#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 1.72 -0.04 1.12 2.02 -0.07 -4.99 117.35 117.11 3gp3 s TYR 2 Ca 0.00 -0.45 0.07 0.00 -0.37 0.00 0.00 57.07 56.32 3gp3 s TYR 2 Cb 0.00 -0.91 -0.02 0.00 -0.40 0.00 0.00 41.96 40.63 3gp3 s TYR 2 CO 0.00 0.23 -0.25 0.15 -1.57 0.00 0.00 175.55 174.11 3gp3 s LYS 3 N -2.23 2.26 -0.06 -0.62 1.02 -1.26 -0.99 119.74 117.86 3gp3 s LYS 3 Ca 0.09 -0.89 0.04 0.00 0.02 0.00 0.00 55.97 55.22 3gp3 s LYS 3 Cb -0.08 -2.05 0.00 0.00 -0.52 0.00 0.00 37.83 35.18 3gp3 s LYS 3 CO 0.05 0.46 -0.17 -1.17 -0.92 0.00 0.00 175.35 173.60 3gp3 s LEU 4 N -0.39 1.89 -0.12 3.17 2.96 -0.25 -4.37 118.68 121.57 3gp3 s LEU 4 Ca 0.04 -0.38 0.00 0.00 -0.22 0.00 0.00 54.13 53.57 3gp3 s LEU 4 Cb -0.12 -1.02 -0.02 0.00 0.50 0.00 0.00 46.19 45.54 3gp3 s LEU 4 CO 0.01 0.13 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.35 3gp3 s VAL 5 N 0.21 3.02 0.07 1.68 1.01 -0.99 -0.58 120.40 124.81 3gp3 s VAL 5 Ca -0.08 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.28 3gp3 s VAL 5 Cb -0.13 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 3gp3 s VAL 5 CO 0.04 0.53 -0.10 -0.76 0.00 0.00 0.00 175.10 174.80 3gp3 s LEU 6 N 0.27 3.01 -0.15 3.92 1.43 0.95 -0.59 118.68 127.52 3gp3 s LEU 6 Ca -0.10 -0.33 -0.09 0.00 -1.03 0.00 0.00 54.13 52.59 3gp3 s LEU 6 Cb -0.16 -1.79 0.05 0.00 0.03 0.00 0.00 46.19 44.33 3gp3 s LEU 6 CO 0.05 0.22 0.36 -0.51 0.23 0.00 0.00 176.35 176.70 3gp3 s ILE 7 N -1.12 -0.02 0.31 -0.59 2.07 -0.28 -0.46 121.20 121.11 3gp3 s ILE 7 Ca 0.19 0.09 -0.25 0.00 -1.41 0.00 0.00 60.65 59.27 3gp3 s ILE 7 Cb -0.11 -0.54 -0.10 0.00 0.13 0.00 0.00 42.46 41.85 3gp3 s ILE 7 CO 0.11 0.04 0.92 -0.60 -1.91 0.00 0.00 174.94 173.49 3gp3 s ARG 8 N 1.12 4.54 0.62 3.50 3.52 -1.26 -1.02 118.95 129.96 3gp3 s ARG 8 Ca -0.08 1.27 -0.18 0.00 -0.13 0.00 0.00 55.73 56.62 3gp3 s ARG 8 Cb -0.08 -2.80 -0.05 0.00 -1.56 0.00 0.00 34.95 30.46 3gp3 s ARG 8 CO -0.09 0.29 0.86 -2.39 -0.81 0.00 0.00 175.30 173.16 3gp3 n HIS 9 N 0.57 0.45 -0.50 5.12 1.44 -0.40 -0.73 115.22 121.16 3gp3 n HIS 9 Ca 0.01 0.43 -0.29 0.00 -2.01 0.00 0.00 57.72 55.86 3gp3 n HIS 9 Cb 0.50 -2.09 0.25 0.00 0.12 0.00 0.00 29.99 28.78 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 1.39 -2.21 3.64 -1.39 0.00 -1.26 -3.28 105.19 102.08 3gp3 n GLY 10 Ca 0.13 -1.13 -0.53 0.00 0.00 0.00 0.00 46.02 44.49 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 -4.49 1.35 -3.20 1.61 2.13 -1.26 -4.85 120.64 111.93 3gp3 n GLU 11 Ca 0.02 0.49 -0.20 0.00 0.66 0.00 0.00 57.16 58.13 3gp3 n GLU 11 Cb 0.56 -2.18 0.01 0.00 0.27 0.00 0.00 31.44 30.10 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 1.72 5.82 0.22 4.31 1.04 -1.26 -1.62 113.70 123.92 3gp3 s SER 12 Ca 0.89 -0.09 -0.08 0.00 0.48 0.00 0.00 55.95 57.14 3gp3 s SER 12 Cb -0.93 -1.18 0.24 0.00 0.10 0.00 0.00 66.02 64.25 3gp3 s SER 12 CO 0.52 -0.62 1.84 0.71 0.98 0.00 0.00 173.24 176.67 3gp3 h THR 13 N 0.66 1.06 0.00 2.02 1.35 -1.47 -1.98 112.91 114.55 3gp3 h THR 13 Ca -0.45 -0.30 -0.07 0.00 -0.55 0.00 0.00 66.41 65.05 3gp3 h THR 13 Cb 1.26 0.11 -0.01 0.00 -1.73 0.00 0.00 68.15 67.78 3gp3 h THR 13 CO 0.53 0.16 -0.32 -0.50 -0.25 0.00 0.00 175.52 175.14 3gp3 h TRP 14 N 0.88 0.00 -0.32 4.73 4.06 -1.92 -0.70 115.95 122.68 3gp3 h TRP 14 Ca 0.31 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.26 3gp3 h TRP 14 Cb 0.09 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.23 3gp3 h TRP 14 CO -0.04 0.32 0.18 -0.91 -3.56 0.00 0.00 178.44 174.42 3gp3 h ASN 15 N 0.00 0.39 -0.58 -3.49 -0.26 -1.65 -1.09 115.58 108.90 3gp3 h ASN 15 Ca -0.00 -0.08 0.00 0.00 -0.56 0.00 0.00 56.30 55.67 3gp3 h ASN 15 Cb 1.02 -0.10 -0.03 0.00 -1.06 0.00 0.00 38.32 38.15 3gp3 h ASN 15 CO 0.04 0.35 0.38 0.50 -1.06 0.00 0.00 177.43 177.65 3gp3 h LYS 16 N 0.40 0.77 -0.01 0.81 3.64 -1.09 -2.33 116.57 118.75 3gp3 h LYS 16 Ca 0.11 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3gp3 h LYS 16 Cb 0.04 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3gp3 h LYS 16 CO -0.02 0.51 0.00 0.39 -2.27 0.00 0.00 179.45 178.06 3gp3 n GLU 17 N -4.68 1.07 -3.80 1.90 1.02 -0.30 -4.94 120.64 110.91 3gp3 n GLU 17 Ca 0.04 -0.10 -0.27 0.00 -0.02 0.00 0.00 57.16 56.81 3gp3 n GLU 17 Cb 0.02 -1.36 0.01 0.00 -0.02 0.00 0.00 31.44 30.10 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 -0.75 -2.40 -4.44 1.62 5.15 -0.53 -4.84 115.26 109.08 3gp3 n ASN 18 Ca 0.17 -0.98 -0.27 0.00 -0.60 0.00 0.00 54.58 52.91 3gp3 n ASN 18 Cb 0.10 -3.38 -0.11 0.00 -0.53 0.00 0.00 39.78 35.86 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 -6.22 1.58 0.12 1.20 0.52 -0.55 -0.39 118.95 115.22 3gp3 s ARG 19 Ca 0.18 -1.52 -0.30 0.00 -0.52 0.00 0.00 55.73 53.58 3gp3 s ARG 19 Cb -0.07 -1.87 -0.06 0.00 0.52 0.00 0.00 34.95 33.47 3gp3 s ARG 19 CO 0.86 0.40 1.10 -0.06 0.02 0.00 0.00 175.30 177.62 3gp3 s PHE 20 N -1.72 3.58 -0.05 -0.53 0.08 -0.62 -4.61 117.98 114.12 3gp3 s PHE 20 Ca 0.22 1.55 -0.08 0.00 0.12 0.00 0.00 56.93 58.74 3gp3 s PHE 20 Cb -0.08 -3.27 -0.03 0.00 -0.57 0.00 0.00 43.02 39.06 3gp3 s PHE 20 CO 0.11 -0.64 -0.16 2.41 -0.10 0.00 0.00 175.22 176.84 3gp3 n THR 21 N 2.98 1.20 0.00 0.64 -1.04 -1.26 0.13 114.28 116.92 3gp3 n THR 21 Ca 0.05 0.18 0.00 0.00 -2.04 0.00 0.00 64.05 62.24 3gp3 n THR 21 Cb 0.47 -1.87 0.00 0.00 -1.82 0.00 0.00 70.33 67.11 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 2.50 3.74 0.31 3.41 0.00 -1.26 -2.15 105.19 111.73 3gp3 n GLY 22 Ca -0.11 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 45.98 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 14.00 0.09 -2.09 1.61 7.02 -1.26 -4.66 117.44 132.16 3gp3 n TRP 23 Ca 0.00 -0.05 -0.41 0.00 -1.02 0.00 0.00 57.50 56.02 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 -1.91 2.85 -1.27 -0.99 1.01 -0.91 -4.89 120.40 114.29 3gp3 s VAL 24 Ca 0.33 0.72 -0.06 0.00 0.00 0.00 0.00 61.98 62.97 3gp3 s VAL 24 Cb 0.17 -3.46 0.16 0.00 0.00 0.00 0.00 36.38 33.25 3gp3 s VAL 24 CO 0.26 0.11 2.19 -0.67 0.00 0.00 0.00 175.10 177.00 3gp3 n ASP 25 N 2.36 7.38 -4.88 3.32 2.03 -1.26 -4.98 116.55 120.52 3gp3 n ASP 25 Ca 0.06 -3.21 -0.30 0.00 0.52 0.00 0.00 54.79 51.85 3gp3 n ASP 25 Cb 0.41 -1.35 0.01 0.00 -0.72 0.00 0.00 41.12 39.47 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 -1.34 4.54 0.45 5.18 -7.23 -1.26 -4.77 120.40 115.97 3gp3 s VAL 26 Ca 0.49 0.75 0.08 0.00 -1.81 0.00 0.00 61.98 61.48 3gp3 s VAL 26 Cb 0.16 -3.81 0.00 0.00 0.56 0.00 0.00 36.38 33.30 3gp3 s VAL 26 CO -0.07 -1.04 0.44 -0.62 -0.31 0.00 0.00 175.10 173.49 3gp3 s ASP 27 N -4.20 5.05 0.52 4.85 -1.08 -1.26 -3.52 116.67 117.02 3gp3 s ASP 27 Ca 0.55 -0.80 -0.20 0.00 -0.52 0.00 0.00 52.55 51.57 3gp3 s ASP 27 Cb -0.11 -0.35 -0.07 0.00 -1.46 0.00 0.00 42.92 40.93 3gp3 s ASP 27 CO 0.53 -0.79 1.12 -0.76 0.52 0.00 0.00 175.17 175.79 3gp3 s LEU 28 N -4.22 3.82 0.85 -1.34 1.43 -1.26 -1.31 118.68 116.65 3gp3 s LEU 28 Ca 0.48 2.16 -0.12 0.00 -1.03 0.00 0.00 54.13 55.62 3gp3 s LEU 28 Cb -0.04 -4.51 0.10 0.00 0.03 0.00 0.00 46.19 41.78 3gp3 s LEU 28 CO 0.28 -1.09 1.15 0.42 0.23 0.00 0.00 176.35 177.35 3gp3 s THR 29 N -1.76 2.09 0.24 5.49 -4.23 -0.64 -4.69 115.64 112.14 3gp3 s THR 29 Ca 0.70 0.03 -0.07 0.00 -1.18 0.00 0.00 61.69 61.17 3gp3 s THR 29 Cb -0.24 -2.90 0.21 0.00 1.34 0.00 0.00 72.50 70.91 3gp3 s THR 29 CO 0.27 -0.04 1.87 -0.08 -0.54 0.00 0.00 174.62 176.11 3gp3 h GLU 30 N -1.25 1.03 -0.33 3.99 4.57 -1.98 -0.16 114.58 120.45 3gp3 h GLU 30 Ca -0.48 -0.06 0.05 0.00 -1.18 0.00 0.00 59.36 57.69 3gp3 h GLU 30 Cb 1.33 -0.23 -0.05 0.00 -0.16 0.00 0.00 28.75 29.63 3gp3 h GLU 30 CO 0.64 0.68 0.03 0.37 -1.18 0.00 0.00 179.01 179.55 3gp3 h GLN 31 N 1.06 0.12 -0.34 1.92 4.15 -1.94 -1.41 115.11 118.68 3gp3 h GLN 31 Ca 0.35 -0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.68 3gp3 h GLN 31 Cb 0.04 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 3gp3 h GLN 31 CO -0.13 0.08 -0.13 0.78 -1.93 0.00 0.00 178.83 177.51 3gp3 h GLY 32 N 0.13 0.64 0.78 2.39 0.00 -1.42 -0.79 103.07 104.81 3gp3 h GLY 32 Ca 0.16 -0.46 0.03 0.00 0.00 0.00 0.00 47.33 47.06 3gp3 h GLY 32 CO -0.24 0.43 0.21 3.43 0.00 0.00 0.00 176.54 180.36 3gp3 h ASN 33 N 0.54 0.31 -0.78 0.19 2.35 -0.70 -1.83 115.58 115.67 3gp3 h ASN 33 Ca 0.10 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.85 3gp3 h ASN 33 Cb 0.54 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.83 3gp3 h ASN 33 CO 0.03 0.22 0.43 -0.09 -1.65 0.00 0.00 177.43 176.38 3gp3 h ARG 34 N 0.43 1.09 -0.26 0.81 1.12 -0.87 -1.54 114.38 115.17 3gp3 h ARG 34 Ca 0.18 -0.13 0.00 0.00 -1.11 0.00 0.00 59.98 58.93 3gp3 h ARG 34 Cb 0.09 -0.21 -0.01 0.00 -0.01 0.00 0.00 29.97 29.82 3gp3 h ARG 34 CO -0.13 0.81 0.17 0.93 -3.11 0.00 0.00 179.97 178.64 3gp3 h GLU 35 N 1.09 0.33 -0.31 0.20 5.08 -1.00 0.13 114.58 120.10 3gp3 h GLU 35 Ca 0.28 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3gp3 h GLU 35 Cb 0.03 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3gp3 h GLU 35 CO -0.04 0.22 0.19 0.00 -1.00 0.00 0.00 179.01 178.38 3gp3 h ALA 36 N 1.10 0.39 -0.53 3.43 0.00 -1.07 -1.11 119.26 121.48 3gp3 h ALA 36 Ca 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3gp3 h ALA 36 Cb -0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3gp3 h ALA 36 CO -0.02 -0.11 0.29 0.00 0.00 0.00 0.00 179.25 179.40 3gp3 h ARG 37 N 0.40 0.73 -0.90 0.00 3.08 -0.97 -1.49 114.38 115.24 3gp3 h ARG 37 Ca 0.11 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 60.10 3gp3 h ARG 37 Cb -0.00 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 29.86 3gp3 h ARG 37 CO -0.02 0.57 0.59 1.96 -1.07 0.00 0.00 179.97 182.00 3gp3 h GLN 38 N 0.70 1.14 -0.66 0.04 1.08 -0.49 -1.04 115.11 115.88 3gp3 h GLN 38 Ca 0.18 -0.07 -0.05 0.00 -1.45 0.00 0.00 58.65 57.27 3gp3 h GLN 38 Cb 0.05 -0.26 -0.03 0.00 -0.05 0.00 0.00 27.48 27.20 3gp3 h GLN 38 CO -0.03 0.75 0.23 0.00 -0.95 0.00 0.00 178.83 178.84 3gp3 h ALA 39 N 1.36 0.86 -0.74 3.87 0.00 -0.69 0.08 119.26 124.00 3gp3 h ALA 39 Ca 0.35 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3gp3 h ALA 39 Cb -0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 3gp3 h ALA 39 CO -0.10 0.51 0.25 0.78 0.00 0.00 0.00 179.25 180.69 3gp3 h GLY 40 N 0.95 1.20 1.06 0.00 0.00 -0.65 -1.67 103.07 103.96 3gp3 h GLY 40 Ca 0.22 -0.68 -0.12 0.00 0.00 0.00 0.00 47.33 46.74 3gp3 h GLY 40 CO -0.01 0.64 -0.20 1.46 0.00 0.00 0.00 176.54 178.43 3gp3 h GLN 41 N 1.08 0.90 -0.57 4.80 1.08 -0.77 -0.55 115.11 121.08 3gp3 h GLN 41 Ca 0.24 -0.39 0.05 0.00 -1.45 0.00 0.00 58.65 57.10 3gp3 h GLN 41 Cb 0.27 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.62 3gp3 h GLN 41 CO -0.01 1.04 0.29 1.25 -0.95 0.00 0.00 178.83 180.45 3gp3 h LEU 42 N 0.73 0.42 -0.31 1.46 5.85 -0.75 -0.04 115.31 122.67 3gp3 h LEU 42 Ca 0.10 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.76 3gp3 h LEU 42 Cb 0.77 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 3gp3 h LEU 42 CO 0.06 0.28 -0.15 -0.07 -0.34 0.00 0.00 178.44 178.22 3gp3 h LEU 43 N 0.55 0.67 -0.44 2.25 3.38 -1.13 -2.12 115.31 118.48 3gp3 h LEU 43 Ca 0.25 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3gp3 h LEU 43 Cb 0.17 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3gp3 h LEU 43 CO -0.18 0.93 0.18 0.50 0.09 0.00 0.00 178.44 179.96 3gp3 h LYS 44 N 0.41 0.65 -0.36 1.13 3.64 -0.83 -2.04 116.57 119.17 3gp3 h LYS 44 Ca 0.07 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 3gp3 h LYS 44 Cb 0.67 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 3gp3 h LYS 44 CO 0.05 0.59 0.10 0.93 -2.27 0.00 0.00 179.45 178.85 3gp3 h GLU 45 N 0.56 0.51 -0.00 1.90 5.08 -0.89 -1.80 114.58 119.94 3gp3 h GLU 45 Ca 0.15 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3gp3 h GLU 45 Cb 0.17 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3gp3 h GLU 45 CO -0.01 0.46 -0.06 0.00 -1.00 0.00 0.00 179.01 178.40 3gp3 n ALA 46 N -2.48 2.70 -0.87 3.43 0.00 -0.81 -4.92 120.51 117.57 3gp3 n ALA 46 Ca 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.20 3gp3 n ALA 46 Cb 0.17 -1.37 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 1.21 0.54 3.78 0.00 0.00 -0.68 -5.04 105.19 105.01 3gp3 n GLY 47 Ca 0.17 -0.25 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 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 3.30 0.16 1.61 2.02 -0.80 -5.03 117.35 116.61 3gp3 s TYR 48 Ca 0.00 1.65 0.00 0.00 -0.37 0.00 0.00 57.07 58.35 3gp3 s TYR 48 Cb 0.00 -3.09 -0.04 0.00 -0.40 0.00 0.00 41.96 38.43 3gp3 s TYR 48 CO 0.00 -0.52 0.05 -0.08 -1.57 0.00 0.00 175.55 173.42 3gp3 s THR 49 N -1.70 0.34 0.03 -0.71 -1.32 -1.26 -4.61 115.64 106.42 3gp3 s THR 49 Ca 0.58 -1.95 0.02 0.00 -1.21 0.00 0.00 61.69 59.13 3gp3 s THR 49 Cb -0.21 -2.15 -0.02 0.00 -1.51 0.00 0.00 72.50 68.61 3gp3 s THR 49 CO 0.26 -0.40 -0.07 -0.36 -2.21 0.00 0.00 174.62 171.85 3gp3 s PHE 50 N -3.89 0.58 -0.12 9.09 0.08 -1.26 -4.82 117.98 117.64 3gp3 s PHE 50 Ca 0.26 -0.45 0.19 0.00 0.12 0.00 0.00 56.93 57.05 3gp3 s PHE 50 Cb 0.07 -0.36 -0.23 0.00 -0.57 0.00 0.00 43.02 41.93 3gp3 s PHE 50 CO 0.04 -0.09 0.48 -0.25 -0.10 0.00 0.00 175.22 175.31 3gp3 n ASP 51 N 1.66 0.32 -3.57 1.36 8.00 0.41 -4.96 116.55 119.77 3gp3 n ASP 51 Ca -0.22 0.14 -0.16 0.00 0.71 0.00 0.00 54.79 55.26 3gp3 n ASP 51 Cb 0.55 1.01 -0.06 0.00 -0.02 0.00 0.00 41.12 42.59 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 -2.98 0.01 0.09 0.53 2.07 -1.07 -4.09 121.20 115.76 3gp3 s ILE 52 Ca -0.07 -0.12 0.04 0.00 -1.41 0.00 0.00 60.65 59.09 3gp3 s ILE 52 Cb 0.09 -0.92 -0.03 0.00 0.13 0.00 0.00 42.46 41.73 3gp3 s ILE 52 CO 0.85 -0.07 -0.11 0.00 -1.91 0.00 0.00 174.94 173.70 3gp3 s ALA 53 N -1.42 1.11 -0.01 1.50 0.00 -0.74 -2.22 121.76 119.97 3gp3 s ALA 53 Ca -0.11 -1.15 0.07 0.00 0.00 0.00 0.00 51.96 50.78 3gp3 s ALA 53 Cb -0.01 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.10 3gp3 s ALA 53 CO 0.07 -0.01 -0.24 0.71 0.00 0.00 0.00 175.76 176.30 3gp3 s TYR 54 N -2.23 2.12 0.30 0.00 2.02 -0.10 -0.99 117.35 118.48 3gp3 s TYR 54 Ca 0.04 -0.40 0.01 0.00 -0.37 0.00 0.00 57.07 56.34 3gp3 s TYR 54 Cb -0.04 -1.35 -0.00 0.00 -0.40 0.00 0.00 41.96 40.16 3gp3 s TYR 54 CO 0.00 -0.02 0.38 -2.37 -1.57 0.00 0.00 175.55 171.97 3gp3 n THR 55 N 2.43 0.00 -1.57 -0.71 5.66 -0.08 -0.68 114.28 119.33 3gp3 n THR 55 Ca -0.16 -1.69 0.00 0.00 -3.05 0.00 0.00 64.05 59.15 3gp3 n THR 55 Cb 0.52 0.98 0.00 0.00 -1.55 0.00 0.00 70.33 70.28 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 -1.74 0.00 -1.23 1.09 3.41 -1.25 -0.12 113.62 113.79 3gp3 n SER 56 Ca 0.02 -0.77 0.11 0.00 -0.26 0.00 0.00 58.87 57.97 3gp3 n SER 56 Cb 0.51 0.00 0.29 0.00 -0.26 0.00 0.00 64.21 64.75 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 -1.24 0.96 -3.67 -3.33 0.24 -1.25 -4.07 118.33 105.99 3gp3 n VAL 57 Ca 0.00 -0.98 -0.36 0.00 -2.04 0.00 0.00 64.34 60.96 3gp3 n VAL 57 Cb 0.00 0.54 -0.09 0.00 -1.47 0.00 0.00 33.84 32.82 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 -1.03 4.14 0.52 1.34 1.43 -1.26 -5.00 118.68 118.82 3gp3 s LEU 58 Ca 0.44 0.15 0.25 0.00 -1.03 0.00 0.00 54.13 53.95 3gp3 s LEU 58 Cb 0.23 -2.12 1.42 0.00 0.03 0.00 0.00 46.19 45.76 3gp3 s LEU 58 CO 0.31 0.09 2.08 0.07 0.23 0.00 0.00 176.35 179.13 3gp3 h LYS 59 N 7.30 0.00 -0.88 1.70 2.10 -1.86 -1.91 116.57 123.02 3gp3 h LYS 59 Ca -0.39 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.25 3gp3 h LYS 59 Cb 1.16 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.45 3gp3 h LYS 59 CO 0.68 0.11 0.51 0.07 -2.00 0.00 0.00 179.45 178.83 