 N -4.52 1.02 -4.23 -2.11 5.75 -1.26 -1.22 116.55 109.97 3gp3 n ASP 118 Ca 0.16 -1.59 -0.33 0.00 -0.01 0.00 0.00 54.79 53.01 3gp3 n ASP 118 Cb 0.48 -0.03 -0.16 0.00 -1.03 0.00 0.00 41.12 40.38 3gp3 n ASP 118 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3gp3 s THR 119 N -0.58 2.44 0.56 2.12 -4.23 -1.24 -4.97 115.64 109.74 3gp3 s THR 119 Ca 0.01 -0.85 -0.04 0.00 -1.18 0.00 0.00 61.69 59.64 3gp3 s THR 119 Cb 0.01 -2.01 0.01 0.00 1.34 0.00 0.00 72.50 71.85 3gp3 s THR 119 CO 0.00 0.53 0.84 -2.16 -0.54 0.00 0.00 174.62 173.29 3gp3 s PRO 120 N 0.84 2.86 0.95 3.99 0.04 -1.26 -4.69 135.00 137.73 3gp3 s PRO 120 Ca -0.05 -0.21 -0.11 0.00 0.04 0.00 0.00 61.00 60.67 3gp3 s PRO 120 Cb -0.15 -2.35 0.16 0.00 0.04 0.00 0.00 34.50 32.20 3gp3 s PRO 120 CO -0.01 -0.64 1.10 -2.14 0.04 0.00 0.00 177.00 175.35 3gp3 s PRO 121 N -4.88 0.81 0.22 0.56 0.02 -1.26 -4.91 135.00 125.55 3gp3 s PRO 121 Ca 0.53 1.22 -0.32 0.00 0.02 0.00 0.00 61.00 62.46 3gp3 s PRO 121 Cb -0.10 -1.73 -0.14 0.00 0.02 0.00 0.00 34.50 32.55 3gp3 s PRO 121 CO 0.43 -2.67 1.43 -2.30 -0.33 0.00 0.00 177.00 173.56 3gp3 n PRO 122 N -4.23 2.00 -2.40 5.54 -0.02 -1.26 -4.82 135.00 129.81 3gp3 n PRO 122 Ca 0.09 0.71 -0.35 0.00 -2.02 0.00 0.00 63.50 61.93 3gp3 n PRO 122 Cb 0.53 -2.39 -0.02 0.00 -0.02 0.00 0.00 33.50 31.61 3gp3 n PRO 122 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gp3 s ALA 123 N 0.15 2.82 0.42 3.55 0.00 -1.26 -0.12 121.76 127.32 3gp3 s ALA 123 Ca 0.71 0.73 -0.27 0.00 0.00 0.00 0.00 51.96 53.14 3gp3 s ALA 123 Cb -0.67 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.04 3gp3 s ALA 123 CO 0.47 -0.52 1.47 -0.51 0.00 0.00 0.00 175.76 176.67 3gp3 s LEU 124 N -3.51 4.21 0.61 0.00 1.43 -0.47 -4.14 118.68 116.81 3gp3 s LEU 124 Ca 0.69 3.01 -0.19 0.00 -1.03 0.00 0.00 54.13 56.60 3gp3 s LEU 124 Cb -0.21 -3.80 -0.03 0.00 0.03 0.00 0.00 46.19 42.18 3gp3 s LEU 124 CO 0.25 -1.05 1.27 -1.61 0.23 0.00 0.00 176.35 175.44 3gp3 s GLU 125 N -2.29 2.83 0.52 1.70 0.41 -1.26 -4.92 118.70 115.69 3gp3 s GLU 125 Ca 0.57 2.01 0.18 0.00 -0.41 0.00 0.00 54.97 57.31 3gp3 s GLU 125 Cb -0.46 -1.96 1.30 0.00 -1.78 0.00 0.00 34.13 31.23 3gp3 s GLU 125 CO 0.60 -1.37 2.13 -1.35 -0.49 0.00 0.00 175.26 174.79 3gp3 h PRO 126 N 0.86 0.00 -0.43 0.39 0.11 -2.00 -1.99 132.00 128.95 3gp3 h PRO 126 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3gp3 h PRO 126 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3gp3 h PRO 126 CO 0.55 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.75 3gp3 n GLY 127 N -1.55 1.19 3.76 -0.55 0.00 -1.26 -4.85 105.19 101.92 3gp3 n GLY 127 Ca -0.01 -0.54 -0.38 0.00 0.00 0.00 0.00 46.02 45.09 3gp3 n GLY 127 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gp3 s ASP 128 N -1.16 5.60 0.57 1.61 2.15 -0.75 -4.90 116.67 119.80 3gp3 s ASP 128 Ca 0.34 2.57 0.28 0.00 0.43 0.00 0.00 52.55 56.17 3gp3 s ASP 128 Cb 0.18 -2.62 1.72 0.00 -0.30 0.00 0.00 42.92 41.90 3gp3 s ASP 128 CO 0.24 -1.33 2.22 1.05 -0.17 0.00 0.00 175.17 177.19 3gp3 h GLU 129 N 1.65 0.00 -0.00 4.34 4.11 -1.93 -2.11 114.58 120.64 3gp3 h GLU 129 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 3gp3 h GLU 129 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 3gp3 h GLU 129 CO 0.58 0.02 -0.11 0.54 0.07 0.00 0.00 179.01 180.11 3gp3 n ARG 130 N -3.89 0.07 -1.68 1.06 1.74 -1.26 -4.89 116.66 107.81 3gp3 n ARG 130 Ca -0.03 -0.01 -0.33 0.00 -0.77 0.00 0.00 57.85 56.71 3gp3 n ARG 130 Cb 0.10 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.10 3gp3 n ARG 130 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gp3 s ALA 131 N -2.94 2.46 -2.55 7.54 0.00 -0.80 -4.96 121.76 120.51 3gp3 s ALA 131 Ca 0.15 0.47 0.25 0.00 0.00 0.00 0.00 51.96 52.83 3gp3 s ALA 131 Cb 0.19 -3.30 0.71 0.00 0.00 0.00 0.00 23.12 20.72 3gp3 s ALA 131 CO 0.56 -1.33 1.55 -0.35 0.00 0.00 0.00 175.76 176.19 3gp3 n PRO 132 N -2.61 1.93 0.18 0.00 -0.04 -1.26 -4.58 135.00 128.62 3gp3 n PRO 132 Ca 0.10 -1.36 0.04 0.00 -0.04 0.00 0.00 63.50 62.24 3gp3 n PRO 132 Cb 0.52 -1.46 0.32 0.00 -0.04 0.00 0.00 33.50 32.84 3gp3 n PRO 132 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3gp3 h TYR 133 N 3.09 0.00 -0.02 0.54 0.05 -1.93 -2.76 116.97 115.94 3gp3 h TYR 133 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3gp3 h TYR 133 Cb 0.66 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.40 3gp3 h TYR 133 CO 0.06 0.42 -0.30 0.00 -1.05 0.00 0.00 178.16 177.28 3gp3 n ALA 134 N -2.34 3.17 -2.68 3.88 0.00 -1.26 -4.90 120.51 116.38 3gp3 n ALA 134 Ca -0.01 -0.56 -0.43 0.00 0.00 0.00 0.00 53.44 52.45 3gp3 n ALA 134 Cb 0.51 -0.94 -0.02 0.00 0.00 0.00 0.00 19.45 19.00 3gp3 n ALA 134 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3gp3 s ASP 135 N -2.37 7.18 0.66 0.00 -1.08 -1.04 -4.94 116.67 115.07 3gp3 s ASP 135 Ca 0.24 1.45 0.44 0.00 -0.52 0.00 0.00 52.55 54.16 3gp3 s ASP 135 Cb 0.19 -2.54 2.37 0.00 -1.46 0.00 0.00 42.92 41.48 3gp3 s ASP 135 CO 0.50 -0.52 2.35 -0.65 0.52 0.00 0.00 175.17 177.37 3gp3 h PRO 136 N 7.23 0.00 -0.09 4.34 0.11 -1.92 -1.08 132.00 140.58 3gp3 h PRO 136 Ca -0.27 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.87 3gp3 h PRO 136 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 3gp3 h PRO 136 CO 0.90 0.00 0.08 0.00 -0.21 0.00 0.00 178.00 178.76 3gp3 h ARG 137 N 0.00 0.00 -0.08 1.05 3.08 -1.94 -2.88 114.38 113.61 3gp3 h ARG 137 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3gp3 h ARG 137 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3gp3 h ARG 137 CO 0.00 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.56 3gp3 n TYR 138 N -4.22 0.24 0.22 3.04 4.01 -0.42 -4.73 117.16 115.31 3gp3 n TYR 138 Ca -0.01 -0.87 0.13 0.00 -0.16 0.00 0.00 57.90 57.00 3gp3 n TYR 138 Cb 0.19 -0.17 0.76 0.00 -0.31 0.00 0.00 39.34 39.81 3gp3 n TYR 138 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3gp3 h ALA 139 N 0.53 1.91 -0.62 -0.72 0.00 -1.38 -0.91 119.26 118.07 3gp3 h ALA 139 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3gp3 h ALA 139 Cb 1.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3gp3 h ALA 139 CO 0.05 -0.16 0.00 0.36 0.00 0.00 0.00 179.25 179.50 3gp3 n LYS 140 N -4.18 2.82 -3.70 0.00 2.85 -1.26 -4.91 118.16 109.78 3gp3 n LYS 140 Ca -0.00 -2.51 -0.35 0.00 -1.05 0.00 0.00 58.31 54.40 3gp3 n LYS 140 Cb 0.21 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 33.01 3gp3 n LYS 140 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3gp3 s VAL 141 N -1.06 5.39 0.19 0.58 1.01 -0.35 -5.04 120.40 121.12 3gp3 s VAL 141 Ca 0.42 0.22 -0.33 0.00 0.00 0.00 0.00 61.98 62.29 3gp3 s VAL 141 Cb 0.22 -3.49 -0.14 0.00 0.00 0.00 0.00 36.38 32.98 3gp3 s VAL 141 CO 0.28 0.42 1.52 -2.65 0.00 0.00 0.00 175.10 174.67 3gp3 n PRO 142 N 3.65 2.13 -0.33 2.72 -0.02 -1.26 -4.86 135.00 137.03 3gp3 n PRO 142 Ca -0.15 0.76 0.17 0.00 -2.02 0.00 0.00 63.50 62.26 3gp3 n PRO 142 Cb 0.52 -2.49 0.41 0.00 -0.02 0.00 0.00 33.50 31.91 3gp3 n PRO 142 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gp3 h ARG 143 N 5.31 0.57 0.00 -0.52 3.08 -1.96 0.42 114.38 121.28 3gp3 h ARG 143 Ca -0.45 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.57 3gp3 h ARG 143 Cb 1.26 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 31.18 3gp3 h ARG 143 CO 0.84 0.38 -0.00 1.05 -1.07 0.00 0.00 179.97 181.17 3gp3 h GLU 144 N 0.59 0.00 0.00 0.04 9.09 -2.04 -2.50 114.58 119.75 3gp3 h GLU 144 Ca 0.57 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.98 3gp3 h GLU 144 Cb 1.14 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.24 3gp3 h GLU 144 CO -0.34 0.00 -0.55 1.04 0.05 0.00 0.00 179.01 179.22 3gp3 n GLN 145 N -3.18 0.08 -3.14 1.06 6.02 0.14 -4.87 117.38 113.49 3gp3 n GLN 145 Ca -0.03 0.02 -0.39 0.00 -0.01 0.00 0.00 57.00 56.59 3gp3 n GLN 145 Cb 0.09 -1.55 -0.05 0.00 1.02 0.00 0.00 30.24 29.75 3gp3 n GLN 145 