3gp3 h ARG 60 N 0.00 1.21 -0.04 0.07 0.11 -1.90 0.18 114.38 114.00 3gp3 h ARG 60 Ca -0.00 -0.12 -0.12 0.00 0.10 0.00 0.00 59.98 59.83 3gp3 h ARG 60 Cb 0.28 -0.25 0.01 0.00 1.11 0.00 0.00 29.97 31.13 3gp3 h ARG 60 CO 0.01 0.86 -0.46 0.00 0.10 0.00 0.00 179.97 180.49 3gp3 h ALA 61 N 1.34 0.11 -0.29 0.08 0.00 -1.67 -2.89 119.26 115.94 3gp3 h ALA 61 Ca 0.31 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 3gp3 h ALA 61 Cb -0.02 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3gp3 h ALA 61 CO -0.06 0.28 0.13 0.82 0.00 0.00 0.00 179.25 180.42 3gp3 h ILE 62 N -0.12 1.17 -0.27 0.00 2.04 -1.17 -1.21 117.51 117.94 3gp3 h ILE 62 Ca -0.05 -0.49 -0.05 0.00 1.00 0.00 0.00 64.86 65.27 3gp3 h ILE 62 Cb 1.14 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 3gp3 h ILE 62 CO 0.09 0.17 -0.05 -0.09 0.00 0.00 0.00 178.15 178.27 3gp3 h ARG 63 N 0.32 0.43 -0.47 2.37 2.43 -0.76 0.73 114.38 119.43 3gp3 h ARG 63 Ca 0.10 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3gp3 h ARG 63 Cb 0.15 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 3gp3 h ARG 63 CO -0.01 0.50 0.29 1.15 -1.51 0.00 0.00 179.97 180.38 3gp3 h THR 64 N 0.41 1.14 -0.21 0.20 2.02 -1.20 -2.01 112.91 113.26 3gp3 h THR 64 Ca 0.09 -0.30 0.01 0.00 0.77 0.00 0.00 66.41 66.97 3gp3 h THR 64 Cb 0.35 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 3gp3 h THR 64 CO 0.02 0.14 0.12 0.25 0.37 0.00 0.00 175.52 176.42 3gp3 h LEU 65 N 0.62 0.20 -0.68 2.58 5.85 -0.40 -1.69 115.31 121.79 3gp3 h LEU 65 Ca 0.17 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.97 3gp3 h LEU 65 Cb -0.02 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 40.90 3gp3 h LEU 65 CO -0.03 0.15 0.33 -0.50 -0.34 0.00 0.00 178.44 178.05 3gp3 h TRP 66 N 0.25 0.60 -0.81 1.25 6.55 -0.63 0.13 115.95 123.29 3gp3 h TRP 66 Ca 0.08 0.03 -0.04 0.00 0.95 0.00 0.00 58.89 59.91 3gp3 h TRP 66 Cb -0.00 -0.17 -0.04 0.00 -0.86 0.00 0.00 29.16 28.09 3gp3 h TRP 66 CO -0.08 0.23 0.34 0.45 -1.05 0.00 0.00 178.44 178.33 3gp3 h HIS 67 N 0.58 1.22 -0.06 0.49 3.86 -0.98 0.56 115.15 120.83 3gp3 h HIS 67 Ca 0.33 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.45 3gp3 h HIS 67 Cb 0.32 -0.37 -0.00 0.00 1.06 0.00 0.00 27.41 28.42 3gp3 h HIS 67 CO -0.11 0.91 0.00 0.28 0.86 0.00 0.00 177.93 179.87 3gp3 h VAL 68 N 1.17 1.23 -0.59 2.45 2.07 -0.33 -1.52 116.25 120.75 3gp3 h VAL 68 Ca 0.27 -0.72 0.07 0.00 0.82 0.00 0.00 66.70 67.14 3gp3 h VAL 68 Cb 0.19 1.60 -0.06 0.00 -1.52 0.00 0.00 31.29 31.51 3gp3 h VAL 68 CO -0.03 0.20 0.27 1.56 0.02 0.00 0.00 177.57 179.59 3gp3 h GLN 69 N -0.17 0.49 0.33 1.57 4.20 -0.38 -1.52 115.11 119.63 3gp3 h GLN 69 Ca 0.02 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3gp3 h GLN 69 Cb 0.31 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.98 3gp3 h GLN 69 CO 0.00 0.32 -0.16 0.22 -0.67 0.00 0.00 178.83 178.55 3gp3 h ASP 70 N 0.50 -0.37 0.27 1.46 1.82 -0.73 0.15 116.42 119.52 3gp3 h ASP 70 Ca 0.28 0.01 -0.05 0.00 -0.39 0.00 0.00 57.03 56.87 3gp3 h ASP 70 Cb 0.25 0.10 -0.01 0.00 0.68 0.00 0.00 39.33 40.35 3gp3 h ASP 70 CO -0.23 -0.26 -0.23 1.56 -1.61 0.00 0.00 179.24 178.48 3gp3 h GLN 71 N -0.45 0.00 -0.00 0.28 1.08 -1.07 -2.75 115.11 112.19 3gp3 h GLN 71 Ca -0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 3gp3 h GLN 71 Cb 0.35 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 3gp3 h GLN 71 CO 0.07 0.23 -0.40 -1.33 -0.95 0.00 0.00 178.83 176.46 3gp3 n MET 72 N -4.15 0.52 -3.30 1.46 2.81 -0.59 -4.80 117.12 109.07 3gp3 n MET 72 Ca -0.02 -0.32 -0.16 0.00 -1.81 0.00 0.00 57.70 55.39 3gp3 n MET 72 Cb 0.29 -1.49 0.08 0.00 -0.71 0.00 0.00 33.22 31.39 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 -0.96 -2.90 -2.04 7.83 2.03 -0.50 -4.94 116.55 115.08 3gp3 n ASP 73 Ca 0.09 -0.53 -0.14 0.00 0.52 0.00 0.00 54.79 54.73 3gp3 n ASP 73 Cb 0.35 -4.55 0.05 0.00 -0.72 0.00 0.00 41.12 36.25 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 -3.91 3.78 0.06 -2.67 4.77 0.42 -4.83 117.00 114.61 3gp3 n LEU 74 Ca -0.20 -4.16 0.10 0.00 -0.03 0.00 0.00 56.01 51.72 3gp3 n LEU 74 Cb 0.63 -0.16 0.42 0.00 -2.33 0.00 0.00 43.42 41.98 3gp3 n LEU 74 CO 0.54 1.73 0.81 0.23 -1.33 0.00 0.00 177.39 179.38 3gp3 n MET 75 N -0.68 0.10 0.00 3.23 2.81 -1.24 -3.14 117.12 118.20 3gp3 n MET 75 Ca 0.31 0.30 0.11 0.00 -1.81 0.00 0.00 57.70 56.61 3gp3 n MET 75 Cb 0.91 -1.68 0.01 0.00 -0.71 0.00 0.00 33.22 31.75 3gp3 n MET 75 CO 0.00 0.00 0.00 2.48 1.51 0.00 0.00 175.97 179.96 3gp3 n TYR 76 N -1.87 0.00 -2.35 2.03 0.18 -1.26 -4.98 117.16 108.91 3gp3 n TYR 76 Ca 0.03 0.00 -0.35 0.00 1.88 0.00 0.00 57.90 59.46 3gp3 n TYR 76 Cb 0.23 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.18 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 -2.36 3.34 0.50 -3.48 -7.23 -1.19 -4.98 120.40 105.00 3gp3 s VAL 77 Ca 0.19 0.87 -0.23 0.00 -1.81 0.00 0.00 61.98 61.01 3gp3 s VAL 77 Cb 0.18 -3.37 -0.06 0.00 0.56 0.00 0.00 36.38 33.68 3gp3 s VAL 77 CO 0.52 -0.14 1.29 -2.16 -0.31 0.00 0.00 175.10 174.29 3gp3 s PRO 78 N -3.13 3.45 -0.10 4.82 0.04 -1.26 -4.89 135.00 133.93 3gp3 s PRO 78 Ca 0.69 2.08 0.01 0.00 0.04 0.00 0.00 61.00 63.82 3gp3 s PRO 78 Cb -0.23 -2.37 0.02 0.00 0.04 0.00 0.00 34.50 31.96 3gp3 s PRO 78 CO 0.26 -0.89 -0.11 0.08 0.04 0.00 0.00 177.00 176.38 3gp3 s VAL 79 N -1.38 1.22 -0.26 -0.36 1.01 -1.26 -1.79 120.40 117.57 3gp3 s VAL 79 Ca 0.67 -0.45 -0.13 0.00 0.00 0.00 0.00 61.98 62.07 3gp3 s VAL 79 Cb -0.36 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 3gp3 s VAL 79 CO 0.44 0.39 0.28 -0.69 0.00 0.00 0.00 175.10 175.52 3gp3 s VAL 80 N 1.26 5.25 -0.32 2.92 1.01 -0.16 -4.99 120.40 125.37 3gp3 s VAL 80 Ca -0.03 0.38 -0.10 0.00 0.00 0.00 0.00 61.98 62.24 3gp3 s VAL 80 Cb -0.14 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.63 3gp3 s VAL 80 CO -0.04 0.22 0.16 -1.00 0.00 0.00 0.00 175.10 174.45 3gp3 s HIS 81 N 1.75 3.19 -0.06 5.22 3.76 -1.26 -0.90 115.29 127.00 3gp3 s HIS 81 Ca 0.11 -0.65 0.03 0.00 -0.15 0.00 0.00 55.06 54.40 3gp3 s HIS 81 Cb -0.15 -2.37 0.01 0.00 1.11 0.00 0.00 32.58 31.17 3gp3 s HIS 81 CO 0.09 -0.50 -0.14 0.45 -0.85 0.00 0.00 174.74 173.80 3gp3 s SER 82 N 1.60 1.92 0.64 1.40 0.15 0.83 -4.87 113.70 115.37 3gp3 s SER 82 Ca 0.04 -0.32 0.35 0.00 0.70 0.00 0.00 55.95 56.71 3gp3 s SER 82 Cb -0.17 -0.80 1.94 0.00 -1.71 0.00 0.00 66.02 65.27 3gp3 s SER 82 CO 0.06 0.07 2.16 4.11 1.20 0.00 0.00 173.24 180.84 3gp3 h TRP 83 N 6.77 0.00 0.00 3.44 5.08 -1.88 -1.02 115.95 128.34 3gp3 h TRP 83 Ca -0.30 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.67 3gp3 h TRP 83 Cb 1.19 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.35 3gp3 h TRP 83 CO 0.47 0.00 0.00 0.54 -1.28 0.00 0.00 178.44 178.17 3gp3 n ARG 84 N -3.31 0.16 -0.12 0.12 1.74 -1.26 -1.63 116.66 112.35 3gp3 n ARG 84 Ca -0.01 0.41 0.11 0.00 -0.77 0.00 0.00 57.85 57.59 3gp3 n ARG 84 Cb 0.24 -1.82 0.16 0.00 -1.02 0.00 0.00 32.46 30.02 3gp3 n ARG 84 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3gp3 n LEU 85 N -2.12 3.17 -4.60 0.55 4.77 -0.39 -3.95 117.00 114.43 3gp3 n LEU 85 Ca 0.02 -1.35 -0.37 0.00 -0.03 0.00 0.00 56.01 54.28 3gp3 n LEU 85 Cb 0.20 -0.16 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 3gp3 n LEU 85 CO 0.18 0.64 0.49 0.59 -1.33 0.00 0.00 177.39 177.96 3gp3 n ASN 86 N 1.32 0.47 -4.53 -1.43 4.13 -0.65 -4.43 115.26 110.16 3gp3 n ASN 86 Ca 0.16 0.75 -0.39 0.00 1.68 0.00 0.00 54.58 56.79 3gp3 n ASN 86 Cb 0.56 -1.37 0.03 0.00 -1.54 0.00 0.00 39.78 37.47 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 -1.17 0.75 -1.62 3.52 4.07 -1.26 -4.54 120.64 120.40 3gp3 n GLU 87 Ca 0.14 0.28 -0.45 0.00 -0.06 0.00 0.00 57.16 57.07 3gp3 n GLU 87 Cb 0.48 -1.86 -0.02 0.00 -0.06 0.00 0.00 31.44 29.98 