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3gp3 s LEU 146 N -3.33 4.28 0.39 1.08 1.43 -0.94 -5.04 118.68 116.55 3gp3 s LEU 146 Ca 0.10 1.01 -0.15 0.00 -1.03 0.00 0.00 54.13 54.06 3gp3 s LEU 146 Cb 0.16 -2.93 -0.08 0.00 0.03 0.00 0.00 46.19 43.37 3gp3 s LEU 146 CO 0.71 -0.10 0.82 -2.16 0.23 0.00 0.00 176.35 175.84 3gp3 s PRO 147 N 0.91 3.97 0.00 1.29 0.04 -1.26 -4.98 135.00 134.97 3gp3 s PRO 147 Ca 0.32 0.73 0.17 0.00 0.04 0.00 0.00 61.00 62.26 3gp3 s PRO 147 Cb -0.17 -2.33 0.14 0.00 0.04 0.00 0.00 34.50 32.18 3gp3 s PRO 147 CO 0.14 0.00 1.04 1.28 0.04 0.00 0.00 177.00 179.51 3gp3 n LEU 148 N -0.87 2.43 -3.63 -3.56 4.77 -1.26 -4.74 117.00 110.15 3gp3 n LEU 148 Ca 0.04 -1.01 -0.03 0.00 -0.03 0.00 0.00 56.01 54.98 3gp3 n LEU 148 Cb 0.54 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 3gp3 n LEU 148 CO 0.43 0.43 1.10 0.28 -1.33 0.00 0.00 177.39 178.30 3gp3 s THR 149 N -1.41 0.00 0.01 -5.08 -1.32 -1.26 -1.36 115.64 105.21 3gp3 s THR 149 Ca 0.20 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.61 3gp3 s THR 149 Cb 0.14 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.13 3gp3 s THR 149 CO 0.21 0.00 0.14 -1.61 -2.21 0.00 0.00 174.62 171.15 3gp3 s GLU 150 N -1.59 0.51 0.50 7.08 2.02 -0.27 -4.91 118.70 122.03 3gp3 s GLU 150 Ca 0.09 -0.45 0.04 0.00 0.02 0.00 0.00 54.97 54.68 3gp3 s GLU 150 Cb -0.01 0.21 0.03 0.00 0.10 0.00 0.00 34.13 34.46 3gp3 s GLU 150 CO -0.05 -0.12 0.69 0.00 0.02 0.00 0.00 175.26 175.79 3gp3 h LEU 152 N 0.32 0.65 -1.00 0.00 5.85 -1.73 -1.21 115.31 118.19 3gp3 h LEU 152 Ca -0.41 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.35 3gp3 h LEU 152 Cb 1.29 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 42.10 3gp3 h LEU 152 CO 0.49 0.46 0.65 0.50 -0.34 0.00 0.00 178.44 180.19 3gp3 h LYS 153 N 0.76 1.20 -0.36 1.25 3.64 -1.50 0.14 116.57 121.69 3gp3 h LYS 153 Ca 0.24 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.41 3gp3 h LYS 153 Cb 0.01 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.55 3gp3 h LYS 153 CO -0.06 0.79 -0.32 -0.44 -2.27 0.00 0.00 179.45 177.15 3gp3 h ASP 154 N 1.23 0.83 -0.20 4.20 3.32 -1.53 -2.34 116.42 121.93 3gp3 h ASP 154 Ca 0.41 -0.34 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3gp3 h ASP 154 Cb 0.06 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3gp3 h ASP 154 CO -0.14 1.08 0.13 0.74 -1.72 0.00 0.00 179.24 179.32 3gp3 h THR 155 N 0.67 1.04 -0.59 0.35 2.02 -0.34 -1.61 112.91 114.46 3gp3 h THR 155 Ca 0.07 -0.09 0.11 0.00 0.77 0.00 0.00 66.41 67.28 3gp3 h THR 155 Cb 0.86 0.75 -0.09 0.00 -1.74 0.00 0.00 68.15 67.94 3gp3 h THR 155 CO 0.08 0.05 0.10 0.58 0.37 0.00 0.00 175.52 176.69 3gp3 h VAL 156 N 0.26 0.63 -0.72 3.16 2.07 -0.67 -0.96 116.25 120.02 3gp3 h VAL 156 Ca 0.08 -0.08 0.05 0.00 0.82 0.00 0.00 66.70 67.56 3gp3 h VAL 156 Cb -0.02 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 3gp3 h VAL 156 CO -0.03 0.04 0.47 0.00 0.02 0.00 0.00 177.57 178.08 3gp3 h ALA 157 N 1.48 1.64 0.00 1.67 0.00 -1.16 -1.88 119.26 121.02 3gp3 h ALA 157 Ca 0.31 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.97 3gp3 h ALA 157 Cb 0.46 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3gp3 h ALA 157 CO -0.41 0.27 -0.92 -0.09 0.00 0.00 0.00 179.25 178.10 3gp3 h ARG 158 N 0.82 0.34 0.23 0.00 2.43 -0.52 -3.35 114.38 114.33 3gp3 h ARG 158 Ca 0.30 -0.37 -0.33 0.00 -0.81 0.00 0.00 59.98 58.77 3gp3 h ARG 158 Cb 0.14 0.11 0.03 0.00 -0.42 0.00 0.00 29.97 29.83 3gp3 h ARG 158 CO -0.09 1.06 -1.44 0.28 -1.51 0.00 0.00 179.97 178.27 3gp3 h VAL 159 N 0.19 1.32 -0.37 0.20 2.07 -0.82 -3.37 116.25 115.47 3gp3 h VAL 159 Ca -0.07 -2.75 -0.02 0.00 0.82 0.00 0.00 66.70 64.68 3gp3 h VAL 159 Cb 1.56 3.01 -0.02 0.00 -1.52 0.00 0.00 31.29 34.32 3gp3 h VAL 159 CO 0.15 0.82 0.12 -0.07 0.02 0.00 0.00 177.57 178.62 3gp3 h LEU 160 N 0.14 0.47 -1.60 2.57 3.38 -1.49 -1.89 115.31 116.89 3gp3 h LEU 160 Ca -0.23 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 