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 -0.22 1.54 -2.48 5.31 0.00 -1.26 -4.62 116.66 114.93 3gp3 n ARG 88 Ca 0.12 0.54 -0.42 0.00 -0.00 0.00 0.00 57.85 58.09 3gp3 n ARG 88 Cb 0.45 -2.02 -0.03 0.00 0.00 0.00 0.00 32.46 30.86 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 -0.69 3.40 -2.31 -0.14 5.65 -1.26 -4.16 115.29 115.78 3gp3 s HIS 89 Ca 0.63 1.34 0.22 0.00 0.25 0.00 0.00 55.06 57.50 3gp3 s HIS 89 Cb -0.71 -3.38 0.52 0.00 -1.18 0.00 0.00 32.58 27.83 3gp3 s HIS 89 CO 0.57 -1.10 1.45 0.66 -0.65 0.00 0.00 174.74 175.67 3gp3 n TYR 90 N 4.30 0.58 -3.64 3.88 4.01 -1.26 -2.10 117.16 122.93 3gp3 n TYR 90 Ca 0.09 -0.29 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 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 1.47 2.51 0.00 2.72 0.00 -1.25 -1.69 105.19 108.94 3gp3 n GLY 91 Ca 0.20 -0.34 0.06 0.00 0.00 0.00 0.00 46.02 45.93 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 7.88 1.65 0.39 4.61 0.00 0.61 -2.13 120.51 133.50 3gp3 n ALA 92 Ca 0.00 -0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.53 3gp3 n ALA 92 Cb 0.00 -1.19 0.49 0.00 0.00 0.00 0.00 19.45 18.75 3gp3 n ALA 92 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3gp3 h LEU 93 N 0.00 0.00 -9.38 0.00 3.38 -1.51 -3.46 115.31 104.34 3gp3 h LEU 93 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 3gp3 h LEU 93 Cb 0.14 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.92 3gp3 h LEU 93 CO 0.00 0.00 1.19 -1.20 0.09 0.00 0.00 178.44 178.52 3gp3 n SER 94 N -2.60 4.06 0.00 -0.43 7.64 -0.91 -0.79 113.62 120.60 3gp3 n SER 94 Ca 0.03 0.93 0.00 0.00 1.01 0.00 0.00 58.87 60.83 3gp3 n SER 94 Cb 0.33 -1.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.02 3gp3 n SER 94 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gp3 n GLY 95 N 4.47 0.68 3.85 0.23 0.00 0.12 -4.98 105.19 109.55 3gp3 n GLY 95 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 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 3.95 0.14 0.99 1.43 0.03 -4.77 118.68 120.45 3gp3 s LEU 96 Ca 0.00 1.36 -0.30 0.00 -1.03 0.00 0.00 54.13 54.16 3gp3 s LEU 96 Cb 0.00 -4.20 -0.07 0.00 0.03 0.00 0.00 46.19 41.95 3gp3 s LEU 96 CO 0.00 -0.31 1.08 0.21 0.23 0.00 0.00 176.35 177.56 3gp3 s ASN 97 N -2.50 7.29 0.17 2.29 3.84 -1.26 -1.60 114.94 123.16 3gp3 s ASN 97 Ca 0.56 2.00 -0.08 0.00 0.21 0.00 0.00 52.86 55.55 3gp3 s ASN 97 Cb -0.10 -2.60 0.03 0.00 -0.55 0.00 0.00 41.25 38.04 3gp3 s ASN 97 CO 0.21 -0.23 1.49 0.11 -2.79 0.00 0.00 177.10 175.89 3gp3 h LYS 98 N 5.54 0.78 -0.26 0.43 1.57 -1.04 -0.96 116.57 122.63 3gp3 h LYS 98 Ca -0.43 -0.44 -0.13 0.00 -1.87 0.00 0.00 60.65 57.77 3gp3 h LYS 98 Cb 1.21 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 3gp3 h LYS 98 CO 0.74 1.07 -0.36 0.00 -0.57 0.00 0.00 179.45 180.32 3gp3 h ALA 99 N 0.86 0.39 -0.49 3.86 0.00 -1.93 -1.56 119.26 120.40 3gp3 h ALA 99 Ca 0.04 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 3gp3 h ALA 99 Cb 1.02 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3gp3 h ALA 99 CO 0.10 0.47 0.11 0.93 0.00 0.00 0.00 179.25 180.86 3gp3 h GLU 100 N 0.43 0.75 -0.30 0.00 5.08 -1.92 -0.80 114.58 117.82 3gp3 h GLU 100 Ca 0.03 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 3gp3 h GLU 100 Cb 0.95 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 3gp3 h GLU 100 CO 0.08 0.68 0.15 1.15 -1.00 0.00 0.00 179.01 180.07 3gp3 h THR 101 N 0.72 1.14 -0.73 1.13 2.02 -1.11 -1.47 112.91 114.62 3gp3 h THR 101 Ca 0.16 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 66.89 3gp3 h THR 101 Cb 0.28 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 3gp3 h THR 101 CO -0.00 0.15 0.28 0.00 0.37 0.00 0.00 175.52 176.32 3gp3 h ALA 102 N 1.01 0.94 -0.15 6.16 0.00 -0.95 0.57 119.26 126.85 3gp3 h ALA 102 Ca 0.10 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.85 3gp3 h ALA 102 Cb 0.10 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3gp3 h ALA 102 CO -0.01 0.57 -0.02 0.00 0.00 0.00 0.00 179.25 179.79 3gp3 h ALA 103 N 1.14 0.11 -0.17 0.00 0.00 -1.04 0.51 119.26 119.81 3gp3 h ALA 103 Ca 0.24 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 3gp3 h ALA 103 Cb 0.22 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3gp3 h ALA 103 CO -0.02 -0.47 -0.12 -0.22 0.00 0.00 0.00 179.25 178.42 3gp3 h LYS 104 N 0.02 0.39 0.00 0.00 3.64 -1.00 -3.38 116.57 116.24 3gp3 h LYS 104 Ca 0.07 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3gp3 h LYS 104 Cb 0.10 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3gp3 h LYS 104 CO -0.14 0.73 -0.73 0.66 -2.27 0.00 0.00 179.45 177.69 3gp3 n TYR 105 N -4.56 0.00 0.00 1.91 4.01 0.17 -5.10 117.16 113.59 3gp3 n TYR 105 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 3gp3 n TYR 105 Cb 0.34 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 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 1.36 1.27 0.32 2.72 0.00 0.18 -4.60 105.19 106.44 3gp3 n GLY 106 Ca 0.03 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.38 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 1.06 0.36 1.61 3.45 -1.93 -2.27 116.42 118.70 3gp3 h ASP 107 Ca 0.00 -0.23 -0.01 0.00 0.43 0.00 0.00 57.03 57.22 3gp3 h ASP 107 Cb 0.00 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.48 3gp3 h ASP 107 CO 0.00 1.02 -0.23 -0.33 -1.57 0.00 0.00 179.24 178.13 3gp3 h GLU 108 N 1.06 -0.55 -0.33 3.56 3.07 -1.94 -0.20 114.58 119.25 3gp3 h GLU 108 Ca 0.22 0.04 0.07 0.00 -0.50 0.00 0.00 59.36 59.19 3gp3 h GLU 108 Cb 0.37 0.12 -0.07 0.00 -0.84 0.00 0.00 28.75 28.34 3gp3 h GLU 108 CO 0.00 -0.37 -0.12 0.37 -1.40 0.00 0.00 179.01 177.50 3gp3 h GLN 109 N -0.57 -0.05 -0.72 2.33 5.75 -1.78 0.36 115.11 120.44 3gp3 h GLN 109 Ca -0.04 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 3gp3 h GLN 109 Cb 0.47 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.00 3gp3 h GLN 109 CO 0.04 -0.03 0.39 0.28 -2.65 0.00 0.00 178.83 176.86 3gp3 h VAL 110 N -0.05 1.22 -0.06 2.39 2.07 -1.27 -1.63 116.25 118.91 3gp3 h VAL 110 Ca 0.17 -0.54 -0.15 0.00 0.82 0.00 0.00 66.70 66.99 3gp3 h VAL 110 Cb 0.30 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 3gp3 h VAL 110 CO -0.37 0.24 -0.63 0.25 0.02 0.00 0.00 177.57 177.08 3gp3 h LEU 111 N 1.01 0.27 -0.08 2.57 6.46 0.19 -0.26 115.31 125.47 3gp3 h LEU 111 Ca 0.26 -0.16 -0.00 0.00 -0.12 0.00 0.00 57.88 57.85 3gp3 h LEU 111 Cb 0.03 -0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 39.88 3gp3 h LEU 111 CO -0.04 0.83 0.05 -0.37 -0.62 0.00 0.00 178.44 178.29 3gp3 h VAL 112 N 0.17 1.07 0.00 1.05 -1.51 -0.67 -0.34 116.25 116.02 3gp3 h VAL 112 Ca -0.01 -0.18 -0.02 0.00 -1.23 0.00 0.00 66.70 65.26 3gp3 h VAL 112 Cb 1.15 1.04 -0.00 0.00 -2.13 0.00 0.00 31.29 31.35 3gp3 h VAL 112 CO 0.10 0.06 -0.08 -0.50 -1.23 0.00 0.00 177.57 175.92 3gp3 h TRP 113 N 0.06 0.00 0.13 5.19 6.55 -0.84 0.70 115.95 127.74 3gp3 h TRP 113 Ca 0.03 0.00 -0.32 0.00 0.95 0.00 0.00 58.89 59.55 3gp3 h TRP 113 Cb 0.05 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.35 3gp3 h TRP 113 CO -0.05 0.08 -1.58 0.00 -1.05 0.00 0.00 178.44 175.83 3gp3 h ARG 114 N 0.00 0.28 0.00 0.49 3.08 -0.85 -3.42 114.38 113.96 3gp3 h ARG 114 Ca -0.00 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 59.58 3gp3 h ARG 114 Cb 0.14 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3gp3 h ARG 114 CO 0.01 1.15 0.00 0.54 -1.07 0.00 0.00 179.97 180.60 3gp3 n ARG 115 N -3.47 1.15 -1.89 0.04 5.12 -0.16 -5.00 116.66 112.45 3gp3 n ARG 115 Ca -0.18 -0.03 -0.42 0.00 -1.93 0.00 0.00 57.85 55.29 3gp3 n ARG 115 Cb 1.05 -0.25 -0.03 0.00 -1.16 0.00 0.00 32.46 32.07 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 -0.17 6.59 0.32 0.55 0.15 0.22 -4.75 113.70 116.60 3gp3 s SER 116 Ca 0.00 2.44 0.09 0.00 0.70 0.00 0.00 