3gp3 h LEU 160 Cb 2.13 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.75 3gp3 h LEU 160 CO 0.26 0.45 0.13 -0.65 0.09 0.00 0.00 178.44 178.73 3gp3 h PRO 161 N 0.52 0.39 -0.37 1.13 0.11 -1.76 0.13 132.00 132.15 3gp3 h PRO 161 Ca 0.13 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 66.05 3gp3 h PRO 161 Cb 0.15 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.17 3gp3 h PRO 161 CO -0.01 0.31 -0.37 1.25 -0.21 0.00 0.00 178.00 178.98 3gp3 h LEU 162 N 0.40 0.93 -0.06 2.35 5.85 -1.57 -0.97 115.31 122.24 3gp3 h LEU 162 Ca 0.10 -0.42 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 3gp3 h LEU 162 Cb 0.05 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 3gp3 h LEU 162 CO -0.01 1.20 0.03 -0.25 -0.34 0.00 0.00 178.44 179.07 3gp3 h TRP 163 N 0.72 0.08 -0.51 1.25 2.91 -1.15 -1.37 115.95 117.88 3gp3 h TRP 163 Ca 0.06 -0.00 -0.09 0.00 1.13 0.00 0.00 58.89 59.99 3gp3 h TRP 163 Cb 0.95 -0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 29.55 3gp3 h TRP 163 CO 0.06 0.10 -0.05 -0.91 -1.03 0.00 0.00 178.44 176.61 3gp3 h ASN 164 N 0.03 0.93 0.93 2.65 2.35 -0.67 0.25 115.58 122.05 3gp3 h ASN 164 Ca 0.02 -0.33 -0.18 0.00 -0.55 0.00 0.00 56.30 55.26 3gp3 h ASN 164 Cb 0.05 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.13 3gp3 h ASN 164 CO -0.00 1.04 -1.14 -0.33 -1.65 0.00 0.00 177.43 175.34 3gp3 h GLU 165 N 0.81 0.00 0.00 0.81 5.08 -1.20 -3.41 114.58 116.67 3gp3 h GLU 165 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3gp3 h GLU 165 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3gp3 h GLU 165 CO 0.04 0.52 -0.21 0.45 -1.00 0.00 0.00 179.01 178.80 3gp3 n SER 166 N -3.10 0.09 -0.05 1.42 2.88 -0.61 -4.79 113.62 109.46 3gp3 n SER 166 Ca -0.06 0.14 -0.14 0.00 -1.33 0.00 0.00 58.87 57.48 3gp3 n SER 166 Cb 0.87 0.06 -0.08 0.00 -0.75 0.00 0.00 64.21 64.32 3gp3 n SER 166 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 3gp3 h ILE 167 N 0.00 1.37 -0.49 2.46 2.04 -1.15 -1.25 117.51 120.49 3gp3 h ILE 167 Ca 0.00 -1.49 -0.09 0.00 1.00 0.00 0.00 64.86 64.29 3gp3 h ILE 167 Cb 0.21 2.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.29 3gp3 h ILE 167 CO 0.00 0.44 -0.03 0.00 0.00 0.00 0.00 178.15 178.55 3gp3 h ALA 168 N 0.55 0.66 -0.44 1.87 0.00 -1.20 -0.85 119.26 119.86 3gp3 h ALA 168 Ca 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 3gp3 h ALA 168 Cb 0.81 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3gp3 h ALA 168 CO 0.05 0.50 0.25 -1.35 0.00 0.00 0.00 179.25 178.70 3gp3 h PRO 169 N 0.74 0.60 -0.27 0.00 0.11 -1.76 -0.40 132.00 131.03 3gp3 h PRO 169 Ca 0.13 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.17 3gp3 h PRO 169 Cb 0.56 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 3gp3 h PRO 169 CO 0.03 0.44 0.07 0.00 -0.21 0.00 0.00 178.00 178.33 3gp3 h ALA 170 N 1.67 0.36 -0.39 -0.75 0.00 -0.35 -0.86 119.26 118.94 3gp3 h ALA 170 Ca 0.16 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3gp3 h ALA 170 Cb 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3gp3 h ALA 170 CO -0.03 0.01 0.23 0.28 0.00 0.00 0.00 179.25 179.74 3gp3 h VAL 171 N 0.27 1.04 0.00 0.00 2.07 -0.75 -1.79 116.25 117.10 3gp3 h VAL 171 Ca 0.09 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 3gp3 h VAL 171 Cb 0.28 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3gp3 h VAL 171 CO 0.00 0.08 -0.13 0.11 0.02 0.00 0.00 177.57 177.65 3gp3 h LYS 172 N 0.46 0.00 0.00 1.57 1.79 -0.88 -1.28 116.57 118.23 3gp3 h LYS 172 Ca 0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 3gp3 h LYS 172 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3gp3 h LYS 172 CO -0.07 0.13 0.00 0.00 -1.08 0.00 0.00 179.45 178.43 3gp3 n ALA 173 N -2.26 2.34 -0.57 3.86 0.00 -0.34 -4.90 120.51 118.64 3gp3 n ALA 173 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.30 3gp3 n ALA 173 Cb 0.27 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.28 3gp3 n ALA 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gp3 n GLY 174 N 1.01 0.68 3.75 0.00 0.00 -0.48 -5.06 105.19 105.09 3gp3 n GLY 174 Ca 0.13 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 3gp3 n GLY 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gp3 s LYS 175 N -0.74 4.51 -0.46 1.61 1.02 -0.71 -5.01 119.74 119.95 3gp3 s LYS 175 Ca 0.00 1.93 -0.23 0.00 0.02 0.00 0.00 55.97 57.69 3gp3 s LYS 175 Cb 0.00 -3.19 0.03 0.00 -0.52 0.00 0.00 37.83 34.15 3gp3 s LYS 175 CO 0.00 -0.01 0.80 -0.65 -0.92 0.00 0.00 175.35 174.57 3gp3 s GLN 176 N -0.95 3.39 -0.11 1.68 -0.21 -1.26 -4.42 119.66 117.78 3gp3 s GLN 176 Ca 0.49 -0.13 -0.04 0.00 0.02 0.00 0.00 55.36 55.70 3gp3 s GLN 176 Cb -0.34 -3.95 -0.04 0.00 1.00 0.00 0.00 33.01 29.68 3gp3 s GLN 176 CO 0.41 -1.16 0.03 0.08 -2.12 0.00 0.00 175.29 172.54 3gp3 s VAL 177 N 3.35 4.57 -0.11 1.09 1.01 -1.26 -0.57 120.40 128.48 3gp3 s VAL 177 Ca 0.30 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.15 3gp3 s VAL 177 Cb -0.12 -2.96 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 3gp3 s VAL 177 CO 0.22 0.58 -0.15 -0.22 0.00 0.00 0.00 175.10 175.54 3gp3 s LEU 178 N -0.64 2.65 -0.22 3.92 2.96 -1.07 -2.03 118.68 124.25 3gp3 s LEU 178 Ca 0.11 -0.32 -0.01 0.00 -0.22 0.00 0.00 54.13 53.69 3gp3 s LEU 178 Cb -0.12 -1.58 0.02 0.00 0.50 0.00 0.00 46.19 45.02 3gp3 s LEU 178 CO 0.02 0.21 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.52 3gp3 s ILE 179 N 0.10 2.59 -0.33 6.68 1.01 -0.25 -0.75 121.20 130.26 3gp3 s ILE 179 Ca -0.07 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 59.57 3gp3 s ILE 179 Cb -0.15 -2.23 0.03 0.00 0.01 0.00 0.00 42.46 40.12 3gp3 s ILE 179 CO 0.05 0.35 0.09 0.00 0.00 0.00 0.00 174.94 175.43 3gp3 s ALA 180 N 1.32 3.04 0.00 9.38 0.00 -0.30 -0.17 121.76 135.03 3gp3 s ALA 180 Ca 0.02 -1.68 0.00 0.00 0.00 0.00 0.00 51.96 50.30 3gp3 s ALA 180 Cb -0.15 -2.23 0.00 0.00 0.00 0.00 0.00 23.12 20.74 3gp3 s ALA 180 CO -0.07 -1.24 0.00 0.00 0.00 0.00 0.00 175.76 174.44 3gp3 n ALA 181 N 4.82 0.00 -2.39 0.00 0.00 0.40 -3.79 120.51 119.54 3gp3 n ALA 181 Ca -0.13 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.11 3gp3 n ALA 181 Cb 0.45 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.80 3gp3 n ALA 181 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3gp3 s HIS 182 N 0.48 1.88 0.13 0.00 3.76 -1.26 -1.35 115.29 118.92 3gp3 s HIS 182 Ca 0.00 -0.54 -0.20 0.00 -0.15 0.00 0.00 55.06 54.17 3gp3 s HIS 182 Cb 0.00 -0.90 -0.02 0.00 1.11 0.00 0.00 32.58 32.77 3gp3 s HIS 182 CO 0.00 0.43 1.69 0.78 -0.85 0.00 0.00 174.74 176.79 3gp3 h GLY 183 N 2.44 0.11 1.61 -2.22 0.00 -1.96 -0.26 103.07 102.79 3gp3 h GLY 183 Ca -0.39 0.09 -0.20 0.00 0.00 0.00 0.00 47.33 46.84 3gp3 h GLY 183 CO 0.63 -0.10 -1.11 3.43 0.00 0.00 0.00 176.54 179.39 3gp3 h ASN 184 N -0.04 0.00 0.61 0.19 2.35 -1.97 -1.87 115.58 114.85 3gp3 h ASN 184 Ca 0.10 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.72 3gp3 h ASN 184 Cb 0.19 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 3gp3 h ASN 184 CO -0.22 0.81 -0.63 0.77 -1.65 0.00 0.00 177.43 176.51 3gp3 h SER 185 N 0.00 0.02 -0.02 5.81 4.64 -1.77 -0.59 113.55 121.64 3gp3 h SER 185 Ca -0.09 -0.01 -0.20 0.00 -0.47 0.00 0.00 61.79 61.02 3gp3 h SER 185 Cb 1.70 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.79 3gp3 h SER 185 CO 0.09 0.64 -0.69 -0.07 -0.87 0.00 0.00 176.83 175.93 3gp3 h LEU 186 N 0.01 0.76 -0.89 5.97 3.38 -1.06 -1.07 115.31 122.41 3gp3 h LEU 186 Ca -0.01 -0.47 0.07 0.00 0.09 0.00 0.00 57.88 57.57 3gp3 h LEU 186 Cb 1.11 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.57 3gp3 h LEU 186 CO 0.08 1.24 0.55 0.03 0.09 0.00 0.00 178.44 180.43 3gp3 h ARG 187 N 0.47 0.94 -0.10 1.13 3.08 -1.13 0.49 114.38 119.26 3gp3 h ARG 187 Ca -0.03 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 3gp3 h ARG 187 Cb 1.28 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 3gp3 h ARG 187 CO 0.13 