55.95 59.18 3gp3 s SER 116 Cb 0.00 -2.54 0.86 0.00 -1.71 0.00 0.00 66.02 62.63 3gp3 s SER 116 CO 0.00 -0.95 1.74 0.22 1.20 0.00 0.00 173.24 175.45 3gp3 h TYR 117 N 9.41 1.03 0.00 3.44 3.20 -1.88 -3.15 116.97 129.02 3gp3 h TYR 117 Ca -0.43 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.47 3gp3 h TYR 117 Cb 1.20 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.17 3gp3 h TYR 117 CO 0.87 0.09 -0.15 -0.40 -1.64 0.00 0.00 178.16 176.93 3gp3 n ASP 118 N -4.87 1.34 -4.16 -2.11 5.75 -1.26 -1.13 116.55 110.11 3gp3 n ASP 118 Ca 0.26 -2.37 -0.33 0.00 -0.01 0.00 0.00 54.79 52.35 3gp3 n ASP 118 Cb 0.72 -0.25 -0.16 0.00 -1.03 0.00 0.00 41.12 40.40 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 -1.41 2.20 0.46 2.12 -4.23 -1.19 -4.99 115.64 108.60 3gp3 s THR 119 Ca 0.14 -0.91 -0.06 0.00 -1.18 0.00 0.00 61.69 59.68 3gp3 s THR 119 Cb 0.12 -1.91 -0.04 0.00 1.34 0.00 0.00 72.50 72.01 3gp3 s THR 119 CO 0.01 0.53 0.77 -2.16 -0.54 0.00 0.00 174.62 173.23 3gp3 s PRO 120 N 1.08 3.57 0.86 3.99 0.04 -1.26 -4.68 135.00 138.59 3gp3 s PRO 120 Ca -0.00 0.20 -0.11 0.00 0.04 0.00 0.00 61.00 61.12 3gp3 s PRO 120 Cb -0.14 -2.40 0.11 0.00 0.04 0.00 0.00 34.50 32.12 3gp3 s PRO 120 CO -0.07 -0.16 1.17 -2.14 0.04 0.00 0.00 177.00 175.84 3gp3 s PRO 121 N -4.59 1.35 0.25 0.56 0.02 -1.26 -4.93 135.00 126.40 3gp3 s PRO 121 Ca 0.47 1.62 -0.30 0.00 0.02 0.00 0.00 61.00 62.81 3gp3 s PRO 121 Cb -0.10 -1.76 -0.14 0.00 0.02 0.00 0.00 34.50 32.52 3gp3 s PRO 121 CO 0.43 -2.40 1.30 -2.30 -0.33 0.00 0.00 177.00 173.70 3gp3 n PRO 122 N -3.79 1.84 -2.60 5.54 -0.02 -1.26 -4.80 135.00 129.90 3gp3 n PRO 122 Ca 0.12 0.65 -0.33 0.00 -2.02 0.00 0.00 63.50 61.92 3gp3 n PRO 122 Cb 0.51 -2.24 -0.04 0.00 -0.02 0.00 0.00 33.50 31.71 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 -0.38 2.94 0.49 3.55 0.00 -1.26 -0.29 121.76 126.81 3gp3 s ALA 123 Ca 0.65 0.49 -0.23 0.00 0.00 0.00 0.00 51.96 52.87 3gp3 s ALA 123 Cb -0.67 -3.20 -0.06 0.00 0.00 0.00 0.00 23.12 19.18 3gp3 s ALA 123 CO 0.53 -0.17 1.29 -0.51 0.00 0.00 0.00 175.76 176.90 3gp3 s LEU 124 N -3.48 3.98 0.46 0.00 1.43 -0.60 -4.22 118.68 116.25 3gp3 s LEU 124 Ca 0.64 2.62 -0.24 0.00 -1.03 0.00 0.00 54.13 56.12 3gp3 s LEU 124 Cb -0.13 -4.18 -0.07 0.00 0.03 0.00 0.00 46.19 41.84 3gp3 s LEU 124 CO 0.19 -1.22 1.28 -1.61 0.23 0.00 0.00 176.35 175.22 3gp3 s GLU 125 N -2.70 3.69 0.41 1.70 0.41 -1.26 -4.91 118.70 116.04 3gp3 s GLU 125 Ca 0.66 2.06 0.29 0.00 -0.41 0.00 0.00 54.97 57.57 3gp3 s GLU 125 Cb -0.37 -2.52 1.33 0.00 -1.78 0.00 0.00 34.13 30.79 3gp3 s GLU 125 CO 0.45 -0.70 1.88 -1.00 -0.49 0.00 0.00 175.26 175.40 3gp3 h PRO 126 N 2.16 0.00 -0.19 0.39 0.13 -2.00 -1.34 132.00 131.15 3gp3 h PRO 126 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3gp3 h PRO 126 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3gp3 h PRO 126 CO 0.60 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.78 3gp3 n GLY 127 N -0.35 0.25 3.77 1.56 0.00 -1.26 -4.84 105.19 104.32 3gp3 n GLY 127 Ca 0.00 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.44 5.85 0.50 1.61 2.15 -0.51 -4.89 116.67 119.93 3gp3 s ASP 128 Ca 0.30 2.25 0.21 0.00 0.43 0.00 0.00 52.55 55.74 3gp3 s ASP 128 Cb 0.16 -2.59 1.29 0.00 -0.30 0.00 0.00 42.92 41.47 3gp3 s ASP 128 CO 0.23 -1.14 2.06 1.05 -0.17 0.00 0.00 175.17 177.21 3gp3 h GLU 129 N 1.50 0.00 0.00 4.34 4.11 -1.92 -1.04 114.58 121.56 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 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 3gp3 h GLU 129 CO 0.58 0.13 0.00 0.54 0.07 0.00 0.00 179.01 180.33 3gp3 n ARG 130 N -4.03 0.01 -2.14 1.06 1.74 -1.26 -4.90 116.66 107.14 3gp3 n ARG 130 Ca -0.02 0.16 -0.33 0.00 -0.77 0.00 0.00 57.85 56.89 3gp3 n ARG 130 Cb 0.21 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 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 -3.01 2.74 -2.50 7.54 0.00 -0.40 -4.95 121.76 121.19 3gp3 s ALA 131 Ca 0.09 0.48 0.26 0.00 0.00 0.00 0.00 51.96 52.79 3gp3 s ALA 131 Cb 0.13 -3.25 0.85 0.00 0.00 0.00 0.00 23.12 20.85 3gp3 s ALA 131 CO 0.37 -0.74 1.63 -0.35 0.00 0.00 0.00 175.76 176.66 3gp3 n PRO 132 N -1.79 1.79 0.21 0.00 -0.04 -1.26 -4.55 135.00 129.36 3gp3 n PRO 132 Ca 0.09 -1.17 0.06 0.00 -0.04 0.00 0.00 63.50 62.45 3gp3 n PRO 132 Cb 0.53 -1.46 0.47 0.00 -0.04 0.00 0.00 33.50 33.00 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 2.68 0.00 -0.02 0.54 0.05 -1.94 -2.62 116.97 115.66 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 0.57 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.31 3gp3 h TYR 133 CO 0.04 0.28 -0.21 0.00 -1.05 0.00 0.00 178.16 177.22 3gp3 n ALA 134 N -2.39 2.95 -2.66 3.88 0.00 -1.26 -4.90 120.51 116.13 3gp3 n ALA 134 Ca -0.02 -0.64 -0.43 0.00 0.00 0.00 0.00 53.44 52.36 3gp3 n ALA 134 Cb 0.36 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.95 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 -2.22 7.14 0.61 0.00 -1.08 -0.99 -4.93 116.67 115.19 3gp3 s ASP 135 Ca 0.25 1.42 0.29 0.00 -0.52 0.00 0.00 52.55 53.99 3gp3 s ASP 135 Cb 0.19 -2.54 1.55 0.00 -1.46 0.00 0.00 42.92 40.66 3gp3 s ASP 135 CO 0.43 -0.61 1.94 -0.65 0.52 0.00 0.00 175.17 176.80 3gp3 h PRO 136 N 7.36 0.00 -0.60 4.34 0.11 -1.92 -1.06 132.00 140.24 3gp3 h PRO 136 Ca -0.22 0.00 0.17 0.00 0.11 0.00 0.00 66.00 66.06 3gp3 h PRO 136 Cb 1.08 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3gp3 h PRO 136 CO 0.95 0.00 0.43 0.00 -0.21 0.00 0.00 178.00 179.17 3gp3 h ARG 137 N 0.00 0.00 -0.01 1.05 3.08 -1.94 -2.72 114.38 113.84 3gp3 h ARG 137 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 3gp3 h ARG 137 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 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 -4.33 0.03 0.12 3.04 4.01 -0.41 -4.73 117.16 114.89 3gp3 n TYR 138 Ca 0.11 -0.73 0.04 0.00 -0.16 0.00 0.00 57.90 57.17 3gp3 n TYR 138 Cb 0.68 -0.10 0.47 0.00 -0.31 0.00 0.00 39.34 40.08 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 0.08 1.71 -0.66 -0.72 0.00 -1.42 -0.96 119.26 117.28 3gp3 h ALA 139 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3gp3 h ALA 139 Cb 0.74 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3gp3 h ALA 139 CO 0.00 0.23 0.00 0.36 0.00 0.00 0.00 179.25 179.84 3gp3 n LYS 140 N -4.42 2.57 -3.67 0.00 2.85 -1.26 -4.89 118.16 109.35 3gp3 n LYS 140 Ca -0.00 -2.38 -0.36 0.00 -1.05 0.00 0.00 58.31 54.52 3gp3 n LYS 140 Cb 0.15 -1.53 -0.08 0.00 -0.65 0.00 0.00 35.03 32.93 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 -1.15 5.37 0.29 0.58 1.01 -0.37 -5.05 120.40 121.08 3gp3 s VAL 141 Ca 0.44 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.45 3gp3 s VAL 141 Cb 0.23 -3.52 -0.12 0.00 0.00 0.00 0.00 36.38 32.97 3gp3 s VAL 141 CO 0.30 0.44 1.50 -2.65 0.00 0.00 0.00 175.10 174.68 3gp3 n PRO 142 N 3.42 2.45 -0.31 2.72 -0.02 -1.26 -4.85 135.00 137.14 3gp3 n PRO 142 Ca -0.15 0.87 0.14 0.00 -2.02 0.00 0.00 63.50 62.34 3gp3 n PRO 142 Cb 0.52 -2.59 0.33 0.00 -0.02 0.00 0.00 33.50 31.74 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 4.26 0.41 -0.03 -0.52 3.08 -1.96 -1.24 114.38 118.38 3gp3 h ARG 143 Ca -0.47 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 59.57 3gp3 h ARG 143 Cb 1.25 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 31.20 3gp3 h ARG 143 CO 0.75 0.27 0.03 1.05 -1.07 0.00 0.00 179.97 181.01 3gp3 h GLU 144 N 0.43 0.00 -0.00 0.04 9.09 -2.04 -2.51 114.58 119.59 3gp3 h GLU 144 Ca 0.58 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.99 3gp3 h GLU 144 Cb 1.11 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.21 3gp3 h GLU 144 CO -0.52 0.00 -0.53 1.04 0.05 0.00 0.00 179.01 179.05 3gp3 n GLN 145 N -3.73 0.06 -2.95 1.06 6.02 -0.47 -4.87 117.38 112.50 3gp3 n GLN 145 Ca -0.02 -0.04 -0.40 0.00 -0.01 0.00 0.00 57.00 56.53 3gp3 n GLN 145 Cb 0.12 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 29.84 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 -2.97 4.32 0.30 1.08 1.43 -0.95 -5.04 118.68 116.85 3gp3 s LEU 146 Ca 0.12 1.30 -0.15 0.00 -1.03 0.00 0.00 54.13 54.37 3gp3 s LEU 146 Cb 0.17 -3.22 -0.09 0.00 0.03 0.00 0.00 46.19 43.09 3gp3 s LEU 146 CO 0.70 -0.18 0.71 -2.16 0.23 0.00 0.00 176.35 175.65 3gp3 s PRO 147 N 0.98 4.00 0.00 1.29 0.04 -1.26 -4.96 135.00 135.09 3gp3 s PRO 147 Ca 0.41 0.63 0.18 0.00 0.04 0.00 0.00 61.00 62.27 3gp3 s PRO 147 Cb -0.18 -2.51 -0.02 0.00 0.04 0.00 0.00 34.50 31.83 3gp3 s PRO 147 CO 0.20 0.20 0.92 1.28 0.04 0.00 0.00 177.00 179.65 3gp3 n LEU 148 N -0.22 1.69 -3.57 -3.56 4.77 -1.26 -4.72 117.00 110.12 3gp3 n LEU 148 Ca 0.02 -0.74 -0.07 0.00 -0.03 0.00 0.00 56.01 55.20 3gp3 n LEU 148 Cb 0.53 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 3gp3 n LEU 148 CO 0.42 0.32 0.88 0.28 -1.33 0.00 0.00 177.39 177.96 3gp3 s THR 149 N -2.16 0.00 -0.01 -5.08 -1.32 -1.26 -1.56 115.64 104.25 3gp3 s THR 149 Ca 0.14 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.63 3gp3 s THR 149 Cb 0.15 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 70.15 3gp3 s THR 149 CO 0.49 0.00 0.01 -1.61 -2.21 0.00 0.00 174.62 171.30 3gp3 s GLU 150 N -1.96 0.06 0.57 7.08 2.02 -0.89 -4.93 118.70 120.64 3gp3 s GLU 150 Ca 0.05 0.06 -0.02 0.00 0.02 0.00 0.00 54.97 55.08 3gp3 s GLU 150 Cb -0.01 -0.18 0.03 0.00 0.10 0.00 0.00 34.13 34.07 3gp3 s GLU 150 CO -0.04 -0.07 0.82 0.00 0.02 0.00 0.00 175.26 176.00 3gp3 h LEU 152 N -0.04 1.01 -0.77 0.00 5.85 -1.74 -1.73 115.31 117.90 3gp3 h LEU 152 Ca -0.44 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.37 3gp3 h LEU 152 Cb 1.28 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 42.02 3gp3 h LEU 152 CO 0.57 0.67 0.41 0.50 -0.34 0.00 0.00 178.44 180.25 3gp3 h LYS 153 N 1.16 0.68 -0.71 1.25 3.64 -1.47 0.15 116.57 121.27 3gp3 h LYS 153 Ca 0.40 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.70 3gp3 h LYS 153 Cb 0.11 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 3gp3 h LYS 153 CO -0.14 0.45 0.26 -0.44 -2.27 0.00 0.00 179.45 177.31 3gp3 h ASP 154 N 0.70 0.98 -0.44 4.20 3.32 -1.62 -1.72 116.42 121.85 3gp3 h ASP 154 Ca 0.37 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 3gp3 h ASP 154 Cb 0.36 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 3gp3 h ASP 154 CO -0.26 0.89 0.15 0.74 -1.72 0.00 0.00 179.24 179.04 3gp3 h THR 155 N 1.04 1.22 -0.49 0.35 2.02 -0.68 -1.26 112.91 115.11 3gp3 h THR 155 Ca 0.24 -0.71 0.04 0.00 0.77 0.00 0.00 66.41 66.74 3gp3 h THR 155 Cb 0.23 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 3gp3 h THR 155 CO -0.02 0.26 0.26 0.58 0.37 0.00 0.00 175.52 176.97 3gp3 h VAL 156 N 0.57 0.98 0.00 3.16 2.07 -0.87 -0.13 116.25 122.03 3gp3 h VAL 156 Ca 0.14 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 3gp3 h VAL 156 Cb 0.25 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 3gp3 h VAL 156 CO -0.01 0.09 -0.19 0.00 0.02 0.00 0.00 177.57 177.48 3gp3 h ALA 157 N 1.25 1.52 -0.08 1.67 0.00 -0.89 -2.17 119.26 120.56 3gp3 h ALA 157 Ca 0.21 -0.18 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 3gp3 h ALA 157 Cb 0.10 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.86 3gp3 h ALA 157 CO -0.13 0.24 -0.85 -0.09 0.00 0.00 0.00 179.25 178.42 3gp3 h ARG 158 N 0.00 0.64 -0.15 0.00 2.43 -0.33 -3.35 114.38 113.61 3gp3 h ARG 158 Ca -0.00 -0.57 -0.15 0.00 -0.81 0.00 0.00 59.98 58.45 3gp3 h ARG 158 Cb 0.38 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 3gp3 h ARG 158 CO 0.03 1.19 -0.49 0.28 -1.51 0.00 0.00 179.97 179.46 3gp3 h VAL 159 N 0.41 1.34 -0.55 0.20 2.07 -0.70 -3.37 116.25 115.64 3gp3 h VAL 159 Ca -0.07 -1.76 -0.01 0.00 0.82 0.00 0.00 66.70 65.69 3gp3 h VAL 159 Cb 1.47 2.03 -0.03 0.00 -1.52 0.00 0.00 31.29 33.24 3gp3 h VAL 159 CO 0.16 0.54 0.30 -0.07 0.02 0.00 0.00 177.57 178.52 3gp3 h LEU 160 N 0.25 0.67 -1.63 2.57 3.38 -1.53 -0.86 115.31 118.16 3gp3 h LEU 160 Ca -0.02 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.92 3gp3 h LEU 160 Cb 1.11 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 3gp3 h LEU 160 CO 0.10 0.54 0.26 -0.65 0.09 0.00 0.00 178.44 178.79 3gp3 h PRO 161 N 0.76 0.50 -0.57 1.13 0.11 -1.76 0.77 132.00 132.94 3gp3 h PRO 161 Ca 0.20 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.19 3gp3 h PRO 161 Cb 0.02 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 3gp3 h PRO 161 CO -0.03 0.33 0.02 1.25 -0.21 0.00 0.00 178.00 179.36 3gp3 h LEU 162 N 0.51 0.96 0.28 2.35 5.85 -1.38 0.18 115.31 124.06 3gp3 h LEU 162 Ca 0.15 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 3gp3 h LEU 162 Cb -0.02 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.75 3gp3 h LEU 162 CO -0.03 1.02 -0.13 -0.25 -0.34 0.00 0.00 178.44 178.70 3gp3 h TRP 163 N 0.87 -0.35 -0.73 1.25 2.91 -1.18 -1.20 115.95 117.52 3gp3 h TRP 163 Ca 0.16 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 60.13 3gp3 h TRP 163 Cb 0.52 0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 29.25 3gp3 h TRP 163 CO 0.04 -0.17 0.29 -0.91 -1.03 0.00 0.00 178.44 176.66 3gp3 h ASN 164 N -0.44 1.00 0.82 2.65 2.35 -0.81 0.28 115.58 121.43 3gp3 h ASN 164 Ca -0.04 -0.17 -0.14 0.00 -0.55 0.00 0.00 56.30 55.40 3gp3 h ASN 164 Cb 0.34 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 3gp3 h ASN 164 CO 0.06 0.90 -1.27 -0.33 -1.65 0.00 0.00 177.43 175.15 3gp3 h GLU 165 N 1.05 0.00 0.00 0.81 5.08 -0.94 -3.42 114.58 117.16 3gp3 h GLU 165 Ca 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 3gp3 h GLU 165 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3gp3 h GLU 165 CO -0.02 0.27 -0.27 0.45 -1.00 0.00 0.00 179.01 178.43 3gp3 n SER 166 N -2.89 0.10 -0.04 1.42 2.88 -0.53 -4.79 113.62 109.77 3gp3 n SER 166 Ca -0.07 0.11 -0.15 0.00 -1.33 0.00 0.00 58.87 57.43 3gp3 n SER 166 Cb 0.79 0.04 -0.09 0.00 -0.75 0.00 0.00 64.21 64.20 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 1.39 -0.54 2.46 2.04 -1.18 -1.64 117.51 120.05 3gp3 h ILE 167 Ca 0.00 -1.68 -0.05 0.00 1.00 0.00 0.00 64.86 64.13 3gp3 h ILE 167 Cb 0.27 2.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 3gp3 h ILE 167 CO 0.00 0.49 0.15 0.00 0.00 0.00 0.00 178.15 178.80 3gp3 h ALA 168 N 0.48 0.71 -0.51 1.87 0.00 -1.19 -0.85 119.26 119.76 3gp3 h ALA 168 Ca -0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3gp3 h ALA 168 Cb 0.97 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3gp3 h ALA 168 CO 0.07 0.38 0.18 -1.35 0.00 0.00 0.00 179.25 178.53 3gp3 h PRO 169 N 0.75 0.74 -0.21 0.00 0.11 -1.75 -0.60 132.00 131.04 3gp3 h PRO 169 Ca 0.17 -0.12 -0.00 0.00 0.11 0.00 0.00 66.00 66.16 3gp3 h PRO 169 Cb 0.30 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 3gp3 h PRO 169 CO -0.00 0.63 0.12 0.00 -0.21 0.00 0.00 178.00 178.54 3gp3 h ALA 170 N 1.47 0.26 -0.20 -0.75 0.00 -0.69 -0.34 119.26 119.01 3gp3 h ALA 170 Ca 0.17 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.08 3gp3 h ALA 170 Cb 0.18 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3gp3 h ALA 170 CO -0.01 -0.23 -0.03 0.28 0.00 0.00 0.00 179.25 179.26 3gp3 h VAL 171 N 0.25 0.83 0.00 0.00 2.07 -0.71 -2.00 116.25 116.69 3gp3 h VAL 171 Ca 0.07 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.56 3gp3 h VAL 171 Cb 0.02 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3gp3 h VAL 171 CO -0.01 0.00 -0.14 0.11 0.02 0.00 0.00 177.57 177.56 3gp3 h LYS 172 N 0.02 0.00 0.00 1.57 1.79 -0.96 -0.97 116.57 118.03 3gp3 h LYS 172 Ca 0.09 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 3gp3 h LYS 172 Cb 0.