0.63 0.02 0.00 -1.07 0.00 0.00 179.97 179.68 3gp3 h ALA 188 N 1.43 0.14 -0.48 0.04 0.00 -0.98 -0.32 119.26 119.10 3gp3 h ALA 188 Ca 0.40 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3gp3 h ALA 188 Cb 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3gp3 h ALA 188 CO -0.19 -0.21 0.25 1.25 0.00 0.00 0.00 179.25 180.34 3gp3 h LEU 189 N -0.06 0.61 -1.32 0.00 5.85 -0.73 -2.71 115.31 116.95 3gp3 h LEU 189 Ca 0.03 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 3gp3 h LEU 189 Cb 0.29 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 3gp3 h LEU 189 CO 0.00 0.55 0.05 0.40 -0.34 0.00 0.00 178.44 179.10 3gp3 h ILE 190 N 0.63 1.18 -0.94 4.05 2.04 -0.81 0.37 117.51 124.03 3gp3 h ILE 190 Ca 0.17 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 3gp3 h ILE 190 Cb 0.09 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 3gp3 h ILE 190 CO -0.02 0.23 0.56 0.50 0.00 0.00 0.00 178.15 179.42 3gp3 h LYS 191 N 0.50 1.29 -0.01 2.37 3.64 -0.75 0.78 116.57 124.39 3gp3 h LYS 191 Ca 0.11 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3gp3 h LYS 191 Cb 0.25 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3gp3 h LYS 191 CO 0.00 0.90 -0.09 -0.92 -2.27 0.00 0.00 179.45 177.07 3gp3 h TYR 192 N 1.30 0.11 -0.71 1.91 3.20 -1.17 -1.51 116.97 120.11 3gp3 h TYR 192 Ca 0.34 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 3gp3 h TYR 192 Cb -0.05 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 3gp3 h TYR 192 CO 0.01 0.79 0.41 -0.07 -1.64 0.00 0.00 178.16 177.65 3gp3 h LEU 193 N -0.60 0.87 -1.42 2.82 3.38 -0.56 -2.65 115.31 117.15 3gp3 h LEU 193 Ca -0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3gp3 h LEU 193 Cb 0.81 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3gp3 h LEU 193 CO 0.02 0.70 0.00 0.47 0.09 0.00 0.00 178.44 179.72 3gp3 n ASP 194 N -4.51 2.20 -3.60 -0.43 8.00 0.24 -4.44 116.55 114.00 3gp3 n ASP 194 Ca 0.06 -1.73 -0.23 0.00 0.71 0.00 0.00 54.79 53.60 3gp3 n ASP 194 Cb 0.07 -0.02 0.07 0.00 -0.02 0.00 0.00 41.12 41.23 3gp3 n ASP 194 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gp3 n GLY 195 N 1.26 -0.47 3.77 0.44 0.00 -0.73 -4.95 105.19 104.50 3gp3 n GLY 195 Ca 0.17 0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.99 3gp3 n GLY 195 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gp3 s ILE 196 N -3.35 4.46 0.93 -0.61 1.01 -0.65 -5.03 121.20 117.95 3gp3 s ILE 196 Ca 0.39 1.69 -0.12 0.00 0.00 0.00 0.00 60.65 62.62 3gp3 s ILE 196 Cb -0.18 -4.14 0.15 0.00 0.01 0.00 0.00 42.46 38.30 3gp3 s ILE 196 CO 0.75 0.48 1.10 -0.94 0.00 0.00 0.00 174.94 176.33 3gp3 s SER 197 N -0.87 3.25 0.30 3.58 1.04 -1.26 -4.84 113.70 114.90 3gp3 s SER 197 Ca 0.37 1.34 0.00 0.00 0.48 0.00 0.00 55.95 58.14 3gp3 s SER 197 Cb -0.22 -2.01 0.52 0.00 0.10 0.00 0.00 66.02 64.41 3gp3 s SER 197 CO 0.25 -2.76 1.91 0.44 0.98 0.00 0.00 173.24 174.07 3gp3 h ASP 198 N -1.63 0.92 0.19 7.02 3.32 -2.00 -1.51 116.42 122.72 3gp3 h ASP 198 Ca -0.51 0.01 -0.29 0.00 0.02 0.00 0.00 57.03 56.25 3gp3 h ASP 198 Cb 1.30 -0.19 0.03 0.00 0.22 0.00 0.00 39.33 40.69 3gp3 h ASP 198 CO 0.56 0.59 -1.22 0.00 -1.72 0.00 0.00 179.24 177.45 3gp3 h ALA 199 N 1.51 0.04 0.00 3.45 0.00 -1.99 -3.33 119.26 118.94 3gp3 h ALA 199 Ca 0.39 -0.78 -0.07 0.00 0.00 0.00 0.00 54.91 54.46 3gp3 h ALA 199 Cb 0.19 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3gp3 h ALA 199 CO -0.15 0.72 -0.32 -0.44 0.00 0.00 0.00 179.25 179.06 3gp3 h ASP 200 N 0.26 0.00 0.65 0.00 3.32 -1.89 -2.96 116.42 115.80 3gp3 h ASP 200 Ca -0.17 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.84 3gp3 h ASP 200 Cb 1.89 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.44 3gp3 h ASP 200 CO 0.23 0.32 -0.19 -0.29 -1.72 0.00 0.00 179.24 177.59 3gp3 h ILE 201 N 0.00 0.59 -0.97 0.35 6.09 -1.38 -2.96 117.51 119.23 3gp3 h ILE 201 Ca -0.00 -0.89 0.23 0.00 -1.37 0.00 0.00 64.86 62.83 3gp3 h ILE 201 Cb 0.75 1.59 -0.08 0.00 