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.78 3gp3 h LYS 172 CO -0.18 0.14 0.00 0.00 -1.08 0.00 0.00 179.45 178.32 3gp3 n ALA 173 N -2.42 2.01 -0.67 3.86 0.00 -0.15 -4.89 120.51 118.25 3gp3 n ALA 173 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.33 3gp3 n ALA 173 Cb 0.22 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.34 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 0.47 0.60 3.75 0.00 0.00 -0.37 -5.06 105.19 104.58 3gp3 n GLY 174 Ca 0.08 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.19 4.74 -0.35 1.61 1.02 -0.79 -5.01 119.74 119.77 3gp3 s LYS 175 Ca 0.00 1.65 -0.25 0.00 0.02 0.00 0.00 55.97 57.39 3gp3 s LYS 175 Cb 0.00 -3.24 0.01 0.00 -0.52 0.00 0.00 37.83 34.08 3gp3 s LYS 175 CO 0.00 0.35 0.88 -0.65 -0.92 0.00 0.00 175.35 175.01 3gp3 s GLN 176 N -1.25 3.88 -0.10 1.68 -1.52 -1.26 -4.40 119.66 116.69 3gp3 s GLN 176 Ca 0.43 0.58 -0.02 0.00 -1.95 0.00 0.00 55.36 54.41 3gp3 s GLN 176 Cb -0.29 -3.78 -0.03 0.00 -0.22 0.00 0.00 33.01 28.69 3gp3 s GLN 176 CO 0.36 -0.86 -0.02 0.08 -0.25 0.00 0.00 175.29 174.60 3gp3 s VAL 177 N 3.30 4.12 -0.11 1.09 1.01 -1.26 -0.44 120.40 128.10 3gp3 s VAL 177 Ca 0.36 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.04 3gp3 s VAL 177 Cb -0.13 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 3gp3 s VAL 177 CO 0.16 0.58 -0.14 -0.22 0.00 0.00 0.00 175.10 175.48 3gp3 s LEU 178 N -0.61 2.66 -0.22 3.92 2.96 -0.94 -2.35 118.68 124.11 3gp3 s LEU 178 Ca 0.10 -0.32 -0.01 0.00 -0.22 0.00 0.00 54.13 53.68 3gp3 s LEU 178 Cb -0.12 -1.58 0.02 0.00 0.50 0.00 0.00 46.19 45.01 3gp3 s LEU 178 CO 0.02 0.20 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.52 3gp3 s ILE 179 N 0.12 2.67 -0.31 6.68 1.01 0.24 -0.92 121.20 130.69 3gp3 s ILE 179 Ca -0.07 -0.93 -0.06 0.00 0.00 0.00 0.00 60.65 59.59 3gp3 s ILE 179 Cb -0.15 -2.27 0.02 0.00 0.01 0.00 0.00 42.46 40.07 3gp3 s ILE 179 CO 0.05 0.34 0.08 0.00 0.00 0.00 0.00 174.94 175.40 3gp3 s ALA 180 N 1.33 3.02 0.00 9.38 0.00 0.14 -1.13 121.76 134.50 3gp3 s ALA 180 Ca 0.02 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.39 3gp3 s ALA 180 Cb -0.15 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.80 3gp3 s ALA 180 CO -0.07 -1.11 0.00 0.00 0.00 0.00 0.00 175.76 174.58 3gp3 n ALA 181 N 4.82 0.00 -2.36 0.00 0.00 -0.19 -3.78 120.51 119.00 3gp3 n ALA 181 Ca -0.14 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.12 3gp3 n ALA 181 Cb 0.46 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 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 1.33 1.71 0.11 0.00 3.76 -1.26 -1.28 115.29 119.67 3gp3 s HIS 182 Ca 0.00 -0.73 -0.26 0.00 -0.15 0.00 0.00 55.06 53.92 3gp3 s HIS 182 Cb 0.00 -0.92 -0.08 0.00 1.11 0.00 0.00 32.58 32.69 3gp3 s HIS 182 CO 0.00 0.20 1.65 0.78 -0.85 0.00 0.00 174.74 176.52 3gp3 h GLY 183 N 2.46 -0.41 1.67 -2.22 0.00 -1.96 -0.39 103.07 102.21 3gp3 h GLY 183 Ca -0.39 0.27 -0.23 0.00 0.00 0.00 0.00 47.33 46.99 3gp3 h GLY 183 CO 0.65 -0.20 -1.01 3.43 0.00 0.00 0.00 176.54 179.40 3gp3 h ASN 184 N -0.42 0.39 0.34 0.19 2.35 -1.97 -0.30 115.58 116.16 3gp3 h ASN 184 Ca 0.04 -0.35 -0.10 0.00 -0.55 0.00 0.00 56.30 55.34 3gp3 h ASN 184 Cb 0.45 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 3gp3 h ASN 184 CO -0.15 1.19 -0.41 0.77 -1.65 0.00 0.00 177.43 177.18 3gp3 h SER 185 N 0.14 0.10 0.21 5.81 4.64 -1.77 -0.93 113.55 121.75 3gp3 h SER 185 Ca -0.08 -0.04 -0.21 0.00 -0.47 0.00 0.00 61.79 60.99 3gp3 h SER 185 Cb 1.68 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.74 3gp3 h SER 185 CO 0.16 0.51 -0.84 -0.07 -0.87 0.00 0.00 176.83 175.73 3gp3 h LEU 186 N 0.09 0.60 -1.25 5.97 3.38 -1.03 -1.67 115.31 121.40 3gp3 h LEU 186 Ca 0.01 -0.43 0.08 0.00 0.09 0.00 0.00 57.88 57.62 3gp3 h LEU 186 Cb 0.77 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.28 3gp3 h LEU 186 CO 0.06 1.20 0.55 0.03 0.09 0.00 0.00 178.44 180.37 3gp3 h ARG 187 N 0.31 0.85 -0.15 1.13 3.08 -0.81 -0.08 114.38 118.71 3gp3 h ARG 187 Ca -0.06 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 59.86 3gp3 h ARG 187 Cb 1.45 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 31.30 3gp3 h ARG 187 CO 0.15 0.57 -0.23 0.00 -1.07 0.00 0.00 179.97 179.38 3gp3 h ALA 188 N 1.56 0.22 -0.57 0.04 0.00 -1.05 0.11 119.26 119.57 3gp3 h ALA 188 Ca 0.37 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3gp3 h ALA 188 Cb 0.31 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3gp3 h ALA 188 CO -0.14 0.19 0.19 1.25 0.00 0.00 0.00 179.25 180.73 3gp3 h LEU 189 N 0.03 0.82 -1.04 0.00 5.85 -0.83 -2.61 115.31 117.52 3gp3 h LEU 189 Ca 0.01 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 3gp3 h LEU 189 Cb 0.81 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.59 3gp3 h LEU 189 CO 0.05 0.81 0.44 0.40 -0.34 0.00 0.00 178.44 179.79 3gp3 h ILE 190 N 0.80 1.23 -0.88 4.05 2.04 -1.00 0.42 117.51 124.16 3gp3 h ILE 190 Ca 0.18 -0.58 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 3gp3 h ILE 190 Cb 0.27 0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 3gp3 h ILE 190 CO -0.01 0.26 0.54 0.50 0.00 0.00 0.00 178.15 179.45 3gp3 h LYS 191 N 1.11 1.19 0.05 2.37 3.64 -0.60 -1.54 116.57 122.79 3gp3 h LYS 191 Ca 0.28 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3gp3 h LYS 191 Cb 0.03 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 3gp3 h LYS 191 CO -0.05 0.82 -0.02 -0.92 -2.27 0.00 0.00 179.45 177.01 3gp3 h TYR 192 N 1.21 -0.06 -0.37 1.91 3.20 -1.12 -1.60 116.97 120.14 3gp3 h TYR 192 Ca 0.32 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.22 3gp3 h TYR 192 Cb -0.07 0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.18 3gp3 h TYR 192 CO 0.00 0.43 0.16 -0.07 -1.64 0.00 0.00 178.16 177.05 3gp3 h LEU 193 N -0.58 0.21 -1.48 2.82 3.38 -0.53 -2.83 115.31 116.30 3gp3 h LEU 193 Ca -0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3gp3 h LEU 193 Cb 0.52 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3gp3 h LEU 193 CO 0.01 0.16 0.00 0.47 0.09 0.00 0.00 178.44 179.17 3gp3 n ASP 194 N -4.97 2.26 -3.12 -0.43 8.00 -0.62 -4.45 116.55 113.22 3gp3 n ASP 194 Ca 0.01 -1.76 -0.20 0.00 0.71 0.00 0.00 54.79 53.56 3gp3 n ASP 194 Cb 0.11 -0.06 0.07 0.00 -0.02 0.00 0.00 41.12 41.22 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 1.27 -0.31 3.77 0.44 0.00 -0.73 -4.95 105.19 104.68 3gp3 n GLY 195 Ca 0.17 0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.28 4.29 0.82 -0.61 1.01 -0.68 -5.03 121.20 117.73 3gp3 s ILE 196 Ca 0.43 1.79 -0.11 0.00 0.00 0.00 0.00 60.65 62.75 3gp3 s ILE 196 Cb -0.19 -4.17 0.08 0.00 0.01 0.00 0.00 42.46 38.20 3gp3 s ILE 196 CO 0.62 0.48 1.10 -0.94 0.00 0.00 0.00 174.94 176.20 3gp3 s SER 197 N -1.21 4.24 0.27 3.58 1.04 -1.26 -4.83 113.70 115.54 3gp3 s SER 197 Ca 0.38 1.34 -0.02 0.00 0.48 0.00 0.00 55.95 58.14 3gp3 s SER 197 Cb -0.23 -2.06 0.44 0.00 0.10 0.00 0.00 66.02 64.26 3gp3 s SER 197 CO 0.27 -2.13 1.88 0.44 0.98 0.00 0.00 173.24 174.69 3gp3 h ASP 198 N -1.20 1.02 -0.25 7.02 3.32 -2.00 -1.23 116.42 123.11 3gp3 h ASP 198 Ca -0.48 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.52 3gp3 h ASP 198 Cb 1.27 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 3gp3 h ASP 198 CO 0.58 0.64 -0.11 0.00 -1.72 0.00 0.00 179.24 178.64 3gp3 h ALA 199 N 1.47 0.34 0.00 3.45 0.00 -2.00 -3.30 119.26 119.23 3gp3 h ALA 199 Ca 0.43 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3gp3 h ALA 199 Cb 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3gp3 h ALA 199 CO -0.18 0.19 -0.39 -0.44 0.00 0.00 0.00 179.25 178.43 3gp3 h ASP 200 N 0.23 0.00 0.81 0.00 3.32 -1.83 -3.09 116.42 115.86 3gp3 h ASP 200 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3gp3 h ASP 200 Cb 0.60 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.15 3gp3 h ASP 200 CO 0.03 0.39 0.00 -0.29 -1.72 0.00 0.00 179.24 177.66 3gp3 h ILE 201 N 0.00 0.00 -0.65 0.35 6.09 -1.31 -3.11 117.51 118.88 3gp3 h ILE 201 Ca -0.00 -0.35 0.05 0.00 -1.37 0.00 0.00 64.86 63.18 3gp3 h ILE 201 Cb 1.15 1.24 -0.04 0.00 0.47 0.00 0.00 36.82 39.64 3gp3 h ILE 201 CO 0.05 0.00 0.43 0.58 -3.07 0.00 0.00 178.15 176.14 3gp3 h VAL 202 N 0.00 1.05 -0.28 2.19 2.07 -1.69 -1.57 116.25 118.01 3gp3 h VAL 202 Ca 0.00 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.28 3gp3 h VAL 202 Cb 0.40 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 3gp3 h VAL 202 CO 0.00 0.13 0.00 0.61 0.02 0.00 0.00 177.57 178.33 3gp3 n GLY 203 N -1.46 0.96 3.67 2.17 0.00 -1.18 -4.89 105.19 104.47 3gp3 n GLY 203 Ca 0.09 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.48 4.17 0.00 0.99 2.96 -0.59 -5.04 118.68 119.69 3gp3 s LEU 204 Ca 0.35 1.23 0.06 0.00 -0.22 0.00 0.00 54.13 55.55 3gp3 s LEU 204 Cb 0.19 -3.30 -0.02 0.00 0.50 0.00 0.00 46.19 43.57 3gp3 s LEU 204 CO 0.28 -0.43 -0.19 0.20 -1.32 0.00 0.00 176.35 174.89 3gp3 s ASN 205 N 1.16 2.22 -0.18 3.68 0.01 -1.26 -5.03 114.94 115.53 3gp3 s ASN 205 Ca 0.40 -0.39 -0.03 0.00 -0.71 0.00 0.00 52.86 52.14 3gp3 s ASN 205 Cb -0.17 -0.23 -0.01 0.00 0.41 0.00 0.00 41.25 41.25 3gp3 s ASN 205 CO 0.12 0.20 -0.07 -0.63 -1.51 0.00 0.00 177.10 175.22 3gp3 s ILE 206 N -0.54 3.37 0.53 0.60 -1.09 -1.26 -5.11 121.20 117.69 3gp3 s ILE 206 Ca 0.07 -0.52 -0.18 0.00 -2.23 0.00 0.00 60.65 57.79 3gp3 s ILE 206 Cb -0.08 -2.49 -0.07 0.00 -1.58 0.00 0.00 42.46 38.25 3gp3 s ILE 206 CO -0.00 0.46 1.04 -2.16 -1.23 0.00 0.00 174.94 173.06 3gp3 s PRO 207 N 0.96 3.64 0.28 2.79 0.04 -1.26 -4.93 135.00 136.52 3gp3 s PRO 207 Ca -0.01 1.27 -0.30 0.00 0.04 0.00 0.00 61.00 62.01 3gp3 s PRO 207 Cb -0.15 -2.07 -0.11 0.00 0.04 0.00 0.00 34.50 32.21 3gp3 s PRO 207 CO 0.00 -0.56 1.53 -0.80 0.04 0.00 0.00 177.00 177.21 3gp3 s ASN 208 N -2.35 6.47 -1.49 6.66 -0.87 -1.26 -4.13 114.94 117.97 3gp3 s ASN 208 Ca 0.65 2.86 0.00 0.00 -1.57 0.00 0.00 52.86 54.80 3gp3 s ASN 208 Cb -0.16 -2.63 0.00 0.00 -0.02 0.00 0.00 41.25 38.44 3gp3 s ASN 208 CO 0.27 -0.83 0.00 0.61 -2.57 0.00 0.00 177.10 174.58 3gp3 n GLY 209 N 2.04 0.43 3.19 0.66 0.00 0.09 -4.89 105.19 106.71 3gp3 n GLY 209 Ca 0.07 -0.23 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.72 2.53 0.27 1.61 1.01 -1.26 -4.50 120.40 117.34 3gp3 s VAL 210 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 60.88 3gp3 s VAL 210 Cb 0.00 -2.11 -0.10 0.00 0.00 0.00 0.00 36.38 34.17 3gp3 s VAL 210 CO 0.00 0.48 1.37 -2.84 0.00 0.00 0.00 175.10 174.11 3gp3 s PRO 211 N 1.35 4.31 -0.20 2.72 0.02 -1.26 -4.54 135.00 137.40 3gp3 s PRO 211 Ca 0.05 2.24 0.01 0.00 0.02 0.00 0.00 61.00 63.33 3gp3 s PRO 211 Cb -0.14 -3.10 0.04 0.00 0.02 0.00 0.00 34.50 31.32 3gp3 s PRO 211 CO -0.09 -0.31 -0.15 -1.17 -0.33 0.00 0.00 177.00 174.94 3gp3 s LEU 212 N -0.90 2.48 -0.24 -5.54 2.96 0.39 -1.04 118.68 116.80 3gp3 s LEU 212 Ca 0.55 -0.89 -0.10 0.00 -0.22 0.00 0.00 54.13 53.47 3gp3 s LEU 212 Cb -0.40 -1.42 -0.05 0.00 0.50 0.00 0.00 46.19 44.82 3gp3 s LEU 212 CO 0.47 -0.09 0.15 -0.69 -1.32 0.00 0.00 176.35 174.87 3gp3 s VAL 213 N 1.28 5.31 -0.23 1.68 1.01 0.53 -0.04 120.40 129.94 3gp3 s VAL 213 Ca -0.00 0.16 -0.08 0.00 0.00 0.00 0.00 61.98 62.06 3gp3 s VAL 213 Cb -0.16 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 3gp3 s VAL 213 CO -0.10 0.35 0.09 -0.31 0.00 0.00 0.00 175.10 175.13 3gp3 s TYR 214 N 1.04 3.16 -0.20 5.22 2.02 0.25 -1.35 117.35 127.48 3gp3 s TYR 214 Ca 0.07 -0.16 -0.15 0.00 -0.37 0.00 0.00 57.07 56.45 3gp3 s TYR 214 Cb -0.13 -2.21 -0.04 0.00 -0.40 0.00 0.00 41.96 39.17 3gp3 s TYR 214 CO 0.04 -0.16 0.38 -1.21 -1.57 0.00 0.00 175.55 173.03 3gp3 s GLU 215 N 1.24 4.16 0.04 -0.62 2.02 -0.31 -1.09 118.70 124.14 3gp3 s GLU 215 Ca 0.05 0.16 0.09 0.00 0.02 0.00 0.00 54.97 55.29 3gp3 s GLU 215 Cb -0.14 -3.54 -0.03 0.00 0.10 0.00 0.00 34.13 30.52 3gp3 s GLU 215 CO 0.04 -0.03 -0.26 -0.51 0.02 0.00 0.00 175.26 174.52 3gp3 s LEU 216 N 1.29 2.15 0.00 1.80 1.43 -0.16 -0.50 118.68 124.69 3gp3 s LEU 216 Ca 0.18 -0.57 -0.02 0.00 -1.03 0.00 0.00 54.13 52.70 3gp3 s LEU 216 Cb -0.15 -1.26 0.03 0.00 0.03 0.00 0.00 46.19 44.84 3gp3 s LEU 216 CO 0.08 0.26 0.20 -0.90 0.23 0.00 0.00 176.35 176.21 3gp3 n ASP 217 N 1.87 0.12 0.22 2.29 5.68 0.02 -0.90 116.55 125.85 3gp3 n ASP 217 Ca -0.17 -1.13 0.14 0.00 -0.50 0.00 0.00 54.79 53.13 3gp3 n ASP 217 Cb 0.52 -0.14 0.76 0.00 -1.14 0.00 0.00 41.12 41.12 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 -0.59 0.11 4.81 -1.96 0.02 114.58 116.97 3gp3 h GLU 218 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3gp3 h GLU 218 Cb 0.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.58 3gp3 h GLU 218 CO 0.06 0.00 0.00 -1.13 -0.73 0.00 0.00 179.01 177.21 3gp3 n SER 219 N -4.17 3.18 -0.63 1.04 3.41 -1.26 -4.93 113.62 110.26 3gp3 n SER 219 Ca -0.00 -2.01 -0.08 0.00 -0.26 0.00 0.00 58.87 56.52 3gp3 n SER 219 Cb 0.21 -0.40 -0.04 0.00 -0.26 0.00 0.00 64.21 63.73 3gp3 n SER 219 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3gp3 n LEU 220 N 1.22 -0.53 -4.72 1.04 4.77 -0.01 -5.01 117.00 113.76 3gp3 n LEU 220 Ca 0.20 0.20 -0.40 0.00 -0.03 0.00 0.00 56.01 55.98 3gp3 n LEU 220 Cb 0.50 -1.58 -0.04 0.00 -2.33 0.00 0.00 43.42 39.97 3gp3 n LEU 220 CO 0.14 -0.50 0.51 -0.89 -1.33 0.00 0.00 177.39 175.31 3gp3 s THR 221 N -2.23 4.87 0.32 -5.08 2.01 -1.26 -4.72 115.64 109.55 3gp3 s THR 221 Ca 0.00 1.70 -0.29 0.00 0.31 0.00 0.00 61.69 63.41 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 0.27 1.52 -2.65 -0.69 0.00 0.00 174.62 173.07 3gp3 n PRO 222 N 3.44 2.61 -0.13 4.92 -0.02 -1.26 -0.80 135.00 143.75 3gp3 n PRO 222 Ca 0.00 0.92 -0.23 0.00 -2.02 0.00 0.00 63.50 62.18 3gp3 n PRO 222 Cb 0.51 -2.66 -0.11 0.00 -0.02 0.00 0.00 33.50 31.21 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 1.40 1.48 -3.58 4.25 5.41 0.34 -4.85 119.36 123.80 3gp3 n ILE 223 Ca 0.06 -0.48 -0.06 0.00 1.00 0.00 0.00 62.75 63.27 3gp3 n ILE 223 Cb 0.37 -1.60 -0.02 0.00 -0.71 0.00 0.00 39.64 37.68 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 -2.51 0.74 0.09 0.38 1.70 -1.19 -5.03 118.95 113.13 3gp3 s ARG 224 Ca -0.36 -0.32 -0.08 0.00 -0.47 0.00 0.00 55.73 54.50 3gp3 s ARG 224 Cb 0.11 0.31 -0.01 0.00 -0.57 0.00 0.00 34.95 34.80 3gp3 s ARG 224 CO 0.54 -0.33 0.16 -3.38 -1.08 0.00 0.00 175.30 171.22 3gp3 s HIS 225 N -2.94 0.20 -0.23 5.89 -3.43 -1.26 -1.16 115.29 112.36 3gp3 s HIS 225 Ca 0.08 -0.65 -0.27 0.00 -0.80 0.00 0.00 55.06 53.42 3gp3 s HIS 225 Cb -0.01 -0.10 0.12 0.00 -1.43 0.00 0.00 32.58 31.17 3gp3 s HIS 225 CO -0.06 -0.53 1.01 1.52 -2.00 0.00 0.00 174.74 174.69 3gp3 s TYR 226 N -3.87 -0.43 0.43 0.38 -0.85 -0.46 -5.00 117.35 107.55 3gp3 s TYR 226 Ca 0.05 0.93 -0.22 0.00 -0.52 0.00 0.00 57.07 57.31 3gp3 s TYR 226 Cb 0.05 0.40 -0.10 0.00 0.38 0.00 0.00 41.96 42.69 3gp3 s TYR 226 CO -0.11 -0.28 0.99 0.71 -1.52 0.00 0.00 175.55 175.34 3gp3 s TYR 227 N -0.36 3.27 0.05 -3.49 2.02 -1.26 -0.34 117.35 117.23 3gp3 s TYR 227 Ca 0.01 1.63 -0.10 0.00 -0.37 0.00 0.00 57.07 58.23 3gp3 s TYR 227 Cb -0.03 -2.95 -0.06 0.00 -0.40 0.00 0.00 41.96 38.52 3gp3 s TYR 227 CO -0.03 -0.33 0.38 -0.51 -1.57 0.00 0.00 175.55 173.49 3gp3 s LEU 228 N -3.05 4.37 0.00 -1.29 1.43 -0.20 -4.93 118.68 115.01 3gp3 s LEU 228 Ca 0.61 0.78 0.00 0.00 -1.03 0.00 0.00 54.13 54.49 3gp3 s LEU 228 Cb -0.14 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 43.22 3gp3 s LEU 228 CO 0.18 0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.58 3gp3 n GLY 229 N 1.09 0.25 0.73 -3.19 0.00 -1.26 -4.54 105.19 98.26 3gp3 n GLY 229 Ca -0.10 -1.83 0.09 0.00 0.00 0.00 0.00 46.02 44.19 3gp3 n GLY 229 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66