0.47 0.00 0.00 36.82 39.55 3gp3 h ILE 201 CO 0.04 0.19 0.63 0.58 -3.07 0.00 0.00 178.15 176.52 3gp3 h VAL 202 N 0.00 0.62 -0.01 2.19 2.07 -1.67 -1.57 116.25 117.88 3gp3 h VAL 202 Ca -0.00 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3gp3 h VAL 202 Cb 0.57 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 3gp3 h VAL 202 CO 0.02 0.07 -0.10 0.61 0.02 0.00 0.00 177.57 178.20 3gp3 n GLY 203 N -1.50 -0.18 3.67 2.17 0.00 -1.12 -4.88 105.19 103.35 3gp3 n GLY 203 Ca 0.22 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 3gp3 n GLY 203 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gp3 s LEU 204 N -2.19 4.18 -0.03 0.99 2.96 -0.59 -5.04 118.68 118.97 3gp3 s LEU 204 Ca 0.32 1.23 0.05 0.00 -0.22 0.00 0.00 54.13 55.52 3gp3 s LEU 204 Cb 0.20 -3.29 -0.01 0.00 0.50 0.00 0.00 46.19 43.60 3gp3 s LEU 204 CO 0.40 -0.41 -0.18 0.20 -1.32 0.00 0.00 176.35 175.04 3gp3 s ASN 205 N 1.14 2.19 -0.16 3.68 0.01 -1.26 -5.03 114.94 115.51 3gp3 s ASN 205 Ca 0.40 -0.35 -0.03 0.00 -0.71 0.00 0.00 52.86 52.17 3gp3 s ASN 205 Cb -0.17 -0.46 -0.02 0.00 0.41 0.00 0.00 41.25 41.01 3gp3 s ASN 205 CO 0.13 0.19 -0.05 -0.63 -1.51 0.00 0.00 177.10 175.23 3gp3 s ILE 206 N -0.17 3.75 0.61 0.60 1.01 -1.26 -5.10 121.20 120.64 3gp3 s ILE 206 Ca 0.01 -0.40 -0.16 0.00 0.00 0.00 0.00 60.65 60.09 3gp3 s ILE 206 Cb -0.10 -2.64 -0.02 0.00 0.01 0.00 0.00 42.46 39.70 3gp3 s ILE 206 CO 0.01 0.49 1.10 -2.16 0.00 0.00 0.00 174.94 174.38 3gp3 s PRO 207 N 0.49 3.07 0.23 2.79 0.04 -1.26 -4.91 135.00 135.44 3gp3 s PRO 207 Ca -0.04 1.42 -0.30 0.00 0.04 0.00 0.00 61.00 62.11 3gp3 s PRO 207 Cb -0.14 -1.98 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 3gp3 s PRO 207 CO 0.03 -1.04 1.48 -0.80 0.04 0.00 0.00 177.00 176.71 3gp3 s ASN 208 N -2.38 6.62 -1.23 6.66 -0.87 -1.26 -4.11 114.94 118.36 3gp3 s ASN 208 Ca 0.68 2.67 0.00 0.00 -1.57 0.00 0.00 52.86 54.64 3gp3 s ASN 208 Cb -0.20 -2.62 0.00 0.00 -0.02 0.00 0.00 41.25 38.41 3gp3 s ASN 208 CO 0.36 -0.75 0.00 0.61 -2.57 0.00 0.00 177.10 174.75 3gp3 n GLY 209 N 2.57 0.27 3.13 0.66 0.00 -0.06 -4.88 105.19 106.90 3gp3 n GLY 209 Ca 0.09 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 3gp3 n GLY 209 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gp3 s VAL 210 N -2.62 2.19 0.22 1.61 1.01 -1.26 -4.50 120.40 117.05 3gp3 s VAL 210 Ca 0.00 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 60.72 3gp3 s VAL 210 Cb 0.00 -1.95 -0.09 0.00 0.00 0.00 0.00 36.38 34.33 3gp3 s VAL 210 CO 0.00 0.48 1.40 -2.84 0.00 0.00 0.00 175.10 174.15 3gp3 s PRO 211 N 1.29 4.31 -0.25 2.72 0.02 -1.26 -4.56 135.00 137.27 3gp3 s PRO 211 Ca 0.04 2.21 0.02 0.00 0.02 0.00 0.00 61.00 63.29 3gp3 s PRO 211 Cb -0.14 -3.15 0.05 0.00 0.02 0.00 0.00 34.50 31.28 3gp3 s PRO 211 CO -0.12 -0.38 -0.11 -1.17 -0.33 0.00 0.00 177.00 174.89 3gp3 s LEU 212 N -0.06 3.26 -0.21 -5.54 2.96 0.06 -1.04 118.68 118.11 3gp3 s LEU 212 Ca 0.60 -1.24 -0.12 0.00 -0.22 0.00 0.00 54.13 53.16 3gp3 s LEU 212 Cb -0.40 -1.56 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 3gp3 s LEU 212 CO 0.40 -0.16 0.20 -0.69 -1.32 0.00 0.00 176.35 174.78 3gp3 s VAL 213 N 1.16 5.35 -0.19 1.68 1.01 0.61 -0.73 120.40 129.29 3gp3 s VAL 213 Ca -0.06 0.31 -0.05 0.00 0.00 0.00 0.00 61.98 62.18 3gp3 s VAL 213 Cb -0.19 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 3gp3 s VAL 213 CO -0.06 0.37 0.01 -0.31 0.00 0.00 0.00 175.10 175.10 3gp3 s TYR 214 N 0.80 3.07 -0.17 5.22 2.02 -0.02 -1.58 117.35 126.70 3gp3 s TYR 214 Ca 0.10 -0.31 -0.13 0.00 -0.37 0.00 0.00 57.07 56.36 3gp3 s TYR 214 Cb -0.13 -2.06 -0.05 0.00 -0.40 0.00 0.00 41.96 39.33 3gp3 s TYR 214 CO 0.03 -0.12 0.28 -1.21 -1.57 0.00 0.00 175.55 172.96 3gp3 s GLU 215 N 0.76 4.25 0.09 -0.62 2.02 0.00 -0.89 118.70 124.31 3gp3 s GLU 215 Ca 0.01 0.06 0.10 0.00 0.02 0.00 0.00 54.97 55.16 3gp3 s GLU 215 Cb -0.14 -3.43 -0.03 0.00 0.10 0.00 0.00 34.13 30.62 3gp3 s GLU 215 CO 0.02 0.23 -0.27 -0.51 0.02 0.00 0.00 175.26 174.75 3gp3 s LEU 216 N 0.51 2.24 0.00 1.80 1.43 0.50 -0.75 118.68 124.41 3gp3 s LEU 216 Ca 0.15 -0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 52.54 3gp3 s LEU 216 Cb -0.13 -1.25 0.08 0.00 0.03 0.00 0.00 46.19 44.92 3gp3 s LEU 216 CO 0.03 0.22 0.49 -0.90 0.23 0.00 0.00 176.35 176.43 3gp3 n ASP 217 N 1.35 0.24 0.15 2.29 5.68 0.00 -0.73 116.55 125.53 3gp3 n ASP 217 Ca -0.17 -1.30 0.16 0.00 -0.50 0.00 0.00 54.79 52.98 3gp3 n ASP 217 Cb 0.52 -0.36 0.75 0.00 -1.14 0.00 0.00 41.12 40.89 3gp3 n ASP 217 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3gp3 h GLU 218 N 0.00 0.00 -0.21 0.11 4.81 -1.96 -0.07 114.58 117.26 3gp3 h GLU 218 Ca -0.16 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 3gp3 h GLU 218 Cb 0.49 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.87 3gp3 h GLU 218 CO 0.13 0.00 0.00 0.43 -0.73 0.00 0.00 179.01 178.84 3gp3 n SER 219 N -4.14 1.94 -0.55 1.04 7.64 -1.26 -4.91 113.62 113.37 3gp3 n SER 219 Ca 0.03 -1.77 -0.07 0.00 1.01 0.00 0.00 58.87 58.07 3gp3 n SER 219 Cb 0.37 -0.13 -0.03 0.00 -1.01 0.00 0.00 64.21 63.40 3gp3 n SER 219 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3gp3 n LEU 220 N 0.50 -0.44 -4.72 -3.43 4.77 -0.04 -5.02 117.00 108.63 3gp3 n LEU 220 Ca 0.16 0.18 -0.40 0.00 -0.03 0.00 0.00 56.01 55.92 3gp3 n LEU 220 Cb 0.37 -1.49 -0.04 0.00 -2.33 0.00 0.00 43.42 39.92 3gp3 n LEU 220 CO 0.13 -0.46 0.50 -0.89 -1.33 0.00 0.00 177.39 175.34 3gp3 s THR 221 N -2.18 4.90 0.28 -5.08 2.01 -1.26 -4.73 115.64 109.59 3gp3 s THR 221 Ca 0.00 1.69 -0.30 0.00 0.31 0.00 0.00 61.69 63.38 3gp3 s THR 221 Cb 0.00 -4.15 -0.12 0.00 0.01 0.00 0.00 72.50 68.24 3gp3 s THR 221 CO 0.00 0.26 1.59 -2.65 -0.69 0.00 0.00 174.62 173.12 3gp3 n PRO 222 N 3.54 2.64 -0.09 4.92 -0.02 -1.26 -0.82 135.00 143.92 3gp3 n PRO 222 Ca 0.01 0.94 -0.22 0.00 -2.02 0.00 0.00 63.50 62.20 3gp3 n PRO 222 Cb 0.51 -2.72 -0.12 0.00 -0.02 0.00 0.00 33.50 31.15 3gp3 n PRO 222 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3gp3 n ILE 223 N 2.24 1.58 -3.66 4.25 5.41 0.07 -4.87 119.36 124.39 3gp3 n ILE 223 Ca 0.09 -0.18 -0.07 0.00 1.00 0.00 0.00 62.75 63.59 3gp3 n ILE 223 Cb 0.36 -1.96 -0.02 0.00 -0.71 0.00 0.00 39.64 37.31 3gp3 n ILE 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3gp3 s ARG 224 N -2.41 1.31 0.10 0.38 1.70 -1.23 -5.03 118.95 113.76 3gp3 s ARG 224 Ca -0.28 -0.64 -0.09 0.00 -0.47 0.00 0.00 55.73 54.25 3gp3 s ARG 224 Cb 0.07 0.50 -0.00 0.00 -0.57 0.00 0.00 34.95 34.95 3gp3 s ARG 224 CO 0.62 -0.59 0.20 -3.38 -1.08 0.00 0.00 175.30 171.07 3gp3 s HIS 225 N -3.55 0.18 -0.13 5.89 -3.43 -1.26 -0.82 115.29 112.18 3gp3 s HIS 225 Ca 0.08 -0.60 -0.30 0.00 -0.80 0.00 0.00 55.06 53.44 3gp3 s HIS 225 Cb -0.03 -0.06 0.10 0.00 -1.43 0.00 0.00 32.58 31.17 3gp3 s HIS 225 CO -0.02 -0.56 0.86 1.52 -2.00 0.00 0.00 174.74 174.54 3gp3 s TYR 226 N -3.87 -0.51 0.30 0.38 -0.85 -0.61 -4.99 117.35 107.19 3gp3 s TYR 226 Ca 0.06 0.92 -0.22 0.00 -0.52 0.00 0.00 57.07 57.31 3gp3 s TYR 226 Cb 0.05 0.42 -0.09 0.00 0.38 0.00 0.00 41.96 42.72 3gp3 s TYR 226 CO -0.10 -0.44 0.83 0.71 -1.52 0.00 0.00 175.55 175.03 3gp3 s TYR 227 N -1.00 3.59 0.25 -3.49 2.02 -1.26 -0.29 117.35 117.18 3gp3 s TYR 227 Ca -0.05 1.54 -0.17 0.00 -0.37 0.00 0.00 57.07 58.02 3gp3 s TYR 227 Cb -0.01 -2.75 -0.08 0.00 -0.40 0.00 0.00 41.96 38.72 3gp3 s TYR 227 CO 0.04 0.21 0.70 -0.51 -1.57 0.00 0.00 175.55 174.43 3gp3 s LEU 228 N -2.26 4.24 0.00 -1.29 1.43 -0.20 -4.94 118.68 115.66 3gp3 s LEU 228 Ca 0.49 1.31 0.00 0.00 -1.03 0.00 0.00 54.13 54.91 3gp3 s LEU 228 Cb -0.16 -3.73 0.00 0.00 0.03 0.00 0.00 46.19 42.33 3gp3 s LEU 228 CO 0.21 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.35 3gp3 n GLY 229 N 0.31 0.23 0.80 -3.19 0.00 -1.26 -4.54 105.19 97.54 3gp3 n GLY 229 Ca -0.00 -2.03 0.13 0.00 0.00 0.00 0.00 46.02 44.11 3gp3 n GLY 229 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66